1 HEADER PROTEINASE INHIBITOR (TRYPSIN) 05-OCT-84 5PTI 5PTI 3
2 COMPND TRYPSIN INHIBITOR (CRYSTAL FORM /II$) 5PTI 4
3 SOURCE BOVINE (BOS $TAURUS) PANCREAS 5PTI 5
4 AUTHOR A.WLODAWER,R.HUBER 5PTI 6
5 REVDAT 4 16-OCT-87 5PTIC 1 HELIX 5PTIC 1
6 REVDAT 3 16-APR-87 5PTIB 1 REMARK 5PTIB 1
7 REVDAT 2 04-MAR-85 5PTIA 1 JRNL 5PTIA 1
8 REVDAT 1 29-OCT-84 5PTI 0 5PTI 7
9 JRNL AUTH A.WLODAWER,J.WALTER,R.HUBER,L.SJOLIN 5PTI 8
10 JRNL TITL STRUCTURE OF BOVINE PANCREATIC TRYPSIN INHIBITOR. 5PTI 9
11 JRNL TITL 2 RESULTS OF JOINT NEUTRON AND X-RAY REFINEMENT OF 5PTI 10
12 JRNL TITL 3 CRYSTAL FORM /II$ 5PTI 11
13 JRNL REF J.MOL.BIOL. V. 180 307 1984 5PTIA 2
14 JRNL REFN ASTM JMOBAK UK ISSN 0022-2836 070 5PTIA 3
16 REMARK 1 REFERENCE 1 5PTIB 2
17 REMARK 1 AUTH A.WLODAWER,J.DEISENHOFER,R.HUBER 5PTIB 3
18 REMARK 1 TITL COMPARISON OF TWO HIGHLY REFINED STRUCTURES OF 5PTIB 4
19 REMARK 1 TITL 2 BOVINE PANCREATIC TRYPSIN INHIBITOR 5PTIB 5
20 REMARK 1 REF J.MOL.BIOL. V. 193 145 1987 5PTIB 6
21 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 5PTIB 7
22 REMARK 1 REFERENCE 2 5PTIB 8
23 REMARK 1 AUTH J.WALTER,R.HUBER 5PTI 16
24 REMARK 1 TITL PANCREATIC TRYPSIN INHIBITOR. A NEW CRYSTAL FORM 5PTI 17
25 REMARK 1 TITL 2 AND ITS ANALYSIS 5PTI 18
26 REMARK 1 REF J.MOL.BIOL. V. 167 911 1983 5PTI 19
27 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 5PTI 20
29 REMARK 2 RESOLUTION. 1.0 ANGSTROMS. (X-RAY ANALYSIS) 5PTI 22
30 REMARK 2 1.8 ANGSTROMS. (NEUTRON ANALYSIS) 5PTI 23
32 REMARK 3 REFINEMENT. JOINT X-RAY AND NEUTRON DATA REFINEMENT 5PTI 25
33 REMARK 3 USING THE HENDRICKSON-KONNERT RESTRAINED LEAST-SQUARES 5PTI 26
34 REMARK 3 REFINEMENT PROGRAM AS MODIFIED BY WLODAWER AND HENDRICKSON 5PTI 27
35 REMARK 3 (ACTA CRYST. (1982) VOL.A38, PP 239-247). THE R-VALUES 5PTI 28
36 REMARK 3 ARE 0.200 FOR THE X-RAY DATA AND 0.197 FOR THE NEUTRON 5PTI 29
37 REMARK 3 DATA. THE R.M.S. DEVIATION FROM IDEALITY OF THE BOND 5PTI 30
38 REMARK 3 LENGTHS IS 0.02 ANGSTROMS. 5PTI 31
40 REMARK 4 COORDINATES FOR 63 WATER MOLECULES ARE GIVEN FOLLOWING THE 5PTI 33
41 REMARK 4 MAIN BODY OF THE PROTEIN. THE NOMENCLATURE OF THE WATER 5PTI 34
42 REMARK 4 MOLECULES IS THAT OF THE DEPOSITORS. 5PTI 35
44 REMARK 5 HYDROGEN AND DEUTERIUM ATOMS IN THIS ENTRY HAVE BEEN 5PTI 37
45 REMARK 5 ASSIGNED NAMES CONSISTENT WITH THE RECOMMENDATIONS OF THE 5PTI 38
46 REMARK 5 IUPAC-IUB COMMISSION ON BIOCHEMICAL NOMENCLATURE (E.G. 5PTI 39
47 REMARK 5 J.MOL.BIOL. (1970) VOL.52, PP 1-17). WE HAVE FOLLOWED RULE 5PTI 40
48 REMARK 5 4.4 OF THE RECOMMENDATIONS WITH THE FOLLOWING MODIFICATION- 5PTI 41
49 REMARK 5 WHEN MORE THAN ONE HYDROGEN ATOM IS BONDED TO A SINGLE 5PTI 42
50 REMARK 5 NON-HYDROGEN ATOM, THE HYDROGEN ATOM NUMBER DESIGNATION IS 5PTI 43
51 REMARK 5 GIVEN AS THE FIRST CHARACTER OF THE ATOM NAME RATHER THAN 5PTI 44
52 REMARK 5 AS THE LAST CHARACTER (E.G. H*BETA*1 IS DENOTED AS 1HB ). 5PTI 45
54 REMARK 6 CORRECTION. UPDATE JRNL REFERENCE TO REFLECT PUBLICATION. 5PTIA 5
55 REMARK 6 04-MAR-85. 5PTIA 6
57 REMARK 7 CORRECTION. INSERT NEW PUBLICATION AS REFERENCE 1 AND 5PTIB 10
58 REMARK 7 RENUMBER THE OTHERS. 16-APR-87. 5PTIB 11
60 REMARK 8 CORRECTION. CORRECT NUMBERING OF HELIX 2. 16-OCT-87. 5PTIC 3
61 SEQRES 1 58 ARG PRO ASP PHE CYS LEU GLU PRO PRO TYR THR GLY PRO 5PTI 46
62 SEQRES 2 58 CYS LYS ALA ARG ILE ILE ARG TYR PHE TYR ASN ALA LYS 5PTI 47
63 SEQRES 3 58 ALA GLY LEU CYS GLN THR PHE VAL TYR GLY GLY CYS ARG 5PTI 48
64 SEQRES 4 58 ALA LYS ARG ASN ASN PHE LYS SER ALA GLU ASP CYS MET 5PTI 49
65 SEQRES 5 58 ARG THR CYS GLY GLY ALA 5PTI 50
67 FTNOTE 1 THE ATOMS IN THE SIDE CHAIN OF RESIDUES GLU 7 AND MET 52 5PTI 52
68 FTNOTE 1 WERE FOUND TO OCCUPY TWO MAJOR SITES. THESE ATOMS ARE 5PTI 53
69 FTNOTE 1 DENOTED WITH ALTERNATE LOCATION INDICATORS *A* AND *B*. 5PTI 54
71 FTNOTE 2 HETATM UNK 324 IS PROBABLY A POTASSIUM ION IN A PARTIALLY 5PTI 56
72 FTNOTE 2 OCCUPIED SITE. 5PTI 57
73 HET PO4 70 5 PHOSPHATE ION 5PTI 58
74 HET UNK 324 1 UNKNOWN ION PROBABLY A POTASSIUM 5PTI 59
75 FORMUL 2 PO4 O4 P1 -- 5PTI 60
76 FORMUL 3 DOD *63(D2 O1) 5PTI 61
77 HELIX 1 H1 PRO 2 GLU 7 5 ALL DONORS,ACCEPTORS INCLUDED 5PTI 62
78 HELIX 2 H2 SER 47 GLY 56 1 ALL DONORS,ACCEPTORS INCLUDED 5PTIC 4
79 SHEET 1 S1 3 LEU 29 TYR 35 0 5PTI 64
80 SHEET 2 S1 3 ILE 18 ASN 24 -1 N ILE 18 O TYR 35 5PTI 65
81 SHEET 3 S1 3 PHE 45 PHE 45 -1 N PHE 45 O TYR 21 5PTI 66
82 SSBOND 1 CYS 5 CYS 55 5PTI 67
83 SSBOND 2 CYS 14 CYS 38 5PTI 68
84 SSBOND 3 CYS 30 CYS 51 5PTI 69
85 CRYST1 74.100 23.400 28.900 90.00 90.00 90.00 P 21 21 21 4 5PTI 70
86 ORIGX1 0.013495 0.000000 0.000000 0.00000 5PTI 71
87 ORIGX2 0.000000 0.042735 0.000000 0.00000 5PTI 72
88 ORIGX3 0.000000 0.000000 0.034602 0.00000 5PTI 73
89 SCALE1 0.013495 0.000000 0.000000 0.00000 5PTI 74
90 SCALE2 0.000000 0.042735 0.000000 0.00000 5PTI 75
91 SCALE3 0.000000 0.000000 0.034602 0.00000 5PTI 76
92 ATOM 1 N ARG 1 32.231 15.281 -13.143 1.00 28.28 5PTI 77
93 ATOM 2 CA ARG 1 32.184 14.697 -11.772 1.00 27.90 5PTI 78
94 ATOM 3 C ARG 1 33.438 13.890 -11.387 1.00 24.90 5PTI 79
95 ATOM 4 O ARG 1 34.102 13.070 -12.066 1.00 24.44 5PTI 80
96 ATOM 5 CB ARG 1 30.797 14.065 -11.625 1.00 27.88 5PTI 81
97 ATOM 6 CG ARG 1 30.976 12.589 -11.819 1.00 29.61 5PTI 82
98 ATOM 7 CD ARG 1 29.608 12.016 -11.694 1.00 31.91 5PTI 83
99 ATOM 8 NE ARG 1 28.942 12.335 -12.945 1.00 33.51 5PTI 84
100 ATOM 9 CZ ARG 1 27.670 12.696 -13.050 1.00 34.29 5PTI 85
101 ATOM 10 NH1 ARG 1 26.901 12.777 -11.999 1.00 34.48 5PTI 86
102 ATOM 11 NH2 ARG 1 27.161 12.963 -14.255 1.00 35.44 5PTI 87
103 ATOM 12 1D ARG 1 32.983 14.824 -13.703 1.00 27.71 5PTI 88
104 ATOM 13 2D ARG 1 31.275 15.112 -13.535 1.00 28.50 5PTI 89
105 ATOM 14 3D ARG 1 32.174 16.346 -13.050 1.00 28.23 5PTI 90
106 ATOM 15 HA ARG 1 32.192 15.563 -11.115 1.00 26.97 5PTI 91
107 ATOM 16 1HB ARG 1 30.392 14.428 -10.697 1.00 28.71 5PTI 92
108 ATOM 17 2HB ARG 1 30.182 14.438 -12.437 1.00 28.97 5PTI 93
109 ATOM 18 1HG ARG 1 31.369 12.359 -12.800 1.00 29.44 5PTI 94
110 ATOM 19 2HG ARG 1 31.591 12.143 -11.105 1.00 29.52 5PTI 95
111 ATOM 20 1HD ARG 1 29.656 10.965 -11.482 1.00 31.41 5PTI 96
112 ATOM 21 2HD ARG 1 29.218 12.381 -10.794 1.00 31.29 5PTI 97
113 ATOM 22 DE ARG 1 29.457 12.292 -13.843 1.00 34.62 5PTI 98
114 ATOM 23 1DH1 ARG 1 25.930 13.038 -12.118 1.00 34.80 5PTI 99
115 ATOM 24 2DH1 ARG 1 27.324 12.549 -11.100 1.00 34.71 5PTI 100
116 ATOM 25 1DH2 ARG 1 27.786 12.886 -15.076 1.00 33.93 5PTI 101
117 ATOM 26 2DH2 ARG 1 26.154 13.214 -14.269 1.00 34.53 5PTI 102
118 ATOM 27 N PRO 2 33.738 14.173 -10.126 1.00 22.41 5PTI 103
119 ATOM 28 CA PRO 2 34.897 13.603 -9.390 1.00 19.52 5PTI 104
120 ATOM 29 C PRO 2 34.652 12.135 -9.374 1.00 17.70 5PTI 105
121 ATOM 30 O PRO 2 33.583 11.537 -9.255 1.00 16.41 5PTI 106
122 ATOM 31 CB PRO 2 34.826 14.292 -8.056 1.00 21.00 5PTI 107
123 ATOM 32 CG PRO 2 33.927 15.515 -8.135 1.00 20.91 5PTI 108
124 ATOM 33 CD PRO 2 32.967 15.143 -9.243 1.00 22.49 5PTI 109
125 ATOM 34 HA PRO 2 35.676 14.152 -9.928 1.00 20.45 5PTI 110
126 ATOM 35 1HB PRO 2 34.431 13.672 -7.369 1.00 19.62 5PTI 111
127 ATOM 36 2HB PRO 2 35.763 14.517 -7.635 1.00 20.71 5PTI 112
128 ATOM 37 1HG PRO 2 33.695 15.873 -7.330 1.00 21.92 5PTI 113
129 ATOM 38 2HG PRO 2 34.491 16.303 -8.682 1.00 21.93 5PTI 114
130 ATOM 39 1HD PRO 2 32.028 14.742 -9.058 1.00 22.01 5PTI 115
131 ATOM 40 2HD PRO 2 32.880 16.031 -9.875 1.00 22.06 5PTI 116
132 ATOM 41 N ASP 3 35.790 11.466 -9.466 1.00 16.15 5PTI 117
133 ATOM 42 CA ASP 3 35.837 10.014 -9.507 1.00 17.15 5PTI 118
134 ATOM 43 C ASP 3 35.296 9.402 -8.236 1.00 13.33 5PTI 119
135 ATOM 44 O ASP 3 34.812 8.288 -8.260 1.00 12.36 5PTI 120
136 ATOM 45 CB ASP 3 37.124 9.634 -10.244 1.00 24.92 5PTI 121
137 ATOM 46 CG ASP 3 36.968 9.957 -11.773 1.00 31.50 5PTI 122
138 ATOM 47 OD1 ASP 3 37.083 11.141 -12.174 1.00 35.71 5PTI 123
139 ATOM 48 OD2 ASP 3 36.712 9.158 -12.735 1.00 35.43 5PTI 124
140 ATOM 49 D ASP 3 36.688 11.887 -9.571 1.00 17.62 5PTI 125
141 ATOM 50 HA ASP 3 35.144 9.745 -10.321 1.00 17.24 5PTI 126
142 ATOM 51 1HB ASP 3 37.980 10.245 -10.070 1.00 24.71 5PTI 127
143 ATOM 52 2HB ASP 3 37.455 8.626 -10.132 1.00 24.82 5PTI 128
144 ATOM 54 N PHE 4 35.466 10.210 -7.174 1.00 12.38 5PTI 129
145 ATOM 55 CA PHE 4 34.975 9.704 -5.855 1.00 13.61 5PTI 130
146 ATOM 56 C PHE 4 33.438 9.514 -5.843 1.00 13.10 5PTI 131
147 ATOM 57 O PHE 4 32.937 8.733 -5.020 1.00 13.82 5PTI 132
148 ATOM 58 CB PHE 4 35.435 10.423 -4.613 1.00 12.65 5PTI 133
149 ATOM 59 CG PHE 4 34.960 11.819 -4.512 1.00 12.81 5PTI 134
150 ATOM 60 CD1 PHE 4 33.708 12.036 -3.946 1.00 12.38 5PTI 135
151 ATOM 61 CD2 PHE 4 35.717 12.897 -4.923 1.00 13.29 5PTI 136
152 ATOM 62 CE1 PHE 4 33.249 13.321 -3.826 1.00 14.62 5PTI 137
153 ATOM 63 CE2 PHE 4 35.276 14.180 -4.764 1.00 14.01 5PTI 138
154 ATOM 64 CZ PHE 4 33.998 14.423 -4.229 1.00 13.69 5PTI 139
155 ATOM 65 D PHE 4 35.855 11.106 -7.148 1.00 12.61 5PTI 140
156 ATOM 66 HA PHE 4 35.473 8.781 -5.789 1.00 13.11 5PTI 141
157 ATOM 67 1HB PHE 4 34.977 9.863 -3.723 1.00 13.10 5PTI 142
158 ATOM 68 2HB PHE 4 36.455 10.163 -4.400 1.00 13.31 5PTI 143
159 ATOM 69 HD1 PHE 4 33.150 11.213 -3.635 1.00 13.03 5PTI 144
160 ATOM 70 HD2 PHE 4 36.680 12.699 -5.370 1.00 12.63 5PTI 145
161 ATOM 71 HE1 PHE 4 32.321 13.499 -3.366 1.00 13.29 5PTI 146
162 ATOM 72 HE2 PHE 4 35.758 15.036 -5.065 1.00 13.88 5PTI 147
163 ATOM 73 HZ PHE 4 33.588 15.411 -4.093 1.00 14.46 5PTI 148
164 ATOM 74 N CYS 5 32.757 10.236 -6.732 1.00 12.49 5PTI 149
165 ATOM 75 CA CYS 5 31.286 10.029 -6.794 1.00 10.18 5PTI 150
166 ATOM 76 C CYS 5 30.864 8.652 -7.254 1.00 10.29 5PTI 151
167 ATOM 77 O CYS 5 29.690 8.279 -7.116 1.00 10.73 5PTI 152
168 ATOM 78 CB CYS 5 30.794 11.065 -7.789 1.00 10.74 5PTI 153
169 ATOM 79 SG CYS 5 31.075 12.797 -7.325 1.00 12.66 5PTI 154
170 ATOM 80 D CYS 5 33.206 10.888 -7.363 1.00 12.80 5PTI 155
171 ATOM 81 HA CYS 5 30.964 10.266 -5.800 1.00 10.82 5PTI 156
172 ATOM 82 1HB CYS 5 31.501 10.869 -8.603 1.00 11.04 5PTI 157
173 ATOM 83 2HB CYS 5 29.793 10.892 -8.171 1.00 10.88 5PTI 158
174 ATOM 85 N LEU 6 31.740 7.909 -7.843 1.00 10.75 5PTI 159
175 ATOM 86 CA LEU 6 31.467 6.583 -8.351 1.00 12.75 5PTI 160
176 ATOM 87 C LEU 6 31.799 5.589 -7.246 1.00 13.85 5PTI 161
177 ATOM 88 O LEU 6 31.435 4.425 -7.543 1.00 15.33 5PTI 162
178 ATOM 89 CB LEU 6 32.345 6.258 -9.563 1.00 14.73 5PTI 163
179 ATOM 90 CG LEU 6 32.299 7.212 -10.787 1.00 16.78 5PTI 164
180 ATOM 91 CD1 LEU 6 33.160 6.693 -11.917 1.00 17.42 5PTI 165
181 ATOM 92 CD2 LEU 6 30.881 7.341 -11.280 1.00 16.88 5PTI 166
182 ATOM 93 D LEU 6 32.679 8.218 -7.970 1.00 11.34 5PTI 167
183 ATOM 94 HA LEU 6 30.422 6.406 -8.558 1.00 13.62 5PTI 168
184 ATOM 95 1HB LEU 6 33.392 6.256 -9.245 1.00 14.22 5PTI 169
185 ATOM 96 2HB LEU 6 32.141 5.230 -9.918 1.00 14.86 5PTI 170
186 ATOM 97 HG LEU 6 32.550 8.192 -10.401 1.00 16.74 5PTI 171
187 ATOM 98 1HD1 LEU 6 34.189 6.620 -11.585 1.00 17.89 5PTI 172
188 ATOM 99 2HD1 LEU 6 32.719 5.718 -12.170 1.00 17.82 5PTI 173
189 ATOM 100 3HD1 LEU 6 33.064 7.391 -12.752 1.00 17.88 5PTI 174
190 ATOM 101 1HD2 LEU 6 30.328 6.553 -10.667 1.00 16.77 5PTI 175
191 ATOM 102 2HD2 LEU 6 30.078 8.051 -11.126 1.00 17.21 5PTI 176
192 ATOM 103 3HD2 LEU 6 30.861 7.064 -12.332 1.00 16.98 5PTI 177
193 ATOM 104 N GLU 7 32.397 5.971 -6.128 1.00 12.79 1 5PTI 178
194 ATOM 105 CA GLU 7 32.663 4.924 -5.112 1.00 15.64 1 5PTI 179
195 ATOM 106 C GLU 7 31.435 4.576 -4.301 1.00 12.90 1 5PTI 180
196 ATOM 107 O GLU 7 30.565 5.427 -4.120 1.00 12.97 1 5PTI 181
197 ATOM 108 CB AGLU 7 33.865 5.265 -4.204 0.70 17.43 1 5PTI 182
198 ATOM 109 CB BGLU 7 34.000 4.971 -4.371 0.30 15.43 1 5PTI 183
199 ATOM 110 CG AGLU 7 34.117 6.694 -3.781 0.70 19.72 1 5PTI 184
200 ATOM 111 CG BGLU 7 35.189 5.031 -5.331 0.30 15.96 1 5PTI 185
201 ATOM 112 CD AGLU 7 34.935 7.120 -2.561 0.70 20.46 1 5PTI 186
202 ATOM 113 CD BGLU 7 35.814 3.742 -5.819 0.30 16.40 1 5PTI 187
203 ATOM 114 OE1AGLU 7 36.104 6.753 -2.502 0.70 22.37 1 5PTI 188
204 ATOM 115 OE1BGLU 7 35.348 2.965 -6.631 0.30 16.49 1 5PTI 189
205 ATOM 116 OE2AGLU 7 34.267 7.823 -1.815 0.70 18.99 1 5PTI 190
206 ATOM 117 OE2BGLU 7 35.846 2.854 -4.979 0.30 16.88 1 5PTI 191
207 ATOM 118 D GLU 7 32.631 6.879 -5.916 1.00 13.33 1 5PTI 192
208 ATOM 119 HA GLU 7 32.837 4.055 -5.770 1.00 14.63 1 5PTI 193
209 ATOM 120 1HB AGLU 7 33.913 4.637 -3.325 0.70 18.60 1 5PTI 194
210 ATOM 121 1HB BGLU 7 34.007 5.833 -3.693 0.30 15.91 1 5PTI 195
211 ATOM 122 2HB AGLU 7 34.757 4.929 -4.809 0.70 17.98 1 5PTI 196
212 ATOM 123 2HB BGLU 7 34.147 4.095 -3.748 0.30 15.98 1 5PTI 197
213 ATOM 124 1HG AGLU 7 34.689 7.248 -4.538 0.70 19.95 1 5PTI 198
214 ATOM 125 1HG BGLU 7 34.911 5.551 -6.241 0.30 15.98 1 5PTI 199
215 ATOM 126 2HG AGLU 7 33.221 7.296 -3.671 0.70 19.64 1 5PTI 200
216 ATOM 127 2HG BGLU 7 35.976 5.605 -4.862 0.30 16.05 1 5PTI 201
217 ATOM 128 N PRO 8 31.351 3.333 -3.911 1.00 13.23 5PTI 202
218 ATOM 129 CA PRO 8 30.224 2.852 -3.086 1.00 13.50 5PTI 203
219 ATOM 130 C PRO 8 30.334 3.516 -1.707 1.00 12.26 5PTI 204
220 ATOM 131 O PRO 8 31.391 3.997 -1.293 1.00 11.77 5PTI 205
221 ATOM 132 CB PRO 8 30.283 1.334 -2.995 1.00 15.10 5PTI 206
222 ATOM 133 CG PRO 8 31.757 1.097 -3.199 1.00 16.05 5PTI 207
223 ATOM 134 CD PRO 8 32.313 2.218 -4.085 1.00 15.37 5PTI 208
224 ATOM 135 HA PRO 8 29.270 3.086 -3.515 1.00 13.91 5PTI 209
225 ATOM 136 1HB PRO 8 29.909 0.979 -2.059 1.00 15.27 5PTI 210
226 ATOM 137 2HB PRO 8 29.773 0.877 -3.721 1.00 15.88 5PTI 211
227 ATOM 138 1HG PRO 8 32.262 1.339 -2.263 1.00 15.42 5PTI 212
228 ATOM 139 2HG PRO 8 31.885 0.245 -3.473 1.00 15.73 5PTI 213
229 ATOM 140 1HD PRO 8 33.271 2.433 -3.655 1.00 14.70 5PTI 214
230 ATOM 141 2HD PRO 8 32.442 2.084 -5.129 1.00 13.81 5PTI 215
231 ATOM 142 N PRO 9 29.200 3.631 -1.017 1.00 11.39 5PTI 216
232 ATOM 143 CA PRO 9 29.160 4.238 0.321 1.00 11.12 5PTI 217
233 ATOM 144 C PRO 9 29.993 3.377 1.274 1.00 10.17 5PTI 218
234 ATOM 145 O PRO 9 30.074 2.152 1.156 1.00 12.88 5PTI 219
235 ATOM 146 CB PRO 9 27.687 4.418 0.604 1.00 11.43 5PTI 220
236 ATOM 147 CG PRO 9 27.075 3.186 -0.051 1.00 12.21 5PTI 221
237 ATOM 148 CD PRO 9 27.842 3.087 -1.403 1.00 11.84 5PTI 222
238 ATOM 149 HA PRO 9 29.948 4.895 0.524 1.00 11.67 5PTI 223
239 ATOM 150 1HB PRO 9 27.561 4.500 1.669 1.00 11.73 5PTI 224
240 ATOM 151 2HB PRO 9 27.101 5.216 0.385 1.00 11.99 5PTI 225
241 ATOM 152 1HG PRO 9 27.438 2.371 0.555 1.00 12.56 5PTI 226
242 ATOM 153 2HG PRO 9 26.185 3.227 -0.191 1.00 12.62 5PTI 227
243 ATOM 154 1HD PRO 9 28.020 2.060 -1.684 1.00 12.42 5PTI 228
244 ATOM 155 2HD PRO 9 27.381 3.649 -2.145 1.00 12.15 5PTI 229
245 ATOM 156 N TYR 10 30.651 4.022 2.200 1.00 9.53 5PTI 230
246 ATOM 157 CA TYR 10 31.512 3.320 3.156 1.00 10.73 5PTI 231
247 ATOM 158 C TYR 10 31.044 3.577 4.617 1.00 9.35 5PTI 232
248 ATOM 159 O TYR 10 31.146 4.687 5.117 1.00 9.61 5PTI 233
249 ATOM 160 CB TYR 10 32.937 3.888 2.901 1.00 12.55 5PTI 234
250 ATOM 161 CG TYR 10 33.970 3.270 3.808 1.00 14.36 5PTI 235
251 ATOM 162 CD1 TYR 10 34.254 1.932 3.622 1.00 16.08 5PTI 236
252 ATOM 163 CD2 TYR 10 34.619 4.002 4.797 1.00 14.93 5PTI 237
253 ATOM 164 CE1 TYR 10 35.226 1.305 4.406 1.00 16.73 5PTI 238
254 ATOM 165 CE2 TYR 10 35.621 3.422 5.573 1.00 15.90 5PTI 239
255 ATOM 166 CZ TYR 10 35.896 2.071 5.383 1.00 17.33 5PTI 240
256 ATOM 167 OH TYR 10 36.861 1.438 6.195 1.00 19.17 5PTI 241
257 ATOM 168 D TYR 10 30.552 5.011 2.208 1.00 11.16 5PTI 242
258 ATOM 169 HA TYR 10 31.496 2.274 3.038 1.00 9.89 5PTI 243
259 ATOM 170 1HB TYR 10 33.209 3.682 1.839 1.00 12.54 5PTI 244
260 ATOM 171 2HB TYR 10 32.886 4.980 2.956 1.00 13.38 5PTI 245
261 ATOM 172 HD1 TYR 10 33.815 1.318 2.852 1.00 15.57 5PTI 246
262 ATOM 173 HD2 TYR 10 34.400 5.053 4.955 1.00 15.82 5PTI 247
263 ATOM 174 HE1 TYR 10 35.521 0.270 4.282 1.00 17.01 5PTI 248
264 ATOM 175 HE2 TYR 10 36.108 3.926 6.391 1.00 16.44 5PTI 249
265 ATOM 176 DH TYR 10 37.454 0.912 5.573 1.00 18.49 5PTI 250
266 ATOM 177 N THR 11 30.520 2.576 5.235 1.00 10.38 5PTI 251
267 ATOM 178 CA THR 11 30.045 2.720 6.641 1.00 12.46 5PTI 252
268 ATOM 179 C THR 11 31.223 2.838 7.584 1.00 11.29 5PTI 253
269 ATOM 180 O THR 11 31.192 3.641 8.497 1.00 11.82 5PTI 254
270 ATOM 181 CB THR 11 29.228 1.496 7.037 1.00 13.67 5PTI 255
271 ATOM 182 OG1 THR 11 28.069 1.656 6.232 1.00 15.23 5PTI 256
272 ATOM 183 CG2 THR 11 28.852 1.446 8.517 1.00 14.27 5PTI 257
273 ATOM 184 D THR 11 30.436 1.643 4.870 1.00 10.49 5PTI 258
274 ATOM 185 HA THR 11 29.423 3.601 6.562 1.00 11.61 5PTI 259
275 ATOM 186 HB THR 11 29.870 0.631 6.788 1.00 14.33 5PTI 260
276 ATOM 187 DG1 THR 11 27.430 2.351 6.648 1.00 13.46 5PTI 261
277 ATOM 188 1HG2 THR 11 28.326 2.341 8.826 1.00 14.24 5PTI 262
278 ATOM 189 2HG2 THR 11 28.145 0.662 8.885 1.00 14.01 5PTI 263
279 ATOM 190 3HG2 THR 11 29.753 1.305 9.111 1.00 14.17 5PTI 264
280 ATOM 191 N GLY 12 32.251 2.091 7.350 1.00 12.43 5PTI 265
281 ATOM 192 CA GLY 12 33.523 2.128 8.130 1.00 13.15 5PTI 266
282 ATOM 193 C GLY 12 33.399 1.159 9.309 1.00 12.80 5PTI 267
283 ATOM 194 O GLY 12 32.437 0.461 9.511 1.00 12.30 5PTI 268
284 ATOM 195 D GLY 12 32.396 1.396 6.648 1.00 13.32 5PTI 269
285 ATOM 196 1HA GLY 12 34.329 1.947 7.445 1.00 12.98 5PTI 270
286 ATOM 197 2HA GLY 12 33.702 3.161 8.474 1.00 12.73 5PTI 271
287 ATOM 198 N PRO 13 34.502 1.082 10.072 1.00 14.49 5PTI 272
288 ATOM 199 CA PRO 13 34.519 0.168 11.227 1.00 13.95 5PTI 273
289 ATOM 200 C PRO 13 33.916 0.539 12.596 1.00 13.29 5PTI 274
290 ATOM 201 O PRO 13 33.930 -0.237 13.544 1.00 14.10 5PTI 275
291 ATOM 202 CB PRO 13 36.012 -0.082 11.370 1.00 13.23 5PTI 276
292 ATOM 203 CG PRO 13 36.631 1.239 10.992 1.00 14.60 5PTI 277
293 ATOM 204 CD PRO 13 35.765 1.879 9.928 1.00 13.98 5PTI 278
294 ATOM 205 HA PRO 13 33.847 -0.643 11.074 1.00 14.35 5PTI 279
295 ATOM 206 1HB PRO 13 36.119 -0.140 12.472 1.00 14.34 5PTI 280
296 ATOM 207 2HB PRO 13 36.450 -0.937 11.151 1.00 15.01 5PTI 281
297 ATOM 208 1HG PRO 13 36.465 1.829 11.916 1.00 14.42 5PTI 282
298 ATOM 209 2HG PRO 13 37.553 1.200 10.948 1.00 14.14 5PTI 283
299 ATOM 210 1HD PRO 13 35.329 2.839 10.245 1.00 15.29 5PTI 284
300 ATOM 211 2HD PRO 13 36.248 1.923 9.001 1.00 14.83 5PTI 285
301 ATOM 212 N CYS 14 33.434 1.727 12.750 1.00 12.13 5PTI 286
302 ATOM 213 CA CYS 14 32.817 2.337 13.956 1.00 13.10 5PTI 287
303 ATOM 214 C CYS 14 31.326 1.931 13.983 1.00 14.28 5PTI 288
304 ATOM 215 O CYS 14 30.770 1.555 12.956 1.00 14.31 5PTI 289
305 ATOM 216 CB CYS 14 33.176 3.792 14.087 1.00 11.97 5PTI 290
306 ATOM 217 SG CYS 14 34.877 4.044 14.560 1.00 12.63 5PTI 291
307 ATOM 218 D CYS 14 33.427 2.362 11.996 1.00 13.25 5PTI 292
308 ATOM 219 HA CYS 14 33.224 1.848 14.827 1.00 13.16 5PTI 293
309 ATOM 220 1HB CYS 14 33.021 4.260 13.114 1.00 13.49 5PTI 294
310 ATOM 221 2HB CYS 14 32.555 4.350 14.792 1.00 13.18 5PTI 295
311 ATOM 223 N LYS 15 30.797 1.938 15.212 1.00 15.59 5PTI 296
312 ATOM 224 CA LYS 15 29.455 1.371 15.454 1.00 16.40 5PTI 297
313 ATOM 225 C LYS 15 28.360 2.334 15.735 1.00 14.53 5PTI 298
314 ATOM 226 O LYS 15 27.329 1.956 16.299 1.00 16.12 5PTI 299
315 ATOM 227 CB LYS 15 29.669 0.354 16.551 1.00 20.41 5PTI 300
316 ATOM 228 CG LYS 15 30.972 -0.476 16.541 1.00 23.07 5PTI 301
317 ATOM 229 CD LYS 15 30.959 -1.503 15.478 1.00 26.62 5PTI 302
318 ATOM 230 CE LYS 15 32.296 -2.170 15.136 1.00 30.12 5PTI 303
319 ATOM 231 NZ LYS 15 31.836 -3.309 14.215 1.00 33.66 5PTI 304
320 ATOM 232 D LYS 15 31.295 2.148 16.031 1.00 14.44 5PTI 305
321 ATOM 233 HA LYS 15 29.255 0.802 14.539 1.00 16.86 5PTI 306
322 ATOM 234 1HB LYS 15 29.799 0.904 17.523 1.00 20.00 5PTI 307
323 ATOM 235 2HB LYS 15 28.831 -0.272 16.908 1.00 19.65 5PTI 308
324 ATOM 236 1HG LYS 15 31.824 0.190 16.751 1.00 23.69 5PTI 309
325 ATOM 237 2HG LYS 15 30.934 -0.947 17.555 1.00 23.35 5PTI 310
326 ATOM 238 1HD LYS 15 30.314 -2.379 15.590 1.00 26.65 5PTI 311
327 ATOM 239 2HD LYS 15 30.655 -1.058 14.485 1.00 26.43 5PTI 312
328 ATOM 240 1HE LYS 15 32.766 -1.611 14.351 1.00 30.52 5PTI 313
329 ATOM 241 2HE LYS 15 32.769 -2.717 15.928 1.00 30.42 5PTI 314
330 ATOM 242 1DZ LYS 15 31.352 -2.960 13.354 1.00 32.81 5PTI 315
331 ATOM 243 2DZ LYS 15 32.722 -3.881 14.018 1.00 33.31 5PTI 316
332 ATOM 244 3DZ LYS 15 31.212 -4.018 14.678 1.00 32.78 5PTI 317
333 ATOM 245 N ALA 16 28.538 3.555 15.339 1.00 12.01 5PTI 318
334 ATOM 246 CA ALA 16 27.519 4.598 15.454 1.00 12.90 5PTI 319
335 ATOM 247 C ALA 16 26.498 4.287 14.310 1.00 12.51 5PTI 320
336 ATOM 248 O ALA 16 26.836 3.476 13.402 1.00 13.19 5PTI 321
337 ATOM 249 CB ALA 16 27.988 6.045 15.277 1.00 11.07 5PTI 322
338 ATOM 250 D ALA 16 29.382 3.725 14.844 1.00 15.12 5PTI 323
339 ATOM 251 HA ALA 16 27.005 4.610 16.375 1.00 11.30 5PTI 324
340 ATOM 252 1HB ALA 16 28.805 6.350 15.920 1.00 12.51 5PTI 325
341 ATOM 253 2HB ALA 16 28.517 6.226 14.332 1.00 12.25 5PTI 326
342 ATOM 254 3HB ALA 16 27.104 6.681 15.367 1.00 12.27 5PTI 327
343 ATOM 255 N ARG 17 25.365 4.924 14.324 1.00 12.27 5PTI 328
344 ATOM 256 CA ARG 17 24.373 4.865 13.248 1.00 13.57 5PTI 329
345 ATOM 257 C ARG 17 24.031 6.307 12.896 1.00 11.67 5PTI 330
346 ATOM 258 O ARG 17 23.100 6.914 13.431 1.00 13.64 5PTI 331
347 ATOM 259 CB ARG 17 23.121 4.138 13.566 1.00 15.95 5PTI 332
348 ATOM 260 CG ARG 17 23.529 2.682 13.790 1.00 21.32 5PTI 333
349 ATOM 261 CD ARG 17 22.243 2.045 14.156 1.00 25.64 5PTI 334
350 ATOM 262 NE ARG 17 21.702 1.586 12.894 1.00 32.90 5PTI 335
351 ATOM 263 CZ ARG 17 20.864 1.665 11.854 1.00 35.77 5PTI 336
352 ATOM 264 NH1 ARG 17 19.924 2.628 11.721 1.00 36.79 5PTI 337
353 ATOM 265 NH2 ARG 17 20.970 0.717 10.868 1.00 36.81 5PTI 338
354 ATOM 266 D ARG 17 25.215 5.619 15.055 1.00 13.85 5PTI 339
355 ATOM 267 HA ARG 17 24.803 4.465 12.336 1.00 12.52 5PTI 340
356 ATOM 268 1HB ARG 17 22.566 4.456 14.456 1.00 17.10 5PTI 341
357 ATOM 269 2HB ARG 17 22.446 4.306 12.740 1.00 17.01 5PTI 342
358 ATOM 270 1HG ARG 17 24.096 2.201 13.028 1.00 20.76 5PTI 343
359 ATOM 271 2HG ARG 17 24.162 2.597 14.652 1.00 20.12 5PTI 344
360 ATOM 272 1HD ARG 17 22.509 1.196 14.762 1.00 27.02 5PTI 345
361 ATOM 273 2HD ARG 17 21.617 2.668 14.729 1.00 26.69 5PTI 346
362 ATOM 274 DE ARG 17 22.338 0.732 12.765 1.00 34.58 5PTI 347
363 ATOM 275 1DH1 ARG 17 19.809 3.376 12.418 1.00 35.94 5PTI 348
364 ATOM 276 2DH1 ARG 17 19.300 2.647 10.901 1.00 35.75 5PTI 349
365 ATOM 277 1DH2 ARG 17 21.641 -0.055 10.942 1.00 35.56 5PTI 350
366 ATOM 278 2DH2 ARG 17 20.319 0.741 10.088 1.00 35.91 5PTI 351
367 ATOM 279 N ILE 18 24.783 6.955 12.017 1.00 10.78 5PTI 352
368 ATOM 280 CA ILE 18 24.709 8.341 11.537 1.00 10.61 5PTI 353
369 ATOM 281 C ILE 18 24.204 8.278 10.079 1.00 10.94 5PTI 354
370 ATOM 282 O ILE 18 24.876 7.679 9.249 1.00 10.62 5PTI 355
371 ATOM 283 CB ILE 18 26.042 9.082 11.623 1.00 11.97 5PTI 356
372 ATOM 284 CG1 ILE 18 26.652 9.020 13.051 1.00 13.12 5PTI 357
373 ATOM 285 CG2 ILE 18 25.974 10.525 11.176 1.00 10.95 5PTI 358
374 ATOM 286 CD1 ILE 18 28.148 9.276 13.084 1.00 13.42 5PTI 359
375 ATOM 287 H ILE 18 25.549 6.401 11.624 1.00 11.76 5PTI 360
376 ATOM 288 HA ILE 18 24.000 8.847 12.188 1.00 11.05 5PTI 361
377 ATOM 289 HB ILE 18 26.865 8.594 11.118 1.00 11.50 5PTI 362
378 ATOM 290 1HG1 ILE 18 25.954 9.414 13.777 1.00 13.26 5PTI 363
379 ATOM 291 2HG1 ILE 18 26.548 7.951 13.380 1.00 13.89 5PTI 364
380 ATOM 292 1HG2 ILE 18 25.331 10.602 10.286 1.00 11.59 5PTI 365
381 ATOM 293 2HG2 ILE 18 25.493 11.179 11.921 1.00 12.37 5PTI 366
382 ATOM 294 3HG2 ILE 18 26.964 10.890 10.940 1.00 12.46 5PTI 367
383 ATOM 295 1HD1 ILE 18 28.535 10.191 12.656 1.00 14.38 5PTI 368
384 ATOM 296 2HD1 ILE 18 28.455 8.952 14.098 1.00 13.86 5PTI 369
385 ATOM 297 3HD1 ILE 18 28.699 8.514 12.441 1.00 13.73 5PTI 370
386 ATOM 298 N ILE 19 23.050 8.866 9.854 1.00 10.63 5PTI 371
387 ATOM 299 CA ILE 19 22.472 8.852 8.467 1.00 11.65 5PTI 372
388 ATOM 300 C ILE 19 23.093 9.970 7.681 1.00 10.38 5PTI 373
389 ATOM 301 O ILE 19 23.078 11.156 8.055 1.00 12.22 5PTI 374
390 ATOM 302 CB ILE 19 20.954 9.049 8.496 1.00 13.30 5PTI 375
391 ATOM 303 CG1 ILE 19 20.478 7.843 9.308 1.00 15.24 5PTI 376
392 ATOM 304 CG2 ILE 19 20.383 9.074 7.118 1.00 13.64 5PTI 377
393 ATOM 305 CD1 ILE 19 21.047 6.435 9.116 1.00 16.83 5PTI 378
394 ATOM 306 D ILE 19 22.527 9.412 10.455 1.00 10.47 5PTI 379
395 ATOM 307 HA ILE 19 22.918 7.937 8.132 1.00 10.97 5PTI 380
396 ATOM 308 HB ILE 19 20.852 10.028 8.952 1.00 14.17 5PTI 381
397 ATOM 309 1HG1 ILE 19 20.631 8.038 10.370 1.00 15.45 5PTI 382
398 ATOM 310 2HG1 ILE 19 19.392 7.700 9.202 1.00 15.29 5PTI 383
399 ATOM 311 1HG2 ILE 19 20.776 8.130 6.682 1.00 13.57 5PTI 384
400 ATOM 312 2HG2 ILE 19 19.302 8.957 7.044 1.00 13.63 5PTI 385
401 ATOM 313 3HG2 ILE 19 20.641 9.847 6.406 1.00 14.10 5PTI 386
402 ATOM 314 1HD1 ILE 19 22.105 6.190 9.208 1.00 15.89 5PTI 387
403 ATOM 315 2HD1 ILE 19 20.411 5.657 9.580 1.00 16.70 5PTI 388
404 ATOM 316 3HD1 ILE 19 20.856 6.216 8.025 1.00 15.33 5PTI 389
405 ATOM 317 N ARG 20 23.726 9.516 6.564 1.00 10.55 5PTI 390
406 ATOM 318 CA ARG 20 24.442 10.455 5.670 1.00 10.78 5PTI 391
407 ATOM 319 C ARG 20 23.927 10.184 4.206 1.00 9.27 5PTI 392
408 ATOM 320 O ARG 20 23.300 9.191 3.965 1.00 10.69 5PTI 393
409 ATOM 321 CB ARG 20 25.962 10.178 5.691 1.00 9.44 5PTI 394
410 ATOM 322 CG ARG 20 26.624 10.625 7.025 1.00 10.78 5PTI 395
411 ATOM 323 CD ARG 20 26.683 12.084 7.147 1.00 12.14 5PTI 396
412 ATOM 324 NE ARG 20 27.301 12.496 8.436 1.00 13.47 5PTI 397
413 ATOM 325 CZ ARG 20 28.569 12.515 8.793 1.00 14.63 5PTI 398
414 ATOM 326 NH1 ARG 20 29.528 12.120 7.954 1.00 14.38 5PTI 399
415 ATOM 327 NH2 ARG 20 28.880 12.930 10.036 1.00 15.39 5PTI 400
416 ATOM 328 H ARG 20 23.787 8.592 6.237 1.00 11.60 5PTI 401
417 ATOM 329 HA ARG 20 24.058 11.425 5.818 1.00 9.96 5PTI 402
418 ATOM 330 1HB ARG 20 25.997 9.096 5.514 1.00 11.42 5PTI 403
419 ATOM 331 2HB ARG 20 26.473 10.556 4.823 1.00 11.61 5PTI 404
420 ATOM 332 1HG ARG 20 26.061 10.144 7.831 1.00 10.85 5PTI 405
421 ATOM 333 2HG ARG 20 27.535 10.103 7.169 1.00 11.31 5PTI 406
422 ATOM 334 1HD ARG 20 27.287 12.570 6.390 1.00 12.19 5PTI 407
423 ATOM 335 2HD ARG 20 25.902 12.789 7.042 1.00 11.77 5PTI 408
424 ATOM 336 DE ARG 20 26.641 12.861 9.099 1.00 15.00 5PTI 409
425 ATOM 337 1DH1 ARG 20 30.497 12.035 8.190 1.00 15.45 5PTI 410
426 ATOM 338 2DH1 ARG 20 29.294 11.758 7.027 1.00 15.68 5PTI 411
427 ATOM 339 1DH2 ARG 20 29.867 12.914 10.308 1.00 13.82 5PTI 412
428 ATOM 340 2DH2 ARG 20 28.137 13.263 10.632 1.00 14.55 5PTI 413
429 ATOM 341 N TYR 21 24.290 11.111 3.341 1.00 9.20 5PTI 414
430 ATOM 342 CA TYR 21 23.980 10.950 1.898 1.00 8.22 5PTI 415
431 ATOM 343 C TYR 21 25.230 10.503 1.171 1.00 8.71 5PTI 416
432 ATOM 344 O TYR 21 26.337 10.911 1.504 1.00 8.47 5PTI 417
433 ATOM 345 CB TYR 21 23.571 12.308 1.316 1.00 9.14 5PTI 418
434 ATOM 346 CG TYR 21 22.096 12.567 1.577 1.00 10.30 5PTI 419
435 ATOM 347 CD1 TYR 21 21.657 13.359 2.656 1.00 10.02 5PTI 420
436 ATOM 348 CD2 TYR 21 21.170 12.008 0.718 1.00 10.29 5PTI 421
437 ATOM 349 CE1 TYR 21 20.312 13.586 2.819 1.00 11.24 5PTI 422
438 ATOM 350 CE2 TYR 21 19.795 12.189 0.909 1.00 11.46 5PTI 423
439 ATOM 351 CZ TYR 21 19.370 13.026 1.971 1.00 12.26 5PTI 424
440 ATOM 352 OH TYR 21 17.995 13.168 2.092 1.00 13.81 5PTI 425
441 ATOM 353 H TYR 21 24.869 11.855 3.627 1.00 9.54 5PTI 426
442 ATOM 354 HA TYR 21 23.253 10.171 1.894 1.00 9.45 5PTI 427
443 ATOM 355 1HB TYR 21 24.218 13.154 1.485 1.00 10.74 5PTI 428
444 ATOM 356 2HB TYR 21 23.593 12.133 0.220 1.00 9.35 5PTI 429
445 ATOM 357 HD1 TYR 21 22.396 13.821 3.302 1.00 11.00 5PTI 430
446 ATOM 358 HD2 TYR 21 21.487 11.347 -0.072 1.00 10.53 5PTI 431
447 ATOM 359 HE1 TYR 21 19.977 14.203 3.642 1.00 10.87 5PTI 432
448 ATOM 360 HE2 TYR 21 19.073 11.749 0.247 1.00 11.44 5PTI 433
449 ATOM 361 DH TYR 21 17.713 13.930 2.654 1.00 14.85 5PTI 434
450 ATOM 362 N PHE 22 24.953 9.731 0.125 1.00 7.43 5PTI 435
451 ATOM 363 CA PHE 22 25.997 9.344 -0.804 1.00 6.76 5PTI 436
452 ATOM 364 C PHE 22 25.379 9.511 -2.224 1.00 7.20 5PTI 437
453 ATOM 365 O PHE 22 24.147 9.372 -2.366 1.00 7.41 5PTI 438
454 ATOM 366 CB PHE 22 26.543 7.944 -0.689 1.00 6.59 5PTI 439
455 ATOM 367 CG PHE 22 25.670 6.853 -1.112 1.00 7.76 5PTI 440
456 ATOM 368 CD1 PHE 22 25.945 6.167 -2.285 1.00 8.47 5PTI 441
457 ATOM 369 CD2 PHE 22 24.511 6.513 -0.412 1.00 8.78 5PTI 442
458 ATOM 370 CE1 PHE 22 25.147 5.127 -2.683 1.00 9.15 5PTI 443
459 ATOM 371 CE2 PHE 22 23.691 5.457 -0.800 1.00 9.59 5PTI 444
460 ATOM 372 CZ PHE 22 24.024 4.780 -1.963 1.00 9.79 5PTI 445
461 ATOM 373 H PHE 22 24.062 9.484 -0.227 1.00 8.93 5PTI 446
462 ATOM 374 HA PHE 22 26.914 9.910 -0.832 1.00 6.50 5PTI 447
463 ATOM 375 1HB PHE 22 27.448 8.048 -1.293 1.00 7.09 5PTI 448
464 ATOM 376 2HB PHE 22 26.675 7.814 0.433 1.00 5.77 5PTI 449
465 ATOM 377 HD1 PHE 22 26.792 6.452 -2.819 1.00 8.71 5PTI 450
466 ATOM 378 HD2 PHE 22 24.305 7.028 0.503 1.00 8.57 5PTI 451
467 ATOM 379 HE1 PHE 22 25.378 4.634 -3.594 1.00 9.13 5PTI 452
468 ATOM 380 HE2 PHE 22 22.866 5.192 -0.228 1.00 9.05 5PTI 453
469 ATOM 381 HZ PHE 22 23.411 3.987 -2.299 1.00 9.64 5PTI 454
470 ATOM 382 N TYR 23 26.248 9.721 -3.224 1.00 8.20 5PTI 455
471 ATOM 383 CA TYR 23 25.779 9.725 -4.634 1.00 7.28 5PTI 456
472 ATOM 384 C TYR 23 25.786 8.322 -5.124 1.00 7.57 5PTI 457
473 ATOM 385 O TYR 23 26.818 7.621 -5.132 1.00 8.16 5PTI 458
474 ATOM 386 CB TYR 23 26.759 10.511 -5.499 1.00 9.85 5PTI 459
475 ATOM 387 CG TYR 23 26.248 10.666 -6.944 1.00 9.96 5PTI 460
476 ATOM 388 CD1 TYR 23 26.914 10.044 -7.987 1.00 10.97 5PTI 461
477 ATOM 389 CD2 TYR 23 25.125 11.475 -7.226 1.00 11.33 5PTI 462
478 ATOM 390 CE1 TYR 23 26.451 10.178 -9.295 1.00 11.27 5PTI 463
479 ATOM 391 CE2 TYR 23 24.587 11.603 -8.518 1.00 11.73 5PTI 464
480 ATOM 392 CZ TYR 23 25.294 10.925 -9.501 1.00 11.91 5PTI 465
481 ATOM 393 OH TYR 23 24.839 11.085 -10.793 1.00 14.10 5PTI 466
482 ATOM 394 H TYR 23 27.210 9.753 -3.004 1.00 7.41 5PTI 467
483 ATOM 395 HA TYR 23 24.818 10.226 -4.744 1.00 8.02 5PTI 468
484 ATOM 396 1HB TYR 23 26.593 11.519 -5.121 1.00 9.84 5PTI 469
485 ATOM 397 2HB TYR 23 27.819 10.292 -5.414 1.00 9.27 5PTI 470
486 ATOM 398 HD1 TYR 23 27.785 9.438 -7.850 1.00 10.63 5PTI 471
487 ATOM 399 HD2 TYR 23 24.614 11.894 -6.350 1.00 10.81 5PTI 472
488 ATOM 400 HE1 TYR 23 26.909 9.696 -10.142 1.00 11.58 5PTI 473
489 ATOM 401 HE2 TYR 23 23.716 12.164 -8.754 1.00 11.77 5PTI 474
490 ATOM 402 DH TYR 23 24.638 12.063 -10.743 1.00 14.22 5PTI 475
491 ATOM 403 N ASN 24 24.618 7.831 -5.550 1.00 7.53 5PTI 476
492 ATOM 404 CA ASN 24 24.473 6.511 -6.126 1.00 8.25 5PTI 477
493 ATOM 405 C ASN 24 24.533 6.730 -7.657 1.00 9.26 5PTI 478
494 ATOM 406 O ASN 24 23.605 7.147 -8.338 1.00 9.06 5PTI 479
495 ATOM 407 CB ASN 24 23.099 5.973 -5.764 1.00 9.60 5PTI 480
496 ATOM 408 CG ASN 24 22.895 4.611 -6.330 1.00 10.11 5PTI 481
497 ATOM 409 OD1 ASN 24 23.537 4.204 -7.313 1.00 13.10 5PTI 482
498 ATOM 410 ND2 ASN 24 21.966 3.903 -5.800 1.00 12.51 5PTI 483
499 ATOM 411 H ASN 24 23.768 8.406 -5.560 1.00 7.95 5PTI 484
500 ATOM 412 HA ASN 24 25.252 5.817 -5.749 1.00 7.93 5PTI 485
501 ATOM 413 1HB ASN 24 23.193 5.827 -4.660 1.00 8.09 5PTI 486
502 ATOM 414 2HB ASN 24 22.291 6.679 -5.844 1.00 9.60 5PTI 487
503 ATOM 415 1DD2 ASN 24 21.767 2.914 -6.106 1.00 12.19 5PTI 488
504 ATOM 416 2DD2 ASN 24 21.419 4.231 -5.010 1.00 11.93 5PTI 489
505 ATOM 417 N ALA 25 25.690 6.499 -8.244 1.00 10.90 5PTI 490
506 ATOM 418 CA ALA 25 25.937 6.771 -9.710 1.00 12.18 5PTI 491
507 ATOM 419 C ALA 25 25.108 5.883 -10.665 1.00 11.03 5PTI 492
508 ATOM 420 O ALA 25 24.972 6.315 -11.816 1.00 12.22 5PTI 493
509 ATOM 421 CB ALA 25 27.438 6.846 -9.903 1.00 11.38 5PTI 494
510 ATOM 422 D ALA 25 26.523 6.274 -7.738 1.00 10.47 5PTI 495
511 ATOM 423 HA ALA 25 25.558 7.786 -9.716 1.00 11.28 5PTI 496
512 ATOM 424 1HB ALA 25 28.036 7.257 -9.107 1.00 12.88 5PTI 497
513 ATOM 425 2HB ALA 25 27.681 5.764 -9.848 1.00 12.72 5PTI 498
514 ATOM 426 3HB ALA 25 27.740 7.086 -10.895 1.00 12.70 5PTI 499
515 ATOM 427 N LYS 26 24.672 4.739 -10.226 1.00 10.74 5PTI 500
516 ATOM 428 CA LYS 26 23.844 3.843 -10.944 1.00 13.89 5PTI 501
517 ATOM 429 C LYS 26 22.458 4.414 -11.053 1.00 13.64 5PTI 502
518 ATOM 430 O LYS 26 21.776 4.419 -12.113 1.00 15.07 5PTI 503
519 ATOM 431 CB LYS 26 23.873 2.469 -10.338 1.00 18.92 5PTI 504
520 ATOM 432 CG LYS 26 22.897 1.688 -11.164 1.00 23.44 5PTI 505
521 ATOM 433 CD LYS 26 23.134 0.220 -10.987 1.00 28.41 5PTI 506
522 ATOM 434 CE LYS 26 21.883 -0.282 -11.734 1.00 33.13 5PTI 507
523 ATOM 435 NZ LYS 26 21.699 -1.653 -11.140 1.00 36.26 5PTI 508
524 ATOM 436 D LYS 26 24.811 4.482 -9.301 1.00 12.45 5PTI 509
525 ATOM 437 HA LYS 26 24.244 3.768 -11.951 1.00 13.36 5PTI 510
526 ATOM 438 1HB LYS 26 24.904 2.072 -10.313 1.00 18.73 5PTI 511
527 ATOM 439 2HB LYS 26 23.584 2.461 -9.286 1.00 18.71 5PTI 512
528 ATOM 440 1HG LYS 26 21.821 1.865 -11.054 1.00 23.71 5PTI 513
529 ATOM 441 2HG LYS 26 23.032 1.822 -12.264 1.00 23.90 5PTI 514
530 ATOM 442 1HD LYS 26 23.995 -0.194 -11.474 1.00 28.42 5PTI 515
531 ATOM 443 2HD LYS 26 23.120 -0.106 -9.964 1.00 28.28 5PTI 516
532 ATOM 444 1HE LYS 26 21.046 0.350 -11.524 1.00 32.48 5PTI 517
533 ATOM 445 2HE LYS 26 22.160 -0.402 -12.753 1.00 32.27 5PTI 518
534 ATOM 446 1DZ LYS 26 21.593 -1.586 -10.094 1.00 36.90 5PTI 519
535 ATOM 447 2DZ LYS 26 20.761 -1.979 -11.479 1.00 37.12 5PTI 520
536 ATOM 448 3DZ LYS 26 22.527 -2.262 -11.359 1.00 36.55 5PTI 521
537 ATOM 449 N ALA 27 21.931 5.074 -10.038 1.00 13.18 5PTI 522
538 ATOM 450 CA ALA 27 20.576 5.701 -10.043 1.00 11.76 5PTI 523
539 ATOM 451 C ALA 27 20.606 7.178 -10.432 1.00 10.74 5PTI 524
540 ATOM 452 O ALA 27 19.595 7.768 -10.820 1.00 11.30 5PTI 525
541 ATOM 453 CB ALA 27 20.054 5.625 -8.612 1.00 12.78 5PTI 526
542 ATOM 454 D ALA 27 22.488 5.076 -9.180 1.00 15.23 5PTI 527
543 ATOM 455 HA ALA 27 20.090 5.015 -10.727 1.00 12.71 5PTI 528
544 ATOM 456 1HB ALA 27 20.772 6.088 -7.962 1.00 11.38 5PTI 529
545 ATOM 457 2HB ALA 27 19.100 6.124 -8.555 1.00 11.24 5PTI 530
546 ATOM 458 3HB ALA 27 20.011 4.596 -8.261 1.00 11.11 5PTI 531
547 ATOM 459 N GLY 28 21.752 7.848 -10.373 1.00 9.60 5PTI 532
548 ATOM 460 CA GLY 28 21.970 9.249 -10.618 1.00 10.58 5PTI 533
549 ATOM 461 C GLY 28 21.292 10.175 -9.591 1.00 11.69 5PTI 534
550 ATOM 462 O GLY 28 20.947 11.316 -9.904 1.00 12.66 5PTI 535
551 ATOM 463 D GLY 28 22.531 7.298 -10.049 1.00 11.71 5PTI 536
552 ATOM 464 1HA GLY 28 22.992 9.579 -10.730 1.00 10.85 5PTI 537
553 ATOM 465 2HA GLY 28 21.483 9.541 -11.578 1.00 10.66 5PTI 538
554 ATOM 466 N LEU 29 21.201 9.723 -8.370 1.00 11.42 5PTI 539
555 ATOM 467 CA LEU 29 20.589 10.458 -7.271 1.00 13.44 5PTI 540
556 ATOM 468 C LEU 29 21.437 10.194 -6.009 1.00 10.49 5PTI 541
557 ATOM 469 O LEU 29 22.077 9.168 -5.914 1.00 11.18 5PTI 542
558 ATOM 470 CB LEU 29 19.233 9.682 -6.932 1.00 15.84 5PTI 543
559 ATOM 471 CG LEU 29 18.126 9.639 -7.924 1.00 17.24 5PTI 544
560 ATOM 472 CD1 LEU 29 16.897 8.857 -7.584 1.00 18.29 5PTI 545
561 ATOM 473 CD2 LEU 29 17.548 11.015 -8.232 1.00 18.39 5PTI 546
562 ATOM 474 D LEU 29 21.510 8.788 -8.071 1.00 11.84 5PTI 547
563 ATOM 475 HA LEU 29 20.311 11.468 -7.252 1.00 13.35 5PTI 548
564 ATOM 476 1HB LEU 29 19.436 8.685 -6.548 1.00 15.95 5PTI 549
565 ATOM 477 2HB LEU 29 18.858 10.134 -5.977 1.00 15.40 5PTI 550
566 ATOM 478 HG LEU 29 18.531 9.305 -8.886 1.00 17.16 5PTI 551
567 ATOM 479 1HD1 LEU 29 16.985 7.826 -7.316 1.00 17.17 5PTI 552
568 ATOM 480 2HD1 LEU 29 16.567 9.316 -6.642 1.00 17.13 5PTI 553
569 ATOM 481 3HD1 LEU 29 16.204 9.016 -8.386 1.00 17.35 5PTI 554
570 ATOM 482 1HD2 LEU 29 18.381 11.675 -8.464 1.00 17.08 5PTI 555
571 ATOM 483 2HD2 LEU 29 16.837 10.957 -9.047 1.00 17.51 5PTI 556
572 ATOM 484 3HD2 LEU 29 17.112 11.417 -7.289 1.00 16.97 5PTI 557
573 ATOM 485 N CYS 30 21.289 11.133 -5.121 1.00 10.45 5PTI 558
574 ATOM 486 CA CYS 30 21.875 11.033 -3.734 1.00 10.30 5PTI 559
575 ATOM 487 C CYS 30 20.869 10.289 -2.850 1.00 10.76 5PTI 560
576 ATOM 488 O CYS 30 19.639 10.651 -2.961 1.00 12.39 5PTI 561
577 ATOM 489 CB CYS 30 22.103 12.439 -3.217 1.00 10.60 5PTI 562
578 ATOM 490 SG CYS 30 23.486 13.149 -4.087 1.00 11.79 5PTI 563
579 ATOM 491 D CYS 30 20.752 11.960 -5.175 1.00 11.99 5PTI 564
580 ATOM 492 HA CYS 30 22.835 10.632 -3.940 1.00 10.70 5PTI 565
581 ATOM 493 1HB CYS 30 21.141 12.922 -3.348 1.00 11.15 5PTI 566
582 ATOM 494 2HB CYS 30 22.434 12.440 -2.188 1.00 10.30 5PTI 567
583 ATOM 496 N GLN 31 21.336 9.324 -2.086 1.00 8.79 5PTI 568
584 ATOM 497 CA GLN 31 20.508 8.474 -1.259 1.00 10.62 5PTI 569
585 ATOM 498 C GLN 31 21.184 8.402 0.118 1.00 10.68 5PTI 570
586 ATOM 499 O GLN 31 22.328 8.784 0.291 1.00 10.44 5PTI 571
587 ATOM 500 CB GLN 31 20.354 7.087 -1.858 1.00 11.67 5PTI 572
588 ATOM 501 CG GLN 31 19.623 7.119 -3.183 1.00 13.65 5PTI 573
589 ATOM 502 CD GLN 31 19.594 5.767 -3.853 1.00 14.34 5PTI 574
590 ATOM 503 OE1 GLN 31 20.395 4.867 -3.653 1.00 15.59 5PTI 575
591 ATOM 504 NE2 GLN 31 18.531 5.618 -4.678 1.00 18.68 5PTI 576
592 ATOM 505 H GLN 31 22.343 9.128 -2.125 1.00 11.77 5PTI 577
593 ATOM 506 HA GLN 31 19.517 8.874 -1.128 1.00 10.53 5PTI 578
594 ATOM 507 1HB GLN 31 21.356 6.648 -2.002 1.00 13.07 5PTI 579
595 ATOM 508 2HB GLN 31 19.931 6.372 -1.113 1.00 11.96 5PTI 580
596 ATOM 509 1HG GLN 31 18.690 7.661 -3.311 1.00 12.84 5PTI 581
597 ATOM 510 2HG GLN 31 20.219 7.714 -3.916 1.00 11.88 5PTI 582
598 ATOM 511 1DE2 GLN 31 18.411 4.689 -5.135 1.00 15.66 5PTI 583
599 ATOM 512 2DE2 GLN 31 17.891 6.434 -4.778 1.00 15.36 5PTI 584
600 ATOM 513 N THR 32 20.404 7.934 1.103 1.00 11.66 5PTI 585
601 ATOM 514 CA THR 32 20.941 7.836 2.490 1.00 11.14 5PTI 586
602 ATOM 515 C THR 32 21.590 6.489 2.656 1.00 10.29 5PTI 587
603 ATOM 516 O THR 32 21.401 5.428 2.076 1.00 11.74 5PTI 588
604 ATOM 517 CB THR 32 19.849 8.116 3.568 1.00 11.90 5PTI 589
605 ATOM 518 OG1 THR 32 18.807 7.216 3.348 1.00 14.39 5PTI 590
606 ATOM 519 CG2 THR 32 19.240 9.473 3.369 1.00 13.60 5PTI 591
607 ATOM 520 D THR 32 19.456 7.621 0.938 1.00 10.82 5PTI 592
608 ATOM 521 HA THR 32 21.592 8.681 2.741 1.00 11.72 5PTI 593
609 ATOM 522 HB THR 32 20.326 8.080 4.568 1.00 13.24 5PTI 594
610 ATOM 523 DG1 THR 32 19.288 6.347 3.409 1.00 15.34 5PTI 595
611 ATOM 524 1HG2 THR 32 18.775 9.734 2.409 1.00 12.24 5PTI 596
612 ATOM 525 2HG2 THR 32 18.605 9.634 4.256 1.00 12.28 5PTI 597
613 ATOM 526 3HG2 THR 32 19.988 10.264 3.585 1.00 13.01 5PTI 598
614 ATOM 527 N PHE 33 22.506 6.456 3.619 1.00 9.22 5PTI 599
615 ATOM 528 CA PHE 33 23.207 5.275 4.060 1.00 9.74 5PTI 600
616 ATOM 529 C PHE 33 23.550 5.541 5.559 1.00 9.40 5PTI 601
617 ATOM 530 O PHE 33 23.556 6.640 6.034 1.00 10.22 5PTI 602
618 ATOM 531 CB PHE 33 24.434 4.964 3.270 1.00 9.26 5PTI 603
619 ATOM 532 CG PHE 33 25.710 5.682 3.555 1.00 9.20 5PTI 604
620 ATOM 533 CD1 PHE 33 26.781 5.095 4.224 1.00 10.68 5PTI 605
621 ATOM 534 CD2 PHE 33 25.843 6.975 3.069 1.00 10.04 5PTI 606
622 ATOM 535 CE1 PHE 33 27.946 5.766 4.445 1.00 8.91 5PTI 607
623 ATOM 536 CE2 PHE 33 27.014 7.710 3.271 1.00 10.37 5PTI 608
624 ATOM 537 CZ PHE 33 28.008 7.053 3.984 1.00 9.71 5PTI 609
625 ATOM 538 H PHE 33 22.695 7.266 4.199 1.00 11.07 5PTI 610
626 ATOM 539 HA PHE 33 22.613 4.388 3.918 1.00 9.08 5PTI 611
627 ATOM 540 1HB PHE 33 24.660 3.891 3.281 1.00 8.91 5PTI 612
628 ATOM 541 2HB PHE 33 24.191 5.223 2.224 1.00 10.11 5PTI 613
629 ATOM 542 HD1 PHE 33 26.642 4.136 4.599 1.00 10.02 5PTI 614
630 ATOM 543 HD2 PHE 33 25.041 7.396 2.488 1.00 10.10 5PTI 615
631 ATOM 544 HE1 PHE 33 28.767 5.394 5.011 1.00 10.09 5PTI 616
632 ATOM 545 HE2 PHE 33 27.164 8.641 2.902 1.00 9.74 5PTI 617
633 ATOM 546 HZ PHE 33 28.943 7.600 4.146 1.00 9.76 5PTI 618
634 ATOM 547 N VAL 34 23.923 4.477 6.205 1.00 11.69 5PTI 619
635 ATOM 548 CA VAL 34 24.349 4.496 7.646 1.00 11.33 5PTI 620
636 ATOM 549 C VAL 34 25.894 4.524 7.711 1.00 10.54 5PTI 621
637 ATOM 550 O VAL 34 26.638 3.625 7.263 1.00 11.75 5PTI 622
638 ATOM 551 CB VAL 34 23.771 3.242 8.364 1.00 13.85 5PTI 623
639 ATOM 552 CG1 VAL 34 24.190 3.382 9.822 1.00 15.43 5PTI 624
640 ATOM 553 CG2 VAL 34 22.264 3.291 8.258 1.00 14.03 5PTI 625
641 ATOM 554 D VAL 34 23.874 3.555 5.766 1.00 10.86 5PTI 626
642 ATOM 555 HA VAL 34 23.896 5.373 8.063 1.00 13.01 5PTI 627
643 ATOM 556 HB VAL 34 24.145 2.394 7.767 1.00 14.28 5PTI 628
644 ATOM 557 1HG1 VAL 34 25.215 3.495 10.080 1.00 14.34 5PTI 629
645 ATOM 558 2HG1 VAL 34 23.715 4.342 10.087 1.00 14.17 5PTI 630
646 ATOM 559 3HG1 VAL 34 23.671 2.771 10.508 1.00 14.55 5PTI 631
647 ATOM 560 1HG2 VAL 34 21.923 3.399 7.220 1.00 13.82 5PTI 632
648 ATOM 561 2HG2 VAL 34 21.859 2.299 8.478 1.00 13.92 5PTI 633
649 ATOM 562 3HG2 VAL 34 21.693 4.035 8.788 1.00 14.12 5PTI 634
650 ATOM 563 N TYR 35 26.387 5.631 8.231 1.00 8.67 5PTI 635
651 ATOM 564 CA TYR 35 27.814 5.860 8.458 1.00 8.52 5PTI 636
652 ATOM 565 C TYR 35 28.085 5.455 9.938 1.00 9.39 5PTI 637
653 ATOM 566 O TYR 35 27.356 5.880 10.841 1.00 10.05 5PTI 638
654 ATOM 567 CB TYR 35 28.111 7.355 8.111 1.00 9.40 5PTI 639
655 ATOM 568 CG TYR 35 29.487 7.835 8.503 1.00 9.39 5PTI 640
656 ATOM 569 CD1 TYR 35 30.614 7.095 8.174 1.00 9.35 5PTI 641
657 ATOM 570 CD2 TYR 35 29.613 8.943 9.313 1.00 9.32 5PTI 642
658 ATOM 571 CE1 TYR 35 31.862 7.506 8.619 1.00 9.35 5PTI 643
659 ATOM 572 CE2 TYR 35 30.895 9.387 9.715 1.00 9.94 5PTI 644
660 ATOM 573 CZ TYR 35 31.977 8.641 9.373 1.00 10.13 5PTI 645
661 ATOM 574 OH TYR 35 33.198 9.064 9.803 1.00 11.76 5PTI 646
662 ATOM 575 H TYR 35 25.808 6.359 8.604 1.00 10.82 5PTI 647
663 ATOM 576 HA TYR 35 28.395 5.346 7.704 1.00 8.94 5PTI 648
664 ATOM 577 1HB TYR 35 28.076 7.240 7.047 1.00 9.25 5PTI 649
665 ATOM 578 2HB TYR 35 27.271 7.909 8.560 1.00 9.74 5PTI 650
666 ATOM 579 HD1 TYR 35 30.545 6.205 7.538 1.00 9.98 5PTI 651
667 ATOM 580 HD2 TYR 35 28.750 9.553 9.589 1.00 10.16 5PTI 652
668 ATOM 581 HE1 TYR 35 32.771 6.952 8.307 1.00 10.27 5PTI 653
669 ATOM 582 HE2 TYR 35 30.943 10.289 10.353 1.00 9.68 5PTI 654
670 ATOM 583 DH TYR 35 33.644 9.848 9.469 1.00 13.94 5PTI 655
671 ATOM 584 N GLY 36 29.181 4.741 10.152 1.00 9.59 5PTI 656
672 ATOM 585 CA GLY 36 29.544 4.252 11.487 1.00 9.91 5PTI 657
673 ATOM 586 C GLY 36 30.219 5.242 12.389 1.00 9.25 5PTI 658
674 ATOM 587 O GLY 36 30.414 4.897 13.554 1.00 9.95 5PTI 659
675 ATOM 588 D GLY 36 29.796 4.369 9.440 1.00 10.72 5PTI 660
676 ATOM 589 1HA GLY 36 28.569 4.035 11.938 1.00 9.21 5PTI 661
677 ATOM 590 2HA GLY 36 29.951 3.244 11.467 1.00 9.63 5PTI 662
678 ATOM 591 N GLY 37 30.587 6.373 11.911 1.00 8.45 5PTI 663
679 ATOM 592 CA GLY 37 31.172 7.377 12.736 1.00 10.39 5PTI 664
680 ATOM 593 C GLY 37 32.637 7.664 12.699 1.00 10.61 5PTI 665
681 ATOM 594 O GLY 37 33.098 8.624 13.380 1.00 13.37 5PTI 666
682 ATOM 595 H GLY 37 30.371 6.645 10.927 1.00 9.53 5PTI 667
683 ATOM 596 1HA GLY 37 30.644 8.301 12.496 1.00 10.62 5PTI 668
684 ATOM 597 2HA GLY 37 30.965 7.251 13.816 1.00 9.36 5PTI 669
685 ATOM 598 N CYS 38 33.387 6.871 11.999 1.00 10.95 5PTI 670
686 ATOM 599 CA CYS 38 34.813 7.212 11.868 1.00 11.65 5PTI 671
687 ATOM 600 C CYS 38 35.267 6.763 10.481 1.00 12.05 5PTI 672
688 ATOM 601 O CYS 38 34.729 5.808 9.860 1.00 11.60 5PTI 673
689 ATOM 602 CB CYS 38 35.702 6.466 12.895 1.00 12.40 5PTI 674
690 ATOM 603 SG CYS 38 35.719 4.684 12.827 1.00 12.21 5PTI 675
691 ATOM 604 D CYS 38 33.052 6.073 11.478 1.00 11.38 5PTI 676
692 ATOM 605 HA CYS 38 34.828 8.254 12.105 1.00 12.48 5PTI 677
693 ATOM 606 1HB CYS 38 36.717 6.782 12.719 1.00 11.84 5PTI 678
694 ATOM 607 2HB CYS 38 35.376 6.694 13.914 1.00 11.11 5PTI 679
695 ATOM 609 N ARG 39 36.341 7.375 10.042 1.00 12.46 5PTI 680
696 ATOM 610 CA ARG 39 37.025 7.056 8.805 1.00 14.63 5PTI 681
697 ATOM 611 C ARG 39 36.187 7.227 7.520 1.00 12.13 5PTI 682
698 ATOM 612 O ARG 39 36.332 6.391 6.640 1.00 13.93 5PTI 683
699 ATOM 613 CB ARG 39 37.538 5.625 8.866 1.00 18.16 5PTI 684
700 ATOM 614 CG ARG 39 38.516 5.562 10.066 1.00 22.63 5PTI 685
701 ATOM 615 CD ARG 39 39.107 4.166 10.098 1.00 26.10 5PTI 686
702 ATOM 616 NE ARG 39 39.805 4.035 11.371 1.00 30.83 5PTI 687
703 ATOM 617 CZ ARG 39 40.590 3.032 11.775 1.00 32.34 5PTI 688
704 ATOM 618 NH1 ARG 39 40.823 1.964 11.024 1.00 33.18 5PTI 689
705 ATOM 619 NH2 ARG 39 41.144 3.105 12.987 1.00 33.57 5PTI 690
706 ATOM 620 D ARG 39 36.670 8.142 10.540 1.00 12.82 5PTI 691
707 ATOM 621 HA ARG 39 37.858 7.741 8.595 1.00 13.15 5PTI 692
708 ATOM 622 1HB ARG 39 36.821 4.846 9.058 1.00 18.94 5PTI 693
709 ATOM 623 2HB ARG 39 38.127 5.322 8.011 1.00 18.72 5PTI 694
710 ATOM 624 1HG ARG 39 39.277 6.303 10.090 1.00 22.77 5PTI 695
711 ATOM 625 2HG ARG 39 38.016 5.637 10.981 1.00 22.29 5PTI 696
712 ATOM 626 1HD ARG 39 38.282 3.473 10.078 1.00 26.48 5PTI 697
713 ATOM 627 2HD ARG 39 39.633 4.052 9.207 1.00 26.96 5PTI 698
714 ATOM 628 DE ARG 39 39.685 4.801 12.039 1.00 31.59 5PTI 699
715 ATOM 629 1DH1 ARG 39 40.376 1.948 10.092 1.00 32.83 5PTI 700
716 ATOM 630 2DH1 ARG 39 41.429 1.235 11.413 1.00 32.46 5PTI 701
717 ATOM 631 1DH2 ARG 39 41.037 3.833 13.662 1.00 33.14 5PTI 702
718 ATOM 632 2DH2 ARG 39 41.738 2.325 13.284 1.00 33.33 5PTI 703
719 ATOM 633 N ALA 40 35.456 8.280 7.530 1.00 11.13 5PTI 704
720 ATOM 634 CA ALA 40 34.631 8.632 6.385 1.00 12.22 5PTI 705
721 ATOM 635 C ALA 40 35.497 8.734 5.135 1.00 13.37 5PTI 706
722 ATOM 636 O ALA 40 36.687 9.115 5.137 1.00 14.12 5PTI 707
723 ATOM 637 CB ALA 40 33.941 9.981 6.542 1.00 11.96 5PTI 708
724 ATOM 638 D ALA 40 35.340 8.972 8.208 1.00 12.73 5PTI 709
725 ATOM 639 HA ALA 40 33.879 7.870 6.308 1.00 12.14 5PTI 710
726 ATOM 640 1HB ALA 40 34.528 10.829 6.846 1.00 12.60 5PTI 711
727 ATOM 641 2HB ALA 40 33.456 10.198 5.563 1.00 12.13 5PTI 712
728 ATOM 642 3HB ALA 40 33.155 9.774 7.271 1.00 11.94 5PTI 713
729 ATOM 643 N LYS 41 34.889 8.428 4.019 1.00 12.73 5PTI 714
730 ATOM 644 CA LYS 41 35.456 8.549 2.638 1.00 12.34 5PTI 715
731 ATOM 645 C LYS 41 34.782 9.775 2.026 1.00 11.42 5PTI 716
732 ATOM 646 O LYS 41 33.938 10.501 2.638 1.00 12.35 5PTI 717
733 ATOM 647 CB LYS 41 35.426 7.283 1.843 1.00 15.66 5PTI 718
734 ATOM 648 CG LYS 41 36.330 6.177 2.314 1.00 17.23 5PTI 719
735 ATOM 649 CD LYS 41 36.220 4.925 1.492 1.00 21.83 5PTI 720
736 ATOM 650 CE LYS 41 36.972 3.830 2.249 1.00 24.86 5PTI 721
737 ATOM 651 NZ LYS 41 38.430 4.086 2.238 1.00 26.80 5PTI 722
738 ATOM 652 D LYS 41 33.904 8.208 4.062 1.00 14.44 5PTI 723
739 ATOM 653 HA LYS 41 36.456 8.823 2.962 1.00 13.22 5PTI 724
740 ATOM 654 1HB LYS 41 34.348 7.148 1.817 1.00 14.20 5PTI 725
741 ATOM 655 2HB LYS 41 35.594 7.443 0.755 1.00 14.27 5PTI 726
742 ATOM 656 1HG LYS 41 37.409 6.485 2.376 1.00 18.75 5PTI 727
743 ATOM 657 2HG LYS 41 36.049 5.955 3.369 1.00 17.95 5PTI 728
744 ATOM 658 1HD LYS 41 35.216 4.451 1.494 1.00 20.99 5PTI 729
745 ATOM 659 2HD LYS 41 36.531 4.849 0.453 1.00 21.24 5PTI 730
746 ATOM 660 1HE LYS 41 36.740 3.973 3.315 1.00 24.44 5PTI 731
747 ATOM 661 2HE LYS 41 36.742 2.821 1.974 1.00 24.67 5PTI 732
748 ATOM 662 1DZ LYS 41 38.697 5.072 2.091 1.00 27.28 5PTI 733
749 ATOM 663 2DZ LYS 41 38.774 3.778 3.195 1.00 28.13 5PTI 734
750 ATOM 664 3DZ LYS 41 38.960 3.393 1.688 1.00 27.94 5PTI 735
751 ATOM 665 N ARG 42 35.115 10.128 0.777 1.00 9.56 5PTI 736
752 ATOM 666 CA ARG 42 34.659 11.372 0.167 1.00 9.93 5PTI 737
753 ATOM 667 C ARG 42 33.178 11.332 -0.259 1.00 7.40 5PTI 738
754 ATOM 668 O ARG 42 32.599 12.401 -0.162 1.00 9.71 5PTI 739
755 ATOM 669 CB ARG 42 35.554 11.797 -0.960 1.00 10.35 5PTI 740
756 ATOM 670 CG ARG 42 36.918 12.265 -0.568 1.00 13.91 5PTI 741
757 ATOM 671 CD ARG 42 37.957 12.565 -1.588 1.00 15.78 5PTI 742
758 ATOM 672 NE ARG 42 38.393 11.235 -1.972 1.00 21.96 5PTI 743
759 ATOM 673 CZ ARG 42 39.092 10.993 -3.114 1.00 24.68 5PTI 744
760 ATOM 674 NH1 ARG 42 39.486 11.979 -3.942 1.00 25.19 5PTI 745
761 ATOM 675 NH2 ARG 42 39.446 9.734 -3.428 1.00 26.22 5PTI 746
762 ATOM 676 D ARG 42 35.813 9.575 0.318 1.00 11.76 5PTI 747
763 ATOM 677 HA ARG 42 34.712 12.168 0.950 1.00 8.89 5PTI 748
764 ATOM 678 1HB ARG 42 35.629 10.967 -1.690 1.00 11.16 5PTI 749
765 ATOM 679 2HB ARG 42 35.017 12.458 -1.640 1.00 11.51 5PTI 750
766 ATOM 680 1HG ARG 42 36.981 13.025 0.221 1.00 12.33 5PTI 751
767 ATOM 681 2HG ARG 42 37.355 11.538 0.099 1.00 11.94 5PTI 752
768 ATOM 682 1HD ARG 42 37.373 13.009 -2.423 1.00 17.32 5PTI 753
769 ATOM 683 2HD ARG 42 38.645 13.283 -1.256 1.00 17.71 5PTI 754
770 ATOM 684 DE ARG 42 38.164 10.450 -1.415 1.00 22.92 5PTI 755
771 ATOM 685 1DH1 ARG 42 40.007 11.665 -4.784 1.00 24.97 5PTI 756
772 ATOM 686 2DH1 ARG 42 39.258 12.965 -3.814 1.00 24.43 5PTI 757
773 ATOM 687 1DH2 ARG 42 39.244 8.893 -2.906 1.00 25.17 5PTI 758
774 ATOM 688 2DH2 ARG 42 39.963 9.580 -4.300 1.00 25.13 5PTI 759
775 ATOM 689 N ASN 43 32.662 10.208 -0.618 1.00 7.80 5PTI 760
776 ATOM 690 CA ASN 43 31.235 10.157 -1.075 1.00 7.75 5PTI 761
777 ATOM 691 C ASN 43 30.363 9.898 0.175 1.00 7.34 5PTI 762
778 ATOM 692 O ASN 43 29.830 8.807 0.431 1.00 7.64 5PTI 763
779 ATOM 693 CB ASN 43 31.158 9.006 -2.072 1.00 8.94 5PTI 764
780 ATOM 694 CG ASN 43 29.799 9.033 -2.770 1.00 8.97 5PTI 765
781 ATOM 695 OD1 ASN 43 29.002 9.968 -2.653 1.00 9.17 5PTI 766
782 ATOM 696 ND2 ASN 43 29.533 8.007 -3.503 1.00 10.14 5PTI 767
783 ATOM 697 D ASN 43 33.214 9.377 -0.662 1.00 8.50 5PTI 768
784 ATOM 698 HA ASN 43 31.097 11.126 -1.506 1.00 9.50 5PTI 769
785 ATOM 699 1HB ASN 43 31.986 9.096 -2.796 1.00 7.95 5PTI 770
786 ATOM 700 2HB ASN 43 31.442 8.069 -1.533 1.00 8.39 5PTI 771
787 ATOM 701 1DD2 ASN 43 30.286 7.249 -3.480 1.00 13.15 5PTI 772
788 ATOM 702 2DD2 ASN 43 28.694 7.778 -4.043 1.00 12.66 5PTI 773
789 ATOM 703 N ASN 44 30.329 10.926 0.929 1.00 7.27 5PTI 774
790 ATOM 704 CA ASN 44 29.680 10.998 2.281 1.00 8.28 5PTI 775
791 ATOM 705 C ASN 44 29.441 12.481 2.513 1.00 7.79 5PTI 776
792 ATOM 706 O ASN 44 30.374 13.253 2.640 1.00 9.89 5PTI 777
793 ATOM 707 CB ASN 44 30.579 10.298 3.287 1.00 9.05 5PTI 778
794 ATOM 708 CG ASN 44 30.097 10.342 4.770 1.00 10.15 5PTI 779
795 ATOM 709 OD1 ASN 44 29.353 11.223 5.157 1.00 11.10 5PTI 780
796 ATOM 710 ND2 ASN 44 30.593 9.396 5.525 1.00 10.18 5PTI 781
797 ATOM 711 D ASN 44 30.784 11.813 0.848 1.00 8.27 5PTI 782
798 ATOM 712 HA ASN 44 28.831 10.413 2.219 1.00 7.51 5PTI 783
799 ATOM 713 1HB ASN 44 30.842 9.286 3.128 1.00 10.20 5PTI 784
800 ATOM 714 2HB ASN 44 31.523 10.823 3.352 1.00 9.86 5PTI 785
801 ATOM 715 1DD2 ASN 44 30.296 9.403 6.524 1.00 11.65 5PTI 786
802 ATOM 716 2DD2 ASN 44 31.216 8.687 5.150 1.00 9.99 5PTI 787
803 ATOM 717 N PHE 45 28.153 12.815 2.580 1.00 7.78 5PTI 788
804 ATOM 718 CA PHE 45 27.732 14.188 2.696 1.00 9.51 5PTI 789
805 ATOM 719 C PHE 45 26.649 14.315 3.805 1.00 10.10 5PTI 790
806 ATOM 720 O PHE 45 25.856 13.419 4.021 1.00 9.63 5PTI 791
807 ATOM 721 CB PHE 45 27.054 14.595 1.345 1.00 11.02 5PTI 792
808 ATOM 722 CG PHE 45 27.916 14.462 0.140 1.00 10.38 5PTI 793
809 ATOM 723 CD1 PHE 45 27.953 13.294 -0.602 1.00 11.42 5PTI 794
810 ATOM 724 CD2 PHE 45 28.752 15.525 -0.138 1.00 11.42 5PTI 795
811 ATOM 725 CE1 PHE 45 28.783 13.173 -1.704 1.00 10.82 5PTI 796
812 ATOM 726 CE2 PHE 45 29.615 15.424 -1.250 1.00 11.73 5PTI 797
813 ATOM 727 CZ PHE 45 29.599 14.241 -1.990 1.00 11.68 5PTI 798
814 ATOM 728 H PHE 45 27.398 12.157 2.411 1.00 9.18 5PTI 799
815 ATOM 729 HA PHE 45 28.527 14.889 2.741 1.00 10.24 5PTI 800
816 ATOM 730 1HB PHE 45 26.350 13.759 1.326 1.00 9.92 5PTI 801
817 ATOM 731 2HB PHE 45 26.487 15.501 1.444 1.00 10.03 5PTI 802
818 ATOM 732 HD1 PHE 45 27.341 12.513 -0.316 1.00 11.59 5PTI 803
819 ATOM 733 HD2 PHE 45 28.699 16.440 0.415 1.00 11.56 5PTI 804
820 ATOM 734 HE1 PHE 45 28.840 12.308 -2.293 1.00 11.54 5PTI 805
821 ATOM 735 HE2 PHE 45 30.188 16.207 -1.556 1.00 11.41 5PTI 806
822 ATOM 736 HZ PHE 45 30.224 14.157 -2.851 1.00 10.58 5PTI 807
823 ATOM 737 N LYS 46 26.654 15.523 4.326 1.00 13.15 5PTI 808
824 ATOM 738 CA LYS 46 25.670 15.810 5.399 1.00 15.31 5PTI 809
825 ATOM 739 C LYS 46 24.360 16.291 4.876 1.00 14.98 5PTI 810
826 ATOM 740 O LYS 46 23.386 16.226 5.649 1.00 16.56 5PTI 811
827 ATOM 741 CB LYS 46 26.188 16.720 6.512 1.00 17.44 5PTI 812
828 ATOM 742 CG LYS 46 27.318 16.084 7.335 1.00 19.58 5PTI 813
829 ATOM 743 CD LYS 46 27.843 17.081 8.391 1.00 22.85 5PTI 814
830 ATOM 744 CE LYS 46 29.236 16.576 8.669 1.00 24.99 5PTI 815
831 ATOM 745 NZ LYS 46 29.962 17.327 9.705 1.00 27.16 5PTI 816
832 ATOM 746 D LYS 46 27.344 16.221 4.047 1.00 11.41 5PTI 817
833 ATOM 747 HA LYS 46 25.458 14.851 5.822 1.00 14.17 5PTI 818
834 ATOM 748 1HB LYS 46 26.587 17.609 5.990 1.00 17.47 5PTI 819
835 ATOM 749 2HB LYS 46 25.404 16.946 7.222 1.00 17.90 5PTI 820
836 ATOM 750 1HG LYS 46 27.027 15.200 7.891 1.00 20.31 5PTI 821
837 ATOM 751 2HG LYS 46 28.203 15.916 6.737 1.00 20.28 5PTI 822
838 ATOM 752 1HD LYS 46 28.122 17.991 7.798 1.00 22.17 5PTI 823
839 ATOM 753 2HD LYS 46 27.135 17.420 9.101 1.00 22.77 5PTI 824
840 ATOM 754 1HE LYS 46 29.175 15.510 8.907 1.00 24.93 5PTI 825
841 ATOM 755 2HE LYS 46 29.805 16.640 7.728 1.00 25.66 5PTI 826
842 ATOM 756 1DZ LYS 46 29.318 17.242 10.520 1.00 26.85 5PTI 827
843 ATOM 757 2DZ LYS 46 30.949 17.000 9.856 1.00 27.02 5PTI 828
844 ATOM 758 3DZ LYS 46 30.127 18.313 9.416 1.00 27.47 5PTI 829
845 ATOM 759 N SER 47 24.337 16.734 3.622 1.00 15.47 5PTI 830
846 ATOM 760 CA SER 47 23.068 17.191 3.061 1.00 15.09 5PTI 831
847 ATOM 761 C SER 47 22.980 16.742 1.594 1.00 14.56 5PTI 832
848 ATOM 762 O SER 47 24.015 16.567 0.916 1.00 13.03 5PTI 833
849 ATOM 763 CB SER 47 22.880 18.711 3.060 1.00 15.63 5PTI 834
850 ATOM 764 OG SER 47 23.822 19.258 2.193 1.00 16.91 5PTI 835
851 ATOM 765 D SER 47 25.180 16.751 3.053 1.00 15.56 5PTI 836
852 ATOM 766 HA SER 47 22.206 16.804 3.574 1.00 15.83 5PTI 837
853 ATOM 767 1HB SER 47 21.900 18.919 2.598 1.00 16.01 5PTI 838
854 ATOM 768 2HB SER 47 22.965 19.264 4.004 1.00 15.86 5PTI 839
855 ATOM 769 DG SER 47 24.248 20.035 2.505 1.00 19.57 5PTI 840
856 ATOM 770 N ALA 48 21.747 16.565 1.233 1.00 14.50 5PTI 841
857 ATOM 771 CA ALA 48 21.452 16.202 -0.192 1.00 15.49 5PTI 842
858 ATOM 772 C ALA 48 21.889 17.264 -1.204 1.00 14.13 5PTI 843
859 ATOM 773 O ALA 48 22.320 16.959 -2.338 1.00 13.28 5PTI 844
860 ATOM 774 CB ALA 48 19.991 15.849 -0.356 1.00 16.34 5PTI 845
861 ATOM 775 D ALA 48 20.954 16.674 1.802 1.00 15.14 5PTI 846
862 ATOM 776 HA ALA 48 22.244 15.481 -0.310 1.00 14.31 5PTI 847
863 ATOM 777 1HB ALA 48 19.319 16.642 -0.038 1.00 15.97 5PTI 848
864 ATOM 778 2HB ALA 48 19.800 15.524 -1.385 1.00 16.04 5PTI 849
865 ATOM 779 3HB ALA 48 19.794 14.988 0.281 1.00 16.24 5PTI 850
866 ATOM 780 N GLU 49 21.835 18.530 -0.819 1.00 14.30 5PTI 851
867 ATOM 781 CA GLU 49 22.235 19.620 -1.652 1.00 16.73 5PTI 852
868 ATOM 782 C GLU 49 23.740 19.554 -1.891 1.00 14.46 5PTI 853
869 ATOM 783 O GLU 49 24.137 19.730 -3.053 1.00 14.56 5PTI 854
870 ATOM 784 CB GLU 49 21.766 20.869 -0.865 1.00 21.56 5PTI 855
871 ATOM 785 CG GLU 49 20.367 20.737 -0.179 1.00 26.75 5PTI 856
872 ATOM 786 CD GLU 49 19.919 19.894 0.994 1.00 29.54 5PTI 857
873 ATOM 787 OE1 GLU 49 19.414 18.784 1.212 1.00 32.40 5PTI 858
874 ATOM 788 OE2 GLU 49 19.912 20.253 2.202 1.00 34.26 5PTI 859
875 ATOM 789 D GLU 49 21.514 18.770 0.081 1.00 15.94 5PTI 860
876 ATOM 790 HA GLU 49 21.885 19.789 -2.644 1.00 17.10 5PTI 861
877 ATOM 791 1HB GLU 49 22.360 20.677 0.079 1.00 21.05 5PTI 862
878 ATOM 792 2HB GLU 49 22.360 21.702 -1.159 1.00 21.64 5PTI 863
879 ATOM 793 1HG GLU 49 20.001 21.722 0.047 1.00 26.97 5PTI 864
880 ATOM 794 2HG GLU 49 19.803 20.281 -0.976 1.00 26.35 5PTI 865
881 ATOM 796 N ASP 50 24.537 19.331 -0.858 1.00 14.10 5PTI 866
882 ATOM 797 CA ASP 50 25.961 19.288 -1.082 1.00 13.93 5PTI 867
883 ATOM 798 C ASP 50 26.280 18.071 -1.961 1.00 11.78 5PTI 868
884 ATOM 799 O ASP 50 27.149 18.165 -2.795 1.00 12.10 5PTI 869
885 ATOM 800 CB ASP 50 26.695 18.778 0.111 1.00 18.61 5PTI 870
886 ATOM 801 CG ASP 50 27.499 19.674 0.972 1.00 25.48 5PTI 871
887 ATOM 802 OD1 ASP 50 26.759 20.572 1.375 1.00 29.01 5PTI 872
888 ATOM 803 OD2 ASP 50 28.655 19.195 1.020 1.00 27.88 5PTI 873
889 ATOM 804 D ASP 50 24.173 19.185 0.045 1.00 14.90 5PTI 874
890 ATOM 805 HA ASP 50 26.388 20.193 -1.435 1.00 14.65 5PTI 875
891 ATOM 806 1HB ASP 50 26.126 18.142 0.783 1.00 18.57 5PTI 876
892 ATOM 807 2HB ASP 50 27.390 17.949 -0.167 1.00 19.69 5PTI 877
893 ATOM 809 N CYS 51 25.605 16.956 -1.732 1.00 10.22 5PTI 878
894 ATOM 810 CA CYS 51 25.822 15.753 -2.493 1.00 10.57 5PTI 879
895 ATOM 811 C CYS 51 25.591 15.998 -3.994 1.00 11.23 5PTI 880
896 ATOM 812 O CYS 51 26.397 15.689 -4.871 1.00 11.33 5PTI 881
897 ATOM 813 CB CYS 51 24.941 14.644 -1.926 1.00 9.71 5PTI 882
898 ATOM 814 SG CYS 51 25.055 13.060 -2.815 1.00 10.82 5PTI 883
899 ATOM 815 D CYS 51 24.881 16.926 -1.041 1.00 11.98 5PTI 884
900 ATOM 816 HA CYS 51 26.840 15.447 -2.313 1.00 9.86 5PTI 885
901 ATOM 817 1HB CYS 51 25.207 14.370 -0.935 1.00 9.50 5PTI 886
902 ATOM 818 2HB CYS 51 23.907 14.950 -1.834 1.00 10.27 5PTI 887
903 ATOM 820 N MET 52 24.405 16.565 -4.212 1.00 12.19 1 5PTI 888
904 ATOM 821 CA MET 52 23.975 16.860 -5.592 1.00 15.04 1 5PTI 889
905 ATOM 822 C MET 52 24.865 17.909 -6.259 1.00 15.23 1 5PTI 890
906 ATOM 823 O MET 52 25.254 17.714 -7.432 1.00 16.42 1 5PTI 891
907 ATOM 824 CB MET 52 22.481 17.237 -5.692 1.00 16.60 1 5PTI 892
908 ATOM 825 CG AMET 52 21.619 16.002 -5.527 0.65 16.58 1 5PTI 893
909 ATOM 826 CG BMET 52 21.536 16.149 -5.278 0.35 19.07 1 5PTI 894
910 ATOM 827 SD AMET 52 21.684 14.673 -6.752 0.65 17.21 1 5PTI 895
911 ATOM 828 SD BMET 52 19.845 16.563 -5.694 0.35 21.60 1 5PTI 896
912 ATOM 829 CE AMET 52 20.896 15.481 -8.152 0.65 17.25 1 5PTI 897
913 ATOM 830 CE BMET 52 19.639 18.241 -5.038 0.35 20.98 1 5PTI 898
914 ATOM 831 D MET 52 23.741 16.776 -3.521 1.00 11.71 1 5PTI 899
915 ATOM 832 HA MET 52 24.027 15.986 -6.232 1.00 14.64 1 5PTI 900
916 ATOM 833 1HB MET 52 22.275 18.123 -5.117 1.00 16.08 1 5PTI 901
917 ATOM 834 2HB MET 52 22.460 17.461 -6.770 1.00 15.52 1 5PTI 902
918 ATOM 835 1HG AMET 52 22.023 15.418 -4.676 0.65 16.82 1 5PTI 903
919 ATOM 836 1HG BMET 52 21.648 15.214 -5.841 0.35 19.25 1 5PTI 904
920 ATOM 837 2HG AMET 52 20.574 16.201 -5.322 0.65 16.79 1 5PTI 905
921 ATOM 838 2HG BMET 52 21.552 15.928 -4.213 0.35 19.04 1 5PTI 906
922 ATOM 839 1HE AMET 52 21.506 16.358 -8.341 0.65 17.36 1 5PTI 907
923 ATOM 840 1HE BMET 52 20.257 18.263 -4.174 0.35 20.84 1 5PTI 908
924 ATOM 841 2HE AMET 52 21.243 14.908 -9.046 0.65 16.78 1 5PTI 909
925 ATOM 842 2HE BMET 52 20.012 18.845 -5.860 0.35 20.71 1 5PTI 910
926 ATOM 843 3HE AMET 52 19.853 15.441 -8.108 0.65 17.36 1 5PTI 911
927 ATOM 844 3HE BMET 52 18.576 18.325 -4.893 0.35 20.87 1 5PTI 912
928 ATOM 845 N ARG 53 25.206 18.931 -5.556 1.00 17.25 5PTI 913
929 ATOM 846 CA ARG 53 26.111 19.970 -6.044 1.00 19.58 5PTI 914
930 ATOM 847 C ARG 53 27.493 19.419 -6.400 1.00 19.14 5PTI 915
931 ATOM 848 O ARG 53 28.105 19.894 -7.379 1.00 18.79 5PTI 916
932 ATOM 849 CB ARG 53 26.365 20.989 -4.925 1.00 21.70 5PTI 917
933 ATOM 850 CG ARG 53 27.106 22.225 -5.375 1.00 24.59 5PTI 918
934 ATOM 851 CD ARG 53 26.494 23.431 -4.716 1.00 26.49 5PTI 919
935 ATOM 852 NE ARG 53 26.503 23.143 -3.308 1.00 30.03 5PTI 920
936 ATOM 853 CZ ARG 53 25.536 23.635 -2.543 1.00 30.47 5PTI 921
937 ATOM 854 NH1 ARG 53 24.554 24.368 -3.034 1.00 31.82 5PTI 922
938 ATOM 855 NH2 ARG 53 25.533 23.348 -1.271 1.00 30.70 5PTI 923
939 ATOM 856 D ARG 53 24.877 19.095 -4.635 1.00 17.26 5PTI 924
940 ATOM 857 HA ARG 53 25.631 20.419 -6.896 1.00 19.36 5PTI 925
941 ATOM 858 1HB ARG 53 25.336 21.264 -4.675 1.00 21.99 5PTI 926
942 ATOM 859 2HB ARG 53 26.827 20.450 -4.106 1.00 22.43 5PTI 927
943 ATOM 860 1HG ARG 53 28.119 22.368 -5.525 1.00 24.05 5PTI 928
944 ATOM 861 2HG ARG 53 26.672 22.362 -6.390 1.00 23.86 5PTI 929
945 ATOM 862 1HD ARG 53 27.053 24.242 -5.072 1.00 27.41 5PTI 930
946 ATOM 863 2HD ARG 53 25.499 23.574 -5.080 1.00 27.53 5PTI 931
947 ATOM 864 DE ARG 53 27.225 22.565 -2.844 1.00 30.30 5PTI 932
948 ATOM 865 1DH1 ARG 53 23.854 24.661 -2.321 1.00 30.67 5PTI 933
949 ATOM 866 2DH1 ARG 53 24.517 24.609 -4.036 1.00 30.96 5PTI 934
950 ATOM 867 1DH2 ARG 53 26.264 22.781 -0.865 1.00 31.15 5PTI 935
951 ATOM 868 2DH2 ARG 53 24.762 23.749 -0.724 1.00 31.05 5PTI 936
952 ATOM 869 N THR 54 28.014 18.446 -5.647 1.00 16.27 5PTI 937
953 ATOM 870 CA THR 54 29.317 17.889 -5.933 1.00 15.50 5PTI 938
954 ATOM 871 C THR 54 29.360 16.811 -7.019 1.00 14.44 5PTI 939
955 ATOM 872 O THR 54 30.323 16.753 -7.836 1.00 14.74 5PTI 940
956 ATOM 873 CB THR 54 29.884 17.308 -4.599 1.00 16.69 5PTI 941
957 ATOM 874 OG1 THR 54 29.915 18.356 -3.628 1.00 17.09 5PTI 942
958 ATOM 875 CG2 THR 54 31.252 16.617 -4.794 1.00 16.12 5PTI 943
959 ATOM 876 D THR 54 27.440 18.111 -4.892 1.00 18.36 5PTI 944
960 ATOM 877 HA THR 54 30.069 18.613 -6.258 1.00 15.14 5PTI 945
961 ATOM 878 HB THR 54 29.173 16.550 -4.194 1.00 16.74 5PTI 946
962 ATOM 879 DG1 THR 54 29.012 18.597 -3.318 1.00 16.70 5PTI 947
963 ATOM 880 1HG2 THR 54 31.801 17.152 -5.610 1.00 17.37 5PTI 948
964 ATOM 881 2HG2 THR 54 31.759 16.514 -3.853 1.00 17.09 5PTI 949
965 ATOM 882 3HG2 THR 54 31.026 15.693 -5.309 1.00 17.52 5PTI 950
966 ATOM 883 N CYS 55 28.364 15.919 -6.980 1.00 12.64 5PTI 951
967 ATOM 884 CA CYS 55 28.337 14.779 -7.839 1.00 14.57 5PTI 952
968 ATOM 885 C CYS 55 27.258 14.663 -8.899 1.00 16.68 5PTI 953
969 ATOM 886 O CYS 55 27.484 13.831 -9.733 1.00 17.00 5PTI 954
970 ATOM 887 CB CYS 55 28.265 13.520 -6.968 1.00 13.88 5PTI 955
971 ATOM 888 SG CYS 55 29.664 13.161 -5.893 1.00 13.03 5PTI 956
972 ATOM 889 D CYS 55 27.614 15.974 -6.323 1.00 14.99 5PTI 957
973 ATOM 890 HA CYS 55 29.253 14.775 -8.417 1.00 14.34 5PTI 958
974 ATOM 891 1HB CYS 55 27.388 13.519 -6.349 1.00 13.38 5PTI 959
975 ATOM 892 2HB CYS 55 28.059 12.720 -7.695 1.00 13.88 5PTI 960
976 ATOM 894 N GLY 56 26.248 15.435 -8.766 1.00 22.23 5PTI 961
977 ATOM 895 CA GLY 56 25.221 15.180 -9.791 1.00 26.06 5PTI 962
978 ATOM 896 C GLY 56 25.286 15.905 -11.139 1.00 29.57 5PTI 963
979 ATOM 897 O GLY 56 26.220 16.540 -11.584 1.00 31.26 5PTI 964
980 ATOM 898 D GLY 56 26.124 16.072 -8.024 1.00 18.76 5PTI 965
981 ATOM 899 1HA GLY 56 25.526 14.160 -10.093 1.00 25.90 5PTI 966
982 ATOM 900 2HA GLY 56 24.206 15.027 -9.457 1.00 26.16 5PTI 967
983 ATOM 901 N GLY 57 24.141 15.735 -11.766 1.00 36.75 5PTI 968
984 ATOM 902 CA GLY 57 23.532 16.179 -13.038 1.00 40.04 5PTI 969
985 ATOM 903 C GLY 57 21.982 15.948 -12.990 1.00 43.19 5PTI 970
986 ATOM 904 O GLY 57 21.139 16.112 -12.036 1.00 44.36 5PTI 971
987 ATOM 905 D GLY 57 23.416 15.164 -11.269 1.00 32.31 5PTI 972
988 ATOM 906 1HA GLY 57 23.651 17.180 -13.336 1.00 40.07 5PTI 973
989 ATOM 907 2HA GLY 57 23.890 15.539 -13.849 1.00 40.01 5PTI 974
990 ATOM 908 N ALA 58 21.533 15.450 -14.175 1.00 46.32 5PTI 975
991 ATOM 909 CA ALA 58 20.058 15.148 -14.143 1.00 46.11 5PTI 976
992 ATOM 910 C ALA 58 20.005 13.727 -14.727 1.00 47.14 5PTI 977
993 ATOM 911 O ALA 58 20.352 13.531 -15.922 1.00 47.19 5PTI 978
994 ATOM 912 CB ALA 58 19.337 16.385 -14.585 1.00 45.68 5PTI 979
995 ATOM 913 OXT ALA 58 19.665 12.821 -13.923 1.00 48.98 5PTI 980
996 ATOM 914 D ALA 58 22.084 15.237 -14.992 1.00 44.06 5PTI 981
997 ATOM 915 HA ALA 58 19.960 14.987 -13.050 1.00 46.35 5PTI 982
998 ATOM 916 1HB ALA 58 19.978 17.245 -14.640 1.00 46.47 5PTI 983
999 ATOM 917 2HB ALA 58 18.939 16.200 -15.586 1.00 46.26 5PTI 984
1000 ATOM 918 3HB ALA 58 18.454 16.576 -13.973 1.00 46.28 5PTI 985
1001 TER 919 ALA 58 5PTI 986
1002 HETATM 920 P PO4 70 32.672 12.772 10.325 0.65 25.52 5PTI 987
1003 HETATM 921 O1 PO4 70 33.530 14.005 10.556 0.65 26.69 5PTI 988
1004 HETATM 922 O2 PO4 70 31.499 12.810 11.272 0.65 25.31 5PTI 989
1005 HETATM 923 O3 PO4 70 32.136 12.729 8.909 0.65 24.51 5PTI 990
1006 HETATM 924 O4 PO4 70 33.561 11.570 10.555 0.65 23.64 5PTI 991
1007 HETATM 925 UNK UNK 324 23.599 13.195 -7.043 1.00 45.42 2 5PTI 992
1008 HETATM 926 O DOD 80 23.194 15.839 8.222 0.40 22.37 5PTI 993
1009 HETATM 927 D1 DOD 80 23.286 16.842 8.165 0.40 22.61 5PTI 994
1010 HETATM 928 D2 DOD 80 24.153 15.561 8.326 0.40 22.60 5PTI 995
1011 HETATM 929 O DOD 101 22.510 21.082 -4.729 1.00 36.16 5PTI 996
1012 HETATM 930 D1 DOD 101 21.831 21.235 -5.370 1.00 35.79 5PTI 997
1013 HETATM 931 D2 DOD 101 23.104 20.367 -4.949 1.00 35.47 5PTI 998
1014 HETATM 932 O DOD 102 32.400 2.989 17.428 0.80 18.44 5PTI 999
1015 HETATM 933 D1 DOD 102 33.257 2.902 16.959 0.80 19.80 5PTI1000
1016 HETATM 934 D2 DOD 102 32.345 2.270 18.071 0.80 19.39 5PTI1001
1017 HETATM 935 O DOD 105 32.325 18.662 -7.849 1.00 32.19 5PTI1002
1018 HETATM 936 D1 DOD 105 31.835 17.834 -8.008 1.00 30.47 5PTI1003
1019 HETATM 937 D2 DOD 105 31.833 19.268 -8.402 1.00 30.09 5PTI1004
1020 HETATM 938 O DOD 110 37.328 8.721 -0.765 0.85 24.80 5PTI1005
1021 HETATM 939 D1 DOD 110 37.884 7.962 -0.994 0.85 28.72 5PTI1006
1022 HETATM 940 D2 DOD 110 36.474 8.348 -1.051 0.85 28.38 5PTI1007
1023 HETATM 941 O DOD 111 32.894 6.077 -0.473 1.00 17.11 5PTI1008
1024 HETATM 942 D1 DOD 111 33.120 6.673 -1.189 1.00 17.18 5PTI1009
1025 HETATM 943 D2 DOD 111 32.082 5.642 -0.714 1.00 18.37 5PTI1010
1026 HETATM 944 O DOD 112 31.242 6.845 1.776 1.00 12.53 5PTI1011
1027 HETATM 945 D1 DOD 112 31.797 6.338 1.211 1.00 12.31 5PTI1012
1028 HETATM 946 D2 DOD 112 30.886 7.631 1.374 1.00 11.82 5PTI1013
1029 HETATM 947 O DOD 113 32.081 7.266 4.248 1.00 10.62 5PTI1014
1030 HETATM 948 D1 DOD 113 31.885 7.136 3.273 1.00 10.81 5PTI1015
1031 HETATM 949 D2 DOD 113 31.780 6.400 4.490 1.00 10.32 5PTI1016
1032 HETATM 950 O DOD 116 21.627 2.820 1.964 0.45 18.18 5PTI1017
1033 HETATM 951 D1 DOD 116 22.311 2.168 1.795 0.45 15.16 5PTI1018
1034 HETATM 952 D2 DOD 116 21.898 3.682 1.661 0.45 13.72 5PTI1019
1035 HETATM 953 O DOD 117 23.450 1.914 4.826 0.85 21.21 5PTI1020
1036 HETATM 954 D1 DOD 117 24.325 1.628 5.014 0.85 18.34 5PTI1021
1037 HETATM 955 D2 DOD 117 22.978 2.382 5.498 0.85 16.27 5PTI1022
1038 HETATM 956 O DOD 119 24.933 8.699 -12.566 1.00 26.51 5PTI1023
1039 HETATM 957 D1 DOD 119 25.519 9.416 -12.334 1.00 24.40 5PTI1024
1040 HETATM 958 D2 DOD 119 25.041 7.808 -12.205 1.00 23.04 5PTI1025
1041 HETATM 959 O DOD 121 27.178 1.079 11.930 1.00 44.15 5PTI1026
1042 HETATM 960 D1 DOD 121 27.529 1.514 12.731 1.00 41.94 5PTI1027
1043 HETATM 961 D2 DOD 121 27.890 1.374 11.346 1.00 42.42 5PTI1028
1044 HETATM 962 O DOD 122 32.824 4.006 10.705 1.00 11.08 5PTI1029
1045 HETATM 963 D1 DOD 122 32.037 4.312 10.212 1.00 14.93 5PTI1030
1046 HETATM 964 D2 DOD 122 33.527 4.614 10.375 1.00 12.63 5PTI1031
1047 HETATM 965 O DOD 125 23.228 10.145 14.693 1.00 37.43 5PTI1032
1048 HETATM 966 D1 DOD 125 23.474 11.090 14.612 1.00 38.73 5PTI1033
1049 HETATM 967 D2 DOD 125 23.557 9.618 15.413 1.00 38.14 5PTI1034
1050 HETATM 968 O DOD 126 21.709 13.163 -11.285 1.00 45.53 5PTI1035
1051 HETATM 969 D1 DOD 126 21.371 12.655 -10.542 1.00 40.21 5PTI1036
1052 HETATM 970 D2 DOD 126 22.643 12.914 -11.319 1.00 40.01 5PTI1037
1053 HETATM 971 O DOD 127 25.304 13.841 10.064 1.00 31.39 5PTI1038
1054 HETATM 972 D1 DOD 127 24.713 13.795 9.294 1.00 29.74 5PTI1039
1055 HETATM 973 D2 DOD 127 24.901 13.162 10.650 1.00 30.13 5PTI1040
1056 HETATM 974 O DOD 129 21.978 10.502 12.070 1.00 22.99 5PTI1041
1057 HETATM 975 D1 DOD 129 21.026 10.401 12.238 1.00 21.72 5PTI1042
1058 HETATM 976 D2 DOD 129 22.220 11.424 12.257 1.00 22.25 5PTI1043
1059 HETATM 977 O DOD 133 37.476 9.724 11.502 0.75 22.01 5PTI1044
1060 HETATM 978 D1 DOD 133 37.584 9.982 12.425 0.75 19.51 5PTI1045
1061 HETATM 979 D2 DOD 133 36.539 9.976 11.345 0.75 19.51 5PTI1046
1062 HETATM 980 O DOD 134 34.490 11.060 -13.079 0.70 44.32 5PTI1047
1063 HETATM 981 D1 DOD 134 34.746 11.987 -12.978 0.70 42.77 5PTI1048
1064 HETATM 982 D2 DOD 134 33.653 10.980 -12.612 0.70 42.52 5PTI1049
1065 HETATM 983 O DOD 138 28.177 17.517 3.360 1.00 25.45 5PTI1050
1066 HETATM 984 D1 DOD 138 27.742 18.283 3.058 1.00 23.32 5PTI1051
1067 HETATM 985 D2 DOD 138 29.101 17.401 3.251 1.00 23.72 5PTI1052
1068 HETATM 986 O DOD 140 30.541 15.267 12.774 1.00 36.43 5PTI1053
1069 HETATM 987 D1 DOD 140 29.677 15.607 12.991 1.00 36.77 5PTI1054
1070 HETATM 988 D2 DOD 140 31.088 15.976 12.426 1.00 36.78 5PTI1055
1071 HETATM 989 O DOD 143 28.284 5.454 -6.397 1.00 27.22 5PTI1056
1072 HETATM 990 D1 DOD 143 28.234 4.659 -5.833 1.00 32.37 5PTI1057
1073 HETATM 991 D2 DOD 143 27.991 6.122 -5.773 1.00 31.67 5PTI1058
1074 HETATM 992 O DOD 144 17.474 21.217 4.158 1.00 42.30 5PTI1059
1075 HETATM 993 D1 DOD 144 18.268 20.904 3.726 1.00 40.47 5PTI1060
1076 HETATM 994 D2 DOD 144 16.993 21.816 3.609 1.00 40.56 5PTI1061
1077 HETATM 995 O DOD 145 38.592 14.977 -3.873 1.00 29.91 5PTI1062
1078 HETATM 996 D1 DOD 145 37.993 15.743 -3.880 1.00 31.95 5PTI1063
1079 HETATM 997 D2 DOD 145 38.520 14.611 -4.764 1.00 33.00 5PTI1064
1080 HETATM 998 O DOD 146 39.369 6.894 -8.744 1.00 41.67 5PTI1065
1081 HETATM 999 D1 DOD 146 39.454 6.652 -9.672 1.00 36.52 5PTI1066
1082 HETATM 1000 D2 DOD 146 40.233 6.697 -8.383 1.00 37.22 5PTI1067
1083 HETATM 1001 O DOD 156 30.562 -0.831 11.569 0.85 29.85 5PTI1068
1084 HETATM 1002 D1 DOD 156 30.253 0.047 11.849 0.85 31.06 5PTI1069
1085 HETATM 1003 D2 DOD 156 30.819 -0.652 10.650 0.85 30.89 5PTI1070
1086 HETATM 1004 O DOD 157 35.840 10.917 9.802 1.00 23.72 5PTI1071
1087 HETATM 1005 D1 DOD 157 35.118 11.562 9.768 1.00 25.45 5PTI1072
1088 HETATM 1006 D2 DOD 157 36.435 11.166 9.095 1.00 25.05 5PTI1073
1089 HETATM 1007 O DOD 158 32.417 -0.400 5.440 0.50 21.01 5PTI1074
1090 HETATM 1008 D1 DOD 158 33.309 -0.402 5.914 0.50 20.94 5PTI1075
1091 HETATM 1009 D2 DOD 158 31.836 -0.783 6.158 0.50 20.72 5PTI1076
1092 HETATM 1010 O DOD 159 30.427 -0.255 3.808 0.50 26.42 5PTI1077
1093 HETATM 1011 D1 DOD 159 30.982 -0.258 2.963 0.50 26.94 5PTI1078
1094 HETATM 1012 D2 DOD 159 31.146 -0.594 4.435 0.50 26.51 5PTI1079
1095 HETATM 1013 O DOD 160 36.062 5.979 -8.634 1.00 41.31 5PTI1080
1096 HETATM 1014 D1 DOD 160 35.305 6.506 -8.327 1.00 40.68 5PTI1081
1097 HETATM 1015 D2 DOD 160 36.596 5.892 -7.843 1.00 40.44 5PTI1082
1098 HETATM 1016 O DOD 200 19.702 17.251 3.159 1.00 19.29 5PTI1083
1099 HETATM 1017 D1 DOD 200 18.842 16.821 3.395 1.00 20.94 5PTI1084
1100 HETATM 1018 D2 DOD 200 20.251 16.690 3.724 1.00 21.48 5PTI1085
1101 HETATM 1019 O DOD 201 38.290 5.419 5.139 0.45 14.23 5PTI1086
1102 HETATM 1020 D1 DOD 201 38.695 6.270 5.301 0.45 11.92 5PTI1087
1103 HETATM 1021 D2 DOD 201 38.934 4.728 5.353 0.45 12.39 5PTI1088
1104 HETATM 1022 O DOD 202 20.841 18.058 5.892 1.00 42.73 5PTI1089
1105 HETATM 1023 D1 DOD 202 20.670 18.727 5.224 1.00 41.57 5PTI1090
1106 HETATM 1024 D2 DOD 202 20.910 17.173 5.525 1.00 41.34 5PTI1091
1107 HETATM 1025 O DOD 203 35.858 -1.262 7.228 1.00 26.79 5PTI1092
1108 HETATM 1026 D1 DOD 203 36.279 -0.389 7.191 1.00 24.31 5PTI1093
1109 HETATM 1027 D2 DOD 203 36.182 -1.468 8.110 1.00 25.43 5PTI1094
1110 HETATM 1028 O DOD 204 39.380 8.361 4.115 0.70 28.37 5PTI1095
1111 HETATM 1029 D1 DOD 204 39.408 7.760 3.358 0.70 29.87 5PTI1096
1112 HETATM 1030 D2 DOD 204 38.462 8.655 4.217 0.70 30.08 5PTI1097
1113 HETATM 1031 O DOD 205 19.638 4.554 4.804 1.00 41.42 5PTI1098
1114 HETATM 1032 D1 DOD 205 18.798 4.746 4.362 1.00 41.56 5PTI1099
1115 HETATM 1033 D2 DOD 205 19.565 3.636 5.102 1.00 41.35 5PTI1100
1116 HETATM 1034 O DOD 209 27.016 14.177 11.548 0.55 23.66 5PTI1101
1117 HETATM 1035 D1 DOD 209 26.247 13.668 11.322 0.55 23.22 5PTI1102
1118 HETATM 1036 D2 DOD 209 27.150 14.829 10.861 0.55 23.19 5PTI1103
1119 HETATM 1037 O DOD 210 32.524 1.944 -8.668 0.55 28.00 5PTI1104
1120 HETATM 1038 D1 DOD 210 32.097 1.168 -8.326 0.55 24.83 5PTI1105
1121 HETATM 1039 D2 DOD 210 33.318 2.192 -8.183 0.55 24.43 5PTI1106
1122 HETATM 1040 O DOD 211 30.420 20.407 -9.327 1.00 50.37 5PTI1107
1123 HETATM 1041 D1 DOD 211 30.380 19.438 -9.416 1.00 50.49 5PTI1108
1124 HETATM 1042 D2 DOD 211 29.504 20.587 -9.585 1.00 50.62 5PTI1109
1125 HETATM 1043 O DOD 212 38.417 11.372 -7.271 1.00 37.18 5PTI1110
1126 HETATM 1044 D1 DOD 212 38.648 12.325 -7.203 1.00 35.24 5PTI1111
1127 HETATM 1045 D2 DOD 212 39.030 10.978 -6.635 1.00 35.81 5PTI1112
1128 HETATM 1046 O DOD 214 15.928 7.068 -4.160 0.80 33.49 5PTI1113
1129 HETATM 1047 D1 DOD 214 15.833 6.849 -5.089 0.80 30.73 5PTI1114
1130 HETATM 1048 D2 DOD 214 15.838 7.998 -3.965 0.80 30.42 5PTI1115
1131 HETATM 1049 O DOD 216 20.369 6.458 13.462 0.75 29.01 5PTI1116
1132 HETATM 1050 D1 DOD 216 20.426 6.571 14.416 0.75 29.73 5PTI1117
1133 HETATM 1051 D2 DOD 216 21.310 6.715 13.308 0.75 30.07 5PTI1118
1134 HETATM 1052 O DOD 217 20.372 9.135 14.450 1.00 45.82 5PTI1119
1135 HETATM 1053 D1 DOD 217 20.014 9.262 13.565 1.00 47.54 5PTI1120
1136 HETATM 1054 D2 DOD 217 20.713 8.233 14.501 1.00 46.99 5PTI1121
1137 HETATM 1055 O DOD 218 34.848 -2.506 13.144 0.60 23.45 5PTI1122
1138 HETATM 1056 D1 DOD 218 35.761 -2.257 13.315 0.60 24.59 5PTI1123
1139 HETATM 1057 D2 DOD 218 34.364 -1.952 13.777 0.60 23.86 5PTI1124
1140 HETATM 1058 O DOD 219 18.689 3.099 -6.988 0.65 32.86 5PTI1125
1141 HETATM 1059 D1 DOD 219 18.183 2.627 -6.333 0.65 31.27 5PTI1126
1142 HETATM 1060 D2 DOD 219 19.292 2.483 -7.421 0.65 31.44 5PTI1127
1143 HETATM 1061 O DOD 220 34.306 13.635 6.574 0.70 44.72 5PTI1128
1144 HETATM 1062 D1 DOD 220 34.435 13.156 7.403 0.70 43.71 5PTI1129
1145 HETATM 1063 D2 DOD 220 33.907 14.473 6.837 0.70 43.25 5PTI1130
1146 HETATM 1064 O DOD 223 39.704 6.653 -0.920 0.70 27.12 5PTI1131
1147 HETATM 1065 D1 DOD 223 39.839 5.695 -0.886 0.70 27.44 5PTI1132
1148 HETATM 1066 D2 DOD 223 40.073 6.944 -0.069 0.70 26.30 5PTI1133
1149 HETATM 1067 O DOD 225 35.835 1.799 -4.168 0.70 22.62 5PTI1134
1150 HETATM 1068 D1 DOD 225 35.195 1.203 -4.651 0.70 21.80 5PTI1135
1151 HETATM 1069 D2 DOD 225 35.838 1.670 -3.184 0.70 22.59 5PTI1136
1152 HETATM 1070 O DOD 302 23.473 14.023 7.697 0.50 17.94 5PTI1137
1153 HETATM 1071 D1 DOD 302 23.104 13.994 6.796 0.50 18.22 5PTI1138
1154 HETATM 1072 D2 DOD 302 23.692 13.105 7.863 0.50 18.44 5PTI1139
1155 HETATM 1073 O DOD 304 17.425 18.515 0.940 0.60 20.11 5PTI1140
1156 HETATM 1074 D1 DOD 304 16.690 18.065 1.361 0.60 20.79 5PTI1141
1157 HETATM 1075 D2 DOD 304 18.107 18.630 1.602 0.60 21.21 5PTI1142
1158 HETATM 1076 O DOD 310 30.817 21.189 -4.297 0.75 33.44 5PTI1143
1159 HETATM 1077 D1 DOD 310 31.670 21.225 -4.770 0.75 33.45 5PTI1144
1160 HETATM 1078 D2 DOD 310 30.745 20.286 -3.971 0.75 33.90 5PTI1145
1161 HETATM 1079 O DOD 311 29.101 21.433 -2.694 0.75 39.78 5PTI1146
1162 HETATM 1080 D1 DOD 311 28.810 20.773 -3.335 0.75 40.82 5PTI1147
1163 HETATM 1081 D2 DOD 311 29.404 20.908 -1.940 0.75 41.00 5PTI1148
1164 HETATM 1082 O DOD 312 34.385 2.967 -0.675 0.75 49.17 5PTI1149
1165 HETATM 1083 D1 DOD 312 33.896 2.264 -0.231 0.75 49.99 5PTI1150
1166 HETATM 1084 D2 DOD 312 35.282 2.635 -0.820 0.75 50.11 5PTI1151
1167 HETATM 1085 O DOD 313 22.760 12.894 9.757 0.75 34.76 5PTI1152
1168 HETATM 1086 D1 DOD 313 23.725 12.886 9.820 0.75 32.32 5PTI1153
1169 HETATM 1087 D2 DOD 313 22.695 12.328 8.975 0.75 32.33 5PTI1154
1170 HETATM 1088 O DOD 314 29.184 16.951 -10.815 1.00 50.56 5PTI1155
1171 HETATM 1089 D1 DOD 314 28.486 16.392 -11.157 1.00 49.79 5PTI1156
1172 HETATM 1090 D2 DOD 314 29.843 17.006 -11.516 1.00 50.11 5PTI1157
1173 HETATM 1091 O DOD 315 37.208 17.290 -2.722 0.75 35.00 5PTI1158
1174 HETATM 1092 D1 DOD 315 36.748 17.851 -2.066 0.75 33.32 5PTI1159
1175 HETATM 1093 D2 DOD 315 37.034 16.398 -2.381 0.75 33.28 5PTI1160
1176 HETATM 1094 O DOD 316 39.924 5.096 15.153 0.75 91.84 5PTI1161
1177 HETATM 1095 D1 DOD 316 40.240 5.673 15.857 0.75 91.50 5PTI1162
1178 HETATM 1096 D2 DOD 316 39.075 4.751 15.456 0.75 91.50 5PTI1163
1179 HETATM 1097 O DOD 317 24.792 1.584 -6.585 1.00 53.91 5PTI1164
1180 HETATM 1098 D1 DOD 317 24.014 2.025 -6.941 1.00 52.72 5PTI1165
1181 HETATM 1099 D2 DOD 317 25.404 2.307 -6.419 1.00 53.49 5PTI1166
1182 HETATM 1100 O DOD 318 29.052 21.202 9.370 0.75 46.66 5PTI1167
1183 HETATM 1101 D1 DOD 318 28.463 20.601 9.828 0.75 44.03 5PTI1168
1184 HETATM 1102 D2 DOD 318 29.833 20.748 9.033 0.75 44.42 5PTI1169
1185 HETATM 1103 O DOD 319 31.855 0.163 0.605 0.75 42.28 5PTI1170
1186 HETATM 1104 D1 DOD 319 30.944 -0.153 0.702 0.75 40.63 5PTI1171
1187 HETATM 1105 D2 DOD 319 31.809 1.074 0.885 0.75 40.72 5PTI1172
1188 HETATM 1106 O DOD 320 17.490 9.671 -3.504 0.75 50.06 5PTI1173
1189 HETATM 1107 D1 DOD 320 17.844 10.566 -3.494 0.75 49.93 5PTI1174
1190 HETATM 1108 D2 DOD 320 16.796 9.717 -2.837 0.75 50.26 5PTI1175
1191 HETATM 1109 O DOD 321 23.571 -0.806 13.870 0.50 28.53 5PTI1176
1192 HETATM 1110 D1 DOD 321 24.067 -1.107 14.640 0.50 28.83 5PTI1177
1193 HETATM 1111 D2 DOD 321 23.508 -1.626 13.366 0.50 27.58 5PTI1178
1194 HETATM 1112 O DOD 322 30.284 21.588 -6.518 0.75 52.32 5PTI1179
1195 HETATM 1113 D1 DOD 322 30.165 22.574 -6.795 0.75 50.92 5PTI1180
1196 HETATM 1114 D2 DOD 322 29.362 21.275 -6.636 0.75 50.63 5PTI1181
1197 CONECT 79 78 888 5PTI1182
1198 CONECT 217 216 603 5PTI1183
1199 CONECT 490 489 814 5PTI1184
1200 CONECT 603 217 602 5PTI1185
1201 CONECT 814 490 813 5PTI1186
1202 CONECT 888 79 887 5PTI1187
1203 MASTER 46 7 2 2 3 0 0 6 1104 1 6 5 5PTIC 5
projects / unres.git / blob