1 HEADER PHOSPHOTRANSFERASE 04-OCT-93 1PTF 1PTF 2
2 COMPND HISTIDINE-CONTAINING PHOSPHOCARRIER PROTEIN (HPR) 1PTF 3
3 SOURCE (STREPTOCOCCUS FAECALIS, STRAIN HPR) 1PTF 4
4 AUTHOR Z.JIA,W.QUAIL,L.DELBAERE 1PTF 5
5 REVDAT 1 31-JAN-94 1PTF 0 1PTF 6
6 JRNL AUTH Z.JIA,M.VANDONSELAAR,W.HENGSTENBERG,J.W.QUAIL, 1PTF 7
7 JRNL AUTH 2 L.T.J.DELBAERE 1PTF 8
8 JRNL TITL THE 1.6 ANGSTROMS STRUCTURE OF 1PTF 9
9 JRNL TITL 2 HISTIDINE-CONTAINING PHOSPHOTRANSFER PROTEIN HPR 1PTF 10
10 JRNL TITL 3 FROM STREPTOCOCCUS FAECALIS 1PTF 11
11 JRNL REF TO BE PUBLISHED 1PTF 12
14 REMARK 1 REFERENCE 1 1PTF 15
15 REMARK 1 AUTH Z.JIA,M.VANDONSELAAR,J.W.QUAIL,L.T.J.DELBAERE 1PTF 16
16 REMARK 1 TITL ACTIVE-CENTRE TORSION-ANGLE STRAIN REVEALED IN 1PTF 17
17 REMARK 1 TITL 2 THE 1.6 ANGSTROMS RESOLUTION STRUCTURE OF THE 1PTF 18
18 REMARK 1 TITL 3 HISTIDINE-CONTAINING PHOSPHOCARRIER PROTEIN HPR 1PTF 19
19 REMARK 1 REF NATURE V. 361 94 1993 1PTF 20
20 REMARK 1 REFN ASTM NATUAS UK ISSN 0028-0836 006 1PTF 21
22 REMARK 2 RESOLUTION. 1.6 ANGSTROMS. 1PTF 23
24 REMARK 3 REFINEMENT. 1PTF 25
25 REMARK 3 PROGRAM 1 X-PLOR 1PTF 26
26 REMARK 3 AUTHORS 1 BRUNGER 1PTF 27
27 REMARK 3 PROGRAM 2 PROLSQ 1PTF 28
28 REMARK 3 AUTHORS 2 KONNERT,HENDRICKSON 1PTF 29
29 REMARK 3 R VALUE 0.156 1PTF 30
30 REMARK 3 RMSD BOND DISTANCES 0.014 ANGSTROMS 1PTF 31
31 REMARK 3 RMSD BOND ANGLES 1.9 DEGREES 1PTF 32
33 REMARK 3 NUMBER OF REFLECTIONS 9481 1PTF 34
34 REMARK 3 RESOLUTION RANGE 8.0 - 1.6 ANGSTROMS 1PTF 35
35 REMARK 3 DATA CUTOFF 0.0 SIGMA(F) 1PTF 36
36 REMARK 3 PER CENT COMPLETION 95.0 1PTF 37
38 REMARK 3 NUMBER OF PROTEIN ATOMS 737 1PTF 39
39 REMARK 3 NUMBER OF SOLVENT ATOMS 100 1PTF 40
41 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES (THE VALUES OF 1PTF 42
42 REMARK 3 SIGMA, IN PARENTHESES, ARE THE INPUT ESTIMATED 1PTF 43
43 REMARK 3 STANDARD DEVIATIONS THAT DETERMINE THE RELATIVE 1PTF 44
44 REMARK 3 WEIGHTS OF THE CORRESPONDING RESTRAINTS) 1PTF 45
45 REMARK 3 DISTANCE RESTRAINTS (ANGSTROMS) 1PTF 46
46 REMARK 3 BOND DISTANCE 0.014(0.010) 1PTF 47
47 REMARK 3 ANGLE DISTANCE 0.035(0.020) 1PTF 48
48 REMARK 3 PLANAR 1-4 DISTANCE 0.047(0.020) 1PTF 49
49 REMARK 3 PLANE RESTRAINT (ANGSTROMS) 0.014(0.020) 1PTF 50
50 REMARK 3 CHIRAL-CENTER RESTRAINT (ANGSTROMS**3) 0.240(0.150) 1PTF 51
51 REMARK 3 NON-BONDED CONTACT RESTRAINTS (ANGSTROMS) 1PTF 52
52 REMARK 3 SINGLE TORSION CONTACT 0.175(0.500) 1PTF 53
53 REMARK 3 MULTIPLE TORSION CONTACT 0.213(0.500) 1PTF 54
54 REMARK 3 POSSIBLE HYDROGEN BOND 0.188(0.500) 1PTF 55
55 REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINT (DEGREES) 1PTF 56
56 REMARK 3 PLANAR 2.6(1.0) 1PTF 57
57 REMARK 3 STAGGERED 15.4(15.0) 1PTF 58
58 REMARK 3 ORTHONORMAL 24.2(20.0) 1PTF 59
59 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS (ANGSTROMS**2) 1PTF 60
60 REMARK 3 MAIN-CHAIN BOND 2.247(2.000) 1PTF 61
61 REMARK 3 MAIN-CHAIN ANGLE 3.104(3.000) 1PTF 62
62 REMARK 3 SIDE-CHAIN BOND 7.902(5.000) 1PTF 63
63 REMARK 3 SIDE-CHAIN ANGLE 11.883(7.000) 1PTF 64
65 REMARK 4 THE STREPTOCOCCUS FAECALIS HPR SEQUENCE HAS BEEN CORRECTED 1PTF 66
66 REMARK 4 TO HAVE 88 RESIDUES INSTEAD OF 89 RESIDUES (Z.JIA, 1PTF 67
67 REMARK 4 M.VANDONSELAAR,J.W.QUAIL,W.HENGSTENBERG,L.T.J.DELBAERE. 1PTF 68
68 REMARK 4 (1993) THE 1.6 ANGSTROMS RESOLUTION STRUCTURE OF 1PTF 69
69 REMARK 4 HISTIDINE-CONTAINING PHOSPHOCARRIER PROTEIN HPR FROM 1PTF 70
70 REMARK 4 STREPTOCOCCUS FAECALIS. JOURNAL OF MOLECULAR BIOLOGY, IN 1PTF 71
71 REMARK 4 PRESS). 1PTF 72
73 REMARK 5 IN THE CURRENT STRUCTURE, THE LAST RESIDUE (GLU 88) IS 1PTF 74
74 REMARK 5 MISSING DUE TO WEAK DENSITY. LYS 83 HAS BEEN BUILT AS ALA 1PTF 75
75 REMARK 5 INTO THE MODEL, DUE TO THE WEAK ELECTRON FOR THIS SIDE 1PTF 76
76 REMARK 5 CHAIN. ALA 16 HAS A HIGH-ENERGY CONFORMATION AS DISCUSSED 1PTF 77
77 REMARK 5 IN NATURE V. 361, 94 (1993). 1PTF 78
78 SEQRES 1 88 MET GLU LYS LYS GLU PHE HIS ILE VAL ALA GLU THR GLY 1PTF 79
79 SEQRES 2 88 ILE HIS ALA ARG PRO ALA THR LEU LEU VAL GLN THR ALA 1PTF 80
80 SEQRES 3 88 SER LYS PHE ASN SER ASP ILE ASN LEU GLU TYR LYS GLY 1PTF 81
81 SEQRES 4 88 LYS SER VAL ASN LEU LYS SER ILE MET GLY VAL MET SER 1PTF 82
82 SEQRES 5 88 LEU GLY VAL GLY GLN GLY SER ASP VAL THR ILE THR VAL 1PTF 83
83 SEQRES 6 88 ASP GLY ALA ASP GLU ALA GLU GLY MET ALA ALA ILE VAL 1PTF 84
84 SEQRES 7 88 GLU THR LEU GLN LYS GLU GLY LEU ALA GLU 1PTF 85
85 FORMUL 2 HOH *99(H2 O1) 1PTF 86
86 HELIX 1 A ALA 16 SER 27 1 1PTF 87
87 HELIX 2 B SER 46 SER 52 1 DISTORTED SHORT HELIX 1PTF 88
88 HELIX 3 C ASP 69 GLU 84 1 1PTF 89
89 SHEET 1 S1 4 GLU 2 ILE 8 0 1PTF 90
90 SHEET 2 S1 4 GLY 58 ASP 66 -1 N ILE 63 O LYS 4 1PTF 91
91 SHEET 3 S1 4 ASP 32 GLU 36 -1 N GLU 36 O THR 62 1PTF 92
92 SHEET 4 S1 4 LYS 40 LEU 44 -1 N VAL 42 O LEU 35 1PTF 93
93 TURN 1 T1 ALA 10 GLY 13 TYPE I 1PTF 94
94 TURN 2 T2 TYR 37 LYS 40 TYPE III' 1PTF 95
95 TURN 3 T3 ASN 43 SER 46 TYPE I 1PTF 96
96 TURN 4 T4 GLY 56 SER 59 TYPE II 1PTF 97
97 TURN 5 T5 GLY 67 GLU 70 TYPE I 1PTF 98
98 CRYST1 53.560 45.460 29.880 90.00 90.00 90.00 P 21 21 2 4 1PTF 99
99 ORIGX1 1.000000 0.000000 0.000000 0.00000 1PTF 100
100 ORIGX2 0.000000 1.000000 0.000000 0.00000 1PTF 101
101 ORIGX3 0.000000 0.000000 1.000000 0.00000 1PTF 102
102 SCALE1 0.018671 0.000000 0.000000 0.00000 1PTF 103
103 SCALE2 0.000000 0.021997 0.000000 0.00000 1PTF 104
104 SCALE3 0.000000 0.000000 0.033467 0.00000 1PTF 105
105 ATOM 1 N MET 1 -0.561 -16.653 8.467 1.00 14.99 1PTF 106
106 ATOM 2 CA MET 1 0.419 -15.666 8.975 1.00 17.05 1PTF 107
107 ATOM 3 C MET 1 1.634 -16.435 9.510 1.00 20.83 1PTF 108
108 ATOM 4 O MET 1 1.478 -17.497 10.151 1.00 17.97 1PTF 109
109 ATOM 5 CB MET 1 -0.257 -14.945 10.148 1.00 16.69 1PTF 110
110 ATOM 6 CG MET 1 0.724 -14.117 10.911 1.00 22.94 1PTF 111
111 ATOM 7 SD MET 1 -0.105 -13.398 12.359 1.00 29.20 1PTF 112
112 ATOM 8 CE MET 1 1.103 -13.699 13.650 1.00 39.30 1PTF 113
113 ATOM 9 N GLU 2 2.834 -15.969 9.195 1.00 16.22 1PTF 114
114 ATOM 10 CA GLU 2 4.085 -16.573 9.746 1.00 12.78 1PTF 115
115 ATOM 11 C GLU 2 4.849 -15.456 10.492 1.00 12.95 1PTF 116
116 ATOM 12 O GLU 2 4.878 -14.304 9.991 1.00 11.76 1PTF 117
117 ATOM 13 CB GLU 2 4.997 -16.907 8.532 1.00 15.63 1PTF 118
118 ATOM 14 CG GLU 2 4.332 -17.798 7.483 1.00 28.85 1PTF 119
119 ATOM 15 CD GLU 2 5.037 -19.117 7.299 1.00 35.26 1PTF 120
120 ATOM 16 OE1 GLU 2 6.143 -19.346 7.756 1.00 38.35 1PTF 121
121 ATOM 17 OE2 GLU 2 4.418 -19.914 6.565 1.00 35.62 1PTF 122
122 ATOM 18 N LYS 3 5.447 -15.826 11.597 1.00 11.30 1PTF 123
123 ATOM 19 CA LYS 3 6.253 -14.853 12.383 1.00 11.56 1PTF 124
124 ATOM 20 C LYS 3 7.574 -15.520 12.746 1.00 15.60 1PTF 125
125 ATOM 21 O LYS 3 7.627 -16.723 13.091 1.00 14.45 1PTF 126
126 ATOM 22 CB LYS 3 5.459 -14.486 13.617 1.00 15.12 1PTF 127
127 ATOM 23 CG LYS 3 6.231 -13.574 14.566 1.00 25.14 1PTF 128
128 ATOM 24 CD LYS 3 5.196 -12.983 15.523 1.00 43.69 1PTF 129
129 ATOM 25 CE LYS 3 5.608 -13.202 16.962 1.00 69.28 1PTF 130
130 ATOM 26 NZ LYS 3 4.531 -12.721 17.874 1.00 88.26 1PTF 131
131 ATOM 27 N LYS 4 8.666 -14.752 12.658 1.00 11.61 1PTF 132
132 ATOM 28 CA LYS 4 10.007 -15.299 13.016 1.00 11.30 1PTF 133
133 ATOM 29 C LYS 4 10.888 -14.214 13.630 1.00 10.93 1PTF 134
134 ATOM 30 O LYS 4 10.878 -13.049 13.145 1.00 11.56 1PTF 135
135 ATOM 31 CB LYS 4 10.700 -15.801 11.743 1.00 14.65 1PTF 136
136 ATOM 32 CG LYS 4 11.896 -16.718 12.094 1.00 29.79 1PTF 137
137 ATOM 33 CD LYS 4 12.109 -17.644 10.890 1.00 40.97 1PTF 138
138 ATOM 34 CE LYS 4 12.783 -18.948 11.248 1.00 55.88 1PTF 139
139 ATOM 35 NZ LYS 4 11.837 -20.092 11.156 1.00 61.05 1PTF 140
140 ATOM 36 N GLU 5 11.650 -14.665 14.615 1.00 8.47 1PTF 141
141 ATOM 37 CA GLU 5 12.612 -13.767 15.292 1.00 8.52 1PTF 142
142 ATOM 38 C GLU 5 14.031 -13.990 14.756 1.00 11.48 1PTF 143
143 ATOM 39 O GLU 5 14.446 -15.117 14.386 1.00 10.69 1PTF 144
144 ATOM 40 CB GLU 5 12.580 -14.075 16.776 1.00 13.85 1PTF 145
145 ATOM 41 CG GLU 5 13.037 -12.965 17.712 1.00 29.71 1PTF 146
146 ATOM 42 CD GLU 5 13.114 -13.383 19.166 1.00 44.79 1PTF 147
147 ATOM 43 OE1 GLU 5 12.170 -14.161 19.478 1.00 40.67 1PTF 148
148 ATOM 44 OE2 GLU 5 14.033 -13.037 19.894 1.00 48.34 1PTF 149
149 ATOM 45 N PHE 6 14.779 -12.871 14.721 1.00 9.84 1PTF 150
150 ATOM 46 CA PHE 6 16.174 -12.911 14.186 1.00 10.90 1PTF 151
151 ATOM 47 C PHE 6 17.088 -12.022 15.020 1.00 12.85 1PTF 152
152 ATOM 48 O PHE 6 16.563 -11.044 15.558 1.00 13.49 1PTF 153
153 ATOM 49 CB PHE 6 16.182 -12.326 12.767 1.00 10.22 1PTF 154
154 ATOM 50 CG PHE 6 15.357 -13.120 11.789 1.00 12.71 1PTF 155
155 ATOM 51 CD1 PHE 6 15.902 -14.272 11.217 1.00 17.63 1PTF 156
156 ATOM 52 CD2 PHE 6 14.070 -12.715 11.446 1.00 16.20 1PTF 157
157 ATOM 53 CE1 PHE 6 15.130 -15.029 10.333 1.00 20.38 1PTF 158
158 ATOM 54 CE2 PHE 6 13.335 -13.413 10.475 1.00 18.06 1PTF 159
159 ATOM 55 CZ PHE 6 13.879 -14.579 9.905 1.00 16.68 1PTF 160
160 ATOM 56 N HIS 7 18.371 -12.346 15.057 1.00 10.45 1PTF 161
161 ATOM 57 CA HIS 7 19.299 -11.458 15.850 1.00 8.17 1PTF 162
162 ATOM 58 C HIS 7 20.242 -10.947 14.751 1.00 11.03 1PTF 163
163 ATOM 59 O HIS 7 20.866 -11.760 13.992 1.00 12.30 1PTF 164
164 ATOM 60 CB HIS 7 20.105 -12.300 16.848 1.00 15.19 1PTF 165
165 ATOM 61 CG HIS 7 21.092 -11.566 17.700 1.00 22.38 1PTF 166
166 ATOM 62 ND1 HIS 7 20.779 -10.571 18.594 1.00 26.02 1PTF 167
167 ATOM 63 CD2 HIS 7 22.405 -11.863 17.928 1.00 28.47 1PTF 168
168 ATOM 64 CE1 HIS 7 21.849 -10.249 19.310 1.00 23.65 1PTF 169
169 ATOM 65 NE2 HIS 7 22.851 -10.985 18.887 1.00 30.09 1PTF 170
170 ATOM 66 N ILE 8 20.300 -9.636 14.656 1.00 9.48 1PTF 171
171 ATOM 67 CA ILE 8 21.131 -9.001 13.594 1.00 9.87 1PTF 172
172 ATOM 68 C ILE 8 22.595 -8.988 14.070 1.00 10.43 1PTF 173
173 ATOM 69 O ILE 8 22.938 -8.419 15.124 1.00 13.58 1PTF 174
174 ATOM 70 CB ILE 8 20.609 -7.518 13.410 1.00 11.05 1PTF 175
175 ATOM 71 CG1 ILE 8 19.096 -7.622 13.093 1.00 13.88 1PTF 176
176 ATOM 72 CG2 ILE 8 21.351 -6.815 12.233 1.00 12.12 1PTF 177
177 ATOM 73 CD1 ILE 8 18.835 -8.394 11.762 1.00 14.70 1PTF 178
178 ATOM 74 N VAL 9 23.450 -9.459 13.179 1.00 10.01 1PTF 179
179 ATOM 75 CA VAL 9 24.888 -9.513 13.535 1.00 11.31 1PTF 180
180 ATOM 76 C VAL 9 25.726 -8.719 12.540 1.00 13.41 1PTF 181
181 ATOM 77 O VAL 9 26.932 -8.628 12.880 1.00 14.25 1PTF 182
182 ATOM 78 CB VAL 9 25.317 -11.014 13.612 1.00 14.07 1PTF 183
183 ATOM 79 CG1 VAL 9 24.611 -11.748 14.739 1.00 14.08 1PTF 184
184 ATOM 80 CG2 VAL 9 25.145 -11.673 12.257 1.00 13.25 1PTF 185
185 ATOM 81 N ALA 10 25.169 -8.189 11.457 1.00 10.54 1PTF 186
186 ATOM 82 CA ALA 10 26.033 -7.439 10.510 1.00 12.74 1PTF 187
187 ATOM 83 C ALA 10 26.530 -6.156 11.191 1.00 16.41 1PTF 188
188 ATOM 84 O ALA 10 25.826 -5.460 11.946 1.00 11.28 1PTF 189
189 ATOM 85 CB ALA 10 25.325 -7.185 9.210 1.00 12.70 1PTF 190
190 ATOM 86 N GLU 11 27.787 -5.815 10.901 1.00 15.78 1PTF 191
191 ATOM 87 CA GLU 11 28.424 -4.608 11.463 1.00 14.88 1PTF 192
192 ATOM 88 C GLU 11 27.711 -3.352 11.003 1.00 13.93 1PTF 193
193 ATOM 89 O GLU 11 27.695 -2.329 11.712 1.00 15.94 1PTF 194
194 ATOM 90 CB GLU 11 29.916 -4.579 11.062 1.00 20.86 1PTF 195
195 ATOM 91 CG GLU 11 30.752 -5.641 11.799 1.00 30.66 1PTF 196
196 ATOM 92 CD GLU 11 31.654 -5.126 12.880 1.00 63.17 1PTF 197
197 ATOM 93 OE1 GLU 11 31.326 -4.927 14.041 1.00 72.07 1PTF 198
198 ATOM 94 OE2 GLU 11 32.825 -4.904 12.476 1.00 76.97 1PTF 199
199 ATOM 95 N THR 12 27.102 -3.386 9.826 1.00 10.63 1PTF 200
200 ATOM 96 CA THR 12 26.360 -2.242 9.307 1.00 11.97 1PTF 201
201 ATOM 97 C THR 12 24.933 -2.152 9.909 1.00 14.32 1PTF 202
202 ATOM 98 O THR 12 24.308 -1.082 9.715 1.00 16.09 1PTF 203
203 ATOM 99 CB THR 12 26.243 -2.315 7.723 1.00 19.92 1PTF 204
204 ATOM 100 OG1 THR 12 25.546 -3.580 7.438 1.00 17.86 1PTF 205
205 ATOM 101 CG2 THR 12 27.556 -2.197 6.955 1.00 22.47 1PTF 206
206 ATOM 102 N GLY 13 24.457 -3.201 10.545 1.00 10.50 1PTF 207
207 ATOM 103 CA GLY 13 23.033 -3.236 11.031 1.00 11.48 1PTF 208
208 ATOM 104 C GLY 13 22.162 -3.280 9.758 1.00 13.68 1PTF 209
209 ATOM 105 O GLY 13 22.708 -3.632 8.687 1.00 10.94 1PTF 210
210 ATOM 106 N ILE 14 20.897 -2.864 9.828 1.00 9.12 1PTF 211
211 ATOM 107 CA ILE 14 20.120 -2.869 8.562 1.00 9.54 1PTF 212
212 ATOM 108 C ILE 14 20.229 -1.451 7.952 1.00 10.89 1PTF 213
213 ATOM 109 O ILE 14 19.323 -0.620 8.162 1.00 11.14 1PTF 214
214 ATOM 110 CB ILE 14 18.638 -3.341 8.794 1.00 9.78 1PTF 215
215 ATOM 111 CG1 ILE 14 18.639 -4.702 9.528 1.00 10.02 1PTF 216
216 ATOM 112 CG2 ILE 14 17.908 -3.474 7.417 1.00 9.34 1PTF 217
217 ATOM 113 CD1 ILE 14 17.203 -5.276 9.841 1.00 13.27 1PTF 218
218 ATOM 114 N HIS 15 21.301 -1.261 7.204 1.00 7.88 1PTF 219
219 ATOM 115 CA HIS 15 21.552 0.046 6.558 1.00 7.17 1PTF 220
220 ATOM 116 C HIS 15 22.322 -0.265 5.272 1.00 11.87 1PTF 221
221 ATOM 117 O HIS 15 22.747 -1.413 5.107 1.00 10.85 1PTF 222
222 ATOM 118 CB HIS 15 22.480 0.949 7.416 1.00 7.64 1PTF 223
223 ATOM 119 CG HIS 15 21.829 1.326 8.719 1.00 10.52 1PTF 224
224 ATOM 120 ND1 HIS 15 22.102 0.751 9.928 1.00 13.39 1PTF 225
225 ATOM 121 CD2 HIS 15 20.927 2.327 8.963 1.00 10.69 1PTF 226
226 ATOM 122 CE1 HIS 15 21.318 1.248 10.863 1.00 8.97 1PTF 227
227 ATOM 123 NE2 HIS 15 20.634 2.225 10.301 1.00 15.74 1PTF 228
228 ATOM 124 N ALA 16 22.465 0.698 4.398 1.00 12.86 1PTF 229
229 ATOM 125 CA ALA 16 23.246 0.623 3.142 1.00 11.02 1PTF 230
230 ATOM 126 C ALA 16 22.762 -0.474 2.222 1.00 11.60 1PTF 231
231 ATOM 127 O ALA 16 21.547 -0.760 2.234 1.00 11.30 1PTF 232
232 ATOM 128 CB ALA 16 24.713 0.451 3.598 1.00 11.63 1PTF 233
233 ATOM 129 N ARG 17 23.607 -1.031 1.368 1.00 10.55 1PTF 234
234 ATOM 130 CA ARG 17 23.227 -2.105 0.467 1.00 12.54 1PTF 235
235 ATOM 131 C ARG 17 22.480 -3.285 1.080 1.00 11.02 1PTF 236
236 ATOM 132 O ARG 17 21.501 -3.782 0.510 1.00 10.95 1PTF 237
237 ATOM 133 CB ARG 17 24.378 -2.565 -0.434 1.00 12.73 1PTF 238
238 ATOM 134 CG ARG 17 23.990 -3.603 -1.490 1.00 16.76 1PTF 239
239 ATOM 135 CD ARG 17 25.145 -3.695 -2.464 1.00 17.07 1PTF 240
240 ATOM 136 NE ARG 17 25.005 -4.797 -3.406 1.00 18.48 1PTF 241
241 ATOM 137 CZ ARG 17 24.287 -4.682 -4.532 1.00 25.76 1PTF 242
242 ATOM 138 NH1 ARG 17 23.729 -3.480 -4.711 1.00 28.16 1PTF 243
243 ATOM 139 NH2 ARG 17 24.081 -5.692 -5.389 1.00 19.98 1PTF 244
244 ATOM 140 N PRO 18 22.885 -3.731 2.268 1.00 12.15 1PTF 245
245 ATOM 141 CA PRO 18 22.173 -4.837 2.956 1.00 10.87 1PTF 246
246 ATOM 142 C PRO 18 20.711 -4.457 3.159 1.00 10.64 1PTF 247
247 ATOM 143 O PRO 18 19.850 -5.326 2.945 1.00 10.86 1PTF 248
248 ATOM 144 CB PRO 18 22.872 -4.910 4.328 1.00 11.54 1PTF 249
249 ATOM 145 CG PRO 18 24.292 -4.500 3.984 1.00 13.05 1PTF 250
250 ATOM 146 CD PRO 18 24.130 -3.343 2.971 1.00 11.21 1PTF 251
251 ATOM 147 N ALA 19 20.435 -3.218 3.500 1.00 8.65 1PTF 252
252 ATOM 148 CA ALA 19 19.032 -2.757 3.695 1.00 9.43 1PTF 253
253 ATOM 149 C ALA 19 18.293 -2.692 2.356 1.00 8.89 1PTF 254
254 ATOM 150 O ALA 19 17.132 -3.172 2.285 1.00 9.73 1PTF 255
255 ATOM 151 CB ALA 19 19.049 -1.374 4.376 1.00 8.68 1PTF 256
256 ATOM 152 N THR 20 18.920 -2.193 1.312 1.00 8.19 1PTF 257
257 ATOM 153 CA THR 20 18.227 -2.096 0.021 1.00 9.75 1PTF 258
258 ATOM 154 C THR 20 17.886 -3.452 -0.588 1.00 9.86 1PTF 259
259 ATOM 155 O THR 20 16.815 -3.601 -1.238 1.00 9.21 1PTF 260
260 ATOM 156 CB THR 20 18.827 -1.062 -1.021 1.00 12.66 1PTF 261
261 ATOM 157 OG1 THR 20 20.124 -1.628 -1.331 1.00 12.53 1PTF 262
262 ATOM 158 CG2 THR 20 18.978 0.346 -0.410 1.00 12.10 1PTF 263
263 ATOM 159 N LEU 21 18.811 -4.379 -0.473 1.00 8.46 1PTF 264
264 ATOM 160 CA LEU 21 18.559 -5.744 -1.009 1.00 9.81 1PTF 265
265 ATOM 161 C LEU 21 17.396 -6.409 -0.229 1.00 10.72 1PTF 266
266 ATOM 162 O LEU 21 16.581 -7.102 -0.905 1.00 9.90 1PTF 267
267 ATOM 163 CB LEU 21 19.868 -6.543 -0.858 1.00 11.37 1PTF 268
268 ATOM 164 CG LEU 21 20.969 -6.137 -1.823 1.00 16.62 1PTF 269
269 ATOM 165 CD1 LEU 21 22.205 -7.001 -1.584 1.00 18.64 1PTF 270
270 ATOM 166 CD2 LEU 21 20.460 -6.294 -3.253 1.00 21.88 1PTF 271
271 ATOM 167 N LEU 22 17.393 -6.226 1.086 1.00 8.22 1PTF 272
272 ATOM 168 CA LEU 22 16.314 -6.827 1.898 1.00 7.53 1PTF 273
273 ATOM 169 C LEU 22 14.956 -6.260 1.450 1.00 7.78 1PTF 274
274 ATOM 170 O LEU 22 14.000 -7.040 1.287 1.00 7.49 1PTF 275
275 ATOM 171 CB LEU 22 16.629 -6.557 3.381 1.00 7.20 1PTF 276
276 ATOM 172 CG LEU 22 15.569 -7.054 4.370 1.00 9.45 1PTF 277
277 ATOM 173 CD1 LEU 22 15.389 -8.593 4.260 1.00 13.87 1PTF 278
278 ATOM 174 CD2 LEU 22 15.952 -6.691 5.806 1.00 11.79 1PTF 279
279 ATOM 175 N VAL 23 14.825 -4.950 1.391 1.00 6.85 1PTF 280
280 ATOM 176 CA VAL 23 13.545 -4.337 0.955 1.00 6.79 1PTF 281
281 ATOM 177 C VAL 23 13.161 -4.804 -0.449 1.00 9.08 1PTF 282
282 ATOM 178 O VAL 23 11.973 -5.063 -0.695 1.00 10.07 1PTF 283
283 ATOM 179 CB VAL 23 13.669 -2.805 1.051 1.00 8.71 1PTF 284
284 ATOM 180 CG1 VAL 23 12.469 -2.123 0.427 1.00 10.13 1PTF 285
285 ATOM 181 CG2 VAL 23 13.800 -2.456 2.534 1.00 6.72 1PTF 286
286 ATOM 182 N GLN 24 14.143 -4.936 -1.326 1.00 8.38 1PTF 287
287 ATOM 183 CA GLN 24 13.862 -5.397 -2.709 1.00 12.35 1PTF 288
288 ATOM 184 C GLN 24 13.250 -6.798 -2.699 1.00 12.23 1PTF 289
289 ATOM 185 O GLN 24 12.363 -7.111 -3.512 1.00 13.41 1PTF 290
290 ATOM 186 CB GLN 24 15.153 -5.435 -3.535 1.00 16.38 1PTF 291
291 ATOM 187 CG GLN 24 15.584 -4.107 -4.103 1.00 45.58 1PTF 292
292 ATOM 188 CD GLN 24 16.816 -4.314 -4.981 1.00 60.79 1PTF 293
293 ATOM 189 OE1 GLN 24 16.998 -5.389 -5.565 1.00 60.14 1PTF 294
294 ATOM 190 NE2 GLN 24 17.632 -3.260 -5.017 1.00 49.38 1PTF 295
295 ATOM 191 N THR 25 13.787 -7.641 -1.820 1.00 10.01 1PTF 296
296 ATOM 192 CA THR 25 13.298 -9.030 -1.704 1.00 10.21 1PTF 297
297 ATOM 193 C THR 25 11.848 -9.043 -1.161 1.00 11.65 1PTF 298
298 ATOM 194 O THR 25 10.985 -9.735 -1.754 1.00 11.46 1PTF 299
299 ATOM 195 CB THR 25 14.189 -9.915 -0.755 1.00 15.26 1PTF 300
300 ATOM 196 OG1 THR 25 15.430 -10.003 -1.528 1.00 20.52 1PTF 301
301 ATOM 197 CG2 THR 25 13.596 -11.309 -0.562 1.00 16.11 1PTF 302
302 ATOM 198 N ALA 26 11.633 -8.225 -0.157 1.00 7.18 1PTF 303
303 ATOM 199 CA ALA 26 10.290 -8.158 0.448 1.00 10.26 1PTF 304
304 ATOM 200 C ALA 26 9.262 -7.695 -0.580 1.00 10.24 1PTF 305
305 ATOM 201 O ALA 26 8.129 -8.189 -0.638 1.00 9.51 1PTF 306
306 ATOM 202 CB ALA 26 10.304 -7.233 1.673 1.00 8.05 1PTF 307
307 ATOM 203 N SER 27 9.673 -6.731 -1.386 1.00 9.28 1PTF 308
308 ATOM 204 CA SER 27 8.849 -6.133 -2.426 1.00 11.13 1PTF 309
309 ATOM 205 C SER 27 8.435 -7.122 -3.497 1.00 12.73 1PTF 310
310 ATOM 206 O SER 27 7.443 -6.780 -4.215 1.00 16.89 1PTF 311
311 ATOM 207 CB SER 27 9.629 -4.955 -3.057 1.00 10.83 1PTF 312
312 ATOM 208 OG SER 27 9.705 -3.981 -2.004 1.00 19.04 1PTF 313
313 ATOM 209 N LYS 28 9.014 -8.311 -3.544 1.00 11.61 1PTF 314
314 ATOM 210 CA LYS 28 8.606 -9.243 -4.624 1.00 11.13 1PTF 315
315 ATOM 211 C LYS 28 7.314 -10.016 -4.208 1.00 14.38 1PTF 316
316 ATOM 212 O LYS 28 6.766 -10.687 -5.114 1.00 16.57 1PTF 317
317 ATOM 213 CB LYS 28 9.667 -10.328 -4.841 1.00 21.30 1PTF 318
318 ATOM 214 CG LYS 28 11.037 -9.875 -5.340 1.00 29.68 1PTF 319
319 ATOM 215 CD LYS 28 11.906 -11.114 -5.581 1.00 52.67 1PTF 320
320 ATOM 216 CE LYS 28 13.132 -10.813 -6.415 1.00 75.08 1PTF 321
321 ATOM 217 NZ LYS 28 12.932 -11.011 -7.872 1.00 81.05 1PTF 322
322 ATOM 218 N PHE 29 6.902 -9.890 -2.959 1.00 9.10 1PTF 323
323 ATOM 219 CA PHE 29 5.758 -10.690 -2.493 1.00 11.73 1PTF 324
324 ATOM 220 C PHE 29 4.473 -9.863 -2.330 1.00 12.74 1PTF 325
325 ATOM 221 O PHE 29 4.597 -8.663 -2.091 1.00 12.70 1PTF 326
326 ATOM 222 CB PHE 29 6.119 -11.403 -1.179 1.00 9.61 1PTF 327
327 ATOM 223 CG PHE 29 7.280 -12.337 -1.438 1.00 9.39 1PTF 328
328 ATOM 224 CD1 PHE 29 7.040 -13.584 -2.056 1.00 12.84 1PTF 329
329 ATOM 225 CD2 PHE 29 8.587 -11.933 -1.186 1.00 8.77 1PTF 330
330 ATOM 226 CE1 PHE 29 8.097 -14.452 -2.322 1.00 14.14 1PTF 331
331 ATOM 227 CE2 PHE 29 9.666 -12.771 -1.494 1.00 10.35 1PTF 332
332 ATOM 228 CZ PHE 29 9.424 -14.047 -2.067 1.00 11.42 1PTF 333
333 ATOM 229 N ASN 30 3.329 -10.535 -2.390 1.00 10.84 1PTF 334
334 ATOM 230 CA ASN 30 2.029 -9.844 -2.201 1.00 11.89 1PTF 335
335 ATOM 231 C ASN 30 1.618 -9.760 -0.736 1.00 11.14 1PTF 336
336 ATOM 232 O ASN 30 0.927 -8.798 -0.315 1.00 13.17 1PTF 337
337 ATOM 233 CB ASN 30 0.954 -10.542 -3.060 1.00 11.63 1PTF 338
338 ATOM 234 CG ASN 30 1.384 -10.549 -4.527 1.00 16.51 1PTF 339
339 ATOM 235 OD1 ASN 30 1.310 -9.461 -5.107 1.00 21.41 1PTF 340
340 ATOM 236 ND2 ASN 30 1.679 -11.724 -5.077 1.00 17.67 1PTF 341
341 ATOM 237 N SER 31 2.040 -10.694 0.095 1.00 8.02 1PTF 342
342 ATOM 238 CA SER 31 1.691 -10.695 1.523 1.00 6.35 1PTF 343
343 ATOM 239 C SER 31 2.138 -9.381 2.168 1.00 8.97 1PTF 344
344 ATOM 240 O SER 31 3.065 -8.734 1.650 1.00 10.35 1PTF 345
345 ATOM 241 CB SER 31 2.462 -11.778 2.256 1.00 12.06 1PTF 346
346 ATOM 242 OG SER 31 2.169 -13.077 1.752 1.00 13.03 1PTF 347
347 ATOM 243 N ASP 32 1.476 -9.088 3.268 1.00 8.33 1PTF 348
348 ATOM 244 CA ASP 32 1.930 -7.949 4.107 1.00 8.85 1PTF 349
349 ATOM 245 C ASP 32 3.169 -8.479 4.881 1.00 8.79 1PTF 350
350 ATOM 246 O ASP 32 3.106 -9.551 5.496 1.00 9.26 1PTF 351
351 ATOM 247 CB ASP 32 0.870 -7.705 5.201 1.00 11.90 1PTF 352
352 ATOM 248 CG ASP 32 -0.328 -6.949 4.640 1.00 26.40 1PTF 353
353 ATOM 249 OD1 ASP 32 -0.143 -6.332 3.567 1.00 24.46 1PTF 354
354 ATOM 250 OD2 ASP 32 -1.392 -7.026 5.267 1.00 43.89 1PTF 355
355 ATOM 251 N ILE 33 4.226 -7.665 4.838 1.00 10.88 1PTF 356
356 ATOM 252 CA ILE 33 5.494 -8.027 5.542 1.00 8.83 1PTF 357
357 ATOM 253 C ILE 33 5.875 -6.879 6.478 1.00 10.48 1PTF 358
358 ATOM 254 O ILE 33 6.104 -5.764 5.950 1.00 11.24 1PTF 359
359 ATOM 255 CB ILE 33 6.655 -8.323 4.532 1.00 6.04 1PTF 360
360 ATOM 256 CG1 ILE 33 6.189 -9.413 3.536 1.00 7.68 1PTF 361
361 ATOM 257 CG2 ILE 33 7.890 -8.873 5.333 1.00 9.38 1PTF 362
362 ATOM 258 CD1 ILE 33 7.240 -9.750 2.427 1.00 13.40 1PTF 363
363 ATOM 259 N ASN 34 5.983 -7.155 7.747 1.00 6.49 1PTF 364
364 ATOM 260 CA ASN 34 6.342 -6.051 8.689 1.00 7.91 1PTF 365
365 ATOM 261 C ASN 34 7.609 -6.464 9.458 1.00 12.92 1PTF 366
366 ATOM 262 O ASN 34 7.781 -7.658 9.747 1.00 12.09 1PTF 367
367 ATOM 263 CB ASN 34 5.187 -5.949 9.732 1.00 10.51 1PTF 368
368 ATOM 264 CG ASN 34 3.981 -5.353 9.009 1.00 22.59 1PTF 369
369 ATOM 265 OD1 ASN 34 2.951 -6.009 8.869 1.00 51.05 1PTF 370
370 ATOM 266 ND2 ASN 34 4.191 -4.224 8.359 1.00 23.89 1PTF 371
371 ATOM 267 N LEU 35 8.404 -5.490 9.791 1.00 8.63 1PTF 372
372 ATOM 268 CA LEU 35 9.618 -5.689 10.615 1.00 7.18 1PTF 373
373 ATOM 269 C LEU 35 9.356 -4.960 11.934 1.00 9.16 1PTF 374
374 ATOM 270 O LEU 35 8.981 -3.762 11.910 1.00 9.58 1PTF 375
375 ATOM 271 CB LEU 35 10.783 -5.050 9.829 1.00 7.04 1PTF 376
376 ATOM 272 CG LEU 35 12.108 -4.911 10.630 1.00 14.24 1PTF 377
377 ATOM 273 CD1 LEU 35 12.719 -6.285 10.859 1.00 14.57 1PTF 378
378 ATOM 274 CD2 LEU 35 13.092 -4.148 9.728 1.00 14.16 1PTF 379
379 ATOM 275 N GLU 36 9.620 -5.658 13.030 1.00 9.42 1PTF 380
380 ATOM 276 CA GLU 36 9.337 -5.016 14.336 1.00 10.68 1PTF 381
381 ATOM 277 C GLU 36 10.583 -5.023 15.218 1.00 11.68 1PTF 382
382 ATOM 278 O GLU 36 11.337 -6.027 15.220 1.00 10.48 1PTF 383
383 ATOM 279 CB GLU 36 8.200 -5.765 15.018 1.00 9.77 1PTF 384
384 ATOM 280 CG GLU 36 8.008 -5.281 16.463 1.00 24.84 1PTF 385
385 ATOM 281 CD GLU 36 7.305 -6.355 17.262 1.00 59.50 1PTF 386
386 ATOM 282 OE1 GLU 36 7.844 -7.440 17.418 1.00 69.64 1PTF 387
387 ATOM 283 OE2 GLU 36 6.140 -6.015 17.559 1.00 63.25 1PTF 388
388 ATOM 284 N TYR 37 10.841 -3.833 15.794 1.00 8.90 1PTF 389
389 ATOM 285 CA TYR 37 12.058 -3.700 16.648 1.00 10.23 1PTF 390
390 ATOM 286 C TYR 37 11.675 -2.873 17.874 1.00 12.73 1PTF 391
391 ATOM 287 O TYR 37 11.184 -1.759 17.692 1.00 11.54 1PTF 392
392 ATOM 288 CB TYR 37 13.166 -3.014 15.851 1.00 10.10 1PTF 393
393 ATOM 289 CG TYR 37 14.381 -2.564 16.633 1.00 16.36 1PTF 394
394 ATOM 290 CD1 TYR 37 15.058 -3.483 17.441 1.00 17.34 1PTF 395
395 ATOM 291 CD2 TYR 37 14.910 -1.272 16.477 1.00 14.02 1PTF 396
396 ATOM 292 CE1 TYR 37 16.205 -3.116 18.147 1.00 20.37 1PTF 397
397 ATOM 293 CE2 TYR 37 16.068 -0.912 17.161 1.00 15.17 1PTF 398
398 ATOM 294 CZ TYR 37 16.708 -1.834 17.977 1.00 18.77 1PTF 399
399 ATOM 295 OH TYR 37 17.843 -1.526 18.665 1.00 25.06 1PTF 400
400 ATOM 296 N LYS 38 11.883 -3.510 19.025 1.00 15.91 1PTF 401
401 ATOM 297 CA LYS 38 11.579 -2.814 20.291 1.00 19.11 1PTF 402
402 ATOM 298 C LYS 38 10.163 -2.218 20.316 1.00 22.96 1PTF 403
403 ATOM 299 O LYS 38 9.913 -1.068 20.752 1.00 20.28 1PTF 404
404 ATOM 300 CB LYS 38 12.653 -1.747 20.548 1.00 18.25 1PTF 405
405 ATOM 301 CG LYS 38 13.924 -2.472 21.076 1.00 16.84 1PTF 406
406 ATOM 302 CD LYS 38 14.986 -1.415 21.298 1.00 18.90 1PTF 407
407 ATOM 303 CE LYS 38 16.199 -1.946 22.017 1.00 25.92 1PTF 408
408 ATOM 304 NZ LYS 38 17.404 -1.133 21.673 1.00 42.57 1PTF 409
409 ATOM 305 N GLY 39 9.212 -3.059 19.865 1.00 20.83 1PTF 410
410 ATOM 306 CA GLY 39 7.808 -2.671 19.869 1.00 18.14 1PTF 411
411 ATOM 307 C GLY 39 7.350 -1.767 18.746 1.00 23.50 1PTF 412
412 ATOM 308 O GLY 39 6.126 -1.462 18.740 1.00 28.37 1PTF 413
413 ATOM 309 N LYS 40 8.231 -1.306 17.877 1.00 16.00 1PTF 414
414 ATOM 310 CA LYS 40 7.742 -0.456 16.771 1.00 14.36 1PTF 415
415 ATOM 311 C LYS 40 7.772 -1.297 15.490 1.00 11.50 1PTF 416
416 ATOM 312 O LYS 40 8.787 -1.933 15.210 1.00 11.41 1PTF 417
417 ATOM 313 CB LYS 40 8.624 0.779 16.692 1.00 13.30 1PTF 418
418 ATOM 314 CG LYS 40 8.333 1.591 15.410 1.00 39.30 1PTF 419
419 ATOM 315 CD LYS 40 9.285 2.769 15.277 1.00 56.03 1PTF 420
420 ATOM 316 CE LYS 40 9.162 3.500 13.954 1.00 70.82 1PTF 421
421 ATOM 317 NZ LYS 40 10.319 4.426 13.775 1.00 72.89 1PTF 422
422 ATOM 318 N SER 41 6.741 -1.192 14.707 1.00 9.60 1PTF 423
423 ATOM 319 CA SER 41 6.635 -1.992 13.462 1.00 14.69 1PTF 424
424 ATOM 320 C SER 41 6.601 -1.112 12.224 1.00 16.01 1PTF 425
425 ATOM 321 O SER 41 5.921 -0.067 12.211 1.00 13.23 1PTF 426
426 ATOM 322 CB SER 41 5.380 -2.843 13.698 1.00 16.37 1PTF 427
427 ATOM 323 OG SER 41 5.023 -3.645 12.594 1.00 32.00 1PTF 428
428 ATOM 324 N VAL 42 7.275 -1.563 11.157 1.00 10.25 1PTF 429
429 ATOM 325 CA VAL 42 7.285 -0.839 9.879 1.00 10.06 1PTF 430
430 ATOM 326 C VAL 42 7.021 -1.833 8.739 1.00 10.05 1PTF 431
431 ATOM 327 O VAL 42 7.295 -3.025 8.888 1.00 10.83 1PTF 432
432 ATOM 328 CB VAL 42 8.578 0.002 9.607 1.00 9.64 1PTF 433
433 ATOM 329 CG1 VAL 42 8.875 0.898 10.826 1.00 12.66 1PTF 434
434 ATOM 330 CG2 VAL 42 9.776 -0.940 9.426 1.00 10.64 1PTF 435
435 ATOM 331 N ASN 43 6.627 -1.266 7.614 1.00 7.69 1PTF 436
436 ATOM 332 CA ASN 43 6.422 -2.111 6.415 1.00 7.27 1PTF 437
437 ATOM 333 C ASN 43 7.824 -2.414 5.861 1.00 8.11 1PTF 438
438 ATOM 334 O ASN 43 8.561 -1.465 5.542 1.00 8.15 1PTF 439
439 ATOM 335 CB ASN 43 5.647 -1.215 5.450 1.00 7.93 1PTF 440
440 ATOM 336 CG ASN 43 5.291 -1.906 4.161 1.00 15.58 1PTF 441
441 ATOM 337 OD1 ASN 43 4.501 -1.328 3.374 1.00 23.12 1PTF 442
442 ATOM 338 ND2 ASN 43 5.786 -3.090 3.851 1.00 5.42 1PTF 443
443 ATOM 339 N LEU 44 8.147 -3.712 5.702 1.00 6.51 1PTF 444
444 ATOM 340 CA LEU 44 9.487 -4.085 5.202 1.00 5.90 1PTF 445
445 ATOM 341 C LEU 44 9.642 -3.752 3.729 1.00 6.86 1PTF 446
446 ATOM 342 O LEU 44 10.783 -3.813 3.195 1.00 8.45 1PTF 447
447 ATOM 343 CB LEU 44 9.800 -5.563 5.571 1.00 6.08 1PTF 448
448 ATOM 344 CG LEU 44 11.219 -6.041 5.198 1.00 10.72 1PTF 449
449 ATOM 345 CD1 LEU 44 12.266 -5.240 5.984 1.00 11.16 1PTF 450
450 ATOM 346 CD2 LEU 44 11.311 -7.509 5.705 1.00 13.01 1PTF 451
451 ATOM 347 N LYS 45 8.548 -3.401 3.049 1.00 5.64 1PTF 452
452 ATOM 348 CA LYS 45 8.661 -3.020 1.620 1.00 5.25 1PTF 453
453 ATOM 349 C LYS 45 8.970 -1.531 1.491 1.00 7.17 1PTF 454
454 ATOM 350 O LYS 45 9.144 -1.105 0.334 1.00 10.22 1PTF 455
455 ATOM 351 CB LYS 45 7.374 -3.316 0.857 1.00 5.14 1PTF 456
456 ATOM 352 CG LYS 45 6.968 -4.821 0.969 1.00 10.29 1PTF 457
457 ATOM 353 CD LYS 45 5.696 -5.086 0.132 1.00 8.84 1PTF 458
458 ATOM 354 CE LYS 45 5.141 -6.464 0.506 1.00 9.40 1PTF 459
459 ATOM 355 NZ LYS 45 3.838 -6.648 -0.177 1.00 8.74 1PTF 460
460 ATOM 356 N SER 46 9.175 -0.867 2.612 1.00 7.39 1PTF 461
461 ATOM 357 CA SER 46 9.413 0.609 2.569 1.00 6.09 1PTF 462
462 ATOM 358 C SER 46 10.834 0.901 3.069 1.00 6.95 1PTF 463
463 ATOM 359 O SER 46 11.138 0.723 4.263 1.00 7.45 1PTF 464
464 ATOM 360 CB SER 46 8.401 1.258 3.544 1.00 6.79 1PTF 465
465 ATOM 361 OG SER 46 8.735 2.653 3.785 1.00 9.99 1PTF 466
466 ATOM 362 N ILE 47 11.689 1.365 2.151 1.00 9.14 1PTF 467
467 ATOM 363 CA ILE 47 13.083 1.697 2.571 1.00 7.09 1PTF 468
468 ATOM 364 C ILE 47 13.051 2.806 3.621 1.00 7.13 1PTF 469
469 ATOM 365 O ILE 47 13.873 2.826 4.578 1.00 9.68 1PTF 470
470 ATOM 366 CB ILE 47 13.956 2.007 1.284 1.00 11.60 1PTF 471
471 ATOM 367 CG1 ILE 47 15.455 2.161 1.671 1.00 12.07 1PTF 472
472 ATOM 368 CG2 ILE 47 13.438 3.254 0.514 1.00 11.45 1PTF 473
473 ATOM 369 CD1 ILE 47 16.045 0.963 2.475 1.00 12.25 1PTF 474
474 ATOM 370 N MET 48 12.127 3.759 3.484 1.00 10.55 1PTF 475
475 ATOM 371 CA MET 48 12.047 4.840 4.497 1.00 9.89 1PTF 476
476 ATOM 372 C MET 48 11.672 4.297 5.867 1.00 8.98 1PTF 477
477 ATOM 373 O MET 48 12.215 4.739 6.906 1.00 10.61 1PTF 478
478 ATOM 374 CB MET 48 11.174 5.999 4.034 1.00 13.21 1PTF 479
479 ATOM 375 CG MET 48 11.840 6.495 2.759 1.00 22.76 1PTF 480
480 ATOM 376 SD MET 48 11.341 8.198 2.421 1.00 36.74 1PTF 481
481 ATOM 377 CE MET 48 9.898 7.901 1.386 1.00 41.95 1PTF 482
482 ATOM 378 N GLY 49 10.679 3.405 5.840 1.00 7.78 1PTF 483
483 ATOM 379 CA GLY 49 10.299 2.799 7.145 1.00 8.46 1PTF 484
484 ATOM 380 C GLY 49 11.494 2.081 7.807 1.00 7.40 1PTF 485
485 ATOM 381 O GLY 49 11.692 2.206 9.041 1.00 9.34 1PTF 486
486 ATOM 382 N VAL 50 12.164 1.292 6.986 1.00 6.15 1PTF 487
487 ATOM 383 CA VAL 50 13.293 0.484 7.509 1.00 8.93 1PTF 488
488 ATOM 384 C VAL 50 14.373 1.423 8.059 1.00 10.99 1PTF 489
489 ATOM 385 O VAL 50 14.900 1.155 9.166 1.00 11.97 1PTF 490
490 ATOM 386 CB VAL 50 13.775 -0.490 6.403 1.00 10.36 1PTF 491
491 ATOM 387 CG1 VAL 50 15.084 -1.172 6.845 1.00 14.44 1PTF 492
492 ATOM 388 CG2 VAL 50 12.734 -1.582 6.144 1.00 11.18 1PTF 493
493 ATOM 389 N MET 51 14.735 2.438 7.276 1.00 8.77 1PTF 494
494 ATOM 390 CA MET 51 15.737 3.406 7.793 1.00 12.45 1PTF 495
495 ATOM 391 C MET 51 15.264 4.116 9.062 1.00 15.48 1PTF 496
496 ATOM 392 O MET 51 16.094 4.271 9.992 1.00 17.66 1PTF 497
497 ATOM 393 CB MET 51 15.989 4.487 6.728 1.00 14.57 1PTF 498
498 ATOM 394 CG MET 51 16.787 3.757 5.654 1.00 29.04 1PTF 499
499 ATOM 395 SD MET 51 17.397 5.068 4.518 1.00 36.18 1PTF 500
500 ATOM 396 CE MET 51 15.858 5.615 3.773 1.00 40.15 1PTF 501
501 ATOM 397 N SER 52 13.983 4.371 9.192 1.00 12.10 1PTF 502
502 ATOM 398 CA SER 52 13.490 5.079 10.384 1.00 16.77 1PTF 503
503 ATOM 399 C SER 52 13.618 4.258 11.658 1.00 13.38 1PTF 504
504 ATOM 400 O SER 52 13.669 4.806 12.766 1.00 14.38 1PTF 505
505 ATOM 401 CB SER 52 12.047 5.529 10.248 1.00 19.52 1PTF 506
506 ATOM 402 OG SER 52 11.178 4.403 10.490 1.00 20.70 1PTF 507
507 ATOM 403 N LEU 53 13.629 2.935 11.449 1.00 12.87 1PTF 508
508 ATOM 404 CA LEU 53 13.695 2.019 12.615 1.00 12.41 1PTF 509
509 ATOM 405 C LEU 53 15.048 2.036 13.292 1.00 11.91 1PTF 510
510 ATOM 406 O LEU 53 15.170 1.756 14.503 1.00 15.15 1PTF 511
511 ATOM 407 CB LEU 53 13.127 0.683 12.085 1.00 12.99 1PTF 512
512 ATOM 408 CG LEU 53 12.659 -0.321 13.086 1.00 20.25 1PTF 513
513 ATOM 409 CD1 LEU 53 11.674 0.341 14.040 1.00 21.15 1PTF 514
514 ATOM 410 CD2 LEU 53 12.088 -1.561 12.383 1.00 16.21 1PTF 515
515 ATOM 411 N GLY 54 16.124 2.261 12.531 1.00 10.82 1PTF 516
516 ATOM 412 CA GLY 54 17.477 2.368 13.111 1.00 13.17 1PTF 517
517 ATOM 413 C GLY 54 17.957 1.081 13.763 1.00 14.18 1PTF 518
518 ATOM 414 O GLY 54 18.441 1.112 14.906 1.00 17.03 1PTF 519
519 ATOM 415 N VAL 55 17.955 0.011 12.967 1.00 9.26 1PTF 520
520 ATOM 416 CA VAL 55 18.362 -1.292 13.536 1.00 10.42 1PTF 521
521 ATOM 417 C VAL 55 19.894 -1.504 13.398 1.00 11.37 1PTF 522
522 ATOM 418 O VAL 55 20.405 -1.648 12.275 1.00 12.59 1PTF 523
523 ATOM 419 CB VAL 55 17.574 -2.430 12.829 1.00 13.10 1PTF 524
524 ATOM 420 CG1 VAL 55 17.945 -3.779 13.472 1.00 11.70 1PTF 525
525 ATOM 421 CG2 VAL 55 16.042 -2.204 12.890 1.00 12.72 1PTF 526
526 ATOM 422 N GLY 56 20.537 -1.561 14.558 1.00 8.39 1PTF 527
527 ATOM 423 CA GLY 56 21.992 -1.781 14.546 1.00 9.00 1PTF 528
528 ATOM 424 C GLY 56 22.381 -3.224 14.856 1.00 10.54 1PTF 529
529 ATOM 425 O GLY 56 21.559 -4.094 15.095 1.00 10.01 1PTF 530
530 ATOM 426 N GLN 57 23.691 -3.435 14.730 1.00 11.09 1PTF 531
531 ATOM 427 CA GLN 57 24.317 -4.726 15.032 1.00 9.59 1PTF 532
532 ATOM 428 C GLN 57 23.904 -5.101 16.465 1.00 11.68 1PTF 533
533 ATOM 429 O GLN 57 23.918 -4.265 17.384 1.00 14.09 1PTF 534
534 ATOM 430 CB GLN 57 25.857 -4.581 14.914 1.00 14.15 1PTF 535
535 ATOM 431 CG GLN 57 26.527 -5.889 15.387 1.00 16.67 1PTF 536
536 ATOM 432 CD GLN 57 28.039 -5.845 15.200 1.00 23.93 1PTF 537
537 ATOM 433 OE1 GLN 57 28.677 -6.721 14.614 1.00 31.28 1PTF 538
538 ATOM 434 NE2 GLN 57 28.563 -4.713 15.620 1.00 16.48 1PTF 539
539 ATOM 435 N GLY 58 23.544 -6.358 16.699 1.00 12.27 1PTF 540
540 ATOM 436 CA GLY 58 23.130 -6.961 17.929 1.00 12.70 1PTF 541
541 ATOM 437 C GLY 58 21.652 -6.920 18.272 1.00 13.36 1PTF 542
542 ATOM 438 O GLY 58 21.208 -7.424 19.316 1.00 18.06 1PTF 543
543 ATOM 439 N SER 59 20.856 -6.311 17.417 1.00 12.84 1PTF 544
544 ATOM 440 CA SER 59 19.412 -6.105 17.617 1.00 10.24 1PTF 545
545 ATOM 441 C SER 59 18.618 -7.415 17.432 1.00 10.36 1PTF 546
546 ATOM 442 O SER 59 18.956 -8.250 16.569 1.00 12.08 1PTF 547
547 ATOM 443 CB SER 59 18.931 -5.130 16.526 1.00 10.83 1PTF 548
548 ATOM 444 OG SER 59 19.422 -3.813 16.772 1.00 16.47 1PTF 549
549 ATOM 445 N ASP 60 17.562 -7.515 18.249 1.00 8.47 1PTF 550
550 ATOM 446 CA ASP 60 16.586 -8.614 18.115 1.00 9.39 1PTF 551
551 ATOM 447 C ASP 60 15.380 -8.020 17.323 1.00 11.26 1PTF 552
552 ATOM 448 O ASP 60 14.886 -6.955 17.745 1.00 12.78 1PTF 553
553 ATOM 449 CB ASP 60 16.074 -9.079 19.477 1.00 14.65 1PTF 554
554 ATOM 450 CG ASP 60 17.134 -9.939 20.143 1.00 32.65 1PTF 555
555 ATOM 451 OD1 ASP 60 17.881 -10.625 19.398 1.00 28.96 1PTF 556
556 ATOM 452 OD2 ASP 60 17.196 -9.859 21.375 1.00 49.63 1PTF 557
557 ATOM 453 N VAL 61 15.044 -8.654 16.215 1.00 8.83 1PTF 558
558 ATOM 454 CA VAL 61 13.887 -8.140 15.429 1.00 9.34 1PTF 559
559 ATOM 455 C VAL 61 12.902 -9.292 15.163 1.00 11.07 1PTF 560
560 ATOM 456 O VAL 61 13.315 -10.456 15.189 1.00 11.56 1PTF 561
561 ATOM 457 CB VAL 61 14.313 -7.482 14.090 1.00 13.14 1PTF 562
562 ATOM 458 CG1 VAL 61 15.259 -6.301 14.330 1.00 11.28 1PTF 563
563 ATOM 459 CG2 VAL 61 14.867 -8.435 13.044 1.00 14.15 1PTF 564
564 ATOM 460 N THR 62 11.661 -8.900 14.853 1.00 8.70 1PTF 565
565 ATOM 461 CA THR 62 10.662 -9.943 14.469 1.00 9.09 1PTF 566
566 ATOM 462 C THR 62 10.109 -9.564 13.083 1.00 11.07 1PTF 567
567 ATOM 463 O THR 62 9.939 -8.356 12.820 1.00 11.57 1PTF 568
568 ATOM 464 CB THR 62 9.427 -9.942 15.470 1.00 11.40 1PTF 569
569 ATOM 465 OG1 THR 62 10.083 -10.307 16.741 1.00 15.26 1PTF 570
570 ATOM 466 CG2 THR 62 8.398 -10.999 15.074 1.00 19.09 1PTF 571
571 ATOM 467 N ILE 63 9.956 -10.579 12.261 1.00 8.72 1PTF 572
572 ATOM 468 CA ILE 63 9.365 -10.331 10.929 1.00 9.35 1PTF 573
573 ATOM 469 C ILE 63 8.047 -11.134 10.850 1.00 9.16 1PTF 574
574 ATOM 470 O ILE 63 8.059 -12.316 11.215 1.00 9.44 1PTF 575
575 ATOM 471 CB ILE 63 10.335 -10.665 9.750 1.00 8.76 1PTF 576
576 ATOM 472 CG1 ILE 63 11.529 -9.637 9.879 1.00 11.59 1PTF 577
577 ATOM 473 CG2 ILE 63 9.663 -10.447 8.343 1.00 10.29 1PTF 578
578 ATOM 474 CD1 ILE 63 12.680 -9.839 8.869 1.00 13.18 1PTF 579
579 ATOM 475 N THR 64 7.000 -10.429 10.372 1.00 8.79 1PTF 580
580 ATOM 476 CA THR 64 5.701 -11.119 10.204 1.00 7.19 1PTF 581
581 ATOM 477 C THR 64 5.367 -11.077 8.703 1.00 8.12 1PTF 582
582 ATOM 478 O THR 64 5.576 -10.042 8.041 1.00 9.57 1PTF 583
583 ATOM 479 CB THR 64 4.560 -10.316 10.979 1.00 10.92 1PTF 584
584 ATOM 480 OG1 THR 64 4.913 -10.518 12.395 1.00 15.66 1PTF 585
585 ATOM 481 CG2 THR 64 3.221 -11.049 10.743 1.00 18.00 1PTF 586
586 ATOM 482 N VAL 65 4.893 -12.222 8.208 1.00 5.63 1PTF 587
587 ATOM 483 CA VAL 65 4.494 -12.355 6.808 1.00 7.31 1PTF 588
588 ATOM 484 C VAL 65 3.009 -12.867 6.783 1.00 9.85 1PTF 589
589 ATOM 485 O VAL 65 2.758 -13.915 7.380 1.00 11.66 1PTF 590
590 ATOM 486 CB VAL 65 5.434 -13.243 5.989 1.00 8.57 1PTF 591
591 ATOM 487 CG1 VAL 65 5.029 -13.261 4.499 1.00 6.68 1PTF 592
592 ATOM 488 CG2 VAL 65 6.916 -12.900 6.063 1.00 10.71 1PTF 593
593 ATOM 489 N ASP 66 2.144 -12.123 6.127 1.00 9.30 1PTF 594
594 ATOM 490 CA ASP 66 0.692 -12.525 6.157 1.00 8.83 1PTF 595
595 ATOM 491 C ASP 66 0.036 -12.280 4.809 1.00 10.53 1PTF 596
596 ATOM 492 O ASP 66 -0.116 -11.112 4.387 1.00 9.61 1PTF 597
597 ATOM 493 CB ASP 66 0.064 -11.691 7.282 1.00 10.43 1PTF 598
598 ATOM 494 CG ASP 66 -1.341 -12.122 7.673 1.00 27.26 1PTF 599
599 ATOM 495 OD1 ASP 66 -1.887 -13.130 7.208 1.00 21.33 1PTF 600
600 ATOM 496 OD2 ASP 66 -1.863 -11.489 8.610 1.00 33.11 1PTF 601
601 ATOM 497 N GLY 67 -0.351 -13.385 4.164 1.00 9.06 1PTF 602
602 ATOM 498 CA GLY 67 -0.993 -13.297 2.840 1.00 9.47 1PTF 603
603 ATOM 499 C GLY 67 -0.976 -14.576 2.015 1.00 8.74 1PTF 604
604 ATOM 500 O GLY 67 -0.492 -15.617 2.492 1.00 10.08 1PTF 605
605 ATOM 501 N ALA 68 -1.301 -14.390 0.721 1.00 9.01 1PTF 606
606 ATOM 502 CA ALA 68 -1.448 -15.531 -0.193 1.00 9.86 1PTF 607
607 ATOM 503 C ALA 68 -0.138 -16.235 -0.489 1.00 13.57 1PTF 608
608 ATOM 504 O ALA 68 -0.195 -17.441 -0.783 1.00 12.69 1PTF 609
609 ATOM 505 CB ALA 68 -2.101 -15.104 -1.496 1.00 12.16 1PTF 610
610 ATOM 506 N ASP 69 0.994 -15.528 -0.382 1.00 10.83 1PTF 611
611 ATOM 507 CA ASP 69 2.299 -16.156 -0.726 1.00 9.34 1PTF 612
612 ATOM 508 C ASP 69 3.219 -16.065 0.508 1.00 8.84 1PTF 613
613 ATOM 509 O ASP 69 4.447 -15.993 0.311 1.00 10.74 1PTF 614
614 ATOM 510 CB ASP 69 2.910 -15.467 -1.945 1.00 10.82 1PTF 615
615 ATOM 511 CG ASP 69 3.117 -13.957 -1.780 1.00 10.14 1PTF 616
616 ATOM 512 OD1 ASP 69 2.854 -13.407 -0.682 1.00 10.24 1PTF 617
617 ATOM 513 OD2 ASP 69 3.484 -13.374 -2.823 1.00 9.78 1PTF 618
618 ATOM 514 N GLU 70 2.620 -16.228 1.653 1.00 5.99 1PTF 619
619 ATOM 515 CA GLU 70 3.383 -16.074 2.874 1.00 7.82 1PTF 620
620 ATOM 516 C GLU 70 4.367 -17.214 3.098 1.00 11.63 1PTF 621
621 ATOM 517 O GLU 70 5.432 -16.914 3.700 1.00 10.19 1PTF 622
622 ATOM 518 CB GLU 70 2.506 -15.912 4.111 1.00 9.58 1PTF 623
623 ATOM 519 CG GLU 70 1.594 -17.122 4.401 1.00 7.92 1PTF 624
624 ATOM 520 CD GLU 70 0.682 -16.884 5.565 1.00 12.48 1PTF 625
625 ATOM 521 OE1 GLU 70 0.061 -15.800 5.692 1.00 10.97 1PTF 626
626 ATOM 522 OE2 GLU 70 0.623 -17.686 6.471 1.00 15.20 1PTF 627
627 ATOM 523 N ALA 71 4.076 -18.414 2.603 1.00 10.08 1PTF 628
628 ATOM 524 CA ALA 71 5.044 -19.529 2.873 1.00 11.69 1PTF 629
629 ATOM 525 C ALA 71 6.388 -19.273 2.152 1.00 8.44 1PTF 630
630 ATOM 526 O ALA 71 7.473 -19.386 2.797 1.00 11.32 1PTF 631
631 ATOM 527 CB ALA 71 4.403 -20.859 2.429 1.00 11.72 1PTF 632
632 ATOM 528 N GLU 72 6.266 -18.999 0.865 1.00 9.74 1PTF 633
633 ATOM 529 CA GLU 72 7.484 -18.736 0.078 1.00 8.65 1PTF 634
634 ATOM 530 C GLU 72 8.033 -17.359 0.464 1.00 10.12 1PTF 635
635 ATOM 531 O GLU 72 9.278 -17.193 0.417 1.00 11.69 1PTF 636
636 ATOM 532 CB GLU 72 7.228 -18.884 -1.405 1.00 16.49 1PTF 637
637 ATOM 533 CG GLU 72 5.959 -18.268 -1.930 1.00 34.31 1PTF 638
638 ATOM 534 CD GLU 72 4.589 -18.867 -1.867 1.00 34.49 1PTF 639
639 ATOM 535 OE1 GLU 72 4.148 -19.268 -0.762 1.00 16.04 1PTF 640
640 ATOM 536 OE2 GLU 72 3.845 -18.751 -2.851 1.00 27.01 1PTF 641
641 ATOM 537 N GLY 73 7.233 -16.422 0.920 1.00 8.57 1PTF 642
642 ATOM 538 CA GLY 73 7.718 -15.070 1.290 1.00 7.20 1PTF 643
643 ATOM 539 C GLY 73 8.581 -15.202 2.544 1.00 7.65 1PTF 644
644 ATOM 540 O GLY 73 9.723 -14.660 2.549 1.00 8.77 1PTF 645
645 ATOM 541 N MET 74 8.087 -15.888 3.568 1.00 6.13 1PTF 646
646 ATOM 542 CA MET 74 8.932 -16.072 4.783 1.00 7.04 1PTF 647
647 ATOM 543 C MET 74 10.210 -16.842 4.422 1.00 8.53 1PTF 648
648 ATOM 544 O MET 74 11.339 -16.518 4.887 1.00 9.32 1PTF 649
649 ATOM 545 CB MET 74 8.129 -16.683 5.928 1.00 9.42 1PTF 650
650 ATOM 546 CG MET 74 8.996 -16.933 7.146 1.00 12.58 1PTF 651
651 ATOM 547 SD MET 74 9.618 -15.388 7.901 1.00 15.21 1PTF 652
652 ATOM 548 CE MET 74 8.193 -14.987 8.914 1.00 11.65 1PTF 653
653 ATOM 549 N ALA 75 10.059 -17.893 3.601 1.00 8.71 1PTF 654
654 ATOM 550 CA ALA 75 11.263 -18.676 3.223 1.00 8.98 1PTF 655
655 ATOM 551 C ALA 75 12.327 -17.818 2.537 1.00 7.04 1PTF 656
656 ATOM 552 O ALA 75 13.554 -17.961 2.828 1.00 7.97 1PTF 657
657 ATOM 553 CB ALA 75 10.861 -19.902 2.396 1.00 8.94 1PTF 658
658 ATOM 554 N ALA 76 11.911 -16.976 1.608 1.00 5.96 1PTF 659
659 ATOM 555 CA ALA 76 12.799 -16.110 0.822 1.00 4.93 1PTF 660
660 ATOM 556 C ALA 76 13.469 -15.111 1.768 1.00 9.56 1PTF 661
661 ATOM 557 O ALA 76 14.649 -14.783 1.603 1.00 9.40 1PTF 662
662 ATOM 558 CB ALA 76 11.998 -15.449 -0.289 1.00 7.77 1PTF 663
663 ATOM 559 N ILE 77 12.732 -14.596 2.737 1.00 7.27 1PTF 664
664 ATOM 560 CA ILE 77 13.285 -13.603 3.702 1.00 9.48 1PTF 665
665 ATOM 561 C ILE 77 14.377 -14.290 4.562 1.00 10.78 1PTF 666
666 ATOM 562 O ILE 77 15.458 -13.710 4.826 1.00 10.97 1PTF 667
667 ATOM 563 CB ILE 77 12.106 -13.001 4.570 1.00 11.55 1PTF 668
668 ATOM 564 CG1 ILE 77 11.162 -12.055 3.786 1.00 11.11 1PTF 669
669 ATOM 565 CG2 ILE 77 12.655 -12.232 5.807 1.00 16.40 1PTF 670
670 ATOM 566 CD1 ILE 77 11.842 -10.966 2.969 1.00 21.81 1PTF 671
671 ATOM 567 N VAL 78 14.104 -15.508 5.036 1.00 7.71 1PTF 672
672 ATOM 568 CA VAL 78 15.101 -16.236 5.866 1.00 7.50 1PTF 673
673 ATOM 569 C VAL 78 16.367 -16.432 5.011 1.00 10.28 1PTF 674
674 ATOM 570 O VAL 78 17.474 -16.172 5.463 1.00 10.01 1PTF 675
675 ATOM 571 CB VAL 78 14.528 -17.595 6.330 1.00 10.07 1PTF 676
676 ATOM 572 CG1 VAL 78 15.666 -18.440 6.931 1.00 11.69 1PTF 677
677 ATOM 573 CG2 VAL 78 13.441 -17.361 7.385 1.00 8.48 1PTF 678
678 ATOM 574 N GLU 79 16.149 -16.881 3.776 1.00 7.31 1PTF 679
679 ATOM 575 CA GLU 79 17.281 -17.114 2.886 1.00 8.11 1PTF 680
680 ATOM 576 C GLU 79 18.114 -15.863 2.682 1.00 10.18 1PTF 681
681 ATOM 577 O GLU 79 19.343 -15.916 2.704 1.00 9.57 1PTF 682
682 ATOM 578 CB GLU 79 16.768 -17.647 1.545 1.00 9.67 1PTF 683
683 ATOM 579 CG GLU 79 17.933 -17.947 0.594 1.00 13.11 1PTF 684
684 ATOM 580 CD GLU 79 17.626 -18.482 -0.769 1.00 20.35 1PTF 685
685 ATOM 581 OE1 GLU 79 16.423 -18.513 -1.078 1.00 17.31 1PTF 686
686 ATOM 582 OE2 GLU 79 18.507 -18.827 -1.545 1.00 16.49 1PTF 687
687 ATOM 583 N THR 80 17.436 -14.742 2.424 1.00 7.68 1PTF 688
688 ATOM 584 CA THR 80 18.100 -13.448 2.177 1.00 6.63 1PTF 689
689 ATOM 585 C THR 80 18.847 -12.951 3.400 1.00 10.52 1PTF 690
690 ATOM 586 O THR 80 20.007 -12.524 3.242 1.00 9.94 1PTF 691
691 ATOM 587 CB THR 80 17.020 -12.389 1.703 1.00 11.43 1PTF 692
692 ATOM 588 OG1 THR 80 16.515 -12.955 0.421 1.00 15.96 1PTF 693
693 ATOM 589 CG2 THR 80 17.724 -11.053 1.460 1.00 15.33 1PTF 694
694 ATOM 590 N LEU 81 18.244 -13.014 4.592 1.00 7.33 1PTF 695
695 ATOM 591 CA LEU 81 18.961 -12.574 5.777 1.00 7.28 1PTF 696
696 ATOM 592 C LEU 81 20.266 -13.349 5.964 1.00 10.19 1PTF 697
697 ATOM 593 O LEU 81 21.286 -12.789 6.401 1.00 11.70 1PTF 698
698 ATOM 594 CB LEU 81 18.016 -12.665 6.982 1.00 8.64 1PTF 699
699 ATOM 595 CG LEU 81 16.852 -11.657 6.949 1.00 14.85 1PTF 700
700 ATOM 596 CD1 LEU 81 15.930 -11.990 8.137 1.00 15.61 1PTF 701
701 ATOM 597 CD2 LEU 81 17.373 -10.242 7.108 1.00 17.22 1PTF 702
702 ATOM 598 N GLN 82 20.197 -14.657 5.728 1.00 9.60 1PTF 703
703 ATOM 599 CA GLN 82 21.437 -15.490 5.897 1.00 9.50 1PTF 704
704 ATOM 600 C GLN 82 22.404 -15.236 4.764 1.00 11.63 1PTF 705
705 ATOM 601 O GLN 82 23.590 -14.995 5.123 1.00 14.08 1PTF 706
706 ATOM 602 CB GLN 82 21.040 -16.943 5.808 1.00 13.87 1PTF 707
707 ATOM 603 CG GLN 82 20.167 -17.428 6.977 1.00 33.69 1PTF 708
708 ATOM 604 CD GLN 82 19.790 -18.892 6.813 1.00 58.82 1PTF 709
709 ATOM 605 OE1 GLN 82 19.679 -19.700 7.727 1.00 72.47 1PTF 710
710 ATOM 606 NE2 GLN 82 19.645 -19.255 5.616 1.00 61.43 1PTF 711
711 ATOM 607 N LYS 83 22.008 -15.153 3.511 1.00 9.53 1PTF 712
712 ATOM 608 CA LYS 83 22.922 -14.874 2.387 1.00 10.95 1PTF 713
713 ATOM 609 C LYS 83 23.618 -13.503 2.482 1.00 16.69 1PTF 714
714 ATOM 610 O LYS 83 24.799 -13.332 2.074 1.00 15.19 1PTF 715
715 ATOM 611 CB LYS 83 22.259 -15.032 0.996 1.00 13.72 1PTF 716
716 ATOM 612 N GLU 84 22.915 -12.508 3.012 1.00 10.80 1PTF 717
717 ATOM 613 CA GLU 84 23.501 -11.153 3.131 1.00 10.56 1PTF 718
718 ATOM 614 C GLU 84 24.351 -11.069 4.402 1.00 10.85 1PTF 719
719 ATOM 615 O GLU 84 24.933 -10.004 4.623 1.00 14.42 1PTF 720
720 ATOM 616 CB GLU 84 22.333 -10.151 3.338 1.00 9.12 1PTF 721
721 ATOM 617 CG GLU 84 21.498 -9.932 2.068 1.00 9.93 1PTF 722
722 ATOM 618 CD GLU 84 20.604 -8.715 2.234 1.00 22.76 1PTF 723
723 ATOM 619 OE1 GLU 84 20.976 -7.597 2.571 1.00 21.71 1PTF 724
724 ATOM 620 OE2 GLU 84 19.420 -8.978 2.012 1.00 34.46 1PTF 725
725 ATOM 621 N GLY 85 24.360 -12.084 5.246 1.00 8.78 1PTF 726
726 ATOM 622 CA GLY 85 25.098 -12.029 6.511 1.00 10.78 1PTF 727
727 ATOM 623 C GLY 85 24.473 -11.048 7.483 1.00 10.75 1PTF 728
728 ATOM 624 O GLY 85 25.152 -10.602 8.432 1.00 12.42 1PTF 729
729 ATOM 625 N LEU 86 23.148 -10.868 7.383 1.00 8.47 1PTF 730
730 ATOM 626 CA LEU 86 22.450 -9.958 8.311 1.00 9.12 1PTF 731
731 ATOM 627 C LEU 86 22.106 -10.651 9.610 1.00 12.83 1PTF 732
732 ATOM 628 O LEU 86 22.213 -9.989 10.661 1.00 15.67 1PTF 733
733 ATOM 629 CB LEU 86 21.202 -9.397 7.610 1.00 11.41 1PTF 734
734 ATOM 630 CG LEU 86 21.354 -8.100 6.854 1.00 18.66 1PTF 735
735 ATOM 631 CD1 LEU 86 20.036 -7.790 6.152 1.00 12.08 1PTF 736
736 ATOM 632 CD2 LEU 86 21.768 -6.975 7.813 1.00 16.86 1PTF 737
737 ATOM 633 N ALA 87 21.741 -11.918 9.562 1.00 13.14 1PTF 738
738 ATOM 634 CA ALA 87 21.345 -12.636 10.797 1.00 22.21 1PTF 739
739 ATOM 635 C ALA 87 21.685 -14.128 10.678 1.00 30.34 1PTF 740
740 ATOM 636 O ALA 87 21.867 -14.555 9.501 1.00 36.61 1PTF 741
741 ATOM 637 CB ALA 87 19.832 -12.490 11.001 1.00 27.80 1PTF 742
742 TER 638 ALA 87 1PTF 743
743 HETATM 639 O HOH 90 7.815 -20.542 5.137 1.00 27.90 1PTF 744
744 HETATM 640 O HOH 91 11.690 -6.251 23.684 1.00 34.84 1PTF 745
745 HETATM 641 O HOH 92 6.071 1.686 7.364 1.00 15.26 1PTF 746
746 HETATM 642 O HOH 93 -3.057 -15.719 8.192 1.00 24.79 1PTF 747
747 HETATM 643 O HOH 94 2.430 -8.819 8.239 1.00 22.79 1PTF 748
748 HETATM 644 O HOH 95 17.597 -5.803 20.763 1.00 12.54 1PTF 749
749 HETATM 645 O HOH 96 13.058 -5.952 19.456 1.00 16.95 1PTF 750
750 HETATM 646 O HOH 97 17.422 0.321 10.207 1.00 11.06 1PTF 751
751 HETATM 647 O HOH 98 12.195 0.912 17.839 1.00 19.58 1PTF 752
752 HETATM 648 O HOH 99 6.786 -8.332 13.029 1.00 18.86 1PTF 753
753 HETATM 649 O HOH 100 25.444 -1.348 13.748 1.00 23.18 1PTF 754
754 HETATM 650 O HOH 101 10.954 -17.190 15.505 1.00 15.73 1PTF 755
755 HETATM 651 O HOH 102 14.493 -20.378 3.722 1.00 7.42 1PTF 756
756 HETATM 652 O HOH 103 3.926 -5.113 3.616 1.00 10.56 1PTF 757
757 HETATM 653 O HOH 104 20.248 -1.946 -3.791 1.00 40.81 1PTF 758
758 HETATM 654 O HOH 105 15.862 -21.609 0.746 1.00 16.84 1PTF 759
759 HETATM 655 O HOH 106 1.687 -19.496 0.842 1.00 24.14 1PTF 760
760 HETATM 656 O HOH 107 24.844 -11.158 -0.121 1.00 14.44 1PTF 761
761 HETATM 657 O HOH 108 31.367 -4.258 17.020 1.00 11.95 1PTF 762
762 HETATM 658 O HOH 109 12.932 -21.669 5.750 1.00 36.61 1PTF 763
763 HETATM 659 O HOH 110 14.090 -17.898 14.543 1.00 25.40 1PTF 764
764 HETATM 660 O HOH 111 19.085 -15.065 14.025 1.00 16.11 1PTF 765
765 HETATM 661 O HOH 112 32.133 -1.787 13.897 1.00 26.74 1PTF 766
766 HETATM 662 O HOH 113 27.912 -4.282 3.389 1.00 24.10 1PTF 767
767 HETATM 663 O HOH 114 27.091 -8.595 5.024 1.00 55.34 1PTF 768
768 HETATM 664 O HOH 115 16.819 -0.588 -4.457 1.00 42.40 1PTF 769
769 HETATM 665 O HOH 116 12.913 0.179 -2.137 1.00 11.08 1PTF 770
770 HETATM 666 O HOH 117 6.153 -3.135 -3.205 1.00 47.51 1PTF 771
771 HETATM 667 O HOH 118 -0.047 -6.560 -1.988 1.00 20.63 1PTF 772
772 HETATM 668 O HOH 119 2.549 -3.984 5.980 1.00 45.70 1PTF 773
773 HETATM 669 O HOH 120 19.879 -0.555 16.989 1.00 22.96 1PTF 774
774 HETATM 670 O HOH 121 9.486 -16.036 17.327 1.00 65.53 1PTF 775
775 HETATM 671 O HOH 122 4.384 -14.317 -5.084 1.00 25.89 1PTF 776
776 HETATM 672 O HOH 123 8.458 5.268 10.226 1.00 17.17 1PTF 777
777 HETATM 673 O HOH 124 19.741 -19.242 -5.786 1.00 16.87 1PTF 778
778 HETATM 674 O HOH 125 22.286 -20.946 -3.375 1.00 16.66 1PTF 779
779 HETATM 675 O HOH 127 17.530 -15.913 16.654 1.00 62.09 1PTF 780
780 HETATM 676 O HOH 128 13.597 -14.382 -3.873 1.00 55.41 1PTF 781
781 HETATM 677 O HOH 129 0.831 -21.779 3.289 1.00 47.75 1PTF 782
782 HETATM 678 O HOH 130 -1.582 -18.875 10.051 1.00 4.41 1PTF 783
783 HETATM 679 O HOH 131 1.637 -20.295 6.362 1.00 15.00 1PTF 784
784 HETATM 680 O HOH 132 28.004 -10.075 8.033 1.00 34.24 1PTF 785
785 HETATM 681 O HOH 133 29.782 -0.661 12.854 1.00 14.26 1PTF 786
786 HETATM 682 O HOH 134 15.438 -1.043 -2.048 1.00 7.86 1PTF 787
787 HETATM 683 O HOH 135 4.605 -7.534 -5.284 1.00 53.70 1PTF 788
788 HETATM 684 O HOH 136 2.115 -4.709 1.300 1.00 24.17 1PTF 789
789 HETATM 685 O HOH 137 3.652 -1.948 0.139 1.00 54.66 1PTF 790
790 HETATM 686 O HOH 138 4.892 -6.435 13.914 1.00 33.96 1PTF 791
791 HETATM 687 O HOH 139 18.781 4.532 10.634 1.00 15.40 1PTF 792
792 HETATM 688 O HOH 140 21.796 -2.864 18.984 1.00 21.56 1PTF 793
793 HETATM 689 O HOH 141 10.266 -20.504 6.529 1.00 21.80 1PTF 794
794 HETATM 690 O HOH 142 11.854 -1.770 -3.006 1.00 18.25 1PTF 795
795 HETATM 691 O HOH 143 16.630 -13.285 18.590 1.00 46.13 1PTF 796
796 HETATM 692 O HOH 144 28.968 -10.468 11.897 1.00 31.23 1PTF 797
797 HETATM 693 O HOH 145 4.178 0.317 15.648 1.00 16.30 1PTF 798
798 HETATM 694 O HOH 146 24.752 -15.115 7.885 1.00 44.14 1PTF 799
799 HETATM 695 O HOH 147 25.886 -15.423 -1.164 1.00 36.76 1PTF 800
800 HETATM 696 O HOH 148 23.330 -8.791 -5.075 1.00 25.70 1PTF 801
801 HETATM 697 O HOH 149 20.970 -19.976 -1.010 1.00 25.49 1PTF 802
802 HETATM 698 O HOH 150 13.384 7.518 6.606 1.00 46.74 1PTF 803
803 HETATM 699 O HOH 151 9.853 -20.214 13.028 1.00 41.55 1PTF 804
804 HETATM 700 O HOH 152 3.836 -6.324 19.367 1.00 85.44 1PTF 805
805 HETATM 701 O HOH 153 30.860 -4.971 6.968 1.00 77.37 1PTF 806
806 HETATM 702 O HOH 154 27.479 -5.999 5.555 1.00 34.61 1PTF 807
807 HETATM 703 O HOH 155 20.050 -3.081 -7.481 1.00 53.12 1PTF 808
808 HETATM 704 O HOH 156 0.012 -7.299 -4.312 1.00 41.17 1PTF 809
809 HETATM 705 O HOH 157 2.907 1.000 4.740 1.00 38.10 1PTF 810
810 HETATM 706 O HOH 159 29.189 -6.994 8.797 1.00 58.78 1PTF 811
811 HETATM 707 O HOH 160 19.115 -3.338 20.364 1.00 26.75 1PTF 812
812 HETATM 708 O HOH 161 14.155 -6.379 22.083 1.00 53.08 1PTF 813
813 HETATM 709 O HOH 162 11.349 -8.089 18.605 1.00 52.46 1PTF 814
814 HETATM 710 O HOH 163 10.795 1.439 20.448 1.00 50.30 1PTF 815
815 HETATM 711 O HOH 164 13.232 -19.988 13.181 1.00 20.77 1PTF 816
816 HETATM 712 O HOH 166 20.714 3.189 4.645 1.00 22.68 1PTF 817
817 HETATM 713 O HOH 167 -2.384 -9.839 3.262 1.00 34.46 1PTF 818
818 HETATM 714 O HOH 168 9.193 -5.776 18.999 1.00 32.42 1PTF 819
819 HETATM 715 O HOH 169 4.452 -9.519 18.970 1.00 21.10 1PTF 820
820 HETATM 716 O HOH 170 4.388 -9.461 15.676 1.00 66.17 1PTF 821
821 HETATM 717 O HOH 171 17.452 -20.893 3.970 1.00 32.84 1PTF 822
822 HETATM 718 O HOH 172 21.850 -14.859 13.048 1.00 51.54 1PTF 823
823 HETATM 719 O HOH 173 2.810 -5.712 -2.563 1.00 33.62 1PTF 824
824 HETATM 720 O HOH 174 -3.789 -13.833 8.873 1.00 17.08 1PTF 825
825 HETATM 721 O HOH 175 23.515 -15.091 16.865 1.00 44.46 1PTF 826
826 HETATM 722 O HOH 176 2.890 -7.037 12.174 1.00 35.42 1PTF 827
827 HETATM 723 O HOH 177 21.711 -19.649 3.184 1.00 93.19 1PTF 828
828 HETATM 724 O HOH 178 22.565 -11.281 -1.237 1.00 48.03 1PTF 829
829 HETATM 725 O HOH 179 0.910 -19.485 -1.616 1.00 12.03 1PTF 830
830 HETATM 726 O HOH 180 15.819 -16.787 13.018 1.00 38.04 1PTF 831
831 HETATM 727 O HOH 181 18.289 -16.237 8.167 1.00 24.80 1PTF 832
832 HETATM 728 O HOH 182 0.331 -22.234 -0.650 1.00 18.43 1PTF 833
833 HETATM 729 O HOH 183 1.180 -19.668 11.879 1.00 13.24 1PTF 834
834 HETATM 730 O HOH 184 7.842 -19.560 10.325 1.00 36.56 1PTF 835
835 HETATM 731 O HOH 185 0.936 -8.586 -7.679 1.00 39.98 1PTF 836
836 HETATM 732 O HOH 186 3.542 0.354 8.323 1.00 42.47 1PTF 837
837 HETATM 733 O HOH 187 3.082 -2.545 16.747 1.00 66.65 1PTF 838
838 HETATM 734 O HOH 188 12.182 -3.514 23.845 1.00 32.81 1PTF 839
839 HETATM 735 O HOH 189 5.540 2.706 12.274 1.00 29.37 1PTF 840
840 HETATM 736 O HOH 190 9.676 4.513 19.176 1.00 28.06 1PTF 841
841 HETATM 737 O HOH 191 6.737 0.687 -0.212 1.00 63.76 1PTF 842
842 MASTER 65 0 0 3 4 5 0 6 736 1 0 7 1PTF 843
projects / unres.git / blob