1 HEADER DE NOVO PROTEIN 09-MAY-02 1LQ7
2 TITLE DE NOVO DESIGNED PROTEIN MODEL OF RADICAL ENZYMES
4 COMPND 2 MOLECULE: ALPHA3W;
6 COMPND 4 ENGINEERED: YES;
7 COMPND 5 OTHER_DETAILS: PROTEIN MODEL FOR TRYPTOPHANYL RADICAL
9 SOURCE 2 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
10 SOURCE 3 EXPRESSION_SYSTEM_COMMON: BACTERIA;
11 SOURCE 4 EXPRESSION_SYSTEM_STRAIN: DH5ALPHA;
12 SOURCE 5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
13 SOURCE 6 EXPRESSION_SYSTEM_PLASMID: PET32;
14 SOURCE 7 OTHER_DETAILS: DE NOVO DESIGN/SYNTHETIC GENE: GENE
15 SOURCE 8 GENERATED USING OVERLAPPING PCR METHOD FROM SYNTHETIC
17 KEYWDS THREE HELIX BUNDLE
18 EXPDTA NMR, 16 STRUCTURES
19 AUTHOR Q.-H.DAI,C.TOMMOS,E.J.FUENTES,M.BLOMBERG,P.L.DUTTON,A.J.WAND
20 REVDAT 2 18-DEC-02 1LQ7 1 JRNL
21 REVDAT 1 05-JUN-02 1LQ7 0
22 JRNL AUTH Q.-H.DAI,C.TOMMOS,E.J.FUENTES,M.BLOMBERG,
23 JRNL AUTH 2 P.L.DUTTON,A.J.WAND
24 JRNL TITL STRUCTURE OF A DE NOVO DESIGNED PROTEIN MODEL OF
25 JRNL TITL 2 RADICAL ENZYMES
26 JRNL REF J.AM.CHEM.SOC. V. 124 10952 2002
27 JRNL REFN ASTM JACSAT US ISSN 0002-7863
30 REMARK 1 AUTH C.TOMMOS,J.J.SKALICKY,D.L.PILLOUD,A.J.WAND,
31 REMARK 1 AUTH 2 P.L.DUTTON
32 REMARK 1 TITL DE NOVO PROTEINS AS MODELS OF RADICAL ENZYMES
33 REMARK 1 REF BIOCHEMISTRY V. 38 9495 1999
34 REMARK 1 REFN ASTM BICHAW US ISSN 0006-2960
36 REMARK 2 RESOLUTION. NOT APPLICABLE.
39 REMARK 3 PROGRAM : DYANA 1.5
40 REMARK 3 AUTHORS : GNTERT, C. MUMENTHALER, K. WUTHRICH
42 REMARK 3 OTHER REFINEMENT REMARKS: 1130 NOES, 43 PHI RESTRAINTS
44 REMARK 4 1LQ7 COMPLIES WITH FORMAT V. 2.3, 09-JULY-1998
46 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-MAY-2002.
47 REMARK 100 THE RCSB ID CODE IS RCSB016177.
49 REMARK 210 EXPERIMENTAL DETAILS
50 REMARK 210 EXPERIMENT TYPE : NMR
51 REMARK 210 TEMPERATURE (KELVIN) : 301; 301
52 REMARK 210 PH : 5.5; 5.5
53 REMARK 210 IONIC STRENGTH : 70 MM; 70 MM
54 REMARK 210 PRESSURE : AMBIENT; AMBIENT
55 REMARK 210 SAMPLE CONTENTS : 0.85 MM U-15N,13C-A3W, 20 MM
56 REMARK 210 ACETATE, 50 MM KCL; 0.85 MM U-
57 REMARK 210 15N,13C-A3W, 20 MM ACETATE, 50
60 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 4D_
61 REMARK 210 13C-SEPARATED_NOESY, HNHA
62 REMARK 210 SPECTROMETER FIELD STRENGTH : 750 MHZ
63 REMARK 210 SPECTROMETER MODEL : INOVA
64 REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
66 REMARK 210 STRUCTURE DETERMINATION.
67 REMARK 210 SOFTWARE USED : NULL
68 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS
70 REMARK 210 CONFORMERS, NUMBER CALCULATED : 30
71 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 16
72 REMARK 210 CONFORMERS, SELECTION CRITERIA : LOWEST REFINEMENT FUNCTION
73 REMARK 210 PENALTY, BEST CHEMICAL SHIFT
76 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 16
78 REMARK 210 REMARK: NULL
81 REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION
82 REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT
83 REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON
84 REMARK 215 THESE RECORDS ARE MEANINGLESS.
86 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
87 REMARK 500 SUBTOPIC: TORSION ANGLES
89 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
90 REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
91 REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
93 REMARK 500 STANDARD TABLE:
94 REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
96 REMARK 500 M RES CSSEQI PSI PHI
97 REMARK 500 1 ARG A 3 -59.28 69.36
98 REMARK 500 6 SER A 2 -61.08 71.31
99 REMARK 500 7 ARG A 3 -63.68 70.16
100 REMARK 500 8 ARG A 3 -68.38 66.22
101 REMARK 500 13 ARG A 3 -70.76 76.32
102 REMARK 500 16 ARG A 3 -69.60 65.18
105 REMARK 999 AN APPROPRIATE SEQUENCE DATABASE REFERENCE
106 REMARK 999 WAS NOT AVAILABLE AT THE TIME OF PROCESSING.
107 SEQRES 1 A 67 GLY SER ARG VAL LYS ALA LEU GLU GLU LYS VAL LYS ALA
108 SEQRES 2 A 67 LEU GLU GLU LYS VAL LYS ALA LEU GLY GLY GLY GLY ARG
109 SEQRES 3 A 67 ILE GLU GLU LEU LYS LYS LYS TRP GLU GLU LEU LYS LYS
110 SEQRES 4 A 67 LYS ILE GLU GLU LEU GLY GLY GLY GLY GLU VAL LYS LYS
111 SEQRES 5 A 67 VAL GLU GLU GLU VAL LYS LYS LEU GLU GLU GLU ILE LYS
112 SEQRES 6 A 67 LYS LEU
113 HELIX 1 1 ARG A 3 LEU A 21 1 19
114 HELIX 2 2 ARG A 26 LEU A 44 1 19
115 HELIX 3 3 GLU A 49 LEU A 67 1 19
116 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
117 ORIGX1 1.000000 0.000000 0.000000 0.00000
118 ORIGX2 0.000000 1.000000 0.000000 0.00000
119 ORIGX3 0.000000 0.000000 1.000000 0.00000
120 SCALE1 1.000000 0.000000 0.000000 0.00000
121 SCALE2 0.000000 1.000000 0.000000 0.00000
122 SCALE3 0.000000 0.000000 1.000000 0.00000
124 ATOM 1 N GLY A 1 -9.007 -15.511 -4.646 1.00 0.00 N
125 ATOM 2 CA GLY A 1 -8.202 -15.036 -3.535 1.00 0.00 C
126 ATOM 3 C GLY A 1 -6.864 -14.478 -4.026 1.00 0.00 C
127 ATOM 4 O GLY A 1 -5.815 -15.074 -3.791 1.00 0.00 O
128 ATOM 5 H GLY A 1 -8.733 -16.397 -5.019 1.00 0.00 H
129 ATOM 6 1HA GLY A 1 -8.744 -14.263 -2.991 1.00 0.00 H
130 ATOM 7 2HA GLY A 1 -8.024 -15.853 -2.834 1.00 0.00 H
131 ATOM 8 N SER A 2 -6.946 -13.339 -4.698 1.00 0.00 N
132 ATOM 9 CA SER A 2 -5.756 -12.694 -5.224 1.00 0.00 C
133 ATOM 10 C SER A 2 -5.207 -11.695 -4.203 1.00 0.00 C
134 ATOM 11 O SER A 2 -3.995 -11.604 -4.007 1.00 0.00 O
135 ATOM 12 CB SER A 2 -6.051 -11.989 -6.549 1.00 0.00 C
136 ATOM 13 OG SER A 2 -5.662 -12.776 -7.672 1.00 0.00 O
137 ATOM 14 H SER A 2 -7.804 -12.860 -4.884 1.00 0.00 H
138 ATOM 15 HA SER A 2 -5.041 -13.500 -5.393 1.00 0.00 H
139 ATOM 16 1HB SER A 2 -7.118 -11.769 -6.613 1.00 0.00 H
140 ATOM 17 2HB SER A 2 -5.528 -11.033 -6.577 1.00 0.00 H
141 ATOM 18 HG SER A 2 -5.792 -12.256 -8.516 1.00 0.00 H
142 ATOM 19 N ARG A 3 -6.124 -10.971 -3.579 1.00 0.00 N
143 ATOM 20 CA ARG A 3 -5.747 -9.983 -2.583 1.00 0.00 C
144 ATOM 21 C ARG A 3 -5.037 -8.803 -3.248 1.00 0.00 C
145 ATOM 22 O ARG A 3 -5.491 -7.663 -3.149 1.00 0.00 O
146 ATOM 23 CB ARG A 3 -4.826 -10.592 -1.523 1.00 0.00 C
147 ATOM 24 CG ARG A 3 -5.559 -10.758 -0.190 1.00 0.00 C
148 ATOM 25 CD ARG A 3 -5.959 -12.217 0.038 1.00 0.00 C
149 ATOM 26 NE ARG A 3 -7.097 -12.288 0.980 1.00 0.00 N
150 ATOM 27 CZ ARG A 3 -7.570 -13.428 1.502 1.00 0.00 C
151 ATOM 28 NH1 ARG A 3 -7.006 -14.599 1.177 1.00 0.00 N
152 ATOM 29 NH2 ARG A 3 -8.609 -13.396 2.349 1.00 0.00 N
153 ATOM 30 H ARG A 3 -7.108 -11.052 -3.743 1.00 0.00 H
154 ATOM 31 HA ARG A 3 -6.689 -9.670 -2.130 1.00 0.00 H
155 ATOM 32 1HB ARG A 3 -4.463 -11.561 -1.866 1.00 0.00 H
156 ATOM 33 2HB ARG A 3 -3.953 -9.955 -1.386 1.00 0.00 H
157 ATOM 34 1HG ARG A 3 -4.918 -10.421 0.625 1.00 0.00 H
158 ATOM 35 2HG ARG A 3 -6.448 -10.127 -0.178 1.00 0.00 H
159 ATOM 36 1HD ARG A 3 -6.230 -12.680 -0.910 1.00 0.00 H
160 ATOM 37 2HD ARG A 3 -5.112 -12.776 0.435 1.00 0.00 H
161 ATOM 38 HE ARG A 3 -7.542 -11.432 1.243 1.00 0.00 H
162 ATOM 39 1HH1 ARG A 3 -6.232 -14.622 0.545 1.00 0.00 H
163 ATOM 40 2HH1 ARG A 3 -7.359 -15.450 1.567 1.00 0.00 H
164 ATOM 41 1HH2 ARG A 3 -9.031 -12.523 2.591 1.00 0.00 H
165 ATOM 42 2HH2 ARG A 3 -8.962 -14.248 2.738 1.00 0.00 H
166 ATOM 43 N VAL A 4 -3.933 -9.115 -3.912 1.00 0.00 N
167 ATOM 44 CA VAL A 4 -3.156 -8.094 -4.594 1.00 0.00 C
168 ATOM 45 C VAL A 4 -4.067 -7.316 -5.546 1.00 0.00 C
169 ATOM 46 O VAL A 4 -3.850 -6.130 -5.786 1.00 0.00 O
170 ATOM 47 CB VAL A 4 -1.958 -8.733 -5.301 1.00 0.00 C
171 ATOM 48 CG1 VAL A 4 -2.355 -10.056 -5.962 1.00 0.00 C
172 ATOM 49 CG2 VAL A 4 -1.348 -7.772 -6.321 1.00 0.00 C
173 ATOM 50 H VAL A 4 -3.571 -10.043 -3.988 1.00 0.00 H
174 ATOM 51 HA VAL A 4 -2.774 -7.411 -3.836 1.00 0.00 H
175 ATOM 52 HB VAL A 4 -1.201 -8.949 -4.547 1.00 0.00 H
176 ATOM 53 1HG1 VAL A 4 -3.441 -10.111 -6.041 1.00 0.00 H
177 ATOM 54 2HG1 VAL A 4 -1.915 -10.110 -6.957 1.00 0.00 H
178 ATOM 55 3HG1 VAL A 4 -1.992 -10.887 -5.358 1.00 0.00 H
179 ATOM 56 1HG2 VAL A 4 -0.343 -8.106 -6.579 1.00 0.00 H
180 ATOM 57 2HG2 VAL A 4 -1.966 -7.754 -7.219 1.00 0.00 H
181 ATOM 58 3HG2 VAL A 4 -1.299 -6.770 -5.893 1.00 0.00 H
182 ATOM 59 N LYS A 5 -5.066 -8.016 -6.061 1.00 0.00 N
183 ATOM 60 CA LYS A 5 -6.011 -7.405 -6.981 1.00 0.00 C
184 ATOM 61 C LYS A 5 -6.755 -6.276 -6.267 1.00 0.00 C
185 ATOM 62 O LYS A 5 -6.691 -5.121 -6.688 1.00 0.00 O
186 ATOM 63 CB LYS A 5 -6.935 -8.467 -7.582 1.00 0.00 C
187 ATOM 64 CG LYS A 5 -7.983 -7.827 -8.495 1.00 0.00 C
188 ATOM 65 CD LYS A 5 -7.456 -7.690 -9.924 1.00 0.00 C
189 ATOM 66 CE LYS A 5 -8.598 -7.422 -10.907 1.00 0.00 C
190 ATOM 67 NZ LYS A 5 -8.368 -6.153 -11.633 1.00 0.00 N
191 ATOM 68 H LYS A 5 -5.235 -8.981 -5.860 1.00 0.00 H
192 ATOM 69 HA LYS A 5 -5.436 -6.977 -7.802 1.00 0.00 H
193 ATOM 70 1HB LYS A 5 -6.347 -9.189 -8.149 1.00 0.00 H
194 ATOM 71 2HB LYS A 5 -7.431 -9.016 -6.783 1.00 0.00 H
195 ATOM 72 1HG LYS A 5 -8.890 -8.433 -8.495 1.00 0.00 H
196 ATOM 73 2HG LYS A 5 -8.256 -6.845 -8.109 1.00 0.00 H
197 ATOM 74 1HD LYS A 5 -6.731 -6.878 -9.972 1.00 0.00 H
198 ATOM 75 2HD LYS A 5 -6.932 -8.602 -10.211 1.00 0.00 H
199 ATOM 76 1HE LYS A 5 -8.675 -8.245 -11.617 1.00 0.00 H
200 ATOM 77 2HE LYS A 5 -9.544 -7.373 -10.370 1.00 0.00 H
201 ATOM 78 1HZ LYS A 5 -8.303 -5.400 -10.978 1.00 0.00 H
202 ATOM 79 2HZ LYS A 5 -7.516 -6.217 -12.155 1.00 0.00 H
203 ATOM 80 3HZ LYS A 5 -9.130 -5.985 -12.260 1.00 0.00 H
204 ATOM 81 N ALA A 6 -7.443 -6.647 -5.197 1.00 0.00 N
205 ATOM 82 CA ALA A 6 -8.198 -5.679 -4.419 1.00 0.00 C
206 ATOM 83 C ALA A 6 -7.238 -4.638 -3.838 1.00 0.00 C
207 ATOM 84 O ALA A 6 -7.669 -3.585 -3.371 1.00 0.00 O
208 ATOM 85 CB ALA A 6 -8.996 -6.406 -3.335 1.00 0.00 C
209 ATOM 86 H ALA A 6 -7.489 -7.587 -4.861 1.00 0.00 H
210 ATOM 87 HA ALA A 6 -8.895 -5.182 -5.095 1.00 0.00 H
211 ATOM 88 1HB ALA A 6 -8.583 -6.163 -2.356 1.00 0.00 H
212 ATOM 89 2HB ALA A 6 -10.038 -6.089 -3.378 1.00 0.00 H
213 ATOM 90 3HB ALA A 6 -8.936 -7.481 -3.498 1.00 0.00 H
214 ATOM 91 N LEU A 7 -5.957 -4.970 -3.888 1.00 0.00 N
215 ATOM 92 CA LEU A 7 -4.933 -4.076 -3.371 1.00 0.00 C
216 ATOM 93 C LEU A 7 -4.545 -3.071 -4.458 1.00 0.00 C
217 ATOM 94 O LEU A 7 -4.553 -1.864 -4.224 1.00 0.00 O
218 ATOM 95 CB LEU A 7 -3.750 -4.877 -2.824 1.00 0.00 C
219 ATOM 96 CG LEU A 7 -3.600 -4.894 -1.302 1.00 0.00 C
220 ATOM 97 CD1 LEU A 7 -3.641 -3.475 -0.730 1.00 0.00 C
221 ATOM 98 CD2 LEU A 7 -4.648 -5.802 -0.658 1.00 0.00 C
222 ATOM 99 H LEU A 7 -5.615 -5.828 -4.270 1.00 0.00 H
223 ATOM 100 HA LEU A 7 -5.367 -3.530 -2.535 1.00 0.00 H
224 ATOM 101 1HB LEU A 7 -3.841 -5.906 -3.172 1.00 0.00 H
225 ATOM 102 2HB LEU A 7 -2.833 -4.474 -3.255 1.00 0.00 H
226 ATOM 103 HG LEU A 7 -2.621 -5.310 -1.060 1.00 0.00 H
227 ATOM 104 1HD1 LEU A 7 -3.150 -3.461 0.242 1.00 0.00 H
228 ATOM 105 2HD1 LEU A 7 -3.126 -2.795 -1.408 1.00 0.00 H
229 ATOM 106 3HD1 LEU A 7 -4.678 -3.159 -0.619 1.00 0.00 H
230 ATOM 107 1HD2 LEU A 7 -4.481 -5.845 0.418 1.00 0.00 H
231 ATOM 108 2HD2 LEU A 7 -5.644 -5.405 -0.855 1.00 0.00 H
232 ATOM 109 3HD2 LEU A 7 -4.568 -6.806 -1.078 1.00 0.00 H
233 ATOM 110 N GLU A 8 -4.214 -3.606 -5.625 1.00 0.00 N
234 ATOM 111 CA GLU A 8 -3.823 -2.772 -6.748 1.00 0.00 C
235 ATOM 112 C GLU A 8 -4.646 -1.482 -6.762 1.00 0.00 C
236 ATOM 113 O GLU A 8 -4.153 -0.431 -7.168 1.00 0.00 O
237 ATOM 114 CB GLU A 8 -3.968 -3.528 -8.070 1.00 0.00 C
238 ATOM 115 CG GLU A 8 -3.345 -2.740 -9.224 1.00 0.00 C
239 ATOM 116 CD GLU A 8 -4.254 -2.760 -10.455 1.00 0.00 C
240 ATOM 117 OE1 GLU A 8 -5.362 -2.193 -10.351 1.00 0.00 O
241 ATOM 118 OE2 GLU A 8 -3.818 -3.342 -11.472 1.00 0.00 O
242 ATOM 119 H GLU A 8 -4.210 -4.590 -5.808 1.00 0.00 H
243 ATOM 120 HA GLU A 8 -2.772 -2.538 -6.582 1.00 0.00 H
244 ATOM 121 1HB GLU A 8 -3.487 -4.504 -7.989 1.00 0.00 H
245 ATOM 122 2HB GLU A 8 -5.023 -3.710 -8.276 1.00 0.00 H
246 ATOM 123 1HG GLU A 8 -3.171 -1.710 -8.912 1.00 0.00 H
247 ATOM 124 2HG GLU A 8 -2.374 -3.165 -9.477 1.00 0.00 H
248 ATOM 125 N GLU A 9 -5.887 -1.605 -6.313 1.00 0.00 N
249 ATOM 126 CA GLU A 9 -6.783 -0.461 -6.269 1.00 0.00 C
250 ATOM 127 C GLU A 9 -6.307 0.546 -5.221 1.00 0.00 C
251 ATOM 128 O GLU A 9 -6.128 1.725 -5.525 1.00 0.00 O
252 ATOM 129 CB GLU A 9 -8.221 -0.902 -5.991 1.00 0.00 C
253 ATOM 130 CG GLU A 9 -9.219 -0.046 -6.772 1.00 0.00 C
254 ATOM 131 CD GLU A 9 -9.402 1.323 -6.113 1.00 0.00 C
255 ATOM 132 OE1 GLU A 9 -10.349 1.442 -5.306 1.00 0.00 O
256 ATOM 133 OE2 GLU A 9 -8.590 2.219 -6.432 1.00 0.00 O
257 ATOM 134 H GLU A 9 -6.280 -2.462 -5.984 1.00 0.00 H
258 ATOM 135 HA GLU A 9 -6.732 -0.015 -7.262 1.00 0.00 H
259 ATOM 136 1HB GLU A 9 -8.343 -1.951 -6.264 1.00 0.00 H
260 ATOM 137 2HB GLU A 9 -8.429 -0.826 -4.923 1.00 0.00 H
261 ATOM 138 1HG GLU A 9 -8.869 0.084 -7.796 1.00 0.00 H
262 ATOM 139 2HG GLU A 9 -10.179 -0.558 -6.827 1.00 0.00 H
263 ATOM 140 N LYS A 10 -6.114 0.046 -4.010 1.00 0.00 N
264 ATOM 141 CA LYS A 10 -5.661 0.889 -2.915 1.00 0.00 C
265 ATOM 142 C LYS A 10 -4.313 1.512 -3.282 1.00 0.00 C
266 ATOM 143 O LYS A 10 -4.156 2.731 -3.236 1.00 0.00 O
267 ATOM 144 CB LYS A 10 -5.638 0.099 -1.606 1.00 0.00 C
268 ATOM 145 CG LYS A 10 -5.827 1.025 -0.403 1.00 0.00 C
269 ATOM 146 CD LYS A 10 -7.267 1.539 -0.326 1.00 0.00 C
270 ATOM 147 CE LYS A 10 -7.825 1.394 1.090 1.00 0.00 C
271 ATOM 148 NZ LYS A 10 -7.913 -0.034 1.471 1.00 0.00 N
272 ATOM 149 H LYS A 10 -6.262 -0.913 -3.771 1.00 0.00 H
273 ATOM 150 HA LYS A 10 -6.391 1.689 -2.796 1.00 0.00 H
274 ATOM 151 1HB LYS A 10 -6.425 -0.655 -1.616 1.00 0.00 H
275 ATOM 152 2HB LYS A 10 -4.690 -0.433 -1.514 1.00 0.00 H
276 ATOM 153 1HG LYS A 10 -5.578 0.492 0.515 1.00 0.00 H
277 ATOM 154 2HG LYS A 10 -5.140 1.869 -0.477 1.00 0.00 H
278 ATOM 155 1HD LYS A 10 -7.300 2.585 -0.630 1.00 0.00 H
279 ATOM 156 2HD LYS A 10 -7.892 0.983 -1.027 1.00 0.00 H
280 ATOM 157 1HE LYS A 10 -7.187 1.926 1.796 1.00 0.00 H
281 ATOM 158 2HE LYS A 10 -8.813 1.853 1.146 1.00 0.00 H
282 ATOM 159 1HZ LYS A 10 -6.992 -0.415 1.545 1.00 0.00 H
283 ATOM 160 2HZ LYS A 10 -8.380 -0.116 2.350 1.00 0.00 H
284 ATOM 161 3HZ LYS A 10 -8.426 -0.534 0.772 1.00 0.00 H
285 ATOM 162 N VAL A 11 -3.373 0.647 -3.637 1.00 0.00 N
286 ATOM 163 CA VAL A 11 -2.044 1.098 -4.011 1.00 0.00 C
287 ATOM 164 C VAL A 11 -2.162 2.209 -5.055 1.00 0.00 C
288 ATOM 165 O VAL A 11 -1.671 3.318 -4.846 1.00 0.00 O
289 ATOM 166 CB VAL A 11 -1.206 -0.088 -4.491 1.00 0.00 C
290 ATOM 167 CG1 VAL A 11 0.273 0.293 -4.598 1.00 0.00 C
291 ATOM 168 CG2 VAL A 11 -1.395 -1.300 -3.576 1.00 0.00 C
292 ATOM 169 H VAL A 11 -3.510 -0.343 -3.672 1.00 0.00 H
293 ATOM 170 HA VAL A 11 -1.572 1.506 -3.117 1.00 0.00 H
294 ATOM 171 HB VAL A 11 -1.553 -0.363 -5.487 1.00 0.00 H
295 ATOM 172 1HG1 VAL A 11 0.380 1.146 -5.267 1.00 0.00 H
296 ATOM 173 2HG1 VAL A 11 0.652 0.556 -3.611 1.00 0.00 H
297 ATOM 174 3HG1 VAL A 11 0.838 -0.552 -4.992 1.00 0.00 H
298 ATOM 175 1HG2 VAL A 11 -0.526 -1.954 -3.655 1.00 0.00 H
299 ATOM 176 2HG2 VAL A 11 -1.503 -0.963 -2.545 1.00 0.00 H
300 ATOM 177 3HG2 VAL A 11 -2.289 -1.846 -3.877 1.00 0.00 H
301 ATOM 178 N LYS A 12 -2.815 1.874 -6.158 1.00 0.00 N
302 ATOM 179 CA LYS A 12 -3.004 2.831 -7.236 1.00 0.00 C
303 ATOM 180 C LYS A 12 -3.517 4.151 -6.657 1.00 0.00 C
304 ATOM 181 O LYS A 12 -3.159 5.224 -7.138 1.00 0.00 O
305 ATOM 182 CB LYS A 12 -3.907 2.242 -8.321 1.00 0.00 C
306 ATOM 183 CG LYS A 12 -4.589 3.350 -9.127 1.00 0.00 C
307 ATOM 184 CD LYS A 12 -4.651 2.989 -10.612 1.00 0.00 C
308 ATOM 185 CE LYS A 12 -3.386 3.446 -11.341 1.00 0.00 C
309 ATOM 186 NZ LYS A 12 -3.698 3.820 -12.738 1.00 0.00 N
310 ATOM 187 H LYS A 12 -3.211 0.971 -6.320 1.00 0.00 H
311 ATOM 188 HA LYS A 12 -2.029 3.008 -7.690 1.00 0.00 H
312 ATOM 189 1HB LYS A 12 -3.318 1.613 -8.989 1.00 0.00 H
313 ATOM 190 2HB LYS A 12 -4.662 1.602 -7.865 1.00 0.00 H
314 ATOM 191 1HG LYS A 12 -5.597 3.512 -8.747 1.00 0.00 H
315 ATOM 192 2HG LYS A 12 -4.045 4.285 -8.999 1.00 0.00 H
316 ATOM 193 1HD LYS A 12 -4.770 1.911 -10.725 1.00 0.00 H
317 ATOM 194 2HD LYS A 12 -5.525 3.455 -11.067 1.00 0.00 H
318 ATOM 195 1HE LYS A 12 -2.947 4.297 -10.820 1.00 0.00 H
319 ATOM 196 2HE LYS A 12 -2.644 2.648 -11.330 1.00 0.00 H
320 ATOM 197 1HZ LYS A 12 -4.659 4.090 -12.804 1.00 0.00 H
321 ATOM 198 2HZ LYS A 12 -3.117 4.585 -13.016 1.00 0.00 H
322 ATOM 199 3HZ LYS A 12 -3.530 3.038 -13.338 1.00 0.00 H
323 ATOM 200 N ALA A 13 -4.349 4.026 -5.633 1.00 0.00 N
324 ATOM 201 CA ALA A 13 -4.915 5.197 -4.984 1.00 0.00 C
325 ATOM 202 C ALA A 13 -3.856 5.838 -4.084 1.00 0.00 C
326 ATOM 203 O ALA A 13 -3.859 7.051 -3.884 1.00 0.00 O
327 ATOM 204 CB ALA A 13 -6.172 4.792 -4.210 1.00 0.00 C
328 ATOM 205 H ALA A 13 -4.635 3.150 -5.248 1.00 0.00 H
329 ATOM 206 HA ALA A 13 -5.195 5.906 -5.763 1.00 0.00 H
330 ATOM 207 1HB ALA A 13 -6.910 5.593 -4.273 1.00 0.00 H
331 ATOM 208 2HB ALA A 13 -6.587 3.881 -4.640 1.00 0.00 H
332 ATOM 209 3HB ALA A 13 -5.915 4.618 -3.166 1.00 0.00 H
333 ATOM 210 N LEU A 14 -2.977 4.993 -3.565 1.00 0.00 N
334 ATOM 211 CA LEU A 14 -1.916 5.462 -2.690 1.00 0.00 C
335 ATOM 212 C LEU A 14 -0.761 5.997 -3.540 1.00 0.00 C
336 ATOM 213 O LEU A 14 0.283 6.372 -3.008 1.00 0.00 O
337 ATOM 214 CB LEU A 14 -1.501 4.361 -1.713 1.00 0.00 C
338 ATOM 215 CG LEU A 14 -2.486 4.063 -0.581 1.00 0.00 C
339 ATOM 216 CD1 LEU A 14 -1.756 3.535 0.656 1.00 0.00 C
340 ATOM 217 CD2 LEU A 14 -3.341 5.291 -0.261 1.00 0.00 C
341 ATOM 218 H LEU A 14 -2.982 4.007 -3.733 1.00 0.00 H
342 ATOM 219 HA LEU A 14 -2.319 6.284 -2.099 1.00 0.00 H
343 ATOM 220 1HB LEU A 14 -1.340 3.443 -2.278 1.00 0.00 H
344 ATOM 221 2HB LEU A 14 -0.543 4.636 -1.272 1.00 0.00 H
345 ATOM 222 HG LEU A 14 -3.164 3.277 -0.915 1.00 0.00 H
346 ATOM 223 1HD1 LEU A 14 -2.359 3.729 1.543 1.00 0.00 H
347 ATOM 224 2HD1 LEU A 14 -1.595 2.462 0.552 1.00 0.00 H
348 ATOM 225 3HD1 LEU A 14 -0.795 4.040 0.753 1.00 0.00 H
349 ATOM 226 1HD2 LEU A 14 -4.004 5.500 -1.101 1.00 0.00 H
350 ATOM 227 2HD2 LEU A 14 -3.935 5.098 0.631 1.00 0.00 H
351 ATOM 228 3HD2 LEU A 14 -2.693 6.150 -0.088 1.00 0.00 H
352 ATOM 229 N GLU A 15 -0.987 6.016 -4.845 1.00 0.00 N
353 ATOM 230 CA GLU A 15 0.021 6.500 -5.773 1.00 0.00 C
354 ATOM 231 C GLU A 15 -0.296 7.933 -6.201 1.00 0.00 C
355 ATOM 232 O GLU A 15 0.558 8.816 -6.108 1.00 0.00 O
356 ATOM 233 CB GLU A 15 0.135 5.577 -6.988 1.00 0.00 C
357 ATOM 234 CG GLU A 15 1.574 5.526 -7.505 1.00 0.00 C
358 ATOM 235 CD GLU A 15 1.694 6.227 -8.861 1.00 0.00 C
359 ATOM 236 OE1 GLU A 15 1.001 7.253 -9.033 1.00 0.00 O
360 ATOM 237 OE2 GLU A 15 2.478 5.721 -9.693 1.00 0.00 O
361 ATOM 238 H GLU A 15 -1.840 5.709 -5.270 1.00 0.00 H
362 ATOM 239 HA GLU A 15 0.959 6.477 -5.218 1.00 0.00 H
363 ATOM 240 1HB GLU A 15 -0.195 4.573 -6.720 1.00 0.00 H
364 ATOM 241 2HB GLU A 15 -0.527 5.928 -7.780 1.00 0.00 H
365 ATOM 242 1HG GLU A 15 2.240 6.002 -6.785 1.00 0.00 H
366 ATOM 243 2HG GLU A 15 1.894 4.489 -7.598 1.00 0.00 H
367 ATOM 244 N GLU A 16 -1.523 8.124 -6.661 1.00 0.00 N
368 ATOM 245 CA GLU A 16 -1.962 9.436 -7.103 1.00 0.00 C
369 ATOM 246 C GLU A 16 -2.069 10.390 -5.912 1.00 0.00 C
370 ATOM 247 O GLU A 16 -1.752 11.572 -6.029 1.00 0.00 O
371 ATOM 248 CB GLU A 16 -3.293 9.344 -7.852 1.00 0.00 C
372 ATOM 249 CG GLU A 16 -3.396 10.434 -8.923 1.00 0.00 C
373 ATOM 250 CD GLU A 16 -4.852 10.848 -9.145 1.00 0.00 C
374 ATOM 251 OE1 GLU A 16 -5.180 11.993 -8.766 1.00 0.00 O
375 ATOM 252 OE2 GLU A 16 -5.604 10.010 -9.689 1.00 0.00 O
376 ATOM 253 H GLU A 16 -2.211 7.401 -6.732 1.00 0.00 H
377 ATOM 254 HA GLU A 16 -1.190 9.784 -7.788 1.00 0.00 H
378 ATOM 255 1HB GLU A 16 -3.386 8.363 -8.319 1.00 0.00 H
379 ATOM 256 2HB GLU A 16 -4.119 9.442 -7.149 1.00 0.00 H
380 ATOM 257 1HG GLU A 16 -2.810 11.301 -8.620 1.00 0.00 H
381 ATOM 258 2HG GLU A 16 -2.970 10.071 -9.858 1.00 0.00 H
382 ATOM 259 N LYS A 17 -2.516 9.840 -4.793 1.00 0.00 N
383 ATOM 260 CA LYS A 17 -2.668 10.626 -3.580 1.00 0.00 C
384 ATOM 261 C LYS A 17 -1.285 10.970 -3.024 1.00 0.00 C
385 ATOM 262 O LYS A 17 -0.911 12.140 -2.959 1.00 0.00 O
386 ATOM 263 CB LYS A 17 -3.571 9.902 -2.580 1.00 0.00 C
387 ATOM 264 CG LYS A 17 -5.037 10.289 -2.784 1.00 0.00 C
388 ATOM 265 CD LYS A 17 -5.964 9.354 -2.005 1.00 0.00 C
389 ATOM 266 CE LYS A 17 -6.715 10.113 -0.910 1.00 0.00 C
390 ATOM 267 NZ LYS A 17 -8.118 9.648 -0.824 1.00 0.00 N
391 ATOM 268 H LYS A 17 -2.771 8.876 -4.705 1.00 0.00 H
392 ATOM 269 HA LYS A 17 -3.171 11.554 -3.854 1.00 0.00 H
393 ATOM 270 1HB LYS A 17 -3.457 8.824 -2.696 1.00 0.00 H
394 ATOM 271 2HB LYS A 17 -3.263 10.147 -1.563 1.00 0.00 H
395 ATOM 272 1HG LYS A 17 -5.193 11.317 -2.457 1.00 0.00 H
396 ATOM 273 2HG LYS A 17 -5.283 10.250 -3.845 1.00 0.00 H
397 ATOM 274 1HD LYS A 17 -6.678 8.893 -2.688 1.00 0.00 H
398 ATOM 275 2HD LYS A 17 -5.382 8.547 -1.560 1.00 0.00 H
399 ATOM 276 1HE LYS A 17 -6.217 9.966 0.050 1.00 0.00 H
400 ATOM 277 2HE LYS A 17 -6.692 11.182 -1.119 1.00 0.00 H
401 ATOM 278 1HZ LYS A 17 -8.594 9.869 -1.675 1.00 0.00 H
402 ATOM 279 2HZ LYS A 17 -8.132 8.658 -0.682 1.00 0.00 H
403 ATOM 280 3HZ LYS A 17 -8.574 10.102 -0.059 1.00 0.00 H
404 ATOM 281 N VAL A 18 -0.562 9.930 -2.636 1.00 0.00 N
405 ATOM 282 CA VAL A 18 0.771 10.106 -2.088 1.00 0.00 C
406 ATOM 283 C VAL A 18 1.543 11.109 -2.947 1.00 0.00 C
407 ATOM 284 O VAL A 18 2.264 11.957 -2.423 1.00 0.00 O
408 ATOM 285 CB VAL A 18 1.474 8.753 -1.973 1.00 0.00 C
409 ATOM 286 CG1 VAL A 18 2.957 8.931 -1.645 1.00 0.00 C
410 ATOM 287 CG2 VAL A 18 0.785 7.864 -0.934 1.00 0.00 C
411 ATOM 288 H VAL A 18 -0.874 8.981 -2.693 1.00 0.00 H
412 ATOM 289 HA VAL A 18 0.662 10.516 -1.083 1.00 0.00 H
413 ATOM 290 HB VAL A 18 1.402 8.255 -2.940 1.00 0.00 H
414 ATOM 291 1HG1 VAL A 18 3.167 9.987 -1.475 1.00 0.00 H
415 ATOM 292 2HG1 VAL A 18 3.202 8.363 -0.746 1.00 0.00 H
416 ATOM 293 3HG1 VAL A 18 3.560 8.570 -2.478 1.00 0.00 H
417 ATOM 294 1HG2 VAL A 18 -0.294 7.906 -1.079 1.00 0.00 H
418 ATOM 295 2HG2 VAL A 18 1.128 6.836 -1.053 1.00 0.00 H
419 ATOM 296 3HG2 VAL A 18 1.033 8.216 0.066 1.00 0.00 H
420 ATOM 297 N LYS A 19 1.365 10.980 -4.254 1.00 0.00 N
421 ATOM 298 CA LYS A 19 2.036 11.865 -5.191 1.00 0.00 C
422 ATOM 299 C LYS A 19 1.354 13.234 -5.172 1.00 0.00 C
423 ATOM 300 O LYS A 19 2.020 14.265 -5.256 1.00 0.00 O
424 ATOM 301 CB LYS A 19 2.094 11.227 -6.581 1.00 0.00 C
425 ATOM 302 CG LYS A 19 3.112 11.944 -7.471 1.00 0.00 C
426 ATOM 303 CD LYS A 19 2.698 11.877 -8.942 1.00 0.00 C
427 ATOM 304 CE LYS A 19 1.803 13.062 -9.314 1.00 0.00 C
428 ATOM 305 NZ LYS A 19 0.410 12.610 -9.531 1.00 0.00 N
429 ATOM 306 H LYS A 19 0.777 10.288 -4.673 1.00 0.00 H
430 ATOM 307 HA LYS A 19 3.063 11.986 -4.848 1.00 0.00 H
431 ATOM 308 1HB LYS A 19 2.362 10.175 -6.492 1.00 0.00 H
432 ATOM 309 2HB LYS A 19 1.109 11.266 -7.045 1.00 0.00 H
433 ATOM 310 1HG LYS A 19 3.201 12.986 -7.161 1.00 0.00 H
434 ATOM 311 2HG LYS A 19 4.095 11.490 -7.344 1.00 0.00 H
435 ATOM 312 1HD LYS A 19 3.586 11.875 -9.574 1.00 0.00 H
436 ATOM 313 2HD LYS A 19 2.169 10.943 -9.132 1.00 0.00 H
437 ATOM 314 1HE LYS A 19 1.830 13.809 -8.522 1.00 0.00 H
438 ATOM 315 2HE LYS A 19 2.180 13.540 -10.217 1.00 0.00 H
439 ATOM 316 1HZ LYS A 19 0.375 11.610 -9.503 1.00 0.00 H
440 ATOM 317 2HZ LYS A 19 -0.177 12.984 -8.812 1.00 0.00 H
441 ATOM 318 3HZ LYS A 19 0.090 12.930 -10.423 1.00 0.00 H
442 ATOM 319 N ALA A 20 0.034 13.201 -5.058 1.00 0.00 N
443 ATOM 320 CA ALA A 20 -0.745 14.427 -5.026 1.00 0.00 C
444 ATOM 321 C ALA A 20 -0.253 15.308 -3.877 1.00 0.00 C
445 ATOM 322 O ALA A 20 -0.127 16.523 -4.032 1.00 0.00 O
446 ATOM 323 CB ALA A 20 -2.232 14.083 -4.901 1.00 0.00 C
447 ATOM 324 H ALA A 20 -0.501 12.358 -4.990 1.00 0.00 H
448 ATOM 325 HA ALA A 20 -0.583 14.948 -5.968 1.00 0.00 H
449 ATOM 326 1HB ALA A 20 -2.373 13.366 -4.094 1.00 0.00 H
450 ATOM 327 2HB ALA A 20 -2.797 14.990 -4.686 1.00 0.00 H
451 ATOM 328 3HB ALA A 20 -2.584 13.651 -5.838 1.00 0.00 H
452 ATOM 329 N LEU A 21 0.012 14.664 -2.750 1.00 0.00 N
453 ATOM 330 CA LEU A 21 0.489 15.375 -1.575 1.00 0.00 C
454 ATOM 331 C LEU A 21 1.645 16.294 -1.974 1.00 0.00 C
455 ATOM 332 O LEU A 21 2.644 15.835 -2.525 1.00 0.00 O
456 ATOM 333 CB LEU A 21 0.842 14.389 -0.459 1.00 0.00 C
457 ATOM 334 CG LEU A 21 -0.009 13.120 -0.391 1.00 0.00 C
458 ATOM 335 CD1 LEU A 21 0.252 12.354 0.908 1.00 0.00 C
459 ATOM 336 CD2 LEU A 21 -1.494 13.444 -0.576 1.00 0.00 C
460 ATOM 337 H LEU A 21 -0.093 13.676 -2.633 1.00 0.00 H
461 ATOM 338 HA LEU A 21 -0.334 15.992 -1.212 1.00 0.00 H
462 ATOM 339 1HB LEU A 21 1.886 14.098 -0.577 1.00 0.00 H
463 ATOM 340 2HB LEU A 21 0.763 14.909 0.496 1.00 0.00 H
464 ATOM 341 HG LEU A 21 0.283 12.469 -1.214 1.00 0.00 H
465 ATOM 342 1HD1 LEU A 21 -0.698 12.122 1.390 1.00 0.00 H
466 ATOM 343 2HD1 LEU A 21 0.781 11.428 0.684 1.00 0.00 H
467 ATOM 344 3HD1 LEU A 21 0.857 12.967 1.575 1.00 0.00 H
468 ATOM 345 1HD2 LEU A 21 -1.595 14.365 -1.151 1.00 0.00 H
469 ATOM 346 2HD2 LEU A 21 -1.979 12.628 -1.110 1.00 0.00 H
470 ATOM 347 3HD2 LEU A 21 -1.962 13.571 0.400 1.00 0.00 H
471 ATOM 348 N GLY A 22 1.470 17.574 -1.680 1.00 0.00 N
472 ATOM 349 CA GLY A 22 2.488 18.560 -2.002 1.00 0.00 C
473 ATOM 350 C GLY A 22 3.890 18.008 -1.741 1.00 0.00 C
474 ATOM 351 O GLY A 22 4.851 18.408 -2.396 1.00 0.00 O
475 ATOM 352 H GLY A 22 0.654 17.938 -1.231 1.00 0.00 H
476 ATOM 353 1HA GLY A 22 2.397 18.854 -3.047 1.00 0.00 H
477 ATOM 354 2HA GLY A 22 2.329 19.458 -1.403 1.00 0.00 H
478 ATOM 355 N GLY A 23 3.963 17.096 -0.782 1.00 0.00 N
479 ATOM 356 CA GLY A 23 5.232 16.484 -0.427 1.00 0.00 C
480 ATOM 357 C GLY A 23 6.230 17.534 0.062 1.00 0.00 C
481 ATOM 358 O GLY A 23 5.900 18.717 0.149 1.00 0.00 O
482 ATOM 359 H GLY A 23 3.177 16.775 -0.254 1.00 0.00 H
483 ATOM 360 1HA GLY A 23 5.074 15.737 0.352 1.00 0.00 H
484 ATOM 361 2HA GLY A 23 5.642 15.960 -1.291 1.00 0.00 H
485 ATOM 362 N GLY A 24 7.432 17.067 0.367 1.00 0.00 N
486 ATOM 363 CA GLY A 24 8.481 17.952 0.843 1.00 0.00 C
487 ATOM 364 C GLY A 24 8.836 17.646 2.299 1.00 0.00 C
488 ATOM 365 O GLY A 24 9.296 18.524 3.028 1.00 0.00 O
489 ATOM 366 H GLY A 24 7.693 16.105 0.292 1.00 0.00 H
490 ATOM 367 1HA GLY A 24 9.366 17.842 0.218 1.00 0.00 H
491 ATOM 368 2HA GLY A 24 8.155 18.988 0.755 1.00 0.00 H
492 ATOM 369 N GLY A 25 8.610 16.398 2.681 1.00 0.00 N
493 ATOM 370 CA GLY A 25 8.902 15.964 4.036 1.00 0.00 C
494 ATOM 371 C GLY A 25 7.617 15.598 4.783 1.00 0.00 C
495 ATOM 372 O GLY A 25 7.191 16.319 5.683 1.00 0.00 O
496 ATOM 373 H GLY A 25 8.237 15.689 2.082 1.00 0.00 H
497 ATOM 374 1HA GLY A 25 9.570 15.104 4.011 1.00 0.00 H
498 ATOM 375 2HA GLY A 25 9.424 16.758 4.571 1.00 0.00 H
499 ATOM 376 N ARG A 26 7.037 14.477 4.380 1.00 0.00 N
500 ATOM 377 CA ARG A 26 5.810 14.005 5.001 1.00 0.00 C
501 ATOM 378 C ARG A 26 5.322 12.730 4.309 1.00 0.00 C
502 ATOM 379 O ARG A 26 4.767 11.843 4.955 1.00 0.00 O
503 ATOM 380 CB ARG A 26 4.712 15.068 4.927 1.00 0.00 C
504 ATOM 381 CG ARG A 26 4.378 15.608 6.320 1.00 0.00 C
505 ATOM 382 CD ARG A 26 4.177 17.124 6.286 1.00 0.00 C
506 ATOM 383 NE ARG A 26 2.770 17.441 5.954 1.00 0.00 N
507 ATOM 384 CZ ARG A 26 2.227 18.661 6.069 1.00 0.00 C
508 ATOM 385 NH1 ARG A 26 2.970 19.686 6.510 1.00 0.00 N
509 ATOM 386 NH2 ARG A 26 0.941 18.856 5.745 1.00 0.00 N
510 ATOM 387 H ARG A 26 7.391 13.895 3.649 1.00 0.00 H
511 ATOM 388 HA ARG A 26 6.079 13.810 6.038 1.00 0.00 H
512 ATOM 389 1HB ARG A 26 5.036 15.887 4.284 1.00 0.00 H
513 ATOM 390 2HB ARG A 26 3.818 14.642 4.474 1.00 0.00 H
514 ATOM 391 1HG ARG A 26 3.475 15.126 6.693 1.00 0.00 H
515 ATOM 392 2HG ARG A 26 5.182 15.359 7.012 1.00 0.00 H
516 ATOM 393 1HD ARG A 26 4.437 17.555 7.253 1.00 0.00 H
517 ATOM 394 2HD ARG A 26 4.844 17.572 5.548 1.00 0.00 H
518 ATOM 395 HE ARG A 26 2.188 16.699 5.622 1.00 0.00 H
519 ATOM 396 1HH1 ARG A 26 3.929 19.540 6.753 1.00 0.00 H
520 ATOM 397 2HH1 ARG A 26 2.564 20.596 6.596 1.00 0.00 H
521 ATOM 398 1HH2 ARG A 26 0.388 18.091 5.417 1.00 0.00 H
522 ATOM 399 2HH2 ARG A 26 0.537 19.766 5.832 1.00 0.00 H
523 ATOM 400 N ILE A 27 5.547 12.680 3.004 1.00 0.00 N
524 ATOM 401 CA ILE A 27 5.136 11.529 2.219 1.00 0.00 C
525 ATOM 402 C ILE A 27 6.286 10.520 2.160 1.00 0.00 C
526 ATOM 403 O ILE A 27 6.057 9.312 2.172 1.00 0.00 O
527 ATOM 404 CB ILE A 27 4.637 11.970 0.841 1.00 0.00 C
528 ATOM 405 CG1 ILE A 27 5.334 13.256 0.391 1.00 0.00 C
529 ATOM 406 CG2 ILE A 27 3.113 12.111 0.830 1.00 0.00 C
530 ATOM 407 CD1 ILE A 27 4.907 13.644 -1.026 1.00 0.00 C
531 ATOM 408 H ILE A 27 5.999 13.406 2.485 1.00 0.00 H
532 ATOM 409 HA ILE A 27 4.295 11.064 2.733 1.00 0.00 H
533 ATOM 410 HB ILE A 27 4.894 11.195 0.120 1.00 0.00 H
534 ATOM 411 1HG1 ILE A 27 5.095 14.065 1.082 1.00 0.00 H
535 ATOM 412 2HG1 ILE A 27 6.414 13.118 0.424 1.00 0.00 H
536 ATOM 413 1HG2 ILE A 27 2.845 13.164 0.911 1.00 0.00 H
537 ATOM 414 2HG2 ILE A 27 2.718 11.705 -0.102 1.00 0.00 H
538 ATOM 415 3HG2 ILE A 27 2.692 11.562 1.672 1.00 0.00 H
539 ATOM 416 1HD1 ILE A 27 4.482 12.775 -1.528 1.00 0.00 H
540 ATOM 417 2HD1 ILE A 27 4.159 14.435 -0.975 1.00 0.00 H
541 ATOM 418 3HD1 ILE A 27 5.774 13.999 -1.583 1.00 0.00 H
542 ATOM 419 N GLU A 28 7.497 11.054 2.100 1.00 0.00 N
543 ATOM 420 CA GLU A 28 8.682 10.217 2.041 1.00 0.00 C
544 ATOM 421 C GLU A 28 8.491 8.964 2.899 1.00 0.00 C
545 ATOM 422 O GLU A 28 8.570 7.845 2.396 1.00 0.00 O
546 ATOM 423 CB GLU A 28 9.926 10.994 2.477 1.00 0.00 C
547 ATOM 424 CG GLU A 28 11.191 10.150 2.300 1.00 0.00 C
548 ATOM 425 CD GLU A 28 11.574 10.040 0.823 1.00 0.00 C
549 ATOM 426 OE1 GLU A 28 12.130 11.033 0.306 1.00 0.00 O
550 ATOM 427 OE2 GLU A 28 11.303 8.965 0.245 1.00 0.00 O
551 ATOM 428 H GLU A 28 7.674 12.039 2.091 1.00 0.00 H
552 ATOM 429 HA GLU A 28 8.786 9.935 0.994 1.00 0.00 H
553 ATOM 430 1HB GLU A 28 10.011 11.909 1.890 1.00 0.00 H
554 ATOM 431 2HB GLU A 28 9.827 11.292 3.520 1.00 0.00 H
555 ATOM 432 1HG GLU A 28 12.012 10.598 2.860 1.00 0.00 H
556 ATOM 433 2HG GLU A 28 11.028 9.155 2.712 1.00 0.00 H
557 ATOM 434 N GLU A 29 8.242 9.196 4.180 1.00 0.00 N
558 ATOM 435 CA GLU A 29 8.039 8.100 5.112 1.00 0.00 C
559 ATOM 436 C GLU A 29 7.064 7.077 4.526 1.00 0.00 C
560 ATOM 437 O GLU A 29 7.471 5.994 4.111 1.00 0.00 O
561 ATOM 438 CB GLU A 29 7.543 8.617 6.464 1.00 0.00 C
562 ATOM 439 CG GLU A 29 7.783 7.583 7.567 1.00 0.00 C
563 ATOM 440 CD GLU A 29 6.464 7.150 8.209 1.00 0.00 C
564 ATOM 441 OE1 GLU A 29 6.126 7.732 9.262 1.00 0.00 O
565 ATOM 442 OE2 GLU A 29 5.822 6.245 7.631 1.00 0.00 O
566 ATOM 443 H GLU A 29 8.179 10.110 4.581 1.00 0.00 H
567 ATOM 444 HA GLU A 29 9.020 7.644 5.242 1.00 0.00 H
568 ATOM 445 1HB GLU A 29 8.057 9.545 6.714 1.00 0.00 H
569 ATOM 446 2HB GLU A 29 6.480 8.848 6.403 1.00 0.00 H
570 ATOM 447 1HG GLU A 29 8.292 6.714 7.152 1.00 0.00 H
571 ATOM 448 2HG GLU A 29 8.440 8.004 8.328 1.00 0.00 H
572 ATOM 449 N LEU A 30 5.795 7.459 4.509 1.00 0.00 N
573 ATOM 450 CA LEU A 30 4.758 6.589 3.979 1.00 0.00 C
574 ATOM 451 C LEU A 30 5.198 6.051 2.616 1.00 0.00 C
575 ATOM 452 O LEU A 30 4.965 4.886 2.300 1.00 0.00 O
576 ATOM 453 CB LEU A 30 3.412 7.315 3.949 1.00 0.00 C
577 ATOM 454 CG LEU A 30 3.362 8.600 3.122 1.00 0.00 C
578 ATOM 455 CD1 LEU A 30 3.341 8.288 1.624 1.00 0.00 C
579 ATOM 456 CD2 LEU A 30 2.180 9.477 3.541 1.00 0.00 C
580 ATOM 457 H LEU A 30 5.472 8.343 4.848 1.00 0.00 H
581 ATOM 458 HA LEU A 30 4.656 5.748 4.666 1.00 0.00 H
582 ATOM 459 1HB LEU A 30 2.660 6.627 3.563 1.00 0.00 H
583 ATOM 460 2HB LEU A 30 3.129 7.556 4.974 1.00 0.00 H
584 ATOM 461 HG LEU A 30 4.270 9.170 3.319 1.00 0.00 H
585 ATOM 462 1HD1 LEU A 30 2.561 8.877 1.141 1.00 0.00 H
586 ATOM 463 2HD1 LEU A 30 4.308 8.537 1.187 1.00 0.00 H
587 ATOM 464 3HD1 LEU A 30 3.139 7.227 1.477 1.00 0.00 H
588 ATOM 465 1HD2 LEU A 30 1.399 8.852 3.975 1.00 0.00 H
589 ATOM 466 2HD2 LEU A 30 2.512 10.206 4.279 1.00 0.00 H
590 ATOM 467 3HD2 LEU A 30 1.786 9.997 2.668 1.00 0.00 H
591 ATOM 468 N LYS A 31 5.825 6.927 1.844 1.00 0.00 N
592 ATOM 469 CA LYS A 31 6.298 6.555 0.522 1.00 0.00 C
593 ATOM 470 C LYS A 31 7.308 5.413 0.649 1.00 0.00 C
594 ATOM 471 O LYS A 31 7.387 4.549 -0.224 1.00 0.00 O
595 ATOM 472 CB LYS A 31 6.845 7.780 -0.216 1.00 0.00 C
596 ATOM 473 CG LYS A 31 5.765 8.419 -1.090 1.00 0.00 C
597 ATOM 474 CD LYS A 31 6.356 8.925 -2.409 1.00 0.00 C
598 ATOM 475 CE LYS A 31 6.482 7.789 -3.424 1.00 0.00 C
599 ATOM 476 NZ LYS A 31 7.803 7.832 -4.089 1.00 0.00 N
600 ATOM 477 H LYS A 31 6.010 7.874 2.108 1.00 0.00 H
601 ATOM 478 HA LYS A 31 5.439 6.196 -0.044 1.00 0.00 H
602 ATOM 479 1HB LYS A 31 7.214 8.508 0.505 1.00 0.00 H
603 ATOM 480 2HB LYS A 31 7.693 7.487 -0.835 1.00 0.00 H
604 ATOM 481 1HG LYS A 31 4.980 7.693 -1.295 1.00 0.00 H
605 ATOM 482 2HG LYS A 31 5.301 9.247 -0.554 1.00 0.00 H
606 ATOM 483 1HD LYS A 31 5.722 9.714 -2.815 1.00 0.00 H
607 ATOM 484 2HD LYS A 31 7.335 9.366 -2.226 1.00 0.00 H
608 ATOM 485 1HE LYS A 31 6.351 6.830 -2.924 1.00 0.00 H
609 ATOM 486 2HE LYS A 31 5.690 7.870 -4.170 1.00 0.00 H
610 ATOM 487 1HZ LYS A 31 8.006 8.771 -4.368 1.00 0.00 H
611 ATOM 488 2HZ LYS A 31 8.507 7.515 -3.453 1.00 0.00 H
612 ATOM 489 3HZ LYS A 31 7.791 7.240 -4.895 1.00 0.00 H
613 ATOM 490 N LYS A 32 8.055 5.445 1.743 1.00 0.00 N
614 ATOM 491 CA LYS A 32 9.057 4.423 1.995 1.00 0.00 C
615 ATOM 492 C LYS A 32 8.368 3.062 2.127 1.00 0.00 C
616 ATOM 493 O LYS A 32 8.660 2.140 1.367 1.00 0.00 O
617 ATOM 494 CB LYS A 32 9.912 4.798 3.207 1.00 0.00 C
618 ATOM 495 CG LYS A 32 10.489 6.207 3.054 1.00 0.00 C
619 ATOM 496 CD LYS A 32 11.997 6.212 3.315 1.00 0.00 C
620 ATOM 497 CE LYS A 32 12.780 6.068 2.009 1.00 0.00 C
621 ATOM 498 NZ LYS A 32 14.168 5.633 2.282 1.00 0.00 N
622 ATOM 499 H LYS A 32 7.984 6.151 2.447 1.00 0.00 H
623 ATOM 500 HA LYS A 32 9.718 4.393 1.130 1.00 0.00 H
624 ATOM 501 1HB LYS A 32 9.309 4.745 4.113 1.00 0.00 H
625 ATOM 502 2HB LYS A 32 10.723 4.079 3.321 1.00 0.00 H
626 ATOM 503 1HG LYS A 32 10.289 6.580 2.050 1.00 0.00 H
627 ATOM 504 2HG LYS A 32 9.994 6.884 3.750 1.00 0.00 H
628 ATOM 505 1HD LYS A 32 12.280 7.140 3.812 1.00 0.00 H
629 ATOM 506 2HD LYS A 32 12.255 5.397 3.991 1.00 0.00 H
630 ATOM 507 1HE LYS A 32 12.287 5.344 1.361 1.00 0.00 H
631 ATOM 508 2HE LYS A 32 12.789 7.019 1.476 1.00 0.00 H
632 ATOM 509 1HZ LYS A 32 14.160 4.701 2.645 1.00 0.00 H
633 ATOM 510 2HZ LYS A 32 14.697 5.655 1.434 1.00 0.00 H
634 ATOM 511 3HZ LYS A 32 14.584 6.249 2.952 1.00 0.00 H
635 ATOM 512 N LYS A 33 7.469 2.981 3.096 1.00 0.00 N
636 ATOM 513 CA LYS A 33 6.737 1.749 3.337 1.00 0.00 C
637 ATOM 514 C LYS A 33 5.916 1.397 2.094 1.00 0.00 C
638 ATOM 515 O LYS A 33 5.772 0.224 1.752 1.00 0.00 O
639 ATOM 516 CB LYS A 33 5.902 1.862 4.613 1.00 0.00 C
640 ATOM 517 CG LYS A 33 6.784 2.199 5.818 1.00 0.00 C
641 ATOM 518 CD LYS A 33 6.537 1.222 6.968 1.00 0.00 C
642 ATOM 519 CE LYS A 33 7.748 0.310 7.184 1.00 0.00 C
643 ATOM 520 NZ LYS A 33 8.528 0.755 8.360 1.00 0.00 N
644 ATOM 521 H LYS A 33 7.238 3.736 3.710 1.00 0.00 H
645 ATOM 522 HA LYS A 33 7.471 0.960 3.500 1.00 0.00 H
646 ATOM 523 1HB LYS A 33 5.142 2.633 4.489 1.00 0.00 H
647 ATOM 524 2HB LYS A 33 5.377 0.923 4.794 1.00 0.00 H
648 ATOM 525 1HG LYS A 33 7.834 2.163 5.525 1.00 0.00 H
649 ATOM 526 2HG LYS A 33 6.580 3.216 6.150 1.00 0.00 H
650 ATOM 527 1HD LYS A 33 6.328 1.776 7.883 1.00 0.00 H
651 ATOM 528 2HD LYS A 33 5.655 0.617 6.754 1.00 0.00 H
652 ATOM 529 1HE LYS A 33 7.414 -0.718 7.328 1.00 0.00 H
653 ATOM 530 2HE LYS A 33 8.379 0.319 6.295 1.00 0.00 H
654 ATOM 531 1HZ LYS A 33 7.965 0.676 9.182 1.00 0.00 H
655 ATOM 532 2HZ LYS A 33 9.340 0.180 8.457 1.00 0.00 H
656 ATOM 533 3HZ LYS A 33 8.807 1.707 8.234 1.00 0.00 H
657 ATOM 534 N TRP A 34 5.401 2.435 1.452 1.00 0.00 N
658 ATOM 535 CA TRP A 34 4.597 2.250 0.255 1.00 0.00 C
659 ATOM 536 C TRP A 34 5.450 1.508 -0.776 1.00 0.00 C
660 ATOM 537 O TRP A 34 4.921 0.795 -1.628 1.00 0.00 O
661 ATOM 538 CB TRP A 34 4.067 3.590 -0.261 1.00 0.00 C
662 ATOM 539 CG TRP A 34 4.140 3.743 -1.782 1.00 0.00 C
663 ATOM 540 CD1 TRP A 34 5.190 4.120 -2.524 1.00 0.00 C
664 ATOM 541 CD2 TRP A 34 3.070 3.507 -2.721 1.00 0.00 C
665 ATOM 542 NE1 TRP A 34 4.877 4.143 -3.868 1.00 0.00 N
666 ATOM 543 CE2 TRP A 34 3.548 3.759 -3.992 1.00 0.00 C
667 ATOM 544 CE3 TRP A 34 1.744 3.094 -2.506 1.00 0.00 C
668 ATOM 545 CZ2 TRP A 34 2.764 3.626 -5.145 1.00 0.00 C
669 ATOM 546 CZ3 TRP A 34 0.974 2.967 -3.669 1.00 0.00 C
670 ATOM 547 CH2 TRP A 34 1.440 3.217 -4.954 1.00 0.00 C
671 ATOM 548 H TRP A 34 5.523 3.386 1.737 1.00 0.00 H
672 ATOM 549 HA TRP A 34 3.730 1.648 0.525 1.00 0.00 H
673 ATOM 550 1HB TRP A 34 3.031 3.705 0.056 1.00 0.00 H
674 ATOM 551 2HB TRP A 34 4.635 4.397 0.203 1.00 0.00 H
675 ATOM 552 HD1 TRP A 34 6.168 4.375 -2.117 1.00 0.00 H
676 ATOM 553 HE1 TRP A 34 5.550 4.414 -4.682 1.00 0.00 H
677 ATOM 554 HE3 TRP A 34 1.344 2.889 -1.513 1.00 0.00 H
678 ATOM 555 HZ2 TRP A 34 3.164 3.831 -6.138 1.00 0.00 H
679 ATOM 556 HZ3 TRP A 34 -0.063 2.649 -3.558 1.00 0.00 H
680 ATOM 557 HH2 TRP A 34 0.776 3.093 -5.810 1.00 0.00 H
681 ATOM 558 N GLU A 35 6.756 1.699 -0.665 1.00 0.00 N
682 ATOM 559 CA GLU A 35 7.687 1.056 -1.577 1.00 0.00 C
683 ATOM 560 C GLU A 35 7.895 -0.407 -1.179 1.00 0.00 C
684 ATOM 561 O GLU A 35 8.043 -1.273 -2.040 1.00 0.00 O
685 ATOM 562 CB GLU A 35 9.020 1.808 -1.620 1.00 0.00 C
686 ATOM 563 CG GLU A 35 9.279 2.384 -3.013 1.00 0.00 C
687 ATOM 564 CD GLU A 35 10.024 1.377 -3.893 1.00 0.00 C
688 ATOM 565 OE1 GLU A 35 11.258 1.278 -3.721 1.00 0.00 O
689 ATOM 566 OE2 GLU A 35 9.343 0.731 -4.717 1.00 0.00 O
690 ATOM 567 H GLU A 35 7.179 2.280 0.031 1.00 0.00 H
691 ATOM 568 HA GLU A 35 7.215 1.110 -2.558 1.00 0.00 H
692 ATOM 569 1HB GLU A 35 9.012 2.612 -0.885 1.00 0.00 H
693 ATOM 570 2HB GLU A 35 9.830 1.132 -1.344 1.00 0.00 H
694 ATOM 571 1HG GLU A 35 8.333 2.651 -3.482 1.00 0.00 H
695 ATOM 572 2HG GLU A 35 9.863 3.300 -2.928 1.00 0.00 H
696 ATOM 573 N GLU A 36 7.897 -0.638 0.125 1.00 0.00 N
697 ATOM 574 CA GLU A 36 8.084 -1.981 0.647 1.00 0.00 C
698 ATOM 575 C GLU A 36 6.746 -2.721 0.699 1.00 0.00 C
699 ATOM 576 O GLU A 36 6.714 -3.941 0.853 1.00 0.00 O
700 ATOM 577 CB GLU A 36 8.744 -1.946 2.027 1.00 0.00 C
701 ATOM 578 CG GLU A 36 9.584 -0.679 2.202 1.00 0.00 C
702 ATOM 579 CD GLU A 36 10.674 -0.884 3.255 1.00 0.00 C
703 ATOM 580 OE1 GLU A 36 11.843 -0.582 2.928 1.00 0.00 O
704 ATOM 581 OE2 GLU A 36 10.315 -1.337 4.363 1.00 0.00 O
705 ATOM 582 H GLU A 36 7.776 0.072 0.820 1.00 0.00 H
706 ATOM 583 HA GLU A 36 8.754 -2.475 -0.056 1.00 0.00 H
707 ATOM 584 1HB GLU A 36 7.978 -1.988 2.802 1.00 0.00 H
708 ATOM 585 2HB GLU A 36 9.377 -2.825 2.154 1.00 0.00 H
709 ATOM 586 1HG GLU A 36 10.039 -0.406 1.250 1.00 0.00 H
710 ATOM 587 2HG GLU A 36 8.940 0.151 2.496 1.00 0.00 H
711 ATOM 588 N LEU A 37 5.675 -1.952 0.566 1.00 0.00 N
712 ATOM 589 CA LEU A 37 4.338 -2.519 0.595 1.00 0.00 C
713 ATOM 590 C LEU A 37 3.973 -3.024 -0.803 1.00 0.00 C
714 ATOM 591 O LEU A 37 3.609 -4.188 -0.970 1.00 0.00 O
715 ATOM 592 CB LEU A 37 3.340 -1.510 1.165 1.00 0.00 C
716 ATOM 593 CG LEU A 37 2.022 -1.365 0.401 1.00 0.00 C
717 ATOM 594 CD1 LEU A 37 1.213 -2.663 0.452 1.00 0.00 C
718 ATOM 595 CD2 LEU A 37 1.219 -0.169 0.915 1.00 0.00 C
719 ATOM 596 H LEU A 37 5.711 -0.960 0.441 1.00 0.00 H
720 ATOM 597 HA LEU A 37 4.359 -3.371 1.276 1.00 0.00 H
721 ATOM 598 1HB LEU A 37 3.112 -1.795 2.192 1.00 0.00 H
722 ATOM 599 2HB LEU A 37 3.823 -0.534 1.205 1.00 0.00 H
723 ATOM 600 HG LEU A 37 2.254 -1.171 -0.646 1.00 0.00 H
724 ATOM 601 1HD1 LEU A 37 1.123 -2.994 1.486 1.00 0.00 H
725 ATOM 602 2HD1 LEU A 37 0.220 -2.488 0.037 1.00 0.00 H
726 ATOM 603 3HD1 LEU A 37 1.721 -3.431 -0.133 1.00 0.00 H
727 ATOM 604 1HD2 LEU A 37 1.068 -0.267 1.990 1.00 0.00 H
728 ATOM 605 2HD2 LEU A 37 1.765 0.752 0.708 1.00 0.00 H
729 ATOM 606 3HD2 LEU A 37 0.252 -0.138 0.414 1.00 0.00 H
730 ATOM 607 N LYS A 38 4.081 -2.125 -1.768 1.00 0.00 N
731 ATOM 608 CA LYS A 38 3.766 -2.464 -3.146 1.00 0.00 C
732 ATOM 609 C LYS A 38 4.583 -3.688 -3.564 1.00 0.00 C
733 ATOM 610 O LYS A 38 4.116 -4.511 -4.349 1.00 0.00 O
734 ATOM 611 CB LYS A 38 3.967 -1.250 -4.056 1.00 0.00 C
735 ATOM 612 CG LYS A 38 3.868 -1.649 -5.530 1.00 0.00 C
736 ATOM 613 CD LYS A 38 4.971 -0.981 -6.353 1.00 0.00 C
737 ATOM 614 CE LYS A 38 4.730 0.525 -6.474 1.00 0.00 C
738 ATOM 615 NZ LYS A 38 3.839 0.818 -7.617 1.00 0.00 N
739 ATOM 616 H LYS A 38 4.378 -1.181 -1.622 1.00 0.00 H
740 ATOM 617 HA LYS A 38 2.709 -2.724 -3.185 1.00 0.00 H
741 ATOM 618 1HB LYS A 38 3.217 -0.493 -3.829 1.00 0.00 H
742 ATOM 619 2HB LYS A 38 4.941 -0.803 -3.861 1.00 0.00 H
743 ATOM 620 1HG LYS A 38 3.943 -2.731 -5.624 1.00 0.00 H
744 ATOM 621 2HG LYS A 38 2.892 -1.361 -5.923 1.00 0.00 H
745 ATOM 622 1HD LYS A 38 5.939 -1.162 -5.886 1.00 0.00 H
746 ATOM 623 2HD LYS A 38 5.009 -1.427 -7.347 1.00 0.00 H
747 ATOM 624 1HE LYS A 38 4.287 0.903 -5.553 1.00 0.00 H
748 ATOM 625 2HE LYS A 38 5.681 1.042 -6.605 1.00 0.00 H
749 ATOM 626 1HZ LYS A 38 3.129 0.115 -7.676 1.00 0.00 H
750 ATOM 627 2HZ LYS A 38 3.411 1.713 -7.487 1.00 0.00 H
751 ATOM 628 3HZ LYS A 38 4.372 0.824 -8.464 1.00 0.00 H
752 ATOM 629 N LYS A 39 5.789 -3.768 -3.021 1.00 0.00 N
753 ATOM 630 CA LYS A 39 6.675 -4.878 -3.329 1.00 0.00 C
754 ATOM 631 C LYS A 39 6.117 -6.159 -2.705 1.00 0.00 C
755 ATOM 632 O LYS A 39 6.420 -7.260 -3.163 1.00 0.00 O
756 ATOM 633 CB LYS A 39 8.107 -4.556 -2.896 1.00 0.00 C
757 ATOM 634 CG LYS A 39 9.124 -5.297 -3.767 1.00 0.00 C
758 ATOM 635 CD LYS A 39 10.237 -5.908 -2.913 1.00 0.00 C
759 ATOM 636 CE LYS A 39 11.539 -5.118 -3.062 1.00 0.00 C
760 ATOM 637 NZ LYS A 39 12.671 -5.872 -2.482 1.00 0.00 N
761 ATOM 638 H LYS A 39 6.162 -3.094 -2.384 1.00 0.00 H
762 ATOM 639 HA LYS A 39 6.687 -4.998 -4.412 1.00 0.00 H
763 ATOM 640 1HB LYS A 39 8.279 -3.483 -2.962 1.00 0.00 H
764 ATOM 641 2HB LYS A 39 8.246 -4.836 -1.851 1.00 0.00 H
765 ATOM 642 1HG LYS A 39 8.621 -6.082 -4.331 1.00 0.00 H
766 ATOM 643 2HG LYS A 39 9.555 -4.608 -4.494 1.00 0.00 H
767 ATOM 644 1HD LYS A 39 9.932 -5.920 -1.867 1.00 0.00 H
768 ATOM 645 2HD LYS A 39 10.400 -6.944 -3.209 1.00 0.00 H
769 ATOM 646 1HE LYS A 39 11.729 -4.915 -4.116 1.00 0.00 H
770 ATOM 647 2HE LYS A 39 11.443 -4.152 -2.565 1.00 0.00 H
771 ATOM 648 1HZ LYS A 39 13.500 -5.314 -2.526 1.00 0.00 H
772 ATOM 649 2HZ LYS A 39 12.471 -6.096 -1.528 1.00 0.00 H
773 ATOM 650 3HZ LYS A 39 12.810 -6.717 -3.000 1.00 0.00 H
774 ATOM 651 N LYS A 40 5.311 -5.973 -1.670 1.00 0.00 N
775 ATOM 652 CA LYS A 40 4.708 -7.100 -0.979 1.00 0.00 C
776 ATOM 653 C LYS A 40 3.481 -7.574 -1.761 1.00 0.00 C
777 ATOM 654 O LYS A 40 3.269 -8.774 -1.920 1.00 0.00 O
778 ATOM 655 CB LYS A 40 4.407 -6.737 0.475 1.00 0.00 C
779 ATOM 656 CG LYS A 40 5.609 -7.035 1.375 1.00 0.00 C
780 ATOM 657 CD LYS A 40 5.515 -6.260 2.691 1.00 0.00 C
781 ATOM 658 CE LYS A 40 6.904 -6.013 3.283 1.00 0.00 C
782 ATOM 659 NZ LYS A 40 6.811 -5.154 4.484 1.00 0.00 N
783 ATOM 660 H LYS A 40 5.070 -5.074 -1.304 1.00 0.00 H
784 ATOM 661 HA LYS A 40 5.442 -7.905 -0.966 1.00 0.00 H
785 ATOM 662 1HB LYS A 40 4.149 -5.680 0.546 1.00 0.00 H
786 ATOM 663 2HB LYS A 40 3.540 -7.299 0.824 1.00 0.00 H
787 ATOM 664 1HG LYS A 40 5.657 -8.104 1.581 1.00 0.00 H
788 ATOM 665 2HG LYS A 40 6.530 -6.768 0.856 1.00 0.00 H
789 ATOM 666 1HD LYS A 40 5.013 -5.308 2.521 1.00 0.00 H
790 ATOM 667 2HD LYS A 40 4.906 -6.818 3.403 1.00 0.00 H
791 ATOM 668 1HE LYS A 40 7.369 -6.964 3.543 1.00 0.00 H
792 ATOM 669 2HE LYS A 40 7.544 -5.539 2.538 1.00 0.00 H
793 ATOM 670 1HZ LYS A 40 7.506 -4.438 4.436 1.00 0.00 H
794 ATOM 671 2HZ LYS A 40 5.904 -4.735 4.524 1.00 0.00 H
795 ATOM 672 3HZ LYS A 40 6.959 -5.709 5.302 1.00 0.00 H
796 ATOM 673 N ILE A 41 2.706 -6.606 -2.228 1.00 0.00 N
797 ATOM 674 CA ILE A 41 1.506 -6.910 -2.989 1.00 0.00 C
798 ATOM 675 C ILE A 41 1.895 -7.646 -4.272 1.00 0.00 C
799 ATOM 676 O ILE A 41 1.050 -8.273 -4.912 1.00 0.00 O
800 ATOM 677 CB ILE A 41 0.690 -5.639 -3.232 1.00 0.00 C
801 ATOM 678 CG1 ILE A 41 0.703 -4.735 -1.998 1.00 0.00 C
802 ATOM 679 CG2 ILE A 41 -0.734 -5.979 -3.679 1.00 0.00 C
803 ATOM 680 CD1 ILE A 41 -0.460 -3.741 -2.034 1.00 0.00 C
804 ATOM 681 H ILE A 41 2.885 -5.632 -2.093 1.00 0.00 H
805 ATOM 682 HA ILE A 41 0.893 -7.576 -2.381 1.00 0.00 H
806 ATOM 683 HB ILE A 41 1.158 -5.082 -4.044 1.00 0.00 H
807 ATOM 684 1HG1 ILE A 41 0.637 -5.343 -1.095 1.00 0.00 H
808 ATOM 685 2HG1 ILE A 41 1.647 -4.193 -1.950 1.00 0.00 H
809 ATOM 686 1HG2 ILE A 41 -1.008 -5.352 -4.527 1.00 0.00 H
810 ATOM 687 2HG2 ILE A 41 -0.782 -7.027 -3.971 1.00 0.00 H
811 ATOM 688 3HG2 ILE A 41 -1.425 -5.799 -2.856 1.00 0.00 H
812 ATOM 689 1HD1 ILE A 41 -0.961 -3.803 -3.000 1.00 0.00 H
813 ATOM 690 2HD1 ILE A 41 -1.168 -3.980 -1.242 1.00 0.00 H
814 ATOM 691 3HD1 ILE A 41 -0.079 -2.730 -1.887 1.00 0.00 H
815 ATOM 692 N GLU A 42 3.171 -7.546 -4.612 1.00 0.00 N
816 ATOM 693 CA GLU A 42 3.681 -8.195 -5.807 1.00 0.00 C
817 ATOM 694 C GLU A 42 3.883 -9.691 -5.555 1.00 0.00 C
818 ATOM 695 O GLU A 42 3.358 -10.524 -6.291 1.00 0.00 O
819 ATOM 696 CB GLU A 42 4.981 -7.538 -6.275 1.00 0.00 C
820 ATOM 697 CG GLU A 42 4.742 -6.667 -7.509 1.00 0.00 C
821 ATOM 698 CD GLU A 42 5.199 -7.381 -8.783 1.00 0.00 C
822 ATOM 699 OE1 GLU A 42 6.421 -7.359 -9.038 1.00 0.00 O
823 ATOM 700 OE2 GLU A 42 4.314 -7.933 -9.471 1.00 0.00 O
824 ATOM 701 H GLU A 42 3.851 -7.034 -4.085 1.00 0.00 H
825 ATOM 702 HA GLU A 42 2.913 -8.048 -6.567 1.00 0.00 H
826 ATOM 703 1HB GLU A 42 5.396 -6.930 -5.471 1.00 0.00 H
827 ATOM 704 2HB GLU A 42 5.719 -8.306 -6.506 1.00 0.00 H
828 ATOM 705 1HG GLU A 42 3.682 -6.421 -7.585 1.00 0.00 H
829 ATOM 706 2HG GLU A 42 5.281 -5.725 -7.404 1.00 0.00 H
830 ATOM 707 N GLU A 43 4.644 -9.985 -4.511 1.00 0.00 N
831 ATOM 708 CA GLU A 43 4.922 -11.365 -4.152 1.00 0.00 C
832 ATOM 709 C GLU A 43 3.663 -12.030 -3.590 1.00 0.00 C
833 ATOM 710 O GLU A 43 3.614 -13.251 -3.445 1.00 0.00 O
834 ATOM 711 CB GLU A 43 6.079 -11.451 -3.155 1.00 0.00 C
835 ATOM 712 CG GLU A 43 7.310 -12.093 -3.798 1.00 0.00 C
836 ATOM 713 CD GLU A 43 8.152 -12.831 -2.754 1.00 0.00 C
837 ATOM 714 OE1 GLU A 43 7.637 -13.836 -2.218 1.00 0.00 O
838 ATOM 715 OE2 GLU A 43 9.290 -12.372 -2.517 1.00 0.00 O
839 ATOM 716 H GLU A 43 5.067 -9.301 -3.917 1.00 0.00 H
840 ATOM 717 HA GLU A 43 5.215 -11.853 -5.083 1.00 0.00 H
841 ATOM 718 1HB GLU A 43 6.330 -10.453 -2.797 1.00 0.00 H
842 ATOM 719 2HB GLU A 43 5.772 -12.034 -2.286 1.00 0.00 H
843 ATOM 720 1HG GLU A 43 6.996 -12.790 -4.576 1.00 0.00 H
844 ATOM 721 2HG GLU A 43 7.914 -11.327 -4.282 1.00 0.00 H
845 ATOM 722 N LEU A 44 2.676 -11.199 -3.290 1.00 0.00 N
846 ATOM 723 CA LEU A 44 1.423 -11.691 -2.747 1.00 0.00 C
847 ATOM 724 C LEU A 44 0.992 -12.940 -3.520 1.00 0.00 C
848 ATOM 725 O LEU A 44 0.440 -12.836 -4.614 1.00 0.00 O
849 ATOM 726 CB LEU A 44 0.370 -10.581 -2.737 1.00 0.00 C
850 ATOM 727 CG LEU A 44 0.243 -9.789 -1.434 1.00 0.00 C
851 ATOM 728 CD1 LEU A 44 -0.914 -8.791 -1.510 1.00 0.00 C
852 ATOM 729 CD2 LEU A 44 0.113 -10.728 -0.233 1.00 0.00 C
853 ATOM 730 H LEU A 44 2.725 -10.208 -3.410 1.00 0.00 H
854 ATOM 731 HA LEU A 44 1.603 -11.973 -1.710 1.00 0.00 H
855 ATOM 732 1HB LEU A 44 0.600 -9.882 -3.542 1.00 0.00 H
856 ATOM 733 2HB LEU A 44 -0.600 -11.023 -2.966 1.00 0.00 H
857 ATOM 734 HG LEU A 44 1.157 -9.212 -1.294 1.00 0.00 H
858 ATOM 735 1HD1 LEU A 44 -1.848 -9.296 -1.258 1.00 0.00 H
859 ATOM 736 2HD1 LEU A 44 -0.740 -7.978 -0.805 1.00 0.00 H
860 ATOM 737 3HD1 LEU A 44 -0.982 -8.388 -2.520 1.00 0.00 H
861 ATOM 738 1HD2 LEU A 44 1.101 -10.927 0.181 1.00 0.00 H
862 ATOM 739 2HD2 LEU A 44 -0.512 -10.259 0.528 1.00 0.00 H
863 ATOM 740 3HD2 LEU A 44 -0.344 -11.665 -0.552 1.00 0.00 H
864 ATOM 741 N GLY A 45 1.261 -14.090 -2.921 1.00 0.00 N
865 ATOM 742 CA GLY A 45 0.909 -15.357 -3.540 1.00 0.00 C
866 ATOM 743 C GLY A 45 1.343 -16.534 -2.665 1.00 0.00 C
867 ATOM 744 O GLY A 45 0.509 -17.196 -2.050 1.00 0.00 O
868 ATOM 745 H GLY A 45 1.711 -14.166 -2.031 1.00 0.00 H
869 ATOM 746 1HA GLY A 45 -0.168 -15.398 -3.704 1.00 0.00 H
870 ATOM 747 2HA GLY A 45 1.383 -15.432 -4.518 1.00 0.00 H
871 ATOM 748 N GLY A 46 2.648 -16.760 -2.637 1.00 0.00 N
872 ATOM 749 CA GLY A 46 3.203 -17.845 -1.848 1.00 0.00 C
873 ATOM 750 C GLY A 46 3.113 -17.538 -0.351 1.00 0.00 C
874 ATOM 751 O GLY A 46 4.134 -17.416 0.324 1.00 0.00 O
875 ATOM 752 H GLY A 46 3.321 -16.216 -3.140 1.00 0.00 H
876 ATOM 753 1HA GLY A 46 2.668 -18.769 -2.066 1.00 0.00 H
877 ATOM 754 2HA GLY A 46 4.245 -18.008 -2.126 1.00 0.00 H
878 ATOM 755 N GLY A 47 1.882 -17.421 0.122 1.00 0.00 N
879 ATOM 756 CA GLY A 47 1.644 -17.131 1.526 1.00 0.00 C
880 ATOM 757 C GLY A 47 0.500 -16.128 1.692 1.00 0.00 C
881 ATOM 758 O GLY A 47 0.503 -15.068 1.068 1.00 0.00 O
882 ATOM 759 H GLY A 47 1.056 -17.522 -0.434 1.00 0.00 H
883 ATOM 760 1HA GLY A 47 1.405 -18.052 2.057 1.00 0.00 H
884 ATOM 761 2HA GLY A 47 2.551 -16.729 1.976 1.00 0.00 H
885 ATOM 762 N GLY A 48 -0.452 -16.499 2.537 1.00 0.00 N
886 ATOM 763 CA GLY A 48 -1.599 -15.646 2.793 1.00 0.00 C
887 ATOM 764 C GLY A 48 -1.303 -14.652 3.917 1.00 0.00 C
888 ATOM 765 O GLY A 48 -2.142 -14.427 4.788 1.00 0.00 O
889 ATOM 766 H GLY A 48 -0.447 -17.364 3.039 1.00 0.00 H
890 ATOM 767 1HA GLY A 48 -1.865 -15.105 1.885 1.00 0.00 H
891 ATOM 768 2HA GLY A 48 -2.460 -16.259 3.061 1.00 0.00 H
892 ATOM 769 N GLU A 49 -0.109 -14.083 3.861 1.00 0.00 N
893 ATOM 770 CA GLU A 49 0.309 -13.118 4.864 1.00 0.00 C
894 ATOM 771 C GLU A 49 -0.016 -11.696 4.400 1.00 0.00 C
895 ATOM 772 O GLU A 49 0.669 -10.745 4.774 1.00 0.00 O
896 ATOM 773 CB GLU A 49 1.799 -13.264 5.180 1.00 0.00 C
897 ATOM 774 CG GLU A 49 2.057 -14.504 6.040 1.00 0.00 C
898 ATOM 775 CD GLU A 49 3.531 -14.594 6.442 1.00 0.00 C
899 ATOM 776 OE1 GLU A 49 4.371 -14.618 5.516 1.00 0.00 O
900 ATOM 777 OE2 GLU A 49 3.784 -14.638 7.665 1.00 0.00 O
901 ATOM 778 H GLU A 49 0.568 -14.272 3.149 1.00 0.00 H
902 ATOM 779 HA GLU A 49 -0.271 -13.358 5.755 1.00 0.00 H
903 ATOM 780 1HB GLU A 49 2.366 -13.337 4.252 1.00 0.00 H
904 ATOM 781 2HB GLU A 49 2.153 -12.376 5.701 1.00 0.00 H
905 ATOM 782 1HG GLU A 49 1.434 -14.466 6.934 1.00 0.00 H
906 ATOM 783 2HG GLU A 49 1.771 -15.400 5.489 1.00 0.00 H
907 ATOM 784 N VAL A 50 -1.061 -11.596 3.593 1.00 0.00 N
908 ATOM 785 CA VAL A 50 -1.486 -10.307 3.074 1.00 0.00 C
909 ATOM 786 C VAL A 50 -1.763 -9.358 4.242 1.00 0.00 C
910 ATOM 787 O VAL A 50 -1.553 -8.151 4.130 1.00 0.00 O
911 ATOM 788 CB VAL A 50 -2.692 -10.485 2.151 1.00 0.00 C
912 ATOM 789 CG1 VAL A 50 -3.072 -9.162 1.483 1.00 0.00 C
913 ATOM 790 CG2 VAL A 50 -2.426 -11.569 1.104 1.00 0.00 C
914 ATOM 791 H VAL A 50 -1.613 -12.374 3.294 1.00 0.00 H
915 ATOM 792 HA VAL A 50 -0.664 -9.904 2.483 1.00 0.00 H
916 ATOM 793 HB VAL A 50 -3.536 -10.808 2.759 1.00 0.00 H
917 ATOM 794 1HG1 VAL A 50 -4.022 -8.811 1.887 1.00 0.00 H
918 ATOM 795 2HG1 VAL A 50 -2.298 -8.420 1.680 1.00 0.00 H
919 ATOM 796 3HG1 VAL A 50 -3.167 -9.311 0.407 1.00 0.00 H
920 ATOM 797 1HG2 VAL A 50 -3.243 -12.291 1.113 1.00 0.00 H
921 ATOM 798 2HG2 VAL A 50 -2.354 -11.113 0.117 1.00 0.00 H
922 ATOM 799 3HG2 VAL A 50 -1.490 -12.078 1.338 1.00 0.00 H
923 ATOM 800 N LYS A 51 -2.229 -9.939 5.337 1.00 0.00 N
924 ATOM 801 CA LYS A 51 -2.537 -9.161 6.525 1.00 0.00 C
925 ATOM 802 C LYS A 51 -1.496 -8.051 6.686 1.00 0.00 C
926 ATOM 803 O LYS A 51 -1.805 -6.974 7.193 1.00 0.00 O
927 ATOM 804 CB LYS A 51 -2.657 -10.073 7.747 1.00 0.00 C
928 ATOM 805 CG LYS A 51 -4.107 -10.516 7.960 1.00 0.00 C
929 ATOM 806 CD LYS A 51 -4.313 -11.958 7.492 1.00 0.00 C
930 ATOM 807 CE LYS A 51 -5.181 -12.007 6.233 1.00 0.00 C
931 ATOM 808 NZ LYS A 51 -6.420 -12.776 6.487 1.00 0.00 N
932 ATOM 809 H LYS A 51 -2.397 -10.922 5.421 1.00 0.00 H
933 ATOM 810 HA LYS A 51 -3.512 -8.700 6.369 1.00 0.00 H
934 ATOM 811 1HB LYS A 51 -2.021 -10.949 7.617 1.00 0.00 H
935 ATOM 812 2HB LYS A 51 -2.300 -9.549 8.634 1.00 0.00 H
936 ATOM 813 1HG LYS A 51 -4.366 -10.432 9.015 1.00 0.00 H
937 ATOM 814 2HG LYS A 51 -4.777 -9.853 7.413 1.00 0.00 H
938 ATOM 815 1HD LYS A 51 -3.347 -12.421 7.291 1.00 0.00 H
939 ATOM 816 2HD LYS A 51 -4.784 -12.538 8.286 1.00 0.00 H
940 ATOM 817 1HE LYS A 51 -5.432 -10.995 5.917 1.00 0.00 H
941 ATOM 818 2HE LYS A 51 -4.622 -12.467 5.417 1.00 0.00 H
942 ATOM 819 1HZ LYS A 51 -6.185 -13.720 6.717 1.00 0.00 H
943 ATOM 820 2HZ LYS A 51 -6.918 -12.362 7.248 1.00 0.00 H
944 ATOM 821 3HZ LYS A 51 -6.993 -12.765 5.668 1.00 0.00 H
945 ATOM 822 N LYS A 52 -0.283 -8.354 6.245 1.00 0.00 N
946 ATOM 823 CA LYS A 52 0.805 -7.395 6.335 1.00 0.00 C
947 ATOM 824 C LYS A 52 0.575 -6.272 5.320 1.00 0.00 C
948 ATOM 825 O LYS A 52 0.476 -5.104 5.694 1.00 0.00 O
949 ATOM 826 CB LYS A 52 2.154 -8.099 6.176 1.00 0.00 C
950 ATOM 827 CG LYS A 52 2.852 -8.258 7.528 1.00 0.00 C
951 ATOM 828 CD LYS A 52 4.208 -8.949 7.367 1.00 0.00 C
952 ATOM 829 CE LYS A 52 4.251 -10.261 8.153 1.00 0.00 C
953 ATOM 830 NZ LYS A 52 5.508 -10.991 7.873 1.00 0.00 N
954 ATOM 831 H LYS A 52 -0.040 -9.231 5.834 1.00 0.00 H
955 ATOM 832 HA LYS A 52 0.781 -6.966 7.336 1.00 0.00 H
956 ATOM 833 1HB LYS A 52 2.006 -9.079 5.721 1.00 0.00 H
957 ATOM 834 2HB LYS A 52 2.789 -7.528 5.499 1.00 0.00 H
958 ATOM 835 1HG LYS A 52 2.991 -7.279 7.987 1.00 0.00 H
959 ATOM 836 2HG LYS A 52 2.221 -8.839 8.201 1.00 0.00 H
960 ATOM 837 1HD LYS A 52 4.396 -9.146 6.312 1.00 0.00 H
961 ATOM 838 2HD LYS A 52 5.001 -8.286 7.715 1.00 0.00 H
962 ATOM 839 1HE LYS A 52 4.174 -10.056 9.221 1.00 0.00 H
963 ATOM 840 2HE LYS A 52 3.396 -10.881 7.885 1.00 0.00 H
964 ATOM 841 1HZ LYS A 52 5.694 -11.632 8.619 1.00 0.00 H
965 ATOM 842 2HZ LYS A 52 5.415 -11.497 7.015 1.00 0.00 H
966 ATOM 843 3HZ LYS A 52 6.262 -10.340 7.796 1.00 0.00 H
967 ATOM 844 N VAL A 53 0.496 -6.666 4.058 1.00 0.00 N
968 ATOM 845 CA VAL A 53 0.280 -5.707 2.988 1.00 0.00 C
969 ATOM 846 C VAL A 53 -0.797 -4.707 3.415 1.00 0.00 C
970 ATOM 847 O VAL A 53 -0.508 -3.527 3.614 1.00 0.00 O
971 ATOM 848 CB VAL A 53 -0.067 -6.440 1.691 1.00 0.00 C
972 ATOM 849 CG1 VAL A 53 -0.975 -5.586 0.803 1.00 0.00 C
973 ATOM 850 CG2 VAL A 53 1.199 -6.857 0.941 1.00 0.00 C
974 ATOM 851 H VAL A 53 0.578 -7.618 3.763 1.00 0.00 H
975 ATOM 852 HA VAL A 53 1.215 -5.171 2.832 1.00 0.00 H
976 ATOM 853 HB VAL A 53 -0.613 -7.347 1.954 1.00 0.00 H
977 ATOM 854 1HG1 VAL A 53 -0.583 -4.570 0.755 1.00 0.00 H
978 ATOM 855 2HG1 VAL A 53 -1.007 -6.011 -0.200 1.00 0.00 H
979 ATOM 856 3HG1 VAL A 53 -1.980 -5.567 1.223 1.00 0.00 H
980 ATOM 857 1HG2 VAL A 53 1.686 -7.674 1.473 1.00 0.00 H
981 ATOM 858 2HG2 VAL A 53 0.934 -7.186 -0.065 1.00 0.00 H
982 ATOM 859 3HG2 VAL A 53 1.880 -6.007 0.878 1.00 0.00 H
983 ATOM 860 N GLU A 54 -2.014 -5.214 3.543 1.00 0.00 N
984 ATOM 861 CA GLU A 54 -3.134 -4.380 3.944 1.00 0.00 C
985 ATOM 862 C GLU A 54 -2.701 -3.395 5.031 1.00 0.00 C
986 ATOM 863 O GLU A 54 -2.645 -2.189 4.795 1.00 0.00 O
987 ATOM 864 CB GLU A 54 -4.312 -5.234 4.416 1.00 0.00 C
988 ATOM 865 CG GLU A 54 -4.669 -6.299 3.376 1.00 0.00 C
989 ATOM 866 CD GLU A 54 -6.108 -6.126 2.885 1.00 0.00 C
990 ATOM 867 OE1 GLU A 54 -7.004 -6.701 3.540 1.00 0.00 O
991 ATOM 868 OE2 GLU A 54 -6.278 -5.423 1.865 1.00 0.00 O
992 ATOM 869 H GLU A 54 -2.239 -6.175 3.380 1.00 0.00 H
993 ATOM 870 HA GLU A 54 -3.425 -3.836 3.045 1.00 0.00 H
994 ATOM 871 1HB GLU A 54 -4.063 -5.714 5.362 1.00 0.00 H
995 ATOM 872 2HB GLU A 54 -5.177 -4.597 4.600 1.00 0.00 H
996 ATOM 873 1HG GLU A 54 -3.982 -6.232 2.533 1.00 0.00 H
997 ATOM 874 2HG GLU A 54 -4.546 -7.292 3.810 1.00 0.00 H
998 ATOM 875 N GLU A 55 -2.405 -3.945 6.199 1.00 0.00 N
999 ATOM 876 CA GLU A 55 -1.979 -3.130 7.324 1.00 0.00 C
1000 ATOM 877 C GLU A 55 -0.968 -2.078 6.863 1.00 0.00 C
1001 ATOM 878 O GLU A 55 -0.913 -0.981 7.418 1.00 0.00 O
1002 ATOM 879 CB GLU A 55 -1.395 -3.999 8.441 1.00 0.00 C
1003 ATOM 880 CG GLU A 55 -2.243 -3.899 9.711 1.00 0.00 C
1004 ATOM 881 CD GLU A 55 -1.366 -3.984 10.963 1.00 0.00 C
1005 ATOM 882 OE1 GLU A 55 -0.362 -3.240 11.003 1.00 0.00 O
1006 ATOM 883 OE2 GLU A 55 -1.719 -4.789 11.850 1.00 0.00 O
1007 ATOM 884 H GLU A 55 -2.453 -4.927 6.384 1.00 0.00 H
1008 ATOM 885 HA GLU A 55 -2.883 -2.641 7.688 1.00 0.00 H
1009 ATOM 886 1HB GLU A 55 -1.347 -5.036 8.112 1.00 0.00 H
1010 ATOM 887 2HB GLU A 55 -0.374 -3.684 8.655 1.00 0.00 H
1011 ATOM 888 1HG GLU A 55 -2.795 -2.959 9.712 1.00 0.00 H
1012 ATOM 889 2HG GLU A 55 -2.979 -4.703 9.725 1.00 0.00 H
1013 ATOM 890 N GLU A 56 -0.193 -2.449 5.855 1.00 0.00 N
1014 ATOM 891 CA GLU A 56 0.812 -1.550 5.314 1.00 0.00 C
1015 ATOM 892 C GLU A 56 0.147 -0.434 4.506 1.00 0.00 C
1016 ATOM 893 O GLU A 56 0.544 0.727 4.602 1.00 0.00 O
1017 ATOM 894 CB GLU A 56 1.827 -2.313 4.460 1.00 0.00 C
1018 ATOM 895 CG GLU A 56 3.251 -1.825 4.734 1.00 0.00 C
1019 ATOM 896 CD GLU A 56 3.561 -1.847 6.233 1.00 0.00 C
1020 ATOM 897 OE1 GLU A 56 3.681 -0.743 6.804 1.00 0.00 O
1021 ATOM 898 OE2 GLU A 56 3.668 -2.969 6.773 1.00 0.00 O
1022 ATOM 899 H GLU A 56 -0.244 -3.343 5.411 1.00 0.00 H
1023 ATOM 900 HA GLU A 56 1.320 -1.128 6.181 1.00 0.00 H
1024 ATOM 901 1HB GLU A 56 1.758 -3.381 4.675 1.00 0.00 H
1025 ATOM 902 2HB GLU A 56 1.591 -2.184 3.405 1.00 0.00 H
1026 ATOM 903 1HG GLU A 56 3.965 -2.455 4.203 1.00 0.00 H
1027 ATOM 904 2HG GLU A 56 3.372 -0.812 4.350 1.00 0.00 H
1028 ATOM 905 N VAL A 57 -0.854 -0.823 3.730 1.00 0.00 N
1029 ATOM 906 CA VAL A 57 -1.578 0.130 2.908 1.00 0.00 C
1030 ATOM 907 C VAL A 57 -2.439 1.021 3.805 1.00 0.00 C
1031 ATOM 908 O VAL A 57 -2.873 2.094 3.388 1.00 0.00 O
1032 ATOM 909 CB VAL A 57 -2.389 -0.608 1.842 1.00 0.00 C
1033 ATOM 910 CG1 VAL A 57 -2.697 0.307 0.655 1.00 0.00 C
1034 ATOM 911 CG2 VAL A 57 -1.667 -1.877 1.384 1.00 0.00 C
1035 ATOM 912 H VAL A 57 -1.170 -1.769 3.659 1.00 0.00 H
1036 ATOM 913 HA VAL A 57 -0.840 0.752 2.399 1.00 0.00 H
1037 ATOM 914 HB VAL A 57 -3.338 -0.906 2.289 1.00 0.00 H
1038 ATOM 915 1HG1 VAL A 57 -3.424 -0.177 0.002 1.00 0.00 H
1039 ATOM 916 2HG1 VAL A 57 -3.106 1.249 1.019 1.00 0.00 H
1040 ATOM 917 3HG1 VAL A 57 -1.781 0.499 0.098 1.00 0.00 H
1041 ATOM 918 1HG2 VAL A 57 -0.628 -1.840 1.708 1.00 0.00 H
1042 ATOM 919 2HG2 VAL A 57 -2.153 -2.750 1.821 1.00 0.00 H
1043 ATOM 920 3HG2 VAL A 57 -1.707 -1.945 0.297 1.00 0.00 H
1044 ATOM 921 N LYS A 58 -2.661 0.544 5.021 1.00 0.00 N
1045 ATOM 922 CA LYS A 58 -3.463 1.283 5.981 1.00 0.00 C
1046 ATOM 923 C LYS A 58 -2.640 2.446 6.538 1.00 0.00 C
1047 ATOM 924 O LYS A 58 -3.067 3.598 6.479 1.00 0.00 O
1048 ATOM 925 CB LYS A 58 -4.011 0.345 7.058 1.00 0.00 C
1049 ATOM 926 CG LYS A 58 -5.357 0.842 7.586 1.00 0.00 C
1050 ATOM 927 CD LYS A 58 -6.480 -0.134 7.232 1.00 0.00 C
1051 ATOM 928 CE LYS A 58 -7.038 -0.807 8.488 1.00 0.00 C
1052 ATOM 929 NZ LYS A 58 -7.167 -2.266 8.282 1.00 0.00 N
1053 ATOM 930 H LYS A 58 -2.304 -0.330 5.352 1.00 0.00 H
1054 ATOM 931 HA LYS A 58 -4.320 1.692 5.444 1.00 0.00 H
1055 ATOM 932 1HB LYS A 58 -4.125 -0.659 6.647 1.00 0.00 H
1056 ATOM 933 2HB LYS A 58 -3.297 0.273 7.879 1.00 0.00 H
1057 ATOM 934 1HG LYS A 58 -5.304 0.964 8.667 1.00 0.00 H
1058 ATOM 935 2HG LYS A 58 -5.577 1.823 7.165 1.00 0.00 H
1059 ATOM 936 1HD LYS A 58 -7.278 0.396 6.713 1.00 0.00 H
1060 ATOM 937 2HD LYS A 58 -6.103 -0.894 6.546 1.00 0.00 H
1061 ATOM 938 1HE LYS A 58 -6.383 -0.609 9.336 1.00 0.00 H
1062 ATOM 939 2HE LYS A 58 -8.012 -0.381 8.732 1.00 0.00 H
1063 ATOM 940 1HZ LYS A 58 -8.059 -2.573 8.612 1.00 0.00 H
1064 ATOM 941 2HZ LYS A 58 -7.082 -2.474 7.307 1.00 0.00 H
1065 ATOM 942 3HZ LYS A 58 -6.444 -2.739 8.788 1.00 0.00 H
1066 ATOM 943 N LYS A 59 -1.474 2.103 7.067 1.00 0.00 N
1067 ATOM 944 CA LYS A 59 -0.587 3.105 7.635 1.00 0.00 C
1068 ATOM 945 C LYS A 59 -0.591 4.348 6.743 1.00 0.00 C
1069 ATOM 946 O LYS A 59 -0.405 5.463 7.227 1.00 0.00 O
1070 ATOM 947 CB LYS A 59 0.807 2.517 7.864 1.00 0.00 C
1071 ATOM 948 CG LYS A 59 1.624 3.398 8.811 1.00 0.00 C
1072 ATOM 949 CD LYS A 59 2.954 3.803 8.173 1.00 0.00 C
1073 ATOM 950 CE LYS A 59 2.753 4.921 7.149 1.00 0.00 C
1074 ATOM 951 NZ LYS A 59 2.718 6.239 7.819 1.00 0.00 N
1075 ATOM 952 H LYS A 59 -1.135 1.164 7.111 1.00 0.00 H
1076 ATOM 953 HA LYS A 59 -0.986 3.379 8.611 1.00 0.00 H
1077 ATOM 954 1HB LYS A 59 0.719 1.513 8.280 1.00 0.00 H
1078 ATOM 955 2HB LYS A 59 1.327 2.422 6.911 1.00 0.00 H
1079 ATOM 956 1HG LYS A 59 1.053 4.289 9.068 1.00 0.00 H
1080 ATOM 957 2HG LYS A 59 1.811 2.861 9.742 1.00 0.00 H
1081 ATOM 958 1HD LYS A 59 3.647 4.135 8.948 1.00 0.00 H
1082 ATOM 959 2HD LYS A 59 3.408 2.939 7.689 1.00 0.00 H
1083 ATOM 960 1HE LYS A 59 3.559 4.900 6.415 1.00 0.00 H
1084 ATOM 961 2HE LYS A 59 1.822 4.759 6.604 1.00 0.00 H
1085 ATOM 962 1HZ LYS A 59 2.129 6.188 8.625 1.00 0.00 H
1086 ATOM 963 2HZ LYS A 59 3.644 6.495 8.100 1.00 0.00 H
1087 ATOM 964 3HZ LYS A 59 2.361 6.926 7.187 1.00 0.00 H
1088 ATOM 965 N LEU A 60 -0.805 4.114 5.457 1.00 0.00 N
1089 ATOM 966 CA LEU A 60 -0.837 5.201 4.493 1.00 0.00 C
1090 ATOM 967 C LEU A 60 -2.152 5.969 4.638 1.00 0.00 C
1091 ATOM 968 O LEU A 60 -2.162 7.108 5.100 1.00 0.00 O
1092 ATOM 969 CB LEU A 60 -0.586 4.671 3.080 1.00 0.00 C
1093 ATOM 970 CG LEU A 60 0.877 4.615 2.635 1.00 0.00 C
1094 ATOM 971 CD1 LEU A 60 1.250 3.209 2.157 1.00 0.00 C
1095 ATOM 972 CD2 LEU A 60 1.168 5.676 1.572 1.00 0.00 C
1096 ATOM 973 H LEU A 60 -0.957 3.203 5.072 1.00 0.00 H
1097 ATOM 974 HA LEU A 60 -0.015 5.876 4.735 1.00 0.00 H
1098 ATOM 975 1HB LEU A 60 -1.006 3.668 3.009 1.00 0.00 H
1099 ATOM 976 2HB LEU A 60 -1.135 5.297 2.377 1.00 0.00 H
1100 ATOM 977 HG LEU A 60 1.506 4.840 3.496 1.00 0.00 H
1101 ATOM 978 1HD1 LEU A 60 0.568 2.483 2.598 1.00 0.00 H
1102 ATOM 979 2HD1 LEU A 60 1.178 3.163 1.071 1.00 0.00 H
1103 ATOM 980 3HD1 LEU A 60 2.271 2.982 2.464 1.00 0.00 H
1104 ATOM 981 1HD2 LEU A 60 0.433 5.601 0.771 1.00 0.00 H
1105 ATOM 982 2HD2 LEU A 60 1.112 6.667 2.024 1.00 0.00 H
1106 ATOM 983 3HD2 LEU A 60 2.167 5.518 1.164 1.00 0.00 H
1107 ATOM 984 N GLU A 61 -3.230 5.312 4.235 1.00 0.00 N
1108 ATOM 985 CA GLU A 61 -4.549 5.919 4.315 1.00 0.00 C
1109 ATOM 986 C GLU A 61 -4.659 6.788 5.568 1.00 0.00 C
1110 ATOM 987 O GLU A 61 -5.005 7.965 5.483 1.00 0.00 O
1111 ATOM 988 CB GLU A 61 -5.645 4.851 4.290 1.00 0.00 C
1112 ATOM 989 CG GLU A 61 -5.773 4.230 2.897 1.00 0.00 C
1113 ATOM 990 CD GLU A 61 -7.139 4.542 2.282 1.00 0.00 C
1114 ATOM 991 OE1 GLU A 61 -7.189 4.649 1.037 1.00 0.00 O
1115 ATOM 992 OE2 GLU A 61 -8.101 4.667 3.069 1.00 0.00 O
1116 ATOM 993 H GLU A 61 -3.214 4.385 3.861 1.00 0.00 H
1117 ATOM 994 HA GLU A 61 -4.636 6.540 3.424 1.00 0.00 H
1118 ATOM 995 1HB GLU A 61 -5.418 4.074 5.019 1.00 0.00 H
1119 ATOM 996 2HB GLU A 61 -6.597 5.295 4.583 1.00 0.00 H
1120 ATOM 997 1HG GLU A 61 -4.983 4.611 2.250 1.00 0.00 H
1121 ATOM 998 2HG GLU A 61 -5.639 3.150 2.963 1.00 0.00 H
1122 ATOM 999 N GLU A 62 -4.358 6.174 6.704 1.00 0.00 N
1123 ATOM 1000 CA GLU A 62 -4.418 6.878 7.974 1.00 0.00 C
1124 ATOM 1001 C GLU A 62 -3.618 8.180 7.897 1.00 0.00 C
1125 ATOM 1002 O GLU A 62 -4.181 9.266 8.025 1.00 0.00 O
1126 ATOM 1003 CB GLU A 62 -3.915 5.992 9.116 1.00 0.00 C
1127 ATOM 1004 CG GLU A 62 -5.077 5.512 9.989 1.00 0.00 C
1128 ATOM 1005 CD GLU A 62 -5.691 4.228 9.427 1.00 0.00 C
1129 ATOM 1006 OE1 GLU A 62 -4.911 3.280 9.193 1.00 0.00 O
1130 ATOM 1007 OE2 GLU A 62 -6.928 4.223 9.244 1.00 0.00 O
1131 ATOM 1008 H GLU A 62 -4.077 5.216 6.764 1.00 0.00 H
1132 ATOM 1009 HA GLU A 62 -5.473 7.099 8.132 1.00 0.00 H
1133 ATOM 1010 1HB GLU A 62 -3.384 5.132 8.707 1.00 0.00 H
1134 ATOM 1011 2HB GLU A 62 -3.202 6.547 9.725 1.00 0.00 H
1135 ATOM 1012 1HG GLU A 62 -4.724 5.336 11.005 1.00 0.00 H
1136 ATOM 1013 2HG GLU A 62 -5.839 6.290 10.046 1.00 0.00 H
1137 ATOM 1014 N GLU A 63 -2.318 8.027 7.691 1.00 0.00 N
1138 ATOM 1015 CA GLU A 63 -1.436 9.178 7.596 1.00 0.00 C
1139 ATOM 1016 C GLU A 63 -1.893 10.106 6.468 1.00 0.00 C
1140 ATOM 1017 O GLU A 63 -2.168 11.282 6.701 1.00 0.00 O
1141 ATOM 1018 CB GLU A 63 0.016 8.740 7.393 1.00 0.00 C
1142 ATOM 1019 CG GLU A 63 0.962 9.550 8.281 1.00 0.00 C
1143 ATOM 1020 CD GLU A 63 2.284 9.828 7.564 1.00 0.00 C
1144 ATOM 1021 OE1 GLU A 63 2.219 10.408 6.458 1.00 0.00 O
1145 ATOM 1022 OE2 GLU A 63 3.331 9.455 8.136 1.00 0.00 O
1146 ATOM 1023 H GLU A 63 -1.868 7.140 7.588 1.00 0.00 H
1147 ATOM 1024 HA GLU A 63 -1.523 9.690 8.555 1.00 0.00 H
1148 ATOM 1025 1HB GLU A 63 0.115 7.679 7.621 1.00 0.00 H
1149 ATOM 1026 2HB GLU A 63 0.294 8.869 6.347 1.00 0.00 H
1150 ATOM 1027 1HG GLU A 63 0.490 10.491 8.559 1.00 0.00 H
1151 ATOM 1028 2HG GLU A 63 1.154 9.004 9.205 1.00 0.00 H
1152 ATOM 1029 N ILE A 64 -1.959 9.542 5.272 1.00 0.00 N
1153 ATOM 1030 CA ILE A 64 -2.377 10.304 4.107 1.00 0.00 C
1154 ATOM 1031 C ILE A 64 -3.641 11.095 4.448 1.00 0.00 C
1155 ATOM 1032 O ILE A 64 -3.730 12.287 4.156 1.00 0.00 O
1156 ATOM 1033 CB ILE A 64 -2.534 9.385 2.894 1.00 0.00 C
1157 ATOM 1034 CG1 ILE A 64 -1.247 8.603 2.627 1.00 0.00 C
1158 ATOM 1035 CG2 ILE A 64 -2.990 10.174 1.665 1.00 0.00 C
1159 ATOM 1036 CD1 ILE A 64 -1.109 8.264 1.142 1.00 0.00 C
1160 ATOM 1037 H ILE A 64 -1.733 8.585 5.091 1.00 0.00 H
1161 ATOM 1038 HA ILE A 64 -1.579 11.010 3.876 1.00 0.00 H
1162 ATOM 1039 HB ILE A 64 -3.314 8.657 3.116 1.00 0.00 H
1163 ATOM 1040 1HG1 ILE A 64 -0.387 9.188 2.953 1.00 0.00 H
1164 ATOM 1041 2HG1 ILE A 64 -1.248 7.684 3.215 1.00 0.00 H
1165 ATOM 1042 1HG2 ILE A 64 -3.674 9.563 1.074 1.00 0.00 H
1166 ATOM 1043 2HG2 ILE A 64 -3.500 11.083 1.985 1.00 0.00 H
1167 ATOM 1044 3HG2 ILE A 64 -2.123 10.438 1.059 1.00 0.00 H
1168 ATOM 1045 1HD1 ILE A 64 -2.095 8.076 0.718 1.00 0.00 H
1169 ATOM 1046 2HD1 ILE A 64 -0.644 9.101 0.621 1.00 0.00 H
1170 ATOM 1047 3HD1 ILE A 64 -0.488 7.376 1.028 1.00 0.00 H
1171 ATOM 1048 N LYS A 65 -4.588 10.400 5.061 1.00 0.00 N
1172 ATOM 1049 CA LYS A 65 -5.844 11.023 5.445 1.00 0.00 C
1173 ATOM 1050 C LYS A 65 -5.558 12.211 6.366 1.00 0.00 C
1174 ATOM 1051 O LYS A 65 -6.297 13.194 6.363 1.00 0.00 O
1175 ATOM 1052 CB LYS A 65 -6.792 9.987 6.052 1.00 0.00 C
1176 ATOM 1053 CG LYS A 65 -8.111 10.634 6.478 1.00 0.00 C
1177 ATOM 1054 CD LYS A 65 -8.918 9.696 7.377 1.00 0.00 C
1178 ATOM 1055 CE LYS A 65 -8.863 10.153 8.836 1.00 0.00 C
1179 ATOM 1056 NZ LYS A 65 -10.227 10.419 9.347 1.00 0.00 N
1180 ATOM 1057 H LYS A 65 -4.508 9.431 5.294 1.00 0.00 H
1181 ATOM 1058 HA LYS A 65 -6.314 11.397 4.536 1.00 0.00 H
1182 ATOM 1059 1HB LYS A 65 -6.987 9.198 5.327 1.00 0.00 H
1183 ATOM 1060 2HB LYS A 65 -6.318 9.517 6.915 1.00 0.00 H
1184 ATOM 1061 1HG LYS A 65 -7.909 11.566 7.006 1.00 0.00 H
1185 ATOM 1062 2HG LYS A 65 -8.696 10.890 5.595 1.00 0.00 H
1186 ATOM 1063 1HD LYS A 65 -9.954 9.665 7.041 1.00 0.00 H
1187 ATOM 1064 2HD LYS A 65 -8.525 8.683 7.296 1.00 0.00 H
1188 ATOM 1065 1HE LYS A 65 -8.383 9.388 9.446 1.00 0.00 H
1189 ATOM 1066 2HE LYS A 65 -8.256 11.055 8.918 1.00 0.00 H
1190 ATOM 1067 1HZ LYS A 65 -10.643 11.158 8.816 1.00 0.00 H
1191 ATOM 1068 2HZ LYS A 65 -10.782 9.592 9.261 1.00 0.00 H
1192 ATOM 1069 3HZ LYS A 65 -10.176 10.688 10.309 1.00 0.00 H
1193 ATOM 1070 N LYS A 66 -4.485 12.080 7.132 1.00 0.00 N
1194 ATOM 1071 CA LYS A 66 -4.093 13.130 8.056 1.00 0.00 C
1195 ATOM 1072 C LYS A 66 -3.270 14.180 7.309 1.00 0.00 C
1196 ATOM 1073 O LYS A 66 -3.325 15.365 7.635 1.00 0.00 O
1197 ATOM 1074 CB LYS A 66 -3.375 12.535 9.270 1.00 0.00 C
1198 ATOM 1075 CG LYS A 66 -3.771 13.267 10.554 1.00 0.00 C
1199 ATOM 1076 CD LYS A 66 -2.536 13.797 11.286 1.00 0.00 C
1200 ATOM 1077 CE LYS A 66 -2.447 13.218 12.700 1.00 0.00 C
1201 ATOM 1078 NZ LYS A 66 -1.326 13.836 13.442 1.00 0.00 N
1202 ATOM 1079 H LYS A 66 -3.889 11.277 7.128 1.00 0.00 H
1203 ATOM 1080 HA LYS A 66 -5.005 13.602 8.421 1.00 0.00 H
1204 ATOM 1081 1HB LYS A 66 -3.620 11.477 9.360 1.00 0.00 H
1205 ATOM 1082 2HB LYS A 66 -2.296 12.601 9.127 1.00 0.00 H
1206 ATOM 1083 1HG LYS A 66 -4.438 14.094 10.314 1.00 0.00 H
1207 ATOM 1084 2HG LYS A 66 -4.323 12.591 11.207 1.00 0.00 H
1208 ATOM 1085 1HD LYS A 66 -1.638 13.537 10.726 1.00 0.00 H
1209 ATOM 1086 2HD LYS A 66 -2.577 14.885 11.336 1.00 0.00 H
1210 ATOM 1087 1HE LYS A 66 -3.383 13.393 13.230 1.00 0.00 H
1211 ATOM 1088 2HE LYS A 66 -2.306 12.139 12.649 1.00 0.00 H
1212 ATOM 1089 1HZ LYS A 66 -1.100 14.720 13.031 1.00 0.00 H
1213 ATOM 1090 2HZ LYS A 66 -1.593 13.972 14.397 1.00 0.00 H
1214 ATOM 1091 3HZ LYS A 66 -0.528 13.235 13.401 1.00 0.00 H
1215 ATOM 1092 N LEU A 67 -2.524 13.708 6.321 1.00 0.00 N
1216 ATOM 1093 CA LEU A 67 -1.690 14.592 5.524 1.00 0.00 C
1217 ATOM 1094 C LEU A 67 -2.554 15.706 4.932 1.00 0.00 C
1218 ATOM 1095 O LEU A 67 -2.044 16.765 4.568 1.00 0.00 O
1219 ATOM 1096 CB LEU A 67 -0.913 13.794 4.474 1.00 0.00 C
1220 ATOM 1097 CG LEU A 67 0.380 13.131 4.957 1.00 0.00 C
1221 ATOM 1098 CD1 LEU A 67 0.757 11.951 4.061 1.00 0.00 C
1222 ATOM 1099 CD2 LEU A 67 1.512 14.154 5.067 1.00 0.00 C
1223 ATOM 1100 H LEU A 67 -2.484 12.742 6.063 1.00 0.00 H
1224 ATOM 1101 HA LEU A 67 -0.957 15.042 6.194 1.00 0.00 H
1225 ATOM 1102 1HB LEU A 67 -1.568 13.020 4.077 1.00 0.00 H
1226 ATOM 1103 2HB LEU A 67 -0.669 14.461 3.648 1.00 0.00 H
1227 ATOM 1104 HG LEU A 67 0.207 12.733 5.958 1.00 0.00 H
1228 ATOM 1105 1HD1 LEU A 67 0.068 11.898 3.218 1.00 0.00 H
1229 ATOM 1106 2HD1 LEU A 67 1.774 12.087 3.690 1.00 0.00 H
1230 ATOM 1107 3HD1 LEU A 67 0.702 11.026 4.635 1.00 0.00 H
1231 ATOM 1108 1HD2 LEU A 67 2.326 13.732 5.657 1.00 0.00 H
1232 ATOM 1109 2HD2 LEU A 67 1.876 14.401 4.070 1.00 0.00 H
1233 ATOM 1110 3HD2 LEU A 67 1.141 15.056 5.553 1.00 0.00 H
1236 MASTER 79 0 0 3 0 0 0 617760 16 0 6
projects / unres.git / blob