Hugging Face's logo

Spaces:
kabuda777
/
Code2MCP-esm
Running

App Files Community
kabudadada commited on
Commit
7528abe
·
1 Parent(s): c6562b0

chore(esM mcp): update requirements for local esm source (torch,fairscale,numpy,tqdm)

Browse files
Files changed (2) hide show
  1. esm/mcp_output/predictions/prediction_20250911_125246.pdb +489 -0
  2. esm/mcp_output/requirements.txt +5 -0
esm/mcp_output/predictions/prediction_20250911_125246.pdb ADDED
@@ -0,0 +1,489 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ HEADER 18-OCT-22
2
+ TITLE ESMFOLD V1 PREDICTION FOR INPUT
3
+ REMARK 1
4
+ REMARK 1 REFERENCE 1
5
+ REMARK 1 AUTH ZEMING LIN, HALIL AKIN, ROSHAN RAO, BRIAN HIE, ZHONGKAI ZHU,
6
+ REMARK 1 AUTH 2 WENTING LU, NIKITA SMETANIN, ROBERT VERKUIL, ORI KABELI,
7
+ REMARK 1 AUTH 3 YANIV SHMUELI, ALLAN DOS SANTOS COSTA,
8
+ REMARK 1 AUTH 4 MARYAM FAZEL-ZARANDI, TOM SERCU, SALVATORE CANDIDO,
9
+ REMARK 1 AUTH 5 ALEXANDER RIVES
10
+ REMARK 1 TITL EVOLUTIONARY-SCALE PREDICTION OF ATOMIC LEVEL PROTEIN
11
+ REMARK 1 TITL 2 STRUCTURE WITH A LANGUAGE MODEL
12
+ REMARK 1 REF
13
+ REMARK 1 REFN
14
+ REMARK 1 PMID
15
+ REMARK 1 DOI 10.1101/2022.07.20.500902
16
+ REMARK 1
17
+ REMARK 1 LICENSE AND DISCLAIMERS
18
+ REMARK 1 ESM METAGENOMIC ATLAS DATA IS AVAILABLE UNDER
19
+ REMARK 1 A CC-BY-4.0 LICENSE FOR ACADEMIC AND COMMERCIAL USE.
20
+ REMARK 1 COPYRIGHT (C) META PLATFORMS, INC. ALL RIGHTS RESERVED.
21
+ REMARK 1 USE OF THE ESM METAGENOMIC ATLAS DATA IS SUBJECT
22
+ REMARK 1 TO THE META OPEN SOURCE TERMS OF USE AND PRIVACY POLICY.
23
+ ATOM 1 N MET A 1 12.955 22.762 2.808 1.00 0.40 N
24
+ ATOM 2 CA MET A 1 13.442 21.402 3.023 1.00 0.43 C
25
+ ATOM 3 C MET A 1 12.281 20.416 3.108 1.00 0.41 C
26
+ ATOM 4 CB MET A 1 14.285 21.328 4.297 1.00 0.37 C
27
+ ATOM 5 O MET A 1 11.322 20.643 3.847 1.00 0.40 O
28
+ ATOM 6 CG MET A 1 15.524 20.457 4.162 1.00 0.36 C
29
+ ATOM 7 SD MET A 1 16.674 20.646 5.579 1.00 0.46 S
30
+ ATOM 8 CE MET A 1 16.455 19.037 6.387 1.00 0.35 C
31
+ ATOM 9 N LYS A 2 11.743 19.862 2.050 1.00 0.44 N
32
+ ATOM 10 CA LYS A 2 10.680 18.862 2.091 1.00 0.48 C
33
+ ATOM 11 C LYS A 2 10.854 17.924 3.282 1.00 0.45 C
34
+ ATOM 12 CB LYS A 2 10.648 18.058 0.791 1.00 0.41 C
35
+ ATOM 13 O LYS A 2 11.967 17.481 3.573 1.00 0.44 O
36
+ ATOM 14 CG LYS A 2 9.807 18.691 -0.308 1.00 0.40 C
37
+ ATOM 15 CD LYS A 2 9.743 17.804 -1.544 1.00 0.44 C
38
+ ATOM 16 CE LYS A 2 8.931 18.452 -2.657 1.00 0.42 C
39
+ ATOM 17 NZ LYS A 2 8.883 17.595 -3.880 1.00 0.37 N
40
+ ATOM 18 N THR A 3 10.260 18.153 4.498 1.00 0.59 N
41
+ ATOM 19 CA THR A 3 10.394 17.359 5.714 1.00 0.62 C
42
+ ATOM 20 C THR A 3 10.444 15.870 5.386 1.00 0.57 C
43
+ ATOM 21 CB THR A 3 9.235 17.633 6.691 1.00 0.52 C
44
+ ATOM 22 O THR A 3 10.034 15.454 4.300 1.00 0.52 O
45
+ ATOM 23 CG2 THR A 3 9.446 18.945 7.440 1.00 0.42 C
46
+ ATOM 24 OG1 THR A 3 8.007 17.707 5.957 1.00 0.44 O
47
+ ATOM 25 N VAL A 4 11.392 14.978 5.807 1.00 0.55 N
48
+ ATOM 26 CA VAL A 4 11.478 13.527 5.688 1.00 0.55 C
49
+ ATOM 27 C VAL A 4 10.083 12.942 5.476 1.00 0.55 C
50
+ ATOM 28 CB VAL A 4 12.139 12.893 6.932 1.00 0.50 C
51
+ ATOM 29 O VAL A 4 9.905 12.019 4.678 1.00 0.54 O
52
+ ATOM 30 CG1 VAL A 4 12.097 11.368 6.849 1.00 0.40 C
53
+ ATOM 31 CG2 VAL A 4 13.578 13.384 7.080 1.00 0.41 C
54
+ ATOM 32 N ARG A 5 9.045 13.367 6.280 1.00 0.59 N
55
+ ATOM 33 CA ARG A 5 7.679 12.859 6.208 1.00 0.59 C
56
+ ATOM 34 C ARG A 5 7.124 12.979 4.793 1.00 0.58 C
57
+ ATOM 35 CB ARG A 5 6.775 13.607 7.191 1.00 0.55 C
58
+ ATOM 36 O ARG A 5 6.507 12.043 4.280 1.00 0.57 O
59
+ ATOM 37 CG ARG A 5 5.520 12.841 7.578 1.00 0.51 C
60
+ ATOM 38 CD ARG A 5 4.719 13.573 8.645 1.00 0.53 C
61
+ ATOM 39 NE ARG A 5 3.461 12.892 8.938 1.00 0.46 N
62
+ ATOM 40 NH1 ARG A 5 2.718 14.472 10.450 1.00 0.36 N
63
+ ATOM 41 NH2 ARG A 5 1.430 12.635 9.979 1.00 0.32 N
64
+ ATOM 42 CZ ARG A 5 2.539 13.335 9.788 1.00 0.47 C
65
+ ATOM 43 N GLN A 6 7.225 14.159 4.296 1.00 0.54 N
66
+ ATOM 44 CA GLN A 6 6.739 14.443 2.950 1.00 0.53 C
67
+ ATOM 45 C GLN A 6 7.437 13.564 1.916 1.00 0.54 C
68
+ ATOM 46 CB GLN A 6 6.942 15.920 2.607 1.00 0.49 C
69
+ ATOM 47 O GLN A 6 6.804 13.084 0.974 1.00 0.53 O
70
+ ATOM 48 CG GLN A 6 5.903 16.844 3.227 1.00 0.46 C
71
+ ATOM 49 CD GLN A 6 6.171 18.309 2.935 1.00 0.48 C
72
+ ATOM 50 NE2 GLN A 6 5.132 19.132 3.031 1.00 0.42 N
73
+ ATOM 51 OE1 GLN A 6 7.302 18.697 2.626 1.00 0.54 O
74
+ ATOM 52 N GLU A 7 8.751 13.356 2.208 1.00 0.53 N
75
+ ATOM 53 CA GLU A 7 9.522 12.566 1.253 1.00 0.51 C
76
+ ATOM 54 C GLU A 7 9.048 11.115 1.229 1.00 0.52 C
77
+ ATOM 55 CB GLU A 7 11.015 12.627 1.585 1.00 0.49 C
78
+ ATOM 56 O GLU A 7 8.959 10.504 0.162 1.00 0.52 O
79
+ ATOM 57 CG GLU A 7 11.700 13.898 1.106 1.00 0.45 C
80
+ ATOM 58 CD GLU A 7 13.193 13.920 1.394 1.00 0.47 C
81
+ ATOM 59 OE1 GLU A 7 13.697 12.984 2.054 1.00 0.53 O
82
+ ATOM 60 OE2 GLU A 7 13.863 14.882 0.956 1.00 0.48 O
83
+ ATOM 61 N ARG A 8 8.906 10.459 2.342 1.00 0.54 N
84
+ ATOM 62 CA ARG A 8 8.501 9.057 2.381 1.00 0.53 C
85
+ ATOM 63 C ARG A 8 7.127 8.866 1.748 1.00 0.54 C
86
+ ATOM 64 CB ARG A 8 8.491 8.540 3.821 1.00 0.52 C
87
+ ATOM 65 O ARG A 8 6.894 7.883 1.042 1.00 0.53 O
88
+ ATOM 66 CG ARG A 8 9.859 8.124 4.336 1.00 0.50 C
89
+ ATOM 67 CD ARG A 8 9.777 7.520 5.731 1.00 0.51 C
90
+ ATOM 68 NE ARG A 8 11.087 7.083 6.207 1.00 0.45 N
91
+ ATOM 69 NH1 ARG A 8 10.307 6.243 8.213 1.00 0.37 N
92
+ ATOM 70 NH2 ARG A 8 12.540 6.130 7.708 1.00 0.33 N
93
+ ATOM 71 CZ ARG A 8 11.308 6.486 7.375 1.00 0.48 C
94
+ ATOM 72 N LEU A 9 6.231 9.830 2.211 1.00 0.55 N
95
+ ATOM 73 CA LEU A 9 4.899 9.731 1.624 1.00 0.54 C
96
+ ATOM 74 C LEU A 9 4.969 9.810 0.103 1.00 0.55 C
97
+ ATOM 75 CB LEU A 9 3.992 10.840 2.163 1.00 0.52 C
98
+ ATOM 76 O LEU A 9 4.234 9.107 -0.594 1.00 0.55 O
99
+ ATOM 77 CG LEU A 9 3.348 10.585 3.527 1.00 0.50 C
100
+ ATOM 78 CD1 LEU A 9 2.845 11.893 4.128 1.00 0.45 C
101
+ ATOM 79 CD2 LEU A 9 2.211 9.577 3.402 1.00 0.47 C
102
+ ATOM 80 N LEU A 10 5.770 10.725 -0.331 1.00 0.49 N
103
+ ATOM 81 CA LEU A 10 5.935 10.895 -1.770 1.00 0.48 C
104
+ ATOM 82 C LEU A 10 6.431 9.605 -2.417 1.00 0.49 C
105
+ ATOM 83 CB LEU A 10 6.911 12.036 -2.067 1.00 0.46 C
106
+ ATOM 84 O LEU A 10 5.980 9.237 -3.503 1.00 0.49 O
107
+ ATOM 85 CG LEU A 10 6.296 13.336 -2.587 1.00 0.43 C
108
+ ATOM 86 CD1 LEU A 10 6.864 14.532 -1.829 1.00 0.38 C
109
+ ATOM 87 CD2 LEU A 10 6.540 13.481 -4.085 1.00 0.41 C
110
+ ATOM 88 N LYS A 11 7.442 8.965 -1.722 1.00 0.51 N
111
+ ATOM 89 CA LYS A 11 8.010 7.762 -2.324 1.00 0.50 C
112
+ ATOM 90 C LYS A 11 6.960 6.663 -2.454 1.00 0.51 C
113
+ ATOM 91 CB LYS A 11 9.197 7.258 -1.501 1.00 0.48 C
114
+ ATOM 92 O LYS A 11 6.940 5.930 -3.445 1.00 0.51 O
115
+ ATOM 93 CG LYS A 11 10.514 7.947 -1.828 1.00 0.46 C
116
+ ATOM 94 CD LYS A 11 11.665 7.365 -1.017 1.00 0.49 C
117
+ ATOM 95 CE LYS A 11 12.973 8.092 -1.300 1.00 0.43 C
118
+ ATOM 96 NZ LYS A 11 14.104 7.528 -0.504 1.00 0.40 N
119
+ ATOM 97 N ILE A 12 6.178 6.565 -1.403 1.00 0.53 N
120
+ ATOM 98 CA ILE A 12 5.147 5.534 -1.450 1.00 0.52 C
121
+ ATOM 99 C ILE A 12 4.183 5.820 -2.599 1.00 0.53 C
122
+ ATOM 100 CB ILE A 12 4.377 5.443 -0.114 1.00 0.51 C
123
+ ATOM 101 O ILE A 12 3.739 4.899 -3.289 1.00 0.54 O
124
+ ATOM 102 CG1 ILE A 12 5.283 4.883 0.988 1.00 0.45 C
125
+ ATOM 103 CG2 ILE A 12 3.117 4.587 -0.274 1.00 0.46 C
126
+ ATOM 104 CD1 ILE A 12 4.733 5.067 2.396 1.00 0.45 C
127
+ ATOM 105 N SER A 13 3.703 7.056 -2.575 1.00 0.53 N
128
+ ATOM 106 CA SER A 13 2.823 7.481 -3.659 1.00 0.52 C
129
+ ATOM 107 C SER A 13 3.421 7.144 -5.020 1.00 0.53 C
130
+ ATOM 108 CB SER A 13 2.549 8.982 -3.570 1.00 0.50 C
131
+ ATOM 109 O SER A 13 2.699 6.764 -5.945 1.00 0.53 O
132
+ ATOM 110 OG SER A 13 1.700 9.275 -2.474 1.00 0.49 O
133
+ ATOM 111 N LEU A 14 4.831 7.388 -5.129 1.00 0.48 N
134
+ ATOM 112 CA LEU A 14 5.477 7.149 -6.415 1.00 0.47 C
135
+ ATOM 113 C LEU A 14 5.426 5.669 -6.781 1.00 0.48 C
136
+ ATOM 114 CB LEU A 14 6.930 7.629 -6.382 1.00 0.44 C
137
+ ATOM 115 O LEU A 14 5.233 5.321 -7.948 1.00 0.47 O
138
+ ATOM 116 CG LEU A 14 7.205 9.002 -6.998 1.00 0.42 C
139
+ ATOM 117 CD1 LEU A 14 8.185 9.785 -6.130 1.00 0.36 C
140
+ ATOM 118 CD2 LEU A 14 7.740 8.854 -8.418 1.00 0.40 C
141
+ ATOM 119 N VAL A 15 5.762 4.833 -5.746 1.00 0.52 N
142
+ ATOM 120 CA VAL A 15 5.724 3.409 -6.064 1.00 0.51 C
143
+ ATOM 121 C VAL A 15 4.335 3.031 -6.573 1.00 0.52 C
144
+ ATOM 122 CB VAL A 15 6.097 2.543 -4.840 1.00 0.49 C
145
+ ATOM 123 O VAL A 15 4.204 2.238 -7.509 1.00 0.51 O
146
+ ATOM 124 CG1 VAL A 15 5.908 1.060 -5.150 1.00 0.44 C
147
+ ATOM 125 CG2 VAL A 15 7.536 2.823 -4.408 1.00 0.46 C
148
+ ATOM 126 N LEU A 16 3.392 3.725 -5.916 1.00 0.55 N
149
+ ATOM 127 CA LEU A 16 2.029 3.405 -6.323 1.00 0.54 C
150
+ ATOM 128 C LEU A 16 1.741 3.935 -7.724 1.00 0.55 C
151
+ ATOM 129 CB LEU A 16 1.021 3.986 -5.328 1.00 0.52 C
152
+ ATOM 130 O LEU A 16 0.957 3.342 -8.468 1.00 0.55 O
153
+ ATOM 131 CG LEU A 16 0.971 3.325 -3.950 1.00 0.50 C
154
+ ATOM 132 CD1 LEU A 16 0.096 4.140 -3.003 1.00 0.46 C
155
+ ATOM 133 CD2 LEU A 16 0.458 1.893 -4.061 1.00 0.47 C
156
+ ATOM 134 N SER A 17 2.343 5.204 -7.894 1.00 0.49 N
157
+ ATOM 135 CA SER A 17 2.073 5.808 -9.195 1.00 0.48 C
158
+ ATOM 136 C SER A 17 2.809 5.072 -10.309 1.00 0.49 C
159
+ ATOM 137 CB SER A 17 2.475 7.284 -9.195 1.00 0.45 C
160
+ ATOM 138 O SER A 17 2.409 5.139 -11.474 1.00 0.48 O
161
+ ATOM 139 OG SER A 17 3.880 7.422 -9.077 1.00 0.43 O
162
+ ATOM 140 N GLU A 18 4.061 4.645 -9.888 1.00 0.51 N
163
+ ATOM 141 CA GLU A 18 4.832 3.986 -10.938 1.00 0.50 C
164
+ ATOM 142 C GLU A 18 4.292 2.588 -11.224 1.00 0.51 C
165
+ ATOM 143 CB GLU A 18 6.311 3.910 -10.552 1.00 0.47 C
166
+ ATOM 144 O GLU A 18 4.769 1.907 -12.134 1.00 0.50 O
167
+ ATOM 145 CG GLU A 18 6.999 5.266 -10.482 1.00 0.45 C
168
+ ATOM 146 CD GLU A 18 8.505 5.185 -10.674 1.00 0.47 C
169
+ ATOM 147 OE1 GLU A 18 9.058 4.062 -10.671 1.00 0.48 O
170
+ ATOM 148 OE2 GLU A 18 9.138 6.254 -10.827 1.00 0.42 O
171
+ ATOM 149 N LEU A 19 3.449 2.137 -10.297 1.00 0.52 N
172
+ ATOM 150 CA LEU A 19 2.839 0.883 -10.722 1.00 0.52 C
173
+ ATOM 151 C LEU A 19 2.051 1.073 -12.014 1.00 0.52 C
174
+ ATOM 152 CB LEU A 19 1.921 0.334 -9.627 1.00 0.50 C
175
+ ATOM 153 O LEU A 19 1.400 2.103 -12.204 1.00 0.52 O
176
+ ATOM 154 CG LEU A 19 2.610 -0.333 -8.436 1.00 0.49 C
177
+ ATOM 155 CD1 LEU A 19 1.682 -0.348 -7.226 1.00 0.47 C
178
+ ATOM 156 CD2 LEU A 19 3.050 -1.748 -8.796 1.00 0.48 C
179
+ ATOM 157 N PRO A 20 2.509 0.425 -12.947 1.00 0.52 N
180
+ ATOM 158 CA PRO A 20 1.748 0.593 -14.187 1.00 0.50 C
181
+ ATOM 159 C PRO A 20 0.239 0.494 -13.972 1.00 0.52 C
182
+ ATOM 160 CB PRO A 20 2.250 -0.555 -15.067 1.00 0.49 C
183
+ ATOM 161 O PRO A 20 -0.239 -0.467 -13.363 1.00 0.51 O
184
+ ATOM 162 CG PRO A 20 3.024 -1.436 -14.141 1.00 0.46 C
185
+ ATOM 163 CD PRO A 20 3.173 -0.730 -12.824 1.00 0.46 C
186
+ ATOM 164 N LEU A 21 -0.387 1.673 -13.561 1.00 0.49 N
187
+ ATOM 165 CA LEU A 21 -1.840 1.543 -13.546 1.00 0.49 C
188
+ ATOM 166 C LEU A 21 -2.334 0.805 -14.786 1.00 0.49 C
189
+ ATOM 167 CB LEU A 21 -2.501 2.921 -13.461 1.00 0.47 C
190
+ ATOM 168 O LEU A 21 -3.422 0.225 -14.776 1.00 0.48 O
191
+ ATOM 169 CG LEU A 21 -2.547 3.567 -12.075 1.00 0.45 C
192
+ ATOM 170 CD1 LEU A 21 -2.511 5.087 -12.197 1.00 0.41 C
193
+ ATOM 171 CD2 LEU A 21 -3.791 3.116 -11.316 1.00 0.42 C
194
+ ATOM 172 N GLU A 22 -1.284 0.823 -15.746 1.00 0.49 N
195
+ ATOM 173 CA GLU A 22 -1.690 0.325 -17.056 1.00 0.49 C
196
+ ATOM 174 C GLU A 22 -1.183 -1.095 -17.289 1.00 0.49 C
197
+ ATOM 175 CB GLU A 22 -1.184 1.252 -18.164 1.00 0.45 C
198
+ ATOM 176 O GLU A 22 -1.105 -1.553 -18.431 1.00 0.47 O
199
+ ATOM 177 CG GLU A 22 -1.870 2.611 -18.191 1.00 0.43 C
200
+ ATOM 178 CD GLU A 22 -1.638 3.375 -19.484 1.00 0.46 C
201
+ ATOM 179 OE1 GLU A 22 -0.921 2.862 -20.372 1.00 0.44 O
202
+ ATOM 180 OE2 GLU A 22 -2.176 4.498 -19.610 1.00 0.40 O
203
+ ATOM 181 N SER A 23 -0.507 -1.685 -16.243 1.00 0.48 N
204
+ ATOM 182 CA SER A 23 -0.409 -3.087 -16.636 1.00 0.47 C
205
+ ATOM 183 C SER A 23 -1.772 -3.771 -16.589 1.00 0.48 C
206
+ ATOM 184 CB SER A 23 0.575 -3.830 -15.732 1.00 0.45 C
207
+ ATOM 185 O SER A 23 -2.460 -3.724 -15.568 1.00 0.46 O
208
+ ATOM 186 OG SER A 23 0.373 -3.480 -14.374 1.00 0.42 O
209
+ ATOM 187 N LYS A 24 -2.783 -3.245 -17.333 1.00 0.48 N
210
+ ATOM 188 CA LYS A 24 -3.816 -4.243 -17.597 1.00 0.47 C
211
+ ATOM 189 C LYS A 24 -3.258 -5.658 -17.476 1.00 0.48 C
212
+ ATOM 190 CB LYS A 24 -4.420 -4.035 -18.987 1.00 0.46 C
213
+ ATOM 191 O LYS A 24 -2.311 -6.020 -18.177 1.00 0.46 O
214
+ ATOM 192 CG LYS A 24 -5.249 -2.766 -19.119 1.00 0.44 C
215
+ ATOM 193 CD LYS A 24 -6.028 -2.741 -20.427 1.00 0.46 C
216
+ ATOM 194 CE LYS A 24 -6.820 -1.449 -20.582 1.00 0.40 C
217
+ ATOM 195 NZ LYS A 24 -7.573 -1.413 -21.871 1.00 0.37 N
218
+ ATOM 196 N PRO A 25 -3.101 -6.132 -16.224 1.00 0.48 N
219
+ ATOM 197 CA PRO A 25 -2.777 -7.561 -16.224 1.00 0.47 C
220
+ ATOM 198 C PRO A 25 -3.419 -8.311 -17.389 1.00 0.49 C
221
+ ATOM 199 CB PRO A 25 -3.336 -8.049 -14.886 1.00 0.46 C
222
+ ATOM 200 O PRO A 25 -4.457 -7.887 -17.905 1.00 0.48 O
223
+ ATOM 201 CG PRO A 25 -4.170 -6.915 -14.383 1.00 0.44 C
224
+ ATOM 202 CD PRO A 25 -3.916 -5.715 -15.250 1.00 0.45 C
225
+ ATOM 203 N GLU A 26 -2.595 -8.749 -18.537 1.00 0.52 N
226
+ ATOM 204 CA GLU A 26 -3.262 -9.728 -19.391 1.00 0.52 C
227
+ ATOM 205 C GLU A 26 -4.559 -10.221 -18.756 1.00 0.52 C
228
+ ATOM 206 CB GLU A 26 -2.334 -10.911 -19.678 1.00 0.49 C
229
+ ATOM 207 O GLU A 26 -4.681 -10.258 -17.530 1.00 0.50 O
230
+ ATOM 208 CG GLU A 26 -1.229 -10.598 -20.678 1.00 0.48 C
231
+ ATOM 209 CD GLU A 26 -0.782 -11.811 -21.477 1.00 0.50 C
232
+ ATOM 210 OE1 GLU A 26 -1.195 -12.945 -21.142 1.00 0.51 O
233
+ ATOM 211 OE2 GLU A 26 -0.012 -11.627 -22.446 1.00 0.47 O
234
+ ATOM 212 N PRO A 27 -5.776 -9.853 -19.347 1.00 0.50 N
235
+ ATOM 213 CA PRO A 27 -6.879 -10.502 -18.634 1.00 0.49 C
236
+ ATOM 214 C PRO A 27 -6.418 -11.681 -17.781 1.00 0.50 C
237
+ ATOM 215 CB PRO A 27 -7.800 -10.971 -19.763 1.00 0.47 C
238
+ ATOM 216 O PRO A 27 -5.769 -12.599 -18.290 1.00 0.49 O
239
+ ATOM 217 CG PRO A 27 -7.065 -10.637 -21.020 1.00 0.45 C
240
+ ATOM 218 CD PRO A 27 -5.782 -9.947 -20.654 1.00 0.45 C
241
+ ATOM 219 N VAL A 28 -5.550 -11.387 -16.664 1.00 0.49 N
242
+ ATOM 220 CA VAL A 28 -5.461 -12.521 -15.750 1.00 0.48 C
243
+ ATOM 221 C VAL A 28 -6.814 -13.223 -15.665 1.00 0.49 C
244
+ ATOM 222 CB VAL A 28 -4.999 -12.081 -14.343 1.00 0.47 C
245
+ ATOM 223 O VAL A 28 -7.852 -12.571 -15.529 1.00 0.48 O
246
+ ATOM 224 CG1 VAL A 28 -4.676 -13.297 -13.476 1.00 0.45 C
247
+ ATOM 225 CG2 VAL A 28 -3.787 -11.157 -14.445 1.00 0.46 C
248
+ ATOM 226 N GLN A 29 -7.108 -14.082 -16.749 1.00 0.53 N
249
+ ATOM 227 CA GLN A 29 -8.211 -15.035 -16.676 1.00 0.53 C
250
+ ATOM 228 C GLN A 29 -8.987 -14.878 -15.372 1.00 0.53 C
251
+ ATOM 229 CB GLN A 29 -7.692 -16.467 -16.810 1.00 0.48 C
252
+ ATOM 230 O GLN A 29 -8.402 -14.913 -14.287 1.00 0.51 O
253
+ ATOM 231 CG GLN A 29 -7.428 -16.894 -18.247 1.00 0.46 C
254
+ ATOM 232 CD GLN A 29 -7.062 -18.362 -18.366 1.00 0.48 C
255
+ ATOM 233 NE2 GLN A 29 -6.750 -18.799 -19.581 1.00 0.41 N
256
+ ATOM 234 OE1 GLN A 29 -7.058 -19.097 -17.373 1.00 0.50 O
257
+ ATOM 235 N GLY A 30 -9.845 -13.707 -15.208 1.00 0.58 N
258
+ ATOM 236 CA GLY A 30 -11.064 -13.567 -14.428 1.00 0.57 C
259
+ ATOM 237 C GLY A 30 -10.991 -12.454 -13.400 1.00 0.58 C
260
+ ATOM 238 O GLY A 30 -9.936 -12.218 -12.807 1.00 0.55 O
261
+ ATOM 239 N ALA A 31 -11.469 -11.174 -13.727 1.00 0.65 N
262
+ ATOM 240 CA ALA A 31 -11.865 -10.061 -12.868 1.00 0.64 C
263
+ ATOM 241 C ALA A 31 -11.715 -10.426 -11.394 1.00 0.65 C
264
+ ATOM 242 CB ALA A 31 -13.303 -9.645 -13.166 1.00 0.61 C
265
+ ATOM 243 O ALA A 31 -11.286 -9.600 -10.584 1.00 0.65 O
266
+ ATOM 244 N ALA A 32 -12.034 -11.668 -11.139 1.00 0.68 N
267
+ ATOM 245 CA ALA A 32 -11.937 -12.088 -9.744 1.00 0.67 C
268
+ ATOM 246 C ALA A 32 -10.490 -12.054 -9.260 1.00 0.68 C
269
+ ATOM 247 CB ALA A 32 -12.521 -13.487 -9.567 1.00 0.64 C
270
+ ATOM 248 O ALA A 32 -10.211 -11.605 -8.146 1.00 0.67 O
271
+ ATOM 249 N LEU A 33 -9.591 -12.548 -10.047 1.00 0.67 N
272
+ ATOM 250 CA LEU A 33 -8.192 -12.557 -9.631 1.00 0.66 C
273
+ ATOM 251 C LEU A 33 -7.660 -11.135 -9.484 1.00 0.67 C
274
+ ATOM 252 CB LEU A 33 -7.339 -13.332 -10.638 1.00 0.63 C
275
+ ATOM 253 O LEU A 33 -6.890 -10.849 -8.564 1.00 0.65 O
276
+ ATOM 254 CG LEU A 33 -5.950 -13.761 -10.161 1.00 0.59 C
277
+ ATOM 255 CD1 LEU A 33 -6.019 -15.128 -9.488 1.00 0.54 C
278
+ ATOM 256 CD2 LEU A 33 -4.967 -13.783 -11.326 1.00 0.55 C
279
+ ATOM 257 N GLN A 34 -8.043 -10.287 -10.357 1.00 0.68 N
280
+ ATOM 258 CA GLN A 34 -7.625 -8.892 -10.272 1.00 0.68 C
281
+ ATOM 259 C GLN A 34 -8.075 -8.262 -8.957 1.00 0.69 C
282
+ ATOM 260 CB GLN A 34 -8.176 -8.093 -11.454 1.00 0.65 C
283
+ ATOM 261 O GLN A 34 -7.304 -7.552 -8.307 1.00 0.68 O
284
+ ATOM 262 CG GLN A 34 -7.476 -6.759 -11.674 1.00 0.61 C
285
+ ATOM 263 CD GLN A 34 -7.961 -6.040 -12.920 1.00 0.59 C
286
+ ATOM 264 NE2 GLN A 34 -7.359 -4.893 -13.214 1.00 0.48 N
287
+ ATOM 265 OE1 GLN A 34 -8.868 -6.513 -13.612 1.00 0.55 O
288
+ ATOM 266 N ALA A 35 -9.311 -8.425 -8.724 1.00 0.72 N
289
+ ATOM 267 CA ALA A 35 -9.858 -7.851 -7.498 1.00 0.71 C
290
+ ATOM 268 C ALA A 35 -9.115 -8.371 -6.270 1.00 0.73 C
291
+ ATOM 269 CB ALA A 35 -11.348 -8.161 -7.384 1.00 0.70 C
292
+ ATOM 270 O ALA A 35 -8.849 -7.616 -5.332 1.00 0.73 O
293
+ ATOM 271 N GLU A 36 -8.800 -9.602 -6.322 1.00 0.75 N
294
+ ATOM 272 CA GLU A 36 -8.080 -10.212 -5.208 1.00 0.75 C
295
+ ATOM 273 C GLU A 36 -6.689 -9.603 -5.050 1.00 0.76 C
296
+ ATOM 274 CB GLU A 36 -7.971 -11.726 -5.403 1.00 0.73 C
297
+ ATOM 275 O GLU A 36 -6.256 -9.313 -3.933 1.00 0.75 O
298
+ ATOM 276 CG GLU A 36 -7.373 -12.458 -4.210 1.00 0.68 C
299
+ ATOM 277 CD GLU A 36 -7.447 -13.972 -4.336 1.00 0.65 C
300
+ ATOM 278 OE1 GLU A 36 -8.001 -14.471 -5.342 1.00 0.64 O
301
+ ATOM 279 OE2 GLU A 36 -6.948 -14.664 -3.421 1.00 0.59 O
302
+ ATOM 280 N LEU A 37 -5.986 -9.435 -6.129 1.00 0.74 N
303
+ ATOM 281 CA LEU A 37 -4.628 -8.906 -6.060 1.00 0.73 C
304
+ ATOM 282 C LEU A 37 -4.630 -7.469 -5.549 1.00 0.74 C
305
+ ATOM 283 CB LEU A 37 -3.957 -8.970 -7.435 1.00 0.71 C
306
+ ATOM 284 O LEU A 37 -3.797 -7.100 -4.718 1.00 0.73 O
307
+ ATOM 285 CG LEU A 37 -3.472 -10.348 -7.888 1.00 0.66 C
308
+ ATOM 286 CD1 LEU A 37 -3.167 -10.337 -9.382 1.00 0.61 C
309
+ ATOM 287 CD2 LEU A 37 -2.244 -10.772 -7.090 1.00 0.61 C
310
+ ATOM 288 N LEU A 38 -5.626 -6.678 -6.066 1.00 0.73 N
311
+ ATOM 289 CA LEU A 38 -5.729 -5.296 -5.610 1.00 0.73 C
312
+ ATOM 290 C LEU A 38 -6.038 -5.238 -4.118 1.00 0.75 C
313
+ ATOM 291 CB LEU A 38 -6.811 -4.551 -6.397 1.00 0.71 C
314
+ ATOM 292 O LEU A 38 -5.501 -4.391 -3.401 1.00 0.75 O
315
+ ATOM 293 CG LEU A 38 -6.433 -4.102 -7.809 1.00 0.66 C
316
+ ATOM 294 CD1 LEU A 38 -7.679 -3.690 -8.586 1.00 0.60 C
317
+ ATOM 295 CD2 LEU A 38 -5.428 -2.956 -7.755 1.00 0.60 C
318
+ ATOM 296 N SER A 39 -6.898 -6.106 -3.777 1.00 0.77 N
319
+ ATOM 297 CA SER A 39 -7.237 -6.146 -2.358 1.00 0.77 C
320
+ ATOM 298 C SER A 39 -6.013 -6.466 -1.507 1.00 0.78 C
321
+ ATOM 299 CB SER A 39 -8.333 -7.179 -2.098 1.00 0.75 C
322
+ ATOM 300 O SER A 39 -5.816 -5.871 -0.445 1.00 0.78 O
323
+ ATOM 301 OG SER A 39 -8.631 -7.259 -0.715 1.00 0.68 O
324
+ ATOM 302 N GLN A 40 -5.194 -7.402 -1.959 1.00 0.76 N
325
+ ATOM 303 CA GLN A 40 -4.005 -7.786 -1.205 1.00 0.76 C
326
+ ATOM 304 C GLN A 40 -3.014 -6.629 -1.113 1.00 0.76 C
327
+ ATOM 305 CB GLN A 40 -3.334 -9.003 -1.843 1.00 0.73 C
328
+ ATOM 306 O GLN A 40 -2.433 -6.384 -0.054 1.00 0.76 O
329
+ ATOM 307 CG GLN A 40 -4.050 -10.317 -1.563 1.00 0.66 C
330
+ ATOM 308 CD GLN A 40 -3.515 -11.466 -2.398 1.00 0.63 C
331
+ ATOM 309 NE2 GLN A 40 -4.359 -12.462 -2.645 1.00 0.54 N
332
+ ATOM 310 OE1 GLN A 40 -2.354 -11.457 -2.820 1.00 0.60 O
333
+ ATOM 311 N VAL A 41 -2.792 -5.944 -2.237 1.00 0.75 N
334
+ ATOM 312 CA VAL A 41 -1.862 -4.820 -2.237 1.00 0.74 C
335
+ ATOM 313 C VAL A 41 -2.341 -3.752 -1.256 1.00 0.75 C
336
+ ATOM 314 CB VAL A 41 -1.704 -4.213 -3.649 1.00 0.73 C
337
+ ATOM 315 O VAL A 41 -1.550 -3.215 -0.478 1.00 0.74 O
338
+ ATOM 316 CG1 VAL A 41 -0.947 -2.888 -3.586 1.00 0.65 C
339
+ ATOM 317 CG2 VAL A 41 -0.989 -5.196 -4.575 1.00 0.66 C
340
+ ATOM 318 N ARG A 42 -3.621 -3.448 -1.361 1.00 0.76 N
341
+ ATOM 319 CA ARG A 42 -4.187 -2.474 -0.434 1.00 0.76 C
342
+ ATOM 320 C ARG A 42 -3.930 -2.881 1.013 1.00 0.77 C
343
+ ATOM 321 CB ARG A 42 -5.690 -2.314 -0.673 1.00 0.74 C
344
+ ATOM 322 O ARG A 42 -3.588 -2.042 1.849 1.00 0.77 O
345
+ ATOM 323 CG ARG A 42 -6.034 -1.420 -1.855 1.00 0.69 C
346
+ ATOM 324 CD ARG A 42 -7.539 -1.280 -2.036 1.00 0.65 C
347
+ ATOM 325 NE ARG A 42 -7.867 -0.358 -3.120 1.00 0.59 N
348
+ ATOM 326 NH1 ARG A 42 -10.131 -0.814 -3.100 1.00 0.49 N
349
+ ATOM 327 NH2 ARG A 42 -9.276 0.705 -4.589 1.00 0.45 N
350
+ ATOM 328 CZ ARG A 42 -9.091 -0.158 -3.601 1.00 0.59 C
351
+ ATOM 329 N GLN A 43 -4.215 -4.159 1.316 1.00 0.78 N
352
+ ATOM 330 CA GLN A 43 -4.020 -4.652 2.675 1.00 0.78 C
353
+ ATOM 331 C GLN A 43 -2.557 -4.540 3.096 1.00 0.78 C
354
+ ATOM 332 CB GLN A 43 -4.490 -6.103 2.793 1.00 0.76 C
355
+ ATOM 333 O GLN A 43 -2.260 -4.175 4.235 1.00 0.77 O
356
+ ATOM 334 CG GLN A 43 -4.504 -6.630 4.222 1.00 0.70 C
357
+ ATOM 335 CD GLN A 43 -5.452 -5.861 5.123 1.00 0.66 C
358
+ ATOM 336 NE2 GLN A 43 -4.992 -5.534 6.326 1.00 0.60 N
359
+ ATOM 337 OE1 GLN A 43 -6.588 -5.562 4.740 1.00 0.66 O
360
+ ATOM 338 N ASP A 44 -1.615 -4.885 2.249 1.00 0.76 N
361
+ ATOM 339 CA ASP A 44 -0.192 -4.815 2.566 1.00 0.75 C
362
+ ATOM 340 C ASP A 44 0.231 -3.383 2.883 1.00 0.75 C
363
+ ATOM 341 CB ASP A 44 0.643 -5.366 1.409 1.00 0.73 C
364
+ ATOM 342 O ASP A 44 1.022 -3.152 3.800 1.00 0.74 O
365
+ ATOM 343 CG ASP A 44 0.532 -6.874 1.262 1.00 0.68 C
366
+ ATOM 344 OD1 ASP A 44 0.048 -7.544 2.199 1.00 0.65 O
367
+ ATOM 345 OD2 ASP A 44 0.935 -7.396 0.200 1.00 0.66 O
368
+ ATOM 346 N ILE A 45 -0.307 -2.445 2.112 1.00 0.76 N
369
+ ATOM 347 CA ILE A 45 -0.006 -1.042 2.371 1.00 0.75 C
370
+ ATOM 348 C ILE A 45 -0.514 -0.652 3.758 1.00 0.76 C
371
+ ATOM 349 CB ILE A 45 -0.625 -0.122 1.295 1.00 0.73 C
372
+ ATOM 350 O ILE A 45 0.201 -0.011 4.531 1.00 0.75 O
373
+ ATOM 351 CG1 ILE A 45 0.082 -0.322 -0.050 1.00 0.67 C
374
+ ATOM 352 CG2 ILE A 45 -0.561 1.343 1.735 1.00 0.67 C
375
+ ATOM 353 CD1 ILE A 45 -0.609 0.363 -1.221 1.00 0.64 C
376
+ ATOM 354 N ALA A 46 -1.744 -0.973 3.967 1.00 0.76 N
377
+ ATOM 355 CA ALA A 46 -2.318 -0.646 5.269 1.00 0.75 C
378
+ ATOM 356 C ALA A 46 -1.481 -1.235 6.401 1.00 0.76 C
379
+ ATOM 357 CB ALA A 46 -3.757 -1.149 5.358 1.00 0.74 C
380
+ ATOM 358 O ALA A 46 -1.239 -0.572 7.413 1.00 0.75 O
381
+ ATOM 359 N ASN A 47 -1.100 -2.513 6.275 1.00 0.77 N
382
+ ATOM 360 CA ASN A 47 -0.287 -3.170 7.293 1.00 0.76 C
383
+ ATOM 361 C ASN A 47 1.046 -2.456 7.493 1.00 0.75 C
384
+ ATOM 362 CB ASN A 47 -0.053 -4.638 6.927 1.00 0.74 C
385
+ ATOM 363 O ASN A 47 1.503 -2.291 8.626 1.00 0.74 O
386
+ ATOM 364 CG ASN A 47 -1.313 -5.474 7.032 1.00 0.70 C
387
+ ATOM 365 ND2 ASN A 47 -1.301 -6.646 6.410 1.00 0.68 N
388
+ ATOM 366 OD1 ASN A 47 -2.291 -5.068 7.666 1.00 0.70 O
389
+ ATOM 367 N SER A 48 1.642 -2.096 6.364 1.00 0.75 N
390
+ ATOM 368 CA SER A 48 2.925 -1.406 6.457 1.00 0.73 C
391
+ ATOM 369 C SER A 48 2.787 -0.078 7.194 1.00 0.73 C
392
+ ATOM 370 CB SER A 48 3.508 -1.167 5.064 1.00 0.71 C
393
+ ATOM 371 O SER A 48 3.641 0.278 8.009 1.00 0.70 O
394
+ ATOM 372 OG SER A 48 3.811 -2.397 4.427 1.00 0.65 O
395
+ ATOM 373 N LEU A 49 1.734 0.640 6.845 1.00 0.72 N
396
+ ATOM 374 CA LEU A 49 1.508 1.919 7.510 1.00 0.72 C
397
+ ATOM 375 C LEU A 49 1.271 1.721 9.003 1.00 0.72 C
398
+ ATOM 376 CB LEU A 49 0.315 2.645 6.884 1.00 0.70 C
399
+ ATOM 377 O LEU A 49 1.763 2.499 9.823 1.00 0.71 O
400
+ ATOM 378 CG LEU A 49 0.534 3.228 5.487 1.00 0.66 C
401
+ ATOM 379 CD1 LEU A 49 -0.788 3.717 4.904 1.00 0.61 C
402
+ ATOM 380 CD2 LEU A 49 1.554 4.360 5.533 1.00 0.62 C
403
+ ATOM 381 N ASN A 50 0.475 0.748 9.327 1.00 0.74 N
404
+ ATOM 382 CA ASN A 50 0.188 0.475 10.732 1.00 0.73 C
405
+ ATOM 383 C ASN A 50 1.452 0.099 11.499 1.00 0.73 C
406
+ ATOM 384 CB ASN A 50 -0.860 -0.633 10.860 1.00 0.70 C
407
+ ATOM 385 O ASN A 50 1.622 0.493 12.654 1.00 0.71 O
408
+ ATOM 386 CG ASN A 50 -2.278 -0.113 10.732 1.00 0.65 C
409
+ ATOM 387 ND2 ASN A 50 -3.214 -1.008 10.440 1.00 0.63 N
410
+ ATOM 388 OD1 ASN A 50 -2.530 1.084 10.892 1.00 0.63 O
411
+ ATOM 389 N ALA A 51 2.296 -0.751 10.857 1.00 0.70 N
412
+ ATOM 390 CA ALA A 51 3.518 -1.202 11.518 1.00 0.69 C
413
+ ATOM 391 C ALA A 51 4.408 -0.020 11.892 1.00 0.68 C
414
+ ATOM 392 CB ALA A 51 4.279 -2.175 10.622 1.00 0.67 C
415
+ ATOM 393 O ALA A 51 5.038 -0.020 12.952 1.00 0.67 O
416
+ ATOM 394 N VAL A 52 4.525 0.951 11.010 1.00 0.67 N
417
+ ATOM 395 CA VAL A 52 5.352 2.120 11.288 1.00 0.66 C
418
+ ATOM 396 C VAL A 52 4.723 2.942 12.411 1.00 0.65 C
419
+ ATOM 397 CB VAL A 52 5.540 2.995 10.029 1.00 0.63 C
420
+ ATOM 398 O VAL A 52 5.431 3.495 13.256 1.00 0.64 O
421
+ ATOM 399 CG1 VAL A 52 6.261 4.296 10.378 1.00 0.57 C
422
+ ATOM 400 CG2 VAL A 52 6.309 2.226 8.956 1.00 0.58 C
423
+ ATOM 401 N ALA A 53 3.415 3.071 12.338 1.00 0.62 N
424
+ ATOM 402 CA ALA A 53 2.746 3.869 13.362 1.00 0.60 C
425
+ ATOM 403 C ALA A 53 2.961 3.272 14.750 1.00 0.61 C
426
+ ATOM 404 CB ALA A 53 1.253 3.980 13.059 1.00 0.58 C
427
+ ATOM 405 O ALA A 53 2.919 3.988 15.753 1.00 0.61 O
428
+ ATOM 406 N THR A 54 3.105 1.936 14.815 1.00 0.61 N
429
+ ATOM 407 CA THR A 54 3.158 1.297 16.126 1.00 0.61 C
430
+ ATOM 408 C THR A 54 4.591 1.253 16.648 1.00 0.61 C
431
+ ATOM 409 CB THR A 54 2.583 -0.131 16.075 1.00 0.57 C
432
+ ATOM 410 O THR A 54 4.835 0.805 17.770 1.00 0.59 O
433
+ ATOM 411 CG2 THR A 54 1.101 -0.114 15.712 1.00 0.51 C
434
+ ATOM 412 OG1 THR A 54 3.295 -0.892 15.092 1.00 0.54 O
435
+ ATOM 413 N ARG A 55 5.532 1.631 15.809 1.00 0.65 N
436
+ ATOM 414 CA ARG A 55 6.903 1.567 16.303 1.00 0.65 C
437
+ ATOM 415 C ARG A 55 7.118 2.544 17.453 1.00 0.65 C
438
+ ATOM 416 CB ARG A 55 7.895 1.859 15.175 1.00 0.61 C
439
+ ATOM 417 O ARG A 55 6.621 3.672 17.418 1.00 0.63 O
440
+ ATOM 418 CG ARG A 55 8.075 0.707 14.199 1.00 0.59 C
441
+ ATOM 419 CD ARG A 55 9.132 1.017 13.148 1.00 0.59 C
442
+ ATOM 420 NE ARG A 55 9.264 -0.067 12.180 1.00 0.52 N
443
+ ATOM 421 NH1 ARG A 55 10.992 0.916 11.004 1.00 0.41 N
444
+ ATOM 422 NH2 ARG A 55 10.179 -1.128 10.359 1.00 0.36 N
445
+ ATOM 423 CZ ARG A 55 10.145 -0.090 11.183 1.00 0.55 C
446
+ ATOM 424 N PRO A 56 7.605 2.129 18.545 1.00 0.62 N
447
+ ATOM 425 CA PRO A 56 7.968 3.039 19.634 1.00 0.61 C
448
+ ATOM 426 C PRO A 56 8.765 4.249 19.151 1.00 0.62 C
449
+ ATOM 427 CB PRO A 56 8.815 2.161 20.559 1.00 0.56 C
450
+ ATOM 428 O PRO A 56 9.656 4.109 18.310 1.00 0.59 O
451
+ ATOM 429 CG PRO A 56 8.612 0.769 20.056 1.00 0.53 C
452
+ ATOM 430 CD PRO A 56 8.067 0.841 18.659 1.00 0.55 C
453
+ ATOM 431 N GLY A 57 8.356 5.535 19.374 1.00 0.58 N
454
+ ATOM 432 CA GLY A 57 8.945 6.814 19.010 1.00 0.58 C
455
+ ATOM 433 C GLY A 57 8.368 7.395 17.733 1.00 0.58 C
456
+ ATOM 434 O GLY A 57 8.738 8.497 17.323 1.00 0.57 O
457
+ ATOM 435 N TYR A 58 7.679 6.470 16.960 1.00 0.54 N
458
+ ATOM 436 CA TYR A 58 7.100 7.135 15.799 1.00 0.54 C
459
+ ATOM 437 C TYR A 58 6.095 8.199 16.224 1.00 0.53 C
460
+ ATOM 438 CB TYR A 58 6.422 6.116 14.878 1.00 0.50 C
461
+ ATOM 439 O TYR A 58 6.065 9.295 15.659 1.00 0.52 O
462
+ ATOM 440 CG TYR A 58 6.176 6.630 13.480 1.00 0.49 C
463
+ ATOM 441 CD1 TYR A 58 4.946 7.177 13.124 1.00 0.47 C
464
+ ATOM 442 CD2 TYR A 58 7.173 6.568 12.512 1.00 0.48 C
465
+ ATOM 443 CE1 TYR A 58 4.714 7.650 11.837 1.00 0.47 C
466
+ ATOM 444 CE2 TYR A 58 6.953 7.038 11.222 1.00 0.48 C
467
+ ATOM 445 OH TYR A 58 5.498 8.043 9.618 1.00 0.44 O
468
+ ATOM 446 CZ TYR A 58 5.722 7.577 10.894 1.00 0.46 C
469
+ ATOM 447 N LEU A 59 5.154 7.928 17.166 1.00 0.50 N
470
+ ATOM 448 CA LEU A 59 4.166 8.868 17.683 1.00 0.50 C
471
+ ATOM 449 C LEU A 59 4.547 9.344 19.081 1.00 0.50 C
472
+ ATOM 450 CB LEU A 59 2.777 8.224 17.711 1.00 0.47 C
473
+ ATOM 451 O LEU A 59 3.832 10.147 19.684 1.00 0.49 O
474
+ ATOM 452 CG LEU A 59 2.130 7.949 16.353 1.00 0.45 C
475
+ ATOM 453 CD1 LEU A 59 0.903 7.059 16.521 1.00 0.42 C
476
+ ATOM 454 CD2 LEU A 59 1.756 9.257 15.663 1.00 0.44 C
477
+ ATOM 455 N ALA A 60 5.718 9.319 19.497 1.00 0.46 N
478
+ ATOM 456 CA ALA A 60 6.022 9.769 20.853 1.00 0.46 C
479
+ ATOM 457 C ALA A 60 7.279 10.633 20.876 1.00 0.46 C
480
+ ATOM 458 CB ALA A 60 6.186 8.572 21.787 1.00 0.42 C
481
+ ATOM 459 O ALA A 60 8.383 10.140 20.637 1.00 0.44 O
482
+ ATOM 460 N GLY A 61 7.357 11.746 20.071 1.00 0.45 N
483
+ ATOM 461 CA GLY A 61 8.144 12.780 20.724 1.00 0.45 C
484
+ ATOM 462 C GLY A 61 7.607 14.179 20.487 1.00 0.46 C
485
+ ATOM 463 O GLY A 61 7.660 14.688 19.366 1.00 0.44 O
486
+ ATOM 464 N GLY A 62 6.464 14.557 21.219 1.00 0.33 N
487
+ ATOM 465 CA GLY A 62 6.288 15.850 21.860 1.00 0.36 C
488
+ ATOM 466 C GLY A 62 7.363 16.852 21.487 1.00 0.33 C
489
+ ATOM 467 O GLY A 62 8.470 16.469 21.102 1.00 0.32 O
esm/mcp_output/requirements.txt CHANGED
@@ -2,3 +2,8 @@ fastmcp>=0.1.0
2
  pydantic>=2.0.0
3
  requests
4
  biopython
 
 
 
 
 
 
2
  pydantic>=2.0.0
3
  requests
4
  biopython
5
+
6
+ torch
7
+ fairscale
8
+ numpy
9
+ tqdm