USER MOD reduce.3.24.130724 H: found=0, std=0, add=780, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 782 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 THR OG1 : rot 56:sc= 2.15 USER MOD Set 1.2: A 112 LYS NZ :NH3+ -174:sc= 1.01 (180deg=0) USER MOD Set 2.1: A 74 ASN : amide:sc= 0.557 X(o=1.1,f=0.69) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0.518 USER MOD Set 3.1: A 73 TYR OH : rot 30:sc= 1.19 USER MOD Set 3.2: A 83 THR OG1 : rot 130:sc= 1.11 USER MOD Set 4.1: A 71 SER OG : rot 61:sc= 2.28 USER MOD Set 4.2: A 86 THR OG1 : rot 33:sc= 0.607 USER MOD Set 5.1: A 57 ASN : amide:sc= 0.829 K(o=1.8,f=-2.2!) USER MOD Set 5.2: A 72 GLN : amide:sc= 0.968 K(o=1.8,f=-0.018) USER MOD Set 6.1: A 47 ASN : amide:sc= -0.0382 K(o=1.2,f=-0.28!) USER MOD Set 6.2: A 62 GLN : amide:sc= 0.652 K(o=1.2,f=0.46) USER MOD Set 6.3: A 64 TYR OH : rot 180:sc= 0.585 USER MOD Set 7.1: A 42 GLN : amide:sc= 0.538 K(o=0.54,f=-0.08) USER MOD Set 7.2: A 44 SER OG : rot 180:sc= 0 USER MOD Set 8.1: A 41 SER OG : rot 57:sc= 2.36 USER MOD Set 8.2: A 43 TYR OH : rot 87:sc= 0.255 USER MOD Set 8.3: A 53 THR OG1 : rot 112:sc= 0.774 USER MOD Set 9.1: A 16 GLN : amide:sc= 1.03 K(o=2.5,f=0.56) USER MOD Set 9.2: A 31 GLN : amide:sc= 1.45 K(o=2.5,f=-0.99) USER MOD Set10.1: A 14 ASN : amide:sc= 1.01 K(o=2.9,f=0.66) USER MOD Set10.2: A 29 ASN : amide:sc= 1.89 K(o=2.9,f=-0.55) USER MOD Set11.1: A 12 THR OG1 : rot -79:sc= 1.76 USER MOD Set11.2: A 15 SER OG : rot 92:sc= 1.9 USER MOD Set12.1: A 8 ASN : amide:sc= 0.652 K(o=2.2,f=0.28) USER MOD Set12.2: A 24 ASN : amide:sc= 1.54 K(o=2.2,f=-0.55) USER MOD Set12.3: A 26 TYR OH : rot 180:sc= 0 USER MOD Set13.1: A 6 ASN : amide:sc= 1.3 K(o=2,f=-11!) USER MOD Set13.2: A 9 SER OG : rot 86:sc= 0.66 USER MOD Single : A 7 THR OG1 : rot 77:sc= 0.239 USER MOD Single : A 10 GLN : amide:sc= -0.0155 K(o=-0.015,f=-3!) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.671 USER MOD Single : A 19 LYS NZ :NH3+ 159:sc= 1.26 (180deg=0.978) USER MOD Single : A 20 SER OG : rot 77:sc= 1.26 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 74:sc= 0.748 USER MOD Single : A 30 SER OG : rot 80:sc= 1.91 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 88:sc= 1.32 USER MOD Single : A 39 THR OG1 : rot 88:sc= 0.648 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 158:sc= 1.17 (180deg=0.463) USER MOD Single : A 51 SER OG : rot 80:sc= 1.8 USER MOD Single : A 54 THR OG1 : rot 1:sc= 0.373 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 71:sc= 1.67 USER MOD Single : A 66 THR OG1 : rot 78:sc= 1.55 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0.299 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 65:sc= 1.74 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 6:sc= 0.455 USER MOD Single : A 121 MET CE :methyl 176:sc= 0 (180deg=-0.03) USER MOD ----------------------------------------------------------------- ATOM 46 N VAL A 5 10.889 -1.897 -1.528 1.00 0.00 N ATOM 47 CA VAL A 5 11.602 -0.860 -2.258 1.00 0.00 C ATOM 48 C VAL A 5 13.082 -1.269 -2.169 1.00 0.00 C ATOM 49 O VAL A 5 13.852 -0.730 -1.369 1.00 0.00 O ATOM 50 CB VAL A 5 11.275 0.532 -1.665 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.922 1.659 -2.486 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.758 0.786 -1.623 1.00 0.00 C ATOM 0 HA VAL A 5 11.312 -0.772 -3.305 1.00 0.00 H new ATOM 0 HB VAL A 5 11.678 0.533 -0.652 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.672 2.622 -2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.004 1.531 -2.490 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.549 1.624 -3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.566 1.772 -1.201 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.353 0.739 -2.634 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.279 0.027 -1.004 1.00 0.00 H new ATOM 62 N ASN A 6 13.459 -2.321 -2.901 1.00 0.00 N ATOM 63 CA ASN A 6 14.843 -2.773 -2.958 1.00 0.00 C ATOM 64 C ASN A 6 15.599 -1.889 -3.950 1.00 0.00 C ATOM 65 O ASN A 6 15.222 -1.810 -5.121 1.00 0.00 O ATOM 66 CB ASN A 6 14.949 -4.251 -3.368 1.00 0.00 C ATOM 67 CG ASN A 6 16.410 -4.691 -3.368 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.262 -4.014 -2.802 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.745 -5.807 -3.986 1.00 0.00 N ATOM 0 H ASN A 6 12.816 -2.876 -3.465 1.00 0.00 H new ATOM 0 HA ASN A 6 15.281 -2.690 -1.963 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.375 -4.870 -2.679 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.518 -4.393 -4.359 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.718 -6.112 -3.995 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.031 -6.365 -4.454 1.00 0.00 H new ATOM 76 N THR A 7 16.654 -1.226 -3.483 1.00 0.00 N ATOM 77 CA THR A 7 17.481 -0.344 -4.294 1.00 0.00 C ATOM 78 C THR A 7 18.453 -1.184 -5.140 1.00 0.00 C ATOM 79 O THR A 7 18.459 -1.068 -6.367 1.00 0.00 O ATOM 80 CB THR A 7 18.220 0.645 -3.368 1.00 0.00 C ATOM 81 OG1 THR A 7 17.337 1.205 -2.411 1.00 0.00 O ATOM 82 CG2 THR A 7 18.869 1.791 -4.146 1.00 0.00 C ATOM 0 H THR A 7 16.961 -1.290 -2.513 1.00 0.00 H new ATOM 0 HA THR A 7 16.866 0.235 -4.982 1.00 0.00 H new ATOM 0 HB THR A 7 18.998 0.067 -2.870 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.158 0.547 -1.707 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.377 2.460 -3.452 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.592 1.386 -4.854 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.101 2.344 -4.687 1.00 0.00 H new ATOM 90 N ASN A 8 19.268 -2.033 -4.493 1.00 0.00 N ATOM 91 CA ASN A 8 20.310 -2.856 -5.130 1.00 0.00 C ATOM 92 C ASN A 8 20.761 -4.011 -4.211 1.00 0.00 C ATOM 93 O ASN A 8 21.846 -4.570 -4.372 1.00 0.00 O ATOM 94 CB ASN A 8 21.519 -1.969 -5.499 1.00 0.00 C ATOM 95 CG ASN A 8 22.488 -2.683 -6.446 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.088 -3.200 -7.487 1.00 0.00 O ATOM 97 ND2 ASN A 8 23.774 -2.709 -6.136 1.00 0.00 N ATOM 0 H ASN A 8 19.219 -2.170 -3.483 1.00 0.00 H new ATOM 0 HA ASN A 8 19.889 -3.297 -6.034 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.165 -1.051 -5.968 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.047 -1.680 -4.590 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.441 -3.160 -6.763 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.099 -2.278 -5.270 1.00 0.00 H new ATOM 104 N SER A 9 19.982 -4.310 -3.172 1.00 0.00 N ATOM 105 CA SER A 9 20.313 -5.284 -2.142 1.00 0.00 C ATOM 106 C SER A 9 20.196 -6.707 -2.676 1.00 0.00 C ATOM 107 O SER A 9 19.502 -6.961 -3.666 1.00 0.00 O ATOM 108 CB SER A 9 19.376 -5.106 -0.944 1.00 0.00 C ATOM 109 OG SER A 9 19.278 -3.727 -0.627 1.00 0.00 O ATOM 0 H SER A 9 19.076 -3.865 -3.023 1.00 0.00 H new ATOM 0 HA SER A 9 21.345 -5.117 -1.832 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.390 -5.509 -1.176 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.754 -5.662 -0.086 1.00 0.00 H new ATOM 0 HG SER A 9 18.581 -3.313 -1.178 1.00 0.00 H new ATOM 115 N GLN A 10 20.825 -7.632 -1.957 1.00 0.00 N ATOM 116 CA GLN A 10 20.789 -9.057 -2.207 1.00 0.00 C ATOM 117 C GLN A 10 19.935 -9.686 -1.112 1.00 0.00 C ATOM 118 O GLN A 10 20.100 -9.382 0.071 1.00 0.00 O ATOM 119 CB GLN A 10 22.240 -9.572 -2.245 1.00 0.00 C ATOM 120 CG GLN A 10 22.476 -11.014 -1.775 1.00 0.00 C ATOM 121 CD GLN A 10 21.854 -12.096 -2.669 1.00 0.00 C ATOM 122 OE1 GLN A 10 20.958 -11.844 -3.470 1.00 0.00 O ATOM 123 NE2 GLN A 10 22.315 -13.329 -2.552 1.00 0.00 N ATOM 0 H GLN A 10 21.398 -7.390 -1.149 1.00 0.00 H new ATOM 0 HA GLN A 10 20.339 -9.320 -3.165 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.605 -9.485 -3.268 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.851 -8.910 -1.631 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.550 -11.189 -1.712 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.076 -11.122 -0.767 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.059 -13.534 -1.885 1.00 0.00 H new ATOM 0 HE22 GLN A 10 21.926 -14.076 -3.128 1.00 0.00 H new ATOM 132 N ILE A 11 19.050 -10.588 -1.526 1.00 0.00 N ATOM 133 CA ILE A 11 18.102 -11.313 -0.695 1.00 0.00 C ATOM 134 C ILE A 11 18.172 -12.760 -1.178 1.00 0.00 C ATOM 135 O ILE A 11 17.889 -13.039 -2.347 1.00 0.00 O ATOM 136 CB ILE A 11 16.678 -10.698 -0.789 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.645 -9.186 -0.453 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.720 -11.421 0.175 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.696 -8.279 -1.687 1.00 0.00 C ATOM 0 H ILE A 11 18.973 -10.846 -2.510 1.00 0.00 H new ATOM 0 HA ILE A 11 18.347 -11.253 0.366 1.00 0.00 H new ATOM 0 HB ILE A 11 16.365 -10.825 -1.825 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.738 -8.968 0.110 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.488 -8.949 0.196 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.726 -10.980 0.099 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.669 -12.478 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.085 -11.318 1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.669 -7.236 -1.373 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.616 -8.468 -2.240 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.839 -8.487 -2.327 1.00 0.00 H new ATOM 151 N THR A 12 18.624 -13.660 -0.305 1.00 0.00 N ATOM 152 CA THR A 12 18.820 -15.070 -0.653 1.00 0.00 C ATOM 153 C THR A 12 17.478 -15.796 -0.850 1.00 0.00 C ATOM 154 O THR A 12 16.415 -15.286 -0.487 1.00 0.00 O ATOM 155 CB THR A 12 19.719 -15.764 0.388 1.00 0.00 C ATOM 156 OG1 THR A 12 19.385 -15.365 1.699 1.00 0.00 O ATOM 157 CG2 THR A 12 21.197 -15.432 0.175 1.00 0.00 C ATOM 0 H THR A 12 18.864 -13.435 0.660 1.00 0.00 H new ATOM 0 HA THR A 12 19.336 -15.119 -1.612 1.00 0.00 H new ATOM 0 HB THR A 12 19.555 -16.834 0.259 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.774 -14.484 1.882 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.797 -15.941 0.930 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.505 -15.763 -0.817 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.344 -14.355 0.260 1.00 0.00 H new ATOM 165 N ALA A 13 17.530 -17.014 -1.405 1.00 0.00 N ATOM 166 CA ALA A 13 16.365 -17.796 -1.820 1.00 0.00 C ATOM 167 C ALA A 13 15.348 -18.062 -0.701 1.00 0.00 C ATOM 168 O ALA A 13 14.166 -18.243 -0.999 1.00 0.00 O ATOM 169 CB ALA A 13 16.854 -19.135 -2.378 1.00 0.00 C ATOM 0 H ALA A 13 18.412 -17.494 -1.582 1.00 0.00 H new ATOM 0 HA ALA A 13 15.841 -17.202 -2.569 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.998 -19.732 -2.693 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.506 -18.957 -3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.406 -19.671 -1.606 1.00 0.00 H new ATOM 175 N ASN A 14 15.787 -18.095 0.563 1.00 0.00 N ATOM 176 CA ASN A 14 14.918 -18.369 1.719 1.00 0.00 C ATOM 177 C ASN A 14 14.793 -17.151 2.645 1.00 0.00 C ATOM 178 O ASN A 14 14.178 -17.215 3.713 1.00 0.00 O ATOM 179 CB ASN A 14 15.402 -19.619 2.467 1.00 0.00 C ATOM 180 CG ASN A 14 14.345 -20.127 3.450 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.210 -20.405 3.071 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.687 -20.286 4.717 1.00 0.00 N ATOM 0 H ASN A 14 16.761 -17.932 0.816 1.00 0.00 H new ATOM 0 HA ASN A 14 13.913 -18.570 1.347 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.641 -20.404 1.750 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.321 -19.389 3.006 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.006 -20.642 5.388 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.632 -20.053 5.023 1.00 0.00 H new ATOM 189 N SER A 15 15.390 -16.029 2.250 1.00 0.00 N ATOM 190 CA SER A 15 15.174 -14.750 2.894 1.00 0.00 C ATOM 191 C SER A 15 13.879 -14.138 2.355 1.00 0.00 C ATOM 192 O SER A 15 13.368 -14.577 1.317 1.00 0.00 O ATOM 193 CB SER A 15 16.361 -13.851 2.583 1.00 0.00 C ATOM 194 OG SER A 15 17.499 -14.344 3.250 1.00 0.00 O ATOM 0 H SER A 15 16.042 -15.989 1.466 1.00 0.00 H new ATOM 0 HA SER A 15 15.084 -14.866 3.974 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.539 -13.821 1.508 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.152 -12.829 2.900 1.00 0.00 H new ATOM 0 HG SER A 15 17.984 -14.957 2.659 1.00 0.00 H new ATOM 200 N GLN A 16 13.359 -13.106 3.018 1.00 0.00 N ATOM 201 CA GLN A 16 12.187 -12.374 2.553 1.00 0.00 C ATOM 202 C GLN A 16 12.371 -10.902 2.886 1.00 0.00 C ATOM 203 O GLN A 16 12.993 -10.558 3.895 1.00 0.00 O ATOM 204 CB GLN A 16 10.900 -12.885 3.229 1.00 0.00 C ATOM 205 CG GLN A 16 10.536 -14.338 2.884 1.00 0.00 C ATOM 206 CD GLN A 16 9.292 -14.791 3.646 1.00 0.00 C ATOM 207 OE1 GLN A 16 8.195 -14.882 3.097 1.00 0.00 O ATOM 208 NE2 GLN A 16 9.435 -15.076 4.929 1.00 0.00 N ATOM 0 H GLN A 16 13.742 -12.755 3.896 1.00 0.00 H new ATOM 0 HA GLN A 16 12.088 -12.522 1.478 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.013 -12.798 4.310 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.071 -12.238 2.942 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.362 -14.427 1.812 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.373 -14.993 3.126 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.351 -14.996 5.370 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.629 -15.376 5.478 1.00 0.00 H new ATOM 217 N CYS A 17 11.767 -10.049 2.063 1.00 0.00 N ATOM 218 CA CYS A 17 11.631 -8.628 2.311 1.00 0.00 C ATOM 219 C CYS A 17 10.177 -8.296 1.989 1.00 0.00 C ATOM 220 O CYS A 17 9.734 -8.593 0.875 1.00 0.00 O ATOM 221 CB CYS A 17 12.622 -7.834 1.454 1.00 0.00 C ATOM 222 SG CYS A 17 12.721 -6.081 1.901 1.00 0.00 S ATOM 0 H CYS A 17 11.348 -10.343 1.180 1.00 0.00 H new ATOM 0 HA CYS A 17 11.863 -8.360 3.342 1.00 0.00 H new ATOM 0 HB2 CYS A 17 13.611 -8.281 1.548 1.00 0.00 H new ATOM 0 HB3 CYS A 17 12.333 -7.918 0.406 1.00 0.00 H new ATOM 0 HG CYS A 17 13.582 -5.485 1.131 1.00 0.00 H new ATOM 227 N VAL A 18 9.439 -7.701 2.931 1.00 0.00 N ATOM 228 CA VAL A 18 8.028 -7.366 2.744 1.00 0.00 C ATOM 229 C VAL A 18 7.771 -5.962 3.306 1.00 0.00 C ATOM 230 O VAL A 18 8.204 -5.646 4.418 1.00 0.00 O ATOM 231 CB VAL A 18 7.114 -8.430 3.401 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.675 -8.308 2.874 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.571 -9.882 3.157 1.00 0.00 C ATOM 0 H VAL A 18 9.806 -7.438 3.846 1.00 0.00 H new ATOM 0 HA VAL A 18 7.788 -7.365 1.681 1.00 0.00 H new ATOM 0 HB VAL A 18 7.171 -8.227 4.470 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.049 -9.064 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.285 -7.317 3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.669 -8.457 1.794 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.881 -10.568 3.648 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.583 -10.084 2.086 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.572 -10.022 3.564 1.00 0.00 H new ATOM 243 N LYS A 19 7.053 -5.134 2.533 1.00 0.00 N ATOM 244 CA LYS A 19 6.667 -3.747 2.820 1.00 0.00 C ATOM 245 C LYS A 19 7.758 -2.942 3.531 1.00 0.00 C ATOM 246 O LYS A 19 7.477 -2.230 4.493 1.00 0.00 O ATOM 247 CB LYS A 19 5.278 -3.659 3.491 1.00 0.00 C ATOM 248 CG LYS A 19 5.108 -4.471 4.785 1.00 0.00 C ATOM 249 CD LYS A 19 3.924 -3.937 5.608 1.00 0.00 C ATOM 250 CE LYS A 19 3.556 -4.893 6.753 1.00 0.00 C ATOM 251 NZ LYS A 19 2.720 -4.229 7.783 1.00 0.00 N ATOM 0 H LYS A 19 6.702 -5.440 1.625 1.00 0.00 H new ATOM 0 HA LYS A 19 6.562 -3.250 1.855 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.067 -2.612 3.711 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.527 -3.992 2.774 1.00 0.00 H new ATOM 0 HG2 LYS A 19 4.945 -5.521 4.543 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.022 -4.418 5.376 1.00 0.00 H new ATOM 0 HD2 LYS A 19 4.176 -2.958 6.017 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.061 -3.798 4.957 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.020 -5.753 6.350 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.467 -5.273 7.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 2.206 -4.949 8.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 3.328 -3.678 8.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 2.039 -3.594 7.321 1.00 0.00 H new ATOM 265 N SER A 20 9.000 -3.062 3.070 1.00 0.00 N ATOM 266 CA SER A 20 10.178 -2.448 3.667 1.00 0.00 C ATOM 267 C SER A 20 11.056 -1.865 2.551 1.00 0.00 C ATOM 268 O SER A 20 10.738 -1.997 1.365 1.00 0.00 O ATOM 269 CB SER A 20 10.903 -3.505 4.517 1.00 0.00 C ATOM 270 OG SER A 20 10.074 -3.920 5.587 1.00 0.00 O ATOM 0 H SER A 20 9.220 -3.611 2.239 1.00 0.00 H new ATOM 0 HA SER A 20 9.913 -1.623 4.328 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.167 -4.362 3.898 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.834 -3.094 4.906 1.00 0.00 H new ATOM 0 HG SER A 20 9.387 -4.532 5.250 1.00 0.00 H new ATOM 276 N THR A 21 12.159 -1.221 2.921 1.00 0.00 N ATOM 277 CA THR A 21 13.118 -0.625 1.999 1.00 0.00 C ATOM 278 C THR A 21 14.472 -1.269 2.290 1.00 0.00 C ATOM 279 O THR A 21 14.795 -1.537 3.452 1.00 0.00 O ATOM 280 CB THR A 21 13.135 0.901 2.212 1.00 0.00 C ATOM 281 OG1 THR A 21 11.827 1.431 2.092 1.00 0.00 O ATOM 282 CG2 THR A 21 14.038 1.653 1.227 1.00 0.00 C ATOM 0 H THR A 21 12.417 -1.096 3.900 1.00 0.00 H new ATOM 0 HA THR A 21 12.858 -0.799 0.955 1.00 0.00 H new ATOM 0 HB THR A 21 13.536 1.047 3.215 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.853 2.401 2.231 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.998 2.721 1.439 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.064 1.300 1.332 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.695 1.473 0.208 1.00 0.00 H new ATOM 290 N ALA A 22 15.271 -1.519 1.252 1.00 0.00 N ATOM 291 CA ALA A 22 16.574 -2.141 1.395 1.00 0.00 C ATOM 292 C ALA A 22 17.552 -1.408 0.492 1.00 0.00 C ATOM 293 O ALA A 22 17.340 -1.334 -0.722 1.00 0.00 O ATOM 294 CB ALA A 22 16.480 -3.637 1.068 1.00 0.00 C ATOM 0 H ALA A 22 15.026 -1.292 0.288 1.00 0.00 H new ATOM 0 HA ALA A 22 16.932 -2.068 2.422 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.463 -4.096 1.178 1.00 0.00 H new ATOM 0 HB2 ALA A 22 15.778 -4.115 1.751 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.133 -3.764 0.043 1.00 0.00 H new ATOM 300 N THR A 23 18.618 -0.877 1.082 1.00 0.00 N ATOM 301 CA THR A 23 19.538 0.019 0.394 1.00 0.00 C ATOM 302 C THR A 23 20.922 -0.638 0.341 1.00 0.00 C ATOM 303 O THR A 23 21.744 -0.450 1.239 1.00 0.00 O ATOM 304 CB THR A 23 19.516 1.421 1.046 1.00 0.00 C ATOM 305 OG1 THR A 23 18.239 1.746 1.569 1.00 0.00 O ATOM 306 CG2 THR A 23 19.928 2.515 0.055 1.00 0.00 C ATOM 0 H THR A 23 18.868 -1.057 2.054 1.00 0.00 H new ATOM 0 HA THR A 23 19.229 0.184 -0.638 1.00 0.00 H new ATOM 0 HB THR A 23 20.237 1.378 1.862 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.082 1.235 2.390 1.00 0.00 H new ATOM 0 HG21 THR A 23 19.900 3.485 0.551 1.00 0.00 H new ATOM 0 HG22 THR A 23 20.939 2.320 -0.303 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.239 2.519 -0.789 1.00 0.00 H new ATOM 314 N ASN A 24 21.156 -1.429 -0.714 1.00 0.00 N ATOM 315 CA ASN A 24 22.388 -2.180 -0.985 1.00 0.00 C ATOM 316 C ASN A 24 22.813 -3.025 0.226 1.00 0.00 C ATOM 317 O ASN A 24 23.944 -2.931 0.706 1.00 0.00 O ATOM 318 CB ASN A 24 23.487 -1.250 -1.536 1.00 0.00 C ATOM 319 CG ASN A 24 24.556 -2.022 -2.308 1.00 0.00 C ATOM 320 OD1 ASN A 24 24.624 -1.939 -3.531 1.00 0.00 O ATOM 321 ND2 ASN A 24 25.394 -2.792 -1.640 1.00 0.00 N ATOM 0 H ASN A 24 20.453 -1.570 -1.440 1.00 0.00 H new ATOM 0 HA ASN A 24 22.195 -2.906 -1.775 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.036 -0.503 -2.190 1.00 0.00 H new ATOM 0 HB3 ASN A 24 23.953 -0.711 -0.711 1.00 0.00 H new ATOM 0 HD21 ASN A 24 26.106 -3.325 -2.140 1.00 0.00 H new ATOM 0 HD22 ASN A 24 25.330 -2.854 -0.624 1.00 0.00 H new ATOM 328 N CYS A 25 21.882 -3.822 0.748 1.00 0.00 N ATOM 329 CA CYS A 25 22.102 -4.698 1.890 1.00 0.00 C ATOM 330 C CYS A 25 22.334 -6.128 1.410 1.00 0.00 C ATOM 331 O CYS A 25 22.188 -6.427 0.223 1.00 0.00 O ATOM 332 CB CYS A 25 20.894 -4.619 2.828 1.00 0.00 C ATOM 333 SG CYS A 25 20.774 -3.037 3.687 1.00 0.00 S ATOM 0 H CYS A 25 20.933 -3.875 0.378 1.00 0.00 H new ATOM 0 HA CYS A 25 22.989 -4.379 2.437 1.00 0.00 H new ATOM 0 HB2 CYS A 25 19.983 -4.785 2.253 1.00 0.00 H new ATOM 0 HB3 CYS A 25 20.958 -5.422 3.563 1.00 0.00 H new ATOM 338 N TYR A 26 22.649 -7.021 2.342 1.00 0.00 N ATOM 339 CA TYR A 26 22.923 -8.423 2.082 1.00 0.00 C ATOM 340 C TYR A 26 22.134 -9.199 3.128 1.00 0.00 C ATOM 341 O TYR A 26 22.289 -8.951 4.326 1.00 0.00 O ATOM 342 CB TYR A 26 24.435 -8.670 2.181 1.00 0.00 C ATOM 343 CG TYR A 26 25.276 -7.739 1.321 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.460 -8.009 -0.048 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.837 -6.575 1.886 1.00 0.00 C ATOM 346 CE1 TYR A 26 26.199 -7.121 -0.852 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.581 -5.685 1.091 1.00 0.00 C ATOM 348 CZ TYR A 26 26.766 -5.956 -0.285 1.00 0.00 C ATOM 349 OH TYR A 26 27.489 -5.109 -1.072 1.00 0.00 O ATOM 0 H TYR A 26 22.722 -6.777 3.330 1.00 0.00 H new ATOM 0 HA TYR A 26 22.624 -8.740 1.083 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.742 -8.562 3.221 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.643 -9.700 1.892 1.00 0.00 H new ATOM 0 HD1 TYR A 26 25.033 -8.900 -0.483 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.694 -6.366 2.936 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.333 -7.330 -1.903 1.00 0.00 H new ATOM 0 HE2 TYR A 26 27.010 -4.797 1.530 1.00 0.00 H new ATOM 0 HH TYR A 26 27.810 -4.356 -0.533 1.00 0.00 H new ATOM 359 N ILE A 27 21.261 -10.100 2.686 1.00 0.00 N ATOM 360 CA ILE A 27 20.280 -10.756 3.535 1.00 0.00 C ATOM 361 C ILE A 27 20.433 -12.258 3.282 1.00 0.00 C ATOM 362 O ILE A 27 20.066 -12.759 2.212 1.00 0.00 O ATOM 363 CB ILE A 27 18.879 -10.158 3.224 1.00 0.00 C ATOM 364 CG1 ILE A 27 18.867 -8.619 3.419 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.777 -10.824 4.053 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.490 -7.947 3.323 1.00 0.00 C ATOM 0 H ILE A 27 21.217 -10.397 1.711 1.00 0.00 H new ATOM 0 HA ILE A 27 20.422 -10.592 4.603 1.00 0.00 H new ATOM 0 HB ILE A 27 18.669 -10.367 2.175 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.295 -8.392 4.395 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.522 -8.171 2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.814 -10.377 3.805 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.749 -11.891 3.831 1.00 0.00 H new ATOM 0 HG23 ILE A 27 17.982 -10.679 5.114 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.598 -6.873 3.474 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.062 -8.133 2.338 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.831 -8.357 4.088 1.00 0.00 H new ATOM 378 N ASP A 28 21.030 -12.963 4.247 1.00 0.00 N ATOM 379 CA ASP A 28 21.358 -14.383 4.186 1.00 0.00 C ATOM 380 C ASP A 28 20.454 -15.127 5.163 1.00 0.00 C ATOM 381 O ASP A 28 20.524 -14.876 6.366 1.00 0.00 O ATOM 382 CB ASP A 28 22.833 -14.604 4.541 1.00 0.00 C ATOM 383 CG ASP A 28 23.135 -16.103 4.713 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.931 -16.876 3.750 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.613 -16.512 5.795 1.00 0.00 O ATOM 0 H ASP A 28 21.309 -12.536 5.131 1.00 0.00 H new ATOM 0 HA ASP A 28 21.198 -14.760 3.176 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.467 -14.188 3.757 1.00 0.00 H new ATOM 0 HB3 ASP A 28 23.074 -14.072 5.461 1.00 0.00 H new ATOM 390 N ASN A 29 19.586 -16.005 4.657 1.00 0.00 N ATOM 391 CA ASN A 29 18.518 -16.698 5.397 1.00 0.00 C ATOM 392 C ASN A 29 17.768 -15.800 6.402 1.00 0.00 C ATOM 393 O ASN A 29 17.377 -16.260 7.476 1.00 0.00 O ATOM 394 CB ASN A 29 19.073 -17.975 6.062 1.00 0.00 C ATOM 395 CG ASN A 29 17.947 -18.956 6.381 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.245 -19.397 5.478 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.738 -19.355 7.625 1.00 0.00 N ATOM 0 H ASN A 29 19.606 -16.268 3.672 1.00 0.00 H new ATOM 0 HA ASN A 29 17.762 -16.982 4.665 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.797 -18.449 5.400 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.602 -17.712 6.978 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.997 -20.025 7.828 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.318 -18.992 8.381 1.00 0.00 H new ATOM 404 N SER A 30 17.581 -14.517 6.087 1.00 0.00 N ATOM 405 CA SER A 30 17.092 -13.512 7.018 1.00 0.00 C ATOM 406 C SER A 30 15.796 -12.878 6.517 1.00 0.00 C ATOM 407 O SER A 30 15.473 -12.915 5.331 1.00 0.00 O ATOM 408 CB SER A 30 18.180 -12.464 7.259 1.00 0.00 C ATOM 409 OG SER A 30 19.303 -13.040 7.887 1.00 0.00 O ATOM 0 H SER A 30 17.771 -14.145 5.156 1.00 0.00 H new ATOM 0 HA SER A 30 16.859 -13.992 7.968 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.478 -12.018 6.310 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.785 -11.659 7.879 1.00 0.00 H new ATOM 0 HG SER A 30 19.851 -13.501 7.218 1.00 0.00 H new ATOM 415 N GLN A 31 15.034 -12.291 7.434 1.00 0.00 N ATOM 416 CA GLN A 31 13.678 -11.837 7.174 1.00 0.00 C ATOM 417 C GLN A 31 13.596 -10.355 7.542 1.00 0.00 C ATOM 418 O GLN A 31 14.040 -9.966 8.625 1.00 0.00 O ATOM 419 CB GLN A 31 12.687 -12.702 7.981 1.00 0.00 C ATOM 420 CG GLN A 31 12.963 -14.225 7.992 1.00 0.00 C ATOM 421 CD GLN A 31 12.980 -14.887 6.609 1.00 0.00 C ATOM 422 OE1 GLN A 31 12.109 -14.640 5.783 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.937 -15.762 6.328 1.00 0.00 N ATOM 0 H GLN A 31 15.347 -12.116 8.389 1.00 0.00 H new ATOM 0 HA GLN A 31 13.413 -11.944 6.122 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.682 -12.347 9.012 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.686 -12.538 7.583 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.924 -14.402 8.476 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.204 -14.713 8.603 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.661 -15.965 7.018 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.949 -16.231 5.422 1.00 0.00 H new ATOM 432 N LEU A 32 13.052 -9.532 6.644 1.00 0.00 N ATOM 433 CA LEU A 32 12.995 -8.076 6.779 1.00 0.00 C ATOM 434 C LEU A 32 11.558 -7.633 6.520 1.00 0.00 C ATOM 435 O LEU A 32 11.059 -7.836 5.413 1.00 0.00 O ATOM 436 CB LEU A 32 13.976 -7.444 5.771 1.00 0.00 C ATOM 437 CG LEU A 32 14.037 -5.909 5.856 1.00 0.00 C ATOM 438 CD1 LEU A 32 14.537 -5.473 7.236 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.969 -5.333 4.782 1.00 0.00 C ATOM 0 H LEU A 32 12.628 -9.869 5.780 1.00 0.00 H new ATOM 0 HA LEU A 32 13.286 -7.754 7.779 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.973 -7.850 5.943 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.684 -7.733 4.761 1.00 0.00 H new ATOM 0 HG LEU A 32 13.029 -5.529 5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.575 -4.385 7.282 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.858 -5.845 8.003 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.534 -5.879 7.407 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.993 -4.246 4.866 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.974 -5.730 4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.603 -5.613 3.794 1.00 0.00 H new ATOM 451 N VAL A 33 10.872 -7.063 7.513 1.00 0.00 N ATOM 452 CA VAL A 33 9.432 -6.827 7.402 1.00 0.00 C ATOM 453 C VAL A 33 8.973 -5.505 8.036 1.00 0.00 C ATOM 454 O VAL A 33 9.672 -4.909 8.861 1.00 0.00 O ATOM 455 CB VAL A 33 8.662 -8.041 7.985 1.00 0.00 C ATOM 456 CG1 VAL A 33 8.845 -9.322 7.154 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.038 -8.362 9.441 1.00 0.00 C ATOM 0 H VAL A 33 11.286 -6.759 8.394 1.00 0.00 H new ATOM 0 HA VAL A 33 9.200 -6.725 6.342 1.00 0.00 H new ATOM 0 HB VAL A 33 7.619 -7.727 7.948 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.283 -10.136 7.612 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.480 -9.154 6.141 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.902 -9.586 7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.462 -9.221 9.785 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.102 -8.591 9.500 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.817 -7.501 10.072 1.00 0.00 H new ATOM 467 N ASP A 34 7.748 -5.113 7.670 1.00 0.00 N ATOM 468 CA ASP A 34 6.943 -4.034 8.246 1.00 0.00 C ATOM 469 C ASP A 34 7.668 -2.694 8.375 1.00 0.00 C ATOM 470 O ASP A 34 8.026 -2.271 9.465 1.00 0.00 O ATOM 471 CB ASP A 34 6.304 -4.501 9.563 1.00 0.00 C ATOM 472 CG ASP A 34 5.313 -3.475 10.125 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.578 -2.845 9.328 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.208 -3.343 11.365 1.00 0.00 O ATOM 0 H ASP A 34 7.258 -5.578 6.906 1.00 0.00 H new ATOM 0 HA ASP A 34 6.149 -3.819 7.530 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.789 -5.448 9.399 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.087 -4.687 10.298 1.00 0.00 H new ATOM 479 N THR A 35 7.858 -1.992 7.260 1.00 0.00 N ATOM 480 CA THR A 35 8.536 -0.716 7.156 1.00 0.00 C ATOM 481 C THR A 35 9.913 -0.675 7.834 1.00 0.00 C ATOM 482 O THR A 35 10.263 0.287 8.525 1.00 0.00 O ATOM 483 CB THR A 35 7.592 0.437 7.524 1.00 0.00 C ATOM 484 OG1 THR A 35 6.251 0.190 7.124 1.00 0.00 O ATOM 485 CG2 THR A 35 8.052 1.712 6.808 1.00 0.00 C ATOM 0 H THR A 35 7.521 -2.324 6.356 1.00 0.00 H new ATOM 0 HA THR A 35 8.795 -0.573 6.107 1.00 0.00 H new ATOM 0 HB THR A 35 7.623 0.539 8.609 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.688 0.950 7.381 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.385 2.535 7.066 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.068 1.957 7.118 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.031 1.552 5.730 1.00 0.00 H new ATOM 493 N SER A 36 10.698 -1.740 7.677 1.00 0.00 N ATOM 494 CA SER A 36 12.095 -1.679 8.049 1.00 0.00 C ATOM 495 C SER A 36 12.803 -0.938 6.912 1.00 0.00 C ATOM 496 O SER A 36 12.305 -0.889 5.782 1.00 0.00 O ATOM 497 CB SER A 36 12.668 -3.077 8.212 1.00 0.00 C ATOM 498 OG SER A 36 12.076 -3.742 9.303 1.00 0.00 O ATOM 0 H SER A 36 10.390 -2.637 7.301 1.00 0.00 H new ATOM 0 HA SER A 36 12.229 -1.168 9.003 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.503 -3.650 7.300 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.746 -3.017 8.360 1.00 0.00 H new ATOM 0 HG SER A 36 11.264 -4.201 9.004 1.00 0.00 H new ATOM 504 N ILE A 37 13.960 -0.349 7.195 1.00 0.00 N ATOM 505 CA ILE A 37 14.695 0.457 6.227 1.00 0.00 C ATOM 506 C ILE A 37 16.180 0.104 6.404 1.00 0.00 C ATOM 507 O ILE A 37 16.844 0.599 7.317 1.00 0.00 O ATOM 508 CB ILE A 37 14.338 1.964 6.383 1.00 0.00 C ATOM 509 CG1 ILE A 37 12.836 2.236 6.118 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.216 2.829 5.455 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.409 3.703 6.255 1.00 0.00 C ATOM 0 H ILE A 37 14.416 -0.417 8.105 1.00 0.00 H new ATOM 0 HA ILE A 37 14.421 0.239 5.195 1.00 0.00 H new ATOM 0 HB ILE A 37 14.541 2.239 7.418 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.592 1.895 5.112 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.246 1.635 6.810 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.951 3.879 5.579 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.266 2.687 5.711 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.052 2.533 4.419 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.342 3.792 6.051 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.615 4.049 7.268 1.00 0.00 H new ATOM 0 HD13 ILE A 37 12.967 4.312 5.544 1.00 0.00 H new ATOM 523 N CYS A 38 16.687 -0.816 5.579 1.00 0.00 N ATOM 524 CA CYS A 38 18.054 -1.302 5.698 1.00 0.00 C ATOM 525 C CYS A 38 18.967 -0.382 4.893 1.00 0.00 C ATOM 526 O CYS A 38 18.586 0.014 3.785 1.00 0.00 O ATOM 527 CB CYS A 38 18.123 -2.743 5.173 1.00 0.00 C ATOM 528 SG CYS A 38 19.743 -3.523 5.367 1.00 0.00 S ATOM 0 H CYS A 38 16.160 -1.240 4.815 1.00 0.00 H new ATOM 0 HA CYS A 38 18.378 -1.300 6.739 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.378 -3.344 5.694 1.00 0.00 H new ATOM 0 HB3 CYS A 38 17.854 -2.747 4.117 1.00 0.00 H new ATOM 533 N THR A 39 20.190 -0.129 5.370 1.00 0.00 N ATOM 534 CA THR A 39 21.209 0.569 4.601 1.00 0.00 C ATOM 535 C THR A 39 22.543 -0.144 4.823 1.00 0.00 C ATOM 536 O THR A 39 22.992 -0.298 5.961 1.00 0.00 O ATOM 537 CB THR A 39 21.286 2.060 4.997 1.00 0.00 C ATOM 538 OG1 THR A 39 20.022 2.601 5.332 1.00 0.00 O ATOM 539 CG2 THR A 39 21.917 2.921 3.900 1.00 0.00 C ATOM 0 H THR A 39 20.496 -0.406 6.303 1.00 0.00 H new ATOM 0 HA THR A 39 20.956 0.547 3.541 1.00 0.00 H new ATOM 0 HB THR A 39 21.923 2.085 5.881 1.00 0.00 H new ATOM 0 HG1 THR A 39 19.844 2.451 6.284 1.00 0.00 H new ATOM 0 HG21 THR A 39 21.948 3.961 4.226 1.00 0.00 H new ATOM 0 HG22 THR A 39 22.930 2.572 3.701 1.00 0.00 H new ATOM 0 HG23 THR A 39 21.322 2.844 2.990 1.00 0.00 H new ATOM 547 N ARG A 40 23.167 -0.587 3.730 1.00 0.00 N ATOM 548 CA ARG A 40 24.489 -1.218 3.629 1.00 0.00 C ATOM 549 C ARG A 40 24.800 -2.311 4.666 1.00 0.00 C ATOM 550 O ARG A 40 25.971 -2.550 4.963 1.00 0.00 O ATOM 551 CB ARG A 40 25.586 -0.133 3.562 1.00 0.00 C ATOM 552 CG ARG A 40 26.710 -0.530 2.582 1.00 0.00 C ATOM 553 CD ARG A 40 28.097 -0.054 3.037 1.00 0.00 C ATOM 554 NE ARG A 40 28.669 -0.950 4.059 1.00 0.00 N ATOM 555 CZ ARG A 40 29.320 -2.100 3.844 1.00 0.00 C ATOM 556 NH1 ARG A 40 29.557 -2.548 2.611 1.00 0.00 N ATOM 557 NH2 ARG A 40 29.733 -2.788 4.898 1.00 0.00 N ATOM 0 H ARG A 40 22.725 -0.508 2.814 1.00 0.00 H new ATOM 0 HA ARG A 40 24.473 -1.781 2.696 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.145 0.813 3.249 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.006 0.024 4.556 1.00 0.00 H new ATOM 0 HG2 ARG A 40 26.722 -1.614 2.471 1.00 0.00 H new ATOM 0 HG3 ARG A 40 26.492 -0.112 1.599 1.00 0.00 H new ATOM 0 HD2 ARG A 40 28.766 -0.007 2.178 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.022 0.956 3.439 1.00 0.00 H new ATOM 0 HE ARG A 40 28.557 -0.664 5.032 1.00 0.00 H new ATOM 0 HH11 ARG A 40 29.240 -2.011 1.804 1.00 0.00 H new ATOM 0 HH12 ARG A 40 30.055 -3.428 2.475 1.00 0.00 H new ATOM 0 HH21 ARG A 40 29.552 -2.438 5.839 1.00 0.00 H new ATOM 0 HH22 ARG A 40 30.232 -3.668 4.769 1.00 0.00 H new ATOM 571 N SER A 41 23.789 -2.955 5.247 1.00 0.00 N ATOM 572 CA SER A 41 23.982 -3.878 6.358 1.00 0.00 C ATOM 573 C SER A 41 23.976 -5.328 5.873 1.00 0.00 C ATOM 574 O SER A 41 23.488 -5.637 4.782 1.00 0.00 O ATOM 575 CB SER A 41 22.906 -3.627 7.415 1.00 0.00 C ATOM 576 OG SER A 41 22.986 -2.285 7.878 1.00 0.00 O ATOM 0 H SER A 41 22.816 -2.850 4.960 1.00 0.00 H new ATOM 0 HA SER A 41 24.959 -3.703 6.809 1.00 0.00 H new ATOM 0 HB2 SER A 41 21.919 -3.817 6.994 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.035 -4.317 8.249 1.00 0.00 H new ATOM 0 HG SER A 41 22.902 -1.671 7.119 1.00 0.00 H new ATOM 582 N GLN A 42 24.500 -6.211 6.720 1.00 0.00 N ATOM 583 CA GLN A 42 24.487 -7.656 6.542 1.00 0.00 C ATOM 584 C GLN A 42 23.544 -8.228 7.594 1.00 0.00 C ATOM 585 O GLN A 42 23.715 -7.953 8.783 1.00 0.00 O ATOM 586 CB GLN A 42 25.908 -8.216 6.739 1.00 0.00 C ATOM 587 CG GLN A 42 26.012 -9.756 6.706 1.00 0.00 C ATOM 588 CD GLN A 42 25.756 -10.367 5.326 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.505 -10.128 4.383 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.723 -11.181 5.167 1.00 0.00 N ATOM 0 H GLN A 42 24.963 -5.925 7.583 1.00 0.00 H new ATOM 0 HA GLN A 42 24.154 -7.926 5.540 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.555 -7.806 5.963 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.293 -7.861 7.695 1.00 0.00 H new ATOM 0 HG2 GLN A 42 27.006 -10.050 7.044 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.297 -10.174 7.415 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.103 -11.377 5.953 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.548 -11.611 4.259 1.00 0.00 H new ATOM 599 N TYR A 43 22.608 -9.071 7.172 1.00 0.00 N ATOM 600 CA TYR A 43 21.772 -9.869 8.053 1.00 0.00 C ATOM 601 C TYR A 43 22.097 -11.323 7.742 1.00 0.00 C ATOM 602 O TYR A 43 22.221 -11.674 6.563 1.00 0.00 O ATOM 603 CB TYR A 43 20.285 -9.605 7.790 1.00 0.00 C ATOM 604 CG TYR A 43 19.786 -8.171 7.845 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.423 -7.177 8.617 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.631 -7.840 7.116 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.894 -5.877 8.682 1.00 0.00 C ATOM 608 CE2 TYR A 43 18.105 -6.542 7.170 1.00 0.00 C ATOM 609 CZ TYR A 43 18.706 -5.564 7.990 1.00 0.00 C ATOM 610 OH TYR A 43 18.134 -4.339 8.147 1.00 0.00 O ATOM 0 H TYR A 43 22.407 -9.220 6.183 1.00 0.00 H new ATOM 0 HA TYR A 43 21.965 -9.620 9.097 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.047 -10.002 6.803 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.712 -10.184 8.514 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.324 -7.417 9.162 1.00 0.00 H new ATOM 0 HD2 TYR A 43 18.146 -8.591 6.510 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.397 -5.118 9.262 1.00 0.00 H new ATOM 0 HE2 TYR A 43 17.236 -6.289 6.581 1.00 0.00 H new ATOM 0 HH TYR A 43 18.525 -3.711 7.504 1.00 0.00 H new ATOM 620 N SER A 44 22.237 -12.152 8.771 1.00 0.00 N ATOM 621 CA SER A 44 22.623 -13.541 8.630 1.00 0.00 C ATOM 622 C SER A 44 21.825 -14.362 9.642 1.00 0.00 C ATOM 623 O SER A 44 21.978 -14.186 10.853 1.00 0.00 O ATOM 624 CB SER A 44 24.136 -13.675 8.844 1.00 0.00 C ATOM 625 OG SER A 44 24.861 -12.840 7.949 1.00 0.00 O ATOM 0 H SER A 44 22.082 -11.868 9.738 1.00 0.00 H new ATOM 0 HA SER A 44 22.403 -13.913 7.629 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.385 -13.412 9.872 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.435 -14.713 8.699 1.00 0.00 H new ATOM 0 HG SER A 44 25.822 -12.945 8.109 1.00 0.00 H new ATOM 631 N ASP A 45 20.968 -15.250 9.137 1.00 0.00 N ATOM 632 CA ASP A 45 19.997 -16.054 9.881 1.00 0.00 C ATOM 633 C ASP A 45 19.234 -15.247 10.948 1.00 0.00 C ATOM 634 O ASP A 45 19.065 -15.691 12.086 1.00 0.00 O ATOM 635 CB ASP A 45 20.677 -17.321 10.427 1.00 0.00 C ATOM 636 CG ASP A 45 19.643 -18.346 10.920 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.701 -18.649 10.154 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.808 -18.912 12.024 1.00 0.00 O ATOM 0 H ASP A 45 20.931 -15.439 8.135 1.00 0.00 H new ATOM 0 HA ASP A 45 19.216 -16.373 9.191 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.293 -17.770 9.647 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.345 -17.053 11.246 1.00 0.00 H new ATOM 643 N ALA A 46 18.796 -14.033 10.594 1.00 0.00 N ATOM 644 CA ALA A 46 18.249 -13.038 11.513 1.00 0.00 C ATOM 645 C ALA A 46 16.846 -12.575 11.099 1.00 0.00 C ATOM 646 O ALA A 46 16.391 -12.834 9.984 1.00 0.00 O ATOM 647 CB ALA A 46 19.224 -11.853 11.559 1.00 0.00 C ATOM 0 H ALA A 46 18.815 -13.709 9.627 1.00 0.00 H new ATOM 0 HA ALA A 46 18.141 -13.484 12.501 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.840 -11.092 12.239 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.197 -12.196 11.910 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.327 -11.428 10.561 1.00 0.00 H new ATOM 653 N ASN A 47 16.166 -11.838 11.980 1.00 0.00 N ATOM 654 CA ASN A 47 14.865 -11.228 11.708 1.00 0.00 C ATOM 655 C ASN A 47 14.902 -9.767 12.121 1.00 0.00 C ATOM 656 O ASN A 47 15.467 -9.427 13.159 1.00 0.00 O ATOM 657 CB ASN A 47 13.742 -11.939 12.467 1.00 0.00 C ATOM 658 CG ASN A 47 12.417 -11.189 12.333 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.906 -11.009 11.234 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.847 -10.710 13.428 1.00 0.00 N ATOM 0 H ASN A 47 16.512 -11.646 12.920 1.00 0.00 H new ATOM 0 HA ASN A 47 14.663 -11.318 10.641 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.628 -12.953 12.085 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.009 -12.023 13.520 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.975 -10.186 13.361 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.280 -10.865 14.338 1.00 0.00 H new ATOM 667 N VAL A 48 14.276 -8.919 11.319 1.00 0.00 N ATOM 668 CA VAL A 48 14.274 -7.475 11.484 1.00 0.00 C ATOM 669 C VAL A 48 12.861 -6.977 11.173 1.00 0.00 C ATOM 670 O VAL A 48 12.308 -7.303 10.119 1.00 0.00 O ATOM 671 CB VAL A 48 15.346 -6.852 10.564 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.413 -5.330 10.747 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.756 -7.423 10.804 1.00 0.00 C ATOM 0 H VAL A 48 13.738 -9.228 10.509 1.00 0.00 H new ATOM 0 HA VAL A 48 14.528 -7.180 12.502 1.00 0.00 H new ATOM 0 HB VAL A 48 15.038 -7.105 9.550 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.176 -4.917 10.087 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.446 -4.891 10.502 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.665 -5.099 11.782 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.463 -6.944 10.126 1.00 0.00 H new ATOM 0 HG22 VAL A 48 17.055 -7.232 11.835 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.749 -8.498 10.621 1.00 0.00 H new ATOM 683 N LYS A 49 12.279 -6.188 12.083 1.00 0.00 N ATOM 684 CA LYS A 49 10.914 -5.684 11.958 1.00 0.00 C ATOM 685 C LYS A 49 10.879 -4.212 12.340 1.00 0.00 C ATOM 686 O LYS A 49 11.379 -3.837 13.405 1.00 0.00 O ATOM 687 CB LYS A 49 9.971 -6.528 12.831 1.00 0.00 C ATOM 688 CG LYS A 49 8.511 -6.065 12.703 1.00 0.00 C ATOM 689 CD LYS A 49 7.529 -7.021 13.390 1.00 0.00 C ATOM 690 CE LYS A 49 6.091 -6.517 13.189 1.00 0.00 C ATOM 691 NZ LYS A 49 5.089 -7.396 13.844 1.00 0.00 N ATOM 0 H LYS A 49 12.750 -5.881 12.934 1.00 0.00 H new ATOM 0 HA LYS A 49 10.574 -5.768 10.926 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.047 -7.576 12.541 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.284 -6.462 13.873 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.409 -5.071 13.138 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.252 -5.980 11.648 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.634 -8.024 12.977 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.756 -7.088 14.454 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.003 -5.507 13.590 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.875 -6.456 12.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.135 -7.016 13.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.153 -8.354 13.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.276 -7.435 14.866 1.00 0.00 H new ATOM 705 N LYS A 50 10.257 -3.395 11.489 1.00 0.00 N ATOM 706 CA LYS A 50 10.160 -1.940 11.589 1.00 0.00 C ATOM 707 C LYS A 50 11.421 -1.293 12.162 1.00 0.00 C ATOM 708 O LYS A 50 11.342 -0.499 13.097 1.00 0.00 O ATOM 709 CB LYS A 50 8.863 -1.594 12.346 1.00 0.00 C ATOM 710 CG LYS A 50 8.429 -0.126 12.183 1.00 0.00 C ATOM 711 CD LYS A 50 6.942 0.027 12.531 1.00 0.00 C ATOM 712 CE LYS A 50 6.097 -0.173 11.262 1.00 0.00 C ATOM 713 NZ LYS A 50 4.718 -0.625 11.547 1.00 0.00 N ATOM 0 H LYS A 50 9.779 -3.754 10.662 1.00 0.00 H new ATOM 0 HA LYS A 50 10.098 -1.505 10.591 1.00 0.00 H new ATOM 0 HB2 LYS A 50 8.062 -2.243 11.993 1.00 0.00 H new ATOM 0 HB3 LYS A 50 9.002 -1.808 13.406 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.029 0.513 12.831 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.606 0.202 11.159 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.658 -0.703 13.289 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.756 1.014 12.953 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.058 0.765 10.707 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.587 -0.904 10.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.103 -0.391 10.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.714 -1.654 11.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.366 -0.148 12.402 1.00 0.00 H new ATOM 727 N SER A 51 12.592 -1.652 11.641 1.00 0.00 N ATOM 728 CA SER A 51 13.865 -1.222 12.201 1.00 0.00 C ATOM 729 C SER A 51 14.709 -0.620 11.092 1.00 0.00 C ATOM 730 O SER A 51 14.505 -0.920 9.914 1.00 0.00 O ATOM 731 CB SER A 51 14.551 -2.411 12.872 1.00 0.00 C ATOM 732 OG SER A 51 13.807 -2.848 13.995 1.00 0.00 O ATOM 0 H SER A 51 12.682 -2.249 10.819 1.00 0.00 H new ATOM 0 HA SER A 51 13.718 -0.458 12.964 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.655 -3.228 12.158 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.557 -2.129 13.183 1.00 0.00 H new ATOM 0 HG SER A 51 13.056 -3.402 13.695 1.00 0.00 H new ATOM 738 N VAL A 52 15.647 0.245 11.459 1.00 0.00 N ATOM 739 CA VAL A 52 16.395 1.066 10.522 1.00 0.00 C ATOM 740 C VAL A 52 17.869 0.768 10.755 1.00 0.00 C ATOM 741 O VAL A 52 18.295 0.689 11.911 1.00 0.00 O ATOM 742 CB VAL A 52 16.036 2.556 10.720 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.722 3.442 9.669 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.515 2.795 10.643 1.00 0.00 C ATOM 0 H VAL A 52 15.912 0.396 12.432 1.00 0.00 H new ATOM 0 HA VAL A 52 16.147 0.838 9.485 1.00 0.00 H new ATOM 0 HB VAL A 52 16.391 2.824 11.715 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.448 4.484 9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.803 3.333 9.751 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.402 3.139 8.672 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.305 3.855 10.787 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.146 2.482 9.666 1.00 0.00 H new ATOM 0 HG23 VAL A 52 14.016 2.217 11.421 1.00 0.00 H new ATOM 754 N THR A 53 18.657 0.596 9.695 1.00 0.00 N ATOM 755 CA THR A 53 20.065 0.256 9.852 1.00 0.00 C ATOM 756 C THR A 53 20.939 1.134 8.970 1.00 0.00 C ATOM 757 O THR A 53 20.476 1.720 7.985 1.00 0.00 O ATOM 758 CB THR A 53 20.329 -1.241 9.607 1.00 0.00 C ATOM 759 OG1 THR A 53 20.283 -1.552 8.232 1.00 0.00 O ATOM 760 CG2 THR A 53 19.357 -2.162 10.353 1.00 0.00 C ATOM 0 H THR A 53 18.346 0.686 8.728 1.00 0.00 H new ATOM 0 HA THR A 53 20.335 0.454 10.889 1.00 0.00 H new ATOM 0 HB THR A 53 21.330 -1.421 10.000 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.181 -1.789 7.920 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.601 -3.202 10.135 1.00 0.00 H new ATOM 0 HG22 THR A 53 19.441 -1.987 11.426 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.337 -1.953 10.030 1.00 0.00 H new ATOM 768 N THR A 54 22.212 1.240 9.334 1.00 0.00 N ATOM 769 CA THR A 54 23.255 1.834 8.530 1.00 0.00 C ATOM 770 C THR A 54 24.538 1.080 8.874 1.00 0.00 C ATOM 771 O THR A 54 25.041 1.196 9.993 1.00 0.00 O ATOM 772 CB THR A 54 23.330 3.348 8.805 1.00 0.00 C ATOM 773 OG1 THR A 54 22.107 3.970 8.451 1.00 0.00 O ATOM 774 CG2 THR A 54 24.444 4.039 8.012 1.00 0.00 C ATOM 0 H THR A 54 22.551 0.899 10.234 1.00 0.00 H new ATOM 0 HA THR A 54 23.069 1.747 7.459 1.00 0.00 H new ATOM 0 HB THR A 54 23.538 3.452 9.870 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.480 3.294 8.119 1.00 0.00 H new ATOM 0 HG21 THR A 54 24.450 5.104 8.245 1.00 0.00 H new ATOM 0 HG22 THR A 54 25.406 3.603 8.281 1.00 0.00 H new ATOM 0 HG23 THR A 54 24.269 3.902 6.945 1.00 0.00 H new ATOM 782 N ASP A 55 25.059 0.330 7.898 1.00 0.00 N ATOM 783 CA ASP A 55 26.330 -0.392 7.957 1.00 0.00 C ATOM 784 C ASP A 55 26.464 -1.247 9.226 1.00 0.00 C ATOM 785 O ASP A 55 27.362 -1.037 10.045 1.00 0.00 O ATOM 786 CB ASP A 55 27.497 0.587 7.742 1.00 0.00 C ATOM 787 CG ASP A 55 28.848 -0.141 7.677 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.941 -1.150 6.945 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.834 0.338 8.283 1.00 0.00 O ATOM 0 H ASP A 55 24.583 0.205 7.005 1.00 0.00 H new ATOM 0 HA ASP A 55 26.359 -1.115 7.142 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.339 1.143 6.818 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.515 1.315 8.553 1.00 0.00 H new ATOM 794 N CYS A 56 25.544 -2.201 9.411 1.00 0.00 N ATOM 795 CA CYS A 56 25.504 -3.074 10.579 1.00 0.00 C ATOM 796 C CYS A 56 25.703 -4.532 10.167 1.00 0.00 C ATOM 797 O CYS A 56 25.594 -4.869 8.987 1.00 0.00 O ATOM 798 CB CYS A 56 24.185 -2.882 11.342 1.00 0.00 C ATOM 799 SG CYS A 56 24.141 -1.389 12.366 1.00 0.00 S ATOM 0 H CYS A 56 24.798 -2.387 8.741 1.00 0.00 H new ATOM 0 HA CYS A 56 26.322 -2.805 11.248 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.364 -2.844 10.626 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.014 -3.751 11.977 1.00 0.00 H new ATOM 804 N ASN A 57 25.961 -5.410 11.138 1.00 0.00 N ATOM 805 CA ASN A 57 26.106 -6.845 10.928 1.00 0.00 C ATOM 806 C ASN A 57 25.226 -7.497 11.976 1.00 0.00 C ATOM 807 O ASN A 57 25.393 -7.208 13.156 1.00 0.00 O ATOM 808 CB ASN A 57 27.571 -7.275 11.093 1.00 0.00 C ATOM 809 CG ASN A 57 27.691 -8.795 11.083 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.806 -9.429 12.127 1.00 0.00 O ATOM 811 ND2 ASN A 57 27.662 -9.414 9.915 1.00 0.00 N ATOM 0 H ASN A 57 26.077 -5.133 12.113 1.00 0.00 H new ATOM 0 HA ASN A 57 25.813 -7.138 9.920 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.172 -6.853 10.288 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.968 -6.880 12.028 1.00 0.00 H new ATOM 0 HD21 ASN A 57 27.736 -10.431 9.875 1.00 0.00 H new ATOM 0 HD22 ASN A 57 27.566 -8.875 9.054 1.00 0.00 H new ATOM 818 N ILE A 58 24.266 -8.315 11.568 1.00 0.00 N ATOM 819 CA ILE A 58 23.229 -8.817 12.459 1.00 0.00 C ATOM 820 C ILE A 58 23.202 -10.324 12.264 1.00 0.00 C ATOM 821 O ILE A 58 22.682 -10.806 11.257 1.00 0.00 O ATOM 822 CB ILE A 58 21.886 -8.097 12.173 1.00 0.00 C ATOM 823 CG1 ILE A 58 22.059 -6.560 12.305 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.770 -8.633 13.085 1.00 0.00 C ATOM 825 CD1 ILE A 58 20.771 -5.733 12.224 1.00 0.00 C ATOM 0 H ILE A 58 24.184 -8.650 10.608 1.00 0.00 H new ATOM 0 HA ILE A 58 23.425 -8.609 13.511 1.00 0.00 H new ATOM 0 HB ILE A 58 21.586 -8.308 11.146 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.544 -6.349 13.258 1.00 0.00 H new ATOM 0 HG13 ILE A 58 22.736 -6.221 11.521 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.838 -8.112 12.865 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.639 -9.701 12.910 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.041 -8.467 14.128 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.011 -4.675 12.328 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.290 -5.903 11.261 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.095 -6.032 13.025 1.00 0.00 H new ATOM 837 N ASP A 59 23.805 -11.062 13.197 1.00 0.00 N ATOM 838 CA ASP A 59 23.981 -12.502 13.076 1.00 0.00 C ATOM 839 C ASP A 59 23.114 -13.195 14.117 1.00 0.00 C ATOM 840 O ASP A 59 23.162 -12.830 15.293 1.00 0.00 O ATOM 841 CB ASP A 59 25.455 -12.863 13.271 1.00 0.00 C ATOM 842 CG ASP A 59 25.663 -14.383 13.175 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.522 -14.938 12.064 1.00 0.00 O ATOM 844 OD2 ASP A 59 26.007 -15.016 14.196 1.00 0.00 O ATOM 0 H ASP A 59 24.185 -10.672 14.060 1.00 0.00 H new ATOM 0 HA ASP A 59 23.678 -12.833 12.083 1.00 0.00 H new ATOM 0 HB2 ASP A 59 26.060 -12.360 12.516 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.796 -12.506 14.243 1.00 0.00 H new ATOM 849 N LYS A 60 22.310 -14.174 13.689 1.00 0.00 N ATOM 850 CA LYS A 60 21.440 -15.001 14.533 1.00 0.00 C ATOM 851 C LYS A 60 20.617 -14.184 15.543 1.00 0.00 C ATOM 852 O LYS A 60 20.408 -14.631 16.673 1.00 0.00 O ATOM 853 CB LYS A 60 22.261 -16.136 15.182 1.00 0.00 C ATOM 854 CG LYS A 60 22.858 -17.102 14.142 1.00 0.00 C ATOM 855 CD LYS A 60 23.714 -18.211 14.770 1.00 0.00 C ATOM 856 CE LYS A 60 22.885 -19.171 15.638 1.00 0.00 C ATOM 857 NZ LYS A 60 23.700 -20.287 16.178 1.00 0.00 N ATOM 0 H LYS A 60 22.245 -14.423 12.702 1.00 0.00 H new ATOM 0 HA LYS A 60 20.687 -15.460 13.892 1.00 0.00 H new ATOM 0 HB2 LYS A 60 23.066 -15.704 15.776 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.624 -16.694 15.868 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.049 -17.556 13.570 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.467 -16.536 13.437 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.209 -18.776 13.980 1.00 0.00 H new ATOM 0 HD3 LYS A 60 24.498 -17.760 15.379 1.00 0.00 H new ATOM 0 HE2 LYS A 60 22.439 -18.617 16.464 1.00 0.00 H new ATOM 0 HE3 LYS A 60 22.065 -19.576 15.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 23.099 -20.908 16.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 24.106 -20.833 15.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 24.468 -19.904 16.765 1.00 0.00 H new ATOM 871 N SER A 61 20.162 -12.989 15.160 1.00 0.00 N ATOM 872 CA SER A 61 19.522 -12.041 16.068 1.00 0.00 C ATOM 873 C SER A 61 18.110 -11.689 15.598 1.00 0.00 C ATOM 874 O SER A 61 17.729 -11.965 14.458 1.00 0.00 O ATOM 875 CB SER A 61 20.398 -10.789 16.195 1.00 0.00 C ATOM 876 OG SER A 61 21.666 -11.104 16.742 1.00 0.00 O ATOM 0 H SER A 61 20.229 -12.651 14.200 1.00 0.00 H new ATOM 0 HA SER A 61 19.422 -12.503 17.050 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.526 -10.330 15.214 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.898 -10.055 16.827 1.00 0.00 H new ATOM 0 HG SER A 61 22.192 -11.602 16.082 1.00 0.00 H new ATOM 882 N GLN A 62 17.337 -11.056 16.476 1.00 0.00 N ATOM 883 CA GLN A 62 15.971 -10.618 16.244 1.00 0.00 C ATOM 884 C GLN A 62 15.913 -9.145 16.650 1.00 0.00 C ATOM 885 O GLN A 62 16.399 -8.778 17.722 1.00 0.00 O ATOM 886 CB GLN A 62 14.997 -11.475 17.063 1.00 0.00 C ATOM 887 CG GLN A 62 14.930 -12.942 16.612 1.00 0.00 C ATOM 888 CD GLN A 62 14.113 -13.800 17.583 1.00 0.00 C ATOM 889 OE1 GLN A 62 14.615 -14.767 18.149 1.00 0.00 O ATOM 890 NE2 GLN A 62 12.849 -13.477 17.816 1.00 0.00 N ATOM 0 H GLN A 62 17.666 -10.825 17.413 1.00 0.00 H new ATOM 0 HA GLN A 62 15.680 -10.731 15.200 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.291 -11.440 18.112 1.00 0.00 H new ATOM 0 HB3 GLN A 62 14.000 -11.039 16.997 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.487 -12.996 15.618 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.940 -13.344 16.533 1.00 0.00 H new ATOM 0 HE21 GLN A 62 12.433 -12.673 17.345 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.292 -14.032 18.466 1.00 0.00 H new ATOM 899 N VAL A 63 15.330 -8.304 15.801 1.00 0.00 N ATOM 900 CA VAL A 63 15.391 -6.855 15.922 1.00 0.00 C ATOM 901 C VAL A 63 13.988 -6.300 15.676 1.00 0.00 C ATOM 902 O VAL A 63 13.356 -6.671 14.683 1.00 0.00 O ATOM 903 CB VAL A 63 16.410 -6.336 14.881 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.602 -4.821 14.972 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.786 -7.011 14.992 1.00 0.00 C ATOM 0 H VAL A 63 14.792 -8.619 14.994 1.00 0.00 H new ATOM 0 HA VAL A 63 15.716 -6.534 16.912 1.00 0.00 H new ATOM 0 HB VAL A 63 15.976 -6.594 13.915 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.326 -4.500 14.223 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.649 -4.322 14.793 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.968 -4.560 15.965 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.454 -6.602 14.234 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.203 -6.826 15.982 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.678 -8.085 14.839 1.00 0.00 H new ATOM 915 N TYR A 64 13.509 -5.411 16.550 1.00 0.00 N ATOM 916 CA TYR A 64 12.160 -4.854 16.484 1.00 0.00 C ATOM 917 C TYR A 64 12.223 -3.370 16.829 1.00 0.00 C ATOM 918 O TYR A 64 12.816 -3.031 17.853 1.00 0.00 O ATOM 919 CB TYR A 64 11.249 -5.571 17.495 1.00 0.00 C ATOM 920 CG TYR A 64 11.201 -7.080 17.349 1.00 0.00 C ATOM 921 CD1 TYR A 64 12.133 -7.879 18.034 1.00 0.00 C ATOM 922 CD2 TYR A 64 10.245 -7.682 16.510 1.00 0.00 C ATOM 923 CE1 TYR A 64 12.136 -9.270 17.852 1.00 0.00 C ATOM 924 CE2 TYR A 64 10.242 -9.076 16.321 1.00 0.00 C ATOM 925 CZ TYR A 64 11.203 -9.876 16.982 1.00 0.00 C ATOM 926 OH TYR A 64 11.247 -11.224 16.778 1.00 0.00 O ATOM 0 H TYR A 64 14.057 -5.055 17.333 1.00 0.00 H new ATOM 0 HA TYR A 64 11.757 -4.990 15.480 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.586 -5.328 18.503 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.237 -5.178 17.394 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.848 -7.421 18.702 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.510 -7.070 16.008 1.00 0.00 H new ATOM 0 HE1 TYR A 64 12.855 -9.880 18.379 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.509 -9.534 15.674 1.00 0.00 H new ATOM 0 HH TYR A 64 10.538 -11.484 16.154 1.00 0.00 H new ATOM 936 N LEU A 65 11.583 -2.490 16.048 1.00 0.00 N ATOM 937 CA LEU A 65 11.461 -1.050 16.344 1.00 0.00 C ATOM 938 C LEU A 65 12.805 -0.380 16.712 1.00 0.00 C ATOM 939 O LEU A 65 12.823 0.616 17.439 1.00 0.00 O ATOM 940 CB LEU A 65 10.382 -0.839 17.433 1.00 0.00 C ATOM 941 CG LEU A 65 8.947 -1.188 16.993 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.033 -1.277 18.220 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.379 -0.140 16.027 1.00 0.00 C ATOM 0 H LEU A 65 11.126 -2.760 15.177 1.00 0.00 H new ATOM 0 HA LEU A 65 11.147 -0.548 15.429 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.639 -1.445 18.302 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.406 0.203 17.753 1.00 0.00 H new ATOM 0 HG LEU A 65 8.987 -2.148 16.478 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.020 -1.524 17.902 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.401 -2.052 18.893 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.027 -0.319 18.739 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.366 -0.421 15.740 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.360 0.834 16.517 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.007 -0.087 15.138 1.00 0.00 H new ATOM 955 N THR A 66 13.933 -0.900 16.225 1.00 0.00 N ATOM 956 CA THR A 66 15.272 -0.524 16.666 1.00 0.00 C ATOM 957 C THR A 66 16.032 0.222 15.561 1.00 0.00 C ATOM 958 O THR A 66 15.687 0.136 14.380 1.00 0.00 O ATOM 959 CB THR A 66 15.941 -1.823 17.166 1.00 0.00 C ATOM 960 OG1 THR A 66 15.334 -2.195 18.392 1.00 0.00 O ATOM 961 CG2 THR A 66 17.453 -1.800 17.398 1.00 0.00 C ATOM 0 H THR A 66 13.938 -1.612 15.495 1.00 0.00 H new ATOM 0 HA THR A 66 15.259 0.195 17.485 1.00 0.00 H new ATOM 0 HB THR A 66 15.791 -2.526 16.346 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.469 -2.619 18.213 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.782 -2.779 17.747 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.961 -1.558 16.464 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.695 -1.047 18.148 1.00 0.00 H new ATOM 969 N THR A 67 17.078 0.958 15.941 1.00 0.00 N ATOM 970 CA THR A 67 17.927 1.717 15.033 1.00 0.00 C ATOM 971 C THR A 67 19.378 1.276 15.257 1.00 0.00 C ATOM 972 O THR A 67 19.845 1.253 16.397 1.00 0.00 O ATOM 973 CB THR A 67 17.714 3.223 15.271 1.00 0.00 C ATOM 974 OG1 THR A 67 16.338 3.554 15.179 1.00 0.00 O ATOM 975 CG2 THR A 67 18.468 4.078 14.246 1.00 0.00 C ATOM 0 H THR A 67 17.362 1.042 16.917 1.00 0.00 H new ATOM 0 HA THR A 67 17.673 1.526 13.990 1.00 0.00 H new ATOM 0 HB THR A 67 18.096 3.433 16.270 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.221 4.515 15.335 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.290 5.134 14.451 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.536 3.870 14.314 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.115 3.839 13.243 1.00 0.00 H new ATOM 983 N CYS A 68 20.093 0.936 14.182 1.00 0.00 N ATOM 984 CA CYS A 68 21.443 0.394 14.239 1.00 0.00 C ATOM 985 C CYS A 68 22.351 1.237 13.351 1.00 0.00 C ATOM 986 O CYS A 68 22.067 1.389 12.162 1.00 0.00 O ATOM 987 CB CYS A 68 21.422 -1.068 13.770 1.00 0.00 C ATOM 988 SG CYS A 68 22.997 -1.941 13.966 1.00 0.00 S ATOM 0 H CYS A 68 19.738 1.034 13.231 1.00 0.00 H new ATOM 0 HA CYS A 68 21.823 0.424 15.260 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.652 -1.604 14.326 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.134 -1.095 12.719 1.00 0.00 H new ATOM 993 N THR A 69 23.455 1.744 13.896 1.00 0.00 N ATOM 994 CA THR A 69 24.419 2.543 13.155 1.00 0.00 C ATOM 995 C THR A 69 25.811 2.003 13.470 1.00 0.00 C ATOM 996 O THR A 69 26.229 2.009 14.631 1.00 0.00 O ATOM 997 CB THR A 69 24.265 4.027 13.544 1.00 0.00 C ATOM 998 OG1 THR A 69 22.912 4.443 13.458 1.00 0.00 O ATOM 999 CG2 THR A 69 25.093 4.943 12.636 1.00 0.00 C ATOM 0 H THR A 69 23.705 1.608 14.876 1.00 0.00 H new ATOM 0 HA THR A 69 24.253 2.477 12.080 1.00 0.00 H new ATOM 0 HB THR A 69 24.621 4.108 14.571 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.843 5.387 13.712 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.957 5.980 12.943 1.00 0.00 H new ATOM 0 HG22 THR A 69 26.147 4.677 12.715 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.765 4.825 11.603 1.00 0.00 H new ATOM 1007 N GLY A 70 26.531 1.529 12.448 1.00 0.00 N ATOM 1008 CA GLY A 70 27.923 1.111 12.559 1.00 0.00 C ATOM 1009 C GLY A 70 28.142 0.084 13.670 1.00 0.00 C ATOM 1010 O GLY A 70 29.122 0.203 14.407 1.00 0.00 O ATOM 0 H GLY A 70 26.152 1.425 11.507 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.248 0.688 11.609 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.547 1.985 12.749 1.00 0.00 H new ATOM 1014 N SER A 71 27.218 -0.870 13.840 1.00 0.00 N ATOM 1015 CA SER A 71 27.206 -1.763 14.990 1.00 0.00 C ATOM 1016 C SER A 71 26.989 -3.225 14.595 1.00 0.00 C ATOM 1017 O SER A 71 26.535 -3.527 13.490 1.00 0.00 O ATOM 1018 CB SER A 71 26.140 -1.297 15.994 1.00 0.00 C ATOM 1019 OG SER A 71 26.438 -0.006 16.496 1.00 0.00 O ATOM 0 H SER A 71 26.460 -1.039 13.179 1.00 0.00 H new ATOM 0 HA SER A 71 28.189 -1.717 15.459 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.163 -1.286 15.512 1.00 0.00 H new ATOM 0 HB3 SER A 71 26.080 -2.006 16.820 1.00 0.00 H new ATOM 0 HG SER A 71 26.453 0.637 15.757 1.00 0.00 H new ATOM 1025 N GLN A 72 27.300 -4.142 15.513 1.00 0.00 N ATOM 1026 CA GLN A 72 27.158 -5.575 15.317 1.00 0.00 C ATOM 1027 C GLN A 72 26.201 -6.125 16.370 1.00 0.00 C ATOM 1028 O GLN A 72 26.334 -5.796 17.551 1.00 0.00 O ATOM 1029 CB GLN A 72 28.535 -6.257 15.375 1.00 0.00 C ATOM 1030 CG GLN A 72 28.429 -7.784 15.227 1.00 0.00 C ATOM 1031 CD GLN A 72 29.790 -8.458 15.044 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.727 -8.238 15.808 1.00 0.00 O ATOM 1033 NE2 GLN A 72 29.930 -9.298 14.033 1.00 0.00 N ATOM 0 H GLN A 72 27.666 -3.897 16.433 1.00 0.00 H new ATOM 0 HA GLN A 72 26.740 -5.783 14.332 1.00 0.00 H new ATOM 0 HB2 GLN A 72 29.170 -5.859 14.583 1.00 0.00 H new ATOM 0 HB3 GLN A 72 29.019 -6.017 16.322 1.00 0.00 H new ATOM 0 HG2 GLN A 72 27.940 -8.197 16.109 1.00 0.00 H new ATOM 0 HG3 GLN A 72 27.795 -8.018 14.372 1.00 0.00 H new ATOM 0 HE21 GLN A 72 29.147 -9.474 13.404 1.00 0.00 H new ATOM 0 HE22 GLN A 72 30.822 -9.770 13.882 1.00 0.00 H new ATOM 1042 N TYR A 73 25.294 -7.005 15.950 1.00 0.00 N ATOM 1043 CA TYR A 73 24.429 -7.790 16.819 1.00 0.00 C ATOM 1044 C TYR A 73 24.776 -9.251 16.563 1.00 0.00 C ATOM 1045 O TYR A 73 24.909 -9.651 15.405 1.00 0.00 O ATOM 1046 CB TYR A 73 22.952 -7.560 16.468 1.00 0.00 C ATOM 1047 CG TYR A 73 22.370 -6.162 16.607 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.994 -5.158 17.375 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.152 -5.878 15.962 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.430 -3.874 17.450 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.575 -4.601 16.041 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.219 -3.587 16.780 1.00 0.00 C ATOM 1053 OH TYR A 73 20.662 -2.350 16.840 1.00 0.00 O ATOM 0 H TYR A 73 25.138 -7.195 14.960 1.00 0.00 H new ATOM 0 HA TYR A 73 24.576 -7.507 17.861 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.806 -7.876 15.435 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.358 -8.227 17.092 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.908 -5.377 17.907 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.654 -6.653 15.398 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.924 -3.102 18.022 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.642 -4.396 15.538 1.00 0.00 H new ATOM 0 HH TYR A 73 21.368 -1.678 16.944 1.00 0.00 H new ATOM 1063 N ASN A 74 24.937 -10.044 17.619 1.00 0.00 N ATOM 1064 CA ASN A 74 25.350 -11.437 17.514 1.00 0.00 C ATOM 1065 C ASN A 74 24.598 -12.276 18.556 1.00 0.00 C ATOM 1066 O ASN A 74 24.948 -12.265 19.736 1.00 0.00 O ATOM 1067 CB ASN A 74 26.873 -11.496 17.728 1.00 0.00 C ATOM 1068 CG ASN A 74 27.371 -12.882 18.126 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.009 -13.892 17.529 1.00 0.00 O ATOM 1070 ND2 ASN A 74 28.216 -12.953 19.143 1.00 0.00 N ATOM 0 H ASN A 74 24.783 -9.734 18.578 1.00 0.00 H new ATOM 0 HA ASN A 74 25.112 -11.846 16.532 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.374 -11.186 16.811 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.153 -10.781 18.501 1.00 0.00 H new ATOM 0 HD21 ASN A 74 28.578 -13.858 19.443 1.00 0.00 H new ATOM 0 HD22 ASN A 74 28.505 -12.103 19.626 1.00 0.00 H new ATOM 1077 N GLY A 75 23.564 -13.006 18.142 1.00 0.00 N ATOM 1078 CA GLY A 75 22.787 -13.864 19.029 1.00 0.00 C ATOM 1079 C GLY A 75 21.945 -13.075 20.033 1.00 0.00 C ATOM 1080 O GLY A 75 21.945 -13.423 21.220 1.00 0.00 O ATOM 0 H GLY A 75 23.241 -13.018 17.175 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.132 -14.497 18.431 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.463 -14.526 19.570 1.00 0.00 H new ATOM 1084 N ILE A 76 21.264 -12.003 19.606 1.00 0.00 N ATOM 1085 CA ILE A 76 20.543 -11.110 20.517 1.00 0.00 C ATOM 1086 C ILE A 76 19.081 -10.926 20.096 1.00 0.00 C ATOM 1087 O ILE A 76 18.708 -11.163 18.949 1.00 0.00 O ATOM 1088 CB ILE A 76 21.276 -9.746 20.681 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.852 -8.678 19.645 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.812 -9.903 20.694 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.537 -7.319 19.835 1.00 0.00 C ATOM 0 H ILE A 76 21.199 -11.733 18.624 1.00 0.00 H new ATOM 0 HA ILE A 76 20.532 -11.589 21.496 1.00 0.00 H new ATOM 0 HB ILE A 76 20.958 -9.380 21.657 1.00 0.00 H new ATOM 0 HG12 ILE A 76 21.074 -9.049 18.644 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.772 -8.540 19.701 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.277 -8.924 20.810 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.105 -10.545 21.525 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.140 -10.351 19.756 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.187 -6.625 19.070 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.295 -6.924 20.822 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.617 -7.440 19.748 1.00 0.00 H new ATOM 1103 N TYR A 77 18.274 -10.422 21.022 1.00 0.00 N ATOM 1104 CA TYR A 77 16.919 -9.945 20.827 1.00 0.00 C ATOM 1105 C TYR A 77 16.998 -8.484 21.255 1.00 0.00 C ATOM 1106 O TYR A 77 17.443 -8.204 22.371 1.00 0.00 O ATOM 1107 CB TYR A 77 15.951 -10.758 21.702 1.00 0.00 C ATOM 1108 CG TYR A 77 14.501 -10.298 21.665 1.00 0.00 C ATOM 1109 CD1 TYR A 77 14.088 -9.177 22.416 1.00 0.00 C ATOM 1110 CD2 TYR A 77 13.551 -11.018 20.915 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.742 -8.769 22.406 1.00 0.00 C ATOM 1112 CE2 TYR A 77 12.200 -10.623 20.911 1.00 0.00 C ATOM 1113 CZ TYR A 77 11.788 -9.490 21.652 1.00 0.00 C ATOM 1114 OH TYR A 77 10.481 -9.097 21.653 1.00 0.00 O ATOM 0 H TYR A 77 18.574 -10.332 21.993 1.00 0.00 H new ATOM 0 HA TYR A 77 16.549 -10.049 19.807 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.992 -11.801 21.389 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.301 -10.721 22.734 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.810 -8.629 23.002 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.861 -11.878 20.340 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.437 -7.903 22.975 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.476 -11.186 20.341 1.00 0.00 H new ATOM 0 HH TYR A 77 9.958 -9.699 21.083 1.00 0.00 H new ATOM 1124 N ILE A 78 16.618 -7.546 20.393 1.00 0.00 N ATOM 1125 CA ILE A 78 16.703 -6.126 20.703 1.00 0.00 C ATOM 1126 C ILE A 78 15.423 -5.443 20.230 1.00 0.00 C ATOM 1127 O ILE A 78 14.955 -5.687 19.112 1.00 0.00 O ATOM 1128 CB ILE A 78 18.021 -5.524 20.167 1.00 0.00 C ATOM 1129 CG1 ILE A 78 18.116 -4.039 20.570 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.206 -5.727 18.654 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.523 -3.448 20.422 1.00 0.00 C ATOM 0 H ILE A 78 16.245 -7.749 19.466 1.00 0.00 H new ATOM 0 HA ILE A 78 16.757 -5.955 21.778 1.00 0.00 H new ATOM 0 HB ILE A 78 18.846 -6.067 20.629 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.423 -3.461 19.959 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.794 -3.932 21.606 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.150 -5.282 18.340 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.215 -6.793 18.428 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.384 -5.250 18.120 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.511 -2.401 20.724 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.218 -4.000 21.055 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.841 -3.522 19.382 1.00 0.00 H new ATOM 1143 N ARG A 79 14.833 -4.625 21.105 1.00 0.00 N ATOM 1144 CA ARG A 79 13.507 -4.073 20.895 1.00 0.00 C ATOM 1145 C ARG A 79 13.494 -2.603 21.278 1.00 0.00 C ATOM 1146 O ARG A 79 13.979 -2.237 22.352 1.00 0.00 O ATOM 1147 CB ARG A 79 12.525 -4.924 21.711 1.00 0.00 C ATOM 1148 CG ARG A 79 11.064 -4.488 21.562 1.00 0.00 C ATOM 1149 CD ARG A 79 10.163 -5.622 22.061 1.00 0.00 C ATOM 1150 NE ARG A 79 8.735 -5.278 21.982 1.00 0.00 N ATOM 1151 CZ ARG A 79 7.730 -6.161 22.073 1.00 0.00 C ATOM 1152 NH1 ARG A 79 7.982 -7.464 22.195 1.00 0.00 N ATOM 1153 NH2 ARG A 79 6.471 -5.735 22.039 1.00 0.00 N ATOM 0 H ARG A 79 15.269 -4.331 21.979 1.00 0.00 H new ATOM 0 HA ARG A 79 13.208 -4.110 19.847 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.618 -5.966 21.403 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.804 -4.876 22.764 1.00 0.00 H new ATOM 0 HG2 ARG A 79 10.880 -3.579 22.134 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.842 -4.259 20.520 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.351 -6.519 21.471 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.420 -5.860 23.093 1.00 0.00 H new ATOM 0 HE ARG A 79 8.492 -4.297 21.848 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.946 -7.797 22.220 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.211 -8.128 22.264 1.00 0.00 H new ATOM 0 HH21 ARG A 79 6.272 -4.739 21.944 1.00 0.00 H new ATOM 0 HH22 ARG A 79 5.704 -6.404 22.108 1.00 0.00 H new ATOM 1167 N SER A 80 12.911 -1.771 20.418 1.00 0.00 N ATOM 1168 CA SER A 80 12.672 -0.354 20.660 1.00 0.00 C ATOM 1169 C SER A 80 13.935 0.410 21.101 1.00 0.00 C ATOM 1170 O SER A 80 13.834 1.351 21.892 1.00 0.00 O ATOM 1171 CB SER A 80 11.503 -0.230 21.647 1.00 0.00 C ATOM 1172 OG SER A 80 10.378 -0.966 21.186 1.00 0.00 O ATOM 0 H SER A 80 12.581 -2.077 19.503 1.00 0.00 H new ATOM 0 HA SER A 80 12.399 0.132 19.723 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.807 -0.597 22.627 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.233 0.819 21.769 1.00 0.00 H new ATOM 0 HG SER A 80 9.643 -0.877 21.828 1.00 0.00 H new ATOM 1178 N SER A 81 15.121 0.014 20.623 1.00 0.00 N ATOM 1179 CA SER A 81 16.405 0.503 21.123 1.00 0.00 C ATOM 1180 C SER A 81 17.235 1.175 20.020 1.00 0.00 C ATOM 1181 O SER A 81 16.847 1.180 18.851 1.00 0.00 O ATOM 1182 CB SER A 81 17.150 -0.677 21.761 1.00 0.00 C ATOM 1183 OG SER A 81 16.441 -1.178 22.882 1.00 0.00 O ATOM 0 H SER A 81 15.213 -0.665 19.867 1.00 0.00 H new ATOM 0 HA SER A 81 16.233 1.276 21.872 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.281 -1.470 21.025 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.146 -0.360 22.068 1.00 0.00 H new ATOM 0 HG SER A 81 15.589 -1.561 22.586 1.00 0.00 H new ATOM 1189 N THR A 82 18.387 1.746 20.379 1.00 0.00 N ATOM 1190 CA THR A 82 19.309 2.390 19.448 1.00 0.00 C ATOM 1191 C THR A 82 20.742 1.992 19.816 1.00 0.00 C ATOM 1192 O THR A 82 21.089 1.976 20.999 1.00 0.00 O ATOM 1193 CB THR A 82 19.100 3.917 19.495 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.762 4.255 19.175 1.00 0.00 O ATOM 1195 CG2 THR A 82 20.009 4.671 18.516 1.00 0.00 C ATOM 0 H THR A 82 18.709 1.773 21.346 1.00 0.00 H new ATOM 0 HA THR A 82 19.120 2.064 18.425 1.00 0.00 H new ATOM 0 HB THR A 82 19.347 4.214 20.514 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.652 5.228 19.213 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.818 5.741 18.593 1.00 0.00 H new ATOM 0 HG22 THR A 82 21.052 4.470 18.760 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.804 4.338 17.499 1.00 0.00 H new ATOM 1203 N THR A 83 21.584 1.704 18.825 1.00 0.00 N ATOM 1204 CA THR A 83 22.975 1.312 19.030 1.00 0.00 C ATOM 1205 C THR A 83 23.846 2.036 17.998 1.00 0.00 C ATOM 1206 O THR A 83 23.510 2.048 16.808 1.00 0.00 O ATOM 1207 CB THR A 83 23.099 -0.218 18.929 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.522 -0.666 17.721 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.396 -0.942 20.082 1.00 0.00 C ATOM 0 H THR A 83 21.313 1.737 17.842 1.00 0.00 H new ATOM 0 HA THR A 83 23.318 1.598 20.024 1.00 0.00 H new ATOM 0 HB THR A 83 24.164 -0.448 18.971 1.00 0.00 H new ATOM 0 HG1 THR A 83 23.151 -1.257 17.257 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.515 -2.019 19.962 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.837 -0.632 21.029 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.335 -0.691 20.076 1.00 0.00 H new ATOM 1217 N THR A 84 24.945 2.643 18.448 1.00 0.00 N ATOM 1218 CA THR A 84 25.806 3.485 17.635 1.00 0.00 C ATOM 1219 C THR A 84 27.266 3.152 17.959 1.00 0.00 C ATOM 1220 O THR A 84 27.725 3.383 19.082 1.00 0.00 O ATOM 1221 CB THR A 84 25.475 4.967 17.906 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.086 5.219 17.776 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.211 5.904 16.940 1.00 0.00 C ATOM 0 H THR A 84 25.264 2.557 19.413 1.00 0.00 H new ATOM 0 HA THR A 84 25.642 3.301 16.573 1.00 0.00 H new ATOM 0 HB THR A 84 25.800 5.163 18.928 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.907 6.166 17.955 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.950 6.938 17.166 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.287 5.769 17.051 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.920 5.672 15.915 1.00 0.00 H new ATOM 1231 N GLY A 85 28.008 2.646 16.970 1.00 0.00 N ATOM 1232 CA GLY A 85 29.416 2.305 17.128 1.00 0.00 C ATOM 1233 C GLY A 85 29.606 1.267 18.230 1.00 0.00 C ATOM 1234 O GLY A 85 30.385 1.497 19.157 1.00 0.00 O ATOM 0 H GLY A 85 27.643 2.462 16.035 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.808 1.918 16.187 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.987 3.202 17.366 1.00 0.00 H new ATOM 1238 N THR A 86 28.898 0.143 18.155 1.00 0.00 N ATOM 1239 CA THR A 86 28.810 -0.828 19.242 1.00 0.00 C ATOM 1240 C THR A 86 28.861 -2.268 18.726 1.00 0.00 C ATOM 1241 O THR A 86 28.523 -2.539 17.577 1.00 0.00 O ATOM 1242 CB THR A 86 27.504 -0.566 20.030 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.496 0.123 19.307 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.773 0.290 21.255 1.00 0.00 C ATOM 0 H THR A 86 28.363 -0.122 17.328 1.00 0.00 H new ATOM 0 HA THR A 86 29.671 -0.706 19.899 1.00 0.00 H new ATOM 0 HB THR A 86 27.150 -1.568 20.271 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.544 -0.126 18.360 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.840 0.460 21.792 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.480 -0.222 21.908 1.00 0.00 H new ATOM 0 HG23 THR A 86 28.193 1.247 20.945 1.00 0.00 H new ATOM 1252 N SER A 87 29.207 -3.214 19.593 1.00 0.00 N ATOM 1253 CA SER A 87 29.131 -4.640 19.311 1.00 0.00 C ATOM 1254 C SER A 87 28.406 -5.264 20.492 1.00 0.00 C ATOM 1255 O SER A 87 28.780 -4.994 21.634 1.00 0.00 O ATOM 1256 CB SER A 87 30.542 -5.219 19.140 1.00 0.00 C ATOM 1257 OG SER A 87 31.246 -4.553 18.102 1.00 0.00 O ATOM 0 H SER A 87 29.555 -3.005 20.529 1.00 0.00 H new ATOM 0 HA SER A 87 28.597 -4.847 18.383 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.093 -5.125 20.076 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.477 -6.283 18.914 1.00 0.00 H new ATOM 0 HG SER A 87 32.142 -4.939 18.015 1.00 0.00 H new ATOM 1263 N ILE A 88 27.366 -6.052 20.228 1.00 0.00 N ATOM 1264 CA ILE A 88 26.474 -6.613 21.232 1.00 0.00 C ATOM 1265 C ILE A 88 26.362 -8.109 20.926 1.00 0.00 C ATOM 1266 O ILE A 88 26.076 -8.491 19.785 1.00 0.00 O ATOM 1267 CB ILE A 88 25.076 -5.944 21.165 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.023 -4.409 20.958 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.261 -6.345 22.402 1.00 0.00 C ATOM 1270 CD1 ILE A 88 25.576 -3.538 22.093 1.00 0.00 C ATOM 0 H ILE A 88 27.116 -6.325 19.278 1.00 0.00 H new ATOM 0 HA ILE A 88 26.863 -6.440 22.236 1.00 0.00 H new ATOM 0 HB ILE A 88 24.643 -6.328 20.242 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.573 -4.170 20.048 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.985 -4.125 20.787 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.278 -5.876 22.358 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.146 -7.429 22.426 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.780 -6.015 23.302 1.00 0.00 H new ATOM 0 HD11 ILE A 88 25.481 -2.486 21.824 1.00 0.00 H new ATOM 0 HD12 ILE A 88 25.014 -3.731 23.007 1.00 0.00 H new ATOM 0 HD13 ILE A 88 26.627 -3.777 22.256 1.00 0.00 H new ATOM 1282 N SER A 89 26.542 -8.942 21.947 1.00 0.00 N ATOM 1283 CA SER A 89 26.598 -10.386 21.827 1.00 0.00 C ATOM 1284 C SER A 89 25.797 -11.056 22.943 1.00 0.00 C ATOM 1285 O SER A 89 25.642 -10.509 24.038 1.00 0.00 O ATOM 1286 CB SER A 89 28.062 -10.841 21.880 1.00 0.00 C ATOM 1287 OG SER A 89 28.754 -10.456 20.701 1.00 0.00 O ATOM 0 H SER A 89 26.656 -8.616 22.907 1.00 0.00 H new ATOM 0 HA SER A 89 26.158 -10.679 20.874 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.551 -10.407 22.752 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.107 -11.924 21.996 1.00 0.00 H new ATOM 0 HG SER A 89 29.686 -10.755 20.756 1.00 0.00 H new ATOM 1321 N CYS A 93 21.036 -12.938 24.396 1.00 0.00 N ATOM 1322 CA CYS A 93 21.002 -11.567 24.876 1.00 0.00 C ATOM 1323 C CYS A 93 19.631 -10.966 24.579 1.00 0.00 C ATOM 1324 O CYS A 93 19.019 -11.293 23.563 1.00 0.00 O ATOM 1325 CB CYS A 93 22.151 -10.787 24.221 1.00 0.00 C ATOM 1326 SG CYS A 93 22.066 -8.976 24.221 1.00 0.00 S ATOM 0 HA CYS A 93 21.146 -11.520 25.955 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.076 -11.077 24.719 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.229 -11.117 23.185 1.00 0.00 H new ATOM 1331 N SER A 94 19.189 -10.056 25.442 1.00 0.00 N ATOM 1332 CA SER A 94 17.890 -9.416 25.388 1.00 0.00 C ATOM 1333 C SER A 94 18.083 -7.967 25.832 1.00 0.00 C ATOM 1334 O SER A 94 18.664 -7.728 26.897 1.00 0.00 O ATOM 1335 CB SER A 94 16.935 -10.165 26.321 1.00 0.00 C ATOM 1336 OG SER A 94 16.663 -11.470 25.834 1.00 0.00 O ATOM 0 H SER A 94 19.754 -9.735 26.228 1.00 0.00 H new ATOM 0 HA SER A 94 17.463 -9.435 24.385 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.371 -10.229 27.318 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.003 -9.608 26.416 1.00 0.00 H new ATOM 0 HG SER A 94 16.052 -11.928 26.449 1.00 0.00 H new ATOM 1342 N ILE A 95 17.623 -7.016 25.017 1.00 0.00 N ATOM 1343 CA ILE A 95 17.745 -5.579 25.241 1.00 0.00 C ATOM 1344 C ILE A 95 16.403 -4.949 24.872 1.00 0.00 C ATOM 1345 O ILE A 95 15.834 -5.270 23.821 1.00 0.00 O ATOM 1346 CB ILE A 95 18.906 -4.989 24.398 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.244 -5.626 24.836 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.942 -3.446 24.470 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.502 -5.009 24.222 1.00 0.00 C ATOM 0 H ILE A 95 17.136 -7.238 24.149 1.00 0.00 H new ATOM 0 HA ILE A 95 17.982 -5.366 26.283 1.00 0.00 H new ATOM 0 HB ILE A 95 18.737 -5.236 23.350 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.320 -5.558 25.921 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.221 -6.686 24.584 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.769 -3.073 23.866 1.00 0.00 H new ATOM 0 HG22 ILE A 95 18.004 -3.042 24.089 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.078 -3.133 25.505 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.383 -5.530 24.596 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.460 -5.101 23.137 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.561 -3.955 24.495 1.00 0.00 H new ATOM 1361 N SER A 96 15.935 -4.014 25.697 1.00 0.00 N ATOM 1362 CA SER A 96 14.692 -3.299 25.463 1.00 0.00 C ATOM 1363 C SER A 96 14.874 -1.825 25.816 1.00 0.00 C ATOM 1364 O SER A 96 15.528 -1.502 26.815 1.00 0.00 O ATOM 1365 CB SER A 96 13.560 -3.916 26.295 1.00 0.00 C ATOM 1366 OG SER A 96 13.399 -5.300 26.021 1.00 0.00 O ATOM 0 H SER A 96 16.415 -3.733 26.552 1.00 0.00 H new ATOM 0 HA SER A 96 14.425 -3.379 24.409 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.771 -3.777 27.355 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.627 -3.393 26.085 1.00 0.00 H new ATOM 0 HG SER A 96 12.671 -5.660 26.570 1.00 0.00 H new ATOM 1372 N THR A 97 14.254 -0.963 25.005 1.00 0.00 N ATOM 1373 CA THR A 97 14.091 0.476 25.222 1.00 0.00 C ATOM 1374 C THR A 97 15.378 1.195 25.679 1.00 0.00 C ATOM 1375 O THR A 97 15.329 2.122 26.491 1.00 0.00 O ATOM 1376 CB THR A 97 12.832 0.736 26.083 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.736 -0.140 27.191 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.553 0.521 25.270 1.00 0.00 C ATOM 0 H THR A 97 13.828 -1.269 24.130 1.00 0.00 H new ATOM 0 HA THR A 97 13.911 0.953 24.259 1.00 0.00 H new ATOM 0 HB THR A 97 12.932 1.767 26.422 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.550 -0.073 27.733 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.685 0.711 25.901 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.542 1.205 24.422 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.521 -0.507 24.908 1.00 0.00 H new ATOM 1386 N CYS A 98 16.539 0.784 25.155 1.00 0.00 N ATOM 1387 CA CYS A 98 17.846 1.285 25.564 1.00 0.00 C ATOM 1388 C CYS A 98 18.485 2.093 24.431 1.00 0.00 C ATOM 1389 O CYS A 98 18.140 1.920 23.263 1.00 0.00 O ATOM 1390 CB CYS A 98 18.736 0.093 25.945 1.00 0.00 C ATOM 1391 SG CYS A 98 20.228 0.564 26.857 1.00 0.00 S ATOM 0 H CYS A 98 16.591 0.079 24.420 1.00 0.00 H new ATOM 0 HA CYS A 98 17.734 1.945 26.424 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.156 -0.604 26.549 1.00 0.00 H new ATOM 0 HB3 CYS A 98 19.027 -0.437 25.038 1.00 0.00 H new ATOM 1396 N THR A 99 19.470 2.928 24.754 1.00 0.00 N ATOM 1397 CA THR A 99 20.316 3.597 23.779 1.00 0.00 C ATOM 1398 C THR A 99 21.751 3.307 24.209 1.00 0.00 C ATOM 1399 O THR A 99 22.057 3.360 25.401 1.00 0.00 O ATOM 1400 CB THR A 99 19.975 5.097 23.734 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.628 5.276 23.331 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.866 5.880 22.762 1.00 0.00 C ATOM 0 H THR A 99 19.704 3.160 25.719 1.00 0.00 H new ATOM 0 HA THR A 99 20.165 3.239 22.761 1.00 0.00 H new ATOM 0 HB THR A 99 20.142 5.480 24.741 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.418 6.233 23.306 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.580 6.932 22.772 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.908 5.785 23.067 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.744 5.481 21.755 1.00 0.00 H new ATOM 1410 N ILE A 100 22.628 2.961 23.266 1.00 0.00 N ATOM 1411 CA ILE A 100 24.002 2.571 23.554 1.00 0.00 C ATOM 1412 C ILE A 100 24.879 3.253 22.506 1.00 0.00 C ATOM 1413 O ILE A 100 24.604 3.148 21.310 1.00 0.00 O ATOM 1414 CB ILE A 100 24.171 1.025 23.549 1.00 0.00 C ATOM 1415 CG1 ILE A 100 23.002 0.278 24.244 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.507 0.648 24.222 1.00 0.00 C ATOM 1417 CD1 ILE A 100 23.142 -1.247 24.291 1.00 0.00 C ATOM 0 H ILE A 100 22.399 2.945 22.272 1.00 0.00 H new ATOM 0 HA ILE A 100 24.296 2.887 24.555 1.00 0.00 H new ATOM 0 HB ILE A 100 24.166 0.710 22.506 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.909 0.650 25.264 1.00 0.00 H new ATOM 0 HG13 ILE A 100 22.075 0.527 23.728 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.624 -0.436 24.218 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.332 1.104 23.674 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.511 1.009 25.250 1.00 0.00 H new ATOM 0 HD11 ILE A 100 22.277 -1.676 24.796 1.00 0.00 H new ATOM 0 HD12 ILE A 100 23.201 -1.638 23.275 1.00 0.00 H new ATOM 0 HD13 ILE A 100 24.048 -1.513 24.835 1.00 0.00 H new ATOM 1429 N THR A 101 25.935 3.937 22.944 1.00 0.00 N ATOM 1430 CA THR A 101 26.884 4.608 22.064 1.00 0.00 C ATOM 1431 C THR A 101 28.283 4.252 22.554 1.00 0.00 C ATOM 1432 O THR A 101 28.574 4.435 23.737 1.00 0.00 O ATOM 1433 CB THR A 101 26.628 6.128 22.068 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.280 6.409 21.736 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.519 6.867 21.062 1.00 0.00 C ATOM 0 H THR A 101 26.156 4.041 23.934 1.00 0.00 H new ATOM 0 HA THR A 101 26.772 4.282 21.030 1.00 0.00 H new ATOM 0 HB THR A 101 26.859 6.473 23.076 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.136 7.378 21.745 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.303 7.935 21.101 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.567 6.699 21.312 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.321 6.493 20.057 1.00 0.00 H new ATOM 1443 N ARG A 102 29.137 3.713 21.672 1.00 0.00 N ATOM 1444 CA ARG A 102 30.486 3.224 22.003 1.00 0.00 C ATOM 1445 C ARG A 102 30.513 2.449 23.333 1.00 0.00 C ATOM 1446 O ARG A 102 31.328 2.719 24.212 1.00 0.00 O ATOM 1447 CB ARG A 102 31.509 4.377 21.943 1.00 0.00 C ATOM 1448 CG ARG A 102 31.623 4.969 20.526 1.00 0.00 C ATOM 1449 CD ARG A 102 32.911 5.785 20.308 1.00 0.00 C ATOM 1450 NE ARG A 102 34.143 5.002 20.545 1.00 0.00 N ATOM 1451 CZ ARG A 102 34.557 3.929 19.855 1.00 0.00 C ATOM 1452 NH1 ARG A 102 33.945 3.530 18.749 1.00 0.00 N ATOM 1453 NH2 ARG A 102 35.586 3.204 20.269 1.00 0.00 N ATOM 0 H ARG A 102 28.905 3.602 20.685 1.00 0.00 H new ATOM 0 HA ARG A 102 30.783 2.498 21.246 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.215 5.160 22.641 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.485 4.014 22.264 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.587 4.159 19.797 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.760 5.607 20.336 1.00 0.00 H new ATOM 0 HD2 ARG A 102 32.922 6.168 19.288 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.903 6.649 20.973 1.00 0.00 H new ATOM 0 HE ARG A 102 34.740 5.310 21.313 1.00 0.00 H new ATOM 0 HH11 ARG A 102 33.135 4.043 18.401 1.00 0.00 H new ATOM 0 HH12 ARG A 102 34.284 2.710 18.246 1.00 0.00 H new ATOM 0 HH21 ARG A 102 36.078 3.459 21.126 1.00 0.00 H new ATOM 0 HH22 ARG A 102 35.887 2.391 19.731 1.00 0.00 H new ATOM 1467 N GLY A 103 29.580 1.506 23.502 1.00 0.00 N ATOM 1468 CA GLY A 103 29.500 0.626 24.667 1.00 0.00 C ATOM 1469 C GLY A 103 28.829 1.261 25.891 1.00 0.00 C ATOM 1470 O GLY A 103 28.424 0.529 26.794 1.00 0.00 O ATOM 0 H GLY A 103 28.845 1.332 22.817 1.00 0.00 H new ATOM 0 HA2 GLY A 103 28.950 -0.274 24.391 1.00 0.00 H new ATOM 0 HA3 GLY A 103 30.507 0.312 24.941 1.00 0.00 H new ATOM 1474 N VAL A 104 28.677 2.586 25.942 1.00 0.00 N ATOM 1475 CA VAL A 104 28.036 3.284 27.050 1.00 0.00 C ATOM 1476 C VAL A 104 26.524 3.205 26.826 1.00 0.00 C ATOM 1477 O VAL A 104 25.992 3.884 25.945 1.00 0.00 O ATOM 1478 CB VAL A 104 28.555 4.739 27.147 1.00 0.00 C ATOM 1479 CG1 VAL A 104 27.986 5.447 28.386 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.091 4.792 27.228 1.00 0.00 C ATOM 0 H VAL A 104 29.001 3.210 25.203 1.00 0.00 H new ATOM 0 HA VAL A 104 28.277 2.820 28.006 1.00 0.00 H new ATOM 0 HB VAL A 104 28.222 5.245 26.241 1.00 0.00 H new ATOM 0 HG11 VAL A 104 28.367 6.467 28.429 1.00 0.00 H new ATOM 0 HG12 VAL A 104 26.898 5.468 28.325 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.289 4.908 29.284 1.00 0.00 H new ATOM 0 HG21 VAL A 104 30.416 5.830 27.295 1.00 0.00 H new ATOM 0 HG22 VAL A 104 30.428 4.249 28.111 1.00 0.00 H new ATOM 0 HG23 VAL A 104 30.518 4.335 26.336 1.00 0.00 H new ATOM 1490 N ALA A 105 25.838 2.341 27.581 1.00 0.00 N ATOM 1491 CA ALA A 105 24.380 2.315 27.629 1.00 0.00 C ATOM 1492 C ALA A 105 23.886 3.530 28.421 1.00 0.00 C ATOM 1493 O ALA A 105 24.564 3.982 29.349 1.00 0.00 O ATOM 1494 CB ALA A 105 23.907 1.015 28.287 1.00 0.00 C ATOM 0 H ALA A 105 26.282 1.641 28.175 1.00 0.00 H new ATOM 0 HA ALA A 105 23.973 2.357 26.619 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.818 1.000 28.321 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.264 0.163 27.708 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.302 0.956 29.301 1.00 0.00 H new ATOM 1548 N ALA A 110 14.533 3.162 31.560 1.00 0.00 N ATOM 1549 CA ALA A 110 13.966 2.631 30.329 1.00 0.00 C ATOM 1550 C ALA A 110 14.895 1.600 29.679 1.00 0.00 C ATOM 1551 O ALA A 110 14.401 0.661 29.060 1.00 0.00 O ATOM 1552 CB ALA A 110 13.686 3.779 29.351 1.00 0.00 C ATOM 0 HA ALA A 110 13.033 2.125 30.577 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.262 3.378 28.431 1.00 0.00 H new ATOM 0 HB2 ALA A 110 12.980 4.477 29.802 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.617 4.299 29.125 1.00 0.00 H new ATOM 1558 N CYS A 111 16.217 1.727 29.829 1.00 0.00 N ATOM 1559 CA CYS A 111 17.144 0.742 29.298 1.00 0.00 C ATOM 1560 C CYS A 111 17.038 -0.535 30.134 1.00 0.00 C ATOM 1561 O CYS A 111 17.261 -0.493 31.348 1.00 0.00 O ATOM 1562 CB CYS A 111 18.581 1.284 29.348 1.00 0.00 C ATOM 1563 SG CYS A 111 19.831 0.089 28.795 1.00 0.00 S ATOM 0 H CYS A 111 16.662 2.505 30.315 1.00 0.00 H new ATOM 0 HA CYS A 111 16.893 0.527 28.259 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.645 2.177 28.726 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.810 1.589 30.369 1.00 0.00 H new ATOM 1568 N LYS A 112 16.753 -1.674 29.493 1.00 0.00 N ATOM 1569 CA LYS A 112 16.845 -2.995 30.117 1.00 0.00 C ATOM 1570 C LYS A 112 17.852 -3.816 29.320 1.00 0.00 C ATOM 1571 O LYS A 112 17.841 -3.765 28.089 1.00 0.00 O ATOM 1572 CB LYS A 112 15.489 -3.721 30.173 1.00 0.00 C ATOM 1573 CG LYS A 112 14.370 -2.913 30.852 1.00 0.00 C ATOM 1574 CD LYS A 112 13.353 -2.396 29.826 1.00 0.00 C ATOM 1575 CE LYS A 112 12.445 -1.343 30.466 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.336 -0.942 29.564 1.00 0.00 N ATOM 0 H LYS A 112 16.450 -1.703 28.519 1.00 0.00 H new ATOM 0 HA LYS A 112 17.166 -2.873 31.151 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.179 -3.968 29.157 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.616 -4.664 30.705 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.862 -3.538 31.587 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.803 -2.072 31.393 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.875 -1.966 28.971 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.753 -3.224 29.449 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.032 -1.737 31.395 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.036 -0.465 30.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 10.806 -0.157 29.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.726 -0.638 28.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.698 -1.750 29.417 1.00 0.00 H new ATOM 1590 N ILE A 113 18.675 -4.585 30.028 1.00 0.00 N ATOM 1591 CA ILE A 113 19.665 -5.523 29.507 1.00 0.00 C ATOM 1592 C ILE A 113 19.460 -6.771 30.373 1.00 0.00 C ATOM 1593 O ILE A 113 19.398 -6.636 31.602 1.00 0.00 O ATOM 1594 CB ILE A 113 21.104 -4.958 29.673 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.335 -3.519 29.150 1.00 0.00 C ATOM 1596 CG2 ILE A 113 22.129 -5.916 29.044 1.00 0.00 C ATOM 1597 CD1 ILE A 113 21.259 -3.344 27.631 1.00 0.00 C ATOM 0 H ILE A 113 18.667 -4.568 31.048 1.00 0.00 H new ATOM 0 HA ILE A 113 19.547 -5.722 28.442 1.00 0.00 H new ATOM 0 HB ILE A 113 21.243 -4.886 30.752 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.597 -2.862 29.610 1.00 0.00 H new ATOM 0 HG13 ILE A 113 22.315 -3.183 29.487 1.00 0.00 H new ATOM 0 HG21 ILE A 113 23.132 -5.508 29.168 1.00 0.00 H new ATOM 0 HG22 ILE A 113 22.069 -6.887 29.536 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.913 -6.033 27.982 1.00 0.00 H new ATOM 0 HD11 ILE A 113 21.436 -2.299 27.376 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.016 -3.967 27.155 1.00 0.00 H new ATOM 0 HD13 ILE A 113 20.271 -3.641 27.279 1.00 0.00 H new ATOM 1609 N SER A 114 19.354 -7.963 29.775 1.00 0.00 N ATOM 1610 CA SER A 114 18.933 -9.162 30.512 1.00 0.00 C ATOM 1611 C SER A 114 19.723 -10.437 30.163 1.00 0.00 C ATOM 1612 O SER A 114 19.227 -11.544 30.388 1.00 0.00 O ATOM 1613 CB SER A 114 17.413 -9.349 30.338 1.00 0.00 C ATOM 1614 OG SER A 114 16.685 -8.153 30.586 1.00 0.00 O ATOM 0 H SER A 114 19.553 -8.124 28.788 1.00 0.00 H new ATOM 0 HA SER A 114 19.166 -8.996 31.564 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.206 -9.693 29.325 1.00 0.00 H new ATOM 0 HB3 SER A 114 17.066 -10.129 31.016 1.00 0.00 H new ATOM 0 HG SER A 114 15.728 -8.321 30.462 1.00 0.00 H new ATOM 1620 N GLY A 115 20.945 -10.311 29.632 1.00 0.00 N ATOM 1621 CA GLY A 115 21.840 -11.456 29.429 1.00 0.00 C ATOM 1622 C GLY A 115 22.849 -11.218 28.313 1.00 0.00 C ATOM 1623 O GLY A 115 22.976 -12.062 27.427 1.00 0.00 O ATOM 0 H GLY A 115 21.339 -9.419 29.333 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.372 -11.666 30.357 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.246 -12.340 29.195 1.00 0.00 H new ATOM 1627 N CYS A 116 23.524 -10.065 28.312 1.00 0.00 N ATOM 1628 CA CYS A 116 24.340 -9.619 27.188 1.00 0.00 C ATOM 1629 C CYS A 116 25.788 -9.356 27.583 1.00 0.00 C ATOM 1630 O CYS A 116 26.109 -9.140 28.755 1.00 0.00 O ATOM 1631 CB CYS A 116 23.737 -8.320 26.639 1.00 0.00 C ATOM 1632 SG CYS A 116 21.994 -8.427 26.173 1.00 0.00 S ATOM 0 H CYS A 116 23.517 -9.414 29.097 1.00 0.00 H new ATOM 0 HA CYS A 116 24.342 -10.413 26.441 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.850 -7.538 27.390 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.313 -8.009 25.767 1.00 0.00 H new ATOM 1637 N SER A 117 26.629 -9.297 26.556 1.00 0.00 N ATOM 1638 CA SER A 117 28.010 -8.853 26.590 1.00 0.00 C ATOM 1639 C SER A 117 28.113 -7.805 25.482 1.00 0.00 C ATOM 1640 O SER A 117 27.469 -7.955 24.440 1.00 0.00 O ATOM 1641 CB SER A 117 28.947 -10.039 26.327 1.00 0.00 C ATOM 1642 OG SER A 117 28.743 -11.072 27.282 1.00 0.00 O ATOM 0 H SER A 117 26.341 -9.577 25.618 1.00 0.00 H new ATOM 0 HA SER A 117 28.298 -8.439 27.557 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.774 -10.428 25.323 1.00 0.00 H new ATOM 0 HB3 SER A 117 29.983 -9.703 26.365 1.00 0.00 H new ATOM 0 HG SER A 117 29.350 -11.817 27.092 1.00 0.00 H new ATOM 1648 N LEU A 118 28.867 -6.728 25.693 1.00 0.00 N ATOM 1649 CA LEU A 118 28.988 -5.661 24.706 1.00 0.00 C ATOM 1650 C LEU A 118 30.365 -5.013 24.758 1.00 0.00 C ATOM 1651 O LEU A 118 31.138 -5.240 25.692 1.00 0.00 O ATOM 1652 CB LEU A 118 27.827 -4.649 24.829 1.00 0.00 C ATOM 1653 CG LEU A 118 27.551 -4.018 26.212 1.00 0.00 C ATOM 1654 CD1 LEU A 118 28.651 -3.058 26.679 1.00 0.00 C ATOM 1655 CD2 LEU A 118 26.224 -3.251 26.145 1.00 0.00 C ATOM 0 H LEU A 118 29.406 -6.572 26.545 1.00 0.00 H new ATOM 0 HA LEU A 118 28.900 -6.100 23.712 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.016 -3.838 24.125 1.00 0.00 H new ATOM 0 HB3 LEU A 118 26.915 -5.148 24.503 1.00 0.00 H new ATOM 0 HG LEU A 118 27.515 -4.834 26.933 1.00 0.00 H new ATOM 0 HD11 LEU A 118 28.390 -2.653 27.657 1.00 0.00 H new ATOM 0 HD12 LEU A 118 29.597 -3.595 26.750 1.00 0.00 H new ATOM 0 HD13 LEU A 118 28.750 -2.242 25.963 1.00 0.00 H new ATOM 0 HD21 LEU A 118 26.015 -2.800 27.115 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.293 -2.470 25.388 1.00 0.00 H new ATOM 0 HD23 LEU A 118 25.419 -3.938 25.884 1.00 0.00 H new ATOM 1667 N SER A 119 30.686 -4.221 23.737 1.00 0.00 N ATOM 1668 CA SER A 119 31.912 -3.441 23.621 1.00 0.00 C ATOM 1669 C SER A 119 31.672 -2.277 22.653 1.00 0.00 C ATOM 1670 O SER A 119 30.690 -2.269 21.900 1.00 0.00 O ATOM 1671 CB SER A 119 33.046 -4.344 23.103 1.00 0.00 C ATOM 1672 OG SER A 119 33.357 -5.365 24.037 1.00 0.00 O ATOM 0 H SER A 119 30.070 -4.102 22.933 1.00 0.00 H new ATOM 0 HA SER A 119 32.198 -3.044 24.595 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.752 -4.793 22.154 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.934 -3.742 22.909 1.00 0.00 H new ATOM 0 HG SER A 119 32.716 -5.337 24.778 1.00 0.00 H new ATOM 1678 N ALA A 120 32.568 -1.289 22.673 1.00 0.00 N ATOM 1679 CA ALA A 120 32.596 -0.231 21.674 1.00 0.00 C ATOM 1680 C ALA A 120 33.146 -0.772 20.348 1.00 0.00 C ATOM 1681 O ALA A 120 33.913 -1.740 20.330 1.00 0.00 O ATOM 1682 CB ALA A 120 33.494 0.909 22.169 1.00 0.00 C ATOM 0 H ALA A 120 33.293 -1.204 23.385 1.00 0.00 H new ATOM 0 HA ALA A 120 31.582 0.137 21.515 1.00 0.00 H new ATOM 0 HB1 ALA A 120 33.518 1.704 21.423 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.100 1.302 23.106 1.00 0.00 H new ATOM 0 HB3 ALA A 120 34.504 0.533 22.330 1.00 0.00 H new ATOM 1688 N MET A 121 32.780 -0.109 19.251 1.00 0.00 N ATOM 1689 CA MET A 121 33.362 -0.321 17.932 1.00 0.00 C ATOM 1690 C MET A 121 34.857 -0.016 18.008 1.00 0.00 C ATOM 1691 O MET A 121 35.209 1.102 18.445 1.00 0.00 O ATOM 1692 CB MET A 121 32.625 0.575 16.927 1.00 0.00 C ATOM 1693 CG MET A 121 33.299 0.618 15.549 1.00 0.00 C ATOM 1694 SD MET A 121 32.401 1.560 14.283 1.00 0.00 S ATOM 1695 CE MET A 121 32.589 3.251 14.913 1.00 0.00 C ATOM 1696 OXT MET A 121 35.669 -0.884 17.624 1.00 0.00 O ATOM 0 H MET A 121 32.053 0.607 19.258 1.00 0.00 H new ATOM 0 HA MET A 121 33.252 -1.353 17.599 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.602 0.217 16.813 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.566 1.587 17.327 1.00 0.00 H new ATOM 0 HG2 MET A 121 34.294 1.047 15.662 1.00 0.00 H new ATOM 0 HG3 MET A 121 33.431 -0.404 15.194 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.150 3.954 14.205 1.00 0.00 H new ATOM 0 HE2 MET A 121 32.082 3.340 15.874 1.00 0.00 H new ATOM 0 HE3 MET A 121 33.648 3.477 15.039 1.00 0.00 H new