USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1024 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 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 92 SER OG : rot -160:sc= 0 USER MOD Set 2.1: A 55 CYS SG : rot 180:sc= -2.08 USER MOD Set 2.2: A 73 HIS : no HD1:sc= -6.09! C(o=-8.2!,f=-4.9!) USER MOD Set 3.1: A 19 THR OG1 : rot -119:sc= -0.164 USER MOD Set 3.2: A 95 GLN : amide:sc= 0.0437 K(o=-0.12,f=-1.6) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -151:sc= -8.39! (180deg=-10.6!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot 180:sc= -0.167 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= -0.125 (180deg=-0.125) USER MOD Single : A 38 TYR OH : rot 165:sc= -1.27 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.622! USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.0775 K(o=-0.077,f=-0.85) USER MOD Single : A 45 GLN : amide:sc= -0.132 K(o=-0.13,f=-1.8!) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.873 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00708) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 CYS SG : rot 20:sc= -5.19 USER MOD Single : A 70 LYS NZ :NH3+ -156:sc= -0.052 (180deg=-0.339) USER MOD Single : A 77 GLN : amide:sc= -0.081 K(o=-0.081,f=-1.6!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 140:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= -0.69 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -149:sc= -6.74! (180deg=-9.97!) USER MOD Single : A 124 LYS NZ :NH3+ -154:sc= -0.127 (180deg=-0.782) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 48:sc= 1.21 USER MOD Single : A 129 SER OG : rot 13:sc= 0.0425 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.011 12.246 11.422 1.00 0.00 N ATOM 2 CA GLY A 1 -15.189 12.732 12.517 1.00 0.00 C ATOM 3 C GLY A 1 -13.703 12.666 12.160 1.00 0.00 C ATOM 4 O GLY A 1 -12.972 11.825 12.681 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.014 12.301 11.690 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.845 12.830 10.578 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.763 11.258 11.213 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.464 13.760 12.754 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.379 12.137 13.410 1.00 0.00 H new ATOM 8 N SER A 2 -13.300 13.563 11.272 1.00 0.00 N ATOM 9 CA SER A 2 -11.915 13.618 10.839 1.00 0.00 C ATOM 10 C SER A 2 -11.015 14.014 12.011 1.00 0.00 C ATOM 11 O SER A 2 -11.307 14.971 12.726 1.00 0.00 O ATOM 12 CB SER A 2 -11.738 14.599 9.679 1.00 0.00 C ATOM 13 OG SER A 2 -10.896 14.073 8.657 1.00 0.00 O ATOM 0 H SER A 2 -13.909 14.258 10.841 1.00 0.00 H new ATOM 0 HA SER A 2 -11.628 12.627 10.488 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.713 14.840 9.256 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.314 15.531 10.054 1.00 0.00 H new ATOM 0 HG SER A 2 -10.810 14.729 7.934 1.00 0.00 H new ATOM 19 N SER A 3 -9.938 13.258 12.171 1.00 0.00 N ATOM 20 CA SER A 3 -8.994 13.518 13.244 1.00 0.00 C ATOM 21 C SER A 3 -7.736 14.186 12.684 1.00 0.00 C ATOM 22 O SER A 3 -7.470 14.109 11.486 1.00 0.00 O ATOM 23 CB SER A 3 -8.627 12.228 13.980 1.00 0.00 C ATOM 24 OG SER A 3 -7.852 11.352 13.167 1.00 0.00 O ATOM 0 H SER A 3 -9.699 12.465 11.575 1.00 0.00 H new ATOM 0 HA SER A 3 -9.467 14.190 13.960 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.069 12.472 14.884 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.538 11.719 14.296 1.00 0.00 H new ATOM 0 HG SER A 3 -7.637 10.541 13.673 1.00 0.00 H new ATOM 30 N GLY A 4 -6.997 14.826 13.578 1.00 0.00 N ATOM 31 CA GLY A 4 -5.774 15.506 13.188 1.00 0.00 C ATOM 32 C GLY A 4 -4.698 15.361 14.265 1.00 0.00 C ATOM 33 O GLY A 4 -4.430 16.302 15.011 1.00 0.00 O ATOM 0 H GLY A 4 -7.222 14.888 14.571 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.409 15.094 12.247 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.980 16.562 13.015 1.00 0.00 H new ATOM 37 N SER A 5 -4.110 14.175 14.313 1.00 0.00 N ATOM 38 CA SER A 5 -3.069 13.894 15.287 1.00 0.00 C ATOM 39 C SER A 5 -1.692 14.033 14.636 1.00 0.00 C ATOM 40 O SER A 5 -0.905 14.897 15.019 1.00 0.00 O ATOM 41 CB SER A 5 -3.236 12.495 15.884 1.00 0.00 C ATOM 42 OG SER A 5 -3.715 12.539 17.225 1.00 0.00 O ATOM 0 H SER A 5 -4.335 13.397 13.693 1.00 0.00 H new ATOM 0 HA SER A 5 -3.155 14.618 16.098 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.929 11.920 15.270 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.279 11.974 15.858 1.00 0.00 H new ATOM 0 HG SER A 5 -3.810 11.626 17.569 1.00 0.00 H new ATOM 48 N SER A 6 -1.442 13.168 13.663 1.00 0.00 N ATOM 49 CA SER A 6 -0.174 13.184 12.955 1.00 0.00 C ATOM 50 C SER A 6 -0.417 13.208 11.445 1.00 0.00 C ATOM 51 O SER A 6 -0.106 14.194 10.778 1.00 0.00 O ATOM 52 CB SER A 6 0.684 11.975 13.335 1.00 0.00 C ATOM 53 OG SER A 6 1.973 12.361 13.804 1.00 0.00 O ATOM 0 H SER A 6 -2.097 12.452 13.349 1.00 0.00 H new ATOM 0 HA SER A 6 0.367 14.085 13.244 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.175 11.398 14.107 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.794 11.322 12.469 1.00 0.00 H new ATOM 0 HG SER A 6 2.489 11.561 14.038 1.00 0.00 H new ATOM 59 N GLY A 7 -0.971 12.111 10.950 1.00 0.00 N ATOM 60 CA GLY A 7 -1.260 11.994 9.531 1.00 0.00 C ATOM 61 C GLY A 7 -1.255 10.529 9.089 1.00 0.00 C ATOM 62 O GLY A 7 -2.281 10.003 8.661 1.00 0.00 O ATOM 0 H GLY A 7 -1.227 11.295 11.506 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.232 12.439 9.316 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.520 12.553 8.958 1.00 0.00 H new ATOM 66 N ILE A 8 -0.089 9.912 9.208 1.00 0.00 N ATOM 67 CA ILE A 8 0.063 8.519 8.827 1.00 0.00 C ATOM 68 C ILE A 8 -1.055 7.694 9.468 1.00 0.00 C ATOM 69 O ILE A 8 -1.496 7.995 10.576 1.00 0.00 O ATOM 70 CB ILE A 8 1.468 8.020 9.168 1.00 0.00 C ATOM 71 CG1 ILE A 8 2.483 8.480 8.120 1.00 0.00 C ATOM 72 CG2 ILE A 8 1.482 6.501 9.351 1.00 0.00 C ATOM 73 CD1 ILE A 8 2.378 9.987 7.879 1.00 0.00 C ATOM 0 H ILE A 8 0.760 10.352 9.563 1.00 0.00 H new ATOM 0 HA ILE A 8 -0.036 8.407 7.747 1.00 0.00 H new ATOM 0 HB ILE A 8 1.765 8.461 10.119 1.00 0.00 H new ATOM 0 HG12 ILE A 8 3.491 8.230 8.451 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.313 7.946 7.185 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.493 6.173 9.593 1.00 0.00 H new ATOM 0 HG22 ILE A 8 0.808 6.226 10.162 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.155 6.020 8.429 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.110 10.288 7.130 1.00 0.00 H new ATOM 0 HD12 ILE A 8 1.376 10.230 7.525 1.00 0.00 H new ATOM 0 HD13 ILE A 8 2.572 10.519 8.810 1.00 0.00 H new ATOM 85 N VAL A 9 -1.482 6.670 8.743 1.00 0.00 N ATOM 86 CA VAL A 9 -2.540 5.800 9.227 1.00 0.00 C ATOM 87 C VAL A 9 -1.929 4.691 10.087 1.00 0.00 C ATOM 88 O VAL A 9 -2.192 4.615 11.286 1.00 0.00 O ATOM 89 CB VAL A 9 -3.355 5.263 8.050 1.00 0.00 C ATOM 90 CG1 VAL A 9 -4.330 4.176 8.508 1.00 0.00 C ATOM 91 CG2 VAL A 9 -4.094 6.394 7.332 1.00 0.00 C ATOM 0 H VAL A 9 -1.114 6.424 7.824 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.233 6.356 9.858 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.660 4.813 7.340 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.897 3.811 7.651 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.773 3.351 8.952 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.016 4.590 9.247 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.666 5.984 6.499 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.771 6.886 8.030 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.372 7.118 6.955 1.00 0.00 H new ATOM 101 N MET A 10 -1.126 3.859 9.440 1.00 0.00 N ATOM 102 CA MET A 10 -0.476 2.758 10.130 1.00 0.00 C ATOM 103 C MET A 10 0.734 2.255 9.341 1.00 0.00 C ATOM 104 O MET A 10 0.815 2.450 8.129 1.00 0.00 O ATOM 105 CB MET A 10 -1.474 1.614 10.320 1.00 0.00 C ATOM 106 CG MET A 10 -1.585 0.767 9.051 1.00 0.00 C ATOM 107 SD MET A 10 -2.957 -0.366 9.192 1.00 0.00 S ATOM 108 CE MET A 10 -2.181 -1.679 10.118 1.00 0.00 C ATOM 0 H MET A 10 -0.911 3.925 8.445 1.00 0.00 H new ATOM 0 HA MET A 10 -0.130 3.115 11.100 1.00 0.00 H new ATOM 0 HB2 MET A 10 -1.159 0.987 11.154 1.00 0.00 H new ATOM 0 HB3 MET A 10 -2.452 2.019 10.578 1.00 0.00 H new ATOM 0 HG2 MET A 10 -1.723 1.413 8.184 1.00 0.00 H new ATOM 0 HG3 MET A 10 -0.660 0.213 8.891 1.00 0.00 H new ATOM 0 HE1 MET A 10 -2.656 -2.628 9.871 1.00 0.00 H new ATOM 0 HE2 MET A 10 -1.122 -1.726 9.865 1.00 0.00 H new ATOM 0 HE3 MET A 10 -2.291 -1.486 11.185 1.00 0.00 H new ATOM 118 N ALA A 11 1.646 1.616 10.060 1.00 0.00 N ATOM 119 CA ALA A 11 2.848 1.083 9.442 1.00 0.00 C ATOM 120 C ALA A 11 3.167 -0.283 10.054 1.00 0.00 C ATOM 121 O ALA A 11 3.221 -0.424 11.274 1.00 0.00 O ATOM 122 CB ALA A 11 3.995 2.080 9.613 1.00 0.00 C ATOM 0 H ALA A 11 1.576 1.456 11.065 1.00 0.00 H new ATOM 0 HA ALA A 11 2.698 0.939 8.372 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.897 1.680 9.149 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.730 3.024 9.137 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.176 2.247 10.675 1.00 0.00 H new ATOM 128 N ASP A 12 3.370 -1.255 9.177 1.00 0.00 N ATOM 129 CA ASP A 12 3.683 -2.605 9.615 1.00 0.00 C ATOM 130 C ASP A 12 4.433 -3.337 8.500 1.00 0.00 C ATOM 131 O ASP A 12 4.526 -2.840 7.379 1.00 0.00 O ATOM 132 CB ASP A 12 2.408 -3.393 9.924 1.00 0.00 C ATOM 133 CG ASP A 12 1.449 -2.713 10.902 1.00 0.00 C ATOM 134 OD1 ASP A 12 0.979 -1.607 10.560 1.00 0.00 O ATOM 135 OD2 ASP A 12 1.208 -3.315 11.971 1.00 0.00 O ATOM 0 H ASP A 12 3.324 -1.135 8.165 1.00 0.00 H new ATOM 0 HA ASP A 12 4.291 -2.535 10.517 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.879 -3.579 8.990 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.689 -4.365 10.330 1.00 0.00 H new ATOM 140 N TRP A 13 4.949 -4.507 8.848 1.00 0.00 N ATOM 141 CA TRP A 13 5.688 -5.313 7.891 1.00 0.00 C ATOM 142 C TRP A 13 4.687 -6.191 7.139 1.00 0.00 C ATOM 143 O TRP A 13 4.120 -7.122 7.710 1.00 0.00 O ATOM 144 CB TRP A 13 6.787 -6.119 8.586 1.00 0.00 C ATOM 145 CG TRP A 13 7.888 -5.261 9.212 1.00 0.00 C ATOM 146 CD1 TRP A 13 7.922 -4.733 10.443 1.00 0.00 C ATOM 147 CD2 TRP A 13 9.120 -4.850 8.583 1.00 0.00 C ATOM 148 NE1 TRP A 13 9.082 -4.015 10.654 1.00 0.00 N ATOM 149 CE2 TRP A 13 9.833 -4.088 9.487 1.00 0.00 C ATOM 150 CE3 TRP A 13 9.616 -5.113 7.294 1.00 0.00 C ATOM 151 CZ2 TRP A 13 11.083 -3.527 9.198 1.00 0.00 C ATOM 152 CZ3 TRP A 13 10.866 -4.545 7.021 1.00 0.00 C ATOM 153 CH2 TRP A 13 11.596 -3.776 7.920 1.00 0.00 C ATOM 0 H TRP A 13 4.870 -4.916 9.779 1.00 0.00 H new ATOM 0 HA TRP A 13 6.204 -4.679 7.170 1.00 0.00 H new ATOM 0 HB2 TRP A 13 6.335 -6.735 9.363 1.00 0.00 H new ATOM 0 HB3 TRP A 13 7.238 -6.798 7.862 1.00 0.00 H new ATOM 0 HD1 TRP A 13 7.140 -4.854 11.178 1.00 0.00 H new ATOM 0 HE1 TRP A 13 9.340 -3.522 11.509 1.00 0.00 H new ATOM 0 HE3 TRP A 13 9.075 -5.706 6.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 11.622 -2.934 9.922 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.293 -4.716 6.044 1.00 0.00 H new ATOM 0 HH2 TRP A 13 12.556 -3.372 7.633 1.00 0.00 H new ATOM 164 N LEU A 14 4.498 -5.865 5.868 1.00 0.00 N ATOM 165 CA LEU A 14 3.575 -6.613 5.032 1.00 0.00 C ATOM 166 C LEU A 14 4.361 -7.361 3.954 1.00 0.00 C ATOM 167 O LEU A 14 5.267 -6.800 3.339 1.00 0.00 O ATOM 168 CB LEU A 14 2.490 -5.689 4.474 1.00 0.00 C ATOM 169 CG LEU A 14 1.852 -4.723 5.473 1.00 0.00 C ATOM 170 CD1 LEU A 14 0.923 -3.735 4.764 1.00 0.00 C ATOM 171 CD2 LEU A 14 1.135 -5.483 6.590 1.00 0.00 C ATOM 0 H LEU A 14 4.969 -5.092 5.397 1.00 0.00 H new ATOM 0 HA LEU A 14 3.050 -7.364 5.621 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.921 -5.106 3.660 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.702 -6.306 4.042 1.00 0.00 H new ATOM 0 HG LEU A 14 2.647 -4.140 5.939 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.482 -3.060 5.497 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.493 -3.158 4.036 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.131 -4.283 4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.690 -4.772 7.286 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.352 -6.108 6.160 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.851 -6.111 7.120 1.00 0.00 H new ATOM 183 N LYS A 15 3.986 -8.616 3.757 1.00 0.00 N ATOM 184 CA LYS A 15 4.645 -9.447 2.764 1.00 0.00 C ATOM 185 C LYS A 15 3.948 -9.269 1.413 1.00 0.00 C ATOM 186 O LYS A 15 2.723 -9.330 1.330 1.00 0.00 O ATOM 187 CB LYS A 15 4.707 -10.901 3.237 1.00 0.00 C ATOM 188 CG LYS A 15 5.966 -11.154 4.068 1.00 0.00 C ATOM 189 CD LYS A 15 5.693 -12.168 5.181 1.00 0.00 C ATOM 190 CE LYS A 15 6.957 -12.434 6.002 1.00 0.00 C ATOM 191 NZ LYS A 15 6.715 -12.146 7.433 1.00 0.00 N ATOM 0 H LYS A 15 3.234 -9.078 4.268 1.00 0.00 H new ATOM 0 HA LYS A 15 5.681 -9.135 2.633 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.823 -11.132 3.831 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.696 -11.568 2.375 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.764 -11.522 3.423 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.314 -10.217 4.502 1.00 0.00 H new ATOM 0 HD2 LYS A 15 4.903 -11.794 5.833 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.333 -13.101 4.748 1.00 0.00 H new ATOM 0 HE2 LYS A 15 7.265 -13.473 5.881 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.774 -11.814 5.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 7.582 -12.332 7.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 6.443 -11.148 7.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.949 -12.755 7.785 1.00 0.00 H new ATOM 205 N ILE A 16 4.760 -9.052 0.389 1.00 0.00 N ATOM 206 CA ILE A 16 4.237 -8.864 -0.954 1.00 0.00 C ATOM 207 C ILE A 16 4.450 -10.145 -1.763 1.00 0.00 C ATOM 208 O ILE A 16 5.460 -10.827 -1.598 1.00 0.00 O ATOM 209 CB ILE A 16 4.851 -7.620 -1.599 1.00 0.00 C ATOM 210 CG1 ILE A 16 4.093 -6.357 -1.185 1.00 0.00 C ATOM 211 CG2 ILE A 16 4.925 -7.771 -3.120 1.00 0.00 C ATOM 212 CD1 ILE A 16 4.211 -6.116 0.322 1.00 0.00 C ATOM 0 H ILE A 16 5.776 -9.002 0.462 1.00 0.00 H new ATOM 0 HA ILE A 16 3.163 -8.681 -0.923 1.00 0.00 H new ATOM 0 HB ILE A 16 5.873 -7.516 -1.235 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.488 -5.497 -1.726 1.00 0.00 H new ATOM 0 HG13 ILE A 16 3.043 -6.452 -1.461 1.00 0.00 H new ATOM 0 HG21 ILE A 16 5.365 -6.873 -3.554 1.00 0.00 H new ATOM 0 HG22 ILE A 16 5.541 -8.635 -3.370 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.921 -7.913 -3.521 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.664 -5.212 0.590 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.793 -6.967 0.860 1.00 0.00 H new ATOM 0 HD13 ILE A 16 5.261 -5.997 0.590 1.00 0.00 H new ATOM 224 N ARG A 17 3.483 -10.433 -2.621 1.00 0.00 N ATOM 225 CA ARG A 17 3.552 -11.620 -3.456 1.00 0.00 C ATOM 226 C ARG A 17 4.985 -11.845 -3.941 1.00 0.00 C ATOM 227 O ARG A 17 5.654 -10.905 -4.369 1.00 0.00 O ATOM 228 CB ARG A 17 2.624 -11.496 -4.667 1.00 0.00 C ATOM 229 CG ARG A 17 2.149 -12.873 -5.137 1.00 0.00 C ATOM 230 CD ARG A 17 2.886 -13.302 -6.407 1.00 0.00 C ATOM 231 NE ARG A 17 1.929 -13.886 -7.374 1.00 0.00 N ATOM 232 CZ ARG A 17 2.289 -14.590 -8.456 1.00 0.00 C ATOM 233 NH1 ARG A 17 3.586 -14.801 -8.716 1.00 0.00 N ATOM 234 NH2 ARG A 17 1.352 -15.082 -9.278 1.00 0.00 N ATOM 0 H ARG A 17 2.647 -9.865 -2.756 1.00 0.00 H new ATOM 0 HA ARG A 17 3.232 -12.469 -2.853 1.00 0.00 H new ATOM 0 HB2 ARG A 17 1.763 -10.879 -4.409 1.00 0.00 H new ATOM 0 HB3 ARG A 17 3.146 -10.991 -5.479 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.316 -13.608 -4.349 1.00 0.00 H new ATOM 0 HG3 ARG A 17 1.076 -12.847 -5.326 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.389 -12.444 -6.853 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.658 -14.031 -6.161 1.00 0.00 H new ATOM 0 HE ARG A 17 0.933 -13.744 -7.206 1.00 0.00 H new ATOM 0 HH11 ARG A 17 4.299 -14.426 -8.091 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.860 -15.337 -9.539 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.364 -14.921 -9.080 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.626 -15.618 -10.101 1.00 0.00 H new ATOM 248 N GLY A 18 5.415 -13.095 -3.859 1.00 0.00 N ATOM 249 CA GLY A 18 6.757 -13.456 -4.284 1.00 0.00 C ATOM 250 C GLY A 18 6.856 -13.493 -5.811 1.00 0.00 C ATOM 251 O GLY A 18 7.230 -14.513 -6.387 1.00 0.00 O ATOM 0 H GLY A 18 4.857 -13.872 -3.504 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.474 -12.738 -3.887 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.022 -14.431 -3.875 1.00 0.00 H new ATOM 255 N THR A 19 6.516 -12.368 -6.422 1.00 0.00 N ATOM 256 CA THR A 19 6.562 -12.258 -7.870 1.00 0.00 C ATOM 257 C THR A 19 7.821 -12.936 -8.415 1.00 0.00 C ATOM 258 O THR A 19 7.746 -13.734 -9.349 1.00 0.00 O ATOM 259 CB THR A 19 6.464 -10.776 -8.236 1.00 0.00 C ATOM 260 OG1 THR A 19 7.566 -10.178 -7.560 1.00 0.00 O ATOM 261 CG2 THR A 19 5.237 -10.101 -7.618 1.00 0.00 C ATOM 0 H THR A 19 6.207 -11.524 -5.940 1.00 0.00 H new ATOM 0 HA THR A 19 5.723 -12.777 -8.333 1.00 0.00 H new ATOM 0 HB THR A 19 6.429 -10.671 -9.320 1.00 0.00 H new ATOM 0 HG1 THR A 19 7.236 -9.511 -6.923 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.215 -9.051 -7.909 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.333 -10.595 -7.973 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.289 -10.176 -6.532 1.00 0.00 H new ATOM 269 N LEU A 20 8.948 -12.595 -7.809 1.00 0.00 N ATOM 270 CA LEU A 20 10.221 -13.161 -8.223 1.00 0.00 C ATOM 271 C LEU A 20 10.224 -14.663 -7.934 1.00 0.00 C ATOM 272 O LEU A 20 10.195 -15.476 -8.857 1.00 0.00 O ATOM 273 CB LEU A 20 11.381 -12.406 -7.568 1.00 0.00 C ATOM 274 CG LEU A 20 11.343 -10.882 -7.691 1.00 0.00 C ATOM 275 CD1 LEU A 20 10.646 -10.453 -8.983 1.00 0.00 C ATOM 276 CD2 LEU A 20 10.701 -10.247 -6.455 1.00 0.00 C ATOM 0 H LEU A 20 9.007 -11.934 -7.034 1.00 0.00 H new ATOM 0 HA LEU A 20 10.360 -13.042 -9.298 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.405 -12.665 -6.509 1.00 0.00 H new ATOM 0 HB3 LEU A 20 12.314 -12.763 -8.005 1.00 0.00 H new ATOM 0 HG LEU A 20 12.369 -10.519 -7.743 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.633 -9.365 -9.045 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.185 -10.859 -9.839 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.623 -10.829 -8.987 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.687 -9.163 -6.569 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.680 -10.614 -6.346 1.00 0.00 H new ATOM 0 HD23 LEU A 20 11.278 -10.511 -5.569 1.00 0.00 H new ATOM 288 N LYS A 21 10.260 -14.987 -6.650 1.00 0.00 N ATOM 289 CA LYS A 21 10.267 -16.377 -6.228 1.00 0.00 C ATOM 290 C LYS A 21 9.525 -16.506 -4.897 1.00 0.00 C ATOM 291 O LYS A 21 8.588 -17.295 -4.779 1.00 0.00 O ATOM 292 CB LYS A 21 11.698 -16.918 -6.189 1.00 0.00 C ATOM 293 CG LYS A 21 12.376 -16.774 -7.553 1.00 0.00 C ATOM 294 CD LYS A 21 13.787 -17.366 -7.529 1.00 0.00 C ATOM 295 CE LYS A 21 14.836 -16.273 -7.307 1.00 0.00 C ATOM 296 NZ LYS A 21 15.791 -16.679 -6.251 1.00 0.00 N ATOM 0 H LYS A 21 10.285 -14.310 -5.887 1.00 0.00 H new ATOM 0 HA LYS A 21 9.736 -16.997 -6.951 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.273 -16.381 -5.435 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.686 -17.967 -5.894 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.780 -17.277 -8.314 1.00 0.00 H new ATOM 0 HG3 LYS A 21 12.424 -15.721 -7.830 1.00 0.00 H new ATOM 0 HD2 LYS A 21 13.859 -18.111 -6.737 1.00 0.00 H new ATOM 0 HD3 LYS A 21 13.986 -17.880 -8.469 1.00 0.00 H new ATOM 0 HE2 LYS A 21 15.372 -16.081 -8.236 1.00 0.00 H new ATOM 0 HE3 LYS A 21 14.345 -15.342 -7.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 16.496 -15.927 -6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 15.277 -16.840 -5.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 16.272 -17.556 -6.536 1.00 0.00 H new ATOM 310 N SER A 22 9.970 -15.719 -3.929 1.00 0.00 N ATOM 311 CA SER A 22 9.359 -15.736 -2.611 1.00 0.00 C ATOM 312 C SER A 22 8.843 -14.340 -2.256 1.00 0.00 C ATOM 313 O SER A 22 9.309 -13.343 -2.805 1.00 0.00 O ATOM 314 CB SER A 22 10.350 -16.220 -1.550 1.00 0.00 C ATOM 315 OG SER A 22 11.602 -15.546 -1.642 1.00 0.00 O ATOM 0 H SER A 22 10.746 -15.065 -4.031 1.00 0.00 H new ATOM 0 HA SER A 22 8.521 -16.433 -2.632 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.925 -16.062 -0.559 1.00 0.00 H new ATOM 0 HB3 SER A 22 10.507 -17.293 -1.663 1.00 0.00 H new ATOM 0 HG SER A 22 12.206 -15.882 -0.947 1.00 0.00 H new ATOM 321 N TRP A 23 7.885 -14.313 -1.340 1.00 0.00 N ATOM 322 CA TRP A 23 7.300 -13.056 -0.906 1.00 0.00 C ATOM 323 C TRP A 23 8.420 -12.188 -0.328 1.00 0.00 C ATOM 324 O TRP A 23 9.472 -12.698 0.052 1.00 0.00 O ATOM 325 CB TRP A 23 6.158 -13.296 0.084 1.00 0.00 C ATOM 326 CG TRP A 23 4.928 -13.963 -0.535 1.00 0.00 C ATOM 327 CD1 TRP A 23 4.839 -15.183 -1.082 1.00 0.00 C ATOM 328 CD2 TRP A 23 3.607 -13.393 -0.648 1.00 0.00 C ATOM 329 NE1 TRP A 23 3.562 -15.440 -1.537 1.00 0.00 N ATOM 330 CE2 TRP A 23 2.789 -14.317 -1.265 1.00 0.00 C ATOM 331 CE3 TRP A 23 3.119 -12.138 -0.242 1.00 0.00 C ATOM 332 CZ2 TRP A 23 1.434 -14.085 -1.532 1.00 0.00 C ATOM 333 CZ3 TRP A 23 1.763 -11.922 -0.516 1.00 0.00 C ATOM 334 CH2 TRP A 23 0.926 -12.842 -1.136 1.00 0.00 C ATOM 0 H TRP A 23 7.500 -15.142 -0.887 1.00 0.00 H new ATOM 0 HA TRP A 23 6.850 -12.529 -1.747 1.00 0.00 H new ATOM 0 HB2 TRP A 23 6.524 -13.918 0.901 1.00 0.00 H new ATOM 0 HB3 TRP A 23 5.861 -12.342 0.519 1.00 0.00 H new ATOM 0 HD1 TRP A 23 5.663 -15.877 -1.157 1.00 0.00 H new ATOM 0 HE1 TRP A 23 3.244 -16.297 -1.990 1.00 0.00 H new ATOM 0 HE3 TRP A 23 3.741 -11.400 0.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 0.815 -14.825 -2.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 1.337 -10.973 -0.225 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -0.112 -12.599 -1.312 1.00 0.00 H new ATOM 345 N THR A 24 8.155 -10.890 -0.282 1.00 0.00 N ATOM 346 CA THR A 24 9.127 -9.947 0.243 1.00 0.00 C ATOM 347 C THR A 24 8.505 -9.106 1.360 1.00 0.00 C ATOM 348 O THR A 24 7.483 -8.453 1.154 1.00 0.00 O ATOM 349 CB THR A 24 9.653 -9.111 -0.926 1.00 0.00 C ATOM 350 OG1 THR A 24 10.302 -10.060 -1.767 1.00 0.00 O ATOM 351 CG2 THR A 24 10.774 -8.157 -0.506 1.00 0.00 C ATOM 0 H THR A 24 7.281 -10.470 -0.600 1.00 0.00 H new ATOM 0 HA THR A 24 9.972 -10.463 0.699 1.00 0.00 H new ATOM 0 HB THR A 24 8.833 -8.539 -1.361 1.00 0.00 H new ATOM 0 HG1 THR A 24 10.671 -9.603 -2.551 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.111 -7.588 -1.372 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.402 -7.472 0.256 1.00 0.00 H new ATOM 0 HG23 THR A 24 11.608 -8.731 -0.102 1.00 0.00 H new ATOM 359 N LYS A 25 9.147 -9.149 2.517 1.00 0.00 N ATOM 360 CA LYS A 25 8.670 -8.400 3.667 1.00 0.00 C ATOM 361 C LYS A 25 9.197 -6.965 3.589 1.00 0.00 C ATOM 362 O LYS A 25 10.309 -6.684 4.033 1.00 0.00 O ATOM 363 CB LYS A 25 9.037 -9.120 4.966 1.00 0.00 C ATOM 364 CG LYS A 25 8.373 -8.449 6.171 1.00 0.00 C ATOM 365 CD LYS A 25 9.299 -8.471 7.389 1.00 0.00 C ATOM 366 CE LYS A 25 8.542 -8.909 8.645 1.00 0.00 C ATOM 367 NZ LYS A 25 9.433 -9.674 9.546 1.00 0.00 N ATOM 0 H LYS A 25 9.995 -9.691 2.683 1.00 0.00 H new ATOM 0 HA LYS A 25 7.582 -8.342 3.659 1.00 0.00 H new ATOM 0 HB2 LYS A 25 8.725 -10.163 4.909 1.00 0.00 H new ATOM 0 HB3 LYS A 25 10.119 -9.117 5.094 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.117 -7.419 5.923 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.441 -8.961 6.409 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.131 -9.151 7.206 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.726 -7.480 7.544 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.152 -8.034 9.166 1.00 0.00 H new ATOM 0 HE3 LYS A 25 7.685 -9.521 8.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.904 -9.964 10.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.784 -10.519 9.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.237 -9.078 9.827 1.00 0.00 H new ATOM 381 N LEU A 26 8.372 -6.096 3.023 1.00 0.00 N ATOM 382 CA LEU A 26 8.741 -4.698 2.882 1.00 0.00 C ATOM 383 C LEU A 26 8.055 -3.880 3.978 1.00 0.00 C ATOM 384 O LEU A 26 7.180 -4.387 4.679 1.00 0.00 O ATOM 385 CB LEU A 26 8.438 -4.204 1.466 1.00 0.00 C ATOM 386 CG LEU A 26 9.232 -4.868 0.339 1.00 0.00 C ATOM 387 CD1 LEU A 26 8.629 -4.536 -1.027 1.00 0.00 C ATOM 388 CD2 LEU A 26 10.713 -4.493 0.418 1.00 0.00 C ATOM 0 H LEU A 26 7.450 -6.333 2.657 1.00 0.00 H new ATOM 0 HA LEU A 26 9.816 -4.573 3.016 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.376 -4.351 1.271 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.623 -3.130 1.430 1.00 0.00 H new ATOM 0 HG LEU A 26 9.166 -5.949 0.465 1.00 0.00 H new ATOM 0 HD11 LEU A 26 9.213 -5.020 -1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.600 -4.894 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.644 -3.457 -1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.255 -4.978 -0.394 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.820 -3.412 0.331 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.121 -4.822 1.374 1.00 0.00 H new ATOM 400 N TRP A 27 8.478 -2.630 4.092 1.00 0.00 N ATOM 401 CA TRP A 27 7.915 -1.738 5.091 1.00 0.00 C ATOM 402 C TRP A 27 6.880 -0.847 4.401 1.00 0.00 C ATOM 403 O TRP A 27 7.233 0.162 3.792 1.00 0.00 O ATOM 404 CB TRP A 27 9.014 -0.941 5.797 1.00 0.00 C ATOM 405 CG TRP A 27 8.492 0.060 6.829 1.00 0.00 C ATOM 406 CD1 TRP A 27 8.489 1.398 6.752 1.00 0.00 C ATOM 407 CD2 TRP A 27 7.894 -0.253 8.104 1.00 0.00 C ATOM 408 NE1 TRP A 27 7.934 1.968 7.880 1.00 0.00 N ATOM 409 CE2 TRP A 27 7.561 0.932 8.728 1.00 0.00 C ATOM 410 CE3 TRP A 27 7.642 -1.496 8.711 1.00 0.00 C ATOM 411 CZ2 TRP A 27 6.958 0.991 9.990 1.00 0.00 C ATOM 412 CZ3 TRP A 27 7.039 -1.420 9.972 1.00 0.00 C ATOM 413 CH2 TRP A 27 6.697 -0.235 10.614 1.00 0.00 C ATOM 0 H TRP A 27 9.204 -2.214 3.509 1.00 0.00 H new ATOM 0 HA TRP A 27 7.417 -2.306 5.877 1.00 0.00 H new ATOM 0 HB2 TRP A 27 9.692 -1.636 6.291 1.00 0.00 H new ATOM 0 HB3 TRP A 27 9.597 -0.405 5.049 1.00 0.00 H new ATOM 0 HD1 TRP A 27 8.873 1.960 5.913 1.00 0.00 H new ATOM 0 HE1 TRP A 27 7.819 2.966 8.058 1.00 0.00 H new ATOM 0 HE3 TRP A 27 7.894 -2.435 8.241 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 6.707 1.932 10.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 6.824 -2.347 10.482 1.00 0.00 H new ATOM 0 HH2 TRP A 27 6.233 -0.260 11.589 1.00 0.00 H new ATOM 424 N CYS A 28 5.624 -1.252 4.518 1.00 0.00 N ATOM 425 CA CYS A 28 4.537 -0.503 3.913 1.00 0.00 C ATOM 426 C CYS A 28 4.018 0.506 4.939 1.00 0.00 C ATOM 427 O CYS A 28 3.820 0.165 6.105 1.00 0.00 O ATOM 428 CB CYS A 28 3.426 -1.426 3.408 1.00 0.00 C ATOM 429 SG CYS A 28 4.150 -2.829 2.483 1.00 0.00 S ATOM 0 H CYS A 28 5.335 -2.090 5.023 1.00 0.00 H new ATOM 0 HA CYS A 28 4.904 0.029 3.036 1.00 0.00 H new ATOM 0 HB2 CYS A 28 2.840 -1.798 4.249 1.00 0.00 H new ATOM 0 HB3 CYS A 28 2.744 -0.870 2.766 1.00 0.00 H new ATOM 0 HG CYS A 28 3.198 -3.608 2.061 1.00 0.00 H new ATOM 435 N VAL A 29 3.813 1.728 4.470 1.00 0.00 N ATOM 436 CA VAL A 29 3.321 2.788 5.333 1.00 0.00 C ATOM 437 C VAL A 29 1.941 3.237 4.847 1.00 0.00 C ATOM 438 O VAL A 29 1.796 3.695 3.715 1.00 0.00 O ATOM 439 CB VAL A 29 4.336 3.932 5.387 1.00 0.00 C ATOM 440 CG1 VAL A 29 3.912 4.993 6.404 1.00 0.00 C ATOM 441 CG2 VAL A 29 5.739 3.405 5.697 1.00 0.00 C ATOM 0 H VAL A 29 3.979 2.008 3.503 1.00 0.00 H new ATOM 0 HA VAL A 29 3.204 2.425 6.354 1.00 0.00 H new ATOM 0 HB VAL A 29 4.364 4.402 4.404 1.00 0.00 H new ATOM 0 HG11 VAL A 29 4.650 5.795 6.423 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.941 5.400 6.122 1.00 0.00 H new ATOM 0 HG13 VAL A 29 3.842 4.541 7.393 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.441 4.238 5.730 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.732 2.898 6.662 1.00 0.00 H new ATOM 0 HG23 VAL A 29 6.044 2.703 4.920 1.00 0.00 H new ATOM 451 N LEU A 30 0.962 3.088 5.727 1.00 0.00 N ATOM 452 CA LEU A 30 -0.401 3.472 5.402 1.00 0.00 C ATOM 453 C LEU A 30 -0.594 4.959 5.705 1.00 0.00 C ATOM 454 O LEU A 30 -0.499 5.379 6.857 1.00 0.00 O ATOM 455 CB LEU A 30 -1.400 2.563 6.122 1.00 0.00 C ATOM 456 CG LEU A 30 -2.642 2.165 5.323 1.00 0.00 C ATOM 457 CD1 LEU A 30 -3.795 1.785 6.254 1.00 0.00 C ATOM 458 CD2 LEU A 30 -3.039 3.269 4.340 1.00 0.00 C ATOM 0 H LEU A 30 1.086 2.707 6.665 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.591 3.336 4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.881 1.654 6.425 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.724 3.064 7.034 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.400 1.281 4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.665 1.506 5.660 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.496 0.942 6.878 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.046 2.635 6.888 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -3.925 2.960 3.785 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.256 4.185 4.890 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.219 3.449 3.645 1.00 0.00 H new ATOM 470 N LYS A 31 -0.860 5.716 4.650 1.00 0.00 N ATOM 471 CA LYS A 31 -1.067 7.147 4.789 1.00 0.00 C ATOM 472 C LYS A 31 -2.528 7.480 4.479 1.00 0.00 C ATOM 473 O LYS A 31 -3.284 6.617 4.035 1.00 0.00 O ATOM 474 CB LYS A 31 -0.064 7.919 3.929 1.00 0.00 C ATOM 475 CG LYS A 31 1.047 8.522 4.790 1.00 0.00 C ATOM 476 CD LYS A 31 2.107 9.202 3.921 1.00 0.00 C ATOM 477 CE LYS A 31 3.434 9.328 4.672 1.00 0.00 C ATOM 478 NZ LYS A 31 3.889 10.737 4.687 1.00 0.00 N ATOM 0 H LYS A 31 -0.937 5.365 3.695 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.880 7.461 5.816 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.370 7.253 3.184 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.579 8.712 3.386 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.621 9.247 5.484 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.511 7.740 5.391 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.256 8.628 3.007 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.758 10.191 3.623 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.316 8.967 5.694 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.189 8.701 4.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.791 10.805 5.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.021 11.070 3.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.176 11.327 5.161 1.00 0.00 H new ATOM 492 N PRO A 32 -2.890 8.766 4.730 1.00 0.00 N ATOM 493 CA PRO A 32 -4.247 9.223 4.482 1.00 0.00 C ATOM 494 C PRO A 32 -4.498 9.409 2.984 1.00 0.00 C ATOM 495 O PRO A 32 -4.279 10.492 2.444 1.00 0.00 O ATOM 496 CB PRO A 32 -4.377 10.516 5.271 1.00 0.00 C ATOM 497 CG PRO A 32 -2.956 10.977 5.553 1.00 0.00 C ATOM 498 CD PRO A 32 -2.022 9.815 5.255 1.00 0.00 C ATOM 0 HA PRO A 32 -4.999 8.501 4.800 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.926 11.267 4.702 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.926 10.354 6.198 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -2.704 11.838 4.934 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -2.855 11.291 6.592 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -1.259 10.097 4.530 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.501 9.485 6.154 1.00 0.00 H new ATOM 506 N GLY A 33 -4.953 8.335 2.355 1.00 0.00 N ATOM 507 CA GLY A 33 -5.236 8.366 0.931 1.00 0.00 C ATOM 508 C GLY A 33 -3.973 8.086 0.114 1.00 0.00 C ATOM 509 O GLY A 33 -3.857 8.527 -1.028 1.00 0.00 O ATOM 0 H GLY A 33 -5.133 7.438 2.806 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.999 7.625 0.692 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.641 9.341 0.658 1.00 0.00 H new ATOM 513 N VAL A 34 -3.058 7.354 0.733 1.00 0.00 N ATOM 514 CA VAL A 34 -1.807 7.010 0.078 1.00 0.00 C ATOM 515 C VAL A 34 -1.096 5.923 0.886 1.00 0.00 C ATOM 516 O VAL A 34 -1.342 5.771 2.082 1.00 0.00 O ATOM 517 CB VAL A 34 -0.954 8.266 -0.115 1.00 0.00 C ATOM 518 CG1 VAL A 34 -1.354 9.010 -1.390 1.00 0.00 C ATOM 519 CG2 VAL A 34 -1.045 9.183 1.107 1.00 0.00 C ATOM 0 H VAL A 34 -3.158 6.990 1.681 1.00 0.00 H new ATOM 0 HA VAL A 34 -1.995 6.606 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 34 0.084 7.953 -0.222 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.733 9.898 -1.503 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.214 8.357 -2.251 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -2.401 9.306 -1.325 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -0.430 10.068 0.944 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.081 9.484 1.259 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -0.689 8.651 1.989 1.00 0.00 H new ATOM 529 N LEU A 35 -0.228 5.193 0.201 1.00 0.00 N ATOM 530 CA LEU A 35 0.521 4.125 0.840 1.00 0.00 C ATOM 531 C LEU A 35 1.953 4.117 0.300 1.00 0.00 C ATOM 532 O LEU A 35 2.166 4.247 -0.905 1.00 0.00 O ATOM 533 CB LEU A 35 -0.206 2.788 0.674 1.00 0.00 C ATOM 534 CG LEU A 35 0.587 1.540 1.069 1.00 0.00 C ATOM 535 CD1 LEU A 35 0.299 1.143 2.518 1.00 0.00 C ATOM 536 CD2 LEU A 35 0.320 0.391 0.095 1.00 0.00 C ATOM 0 H LEU A 35 -0.027 5.320 -0.791 1.00 0.00 H new ATOM 0 HA LEU A 35 0.586 4.296 1.915 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -1.119 2.817 1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.507 2.688 -0.369 1.00 0.00 H new ATOM 0 HG LEU A 35 1.649 1.775 1.006 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.875 0.253 2.773 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.581 1.960 3.182 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.764 0.932 2.633 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.895 -0.484 0.398 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.742 0.147 0.102 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.617 0.690 -0.910 1.00 0.00 H new ATOM 548 N LEU A 36 2.896 3.963 1.217 1.00 0.00 N ATOM 549 CA LEU A 36 4.301 3.937 0.848 1.00 0.00 C ATOM 550 C LEU A 36 4.890 2.568 1.197 1.00 0.00 C ATOM 551 O LEU A 36 4.377 1.872 2.071 1.00 0.00 O ATOM 552 CB LEU A 36 5.046 5.109 1.491 1.00 0.00 C ATOM 553 CG LEU A 36 4.885 6.465 0.801 1.00 0.00 C ATOM 554 CD1 LEU A 36 3.941 7.373 1.591 1.00 0.00 C ATOM 555 CD2 LEU A 36 6.246 7.122 0.560 1.00 0.00 C ATOM 0 H LEU A 36 2.715 3.855 2.215 1.00 0.00 H new ATOM 0 HA LEU A 36 4.415 4.069 -0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.708 5.206 2.523 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.108 4.864 1.525 1.00 0.00 H new ATOM 0 HG LEU A 36 4.430 6.300 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 36 3.844 8.330 1.079 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.961 6.901 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.344 7.535 2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 36 6.104 8.084 0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.751 7.273 1.514 1.00 0.00 H new ATOM 0 HD23 LEU A 36 6.854 6.477 -0.074 1.00 0.00 H new ATOM 567 N ILE A 37 5.960 2.224 0.495 1.00 0.00 N ATOM 568 CA ILE A 37 6.625 0.951 0.720 1.00 0.00 C ATOM 569 C ILE A 37 8.138 1.170 0.753 1.00 0.00 C ATOM 570 O ILE A 37 8.706 1.750 -0.171 1.00 0.00 O ATOM 571 CB ILE A 37 6.175 -0.078 -0.318 1.00 0.00 C ATOM 572 CG1 ILE A 37 4.655 -0.254 -0.293 1.00 0.00 C ATOM 573 CG2 ILE A 37 6.909 -1.407 -0.126 1.00 0.00 C ATOM 574 CD1 ILE A 37 4.038 0.111 -1.645 1.00 0.00 C ATOM 0 H ILE A 37 6.383 2.804 -0.230 1.00 0.00 H new ATOM 0 HA ILE A 37 6.341 0.538 1.688 1.00 0.00 H new ATOM 0 HB ILE A 37 6.439 0.296 -1.307 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.409 -1.286 -0.044 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.226 0.373 0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.571 -2.121 -0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 37 7.982 -1.249 -0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.698 -1.799 0.869 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.957 -0.023 -1.600 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.265 1.151 -1.880 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.451 -0.535 -2.420 1.00 0.00 H new ATOM 586 N TYR A 38 8.750 0.694 1.828 1.00 0.00 N ATOM 587 CA TYR A 38 10.187 0.830 1.994 1.00 0.00 C ATOM 588 C TYR A 38 10.843 -0.531 2.230 1.00 0.00 C ATOM 589 O TYR A 38 10.307 -1.365 2.959 1.00 0.00 O ATOM 590 CB TYR A 38 10.387 1.702 3.235 1.00 0.00 C ATOM 591 CG TYR A 38 10.032 3.175 3.025 1.00 0.00 C ATOM 592 CD1 TYR A 38 8.721 3.592 3.139 1.00 0.00 C ATOM 593 CD2 TYR A 38 11.022 4.088 2.722 1.00 0.00 C ATOM 594 CE1 TYR A 38 8.386 4.978 2.941 1.00 0.00 C ATOM 595 CE2 TYR A 38 10.687 5.474 2.524 1.00 0.00 C ATOM 596 CZ TYR A 38 9.386 5.851 2.643 1.00 0.00 C ATOM 597 OH TYR A 38 9.070 7.161 2.457 1.00 0.00 O ATOM 0 H TYR A 38 8.276 0.213 2.593 1.00 0.00 H new ATOM 0 HA TYR A 38 10.637 1.264 1.101 1.00 0.00 H new ATOM 0 HB2 TYR A 38 9.779 1.305 4.047 1.00 0.00 H new ATOM 0 HB3 TYR A 38 11.427 1.631 3.552 1.00 0.00 H new ATOM 0 HD1 TYR A 38 7.946 2.878 3.377 1.00 0.00 H new ATOM 0 HD2 TYR A 38 12.048 3.762 2.633 1.00 0.00 H new ATOM 0 HE1 TYR A 38 7.364 5.317 3.027 1.00 0.00 H new ATOM 0 HE2 TYR A 38 11.452 6.198 2.286 1.00 0.00 H new ATOM 0 HH TYR A 38 9.886 7.702 2.490 1.00 0.00 H new ATOM 607 N LYS A 39 11.994 -0.715 1.600 1.00 0.00 N ATOM 608 CA LYS A 39 12.729 -1.962 1.732 1.00 0.00 C ATOM 609 C LYS A 39 12.795 -2.355 3.209 1.00 0.00 C ATOM 610 O LYS A 39 12.497 -3.494 3.565 1.00 0.00 O ATOM 611 CB LYS A 39 14.100 -1.848 1.064 1.00 0.00 C ATOM 612 CG LYS A 39 13.959 -1.605 -0.440 1.00 0.00 C ATOM 613 CD LYS A 39 15.319 -1.679 -1.138 1.00 0.00 C ATOM 614 CE LYS A 39 15.297 -2.706 -2.272 1.00 0.00 C ATOM 615 NZ LYS A 39 16.626 -3.342 -2.421 1.00 0.00 N ATOM 0 H LYS A 39 12.436 -0.021 0.997 1.00 0.00 H new ATOM 0 HA LYS A 39 12.212 -2.767 1.210 1.00 0.00 H new ATOM 0 HB2 LYS A 39 14.662 -1.031 1.517 1.00 0.00 H new ATOM 0 HB3 LYS A 39 14.670 -2.761 1.237 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.285 -2.346 -0.870 1.00 0.00 H new ATOM 0 HG3 LYS A 39 13.510 -0.627 -0.613 1.00 0.00 H new ATOM 0 HD2 LYS A 39 15.582 -0.699 -1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 39 16.089 -1.947 -0.415 1.00 0.00 H new ATOM 0 HE2 LYS A 39 14.544 -3.467 -2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 39 15.013 -2.220 -3.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 16.594 -4.036 -3.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 17.337 -2.614 -2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 16.882 -3.823 -1.535 1.00 0.00 H new ATOM 629 N THR A 40 13.187 -1.391 4.029 1.00 0.00 N ATOM 630 CA THR A 40 13.295 -1.622 5.459 1.00 0.00 C ATOM 631 C THR A 40 12.985 -0.339 6.232 1.00 0.00 C ATOM 632 O THR A 40 12.834 0.727 5.637 1.00 0.00 O ATOM 633 CB THR A 40 14.692 -2.180 5.743 1.00 0.00 C ATOM 634 OG1 THR A 40 14.869 -1.977 7.142 1.00 0.00 O ATOM 635 CG2 THR A 40 15.799 -1.341 5.101 1.00 0.00 C ATOM 0 H THR A 40 13.434 -0.448 3.730 1.00 0.00 H new ATOM 0 HA THR A 40 12.561 -2.353 5.798 1.00 0.00 H new ATOM 0 HB THR A 40 14.755 -3.205 5.377 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.749 -2.312 7.412 1.00 0.00 H new ATOM 0 HG21 THR A 40 16.769 -1.780 5.333 1.00 0.00 H new ATOM 0 HG22 THR A 40 15.659 -1.320 4.020 1.00 0.00 H new ATOM 0 HG23 THR A 40 15.758 -0.324 5.492 1.00 0.00 H new ATOM 643 N GLN A 41 12.900 -0.484 7.546 1.00 0.00 N ATOM 644 CA GLN A 41 12.610 0.650 8.407 1.00 0.00 C ATOM 645 C GLN A 41 13.909 1.337 8.834 1.00 0.00 C ATOM 646 O GLN A 41 13.924 2.541 9.089 1.00 0.00 O ATOM 647 CB GLN A 41 11.791 0.219 9.625 1.00 0.00 C ATOM 648 CG GLN A 41 10.385 0.821 9.582 1.00 0.00 C ATOM 649 CD GLN A 41 10.319 2.119 10.390 1.00 0.00 C ATOM 650 OE1 GLN A 41 10.645 3.194 9.914 1.00 0.00 O ATOM 651 NE2 GLN A 41 9.881 1.958 11.636 1.00 0.00 N ATOM 0 H GLN A 41 13.027 -1.370 8.036 1.00 0.00 H new ATOM 0 HA GLN A 41 12.011 1.366 7.844 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.724 -0.868 9.656 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.297 0.533 10.538 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.101 1.017 8.548 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.666 0.104 9.979 1.00 0.00 H new ATOM 0 HE21 GLN A 41 9.625 1.029 11.970 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.801 2.763 12.257 1.00 0.00 H new ATOM 660 N LYS A 42 14.967 0.543 8.900 1.00 0.00 N ATOM 661 CA LYS A 42 16.267 1.060 9.292 1.00 0.00 C ATOM 662 C LYS A 42 16.788 2.000 8.203 1.00 0.00 C ATOM 663 O LYS A 42 16.455 3.184 8.188 1.00 0.00 O ATOM 664 CB LYS A 42 17.223 -0.088 9.622 1.00 0.00 C ATOM 665 CG LYS A 42 17.042 -0.554 11.068 1.00 0.00 C ATOM 666 CD LYS A 42 15.988 -1.659 11.161 1.00 0.00 C ATOM 667 CE LYS A 42 16.399 -2.726 12.177 1.00 0.00 C ATOM 668 NZ LYS A 42 16.079 -4.078 11.667 1.00 0.00 N ATOM 0 H LYS A 42 14.951 -0.455 8.689 1.00 0.00 H new ATOM 0 HA LYS A 42 16.183 1.647 10.206 1.00 0.00 H new ATOM 0 HB2 LYS A 42 17.044 -0.921 8.943 1.00 0.00 H new ATOM 0 HB3 LYS A 42 18.252 0.235 9.466 1.00 0.00 H new ATOM 0 HG2 LYS A 42 17.992 -0.919 11.458 1.00 0.00 H new ATOM 0 HG3 LYS A 42 16.745 0.290 11.691 1.00 0.00 H new ATOM 0 HD2 LYS A 42 15.029 -1.228 11.449 1.00 0.00 H new ATOM 0 HD3 LYS A 42 15.850 -2.118 10.182 1.00 0.00 H new ATOM 0 HE2 LYS A 42 17.467 -2.651 12.380 1.00 0.00 H new ATOM 0 HE3 LYS A 42 15.882 -2.555 13.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 16.364 -4.790 12.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 15.056 -4.151 11.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 16.592 -4.244 10.777 1.00 0.00 H new ATOM 682 N ASN A 43 17.596 1.436 7.316 1.00 0.00 N ATOM 683 CA ASN A 43 18.165 2.209 6.226 1.00 0.00 C ATOM 684 C ASN A 43 17.064 3.043 5.567 1.00 0.00 C ATOM 685 O ASN A 43 17.076 4.270 5.651 1.00 0.00 O ATOM 686 CB ASN A 43 18.767 1.293 5.158 1.00 0.00 C ATOM 687 CG ASN A 43 20.286 1.192 5.315 1.00 0.00 C ATOM 688 OD1 ASN A 43 20.842 1.420 6.377 1.00 0.00 O ATOM 689 ND2 ASN A 43 20.922 0.837 4.203 1.00 0.00 N ATOM 0 H ASN A 43 17.869 0.453 7.331 1.00 0.00 H new ATOM 0 HA ASN A 43 18.947 2.847 6.638 1.00 0.00 H new ATOM 0 HB2 ASN A 43 18.323 0.300 5.233 1.00 0.00 H new ATOM 0 HB3 ASN A 43 18.525 1.676 4.167 1.00 0.00 H new ATOM 0 HD21 ASN A 43 21.937 0.741 4.205 1.00 0.00 H new ATOM 0 HD22 ASN A 43 20.395 0.661 3.348 1.00 0.00 H new ATOM 696 N GLY A 44 16.139 2.343 4.927 1.00 0.00 N ATOM 697 CA GLY A 44 15.033 3.003 4.255 1.00 0.00 C ATOM 698 C GLY A 44 15.466 3.547 2.892 1.00 0.00 C ATOM 699 O GLY A 44 15.890 4.697 2.785 1.00 0.00 O ATOM 0 H GLY A 44 16.133 1.325 4.860 1.00 0.00 H new ATOM 0 HA2 GLY A 44 14.210 2.300 4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 44 14.661 3.819 4.875 1.00 0.00 H new ATOM 703 N GLN A 45 15.343 2.696 1.885 1.00 0.00 N ATOM 704 CA GLN A 45 15.716 3.077 0.533 1.00 0.00 C ATOM 705 C GLN A 45 14.468 3.394 -0.293 1.00 0.00 C ATOM 706 O GLN A 45 14.571 3.845 -1.432 1.00 0.00 O ATOM 707 CB GLN A 45 16.552 1.983 -0.134 1.00 0.00 C ATOM 708 CG GLN A 45 17.490 1.317 0.875 1.00 0.00 C ATOM 709 CD GLN A 45 18.661 0.633 0.167 1.00 0.00 C ATOM 710 OE1 GLN A 45 19.045 0.987 -0.936 1.00 0.00 O ATOM 711 NE2 GLN A 45 19.205 -0.363 0.859 1.00 0.00 N ATOM 0 H GLN A 45 14.990 1.743 1.978 1.00 0.00 H new ATOM 0 HA GLN A 45 16.330 3.976 0.586 1.00 0.00 H new ATOM 0 HB2 GLN A 45 15.893 1.234 -0.573 1.00 0.00 H new ATOM 0 HB3 GLN A 45 17.135 2.412 -0.949 1.00 0.00 H new ATOM 0 HG2 GLN A 45 17.869 2.064 1.573 1.00 0.00 H new ATOM 0 HG3 GLN A 45 16.937 0.584 1.462 1.00 0.00 H new ATOM 0 HE21 GLN A 45 18.835 -0.608 1.777 1.00 0.00 H new ATOM 0 HE22 GLN A 45 19.993 -0.882 0.472 1.00 0.00 H new ATOM 720 N TRP A 46 13.316 3.144 0.314 1.00 0.00 N ATOM 721 CA TRP A 46 12.050 3.397 -0.351 1.00 0.00 C ATOM 722 C TRP A 46 11.916 2.404 -1.507 1.00 0.00 C ATOM 723 O TRP A 46 12.917 1.952 -2.061 1.00 0.00 O ATOM 724 CB TRP A 46 11.949 4.856 -0.802 1.00 0.00 C ATOM 725 CG TRP A 46 10.609 5.217 -1.447 1.00 0.00 C ATOM 726 CD1 TRP A 46 9.379 5.052 -0.942 1.00 0.00 C ATOM 727 CD2 TRP A 46 10.415 5.814 -2.747 1.00 0.00 C ATOM 728 NE1 TRP A 46 8.409 5.497 -1.818 1.00 0.00 N ATOM 729 CE2 TRP A 46 9.059 5.975 -2.950 1.00 0.00 C ATOM 730 CE3 TRP A 46 11.352 6.205 -3.718 1.00 0.00 C ATOM 731 CZ2 TRP A 46 8.519 6.530 -4.116 1.00 0.00 C ATOM 732 CZ3 TRP A 46 10.797 6.758 -4.878 1.00 0.00 C ATOM 733 CH2 TRP A 46 9.435 6.927 -5.098 1.00 0.00 C ATOM 0 H TRP A 46 13.234 2.769 1.259 1.00 0.00 H new ATOM 0 HA TRP A 46 11.217 3.246 0.336 1.00 0.00 H new ATOM 0 HB2 TRP A 46 12.112 5.504 0.059 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.750 5.062 -1.512 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.172 4.625 0.028 1.00 0.00 H new ATOM 0 HE1 TRP A 46 7.401 5.478 -1.663 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.417 6.088 -3.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 7.454 6.646 -4.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 11.475 7.076 -5.657 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.085 7.363 -6.022 1.00 0.00 H new ATOM 744 N VAL A 47 10.671 2.093 -1.836 1.00 0.00 N ATOM 745 CA VAL A 47 10.393 1.161 -2.916 1.00 0.00 C ATOM 746 C VAL A 47 9.454 1.823 -3.926 1.00 0.00 C ATOM 747 O VAL A 47 9.774 1.913 -5.110 1.00 0.00 O ATOM 748 CB VAL A 47 9.835 -0.146 -2.349 1.00 0.00 C ATOM 749 CG1 VAL A 47 9.396 -1.087 -3.472 1.00 0.00 C ATOM 750 CG2 VAL A 47 10.855 -0.825 -1.432 1.00 0.00 C ATOM 0 H VAL A 47 9.843 2.470 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 47 11.311 0.905 -3.445 1.00 0.00 H new ATOM 0 HB VAL A 47 8.956 0.096 -1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 47 9.003 -2.008 -3.042 1.00 0.00 H new ATOM 0 HG12 VAL A 47 8.621 -0.605 -4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.251 -1.319 -4.108 1.00 0.00 H new ATOM 0 HG21 VAL A 47 10.434 -1.752 -1.042 1.00 0.00 H new ATOM 0 HG22 VAL A 47 11.760 -1.047 -1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 47 11.098 -0.160 -0.603 1.00 0.00 H new ATOM 760 N GLY A 48 8.313 2.269 -3.421 1.00 0.00 N ATOM 761 CA GLY A 48 7.325 2.920 -4.265 1.00 0.00 C ATOM 762 C GLY A 48 6.133 3.407 -3.438 1.00 0.00 C ATOM 763 O GLY A 48 6.002 3.058 -2.266 1.00 0.00 O ATOM 0 H GLY A 48 8.051 2.192 -2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 48 7.782 3.764 -4.782 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.981 2.225 -5.031 1.00 0.00 H new ATOM 767 N THR A 49 5.294 4.205 -4.081 1.00 0.00 N ATOM 768 CA THR A 49 4.117 4.743 -3.420 1.00 0.00 C ATOM 769 C THR A 49 2.848 4.314 -4.158 1.00 0.00 C ATOM 770 O THR A 49 2.800 4.343 -5.387 1.00 0.00 O ATOM 771 CB THR A 49 4.281 6.261 -3.325 1.00 0.00 C ATOM 772 OG1 THR A 49 5.232 6.444 -2.279 1.00 0.00 O ATOM 773 CG2 THR A 49 3.020 6.955 -2.807 1.00 0.00 C ATOM 0 H THR A 49 5.406 4.492 -5.053 1.00 0.00 H new ATOM 0 HA THR A 49 4.016 4.348 -2.409 1.00 0.00 H new ATOM 0 HB THR A 49 4.538 6.660 -4.306 1.00 0.00 H new ATOM 0 HG1 THR A 49 5.398 7.401 -2.152 1.00 0.00 H new ATOM 0 HG21 THR A 49 3.190 8.031 -2.759 1.00 0.00 H new ATOM 0 HG22 THR A 49 2.188 6.749 -3.481 1.00 0.00 H new ATOM 0 HG23 THR A 49 2.781 6.581 -1.812 1.00 0.00 H new ATOM 781 N VAL A 50 1.851 3.925 -3.377 1.00 0.00 N ATOM 782 CA VAL A 50 0.584 3.490 -3.941 1.00 0.00 C ATOM 783 C VAL A 50 -0.459 4.593 -3.752 1.00 0.00 C ATOM 784 O VAL A 50 -0.652 5.087 -2.642 1.00 0.00 O ATOM 785 CB VAL A 50 0.164 2.157 -3.318 1.00 0.00 C ATOM 786 CG1 VAL A 50 -1.123 1.634 -3.958 1.00 0.00 C ATOM 787 CG2 VAL A 50 1.288 1.124 -3.423 1.00 0.00 C ATOM 0 H VAL A 50 1.895 3.902 -2.358 1.00 0.00 H new ATOM 0 HA VAL A 50 0.683 3.316 -5.012 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.034 2.330 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.399 0.686 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.924 2.358 -3.808 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.964 1.486 -5.026 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.963 0.186 -2.973 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.532 0.958 -4.472 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.170 1.492 -2.899 1.00 0.00 H new ATOM 797 N LEU A 51 -1.104 4.948 -4.854 1.00 0.00 N ATOM 798 CA LEU A 51 -2.122 5.984 -4.823 1.00 0.00 C ATOM 799 C LEU A 51 -3.491 5.341 -4.589 1.00 0.00 C ATOM 800 O LEU A 51 -3.852 4.378 -5.264 1.00 0.00 O ATOM 801 CB LEU A 51 -2.054 6.840 -6.090 1.00 0.00 C ATOM 802 CG LEU A 51 -0.799 7.700 -6.251 1.00 0.00 C ATOM 803 CD1 LEU A 51 -1.046 8.852 -7.227 1.00 0.00 C ATOM 804 CD2 LEU A 51 -0.297 8.197 -4.894 1.00 0.00 C ATOM 0 H LEU A 51 -0.941 4.537 -5.773 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.944 6.668 -3.993 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.132 6.181 -6.955 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.925 7.496 -6.109 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.012 7.079 -6.678 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.138 9.448 -7.324 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.322 8.450 -8.202 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.854 9.480 -6.852 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.596 8.806 -5.037 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.072 8.796 -4.417 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.056 7.343 -4.260 1.00 0.00 H new ATOM 816 N LEU A 52 -4.215 5.900 -3.630 1.00 0.00 N ATOM 817 CA LEU A 52 -5.536 5.393 -3.298 1.00 0.00 C ATOM 818 C LEU A 52 -6.589 6.428 -3.696 1.00 0.00 C ATOM 819 O LEU A 52 -7.457 6.775 -2.897 1.00 0.00 O ATOM 820 CB LEU A 52 -5.599 4.987 -1.824 1.00 0.00 C ATOM 821 CG LEU A 52 -4.265 4.617 -1.173 1.00 0.00 C ATOM 822 CD1 LEU A 52 -4.388 4.591 0.352 1.00 0.00 C ATOM 823 CD2 LEU A 52 -3.731 3.295 -1.727 1.00 0.00 C ATOM 0 H LEU A 52 -3.912 6.699 -3.073 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.750 4.486 -3.864 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.040 5.809 -1.260 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.275 4.137 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.537 5.388 -1.425 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.426 4.325 0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.690 5.575 0.709 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -5.136 3.854 0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.782 3.056 -1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.449 2.500 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.581 3.386 -2.803 1.00 0.00 H new ATOM 835 N ASN A 53 -6.479 6.892 -4.933 1.00 0.00 N ATOM 836 CA ASN A 53 -7.412 7.880 -5.447 1.00 0.00 C ATOM 837 C ASN A 53 -8.841 7.357 -5.291 1.00 0.00 C ATOM 838 O ASN A 53 -9.764 8.128 -5.035 1.00 0.00 O ATOM 839 CB ASN A 53 -7.166 8.149 -6.933 1.00 0.00 C ATOM 840 CG ASN A 53 -6.894 9.633 -7.184 1.00 0.00 C ATOM 841 OD1 ASN A 53 -7.687 10.344 -7.781 1.00 0.00 O ATOM 842 ND2 ASN A 53 -5.732 10.060 -6.698 1.00 0.00 N ATOM 0 H ASN A 53 -5.758 6.602 -5.594 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.269 8.803 -4.885 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -6.318 7.557 -7.278 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.033 7.832 -7.512 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -5.458 11.035 -6.815 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -5.115 9.412 -6.208 1.00 0.00 H new ATOM 849 N ALA A 54 -8.979 6.049 -5.451 1.00 0.00 N ATOM 850 CA ALA A 54 -10.280 5.413 -5.331 1.00 0.00 C ATOM 851 C ALA A 54 -10.125 3.904 -5.528 1.00 0.00 C ATOM 852 O ALA A 54 -10.674 3.338 -6.472 1.00 0.00 O ATOM 853 CB ALA A 54 -11.248 6.036 -6.338 1.00 0.00 C ATOM 0 H ALA A 54 -8.211 5.412 -5.663 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.696 5.575 -4.337 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.224 5.559 -6.248 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -11.346 7.103 -6.137 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.865 5.891 -7.348 1.00 0.00 H new ATOM 859 N CYS A 55 -9.374 3.294 -4.622 1.00 0.00 N ATOM 860 CA CYS A 55 -9.140 1.862 -4.684 1.00 0.00 C ATOM 861 C CYS A 55 -10.084 1.177 -3.694 1.00 0.00 C ATOM 862 O CYS A 55 -10.646 1.829 -2.815 1.00 0.00 O ATOM 863 CB CYS A 55 -7.676 1.515 -4.409 1.00 0.00 C ATOM 864 SG CYS A 55 -6.582 2.533 -5.466 1.00 0.00 S ATOM 0 H CYS A 55 -8.920 3.767 -3.841 1.00 0.00 H new ATOM 0 HA CYS A 55 -9.347 1.501 -5.691 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.444 1.688 -3.358 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -7.502 0.457 -4.604 1.00 0.00 H new ATOM 0 HG CYS A 55 -5.341 2.232 -5.223 1.00 0.00 H new ATOM 870 N GLU A 56 -10.230 -0.128 -3.870 1.00 0.00 N ATOM 871 CA GLU A 56 -11.097 -0.908 -3.003 1.00 0.00 C ATOM 872 C GLU A 56 -10.378 -2.175 -2.536 1.00 0.00 C ATOM 873 O GLU A 56 -9.263 -2.458 -2.972 1.00 0.00 O ATOM 874 CB GLU A 56 -12.412 -1.250 -3.706 1.00 0.00 C ATOM 875 CG GLU A 56 -13.414 -0.101 -3.585 1.00 0.00 C ATOM 876 CD GLU A 56 -14.755 -0.598 -3.042 1.00 0.00 C ATOM 877 OE1 GLU A 56 -15.160 -1.705 -3.458 1.00 0.00 O ATOM 878 OE2 GLU A 56 -15.346 0.140 -2.225 1.00 0.00 O ATOM 0 H GLU A 56 -9.762 -0.665 -4.600 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.339 -0.307 -2.126 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.222 -1.462 -4.758 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.837 -2.155 -3.271 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.013 0.668 -2.925 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.562 0.362 -4.561 1.00 0.00 H new ATOM 885 N ILE A 57 -11.047 -2.905 -1.655 1.00 0.00 N ATOM 886 CA ILE A 57 -10.486 -4.136 -1.124 1.00 0.00 C ATOM 887 C ILE A 57 -11.507 -5.265 -1.278 1.00 0.00 C ATOM 888 O ILE A 57 -12.707 -5.047 -1.118 1.00 0.00 O ATOM 889 CB ILE A 57 -10.009 -3.931 0.315 1.00 0.00 C ATOM 890 CG1 ILE A 57 -8.481 -3.887 0.386 1.00 0.00 C ATOM 891 CG2 ILE A 57 -10.596 -4.995 1.245 1.00 0.00 C ATOM 892 CD1 ILE A 57 -7.995 -2.541 0.928 1.00 0.00 C ATOM 0 H ILE A 57 -11.972 -2.668 -1.296 1.00 0.00 H new ATOM 0 HA ILE A 57 -9.601 -4.426 -1.690 1.00 0.00 H new ATOM 0 HB ILE A 57 -10.375 -2.964 0.661 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.120 -4.692 1.026 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -8.062 -4.056 -0.606 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -10.241 -4.826 2.261 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -11.684 -4.934 1.226 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -10.282 -5.984 0.911 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -6.906 -2.537 0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.337 -1.740 0.273 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.395 -2.386 1.930 1.00 0.00 H new ATOM 904 N ILE A 58 -10.993 -6.447 -1.586 1.00 0.00 N ATOM 905 CA ILE A 58 -11.846 -7.610 -1.764 1.00 0.00 C ATOM 906 C ILE A 58 -11.393 -8.719 -0.812 1.00 0.00 C ATOM 907 O ILE A 58 -12.216 -9.468 -0.289 1.00 0.00 O ATOM 908 CB ILE A 58 -11.874 -8.034 -3.233 1.00 0.00 C ATOM 909 CG1 ILE A 58 -10.460 -8.297 -3.755 1.00 0.00 C ATOM 910 CG2 ILE A 58 -12.618 -7.006 -4.087 1.00 0.00 C ATOM 911 CD1 ILE A 58 -10.274 -9.772 -4.118 1.00 0.00 C ATOM 0 H ILE A 58 -9.997 -6.624 -1.717 1.00 0.00 H new ATOM 0 HA ILE A 58 -12.877 -7.369 -1.506 1.00 0.00 H new ATOM 0 HB ILE A 58 -12.424 -8.972 -3.307 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -10.271 -7.677 -4.631 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -9.730 -8.010 -2.998 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -12.623 -7.332 -5.127 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -13.644 -6.912 -3.731 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -12.118 -6.040 -4.012 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.260 -9.931 -4.486 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.440 -10.388 -3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -10.989 -10.049 -4.893 1.00 0.00 H new ATOM 923 N GLU A 59 -10.084 -8.789 -0.616 1.00 0.00 N ATOM 924 CA GLU A 59 -9.512 -9.793 0.263 1.00 0.00 C ATOM 925 C GLU A 59 -9.143 -11.048 -0.532 1.00 0.00 C ATOM 926 O GLU A 59 -9.734 -11.321 -1.576 1.00 0.00 O ATOM 927 CB GLU A 59 -10.470 -10.131 1.407 1.00 0.00 C ATOM 928 CG GLU A 59 -9.703 -10.607 2.643 1.00 0.00 C ATOM 929 CD GLU A 59 -10.665 -11.006 3.764 1.00 0.00 C ATOM 930 OE1 GLU A 59 -11.676 -10.289 3.927 1.00 0.00 O ATOM 931 OE2 GLU A 59 -10.367 -12.019 4.434 1.00 0.00 O ATOM 0 H GLU A 59 -9.404 -8.166 -1.052 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.602 -9.385 0.703 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.065 -9.253 1.659 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.166 -10.906 1.086 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.073 -11.457 2.380 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.041 -9.815 2.992 1.00 0.00 H new ATOM 938 N ARG A 60 -8.169 -11.777 -0.008 1.00 0.00 N ATOM 939 CA ARG A 60 -7.716 -12.996 -0.656 1.00 0.00 C ATOM 940 C ARG A 60 -6.840 -13.810 0.298 1.00 0.00 C ATOM 941 O ARG A 60 -5.620 -13.855 0.142 1.00 0.00 O ATOM 942 CB ARG A 60 -6.920 -12.682 -1.925 1.00 0.00 C ATOM 943 CG ARG A 60 -7.836 -12.640 -3.150 1.00 0.00 C ATOM 944 CD ARG A 60 -7.353 -13.612 -4.228 1.00 0.00 C ATOM 945 NE ARG A 60 -8.063 -14.904 -4.100 1.00 0.00 N ATOM 946 CZ ARG A 60 -8.080 -15.850 -5.049 1.00 0.00 C ATOM 947 NH1 ARG A 60 -7.427 -15.653 -6.203 1.00 0.00 N ATOM 948 NH2 ARG A 60 -8.751 -16.992 -4.845 1.00 0.00 N ATOM 0 H ARG A 60 -7.681 -11.547 0.858 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.599 -13.575 -0.928 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -6.413 -11.724 -1.813 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.147 -13.437 -2.070 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.854 -12.894 -2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -7.864 -11.628 -3.554 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -7.528 -13.188 -5.217 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.278 -13.767 -4.134 1.00 0.00 H new ATOM 0 HE ARG A 60 -8.572 -15.086 -3.235 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.917 -14.783 -6.359 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.440 -16.373 -6.926 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -9.249 -17.141 -3.967 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.764 -17.712 -5.567 1.00 0.00 H new ATOM 962 N PRO A 61 -7.513 -14.450 1.292 1.00 0.00 N ATOM 963 CA PRO A 61 -6.809 -15.260 2.271 1.00 0.00 C ATOM 964 C PRO A 61 -6.367 -16.593 1.665 1.00 0.00 C ATOM 965 O PRO A 61 -5.670 -17.373 2.312 1.00 0.00 O ATOM 966 CB PRO A 61 -7.789 -15.426 3.421 1.00 0.00 C ATOM 967 CG PRO A 61 -9.160 -15.101 2.851 1.00 0.00 C ATOM 968 CD PRO A 61 -8.956 -14.419 1.508 1.00 0.00 C ATOM 0 HA PRO A 61 -5.885 -14.795 2.616 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -7.761 -16.442 3.815 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -7.540 -14.758 4.245 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -9.749 -16.010 2.732 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.711 -14.450 3.530 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -9.487 -14.943 0.713 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.332 -13.396 1.522 1.00 0.00 H new ATOM 976 N SER A 62 -6.791 -16.814 0.429 1.00 0.00 N ATOM 977 CA SER A 62 -6.447 -18.039 -0.273 1.00 0.00 C ATOM 978 C SER A 62 -6.819 -19.253 0.582 1.00 0.00 C ATOM 979 O SER A 62 -7.335 -19.103 1.688 1.00 0.00 O ATOM 980 CB SER A 62 -4.959 -18.074 -0.624 1.00 0.00 C ATOM 981 OG SER A 62 -4.522 -16.854 -1.218 1.00 0.00 O ATOM 0 H SER A 62 -7.370 -16.165 -0.104 1.00 0.00 H new ATOM 0 HA SER A 62 -7.013 -18.070 -1.204 1.00 0.00 H new ATOM 0 HB2 SER A 62 -4.378 -18.267 0.278 1.00 0.00 H new ATOM 0 HB3 SER A 62 -4.767 -18.900 -1.309 1.00 0.00 H new ATOM 0 HG SER A 62 -3.566 -16.915 -1.426 1.00 0.00 H new ATOM 987 N LYS A 63 -6.543 -20.428 0.035 1.00 0.00 N ATOM 988 CA LYS A 63 -6.842 -21.666 0.734 1.00 0.00 C ATOM 989 C LYS A 63 -5.873 -21.833 1.906 1.00 0.00 C ATOM 990 O LYS A 63 -4.840 -22.488 1.774 1.00 0.00 O ATOM 991 CB LYS A 63 -6.837 -22.846 -0.241 1.00 0.00 C ATOM 992 CG LYS A 63 -8.155 -22.924 -1.014 1.00 0.00 C ATOM 993 CD LYS A 63 -8.957 -24.161 -0.606 1.00 0.00 C ATOM 994 CE LYS A 63 -9.795 -24.681 -1.776 1.00 0.00 C ATOM 995 NZ LYS A 63 -10.876 -23.725 -2.105 1.00 0.00 N ATOM 0 H LYS A 63 -6.116 -20.549 -0.883 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.847 -21.633 1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -6.007 -22.741 -0.940 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -6.677 -23.775 0.307 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.744 -22.026 -0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -7.952 -22.955 -2.084 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.278 -24.943 -0.264 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.609 -23.916 0.232 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.158 -24.833 -2.648 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.224 -25.650 -1.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.466 -24.117 -2.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -11.463 -23.561 -1.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -10.460 -22.824 -2.417 1.00 0.00 H new ATOM 1009 N LYS A 64 -6.241 -21.229 3.026 1.00 0.00 N ATOM 1010 CA LYS A 64 -5.416 -21.302 4.221 1.00 0.00 C ATOM 1011 C LYS A 64 -4.045 -20.692 3.927 1.00 0.00 C ATOM 1012 O LYS A 64 -3.288 -21.219 3.113 1.00 0.00 O ATOM 1013 CB LYS A 64 -5.352 -22.740 4.740 1.00 0.00 C ATOM 1014 CG LYS A 64 -6.727 -23.214 5.214 1.00 0.00 C ATOM 1015 CD LYS A 64 -6.840 -23.131 6.738 1.00 0.00 C ATOM 1016 CE LYS A 64 -8.228 -22.644 7.158 1.00 0.00 C ATOM 1017 NZ LYS A 64 -8.216 -21.183 7.392 1.00 0.00 N ATOM 0 H LYS A 64 -7.099 -20.687 3.132 1.00 0.00 H new ATOM 0 HA LYS A 64 -5.859 -20.716 5.027 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.988 -23.399 3.952 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.639 -22.802 5.562 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -7.504 -22.604 4.754 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -6.894 -24.241 4.889 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -6.647 -24.111 7.175 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -6.080 -22.453 7.126 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -8.955 -22.888 6.384 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -8.542 -23.161 8.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.166 -20.869 7.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -7.537 -20.958 8.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -7.937 -20.694 6.518 1.00 0.00 H new ATOM 1031 N ASP A 65 -3.765 -19.589 4.605 1.00 0.00 N ATOM 1032 CA ASP A 65 -2.498 -18.901 4.427 1.00 0.00 C ATOM 1033 C ASP A 65 -2.565 -17.533 5.108 1.00 0.00 C ATOM 1034 O ASP A 65 -2.607 -16.503 4.437 1.00 0.00 O ATOM 1035 CB ASP A 65 -2.197 -18.677 2.944 1.00 0.00 C ATOM 1036 CG ASP A 65 -1.258 -19.706 2.312 1.00 0.00 C ATOM 1037 OD1 ASP A 65 -0.953 -20.699 3.008 1.00 0.00 O ATOM 1038 OD2 ASP A 65 -0.867 -19.478 1.147 1.00 0.00 O ATOM 0 H ASP A 65 -4.395 -19.154 5.279 1.00 0.00 H new ATOM 0 HA ASP A 65 -1.714 -19.519 4.865 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.138 -18.680 2.393 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.760 -17.686 2.823 1.00 0.00 H new ATOM 1043 N GLY A 66 -2.571 -17.566 6.433 1.00 0.00 N ATOM 1044 CA GLY A 66 -2.632 -16.341 7.212 1.00 0.00 C ATOM 1045 C GLY A 66 -3.811 -15.471 6.774 1.00 0.00 C ATOM 1046 O GLY A 66 -4.950 -15.717 7.168 1.00 0.00 O ATOM 0 H GLY A 66 -2.535 -18.422 6.986 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.728 -16.583 8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.702 -15.785 7.095 1.00 0.00 H new ATOM 1050 N PHE A 67 -3.498 -14.470 5.963 1.00 0.00 N ATOM 1051 CA PHE A 67 -4.517 -13.562 5.467 1.00 0.00 C ATOM 1052 C PHE A 67 -3.914 -12.532 4.508 1.00 0.00 C ATOM 1053 O PHE A 67 -2.957 -11.842 4.855 1.00 0.00 O ATOM 1054 CB PHE A 67 -5.096 -12.832 6.681 1.00 0.00 C ATOM 1055 CG PHE A 67 -6.370 -12.041 6.382 1.00 0.00 C ATOM 1056 CD1 PHE A 67 -6.332 -10.991 5.518 1.00 0.00 C ATOM 1057 CD2 PHE A 67 -7.542 -12.386 6.980 1.00 0.00 C ATOM 1058 CE1 PHE A 67 -7.515 -10.256 5.240 1.00 0.00 C ATOM 1059 CE2 PHE A 67 -8.725 -11.652 6.703 1.00 0.00 C ATOM 1060 CZ PHE A 67 -8.686 -10.602 5.838 1.00 0.00 C ATOM 0 H PHE A 67 -2.553 -14.269 5.638 1.00 0.00 H new ATOM 0 HA PHE A 67 -5.281 -14.120 4.926 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -5.308 -13.561 7.463 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.342 -12.151 7.076 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -5.402 -10.716 5.043 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -7.573 -13.219 7.666 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -7.484 -9.423 4.554 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -9.655 -11.927 7.178 1.00 0.00 H new ATOM 0 HZ PHE A 67 -9.586 -10.043 5.626 1.00 0.00 H new ATOM 1070 N CYS A 68 -4.500 -12.462 3.322 1.00 0.00 N ATOM 1071 CA CYS A 68 -4.032 -11.529 2.311 1.00 0.00 C ATOM 1072 C CYS A 68 -5.252 -10.947 1.593 1.00 0.00 C ATOM 1073 O CYS A 68 -6.349 -11.498 1.681 1.00 0.00 O ATOM 1074 CB CYS A 68 -3.059 -12.193 1.335 1.00 0.00 C ATOM 1075 SG CYS A 68 -1.461 -12.516 2.168 1.00 0.00 S ATOM 0 H CYS A 68 -5.294 -13.036 3.038 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.473 -10.724 2.787 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -3.482 -13.127 0.966 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -2.904 -11.550 0.469 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.634 -12.508 3.456 1.00 0.00 H new ATOM 1081 N PHE A 69 -5.020 -9.843 0.900 1.00 0.00 N ATOM 1082 CA PHE A 69 -6.086 -9.181 0.168 1.00 0.00 C ATOM 1083 C PHE A 69 -5.567 -8.596 -1.148 1.00 0.00 C ATOM 1084 O PHE A 69 -4.372 -8.660 -1.430 1.00 0.00 O ATOM 1085 CB PHE A 69 -6.596 -8.041 1.052 1.00 0.00 C ATOM 1086 CG PHE A 69 -5.511 -7.049 1.476 1.00 0.00 C ATOM 1087 CD1 PHE A 69 -4.507 -7.451 2.301 1.00 0.00 C ATOM 1088 CD2 PHE A 69 -5.550 -5.766 1.029 1.00 0.00 C ATOM 1089 CE1 PHE A 69 -3.500 -6.531 2.695 1.00 0.00 C ATOM 1090 CE2 PHE A 69 -4.543 -4.846 1.422 1.00 0.00 C ATOM 1091 CZ PHE A 69 -3.539 -5.248 2.247 1.00 0.00 C ATOM 0 H PHE A 69 -4.109 -9.390 0.830 1.00 0.00 H new ATOM 0 HA PHE A 69 -6.874 -9.896 -0.068 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -7.378 -7.502 0.517 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.055 -8.465 1.945 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -4.476 -8.470 2.656 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -6.347 -5.446 0.375 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -2.703 -6.850 3.350 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -4.574 -3.827 1.066 1.00 0.00 H new ATOM 0 HZ PHE A 69 -2.773 -4.548 2.546 1.00 0.00 H new ATOM 1101 N LYS A 70 -6.492 -8.041 -1.917 1.00 0.00 N ATOM 1102 CA LYS A 70 -6.143 -7.446 -3.196 1.00 0.00 C ATOM 1103 C LYS A 70 -6.852 -6.097 -3.336 1.00 0.00 C ATOM 1104 O LYS A 70 -8.059 -6.001 -3.123 1.00 0.00 O ATOM 1105 CB LYS A 70 -6.440 -8.419 -4.338 1.00 0.00 C ATOM 1106 CG LYS A 70 -6.134 -7.781 -5.695 1.00 0.00 C ATOM 1107 CD LYS A 70 -7.368 -7.072 -6.258 1.00 0.00 C ATOM 1108 CE LYS A 70 -8.064 -7.937 -7.311 1.00 0.00 C ATOM 1109 NZ LYS A 70 -7.228 -8.046 -8.527 1.00 0.00 N ATOM 0 H LYS A 70 -7.483 -7.991 -1.679 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.072 -7.250 -3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -5.844 -9.323 -4.214 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.487 -8.720 -4.301 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.317 -7.068 -5.589 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.800 -8.547 -6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.063 -6.847 -5.449 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.075 -6.120 -6.700 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.257 -8.930 -6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -9.031 -7.503 -7.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.832 -8.263 -9.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.734 -7.146 -8.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.530 -8.806 -8.401 1.00 0.00 H new ATOM 1123 N LEU A 71 -6.070 -5.089 -3.694 1.00 0.00 N ATOM 1124 CA LEU A 71 -6.608 -3.750 -3.865 1.00 0.00 C ATOM 1125 C LEU A 71 -6.366 -3.288 -5.304 1.00 0.00 C ATOM 1126 O LEU A 71 -5.227 -3.036 -5.695 1.00 0.00 O ATOM 1127 CB LEU A 71 -6.033 -2.802 -2.810 1.00 0.00 C ATOM 1128 CG LEU A 71 -6.497 -1.346 -2.892 1.00 0.00 C ATOM 1129 CD1 LEU A 71 -6.837 -0.800 -1.504 1.00 0.00 C ATOM 1130 CD2 LEU A 71 -5.460 -0.481 -3.611 1.00 0.00 C ATOM 0 H LEU A 71 -5.069 -5.173 -3.870 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.686 -3.750 -3.706 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -6.289 -3.189 -1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.946 -2.821 -2.887 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.412 -1.311 -3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.164 0.236 -1.591 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.636 -1.397 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.954 -0.850 -0.867 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.814 0.549 -3.656 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.516 -0.517 -3.067 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.310 -0.858 -4.623 1.00 0.00 H new ATOM 1142 N PHE A 72 -7.455 -3.190 -6.052 1.00 0.00 N ATOM 1143 CA PHE A 72 -7.375 -2.763 -7.438 1.00 0.00 C ATOM 1144 C PHE A 72 -8.137 -1.453 -7.653 1.00 0.00 C ATOM 1145 O PHE A 72 -8.881 -1.013 -6.778 1.00 0.00 O ATOM 1146 CB PHE A 72 -8.025 -3.861 -8.283 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.506 -4.089 -7.975 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -9.871 -4.914 -6.958 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -10.458 -3.465 -8.720 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -11.246 -5.125 -6.672 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -11.833 -3.676 -8.435 1.00 0.00 C ATOM 1152 CZ PHE A 72 -12.198 -4.501 -7.417 1.00 0.00 C ATOM 0 H PHE A 72 -8.398 -3.399 -5.724 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.334 -2.597 -7.717 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.919 -3.605 -9.337 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.484 -4.794 -8.126 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -9.115 -5.409 -6.367 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -10.168 -2.809 -9.528 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -11.536 -5.780 -5.864 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -12.589 -3.181 -9.027 1.00 0.00 H new ATOM 0 HZ PHE A 72 -13.244 -4.661 -7.200 1.00 0.00 H new ATOM 1162 N HIS A 73 -7.924 -0.868 -8.822 1.00 0.00 N ATOM 1163 CA HIS A 73 -8.581 0.383 -9.163 1.00 0.00 C ATOM 1164 C HIS A 73 -9.583 0.144 -10.295 1.00 0.00 C ATOM 1165 O HIS A 73 -9.209 -0.316 -11.373 1.00 0.00 O ATOM 1166 CB HIS A 73 -7.551 1.463 -9.501 1.00 0.00 C ATOM 1167 CG HIS A 73 -7.984 2.861 -9.129 1.00 0.00 C ATOM 1168 ND1 HIS A 73 -9.161 3.428 -9.585 1.00 0.00 N ATOM 1169 CD2 HIS A 73 -7.385 3.799 -8.340 1.00 0.00 C ATOM 1170 CE1 HIS A 73 -9.256 4.652 -9.088 1.00 0.00 C ATOM 1171 NE2 HIS A 73 -8.155 4.881 -8.317 1.00 0.00 N ATOM 0 H HIS A 73 -7.306 -1.236 -9.545 1.00 0.00 H new ATOM 0 HA HIS A 73 -9.139 0.752 -8.302 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -6.617 1.234 -8.987 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.343 1.430 -10.570 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -6.445 3.682 -7.822 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -10.064 5.347 -9.263 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -7.956 5.741 -7.807 1.00 0.00 H new ATOM 1179 N PRO A 74 -10.869 0.477 -10.003 1.00 0.00 N ATOM 1180 CA PRO A 74 -11.927 0.303 -10.984 1.00 0.00 C ATOM 1181 C PRO A 74 -11.856 1.385 -12.064 1.00 0.00 C ATOM 1182 O PRO A 74 -11.954 1.087 -13.253 1.00 0.00 O ATOM 1183 CB PRO A 74 -13.217 0.349 -10.182 1.00 0.00 C ATOM 1184 CG PRO A 74 -12.863 1.007 -8.859 1.00 0.00 C ATOM 1185 CD PRO A 74 -11.348 1.024 -8.738 1.00 0.00 C ATOM 0 HA PRO A 74 -11.845 -0.637 -11.529 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -13.984 0.918 -10.708 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.615 -0.653 -10.025 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.261 2.021 -8.818 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -13.306 0.457 -8.029 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.975 2.036 -8.577 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -11.011 0.422 -7.894 1.00 0.00 H new ATOM 1193 N LEU A 75 -11.685 2.618 -11.611 1.00 0.00 N ATOM 1194 CA LEU A 75 -11.600 3.745 -12.524 1.00 0.00 C ATOM 1195 C LEU A 75 -10.617 3.412 -13.649 1.00 0.00 C ATOM 1196 O LEU A 75 -10.726 3.945 -14.752 1.00 0.00 O ATOM 1197 CB LEU A 75 -11.252 5.026 -11.763 1.00 0.00 C ATOM 1198 CG LEU A 75 -12.361 5.603 -10.880 1.00 0.00 C ATOM 1199 CD1 LEU A 75 -12.681 4.663 -9.717 1.00 0.00 C ATOM 1200 CD2 LEU A 75 -12.000 7.010 -10.398 1.00 0.00 C ATOM 0 H LEU A 75 -11.603 2.861 -10.624 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.568 3.931 -12.990 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -10.382 4.828 -11.137 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.958 5.786 -12.486 1.00 0.00 H new ATOM 0 HG LEU A 75 -13.266 5.690 -11.481 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -13.472 5.097 -9.105 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.011 3.700 -10.107 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.788 4.521 -9.108 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -12.804 7.398 -9.773 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -11.077 6.971 -9.820 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.861 7.665 -11.258 1.00 0.00 H new ATOM 1212 N GLU A 76 -9.679 2.532 -13.330 1.00 0.00 N ATOM 1213 CA GLU A 76 -8.678 2.122 -14.299 1.00 0.00 C ATOM 1214 C GLU A 76 -7.783 3.305 -14.672 1.00 0.00 C ATOM 1215 O GLU A 76 -7.722 3.699 -15.836 1.00 0.00 O ATOM 1216 CB GLU A 76 -9.334 1.517 -15.543 1.00 0.00 C ATOM 1217 CG GLU A 76 -9.705 0.052 -15.309 1.00 0.00 C ATOM 1218 CD GLU A 76 -10.144 -0.617 -16.613 1.00 0.00 C ATOM 1219 OE1 GLU A 76 -9.248 -1.125 -17.321 1.00 0.00 O ATOM 1220 OE2 GLU A 76 -11.367 -0.605 -16.873 1.00 0.00 O ATOM 0 H GLU A 76 -9.592 2.092 -12.414 1.00 0.00 H new ATOM 0 HA GLU A 76 -8.056 1.351 -13.845 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -10.228 2.086 -15.800 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -8.653 1.593 -16.391 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.851 -0.481 -14.892 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -10.509 -0.011 -14.575 1.00 0.00 H new ATOM 1227 N GLN A 77 -7.112 3.839 -13.662 1.00 0.00 N ATOM 1228 CA GLN A 77 -6.223 4.970 -13.869 1.00 0.00 C ATOM 1229 C GLN A 77 -4.783 4.584 -13.525 1.00 0.00 C ATOM 1230 O GLN A 77 -3.997 4.252 -14.410 1.00 0.00 O ATOM 1231 CB GLN A 77 -6.677 6.181 -13.051 1.00 0.00 C ATOM 1232 CG GLN A 77 -8.059 6.658 -13.499 1.00 0.00 C ATOM 1233 CD GLN A 77 -7.974 7.416 -14.826 1.00 0.00 C ATOM 1234 OE1 GLN A 77 -6.909 7.782 -15.294 1.00 0.00 O ATOM 1235 NE2 GLN A 77 -9.153 7.631 -15.402 1.00 0.00 N ATOM 0 H GLN A 77 -7.166 3.510 -12.698 1.00 0.00 H new ATOM 0 HA GLN A 77 -6.261 5.249 -14.922 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -6.704 5.920 -11.993 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -5.955 6.990 -13.162 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.726 5.802 -13.607 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.490 7.304 -12.734 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.007 7.297 -14.956 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.203 8.130 -16.290 1.00 0.00 H new ATOM 1244 N SER A 78 -4.482 4.640 -12.236 1.00 0.00 N ATOM 1245 CA SER A 78 -3.150 4.300 -11.763 1.00 0.00 C ATOM 1246 C SER A 78 -3.144 4.212 -10.236 1.00 0.00 C ATOM 1247 O SER A 78 -3.794 5.010 -9.562 1.00 0.00 O ATOM 1248 CB SER A 78 -2.118 5.324 -12.240 1.00 0.00 C ATOM 1249 OG SER A 78 -0.794 4.799 -12.213 1.00 0.00 O ATOM 0 H SER A 78 -5.137 4.916 -11.504 1.00 0.00 H new ATOM 0 HA SER A 78 -2.877 3.330 -12.178 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.362 5.640 -13.254 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.169 6.211 -11.609 1.00 0.00 H new ATOM 0 HG SER A 78 -0.165 5.482 -12.526 1.00 0.00 H new ATOM 1255 N ILE A 79 -2.402 3.236 -9.734 1.00 0.00 N ATOM 1256 CA ILE A 79 -2.302 3.033 -8.299 1.00 0.00 C ATOM 1257 C ILE A 79 -0.851 3.240 -7.859 1.00 0.00 C ATOM 1258 O ILE A 79 -0.422 2.689 -6.846 1.00 0.00 O ATOM 1259 CB ILE A 79 -2.874 1.669 -7.909 1.00 0.00 C ATOM 1260 CG1 ILE A 79 -2.012 0.533 -8.465 1.00 0.00 C ATOM 1261 CG2 ILE A 79 -4.336 1.543 -8.343 1.00 0.00 C ATOM 1262 CD1 ILE A 79 -1.776 -0.545 -7.406 1.00 0.00 C ATOM 0 H ILE A 79 -1.864 2.577 -10.296 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.905 3.769 -7.768 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.852 1.588 -6.822 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.501 0.093 -9.334 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.055 0.930 -8.804 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.718 0.564 -8.054 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -4.927 2.321 -7.860 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -4.405 1.654 -9.425 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.161 -1.340 -7.827 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.265 -0.107 -6.548 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.733 -0.957 -7.087 1.00 0.00 H new ATOM 1274 N TRP A 80 -0.137 4.036 -8.641 1.00 0.00 N ATOM 1275 CA TRP A 80 1.256 4.323 -8.344 1.00 0.00 C ATOM 1276 C TRP A 80 1.463 5.834 -8.461 1.00 0.00 C ATOM 1277 O TRP A 80 0.874 6.480 -9.327 1.00 0.00 O ATOM 1278 CB TRP A 80 2.187 3.520 -9.255 1.00 0.00 C ATOM 1279 CG TRP A 80 2.105 2.006 -9.049 1.00 0.00 C ATOM 1280 CD1 TRP A 80 1.363 1.120 -9.728 1.00 0.00 C ATOM 1281 CD2 TRP A 80 2.824 1.232 -8.067 1.00 0.00 C ATOM 1282 NE1 TRP A 80 1.551 -0.163 -9.257 1.00 0.00 N ATOM 1283 CE2 TRP A 80 2.468 -0.093 -8.215 1.00 0.00 C ATOM 1284 CE3 TRP A 80 3.746 1.637 -7.085 1.00 0.00 C ATOM 1285 CZ2 TRP A 80 2.985 -1.120 -7.416 1.00 0.00 C ATOM 1286 CZ3 TRP A 80 4.253 0.599 -6.295 1.00 0.00 C ATOM 1287 CH2 TRP A 80 3.905 -0.740 -6.431 1.00 0.00 C ATOM 0 H TRP A 80 -0.497 4.491 -9.480 1.00 0.00 H new ATOM 0 HA TRP A 80 1.505 4.015 -7.328 1.00 0.00 H new ATOM 0 HB2 TRP A 80 1.948 3.749 -10.294 1.00 0.00 H new ATOM 0 HB3 TRP A 80 3.214 3.844 -9.085 1.00 0.00 H new ATOM 0 HD1 TRP A 80 0.701 1.378 -10.542 1.00 0.00 H new ATOM 0 HE1 TRP A 80 1.100 -1.008 -9.609 1.00 0.00 H new ATOM 0 HE3 TRP A 80 4.040 2.668 -6.951 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 2.690 -2.150 -7.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 4.965 0.857 -5.525 1.00 0.00 H new ATOM 0 HH2 TRP A 80 4.342 -1.483 -5.780 1.00 0.00 H new ATOM 1298 N ALA A 81 2.301 6.355 -7.577 1.00 0.00 N ATOM 1299 CA ALA A 81 2.593 7.778 -7.570 1.00 0.00 C ATOM 1300 C ALA A 81 3.604 8.093 -8.675 1.00 0.00 C ATOM 1301 O ALA A 81 4.318 7.205 -9.139 1.00 0.00 O ATOM 1302 CB ALA A 81 3.097 8.190 -6.185 1.00 0.00 C ATOM 0 H ALA A 81 2.787 5.817 -6.860 1.00 0.00 H new ATOM 0 HA ALA A 81 1.691 8.355 -7.774 1.00 0.00 H new ATOM 0 HB1 ALA A 81 3.316 9.258 -6.180 1.00 0.00 H new ATOM 0 HB2 ALA A 81 2.331 7.973 -5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.003 7.633 -5.947 1.00 0.00 H new ATOM 1308 N VAL A 82 3.633 9.359 -9.064 1.00 0.00 N ATOM 1309 CA VAL A 82 4.544 9.801 -10.106 1.00 0.00 C ATOM 1310 C VAL A 82 5.965 9.863 -9.542 1.00 0.00 C ATOM 1311 O VAL A 82 6.932 9.603 -10.256 1.00 0.00 O ATOM 1312 CB VAL A 82 4.071 11.137 -10.683 1.00 0.00 C ATOM 1313 CG1 VAL A 82 2.891 10.936 -11.635 1.00 0.00 C ATOM 1314 CG2 VAL A 82 3.713 12.120 -9.566 1.00 0.00 C ATOM 0 H VAL A 82 3.040 10.093 -8.676 1.00 0.00 H new ATOM 0 HA VAL A 82 4.553 9.090 -10.932 1.00 0.00 H new ATOM 0 HB VAL A 82 4.894 11.565 -11.256 1.00 0.00 H new ATOM 0 HG11 VAL A 82 2.574 11.901 -12.031 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.193 10.288 -12.458 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.063 10.476 -11.096 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.380 13.061 -10.003 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.914 11.701 -8.955 1.00 0.00 H new ATOM 0 HG23 VAL A 82 4.590 12.299 -8.944 1.00 0.00 H new ATOM 1324 N LYS A 83 6.046 10.209 -8.265 1.00 0.00 N ATOM 1325 CA LYS A 83 7.332 10.308 -7.597 1.00 0.00 C ATOM 1326 C LYS A 83 7.310 9.454 -6.328 1.00 0.00 C ATOM 1327 O LYS A 83 6.868 8.306 -6.356 1.00 0.00 O ATOM 1328 CB LYS A 83 7.694 11.774 -7.346 1.00 0.00 C ATOM 1329 CG LYS A 83 6.605 12.474 -6.530 1.00 0.00 C ATOM 1330 CD LYS A 83 6.651 13.989 -6.741 1.00 0.00 C ATOM 1331 CE LYS A 83 6.022 14.375 -8.082 1.00 0.00 C ATOM 1332 NZ LYS A 83 4.941 15.365 -7.880 1.00 0.00 N ATOM 0 H LYS A 83 5.242 10.424 -7.676 1.00 0.00 H new ATOM 0 HA LYS A 83 8.123 9.913 -8.234 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.645 11.832 -6.816 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.827 12.288 -8.298 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.626 12.092 -6.820 1.00 0.00 H new ATOM 0 HG3 LYS A 83 6.735 12.246 -5.472 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.122 14.489 -5.930 1.00 0.00 H new ATOM 0 HD3 LYS A 83 7.685 14.333 -6.707 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.784 14.789 -8.742 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.623 13.487 -8.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 4.524 15.617 -8.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.207 14.957 -7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.331 16.218 -7.432 1.00 0.00 H new ATOM 1346 N GLY A 84 7.793 10.046 -5.246 1.00 0.00 N ATOM 1347 CA GLY A 84 7.834 9.354 -3.969 1.00 0.00 C ATOM 1348 C GLY A 84 7.616 10.328 -2.810 1.00 0.00 C ATOM 1349 O GLY A 84 6.853 11.284 -2.933 1.00 0.00 O ATOM 0 H GLY A 84 8.160 10.998 -5.227 1.00 0.00 H new ATOM 0 HA2 GLY A 84 7.068 8.579 -3.947 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.796 8.854 -3.853 1.00 0.00 H new ATOM 1353 N PRO A 85 8.319 10.043 -1.680 1.00 0.00 N ATOM 1354 CA PRO A 85 8.209 10.883 -0.500 1.00 0.00 C ATOM 1355 C PRO A 85 8.975 12.194 -0.687 1.00 0.00 C ATOM 1356 O PRO A 85 8.419 13.275 -0.495 1.00 0.00 O ATOM 1357 CB PRO A 85 8.754 10.035 0.638 1.00 0.00 C ATOM 1358 CG PRO A 85 9.573 8.934 -0.017 1.00 0.00 C ATOM 1359 CD PRO A 85 9.232 8.919 -1.498 1.00 0.00 C ATOM 0 HA PRO A 85 7.183 11.189 -0.296 1.00 0.00 H new ATOM 0 HB2 PRO A 85 9.370 10.633 1.310 1.00 0.00 H new ATOM 0 HB3 PRO A 85 7.944 9.616 1.236 1.00 0.00 H new ATOM 0 HG2 PRO A 85 10.638 9.113 0.128 1.00 0.00 H new ATOM 0 HG3 PRO A 85 9.347 7.969 0.437 1.00 0.00 H new ATOM 0 HD2 PRO A 85 10.126 9.032 -2.111 1.00 0.00 H new ATOM 0 HD3 PRO A 85 8.764 7.978 -1.787 1.00 0.00 H new ATOM 1367 N LYS A 86 10.239 12.056 -1.059 1.00 0.00 N ATOM 1368 CA LYS A 86 11.087 13.217 -1.275 1.00 0.00 C ATOM 1369 C LYS A 86 11.038 13.611 -2.752 1.00 0.00 C ATOM 1370 O LYS A 86 12.042 14.046 -3.315 1.00 0.00 O ATOM 1371 CB LYS A 86 12.501 12.951 -0.755 1.00 0.00 C ATOM 1372 CG LYS A 86 12.541 12.999 0.774 1.00 0.00 C ATOM 1373 CD LYS A 86 12.518 11.589 1.367 1.00 0.00 C ATOM 1374 CE LYS A 86 11.760 11.566 2.696 1.00 0.00 C ATOM 1375 NZ LYS A 86 11.723 10.193 3.248 1.00 0.00 N ATOM 0 H LYS A 86 10.697 11.158 -1.216 1.00 0.00 H new ATOM 0 HA LYS A 86 10.718 14.070 -0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.842 11.975 -1.101 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.188 13.692 -1.164 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.440 13.521 1.102 1.00 0.00 H new ATOM 0 HG3 LYS A 86 11.689 13.568 1.146 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.047 10.902 0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.539 11.238 1.520 1.00 0.00 H new ATOM 0 HE2 LYS A 86 12.241 12.237 3.407 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.744 11.932 2.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.205 10.195 4.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.244 9.561 2.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.694 9.857 3.407 1.00 0.00 H new ATOM 1389 N GLY A 87 9.862 13.445 -3.338 1.00 0.00 N ATOM 1390 CA GLY A 87 9.669 13.778 -4.739 1.00 0.00 C ATOM 1391 C GLY A 87 10.755 13.141 -5.608 1.00 0.00 C ATOM 1392 O GLY A 87 11.506 13.843 -6.284 1.00 0.00 O ATOM 0 H GLY A 87 9.032 13.084 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.688 13.434 -5.066 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.686 14.861 -4.865 1.00 0.00 H new ATOM 1396 N GLU A 88 10.804 11.818 -5.562 1.00 0.00 N ATOM 1397 CA GLU A 88 11.786 11.078 -6.337 1.00 0.00 C ATOM 1398 C GLU A 88 11.096 10.001 -7.178 1.00 0.00 C ATOM 1399 O GLU A 88 10.250 9.264 -6.675 1.00 0.00 O ATOM 1400 CB GLU A 88 12.852 10.464 -5.428 1.00 0.00 C ATOM 1401 CG GLU A 88 13.889 11.510 -5.015 1.00 0.00 C ATOM 1402 CD GLU A 88 14.632 11.077 -3.749 1.00 0.00 C ATOM 1403 OE1 GLU A 88 13.946 10.573 -2.834 1.00 0.00 O ATOM 1404 OE2 GLU A 88 15.868 11.260 -3.726 1.00 0.00 O ATOM 0 H GLU A 88 10.180 11.239 -5.000 1.00 0.00 H new ATOM 0 HA GLU A 88 12.287 11.773 -7.011 1.00 0.00 H new ATOM 0 HB2 GLU A 88 12.380 10.044 -4.540 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.346 9.641 -5.945 1.00 0.00 H new ATOM 0 HG2 GLU A 88 14.602 11.660 -5.826 1.00 0.00 H new ATOM 0 HG3 GLU A 88 13.396 12.467 -4.842 1.00 0.00 H new ATOM 1411 N ALA A 89 11.484 9.946 -8.443 1.00 0.00 N ATOM 1412 CA ALA A 89 10.914 8.972 -9.359 1.00 0.00 C ATOM 1413 C ALA A 89 10.848 7.608 -8.669 1.00 0.00 C ATOM 1414 O ALA A 89 9.768 7.040 -8.511 1.00 0.00 O ATOM 1415 CB ALA A 89 11.741 8.935 -10.645 1.00 0.00 C ATOM 0 H ALA A 89 12.186 10.560 -8.856 1.00 0.00 H new ATOM 0 HA ALA A 89 9.897 9.253 -9.634 1.00 0.00 H new ATOM 0 HB1 ALA A 89 11.313 8.204 -11.332 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.732 9.920 -11.112 1.00 0.00 H new ATOM 0 HB3 ALA A 89 12.767 8.654 -10.410 1.00 0.00 H new ATOM 1421 N VAL A 90 12.016 7.121 -8.276 1.00 0.00 N ATOM 1422 CA VAL A 90 12.104 5.835 -7.607 1.00 0.00 C ATOM 1423 C VAL A 90 13.296 5.845 -6.647 1.00 0.00 C ATOM 1424 O VAL A 90 14.237 6.615 -6.829 1.00 0.00 O ATOM 1425 CB VAL A 90 12.180 4.711 -8.642 1.00 0.00 C ATOM 1426 CG1 VAL A 90 11.768 3.371 -8.028 1.00 0.00 C ATOM 1427 CG2 VAL A 90 11.326 5.037 -9.869 1.00 0.00 C ATOM 0 H VAL A 90 12.910 7.595 -8.408 1.00 0.00 H new ATOM 0 HA VAL A 90 11.209 5.652 -7.013 1.00 0.00 H new ATOM 0 HB VAL A 90 13.217 4.626 -8.968 1.00 0.00 H new ATOM 0 HG11 VAL A 90 11.831 2.589 -8.785 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.435 3.129 -7.201 1.00 0.00 H new ATOM 0 HG13 VAL A 90 10.744 3.439 -7.661 1.00 0.00 H new ATOM 0 HG21 VAL A 90 11.398 4.222 -10.589 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.287 5.163 -9.566 1.00 0.00 H new ATOM 0 HG23 VAL A 90 11.684 5.959 -10.327 1.00 0.00 H new ATOM 1437 N GLY A 91 13.216 4.980 -5.647 1.00 0.00 N ATOM 1438 CA GLY A 91 14.276 4.879 -4.658 1.00 0.00 C ATOM 1439 C GLY A 91 15.247 3.750 -5.008 1.00 0.00 C ATOM 1440 O GLY A 91 16.398 4.003 -5.359 1.00 0.00 O ATOM 0 H GLY A 91 12.433 4.342 -5.500 1.00 0.00 H new ATOM 0 HA2 GLY A 91 14.817 5.824 -4.601 1.00 0.00 H new ATOM 0 HA3 GLY A 91 13.844 4.700 -3.674 1.00 0.00 H new ATOM 1444 N SER A 92 14.746 2.528 -4.901 1.00 0.00 N ATOM 1445 CA SER A 92 15.555 1.359 -5.202 1.00 0.00 C ATOM 1446 C SER A 92 14.925 0.567 -6.349 1.00 0.00 C ATOM 1447 O SER A 92 13.805 0.858 -6.767 1.00 0.00 O ATOM 1448 CB SER A 92 15.717 0.468 -3.969 1.00 0.00 C ATOM 1449 OG SER A 92 17.082 0.150 -3.715 1.00 0.00 O ATOM 0 H SER A 92 13.790 2.322 -4.610 1.00 0.00 H new ATOM 0 HA SER A 92 16.546 1.699 -5.504 1.00 0.00 H new ATOM 0 HB2 SER A 92 15.295 0.972 -3.100 1.00 0.00 H new ATOM 0 HB3 SER A 92 15.151 -0.453 -4.110 1.00 0.00 H new ATOM 0 HG SER A 92 17.132 -0.646 -3.145 1.00 0.00 H new ATOM 1455 N ILE A 93 15.671 -0.417 -6.827 1.00 0.00 N ATOM 1456 CA ILE A 93 15.199 -1.253 -7.918 1.00 0.00 C ATOM 1457 C ILE A 93 14.824 -2.632 -7.373 1.00 0.00 C ATOM 1458 O ILE A 93 15.666 -3.331 -6.811 1.00 0.00 O ATOM 1459 CB ILE A 93 16.233 -1.297 -9.045 1.00 0.00 C ATOM 1460 CG1 ILE A 93 16.655 0.115 -9.458 1.00 0.00 C ATOM 1461 CG2 ILE A 93 15.715 -2.110 -10.233 1.00 0.00 C ATOM 1462 CD1 ILE A 93 17.630 0.073 -10.636 1.00 0.00 C ATOM 0 H ILE A 93 16.600 -0.655 -6.479 1.00 0.00 H new ATOM 0 HA ILE A 93 14.297 -0.829 -8.360 1.00 0.00 H new ATOM 0 HB ILE A 93 17.123 -1.803 -8.672 1.00 0.00 H new ATOM 0 HG12 ILE A 93 15.774 0.696 -9.731 1.00 0.00 H new ATOM 0 HG13 ILE A 93 17.122 0.621 -8.613 1.00 0.00 H new ATOM 0 HG21 ILE A 93 16.469 -2.125 -11.020 1.00 0.00 H new ATOM 0 HG22 ILE A 93 15.505 -3.130 -9.912 1.00 0.00 H new ATOM 0 HG23 ILE A 93 14.801 -1.654 -10.615 1.00 0.00 H new ATOM 0 HD11 ILE A 93 17.914 1.089 -10.910 1.00 0.00 H new ATOM 0 HD12 ILE A 93 18.520 -0.489 -10.352 1.00 0.00 H new ATOM 0 HD13 ILE A 93 17.152 -0.412 -11.487 1.00 0.00 H new ATOM 1474 N THR A 94 13.560 -2.983 -7.558 1.00 0.00 N ATOM 1475 CA THR A 94 13.064 -4.266 -7.092 1.00 0.00 C ATOM 1476 C THR A 94 12.082 -4.859 -8.106 1.00 0.00 C ATOM 1477 O THR A 94 11.968 -4.365 -9.226 1.00 0.00 O ATOM 1478 CB THR A 94 12.453 -4.061 -5.704 1.00 0.00 C ATOM 1479 OG1 THR A 94 11.633 -2.906 -5.853 1.00 0.00 O ATOM 1480 CG2 THR A 94 13.495 -3.647 -4.662 1.00 0.00 C ATOM 0 H THR A 94 12.864 -2.401 -8.024 1.00 0.00 H new ATOM 0 HA THR A 94 13.871 -4.993 -7.004 1.00 0.00 H new ATOM 0 HB THR A 94 11.964 -4.980 -5.383 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.796 -3.033 -5.359 1.00 0.00 H new ATOM 0 HG21 THR A 94 13.010 -3.514 -3.695 1.00 0.00 H new ATOM 0 HG22 THR A 94 14.258 -4.422 -4.582 1.00 0.00 H new ATOM 0 HG23 THR A 94 13.961 -2.709 -4.966 1.00 0.00 H new ATOM 1488 N GLN A 95 11.399 -5.909 -7.676 1.00 0.00 N ATOM 1489 CA GLN A 95 10.432 -6.574 -8.532 1.00 0.00 C ATOM 1490 C GLN A 95 9.625 -5.542 -9.322 1.00 0.00 C ATOM 1491 O GLN A 95 9.551 -4.377 -8.935 1.00 0.00 O ATOM 1492 CB GLN A 95 9.510 -7.482 -7.715 1.00 0.00 C ATOM 1493 CG GLN A 95 8.377 -6.679 -7.074 1.00 0.00 C ATOM 1494 CD GLN A 95 8.153 -7.108 -5.622 1.00 0.00 C ATOM 1495 OE1 GLN A 95 7.274 -7.893 -5.308 1.00 0.00 O ATOM 1496 NE2 GLN A 95 8.997 -6.551 -4.757 1.00 0.00 N ATOM 0 H GLN A 95 11.496 -6.316 -6.746 1.00 0.00 H new ATOM 0 HA GLN A 95 10.973 -7.202 -9.239 1.00 0.00 H new ATOM 0 HB2 GLN A 95 9.093 -8.256 -8.359 1.00 0.00 H new ATOM 0 HB3 GLN A 95 10.086 -7.988 -6.940 1.00 0.00 H new ATOM 0 HG2 GLN A 95 8.615 -5.616 -7.110 1.00 0.00 H new ATOM 0 HG3 GLN A 95 7.459 -6.820 -7.644 1.00 0.00 H new ATOM 0 HE21 GLN A 95 9.711 -5.901 -5.087 1.00 0.00 H new ATOM 0 HE22 GLN A 95 8.930 -6.774 -3.764 1.00 0.00 H new ATOM 1505 N PRO A 96 9.025 -6.020 -10.445 1.00 0.00 N ATOM 1506 CA PRO A 96 8.226 -5.152 -11.294 1.00 0.00 C ATOM 1507 C PRO A 96 6.869 -4.856 -10.653 1.00 0.00 C ATOM 1508 O PRO A 96 6.234 -3.851 -10.970 1.00 0.00 O ATOM 1509 CB PRO A 96 8.109 -5.893 -12.616 1.00 0.00 C ATOM 1510 CG PRO A 96 8.447 -7.344 -12.312 1.00 0.00 C ATOM 1511 CD PRO A 96 9.090 -7.394 -10.935 1.00 0.00 C ATOM 0 HA PRO A 96 8.681 -4.173 -11.441 1.00 0.00 H new ATOM 0 HB2 PRO A 96 7.103 -5.804 -13.026 1.00 0.00 H new ATOM 0 HB3 PRO A 96 8.793 -5.480 -13.357 1.00 0.00 H new ATOM 0 HG2 PRO A 96 7.547 -7.959 -12.336 1.00 0.00 H new ATOM 0 HG3 PRO A 96 9.126 -7.744 -13.065 1.00 0.00 H new ATOM 0 HD2 PRO A 96 8.556 -8.076 -10.273 1.00 0.00 H new ATOM 0 HD3 PRO A 96 10.120 -7.746 -10.992 1.00 0.00 H new ATOM 1519 N LEU A 97 6.464 -5.749 -9.762 1.00 0.00 N ATOM 1520 CA LEU A 97 5.194 -5.596 -9.073 1.00 0.00 C ATOM 1521 C LEU A 97 4.083 -5.382 -10.103 1.00 0.00 C ATOM 1522 O LEU A 97 4.346 -5.328 -11.303 1.00 0.00 O ATOM 1523 CB LEU A 97 5.283 -4.485 -8.025 1.00 0.00 C ATOM 1524 CG LEU A 97 6.648 -3.811 -7.876 1.00 0.00 C ATOM 1525 CD1 LEU A 97 6.736 -2.553 -8.741 1.00 0.00 C ATOM 1526 CD2 LEU A 97 6.958 -3.519 -6.407 1.00 0.00 C ATOM 0 H LEU A 97 6.993 -6.581 -9.501 1.00 0.00 H new ATOM 0 HA LEU A 97 4.948 -6.503 -8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.547 -3.720 -8.272 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.998 -4.901 -7.059 1.00 0.00 H new ATOM 0 HG LEU A 97 7.411 -4.502 -8.235 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.716 -2.093 -8.616 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.591 -2.820 -9.788 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.963 -1.847 -8.436 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.934 -3.040 -6.329 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.195 -2.856 -5.999 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.966 -4.453 -5.844 1.00 0.00 H new ATOM 1538 N PRO A 98 2.832 -5.264 -9.583 1.00 0.00 N ATOM 1539 CA PRO A 98 1.679 -5.057 -10.444 1.00 0.00 C ATOM 1540 C PRO A 98 1.636 -3.619 -10.966 1.00 0.00 C ATOM 1541 O PRO A 98 2.642 -2.912 -10.931 1.00 0.00 O ATOM 1542 CB PRO A 98 0.477 -5.413 -9.584 1.00 0.00 C ATOM 1543 CG PRO A 98 0.963 -5.358 -8.145 1.00 0.00 C ATOM 1544 CD PRO A 98 2.482 -5.323 -8.166 1.00 0.00 C ATOM 0 HA PRO A 98 1.707 -5.675 -11.341 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.341 -4.712 -9.747 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.100 -6.405 -9.831 1.00 0.00 H new ATOM 0 HG2 PRO A 98 0.568 -4.475 -7.642 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.609 -6.226 -7.589 1.00 0.00 H new ATOM 0 HD2 PRO A 98 2.866 -4.457 -7.627 1.00 0.00 H new ATOM 0 HD3 PRO A 98 2.905 -6.208 -7.690 1.00 0.00 H new ATOM 1552 N SER A 99 0.461 -3.230 -11.438 1.00 0.00 N ATOM 1553 CA SER A 99 0.273 -1.890 -11.967 1.00 0.00 C ATOM 1554 C SER A 99 -1.085 -1.340 -11.528 1.00 0.00 C ATOM 1555 O SER A 99 -1.180 -0.201 -11.073 1.00 0.00 O ATOM 1556 CB SER A 99 0.383 -1.880 -13.493 1.00 0.00 C ATOM 1557 OG SER A 99 1.739 -1.861 -13.931 1.00 0.00 O ATOM 0 H SER A 99 -0.371 -3.820 -11.465 1.00 0.00 H new ATOM 0 HA SER A 99 1.062 -1.251 -11.569 1.00 0.00 H new ATOM 0 HB2 SER A 99 -0.116 -2.760 -13.898 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.138 -1.008 -13.888 1.00 0.00 H new ATOM 0 HG SER A 99 1.766 -1.857 -14.911 1.00 0.00 H new ATOM 1563 N SER A 100 -2.103 -2.174 -11.682 1.00 0.00 N ATOM 1564 CA SER A 100 -3.452 -1.786 -11.307 1.00 0.00 C ATOM 1565 C SER A 100 -3.741 -2.217 -9.868 1.00 0.00 C ATOM 1566 O SER A 100 -4.111 -1.394 -9.032 1.00 0.00 O ATOM 1567 CB SER A 100 -4.485 -2.392 -12.259 1.00 0.00 C ATOM 1568 OG SER A 100 -4.972 -3.647 -11.790 1.00 0.00 O ATOM 0 H SER A 100 -2.021 -3.117 -12.062 1.00 0.00 H new ATOM 0 HA SER A 100 -3.526 -0.701 -11.376 1.00 0.00 H new ATOM 0 HB2 SER A 100 -5.319 -1.700 -12.377 1.00 0.00 H new ATOM 0 HB3 SER A 100 -4.038 -2.522 -13.244 1.00 0.00 H new ATOM 0 HG SER A 100 -5.630 -4.000 -12.424 1.00 0.00 H new ATOM 1574 N TYR A 101 -3.560 -3.506 -9.622 1.00 0.00 N ATOM 1575 CA TYR A 101 -3.796 -4.056 -8.298 1.00 0.00 C ATOM 1576 C TYR A 101 -2.495 -4.132 -7.496 1.00 0.00 C ATOM 1577 O TYR A 101 -1.428 -3.791 -8.004 1.00 0.00 O ATOM 1578 CB TYR A 101 -4.328 -5.473 -8.519 1.00 0.00 C ATOM 1579 CG TYR A 101 -3.255 -6.485 -8.926 1.00 0.00 C ATOM 1580 CD1 TYR A 101 -2.511 -7.128 -7.957 1.00 0.00 C ATOM 1581 CD2 TYR A 101 -3.031 -6.755 -10.260 1.00 0.00 C ATOM 1582 CE1 TYR A 101 -1.501 -8.081 -8.340 1.00 0.00 C ATOM 1583 CE2 TYR A 101 -2.020 -7.707 -10.643 1.00 0.00 C ATOM 1584 CZ TYR A 101 -1.305 -8.323 -9.663 1.00 0.00 C ATOM 1585 OH TYR A 101 -0.351 -9.222 -10.025 1.00 0.00 O ATOM 0 H TYR A 101 -3.253 -4.186 -10.317 1.00 0.00 H new ATOM 0 HA TYR A 101 -4.493 -3.430 -7.741 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -4.808 -5.817 -7.603 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -5.097 -5.445 -9.291 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -2.686 -6.917 -6.912 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -3.614 -6.252 -11.018 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -0.912 -8.592 -7.592 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -1.834 -7.927 -11.684 1.00 0.00 H new ATOM 0 HH TYR A 101 -0.323 -9.294 -11.002 1.00 0.00 H new ATOM 1595 N LEU A 102 -2.627 -4.581 -6.257 1.00 0.00 N ATOM 1596 CA LEU A 102 -1.475 -4.706 -5.380 1.00 0.00 C ATOM 1597 C LEU A 102 -1.800 -5.694 -4.257 1.00 0.00 C ATOM 1598 O LEU A 102 -2.612 -5.399 -3.382 1.00 0.00 O ATOM 1599 CB LEU A 102 -1.031 -3.331 -4.879 1.00 0.00 C ATOM 1600 CG LEU A 102 0.338 -2.850 -5.366 1.00 0.00 C ATOM 1601 CD1 LEU A 102 0.575 -1.389 -4.979 1.00 0.00 C ATOM 1602 CD2 LEU A 102 1.453 -3.765 -4.857 1.00 0.00 C ATOM 0 H LEU A 102 -3.514 -4.863 -5.839 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.623 -5.111 -5.926 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.780 -2.598 -5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -1.021 -3.349 -3.789 1.00 0.00 H new ATOM 0 HG LEU A 102 0.351 -2.901 -6.455 1.00 0.00 H new ATOM 0 HD11 LEU A 102 1.555 -1.072 -5.337 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.196 -0.764 -5.430 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.535 -1.289 -3.894 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.415 -3.401 -5.217 1.00 0.00 H new ATOM 0 HD22 LEU A 102 1.451 -3.769 -3.767 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.288 -4.778 -5.224 1.00 0.00 H new ATOM 1614 N ILE A 103 -1.148 -6.846 -4.319 1.00 0.00 N ATOM 1615 CA ILE A 103 -1.357 -7.878 -3.318 1.00 0.00 C ATOM 1616 C ILE A 103 -0.468 -7.595 -2.105 1.00 0.00 C ATOM 1617 O ILE A 103 0.699 -7.235 -2.257 1.00 0.00 O ATOM 1618 CB ILE A 103 -1.142 -9.266 -3.927 1.00 0.00 C ATOM 1619 CG1 ILE A 103 -2.027 -9.467 -5.158 1.00 0.00 C ATOM 1620 CG2 ILE A 103 -1.356 -10.362 -2.881 1.00 0.00 C ATOM 1621 CD1 ILE A 103 -3.495 -9.628 -4.759 1.00 0.00 C ATOM 0 H ILE A 103 -0.475 -7.087 -5.047 1.00 0.00 H new ATOM 0 HA ILE A 103 -2.389 -7.864 -2.967 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.107 -9.337 -4.260 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -1.921 -8.615 -5.830 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -1.697 -10.349 -5.707 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.197 -11.338 -3.339 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.650 -10.226 -2.062 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -2.374 -10.303 -2.496 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -4.102 -9.769 -5.653 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.602 -10.495 -4.107 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -3.829 -8.734 -4.232 1.00 0.00 H new ATOM 1633 N ILE A 104 -1.054 -7.767 -0.929 1.00 0.00 N ATOM 1634 CA ILE A 104 -0.330 -7.534 0.309 1.00 0.00 C ATOM 1635 C ILE A 104 -0.622 -8.672 1.288 1.00 0.00 C ATOM 1636 O ILE A 104 -1.580 -9.422 1.106 1.00 0.00 O ATOM 1637 CB ILE A 104 -0.653 -6.146 0.865 1.00 0.00 C ATOM 1638 CG1 ILE A 104 -0.249 -5.050 -0.124 1.00 0.00 C ATOM 1639 CG2 ILE A 104 -0.010 -5.942 2.239 1.00 0.00 C ATOM 1640 CD1 ILE A 104 -1.390 -4.053 -0.333 1.00 0.00 C ATOM 0 H ILE A 104 -2.022 -8.065 -0.807 1.00 0.00 H new ATOM 0 HA ILE A 104 0.745 -7.537 0.128 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.732 -6.076 1.000 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.632 -4.527 0.247 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.025 -5.499 -1.078 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.255 -4.947 2.611 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.388 -6.693 2.933 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.072 -6.040 2.153 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.077 -3.285 -1.040 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.262 -4.575 -0.727 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.645 -3.588 0.619 1.00 0.00 H new ATOM 1652 N ARG A 105 0.221 -8.767 2.305 1.00 0.00 N ATOM 1653 CA ARG A 105 0.065 -9.801 3.313 1.00 0.00 C ATOM 1654 C ARG A 105 0.245 -9.210 4.713 1.00 0.00 C ATOM 1655 O ARG A 105 1.126 -8.379 4.931 1.00 0.00 O ATOM 1656 CB ARG A 105 1.080 -10.928 3.108 1.00 0.00 C ATOM 1657 CG ARG A 105 0.998 -11.953 4.241 1.00 0.00 C ATOM 1658 CD ARG A 105 1.966 -13.113 4.002 1.00 0.00 C ATOM 1659 NE ARG A 105 1.241 -14.266 3.423 1.00 0.00 N ATOM 1660 CZ ARG A 105 1.708 -15.522 3.420 1.00 0.00 C ATOM 1661 NH1 ARG A 105 2.902 -15.794 3.963 1.00 0.00 N ATOM 1662 NH2 ARG A 105 0.981 -16.505 2.872 1.00 0.00 N ATOM 0 H ARG A 105 1.015 -8.144 2.453 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.940 -10.210 3.215 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.894 -11.420 2.153 1.00 0.00 H new ATOM 0 HB3 ARG A 105 2.086 -10.512 3.062 1.00 0.00 H new ATOM 0 HG2 ARG A 105 1.230 -11.470 5.190 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -0.020 -12.334 4.318 1.00 0.00 H new ATOM 0 HD2 ARG A 105 2.764 -12.799 3.329 1.00 0.00 H new ATOM 0 HD3 ARG A 105 2.437 -13.404 4.941 1.00 0.00 H new ATOM 0 HE ARG A 105 0.329 -14.094 3.000 1.00 0.00 H new ATOM 0 HH11 ARG A 105 3.456 -15.045 4.379 1.00 0.00 H new ATOM 0 HH12 ARG A 105 3.257 -16.750 3.961 1.00 0.00 H new ATOM 0 HH21 ARG A 105 0.073 -16.297 2.457 1.00 0.00 H new ATOM 0 HH22 ARG A 105 1.336 -17.461 2.869 1.00 0.00 H new ATOM 1676 N ALA A 106 -0.602 -9.662 5.626 1.00 0.00 N ATOM 1677 CA ALA A 106 -0.547 -9.188 6.998 1.00 0.00 C ATOM 1678 C ALA A 106 -0.027 -10.310 7.900 1.00 0.00 C ATOM 1679 O ALA A 106 0.068 -11.460 7.474 1.00 0.00 O ATOM 1680 CB ALA A 106 -1.931 -8.693 7.423 1.00 0.00 C ATOM 0 H ALA A 106 -1.330 -10.352 5.442 1.00 0.00 H new ATOM 0 HA ALA A 106 0.141 -8.348 7.086 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -1.890 -8.337 8.453 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -2.242 -7.878 6.770 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -2.648 -9.511 7.350 1.00 0.00 H new ATOM 1686 N THR A 107 0.298 -9.935 9.128 1.00 0.00 N ATOM 1687 CA THR A 107 0.806 -10.895 10.094 1.00 0.00 C ATOM 1688 C THR A 107 -0.298 -11.868 10.511 1.00 0.00 C ATOM 1689 O THR A 107 -0.204 -13.067 10.252 1.00 0.00 O ATOM 1690 CB THR A 107 1.403 -10.115 11.266 1.00 0.00 C ATOM 1691 OG1 THR A 107 2.750 -9.868 10.870 1.00 0.00 O ATOM 1692 CG2 THR A 107 1.537 -10.968 12.530 1.00 0.00 C ATOM 0 H THR A 107 0.220 -8.980 9.477 1.00 0.00 H new ATOM 0 HA THR A 107 1.593 -11.513 9.661 1.00 0.00 H new ATOM 0 HB THR A 107 0.779 -9.247 11.478 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.211 -9.364 11.573 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.966 -10.366 13.331 1.00 0.00 H new ATOM 0 HG22 THR A 107 0.553 -11.327 12.833 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.187 -11.819 12.327 1.00 0.00 H new ATOM 1700 N SER A 108 -1.319 -11.316 11.149 1.00 0.00 N ATOM 1701 CA SER A 108 -2.440 -12.120 11.604 1.00 0.00 C ATOM 1702 C SER A 108 -3.723 -11.679 10.896 1.00 0.00 C ATOM 1703 O SER A 108 -3.748 -10.637 10.243 1.00 0.00 O ATOM 1704 CB SER A 108 -2.610 -12.020 13.122 1.00 0.00 C ATOM 1705 OG SER A 108 -2.771 -13.300 13.727 1.00 0.00 O ATOM 0 H SER A 108 -1.393 -10.321 11.362 1.00 0.00 H new ATOM 0 HA SER A 108 -2.236 -13.162 11.356 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.741 -11.523 13.552 1.00 0.00 H new ATOM 0 HB3 SER A 108 -3.477 -11.400 13.350 1.00 0.00 H new ATOM 0 HG SER A 108 -2.875 -13.193 14.696 1.00 0.00 H new ATOM 1711 N GLU A 109 -4.756 -12.494 11.051 1.00 0.00 N ATOM 1712 CA GLU A 109 -6.039 -12.200 10.434 1.00 0.00 C ATOM 1713 C GLU A 109 -6.489 -10.783 10.795 1.00 0.00 C ATOM 1714 O GLU A 109 -6.787 -9.979 9.912 1.00 0.00 O ATOM 1715 CB GLU A 109 -7.093 -13.231 10.844 1.00 0.00 C ATOM 1716 CG GLU A 109 -8.459 -12.885 10.247 1.00 0.00 C ATOM 1717 CD GLU A 109 -9.580 -13.155 11.253 1.00 0.00 C ATOM 1718 OE1 GLU A 109 -9.974 -14.336 11.361 1.00 0.00 O ATOM 1719 OE2 GLU A 109 -10.018 -12.173 11.891 1.00 0.00 O ATOM 0 H GLU A 109 -4.731 -13.357 11.594 1.00 0.00 H new ATOM 0 HA GLU A 109 -5.922 -12.259 9.352 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -6.787 -14.222 10.510 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -7.166 -13.269 11.931 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -8.476 -11.836 9.951 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -8.625 -13.473 9.345 1.00 0.00 H new ATOM 1726 N SER A 110 -6.525 -10.520 12.093 1.00 0.00 N ATOM 1727 CA SER A 110 -6.934 -9.214 12.581 1.00 0.00 C ATOM 1728 C SER A 110 -6.140 -8.117 11.867 1.00 0.00 C ATOM 1729 O SER A 110 -6.720 -7.254 11.209 1.00 0.00 O ATOM 1730 CB SER A 110 -6.743 -9.107 14.095 1.00 0.00 C ATOM 1731 OG SER A 110 -7.751 -9.815 14.811 1.00 0.00 O ATOM 0 H SER A 110 -6.278 -11.189 12.822 1.00 0.00 H new ATOM 0 HA SER A 110 -7.995 -9.085 12.366 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.763 -9.499 14.365 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.759 -8.058 14.389 1.00 0.00 H new ATOM 0 HG SER A 110 -7.593 -9.724 15.774 1.00 0.00 H new ATOM 1737 N ASP A 111 -4.826 -8.185 12.022 1.00 0.00 N ATOM 1738 CA ASP A 111 -3.948 -7.209 11.401 1.00 0.00 C ATOM 1739 C ASP A 111 -4.456 -6.894 9.993 1.00 0.00 C ATOM 1740 O ASP A 111 -4.932 -5.790 9.733 1.00 0.00 O ATOM 1741 CB ASP A 111 -2.522 -7.750 11.279 1.00 0.00 C ATOM 1742 CG ASP A 111 -1.663 -7.599 12.536 1.00 0.00 C ATOM 1743 OD1 ASP A 111 -1.190 -6.466 12.767 1.00 0.00 O ATOM 1744 OD2 ASP A 111 -1.499 -8.621 13.237 1.00 0.00 O ATOM 0 H ASP A 111 -4.348 -8.901 12.569 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.943 -6.315 12.025 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.572 -8.807 11.016 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.025 -7.239 10.454 1.00 0.00 H new ATOM 1749 N GLY A 112 -4.339 -7.885 9.121 1.00 0.00 N ATOM 1750 CA GLY A 112 -4.781 -7.728 7.745 1.00 0.00 C ATOM 1751 C GLY A 112 -6.158 -7.062 7.685 1.00 0.00 C ATOM 1752 O GLY A 112 -6.337 -6.062 6.992 1.00 0.00 O ATOM 0 H GLY A 112 -3.945 -8.800 9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -4.058 -7.127 7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -4.823 -8.703 7.259 1.00 0.00 H new ATOM 1756 N ARG A 113 -7.094 -7.645 8.419 1.00 0.00 N ATOM 1757 CA ARG A 113 -8.449 -7.121 8.457 1.00 0.00 C ATOM 1758 C ARG A 113 -8.429 -5.618 8.739 1.00 0.00 C ATOM 1759 O ARG A 113 -9.256 -4.873 8.216 1.00 0.00 O ATOM 1760 CB ARG A 113 -9.281 -7.824 9.531 1.00 0.00 C ATOM 1761 CG ARG A 113 -9.435 -9.313 9.219 1.00 0.00 C ATOM 1762 CD ARG A 113 -10.911 -9.694 9.075 1.00 0.00 C ATOM 1763 NE ARG A 113 -11.515 -9.891 10.412 1.00 0.00 N ATOM 1764 CZ ARG A 113 -12.831 -10.013 10.631 1.00 0.00 C ATOM 1765 NH1 ARG A 113 -13.689 -9.959 9.603 1.00 0.00 N ATOM 1766 NH2 ARG A 113 -13.289 -10.189 11.878 1.00 0.00 N ATOM 0 H ARG A 113 -6.941 -8.475 8.992 1.00 0.00 H new ATOM 0 HA ARG A 113 -8.903 -7.305 7.483 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -8.805 -7.700 10.504 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -10.265 -7.359 9.596 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -8.903 -9.552 8.298 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -8.979 -9.904 10.014 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.446 -8.912 8.537 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.004 -10.607 8.487 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.890 -9.937 11.217 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.340 -9.825 8.654 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.691 -10.052 9.770 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -12.636 -10.230 12.660 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -14.291 -10.282 12.045 1.00 0.00 H new ATOM 1780 N CYS A 114 -7.474 -5.216 9.565 1.00 0.00 N ATOM 1781 CA CYS A 114 -7.335 -3.814 9.923 1.00 0.00 C ATOM 1782 C CYS A 114 -6.692 -3.079 8.746 1.00 0.00 C ATOM 1783 O CYS A 114 -7.054 -1.942 8.447 1.00 0.00 O ATOM 1784 CB CYS A 114 -6.533 -3.637 11.214 1.00 0.00 C ATOM 1785 SG CYS A 114 -7.579 -2.861 12.500 1.00 0.00 S ATOM 0 H CYS A 114 -6.789 -5.836 9.997 1.00 0.00 H new ATOM 0 HA CYS A 114 -8.318 -3.388 10.122 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -6.171 -4.604 11.563 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -5.656 -3.018 11.025 1.00 0.00 H new ATOM 0 HG CYS A 114 -6.889 -2.718 13.592 1.00 0.00 H new ATOM 1791 N TRP A 115 -5.749 -3.758 8.109 1.00 0.00 N ATOM 1792 CA TRP A 115 -5.052 -3.184 6.971 1.00 0.00 C ATOM 1793 C TRP A 115 -6.072 -2.970 5.851 1.00 0.00 C ATOM 1794 O TRP A 115 -6.358 -1.834 5.476 1.00 0.00 O ATOM 1795 CB TRP A 115 -3.875 -4.065 6.547 1.00 0.00 C ATOM 1796 CG TRP A 115 -2.554 -3.711 7.234 1.00 0.00 C ATOM 1797 CD1 TRP A 115 -1.967 -4.334 8.265 1.00 0.00 C ATOM 1798 CD2 TRP A 115 -1.674 -2.619 6.894 1.00 0.00 C ATOM 1799 NE1 TRP A 115 -0.779 -3.725 8.613 1.00 0.00 N ATOM 1800 CE2 TRP A 115 -0.595 -2.649 7.753 1.00 0.00 C ATOM 1801 CE3 TRP A 115 -1.786 -1.637 5.893 1.00 0.00 C ATOM 1802 CZ2 TRP A 115 0.455 -1.724 7.699 1.00 0.00 C ATOM 1803 CZ3 TRP A 115 -0.730 -0.720 5.852 1.00 0.00 C ATOM 1804 CH2 TRP A 115 0.364 -0.738 6.710 1.00 0.00 C ATOM 0 H TRP A 115 -5.451 -4.701 8.360 1.00 0.00 H new ATOM 0 HA TRP A 115 -4.615 -2.221 7.233 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -4.117 -5.106 6.762 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -3.744 -3.985 5.468 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -2.373 -5.203 8.761 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -0.151 -4.012 9.364 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -2.621 -1.594 5.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 1.289 -1.769 8.383 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -0.767 0.056 5.102 1.00 0.00 H new ATOM 0 HH2 TRP A 115 1.141 0.006 6.614 1.00 0.00 H new ATOM 1815 N MET A 116 -6.592 -4.080 5.348 1.00 0.00 N ATOM 1816 CA MET A 116 -7.574 -4.028 4.278 1.00 0.00 C ATOM 1817 C MET A 116 -8.715 -3.070 4.627 1.00 0.00 C ATOM 1818 O MET A 116 -9.350 -2.505 3.738 1.00 0.00 O ATOM 1819 CB MET A 116 -8.140 -5.429 4.036 1.00 0.00 C ATOM 1820 CG MET A 116 -9.115 -5.826 5.146 1.00 0.00 C ATOM 1821 SD MET A 116 -9.550 -7.550 4.987 1.00 0.00 S ATOM 1822 CE MET A 116 -10.259 -7.541 3.349 1.00 0.00 C ATOM 0 H MET A 116 -6.352 -5.020 5.661 1.00 0.00 H new ATOM 0 HA MET A 116 -7.082 -3.664 3.376 1.00 0.00 H new ATOM 0 HB2 MET A 116 -8.649 -5.458 3.073 1.00 0.00 H new ATOM 0 HB3 MET A 116 -7.325 -6.151 3.988 1.00 0.00 H new ATOM 0 HG2 MET A 116 -8.663 -5.645 6.121 1.00 0.00 H new ATOM 0 HG3 MET A 116 -10.012 -5.209 5.091 1.00 0.00 H new ATOM 0 HE1 MET A 116 -11.036 -8.302 3.285 1.00 0.00 H new ATOM 0 HE2 MET A 116 -10.692 -6.562 3.146 1.00 0.00 H new ATOM 0 HE3 MET A 116 -9.482 -7.753 2.615 1.00 0.00 H new ATOM 1832 N ASP A 117 -8.941 -2.916 5.924 1.00 0.00 N ATOM 1833 CA ASP A 117 -9.994 -2.036 6.401 1.00 0.00 C ATOM 1834 C ASP A 117 -9.505 -0.588 6.349 1.00 0.00 C ATOM 1835 O ASP A 117 -10.067 0.235 5.627 1.00 0.00 O ATOM 1836 CB ASP A 117 -10.366 -2.358 7.850 1.00 0.00 C ATOM 1837 CG ASP A 117 -11.430 -3.444 8.019 1.00 0.00 C ATOM 1838 OD1 ASP A 117 -11.827 -4.016 6.981 1.00 0.00 O ATOM 1839 OD2 ASP A 117 -11.823 -3.677 9.182 1.00 0.00 O ATOM 0 H ASP A 117 -8.413 -3.386 6.659 1.00 0.00 H new ATOM 0 HA ASP A 117 -10.867 -2.178 5.764 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -9.465 -2.667 8.380 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -10.720 -1.446 8.329 1.00 0.00 H new ATOM 1844 N ALA A 118 -8.463 -0.320 7.122 1.00 0.00 N ATOM 1845 CA ALA A 118 -7.892 1.015 7.173 1.00 0.00 C ATOM 1846 C ALA A 118 -7.752 1.560 5.750 1.00 0.00 C ATOM 1847 O ALA A 118 -7.926 2.755 5.519 1.00 0.00 O ATOM 1848 CB ALA A 118 -6.555 0.971 7.915 1.00 0.00 C ATOM 0 H ALA A 118 -7.999 -1.005 7.718 1.00 0.00 H new ATOM 0 HA ALA A 118 -8.547 1.692 7.722 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -6.127 1.973 7.953 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.714 0.605 8.930 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.870 0.303 7.392 1.00 0.00 H new ATOM 1854 N LEU A 119 -7.437 0.656 4.834 1.00 0.00 N ATOM 1855 CA LEU A 119 -7.271 1.031 3.440 1.00 0.00 C ATOM 1856 C LEU A 119 -8.592 1.587 2.905 1.00 0.00 C ATOM 1857 O LEU A 119 -8.699 2.780 2.625 1.00 0.00 O ATOM 1858 CB LEU A 119 -6.727 -0.147 2.629 1.00 0.00 C ATOM 1859 CG LEU A 119 -5.204 -0.245 2.528 1.00 0.00 C ATOM 1860 CD1 LEU A 119 -4.779 -1.594 1.943 1.00 0.00 C ATOM 1861 CD2 LEU A 119 -4.630 0.930 1.734 1.00 0.00 C ATOM 0 H LEU A 119 -7.292 -0.335 5.030 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.529 1.824 3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.102 -1.070 3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -7.135 -0.087 1.620 1.00 0.00 H new ATOM 0 HG LEU A 119 -4.791 -0.186 3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.692 -1.638 1.882 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -5.139 -2.398 2.584 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.203 -1.708 0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.546 0.836 1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.048 0.927 0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.887 1.865 2.231 1.00 0.00 H new ATOM 1873 N GLU A 120 -9.565 0.697 2.779 1.00 0.00 N ATOM 1874 CA GLU A 120 -10.875 1.084 2.283 1.00 0.00 C ATOM 1875 C GLU A 120 -11.267 2.456 2.834 1.00 0.00 C ATOM 1876 O GLU A 120 -11.878 3.260 2.131 1.00 0.00 O ATOM 1877 CB GLU A 120 -11.927 0.031 2.634 1.00 0.00 C ATOM 1878 CG GLU A 120 -11.642 -1.290 1.917 1.00 0.00 C ATOM 1879 CD GLU A 120 -12.666 -2.358 2.307 1.00 0.00 C ATOM 1880 OE1 GLU A 120 -13.873 -2.064 2.166 1.00 0.00 O ATOM 1881 OE2 GLU A 120 -12.220 -3.443 2.736 1.00 0.00 O ATOM 0 H GLU A 120 -9.473 -0.292 3.012 1.00 0.00 H new ATOM 0 HA GLU A 120 -10.825 1.152 1.196 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -11.938 -0.131 3.712 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -12.917 0.394 2.356 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -11.666 -1.135 0.838 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -10.639 -1.635 2.167 1.00 0.00 H new ATOM 1888 N LEU A 121 -10.899 2.683 4.087 1.00 0.00 N ATOM 1889 CA LEU A 121 -11.205 3.944 4.740 1.00 0.00 C ATOM 1890 C LEU A 121 -10.254 5.025 4.223 1.00 0.00 C ATOM 1891 O LEU A 121 -10.696 6.080 3.771 1.00 0.00 O ATOM 1892 CB LEU A 121 -11.179 3.779 6.261 1.00 0.00 C ATOM 1893 CG LEU A 121 -11.929 2.567 6.818 1.00 0.00 C ATOM 1894 CD1 LEU A 121 -11.628 2.371 8.305 1.00 0.00 C ATOM 1895 CD2 LEU A 121 -13.430 2.679 6.546 1.00 0.00 C ATOM 0 H LEU A 121 -10.392 2.015 4.667 1.00 0.00 H new ATOM 0 HA LEU A 121 -12.217 4.265 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -10.139 3.717 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -11.598 4.679 6.711 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.574 1.677 6.299 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -12.174 1.503 8.675 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -10.558 2.213 8.442 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -11.937 3.257 8.859 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -13.940 1.805 6.952 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -13.820 3.579 7.021 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -13.602 2.732 5.471 1.00 0.00 H new ATOM 1907 N ALA A 122 -8.966 4.725 4.306 1.00 0.00 N ATOM 1908 CA ALA A 122 -7.949 5.658 3.851 1.00 0.00 C ATOM 1909 C ALA A 122 -8.380 6.263 2.513 1.00 0.00 C ATOM 1910 O ALA A 122 -8.524 7.478 2.395 1.00 0.00 O ATOM 1911 CB ALA A 122 -6.601 4.940 3.760 1.00 0.00 C ATOM 0 H ALA A 122 -8.603 3.849 4.682 1.00 0.00 H new ATOM 0 HA ALA A 122 -7.834 6.477 4.561 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -5.838 5.640 3.419 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -6.327 4.555 4.742 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -6.676 4.113 3.054 1.00 0.00 H new ATOM 1917 N LEU A 123 -8.573 5.386 1.539 1.00 0.00 N ATOM 1918 CA LEU A 123 -8.984 5.818 0.214 1.00 0.00 C ATOM 1919 C LEU A 123 -10.279 6.625 0.324 1.00 0.00 C ATOM 1920 O LEU A 123 -10.495 7.566 -0.438 1.00 0.00 O ATOM 1921 CB LEU A 123 -9.084 4.621 -0.734 1.00 0.00 C ATOM 1922 CG LEU A 123 -9.971 3.466 -0.264 1.00 0.00 C ATOM 1923 CD1 LEU A 123 -11.325 3.490 -0.977 1.00 0.00 C ATOM 1924 CD2 LEU A 123 -9.258 2.123 -0.432 1.00 0.00 C ATOM 0 H LEU A 123 -8.452 4.378 1.641 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.233 6.477 -0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.459 4.974 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.080 4.235 -0.907 1.00 0.00 H new ATOM 0 HG LEU A 123 -10.165 3.596 0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -11.936 2.659 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.833 4.430 -0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.172 3.398 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.910 1.319 -0.090 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -9.013 1.970 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -8.341 2.121 0.158 1.00 0.00 H new ATOM 1936 N LYS A 124 -11.107 6.227 1.279 1.00 0.00 N ATOM 1937 CA LYS A 124 -12.375 6.901 1.499 1.00 0.00 C ATOM 1938 C LYS A 124 -12.160 8.087 2.441 1.00 0.00 C ATOM 1939 O LYS A 124 -13.121 8.658 2.955 1.00 0.00 O ATOM 1940 CB LYS A 124 -13.431 5.909 1.989 1.00 0.00 C ATOM 1941 CG LYS A 124 -14.185 5.285 0.813 1.00 0.00 C ATOM 1942 CD LYS A 124 -15.520 5.995 0.578 1.00 0.00 C ATOM 1943 CE LYS A 124 -16.125 5.594 -0.769 1.00 0.00 C ATOM 1944 NZ LYS A 124 -15.205 5.943 -1.874 1.00 0.00 N ATOM 0 H LYS A 124 -10.924 5.446 1.909 1.00 0.00 H new ATOM 0 HA LYS A 124 -12.760 7.304 0.562 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -12.954 5.125 2.577 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -14.135 6.417 2.648 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -13.574 5.344 -0.088 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -14.361 4.227 1.010 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -16.214 5.747 1.381 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -15.372 7.074 0.607 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -16.326 4.523 -0.780 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -17.081 6.099 -0.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -15.751 6.087 -2.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -14.693 6.817 -1.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -14.523 5.170 -2.015 1.00 0.00 H new ATOM 1958 N SER A 125 -10.894 8.423 2.640 1.00 0.00 N ATOM 1959 CA SER A 125 -10.541 9.530 3.511 1.00 0.00 C ATOM 1960 C SER A 125 -9.890 10.650 2.697 1.00 0.00 C ATOM 1961 O SER A 125 -10.038 11.827 3.025 1.00 0.00 O ATOM 1962 CB SER A 125 -9.603 9.074 4.630 1.00 0.00 C ATOM 1963 OG SER A 125 -9.875 9.739 5.861 1.00 0.00 O ATOM 0 H SER A 125 -10.100 7.947 2.212 1.00 0.00 H new ATOM 0 HA SER A 125 -11.455 9.907 3.971 1.00 0.00 H new ATOM 0 HB2 SER A 125 -9.703 7.998 4.770 1.00 0.00 H new ATOM 0 HB3 SER A 125 -8.570 9.263 4.337 1.00 0.00 H new ATOM 0 HG SER A 125 -9.256 9.418 6.550 1.00 0.00 H new ATOM 1969 N GLY A 126 -9.184 10.245 1.652 1.00 0.00 N ATOM 1970 CA GLY A 126 -8.511 11.200 0.788 1.00 0.00 C ATOM 1971 C GLY A 126 -7.313 11.833 1.500 1.00 0.00 C ATOM 1972 O GLY A 126 -7.070 11.562 2.675 1.00 0.00 O ATOM 0 H GLY A 126 -9.063 9.268 1.384 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -8.176 10.701 -0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -9.211 11.978 0.485 1.00 0.00 H new ATOM 1976 N PRO A 127 -6.578 12.687 0.738 1.00 0.00 N ATOM 1977 CA PRO A 127 -5.411 13.361 1.284 1.00 0.00 C ATOM 1978 C PRO A 127 -5.823 14.497 2.222 1.00 0.00 C ATOM 1979 O PRO A 127 -6.996 14.865 2.279 1.00 0.00 O ATOM 1980 CB PRO A 127 -4.634 13.844 0.071 1.00 0.00 C ATOM 1981 CG PRO A 127 -5.618 13.833 -1.087 1.00 0.00 C ATOM 1982 CD PRO A 127 -6.836 13.032 -0.657 1.00 0.00 C ATOM 0 HA PRO A 127 -4.795 12.705 1.900 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -4.236 14.845 0.236 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -3.784 13.193 -0.133 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -5.905 14.850 -1.354 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -5.162 13.388 -1.971 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -7.750 13.617 -0.758 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -6.959 12.139 -1.270 1.00 0.00 H new ATOM 1990 N SER A 128 -4.836 15.022 2.933 1.00 0.00 N ATOM 1991 CA SER A 128 -5.082 16.109 3.865 1.00 0.00 C ATOM 1992 C SER A 128 -3.760 16.592 4.465 1.00 0.00 C ATOM 1993 O SER A 128 -2.739 15.913 4.355 1.00 0.00 O ATOM 1994 CB SER A 128 -6.042 15.676 4.975 1.00 0.00 C ATOM 1995 OG SER A 128 -7.399 15.965 4.650 1.00 0.00 O ATOM 0 H SER A 128 -3.865 14.715 2.882 1.00 0.00 H new ATOM 0 HA SER A 128 -5.548 16.930 3.319 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.932 14.606 5.153 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.776 16.182 5.903 1.00 0.00 H new ATOM 0 HG SER A 128 -7.591 15.653 3.741 1.00 0.00 H new ATOM 2001 N SER A 129 -3.821 17.760 5.087 1.00 0.00 N ATOM 2002 CA SER A 129 -2.641 18.342 5.705 1.00 0.00 C ATOM 2003 C SER A 129 -3.028 19.062 6.997 1.00 0.00 C ATOM 2004 O SER A 129 -3.529 20.185 6.961 1.00 0.00 O ATOM 2005 CB SER A 129 -1.939 19.308 4.749 1.00 0.00 C ATOM 2006 OG SER A 129 -1.165 18.621 3.768 1.00 0.00 O ATOM 0 H SER A 129 -4.669 18.320 5.177 1.00 0.00 H new ATOM 0 HA SER A 129 -1.946 17.536 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 129 -2.683 19.931 4.253 1.00 0.00 H new ATOM 0 HB3 SER A 129 -1.292 19.976 5.318 1.00 0.00 H new ATOM 0 HG SER A 129 -1.394 17.668 3.779 1.00 0.00 H new ATOM 2012 N GLY A 130 -2.782 18.386 8.110 1.00 0.00 N ATOM 2013 CA GLY A 130 -3.099 18.948 9.412 1.00 0.00 C ATOM 2014 C GLY A 130 -3.739 17.897 10.322 1.00 0.00 C ATOM 2015 O GLY A 130 -3.945 18.141 11.510 1.00 0.00 O ATOM 0 H GLY A 130 -2.367 17.455 8.137 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.191 19.332 9.877 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.778 19.792 9.292 1.00 0.00 H new TER 2019 GLY A 130