USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 606 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 NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 83 SER OG : rot 180:sc= 0.226 USER MOD Set 1.2: A 86 SER OG : rot -72:sc= 0.237 USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.0862 (180deg=0) USER MOD Single : A 2 SER OG : rot 31:sc= 1.26 USER MOD Single : A 3 SER OG : rot 31:sc= 1.28 USER MOD Single : A 5 SER OG : rot 40:sc= 1.24 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 30:sc= 0.405 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0153 USER MOD Single : A 20 SER OG : rot 180:sc= -0.0233 USER MOD Single : A 22 HIS : no HD1:sc= -0.0495 X(o=-0.049,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.415 X(o=0.41,f=-0.074) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc=-0.000616 X(o=-0.00062,f=0) USER MOD Single : A 43 GLN : amide:sc= -0.517 X(o=-0.52,f=-0.86) USER MOD Single : A 45 SER OG : rot 26:sc= 0.529 USER MOD Single : A 46 TYR OH : rot -15:sc= 0.296 USER MOD Single : A 49 MET CE :methyl 177:sc= -0.148 (180deg=-0.172) USER MOD Single : A 54 ASN : amide:sc= -1.91 K(o=-1.9,f=-4.4!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -133:sc= -0.807 (180deg=-1.12) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.778 84.292 -22.494 1.00 0.00 N ATOM 2 CA GLY A 1 -25.384 84.184 -22.884 1.00 0.00 C ATOM 3 C GLY A 1 -24.945 82.745 -23.071 1.00 0.00 C ATOM 4 O GLY A 1 -25.762 81.827 -23.012 1.00 0.00 O ATOM 0 H1 GLY A 1 -27.282 84.900 -23.171 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.211 83.347 -22.488 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.841 84.707 -21.543 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -25.226 84.733 -23.813 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -24.760 84.656 -22.125 1.00 0.00 H new ATOM 8 N SER A 2 -23.650 82.549 -23.299 1.00 0.00 N ATOM 9 CA SER A 2 -23.104 81.212 -23.501 1.00 0.00 C ATOM 10 C SER A 2 -21.580 81.252 -23.569 1.00 0.00 C ATOM 11 O SER A 2 -20.978 82.324 -23.620 1.00 0.00 O ATOM 12 CB SER A 2 -23.667 80.596 -24.783 1.00 0.00 C ATOM 13 OG SER A 2 -24.879 79.908 -24.529 1.00 0.00 O ATOM 0 H SER A 2 -22.960 83.299 -23.348 1.00 0.00 H new ATOM 0 HA SER A 2 -23.397 80.595 -22.651 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.838 81.379 -25.522 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.937 79.908 -25.210 1.00 0.00 H new ATOM 0 HG SER A 2 -25.349 80.338 -23.784 1.00 0.00 H new ATOM 19 N SER A 3 -20.963 80.075 -23.568 1.00 0.00 N ATOM 20 CA SER A 3 -19.509 79.974 -23.626 1.00 0.00 C ATOM 21 C SER A 3 -19.070 78.518 -23.746 1.00 0.00 C ATOM 22 O SER A 3 -19.895 77.605 -23.728 1.00 0.00 O ATOM 23 CB SER A 3 -18.883 80.606 -22.381 1.00 0.00 C ATOM 24 OG SER A 3 -18.619 81.983 -22.587 1.00 0.00 O ATOM 0 H SER A 3 -21.447 79.178 -23.528 1.00 0.00 H new ATOM 0 HA SER A 3 -19.167 80.513 -24.510 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.554 80.484 -21.531 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.957 80.088 -22.133 1.00 0.00 H new ATOM 0 HG SER A 3 -19.282 82.354 -23.206 1.00 0.00 H new ATOM 30 N GLY A 4 -17.763 78.308 -23.869 1.00 0.00 N ATOM 31 CA GLY A 4 -17.235 76.962 -23.991 1.00 0.00 C ATOM 32 C GLY A 4 -15.736 76.905 -23.776 1.00 0.00 C ATOM 33 O GLY A 4 -15.100 77.927 -23.518 1.00 0.00 O ATOM 0 H GLY A 4 -17.060 79.047 -23.886 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -17.728 76.315 -23.265 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.472 76.570 -24.980 1.00 0.00 H new ATOM 37 N SER A 5 -15.170 75.707 -23.879 1.00 0.00 N ATOM 38 CA SER A 5 -13.736 75.520 -23.688 1.00 0.00 C ATOM 39 C SER A 5 -13.329 74.084 -24.004 1.00 0.00 C ATOM 40 O SER A 5 -14.174 73.237 -24.295 1.00 0.00 O ATOM 41 CB SER A 5 -13.341 75.870 -22.253 1.00 0.00 C ATOM 42 OG SER A 5 -13.001 77.241 -22.137 1.00 0.00 O ATOM 0 H SER A 5 -15.682 74.851 -24.094 1.00 0.00 H new ATOM 0 HA SER A 5 -13.213 76.187 -24.374 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.166 75.638 -21.579 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.495 75.255 -21.945 1.00 0.00 H new ATOM 0 HG SER A 5 -13.614 77.777 -22.682 1.00 0.00 H new ATOM 48 N SER A 6 -12.028 73.817 -23.944 1.00 0.00 N ATOM 49 CA SER A 6 -11.507 72.485 -24.227 1.00 0.00 C ATOM 50 C SER A 6 -10.026 72.395 -23.873 1.00 0.00 C ATOM 51 O SER A 6 -9.401 73.390 -23.510 1.00 0.00 O ATOM 52 CB SER A 6 -11.712 72.137 -25.703 1.00 0.00 C ATOM 53 OG SER A 6 -10.724 72.749 -26.513 1.00 0.00 O ATOM 0 H SER A 6 -11.316 74.506 -23.702 1.00 0.00 H new ATOM 0 HA SER A 6 -12.054 71.770 -23.613 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.675 71.055 -25.833 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.702 72.463 -26.023 1.00 0.00 H new ATOM 0 HG SER A 6 -10.876 72.510 -27.451 1.00 0.00 H new ATOM 59 N GLY A 7 -9.470 71.192 -23.981 1.00 0.00 N ATOM 60 CA GLY A 7 -8.067 70.992 -23.669 1.00 0.00 C ATOM 61 C GLY A 7 -7.768 69.574 -23.224 1.00 0.00 C ATOM 62 O GLY A 7 -8.679 68.817 -22.888 1.00 0.00 O ATOM 0 H GLY A 7 -9.966 70.352 -24.279 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.466 71.228 -24.547 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.770 71.686 -22.883 1.00 0.00 H new ATOM 66 N SER A 8 -6.489 69.213 -23.223 1.00 0.00 N ATOM 67 CA SER A 8 -6.073 67.875 -22.821 1.00 0.00 C ATOM 68 C SER A 8 -4.551 67.765 -22.789 1.00 0.00 C ATOM 69 O SER A 8 -3.868 67.965 -23.794 1.00 0.00 O ATOM 70 CB SER A 8 -6.651 66.829 -23.778 1.00 0.00 C ATOM 71 OG SER A 8 -6.225 67.066 -25.109 1.00 0.00 O ATOM 0 H SER A 8 -5.723 69.829 -23.496 1.00 0.00 H new ATOM 0 HA SER A 8 -6.454 67.689 -21.817 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.339 65.833 -23.465 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.740 66.851 -23.732 1.00 0.00 H new ATOM 0 HG SER A 8 -5.345 67.496 -25.099 1.00 0.00 H new ATOM 77 N PRO A 9 -4.007 67.440 -21.607 1.00 0.00 N ATOM 78 CA PRO A 9 -2.561 67.296 -21.415 1.00 0.00 C ATOM 79 C PRO A 9 -2.002 66.066 -22.121 1.00 0.00 C ATOM 80 O PRO A 9 -2.723 65.366 -22.832 1.00 0.00 O ATOM 81 CB PRO A 9 -2.418 67.151 -19.897 1.00 0.00 C ATOM 82 CG PRO A 9 -3.728 66.606 -19.444 1.00 0.00 C ATOM 83 CD PRO A 9 -4.762 67.187 -20.368 1.00 0.00 C ATOM 0 HA PRO A 9 -2.009 68.139 -21.831 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -1.599 66.479 -19.639 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -2.204 68.110 -19.426 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -3.733 65.517 -19.488 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -3.929 66.884 -18.409 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.587 66.494 -20.534 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.192 68.104 -19.965 1.00 0.00 H new ATOM 91 N GLU A 10 -0.713 65.809 -21.922 1.00 0.00 N ATOM 92 CA GLU A 10 -0.058 64.663 -22.541 1.00 0.00 C ATOM 93 C GLU A 10 1.381 64.529 -22.053 1.00 0.00 C ATOM 94 O GLU A 10 2.098 65.521 -21.920 1.00 0.00 O ATOM 95 CB GLU A 10 -0.080 64.797 -24.065 1.00 0.00 C ATOM 96 CG GLU A 10 -0.054 63.464 -24.794 1.00 0.00 C ATOM 97 CD GLU A 10 -1.441 62.889 -25.007 1.00 0.00 C ATOM 98 OE1 GLU A 10 -2.140 63.350 -25.934 1.00 0.00 O ATOM 99 OE2 GLU A 10 -1.828 61.976 -24.247 1.00 0.00 O ATOM 0 H GLU A 10 -0.102 66.379 -21.337 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.606 63.766 -22.254 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -0.975 65.345 -24.360 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.777 65.391 -24.381 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.435 63.592 -25.760 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.546 62.754 -24.225 1.00 0.00 H new ATOM 106 N TYR A 11 1.797 63.296 -21.786 1.00 0.00 N ATOM 107 CA TYR A 11 3.149 63.031 -21.309 1.00 0.00 C ATOM 108 C TYR A 11 3.412 61.531 -21.223 1.00 0.00 C ATOM 109 O TYR A 11 2.513 60.718 -21.432 1.00 0.00 O ATOM 110 CB TYR A 11 3.365 63.677 -19.940 1.00 0.00 C ATOM 111 CG TYR A 11 3.847 65.108 -20.015 1.00 0.00 C ATOM 112 CD1 TYR A 11 5.017 65.434 -20.691 1.00 0.00 C ATOM 113 CD2 TYR A 11 3.133 66.135 -19.410 1.00 0.00 C ATOM 114 CE1 TYR A 11 5.461 66.740 -20.761 1.00 0.00 C ATOM 115 CE2 TYR A 11 3.569 67.445 -19.477 1.00 0.00 C ATOM 116 CZ TYR A 11 4.734 67.741 -20.153 1.00 0.00 C ATOM 117 OH TYR A 11 5.173 69.044 -20.222 1.00 0.00 O ATOM 0 H TYR A 11 1.217 62.464 -21.892 1.00 0.00 H new ATOM 0 HA TYR A 11 3.850 63.464 -22.022 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.429 63.646 -19.381 1.00 0.00 H new ATOM 0 HB3 TYR A 11 4.090 63.087 -19.380 1.00 0.00 H new ATOM 0 HD1 TYR A 11 5.589 64.653 -21.170 1.00 0.00 H new ATOM 0 HD2 TYR A 11 2.221 65.906 -18.878 1.00 0.00 H new ATOM 0 HE1 TYR A 11 6.373 66.976 -21.289 1.00 0.00 H new ATOM 0 HE2 TYR A 11 3.001 68.232 -19.003 1.00 0.00 H new ATOM 0 HH TYR A 11 4.547 69.626 -19.743 1.00 0.00 H new ATOM 127 N GLY A 12 4.654 61.171 -20.912 1.00 0.00 N ATOM 128 CA GLY A 12 5.016 59.770 -20.803 1.00 0.00 C ATOM 129 C GLY A 12 6.480 59.523 -21.109 1.00 0.00 C ATOM 130 O GLY A 12 6.949 59.817 -22.208 1.00 0.00 O ATOM 0 H GLY A 12 5.416 61.825 -20.734 1.00 0.00 H new ATOM 0 HA2 GLY A 12 4.794 59.418 -19.795 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.401 59.185 -21.487 1.00 0.00 H new ATOM 134 N MET A 13 7.204 58.983 -20.134 1.00 0.00 N ATOM 135 CA MET A 13 8.623 58.698 -20.305 1.00 0.00 C ATOM 136 C MET A 13 9.001 57.389 -19.619 1.00 0.00 C ATOM 137 O MET A 13 8.518 57.067 -18.533 1.00 0.00 O ATOM 138 CB MET A 13 9.467 59.844 -19.743 1.00 0.00 C ATOM 139 CG MET A 13 9.663 60.991 -20.721 1.00 0.00 C ATOM 140 SD MET A 13 10.637 60.516 -22.162 1.00 0.00 S ATOM 141 CE MET A 13 12.219 61.254 -21.760 1.00 0.00 C ATOM 0 H MET A 13 6.831 58.734 -19.218 1.00 0.00 H new ATOM 0 HA MET A 13 8.822 58.599 -21.372 1.00 0.00 H new ATOM 0 HB2 MET A 13 8.991 60.225 -18.839 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.443 59.456 -19.450 1.00 0.00 H new ATOM 0 HG2 MET A 13 8.689 61.354 -21.049 1.00 0.00 H new ATOM 0 HG3 MET A 13 10.156 61.818 -20.211 1.00 0.00 H new ATOM 0 HE1 MET A 13 12.931 61.047 -22.559 1.00 0.00 H new ATOM 0 HE2 MET A 13 12.100 62.332 -21.650 1.00 0.00 H new ATOM 0 HE3 MET A 13 12.590 60.833 -20.825 1.00 0.00 H new ATOM 151 N PRO A 14 9.885 56.615 -20.265 1.00 0.00 N ATOM 152 CA PRO A 14 10.347 55.328 -19.735 1.00 0.00 C ATOM 153 C PRO A 14 11.240 55.493 -18.510 1.00 0.00 C ATOM 154 O PRO A 14 11.396 56.597 -17.988 1.00 0.00 O ATOM 155 CB PRO A 14 11.141 54.730 -20.899 1.00 0.00 C ATOM 156 CG PRO A 14 11.590 55.906 -21.696 1.00 0.00 C ATOM 157 CD PRO A 14 10.502 56.935 -21.564 1.00 0.00 C ATOM 0 HA PRO A 14 9.519 54.703 -19.401 1.00 0.00 H new ATOM 0 HB2 PRO A 14 11.990 54.147 -20.541 1.00 0.00 H new ATOM 0 HB3 PRO A 14 10.523 54.060 -21.496 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.539 56.291 -21.323 1.00 0.00 H new ATOM 0 HG3 PRO A 14 11.745 55.634 -22.740 1.00 0.00 H new ATOM 0 HD2 PRO A 14 10.903 57.948 -21.579 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.782 56.865 -22.379 1.00 0.00 H new ATOM 165 N SER A 15 11.824 54.389 -18.056 1.00 0.00 N ATOM 166 CA SER A 15 12.698 54.411 -16.890 1.00 0.00 C ATOM 167 C SER A 15 13.454 53.092 -16.752 1.00 0.00 C ATOM 168 O SER A 15 12.943 52.031 -17.110 1.00 0.00 O ATOM 169 CB SER A 15 11.886 54.681 -15.622 1.00 0.00 C ATOM 170 OG SER A 15 12.731 55.032 -14.540 1.00 0.00 O ATOM 0 H SER A 15 11.707 53.468 -18.478 1.00 0.00 H new ATOM 0 HA SER A 15 13.423 55.213 -17.026 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.174 55.485 -15.807 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.306 53.795 -15.362 1.00 0.00 H new ATOM 0 HG SER A 15 12.188 55.201 -13.742 1.00 0.00 H new ATOM 176 N VAL A 16 14.674 53.168 -16.231 1.00 0.00 N ATOM 177 CA VAL A 16 15.501 51.982 -16.044 1.00 0.00 C ATOM 178 C VAL A 16 16.332 52.086 -14.771 1.00 0.00 C ATOM 179 O VAL A 16 16.713 53.180 -14.352 1.00 0.00 O ATOM 180 CB VAL A 16 16.443 51.760 -17.243 1.00 0.00 C ATOM 181 CG1 VAL A 16 17.343 50.558 -16.999 1.00 0.00 C ATOM 182 CG2 VAL A 16 15.642 51.586 -18.524 1.00 0.00 C ATOM 0 H VAL A 16 15.112 54.039 -15.931 1.00 0.00 H new ATOM 0 HA VAL A 16 14.822 51.133 -15.962 1.00 0.00 H new ATOM 0 HB VAL A 16 17.076 52.641 -17.354 1.00 0.00 H new ATOM 0 HG11 VAL A 16 18.001 50.416 -17.856 1.00 0.00 H new ATOM 0 HG12 VAL A 16 17.943 50.728 -16.105 1.00 0.00 H new ATOM 0 HG13 VAL A 16 16.731 49.667 -16.861 1.00 0.00 H new ATOM 0 HG21 VAL A 16 16.323 51.430 -19.361 1.00 0.00 H new ATOM 0 HG22 VAL A 16 14.983 50.723 -18.427 1.00 0.00 H new ATOM 0 HG23 VAL A 16 15.045 52.480 -18.704 1.00 0.00 H new ATOM 192 N THR A 17 16.612 50.940 -14.157 1.00 0.00 N ATOM 193 CA THR A 17 17.398 50.902 -12.931 1.00 0.00 C ATOM 194 C THR A 17 18.254 49.642 -12.865 1.00 0.00 C ATOM 195 O THR A 17 17.891 48.604 -13.418 1.00 0.00 O ATOM 196 CB THR A 17 16.496 50.962 -11.683 1.00 0.00 C ATOM 197 OG1 THR A 17 15.558 52.037 -11.808 1.00 0.00 O ATOM 198 CG2 THR A 17 17.327 51.151 -10.423 1.00 0.00 C ATOM 0 H THR A 17 16.305 50.026 -14.490 1.00 0.00 H new ATOM 0 HA THR A 17 18.046 51.778 -12.944 1.00 0.00 H new ATOM 0 HB THR A 17 15.957 50.018 -11.605 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.987 52.068 -11.012 1.00 0.00 H new ATOM 0 HG21 THR A 17 16.668 51.190 -9.555 1.00 0.00 H new ATOM 0 HG22 THR A 17 18.020 50.316 -10.315 1.00 0.00 H new ATOM 0 HG23 THR A 17 17.889 52.082 -10.494 1.00 0.00 H new ATOM 206 N PHE A 18 19.391 49.740 -12.185 1.00 0.00 N ATOM 207 CA PHE A 18 20.299 48.607 -12.047 1.00 0.00 C ATOM 208 C PHE A 18 20.622 48.344 -10.579 1.00 0.00 C ATOM 209 O PHE A 18 20.162 49.063 -9.693 1.00 0.00 O ATOM 210 CB PHE A 18 21.590 48.863 -12.827 1.00 0.00 C ATOM 211 CG PHE A 18 22.249 47.608 -13.325 1.00 0.00 C ATOM 212 CD1 PHE A 18 21.551 46.711 -14.117 1.00 0.00 C ATOM 213 CD2 PHE A 18 23.566 47.326 -13.002 1.00 0.00 C ATOM 214 CE1 PHE A 18 22.154 45.555 -14.576 1.00 0.00 C ATOM 215 CE2 PHE A 18 24.175 46.172 -13.458 1.00 0.00 C ATOM 216 CZ PHE A 18 23.468 45.286 -14.247 1.00 0.00 C ATOM 0 H PHE A 18 19.706 50.592 -11.721 1.00 0.00 H new ATOM 0 HA PHE A 18 19.805 47.726 -12.455 1.00 0.00 H new ATOM 0 HB2 PHE A 18 21.370 49.510 -13.676 1.00 0.00 H new ATOM 0 HB3 PHE A 18 22.290 49.403 -12.189 1.00 0.00 H new ATOM 0 HD1 PHE A 18 20.524 46.917 -14.379 1.00 0.00 H new ATOM 0 HD2 PHE A 18 24.124 48.016 -12.386 1.00 0.00 H new ATOM 0 HE1 PHE A 18 21.598 44.863 -15.191 1.00 0.00 H new ATOM 0 HE2 PHE A 18 25.202 45.963 -13.198 1.00 0.00 H new ATOM 0 HZ PHE A 18 23.942 44.384 -14.606 1.00 0.00 H new ATOM 226 N GLY A 19 21.417 47.307 -10.331 1.00 0.00 N ATOM 227 CA GLY A 19 21.788 46.967 -8.970 1.00 0.00 C ATOM 228 C GLY A 19 22.155 45.504 -8.818 1.00 0.00 C ATOM 229 O GLY A 19 21.726 44.664 -9.608 1.00 0.00 O ATOM 0 H GLY A 19 21.810 46.697 -11.048 1.00 0.00 H new ATOM 0 HA2 GLY A 19 22.632 47.584 -8.662 1.00 0.00 H new ATOM 0 HA3 GLY A 19 20.960 47.202 -8.301 1.00 0.00 H new ATOM 233 N SER A 20 22.952 45.198 -7.799 1.00 0.00 N ATOM 234 CA SER A 20 23.382 43.827 -7.549 1.00 0.00 C ATOM 235 C SER A 20 23.626 43.597 -6.061 1.00 0.00 C ATOM 236 O SER A 20 23.613 44.537 -5.265 1.00 0.00 O ATOM 237 CB SER A 20 24.654 43.517 -8.340 1.00 0.00 C ATOM 238 OG SER A 20 24.898 42.122 -8.387 1.00 0.00 O ATOM 0 H SER A 20 23.313 45.881 -7.133 1.00 0.00 H new ATOM 0 HA SER A 20 22.587 43.157 -7.877 1.00 0.00 H new ATOM 0 HB2 SER A 20 24.560 43.907 -9.353 1.00 0.00 H new ATOM 0 HB3 SER A 20 25.504 44.023 -7.881 1.00 0.00 H new ATOM 0 HG SER A 20 25.715 41.950 -8.900 1.00 0.00 H new ATOM 244 N VAL A 21 23.850 42.340 -5.692 1.00 0.00 N ATOM 245 CA VAL A 21 24.099 41.985 -4.300 1.00 0.00 C ATOM 246 C VAL A 21 24.825 40.649 -4.195 1.00 0.00 C ATOM 247 O VAL A 21 24.592 39.739 -4.991 1.00 0.00 O ATOM 248 CB VAL A 21 22.786 41.907 -3.497 1.00 0.00 C ATOM 249 CG1 VAL A 21 21.860 40.856 -4.088 1.00 0.00 C ATOM 250 CG2 VAL A 21 23.074 41.613 -2.033 1.00 0.00 C ATOM 0 H VAL A 21 23.864 41.550 -6.338 1.00 0.00 H new ATOM 0 HA VAL A 21 24.727 42.771 -3.881 1.00 0.00 H new ATOM 0 HB VAL A 21 22.285 42.873 -3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 21 20.938 40.815 -3.508 1.00 0.00 H new ATOM 0 HG12 VAL A 21 21.627 41.115 -5.121 1.00 0.00 H new ATOM 0 HG13 VAL A 21 22.350 39.883 -4.060 1.00 0.00 H new ATOM 0 HG21 VAL A 21 22.136 41.561 -1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 21 23.597 40.660 -1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 21 23.696 42.406 -1.618 1.00 0.00 H new ATOM 260 N HIS A 22 25.707 40.537 -3.207 1.00 0.00 N ATOM 261 CA HIS A 22 26.468 39.310 -2.996 1.00 0.00 C ATOM 262 C HIS A 22 25.768 38.402 -1.990 1.00 0.00 C ATOM 263 O HIS A 22 24.955 38.845 -1.178 1.00 0.00 O ATOM 264 CB HIS A 22 27.880 39.639 -2.509 1.00 0.00 C ATOM 265 CG HIS A 22 28.861 39.860 -3.619 1.00 0.00 C ATOM 266 ND1 HIS A 22 29.643 40.991 -3.717 1.00 0.00 N ATOM 267 CD2 HIS A 22 29.185 39.087 -4.681 1.00 0.00 C ATOM 268 CE1 HIS A 22 30.405 40.905 -4.792 1.00 0.00 C ATOM 269 NE2 HIS A 22 30.147 39.758 -5.395 1.00 0.00 N ATOM 0 H HIS A 22 25.913 41.281 -2.540 1.00 0.00 H new ATOM 0 HA HIS A 22 26.533 38.784 -3.948 1.00 0.00 H new ATOM 0 HB2 HIS A 22 27.841 40.533 -1.886 1.00 0.00 H new ATOM 0 HB3 HIS A 22 28.236 38.825 -1.877 1.00 0.00 H new ATOM 0 HD2 HIS A 22 28.765 38.122 -4.922 1.00 0.00 H new ATOM 0 HE1 HIS A 22 31.118 41.646 -5.122 1.00 0.00 H new ATOM 0 HE2 HIS A 22 30.590 39.425 -6.251 1.00 0.00 H new ATOM 278 N PRO A 23 26.088 37.101 -2.044 1.00 0.00 N ATOM 279 CA PRO A 23 25.501 36.103 -1.145 1.00 0.00 C ATOM 280 C PRO A 23 25.983 36.263 0.293 1.00 0.00 C ATOM 281 O PRO A 23 26.964 35.642 0.701 1.00 0.00 O ATOM 282 CB PRO A 23 25.985 34.773 -1.726 1.00 0.00 C ATOM 283 CG PRO A 23 27.241 35.111 -2.451 1.00 0.00 C ATOM 284 CD PRO A 23 27.049 36.503 -2.986 1.00 0.00 C ATOM 0 HA PRO A 23 24.416 36.191 -1.092 1.00 0.00 H new ATOM 0 HB2 PRO A 23 26.167 34.040 -0.940 1.00 0.00 H new ATOM 0 HB3 PRO A 23 25.244 34.342 -2.399 1.00 0.00 H new ATOM 0 HG2 PRO A 23 28.101 35.065 -1.783 1.00 0.00 H new ATOM 0 HG3 PRO A 23 27.427 34.404 -3.260 1.00 0.00 H new ATOM 0 HD2 PRO A 23 27.987 37.058 -3.009 1.00 0.00 H new ATOM 0 HD3 PRO A 23 26.660 36.492 -4.004 1.00 0.00 H new ATOM 292 N SER A 24 25.287 37.100 1.056 1.00 0.00 N ATOM 293 CA SER A 24 25.647 37.344 2.448 1.00 0.00 C ATOM 294 C SER A 24 25.720 36.034 3.228 1.00 0.00 C ATOM 295 O SER A 24 25.286 34.988 2.747 1.00 0.00 O ATOM 296 CB SER A 24 24.633 38.284 3.102 1.00 0.00 C ATOM 297 OG SER A 24 25.190 38.925 4.237 1.00 0.00 O ATOM 0 H SER A 24 24.471 37.620 0.734 1.00 0.00 H new ATOM 0 HA SER A 24 26.631 37.813 2.466 1.00 0.00 H new ATOM 0 HB2 SER A 24 24.309 39.033 2.380 1.00 0.00 H new ATOM 0 HB3 SER A 24 23.747 37.721 3.397 1.00 0.00 H new ATOM 0 HG SER A 24 24.523 39.522 4.636 1.00 0.00 H new ATOM 303 N ASP A 25 26.272 36.102 4.434 1.00 0.00 N ATOM 304 CA ASP A 25 26.401 34.923 5.283 1.00 0.00 C ATOM 305 C ASP A 25 25.213 34.803 6.232 1.00 0.00 C ATOM 306 O ASP A 25 25.268 35.260 7.374 1.00 0.00 O ATOM 307 CB ASP A 25 27.704 34.984 6.082 1.00 0.00 C ATOM 308 CG ASP A 25 28.248 33.607 6.408 1.00 0.00 C ATOM 309 OD1 ASP A 25 28.041 32.679 5.598 1.00 0.00 O ATOM 310 OD2 ASP A 25 28.882 33.457 7.473 1.00 0.00 O ATOM 0 H ASP A 25 26.637 36.961 4.846 1.00 0.00 H new ATOM 0 HA ASP A 25 26.419 34.043 4.640 1.00 0.00 H new ATOM 0 HB2 ASP A 25 28.449 35.541 5.514 1.00 0.00 H new ATOM 0 HB3 ASP A 25 27.534 35.533 7.008 1.00 0.00 H new ATOM 315 N VAL A 26 24.138 34.187 5.751 1.00 0.00 N ATOM 316 CA VAL A 26 22.936 34.007 6.556 1.00 0.00 C ATOM 317 C VAL A 26 21.984 33.008 5.907 1.00 0.00 C ATOM 318 O VAL A 26 21.621 33.148 4.739 1.00 0.00 O ATOM 319 CB VAL A 26 22.196 35.341 6.767 1.00 0.00 C ATOM 320 CG1 VAL A 26 21.723 35.906 5.435 1.00 0.00 C ATOM 321 CG2 VAL A 26 21.027 35.157 7.722 1.00 0.00 C ATOM 0 H VAL A 26 24.075 33.804 4.808 1.00 0.00 H new ATOM 0 HA VAL A 26 23.258 33.622 7.523 1.00 0.00 H new ATOM 0 HB VAL A 26 22.890 36.054 7.212 1.00 0.00 H new ATOM 0 HG11 VAL A 26 21.202 36.849 5.604 1.00 0.00 H new ATOM 0 HG12 VAL A 26 22.582 36.077 4.787 1.00 0.00 H new ATOM 0 HG13 VAL A 26 21.045 35.197 4.959 1.00 0.00 H new ATOM 0 HG21 VAL A 26 20.516 36.110 7.859 1.00 0.00 H new ATOM 0 HG22 VAL A 26 20.330 34.428 7.308 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.396 34.801 8.684 1.00 0.00 H new ATOM 331 N LEU A 27 21.582 31.999 6.673 1.00 0.00 N ATOM 332 CA LEU A 27 20.671 30.975 6.173 1.00 0.00 C ATOM 333 C LEU A 27 19.278 31.551 5.944 1.00 0.00 C ATOM 334 O LEU A 27 18.973 32.660 6.385 1.00 0.00 O ATOM 335 CB LEU A 27 20.597 29.807 7.157 1.00 0.00 C ATOM 336 CG LEU A 27 19.829 30.069 8.453 1.00 0.00 C ATOM 337 CD1 LEU A 27 19.580 28.767 9.199 1.00 0.00 C ATOM 338 CD2 LEU A 27 20.586 31.053 9.333 1.00 0.00 C ATOM 0 H LEU A 27 21.872 31.868 7.642 1.00 0.00 H new ATOM 0 HA LEU A 27 21.056 30.615 5.219 1.00 0.00 H new ATOM 0 HB2 LEU A 27 20.136 28.959 6.650 1.00 0.00 H new ATOM 0 HB3 LEU A 27 21.614 29.510 7.414 1.00 0.00 H new ATOM 0 HG LEU A 27 18.865 30.508 8.198 1.00 0.00 H new ATOM 0 HD11 LEU A 27 19.032 28.974 10.119 1.00 0.00 H new ATOM 0 HD12 LEU A 27 18.995 28.094 8.572 1.00 0.00 H new ATOM 0 HD13 LEU A 27 20.534 28.299 9.442 1.00 0.00 H new ATOM 0 HD21 LEU A 27 20.024 31.227 10.251 1.00 0.00 H new ATOM 0 HD22 LEU A 27 21.565 30.642 9.579 1.00 0.00 H new ATOM 0 HD23 LEU A 27 20.712 31.996 8.800 1.00 0.00 H new ATOM 350 N ASP A 28 18.435 30.791 5.253 1.00 0.00 N ATOM 351 CA ASP A 28 17.072 31.225 4.967 1.00 0.00 C ATOM 352 C ASP A 28 16.196 30.039 4.575 1.00 0.00 C ATOM 353 O ASP A 28 16.632 29.146 3.849 1.00 0.00 O ATOM 354 CB ASP A 28 17.070 32.269 3.850 1.00 0.00 C ATOM 355 CG ASP A 28 17.834 33.522 4.227 1.00 0.00 C ATOM 356 OD1 ASP A 28 17.313 34.314 5.040 1.00 0.00 O ATOM 357 OD2 ASP A 28 18.955 33.712 3.709 1.00 0.00 O ATOM 0 H ASP A 28 18.671 29.871 4.881 1.00 0.00 H new ATOM 0 HA ASP A 28 16.662 31.673 5.872 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.509 31.836 2.951 1.00 0.00 H new ATOM 0 HB3 ASP A 28 16.041 32.534 3.606 1.00 0.00 H new ATOM 362 N MET A 29 14.959 30.038 5.061 1.00 0.00 N ATOM 363 CA MET A 29 14.022 28.962 4.761 1.00 0.00 C ATOM 364 C MET A 29 14.229 28.440 3.342 1.00 0.00 C ATOM 365 O MET A 29 14.148 29.183 2.364 1.00 0.00 O ATOM 366 CB MET A 29 12.582 29.448 4.932 1.00 0.00 C ATOM 367 CG MET A 29 12.139 29.536 6.383 1.00 0.00 C ATOM 368 SD MET A 29 12.088 27.926 7.193 1.00 0.00 S ATOM 369 CE MET A 29 10.780 28.189 8.388 1.00 0.00 C ATOM 0 H MET A 29 14.583 30.770 5.664 1.00 0.00 H new ATOM 0 HA MET A 29 14.208 28.147 5.460 1.00 0.00 H new ATOM 0 HB2 MET A 29 12.481 30.430 4.470 1.00 0.00 H new ATOM 0 HB3 MET A 29 11.914 28.774 4.397 1.00 0.00 H new ATOM 0 HG2 MET A 29 12.819 30.191 6.927 1.00 0.00 H new ATOM 0 HG3 MET A 29 11.151 29.993 6.430 1.00 0.00 H new ATOM 0 HE1 MET A 29 10.629 27.279 8.969 1.00 0.00 H new ATOM 0 HE2 MET A 29 11.056 29.004 9.056 1.00 0.00 H new ATOM 0 HE3 MET A 29 9.857 28.444 7.867 1.00 0.00 H new ATOM 379 N PRO A 30 14.504 27.132 3.226 1.00 0.00 N ATOM 380 CA PRO A 30 14.729 26.483 1.931 1.00 0.00 C ATOM 381 C PRO A 30 13.453 26.389 1.101 1.00 0.00 C ATOM 382 O PRO A 30 12.354 26.275 1.644 1.00 0.00 O ATOM 383 CB PRO A 30 15.221 25.085 2.316 1.00 0.00 C ATOM 384 CG PRO A 30 14.655 24.845 3.673 1.00 0.00 C ATOM 385 CD PRO A 30 14.617 26.187 4.349 1.00 0.00 C ATOM 0 HA PRO A 30 15.431 27.041 1.311 1.00 0.00 H new ATOM 0 HB2 PRO A 30 14.876 24.334 1.605 1.00 0.00 H new ATOM 0 HB3 PRO A 30 16.310 25.038 2.327 1.00 0.00 H new ATOM 0 HG2 PRO A 30 13.657 24.412 3.608 1.00 0.00 H new ATOM 0 HG3 PRO A 30 15.271 24.143 4.234 1.00 0.00 H new ATOM 0 HD2 PRO A 30 13.770 26.270 5.030 1.00 0.00 H new ATOM 0 HD3 PRO A 30 15.518 26.367 4.936 1.00 0.00 H new ATOM 393 N VAL A 31 13.607 26.437 -0.219 1.00 0.00 N ATOM 394 CA VAL A 31 12.467 26.355 -1.124 1.00 0.00 C ATOM 395 C VAL A 31 11.888 24.945 -1.153 1.00 0.00 C ATOM 396 O VAL A 31 12.623 23.963 -1.263 1.00 0.00 O ATOM 397 CB VAL A 31 12.857 26.768 -2.556 1.00 0.00 C ATOM 398 CG1 VAL A 31 13.756 25.717 -3.189 1.00 0.00 C ATOM 399 CG2 VAL A 31 11.613 26.996 -3.402 1.00 0.00 C ATOM 0 H VAL A 31 14.510 26.532 -0.685 1.00 0.00 H new ATOM 0 HA VAL A 31 11.713 27.046 -0.747 1.00 0.00 H new ATOM 0 HB VAL A 31 13.412 27.705 -2.507 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.021 26.026 -4.200 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.662 25.607 -2.594 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.230 24.763 -3.227 1.00 0.00 H new ATOM 0 HG21 VAL A 31 11.907 27.287 -4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 31 11.029 26.077 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.010 27.788 -2.957 1.00 0.00 H new ATOM 409 N ASP A 32 10.566 24.852 -1.054 1.00 0.00 N ATOM 410 CA ASP A 32 9.887 23.561 -1.071 1.00 0.00 C ATOM 411 C ASP A 32 9.326 23.260 -2.457 1.00 0.00 C ATOM 412 O ASP A 32 8.995 24.161 -3.229 1.00 0.00 O ATOM 413 CB ASP A 32 8.762 23.540 -0.036 1.00 0.00 C ATOM 414 CG ASP A 32 9.039 24.455 1.140 1.00 0.00 C ATOM 415 OD1 ASP A 32 10.214 24.550 1.554 1.00 0.00 O ATOM 416 OD2 ASP A 32 8.082 25.077 1.648 1.00 0.00 O ATOM 0 H ASP A 32 9.944 25.655 -0.961 1.00 0.00 H new ATOM 0 HA ASP A 32 10.616 22.791 -0.820 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.828 23.839 -0.513 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.624 22.521 0.325 1.00 0.00 H new ATOM 421 N PRO A 33 9.218 21.964 -2.783 1.00 0.00 N ATOM 422 CA PRO A 33 8.698 21.514 -4.078 1.00 0.00 C ATOM 423 C PRO A 33 7.203 21.777 -4.225 1.00 0.00 C ATOM 424 O PRO A 33 6.752 22.295 -5.246 1.00 0.00 O ATOM 425 CB PRO A 33 8.978 20.009 -4.069 1.00 0.00 C ATOM 426 CG PRO A 33 9.026 19.641 -2.626 1.00 0.00 C ATOM 427 CD PRO A 33 9.594 20.837 -1.913 1.00 0.00 C ATOM 0 HA PRO A 33 9.163 22.043 -4.910 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.197 19.458 -4.592 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.919 19.778 -4.568 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.031 19.399 -2.251 1.00 0.00 H new ATOM 0 HG3 PRO A 33 9.649 18.760 -2.468 1.00 0.00 H new ATOM 0 HD2 PRO A 33 9.175 20.945 -0.913 1.00 0.00 H new ATOM 0 HD3 PRO A 33 10.675 20.761 -1.799 1.00 0.00 H new ATOM 435 N ASN A 34 6.439 21.417 -3.199 1.00 0.00 N ATOM 436 CA ASN A 34 4.995 21.614 -3.215 1.00 0.00 C ATOM 437 C ASN A 34 4.388 21.093 -4.514 1.00 0.00 C ATOM 438 O ASN A 34 3.341 21.565 -4.954 1.00 0.00 O ATOM 439 CB ASN A 34 4.660 23.097 -3.041 1.00 0.00 C ATOM 440 CG ASN A 34 3.331 23.312 -2.342 1.00 0.00 C ATOM 441 OD1 ASN A 34 3.284 23.566 -1.139 1.00 0.00 O ATOM 442 ND2 ASN A 34 2.243 23.210 -3.096 1.00 0.00 N ATOM 0 H ASN A 34 6.796 20.987 -2.346 1.00 0.00 H new ATOM 0 HA ASN A 34 4.568 21.052 -2.385 1.00 0.00 H new ATOM 0 HB2 ASN A 34 5.451 23.580 -2.468 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.635 23.578 -4.019 1.00 0.00 H new ATOM 0 HD21 ASN A 34 1.321 23.344 -2.681 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.329 22.998 -4.090 1.00 0.00 H new ATOM 449 N GLU A 35 5.056 20.118 -5.122 1.00 0.00 N ATOM 450 CA GLU A 35 4.582 19.533 -6.372 1.00 0.00 C ATOM 451 C GLU A 35 3.763 18.273 -6.107 1.00 0.00 C ATOM 452 O GLU A 35 3.849 17.658 -5.044 1.00 0.00 O ATOM 453 CB GLU A 35 5.764 19.202 -7.286 1.00 0.00 C ATOM 454 CG GLU A 35 6.158 20.344 -8.208 1.00 0.00 C ATOM 455 CD GLU A 35 7.476 20.094 -8.915 1.00 0.00 C ATOM 456 OE1 GLU A 35 8.530 20.176 -8.250 1.00 0.00 O ATOM 457 OE2 GLU A 35 7.454 19.817 -10.132 1.00 0.00 O ATOM 0 H GLU A 35 5.925 19.717 -4.771 1.00 0.00 H new ATOM 0 HA GLU A 35 3.943 20.264 -6.866 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.622 18.929 -6.672 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.513 18.329 -7.889 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.374 20.494 -8.951 1.00 0.00 H new ATOM 0 HG3 GLU A 35 6.229 21.265 -7.630 1.00 0.00 H new ATOM 464 N PRO A 36 2.946 17.881 -7.096 1.00 0.00 N ATOM 465 CA PRO A 36 2.094 16.692 -6.994 1.00 0.00 C ATOM 466 C PRO A 36 2.901 15.398 -7.013 1.00 0.00 C ATOM 467 O PRO A 36 3.950 15.316 -7.653 1.00 0.00 O ATOM 468 CB PRO A 36 1.204 16.786 -8.236 1.00 0.00 C ATOM 469 CG PRO A 36 1.996 17.588 -9.209 1.00 0.00 C ATOM 470 CD PRO A 36 2.792 18.566 -8.390 1.00 0.00 C ATOM 0 HA PRO A 36 1.539 16.667 -6.056 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.973 15.798 -8.633 1.00 0.00 H new ATOM 0 HB3 PRO A 36 0.254 17.268 -8.007 1.00 0.00 H new ATOM 0 HG2 PRO A 36 2.652 16.948 -9.799 1.00 0.00 H new ATOM 0 HG3 PRO A 36 1.342 18.107 -9.910 1.00 0.00 H new ATOM 0 HD2 PRO A 36 3.757 18.782 -8.848 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.271 19.517 -8.282 1.00 0.00 H new ATOM 478 N THR A 37 2.404 14.386 -6.307 1.00 0.00 N ATOM 479 CA THR A 37 3.079 13.096 -6.243 1.00 0.00 C ATOM 480 C THR A 37 2.292 12.026 -6.992 1.00 0.00 C ATOM 481 O THR A 37 1.082 11.892 -6.812 1.00 0.00 O ATOM 482 CB THR A 37 3.283 12.641 -4.785 1.00 0.00 C ATOM 483 OG1 THR A 37 2.015 12.471 -4.143 1.00 0.00 O ATOM 484 CG2 THR A 37 4.117 13.653 -4.014 1.00 0.00 C ATOM 0 H THR A 37 1.537 14.436 -5.772 1.00 0.00 H new ATOM 0 HA THR A 37 4.053 13.225 -6.716 1.00 0.00 H new ATOM 0 HB THR A 37 3.814 11.689 -4.795 1.00 0.00 H new ATOM 0 HG1 THR A 37 2.153 12.180 -3.217 1.00 0.00 H new ATOM 0 HG21 THR A 37 4.248 13.310 -2.988 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.093 13.757 -4.489 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.609 14.617 -4.013 1.00 0.00 H new ATOM 492 N TYR A 38 2.987 11.266 -7.831 1.00 0.00 N ATOM 493 CA TYR A 38 2.353 10.209 -8.609 1.00 0.00 C ATOM 494 C TYR A 38 2.834 8.835 -8.154 1.00 0.00 C ATOM 495 O TYR A 38 2.042 7.998 -7.719 1.00 0.00 O ATOM 496 CB TYR A 38 2.646 10.397 -10.098 1.00 0.00 C ATOM 497 CG TYR A 38 2.101 11.689 -10.664 1.00 0.00 C ATOM 498 CD1 TYR A 38 2.654 12.913 -10.312 1.00 0.00 C ATOM 499 CD2 TYR A 38 1.032 11.685 -11.553 1.00 0.00 C ATOM 500 CE1 TYR A 38 2.159 14.096 -10.825 1.00 0.00 C ATOM 501 CE2 TYR A 38 0.531 12.863 -12.073 1.00 0.00 C ATOM 502 CZ TYR A 38 1.098 14.065 -11.706 1.00 0.00 C ATOM 503 OH TYR A 38 0.602 15.241 -12.221 1.00 0.00 O ATOM 0 H TYR A 38 3.990 11.363 -7.990 1.00 0.00 H new ATOM 0 HA TYR A 38 1.277 10.269 -8.447 1.00 0.00 H new ATOM 0 HB2 TYR A 38 3.724 10.368 -10.254 1.00 0.00 H new ATOM 0 HB3 TYR A 38 2.221 9.560 -10.652 1.00 0.00 H new ATOM 0 HD1 TYR A 38 3.486 12.941 -9.624 1.00 0.00 H new ATOM 0 HD2 TYR A 38 0.586 10.745 -11.842 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.600 15.039 -10.538 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -0.300 12.842 -12.763 1.00 0.00 H new ATOM 0 HH TYR A 38 -0.143 15.044 -12.826 1.00 0.00 H new ATOM 513 N CYS A 39 4.140 8.608 -8.257 1.00 0.00 N ATOM 514 CA CYS A 39 4.730 7.336 -7.857 1.00 0.00 C ATOM 515 C CYS A 39 4.022 6.771 -6.630 1.00 0.00 C ATOM 516 O CYS A 39 3.449 7.514 -5.831 1.00 0.00 O ATOM 517 CB CYS A 39 6.221 7.512 -7.564 1.00 0.00 C ATOM 518 SG CYS A 39 7.167 5.956 -7.564 1.00 0.00 S ATOM 0 H CYS A 39 4.810 9.289 -8.614 1.00 0.00 H new ATOM 0 HA CYS A 39 4.609 6.632 -8.680 1.00 0.00 H new ATOM 0 HB2 CYS A 39 6.649 8.185 -8.307 1.00 0.00 H new ATOM 0 HB3 CYS A 39 6.335 7.994 -6.593 1.00 0.00 H new ATOM 523 N LEU A 40 4.065 5.451 -6.485 1.00 0.00 N ATOM 524 CA LEU A 40 3.428 4.784 -5.355 1.00 0.00 C ATOM 525 C LEU A 40 3.949 5.337 -4.032 1.00 0.00 C ATOM 526 O LEU A 40 3.197 5.482 -3.068 1.00 0.00 O ATOM 527 CB LEU A 40 3.674 3.276 -5.422 1.00 0.00 C ATOM 528 CG LEU A 40 3.852 2.687 -6.822 1.00 0.00 C ATOM 529 CD1 LEU A 40 5.326 2.634 -7.195 1.00 0.00 C ATOM 530 CD2 LEU A 40 3.230 1.301 -6.901 1.00 0.00 C ATOM 0 H LEU A 40 4.534 4.822 -7.136 1.00 0.00 H new ATOM 0 HA LEU A 40 2.356 4.974 -5.411 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.565 3.047 -4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.838 2.770 -4.940 1.00 0.00 H new ATOM 0 HG LEU A 40 3.341 3.334 -7.535 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.433 2.212 -8.194 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.742 3.642 -7.180 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.860 2.010 -6.478 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.366 0.898 -7.904 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.712 0.644 -6.177 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.165 1.367 -6.678 1.00 0.00 H new ATOM 542 N CYS A 41 5.241 5.645 -3.994 1.00 0.00 N ATOM 543 CA CYS A 41 5.864 6.183 -2.791 1.00 0.00 C ATOM 544 C CYS A 41 5.277 7.547 -2.438 1.00 0.00 C ATOM 545 O CYS A 41 5.521 8.078 -1.354 1.00 0.00 O ATOM 546 CB CYS A 41 7.377 6.302 -2.985 1.00 0.00 C ATOM 547 SG CYS A 41 7.875 7.579 -4.185 1.00 0.00 S ATOM 0 H CYS A 41 5.877 5.531 -4.783 1.00 0.00 H new ATOM 0 HA CYS A 41 5.662 5.496 -1.969 1.00 0.00 H new ATOM 0 HB2 CYS A 41 7.840 6.523 -2.023 1.00 0.00 H new ATOM 0 HB3 CYS A 41 7.767 5.339 -3.313 1.00 0.00 H new ATOM 552 N HIS A 42 4.501 8.108 -3.360 1.00 0.00 N ATOM 553 CA HIS A 42 3.878 9.409 -3.147 1.00 0.00 C ATOM 554 C HIS A 42 4.934 10.501 -3.006 1.00 0.00 C ATOM 555 O HIS A 42 4.952 11.235 -2.018 1.00 0.00 O ATOM 556 CB HIS A 42 2.993 9.375 -1.900 1.00 0.00 C ATOM 557 CG HIS A 42 1.597 8.904 -2.170 1.00 0.00 C ATOM 558 ND1 HIS A 42 0.516 9.269 -1.395 1.00 0.00 N ATOM 559 CD2 HIS A 42 1.107 8.094 -3.137 1.00 0.00 C ATOM 560 CE1 HIS A 42 -0.577 8.703 -1.872 1.00 0.00 C ATOM 561 NE2 HIS A 42 -0.246 7.984 -2.930 1.00 0.00 N ATOM 0 H HIS A 42 4.289 7.682 -4.262 1.00 0.00 H new ATOM 0 HA HIS A 42 3.261 9.636 -4.016 1.00 0.00 H new ATOM 0 HB2 HIS A 42 3.451 8.722 -1.157 1.00 0.00 H new ATOM 0 HB3 HIS A 42 2.953 10.374 -1.465 1.00 0.00 H new ATOM 0 HD2 HIS A 42 1.675 7.622 -3.925 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.572 8.809 -1.467 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -0.891 7.436 -3.500 1.00 0.00 H new ATOM 570 N GLN A 43 5.812 10.600 -3.999 1.00 0.00 N ATOM 571 CA GLN A 43 6.871 11.602 -3.983 1.00 0.00 C ATOM 572 C GLN A 43 6.841 12.445 -5.254 1.00 0.00 C ATOM 573 O GLN A 43 6.256 12.048 -6.261 1.00 0.00 O ATOM 574 CB GLN A 43 8.237 10.928 -3.837 1.00 0.00 C ATOM 575 CG GLN A 43 8.501 10.386 -2.441 1.00 0.00 C ATOM 576 CD GLN A 43 8.022 11.323 -1.351 1.00 0.00 C ATOM 577 OE1 GLN A 43 8.302 12.522 -1.380 1.00 0.00 O ATOM 578 NE2 GLN A 43 7.295 10.782 -0.380 1.00 0.00 N ATOM 0 H GLN A 43 5.811 9.999 -4.823 1.00 0.00 H new ATOM 0 HA GLN A 43 6.704 12.258 -3.129 1.00 0.00 H new ATOM 0 HB2 GLN A 43 8.308 10.111 -4.555 1.00 0.00 H new ATOM 0 HB3 GLN A 43 9.016 11.646 -4.093 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.005 9.422 -2.330 1.00 0.00 H new ATOM 0 HG3 GLN A 43 9.570 10.210 -2.320 1.00 0.00 H new ATOM 0 HE21 GLN A 43 7.086 9.784 -0.395 1.00 0.00 H new ATOM 0 HE22 GLN A 43 6.945 11.365 0.381 1.00 0.00 H new ATOM 587 N VAL A 44 7.476 13.612 -5.198 1.00 0.00 N ATOM 588 CA VAL A 44 7.522 14.512 -6.344 1.00 0.00 C ATOM 589 C VAL A 44 8.272 13.878 -7.511 1.00 0.00 C ATOM 590 O VAL A 44 9.314 13.251 -7.324 1.00 0.00 O ATOM 591 CB VAL A 44 8.196 15.849 -5.981 1.00 0.00 C ATOM 592 CG1 VAL A 44 9.567 15.607 -5.370 1.00 0.00 C ATOM 593 CG2 VAL A 44 8.300 16.743 -7.208 1.00 0.00 C ATOM 0 H VAL A 44 7.965 13.956 -4.372 1.00 0.00 H new ATOM 0 HA VAL A 44 6.490 14.702 -6.639 1.00 0.00 H new ATOM 0 HB VAL A 44 7.579 16.358 -5.240 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.028 16.563 -5.120 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.462 15.007 -4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 44 10.196 15.077 -6.085 1.00 0.00 H new ATOM 0 HG21 VAL A 44 8.778 17.683 -6.934 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.894 16.243 -7.973 1.00 0.00 H new ATOM 0 HG23 VAL A 44 7.302 16.944 -7.597 1.00 0.00 H new ATOM 603 N SER A 45 7.734 14.047 -8.714 1.00 0.00 N ATOM 604 CA SER A 45 8.351 13.488 -9.912 1.00 0.00 C ATOM 605 C SER A 45 9.642 14.226 -10.253 1.00 0.00 C ATOM 606 O SER A 45 9.635 15.434 -10.491 1.00 0.00 O ATOM 607 CB SER A 45 7.381 13.563 -11.093 1.00 0.00 C ATOM 608 OG SER A 45 7.060 14.907 -11.405 1.00 0.00 O ATOM 0 H SER A 45 6.873 14.566 -8.886 1.00 0.00 H new ATOM 0 HA SER A 45 8.591 12.444 -9.713 1.00 0.00 H new ATOM 0 HB2 SER A 45 7.825 13.081 -11.964 1.00 0.00 H new ATOM 0 HB3 SER A 45 6.470 13.014 -10.855 1.00 0.00 H new ATOM 0 HG SER A 45 7.791 15.493 -11.118 1.00 0.00 H new ATOM 614 N TYR A 46 10.748 13.491 -10.275 1.00 0.00 N ATOM 615 CA TYR A 46 12.048 14.074 -10.584 1.00 0.00 C ATOM 616 C TYR A 46 12.712 13.340 -11.744 1.00 0.00 C ATOM 617 O TYR A 46 13.570 12.481 -11.541 1.00 0.00 O ATOM 618 CB TYR A 46 12.955 14.033 -9.353 1.00 0.00 C ATOM 619 CG TYR A 46 12.633 12.902 -8.402 1.00 0.00 C ATOM 620 CD1 TYR A 46 12.476 11.602 -8.865 1.00 0.00 C ATOM 621 CD2 TYR A 46 12.485 13.135 -7.040 1.00 0.00 C ATOM 622 CE1 TYR A 46 12.181 10.566 -8.000 1.00 0.00 C ATOM 623 CE2 TYR A 46 12.192 12.105 -6.167 1.00 0.00 C ATOM 624 CZ TYR A 46 12.040 10.823 -6.652 1.00 0.00 C ATOM 625 OH TYR A 46 11.747 9.794 -5.786 1.00 0.00 O ATOM 0 H TYR A 46 10.770 12.490 -10.082 1.00 0.00 H new ATOM 0 HA TYR A 46 11.892 15.112 -10.877 1.00 0.00 H new ATOM 0 HB2 TYR A 46 13.991 13.939 -9.678 1.00 0.00 H new ATOM 0 HB3 TYR A 46 12.873 14.980 -8.819 1.00 0.00 H new ATOM 0 HD1 TYR A 46 12.586 11.397 -9.920 1.00 0.00 H new ATOM 0 HD2 TYR A 46 12.601 14.138 -6.657 1.00 0.00 H new ATOM 0 HE1 TYR A 46 12.061 9.561 -8.377 1.00 0.00 H new ATOM 0 HE2 TYR A 46 12.083 12.303 -5.111 1.00 0.00 H new ATOM 0 HH TYR A 46 11.439 9.015 -6.295 1.00 0.00 H new ATOM 635 N GLY A 47 12.310 13.686 -12.964 1.00 0.00 N ATOM 636 CA GLY A 47 12.876 13.051 -14.140 1.00 0.00 C ATOM 637 C GLY A 47 12.691 11.547 -14.132 1.00 0.00 C ATOM 638 O GLY A 47 11.750 11.028 -14.733 1.00 0.00 O ATOM 0 H GLY A 47 11.603 14.395 -13.158 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.410 13.467 -15.033 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.939 13.283 -14.198 1.00 0.00 H new ATOM 642 N GLU A 48 13.591 10.844 -13.452 1.00 0.00 N ATOM 643 CA GLU A 48 13.523 9.390 -13.373 1.00 0.00 C ATOM 644 C GLU A 48 12.074 8.912 -13.381 1.00 0.00 C ATOM 645 O GLU A 48 11.429 8.837 -12.336 1.00 0.00 O ATOM 646 CB GLU A 48 14.229 8.893 -12.109 1.00 0.00 C ATOM 647 CG GLU A 48 15.734 9.100 -12.131 1.00 0.00 C ATOM 648 CD GLU A 48 16.146 10.439 -11.551 1.00 0.00 C ATOM 649 OE1 GLU A 48 15.942 10.649 -10.337 1.00 0.00 O ATOM 650 OE2 GLU A 48 16.674 11.278 -12.311 1.00 0.00 O ATOM 0 H GLU A 48 14.375 11.258 -12.948 1.00 0.00 H new ATOM 0 HA GLU A 48 14.027 8.980 -14.248 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.812 9.409 -11.244 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.019 7.831 -11.979 1.00 0.00 H new ATOM 0 HG2 GLU A 48 16.215 8.300 -11.568 1.00 0.00 H new ATOM 0 HG3 GLU A 48 16.092 9.027 -13.158 1.00 0.00 H new ATOM 657 N MET A 49 11.570 8.590 -14.568 1.00 0.00 N ATOM 658 CA MET A 49 10.198 8.118 -14.712 1.00 0.00 C ATOM 659 C MET A 49 10.039 7.288 -15.982 1.00 0.00 C ATOM 660 O MET A 49 10.746 7.503 -16.968 1.00 0.00 O ATOM 661 CB MET A 49 9.229 9.302 -14.739 1.00 0.00 C ATOM 662 CG MET A 49 9.140 10.044 -13.415 1.00 0.00 C ATOM 663 SD MET A 49 7.532 10.819 -13.161 1.00 0.00 S ATOM 664 CE MET A 49 6.979 9.974 -11.682 1.00 0.00 C ATOM 0 H MET A 49 12.091 8.647 -15.443 1.00 0.00 H new ATOM 0 HA MET A 49 9.966 7.486 -13.854 1.00 0.00 H new ATOM 0 HB2 MET A 49 9.541 9.999 -15.517 1.00 0.00 H new ATOM 0 HB3 MET A 49 8.237 8.943 -15.012 1.00 0.00 H new ATOM 0 HG2 MET A 49 9.337 9.349 -12.599 1.00 0.00 H new ATOM 0 HG3 MET A 49 9.917 10.807 -13.378 1.00 0.00 H new ATOM 0 HE1 MET A 49 6.019 10.383 -11.367 1.00 0.00 H new ATOM 0 HE2 MET A 49 6.870 8.910 -11.890 1.00 0.00 H new ATOM 0 HE3 MET A 49 7.711 10.115 -10.887 1.00 0.00 H new ATOM 674 N ILE A 50 9.109 6.340 -15.951 1.00 0.00 N ATOM 675 CA ILE A 50 8.859 5.479 -17.100 1.00 0.00 C ATOM 676 C ILE A 50 7.397 5.547 -17.530 1.00 0.00 C ATOM 677 O ILE A 50 7.070 5.313 -18.693 1.00 0.00 O ATOM 678 CB ILE A 50 9.224 4.014 -16.796 1.00 0.00 C ATOM 679 CG1 ILE A 50 8.119 3.349 -15.973 1.00 0.00 C ATOM 680 CG2 ILE A 50 10.555 3.941 -16.062 1.00 0.00 C ATOM 681 CD1 ILE A 50 8.277 3.543 -14.481 1.00 0.00 C ATOM 0 H ILE A 50 8.516 6.149 -15.143 1.00 0.00 H new ATOM 0 HA ILE A 50 9.492 5.842 -17.910 1.00 0.00 H new ATOM 0 HB ILE A 50 9.321 3.477 -17.739 1.00 0.00 H new ATOM 0 HG12 ILE A 50 7.154 3.751 -16.283 1.00 0.00 H new ATOM 0 HG13 ILE A 50 8.106 2.282 -16.193 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.799 2.899 -15.854 1.00 0.00 H new ATOM 0 HG22 ILE A 50 11.337 4.380 -16.682 1.00 0.00 H new ATOM 0 HG23 ILE A 50 10.484 4.491 -15.124 1.00 0.00 H new ATOM 0 HD11 ILE A 50 7.459 3.045 -13.961 1.00 0.00 H new ATOM 0 HD12 ILE A 50 9.226 3.116 -14.157 1.00 0.00 H new ATOM 0 HD13 ILE A 50 8.260 4.608 -14.249 1.00 0.00 H new ATOM 693 N GLY A 51 6.522 5.872 -16.584 1.00 0.00 N ATOM 694 CA GLY A 51 5.105 5.968 -16.884 1.00 0.00 C ATOM 695 C GLY A 51 4.537 4.669 -17.421 1.00 0.00 C ATOM 696 O GLY A 51 4.825 4.278 -18.552 1.00 0.00 O ATOM 0 H GLY A 51 6.769 6.071 -15.614 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.564 6.252 -15.981 1.00 0.00 H new ATOM 0 HA3 GLY A 51 4.944 6.761 -17.615 1.00 0.00 H new ATOM 700 N CYS A 52 3.730 3.998 -16.607 1.00 0.00 N ATOM 701 CA CYS A 52 3.121 2.734 -17.005 1.00 0.00 C ATOM 702 C CYS A 52 2.650 2.790 -18.455 1.00 0.00 C ATOM 703 O CYS A 52 2.129 3.808 -18.911 1.00 0.00 O ATOM 704 CB CYS A 52 1.944 2.400 -16.086 1.00 0.00 C ATOM 705 SG CYS A 52 1.353 0.682 -16.229 1.00 0.00 S ATOM 0 H CYS A 52 3.482 4.308 -15.667 1.00 0.00 H new ATOM 0 HA CYS A 52 3.875 1.952 -16.917 1.00 0.00 H new ATOM 0 HB2 CYS A 52 2.239 2.587 -15.053 1.00 0.00 H new ATOM 0 HB3 CYS A 52 1.119 3.077 -16.309 1.00 0.00 H new ATOM 710 N ASP A 53 2.835 1.688 -19.174 1.00 0.00 N ATOM 711 CA ASP A 53 2.428 1.610 -20.572 1.00 0.00 C ATOM 712 C ASP A 53 0.911 1.501 -20.691 1.00 0.00 C ATOM 713 O ASP A 53 0.354 1.626 -21.780 1.00 0.00 O ATOM 714 CB ASP A 53 3.093 0.413 -21.253 1.00 0.00 C ATOM 715 CG ASP A 53 2.896 0.419 -22.756 1.00 0.00 C ATOM 716 OD1 ASP A 53 3.454 1.314 -23.424 1.00 0.00 O ATOM 717 OD2 ASP A 53 2.183 -0.472 -23.265 1.00 0.00 O ATOM 0 H ASP A 53 3.264 0.837 -18.812 1.00 0.00 H new ATOM 0 HA ASP A 53 2.749 2.525 -21.070 1.00 0.00 H new ATOM 0 HB2 ASP A 53 4.160 0.418 -21.029 1.00 0.00 H new ATOM 0 HB3 ASP A 53 2.685 -0.509 -20.840 1.00 0.00 H new ATOM 722 N ASN A 54 0.250 1.265 -19.562 1.00 0.00 N ATOM 723 CA ASN A 54 -1.203 1.137 -19.540 1.00 0.00 C ATOM 724 C ASN A 54 -1.869 2.507 -19.451 1.00 0.00 C ATOM 725 O ASN A 54 -1.653 3.269 -18.508 1.00 0.00 O ATOM 726 CB ASN A 54 -1.641 0.266 -18.361 1.00 0.00 C ATOM 727 CG ASN A 54 -3.138 0.026 -18.345 1.00 0.00 C ATOM 728 OD1 ASN A 54 -3.767 -0.115 -19.394 1.00 0.00 O ATOM 729 ND2 ASN A 54 -3.717 -0.022 -17.150 1.00 0.00 N ATOM 0 H ASN A 54 0.697 1.159 -18.651 1.00 0.00 H new ATOM 0 HA ASN A 54 -1.515 0.661 -20.470 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -1.123 -0.692 -18.408 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -1.342 0.745 -17.428 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -4.722 -0.181 -17.076 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -3.157 0.100 -16.307 1.00 0.00 H new ATOM 736 N PRO A 55 -2.698 2.828 -20.454 1.00 0.00 N ATOM 737 CA PRO A 55 -3.414 4.106 -20.511 1.00 0.00 C ATOM 738 C PRO A 55 -4.502 4.210 -19.448 1.00 0.00 C ATOM 739 O PRO A 55 -4.911 5.308 -19.069 1.00 0.00 O ATOM 740 CB PRO A 55 -4.032 4.104 -21.911 1.00 0.00 C ATOM 741 CG PRO A 55 -4.164 2.663 -22.265 1.00 0.00 C ATOM 742 CD PRO A 55 -3.003 1.968 -21.610 1.00 0.00 C ATOM 0 HA PRO A 55 -2.753 4.952 -20.323 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -5.001 4.603 -21.917 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -3.398 4.630 -22.624 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.112 2.259 -21.909 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -4.143 2.523 -23.346 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -3.263 0.956 -21.300 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -2.151 1.885 -22.285 1.00 0.00 H new ATOM 750 N ASP A 56 -4.966 3.061 -18.970 1.00 0.00 N ATOM 751 CA ASP A 56 -6.007 3.022 -17.949 1.00 0.00 C ATOM 752 C ASP A 56 -5.423 3.308 -16.568 1.00 0.00 C ATOM 753 O ASP A 56 -6.071 3.930 -15.726 1.00 0.00 O ATOM 754 CB ASP A 56 -6.703 1.660 -17.951 1.00 0.00 C ATOM 755 CG ASP A 56 -7.739 1.541 -19.050 1.00 0.00 C ATOM 756 OD1 ASP A 56 -7.593 2.232 -20.080 1.00 0.00 O ATOM 757 OD2 ASP A 56 -8.697 0.758 -18.881 1.00 0.00 O ATOM 0 H ASP A 56 -4.638 2.144 -19.273 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.740 3.795 -18.181 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.957 0.874 -18.072 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.182 1.499 -16.985 1.00 0.00 H new ATOM 762 N CYS A 57 -4.197 2.848 -16.343 1.00 0.00 N ATOM 763 CA CYS A 57 -3.526 3.052 -15.065 1.00 0.00 C ATOM 764 C CYS A 57 -3.684 4.495 -14.592 1.00 0.00 C ATOM 765 O CYS A 57 -3.359 5.435 -15.317 1.00 0.00 O ATOM 766 CB CYS A 57 -2.042 2.702 -15.183 1.00 0.00 C ATOM 767 SG CYS A 57 -1.291 2.113 -13.631 1.00 0.00 S ATOM 0 H CYS A 57 -3.648 2.331 -17.030 1.00 0.00 H new ATOM 0 HA CYS A 57 -3.990 2.394 -14.330 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -1.920 1.934 -15.947 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -1.498 3.582 -15.526 1.00 0.00 H new ATOM 772 N SER A 58 -4.183 4.660 -13.372 1.00 0.00 N ATOM 773 CA SER A 58 -4.387 5.987 -12.803 1.00 0.00 C ATOM 774 C SER A 58 -3.052 6.680 -12.549 1.00 0.00 C ATOM 775 O SER A 58 -2.851 7.828 -12.946 1.00 0.00 O ATOM 776 CB SER A 58 -5.181 5.890 -11.498 1.00 0.00 C ATOM 777 OG SER A 58 -5.894 7.088 -11.244 1.00 0.00 O ATOM 0 H SER A 58 -4.454 3.892 -12.758 1.00 0.00 H new ATOM 0 HA SER A 58 -4.954 6.580 -13.521 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.878 5.054 -11.554 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.502 5.685 -10.670 1.00 0.00 H new ATOM 0 HG SER A 58 -6.394 7.000 -10.406 1.00 0.00 H new ATOM 783 N ILE A 59 -2.144 5.975 -11.884 1.00 0.00 N ATOM 784 CA ILE A 59 -0.828 6.521 -11.577 1.00 0.00 C ATOM 785 C ILE A 59 0.019 6.657 -12.838 1.00 0.00 C ATOM 786 O ILE A 59 0.529 7.735 -13.141 1.00 0.00 O ATOM 787 CB ILE A 59 -0.076 5.641 -10.561 1.00 0.00 C ATOM 788 CG1 ILE A 59 -0.946 5.392 -9.327 1.00 0.00 C ATOM 789 CG2 ILE A 59 1.239 6.295 -10.165 1.00 0.00 C ATOM 790 CD1 ILE A 59 -0.506 4.199 -8.508 1.00 0.00 C ATOM 0 H ILE A 59 -2.295 5.024 -11.547 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.990 7.507 -11.142 1.00 0.00 H new ATOM 0 HB ILE A 59 0.144 4.681 -11.027 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.931 6.281 -8.696 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -1.978 5.244 -9.644 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.759 5.661 -9.447 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.861 6.426 -11.050 1.00 0.00 H new ATOM 0 HG23 ILE A 59 1.041 7.267 -9.714 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.168 4.083 -7.650 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.548 3.300 -9.123 1.00 0.00 H new ATOM 0 HD13 ILE A 59 0.516 4.353 -8.160 1.00 0.00 H new ATOM 802 N GLU A 60 0.161 5.557 -13.571 1.00 0.00 N ATOM 803 CA GLU A 60 0.944 5.555 -14.800 1.00 0.00 C ATOM 804 C GLU A 60 2.171 6.452 -14.666 1.00 0.00 C ATOM 805 O GLU A 60 2.561 7.134 -15.613 1.00 0.00 O ATOM 806 CB GLU A 60 0.086 6.019 -15.979 1.00 0.00 C ATOM 807 CG GLU A 60 -0.415 7.447 -15.842 1.00 0.00 C ATOM 808 CD GLU A 60 -1.480 7.792 -16.865 1.00 0.00 C ATOM 809 OE1 GLU A 60 -2.397 6.968 -17.066 1.00 0.00 O ATOM 810 OE2 GLU A 60 -1.397 8.885 -17.463 1.00 0.00 O ATOM 0 H GLU A 60 -0.256 4.657 -13.335 1.00 0.00 H new ATOM 0 HA GLU A 60 1.280 4.534 -14.984 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.668 5.933 -16.897 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.769 5.351 -16.080 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.819 7.592 -14.840 1.00 0.00 H new ATOM 0 HG3 GLU A 60 0.424 8.134 -15.950 1.00 0.00 H new ATOM 817 N TRP A 61 2.773 6.447 -13.482 1.00 0.00 N ATOM 818 CA TRP A 61 3.955 7.261 -13.222 1.00 0.00 C ATOM 819 C TRP A 61 4.693 6.768 -11.982 1.00 0.00 C ATOM 820 O TRP A 61 4.109 6.655 -10.904 1.00 0.00 O ATOM 821 CB TRP A 61 3.561 8.728 -13.047 1.00 0.00 C ATOM 822 CG TRP A 61 3.272 9.424 -14.342 1.00 0.00 C ATOM 823 CD1 TRP A 61 2.061 9.887 -14.771 1.00 0.00 C ATOM 824 CD2 TRP A 61 4.212 9.734 -15.376 1.00 0.00 C ATOM 825 NE1 TRP A 61 2.191 10.466 -16.011 1.00 0.00 N ATOM 826 CE2 TRP A 61 3.501 10.386 -16.403 1.00 0.00 C ATOM 827 CE3 TRP A 61 5.585 9.527 -15.534 1.00 0.00 C ATOM 828 CZ2 TRP A 61 4.119 10.829 -17.570 1.00 0.00 C ATOM 829 CZ3 TRP A 61 6.196 9.967 -16.693 1.00 0.00 C ATOM 830 CH2 TRP A 61 5.464 10.613 -17.698 1.00 0.00 C ATOM 0 H TRP A 61 2.462 5.889 -12.687 1.00 0.00 H new ATOM 0 HA TRP A 61 4.623 7.172 -14.079 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.681 8.786 -12.407 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.365 9.254 -12.532 1.00 0.00 H new ATOM 0 HD1 TRP A 61 1.137 9.810 -14.217 1.00 0.00 H new ATOM 0 HE1 TRP A 61 1.435 10.887 -16.551 1.00 0.00 H new ATOM 0 HE3 TRP A 61 6.158 9.032 -14.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 3.556 11.326 -18.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 7.256 9.810 -16.826 1.00 0.00 H new ATOM 0 HH2 TRP A 61 5.971 10.947 -18.591 1.00 0.00 H new ATOM 841 N PHE A 62 5.980 6.476 -12.142 1.00 0.00 N ATOM 842 CA PHE A 62 6.798 5.995 -11.034 1.00 0.00 C ATOM 843 C PHE A 62 8.266 6.350 -11.248 1.00 0.00 C ATOM 844 O PHE A 62 8.616 7.043 -12.204 1.00 0.00 O ATOM 845 CB PHE A 62 6.645 4.481 -10.881 1.00 0.00 C ATOM 846 CG PHE A 62 5.226 4.005 -11.006 1.00 0.00 C ATOM 847 CD1 PHE A 62 4.352 4.101 -9.935 1.00 0.00 C ATOM 848 CD2 PHE A 62 4.765 3.464 -12.195 1.00 0.00 C ATOM 849 CE1 PHE A 62 3.046 3.663 -10.047 1.00 0.00 C ATOM 850 CE2 PHE A 62 3.460 3.025 -12.314 1.00 0.00 C ATOM 851 CZ PHE A 62 2.599 3.126 -11.239 1.00 0.00 C ATOM 0 H PHE A 62 6.479 6.564 -13.027 1.00 0.00 H new ATOM 0 HA PHE A 62 6.454 6.483 -10.122 1.00 0.00 H new ATOM 0 HB2 PHE A 62 7.254 3.984 -11.636 1.00 0.00 H new ATOM 0 HB3 PHE A 62 7.036 4.181 -9.909 1.00 0.00 H new ATOM 0 HD1 PHE A 62 4.695 4.523 -9.002 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.434 3.384 -13.039 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.376 3.740 -9.204 1.00 0.00 H new ATOM 0 HE2 PHE A 62 3.114 2.604 -13.246 1.00 0.00 H new ATOM 0 HZ PHE A 62 1.578 2.786 -11.330 1.00 0.00 H new ATOM 861 N HIS A 63 9.122 5.871 -10.351 1.00 0.00 N ATOM 862 CA HIS A 63 10.553 6.138 -10.440 1.00 0.00 C ATOM 863 C HIS A 63 11.327 4.856 -10.731 1.00 0.00 C ATOM 864 O HIS A 63 10.743 3.777 -10.840 1.00 0.00 O ATOM 865 CB HIS A 63 11.058 6.769 -9.142 1.00 0.00 C ATOM 866 CG HIS A 63 10.295 7.991 -8.734 1.00 0.00 C ATOM 867 ND1 HIS A 63 9.770 8.164 -7.471 1.00 0.00 N ATOM 868 CD2 HIS A 63 9.970 9.106 -9.430 1.00 0.00 C ATOM 869 CE1 HIS A 63 9.154 9.331 -7.408 1.00 0.00 C ATOM 870 NE2 HIS A 63 9.262 9.923 -8.584 1.00 0.00 N ATOM 0 H HIS A 63 8.849 5.296 -9.554 1.00 0.00 H new ATOM 0 HA HIS A 63 10.717 6.836 -11.261 1.00 0.00 H new ATOM 0 HB2 HIS A 63 11.000 6.031 -8.342 1.00 0.00 H new ATOM 0 HB3 HIS A 63 12.110 7.030 -9.260 1.00 0.00 H new ATOM 0 HD2 HIS A 63 10.221 9.314 -10.460 1.00 0.00 H new ATOM 0 HE1 HIS A 63 8.648 9.733 -6.542 1.00 0.00 H new ATOM 0 HE2 HIS A 63 8.881 10.838 -8.824 1.00 0.00 H new ATOM 878 N PHE A 64 12.644 4.981 -10.857 1.00 0.00 N ATOM 879 CA PHE A 64 13.498 3.833 -11.138 1.00 0.00 C ATOM 880 C PHE A 64 13.990 3.192 -9.843 1.00 0.00 C ATOM 881 O PHE A 64 14.075 1.969 -9.737 1.00 0.00 O ATOM 882 CB PHE A 64 14.692 4.256 -11.996 1.00 0.00 C ATOM 883 CG PHE A 64 14.305 5.046 -13.214 1.00 0.00 C ATOM 884 CD1 PHE A 64 12.985 5.096 -13.632 1.00 0.00 C ATOM 885 CD2 PHE A 64 15.261 5.737 -13.940 1.00 0.00 C ATOM 886 CE1 PHE A 64 12.625 5.822 -14.752 1.00 0.00 C ATOM 887 CE2 PHE A 64 14.907 6.465 -15.060 1.00 0.00 C ATOM 888 CZ PHE A 64 13.588 6.507 -15.467 1.00 0.00 C ATOM 0 H PHE A 64 13.143 5.866 -10.769 1.00 0.00 H new ATOM 0 HA PHE A 64 12.908 3.098 -11.686 1.00 0.00 H new ATOM 0 HB2 PHE A 64 15.373 4.851 -11.388 1.00 0.00 H new ATOM 0 HB3 PHE A 64 15.238 3.366 -12.308 1.00 0.00 H new ATOM 0 HD1 PHE A 64 12.229 4.562 -13.076 1.00 0.00 H new ATOM 0 HD2 PHE A 64 16.294 5.707 -13.627 1.00 0.00 H new ATOM 0 HE1 PHE A 64 11.593 5.854 -15.067 1.00 0.00 H new ATOM 0 HE2 PHE A 64 15.662 7.001 -15.617 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.310 7.074 -16.343 1.00 0.00 H new ATOM 898 N ALA A 65 14.313 4.028 -8.862 1.00 0.00 N ATOM 899 CA ALA A 65 14.795 3.544 -7.574 1.00 0.00 C ATOM 900 C ALA A 65 13.637 3.111 -6.682 1.00 0.00 C ATOM 901 O ALA A 65 13.779 3.023 -5.462 1.00 0.00 O ATOM 902 CB ALA A 65 15.623 4.617 -6.883 1.00 0.00 C ATOM 0 H ALA A 65 14.250 5.043 -8.934 1.00 0.00 H new ATOM 0 HA ALA A 65 15.426 2.674 -7.754 1.00 0.00 H new ATOM 0 HB1 ALA A 65 15.976 4.242 -5.923 1.00 0.00 H new ATOM 0 HB2 ALA A 65 16.478 4.876 -7.508 1.00 0.00 H new ATOM 0 HB3 ALA A 65 15.009 5.503 -6.723 1.00 0.00 H new ATOM 908 N CYS A 66 12.491 2.842 -7.297 1.00 0.00 N ATOM 909 CA CYS A 66 11.307 2.419 -6.559 1.00 0.00 C ATOM 910 C CYS A 66 10.818 1.058 -7.049 1.00 0.00 C ATOM 911 O CYS A 66 10.139 0.333 -6.322 1.00 0.00 O ATOM 912 CB CYS A 66 10.192 3.456 -6.705 1.00 0.00 C ATOM 913 SG CYS A 66 10.206 4.749 -5.421 1.00 0.00 S ATOM 0 H CYS A 66 12.357 2.909 -8.306 1.00 0.00 H new ATOM 0 HA CYS A 66 11.577 2.331 -5.507 1.00 0.00 H new ATOM 0 HB2 CYS A 66 10.277 3.929 -7.683 1.00 0.00 H new ATOM 0 HB3 CYS A 66 9.230 2.945 -6.680 1.00 0.00 H new ATOM 918 N VAL A 67 11.169 0.719 -8.285 1.00 0.00 N ATOM 919 CA VAL A 67 10.768 -0.554 -8.871 1.00 0.00 C ATOM 920 C VAL A 67 11.969 -1.300 -9.441 1.00 0.00 C ATOM 921 O VAL A 67 12.030 -2.528 -9.395 1.00 0.00 O ATOM 922 CB VAL A 67 9.725 -0.354 -9.988 1.00 0.00 C ATOM 923 CG1 VAL A 67 8.434 0.211 -9.418 1.00 0.00 C ATOM 924 CG2 VAL A 67 10.279 0.552 -11.077 1.00 0.00 C ATOM 0 H VAL A 67 11.730 1.308 -8.900 1.00 0.00 H new ATOM 0 HA VAL A 67 10.324 -1.145 -8.070 1.00 0.00 H new ATOM 0 HB VAL A 67 9.503 -1.324 -10.433 1.00 0.00 H new ATOM 0 HG11 VAL A 67 7.710 0.345 -10.221 1.00 0.00 H new ATOM 0 HG12 VAL A 67 8.030 -0.479 -8.677 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.635 1.173 -8.946 1.00 0.00 H new ATOM 0 HG21 VAL A 67 9.530 0.683 -11.858 1.00 0.00 H new ATOM 0 HG22 VAL A 67 10.531 1.523 -10.650 1.00 0.00 H new ATOM 0 HG23 VAL A 67 11.174 0.101 -11.505 1.00 0.00 H new ATOM 934 N GLY A 68 12.926 -0.548 -9.977 1.00 0.00 N ATOM 935 CA GLY A 68 14.114 -1.155 -10.548 1.00 0.00 C ATOM 936 C GLY A 68 14.241 -0.895 -12.036 1.00 0.00 C ATOM 937 O GLY A 68 14.171 -1.822 -12.844 1.00 0.00 O ATOM 0 H GLY A 68 12.899 0.470 -10.026 1.00 0.00 H new ATOM 0 HA2 GLY A 68 14.996 -0.768 -10.038 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.089 -2.230 -10.371 1.00 0.00 H new ATOM 941 N LEU A 69 14.425 0.369 -12.400 1.00 0.00 N ATOM 942 CA LEU A 69 14.560 0.749 -13.802 1.00 0.00 C ATOM 943 C LEU A 69 15.750 1.683 -14.001 1.00 0.00 C ATOM 944 O LEU A 69 15.589 2.835 -14.405 1.00 0.00 O ATOM 945 CB LEU A 69 13.279 1.426 -14.293 1.00 0.00 C ATOM 946 CG LEU A 69 12.076 0.507 -14.511 1.00 0.00 C ATOM 947 CD1 LEU A 69 10.780 1.246 -14.218 1.00 0.00 C ATOM 948 CD2 LEU A 69 12.072 -0.038 -15.932 1.00 0.00 C ATOM 0 H LEU A 69 14.484 1.148 -11.744 1.00 0.00 H new ATOM 0 HA LEU A 69 14.731 -0.157 -14.383 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.998 2.194 -13.572 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.497 1.935 -15.232 1.00 0.00 H new ATOM 0 HG LEU A 69 12.155 -0.333 -13.821 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.935 0.576 -14.379 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.781 1.587 -13.183 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.693 2.106 -14.883 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.209 -0.690 -16.069 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.018 0.790 -16.639 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.986 -0.605 -16.107 1.00 0.00 H new ATOM 960 N THR A 70 16.946 1.178 -13.716 1.00 0.00 N ATOM 961 CA THR A 70 18.163 1.965 -13.865 1.00 0.00 C ATOM 962 C THR A 70 18.026 2.984 -14.991 1.00 0.00 C ATOM 963 O THR A 70 18.506 4.113 -14.884 1.00 0.00 O ATOM 964 CB THR A 70 19.383 1.067 -14.147 1.00 0.00 C ATOM 965 OG1 THR A 70 20.513 1.873 -14.499 1.00 0.00 O ATOM 966 CG2 THR A 70 19.084 0.085 -15.269 1.00 0.00 C ATOM 0 H THR A 70 17.098 0.227 -13.380 1.00 0.00 H new ATOM 0 HA THR A 70 18.317 2.489 -12.921 1.00 0.00 H new ATOM 0 HB THR A 70 19.608 0.502 -13.242 1.00 0.00 H new ATOM 0 HG1 THR A 70 21.285 1.295 -14.675 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.960 -0.538 -15.450 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.242 -0.546 -14.985 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.836 0.635 -16.177 1.00 0.00 H new ATOM 974 N THR A 71 17.366 2.579 -16.071 1.00 0.00 N ATOM 975 CA THR A 71 17.165 3.456 -17.218 1.00 0.00 C ATOM 976 C THR A 71 15.742 3.343 -17.754 1.00 0.00 C ATOM 977 O THR A 71 15.178 2.251 -17.821 1.00 0.00 O ATOM 978 CB THR A 71 18.156 3.134 -18.352 1.00 0.00 C ATOM 979 OG1 THR A 71 17.979 1.782 -18.788 1.00 0.00 O ATOM 980 CG2 THR A 71 19.591 3.340 -17.891 1.00 0.00 C ATOM 0 H THR A 71 16.961 1.649 -16.176 1.00 0.00 H new ATOM 0 HA THR A 71 17.340 4.475 -16.871 1.00 0.00 H new ATOM 0 HB THR A 71 17.957 3.812 -19.182 1.00 0.00 H new ATOM 0 HG1 THR A 71 18.612 1.586 -19.510 1.00 0.00 H new ATOM 0 HG21 THR A 71 20.273 3.106 -18.709 1.00 0.00 H new ATOM 0 HG22 THR A 71 19.730 4.378 -17.587 1.00 0.00 H new ATOM 0 HG23 THR A 71 19.799 2.684 -17.046 1.00 0.00 H new ATOM 988 N LYS A 72 15.167 4.478 -18.136 1.00 0.00 N ATOM 989 CA LYS A 72 13.810 4.507 -18.669 1.00 0.00 C ATOM 990 C LYS A 72 13.668 3.549 -19.848 1.00 0.00 C ATOM 991 O LYS A 72 14.380 3.646 -20.847 1.00 0.00 O ATOM 992 CB LYS A 72 13.442 5.927 -19.105 1.00 0.00 C ATOM 993 CG LYS A 72 11.962 6.110 -19.394 1.00 0.00 C ATOM 994 CD LYS A 72 11.675 7.477 -19.993 1.00 0.00 C ATOM 995 CE LYS A 72 10.185 7.782 -19.999 1.00 0.00 C ATOM 996 NZ LYS A 72 9.387 6.636 -20.517 1.00 0.00 N ATOM 0 H LYS A 72 15.620 5.391 -18.086 1.00 0.00 H new ATOM 0 HA LYS A 72 13.129 4.188 -17.880 1.00 0.00 H new ATOM 0 HB2 LYS A 72 13.740 6.627 -18.324 1.00 0.00 H new ATOM 0 HB3 LYS A 72 14.012 6.183 -19.998 1.00 0.00 H new ATOM 0 HG2 LYS A 72 11.626 5.333 -20.081 1.00 0.00 H new ATOM 0 HG3 LYS A 72 11.393 5.989 -18.472 1.00 0.00 H new ATOM 0 HD2 LYS A 72 12.202 8.243 -19.423 1.00 0.00 H new ATOM 0 HD3 LYS A 72 12.060 7.517 -21.012 1.00 0.00 H new ATOM 0 HE2 LYS A 72 9.860 8.023 -18.987 1.00 0.00 H new ATOM 0 HE3 LYS A 72 9.997 8.663 -20.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.695 6.981 -21.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 10.021 5.948 -20.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.886 6.177 -19.729 1.00 0.00 H new ATOM 1010 N PRO A 73 12.726 2.601 -19.730 1.00 0.00 N ATOM 1011 CA PRO A 73 12.467 1.609 -20.778 1.00 0.00 C ATOM 1012 C PRO A 73 11.830 2.227 -22.018 1.00 0.00 C ATOM 1013 O PRO A 73 11.937 1.685 -23.118 1.00 0.00 O ATOM 1014 CB PRO A 73 11.497 0.632 -20.109 1.00 0.00 C ATOM 1015 CG PRO A 73 10.819 1.435 -19.052 1.00 0.00 C ATOM 1016 CD PRO A 73 11.840 2.426 -18.567 1.00 0.00 C ATOM 0 HA PRO A 73 13.386 1.143 -21.134 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.779 0.234 -20.826 1.00 0.00 H new ATOM 0 HB3 PRO A 73 12.025 -0.220 -19.681 1.00 0.00 H new ATOM 0 HG2 PRO A 73 9.941 1.943 -19.451 1.00 0.00 H new ATOM 0 HG3 PRO A 73 10.476 0.797 -18.237 1.00 0.00 H new ATOM 0 HD2 PRO A 73 11.377 3.367 -18.270 1.00 0.00 H new ATOM 0 HD3 PRO A 73 12.384 2.051 -17.700 1.00 0.00 H new ATOM 1024 N ARG A 74 11.168 3.365 -21.833 1.00 0.00 N ATOM 1025 CA ARG A 74 10.514 4.056 -22.937 1.00 0.00 C ATOM 1026 C ARG A 74 9.955 3.059 -23.948 1.00 0.00 C ATOM 1027 O ARG A 74 10.184 3.185 -25.150 1.00 0.00 O ATOM 1028 CB ARG A 74 11.496 5.003 -23.628 1.00 0.00 C ATOM 1029 CG ARG A 74 10.837 5.948 -24.619 1.00 0.00 C ATOM 1030 CD ARG A 74 9.909 6.930 -23.921 1.00 0.00 C ATOM 1031 NE ARG A 74 9.271 7.845 -24.863 1.00 0.00 N ATOM 1032 CZ ARG A 74 9.875 8.911 -25.377 1.00 0.00 C ATOM 1033 NH1 ARG A 74 11.126 9.193 -25.042 1.00 0.00 N ATOM 1034 NH2 ARG A 74 9.228 9.695 -26.229 1.00 0.00 N ATOM 0 H ARG A 74 11.071 3.827 -20.929 1.00 0.00 H new ATOM 0 HA ARG A 74 9.686 4.637 -22.529 1.00 0.00 H new ATOM 0 HB2 ARG A 74 12.016 5.590 -22.870 1.00 0.00 H new ATOM 0 HB3 ARG A 74 12.251 4.413 -24.148 1.00 0.00 H new ATOM 0 HG2 ARG A 74 11.604 6.497 -25.165 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.273 5.372 -25.353 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.143 6.379 -23.375 1.00 0.00 H new ATOM 0 HD3 ARG A 74 10.474 7.503 -23.186 1.00 0.00 H new ATOM 0 HE ARG A 74 8.308 7.655 -25.142 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.627 8.591 -24.388 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.588 10.012 -25.438 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.266 9.480 -26.490 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.693 10.513 -26.623 1.00 0.00 H new ATOM 1048 N GLY A 75 9.221 2.068 -23.451 1.00 0.00 N ATOM 1049 CA GLY A 75 8.642 1.064 -24.324 1.00 0.00 C ATOM 1050 C GLY A 75 7.411 0.414 -23.724 1.00 0.00 C ATOM 1051 O GLY A 75 6.340 1.019 -23.678 1.00 0.00 O ATOM 0 H GLY A 75 9.017 1.943 -22.459 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.379 1.524 -25.277 1.00 0.00 H new ATOM 0 HA3 GLY A 75 9.387 0.297 -24.535 1.00 0.00 H new ATOM 1055 N LYS A 76 7.562 -0.823 -23.263 1.00 0.00 N ATOM 1056 CA LYS A 76 6.455 -1.557 -22.663 1.00 0.00 C ATOM 1057 C LYS A 76 6.766 -1.925 -21.216 1.00 0.00 C ATOM 1058 O LYS A 76 7.264 -3.016 -20.937 1.00 0.00 O ATOM 1059 CB LYS A 76 6.158 -2.823 -23.470 1.00 0.00 C ATOM 1060 CG LYS A 76 5.202 -3.777 -22.776 1.00 0.00 C ATOM 1061 CD LYS A 76 3.756 -3.471 -23.127 1.00 0.00 C ATOM 1062 CE LYS A 76 3.427 -3.893 -24.551 1.00 0.00 C ATOM 1063 NZ LYS A 76 1.961 -4.057 -24.757 1.00 0.00 N ATOM 0 H LYS A 76 8.442 -1.338 -23.294 1.00 0.00 H new ATOM 0 HA LYS A 76 5.576 -0.912 -22.674 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.737 -2.538 -24.435 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.094 -3.343 -23.672 1.00 0.00 H new ATOM 0 HG2 LYS A 76 5.438 -4.802 -23.062 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.338 -3.708 -21.697 1.00 0.00 H new ATOM 0 HD2 LYS A 76 3.094 -3.987 -22.431 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.570 -2.403 -23.011 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.810 -3.148 -25.248 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.933 -4.832 -24.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.779 -4.345 -25.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 1.599 -4.786 -24.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 1.480 -3.155 -24.566 1.00 0.00 H new ATOM 1077 N TRP A 77 6.469 -1.010 -20.301 1.00 0.00 N ATOM 1078 CA TRP A 77 6.717 -1.240 -18.882 1.00 0.00 C ATOM 1079 C TRP A 77 5.428 -1.115 -18.077 1.00 0.00 C ATOM 1080 O TRP A 77 4.940 -0.011 -17.836 1.00 0.00 O ATOM 1081 CB TRP A 77 7.758 -0.250 -18.358 1.00 0.00 C ATOM 1082 CG TRP A 77 8.216 -0.551 -16.963 1.00 0.00 C ATOM 1083 CD1 TRP A 77 9.286 -1.317 -16.599 1.00 0.00 C ATOM 1084 CD2 TRP A 77 7.614 -0.095 -15.746 1.00 0.00 C ATOM 1085 NE1 TRP A 77 9.387 -1.364 -15.229 1.00 0.00 N ATOM 1086 CE2 TRP A 77 8.374 -0.622 -14.683 1.00 0.00 C ATOM 1087 CE3 TRP A 77 6.510 0.709 -15.451 1.00 0.00 C ATOM 1088 CZ2 TRP A 77 8.061 -0.370 -13.350 1.00 0.00 C ATOM 1089 CZ3 TRP A 77 6.201 0.957 -14.127 1.00 0.00 C ATOM 1090 CH2 TRP A 77 6.975 0.420 -13.090 1.00 0.00 C ATOM 0 H TRP A 77 6.056 -0.102 -20.516 1.00 0.00 H new ATOM 0 HA TRP A 77 7.099 -2.254 -18.765 1.00 0.00 H new ATOM 0 HB2 TRP A 77 8.620 -0.254 -19.025 1.00 0.00 H new ATOM 0 HB3 TRP A 77 7.339 0.756 -18.386 1.00 0.00 H new ATOM 0 HD1 TRP A 77 9.955 -1.813 -17.287 1.00 0.00 H new ATOM 0 HE1 TRP A 77 10.101 -1.870 -14.704 1.00 0.00 H new ATOM 0 HE3 TRP A 77 5.909 1.129 -16.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 8.655 -0.784 -12.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 5.348 1.575 -13.888 1.00 0.00 H new ATOM 0 HH2 TRP A 77 6.709 0.634 -12.065 1.00 0.00 H new ATOM 1101 N PHE A 78 4.881 -2.253 -17.663 1.00 0.00 N ATOM 1102 CA PHE A 78 3.648 -2.271 -16.885 1.00 0.00 C ATOM 1103 C PHE A 78 3.947 -2.392 -15.394 1.00 0.00 C ATOM 1104 O PHE A 78 4.482 -3.402 -14.937 1.00 0.00 O ATOM 1105 CB PHE A 78 2.753 -3.428 -17.334 1.00 0.00 C ATOM 1106 CG PHE A 78 1.871 -3.087 -18.500 1.00 0.00 C ATOM 1107 CD1 PHE A 78 2.410 -2.895 -19.762 1.00 0.00 C ATOM 1108 CD2 PHE A 78 0.501 -2.957 -18.334 1.00 0.00 C ATOM 1109 CE1 PHE A 78 1.601 -2.581 -20.837 1.00 0.00 C ATOM 1110 CE2 PHE A 78 -0.314 -2.644 -19.406 1.00 0.00 C ATOM 1111 CZ PHE A 78 0.237 -2.454 -20.659 1.00 0.00 C ATOM 0 H PHE A 78 5.273 -3.175 -17.853 1.00 0.00 H new ATOM 0 HA PHE A 78 3.126 -1.330 -17.057 1.00 0.00 H new ATOM 0 HB2 PHE A 78 3.380 -4.279 -17.600 1.00 0.00 H new ATOM 0 HB3 PHE A 78 2.129 -3.740 -16.496 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.476 -2.992 -19.907 1.00 0.00 H new ATOM 0 HD2 PHE A 78 0.065 -3.102 -17.356 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.034 -2.435 -21.815 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.380 -2.548 -19.264 1.00 0.00 H new ATOM 0 HZ PHE A 78 -0.397 -2.207 -21.497 1.00 0.00 H new ATOM 1121 N CYS A 79 3.598 -1.355 -14.640 1.00 0.00 N ATOM 1122 CA CYS A 79 3.828 -1.343 -13.201 1.00 0.00 C ATOM 1123 C CYS A 79 3.574 -2.721 -12.598 1.00 0.00 C ATOM 1124 O CYS A 79 2.807 -3.526 -13.126 1.00 0.00 O ATOM 1125 CB CYS A 79 2.927 -0.305 -12.528 1.00 0.00 C ATOM 1126 SG CYS A 79 1.164 -0.760 -12.499 1.00 0.00 S ATOM 0 H CYS A 79 3.154 -0.511 -15.003 1.00 0.00 H new ATOM 0 HA CYS A 79 4.871 -1.077 -13.027 1.00 0.00 H new ATOM 0 HB2 CYS A 79 3.269 -0.152 -11.504 1.00 0.00 H new ATOM 0 HB3 CYS A 79 3.037 0.647 -13.047 1.00 0.00 H new ATOM 1131 N PRO A 80 4.234 -3.001 -11.464 1.00 0.00 N ATOM 1132 CA PRO A 80 4.096 -4.282 -10.764 1.00 0.00 C ATOM 1133 C PRO A 80 2.723 -4.445 -10.121 1.00 0.00 C ATOM 1134 O PRO A 80 2.481 -5.403 -9.386 1.00 0.00 O ATOM 1135 CB PRO A 80 5.185 -4.218 -9.690 1.00 0.00 C ATOM 1136 CG PRO A 80 5.400 -2.762 -9.454 1.00 0.00 C ATOM 1137 CD PRO A 80 5.165 -2.090 -10.778 1.00 0.00 C ATOM 0 HA PRO A 80 4.196 -5.130 -11.441 1.00 0.00 H new ATOM 0 HB2 PRO A 80 4.871 -4.725 -8.777 1.00 0.00 H new ATOM 0 HB3 PRO A 80 6.101 -4.704 -10.026 1.00 0.00 H new ATOM 0 HG2 PRO A 80 4.713 -2.384 -8.697 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.410 -2.570 -9.093 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.735 -1.096 -10.653 1.00 0.00 H new ATOM 0 HD3 PRO A 80 6.093 -1.968 -11.337 1.00 0.00 H new ATOM 1145 N ARG A 81 1.827 -3.505 -10.402 1.00 0.00 N ATOM 1146 CA ARG A 81 0.478 -3.545 -9.850 1.00 0.00 C ATOM 1147 C ARG A 81 -0.543 -3.876 -10.934 1.00 0.00 C ATOM 1148 O ARG A 81 -1.634 -4.368 -10.645 1.00 0.00 O ATOM 1149 CB ARG A 81 0.131 -2.205 -9.198 1.00 0.00 C ATOM 1150 CG ARG A 81 0.598 -2.090 -7.757 1.00 0.00 C ATOM 1151 CD ARG A 81 -0.318 -1.187 -6.945 1.00 0.00 C ATOM 1152 NE ARG A 81 -1.404 -1.932 -6.315 1.00 0.00 N ATOM 1153 CZ ARG A 81 -1.341 -2.420 -5.081 1.00 0.00 C ATOM 1154 NH1 ARG A 81 -0.251 -2.241 -4.348 1.00 0.00 N ATOM 1155 NH2 ARG A 81 -2.371 -3.088 -4.577 1.00 0.00 N ATOM 0 H ARG A 81 2.011 -2.706 -11.009 1.00 0.00 H new ATOM 0 HA ARG A 81 0.445 -4.329 -9.093 1.00 0.00 H new ATOM 0 HB2 ARG A 81 0.578 -1.400 -9.781 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -0.949 -2.062 -9.234 1.00 0.00 H new ATOM 0 HG2 ARG A 81 0.630 -3.081 -7.303 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.614 -1.696 -7.733 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.264 -0.676 -6.178 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -0.736 -0.417 -7.594 1.00 0.00 H new ATOM 0 HE ARG A 81 -2.258 -2.086 -6.852 1.00 0.00 H new ATOM 0 HH11 ARG A 81 0.543 -1.727 -4.731 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.206 -2.617 -3.401 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -3.212 -3.227 -5.137 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -2.322 -3.462 -3.629 1.00 0.00 H new ATOM 1169 N CYS A 82 -0.182 -3.601 -12.183 1.00 0.00 N ATOM 1170 CA CYS A 82 -1.066 -3.868 -13.311 1.00 0.00 C ATOM 1171 C CYS A 82 -0.894 -5.300 -13.810 1.00 0.00 C ATOM 1172 O CYS A 82 -1.854 -6.068 -13.868 1.00 0.00 O ATOM 1173 CB CYS A 82 -0.788 -2.883 -14.448 1.00 0.00 C ATOM 1174 SG CYS A 82 -1.520 -1.234 -14.199 1.00 0.00 S ATOM 0 H CYS A 82 0.717 -3.193 -12.439 1.00 0.00 H new ATOM 0 HA CYS A 82 -2.094 -3.741 -12.973 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.290 -2.776 -14.566 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -1.171 -3.302 -15.379 1.00 0.00 H new ATOM 1179 N SER A 83 0.336 -5.651 -14.170 1.00 0.00 N ATOM 1180 CA SER A 83 0.634 -6.989 -14.668 1.00 0.00 C ATOM 1181 C SER A 83 -0.141 -8.045 -13.886 1.00 0.00 C ATOM 1182 O SER A 83 -0.804 -8.902 -14.470 1.00 0.00 O ATOM 1183 CB SER A 83 2.136 -7.268 -14.574 1.00 0.00 C ATOM 1184 OG SER A 83 2.510 -8.336 -15.426 1.00 0.00 O ATOM 0 H SER A 83 1.142 -5.028 -14.126 1.00 0.00 H new ATOM 0 HA SER A 83 0.327 -7.038 -15.713 1.00 0.00 H new ATOM 0 HB2 SER A 83 2.693 -6.371 -14.844 1.00 0.00 H new ATOM 0 HB3 SER A 83 2.400 -7.510 -13.545 1.00 0.00 H new ATOM 0 HG SER A 83 3.474 -8.494 -15.349 1.00 0.00 H new ATOM 1190 N GLN A 84 -0.051 -7.976 -12.562 1.00 0.00 N ATOM 1191 CA GLN A 84 -0.743 -8.926 -11.699 1.00 0.00 C ATOM 1192 C GLN A 84 -0.110 -10.310 -11.795 1.00 0.00 C ATOM 1193 O GLN A 84 -0.805 -11.324 -11.757 1.00 0.00 O ATOM 1194 CB GLN A 84 -2.224 -9.003 -12.074 1.00 0.00 C ATOM 1195 CG GLN A 84 -3.105 -9.554 -10.965 1.00 0.00 C ATOM 1196 CD GLN A 84 -4.409 -10.127 -11.485 1.00 0.00 C ATOM 1197 OE1 GLN A 84 -5.180 -9.438 -12.153 1.00 0.00 O ATOM 1198 NE2 GLN A 84 -4.662 -11.395 -11.181 1.00 0.00 N ATOM 0 H GLN A 84 0.494 -7.273 -12.064 1.00 0.00 H new ATOM 0 HA GLN A 84 -0.653 -8.576 -10.671 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.574 -8.007 -12.343 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -2.334 -9.630 -12.959 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.561 -10.330 -10.426 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -3.321 -8.760 -10.250 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -3.994 -11.929 -10.625 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.524 -11.835 -11.504 1.00 0.00 H new ATOM 1207 N GLU A 85 1.213 -10.342 -11.920 1.00 0.00 N ATOM 1208 CA GLU A 85 1.939 -11.603 -12.023 1.00 0.00 C ATOM 1209 C GLU A 85 1.433 -12.428 -13.203 1.00 0.00 C ATOM 1210 O GLU A 85 1.221 -13.634 -13.085 1.00 0.00 O ATOM 1211 CB GLU A 85 1.798 -12.405 -10.728 1.00 0.00 C ATOM 1212 CG GLU A 85 2.472 -11.754 -9.531 1.00 0.00 C ATOM 1213 CD GLU A 85 3.980 -11.697 -9.671 1.00 0.00 C ATOM 1214 OE1 GLU A 85 4.622 -12.767 -9.619 1.00 0.00 O ATOM 1215 OE2 GLU A 85 4.519 -10.582 -9.831 1.00 0.00 O ATOM 0 H GLU A 85 1.803 -9.511 -11.952 1.00 0.00 H new ATOM 0 HA GLU A 85 2.992 -11.374 -12.187 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.739 -12.541 -10.508 1.00 0.00 H new ATOM 0 HB3 GLU A 85 2.222 -13.398 -10.878 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.084 -10.743 -9.406 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.215 -12.308 -8.628 1.00 0.00 H new ATOM 1222 N SER A 86 1.241 -11.767 -14.340 1.00 0.00 N ATOM 1223 CA SER A 86 0.756 -12.437 -15.541 1.00 0.00 C ATOM 1224 C SER A 86 1.885 -13.192 -16.236 1.00 0.00 C ATOM 1225 O SER A 86 1.644 -14.123 -17.002 1.00 0.00 O ATOM 1226 CB SER A 86 0.138 -11.421 -16.503 1.00 0.00 C ATOM 1227 OG SER A 86 1.127 -10.556 -17.036 1.00 0.00 O ATOM 0 H SER A 86 1.414 -10.768 -14.455 1.00 0.00 H new ATOM 0 HA SER A 86 -0.008 -13.155 -15.243 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.367 -11.945 -17.315 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.619 -10.835 -15.981 1.00 0.00 H new ATOM 0 HG SER A 86 1.434 -9.940 -16.338 1.00 0.00 H new ATOM 1233 N GLY A 87 3.119 -12.781 -15.961 1.00 0.00 N ATOM 1234 CA GLY A 87 4.268 -13.428 -16.568 1.00 0.00 C ATOM 1235 C GLY A 87 4.374 -14.893 -16.192 1.00 0.00 C ATOM 1236 O GLY A 87 3.860 -15.330 -15.162 1.00 0.00 O ATOM 0 H GLY A 87 3.344 -12.012 -15.329 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.201 -13.338 -17.652 1.00 0.00 H new ATOM 0 HA3 GLY A 87 5.177 -12.911 -16.261 1.00 0.00 H new ATOM 1240 N PRO A 88 5.052 -15.678 -17.042 1.00 0.00 N ATOM 1241 CA PRO A 88 5.238 -17.115 -16.815 1.00 0.00 C ATOM 1242 C PRO A 88 6.176 -17.401 -15.648 1.00 0.00 C ATOM 1243 O PRO A 88 7.353 -17.039 -15.681 1.00 0.00 O ATOM 1244 CB PRO A 88 5.855 -17.604 -18.128 1.00 0.00 C ATOM 1245 CG PRO A 88 6.527 -16.404 -18.702 1.00 0.00 C ATOM 1246 CD PRO A 88 5.691 -15.224 -18.289 1.00 0.00 C ATOM 0 HA PRO A 88 4.303 -17.611 -16.556 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.567 -18.411 -17.954 1.00 0.00 H new ATOM 0 HB3 PRO A 88 5.092 -17.992 -18.803 1.00 0.00 H new ATOM 0 HG2 PRO A 88 7.546 -16.311 -18.327 1.00 0.00 H new ATOM 0 HG3 PRO A 88 6.592 -16.475 -19.788 1.00 0.00 H new ATOM 0 HD2 PRO A 88 6.302 -14.336 -18.127 1.00 0.00 H new ATOM 0 HD3 PRO A 88 4.953 -14.969 -19.049 1.00 0.00 H new ATOM 1254 N SER A 89 5.649 -18.052 -14.616 1.00 0.00 N ATOM 1255 CA SER A 89 6.438 -18.383 -13.436 1.00 0.00 C ATOM 1256 C SER A 89 6.119 -19.793 -12.948 1.00 0.00 C ATOM 1257 O SER A 89 5.062 -20.344 -13.253 1.00 0.00 O ATOM 1258 CB SER A 89 6.174 -17.372 -12.319 1.00 0.00 C ATOM 1259 OG SER A 89 4.796 -17.319 -11.994 1.00 0.00 O ATOM 0 H SER A 89 4.678 -18.361 -14.574 1.00 0.00 H new ATOM 0 HA SER A 89 7.492 -18.342 -13.711 1.00 0.00 H new ATOM 0 HB2 SER A 89 6.749 -17.645 -11.434 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.516 -16.385 -12.630 1.00 0.00 H new ATOM 0 HG SER A 89 4.654 -16.667 -11.276 1.00 0.00 H new ATOM 1265 N SER A 90 7.043 -20.372 -12.186 1.00 0.00 N ATOM 1266 CA SER A 90 6.863 -21.719 -11.657 1.00 0.00 C ATOM 1267 C SER A 90 5.434 -21.922 -11.162 1.00 0.00 C ATOM 1268 O SER A 90 4.920 -21.130 -10.373 1.00 0.00 O ATOM 1269 CB SER A 90 7.851 -21.978 -10.519 1.00 0.00 C ATOM 1270 OG SER A 90 9.176 -22.095 -11.010 1.00 0.00 O ATOM 0 H SER A 90 7.923 -19.929 -11.922 1.00 0.00 H new ATOM 0 HA SER A 90 7.054 -22.428 -12.463 1.00 0.00 H new ATOM 0 HB2 SER A 90 7.799 -21.164 -9.796 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.573 -22.891 -9.993 1.00 0.00 H new ATOM 0 HG SER A 90 9.789 -22.259 -10.263 1.00 0.00 H new ATOM 1276 N GLY A 91 4.798 -22.990 -11.632 1.00 0.00 N ATOM 1277 CA GLY A 91 3.435 -23.280 -11.227 1.00 0.00 C ATOM 1278 C GLY A 91 3.369 -24.075 -9.938 1.00 0.00 C ATOM 1279 O GLY A 91 4.414 -24.472 -9.426 1.00 0.00 O ATOM 0 H GLY A 91 5.202 -23.660 -12.286 1.00 0.00 H new ATOM 0 HA2 GLY A 91 2.890 -22.344 -11.101 1.00 0.00 H new ATOM 0 HA3 GLY A 91 2.935 -23.837 -12.019 1.00 0.00 H new TER 1283 GLY A 91 HETATM 1284 ZN ZN A 201 8.906 6.574 -6.010 1.00 0.00 ZN HETATM 1285 ZN ZN A 401 0.152 0.394 -14.247 1.00 0.00 ZN