USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 776 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 60 HIS HD1 : A 60 HIS ND1 : A 200 ZNZN :(H bumps) USER MOD Set 1.1: A 62 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 29 LYS NZ :NH3+ 163:sc= -2.42! (180deg=-1.04) USER MOD Set 2.2: A 57 HIS : no HD1:sc= -6.47! C(o=-9.1!,f=-14!) USER MOD Set 2.3: A 59 TYR OH : rot 180:sc= -0.185 USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0631 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -57:sc= 0.21 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 8 MET CE :methyl 167:sc= 0 (180deg=-0.194) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= -0.0932 USER MOD Single : A 14 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0453) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc=-0.00609 USER MOD Single : A 22 LYS NZ :NH3+ -141:sc= -0.383 (180deg=-1.57!) USER MOD Single : A 23 SER OG : rot 18:sc= 0.0805 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -120:sc= -0.62 (180deg=-1.52) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot -91:sc= 1.29 USER MOD Single : A 42 MET CE :methyl 169:sc= -0.0849 (180deg=-0.321) USER MOD Single : A 45 MET CE :methyl 149:sc= -0.736 (180deg=-2.28!) USER MOD Single : A 47 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.65) USER MOD Single : A 48 SER OG : rot -150:sc= 0 USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.862 X(o=-0.86,f=-0.85) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 82 SER OG : rot 180:sc= -0.014 USER MOD Single : A 89 GLN : amide:sc= -0.895 K(o=-0.9,f=-2.9!) USER MOD Single : A 90 GLN : amide:sc=-0.00617 X(o=-0.0062,f=-0.0062) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0203) USER MOD Single : A 95 THR OG1 : rot 98:sc= 1.3 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.805 15.942 26.990 1.00 0.00 N ATOM 2 CA GLY A 1 -5.182 14.797 26.352 1.00 0.00 C ATOM 3 C GLY A 1 -4.525 15.153 25.034 1.00 0.00 C ATOM 4 O GLY A 1 -4.761 16.230 24.486 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.194 16.287 27.757 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.941 16.698 26.289 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.727 15.662 27.381 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.435 14.373 27.023 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.934 14.026 26.183 1.00 0.00 H new ATOM 8 N SER A 2 -3.697 14.248 24.523 1.00 0.00 N ATOM 9 CA SER A 2 -2.999 14.475 23.263 1.00 0.00 C ATOM 10 C SER A 2 -3.937 14.264 22.077 1.00 0.00 C ATOM 11 O SER A 2 -3.945 15.051 21.131 1.00 0.00 O ATOM 12 CB SER A 2 -1.794 13.539 23.147 1.00 0.00 C ATOM 13 OG SER A 2 -0.647 14.108 23.756 1.00 0.00 O ATOM 0 H SER A 2 -3.493 13.350 24.962 1.00 0.00 H new ATOM 0 HA SER A 2 -2.651 15.508 23.250 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.024 12.584 23.619 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.588 13.334 22.096 1.00 0.00 H new ATOM 0 HG SER A 2 0.109 13.491 23.670 1.00 0.00 H new ATOM 19 N SER A 3 -4.724 13.195 22.137 1.00 0.00 N ATOM 20 CA SER A 3 -5.663 12.877 21.067 1.00 0.00 C ATOM 21 C SER A 3 -5.020 13.086 19.700 1.00 0.00 C ATOM 22 O SER A 3 -5.643 13.621 18.784 1.00 0.00 O ATOM 23 CB SER A 3 -6.920 13.740 21.190 1.00 0.00 C ATOM 24 OG SER A 3 -7.961 13.246 20.365 1.00 0.00 O ATOM 0 H SER A 3 -4.730 12.535 22.914 1.00 0.00 H new ATOM 0 HA SER A 3 -5.941 11.827 21.161 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.252 13.758 22.228 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.688 14.768 20.911 1.00 0.00 H new ATOM 0 HG SER A 3 -7.654 13.213 19.435 1.00 0.00 H new ATOM 30 N GLY A 4 -3.767 12.660 19.570 1.00 0.00 N ATOM 31 CA GLY A 4 -3.059 12.809 18.313 1.00 0.00 C ATOM 32 C GLY A 4 -2.084 11.676 18.058 1.00 0.00 C ATOM 33 O GLY A 4 -2.110 10.659 18.751 1.00 0.00 O ATOM 0 H GLY A 4 -3.230 12.214 20.314 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.780 12.854 17.497 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.519 13.756 18.314 1.00 0.00 H new ATOM 37 N SER A 5 -1.223 11.852 17.061 1.00 0.00 N ATOM 38 CA SER A 5 -0.238 10.834 16.713 1.00 0.00 C ATOM 39 C SER A 5 1.154 11.241 17.185 1.00 0.00 C ATOM 40 O SER A 5 1.450 12.427 17.330 1.00 0.00 O ATOM 41 CB SER A 5 -0.229 10.598 15.202 1.00 0.00 C ATOM 42 OG SER A 5 -0.098 11.820 14.496 1.00 0.00 O ATOM 0 H SER A 5 -1.187 12.690 16.480 1.00 0.00 H new ATOM 0 HA SER A 5 -0.516 9.908 17.216 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.594 9.933 14.940 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.151 10.099 14.903 1.00 0.00 H new ATOM 0 HG SER A 5 -0.093 11.642 13.532 1.00 0.00 H new ATOM 48 N SER A 6 2.006 10.248 17.422 1.00 0.00 N ATOM 49 CA SER A 6 3.367 10.502 17.881 1.00 0.00 C ATOM 50 C SER A 6 4.189 11.185 16.792 1.00 0.00 C ATOM 51 O SER A 6 4.876 12.173 17.045 1.00 0.00 O ATOM 52 CB SER A 6 4.039 9.193 18.297 1.00 0.00 C ATOM 53 OG SER A 6 5.362 9.421 18.751 1.00 0.00 O ATOM 0 H SER A 6 1.778 9.261 17.304 1.00 0.00 H new ATOM 0 HA SER A 6 3.316 11.166 18.744 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.457 8.717 19.086 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.055 8.504 17.452 1.00 0.00 H new ATOM 0 HG SER A 6 5.770 8.569 19.013 1.00 0.00 H new ATOM 59 N GLY A 7 4.112 10.649 15.577 1.00 0.00 N ATOM 60 CA GLY A 7 4.853 11.219 14.467 1.00 0.00 C ATOM 61 C GLY A 7 5.797 10.220 13.827 1.00 0.00 C ATOM 62 O GLY A 7 6.923 10.037 14.288 1.00 0.00 O ATOM 0 H GLY A 7 3.550 9.831 15.342 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.153 11.585 13.716 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.423 12.079 14.818 1.00 0.00 H new ATOM 66 N MET A 8 5.336 9.571 12.763 1.00 0.00 N ATOM 67 CA MET A 8 6.148 8.585 12.059 1.00 0.00 C ATOM 68 C MET A 8 7.476 9.191 11.615 1.00 0.00 C ATOM 69 O MET A 8 7.650 10.409 11.635 1.00 0.00 O ATOM 70 CB MET A 8 5.391 8.042 10.845 1.00 0.00 C ATOM 71 CG MET A 8 5.262 9.045 9.711 1.00 0.00 C ATOM 72 SD MET A 8 3.845 10.142 9.911 1.00 0.00 S ATOM 73 CE MET A 8 2.597 9.257 8.981 1.00 0.00 C ATOM 0 H MET A 8 4.405 9.710 12.370 1.00 0.00 H new ATOM 0 HA MET A 8 6.355 7.765 12.746 1.00 0.00 H new ATOM 0 HB2 MET A 8 5.902 7.153 10.476 1.00 0.00 H new ATOM 0 HB3 MET A 8 4.395 7.730 11.158 1.00 0.00 H new ATOM 0 HG2 MET A 8 6.173 9.641 9.653 1.00 0.00 H new ATOM 0 HG3 MET A 8 5.171 8.509 8.766 1.00 0.00 H new ATOM 0 HE1 MET A 8 1.615 9.679 9.197 1.00 0.00 H new ATOM 0 HE2 MET A 8 2.805 9.348 7.915 1.00 0.00 H new ATOM 0 HE3 MET A 8 2.610 8.205 9.264 1.00 0.00 H new ATOM 83 N ALA A 9 8.408 8.333 11.215 1.00 0.00 N ATOM 84 CA ALA A 9 9.719 8.784 10.765 1.00 0.00 C ATOM 85 C ALA A 9 9.600 9.672 9.531 1.00 0.00 C ATOM 86 O ALA A 9 8.985 9.288 8.537 1.00 0.00 O ATOM 87 CB ALA A 9 10.617 7.591 10.474 1.00 0.00 C ATOM 0 H ALA A 9 8.280 7.321 11.193 1.00 0.00 H new ATOM 0 HA ALA A 9 10.166 9.375 11.564 1.00 0.00 H new ATOM 0 HB1 ALA A 9 11.593 7.943 10.139 1.00 0.00 H new ATOM 0 HB2 ALA A 9 10.737 6.997 11.380 1.00 0.00 H new ATOM 0 HB3 ALA A 9 10.165 6.977 9.695 1.00 0.00 H new ATOM 93 N GLU A 10 10.192 10.860 9.603 1.00 0.00 N ATOM 94 CA GLU A 10 10.150 11.803 8.491 1.00 0.00 C ATOM 95 C GLU A 10 11.246 11.495 7.475 1.00 0.00 C ATOM 96 O GLU A 10 12.372 11.977 7.596 1.00 0.00 O ATOM 97 CB GLU A 10 10.302 13.237 9.003 1.00 0.00 C ATOM 98 CG GLU A 10 9.149 13.696 9.879 1.00 0.00 C ATOM 99 CD GLU A 10 9.544 14.812 10.827 1.00 0.00 C ATOM 100 OE1 GLU A 10 10.437 14.585 11.670 1.00 0.00 O ATOM 101 OE2 GLU A 10 8.962 15.912 10.725 1.00 0.00 O ATOM 0 H GLU A 10 10.706 11.192 10.419 1.00 0.00 H new ATOM 0 HA GLU A 10 9.183 11.702 7.998 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.230 13.315 9.569 1.00 0.00 H new ATOM 0 HB3 GLU A 10 10.390 13.911 8.151 1.00 0.00 H new ATOM 0 HG2 GLU A 10 8.329 14.036 9.246 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.777 12.849 10.456 1.00 0.00 H new ATOM 108 N SER A 11 10.907 10.688 6.475 1.00 0.00 N ATOM 109 CA SER A 11 11.863 10.311 5.440 1.00 0.00 C ATOM 110 C SER A 11 11.236 10.427 4.054 1.00 0.00 C ATOM 111 O SER A 11 11.894 10.829 3.094 1.00 0.00 O ATOM 112 CB SER A 11 12.359 8.882 5.669 1.00 0.00 C ATOM 113 OG SER A 11 11.278 8.002 5.925 1.00 0.00 O ATOM 0 H SER A 11 9.978 10.283 6.359 1.00 0.00 H new ATOM 0 HA SER A 11 12.710 10.995 5.496 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.911 8.540 4.793 1.00 0.00 H new ATOM 0 HB3 SER A 11 13.053 8.865 6.509 1.00 0.00 H new ATOM 0 HG SER A 11 11.621 7.095 6.066 1.00 0.00 H new ATOM 119 N SER A 12 9.959 10.072 3.957 1.00 0.00 N ATOM 120 CA SER A 12 9.242 10.132 2.688 1.00 0.00 C ATOM 121 C SER A 12 7.750 10.352 2.917 1.00 0.00 C ATOM 122 O SER A 12 7.158 9.772 3.827 1.00 0.00 O ATOM 123 CB SER A 12 9.463 8.844 1.892 1.00 0.00 C ATOM 124 OG SER A 12 10.845 8.583 1.719 1.00 0.00 O ATOM 0 H SER A 12 9.399 9.740 4.742 1.00 0.00 H new ATOM 0 HA SER A 12 9.632 10.975 2.118 1.00 0.00 H new ATOM 0 HB2 SER A 12 8.994 8.008 2.410 1.00 0.00 H new ATOM 0 HB3 SER A 12 8.981 8.927 0.918 1.00 0.00 H new ATOM 0 HG SER A 12 10.960 7.754 1.209 1.00 0.00 H new ATOM 130 N ASP A 13 7.149 11.195 2.085 1.00 0.00 N ATOM 131 CA ASP A 13 5.725 11.493 2.194 1.00 0.00 C ATOM 132 C ASP A 13 5.032 11.336 0.844 1.00 0.00 C ATOM 133 O ASP A 13 4.229 12.179 0.445 1.00 0.00 O ATOM 134 CB ASP A 13 5.519 12.912 2.725 1.00 0.00 C ATOM 135 CG ASP A 13 5.604 12.982 4.237 1.00 0.00 C ATOM 136 OD1 ASP A 13 5.316 11.961 4.896 1.00 0.00 O ATOM 137 OD2 ASP A 13 5.959 14.059 4.762 1.00 0.00 O ATOM 0 H ASP A 13 7.625 11.684 1.327 1.00 0.00 H new ATOM 0 HA ASP A 13 5.283 10.784 2.894 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.270 13.572 2.291 1.00 0.00 H new ATOM 0 HB3 ASP A 13 4.546 13.280 2.401 1.00 0.00 H new ATOM 142 N LYS A 14 5.349 10.251 0.145 1.00 0.00 N ATOM 143 CA LYS A 14 4.758 9.982 -1.161 1.00 0.00 C ATOM 144 C LYS A 14 3.235 10.010 -1.084 1.00 0.00 C ATOM 145 O LYS A 14 2.648 9.652 -0.062 1.00 0.00 O ATOM 146 CB LYS A 14 5.228 8.624 -1.686 1.00 0.00 C ATOM 147 CG LYS A 14 6.734 8.524 -1.851 1.00 0.00 C ATOM 148 CD LYS A 14 7.110 7.572 -2.974 1.00 0.00 C ATOM 149 CE LYS A 14 8.536 7.806 -3.449 1.00 0.00 C ATOM 150 NZ LYS A 14 9.524 7.628 -2.349 1.00 0.00 N ATOM 0 H LYS A 14 6.012 9.543 0.461 1.00 0.00 H new ATOM 0 HA LYS A 14 5.084 10.763 -1.848 1.00 0.00 H new ATOM 0 HB2 LYS A 14 4.893 7.844 -1.002 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.752 8.431 -2.647 1.00 0.00 H new ATOM 0 HG2 LYS A 14 7.145 9.512 -2.058 1.00 0.00 H new ATOM 0 HG3 LYS A 14 7.181 8.182 -0.918 1.00 0.00 H new ATOM 0 HD2 LYS A 14 7.004 6.543 -2.631 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.421 7.702 -3.809 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.767 7.115 -4.260 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.623 8.814 -3.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 10.487 7.645 -2.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 9.418 8.399 -1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.358 6.716 -1.878 1.00 0.00 H new ATOM 164 N LEU A 15 2.600 10.436 -2.170 1.00 0.00 N ATOM 165 CA LEU A 15 1.144 10.508 -2.227 1.00 0.00 C ATOM 166 C LEU A 15 0.513 9.237 -1.667 1.00 0.00 C ATOM 167 O LEU A 15 -0.332 9.293 -0.774 1.00 0.00 O ATOM 168 CB LEU A 15 0.680 10.730 -3.668 1.00 0.00 C ATOM 169 CG LEU A 15 0.749 12.169 -4.181 1.00 0.00 C ATOM 170 CD1 LEU A 15 0.642 12.200 -5.698 1.00 0.00 C ATOM 171 CD2 LEU A 15 -0.348 13.013 -3.549 1.00 0.00 C ATOM 0 H LEU A 15 3.070 10.737 -3.023 1.00 0.00 H new ATOM 0 HA LEU A 15 0.823 11.351 -1.615 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.284 10.102 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.350 10.384 -3.754 1.00 0.00 H new ATOM 0 HG LEU A 15 1.713 12.591 -3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.693 13.232 -6.045 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.463 11.630 -6.132 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.307 11.760 -6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.284 14.034 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.322 12.593 -3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.225 13.017 -2.466 1.00 0.00 H new ATOM 183 N TYR A 16 0.931 8.093 -2.198 1.00 0.00 N ATOM 184 CA TYR A 16 0.406 6.808 -1.752 1.00 0.00 C ATOM 185 C TYR A 16 1.449 6.046 -0.939 1.00 0.00 C ATOM 186 O TYR A 16 2.628 6.404 -0.930 1.00 0.00 O ATOM 187 CB TYR A 16 -0.034 5.969 -2.952 1.00 0.00 C ATOM 188 CG TYR A 16 -0.986 6.690 -3.879 1.00 0.00 C ATOM 189 CD1 TYR A 16 -2.355 6.683 -3.643 1.00 0.00 C ATOM 190 CD2 TYR A 16 -0.516 7.380 -4.990 1.00 0.00 C ATOM 191 CE1 TYR A 16 -3.229 7.341 -4.488 1.00 0.00 C ATOM 192 CE2 TYR A 16 -1.382 8.041 -5.839 1.00 0.00 C ATOM 193 CZ TYR A 16 -2.737 8.018 -5.584 1.00 0.00 C ATOM 194 OH TYR A 16 -3.604 8.675 -6.427 1.00 0.00 O ATOM 0 H TYR A 16 1.631 8.029 -2.937 1.00 0.00 H new ATOM 0 HA TYR A 16 -0.457 6.998 -1.114 1.00 0.00 H new ATOM 0 HB2 TYR A 16 0.848 5.666 -3.515 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -0.511 5.058 -2.592 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -2.743 6.155 -2.785 1.00 0.00 H new ATOM 0 HD2 TYR A 16 0.545 7.400 -5.193 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -4.291 7.325 -4.291 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -1.000 8.573 -6.698 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.097 9.102 -7.149 1.00 0.00 H new ATOM 204 N ARG A 17 1.007 4.994 -0.259 1.00 0.00 N ATOM 205 CA ARG A 17 1.901 4.181 0.557 1.00 0.00 C ATOM 206 C ARG A 17 1.358 2.764 0.711 1.00 0.00 C ATOM 207 O ARG A 17 0.346 2.544 1.378 1.00 0.00 O ATOM 208 CB ARG A 17 2.090 4.819 1.935 1.00 0.00 C ATOM 209 CG ARG A 17 2.883 3.956 2.902 1.00 0.00 C ATOM 210 CD ARG A 17 3.236 4.719 4.169 1.00 0.00 C ATOM 211 NE ARG A 17 2.055 5.019 4.974 1.00 0.00 N ATOM 212 CZ ARG A 17 1.996 6.016 5.850 1.00 0.00 C ATOM 213 NH1 ARG A 17 3.046 6.805 6.033 1.00 0.00 N ATOM 214 NH2 ARG A 17 0.885 6.226 6.545 1.00 0.00 N ATOM 0 H ARG A 17 0.035 4.684 -0.257 1.00 0.00 H new ATOM 0 HA ARG A 17 2.866 4.129 0.053 1.00 0.00 H new ATOM 0 HB2 ARG A 17 2.597 5.777 1.816 1.00 0.00 H new ATOM 0 HB3 ARG A 17 1.111 5.028 2.367 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.303 3.069 3.159 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.796 3.610 2.418 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.939 4.133 4.761 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.740 5.649 3.904 1.00 0.00 H new ATOM 0 HE ARG A 17 1.230 4.431 4.857 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.902 6.647 5.501 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.998 7.570 6.706 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.075 5.622 6.407 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.841 6.992 7.217 1.00 0.00 H new ATOM 228 N VAL A 18 2.036 1.805 0.090 1.00 0.00 N ATOM 229 CA VAL A 18 1.622 0.408 0.158 1.00 0.00 C ATOM 230 C VAL A 18 2.570 -0.404 1.034 1.00 0.00 C ATOM 231 O VAL A 18 3.783 -0.197 1.010 1.00 0.00 O ATOM 232 CB VAL A 18 1.563 -0.229 -1.243 1.00 0.00 C ATOM 233 CG1 VAL A 18 2.933 -0.193 -1.904 1.00 0.00 C ATOM 234 CG2 VAL A 18 1.041 -1.655 -1.158 1.00 0.00 C ATOM 0 H VAL A 18 2.875 1.969 -0.466 1.00 0.00 H new ATOM 0 HA VAL A 18 0.624 0.395 0.597 1.00 0.00 H new ATOM 0 HB VAL A 18 0.874 0.350 -1.858 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.872 -0.647 -2.893 1.00 0.00 H new ATOM 0 HG12 VAL A 18 3.264 0.841 -2.000 1.00 0.00 H new ATOM 0 HG13 VAL A 18 3.646 -0.747 -1.294 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.006 -2.090 -2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.703 -2.248 -0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.039 -1.651 -0.729 1.00 0.00 H new ATOM 244 N GLU A 19 2.007 -1.327 1.807 1.00 0.00 N ATOM 245 CA GLU A 19 2.803 -2.170 2.692 1.00 0.00 C ATOM 246 C GLU A 19 1.932 -3.225 3.368 1.00 0.00 C ATOM 247 O GLU A 19 0.706 -3.111 3.391 1.00 0.00 O ATOM 248 CB GLU A 19 3.504 -1.317 3.751 1.00 0.00 C ATOM 249 CG GLU A 19 2.546 -0.554 4.650 1.00 0.00 C ATOM 250 CD GLU A 19 3.189 0.662 5.289 1.00 0.00 C ATOM 251 OE1 GLU A 19 4.096 1.250 4.666 1.00 0.00 O ATOM 252 OE2 GLU A 19 2.782 1.025 6.413 1.00 0.00 O ATOM 0 H GLU A 19 1.004 -1.510 1.839 1.00 0.00 H new ATOM 0 HA GLU A 19 3.555 -2.678 2.088 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.132 -1.961 4.367 1.00 0.00 H new ATOM 0 HB3 GLU A 19 4.166 -0.607 3.254 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.680 -0.239 4.068 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.179 -1.219 5.432 1.00 0.00 H new ATOM 259 N TYR A 20 2.573 -4.250 3.916 1.00 0.00 N ATOM 260 CA TYR A 20 1.858 -5.327 4.590 1.00 0.00 C ATOM 261 C TYR A 20 1.358 -4.876 5.959 1.00 0.00 C ATOM 262 O TYR A 20 2.139 -4.724 6.898 1.00 0.00 O ATOM 263 CB TYR A 20 2.762 -6.552 4.743 1.00 0.00 C ATOM 264 CG TYR A 20 3.339 -7.045 3.435 1.00 0.00 C ATOM 265 CD1 TYR A 20 2.514 -7.327 2.352 1.00 0.00 C ATOM 266 CD2 TYR A 20 4.707 -7.232 3.282 1.00 0.00 C ATOM 267 CE1 TYR A 20 3.036 -7.779 1.156 1.00 0.00 C ATOM 268 CE2 TYR A 20 5.238 -7.682 2.089 1.00 0.00 C ATOM 269 CZ TYR A 20 4.398 -7.954 1.029 1.00 0.00 C ATOM 270 OH TYR A 20 4.923 -8.404 -0.161 1.00 0.00 O ATOM 0 H TYR A 20 3.587 -4.358 3.907 1.00 0.00 H new ATOM 0 HA TYR A 20 0.996 -5.594 3.978 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.579 -6.308 5.422 1.00 0.00 H new ATOM 0 HB3 TYR A 20 2.193 -7.358 5.206 1.00 0.00 H new ATOM 0 HD1 TYR A 20 1.447 -7.190 2.448 1.00 0.00 H new ATOM 0 HD2 TYR A 20 5.367 -7.022 4.111 1.00 0.00 H new ATOM 0 HE1 TYR A 20 2.381 -7.994 0.325 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.304 -7.820 1.987 1.00 0.00 H new ATOM 0 HH TYR A 20 5.898 -8.472 -0.084 1.00 0.00 H new ATOM 280 N ALA A 21 0.050 -4.665 6.064 1.00 0.00 N ATOM 281 CA ALA A 21 -0.555 -4.234 7.318 1.00 0.00 C ATOM 282 C ALA A 21 0.180 -4.827 8.515 1.00 0.00 C ATOM 283 O ALA A 21 0.156 -6.038 8.735 1.00 0.00 O ATOM 284 CB ALA A 21 -2.026 -4.623 7.355 1.00 0.00 C ATOM 0 H ALA A 21 -0.610 -4.786 5.296 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.475 -3.149 7.377 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.465 -4.295 8.297 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.549 -4.147 6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -2.118 -5.706 7.269 1.00 0.00 H new ATOM 290 N LYS A 22 0.835 -3.966 9.287 1.00 0.00 N ATOM 291 CA LYS A 22 1.577 -4.403 10.463 1.00 0.00 C ATOM 292 C LYS A 22 0.647 -5.047 11.486 1.00 0.00 C ATOM 293 O LYS A 22 0.987 -6.059 12.098 1.00 0.00 O ATOM 294 CB LYS A 22 2.310 -3.219 11.098 1.00 0.00 C ATOM 295 CG LYS A 22 3.699 -2.987 10.529 1.00 0.00 C ATOM 296 CD LYS A 22 3.649 -2.145 9.265 1.00 0.00 C ATOM 297 CE LYS A 22 3.683 -0.658 9.584 1.00 0.00 C ATOM 298 NZ LYS A 22 2.327 -0.126 9.893 1.00 0.00 N ATOM 0 H LYS A 22 0.867 -2.960 9.119 1.00 0.00 H new ATOM 0 HA LYS A 22 2.308 -5.147 10.145 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.714 -2.317 10.959 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.390 -3.386 12.172 1.00 0.00 H new ATOM 0 HG2 LYS A 22 4.320 -2.490 11.274 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.169 -3.946 10.310 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.492 -2.400 8.623 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.742 -2.378 8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 22 4.344 -0.484 10.433 1.00 0.00 H new ATOM 0 HE3 LYS A 22 4.102 -0.114 8.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 2.223 0.821 9.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.606 -0.761 9.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 2.204 -0.066 10.924 1.00 0.00 H new ATOM 312 N SER A 23 -0.529 -4.454 11.666 1.00 0.00 N ATOM 313 CA SER A 23 -1.507 -4.968 12.617 1.00 0.00 C ATOM 314 C SER A 23 -2.929 -4.707 12.128 1.00 0.00 C ATOM 315 O SER A 23 -3.209 -3.673 11.522 1.00 0.00 O ATOM 316 CB SER A 23 -1.302 -4.327 13.990 1.00 0.00 C ATOM 317 OG SER A 23 -0.173 -4.879 14.647 1.00 0.00 O ATOM 0 H SER A 23 -0.827 -3.617 11.165 1.00 0.00 H new ATOM 0 HA SER A 23 -1.362 -6.045 12.702 1.00 0.00 H new ATOM 0 HB2 SER A 23 -1.171 -3.251 13.877 1.00 0.00 H new ATOM 0 HB3 SER A 23 -2.192 -4.477 14.601 1.00 0.00 H new ATOM 0 HG SER A 23 0.399 -5.330 13.991 1.00 0.00 H new ATOM 323 N GLY A 24 -3.824 -5.652 12.397 1.00 0.00 N ATOM 324 CA GLY A 24 -5.206 -5.506 11.979 1.00 0.00 C ATOM 325 C GLY A 24 -5.973 -4.526 12.844 1.00 0.00 C ATOM 326 O GLY A 24 -6.847 -4.922 13.616 1.00 0.00 O ATOM 0 H GLY A 24 -3.617 -6.516 12.897 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.235 -5.171 10.942 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -5.697 -6.478 12.014 1.00 0.00 H new ATOM 330 N ARG A 25 -5.646 -3.245 12.717 1.00 0.00 N ATOM 331 CA ARG A 25 -6.309 -2.206 13.496 1.00 0.00 C ATOM 332 C ARG A 25 -6.998 -1.197 12.581 1.00 0.00 C ATOM 333 O ARG A 25 -8.195 -0.943 12.711 1.00 0.00 O ATOM 334 CB ARG A 25 -5.299 -1.489 14.394 1.00 0.00 C ATOM 335 CG ARG A 25 -4.782 -2.349 15.536 1.00 0.00 C ATOM 336 CD ARG A 25 -4.421 -1.505 16.749 1.00 0.00 C ATOM 337 NE ARG A 25 -3.945 -2.323 17.862 1.00 0.00 N ATOM 338 CZ ARG A 25 -3.850 -1.880 19.110 1.00 0.00 C ATOM 339 NH1 ARG A 25 -4.197 -0.634 19.404 1.00 0.00 N ATOM 340 NH2 ARG A 25 -3.408 -2.684 20.069 1.00 0.00 N ATOM 0 H ARG A 25 -4.926 -2.901 12.082 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.066 -2.682 14.120 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.455 -1.160 13.787 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.764 -0.593 14.806 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.540 -3.082 15.813 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -3.906 -2.907 15.205 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -3.651 -0.784 16.473 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.293 -0.934 17.066 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.671 -3.287 17.670 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -4.538 -0.013 18.670 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.123 -0.297 20.364 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.141 -3.643 19.848 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.335 -2.343 21.027 1.00 0.00 H new ATOM 354 N ALA A 26 -6.233 -0.625 11.657 1.00 0.00 N ATOM 355 CA ALA A 26 -6.770 0.354 10.721 1.00 0.00 C ATOM 356 C ALA A 26 -8.081 -0.130 10.111 1.00 0.00 C ATOM 357 O ALA A 26 -8.356 -1.330 10.078 1.00 0.00 O ATOM 358 CB ALA A 26 -5.755 0.651 9.627 1.00 0.00 C ATOM 0 H ALA A 26 -5.240 -0.823 11.537 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.973 1.272 11.272 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.170 1.384 8.935 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.844 1.049 10.074 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.523 -0.267 9.087 1.00 0.00 H new ATOM 364 N SER A 27 -8.888 0.810 9.629 1.00 0.00 N ATOM 365 CA SER A 27 -10.173 0.478 9.025 1.00 0.00 C ATOM 366 C SER A 27 -10.246 0.990 7.589 1.00 0.00 C ATOM 367 O SER A 27 -9.696 2.042 7.264 1.00 0.00 O ATOM 368 CB SER A 27 -11.317 1.073 9.848 1.00 0.00 C ATOM 369 OG SER A 27 -11.321 2.488 9.769 1.00 0.00 O ATOM 0 H SER A 27 -8.675 1.807 9.645 1.00 0.00 H new ATOM 0 HA SER A 27 -10.271 -0.608 9.012 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.269 0.683 9.488 1.00 0.00 H new ATOM 0 HB3 SER A 27 -11.219 0.764 10.889 1.00 0.00 H new ATOM 0 HG SER A 27 -12.063 2.843 10.302 1.00 0.00 H new ATOM 375 N CYS A 28 -10.929 0.237 6.733 1.00 0.00 N ATOM 376 CA CYS A 28 -11.075 0.611 5.332 1.00 0.00 C ATOM 377 C CYS A 28 -12.171 1.659 5.160 1.00 0.00 C ATOM 378 O CYS A 28 -13.218 1.589 5.804 1.00 0.00 O ATOM 379 CB CYS A 28 -11.394 -0.621 4.484 1.00 0.00 C ATOM 380 SG CYS A 28 -11.447 -0.297 2.692 1.00 0.00 S ATOM 0 H CYS A 28 -11.390 -0.637 6.986 1.00 0.00 H new ATOM 0 HA CYS A 28 -10.131 1.040 4.996 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -10.646 -1.389 4.682 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -12.356 -1.026 4.798 1.00 0.00 H new ATOM 385 N LYS A 29 -11.923 2.629 4.287 1.00 0.00 N ATOM 386 CA LYS A 29 -12.888 3.690 4.027 1.00 0.00 C ATOM 387 C LYS A 29 -13.652 3.427 2.733 1.00 0.00 C ATOM 388 O LYS A 29 -14.087 4.359 2.057 1.00 0.00 O ATOM 389 CB LYS A 29 -12.179 5.044 3.947 1.00 0.00 C ATOM 390 CG LYS A 29 -11.358 5.375 5.181 1.00 0.00 C ATOM 391 CD LYS A 29 -12.195 6.083 6.234 1.00 0.00 C ATOM 392 CE LYS A 29 -12.124 7.594 6.079 1.00 0.00 C ATOM 393 NZ LYS A 29 -10.727 8.097 6.184 1.00 0.00 N ATOM 0 H LYS A 29 -11.061 2.702 3.747 1.00 0.00 H new ATOM 0 HA LYS A 29 -13.601 3.708 4.851 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.526 5.052 3.074 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -12.923 5.826 3.796 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -10.944 4.458 5.600 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -10.515 6.006 4.900 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -13.232 5.757 6.156 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -11.846 5.801 7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -12.541 7.880 5.114 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -12.739 8.067 6.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -10.675 9.060 5.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -10.437 8.110 7.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -10.092 7.473 5.647 1.00 0.00 H new ATOM 407 N LYS A 30 -13.813 2.152 2.396 1.00 0.00 N ATOM 408 CA LYS A 30 -14.527 1.765 1.185 1.00 0.00 C ATOM 409 C LYS A 30 -15.551 0.674 1.482 1.00 0.00 C ATOM 410 O LYS A 30 -16.730 0.809 1.154 1.00 0.00 O ATOM 411 CB LYS A 30 -13.541 1.279 0.120 1.00 0.00 C ATOM 412 CG LYS A 30 -14.213 0.663 -1.095 1.00 0.00 C ATOM 413 CD LYS A 30 -14.511 1.708 -2.157 1.00 0.00 C ATOM 414 CE LYS A 30 -15.656 1.275 -3.059 1.00 0.00 C ATOM 415 NZ LYS A 30 -15.766 2.137 -4.268 1.00 0.00 N ATOM 0 H LYS A 30 -13.458 1.369 2.945 1.00 0.00 H new ATOM 0 HA LYS A 30 -15.055 2.641 0.809 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -12.925 2.118 -0.203 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.871 0.544 0.566 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -13.570 -0.110 -1.515 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -15.140 0.177 -0.792 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -14.762 2.654 -1.678 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.619 1.882 -2.758 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -15.506 0.239 -3.364 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.592 1.311 -2.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.701 2.593 -4.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -15.025 2.866 -4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -15.649 1.554 -5.122 1.00 0.00 H new ATOM 429 N CYS A 31 -15.092 -0.407 2.105 1.00 0.00 N ATOM 430 CA CYS A 31 -15.968 -1.521 2.447 1.00 0.00 C ATOM 431 C CYS A 31 -16.370 -1.465 3.918 1.00 0.00 C ATOM 432 O CYS A 31 -17.152 -2.290 4.391 1.00 0.00 O ATOM 433 CB CYS A 31 -15.275 -2.852 2.147 1.00 0.00 C ATOM 434 SG CYS A 31 -13.792 -3.163 3.159 1.00 0.00 S ATOM 0 H CYS A 31 -14.119 -0.535 2.383 1.00 0.00 H new ATOM 0 HA CYS A 31 -16.869 -1.442 1.839 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -15.986 -3.663 2.305 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -14.994 -2.874 1.094 1.00 0.00 H new ATOM 439 N SER A 32 -15.830 -0.486 4.637 1.00 0.00 N ATOM 440 CA SER A 32 -16.129 -0.323 6.055 1.00 0.00 C ATOM 441 C SER A 32 -15.811 -1.600 6.827 1.00 0.00 C ATOM 442 O SER A 32 -16.641 -2.103 7.583 1.00 0.00 O ATOM 443 CB SER A 32 -17.600 0.050 6.247 1.00 0.00 C ATOM 444 OG SER A 32 -17.778 1.456 6.213 1.00 0.00 O ATOM 0 H SER A 32 -15.183 0.207 4.261 1.00 0.00 H new ATOM 0 HA SER A 32 -15.504 0.481 6.444 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.201 -0.415 5.466 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.957 -0.342 7.200 1.00 0.00 H new ATOM 0 HG SER A 32 -18.727 1.669 6.336 1.00 0.00 H new ATOM 450 N GLU A 33 -14.603 -2.119 6.629 1.00 0.00 N ATOM 451 CA GLU A 33 -14.176 -3.338 7.305 1.00 0.00 C ATOM 452 C GLU A 33 -12.840 -3.128 8.012 1.00 0.00 C ATOM 453 O GLU A 33 -12.193 -2.094 7.846 1.00 0.00 O ATOM 454 CB GLU A 33 -14.060 -4.490 6.305 1.00 0.00 C ATOM 455 CG GLU A 33 -15.388 -4.895 5.687 1.00 0.00 C ATOM 456 CD GLU A 33 -16.124 -5.931 6.513 1.00 0.00 C ATOM 457 OE1 GLU A 33 -15.493 -6.934 6.907 1.00 0.00 O ATOM 458 OE2 GLU A 33 -17.332 -5.739 6.767 1.00 0.00 O ATOM 0 H GLU A 33 -13.904 -1.714 6.006 1.00 0.00 H new ATOM 0 HA GLU A 33 -14.928 -3.590 8.052 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.372 -4.202 5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -13.624 -5.354 6.807 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -16.017 -4.012 5.575 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -15.213 -5.291 4.687 1.00 0.00 H new ATOM 465 N SER A 34 -12.433 -4.116 8.802 1.00 0.00 N ATOM 466 CA SER A 34 -11.177 -4.039 9.539 1.00 0.00 C ATOM 467 C SER A 34 -10.055 -4.732 8.772 1.00 0.00 C ATOM 468 O SER A 34 -10.014 -5.960 8.686 1.00 0.00 O ATOM 469 CB SER A 34 -11.332 -4.673 10.922 1.00 0.00 C ATOM 470 OG SER A 34 -12.479 -4.171 11.587 1.00 0.00 O ATOM 0 H SER A 34 -12.955 -4.980 8.948 1.00 0.00 H new ATOM 0 HA SER A 34 -10.918 -2.987 9.657 1.00 0.00 H new ATOM 0 HB2 SER A 34 -11.410 -5.756 10.823 1.00 0.00 H new ATOM 0 HB3 SER A 34 -10.443 -4.471 11.520 1.00 0.00 H new ATOM 0 HG SER A 34 -12.557 -4.593 12.468 1.00 0.00 H new ATOM 476 N ILE A 35 -9.146 -3.937 8.218 1.00 0.00 N ATOM 477 CA ILE A 35 -8.023 -4.473 7.459 1.00 0.00 C ATOM 478 C ILE A 35 -7.271 -5.528 8.263 1.00 0.00 C ATOM 479 O ILE A 35 -6.769 -5.270 9.358 1.00 0.00 O ATOM 480 CB ILE A 35 -7.040 -3.361 7.047 1.00 0.00 C ATOM 481 CG1 ILE A 35 -7.764 -2.288 6.231 1.00 0.00 C ATOM 482 CG2 ILE A 35 -5.882 -3.946 6.253 1.00 0.00 C ATOM 483 CD1 ILE A 35 -7.101 -0.930 6.297 1.00 0.00 C ATOM 0 H ILE A 35 -9.165 -2.919 8.281 1.00 0.00 H new ATOM 0 HA ILE A 35 -8.438 -4.931 6.561 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.639 -2.897 7.948 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -7.816 -2.608 5.190 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -8.790 -2.201 6.589 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -5.196 -3.148 5.969 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -5.354 -4.678 6.865 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.265 -4.432 5.356 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -7.668 -0.219 5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.073 -0.589 7.332 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.084 -1.002 5.911 1.00 0.00 H new ATOM 495 N PRO A 36 -7.188 -6.746 7.709 1.00 0.00 N ATOM 496 CA PRO A 36 -6.496 -7.865 8.356 1.00 0.00 C ATOM 497 C PRO A 36 -4.984 -7.670 8.390 1.00 0.00 C ATOM 498 O PRO A 36 -4.411 -7.025 7.512 1.00 0.00 O ATOM 499 CB PRO A 36 -6.861 -9.064 7.476 1.00 0.00 C ATOM 500 CG PRO A 36 -7.159 -8.477 6.140 1.00 0.00 C ATOM 501 CD PRO A 36 -7.762 -7.126 6.407 1.00 0.00 C ATOM 0 HA PRO A 36 -6.791 -7.979 9.399 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.040 -9.779 7.420 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -7.723 -9.599 7.874 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -6.252 -8.388 5.542 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -7.849 -9.109 5.581 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -7.501 -6.409 5.629 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.850 -7.173 6.446 1.00 0.00 H new ATOM 509 N LYS A 37 -4.343 -8.232 9.409 1.00 0.00 N ATOM 510 CA LYS A 37 -2.896 -8.122 9.557 1.00 0.00 C ATOM 511 C LYS A 37 -2.176 -8.952 8.499 1.00 0.00 C ATOM 512 O LYS A 37 -2.671 -9.995 8.071 1.00 0.00 O ATOM 513 CB LYS A 37 -2.470 -8.579 10.954 1.00 0.00 C ATOM 514 CG LYS A 37 -0.976 -8.463 11.203 1.00 0.00 C ATOM 515 CD LYS A 37 -0.573 -9.139 12.502 1.00 0.00 C ATOM 516 CE LYS A 37 -0.744 -8.207 13.692 1.00 0.00 C ATOM 517 NZ LYS A 37 -0.523 -8.913 14.985 1.00 0.00 N ATOM 0 H LYS A 37 -4.802 -8.768 10.145 1.00 0.00 H new ATOM 0 HA LYS A 37 -2.621 -7.076 9.423 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -3.001 -7.986 11.699 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -2.774 -9.616 11.096 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -0.432 -8.914 10.373 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -0.692 -7.411 11.236 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -1.177 -10.034 12.650 1.00 0.00 H new ATOM 0 HD3 LYS A 37 0.466 -9.462 12.438 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -0.043 -7.377 13.607 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -1.747 -7.780 13.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -0.649 -8.244 15.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.208 -9.690 15.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 0.443 -9.299 15.009 1.00 0.00 H new ATOM 531 N ASP A 38 -1.006 -8.482 8.081 1.00 0.00 N ATOM 532 CA ASP A 38 -0.216 -9.182 7.074 1.00 0.00 C ATOM 533 C ASP A 38 -0.964 -9.247 5.746 1.00 0.00 C ATOM 534 O ASP A 38 -0.962 -10.276 5.071 1.00 0.00 O ATOM 535 CB ASP A 38 0.122 -10.595 7.553 1.00 0.00 C ATOM 536 CG ASP A 38 0.892 -10.595 8.859 1.00 0.00 C ATOM 537 OD1 ASP A 38 1.895 -9.858 8.957 1.00 0.00 O ATOM 538 OD2 ASP A 38 0.490 -11.331 9.783 1.00 0.00 O ATOM 0 H ASP A 38 -0.583 -7.619 8.424 1.00 0.00 H new ATOM 0 HA ASP A 38 0.710 -8.627 6.922 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.800 -11.163 7.678 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.709 -11.104 6.788 1.00 0.00 H new ATOM 543 N SER A 39 -1.602 -8.141 5.378 1.00 0.00 N ATOM 544 CA SER A 39 -2.358 -8.073 4.133 1.00 0.00 C ATOM 545 C SER A 39 -1.880 -6.910 3.269 1.00 0.00 C ATOM 546 O SER A 39 -1.396 -5.900 3.780 1.00 0.00 O ATOM 547 CB SER A 39 -3.853 -7.924 4.426 1.00 0.00 C ATOM 548 OG SER A 39 -4.156 -6.615 4.874 1.00 0.00 O ATOM 0 H SER A 39 -1.611 -7.280 5.924 1.00 0.00 H new ATOM 0 HA SER A 39 -2.193 -9.001 3.586 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.427 -8.146 3.526 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.153 -8.649 5.182 1.00 0.00 H new ATOM 0 HG SER A 39 -4.105 -6.584 5.852 1.00 0.00 H new ATOM 554 N LEU A 40 -2.018 -7.061 1.956 1.00 0.00 N ATOM 555 CA LEU A 40 -1.601 -6.023 1.019 1.00 0.00 C ATOM 556 C LEU A 40 -2.636 -4.905 0.948 1.00 0.00 C ATOM 557 O LEU A 40 -3.718 -5.082 0.387 1.00 0.00 O ATOM 558 CB LEU A 40 -1.383 -6.623 -0.371 1.00 0.00 C ATOM 559 CG LEU A 40 -0.633 -5.743 -1.372 1.00 0.00 C ATOM 560 CD1 LEU A 40 0.801 -5.519 -0.915 1.00 0.00 C ATOM 561 CD2 LEU A 40 -0.661 -6.368 -2.759 1.00 0.00 C ATOM 0 H LEU A 40 -2.415 -7.891 1.516 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.662 -5.600 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.836 -7.559 -0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.356 -6.872 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.133 -4.776 -1.422 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.320 -4.891 -1.639 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.800 -5.027 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.312 -6.479 -0.836 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.122 -5.728 -3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.186 -7.349 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.694 -6.476 -3.089 1.00 0.00 H new ATOM 573 N ARG A 41 -2.295 -3.753 1.517 1.00 0.00 N ATOM 574 CA ARG A 41 -3.194 -2.606 1.516 1.00 0.00 C ATOM 575 C ARG A 41 -2.468 -1.346 1.052 1.00 0.00 C ATOM 576 O ARG A 41 -1.246 -1.250 1.153 1.00 0.00 O ATOM 577 CB ARG A 41 -3.776 -2.387 2.914 1.00 0.00 C ATOM 578 CG ARG A 41 -2.800 -1.746 3.886 1.00 0.00 C ATOM 579 CD ARG A 41 -3.414 -1.587 5.269 1.00 0.00 C ATOM 580 NE ARG A 41 -2.547 -0.831 6.169 1.00 0.00 N ATOM 581 CZ ARG A 41 -2.694 -0.815 7.489 1.00 0.00 C ATOM 582 NH1 ARG A 41 -3.668 -1.510 8.059 1.00 0.00 N ATOM 583 NH2 ARG A 41 -1.865 -0.102 8.241 1.00 0.00 N ATOM 0 H ARG A 41 -1.403 -3.590 1.984 1.00 0.00 H new ATOM 0 HA ARG A 41 -4.007 -2.813 0.820 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.663 -1.758 2.835 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.101 -3.346 3.318 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.899 -2.356 3.955 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.496 -0.770 3.507 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.376 -1.082 5.183 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.608 -2.571 5.695 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.787 -0.286 5.762 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.307 -2.059 7.484 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.779 -1.496 9.073 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -1.115 0.434 7.805 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.978 -0.090 9.255 1.00 0.00 H new ATOM 597 N MET A 42 -3.231 -0.384 0.544 1.00 0.00 N ATOM 598 CA MET A 42 -2.660 0.870 0.065 1.00 0.00 C ATOM 599 C MET A 42 -3.129 2.043 0.920 1.00 0.00 C ATOM 600 O MET A 42 -4.112 1.934 1.652 1.00 0.00 O ATOM 601 CB MET A 42 -3.043 1.104 -1.397 1.00 0.00 C ATOM 602 CG MET A 42 -2.549 0.016 -2.337 1.00 0.00 C ATOM 603 SD MET A 42 -2.985 0.333 -4.057 1.00 0.00 S ATOM 604 CE MET A 42 -1.472 1.081 -4.657 1.00 0.00 C ATOM 0 H MET A 42 -4.245 -0.448 0.453 1.00 0.00 H new ATOM 0 HA MET A 42 -1.575 0.799 0.142 1.00 0.00 H new ATOM 0 HB2 MET A 42 -4.128 1.173 -1.473 1.00 0.00 H new ATOM 0 HB3 MET A 42 -2.639 2.063 -1.721 1.00 0.00 H new ATOM 0 HG2 MET A 42 -1.466 -0.069 -2.251 1.00 0.00 H new ATOM 0 HG3 MET A 42 -2.969 -0.942 -2.030 1.00 0.00 H new ATOM 0 HE1 MET A 42 -1.509 1.156 -5.744 1.00 0.00 H new ATOM 0 HE2 MET A 42 -1.364 2.077 -4.228 1.00 0.00 H new ATOM 0 HE3 MET A 42 -0.621 0.466 -4.364 1.00 0.00 H new ATOM 614 N ALA A 43 -2.420 3.162 0.822 1.00 0.00 N ATOM 615 CA ALA A 43 -2.766 4.355 1.585 1.00 0.00 C ATOM 616 C ALA A 43 -2.845 5.581 0.682 1.00 0.00 C ATOM 617 O ALA A 43 -2.128 5.676 -0.315 1.00 0.00 O ATOM 618 CB ALA A 43 -1.754 4.581 2.698 1.00 0.00 C ATOM 0 H ALA A 43 -1.602 3.268 0.222 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.749 4.200 2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -2.025 5.475 3.260 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.750 3.720 3.366 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.761 4.710 2.267 1.00 0.00 H new ATOM 624 N ILE A 44 -3.720 6.516 1.036 1.00 0.00 N ATOM 625 CA ILE A 44 -3.891 7.736 0.256 1.00 0.00 C ATOM 626 C ILE A 44 -3.835 8.971 1.149 1.00 0.00 C ATOM 627 O ILE A 44 -4.271 8.938 2.299 1.00 0.00 O ATOM 628 CB ILE A 44 -5.227 7.731 -0.511 1.00 0.00 C ATOM 629 CG1 ILE A 44 -5.314 6.503 -1.419 1.00 0.00 C ATOM 630 CG2 ILE A 44 -5.376 9.009 -1.322 1.00 0.00 C ATOM 631 CD1 ILE A 44 -6.724 6.173 -1.856 1.00 0.00 C ATOM 0 H ILE A 44 -4.321 6.452 1.857 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.070 7.771 -0.460 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.043 7.684 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -4.698 6.670 -2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -4.894 5.644 -0.896 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -6.325 8.991 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -5.354 9.869 -0.653 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.556 9.084 -2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -6.709 5.292 -2.497 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -7.340 5.974 -0.979 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.141 7.016 -2.408 1.00 0.00 H new ATOM 643 N MET A 45 -3.297 10.060 0.610 1.00 0.00 N ATOM 644 CA MET A 45 -3.187 11.307 1.357 1.00 0.00 C ATOM 645 C MET A 45 -4.282 12.286 0.946 1.00 0.00 C ATOM 646 O MET A 45 -4.308 12.763 -0.189 1.00 0.00 O ATOM 647 CB MET A 45 -1.812 11.940 1.135 1.00 0.00 C ATOM 648 CG MET A 45 -0.691 11.236 1.882 1.00 0.00 C ATOM 649 SD MET A 45 -0.405 11.931 3.521 1.00 0.00 S ATOM 650 CE MET A 45 -1.663 11.083 4.472 1.00 0.00 C ATOM 0 H MET A 45 -2.931 10.104 -0.341 1.00 0.00 H new ATOM 0 HA MET A 45 -3.307 11.078 2.416 1.00 0.00 H new ATOM 0 HB2 MET A 45 -1.586 11.934 0.069 1.00 0.00 H new ATOM 0 HB3 MET A 45 -1.847 12.984 1.448 1.00 0.00 H new ATOM 0 HG2 MET A 45 -0.932 10.177 1.978 1.00 0.00 H new ATOM 0 HG3 MET A 45 0.227 11.302 1.298 1.00 0.00 H new ATOM 0 HE1 MET A 45 -1.315 10.947 5.496 1.00 0.00 H new ATOM 0 HE2 MET A 45 -2.578 11.676 4.475 1.00 0.00 H new ATOM 0 HE3 MET A 45 -1.863 10.109 4.024 1.00 0.00 H new ATOM 660 N VAL A 46 -5.186 12.580 1.875 1.00 0.00 N ATOM 661 CA VAL A 46 -6.283 13.502 1.609 1.00 0.00 C ATOM 662 C VAL A 46 -6.413 14.538 2.720 1.00 0.00 C ATOM 663 O VAL A 46 -5.731 14.455 3.741 1.00 0.00 O ATOM 664 CB VAL A 46 -7.622 12.755 1.461 1.00 0.00 C ATOM 665 CG1 VAL A 46 -7.650 11.961 0.164 1.00 0.00 C ATOM 666 CG2 VAL A 46 -7.858 11.845 2.657 1.00 0.00 C ATOM 0 H VAL A 46 -5.180 12.193 2.819 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.051 14.006 0.671 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.427 13.490 1.427 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -8.603 11.440 0.077 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.529 12.639 -0.681 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.838 11.234 0.165 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.808 11.325 2.536 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.051 11.116 2.724 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.884 12.442 3.569 1.00 0.00 H new ATOM 676 N GLN A 47 -7.292 15.513 2.514 1.00 0.00 N ATOM 677 CA GLN A 47 -7.511 16.565 3.499 1.00 0.00 C ATOM 678 C GLN A 47 -8.582 16.156 4.505 1.00 0.00 C ATOM 679 O GLN A 47 -9.603 15.576 4.137 1.00 0.00 O ATOM 680 CB GLN A 47 -7.917 17.867 2.805 1.00 0.00 C ATOM 681 CG GLN A 47 -6.738 18.755 2.440 1.00 0.00 C ATOM 682 CD GLN A 47 -6.314 19.659 3.581 1.00 0.00 C ATOM 683 OE1 GLN A 47 -5.178 19.594 4.052 1.00 0.00 O ATOM 684 NE2 GLN A 47 -7.228 20.511 4.032 1.00 0.00 N ATOM 0 H GLN A 47 -7.864 15.596 1.674 1.00 0.00 H new ATOM 0 HA GLN A 47 -6.576 16.724 4.036 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -8.475 17.628 1.900 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -8.591 18.422 3.458 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -5.895 18.130 2.144 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -7.001 19.365 1.576 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -8.157 20.531 3.612 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -7.000 21.145 4.798 1.00 0.00 H new ATOM 693 N SER A 48 -8.340 16.461 5.776 1.00 0.00 N ATOM 694 CA SER A 48 -9.283 16.121 6.835 1.00 0.00 C ATOM 695 C SER A 48 -10.156 17.320 7.191 1.00 0.00 C ATOM 696 O SER A 48 -9.668 18.418 7.459 1.00 0.00 O ATOM 697 CB SER A 48 -8.533 15.636 8.077 1.00 0.00 C ATOM 698 OG SER A 48 -9.316 14.718 8.821 1.00 0.00 O ATOM 0 H SER A 48 -7.500 16.942 6.097 1.00 0.00 H new ATOM 0 HA SER A 48 -9.927 15.320 6.471 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.598 15.162 7.779 1.00 0.00 H new ATOM 0 HB3 SER A 48 -8.273 16.489 8.704 1.00 0.00 H new ATOM 0 HG SER A 48 -9.082 14.783 9.770 1.00 0.00 H new ATOM 704 N PRO A 49 -11.480 17.107 7.194 1.00 0.00 N ATOM 705 CA PRO A 49 -12.451 18.157 7.515 1.00 0.00 C ATOM 706 C PRO A 49 -12.413 18.551 8.988 1.00 0.00 C ATOM 707 O PRO A 49 -13.155 19.430 9.424 1.00 0.00 O ATOM 708 CB PRO A 49 -13.796 17.515 7.168 1.00 0.00 C ATOM 709 CG PRO A 49 -13.561 16.049 7.295 1.00 0.00 C ATOM 710 CD PRO A 49 -12.132 15.823 6.884 1.00 0.00 C ATOM 0 HA PRO A 49 -12.250 19.079 6.969 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -14.581 17.850 7.846 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -14.112 17.779 6.159 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.731 15.713 8.318 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -14.244 15.487 6.658 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -11.680 14.999 7.437 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -12.053 15.577 5.825 1.00 0.00 H new ATOM 718 N MET A 50 -11.542 17.895 9.748 1.00 0.00 N ATOM 719 CA MET A 50 -11.407 18.179 11.172 1.00 0.00 C ATOM 720 C MET A 50 -10.333 19.235 11.416 1.00 0.00 C ATOM 721 O MET A 50 -10.561 20.213 12.129 1.00 0.00 O ATOM 722 CB MET A 50 -11.065 16.900 11.939 1.00 0.00 C ATOM 723 CG MET A 50 -12.252 15.970 12.129 1.00 0.00 C ATOM 724 SD MET A 50 -11.763 14.323 12.677 1.00 0.00 S ATOM 725 CE MET A 50 -12.604 14.227 14.255 1.00 0.00 C ATOM 0 H MET A 50 -10.920 17.164 9.402 1.00 0.00 H new ATOM 0 HA MET A 50 -12.360 18.566 11.532 1.00 0.00 H new ATOM 0 HB2 MET A 50 -10.277 16.367 11.407 1.00 0.00 H new ATOM 0 HB3 MET A 50 -10.664 17.168 12.916 1.00 0.00 H new ATOM 0 HG2 MET A 50 -12.935 16.404 12.859 1.00 0.00 H new ATOM 0 HG3 MET A 50 -12.799 15.889 11.190 1.00 0.00 H new ATOM 0 HE1 MET A 50 -12.398 13.262 14.719 1.00 0.00 H new ATOM 0 HE2 MET A 50 -12.249 15.026 14.906 1.00 0.00 H new ATOM 0 HE3 MET A 50 -13.678 14.334 14.102 1.00 0.00 H new ATOM 735 N PHE A 51 -9.163 19.030 10.821 1.00 0.00 N ATOM 736 CA PHE A 51 -8.053 19.964 10.976 1.00 0.00 C ATOM 737 C PHE A 51 -7.506 20.387 9.616 1.00 0.00 C ATOM 738 O PHE A 51 -7.816 19.778 8.592 1.00 0.00 O ATOM 739 CB PHE A 51 -6.939 19.332 11.812 1.00 0.00 C ATOM 740 CG PHE A 51 -6.343 18.104 11.186 1.00 0.00 C ATOM 741 CD1 PHE A 51 -7.100 16.955 11.025 1.00 0.00 C ATOM 742 CD2 PHE A 51 -5.024 18.099 10.760 1.00 0.00 C ATOM 743 CE1 PHE A 51 -6.554 15.823 10.448 1.00 0.00 C ATOM 744 CE2 PHE A 51 -4.473 16.970 10.183 1.00 0.00 C ATOM 745 CZ PHE A 51 -5.238 15.831 10.028 1.00 0.00 C ATOM 0 H PHE A 51 -8.958 18.226 10.227 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.425 20.850 11.491 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -6.151 20.069 11.969 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -7.335 19.074 12.794 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -8.129 16.943 11.354 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.420 18.986 10.880 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.155 14.934 10.326 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.445 16.979 9.854 1.00 0.00 H new ATOM 0 HZ PHE A 51 -4.808 14.948 9.579 1.00 0.00 H new ATOM 755 N ASP A 52 -6.689 21.436 9.614 1.00 0.00 N ATOM 756 CA ASP A 52 -6.097 21.941 8.381 1.00 0.00 C ATOM 757 C ASP A 52 -4.921 21.072 7.947 1.00 0.00 C ATOM 758 O ASP A 52 -3.858 21.581 7.592 1.00 0.00 O ATOM 759 CB ASP A 52 -5.638 23.388 8.566 1.00 0.00 C ATOM 760 CG ASP A 52 -6.656 24.227 9.313 1.00 0.00 C ATOM 761 OD1 ASP A 52 -7.793 24.361 8.816 1.00 0.00 O ATOM 762 OD2 ASP A 52 -6.314 24.751 10.395 1.00 0.00 O ATOM 0 H ASP A 52 -6.422 21.952 10.452 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.858 21.907 7.601 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -4.693 23.400 9.109 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.450 23.834 7.589 1.00 0.00 H new ATOM 767 N GLY A 53 -5.118 19.758 7.979 1.00 0.00 N ATOM 768 CA GLY A 53 -4.065 18.840 7.588 1.00 0.00 C ATOM 769 C GLY A 53 -4.574 17.712 6.713 1.00 0.00 C ATOM 770 O GLY A 53 -5.623 17.832 6.079 1.00 0.00 O ATOM 0 H GLY A 53 -5.989 19.313 8.269 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -3.289 19.388 7.054 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -3.602 18.422 8.482 1.00 0.00 H new ATOM 774 N LYS A 54 -3.829 16.612 6.674 1.00 0.00 N ATOM 775 CA LYS A 54 -4.210 15.457 5.870 1.00 0.00 C ATOM 776 C LYS A 54 -4.132 14.174 6.690 1.00 0.00 C ATOM 777 O LYS A 54 -3.258 14.022 7.544 1.00 0.00 O ATOM 778 CB LYS A 54 -3.305 15.346 4.641 1.00 0.00 C ATOM 779 CG LYS A 54 -3.604 16.379 3.569 1.00 0.00 C ATOM 780 CD LYS A 54 -2.993 15.990 2.233 1.00 0.00 C ATOM 781 CE LYS A 54 -3.290 17.028 1.161 1.00 0.00 C ATOM 782 NZ LYS A 54 -3.043 16.497 -0.208 1.00 0.00 N ATOM 0 H LYS A 54 -2.957 16.496 7.191 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.241 15.596 5.544 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -2.266 15.451 4.955 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -3.410 14.349 4.212 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -4.683 16.488 3.459 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -3.216 17.349 3.879 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -1.914 15.878 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.384 15.021 1.921 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -4.328 17.349 1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -2.670 17.909 1.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -3.257 17.234 -0.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.046 16.214 -0.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -3.653 15.672 -0.376 1.00 0.00 H new ATOM 796 N VAL A 55 -5.051 13.250 6.424 1.00 0.00 N ATOM 797 CA VAL A 55 -5.085 11.978 7.135 1.00 0.00 C ATOM 798 C VAL A 55 -4.881 10.808 6.179 1.00 0.00 C ATOM 799 O VAL A 55 -5.400 10.789 5.063 1.00 0.00 O ATOM 800 CB VAL A 55 -6.417 11.789 7.884 1.00 0.00 C ATOM 801 CG1 VAL A 55 -6.565 12.831 8.983 1.00 0.00 C ATOM 802 CG2 VAL A 55 -7.587 11.856 6.914 1.00 0.00 C ATOM 0 H VAL A 55 -5.782 13.359 5.721 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.270 11.998 7.858 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.415 10.803 8.349 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.512 12.681 9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.744 12.731 9.692 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -6.545 13.828 8.544 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.521 11.720 7.460 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.594 12.827 6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -7.486 11.069 6.167 1.00 0.00 H new ATOM 812 N PRO A 56 -4.108 9.807 6.626 1.00 0.00 N ATOM 813 CA PRO A 56 -3.819 8.613 5.826 1.00 0.00 C ATOM 814 C PRO A 56 -5.043 7.721 5.652 1.00 0.00 C ATOM 815 O PRO A 56 -5.579 7.188 6.624 1.00 0.00 O ATOM 816 CB PRO A 56 -2.743 7.892 6.642 1.00 0.00 C ATOM 817 CG PRO A 56 -2.962 8.347 8.043 1.00 0.00 C ATOM 818 CD PRO A 56 -3.458 9.763 7.946 1.00 0.00 C ATOM 0 HA PRO A 56 -3.507 8.867 4.813 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.841 6.810 6.557 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -1.743 8.150 6.294 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -3.689 7.713 8.550 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -2.038 8.296 8.619 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -4.159 9.999 8.747 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.641 10.481 8.016 1.00 0.00 H new ATOM 826 N HIS A 57 -5.482 7.562 4.407 1.00 0.00 N ATOM 827 CA HIS A 57 -6.643 6.733 4.106 1.00 0.00 C ATOM 828 C HIS A 57 -6.213 5.359 3.600 1.00 0.00 C ATOM 829 O HIS A 57 -5.659 5.235 2.508 1.00 0.00 O ATOM 830 CB HIS A 57 -7.529 7.418 3.065 1.00 0.00 C ATOM 831 CG HIS A 57 -8.402 8.493 3.636 1.00 0.00 C ATOM 832 ND1 HIS A 57 -9.465 9.043 2.950 1.00 0.00 N ATOM 833 CD2 HIS A 57 -8.367 9.117 4.836 1.00 0.00 C ATOM 834 CE1 HIS A 57 -10.044 9.961 3.703 1.00 0.00 C ATOM 835 NE2 HIS A 57 -9.398 10.025 4.853 1.00 0.00 N ATOM 0 H HIS A 57 -5.051 7.996 3.591 1.00 0.00 H new ATOM 0 HA HIS A 57 -7.212 6.600 5.026 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -6.897 7.849 2.289 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -8.157 6.668 2.585 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -7.660 8.935 5.632 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -10.900 10.558 3.425 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -9.627 10.647 5.628 1.00 0.00 H new ATOM 843 N TRP A 58 -6.473 4.332 4.401 1.00 0.00 N ATOM 844 CA TRP A 58 -6.112 2.967 4.034 1.00 0.00 C ATOM 845 C TRP A 58 -7.208 2.320 3.195 1.00 0.00 C ATOM 846 O TRP A 58 -8.396 2.505 3.462 1.00 0.00 O ATOM 847 CB TRP A 58 -5.853 2.132 5.289 1.00 0.00 C ATOM 848 CG TRP A 58 -4.775 2.695 6.166 1.00 0.00 C ATOM 849 CD1 TRP A 58 -4.944 3.376 7.337 1.00 0.00 C ATOM 850 CD2 TRP A 58 -3.363 2.626 5.939 1.00 0.00 C ATOM 851 NE1 TRP A 58 -3.722 3.735 7.852 1.00 0.00 N ATOM 852 CE2 TRP A 58 -2.736 3.286 7.014 1.00 0.00 C ATOM 853 CE3 TRP A 58 -2.567 2.070 4.934 1.00 0.00 C ATOM 854 CZ2 TRP A 58 -1.352 3.405 7.109 1.00 0.00 C ATOM 855 CZ3 TRP A 58 -1.194 2.189 5.030 1.00 0.00 C ATOM 856 CH2 TRP A 58 -0.597 2.851 6.111 1.00 0.00 C ATOM 0 H TRP A 58 -6.932 4.418 5.308 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.201 3.007 3.437 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.776 2.057 5.863 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -5.579 1.120 4.993 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -5.898 3.600 7.792 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -3.573 4.252 8.718 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -3.017 1.556 4.097 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.891 3.916 7.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -0.570 1.764 4.258 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.479 2.925 6.158 1.00 0.00 H new ATOM 867 N TYR A 59 -6.803 1.563 2.182 1.00 0.00 N ATOM 868 CA TYR A 59 -7.753 0.891 1.303 1.00 0.00 C ATOM 869 C TYR A 59 -7.227 -0.476 0.877 1.00 0.00 C ATOM 870 O TYR A 59 -6.048 -0.628 0.554 1.00 0.00 O ATOM 871 CB TYR A 59 -8.033 1.750 0.069 1.00 0.00 C ATOM 872 CG TYR A 59 -8.848 2.988 0.366 1.00 0.00 C ATOM 873 CD1 TYR A 59 -10.204 2.900 0.652 1.00 0.00 C ATOM 874 CD2 TYR A 59 -8.260 4.247 0.361 1.00 0.00 C ATOM 875 CE1 TYR A 59 -10.952 4.029 0.922 1.00 0.00 C ATOM 876 CE2 TYR A 59 -9.000 5.382 0.632 1.00 0.00 C ATOM 877 CZ TYR A 59 -10.346 5.268 0.912 1.00 0.00 C ATOM 878 OH TYR A 59 -11.087 6.395 1.182 1.00 0.00 O ATOM 0 H TYR A 59 -5.824 1.399 1.949 1.00 0.00 H new ATOM 0 HA TYR A 59 -8.682 0.747 1.855 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -7.085 2.048 -0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -8.560 1.147 -0.671 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.682 1.932 0.663 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.207 4.340 0.142 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.006 3.942 1.140 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -8.527 6.353 0.625 1.00 0.00 H new ATOM 0 HH TYR A 59 -10.509 7.185 1.135 1.00 0.00 H new ATOM 888 N HIS A 60 -8.110 -1.470 0.878 1.00 0.00 N ATOM 889 CA HIS A 60 -7.736 -2.825 0.490 1.00 0.00 C ATOM 890 C HIS A 60 -7.182 -2.850 -0.932 1.00 0.00 C ATOM 891 O HIS A 60 -7.566 -2.037 -1.773 1.00 0.00 O ATOM 892 CB HIS A 60 -8.942 -3.759 0.596 1.00 0.00 C ATOM 893 CG HIS A 60 -9.271 -4.155 2.003 1.00 0.00 C ATOM 894 ND1 HIS A 60 -10.362 -3.661 2.687 1.00 0.00 N ATOM 895 CD2 HIS A 60 -8.647 -5.003 2.853 1.00 0.00 C ATOM 896 CE1 HIS A 60 -10.393 -4.187 3.899 1.00 0.00 C ATOM 897 NE2 HIS A 60 -9.364 -5.006 4.024 1.00 0.00 N ATOM 0 H HIS A 60 -9.089 -1.362 1.143 1.00 0.00 H new ATOM 0 HA HIS A 60 -6.957 -3.170 1.170 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -9.810 -3.271 0.152 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -8.748 -4.658 0.010 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -7.752 -5.572 2.648 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -11.133 -3.982 4.658 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -9.139 -5.552 4.856 1.00 0.00 H new ATOM 905 N PHE A 61 -6.278 -3.788 -1.193 1.00 0.00 N ATOM 906 CA PHE A 61 -5.669 -3.918 -2.511 1.00 0.00 C ATOM 907 C PHE A 61 -6.718 -3.772 -3.611 1.00 0.00 C ATOM 908 O PHE A 61 -6.438 -3.238 -4.684 1.00 0.00 O ATOM 909 CB PHE A 61 -4.964 -5.269 -2.640 1.00 0.00 C ATOM 910 CG PHE A 61 -4.122 -5.390 -3.879 1.00 0.00 C ATOM 911 CD1 PHE A 61 -3.128 -4.464 -4.150 1.00 0.00 C ATOM 912 CD2 PHE A 61 -4.326 -6.430 -4.771 1.00 0.00 C ATOM 913 CE1 PHE A 61 -2.352 -4.573 -5.288 1.00 0.00 C ATOM 914 CE2 PHE A 61 -3.552 -6.545 -5.911 1.00 0.00 C ATOM 915 CZ PHE A 61 -2.565 -5.614 -6.171 1.00 0.00 C ATOM 0 H PHE A 61 -5.951 -4.470 -0.509 1.00 0.00 H new ATOM 0 HA PHE A 61 -4.934 -3.121 -2.624 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.333 -5.426 -1.765 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.712 -6.062 -2.640 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.958 -3.648 -3.464 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -5.098 -7.159 -4.574 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.580 -3.845 -5.487 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.719 -7.362 -6.598 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.961 -5.700 -7.062 1.00 0.00 H new ATOM 925 N SER A 62 -7.926 -4.253 -3.335 1.00 0.00 N ATOM 926 CA SER A 62 -9.016 -4.180 -4.301 1.00 0.00 C ATOM 927 C SER A 62 -9.813 -2.891 -4.126 1.00 0.00 C ATOM 928 O SER A 62 -10.044 -2.155 -5.085 1.00 0.00 O ATOM 929 CB SER A 62 -9.941 -5.390 -4.150 1.00 0.00 C ATOM 930 OG SER A 62 -10.641 -5.650 -5.354 1.00 0.00 O ATOM 0 H SER A 62 -8.175 -4.697 -2.451 1.00 0.00 H new ATOM 0 HA SER A 62 -8.583 -4.185 -5.301 1.00 0.00 H new ATOM 0 HB2 SER A 62 -9.356 -6.266 -3.869 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.652 -5.210 -3.344 1.00 0.00 H new ATOM 0 HG SER A 62 -11.224 -6.428 -5.232 1.00 0.00 H new ATOM 936 N CYS A 63 -10.231 -2.625 -2.893 1.00 0.00 N ATOM 937 CA CYS A 63 -11.003 -1.426 -2.589 1.00 0.00 C ATOM 938 C CYS A 63 -10.357 -0.191 -3.210 1.00 0.00 C ATOM 939 O CYS A 63 -11.028 0.620 -3.849 1.00 0.00 O ATOM 940 CB CYS A 63 -11.127 -1.244 -1.075 1.00 0.00 C ATOM 941 SG CYS A 63 -12.232 -2.447 -0.269 1.00 0.00 S ATOM 0 H CYS A 63 -10.048 -3.224 -2.088 1.00 0.00 H new ATOM 0 HA CYS A 63 -11.998 -1.547 -3.016 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -10.136 -1.321 -0.628 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -11.492 -0.238 -0.870 1.00 0.00 H new ATOM 946 N PHE A 64 -9.049 -0.055 -3.018 1.00 0.00 N ATOM 947 CA PHE A 64 -8.311 1.081 -3.558 1.00 0.00 C ATOM 948 C PHE A 64 -8.639 1.291 -5.033 1.00 0.00 C ATOM 949 O PHE A 64 -8.621 2.417 -5.530 1.00 0.00 O ATOM 950 CB PHE A 64 -6.806 0.867 -3.385 1.00 0.00 C ATOM 951 CG PHE A 64 -5.977 2.025 -3.862 1.00 0.00 C ATOM 952 CD1 PHE A 64 -5.746 2.218 -5.214 1.00 0.00 C ATOM 953 CD2 PHE A 64 -5.429 2.921 -2.958 1.00 0.00 C ATOM 954 CE1 PHE A 64 -4.983 3.283 -5.656 1.00 0.00 C ATOM 955 CE2 PHE A 64 -4.666 3.988 -3.394 1.00 0.00 C ATOM 956 CZ PHE A 64 -4.443 4.169 -4.745 1.00 0.00 C ATOM 0 H PHE A 64 -8.478 -0.717 -2.493 1.00 0.00 H new ATOM 0 HA PHE A 64 -8.611 1.972 -3.006 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -6.592 0.687 -2.332 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -6.510 -0.030 -3.929 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -6.167 1.529 -5.931 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -5.600 2.784 -1.900 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.810 3.422 -6.713 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.245 4.679 -2.679 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.847 5.002 -5.088 1.00 0.00 H new ATOM 966 N TRP A 65 -8.939 0.199 -5.728 1.00 0.00 N ATOM 967 CA TRP A 65 -9.271 0.263 -7.146 1.00 0.00 C ATOM 968 C TRP A 65 -10.765 0.493 -7.346 1.00 0.00 C ATOM 969 O TRP A 65 -11.186 1.073 -8.347 1.00 0.00 O ATOM 970 CB TRP A 65 -8.842 -1.025 -7.850 1.00 0.00 C ATOM 971 CG TRP A 65 -7.388 -1.344 -7.673 1.00 0.00 C ATOM 972 CD1 TRP A 65 -6.859 -2.462 -7.095 1.00 0.00 C ATOM 973 CD2 TRP A 65 -6.279 -0.533 -8.074 1.00 0.00 C ATOM 974 NE1 TRP A 65 -5.487 -2.396 -7.113 1.00 0.00 N ATOM 975 CE2 TRP A 65 -5.106 -1.223 -7.709 1.00 0.00 C ATOM 976 CE3 TRP A 65 -6.161 0.707 -8.708 1.00 0.00 C ATOM 977 CZ2 TRP A 65 -3.834 -0.712 -7.957 1.00 0.00 C ATOM 978 CZ3 TRP A 65 -4.899 1.213 -8.953 1.00 0.00 C ATOM 979 CH2 TRP A 65 -3.749 0.504 -8.579 1.00 0.00 C ATOM 0 H TRP A 65 -8.959 -0.741 -5.332 1.00 0.00 H new ATOM 0 HA TRP A 65 -8.732 1.104 -7.582 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -9.437 -1.854 -7.469 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -9.061 -0.939 -8.914 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -7.435 -3.278 -6.684 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -4.855 -3.105 -6.743 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -7.041 1.260 -9.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -2.947 -1.256 -7.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -4.797 2.171 -9.441 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -2.777 0.926 -8.786 1.00 0.00 H new ATOM 990 N LYS A 66 -11.563 0.035 -6.388 1.00 0.00 N ATOM 991 CA LYS A 66 -13.011 0.191 -6.457 1.00 0.00 C ATOM 992 C LYS A 66 -13.393 1.662 -6.592 1.00 0.00 C ATOM 993 O LYS A 66 -14.165 2.035 -7.475 1.00 0.00 O ATOM 994 CB LYS A 66 -13.669 -0.405 -5.211 1.00 0.00 C ATOM 995 CG LYS A 66 -13.399 -1.889 -5.031 1.00 0.00 C ATOM 996 CD LYS A 66 -14.238 -2.728 -5.980 1.00 0.00 C ATOM 997 CE LYS A 66 -13.754 -4.169 -6.026 1.00 0.00 C ATOM 998 NZ LYS A 66 -14.219 -4.947 -4.844 1.00 0.00 N ATOM 0 H LYS A 66 -11.231 -0.448 -5.553 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.367 -0.342 -7.338 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -13.312 0.130 -4.331 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -14.746 -0.244 -5.267 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -12.342 -2.091 -5.203 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -13.615 -2.177 -4.002 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -15.281 -2.703 -5.664 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -14.198 -2.297 -6.981 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -14.114 -4.644 -6.938 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -12.665 -4.185 -6.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.869 -5.924 -4.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -13.855 -4.508 -3.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -15.259 -4.953 -4.819 1.00 0.00 H new ATOM 1012 N VAL A 67 -12.847 2.494 -5.711 1.00 0.00 N ATOM 1013 CA VAL A 67 -13.128 3.924 -5.734 1.00 0.00 C ATOM 1014 C VAL A 67 -12.807 4.526 -7.097 1.00 0.00 C ATOM 1015 O VAL A 67 -13.533 5.387 -7.594 1.00 0.00 O ATOM 1016 CB VAL A 67 -12.325 4.672 -4.653 1.00 0.00 C ATOM 1017 CG1 VAL A 67 -12.866 4.351 -3.268 1.00 0.00 C ATOM 1018 CG2 VAL A 67 -10.848 4.324 -4.751 1.00 0.00 C ATOM 0 H VAL A 67 -12.207 2.202 -4.972 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.193 4.040 -5.531 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.434 5.744 -4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -12.286 4.888 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.911 4.655 -3.206 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -12.789 3.279 -3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.296 4.861 -3.980 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -10.717 3.251 -4.610 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -10.471 4.610 -5.733 1.00 0.00 H new ATOM 1028 N GLY A 68 -11.715 4.066 -7.699 1.00 0.00 N ATOM 1029 CA GLY A 68 -11.316 4.570 -9.000 1.00 0.00 C ATOM 1030 C GLY A 68 -10.074 5.435 -8.931 1.00 0.00 C ATOM 1031 O GLY A 68 -10.032 6.522 -9.509 1.00 0.00 O ATOM 0 H GLY A 68 -11.099 3.353 -7.309 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -11.133 3.731 -9.671 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -12.134 5.148 -9.429 1.00 0.00 H new ATOM 1035 N HIS A 69 -9.058 4.954 -8.222 1.00 0.00 N ATOM 1036 CA HIS A 69 -7.808 5.692 -8.078 1.00 0.00 C ATOM 1037 C HIS A 69 -6.721 5.099 -8.970 1.00 0.00 C ATOM 1038 O HIS A 69 -5.905 4.296 -8.520 1.00 0.00 O ATOM 1039 CB HIS A 69 -7.349 5.681 -6.620 1.00 0.00 C ATOM 1040 CG HIS A 69 -7.929 6.794 -5.801 1.00 0.00 C ATOM 1041 ND1 HIS A 69 -7.172 7.583 -4.961 1.00 0.00 N ATOM 1042 CD2 HIS A 69 -9.199 7.248 -5.699 1.00 0.00 C ATOM 1043 CE1 HIS A 69 -7.953 8.474 -4.376 1.00 0.00 C ATOM 1044 NE2 HIS A 69 -9.188 8.292 -4.807 1.00 0.00 N ATOM 0 H HIS A 69 -9.076 4.056 -7.738 1.00 0.00 H new ATOM 0 HA HIS A 69 -7.986 6.722 -8.387 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -7.623 4.728 -6.168 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -6.261 5.747 -6.589 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -10.061 6.861 -6.222 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -7.635 9.223 -3.666 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -10.001 8.838 -4.523 1.00 0.00 H new ATOM 1052 N SER A 70 -6.719 5.499 -10.238 1.00 0.00 N ATOM 1053 CA SER A 70 -5.736 5.004 -11.194 1.00 0.00 C ATOM 1054 C SER A 70 -4.327 5.434 -10.797 1.00 0.00 C ATOM 1055 O SER A 70 -4.137 6.489 -10.190 1.00 0.00 O ATOM 1056 CB SER A 70 -6.060 5.512 -12.600 1.00 0.00 C ATOM 1057 OG SER A 70 -5.863 6.912 -12.694 1.00 0.00 O ATOM 0 H SER A 70 -7.387 6.164 -10.627 1.00 0.00 H new ATOM 0 HA SER A 70 -5.779 3.915 -11.190 1.00 0.00 H new ATOM 0 HB2 SER A 70 -5.429 5.003 -13.328 1.00 0.00 H new ATOM 0 HB3 SER A 70 -7.093 5.269 -12.849 1.00 0.00 H new ATOM 0 HG SER A 70 -6.075 7.212 -13.603 1.00 0.00 H new ATOM 1063 N ILE A 71 -3.344 4.611 -11.145 1.00 0.00 N ATOM 1064 CA ILE A 71 -1.952 4.907 -10.827 1.00 0.00 C ATOM 1065 C ILE A 71 -1.037 4.574 -12.000 1.00 0.00 C ATOM 1066 O ILE A 71 -0.940 3.419 -12.416 1.00 0.00 O ATOM 1067 CB ILE A 71 -1.481 4.126 -9.585 1.00 0.00 C ATOM 1068 CG1 ILE A 71 -2.354 4.472 -8.377 1.00 0.00 C ATOM 1069 CG2 ILE A 71 -0.019 4.429 -9.293 1.00 0.00 C ATOM 1070 CD1 ILE A 71 -2.374 3.392 -7.318 1.00 0.00 C ATOM 0 H ILE A 71 -3.485 3.734 -11.647 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.896 5.975 -10.618 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.578 3.059 -9.786 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.994 5.399 -7.932 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -3.373 4.656 -8.716 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.300 3.870 -8.413 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.591 4.138 -10.148 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.101 5.496 -9.108 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.012 3.705 -6.491 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.763 2.469 -7.747 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -1.362 3.223 -6.951 1.00 0.00 H new ATOM 1082 N ARG A 72 -0.367 5.592 -12.528 1.00 0.00 N ATOM 1083 CA ARG A 72 0.541 5.408 -13.654 1.00 0.00 C ATOM 1084 C ARG A 72 1.733 4.543 -13.254 1.00 0.00 C ATOM 1085 O ARG A 72 1.905 3.433 -13.759 1.00 0.00 O ATOM 1086 CB ARG A 72 1.031 6.763 -14.169 1.00 0.00 C ATOM 1087 CG ARG A 72 -0.004 7.510 -14.994 1.00 0.00 C ATOM 1088 CD ARG A 72 -0.920 8.346 -14.114 1.00 0.00 C ATOM 1089 NE ARG A 72 -0.210 9.453 -13.479 1.00 0.00 N ATOM 1090 CZ ARG A 72 0.038 10.610 -14.083 1.00 0.00 C ATOM 1091 NH1 ARG A 72 -0.365 10.811 -15.329 1.00 0.00 N ATOM 1092 NH2 ARG A 72 0.691 11.569 -13.438 1.00 0.00 N ATOM 0 H ARG A 72 -0.435 6.553 -12.194 1.00 0.00 H new ATOM 0 HA ARG A 72 -0.005 4.901 -14.450 1.00 0.00 H new ATOM 0 HB2 ARG A 72 1.322 7.381 -13.320 1.00 0.00 H new ATOM 0 HB3 ARG A 72 1.925 6.611 -14.774 1.00 0.00 H new ATOM 0 HG2 ARG A 72 0.500 8.155 -15.714 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -0.598 6.797 -15.566 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -1.740 8.739 -14.715 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -1.363 7.712 -13.346 1.00 0.00 H new ATOM 0 HE ARG A 72 0.113 9.331 -12.519 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.867 10.076 -15.827 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.173 11.700 -15.790 1.00 0.00 H new ATOM 0 HH21 ARG A 72 1.002 11.418 -12.479 1.00 0.00 H new ATOM 0 HH22 ARG A 72 0.881 12.457 -13.902 1.00 0.00 H new ATOM 1106 N HIS A 73 2.554 5.059 -12.345 1.00 0.00 N ATOM 1107 CA HIS A 73 3.730 4.334 -11.878 1.00 0.00 C ATOM 1108 C HIS A 73 3.725 4.212 -10.357 1.00 0.00 C ATOM 1109 O HIS A 73 4.246 5.067 -9.640 1.00 0.00 O ATOM 1110 CB HIS A 73 5.006 5.037 -12.341 1.00 0.00 C ATOM 1111 CG HIS A 73 5.163 5.076 -13.830 1.00 0.00 C ATOM 1112 ND1 HIS A 73 5.135 3.946 -14.619 1.00 0.00 N ATOM 1113 CD2 HIS A 73 5.347 6.118 -14.673 1.00 0.00 C ATOM 1114 CE1 HIS A 73 5.298 4.291 -15.884 1.00 0.00 C ATOM 1115 NE2 HIS A 73 5.428 5.604 -15.944 1.00 0.00 N ATOM 0 H HIS A 73 2.427 5.976 -11.917 1.00 0.00 H new ATOM 0 HA HIS A 73 3.701 3.332 -12.305 1.00 0.00 H new ATOM 0 HB2 HIS A 73 5.008 6.057 -11.957 1.00 0.00 H new ATOM 0 HB3 HIS A 73 5.868 4.531 -11.906 1.00 0.00 H new ATOM 0 HD2 HIS A 73 5.417 7.160 -14.398 1.00 0.00 H new ATOM 0 HE1 HIS A 73 5.321 3.615 -16.726 1.00 0.00 H new ATOM 0 HE2 HIS A 73 5.566 6.148 -16.796 1.00 0.00 H new ATOM 1123 N PRO A 74 3.121 3.126 -9.852 1.00 0.00 N ATOM 1124 CA PRO A 74 3.033 2.868 -8.411 1.00 0.00 C ATOM 1125 C PRO A 74 4.387 2.520 -7.801 1.00 0.00 C ATOM 1126 O PRO A 74 4.569 2.598 -6.586 1.00 0.00 O ATOM 1127 CB PRO A 74 2.084 1.671 -8.323 1.00 0.00 C ATOM 1128 CG PRO A 74 2.218 0.983 -9.638 1.00 0.00 C ATOM 1129 CD PRO A 74 2.479 2.067 -10.647 1.00 0.00 C ATOM 0 HA PRO A 74 2.689 3.744 -7.860 1.00 0.00 H new ATOM 0 HB2 PRO A 74 2.357 1.009 -7.501 1.00 0.00 H new ATOM 0 HB3 PRO A 74 1.057 1.992 -8.147 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.035 0.262 -9.620 1.00 0.00 H new ATOM 0 HG3 PRO A 74 1.311 0.431 -9.884 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.127 1.720 -11.451 1.00 0.00 H new ATOM 0 HD3 PRO A 74 1.556 2.416 -11.110 1.00 0.00 H new ATOM 1137 N ASP A 75 5.333 2.138 -8.651 1.00 0.00 N ATOM 1138 CA ASP A 75 6.671 1.780 -8.195 1.00 0.00 C ATOM 1139 C ASP A 75 7.413 3.006 -7.672 1.00 0.00 C ATOM 1140 O ASP A 75 8.297 2.893 -6.823 1.00 0.00 O ATOM 1141 CB ASP A 75 7.465 1.135 -9.333 1.00 0.00 C ATOM 1142 CG ASP A 75 8.058 2.161 -10.279 1.00 0.00 C ATOM 1143 OD1 ASP A 75 7.330 2.627 -11.181 1.00 0.00 O ATOM 1144 OD2 ASP A 75 9.249 2.498 -10.117 1.00 0.00 O ATOM 0 H ASP A 75 5.198 2.068 -9.660 1.00 0.00 H new ATOM 0 HA ASP A 75 6.571 1.063 -7.380 1.00 0.00 H new ATOM 0 HB2 ASP A 75 8.266 0.526 -8.914 1.00 0.00 H new ATOM 0 HB3 ASP A 75 6.813 0.464 -9.892 1.00 0.00 H new ATOM 1149 N VAL A 76 7.048 4.176 -8.185 1.00 0.00 N ATOM 1150 CA VAL A 76 7.678 5.423 -7.769 1.00 0.00 C ATOM 1151 C VAL A 76 6.676 6.344 -7.082 1.00 0.00 C ATOM 1152 O VAL A 76 7.041 7.141 -6.219 1.00 0.00 O ATOM 1153 CB VAL A 76 8.301 6.164 -8.967 1.00 0.00 C ATOM 1154 CG1 VAL A 76 9.541 5.434 -9.461 1.00 0.00 C ATOM 1155 CG2 VAL A 76 7.282 6.317 -10.087 1.00 0.00 C ATOM 0 H VAL A 76 6.319 4.287 -8.890 1.00 0.00 H new ATOM 0 HA VAL A 76 8.466 5.159 -7.064 1.00 0.00 H new ATOM 0 HB VAL A 76 8.601 7.160 -8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.967 5.972 -10.308 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.276 5.381 -8.658 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.270 4.425 -9.772 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.739 6.843 -10.925 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.950 5.332 -10.414 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.426 6.886 -9.725 1.00 0.00 H new ATOM 1165 N GLU A 77 5.410 6.227 -7.472 1.00 0.00 N ATOM 1166 CA GLU A 77 4.354 7.050 -6.893 1.00 0.00 C ATOM 1167 C GLU A 77 3.859 6.454 -5.578 1.00 0.00 C ATOM 1168 O GLU A 77 3.575 7.177 -4.624 1.00 0.00 O ATOM 1169 CB GLU A 77 3.188 7.187 -7.874 1.00 0.00 C ATOM 1170 CG GLU A 77 3.522 8.016 -9.103 1.00 0.00 C ATOM 1171 CD GLU A 77 2.291 8.623 -9.749 1.00 0.00 C ATOM 1172 OE1 GLU A 77 1.585 9.396 -9.068 1.00 0.00 O ATOM 1173 OE2 GLU A 77 2.035 8.326 -10.934 1.00 0.00 O ATOM 0 H GLU A 77 5.091 5.571 -8.185 1.00 0.00 H new ATOM 0 HA GLU A 77 4.768 8.038 -6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.872 6.193 -8.191 1.00 0.00 H new ATOM 0 HB3 GLU A 77 2.342 7.641 -7.359 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.211 8.813 -8.823 1.00 0.00 H new ATOM 0 HG3 GLU A 77 4.038 7.389 -9.830 1.00 0.00 H new ATOM 1180 N VAL A 78 3.757 5.129 -5.537 1.00 0.00 N ATOM 1181 CA VAL A 78 3.297 4.434 -4.340 1.00 0.00 C ATOM 1182 C VAL A 78 4.469 3.855 -3.556 1.00 0.00 C ATOM 1183 O VAL A 78 5.008 2.806 -3.910 1.00 0.00 O ATOM 1184 CB VAL A 78 2.318 3.299 -4.692 1.00 0.00 C ATOM 1185 CG1 VAL A 78 1.698 2.718 -3.430 1.00 0.00 C ATOM 1186 CG2 VAL A 78 1.241 3.800 -5.643 1.00 0.00 C ATOM 0 H VAL A 78 3.987 4.515 -6.319 1.00 0.00 H new ATOM 0 HA VAL A 78 2.781 5.171 -3.725 1.00 0.00 H new ATOM 0 HB VAL A 78 2.873 2.506 -5.194 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.009 1.917 -3.699 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.484 2.320 -2.788 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.156 3.500 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.558 2.985 -5.881 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.687 4.611 -5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.705 4.164 -6.560 1.00 0.00 H new ATOM 1196 N ASP A 79 4.860 4.545 -2.490 1.00 0.00 N ATOM 1197 CA ASP A 79 5.968 4.099 -1.654 1.00 0.00 C ATOM 1198 C ASP A 79 5.715 2.691 -1.123 1.00 0.00 C ATOM 1199 O ASP A 79 4.584 2.335 -0.793 1.00 0.00 O ATOM 1200 CB ASP A 79 6.178 5.067 -0.489 1.00 0.00 C ATOM 1201 CG ASP A 79 7.567 4.961 0.109 1.00 0.00 C ATOM 1202 OD1 ASP A 79 8.152 3.859 0.057 1.00 0.00 O ATOM 1203 OD2 ASP A 79 8.068 5.979 0.630 1.00 0.00 O ATOM 0 H ASP A 79 4.426 5.416 -2.185 1.00 0.00 H new ATOM 0 HA ASP A 79 6.869 4.080 -2.267 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.011 6.087 -0.834 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.436 4.866 0.284 1.00 0.00 H new ATOM 1208 N GLY A 80 6.776 1.894 -1.044 1.00 0.00 N ATOM 1209 CA GLY A 80 6.647 0.534 -0.554 1.00 0.00 C ATOM 1210 C GLY A 80 6.700 -0.492 -1.669 1.00 0.00 C ATOM 1211 O GLY A 80 7.287 -1.562 -1.510 1.00 0.00 O ATOM 0 H GLY A 80 7.722 2.166 -1.310 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.445 0.331 0.160 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.704 0.433 -0.016 1.00 0.00 H new ATOM 1215 N PHE A 81 6.084 -0.166 -2.800 1.00 0.00 N ATOM 1216 CA PHE A 81 6.060 -1.069 -3.945 1.00 0.00 C ATOM 1217 C PHE A 81 7.396 -1.791 -4.096 1.00 0.00 C ATOM 1218 O PHE A 81 7.449 -3.020 -4.128 1.00 0.00 O ATOM 1219 CB PHE A 81 5.739 -0.295 -5.225 1.00 0.00 C ATOM 1220 CG PHE A 81 5.951 -1.095 -6.479 1.00 0.00 C ATOM 1221 CD1 PHE A 81 7.214 -1.213 -7.036 1.00 0.00 C ATOM 1222 CD2 PHE A 81 4.887 -1.728 -7.100 1.00 0.00 C ATOM 1223 CE1 PHE A 81 7.412 -1.949 -8.189 1.00 0.00 C ATOM 1224 CE2 PHE A 81 5.079 -2.465 -8.253 1.00 0.00 C ATOM 1225 CZ PHE A 81 6.343 -2.575 -8.799 1.00 0.00 C ATOM 0 H PHE A 81 5.595 0.717 -2.949 1.00 0.00 H new ATOM 0 HA PHE A 81 5.282 -1.813 -3.773 1.00 0.00 H new ATOM 0 HB2 PHE A 81 4.702 0.039 -5.188 1.00 0.00 H new ATOM 0 HB3 PHE A 81 6.361 0.599 -5.265 1.00 0.00 H new ATOM 0 HD1 PHE A 81 8.053 -0.724 -6.564 1.00 0.00 H new ATOM 0 HD2 PHE A 81 3.896 -1.645 -6.678 1.00 0.00 H new ATOM 0 HE1 PHE A 81 8.402 -2.034 -8.612 1.00 0.00 H new ATOM 0 HE2 PHE A 81 4.241 -2.955 -8.727 1.00 0.00 H new ATOM 0 HZ PHE A 81 6.495 -3.149 -9.701 1.00 0.00 H new ATOM 1235 N SER A 82 8.473 -1.017 -4.187 1.00 0.00 N ATOM 1236 CA SER A 82 9.809 -1.582 -4.339 1.00 0.00 C ATOM 1237 C SER A 82 10.120 -2.553 -3.204 1.00 0.00 C ATOM 1238 O SER A 82 10.760 -3.583 -3.414 1.00 0.00 O ATOM 1239 CB SER A 82 10.856 -0.467 -4.372 1.00 0.00 C ATOM 1240 OG SER A 82 11.011 0.125 -3.094 1.00 0.00 O ATOM 0 H SER A 82 8.447 0.002 -4.158 1.00 0.00 H new ATOM 0 HA SER A 82 9.841 -2.129 -5.281 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.811 -0.871 -4.707 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.560 0.293 -5.095 1.00 0.00 H new ATOM 0 HG SER A 82 11.687 0.833 -3.141 1.00 0.00 H new ATOM 1246 N GLU A 83 9.662 -2.216 -2.003 1.00 0.00 N ATOM 1247 CA GLU A 83 9.893 -3.058 -0.834 1.00 0.00 C ATOM 1248 C GLU A 83 9.198 -4.408 -0.991 1.00 0.00 C ATOM 1249 O GLU A 83 9.744 -5.447 -0.619 1.00 0.00 O ATOM 1250 CB GLU A 83 9.394 -2.359 0.432 1.00 0.00 C ATOM 1251 CG GLU A 83 10.024 -0.996 0.663 1.00 0.00 C ATOM 1252 CD GLU A 83 9.891 -0.528 2.099 1.00 0.00 C ATOM 1253 OE1 GLU A 83 8.748 -0.281 2.539 1.00 0.00 O ATOM 1254 OE2 GLU A 83 10.929 -0.408 2.783 1.00 0.00 O ATOM 0 H GLU A 83 9.129 -1.367 -1.813 1.00 0.00 H new ATOM 0 HA GLU A 83 10.966 -3.229 -0.747 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.312 -2.244 0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 83 9.599 -2.995 1.293 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.080 -1.038 0.395 1.00 0.00 H new ATOM 0 HG3 GLU A 83 9.556 -0.267 0.002 1.00 0.00 H new ATOM 1261 N LEU A 84 7.990 -4.384 -1.544 1.00 0.00 N ATOM 1262 CA LEU A 84 7.218 -5.605 -1.750 1.00 0.00 C ATOM 1263 C LEU A 84 8.083 -6.697 -2.372 1.00 0.00 C ATOM 1264 O LEU A 84 9.207 -6.441 -2.804 1.00 0.00 O ATOM 1265 CB LEU A 84 6.010 -5.323 -2.644 1.00 0.00 C ATOM 1266 CG LEU A 84 4.984 -4.332 -2.094 1.00 0.00 C ATOM 1267 CD1 LEU A 84 3.948 -3.992 -3.155 1.00 0.00 C ATOM 1268 CD2 LEU A 84 4.312 -4.894 -0.850 1.00 0.00 C ATOM 0 H LEU A 84 7.524 -3.533 -1.858 1.00 0.00 H new ATOM 0 HA LEU A 84 6.869 -5.954 -0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.372 -4.947 -3.601 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.503 -6.267 -2.843 1.00 0.00 H new ATOM 0 HG LEU A 84 5.505 -3.415 -1.818 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.226 -3.285 -2.745 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.443 -3.546 -4.017 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.431 -4.901 -3.463 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.585 -4.175 -0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.805 -5.826 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.064 -5.085 -0.085 1.00 0.00 H new ATOM 1280 N ARG A 85 7.550 -7.913 -2.415 1.00 0.00 N ATOM 1281 CA ARG A 85 8.272 -9.044 -2.986 1.00 0.00 C ATOM 1282 C ARG A 85 8.051 -9.126 -4.493 1.00 0.00 C ATOM 1283 O ARG A 85 7.013 -8.702 -5.002 1.00 0.00 O ATOM 1284 CB ARG A 85 7.826 -10.348 -2.323 1.00 0.00 C ATOM 1285 CG ARG A 85 8.402 -10.552 -0.931 1.00 0.00 C ATOM 1286 CD ARG A 85 8.500 -12.028 -0.579 1.00 0.00 C ATOM 1287 NE ARG A 85 7.202 -12.592 -0.218 1.00 0.00 N ATOM 1288 CZ ARG A 85 6.399 -13.202 -1.084 1.00 0.00 C ATOM 1289 NH1 ARG A 85 6.760 -13.325 -2.354 1.00 0.00 N ATOM 1290 NH2 ARG A 85 5.233 -13.689 -0.680 1.00 0.00 N ATOM 0 H ARG A 85 6.621 -8.141 -2.061 1.00 0.00 H new ATOM 0 HA ARG A 85 9.336 -8.895 -2.800 1.00 0.00 H new ATOM 0 HB2 ARG A 85 6.738 -10.361 -2.262 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.120 -11.186 -2.955 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.391 -10.097 -0.875 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.775 -10.043 -0.199 1.00 0.00 H new ATOM 0 HD2 ARG A 85 8.910 -12.576 -1.427 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.195 -12.157 0.251 1.00 0.00 H new ATOM 0 HE ARG A 85 6.895 -12.514 0.752 1.00 0.00 H new ATOM 0 HH11 ARG A 85 7.656 -12.951 -2.668 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.142 -13.793 -3.017 1.00 0.00 H new ATOM 0 HH21 ARG A 85 4.952 -13.596 0.296 1.00 0.00 H new ATOM 0 HH22 ARG A 85 4.618 -14.157 -1.345 1.00 0.00 H new ATOM 1304 N TRP A 86 9.034 -9.671 -5.201 1.00 0.00 N ATOM 1305 CA TRP A 86 8.947 -9.808 -6.650 1.00 0.00 C ATOM 1306 C TRP A 86 7.513 -10.091 -7.085 1.00 0.00 C ATOM 1307 O TRP A 86 6.925 -9.329 -7.853 1.00 0.00 O ATOM 1308 CB TRP A 86 9.870 -10.927 -7.134 1.00 0.00 C ATOM 1309 CG TRP A 86 9.703 -11.248 -8.589 1.00 0.00 C ATOM 1310 CD1 TRP A 86 10.347 -10.658 -9.638 1.00 0.00 C ATOM 1311 CD2 TRP A 86 8.833 -12.235 -9.153 1.00 0.00 C ATOM 1312 NE1 TRP A 86 9.930 -11.218 -10.821 1.00 0.00 N ATOM 1313 CE2 TRP A 86 9.002 -12.189 -10.551 1.00 0.00 C ATOM 1314 CE3 TRP A 86 7.929 -13.155 -8.615 1.00 0.00 C ATOM 1315 CZ2 TRP A 86 8.299 -13.026 -11.414 1.00 0.00 C ATOM 1316 CZ3 TRP A 86 7.232 -13.985 -9.473 1.00 0.00 C ATOM 1317 CH2 TRP A 86 7.421 -13.916 -10.859 1.00 0.00 C ATOM 0 H TRP A 86 9.900 -10.025 -4.795 1.00 0.00 H new ATOM 0 HA TRP A 86 9.264 -8.866 -7.098 1.00 0.00 H new ATOM 0 HB2 TRP A 86 10.905 -10.640 -6.949 1.00 0.00 H new ATOM 0 HB3 TRP A 86 9.679 -11.825 -6.547 1.00 0.00 H new ATOM 0 HD1 TRP A 86 11.077 -9.867 -9.551 1.00 0.00 H new ATOM 0 HE1 TRP A 86 10.258 -10.954 -11.750 1.00 0.00 H new ATOM 0 HE3 TRP A 86 7.778 -13.216 -7.547 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 8.442 -12.974 -12.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 6.530 -14.699 -9.068 1.00 0.00 H new ATOM 0 HH2 TRP A 86 6.862 -14.579 -11.503 1.00 0.00 H new ATOM 1328 N ASP A 87 6.955 -11.191 -6.590 1.00 0.00 N ATOM 1329 CA ASP A 87 5.589 -11.573 -6.927 1.00 0.00 C ATOM 1330 C ASP A 87 4.643 -10.384 -6.795 1.00 0.00 C ATOM 1331 O ASP A 87 4.080 -9.913 -7.784 1.00 0.00 O ATOM 1332 CB ASP A 87 5.120 -12.716 -6.026 1.00 0.00 C ATOM 1333 CG ASP A 87 5.728 -14.049 -6.417 1.00 0.00 C ATOM 1334 OD1 ASP A 87 6.824 -14.372 -5.914 1.00 0.00 O ATOM 1335 OD2 ASP A 87 5.107 -14.769 -7.228 1.00 0.00 O ATOM 0 H ASP A 87 7.428 -11.833 -5.954 1.00 0.00 H new ATOM 0 HA ASP A 87 5.578 -11.909 -7.964 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.381 -12.490 -4.992 1.00 0.00 H new ATOM 0 HB3 ASP A 87 4.033 -12.788 -6.072 1.00 0.00 H new ATOM 1340 N ASP A 88 4.473 -9.903 -5.568 1.00 0.00 N ATOM 1341 CA ASP A 88 3.595 -8.769 -5.307 1.00 0.00 C ATOM 1342 C ASP A 88 3.878 -7.627 -6.279 1.00 0.00 C ATOM 1343 O ASP A 88 2.982 -7.165 -6.985 1.00 0.00 O ATOM 1344 CB ASP A 88 3.769 -8.284 -3.867 1.00 0.00 C ATOM 1345 CG ASP A 88 3.443 -9.360 -2.850 1.00 0.00 C ATOM 1346 OD1 ASP A 88 2.246 -9.547 -2.547 1.00 0.00 O ATOM 1347 OD2 ASP A 88 4.385 -10.016 -2.358 1.00 0.00 O ATOM 0 H ASP A 88 4.932 -10.281 -4.739 1.00 0.00 H new ATOM 0 HA ASP A 88 2.566 -9.097 -5.450 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.796 -7.950 -3.721 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.125 -7.421 -3.697 1.00 0.00 H new ATOM 1352 N GLN A 89 5.129 -7.178 -6.308 1.00 0.00 N ATOM 1353 CA GLN A 89 5.528 -6.089 -7.192 1.00 0.00 C ATOM 1354 C GLN A 89 4.843 -6.211 -8.549 1.00 0.00 C ATOM 1355 O GLN A 89 4.329 -5.229 -9.085 1.00 0.00 O ATOM 1356 CB GLN A 89 7.047 -6.083 -7.373 1.00 0.00 C ATOM 1357 CG GLN A 89 7.809 -5.706 -6.113 1.00 0.00 C ATOM 1358 CD GLN A 89 9.302 -5.586 -6.347 1.00 0.00 C ATOM 1359 OE1 GLN A 89 10.005 -6.589 -6.470 1.00 0.00 O ATOM 1360 NE2 GLN A 89 9.794 -4.355 -6.409 1.00 0.00 N ATOM 0 H GLN A 89 5.883 -7.551 -5.730 1.00 0.00 H new ATOM 0 HA GLN A 89 5.220 -5.150 -6.733 1.00 0.00 H new ATOM 0 HB2 GLN A 89 7.369 -7.071 -7.700 1.00 0.00 H new ATOM 0 HB3 GLN A 89 7.307 -5.384 -8.168 1.00 0.00 H new ATOM 0 HG2 GLN A 89 7.428 -4.759 -5.732 1.00 0.00 H new ATOM 0 HG3 GLN A 89 7.625 -6.456 -5.344 1.00 0.00 H new ATOM 0 HE21 GLN A 89 9.174 -3.552 -6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 89 10.792 -4.212 -6.564 1.00 0.00 H new ATOM 1369 N GLN A 90 4.839 -7.421 -9.099 1.00 0.00 N ATOM 1370 CA GLN A 90 4.218 -7.669 -10.394 1.00 0.00 C ATOM 1371 C GLN A 90 2.702 -7.520 -10.308 1.00 0.00 C ATOM 1372 O GLN A 90 2.076 -6.925 -11.185 1.00 0.00 O ATOM 1373 CB GLN A 90 4.576 -9.069 -10.895 1.00 0.00 C ATOM 1374 CG GLN A 90 6.066 -9.273 -11.118 1.00 0.00 C ATOM 1375 CD GLN A 90 6.577 -8.547 -12.347 1.00 0.00 C ATOM 1376 OE1 GLN A 90 6.217 -8.884 -13.475 1.00 0.00 O ATOM 1377 NE2 GLN A 90 7.421 -7.545 -12.135 1.00 0.00 N ATOM 0 H GLN A 90 5.259 -8.245 -8.668 1.00 0.00 H new ATOM 0 HA GLN A 90 4.599 -6.930 -11.099 1.00 0.00 H new ATOM 0 HB2 GLN A 90 4.221 -9.806 -10.174 1.00 0.00 H new ATOM 0 HB3 GLN A 90 4.048 -9.257 -11.830 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.612 -8.924 -10.241 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.272 -10.339 -11.218 1.00 0.00 H new ATOM 0 HE21 GLN A 90 7.692 -7.300 -11.183 1.00 0.00 H new ATOM 0 HE22 GLN A 90 7.798 -7.020 -12.924 1.00 0.00 H new ATOM 1386 N LYS A 91 2.118 -8.063 -9.246 1.00 0.00 N ATOM 1387 CA LYS A 91 0.676 -7.990 -9.044 1.00 0.00 C ATOM 1388 C LYS A 91 0.191 -6.546 -9.104 1.00 0.00 C ATOM 1389 O LYS A 91 -0.799 -6.240 -9.768 1.00 0.00 O ATOM 1390 CB LYS A 91 0.297 -8.612 -7.697 1.00 0.00 C ATOM 1391 CG LYS A 91 -1.201 -8.678 -7.459 1.00 0.00 C ATOM 1392 CD LYS A 91 -1.522 -9.194 -6.066 1.00 0.00 C ATOM 1393 CE LYS A 91 -1.639 -10.710 -6.047 1.00 0.00 C ATOM 1394 NZ LYS A 91 -2.359 -11.196 -4.836 1.00 0.00 N ATOM 0 H LYS A 91 2.622 -8.559 -8.511 1.00 0.00 H new ATOM 0 HA LYS A 91 0.193 -8.550 -9.845 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.710 -9.619 -7.642 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.759 -8.034 -6.896 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.635 -7.687 -7.590 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.660 -9.328 -8.204 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.743 -8.879 -5.372 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -2.456 -8.751 -5.719 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -2.165 -11.045 -6.941 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.643 -11.152 -6.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -2.418 -12.234 -4.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.844 -10.898 -3.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -3.318 -10.795 -4.818 1.00 0.00 H new ATOM 1408 N VAL A 92 0.895 -5.660 -8.406 1.00 0.00 N ATOM 1409 CA VAL A 92 0.537 -4.247 -8.382 1.00 0.00 C ATOM 1410 C VAL A 92 0.705 -3.614 -9.759 1.00 0.00 C ATOM 1411 O VAL A 92 -0.103 -2.783 -10.175 1.00 0.00 O ATOM 1412 CB VAL A 92 1.393 -3.468 -7.364 1.00 0.00 C ATOM 1413 CG1 VAL A 92 1.049 -1.987 -7.400 1.00 0.00 C ATOM 1414 CG2 VAL A 92 1.202 -4.035 -5.965 1.00 0.00 C ATOM 0 H VAL A 92 1.717 -5.896 -7.850 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.510 -4.191 -8.084 1.00 0.00 H new ATOM 0 HB VAL A 92 2.443 -3.579 -7.636 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.663 -1.453 -6.675 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.241 -1.593 -8.398 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.004 -1.852 -7.153 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.813 -3.474 -5.258 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.153 -3.955 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.503 -5.083 -5.953 1.00 0.00 H new ATOM 1424 N LYS A 93 1.758 -4.013 -10.463 1.00 0.00 N ATOM 1425 CA LYS A 93 2.032 -3.488 -11.795 1.00 0.00 C ATOM 1426 C LYS A 93 0.859 -3.748 -12.735 1.00 0.00 C ATOM 1427 O LYS A 93 0.183 -2.817 -13.173 1.00 0.00 O ATOM 1428 CB LYS A 93 3.305 -4.120 -12.364 1.00 0.00 C ATOM 1429 CG LYS A 93 4.584 -3.484 -11.848 1.00 0.00 C ATOM 1430 CD LYS A 93 5.803 -4.000 -12.592 1.00 0.00 C ATOM 1431 CE LYS A 93 5.937 -3.351 -13.961 1.00 0.00 C ATOM 1432 NZ LYS A 93 7.359 -3.246 -14.389 1.00 0.00 N ATOM 0 H LYS A 93 2.437 -4.699 -10.133 1.00 0.00 H new ATOM 0 HA LYS A 93 2.175 -2.411 -11.710 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.313 -5.182 -12.120 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.284 -4.043 -13.451 1.00 0.00 H new ATOM 0 HG2 LYS A 93 4.522 -2.401 -11.956 1.00 0.00 H new ATOM 0 HG3 LYS A 93 4.691 -3.692 -10.784 1.00 0.00 H new ATOM 0 HD2 LYS A 93 6.700 -3.802 -12.005 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.730 -5.081 -12.707 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.379 -3.933 -14.695 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.491 -2.357 -13.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 7.407 -2.798 -15.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 7.886 -2.670 -13.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 7.778 -4.197 -14.437 1.00 0.00 H new ATOM 1446 N LYS A 94 0.622 -5.019 -13.039 1.00 0.00 N ATOM 1447 CA LYS A 94 -0.472 -5.403 -13.924 1.00 0.00 C ATOM 1448 C LYS A 94 -1.792 -4.805 -13.449 1.00 0.00 C ATOM 1449 O LYS A 94 -2.439 -4.047 -14.172 1.00 0.00 O ATOM 1450 CB LYS A 94 -0.586 -6.927 -13.996 1.00 0.00 C ATOM 1451 CG LYS A 94 -0.553 -7.604 -12.637 1.00 0.00 C ATOM 1452 CD LYS A 94 0.093 -8.977 -12.713 1.00 0.00 C ATOM 1453 CE LYS A 94 -0.936 -10.063 -12.991 1.00 0.00 C ATOM 1454 NZ LYS A 94 -1.735 -10.393 -11.779 1.00 0.00 N ATOM 0 H LYS A 94 1.173 -5.801 -12.686 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.255 -5.014 -14.919 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.515 -7.190 -14.501 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.229 -7.316 -14.606 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.003 -6.981 -11.932 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.568 -7.700 -12.252 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.849 -8.981 -13.498 1.00 0.00 H new ATOM 0 HD3 LYS A 94 0.606 -9.191 -11.775 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.604 -9.735 -13.788 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.430 -10.960 -13.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.341 -11.215 -11.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.094 -10.616 -10.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.329 -9.579 -11.523 1.00 0.00 H new ATOM 1468 N THR A 95 -2.187 -5.150 -12.227 1.00 0.00 N ATOM 1469 CA THR A 95 -3.430 -4.648 -11.655 1.00 0.00 C ATOM 1470 C THR A 95 -3.583 -3.151 -11.903 1.00 0.00 C ATOM 1471 O THR A 95 -4.593 -2.703 -12.445 1.00 0.00 O ATOM 1472 CB THR A 95 -3.500 -4.916 -10.140 1.00 0.00 C ATOM 1473 OG1 THR A 95 -3.358 -6.317 -9.884 1.00 0.00 O ATOM 1474 CG2 THR A 95 -4.817 -4.420 -9.563 1.00 0.00 C ATOM 0 H THR A 95 -1.663 -5.775 -11.614 1.00 0.00 H new ATOM 0 HA THR A 95 -4.243 -5.181 -12.148 1.00 0.00 H new ATOM 0 HB THR A 95 -2.685 -4.375 -9.659 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.429 -6.513 -9.641 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.843 -4.620 -8.492 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.908 -3.347 -9.734 1.00 0.00 H new ATOM 0 HG23 THR A 95 -5.645 -4.936 -10.049 1.00 0.00 H new ATOM 1482 N ALA A 96 -2.575 -2.383 -11.502 1.00 0.00 N ATOM 1483 CA ALA A 96 -2.597 -0.937 -11.683 1.00 0.00 C ATOM 1484 C ALA A 96 -2.863 -0.570 -13.139 1.00 0.00 C ATOM 1485 O ALA A 96 -3.763 0.215 -13.436 1.00 0.00 O ATOM 1486 CB ALA A 96 -1.285 -0.326 -11.214 1.00 0.00 C ATOM 0 H ALA A 96 -1.733 -2.739 -11.050 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.410 -0.533 -11.079 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -1.316 0.754 -11.355 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.136 -0.550 -10.158 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.461 -0.744 -11.793 1.00 0.00 H new ATOM 1492 N GLU A 97 -2.075 -1.144 -14.043 1.00 0.00 N ATOM 1493 CA GLU A 97 -2.226 -0.875 -15.468 1.00 0.00 C ATOM 1494 C GLU A 97 -3.646 -1.183 -15.933 1.00 0.00 C ATOM 1495 O GLU A 97 -4.204 -0.474 -16.769 1.00 0.00 O ATOM 1496 CB GLU A 97 -1.223 -1.702 -16.275 1.00 0.00 C ATOM 1497 CG GLU A 97 0.223 -1.288 -16.056 1.00 0.00 C ATOM 1498 CD GLU A 97 0.579 -0.007 -16.784 1.00 0.00 C ATOM 1499 OE1 GLU A 97 -0.152 0.992 -16.620 1.00 0.00 O ATOM 1500 OE2 GLU A 97 1.591 -0.003 -17.516 1.00 0.00 O ATOM 0 H GLU A 97 -1.326 -1.798 -13.814 1.00 0.00 H new ATOM 0 HA GLU A 97 -2.030 0.184 -15.634 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.335 -2.753 -16.010 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -1.461 -1.613 -17.335 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.402 -1.157 -14.989 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.881 -2.088 -16.394 1.00 0.00 H new ATOM 1507 N ALA A 98 -4.224 -2.246 -15.383 1.00 0.00 N ATOM 1508 CA ALA A 98 -5.580 -2.648 -15.740 1.00 0.00 C ATOM 1509 C ALA A 98 -6.613 -1.882 -14.920 1.00 0.00 C ATOM 1510 O ALA A 98 -7.793 -2.228 -14.912 1.00 0.00 O ATOM 1511 CB ALA A 98 -5.754 -4.147 -15.545 1.00 0.00 C ATOM 0 H ALA A 98 -3.775 -2.844 -14.689 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.739 -2.409 -16.791 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.770 -4.433 -15.815 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -5.046 -4.681 -16.179 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.570 -4.402 -14.501 1.00 0.00 H new ATOM 1517 N GLY A 99 -6.159 -0.840 -14.229 1.00 0.00 N ATOM 1518 CA GLY A 99 -7.058 -0.043 -13.415 1.00 0.00 C ATOM 1519 C GLY A 99 -7.957 0.850 -14.247 1.00 0.00 C ATOM 1520 O GLY A 99 -7.882 2.075 -14.157 1.00 0.00 O ATOM 0 H GLY A 99 -5.186 -0.534 -14.219 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -7.673 -0.704 -12.805 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -6.474 0.572 -12.730 1.00 0.00 H new ATOM 1524 N GLY A 100 -8.809 0.235 -15.061 1.00 0.00 N ATOM 1525 CA GLY A 100 -9.713 0.997 -15.902 1.00 0.00 C ATOM 1526 C GLY A 100 -11.148 0.520 -15.794 1.00 0.00 C ATOM 1527 O GLY A 100 -11.779 0.662 -14.747 1.00 0.00 O ATOM 0 H GLY A 100 -8.889 -0.778 -15.153 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.662 2.050 -15.624 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.387 0.925 -16.939 1.00 0.00 H new ATOM 1531 N SER A 101 -11.665 -0.047 -16.879 1.00 0.00 N ATOM 1532 CA SER A 101 -13.036 -0.542 -16.904 1.00 0.00 C ATOM 1533 C SER A 101 -13.123 -1.933 -16.285 1.00 0.00 C ATOM 1534 O SER A 101 -12.211 -2.747 -16.429 1.00 0.00 O ATOM 1535 CB SER A 101 -13.563 -0.576 -18.340 1.00 0.00 C ATOM 1536 OG SER A 101 -12.786 -1.444 -19.147 1.00 0.00 O ATOM 0 H SER A 101 -11.155 -0.175 -17.753 1.00 0.00 H new ATOM 0 HA SER A 101 -13.652 0.138 -16.315 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.602 -0.905 -18.342 1.00 0.00 H new ATOM 0 HB3 SER A 101 -13.546 0.429 -18.761 1.00 0.00 H new ATOM 0 HG SER A 101 -13.144 -1.450 -20.059 1.00 0.00 H new ATOM 1542 N GLY A 102 -14.227 -2.200 -15.594 1.00 0.00 N ATOM 1543 CA GLY A 102 -14.413 -3.493 -14.962 1.00 0.00 C ATOM 1544 C GLY A 102 -15.799 -3.654 -14.369 1.00 0.00 C ATOM 1545 O GLY A 102 -16.811 -3.418 -15.029 1.00 0.00 O ATOM 0 H GLY A 102 -14.996 -1.544 -15.461 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -14.241 -4.281 -15.696 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -13.668 -3.621 -14.177 1.00 0.00 H new ATOM 1549 N PRO A 103 -15.857 -4.067 -13.094 1.00 0.00 N ATOM 1550 CA PRO A 103 -17.123 -4.270 -12.385 1.00 0.00 C ATOM 1551 C PRO A 103 -17.842 -2.957 -12.094 1.00 0.00 C ATOM 1552 O PRO A 103 -17.229 -1.890 -12.091 1.00 0.00 O ATOM 1553 CB PRO A 103 -16.694 -4.945 -11.079 1.00 0.00 C ATOM 1554 CG PRO A 103 -15.284 -4.510 -10.873 1.00 0.00 C ATOM 1555 CD PRO A 103 -14.690 -4.367 -12.247 1.00 0.00 C ATOM 0 HA PRO A 103 -17.829 -4.857 -12.973 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -17.329 -4.638 -10.248 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -16.767 -6.030 -11.152 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -15.242 -3.566 -10.330 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -14.732 -5.242 -10.283 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -13.951 -3.567 -12.284 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -14.187 -5.281 -12.564 1.00 0.00 H new ATOM 1563 N SER A 104 -19.146 -3.043 -11.850 1.00 0.00 N ATOM 1564 CA SER A 104 -19.949 -1.861 -11.562 1.00 0.00 C ATOM 1565 C SER A 104 -19.877 -1.503 -10.081 1.00 0.00 C ATOM 1566 O SER A 104 -19.417 -2.297 -9.261 1.00 0.00 O ATOM 1567 CB SER A 104 -21.405 -2.095 -11.971 1.00 0.00 C ATOM 1568 OG SER A 104 -22.088 -2.871 -11.002 1.00 0.00 O ATOM 0 H SER A 104 -19.668 -3.919 -11.846 1.00 0.00 H new ATOM 0 HA SER A 104 -19.546 -1.029 -12.139 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.910 -1.137 -12.096 1.00 0.00 H new ATOM 0 HB3 SER A 104 -21.438 -2.601 -12.936 1.00 0.00 H new ATOM 0 HG SER A 104 -23.016 -3.005 -11.285 1.00 0.00 H new ATOM 1574 N SER A 105 -20.334 -0.300 -9.746 1.00 0.00 N ATOM 1575 CA SER A 105 -20.318 0.166 -8.365 1.00 0.00 C ATOM 1576 C SER A 105 -21.150 1.436 -8.210 1.00 0.00 C ATOM 1577 O SER A 105 -21.310 2.206 -9.157 1.00 0.00 O ATOM 1578 CB SER A 105 -18.881 0.426 -7.908 1.00 0.00 C ATOM 1579 OG SER A 105 -18.798 0.489 -6.495 1.00 0.00 O ATOM 0 H SER A 105 -20.720 0.369 -10.412 1.00 0.00 H new ATOM 0 HA SER A 105 -20.755 -0.613 -7.740 1.00 0.00 H new ATOM 0 HB2 SER A 105 -18.230 -0.365 -8.279 1.00 0.00 H new ATOM 0 HB3 SER A 105 -18.523 1.361 -8.338 1.00 0.00 H new ATOM 0 HG SER A 105 -17.869 0.654 -6.229 1.00 0.00 H new ATOM 1585 N GLY A 106 -21.679 1.647 -7.009 1.00 0.00 N ATOM 1586 CA GLY A 106 -22.488 2.824 -6.751 1.00 0.00 C ATOM 1587 C GLY A 106 -21.662 4.004 -6.280 1.00 0.00 C ATOM 1588 O GLY A 106 -21.765 5.100 -6.828 1.00 0.00 O ATOM 0 H GLY A 106 -21.562 1.024 -6.210 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -23.024 3.099 -7.660 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -23.239 2.587 -5.998 1.00 0.00 H new TER 1592 GLY A 106 HETATM 1593 ZN ZN A 200 -11.896 -2.481 1.953 1.00 0.00 ZN