USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 917 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 ASN : amide:sc= 0.167 K(o=0.81,f=-9.5!) USER MOD Set 1.2: A 75 LYS NZ :NH3+ -151:sc= 0.641 (180deg=-0.392) USER MOD Set 2.1: A 6 CYS SG : rot -154:sc= 1.67 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.831 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0.0385 K(o=0.038,f=-1.9) USER MOD Single : A 17 SER OG : rot 180:sc= -0.0132 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 134:sc= 1.01 USER MOD Single : A 26 TYR OH : rot 110:sc= -0.831 USER MOD Single : A 27 GLN :FLIP amide:sc= -2.77! C(o=-4.2!,f=-2.8!) USER MOD Single : A 29 MET CE :methyl -149:sc= -3.01 (180deg=-6.96!) USER MOD Single : A 32 THR OG1 : rot -83:sc= 0.74 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 12:sc= 0.941 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 161:sc= 1.24 (180deg=0.915) USER MOD Single : A 45 LYS NZ :NH3+ -170:sc= 1.21 (180deg=1.03) USER MOD Single : A 48 LYS NZ :NH3+ 166:sc= 0.605 (180deg=0.493) USER MOD Single : A 49 GLN : amide:sc= 0.467 X(o=0.47,f=-0.021) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 168:sc= -0.0364 (180deg=-0.229) USER MOD Single : A 57 THR OG1 : rot 180:sc= -0.0515 USER MOD Single : A 60 LYS NZ :NH3+ -167:sc= -0.0252 (180deg=-0.215) USER MOD Single : A 61 LYS NZ :NH3+ -167:sc= -0.0419 (180deg=-0.225) USER MOD Single : A 62 SER OG : rot 76:sc= 1.04 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.0226 X(o=-0.023,f=-0.48) USER MOD Single : A 70 MET CE :methyl -140:sc= -0.197 (180deg=-0.737) USER MOD Single : A 72 LYS NZ :NH3+ 173:sc=-0.00562 (180deg=-0.0789) USER MOD Single : A 79 LYS NZ :NH3+ -163:sc= -0.0633 (180deg=-0.378) USER MOD Single : A 80 MET CE :methyl 163:sc= -0.0665 (180deg=-0.452) USER MOD Single : A 83 LYS NZ :NH3+ -166:sc= -0.036 (180deg=-0.251) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.0442 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 106 THR OG1 : rot -153:sc= 0.0352 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -3.670 -1.584 -30.854 1.00 40.32 N ATOM 2 CA GLY A -1 -2.728 -0.926 -29.945 1.00 64.53 C ATOM 3 C GLY A -1 -2.323 -1.842 -28.820 1.00 21.43 C ATOM 4 O GLY A -1 -1.482 -2.727 -28.998 1.00 24.05 O ATOM 0 H1 GLY A -1 -3.930 -0.928 -31.618 1.00 40.32 H new ATOM 0 H2 GLY A -1 -3.225 -2.431 -31.261 1.00 40.32 H new ATOM 0 H3 GLY A -1 -4.524 -1.860 -30.329 1.00 40.32 H new ATOM 0 HA2 GLY A -1 -1.843 -0.613 -30.499 1.00 64.53 H new ATOM 0 HA3 GLY A -1 -3.183 -0.024 -29.536 1.00 64.53 H new ATOM 10 N SER A 0 -2.914 -1.642 -27.674 1.00 33.52 N ATOM 11 CA SER A 0 -2.659 -2.461 -26.526 1.00 70.23 C ATOM 12 C SER A 0 -3.945 -2.609 -25.734 1.00 31.14 C ATOM 13 O SER A 0 -4.890 -1.836 -25.937 1.00 11.32 O ATOM 14 CB SER A 0 -1.534 -1.843 -25.676 1.00 30.54 C ATOM 15 OG SER A 0 -1.824 -0.498 -25.331 1.00 64.20 O ATOM 0 H SER A 0 -3.593 -0.898 -27.512 1.00 33.52 H new ATOM 0 HA SER A 0 -2.326 -3.452 -26.835 1.00 70.23 H new ATOM 0 HB2 SER A 0 -1.397 -2.431 -24.769 1.00 30.54 H new ATOM 0 HB3 SER A 0 -0.595 -1.884 -26.228 1.00 30.54 H new ATOM 0 HG SER A 0 -1.092 -0.134 -24.790 1.00 64.20 H new ATOM 21 N MET A 1 -4.007 -3.590 -24.882 1.00 22.34 N ATOM 22 CA MET A 1 -5.184 -3.822 -24.081 1.00 60.41 C ATOM 23 C MET A 1 -5.105 -3.050 -22.783 1.00 51.53 C ATOM 24 O MET A 1 -4.251 -3.321 -21.928 1.00 41.02 O ATOM 25 CB MET A 1 -5.417 -5.323 -23.820 1.00 20.42 C ATOM 26 CG MET A 1 -5.823 -6.152 -25.050 1.00 31.33 C ATOM 27 SD MET A 1 -4.591 -6.172 -26.377 1.00 1.42 S ATOM 28 CE MET A 1 -5.409 -7.224 -27.576 1.00 73.13 C ATOM 0 H MET A 1 -3.249 -4.252 -24.719 1.00 22.34 H new ATOM 0 HA MET A 1 -6.042 -3.460 -24.647 1.00 60.41 H new ATOM 0 HB2 MET A 1 -4.504 -5.748 -23.402 1.00 20.42 H new ATOM 0 HB3 MET A 1 -6.193 -5.426 -23.061 1.00 20.42 H new ATOM 0 HG2 MET A 1 -6.016 -7.177 -24.735 1.00 31.33 H new ATOM 0 HG3 MET A 1 -6.759 -5.758 -25.446 1.00 31.33 H new ATOM 0 HE1 MET A 1 -4.775 -7.335 -28.455 1.00 73.13 H new ATOM 0 HE2 MET A 1 -5.592 -8.204 -27.135 1.00 73.13 H new ATOM 0 HE3 MET A 1 -6.358 -6.774 -27.867 1.00 73.13 H new ATOM 38 N THR A 2 -5.971 -2.073 -22.659 1.00 13.31 N ATOM 39 CA THR A 2 -6.032 -1.244 -21.489 1.00 65.23 C ATOM 40 C THR A 2 -6.901 -1.904 -20.425 1.00 33.42 C ATOM 41 O THR A 2 -8.086 -2.168 -20.650 1.00 15.41 O ATOM 42 CB THR A 2 -6.619 0.134 -21.850 1.00 32.22 C ATOM 43 OG1 THR A 2 -5.853 0.700 -22.928 1.00 62.14 O ATOM 44 CG2 THR A 2 -6.571 1.081 -20.655 1.00 43.50 C ATOM 0 H THR A 2 -6.656 -1.833 -23.375 1.00 13.31 H new ATOM 0 HA THR A 2 -5.023 -1.115 -21.099 1.00 65.23 H new ATOM 0 HB THR A 2 -7.660 0.002 -22.145 1.00 32.22 H new ATOM 0 HG1 THR A 2 -6.221 1.577 -23.166 1.00 62.14 H new ATOM 0 HG21 THR A 2 -6.992 2.046 -20.938 1.00 43.50 H new ATOM 0 HG22 THR A 2 -7.150 0.660 -19.833 1.00 43.50 H new ATOM 0 HG23 THR A 2 -5.537 1.215 -20.338 1.00 43.50 H new ATOM 52 N VAL A 3 -6.323 -2.189 -19.289 1.00 62.22 N ATOM 53 CA VAL A 3 -7.079 -2.795 -18.208 1.00 24.25 C ATOM 54 C VAL A 3 -7.238 -1.765 -17.103 1.00 0.30 C ATOM 55 O VAL A 3 -6.290 -1.033 -16.799 1.00 15.03 O ATOM 56 CB VAL A 3 -6.371 -4.040 -17.606 1.00 42.14 C ATOM 57 CG1 VAL A 3 -7.293 -4.791 -16.692 1.00 72.44 C ATOM 58 CG2 VAL A 3 -5.828 -4.972 -18.648 1.00 2.43 C ATOM 0 H VAL A 3 -5.339 -2.016 -19.082 1.00 62.22 H new ATOM 0 HA VAL A 3 -8.037 -3.118 -18.615 1.00 24.25 H new ATOM 0 HB VAL A 3 -5.523 -3.656 -17.040 1.00 42.14 H new ATOM 0 HG11 VAL A 3 -6.774 -5.658 -16.284 1.00 72.44 H new ATOM 0 HG12 VAL A 3 -7.608 -4.139 -15.877 1.00 72.44 H new ATOM 0 HG13 VAL A 3 -8.169 -5.122 -17.250 1.00 72.44 H new ATOM 0 HG21 VAL A 3 -5.346 -5.820 -18.162 1.00 2.43 H new ATOM 0 HG22 VAL A 3 -6.643 -5.329 -19.277 1.00 2.43 H new ATOM 0 HG23 VAL A 3 -5.099 -4.445 -19.264 1.00 2.43 H new ATOM 68 N TYR A 4 -8.414 -1.678 -16.530 1.00 3.02 N ATOM 69 CA TYR A 4 -8.656 -0.758 -15.451 1.00 64.32 C ATOM 70 C TYR A 4 -8.662 -1.498 -14.121 1.00 75.12 C ATOM 71 O TYR A 4 -9.323 -2.536 -13.976 1.00 54.12 O ATOM 72 CB TYR A 4 -9.973 -0.019 -15.676 1.00 31.20 C ATOM 73 CG TYR A 4 -9.998 0.787 -16.960 1.00 72.44 C ATOM 74 CD1 TYR A 4 -10.328 0.195 -18.174 1.00 25.33 C ATOM 75 CD2 TYR A 4 -9.687 2.132 -16.956 1.00 72.22 C ATOM 76 CE1 TYR A 4 -10.347 0.926 -19.340 1.00 21.25 C ATOM 77 CE2 TYR A 4 -9.704 2.872 -18.118 1.00 2.11 C ATOM 78 CZ TYR A 4 -10.035 2.265 -19.306 1.00 3.13 C ATOM 79 OH TYR A 4 -10.048 2.998 -20.466 1.00 42.24 O ATOM 0 H TYR A 4 -9.223 -2.239 -16.797 1.00 3.02 H new ATOM 0 HA TYR A 4 -7.854 -0.021 -15.424 1.00 64.32 H new ATOM 0 HB2 TYR A 4 -10.789 -0.742 -15.693 1.00 31.20 H new ATOM 0 HB3 TYR A 4 -10.156 0.648 -14.833 1.00 31.20 H new ATOM 0 HD1 TYR A 4 -10.574 -0.856 -18.203 1.00 25.33 H new ATOM 0 HD2 TYR A 4 -9.426 2.613 -16.025 1.00 72.22 H new ATOM 0 HE1 TYR A 4 -10.605 0.451 -20.275 1.00 21.25 H new ATOM 0 HE2 TYR A 4 -9.459 3.923 -18.096 1.00 2.11 H new ATOM 0 HH TYR A 4 -9.806 3.927 -20.269 1.00 42.24 H new ATOM 89 N ILE A 5 -7.911 -0.982 -13.175 1.00 60.44 N ATOM 90 CA ILE A 5 -7.800 -1.568 -11.853 1.00 72.42 C ATOM 91 C ILE A 5 -8.358 -0.575 -10.851 1.00 2.21 C ATOM 92 O ILE A 5 -7.855 0.529 -10.730 1.00 23.53 O ATOM 93 CB ILE A 5 -6.305 -1.799 -11.385 1.00 34.31 C ATOM 94 CG1 ILE A 5 -5.415 -2.651 -12.315 1.00 2.30 C ATOM 95 CG2 ILE A 5 -6.283 -2.432 -9.997 1.00 34.12 C ATOM 96 CD1 ILE A 5 -5.193 -2.144 -13.733 1.00 22.51 C ATOM 0 H ILE A 5 -7.354 -0.137 -13.300 1.00 60.44 H new ATOM 0 HA ILE A 5 -8.323 -2.523 -11.900 1.00 72.42 H new ATOM 0 HB ILE A 5 -5.874 -0.798 -11.399 1.00 34.31 H new ATOM 0 HG12 ILE A 5 -4.440 -2.760 -11.840 1.00 2.30 H new ATOM 0 HG13 ILE A 5 -5.852 -3.648 -12.379 1.00 2.30 H new ATOM 0 HG21 ILE A 5 -5.250 -2.587 -9.684 1.00 34.12 H new ATOM 0 HG22 ILE A 5 -6.782 -1.771 -9.288 1.00 34.12 H new ATOM 0 HG23 ILE A 5 -6.801 -3.391 -10.026 1.00 34.12 H new ATOM 0 HD11 ILE A 5 -4.550 -2.840 -14.272 1.00 22.51 H new ATOM 0 HD12 ILE A 5 -6.152 -2.065 -14.245 1.00 22.51 H new ATOM 0 HD13 ILE A 5 -4.718 -1.164 -13.699 1.00 22.51 H new ATOM 108 N CYS A 6 -9.377 -0.928 -10.179 1.00 45.23 N ATOM 109 CA CYS A 6 -9.842 -0.132 -9.104 1.00 60.40 C ATOM 110 C CYS A 6 -9.951 -1.002 -7.880 1.00 62.44 C ATOM 111 O CYS A 6 -10.934 -1.714 -7.717 1.00 14.22 O ATOM 112 CB CYS A 6 -11.159 0.567 -9.412 1.00 4.14 C ATOM 113 SG CYS A 6 -11.734 1.656 -8.092 1.00 13.20 S ATOM 0 H CYS A 6 -9.918 -1.775 -10.352 1.00 45.23 H new ATOM 0 HA CYS A 6 -9.125 0.670 -8.929 1.00 60.40 H new ATOM 0 HB2 CYS A 6 -11.045 1.149 -10.326 1.00 4.14 H new ATOM 0 HB3 CYS A 6 -11.922 -0.186 -9.607 1.00 4.14 H new ATOM 0 HG CYS A 6 -13.028 1.765 -8.152 1.00 13.20 H new ATOM 119 N PRO A 7 -8.930 -1.005 -7.009 1.00 41.41 N ATOM 120 CA PRO A 7 -8.940 -1.825 -5.777 1.00 70.51 C ATOM 121 C PRO A 7 -10.106 -1.466 -4.851 1.00 12.14 C ATOM 122 O PRO A 7 -10.470 -2.231 -3.951 1.00 22.34 O ATOM 123 CB PRO A 7 -7.610 -1.461 -5.098 1.00 11.51 C ATOM 124 CG PRO A 7 -6.749 -0.930 -6.194 1.00 44.24 C ATOM 125 CD PRO A 7 -7.671 -0.237 -7.149 1.00 72.00 C ATOM 0 HA PRO A 7 -9.055 -2.886 -5.998 1.00 70.51 H new ATOM 0 HB2 PRO A 7 -7.757 -0.716 -4.316 1.00 11.51 H new ATOM 0 HB3 PRO A 7 -7.156 -2.333 -4.627 1.00 11.51 H new ATOM 0 HG2 PRO A 7 -6.002 -0.239 -5.803 1.00 44.24 H new ATOM 0 HG3 PRO A 7 -6.208 -1.736 -6.690 1.00 44.24 H new ATOM 0 HD2 PRO A 7 -7.807 0.813 -6.889 1.00 72.00 H new ATOM 0 HD3 PRO A 7 -7.291 -0.266 -8.170 1.00 72.00 H new ATOM 133 N GLU A 8 -10.695 -0.321 -5.106 1.00 63.30 N ATOM 134 CA GLU A 8 -11.730 0.225 -4.280 1.00 41.02 C ATOM 135 C GLU A 8 -13.105 -0.251 -4.726 1.00 23.44 C ATOM 136 O GLU A 8 -13.815 -0.901 -3.971 1.00 32.34 O ATOM 137 CB GLU A 8 -11.653 1.747 -4.354 1.00 14.21 C ATOM 138 CG GLU A 8 -10.236 2.234 -4.203 1.00 73.24 C ATOM 139 CD GLU A 8 -10.086 3.725 -4.171 1.00 51.33 C ATOM 140 OE1 GLU A 8 -10.167 4.310 -3.068 1.00 1.12 O ATOM 141 OE2 GLU A 8 -9.841 4.334 -5.235 1.00 23.53 O ATOM 0 H GLU A 8 -10.459 0.262 -5.909 1.00 63.30 H new ATOM 0 HA GLU A 8 -11.584 -0.114 -3.254 1.00 41.02 H new ATOM 0 HB2 GLU A 8 -12.056 2.087 -5.308 1.00 14.21 H new ATOM 0 HB3 GLU A 8 -12.274 2.183 -3.571 1.00 14.21 H new ATOM 0 HG2 GLU A 8 -9.820 1.821 -3.284 1.00 73.24 H new ATOM 0 HG3 GLU A 8 -9.641 1.840 -5.027 1.00 73.24 H new ATOM 148 N THR A 9 -13.463 0.051 -5.956 1.00 31.41 N ATOM 149 CA THR A 9 -14.801 -0.228 -6.437 1.00 44.51 C ATOM 150 C THR A 9 -14.860 -1.498 -7.295 1.00 41.03 C ATOM 151 O THR A 9 -15.946 -2.035 -7.552 1.00 62.15 O ATOM 152 CB THR A 9 -15.336 0.981 -7.245 1.00 41.25 C ATOM 153 OG1 THR A 9 -14.538 1.167 -8.425 1.00 62.21 O ATOM 154 CG2 THR A 9 -15.243 2.251 -6.403 1.00 72.31 C ATOM 0 H THR A 9 -12.847 0.489 -6.641 1.00 31.41 H new ATOM 0 HA THR A 9 -15.431 -0.397 -5.563 1.00 44.51 H new ATOM 0 HB THR A 9 -16.373 0.786 -7.516 1.00 41.25 H new ATOM 0 HG1 THR A 9 -14.880 1.932 -8.934 1.00 62.21 H new ATOM 0 HG21 THR A 9 -15.621 3.097 -6.977 1.00 72.31 H new ATOM 0 HG22 THR A 9 -15.839 2.132 -5.498 1.00 72.31 H new ATOM 0 HG23 THR A 9 -14.203 2.432 -6.132 1.00 72.31 H new ATOM 162 N GLY A 10 -13.709 -1.978 -7.731 1.00 53.44 N ATOM 163 CA GLY A 10 -13.692 -3.151 -8.572 1.00 22.14 C ATOM 164 C GLY A 10 -13.294 -4.383 -7.812 1.00 3.22 C ATOM 165 O GLY A 10 -13.133 -4.350 -6.580 1.00 75.22 O ATOM 0 H GLY A 10 -12.794 -1.580 -7.520 1.00 53.44 H new ATOM 0 HA2 GLY A 10 -14.680 -3.298 -9.009 1.00 22.14 H new ATOM 0 HA3 GLY A 10 -12.998 -2.995 -9.398 1.00 22.14 H new ATOM 169 N ASP A 11 -13.093 -5.445 -8.534 1.00 25.41 N ATOM 170 CA ASP A 11 -12.796 -6.736 -7.980 1.00 31.53 C ATOM 171 C ASP A 11 -12.213 -7.593 -9.075 1.00 13.13 C ATOM 172 O ASP A 11 -12.573 -7.431 -10.242 1.00 41.01 O ATOM 173 CB ASP A 11 -14.073 -7.379 -7.407 1.00 2.34 C ATOM 174 CG ASP A 11 -13.817 -8.722 -6.777 1.00 43.21 C ATOM 175 OD1 ASP A 11 -13.301 -8.774 -5.631 1.00 32.14 O ATOM 176 OD2 ASP A 11 -14.115 -9.745 -7.408 1.00 53.25 O ATOM 0 H ASP A 11 -13.132 -5.439 -9.553 1.00 25.41 H new ATOM 0 HA ASP A 11 -12.080 -6.640 -7.164 1.00 31.53 H new ATOM 0 HB2 ASP A 11 -14.509 -6.711 -6.664 1.00 2.34 H new ATOM 0 HB3 ASP A 11 -14.807 -7.491 -8.205 1.00 2.34 H new ATOM 181 N ASP A 12 -11.300 -8.481 -8.730 1.00 10.11 N ATOM 182 CA ASP A 12 -10.648 -9.340 -9.749 1.00 34.20 C ATOM 183 C ASP A 12 -11.584 -10.385 -10.336 1.00 14.12 C ATOM 184 O ASP A 12 -11.202 -11.113 -11.245 1.00 64.33 O ATOM 185 CB ASP A 12 -9.365 -10.017 -9.249 1.00 40.22 C ATOM 186 CG ASP A 12 -8.312 -9.046 -8.808 1.00 21.12 C ATOM 187 OD1 ASP A 12 -8.098 -8.021 -9.490 1.00 21.22 O ATOM 188 OD2 ASP A 12 -7.671 -9.303 -7.755 1.00 20.41 O ATOM 0 H ASP A 12 -10.984 -8.639 -7.773 1.00 10.11 H new ATOM 0 HA ASP A 12 -10.371 -8.645 -10.542 1.00 34.20 H new ATOM 0 HB2 ASP A 12 -9.612 -10.677 -8.417 1.00 40.22 H new ATOM 0 HB3 ASP A 12 -8.961 -10.644 -10.044 1.00 40.22 H new ATOM 193 N GLY A 13 -12.809 -10.461 -9.828 1.00 23.54 N ATOM 194 CA GLY A 13 -13.791 -11.368 -10.393 1.00 53.04 C ATOM 195 C GLY A 13 -14.410 -10.797 -11.665 1.00 42.45 C ATOM 196 O GLY A 13 -15.244 -11.440 -12.320 1.00 25.41 O ATOM 0 H GLY A 13 -13.140 -9.911 -9.035 1.00 23.54 H new ATOM 0 HA2 GLY A 13 -13.319 -12.325 -10.614 1.00 53.04 H new ATOM 0 HA3 GLY A 13 -14.575 -11.561 -9.660 1.00 53.04 H new ATOM 200 N ASN A 14 -14.000 -9.589 -12.002 1.00 64.11 N ATOM 201 CA ASN A 14 -14.461 -8.894 -13.193 1.00 5.23 C ATOM 202 C ASN A 14 -13.598 -9.256 -14.388 1.00 30.25 C ATOM 203 O ASN A 14 -12.594 -9.944 -14.248 1.00 4.22 O ATOM 204 CB ASN A 14 -14.425 -7.378 -12.976 1.00 35.13 C ATOM 205 CG ASN A 14 -15.414 -6.887 -11.935 1.00 33.42 C ATOM 206 OD1 ASN A 14 -16.478 -7.465 -11.744 1.00 41.23 O ATOM 207 ND2 ASN A 14 -15.075 -5.819 -11.263 1.00 3.10 N ATOM 0 H ASN A 14 -13.329 -9.054 -11.451 1.00 64.11 H new ATOM 0 HA ASN A 14 -15.488 -9.203 -13.389 1.00 5.23 H new ATOM 0 HB2 ASN A 14 -13.419 -7.087 -12.674 1.00 35.13 H new ATOM 0 HB3 ASN A 14 -14.630 -6.879 -13.923 1.00 35.13 H new ATOM 0 HD21 ASN A 14 -15.704 -5.442 -10.554 1.00 3.10 H new ATOM 0 HD22 ASN A 14 -14.182 -5.363 -11.447 1.00 3.10 H new ATOM 214 N ASP A 15 -13.980 -8.783 -15.559 1.00 70.43 N ATOM 215 CA ASP A 15 -13.221 -9.047 -16.785 1.00 73.04 C ATOM 216 C ASP A 15 -12.300 -7.881 -17.097 1.00 21.13 C ATOM 217 O ASP A 15 -11.616 -7.870 -18.120 1.00 23.02 O ATOM 218 CB ASP A 15 -14.163 -9.318 -17.973 1.00 51.42 C ATOM 219 CG ASP A 15 -15.047 -8.142 -18.315 1.00 21.42 C ATOM 220 OD1 ASP A 15 -15.960 -7.836 -17.521 1.00 73.21 O ATOM 221 OD2 ASP A 15 -14.865 -7.528 -19.402 1.00 1.15 O ATOM 0 H ASP A 15 -14.813 -8.211 -15.696 1.00 70.43 H new ATOM 0 HA ASP A 15 -12.617 -9.940 -16.623 1.00 73.04 H new ATOM 0 HB2 ASP A 15 -13.568 -9.582 -18.847 1.00 51.42 H new ATOM 0 HB3 ASP A 15 -14.790 -10.179 -17.742 1.00 51.42 H new ATOM 226 N GLY A 16 -12.279 -6.912 -16.191 1.00 72.04 N ATOM 227 CA GLY A 16 -11.428 -5.766 -16.318 1.00 21.25 C ATOM 228 C GLY A 16 -11.799 -4.830 -17.441 1.00 34.55 C ATOM 229 O GLY A 16 -11.224 -4.873 -18.528 1.00 11.30 O ATOM 0 H GLY A 16 -12.857 -6.911 -15.351 1.00 72.04 H new ATOM 0 HA2 GLY A 16 -11.445 -5.211 -15.380 1.00 21.25 H new ATOM 0 HA3 GLY A 16 -10.403 -6.106 -16.469 1.00 21.25 H new ATOM 233 N SER A 17 -12.736 -3.992 -17.168 1.00 14.04 N ATOM 234 CA SER A 17 -13.176 -2.969 -18.070 1.00 13.42 C ATOM 235 C SER A 17 -13.242 -1.694 -17.243 1.00 53.14 C ATOM 236 O SER A 17 -12.941 -1.737 -16.052 1.00 54.01 O ATOM 237 CB SER A 17 -14.561 -3.332 -18.641 1.00 34.51 C ATOM 238 OG SER A 17 -14.987 -2.395 -19.624 1.00 12.31 O ATOM 0 H SER A 17 -13.239 -3.994 -16.281 1.00 14.04 H new ATOM 0 HA SER A 17 -12.504 -2.851 -18.920 1.00 13.42 H new ATOM 0 HB2 SER A 17 -14.524 -4.329 -19.080 1.00 34.51 H new ATOM 0 HB3 SER A 17 -15.290 -3.368 -17.832 1.00 34.51 H new ATOM 0 HG SER A 17 -15.867 -2.657 -19.966 1.00 12.31 H new ATOM 244 N GLU A 18 -13.610 -0.581 -17.829 1.00 30.52 N ATOM 245 CA GLU A 18 -13.713 0.643 -17.076 1.00 15.25 C ATOM 246 C GLU A 18 -14.924 0.541 -16.131 1.00 11.21 C ATOM 247 O GLU A 18 -14.913 1.065 -15.021 1.00 20.23 O ATOM 248 CB GLU A 18 -13.875 1.826 -18.021 1.00 41.12 C ATOM 249 CG GLU A 18 -13.756 3.171 -17.366 1.00 72.51 C ATOM 250 CD GLU A 18 -14.002 4.297 -18.335 1.00 22.15 C ATOM 251 OE1 GLU A 18 -13.071 4.695 -19.060 1.00 53.23 O ATOM 252 OE2 GLU A 18 -15.139 4.800 -18.392 1.00 23.42 O ATOM 0 H GLU A 18 -13.842 -0.498 -18.819 1.00 30.52 H new ATOM 0 HA GLU A 18 -12.806 0.796 -16.491 1.00 15.25 H new ATOM 0 HB2 GLU A 18 -13.123 1.752 -18.807 1.00 41.12 H new ATOM 0 HB3 GLU A 18 -14.850 1.757 -18.504 1.00 41.12 H new ATOM 0 HG2 GLU A 18 -14.469 3.238 -16.545 1.00 72.51 H new ATOM 0 HG3 GLU A 18 -12.761 3.276 -16.934 1.00 72.51 H new ATOM 259 N LEU A 19 -15.956 -0.174 -16.589 1.00 21.53 N ATOM 260 CA LEU A 19 -17.179 -0.370 -15.819 1.00 32.54 C ATOM 261 C LEU A 19 -17.033 -1.517 -14.828 1.00 74.31 C ATOM 262 O LEU A 19 -17.809 -1.639 -13.878 1.00 41.42 O ATOM 263 CB LEU A 19 -18.377 -0.639 -16.737 1.00 74.32 C ATOM 264 CG LEU A 19 -18.767 0.457 -17.741 1.00 34.23 C ATOM 265 CD1 LEU A 19 -18.975 1.806 -17.068 1.00 72.14 C ATOM 266 CD2 LEU A 19 -17.810 0.547 -18.924 1.00 50.11 C ATOM 0 H LEU A 19 -15.963 -0.630 -17.501 1.00 21.53 H new ATOM 0 HA LEU A 19 -17.357 0.552 -15.266 1.00 32.54 H new ATOM 0 HB2 LEU A 19 -18.172 -1.550 -17.298 1.00 74.32 H new ATOM 0 HB3 LEU A 19 -19.244 -0.841 -16.107 1.00 74.32 H new ATOM 0 HG LEU A 19 -19.730 0.157 -18.154 1.00 34.23 H new ATOM 0 HD11 LEU A 19 -19.249 2.548 -17.818 1.00 72.14 H new ATOM 0 HD12 LEU A 19 -19.772 1.725 -16.329 1.00 72.14 H new ATOM 0 HD13 LEU A 19 -18.053 2.112 -16.574 1.00 72.14 H new ATOM 0 HD21 LEU A 19 -18.138 1.339 -19.598 1.00 50.11 H new ATOM 0 HD22 LEU A 19 -16.806 0.770 -18.563 1.00 50.11 H new ATOM 0 HD23 LEU A 19 -17.801 -0.403 -19.458 1.00 50.11 H new ATOM 278 N LYS A 20 -16.055 -2.369 -15.065 1.00 33.43 N ATOM 279 CA LYS A 20 -15.770 -3.491 -14.170 1.00 25.24 C ATOM 280 C LYS A 20 -14.297 -3.597 -13.993 1.00 42.33 C ATOM 281 O LYS A 20 -13.648 -4.419 -14.641 1.00 50.21 O ATOM 282 CB LYS A 20 -16.282 -4.827 -14.707 1.00 71.31 C ATOM 283 CG LYS A 20 -17.760 -4.851 -15.058 1.00 72.41 C ATOM 284 CD LYS A 20 -18.195 -6.232 -15.489 1.00 12.04 C ATOM 285 CE LYS A 20 -19.666 -6.259 -15.863 1.00 44.22 C ATOM 286 NZ LYS A 20 -20.103 -7.607 -16.280 1.00 54.44 N ATOM 0 H LYS A 20 -15.436 -2.311 -15.874 1.00 33.43 H new ATOM 0 HA LYS A 20 -16.283 -3.292 -13.229 1.00 25.24 H new ATOM 0 HB2 LYS A 20 -15.708 -5.089 -15.596 1.00 71.31 H new ATOM 0 HB3 LYS A 20 -16.087 -5.600 -13.963 1.00 71.31 H new ATOM 0 HG2 LYS A 20 -18.347 -4.534 -14.196 1.00 72.41 H new ATOM 0 HG3 LYS A 20 -17.958 -4.138 -15.858 1.00 72.41 H new ATOM 0 HD2 LYS A 20 -17.596 -6.554 -16.341 1.00 12.04 H new ATOM 0 HD3 LYS A 20 -18.010 -6.941 -14.682 1.00 12.04 H new ATOM 0 HE2 LYS A 20 -20.263 -5.931 -15.012 1.00 44.22 H new ATOM 0 HE3 LYS A 20 -19.848 -5.552 -16.672 1.00 44.22 H new ATOM 0 HZ1 LYS A 20 -21.113 -7.584 -16.527 1.00 54.44 H new ATOM 0 HZ2 LYS A 20 -19.551 -7.910 -17.108 1.00 54.44 H new ATOM 0 HZ3 LYS A 20 -19.953 -8.277 -15.499 1.00 54.44 H new ATOM 300 N PRO A 21 -13.726 -2.743 -13.192 1.00 50.50 N ATOM 301 CA PRO A 21 -12.317 -2.759 -12.975 1.00 23.32 C ATOM 302 C PRO A 21 -11.906 -3.897 -12.067 1.00 43.01 C ATOM 303 O PRO A 21 -12.710 -4.412 -11.273 1.00 75.33 O ATOM 304 CB PRO A 21 -12.030 -1.402 -12.340 1.00 21.35 C ATOM 305 CG PRO A 21 -13.304 -1.011 -11.667 1.00 31.40 C ATOM 306 CD PRO A 21 -14.407 -1.661 -12.438 1.00 74.12 C ATOM 0 HA PRO A 21 -11.754 -2.917 -13.895 1.00 23.32 H new ATOM 0 HB2 PRO A 21 -11.210 -1.467 -11.625 1.00 21.35 H new ATOM 0 HB3 PRO A 21 -11.740 -0.668 -13.092 1.00 21.35 H new ATOM 0 HG2 PRO A 21 -13.311 -1.340 -10.628 1.00 31.40 H new ATOM 0 HG3 PRO A 21 -13.422 0.073 -11.659 1.00 31.40 H new ATOM 0 HD2 PRO A 21 -15.177 -2.058 -11.776 1.00 74.12 H new ATOM 0 HD3 PRO A 21 -14.897 -0.954 -13.108 1.00 74.12 H new ATOM 314 N LEU A 22 -10.684 -4.306 -12.203 1.00 65.42 N ATOM 315 CA LEU A 22 -10.127 -5.335 -11.367 1.00 73.21 C ATOM 316 C LEU A 22 -9.726 -4.705 -10.056 1.00 10.12 C ATOM 317 O LEU A 22 -9.928 -3.516 -9.872 1.00 15.12 O ATOM 318 CB LEU A 22 -8.935 -5.951 -12.070 1.00 24.01 C ATOM 319 CG LEU A 22 -9.248 -6.580 -13.425 1.00 11.10 C ATOM 320 CD1 LEU A 22 -7.991 -7.052 -14.084 1.00 14.44 C ATOM 321 CD2 LEU A 22 -10.230 -7.730 -13.278 1.00 52.12 C ATOM 0 H LEU A 22 -10.037 -3.937 -12.900 1.00 65.42 H new ATOM 0 HA LEU A 22 -10.852 -6.126 -11.175 1.00 73.21 H new ATOM 0 HB2 LEU A 22 -8.175 -5.182 -12.209 1.00 24.01 H new ATOM 0 HB3 LEU A 22 -8.503 -6.713 -11.422 1.00 24.01 H new ATOM 0 HG LEU A 22 -9.709 -5.818 -14.053 1.00 11.10 H new ATOM 0 HD11 LEU A 22 -8.231 -7.498 -15.049 1.00 14.44 H new ATOM 0 HD12 LEU A 22 -7.318 -6.207 -14.232 1.00 14.44 H new ATOM 0 HD13 LEU A 22 -7.506 -7.795 -13.452 1.00 14.44 H new ATOM 0 HD21 LEU A 22 -10.436 -8.160 -14.258 1.00 52.12 H new ATOM 0 HD22 LEU A 22 -9.801 -8.494 -12.629 1.00 52.12 H new ATOM 0 HD23 LEU A 22 -11.158 -7.362 -12.841 1.00 52.12 H new ATOM 333 N ARG A 23 -9.168 -5.449 -9.157 1.00 30.41 N ATOM 334 CA ARG A 23 -8.826 -4.866 -7.887 1.00 44.10 C ATOM 335 C ARG A 23 -7.351 -5.029 -7.631 1.00 53.43 C ATOM 336 O ARG A 23 -6.795 -4.446 -6.694 1.00 55.43 O ATOM 337 CB ARG A 23 -9.660 -5.483 -6.756 1.00 10.31 C ATOM 338 CG ARG A 23 -9.364 -6.924 -6.469 1.00 20.00 C ATOM 339 CD ARG A 23 -10.157 -7.461 -5.296 1.00 64.25 C ATOM 340 NE ARG A 23 -9.840 -6.804 -4.031 1.00 15.24 N ATOM 341 CZ ARG A 23 -9.269 -7.427 -2.979 1.00 32.31 C ATOM 342 NH1 ARG A 23 -8.774 -8.663 -3.115 1.00 11.21 N ATOM 343 NH2 ARG A 23 -9.163 -6.803 -1.811 1.00 41.34 N ATOM 0 H ARG A 23 -8.941 -6.437 -9.266 1.00 30.41 H new ATOM 0 HA ARG A 23 -9.057 -3.801 -7.915 1.00 44.10 H new ATOM 0 HB2 ARG A 23 -9.496 -4.905 -5.846 1.00 10.31 H new ATOM 0 HB3 ARG A 23 -10.716 -5.387 -7.009 1.00 10.31 H new ATOM 0 HG2 ARG A 23 -9.585 -7.519 -7.355 1.00 20.00 H new ATOM 0 HG3 ARG A 23 -8.299 -7.038 -6.265 1.00 20.00 H new ATOM 0 HD2 ARG A 23 -11.221 -7.342 -5.502 1.00 64.25 H new ATOM 0 HD3 ARG A 23 -9.968 -8.530 -5.199 1.00 64.25 H new ATOM 0 HE ARG A 23 -10.064 -5.813 -3.937 1.00 15.24 H new ATOM 0 HH11 ARG A 23 -8.828 -9.138 -4.016 1.00 11.21 H new ATOM 0 HH12 ARG A 23 -8.343 -9.130 -2.317 1.00 11.21 H new ATOM 0 HH21 ARG A 23 -9.514 -5.851 -1.708 1.00 41.34 H new ATOM 0 HH22 ARG A 23 -8.731 -7.276 -1.017 1.00 41.34 H new ATOM 357 N THR A 24 -6.719 -5.811 -8.465 1.00 75.22 N ATOM 358 CA THR A 24 -5.339 -6.069 -8.341 1.00 64.23 C ATOM 359 C THR A 24 -4.688 -5.940 -9.732 1.00 13.12 C ATOM 360 O THR A 24 -5.295 -6.298 -10.748 1.00 52.32 O ATOM 361 CB THR A 24 -5.149 -7.498 -7.785 1.00 20.33 C ATOM 362 OG1 THR A 24 -5.992 -7.674 -6.633 1.00 1.51 O ATOM 363 CG2 THR A 24 -3.736 -7.715 -7.353 1.00 63.35 C ATOM 0 H THR A 24 -7.166 -6.283 -9.251 1.00 75.22 H new ATOM 0 HA THR A 24 -4.871 -5.358 -7.660 1.00 64.23 H new ATOM 0 HB THR A 24 -5.405 -8.207 -8.573 1.00 20.33 H new ATOM 0 HG1 THR A 24 -6.458 -8.534 -6.697 1.00 1.51 H new ATOM 0 HG21 THR A 24 -3.626 -8.728 -6.965 1.00 63.35 H new ATOM 0 HG22 THR A 24 -3.070 -7.578 -8.205 1.00 63.35 H new ATOM 0 HG23 THR A 24 -3.480 -6.998 -6.573 1.00 63.35 H new ATOM 371 N LEU A 25 -3.462 -5.448 -9.769 1.00 14.34 N ATOM 372 CA LEU A 25 -2.741 -5.230 -11.022 1.00 3.11 C ATOM 373 C LEU A 25 -2.253 -6.574 -11.588 1.00 34.41 C ATOM 374 O LEU A 25 -1.977 -6.716 -12.785 1.00 72.44 O ATOM 375 CB LEU A 25 -1.597 -4.241 -10.773 1.00 31.13 C ATOM 376 CG LEU A 25 -0.733 -3.832 -11.958 1.00 40.21 C ATOM 377 CD1 LEU A 25 -1.586 -3.260 -13.086 1.00 52.12 C ATOM 378 CD2 LEU A 25 0.282 -2.806 -11.492 1.00 53.43 C ATOM 0 H LEU A 25 -2.935 -5.187 -8.936 1.00 14.34 H new ATOM 0 HA LEU A 25 -3.399 -4.794 -11.774 1.00 3.11 H new ATOM 0 HB2 LEU A 25 -2.026 -3.335 -10.345 1.00 31.13 H new ATOM 0 HB3 LEU A 25 -0.942 -4.672 -10.016 1.00 31.13 H new ATOM 0 HG LEU A 25 -0.219 -4.711 -12.347 1.00 40.21 H new ATOM 0 HD11 LEU A 25 -0.944 -2.976 -13.920 1.00 52.12 H new ATOM 0 HD12 LEU A 25 -2.301 -4.012 -13.419 1.00 52.12 H new ATOM 0 HD13 LEU A 25 -2.123 -2.382 -12.727 1.00 52.12 H new ATOM 0 HD21 LEU A 25 0.907 -2.505 -12.333 1.00 53.43 H new ATOM 0 HD22 LEU A 25 -0.238 -1.934 -11.096 1.00 53.43 H new ATOM 0 HD23 LEU A 25 0.907 -3.241 -10.712 1.00 53.43 H new ATOM 390 N TYR A 26 -2.191 -7.547 -10.700 1.00 42.52 N ATOM 391 CA TYR A 26 -1.855 -8.923 -11.006 1.00 20.40 C ATOM 392 C TYR A 26 -2.817 -9.489 -12.067 1.00 4.32 C ATOM 393 O TYR A 26 -2.375 -10.035 -13.077 1.00 51.32 O ATOM 394 CB TYR A 26 -1.998 -9.730 -9.699 1.00 43.34 C ATOM 395 CG TYR A 26 -1.723 -11.209 -9.792 1.00 61.23 C ATOM 396 CD1 TYR A 26 -2.720 -12.111 -10.131 1.00 34.13 C ATOM 397 CD2 TYR A 26 -0.473 -11.701 -9.534 1.00 74.45 C ATOM 398 CE1 TYR A 26 -2.462 -13.456 -10.204 1.00 22.54 C ATOM 399 CE2 TYR A 26 -0.211 -13.040 -9.610 1.00 52.13 C ATOM 400 CZ TYR A 26 -1.209 -13.916 -9.945 1.00 32.12 C ATOM 401 OH TYR A 26 -0.945 -15.258 -10.031 1.00 34.45 O ATOM 0 H TYR A 26 -2.380 -7.395 -9.709 1.00 42.52 H new ATOM 0 HA TYR A 26 -0.841 -8.986 -11.401 1.00 20.40 H new ATOM 0 HB2 TYR A 26 -1.323 -9.303 -8.958 1.00 43.34 H new ATOM 0 HB3 TYR A 26 -3.012 -9.594 -9.322 1.00 43.34 H new ATOM 0 HD1 TYR A 26 -3.716 -11.749 -10.341 1.00 34.13 H new ATOM 0 HD2 TYR A 26 0.321 -11.019 -9.266 1.00 74.45 H new ATOM 0 HE1 TYR A 26 -3.250 -14.146 -10.466 1.00 22.54 H new ATOM 0 HE2 TYR A 26 0.784 -13.408 -9.406 1.00 52.13 H new ATOM 0 HH TYR A 26 -0.374 -15.430 -10.809 1.00 34.45 H new ATOM 411 N GLN A 27 -4.123 -9.331 -11.853 1.00 65.12 N ATOM 412 CA GLN A 27 -5.101 -9.878 -12.787 1.00 71.53 C ATOM 413 C GLN A 27 -5.070 -9.136 -14.133 1.00 43.12 C ATOM 414 O GLN A 27 -5.291 -9.740 -15.176 1.00 32.02 O ATOM 415 CB GLN A 27 -6.523 -9.944 -12.169 1.00 0.11 C ATOM 416 CG GLN A 27 -7.634 -10.429 -13.128 1.00 14.04 C ATOM 417 CD GLN A 27 -7.372 -11.800 -13.753 1.00 22.33 C ATOM 418 OE1 GLN A 27 -7.857 -11.972 -14.960 1.00 73.34 O flip ATOM 419 NE2 GLN A 27 -6.736 -12.673 -13.164 1.00 34.31 N flip ATOM 0 H GLN A 27 -4.522 -8.837 -11.055 1.00 65.12 H new ATOM 0 HA GLN A 27 -4.815 -10.910 -12.993 1.00 71.53 H new ATOM 0 HB2 GLN A 27 -6.496 -10.607 -11.305 1.00 0.11 H new ATOM 0 HB3 GLN A 27 -6.789 -8.953 -11.802 1.00 0.11 H new ATOM 0 HG2 GLN A 27 -8.577 -10.465 -12.583 1.00 14.04 H new ATOM 0 HG3 GLN A 27 -7.755 -9.696 -13.926 1.00 14.04 H new ATOM 0 HE21 GLN A 27 -6.377 -12.497 -12.226 1.00 34.31 H new ATOM 0 HE22 GLN A 27 -6.568 -13.573 -13.614 1.00 34.31 H new ATOM 428 N ALA A 28 -4.753 -7.842 -14.103 1.00 52.23 N ATOM 429 CA ALA A 28 -4.624 -7.039 -15.305 1.00 24.24 C ATOM 430 C ALA A 28 -3.553 -7.628 -16.217 1.00 3.33 C ATOM 431 O ALA A 28 -3.701 -7.671 -17.450 1.00 0.40 O ATOM 432 CB ALA A 28 -4.295 -5.603 -14.930 1.00 53.13 C ATOM 0 H ALA A 28 -4.579 -7.326 -13.240 1.00 52.23 H new ATOM 0 HA ALA A 28 -5.569 -7.045 -15.848 1.00 24.24 H new ATOM 0 HB1 ALA A 28 -4.199 -5.003 -15.835 1.00 53.13 H new ATOM 0 HB2 ALA A 28 -5.093 -5.197 -14.309 1.00 53.13 H new ATOM 0 HB3 ALA A 28 -3.356 -5.577 -14.377 1.00 53.13 H new ATOM 438 N MET A 29 -2.493 -8.097 -15.610 1.00 72.32 N ATOM 439 CA MET A 29 -1.453 -8.757 -16.316 1.00 63.55 C ATOM 440 C MET A 29 -1.871 -10.121 -16.841 1.00 41.35 C ATOM 441 O MET A 29 -1.407 -10.529 -17.884 1.00 15.21 O ATOM 442 CB MET A 29 -0.177 -8.841 -15.509 1.00 1.15 C ATOM 443 CG MET A 29 0.626 -7.555 -15.472 1.00 42.23 C ATOM 444 SD MET A 29 2.169 -7.766 -14.640 1.00 62.42 S ATOM 445 CE MET A 29 2.921 -6.232 -15.066 1.00 35.44 C ATOM 0 H MET A 29 -2.337 -8.025 -14.605 1.00 72.32 H new ATOM 0 HA MET A 29 -1.245 -8.137 -17.188 1.00 63.55 H new ATOM 0 HB2 MET A 29 -0.426 -9.129 -14.488 1.00 1.15 H new ATOM 0 HB3 MET A 29 0.448 -9.634 -15.921 1.00 1.15 H new ATOM 0 HG2 MET A 29 0.807 -7.210 -16.490 1.00 42.23 H new ATOM 0 HG3 MET A 29 0.047 -6.779 -14.971 1.00 42.23 H new ATOM 0 HE1 MET A 29 4.001 -6.363 -15.136 1.00 35.44 H new ATOM 0 HE2 MET A 29 2.534 -5.891 -16.026 1.00 35.44 H new ATOM 0 HE3 MET A 29 2.694 -5.491 -14.300 1.00 35.44 H new ATOM 455 N ILE A 30 -2.747 -10.817 -16.131 1.00 52.44 N ATOM 456 CA ILE A 30 -3.223 -12.133 -16.596 1.00 41.01 C ATOM 457 C ILE A 30 -4.176 -11.961 -17.782 1.00 55.12 C ATOM 458 O ILE A 30 -4.184 -12.769 -18.710 1.00 2.24 O ATOM 459 CB ILE A 30 -3.962 -12.938 -15.495 1.00 61.40 C ATOM 460 CG1 ILE A 30 -3.119 -13.041 -14.232 1.00 25.13 C ATOM 461 CG2 ILE A 30 -4.289 -14.343 -16.005 1.00 20.35 C ATOM 462 CD1 ILE A 30 -3.761 -13.861 -13.159 1.00 50.01 C ATOM 0 H ILE A 30 -3.144 -10.508 -15.243 1.00 52.44 H new ATOM 0 HA ILE A 30 -2.332 -12.691 -16.884 1.00 41.01 H new ATOM 0 HB ILE A 30 -4.885 -12.410 -15.254 1.00 61.40 H new ATOM 0 HG12 ILE A 30 -2.152 -13.477 -14.483 1.00 25.13 H new ATOM 0 HG13 ILE A 30 -2.927 -12.039 -13.848 1.00 25.13 H new ATOM 0 HG21 ILE A 30 -4.808 -14.901 -15.226 1.00 20.35 H new ATOM 0 HG22 ILE A 30 -4.927 -14.271 -16.886 1.00 20.35 H new ATOM 0 HG23 ILE A 30 -3.365 -14.859 -16.267 1.00 20.35 H new ATOM 0 HD11 ILE A 30 -3.108 -13.894 -12.287 1.00 50.01 H new ATOM 0 HD12 ILE A 30 -4.715 -13.414 -12.881 1.00 50.01 H new ATOM 0 HD13 ILE A 30 -3.928 -14.874 -13.526 1.00 50.01 H new ATOM 474 N ILE A 31 -4.980 -10.909 -17.727 1.00 21.02 N ATOM 475 CA ILE A 31 -5.917 -10.582 -18.790 1.00 23.50 C ATOM 476 C ILE A 31 -5.163 -10.370 -20.108 1.00 71.33 C ATOM 477 O ILE A 31 -5.561 -10.873 -21.170 1.00 20.12 O ATOM 478 CB ILE A 31 -6.703 -9.262 -18.462 1.00 72.12 C ATOM 479 CG1 ILE A 31 -7.596 -9.399 -17.224 1.00 43.52 C ATOM 480 CG2 ILE A 31 -7.557 -8.867 -19.629 1.00 44.20 C ATOM 481 CD1 ILE A 31 -8.782 -10.330 -17.413 1.00 20.12 C ATOM 0 H ILE A 31 -5.000 -10.258 -16.942 1.00 21.02 H new ATOM 0 HA ILE A 31 -6.617 -11.412 -18.878 1.00 23.50 H new ATOM 0 HB ILE A 31 -5.954 -8.497 -18.256 1.00 72.12 H new ATOM 0 HG12 ILE A 31 -6.992 -9.762 -16.392 1.00 43.52 H new ATOM 0 HG13 ILE A 31 -7.964 -8.412 -16.944 1.00 43.52 H new ATOM 0 HG21 ILE A 31 -8.097 -7.951 -19.391 1.00 44.20 H new ATOM 0 HG22 ILE A 31 -6.926 -8.699 -20.502 1.00 44.20 H new ATOM 0 HG23 ILE A 31 -8.270 -9.663 -19.844 1.00 44.20 H new ATOM 0 HD11 ILE A 31 -9.363 -10.371 -16.491 1.00 20.12 H new ATOM 0 HD12 ILE A 31 -9.411 -9.958 -18.222 1.00 20.12 H new ATOM 0 HD13 ILE A 31 -8.424 -11.329 -17.662 1.00 20.12 H new ATOM 493 N THR A 32 -4.071 -9.656 -20.018 1.00 1.05 N ATOM 494 CA THR A 32 -3.329 -9.253 -21.174 1.00 61.24 C ATOM 495 C THR A 32 -2.204 -10.240 -21.551 1.00 64.23 C ATOM 496 O THR A 32 -1.971 -10.502 -22.737 1.00 73.24 O ATOM 497 CB THR A 32 -2.746 -7.843 -20.942 1.00 55.22 C ATOM 498 OG1 THR A 32 -1.935 -7.852 -19.745 1.00 54.33 O ATOM 499 CG2 THR A 32 -3.866 -6.823 -20.764 1.00 22.55 C ATOM 0 H THR A 32 -3.673 -9.338 -19.134 1.00 1.05 H new ATOM 0 HA THR A 32 -4.022 -9.244 -22.015 1.00 61.24 H new ATOM 0 HB THR A 32 -2.145 -7.569 -21.809 1.00 55.22 H new ATOM 0 HG1 THR A 32 -2.510 -7.742 -18.959 1.00 54.33 H new ATOM 0 HG21 THR A 32 -3.436 -5.835 -20.602 1.00 22.55 H new ATOM 0 HG22 THR A 32 -4.488 -6.805 -21.659 1.00 22.55 H new ATOM 0 HG23 THR A 32 -4.476 -7.099 -19.904 1.00 22.55 H new ATOM 507 N LYS A 33 -1.502 -10.765 -20.528 1.00 20.21 N ATOM 508 CA LYS A 33 -0.331 -11.666 -20.684 1.00 21.15 C ATOM 509 C LYS A 33 0.832 -10.964 -21.375 1.00 60.15 C ATOM 510 O LYS A 33 1.811 -11.582 -21.771 1.00 21.22 O ATOM 511 CB LYS A 33 -0.681 -12.987 -21.392 1.00 14.14 C ATOM 512 CG LYS A 33 -1.589 -13.899 -20.586 1.00 4.03 C ATOM 513 CD LYS A 33 -1.833 -15.211 -21.309 1.00 23.22 C ATOM 514 CE LYS A 33 -2.670 -16.161 -20.470 1.00 70.24 C ATOM 515 NZ LYS A 33 -2.911 -17.445 -21.162 1.00 23.11 N ATOM 0 H LYS A 33 -1.732 -10.575 -19.553 1.00 20.21 H new ATOM 0 HA LYS A 33 -0.015 -11.927 -19.674 1.00 21.15 H new ATOM 0 HB2 LYS A 33 -1.163 -12.761 -22.343 1.00 14.14 H new ATOM 0 HB3 LYS A 33 0.242 -13.520 -21.621 1.00 14.14 H new ATOM 0 HG2 LYS A 33 -1.140 -14.096 -19.613 1.00 4.03 H new ATOM 0 HG3 LYS A 33 -2.540 -13.399 -20.403 1.00 4.03 H new ATOM 0 HD2 LYS A 33 -2.338 -15.018 -22.255 1.00 23.22 H new ATOM 0 HD3 LYS A 33 -0.878 -15.679 -21.548 1.00 23.22 H new ATOM 0 HE2 LYS A 33 -2.165 -16.349 -19.523 1.00 70.24 H new ATOM 0 HE3 LYS A 33 -3.625 -15.691 -20.234 1.00 70.24 H new ATOM 0 HZ1 LYS A 33 -3.486 -18.064 -20.555 1.00 23.11 H new ATOM 0 HZ2 LYS A 33 -3.416 -17.269 -22.054 1.00 23.11 H new ATOM 0 HZ3 LYS A 33 -2.001 -17.906 -21.364 1.00 23.11 H new ATOM 529 N SER A 34 0.735 -9.662 -21.467 1.00 34.33 N ATOM 530 CA SER A 34 1.743 -8.877 -22.121 1.00 50.55 C ATOM 531 C SER A 34 2.718 -8.301 -21.109 1.00 1.23 C ATOM 532 O SER A 34 3.797 -7.844 -21.471 1.00 45.41 O ATOM 533 CB SER A 34 1.061 -7.764 -22.883 1.00 63.43 C ATOM 534 OG SER A 34 0.068 -8.307 -23.731 1.00 53.12 O ATOM 0 H SER A 34 -0.043 -9.121 -21.091 1.00 34.33 H new ATOM 0 HA SER A 34 2.310 -9.507 -22.806 1.00 50.55 H new ATOM 0 HB2 SER A 34 0.611 -7.056 -22.187 1.00 63.43 H new ATOM 0 HB3 SER A 34 1.793 -7.211 -23.472 1.00 63.43 H new ATOM 0 HG SER A 34 -0.374 -7.583 -24.223 1.00 53.12 H new ATOM 540 N SER A 35 2.310 -8.315 -19.827 1.00 52.05 N ATOM 541 CA SER A 35 3.090 -7.774 -18.676 1.00 33.24 C ATOM 542 C SER A 35 3.433 -6.266 -18.798 1.00 71.14 C ATOM 543 O SER A 35 4.043 -5.686 -17.913 1.00 54.40 O ATOM 544 CB SER A 35 4.342 -8.639 -18.358 1.00 72.40 C ATOM 545 OG SER A 35 5.208 -8.801 -19.480 1.00 22.13 O ATOM 0 H SER A 35 1.412 -8.709 -19.546 1.00 52.05 H new ATOM 0 HA SER A 35 2.421 -7.844 -17.818 1.00 33.24 H new ATOM 0 HB2 SER A 35 4.897 -8.178 -17.541 1.00 72.40 H new ATOM 0 HB3 SER A 35 4.020 -9.620 -18.010 1.00 72.40 H new ATOM 0 HG SER A 35 4.942 -8.180 -20.190 1.00 22.13 H new ATOM 551 N LYS A 36 2.999 -5.657 -19.879 1.00 24.41 N ATOM 552 CA LYS A 36 3.237 -4.294 -20.198 1.00 74.35 C ATOM 553 C LYS A 36 2.114 -3.892 -21.101 1.00 75.13 C ATOM 554 O LYS A 36 1.516 -4.744 -21.779 1.00 60.51 O ATOM 555 CB LYS A 36 4.571 -4.107 -20.955 1.00 44.31 C ATOM 556 CG LYS A 36 5.813 -4.592 -20.227 1.00 25.41 C ATOM 557 CD LYS A 36 7.056 -4.383 -21.056 1.00 2.22 C ATOM 558 CE LYS A 36 8.275 -4.954 -20.365 1.00 12.11 C ATOM 559 NZ LYS A 36 9.503 -4.756 -21.159 1.00 35.01 N ATOM 0 H LYS A 36 2.443 -6.137 -20.587 1.00 24.41 H new ATOM 0 HA LYS A 36 3.295 -3.697 -19.288 1.00 74.35 H new ATOM 0 HB2 LYS A 36 4.503 -4.630 -21.909 1.00 44.31 H new ATOM 0 HB3 LYS A 36 4.694 -3.048 -21.181 1.00 44.31 H new ATOM 0 HG2 LYS A 36 5.912 -4.061 -19.280 1.00 25.41 H new ATOM 0 HG3 LYS A 36 5.707 -5.650 -19.989 1.00 25.41 H new ATOM 0 HD2 LYS A 36 6.931 -4.857 -22.030 1.00 2.22 H new ATOM 0 HD3 LYS A 36 7.202 -3.318 -21.236 1.00 2.22 H new ATOM 0 HE2 LYS A 36 8.394 -4.482 -19.390 1.00 12.11 H new ATOM 0 HE3 LYS A 36 8.126 -6.019 -20.187 1.00 12.11 H new ATOM 0 HZ1 LYS A 36 10.314 -5.161 -20.650 1.00 35.01 H new ATOM 0 HZ2 LYS A 36 9.401 -5.228 -22.080 1.00 35.01 H new ATOM 0 HZ3 LYS A 36 9.660 -3.739 -21.307 1.00 35.01 H new ATOM 573 N GLY A 37 1.823 -2.674 -21.102 1.00 75.12 N ATOM 574 CA GLY A 37 0.768 -2.134 -21.897 1.00 71.44 C ATOM 575 C GLY A 37 0.214 -0.956 -21.196 1.00 2.33 C ATOM 576 O GLY A 37 0.936 -0.306 -20.428 1.00 70.33 O ATOM 0 H GLY A 37 2.314 -1.979 -20.539 1.00 75.12 H new ATOM 0 HA2 GLY A 37 1.141 -1.849 -22.881 1.00 71.44 H new ATOM 0 HA3 GLY A 37 -0.009 -2.882 -22.055 1.00 71.44 H new ATOM 580 N ASP A 38 -1.028 -0.653 -21.403 1.00 33.13 N ATOM 581 CA ASP A 38 -1.576 0.448 -20.684 1.00 3.25 C ATOM 582 C ASP A 38 -2.523 -0.075 -19.646 1.00 3.33 C ATOM 583 O ASP A 38 -3.564 -0.643 -19.955 1.00 72.22 O ATOM 584 CB ASP A 38 -2.258 1.456 -21.609 1.00 40.51 C ATOM 585 CG ASP A 38 -2.578 2.766 -20.897 1.00 43.35 C ATOM 586 OD1 ASP A 38 -1.628 3.395 -20.334 1.00 53.40 O ATOM 587 OD2 ASP A 38 -3.741 3.211 -20.932 1.00 73.13 O ATOM 0 H ASP A 38 -1.662 -1.134 -22.041 1.00 33.13 H new ATOM 0 HA ASP A 38 -0.765 0.989 -20.196 1.00 3.25 H new ATOM 0 HB2 ASP A 38 -1.612 1.657 -22.464 1.00 40.51 H new ATOM 0 HB3 ASP A 38 -3.179 1.023 -22.000 1.00 40.51 H new ATOM 592 N PHE A 39 -2.142 0.085 -18.427 1.00 55.44 N ATOM 593 CA PHE A 39 -2.940 -0.335 -17.319 1.00 32.20 C ATOM 594 C PHE A 39 -3.291 0.895 -16.531 1.00 3.52 C ATOM 595 O PHE A 39 -2.401 1.702 -16.214 1.00 2.42 O ATOM 596 CB PHE A 39 -2.169 -1.336 -16.432 1.00 30.43 C ATOM 597 CG PHE A 39 -1.691 -2.579 -17.153 1.00 33.41 C ATOM 598 CD1 PHE A 39 -2.583 -3.556 -17.532 1.00 21.54 C ATOM 599 CD2 PHE A 39 -0.343 -2.770 -17.438 1.00 50.12 C ATOM 600 CE1 PHE A 39 -2.154 -4.696 -18.185 1.00 45.32 C ATOM 601 CE2 PHE A 39 0.090 -3.907 -18.090 1.00 13.20 C ATOM 602 CZ PHE A 39 -0.817 -4.869 -18.464 1.00 61.12 C ATOM 0 H PHE A 39 -1.256 0.517 -18.163 1.00 55.44 H new ATOM 0 HA PHE A 39 -3.839 -0.841 -17.672 1.00 32.20 H new ATOM 0 HB2 PHE A 39 -1.307 -0.829 -15.999 1.00 30.43 H new ATOM 0 HB3 PHE A 39 -2.811 -1.636 -15.604 1.00 30.43 H new ATOM 0 HD1 PHE A 39 -3.634 -3.430 -17.316 1.00 21.54 H new ATOM 0 HD2 PHE A 39 0.375 -2.018 -17.145 1.00 50.12 H new ATOM 0 HE1 PHE A 39 -2.868 -5.452 -18.477 1.00 45.32 H new ATOM 0 HE2 PHE A 39 1.140 -4.040 -18.306 1.00 13.20 H new ATOM 0 HZ PHE A 39 -0.482 -5.759 -18.976 1.00 61.12 H new ATOM 612 N LEU A 40 -4.540 1.076 -16.235 1.00 23.53 N ATOM 613 CA LEU A 40 -4.957 2.259 -15.525 1.00 13.54 C ATOM 614 C LEU A 40 -5.568 1.895 -14.211 1.00 34.12 C ATOM 615 O LEU A 40 -6.521 1.129 -14.148 1.00 21.13 O ATOM 616 CB LEU A 40 -5.935 3.097 -16.342 1.00 63.44 C ATOM 617 CG LEU A 40 -5.442 3.610 -17.699 1.00 5.22 C ATOM 618 CD1 LEU A 40 -6.528 4.407 -18.387 1.00 31.24 C ATOM 619 CD2 LEU A 40 -4.197 4.459 -17.531 1.00 13.10 C ATOM 0 H LEU A 40 -5.291 0.427 -16.470 1.00 23.53 H new ATOM 0 HA LEU A 40 -4.066 2.862 -15.351 1.00 13.54 H new ATOM 0 HB2 LEU A 40 -6.833 2.503 -16.510 1.00 63.44 H new ATOM 0 HB3 LEU A 40 -6.230 3.957 -15.741 1.00 63.44 H new ATOM 0 HG LEU A 40 -5.192 2.749 -18.319 1.00 5.22 H new ATOM 0 HD11 LEU A 40 -6.162 4.765 -19.350 1.00 31.24 H new ATOM 0 HD12 LEU A 40 -7.401 3.773 -18.543 1.00 31.24 H new ATOM 0 HD13 LEU A 40 -6.804 5.258 -17.765 1.00 31.24 H new ATOM 0 HD21 LEU A 40 -3.864 4.813 -18.507 1.00 13.10 H new ATOM 0 HD22 LEU A 40 -4.423 5.313 -16.893 1.00 13.10 H new ATOM 0 HD23 LEU A 40 -3.409 3.862 -17.073 1.00 13.10 H new ATOM 631 N ILE A 41 -5.028 2.436 -13.168 1.00 15.45 N ATOM 632 CA ILE A 41 -5.491 2.154 -11.853 1.00 13.51 C ATOM 633 C ILE A 41 -6.165 3.380 -11.277 1.00 72.51 C ATOM 634 O ILE A 41 -5.676 4.493 -11.434 1.00 25.42 O ATOM 635 CB ILE A 41 -4.342 1.670 -10.929 1.00 53.03 C ATOM 636 CG1 ILE A 41 -3.646 0.456 -11.585 1.00 72.34 C ATOM 637 CG2 ILE A 41 -4.881 1.322 -9.540 1.00 32.14 C ATOM 638 CD1 ILE A 41 -2.689 -0.306 -10.707 1.00 3.44 C ATOM 0 H ILE A 41 -4.247 3.091 -13.207 1.00 15.45 H new ATOM 0 HA ILE A 41 -6.215 1.341 -11.913 1.00 13.51 H new ATOM 0 HB ILE A 41 -3.611 2.468 -10.801 1.00 53.03 H new ATOM 0 HG12 ILE A 41 -4.414 -0.233 -11.936 1.00 72.34 H new ATOM 0 HG13 ILE A 41 -3.104 0.804 -12.464 1.00 72.34 H new ATOM 0 HG21 ILE A 41 -4.061 0.985 -8.906 1.00 32.14 H new ATOM 0 HG22 ILE A 41 -5.343 2.205 -9.097 1.00 32.14 H new ATOM 0 HG23 ILE A 41 -5.623 0.529 -9.626 1.00 32.14 H new ATOM 0 HD11 ILE A 41 -2.260 -1.135 -11.270 1.00 3.44 H new ATOM 0 HD12 ILE A 41 -1.891 0.359 -10.376 1.00 3.44 H new ATOM 0 HD13 ILE A 41 -3.222 -0.694 -9.839 1.00 3.44 H new ATOM 650 N ARG A 42 -7.298 3.174 -10.650 1.00 41.22 N ATOM 651 CA ARG A 42 -8.062 4.248 -10.062 1.00 33.21 C ATOM 652 C ARG A 42 -7.283 4.816 -8.894 1.00 32.23 C ATOM 653 O ARG A 42 -6.804 4.082 -8.028 1.00 24.41 O ATOM 654 CB ARG A 42 -9.405 3.728 -9.582 1.00 71.51 C ATOM 655 CG ARG A 42 -10.468 4.788 -9.254 1.00 2.14 C ATOM 656 CD ARG A 42 -10.910 5.550 -10.505 1.00 72.54 C ATOM 657 NE ARG A 42 -12.255 6.111 -10.383 1.00 74.52 N ATOM 658 CZ ARG A 42 -12.924 6.735 -11.373 1.00 15.41 C ATOM 659 NH1 ARG A 42 -12.405 6.810 -12.595 1.00 13.50 N ATOM 660 NH2 ARG A 42 -14.115 7.260 -11.135 1.00 34.13 N ATOM 0 H ARG A 42 -7.718 2.252 -10.533 1.00 41.22 H new ATOM 0 HA ARG A 42 -8.236 5.026 -10.805 1.00 33.21 H new ATOM 0 HB2 ARG A 42 -9.808 3.065 -10.347 1.00 71.51 H new ATOM 0 HB3 ARG A 42 -9.239 3.123 -8.691 1.00 71.51 H new ATOM 0 HG2 ARG A 42 -11.332 4.307 -8.796 1.00 2.14 H new ATOM 0 HG3 ARG A 42 -10.069 5.490 -8.522 1.00 2.14 H new ATOM 0 HD2 ARG A 42 -10.202 6.355 -10.703 1.00 72.54 H new ATOM 0 HD3 ARG A 42 -10.878 4.879 -11.363 1.00 72.54 H new ATOM 0 HE ARG A 42 -12.722 6.023 -9.481 1.00 74.52 H new ATOM 0 HH11 ARG A 42 -11.494 6.394 -12.789 1.00 13.50 H new ATOM 0 HH12 ARG A 42 -12.918 7.284 -13.339 1.00 13.50 H new ATOM 0 HH21 ARG A 42 -14.525 7.192 -10.204 1.00 34.13 H new ATOM 0 HH22 ARG A 42 -14.623 7.733 -11.883 1.00 34.13 H new ATOM 674 N THR A 43 -7.145 6.076 -8.897 1.00 45.32 N ATOM 675 CA THR A 43 -6.420 6.781 -7.902 1.00 2.11 C ATOM 676 C THR A 43 -7.253 7.973 -7.511 1.00 11.23 C ATOM 677 O THR A 43 -8.090 8.414 -8.295 1.00 71.05 O ATOM 678 CB THR A 43 -5.022 7.250 -8.442 1.00 71.52 C ATOM 679 OG1 THR A 43 -4.208 7.759 -7.376 1.00 65.33 O ATOM 680 CG2 THR A 43 -5.171 8.340 -9.493 1.00 33.25 C ATOM 0 H THR A 43 -7.545 6.679 -9.616 1.00 45.32 H new ATOM 0 HA THR A 43 -6.230 6.134 -7.045 1.00 2.11 H new ATOM 0 HB THR A 43 -4.547 6.377 -8.890 1.00 71.52 H new ATOM 0 HG1 THR A 43 -3.341 8.044 -7.734 1.00 65.33 H new ATOM 0 HG21 THR A 43 -4.185 8.642 -9.846 1.00 33.25 H new ATOM 0 HG22 THR A 43 -5.756 7.960 -10.331 1.00 33.25 H new ATOM 0 HG23 THR A 43 -5.679 9.200 -9.056 1.00 33.25 H new ATOM 688 N LYS A 44 -7.079 8.472 -6.335 1.00 42.33 N ATOM 689 CA LYS A 44 -7.764 9.669 -5.987 1.00 54.21 C ATOM 690 C LYS A 44 -6.799 10.813 -5.951 1.00 53.30 C ATOM 691 O LYS A 44 -5.923 10.911 -5.084 1.00 53.15 O ATOM 692 CB LYS A 44 -8.662 9.574 -4.710 1.00 64.00 C ATOM 693 CG LYS A 44 -8.072 8.869 -3.481 1.00 3.13 C ATOM 694 CD LYS A 44 -8.086 7.348 -3.650 1.00 4.01 C ATOM 695 CE LYS A 44 -7.560 6.634 -2.420 1.00 30.34 C ATOM 696 NZ LYS A 44 -7.638 5.170 -2.570 1.00 60.31 N ATOM 0 H LYS A 44 -6.479 8.078 -5.610 1.00 42.33 H new ATOM 0 HA LYS A 44 -8.494 9.852 -6.775 1.00 54.21 H new ATOM 0 HB2 LYS A 44 -8.938 10.587 -4.417 1.00 64.00 H new ATOM 0 HB3 LYS A 44 -9.583 9.059 -4.984 1.00 64.00 H new ATOM 0 HG2 LYS A 44 -7.049 9.209 -3.320 1.00 3.13 H new ATOM 0 HG3 LYS A 44 -8.642 9.143 -2.593 1.00 3.13 H new ATOM 0 HD2 LYS A 44 -9.104 7.015 -3.855 1.00 4.01 H new ATOM 0 HD3 LYS A 44 -7.481 7.074 -4.514 1.00 4.01 H new ATOM 0 HE2 LYS A 44 -6.526 6.928 -2.242 1.00 30.34 H new ATOM 0 HE3 LYS A 44 -8.134 6.942 -1.546 1.00 30.34 H new ATOM 0 HZ1 LYS A 44 -6.998 4.716 -1.887 1.00 60.31 H new ATOM 0 HZ2 LYS A 44 -8.613 4.854 -2.394 1.00 60.31 H new ATOM 0 HZ3 LYS A 44 -7.357 4.905 -3.536 1.00 60.31 H new ATOM 710 N LYS A 45 -6.965 11.661 -6.927 1.00 72.10 N ATOM 711 CA LYS A 45 -6.119 12.785 -7.173 1.00 53.54 C ATOM 712 C LYS A 45 -7.003 14.010 -7.236 1.00 51.50 C ATOM 713 O LYS A 45 -8.047 13.979 -7.904 1.00 30.25 O ATOM 714 CB LYS A 45 -5.394 12.582 -8.518 1.00 51.34 C ATOM 715 CG LYS A 45 -4.391 13.643 -8.876 1.00 62.23 C ATOM 716 CD LYS A 45 -3.699 13.298 -10.182 1.00 32.12 C ATOM 717 CE LYS A 45 -2.795 12.071 -10.077 1.00 64.21 C ATOM 718 NZ LYS A 45 -2.082 11.807 -11.351 1.00 0.12 N ATOM 0 H LYS A 45 -7.728 11.580 -7.599 1.00 72.10 H new ATOM 0 HA LYS A 45 -5.371 12.900 -6.388 1.00 53.54 H new ATOM 0 HB2 LYS A 45 -4.886 11.618 -8.496 1.00 51.34 H new ATOM 0 HB3 LYS A 45 -6.141 12.530 -9.310 1.00 51.34 H new ATOM 0 HG2 LYS A 45 -4.889 14.608 -8.965 1.00 62.23 H new ATOM 0 HG3 LYS A 45 -3.653 13.738 -8.080 1.00 62.23 H new ATOM 0 HD2 LYS A 45 -4.452 13.122 -10.950 1.00 32.12 H new ATOM 0 HD3 LYS A 45 -3.105 14.152 -10.508 1.00 32.12 H new ATOM 0 HE2 LYS A 45 -2.069 12.220 -9.278 1.00 64.21 H new ATOM 0 HE3 LYS A 45 -3.392 11.200 -9.807 1.00 64.21 H new ATOM 0 HZ1 LYS A 45 -1.613 10.880 -11.301 1.00 0.12 H new ATOM 0 HZ2 LYS A 45 -2.763 11.808 -12.137 1.00 0.12 H new ATOM 0 HZ3 LYS A 45 -1.369 12.547 -11.510 1.00 0.12 H new ATOM 732 N ASP A 46 -6.610 15.069 -6.525 1.00 0.00 N ATOM 733 CA ASP A 46 -7.405 16.321 -6.420 1.00 24.40 C ATOM 734 C ASP A 46 -8.749 15.985 -5.734 1.00 64.02 C ATOM 735 O ASP A 46 -9.765 16.640 -5.924 1.00 4.31 O ATOM 736 CB ASP A 46 -7.606 16.941 -7.852 1.00 75.03 C ATOM 737 CG ASP A 46 -8.344 18.285 -7.891 1.00 33.24 C ATOM 738 OD1 ASP A 46 -7.794 19.294 -7.405 1.00 13.10 O ATOM 739 OD2 ASP A 46 -9.478 18.350 -8.435 1.00 50.35 O ATOM 0 H ASP A 46 -5.735 15.095 -6.002 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.886 17.067 -5.818 1.00 24.40 H new ATOM 0 HB2 ASP A 46 -6.627 17.070 -8.314 1.00 75.03 H new ATOM 0 HB3 ASP A 46 -8.156 16.226 -8.465 1.00 75.03 H new ATOM 744 N GLY A 47 -8.683 14.973 -4.853 1.00 41.45 N ATOM 745 CA GLY A 47 -9.841 14.514 -4.085 1.00 31.51 C ATOM 746 C GLY A 47 -10.900 13.826 -4.938 1.00 12.14 C ATOM 747 O GLY A 47 -12.044 13.671 -4.512 1.00 1.21 O ATOM 0 H GLY A 47 -7.826 14.455 -4.657 1.00 41.45 H new ATOM 0 HA2 GLY A 47 -9.504 13.824 -3.311 1.00 31.51 H new ATOM 0 HA3 GLY A 47 -10.292 15.367 -3.577 1.00 31.51 H new ATOM 751 N LYS A 48 -10.518 13.427 -6.134 1.00 71.43 N ATOM 752 CA LYS A 48 -11.427 12.807 -7.089 1.00 22.30 C ATOM 753 C LYS A 48 -10.790 11.525 -7.600 1.00 11.23 C ATOM 754 O LYS A 48 -9.567 11.453 -7.712 1.00 33.11 O ATOM 755 CB LYS A 48 -11.633 13.792 -8.237 1.00 62.31 C ATOM 756 CG LYS A 48 -12.165 15.127 -7.758 1.00 42.44 C ATOM 757 CD LYS A 48 -12.050 16.206 -8.799 1.00 61.31 C ATOM 758 CE LYS A 48 -12.496 17.532 -8.219 1.00 41.02 C ATOM 759 NZ LYS A 48 -12.254 18.655 -9.138 1.00 4.22 N ATOM 0 H LYS A 48 -9.562 13.522 -6.477 1.00 71.43 H new ATOM 0 HA LYS A 48 -12.387 12.567 -6.632 1.00 22.30 H new ATOM 0 HB2 LYS A 48 -10.687 13.945 -8.756 1.00 62.31 H new ATOM 0 HB3 LYS A 48 -12.328 13.364 -8.960 1.00 62.31 H new ATOM 0 HG2 LYS A 48 -13.211 15.015 -7.471 1.00 42.44 H new ATOM 0 HG3 LYS A 48 -11.620 15.431 -6.864 1.00 42.44 H new ATOM 0 HD2 LYS A 48 -11.020 16.280 -9.147 1.00 61.31 H new ATOM 0 HD3 LYS A 48 -12.662 15.954 -9.665 1.00 61.31 H new ATOM 0 HE2 LYS A 48 -13.559 17.483 -7.982 1.00 41.02 H new ATOM 0 HE3 LYS A 48 -11.968 17.712 -7.282 1.00 41.02 H new ATOM 0 HZ1 LYS A 48 -12.780 19.491 -8.811 1.00 4.22 H new ATOM 0 HZ2 LYS A 48 -11.237 18.872 -9.160 1.00 4.22 H new ATOM 0 HZ3 LYS A 48 -12.574 18.397 -10.093 1.00 4.22 H new ATOM 773 N GLN A 49 -11.579 10.527 -7.898 1.00 62.21 N ATOM 774 CA GLN A 49 -11.048 9.298 -8.371 1.00 35.54 C ATOM 775 C GLN A 49 -10.913 9.344 -9.875 1.00 63.11 C ATOM 776 O GLN A 49 -11.871 9.631 -10.599 1.00 52.33 O ATOM 777 CB GLN A 49 -11.900 8.114 -7.928 1.00 72.21 C ATOM 778 CG GLN A 49 -12.025 7.962 -6.418 1.00 3.35 C ATOM 779 CD GLN A 49 -12.841 6.751 -6.034 1.00 75.45 C ATOM 780 OE1 GLN A 49 -14.062 6.824 -5.903 1.00 20.41 O ATOM 781 NE2 GLN A 49 -12.197 5.639 -5.825 1.00 42.43 N ATOM 0 H GLN A 49 -12.596 10.552 -7.817 1.00 62.21 H new ATOM 0 HA GLN A 49 -10.059 9.158 -7.935 1.00 35.54 H new ATOM 0 HB2 GLN A 49 -12.898 8.219 -8.355 1.00 72.21 H new ATOM 0 HB3 GLN A 49 -11.472 7.200 -8.339 1.00 72.21 H new ATOM 0 HG2 GLN A 49 -11.031 7.883 -5.979 1.00 3.35 H new ATOM 0 HG3 GLN A 49 -12.487 8.857 -6.001 1.00 3.35 H new ATOM 0 HE21 GLN A 49 -11.184 5.607 -5.941 1.00 42.43 H new ATOM 0 HE22 GLN A 49 -12.705 4.800 -5.545 1.00 42.43 H new ATOM 790 N VAL A 50 -9.732 9.079 -10.327 1.00 5.41 N ATOM 791 CA VAL A 50 -9.379 9.110 -11.721 1.00 30.20 C ATOM 792 C VAL A 50 -8.546 7.901 -12.050 1.00 21.51 C ATOM 793 O VAL A 50 -8.156 7.162 -11.152 1.00 12.42 O ATOM 794 CB VAL A 50 -8.585 10.396 -12.093 1.00 54.15 C ATOM 795 CG1 VAL A 50 -9.453 11.634 -11.958 1.00 40.12 C ATOM 796 CG2 VAL A 50 -7.338 10.530 -11.219 1.00 0.20 C ATOM 0 H VAL A 50 -8.953 8.825 -9.719 1.00 5.41 H new ATOM 0 HA VAL A 50 -10.303 9.109 -12.299 1.00 30.20 H new ATOM 0 HB VAL A 50 -8.277 10.307 -13.135 1.00 54.15 H new ATOM 0 HG11 VAL A 50 -8.872 12.517 -12.224 1.00 40.12 H new ATOM 0 HG12 VAL A 50 -10.312 11.551 -12.624 1.00 40.12 H new ATOM 0 HG13 VAL A 50 -9.800 11.725 -10.929 1.00 40.12 H new ATOM 0 HG21 VAL A 50 -6.796 11.435 -11.494 1.00 0.20 H new ATOM 0 HG22 VAL A 50 -7.633 10.588 -10.171 1.00 0.20 H new ATOM 0 HG23 VAL A 50 -6.695 9.663 -11.368 1.00 0.20 H new ATOM 806 N TRP A 51 -8.294 7.684 -13.297 1.00 53.40 N ATOM 807 CA TRP A 51 -7.474 6.588 -13.714 1.00 51.54 C ATOM 808 C TRP A 51 -6.035 7.065 -13.913 1.00 63.43 C ATOM 809 O TRP A 51 -5.787 8.012 -14.649 1.00 12.44 O ATOM 810 CB TRP A 51 -8.009 5.984 -15.016 1.00 11.05 C ATOM 811 CG TRP A 51 -9.394 5.435 -14.952 1.00 72.12 C ATOM 812 CD1 TRP A 51 -10.459 5.920 -15.600 1.00 24.25 C ATOM 813 CD2 TRP A 51 -9.856 4.294 -14.209 1.00 54.22 C ATOM 814 NE1 TRP A 51 -11.577 5.162 -15.337 1.00 42.42 N ATOM 815 CE2 TRP A 51 -11.234 4.156 -14.482 1.00 72.35 C ATOM 816 CE3 TRP A 51 -9.246 3.377 -13.349 1.00 52.15 C ATOM 817 CZ2 TRP A 51 -12.009 3.144 -13.933 1.00 31.53 C ATOM 818 CZ3 TRP A 51 -10.019 2.370 -12.802 1.00 52.25 C ATOM 819 CH2 TRP A 51 -11.386 2.261 -13.097 1.00 14.42 C ATOM 0 H TRP A 51 -8.650 8.260 -14.060 1.00 53.40 H new ATOM 0 HA TRP A 51 -7.495 5.820 -12.941 1.00 51.54 H new ATOM 0 HB2 TRP A 51 -7.977 6.750 -15.791 1.00 11.05 H new ATOM 0 HB3 TRP A 51 -7.335 5.186 -15.329 1.00 11.05 H new ATOM 0 HD1 TRP A 51 -10.444 6.788 -16.242 1.00 24.25 H new ATOM 0 HE1 TRP A 51 -12.509 5.325 -15.719 1.00 42.42 H new ATOM 0 HE3 TRP A 51 -8.194 3.453 -13.117 1.00 52.15 H new ATOM 0 HZ2 TRP A 51 -13.062 3.058 -14.158 1.00 31.53 H new ATOM 0 HZ3 TRP A 51 -9.562 1.654 -12.135 1.00 52.25 H new ATOM 0 HH2 TRP A 51 -11.959 1.461 -12.653 1.00 14.42 H new ATOM 830 N GLU A 52 -5.114 6.428 -13.251 1.00 54.42 N ATOM 831 CA GLU A 52 -3.707 6.743 -13.370 1.00 25.23 C ATOM 832 C GLU A 52 -2.988 5.562 -13.970 1.00 62.44 C ATOM 833 O GLU A 52 -3.358 4.420 -13.728 1.00 23.01 O ATOM 834 CB GLU A 52 -3.104 7.075 -11.996 1.00 11.31 C ATOM 835 CG GLU A 52 -1.602 7.356 -12.010 1.00 53.52 C ATOM 836 CD GLU A 52 -1.210 8.575 -12.819 1.00 2.35 C ATOM 837 OE1 GLU A 52 -1.244 8.516 -14.074 1.00 32.43 O ATOM 838 OE2 GLU A 52 -0.854 9.609 -12.202 1.00 11.35 O ATOM 0 H GLU A 52 -5.314 5.665 -12.604 1.00 54.42 H new ATOM 0 HA GLU A 52 -3.592 7.616 -14.013 1.00 25.23 H new ATOM 0 HB2 GLU A 52 -3.619 7.945 -11.589 1.00 11.31 H new ATOM 0 HB3 GLU A 52 -3.298 6.244 -11.318 1.00 11.31 H new ATOM 0 HG2 GLU A 52 -1.258 7.488 -10.984 1.00 53.52 H new ATOM 0 HG3 GLU A 52 -1.084 6.485 -12.411 1.00 53.52 H new ATOM 845 N ALA A 53 -1.985 5.832 -14.755 1.00 33.42 N ATOM 846 CA ALA A 53 -1.216 4.793 -15.378 1.00 74.51 C ATOM 847 C ALA A 53 -0.448 4.015 -14.333 1.00 15.42 C ATOM 848 O ALA A 53 0.150 4.607 -13.417 1.00 3.14 O ATOM 849 CB ALA A 53 -0.263 5.386 -16.392 1.00 41.50 C ATOM 0 H ALA A 53 -1.677 6.778 -14.981 1.00 33.42 H new ATOM 0 HA ALA A 53 -1.896 4.113 -15.892 1.00 74.51 H new ATOM 0 HB1 ALA A 53 0.315 4.588 -16.858 1.00 41.50 H new ATOM 0 HB2 ALA A 53 -0.830 5.918 -17.156 1.00 41.50 H new ATOM 0 HB3 ALA A 53 0.413 6.080 -15.893 1.00 41.50 H new ATOM 855 N ALA A 54 -0.500 2.702 -14.435 1.00 65.21 N ATOM 856 CA ALA A 54 0.257 1.841 -13.564 1.00 52.43 C ATOM 857 C ALA A 54 1.735 2.116 -13.750 1.00 51.54 C ATOM 858 O ALA A 54 2.164 2.580 -14.820 1.00 30.34 O ATOM 859 CB ALA A 54 -0.053 0.384 -13.857 1.00 71.55 C ATOM 0 H ALA A 54 -1.068 2.208 -15.123 1.00 65.21 H new ATOM 0 HA ALA A 54 -0.019 2.043 -12.529 1.00 52.43 H new ATOM 0 HB1 ALA A 54 0.528 -0.253 -13.190 1.00 71.55 H new ATOM 0 HB2 ALA A 54 -1.116 0.200 -13.701 1.00 71.55 H new ATOM 0 HB3 ALA A 54 0.206 0.158 -14.891 1.00 71.55 H new ATOM 865 N SER A 55 2.504 1.818 -12.764 1.00 13.12 N ATOM 866 CA SER A 55 3.877 2.128 -12.799 1.00 23.14 C ATOM 867 C SER A 55 4.604 0.865 -13.079 1.00 23.03 C ATOM 868 O SER A 55 4.186 -0.197 -12.610 1.00 71.40 O ATOM 869 CB SER A 55 4.293 2.705 -11.449 1.00 44.21 C ATOM 870 OG SER A 55 3.504 3.852 -11.133 1.00 21.53 O ATOM 0 H SER A 55 2.193 1.352 -11.912 1.00 13.12 H new ATOM 0 HA SER A 55 4.104 2.867 -13.568 1.00 23.14 H new ATOM 0 HB2 SER A 55 4.176 1.950 -10.672 1.00 44.21 H new ATOM 0 HB3 SER A 55 5.348 2.977 -11.472 1.00 44.21 H new ATOM 0 HG SER A 55 3.781 4.210 -10.264 1.00 21.53 H new ATOM 876 N LYS A 56 5.674 0.952 -13.821 1.00 1.23 N ATOM 877 CA LYS A 56 6.440 -0.212 -14.180 1.00 12.42 C ATOM 878 C LYS A 56 7.028 -0.884 -12.958 1.00 52.41 C ATOM 879 O LYS A 56 7.154 -2.091 -12.918 1.00 12.03 O ATOM 880 CB LYS A 56 7.458 0.118 -15.265 1.00 11.20 C ATOM 881 CG LYS A 56 6.775 0.511 -16.574 1.00 44.54 C ATOM 882 CD LYS A 56 7.753 0.964 -17.633 1.00 74.25 C ATOM 883 CE LYS A 56 7.035 1.293 -18.948 1.00 15.01 C ATOM 884 NZ LYS A 56 5.947 2.293 -18.778 1.00 43.15 N ATOM 0 H LYS A 56 6.039 1.829 -14.193 1.00 1.23 H new ATOM 0 HA LYS A 56 5.772 -0.953 -14.620 1.00 12.42 H new ATOM 0 HB2 LYS A 56 8.098 0.933 -14.929 1.00 11.20 H new ATOM 0 HB3 LYS A 56 8.103 -0.744 -15.435 1.00 11.20 H new ATOM 0 HG2 LYS A 56 6.206 -0.339 -16.951 1.00 44.54 H new ATOM 0 HG3 LYS A 56 6.061 1.311 -16.380 1.00 44.54 H new ATOM 0 HD2 LYS A 56 8.293 1.843 -17.281 1.00 74.25 H new ATOM 0 HD3 LYS A 56 8.494 0.183 -17.806 1.00 74.25 H new ATOM 0 HE2 LYS A 56 7.761 1.672 -19.668 1.00 15.01 H new ATOM 0 HE3 LYS A 56 6.618 0.377 -19.368 1.00 15.01 H new ATOM 0 HZ1 LYS A 56 5.635 2.628 -19.712 1.00 43.15 H new ATOM 0 HZ2 LYS A 56 5.146 1.853 -18.282 1.00 43.15 H new ATOM 0 HZ3 LYS A 56 6.299 3.098 -18.221 1.00 43.15 H new ATOM 898 N THR A 57 7.312 -0.099 -11.945 1.00 51.35 N ATOM 899 CA THR A 57 7.762 -0.616 -10.678 1.00 50.43 C ATOM 900 C THR A 57 6.703 -1.573 -10.092 1.00 45.40 C ATOM 901 O THR A 57 6.987 -2.734 -9.810 1.00 61.52 O ATOM 902 CB THR A 57 7.998 0.554 -9.711 1.00 3.23 C ATOM 903 OG1 THR A 57 6.837 1.416 -9.736 1.00 11.41 O ATOM 904 CG2 THR A 57 9.226 1.350 -10.109 1.00 24.41 C ATOM 0 H THR A 57 7.237 0.918 -11.978 1.00 51.35 H new ATOM 0 HA THR A 57 8.692 -1.167 -10.821 1.00 50.43 H new ATOM 0 HB THR A 57 8.160 0.158 -8.708 1.00 3.23 H new ATOM 0 HG1 THR A 57 6.974 2.167 -9.121 1.00 11.41 H new ATOM 0 HG21 THR A 57 9.370 2.172 -9.408 1.00 24.41 H new ATOM 0 HG22 THR A 57 10.102 0.701 -10.092 1.00 24.41 H new ATOM 0 HG23 THR A 57 9.090 1.750 -11.114 1.00 24.41 H new ATOM 912 N ALA A 58 5.474 -1.082 -9.984 1.00 24.50 N ATOM 913 CA ALA A 58 4.356 -1.857 -9.457 1.00 1.21 C ATOM 914 C ALA A 58 4.023 -3.018 -10.380 1.00 33.52 C ATOM 915 O ALA A 58 3.625 -4.099 -9.924 1.00 22.24 O ATOM 916 CB ALA A 58 3.143 -0.965 -9.253 1.00 20.13 C ATOM 0 H ALA A 58 5.224 -0.133 -10.260 1.00 24.50 H new ATOM 0 HA ALA A 58 4.647 -2.268 -8.490 1.00 1.21 H new ATOM 0 HB1 ALA A 58 2.317 -1.558 -8.859 1.00 20.13 H new ATOM 0 HB2 ALA A 58 3.389 -0.172 -8.547 1.00 20.13 H new ATOM 0 HB3 ALA A 58 2.851 -0.524 -10.206 1.00 20.13 H new ATOM 922 N LEU A 59 4.183 -2.796 -11.668 1.00 54.22 N ATOM 923 CA LEU A 59 3.990 -3.820 -12.650 1.00 0.44 C ATOM 924 C LEU A 59 4.992 -4.984 -12.421 1.00 21.40 C ATOM 925 O LEU A 59 4.596 -6.145 -12.435 1.00 4.34 O ATOM 926 CB LEU A 59 4.083 -3.233 -14.076 1.00 42.42 C ATOM 927 CG LEU A 59 2.962 -2.278 -14.532 1.00 12.35 C ATOM 928 CD1 LEU A 59 3.325 -1.639 -15.867 1.00 62.02 C ATOM 929 CD2 LEU A 59 1.673 -3.030 -14.708 1.00 71.11 C ATOM 0 H LEU A 59 4.452 -1.892 -12.056 1.00 54.22 H new ATOM 0 HA LEU A 59 2.987 -4.233 -12.543 1.00 0.44 H new ATOM 0 HB2 LEU A 59 5.031 -2.701 -14.159 1.00 42.42 H new ATOM 0 HB3 LEU A 59 4.122 -4.065 -14.779 1.00 42.42 H new ATOM 0 HG LEU A 59 2.844 -1.510 -13.768 1.00 12.35 H new ATOM 0 HD11 LEU A 59 2.525 -0.967 -16.178 1.00 62.02 H new ATOM 0 HD12 LEU A 59 4.252 -1.075 -15.761 1.00 62.02 H new ATOM 0 HD13 LEU A 59 3.458 -2.417 -16.619 1.00 62.02 H new ATOM 0 HD21 LEU A 59 0.891 -2.342 -15.030 1.00 71.11 H new ATOM 0 HD22 LEU A 59 1.805 -3.807 -15.461 1.00 71.11 H new ATOM 0 HD23 LEU A 59 1.386 -3.487 -13.761 1.00 71.11 H new ATOM 941 N LYS A 60 6.279 -4.662 -12.155 1.00 41.23 N ATOM 942 CA LYS A 60 7.284 -5.712 -11.837 1.00 1.20 C ATOM 943 C LYS A 60 6.835 -6.595 -10.663 1.00 43.04 C ATOM 944 O LYS A 60 6.962 -7.819 -10.722 1.00 51.44 O ATOM 945 CB LYS A 60 8.710 -5.155 -11.539 1.00 3.31 C ATOM 946 CG LYS A 60 9.725 -4.978 -12.725 1.00 72.42 C ATOM 947 CD LYS A 60 9.365 -3.920 -13.775 1.00 51.41 C ATOM 948 CE LYS A 60 8.241 -4.339 -14.707 1.00 71.03 C ATOM 949 NZ LYS A 60 8.592 -5.509 -15.538 1.00 32.13 N ATOM 0 H LYS A 60 6.643 -3.709 -12.153 1.00 41.23 H new ATOM 0 HA LYS A 60 7.350 -6.310 -12.746 1.00 1.20 H new ATOM 0 HB2 LYS A 60 8.590 -4.182 -11.062 1.00 3.31 H new ATOM 0 HB3 LYS A 60 9.174 -5.815 -10.806 1.00 3.31 H new ATOM 0 HG2 LYS A 60 10.700 -4.727 -12.307 1.00 72.42 H new ATOM 0 HG3 LYS A 60 9.832 -5.938 -13.230 1.00 72.42 H new ATOM 0 HD2 LYS A 60 9.079 -2.999 -13.266 1.00 51.41 H new ATOM 0 HD3 LYS A 60 10.251 -3.694 -14.368 1.00 51.41 H new ATOM 0 HE2 LYS A 60 7.354 -4.571 -14.118 1.00 71.03 H new ATOM 0 HE3 LYS A 60 7.983 -3.502 -15.356 1.00 71.03 H new ATOM 0 HZ1 LYS A 60 7.891 -5.617 -16.299 1.00 32.13 H new ATOM 0 HZ2 LYS A 60 9.535 -5.370 -15.953 1.00 32.13 H new ATOM 0 HZ3 LYS A 60 8.597 -6.365 -14.948 1.00 32.13 H new ATOM 963 N LYS A 61 6.296 -5.978 -9.611 1.00 41.52 N ATOM 964 CA LYS A 61 5.840 -6.737 -8.430 1.00 13.34 C ATOM 965 C LYS A 61 4.614 -7.589 -8.741 1.00 54.25 C ATOM 966 O LYS A 61 4.462 -8.700 -8.221 1.00 50.13 O ATOM 967 CB LYS A 61 5.571 -5.836 -7.200 1.00 2.33 C ATOM 968 CG LYS A 61 6.810 -5.256 -6.500 1.00 63.24 C ATOM 969 CD LYS A 61 7.610 -4.317 -7.373 1.00 42.31 C ATOM 970 CE LYS A 61 8.822 -3.762 -6.645 1.00 53.11 C ATOM 971 NZ LYS A 61 8.447 -3.003 -5.428 1.00 60.11 N ATOM 0 H LYS A 61 6.163 -4.969 -9.545 1.00 41.52 H new ATOM 0 HA LYS A 61 6.665 -7.400 -8.171 1.00 13.34 H new ATOM 0 HB2 LYS A 61 4.936 -5.008 -7.514 1.00 2.33 H new ATOM 0 HB3 LYS A 61 5.004 -6.413 -6.470 1.00 2.33 H new ATOM 0 HG2 LYS A 61 6.495 -4.725 -5.602 1.00 63.24 H new ATOM 0 HG3 LYS A 61 7.452 -6.075 -6.177 1.00 63.24 H new ATOM 0 HD2 LYS A 61 7.935 -4.844 -8.270 1.00 42.31 H new ATOM 0 HD3 LYS A 61 6.974 -3.494 -7.699 1.00 42.31 H new ATOM 0 HE2 LYS A 61 9.485 -4.582 -6.369 1.00 53.11 H new ATOM 0 HE3 LYS A 61 9.382 -3.112 -7.318 1.00 53.11 H new ATOM 0 HZ1 LYS A 61 9.269 -2.463 -5.089 1.00 60.11 H new ATOM 0 HZ2 LYS A 61 7.671 -2.348 -5.653 1.00 60.11 H new ATOM 0 HZ3 LYS A 61 8.138 -3.665 -4.688 1.00 60.11 H new ATOM 985 N SER A 62 3.757 -7.081 -9.589 1.00 43.25 N ATOM 986 CA SER A 62 2.567 -7.796 -9.988 1.00 40.32 C ATOM 987 C SER A 62 2.938 -9.023 -10.829 1.00 50.35 C ATOM 988 O SER A 62 2.396 -10.115 -10.630 1.00 34.52 O ATOM 989 CB SER A 62 1.652 -6.853 -10.759 1.00 11.24 C ATOM 990 OG SER A 62 1.335 -5.718 -9.951 1.00 22.22 O ATOM 0 H SER A 62 3.862 -6.164 -10.022 1.00 43.25 H new ATOM 0 HA SER A 62 2.039 -8.152 -9.104 1.00 40.32 H new ATOM 0 HB2 SER A 62 2.139 -6.531 -11.680 1.00 11.24 H new ATOM 0 HB3 SER A 62 0.738 -7.373 -11.047 1.00 11.24 H new ATOM 0 HG SER A 62 2.104 -5.112 -9.922 1.00 22.22 H new ATOM 996 N TRP A 63 3.897 -8.852 -11.729 1.00 50.04 N ATOM 997 CA TRP A 63 4.323 -9.916 -12.584 1.00 54.42 C ATOM 998 C TRP A 63 5.190 -10.915 -11.818 1.00 53.14 C ATOM 999 O TRP A 63 5.214 -12.090 -12.127 1.00 53.23 O ATOM 1000 CB TRP A 63 5.053 -9.355 -13.793 1.00 31.41 C ATOM 1001 CG TRP A 63 5.392 -10.388 -14.794 1.00 3.22 C ATOM 1002 CD1 TRP A 63 6.598 -10.950 -14.990 1.00 42.43 C ATOM 1003 CD2 TRP A 63 4.495 -11.005 -15.723 1.00 11.24 C ATOM 1004 NE1 TRP A 63 6.529 -11.868 -16.011 1.00 42.14 N ATOM 1005 CE2 TRP A 63 5.239 -11.921 -16.471 1.00 45.44 C ATOM 1006 CE3 TRP A 63 3.128 -10.862 -15.996 1.00 64.13 C ATOM 1007 CZ2 TRP A 63 4.672 -12.695 -17.475 1.00 61.23 C ATOM 1008 CZ3 TRP A 63 2.564 -11.633 -16.993 1.00 50.31 C ATOM 1009 CH2 TRP A 63 3.336 -12.539 -17.722 1.00 52.23 C ATOM 0 H TRP A 63 4.390 -7.971 -11.875 1.00 50.04 H new ATOM 0 HA TRP A 63 3.445 -10.455 -12.940 1.00 54.42 H new ATOM 0 HB2 TRP A 63 4.433 -8.591 -14.263 1.00 31.41 H new ATOM 0 HB3 TRP A 63 5.968 -8.863 -13.462 1.00 31.41 H new ATOM 0 HD1 TRP A 63 7.490 -10.715 -14.428 1.00 42.43 H new ATOM 0 HE1 TRP A 63 7.310 -12.419 -16.368 1.00 42.14 H new ATOM 0 HE3 TRP A 63 2.526 -10.161 -15.436 1.00 64.13 H new ATOM 0 HZ2 TRP A 63 5.266 -13.397 -18.042 1.00 61.23 H new ATOM 0 HZ3 TRP A 63 1.511 -11.534 -17.212 1.00 50.31 H new ATOM 0 HH2 TRP A 63 2.869 -13.129 -18.497 1.00 52.23 H new ATOM 1020 N LYS A 64 5.888 -10.442 -10.804 1.00 15.53 N ATOM 1021 CA LYS A 64 6.709 -11.325 -9.991 1.00 51.31 C ATOM 1022 C LYS A 64 5.803 -12.314 -9.252 1.00 44.30 C ATOM 1023 O LYS A 64 6.130 -13.490 -9.083 1.00 30.43 O ATOM 1024 CB LYS A 64 7.534 -10.522 -8.993 1.00 45.45 C ATOM 1025 CG LYS A 64 8.496 -11.364 -8.180 1.00 42.53 C ATOM 1026 CD LYS A 64 9.270 -10.518 -7.206 1.00 50.52 C ATOM 1027 CE LYS A 64 10.278 -11.352 -6.438 1.00 71.43 C ATOM 1028 NZ LYS A 64 11.035 -10.541 -5.475 1.00 53.23 N ATOM 0 H LYS A 64 5.905 -9.462 -10.523 1.00 15.53 H new ATOM 0 HA LYS A 64 7.396 -11.871 -10.638 1.00 51.31 H new ATOM 0 HB2 LYS A 64 8.098 -9.760 -9.531 1.00 45.45 H new ATOM 0 HB3 LYS A 64 6.859 -10.000 -8.314 1.00 45.45 H new ATOM 0 HG2 LYS A 64 7.943 -12.132 -7.639 1.00 42.53 H new ATOM 0 HG3 LYS A 64 9.187 -11.879 -8.848 1.00 42.53 H new ATOM 0 HD2 LYS A 64 9.786 -9.721 -7.742 1.00 50.52 H new ATOM 0 HD3 LYS A 64 8.582 -10.040 -6.508 1.00 50.52 H new ATOM 0 HE2 LYS A 64 9.761 -12.154 -5.911 1.00 71.43 H new ATOM 0 HE3 LYS A 64 10.968 -11.824 -7.138 1.00 71.43 H new ATOM 0 HZ1 LYS A 64 11.714 -11.146 -4.970 1.00 53.23 H new ATOM 0 HZ2 LYS A 64 11.549 -9.791 -5.981 1.00 53.23 H new ATOM 0 HZ3 LYS A 64 10.379 -10.111 -4.792 1.00 53.23 H new ATOM 1042 N ARG A 65 4.649 -11.815 -8.851 1.00 55.00 N ATOM 1043 CA ARG A 65 3.638 -12.598 -8.166 1.00 32.10 C ATOM 1044 C ARG A 65 3.088 -13.664 -9.136 1.00 5.22 C ATOM 1045 O ARG A 65 2.758 -14.790 -8.737 1.00 14.01 O ATOM 1046 CB ARG A 65 2.513 -11.654 -7.746 1.00 64.21 C ATOM 1047 CG ARG A 65 1.439 -12.251 -6.859 1.00 51.02 C ATOM 1048 CD ARG A 65 1.971 -12.560 -5.498 1.00 44.43 C ATOM 1049 NE ARG A 65 0.949 -13.160 -4.636 1.00 4.15 N ATOM 1050 CZ ARG A 65 1.171 -13.671 -3.423 1.00 12.35 C ATOM 1051 NH1 ARG A 65 2.367 -13.563 -2.863 1.00 43.44 N ATOM 1052 NH2 ARG A 65 0.185 -14.273 -2.762 1.00 62.33 N ATOM 0 H ARG A 65 4.384 -10.841 -8.994 1.00 55.00 H new ATOM 0 HA ARG A 65 4.058 -13.093 -7.290 1.00 32.10 H new ATOM 0 HB2 ARG A 65 2.954 -10.804 -7.226 1.00 64.21 H new ATOM 0 HB3 ARG A 65 2.037 -11.265 -8.646 1.00 64.21 H new ATOM 0 HG2 ARG A 65 0.604 -11.555 -6.776 1.00 51.02 H new ATOM 0 HG3 ARG A 65 1.051 -13.161 -7.316 1.00 51.02 H new ATOM 0 HD2 ARG A 65 2.818 -13.241 -5.585 1.00 44.43 H new ATOM 0 HD3 ARG A 65 2.343 -11.645 -5.037 1.00 44.43 H new ATOM 0 HE ARG A 65 -0.007 -13.189 -4.991 1.00 4.15 H new ATOM 0 HH11 ARG A 65 3.121 -13.088 -3.359 1.00 43.44 H new ATOM 0 HH12 ARG A 65 2.533 -13.955 -1.936 1.00 43.44 H new ATOM 0 HH21 ARG A 65 -0.742 -14.344 -3.182 1.00 62.33 H new ATOM 0 HH22 ARG A 65 0.356 -14.663 -1.835 1.00 62.33 H new ATOM 1066 N TYR A 66 2.995 -13.272 -10.401 1.00 51.31 N ATOM 1067 CA TYR A 66 2.548 -14.118 -11.503 1.00 1.14 C ATOM 1068 C TYR A 66 3.535 -15.285 -11.654 1.00 72.02 C ATOM 1069 O TYR A 66 3.142 -16.451 -11.697 1.00 13.45 O ATOM 1070 CB TYR A 66 2.552 -13.245 -12.769 1.00 34.12 C ATOM 1071 CG TYR A 66 1.896 -13.836 -13.980 1.00 72.43 C ATOM 1072 CD1 TYR A 66 2.469 -14.881 -14.662 1.00 42.11 C ATOM 1073 CD2 TYR A 66 0.708 -13.317 -14.452 1.00 33.41 C ATOM 1074 CE1 TYR A 66 1.883 -15.403 -15.779 1.00 43.53 C ATOM 1075 CE2 TYR A 66 0.106 -13.834 -15.571 1.00 4.34 C ATOM 1076 CZ TYR A 66 0.700 -14.883 -16.237 1.00 74.21 C ATOM 1077 OH TYR A 66 0.114 -15.408 -17.375 1.00 14.35 O ATOM 0 H TYR A 66 3.236 -12.327 -10.698 1.00 51.31 H new ATOM 0 HA TYR A 66 1.552 -14.524 -11.329 1.00 1.14 H new ATOM 0 HB2 TYR A 66 2.057 -12.302 -12.537 1.00 34.12 H new ATOM 0 HB3 TYR A 66 3.586 -13.009 -13.020 1.00 34.12 H new ATOM 0 HD1 TYR A 66 3.400 -15.298 -14.308 1.00 42.11 H new ATOM 0 HD2 TYR A 66 0.245 -12.491 -13.933 1.00 33.41 H new ATOM 0 HE1 TYR A 66 2.351 -16.225 -16.301 1.00 43.53 H new ATOM 0 HE2 TYR A 66 -0.827 -13.422 -15.927 1.00 4.34 H new ATOM 0 HH TYR A 66 -0.720 -14.929 -17.565 1.00 14.35 H new ATOM 1087 N GLU A 67 4.822 -14.949 -11.689 1.00 23.02 N ATOM 1088 CA GLU A 67 5.923 -15.928 -11.813 1.00 31.05 C ATOM 1089 C GLU A 67 5.935 -16.867 -10.674 1.00 25.00 C ATOM 1090 O GLU A 67 6.190 -18.039 -10.854 1.00 23.05 O ATOM 1091 CB GLU A 67 7.254 -15.220 -11.889 1.00 54.32 C ATOM 1092 CG GLU A 67 7.304 -14.235 -12.999 1.00 31.23 C ATOM 1093 CD GLU A 67 7.101 -14.881 -14.354 1.00 52.44 C ATOM 1094 OE1 GLU A 67 5.965 -14.990 -14.808 1.00 51.54 O ATOM 1095 OE2 GLU A 67 8.103 -15.301 -14.986 1.00 2.35 O ATOM 0 H GLU A 67 5.143 -13.983 -11.632 1.00 23.02 H new ATOM 0 HA GLU A 67 5.757 -16.492 -12.731 1.00 31.05 H new ATOM 0 HB2 GLU A 67 7.447 -14.711 -10.945 1.00 54.32 H new ATOM 0 HB3 GLU A 67 8.047 -15.955 -12.022 1.00 54.32 H new ATOM 0 HG2 GLU A 67 6.537 -13.476 -12.843 1.00 31.23 H new ATOM 0 HG3 GLU A 67 8.266 -13.723 -12.984 1.00 31.23 H new ATOM 1102 N GLN A 68 5.661 -16.355 -9.516 1.00 1.24 N ATOM 1103 CA GLN A 68 5.589 -17.122 -8.344 1.00 50.12 C ATOM 1104 C GLN A 68 4.534 -18.252 -8.490 1.00 75.10 C ATOM 1105 O GLN A 68 4.775 -19.390 -8.084 1.00 35.42 O ATOM 1106 CB GLN A 68 5.259 -16.173 -7.236 1.00 24.15 C ATOM 1107 CG GLN A 68 5.075 -16.791 -5.924 1.00 60.45 C ATOM 1108 CD GLN A 68 6.315 -17.482 -5.384 1.00 61.34 C ATOM 1109 OE1 GLN A 68 7.443 -17.076 -5.663 1.00 64.33 O ATOM 1110 NE2 GLN A 68 6.117 -18.517 -4.611 1.00 50.43 N ATOM 0 H GLN A 68 5.478 -15.362 -9.371 1.00 1.24 H new ATOM 0 HA GLN A 68 6.532 -17.626 -8.134 1.00 50.12 H new ATOM 0 HB2 GLN A 68 6.056 -15.433 -7.163 1.00 24.15 H new ATOM 0 HB3 GLN A 68 4.348 -15.636 -7.498 1.00 24.15 H new ATOM 0 HG2 GLN A 68 4.761 -16.025 -5.215 1.00 60.45 H new ATOM 0 HG3 GLN A 68 4.266 -17.518 -5.987 1.00 60.45 H new ATOM 0 HE21 GLN A 68 5.167 -18.824 -4.403 1.00 50.43 H new ATOM 0 HE22 GLN A 68 6.913 -19.018 -4.216 1.00 50.43 H new ATOM 1119 N GLU A 69 3.389 -17.932 -9.093 1.00 13.55 N ATOM 1120 CA GLU A 69 2.351 -18.939 -9.349 1.00 13.32 C ATOM 1121 C GLU A 69 2.747 -19.856 -10.516 1.00 42.03 C ATOM 1122 O GLU A 69 2.478 -21.052 -10.496 1.00 63.35 O ATOM 1123 CB GLU A 69 0.996 -18.299 -9.617 1.00 40.05 C ATOM 1124 CG GLU A 69 0.437 -17.500 -8.454 1.00 41.15 C ATOM 1125 CD GLU A 69 0.249 -18.317 -7.199 1.00 35.54 C ATOM 1126 OE1 GLU A 69 -0.769 -19.024 -7.088 1.00 30.13 O ATOM 1127 OE2 GLU A 69 1.112 -18.248 -6.301 1.00 63.34 O ATOM 0 H GLU A 69 3.155 -16.992 -9.412 1.00 13.55 H new ATOM 0 HA GLU A 69 2.263 -19.543 -8.446 1.00 13.32 H new ATOM 0 HB2 GLU A 69 1.083 -17.643 -10.483 1.00 40.05 H new ATOM 0 HB3 GLU A 69 0.284 -19.082 -9.879 1.00 40.05 H new ATOM 0 HG2 GLU A 69 1.107 -16.668 -8.239 1.00 41.15 H new ATOM 0 HG3 GLU A 69 -0.521 -17.070 -8.746 1.00 41.15 H new ATOM 1134 N MET A 70 3.384 -19.280 -11.526 1.00 31.12 N ATOM 1135 CA MET A 70 3.885 -20.050 -12.684 1.00 53.21 C ATOM 1136 C MET A 70 4.886 -21.087 -12.228 1.00 4.45 C ATOM 1137 O MET A 70 4.849 -22.245 -12.651 1.00 70.03 O ATOM 1138 CB MET A 70 4.556 -19.126 -13.701 1.00 13.51 C ATOM 1139 CG MET A 70 3.620 -18.178 -14.404 1.00 62.30 C ATOM 1140 SD MET A 70 2.432 -19.030 -15.456 1.00 44.31 S ATOM 1141 CE MET A 70 3.526 -19.803 -16.654 1.00 55.44 C ATOM 0 H MET A 70 3.573 -18.279 -11.578 1.00 31.12 H new ATOM 0 HA MET A 70 3.033 -20.541 -13.154 1.00 53.21 H new ATOM 0 HB2 MET A 70 5.325 -18.545 -13.192 1.00 13.51 H new ATOM 0 HB3 MET A 70 5.061 -19.737 -14.449 1.00 13.51 H new ATOM 0 HG2 MET A 70 3.084 -17.586 -13.662 1.00 62.30 H new ATOM 0 HG3 MET A 70 4.201 -17.481 -15.008 1.00 62.30 H new ATOM 0 HE1 MET A 70 3.082 -19.738 -17.647 1.00 55.44 H new ATOM 0 HE2 MET A 70 4.488 -19.290 -16.652 1.00 55.44 H new ATOM 0 HE3 MET A 70 3.672 -20.850 -16.390 1.00 55.44 H new ATOM 1151 N LEU A 71 5.759 -20.651 -11.353 1.00 23.15 N ATOM 1152 CA LEU A 71 6.791 -21.458 -10.765 1.00 62.34 C ATOM 1153 C LEU A 71 6.187 -22.472 -9.785 1.00 65.22 C ATOM 1154 O LEU A 71 6.733 -23.550 -9.580 1.00 75.13 O ATOM 1155 CB LEU A 71 7.808 -20.523 -10.085 1.00 71.25 C ATOM 1156 CG LEU A 71 8.923 -21.166 -9.264 1.00 54.43 C ATOM 1157 CD1 LEU A 71 9.829 -22.014 -10.146 1.00 15.31 C ATOM 1158 CD2 LEU A 71 9.723 -20.106 -8.527 1.00 41.04 C ATOM 0 H LEU A 71 5.767 -19.687 -11.021 1.00 23.15 H new ATOM 0 HA LEU A 71 7.307 -22.038 -11.531 1.00 62.34 H new ATOM 0 HB2 LEU A 71 8.271 -19.911 -10.859 1.00 71.25 H new ATOM 0 HB3 LEU A 71 7.257 -19.847 -9.431 1.00 71.25 H new ATOM 0 HG LEU A 71 8.465 -21.823 -8.525 1.00 54.43 H new ATOM 0 HD11 LEU A 71 10.615 -22.461 -9.537 1.00 15.31 H new ATOM 0 HD12 LEU A 71 9.243 -22.803 -10.618 1.00 15.31 H new ATOM 0 HD13 LEU A 71 10.279 -21.386 -10.915 1.00 15.31 H new ATOM 0 HD21 LEU A 71 10.513 -20.584 -7.947 1.00 41.04 H new ATOM 0 HD22 LEU A 71 10.166 -19.419 -9.247 1.00 41.04 H new ATOM 0 HD23 LEU A 71 9.064 -19.554 -7.857 1.00 41.04 H new ATOM 1170 N LYS A 72 5.045 -22.115 -9.203 1.00 71.02 N ATOM 1171 CA LYS A 72 4.295 -23.016 -8.329 1.00 63.35 C ATOM 1172 C LYS A 72 3.831 -24.231 -9.123 1.00 24.55 C ATOM 1173 O LYS A 72 3.776 -25.355 -8.605 1.00 75.15 O ATOM 1174 CB LYS A 72 3.079 -22.286 -7.737 1.00 23.04 C ATOM 1175 CG LYS A 72 2.146 -23.163 -6.921 1.00 73.12 C ATOM 1176 CD LYS A 72 0.941 -22.376 -6.441 1.00 30.34 C ATOM 1177 CE LYS A 72 -0.051 -23.255 -5.690 1.00 14.14 C ATOM 1178 NZ LYS A 72 0.538 -23.864 -4.479 1.00 42.44 N ATOM 0 H LYS A 72 4.614 -21.198 -9.322 1.00 71.02 H new ATOM 0 HA LYS A 72 4.942 -23.342 -7.515 1.00 63.35 H new ATOM 0 HB2 LYS A 72 3.434 -21.471 -7.106 1.00 23.04 H new ATOM 0 HB3 LYS A 72 2.512 -21.835 -8.551 1.00 23.04 H new ATOM 0 HG2 LYS A 72 1.816 -24.009 -7.524 1.00 73.12 H new ATOM 0 HG3 LYS A 72 2.682 -23.572 -6.065 1.00 73.12 H new ATOM 0 HD2 LYS A 72 1.272 -21.566 -5.791 1.00 30.34 H new ATOM 0 HD3 LYS A 72 0.444 -21.916 -7.295 1.00 30.34 H new ATOM 0 HE2 LYS A 72 -0.919 -22.659 -5.408 1.00 14.14 H new ATOM 0 HE3 LYS A 72 -0.408 -24.043 -6.353 1.00 14.14 H new ATOM 0 HZ1 LYS A 72 -0.205 -24.354 -3.941 1.00 42.44 H new ATOM 0 HZ2 LYS A 72 1.273 -24.546 -4.756 1.00 42.44 H new ATOM 0 HZ3 LYS A 72 0.961 -23.121 -3.887 1.00 42.44 H new ATOM 1192 N ASN A 73 3.503 -24.002 -10.373 1.00 24.51 N ATOM 1193 CA ASN A 73 3.087 -25.069 -11.244 1.00 62.41 C ATOM 1194 C ASN A 73 4.301 -25.780 -11.828 1.00 2.22 C ATOM 1195 O ASN A 73 4.919 -25.325 -12.813 1.00 41.22 O ATOM 1196 CB ASN A 73 2.109 -24.577 -12.323 1.00 52.51 C ATOM 1197 CG ASN A 73 1.662 -25.673 -13.286 1.00 2.10 C ATOM 1198 OD1 ASN A 73 2.271 -25.875 -14.319 1.00 64.12 O ATOM 1199 ND2 ASN A 73 0.606 -26.378 -12.949 1.00 12.35 N ATOM 0 H ASN A 73 3.517 -23.080 -10.809 1.00 24.51 H new ATOM 0 HA ASN A 73 2.534 -25.800 -10.654 1.00 62.41 H new ATOM 0 HB2 ASN A 73 1.231 -24.150 -11.838 1.00 52.51 H new ATOM 0 HB3 ASN A 73 2.581 -23.775 -12.891 1.00 52.51 H new ATOM 0 HD21 ASN A 73 0.273 -27.122 -13.562 1.00 12.35 H new ATOM 0 HD22 ASN A 73 0.119 -26.181 -12.075 1.00 12.35 H new ATOM 1206 N GLU A 74 4.664 -26.855 -11.168 1.00 32.34 N ATOM 1207 CA GLU A 74 5.796 -27.685 -11.514 1.00 45.11 C ATOM 1208 C GLU A 74 5.488 -28.480 -12.778 1.00 44.30 C ATOM 1209 O GLU A 74 4.573 -29.309 -12.803 1.00 25.33 O ATOM 1210 CB GLU A 74 6.093 -28.612 -10.339 1.00 40.30 C ATOM 1211 CG GLU A 74 6.420 -27.861 -9.053 1.00 0.24 C ATOM 1212 CD GLU A 74 6.442 -28.742 -7.825 1.00 42.23 C ATOM 1213 OE1 GLU A 74 7.477 -29.383 -7.524 1.00 64.41 O ATOM 1214 OE2 GLU A 74 5.416 -28.774 -7.109 1.00 51.15 O ATOM 0 H GLU A 74 4.161 -27.188 -10.345 1.00 32.34 H new ATOM 0 HA GLU A 74 6.673 -27.069 -11.714 1.00 45.11 H new ATOM 0 HB2 GLU A 74 5.232 -29.258 -10.167 1.00 40.30 H new ATOM 0 HB3 GLU A 74 6.931 -29.260 -10.598 1.00 40.30 H new ATOM 0 HG2 GLU A 74 7.392 -27.379 -9.161 1.00 0.24 H new ATOM 0 HG3 GLU A 74 5.685 -27.069 -8.908 1.00 0.24 H new ATOM 1221 N LYS A 75 6.228 -28.192 -13.820 1.00 22.10 N ATOM 1222 CA LYS A 75 6.044 -28.810 -15.125 1.00 60.12 C ATOM 1223 C LYS A 75 7.364 -28.847 -15.900 1.00 60.42 C ATOM 1224 O LYS A 75 7.689 -29.838 -16.545 1.00 12.42 O ATOM 1225 CB LYS A 75 4.964 -28.050 -15.926 1.00 12.11 C ATOM 1226 CG LYS A 75 5.203 -26.549 -15.985 1.00 74.51 C ATOM 1227 CD LYS A 75 4.152 -25.819 -16.785 1.00 34.20 C ATOM 1228 CE LYS A 75 4.330 -24.317 -16.646 1.00 32.13 C ATOM 1229 NZ LYS A 75 4.178 -23.883 -15.227 1.00 14.11 N ATOM 0 H LYS A 75 6.988 -27.513 -13.793 1.00 22.10 H new ATOM 0 HA LYS A 75 5.711 -29.837 -14.977 1.00 60.12 H new ATOM 0 HB2 LYS A 75 4.929 -28.445 -16.941 1.00 12.11 H new ATOM 0 HB3 LYS A 75 3.989 -28.238 -15.477 1.00 12.11 H new ATOM 0 HG2 LYS A 75 5.224 -26.149 -14.971 1.00 74.51 H new ATOM 0 HG3 LYS A 75 6.183 -26.359 -16.423 1.00 74.51 H new ATOM 0 HD2 LYS A 75 4.221 -26.104 -17.835 1.00 34.20 H new ATOM 0 HD3 LYS A 75 3.159 -26.107 -16.441 1.00 34.20 H new ATOM 0 HE2 LYS A 75 5.315 -24.030 -17.013 1.00 32.13 H new ATOM 0 HE3 LYS A 75 3.596 -23.803 -17.267 1.00 32.13 H new ATOM 0 HZ1 LYS A 75 3.818 -22.908 -15.199 1.00 14.11 H new ATOM 0 HZ2 LYS A 75 3.508 -24.513 -14.741 1.00 14.11 H new ATOM 0 HZ3 LYS A 75 5.101 -23.925 -14.750 1.00 14.11 H new ATOM 1243 N VAL A 76 8.121 -27.764 -15.824 1.00 3.04 N ATOM 1244 CA VAL A 76 9.397 -27.667 -16.515 1.00 55.25 C ATOM 1245 C VAL A 76 10.472 -28.382 -15.710 1.00 43.22 C ATOM 1246 O VAL A 76 11.236 -29.191 -16.236 1.00 30.21 O ATOM 1247 CB VAL A 76 9.815 -26.180 -16.737 1.00 64.20 C ATOM 1248 CG1 VAL A 76 11.156 -26.086 -17.448 1.00 44.11 C ATOM 1249 CG2 VAL A 76 8.747 -25.427 -17.520 1.00 10.33 C ATOM 0 H VAL A 76 7.871 -26.934 -15.286 1.00 3.04 H new ATOM 0 HA VAL A 76 9.287 -28.139 -17.492 1.00 55.25 H new ATOM 0 HB VAL A 76 9.917 -25.716 -15.756 1.00 64.20 H new ATOM 0 HG11 VAL A 76 11.421 -25.038 -17.589 1.00 44.11 H new ATOM 0 HG12 VAL A 76 11.922 -26.576 -16.847 1.00 44.11 H new ATOM 0 HG13 VAL A 76 11.088 -26.576 -18.419 1.00 44.11 H new ATOM 0 HG21 VAL A 76 9.061 -24.393 -17.662 1.00 10.33 H new ATOM 0 HG22 VAL A 76 8.607 -25.900 -18.492 1.00 10.33 H new ATOM 0 HG23 VAL A 76 7.808 -25.448 -16.967 1.00 10.33 H new ATOM 1259 N ALA A 77 10.498 -28.103 -14.439 1.00 14.21 N ATOM 1260 CA ALA A 77 11.456 -28.674 -13.528 1.00 54.20 C ATOM 1261 C ALA A 77 10.751 -28.927 -12.216 1.00 34.15 C ATOM 1262 O ALA A 77 9.520 -29.033 -12.208 1.00 24.43 O ATOM 1263 CB ALA A 77 12.610 -27.700 -13.339 1.00 51.04 C ATOM 0 H ALA A 77 9.842 -27.460 -13.995 1.00 14.21 H new ATOM 0 HA ALA A 77 11.858 -29.610 -13.916 1.00 54.20 H new ATOM 0 HB1 ALA A 77 13.338 -28.128 -12.650 1.00 51.04 H new ATOM 0 HB2 ALA A 77 13.088 -27.511 -14.300 1.00 51.04 H new ATOM 0 HB3 ALA A 77 12.232 -26.763 -12.931 1.00 51.04 H new ATOM 1269 N ALA A 78 11.526 -29.053 -11.133 1.00 34.45 N ATOM 1270 CA ALA A 78 11.008 -29.230 -9.766 1.00 40.44 C ATOM 1271 C ALA A 78 10.553 -30.661 -9.497 1.00 73.12 C ATOM 1272 O ALA A 78 10.867 -31.575 -10.267 1.00 53.24 O ATOM 1273 CB ALA A 78 9.940 -28.201 -9.426 1.00 54.22 C ATOM 0 H ALA A 78 12.545 -29.035 -11.179 1.00 34.45 H new ATOM 0 HA ALA A 78 11.841 -29.048 -9.087 1.00 40.44 H new ATOM 0 HB1 ALA A 78 9.585 -28.367 -8.409 1.00 54.22 H new ATOM 0 HB2 ALA A 78 10.362 -27.199 -9.504 1.00 54.22 H new ATOM 0 HB3 ALA A 78 9.107 -28.298 -10.122 1.00 54.22 H new ATOM 1279 N LYS A 79 9.816 -30.859 -8.423 1.00 34.44 N ATOM 1280 CA LYS A 79 9.533 -32.187 -7.948 1.00 41.12 C ATOM 1281 C LYS A 79 8.205 -32.743 -8.471 1.00 24.22 C ATOM 1282 O LYS A 79 8.197 -33.738 -9.201 1.00 64.22 O ATOM 1283 CB LYS A 79 9.577 -32.215 -6.416 1.00 40.14 C ATOM 1284 CG LYS A 79 9.435 -33.599 -5.795 1.00 44.24 C ATOM 1285 CD LYS A 79 10.565 -34.519 -6.223 1.00 3.13 C ATOM 1286 CE LYS A 79 10.477 -35.867 -5.535 1.00 14.14 C ATOM 1287 NZ LYS A 79 10.571 -35.744 -4.066 1.00 22.14 N ATOM 0 H LYS A 79 9.404 -30.111 -7.865 1.00 34.44 H new ATOM 0 HA LYS A 79 10.309 -32.842 -8.344 1.00 41.12 H new ATOM 0 HB2 LYS A 79 10.520 -31.780 -6.086 1.00 40.14 H new ATOM 0 HB3 LYS A 79 8.781 -31.577 -6.033 1.00 40.14 H new ATOM 0 HG2 LYS A 79 9.426 -33.512 -4.708 1.00 44.24 H new ATOM 0 HG3 LYS A 79 8.479 -34.034 -6.088 1.00 44.24 H new ATOM 0 HD2 LYS A 79 10.532 -34.658 -7.304 1.00 3.13 H new ATOM 0 HD3 LYS A 79 11.523 -34.053 -5.991 1.00 3.13 H new ATOM 0 HE2 LYS A 79 9.535 -36.348 -5.799 1.00 14.14 H new ATOM 0 HE3 LYS A 79 11.278 -36.512 -5.897 1.00 14.14 H new ATOM 0 HZ1 LYS A 79 10.795 -36.672 -3.654 1.00 22.14 H new ATOM 0 HZ2 LYS A 79 11.321 -35.066 -3.822 1.00 22.14 H new ATOM 0 HZ3 LYS A 79 9.663 -35.407 -3.687 1.00 22.14 H new ATOM 1301 N MET A 80 7.096 -32.114 -8.123 1.00 2.10 N ATOM 1302 CA MET A 80 5.790 -32.656 -8.495 1.00 64.11 C ATOM 1303 C MET A 80 5.307 -32.213 -9.841 1.00 5.32 C ATOM 1304 O MET A 80 4.566 -31.237 -9.954 1.00 72.12 O ATOM 1305 CB MET A 80 4.673 -32.452 -7.436 1.00 55.45 C ATOM 1306 CG MET A 80 4.698 -33.397 -6.226 1.00 72.42 C ATOM 1307 SD MET A 80 6.166 -33.269 -5.191 1.00 15.14 S ATOM 1308 CE MET A 80 6.063 -31.563 -4.669 1.00 60.34 C ATOM 0 H MET A 80 7.066 -31.243 -7.593 1.00 2.10 H new ATOM 0 HA MET A 80 5.990 -33.726 -8.545 1.00 64.11 H new ATOM 0 HB2 MET A 80 4.732 -31.427 -7.070 1.00 55.45 H new ATOM 0 HB3 MET A 80 3.708 -32.558 -7.932 1.00 55.45 H new ATOM 0 HG2 MET A 80 3.820 -33.199 -5.611 1.00 72.42 H new ATOM 0 HG3 MET A 80 4.612 -34.423 -6.583 1.00 72.42 H new ATOM 0 HE1 MET A 80 6.707 -31.408 -3.803 1.00 60.34 H new ATOM 0 HE2 MET A 80 6.386 -30.913 -5.483 1.00 60.34 H new ATOM 0 HE3 MET A 80 5.033 -31.326 -4.402 1.00 60.34 H new ATOM 1318 N LEU A 81 5.731 -32.919 -10.870 1.00 24.24 N ATOM 1319 CA LEU A 81 5.218 -32.680 -12.205 1.00 74.00 C ATOM 1320 C LEU A 81 3.790 -33.185 -12.206 1.00 52.43 C ATOM 1321 O LEU A 81 2.910 -32.651 -12.880 1.00 45.23 O ATOM 1322 CB LEU A 81 6.048 -33.429 -13.250 1.00 5.13 C ATOM 1323 CG LEU A 81 7.546 -33.109 -13.288 1.00 52.31 C ATOM 1324 CD1 LEU A 81 8.228 -33.910 -14.376 1.00 63.25 C ATOM 1325 CD2 LEU A 81 7.779 -31.622 -13.497 1.00 25.02 C ATOM 0 H LEU A 81 6.428 -33.661 -10.808 1.00 24.24 H new ATOM 0 HA LEU A 81 5.268 -31.621 -12.459 1.00 74.00 H new ATOM 0 HB2 LEU A 81 5.932 -34.499 -13.076 1.00 5.13 H new ATOM 0 HB3 LEU A 81 5.629 -33.219 -14.234 1.00 5.13 H new ATOM 0 HG LEU A 81 7.978 -33.387 -12.327 1.00 52.31 H new ATOM 0 HD11 LEU A 81 9.292 -33.672 -14.391 1.00 63.25 H new ATOM 0 HD12 LEU A 81 8.097 -34.974 -14.181 1.00 63.25 H new ATOM 0 HD13 LEU A 81 7.787 -33.661 -15.341 1.00 63.25 H new ATOM 0 HD21 LEU A 81 8.850 -31.421 -13.520 1.00 25.02 H new ATOM 0 HD22 LEU A 81 7.331 -31.313 -14.442 1.00 25.02 H new ATOM 0 HD23 LEU A 81 7.323 -31.064 -12.679 1.00 25.02 H new ATOM 1337 N GLU A 82 3.606 -34.232 -11.411 1.00 11.43 N ATOM 1338 CA GLU A 82 2.348 -34.835 -11.072 1.00 71.42 C ATOM 1339 C GLU A 82 1.541 -35.384 -12.236 1.00 2.14 C ATOM 1340 O GLU A 82 0.894 -34.644 -12.990 1.00 74.21 O ATOM 1341 CB GLU A 82 1.503 -33.929 -10.169 1.00 4.42 C ATOM 1342 CG GLU A 82 0.175 -34.546 -9.775 1.00 10.31 C ATOM 1343 CD GLU A 82 -0.623 -33.691 -8.833 1.00 74.44 C ATOM 1344 OE1 GLU A 82 -1.243 -32.709 -9.276 1.00 73.54 O ATOM 1345 OE2 GLU A 82 -0.653 -33.992 -7.634 1.00 2.12 O ATOM 0 H GLU A 82 4.391 -34.704 -10.963 1.00 11.43 H new ATOM 0 HA GLU A 82 2.630 -35.723 -10.507 1.00 71.42 H new ATOM 0 HB2 GLU A 82 2.069 -33.696 -9.267 1.00 4.42 H new ATOM 0 HB3 GLU A 82 1.319 -32.985 -10.683 1.00 4.42 H new ATOM 0 HG2 GLU A 82 -0.413 -34.730 -10.674 1.00 10.31 H new ATOM 0 HG3 GLU A 82 0.357 -35.515 -9.310 1.00 10.31 H new ATOM 1352 N LYS A 83 1.606 -36.671 -12.384 1.00 74.03 N ATOM 1353 CA LYS A 83 0.732 -37.376 -13.264 1.00 64.21 C ATOM 1354 C LYS A 83 -0.306 -38.025 -12.370 1.00 31.00 C ATOM 1355 O LYS A 83 -0.083 -39.103 -11.807 1.00 33.02 O ATOM 1356 CB LYS A 83 1.487 -38.430 -14.080 1.00 62.44 C ATOM 1357 CG LYS A 83 0.623 -39.194 -15.065 1.00 71.44 C ATOM 1358 CD LYS A 83 1.429 -40.244 -15.806 1.00 35.03 C ATOM 1359 CE LYS A 83 0.564 -41.022 -16.781 1.00 33.32 C ATOM 1360 NZ LYS A 83 -0.535 -41.744 -16.102 1.00 21.44 N ATOM 0 H LYS A 83 2.274 -37.265 -11.892 1.00 74.03 H new ATOM 0 HA LYS A 83 0.278 -36.704 -13.992 1.00 64.21 H new ATOM 0 HB2 LYS A 83 2.294 -37.941 -14.626 1.00 62.44 H new ATOM 0 HB3 LYS A 83 1.950 -39.140 -13.395 1.00 62.44 H new ATOM 0 HG2 LYS A 83 -0.201 -39.672 -14.535 1.00 71.44 H new ATOM 0 HG3 LYS A 83 0.182 -38.500 -15.780 1.00 71.44 H new ATOM 0 HD2 LYS A 83 2.246 -39.764 -16.345 1.00 35.03 H new ATOM 0 HD3 LYS A 83 1.880 -40.931 -15.090 1.00 35.03 H new ATOM 0 HE2 LYS A 83 0.145 -40.337 -17.518 1.00 33.32 H new ATOM 0 HE3 LYS A 83 1.184 -41.735 -17.324 1.00 33.32 H new ATOM 0 HZ1 LYS A 83 -0.949 -42.440 -16.755 1.00 21.44 H new ATOM 0 HZ2 LYS A 83 -0.162 -42.235 -15.264 1.00 21.44 H new ATOM 0 HZ3 LYS A 83 -1.267 -41.066 -15.809 1.00 21.44 H new ATOM 1374 N ASP A 84 -1.388 -37.335 -12.164 1.00 62.43 N ATOM 1375 CA ASP A 84 -2.395 -37.768 -11.219 1.00 52.21 C ATOM 1376 C ASP A 84 -3.476 -38.580 -11.891 1.00 54.11 C ATOM 1377 O ASP A 84 -3.594 -39.793 -11.661 1.00 41.03 O ATOM 1378 CB ASP A 84 -2.999 -36.557 -10.500 1.00 71.25 C ATOM 1379 CG ASP A 84 -4.052 -36.927 -9.484 1.00 2.11 C ATOM 1380 OD1 ASP A 84 -5.239 -36.991 -9.837 1.00 41.55 O ATOM 1381 OD2 ASP A 84 -3.707 -37.132 -8.302 1.00 43.12 O ATOM 0 H ASP A 84 -1.605 -36.459 -12.640 1.00 62.43 H new ATOM 0 HA ASP A 84 -1.911 -38.412 -10.485 1.00 52.21 H new ATOM 0 HB2 ASP A 84 -2.202 -36.005 -10.002 1.00 71.25 H new ATOM 0 HB3 ASP A 84 -3.437 -35.886 -11.239 1.00 71.25 H new ATOM 1386 N ALA A 85 -4.229 -37.931 -12.738 1.00 32.10 N ATOM 1387 CA ALA A 85 -5.333 -38.554 -13.412 1.00 22.14 C ATOM 1388 C ALA A 85 -4.846 -39.426 -14.545 1.00 3.40 C ATOM 1389 O ALA A 85 -3.882 -39.087 -15.241 1.00 24.42 O ATOM 1390 CB ALA A 85 -6.302 -37.498 -13.929 1.00 4.13 C ATOM 0 H ALA A 85 -4.092 -36.950 -12.980 1.00 32.10 H new ATOM 0 HA ALA A 85 -5.858 -39.188 -12.697 1.00 22.14 H new ATOM 0 HB1 ALA A 85 -7.134 -37.985 -14.438 1.00 4.13 H new ATOM 0 HB2 ALA A 85 -6.682 -36.912 -13.092 1.00 4.13 H new ATOM 0 HB3 ALA A 85 -5.785 -36.840 -14.628 1.00 4.13 H new ATOM 1396 N THR A 86 -5.489 -40.535 -14.718 1.00 51.20 N ATOM 1397 CA THR A 86 -5.177 -41.435 -15.771 1.00 74.24 C ATOM 1398 C THR A 86 -5.894 -40.997 -17.037 1.00 14.22 C ATOM 1399 O THR A 86 -6.930 -40.304 -16.972 1.00 62.24 O ATOM 1400 CB THR A 86 -5.610 -42.856 -15.379 1.00 31.44 C ATOM 1401 OG1 THR A 86 -6.952 -42.807 -14.871 1.00 51.41 O ATOM 1402 CG2 THR A 86 -4.683 -43.437 -14.321 1.00 51.33 C ATOM 0 H THR A 86 -6.257 -40.842 -14.121 1.00 51.20 H new ATOM 0 HA THR A 86 -4.102 -41.432 -15.952 1.00 74.24 H new ATOM 0 HB THR A 86 -5.561 -43.496 -16.260 1.00 31.44 H new ATOM 0 HG1 THR A 86 -7.240 -43.709 -14.619 1.00 51.41 H new ATOM 0 HG21 THR A 86 -5.012 -44.443 -14.062 1.00 51.33 H new ATOM 0 HG22 THR A 86 -3.666 -43.477 -14.711 1.00 51.33 H new ATOM 0 HG23 THR A 86 -4.706 -42.807 -13.432 1.00 51.33 H new ATOM 1410 N GLU A 87 -5.357 -41.347 -18.171 1.00 2.23 N ATOM 1411 CA GLU A 87 -5.983 -41.008 -19.404 1.00 45.20 C ATOM 1412 C GLU A 87 -6.981 -42.103 -19.733 1.00 14.40 C ATOM 1413 O GLU A 87 -6.610 -43.180 -20.226 1.00 62.21 O ATOM 1414 CB GLU A 87 -4.948 -40.854 -20.526 1.00 73.35 C ATOM 1415 CG GLU A 87 -5.512 -40.266 -21.808 1.00 23.20 C ATOM 1416 CD GLU A 87 -6.053 -38.873 -21.586 1.00 54.43 C ATOM 1417 OE1 GLU A 87 -5.260 -37.915 -21.558 1.00 54.14 O ATOM 1418 OE2 GLU A 87 -7.280 -38.712 -21.405 1.00 1.00 O ATOM 0 H GLU A 87 -4.485 -41.868 -18.261 1.00 2.23 H new ATOM 0 HA GLU A 87 -6.493 -40.049 -19.312 1.00 45.20 H new ATOM 0 HB2 GLU A 87 -4.136 -40.218 -20.173 1.00 73.35 H new ATOM 0 HB3 GLU A 87 -4.516 -41.831 -20.745 1.00 73.35 H new ATOM 0 HG2 GLU A 87 -4.733 -40.238 -22.570 1.00 23.20 H new ATOM 0 HG3 GLU A 87 -6.306 -40.910 -22.187 1.00 23.20 H new ATOM 1425 N VAL A 88 -8.217 -41.863 -19.391 1.00 21.24 N ATOM 1426 CA VAL A 88 -9.265 -42.823 -19.610 1.00 54.24 C ATOM 1427 C VAL A 88 -10.043 -42.441 -20.846 1.00 72.11 C ATOM 1428 O VAL A 88 -10.618 -41.343 -20.920 1.00 3.25 O ATOM 1429 CB VAL A 88 -10.219 -42.915 -18.390 1.00 32.43 C ATOM 1430 CG1 VAL A 88 -11.289 -43.968 -18.617 1.00 71.25 C ATOM 1431 CG2 VAL A 88 -9.439 -43.224 -17.122 1.00 61.41 C ATOM 0 H VAL A 88 -8.527 -40.996 -18.952 1.00 21.24 H new ATOM 0 HA VAL A 88 -8.808 -43.803 -19.746 1.00 54.24 H new ATOM 0 HB VAL A 88 -10.708 -41.948 -18.272 1.00 32.43 H new ATOM 0 HG11 VAL A 88 -11.945 -44.013 -17.748 1.00 71.25 H new ATOM 0 HG12 VAL A 88 -11.873 -43.708 -19.500 1.00 71.25 H new ATOM 0 HG13 VAL A 88 -10.818 -44.939 -18.767 1.00 71.25 H new ATOM 0 HG21 VAL A 88 -10.126 -43.284 -16.278 1.00 61.41 H new ATOM 0 HG22 VAL A 88 -8.920 -44.176 -17.237 1.00 61.41 H new ATOM 0 HG23 VAL A 88 -8.711 -42.434 -16.941 1.00 61.41 H new ATOM 1441 N GLY A 89 -10.045 -43.311 -21.810 1.00 22.42 N ATOM 1442 CA GLY A 89 -10.729 -43.054 -23.035 1.00 24.12 C ATOM 1443 C GLY A 89 -10.085 -43.782 -24.175 1.00 0.04 C ATOM 1444 O GLY A 89 -9.587 -43.162 -25.124 1.00 73.14 O ATOM 0 H GLY A 89 -9.574 -44.215 -21.768 1.00 22.42 H new ATOM 0 HA2 GLY A 89 -11.771 -43.362 -22.945 1.00 24.12 H new ATOM 0 HA3 GLY A 89 -10.729 -41.983 -23.237 1.00 24.12 H new ATOM 1448 N VAL A 90 -10.042 -45.091 -24.076 1.00 70.31 N ATOM 1449 CA VAL A 90 -9.495 -45.896 -25.137 1.00 61.50 C ATOM 1450 C VAL A 90 -10.532 -46.009 -26.245 1.00 61.04 C ATOM 1451 O VAL A 90 -11.698 -46.322 -25.978 1.00 42.42 O ATOM 1452 CB VAL A 90 -9.015 -47.310 -24.648 1.00 63.32 C ATOM 1453 CG1 VAL A 90 -10.150 -48.140 -24.064 1.00 52.43 C ATOM 1454 CG2 VAL A 90 -8.310 -48.068 -25.768 1.00 73.52 C ATOM 0 H VAL A 90 -10.380 -45.618 -23.271 1.00 70.31 H new ATOM 0 HA VAL A 90 -8.599 -45.404 -25.516 1.00 61.50 H new ATOM 0 HB VAL A 90 -8.300 -47.137 -23.844 1.00 63.32 H new ATOM 0 HG11 VAL A 90 -9.765 -49.107 -23.741 1.00 52.43 H new ATOM 0 HG12 VAL A 90 -10.580 -47.618 -23.210 1.00 52.43 H new ATOM 0 HG13 VAL A 90 -10.918 -48.290 -24.822 1.00 52.43 H new ATOM 0 HG21 VAL A 90 -7.989 -49.043 -25.401 1.00 73.52 H new ATOM 0 HG22 VAL A 90 -8.996 -48.203 -26.604 1.00 73.52 H new ATOM 0 HG23 VAL A 90 -7.441 -47.501 -26.100 1.00 73.52 H new ATOM 1464 N LYS A 91 -10.106 -45.724 -27.457 1.00 75.13 N ATOM 1465 CA LYS A 91 -10.954 -45.675 -28.628 1.00 33.33 C ATOM 1466 C LYS A 91 -12.023 -44.603 -28.496 1.00 41.41 C ATOM 1467 O LYS A 91 -13.093 -44.821 -27.893 1.00 5.34 O ATOM 1468 CB LYS A 91 -11.587 -47.020 -28.971 1.00 22.55 C ATOM 1469 CG LYS A 91 -12.404 -46.971 -30.247 1.00 72.41 C ATOM 1470 CD LYS A 91 -12.995 -48.299 -30.554 1.00 13.51 C ATOM 1471 CE LYS A 91 -13.764 -48.279 -31.864 1.00 22.33 C ATOM 1472 NZ LYS A 91 -14.371 -49.593 -32.159 1.00 32.05 N ATOM 0 H LYS A 91 -9.129 -45.513 -27.660 1.00 75.13 H new ATOM 0 HA LYS A 91 -10.296 -45.415 -29.458 1.00 33.33 H new ATOM 0 HB2 LYS A 91 -10.803 -47.770 -29.074 1.00 22.55 H new ATOM 0 HB3 LYS A 91 -12.226 -47.338 -28.147 1.00 22.55 H new ATOM 0 HG2 LYS A 91 -13.198 -46.231 -30.146 1.00 72.41 H new ATOM 0 HG3 LYS A 91 -11.772 -46.650 -31.075 1.00 72.41 H new ATOM 0 HD2 LYS A 91 -12.204 -49.047 -30.607 1.00 13.51 H new ATOM 0 HD3 LYS A 91 -13.661 -48.597 -29.745 1.00 13.51 H new ATOM 0 HE2 LYS A 91 -14.544 -47.520 -31.817 1.00 22.33 H new ATOM 0 HE3 LYS A 91 -13.094 -47.997 -32.676 1.00 22.33 H new ATOM 0 HZ1 LYS A 91 -14.888 -49.542 -33.060 1.00 32.05 H new ATOM 0 HZ2 LYS A 91 -13.624 -50.313 -32.229 1.00 32.05 H new ATOM 0 HZ3 LYS A 91 -15.030 -49.850 -31.396 1.00 32.05 H new ATOM 1486 N ALA A 92 -11.724 -43.445 -29.001 1.00 23.21 N ATOM 1487 CA ALA A 92 -12.670 -42.373 -29.017 1.00 61.14 C ATOM 1488 C ALA A 92 -13.101 -42.153 -30.437 1.00 14.54 C ATOM 1489 O ALA A 92 -12.495 -41.350 -31.166 1.00 12.15 O ATOM 1490 CB ALA A 92 -12.087 -41.107 -28.413 1.00 20.41 C ATOM 0 H ALA A 92 -10.819 -43.217 -29.413 1.00 23.21 H new ATOM 0 HA ALA A 92 -13.533 -42.635 -28.405 1.00 61.14 H new ATOM 0 HB1 ALA A 92 -12.833 -40.313 -28.442 1.00 20.41 H new ATOM 0 HB2 ALA A 92 -11.798 -41.297 -27.379 1.00 20.41 H new ATOM 0 HB3 ALA A 92 -11.210 -40.802 -28.984 1.00 20.41 H new ATOM 1496 N ALA A 93 -14.094 -42.942 -30.854 1.00 31.43 N ATOM 1497 CA ALA A 93 -14.599 -42.969 -32.222 1.00 45.10 C ATOM 1498 C ALA A 93 -13.509 -43.501 -33.165 1.00 23.55 C ATOM 1499 O ALA A 93 -12.397 -43.854 -32.723 1.00 30.01 O ATOM 1500 CB ALA A 93 -15.097 -41.584 -32.664 1.00 34.32 C ATOM 0 H ALA A 93 -14.577 -43.592 -30.234 1.00 31.43 H new ATOM 0 HA ALA A 93 -15.456 -43.641 -32.265 1.00 45.10 H new ATOM 0 HB1 ALA A 93 -15.466 -41.640 -33.688 1.00 34.32 H new ATOM 0 HB2 ALA A 93 -15.902 -41.260 -32.005 1.00 34.32 H new ATOM 0 HB3 ALA A 93 -14.276 -40.869 -32.613 1.00 34.32 H new ATOM 1506 N LEU A 94 -13.805 -43.597 -34.422 1.00 1.11 N ATOM 1507 CA LEU A 94 -12.807 -44.017 -35.371 1.00 60.40 C ATOM 1508 C LEU A 94 -12.743 -43.066 -36.532 1.00 2.11 C ATOM 1509 O LEU A 94 -13.311 -43.299 -37.586 1.00 62.25 O ATOM 1510 CB LEU A 94 -12.906 -45.517 -35.821 1.00 71.34 C ATOM 1511 CG LEU A 94 -14.209 -46.015 -36.496 1.00 73.22 C ATOM 1512 CD1 LEU A 94 -13.995 -47.417 -37.044 1.00 34.21 C ATOM 1513 CD2 LEU A 94 -15.364 -46.044 -35.507 1.00 42.13 C ATOM 0 H LEU A 94 -14.722 -43.393 -34.820 1.00 1.11 H new ATOM 0 HA LEU A 94 -11.857 -43.976 -34.838 1.00 60.40 H new ATOM 0 HB2 LEU A 94 -12.084 -45.708 -36.511 1.00 71.34 H new ATOM 0 HB3 LEU A 94 -12.734 -46.137 -34.941 1.00 71.34 H new ATOM 0 HG LEU A 94 -14.456 -45.325 -37.303 1.00 73.22 H new ATOM 0 HD11 LEU A 94 -14.912 -47.766 -37.518 1.00 34.21 H new ATOM 0 HD12 LEU A 94 -13.190 -47.402 -37.778 1.00 34.21 H new ATOM 0 HD13 LEU A 94 -13.730 -48.090 -36.229 1.00 34.21 H new ATOM 0 HD21 LEU A 94 -16.264 -46.397 -36.009 1.00 42.13 H new ATOM 0 HD22 LEU A 94 -15.121 -46.715 -34.683 1.00 42.13 H new ATOM 0 HD23 LEU A 94 -15.536 -45.040 -35.119 1.00 42.13 H new ATOM 1525 N GLU A 95 -12.115 -41.956 -36.297 1.00 5.14 N ATOM 1526 CA GLU A 95 -11.964 -40.941 -37.289 1.00 54.31 C ATOM 1527 C GLU A 95 -10.522 -40.903 -37.711 1.00 13.13 C ATOM 1528 O GLU A 95 -9.681 -40.305 -37.037 1.00 2.31 O ATOM 1529 CB GLU A 95 -12.377 -39.583 -36.738 1.00 1.33 C ATOM 1530 CG GLU A 95 -13.792 -39.529 -36.196 1.00 12.45 C ATOM 1531 CD GLU A 95 -14.138 -38.164 -35.685 1.00 53.12 C ATOM 1532 OE1 GLU A 95 -13.871 -37.867 -34.503 1.00 34.01 O ATOM 1533 OE2 GLU A 95 -14.669 -37.345 -36.464 1.00 54.11 O ATOM 0 H GLU A 95 -11.688 -41.728 -35.399 1.00 5.14 H new ATOM 0 HA GLU A 95 -12.604 -41.167 -38.142 1.00 54.31 H new ATOM 0 HB2 GLU A 95 -11.686 -39.302 -35.943 1.00 1.33 H new ATOM 0 HB3 GLU A 95 -12.275 -38.838 -37.527 1.00 1.33 H new ATOM 0 HG2 GLU A 95 -14.493 -39.812 -36.981 1.00 12.45 H new ATOM 0 HG3 GLU A 95 -13.902 -40.257 -35.392 1.00 12.45 H new ATOM 1540 N GLU A 96 -10.223 -41.577 -38.772 1.00 2.34 N ATOM 1541 CA GLU A 96 -8.875 -41.656 -39.252 1.00 61.10 C ATOM 1542 C GLU A 96 -8.598 -40.619 -40.331 1.00 53.52 C ATOM 1543 O GLU A 96 -8.847 -40.847 -41.528 1.00 22.10 O ATOM 1544 CB GLU A 96 -8.526 -43.081 -39.716 1.00 22.15 C ATOM 1545 CG GLU A 96 -9.525 -43.672 -40.697 1.00 50.12 C ATOM 1546 CD GLU A 96 -9.095 -44.992 -41.258 1.00 60.50 C ATOM 1547 OE1 GLU A 96 -9.413 -46.033 -40.661 1.00 21.30 O ATOM 1548 OE2 GLU A 96 -8.435 -45.003 -42.325 1.00 23.11 O ATOM 0 H GLU A 96 -10.903 -42.090 -39.333 1.00 2.34 H new ATOM 0 HA GLU A 96 -8.217 -41.421 -38.416 1.00 61.10 H new ATOM 0 HB2 GLU A 96 -7.540 -43.070 -40.180 1.00 22.15 H new ATOM 0 HB3 GLU A 96 -8.461 -43.731 -38.843 1.00 22.15 H new ATOM 0 HG2 GLU A 96 -10.486 -43.793 -40.197 1.00 50.12 H new ATOM 0 HG3 GLU A 96 -9.678 -42.970 -41.516 1.00 50.12 H new ATOM 1555 N ALA A 97 -8.130 -39.471 -39.913 1.00 43.35 N ATOM 1556 CA ALA A 97 -7.779 -38.435 -40.843 1.00 42.12 C ATOM 1557 C ALA A 97 -6.371 -38.669 -41.339 1.00 54.42 C ATOM 1558 O ALA A 97 -5.398 -38.219 -40.739 1.00 61.51 O ATOM 1559 CB ALA A 97 -7.924 -37.050 -40.225 1.00 62.14 C ATOM 0 H ALA A 97 -7.984 -39.232 -38.932 1.00 43.35 H new ATOM 0 HA ALA A 97 -8.468 -38.473 -41.687 1.00 42.12 H new ATOM 0 HB1 ALA A 97 -7.649 -36.293 -40.960 1.00 62.14 H new ATOM 0 HB2 ALA A 97 -8.958 -36.896 -39.915 1.00 62.14 H new ATOM 0 HB3 ALA A 97 -7.269 -36.968 -39.358 1.00 62.14 H new ATOM 1565 N LYS A 98 -6.265 -39.448 -42.376 1.00 14.12 N ATOM 1566 CA LYS A 98 -4.997 -39.758 -42.965 1.00 14.22 C ATOM 1567 C LYS A 98 -4.978 -39.222 -44.363 1.00 72.51 C ATOM 1568 O LYS A 98 -5.688 -39.726 -45.246 1.00 51.11 O ATOM 1569 CB LYS A 98 -4.742 -41.274 -42.964 1.00 24.33 C ATOM 1570 CG LYS A 98 -4.764 -41.906 -41.578 1.00 12.01 C ATOM 1571 CD LYS A 98 -4.488 -43.399 -41.638 1.00 71.13 C ATOM 1572 CE LYS A 98 -4.564 -44.022 -40.253 1.00 75.31 C ATOM 1573 NZ LYS A 98 -4.264 -45.471 -40.266 1.00 33.43 N ATOM 0 H LYS A 98 -7.061 -39.888 -42.839 1.00 14.12 H new ATOM 0 HA LYS A 98 -4.203 -39.295 -42.379 1.00 14.22 H new ATOM 0 HB2 LYS A 98 -5.495 -41.759 -43.585 1.00 24.33 H new ATOM 0 HB3 LYS A 98 -3.774 -41.469 -43.426 1.00 24.33 H new ATOM 0 HG2 LYS A 98 -4.019 -41.423 -40.946 1.00 12.01 H new ATOM 0 HG3 LYS A 98 -5.735 -41.734 -41.115 1.00 12.01 H new ATOM 0 HD2 LYS A 98 -5.210 -43.880 -42.297 1.00 71.13 H new ATOM 0 HD3 LYS A 98 -3.501 -43.573 -42.066 1.00 71.13 H new ATOM 0 HE2 LYS A 98 -3.862 -43.515 -39.591 1.00 75.31 H new ATOM 0 HE3 LYS A 98 -5.561 -43.864 -39.841 1.00 75.31 H new ATOM 0 HZ1 LYS A 98 -4.329 -45.848 -39.299 1.00 33.43 H new ATOM 0 HZ2 LYS A 98 -4.949 -45.962 -40.876 1.00 33.43 H new ATOM 0 HZ3 LYS A 98 -3.303 -45.623 -40.633 1.00 33.43 H new ATOM 1587 N LYS A 99 -4.230 -38.186 -44.564 1.00 51.40 N ATOM 1588 CA LYS A 99 -4.146 -37.569 -45.845 1.00 3.20 C ATOM 1589 C LYS A 99 -3.065 -38.190 -46.672 1.00 30.43 C ATOM 1590 O LYS A 99 -1.887 -38.151 -46.301 1.00 51.01 O ATOM 1591 CB LYS A 99 -3.947 -36.071 -45.706 1.00 22.11 C ATOM 1592 CG LYS A 99 -5.150 -35.399 -45.104 1.00 52.22 C ATOM 1593 CD LYS A 99 -4.972 -33.912 -44.962 1.00 5.03 C ATOM 1594 CE LYS A 99 -6.244 -33.311 -44.430 1.00 50.23 C ATOM 1595 NZ LYS A 99 -6.141 -31.856 -44.201 1.00 20.21 N ATOM 0 H LYS A 99 -3.660 -37.744 -43.843 1.00 51.40 H new ATOM 0 HA LYS A 99 -5.090 -37.734 -46.365 1.00 3.20 H new ATOM 0 HB2 LYS A 99 -3.073 -35.877 -45.084 1.00 22.11 H new ATOM 0 HB3 LYS A 99 -3.742 -35.639 -46.686 1.00 22.11 H new ATOM 0 HG2 LYS A 99 -6.022 -35.599 -45.726 1.00 52.22 H new ATOM 0 HG3 LYS A 99 -5.351 -35.832 -44.124 1.00 52.22 H new ATOM 0 HD2 LYS A 99 -4.143 -33.695 -44.288 1.00 5.03 H new ATOM 0 HD3 LYS A 99 -4.722 -33.470 -45.926 1.00 5.03 H new ATOM 0 HE2 LYS A 99 -7.054 -33.506 -45.133 1.00 50.23 H new ATOM 0 HE3 LYS A 99 -6.509 -33.803 -43.494 1.00 50.23 H new ATOM 0 HZ1 LYS A 99 -7.046 -31.497 -43.835 1.00 20.21 H new ATOM 0 HZ2 LYS A 99 -5.388 -31.666 -43.509 1.00 20.21 H new ATOM 0 HZ3 LYS A 99 -5.916 -31.379 -45.097 1.00 20.21 H new ATOM 1609 N VAL A 100 -3.459 -38.796 -47.771 1.00 51.42 N ATOM 1610 CA VAL A 100 -2.522 -39.404 -48.676 1.00 34.31 C ATOM 1611 C VAL A 100 -1.780 -38.306 -49.400 1.00 61.04 C ATOM 1612 O VAL A 100 -2.289 -37.711 -50.352 1.00 15.50 O ATOM 1613 CB VAL A 100 -3.215 -40.340 -49.703 1.00 61.02 C ATOM 1614 CG1 VAL A 100 -2.186 -41.019 -50.600 1.00 34.44 C ATOM 1615 CG2 VAL A 100 -4.072 -41.379 -48.999 1.00 71.52 C ATOM 0 H VAL A 100 -4.435 -38.878 -48.057 1.00 51.42 H new ATOM 0 HA VAL A 100 -1.836 -40.023 -48.098 1.00 34.31 H new ATOM 0 HB VAL A 100 -3.864 -39.727 -50.328 1.00 61.02 H new ATOM 0 HG11 VAL A 100 -2.696 -41.669 -51.311 1.00 34.44 H new ATOM 0 HG12 VAL A 100 -1.620 -40.262 -51.142 1.00 34.44 H new ATOM 0 HG13 VAL A 100 -1.506 -41.612 -49.989 1.00 34.44 H new ATOM 0 HG21 VAL A 100 -4.546 -42.022 -49.740 1.00 71.52 H new ATOM 0 HG22 VAL A 100 -3.446 -41.983 -48.342 1.00 71.52 H new ATOM 0 HG23 VAL A 100 -4.839 -40.878 -48.409 1.00 71.52 H new ATOM 1625 N GLN A 101 -0.624 -37.999 -48.916 1.00 31.22 N ATOM 1626 CA GLN A 101 0.162 -36.936 -49.459 1.00 12.40 C ATOM 1627 C GLN A 101 1.550 -37.437 -49.759 1.00 74.42 C ATOM 1628 O GLN A 101 2.152 -38.171 -48.951 1.00 54.54 O ATOM 1629 CB GLN A 101 0.189 -35.729 -48.485 1.00 52.53 C ATOM 1630 CG GLN A 101 0.751 -36.048 -47.104 1.00 11.14 C ATOM 1631 CD GLN A 101 0.678 -34.890 -46.126 1.00 73.30 C ATOM 1632 OE1 GLN A 101 0.724 -33.722 -46.508 1.00 64.42 O ATOM 1633 NE2 GLN A 101 0.572 -35.204 -44.859 1.00 31.44 N ATOM 0 H GLN A 101 -0.192 -38.480 -48.127 1.00 31.22 H new ATOM 0 HA GLN A 101 -0.287 -36.592 -50.391 1.00 12.40 H new ATOM 0 HB2 GLN A 101 0.783 -34.931 -48.931 1.00 52.53 H new ATOM 0 HB3 GLN A 101 -0.825 -35.346 -48.372 1.00 52.53 H new ATOM 0 HG2 GLN A 101 0.207 -36.896 -46.688 1.00 11.14 H new ATOM 0 HG3 GLN A 101 1.791 -36.357 -47.209 1.00 11.14 H new ATOM 0 HE21 GLN A 101 0.537 -36.184 -44.578 1.00 31.44 H new ATOM 0 HE22 GLN A 101 0.525 -34.469 -44.154 1.00 31.44 H new ATOM 1642 N ILE A 102 2.039 -37.108 -50.913 1.00 11.12 N ATOM 1643 CA ILE A 102 3.362 -37.500 -51.296 1.00 1.01 C ATOM 1644 C ILE A 102 4.299 -36.325 -51.136 1.00 60.33 C ATOM 1645 O ILE A 102 3.995 -35.209 -51.586 1.00 71.03 O ATOM 1646 CB ILE A 102 3.422 -38.060 -52.754 1.00 51.13 C ATOM 1647 CG1 ILE A 102 2.877 -37.038 -53.774 1.00 20.31 C ATOM 1648 CG2 ILE A 102 2.661 -39.376 -52.847 1.00 73.00 C ATOM 1649 CD1 ILE A 102 2.941 -37.498 -55.219 1.00 44.03 C ATOM 0 H ILE A 102 1.537 -36.563 -51.614 1.00 11.12 H new ATOM 0 HA ILE A 102 3.673 -38.313 -50.640 1.00 1.01 H new ATOM 0 HB ILE A 102 4.468 -38.244 -53.001 1.00 51.13 H new ATOM 0 HG12 ILE A 102 1.841 -36.811 -53.524 1.00 20.31 H new ATOM 0 HG13 ILE A 102 3.440 -36.110 -53.676 1.00 20.31 H new ATOM 0 HG21 ILE A 102 2.711 -39.754 -53.868 1.00 73.00 H new ATOM 0 HG22 ILE A 102 3.107 -40.103 -52.168 1.00 73.00 H new ATOM 0 HG23 ILE A 102 1.619 -39.214 -52.571 1.00 73.00 H new ATOM 0 HD11 ILE A 102 2.538 -36.719 -55.867 1.00 44.03 H new ATOM 0 HD12 ILE A 102 3.977 -37.697 -55.492 1.00 44.03 H new ATOM 0 HD13 ILE A 102 2.354 -38.408 -55.337 1.00 44.03 H new ATOM 1661 N GLU A 103 5.391 -36.535 -50.466 1.00 61.21 N ATOM 1662 CA GLU A 103 6.355 -35.482 -50.311 1.00 73.41 C ATOM 1663 C GLU A 103 7.511 -35.656 -51.269 1.00 55.11 C ATOM 1664 O GLU A 103 8.473 -36.383 -51.001 1.00 62.42 O ATOM 1665 CB GLU A 103 6.808 -35.286 -48.851 1.00 52.35 C ATOM 1666 CG GLU A 103 7.377 -36.518 -48.164 1.00 40.14 C ATOM 1667 CD GLU A 103 7.819 -36.221 -46.758 1.00 42.02 C ATOM 1668 OE1 GLU A 103 6.951 -36.108 -45.868 1.00 43.12 O ATOM 1669 OE2 GLU A 103 9.043 -36.102 -46.507 1.00 11.42 O ATOM 0 H GLU A 103 5.638 -37.418 -50.020 1.00 61.21 H new ATOM 0 HA GLU A 103 5.855 -34.551 -50.576 1.00 73.41 H new ATOM 0 HB2 GLU A 103 7.562 -34.499 -48.827 1.00 52.35 H new ATOM 0 HB3 GLU A 103 5.957 -34.930 -48.271 1.00 52.35 H new ATOM 0 HG2 GLU A 103 6.624 -37.306 -48.149 1.00 40.14 H new ATOM 0 HG3 GLU A 103 8.223 -36.896 -48.738 1.00 40.14 H new ATOM 1676 N LEU A 104 7.389 -35.036 -52.411 1.00 71.43 N ATOM 1677 CA LEU A 104 8.408 -35.111 -53.408 1.00 61.35 C ATOM 1678 C LEU A 104 9.338 -33.943 -53.261 1.00 73.42 C ATOM 1679 O LEU A 104 9.051 -32.844 -53.735 1.00 13.10 O ATOM 1680 CB LEU A 104 7.814 -35.139 -54.826 1.00 74.44 C ATOM 1681 CG LEU A 104 6.875 -36.305 -55.159 1.00 31.24 C ATOM 1682 CD1 LEU A 104 6.355 -36.172 -56.581 1.00 11.51 C ATOM 1683 CD2 LEU A 104 7.581 -37.641 -54.976 1.00 42.44 C ATOM 0 H LEU A 104 6.582 -34.468 -52.671 1.00 71.43 H new ATOM 0 HA LEU A 104 8.958 -36.041 -53.264 1.00 61.35 H new ATOM 0 HB2 LEU A 104 7.269 -34.208 -54.985 1.00 74.44 H new ATOM 0 HB3 LEU A 104 8.638 -35.152 -55.539 1.00 74.44 H new ATOM 0 HG LEU A 104 6.031 -36.271 -54.471 1.00 31.24 H new ATOM 0 HD11 LEU A 104 5.690 -37.006 -56.805 1.00 11.51 H new ATOM 0 HD12 LEU A 104 5.808 -35.234 -56.682 1.00 11.51 H new ATOM 0 HD13 LEU A 104 7.194 -36.180 -57.277 1.00 11.51 H new ATOM 0 HD21 LEU A 104 6.894 -38.452 -55.218 1.00 42.44 H new ATOM 0 HD22 LEU A 104 8.446 -37.689 -55.637 1.00 42.44 H new ATOM 0 HD23 LEU A 104 7.909 -37.740 -53.941 1.00 42.44 H new ATOM 1695 N ASP A 105 10.422 -34.158 -52.559 1.00 43.55 N ATOM 1696 CA ASP A 105 11.441 -33.130 -52.399 1.00 31.31 C ATOM 1697 C ASP A 105 12.300 -33.149 -53.642 1.00 33.31 C ATOM 1698 O ASP A 105 12.949 -32.163 -54.014 1.00 15.42 O ATOM 1699 CB ASP A 105 12.274 -33.391 -51.140 1.00 30.02 C ATOM 1700 CG ASP A 105 13.317 -32.323 -50.874 1.00 40.45 C ATOM 1701 OD1 ASP A 105 12.948 -31.201 -50.458 1.00 4.24 O ATOM 1702 OD2 ASP A 105 14.522 -32.589 -51.055 1.00 70.11 O ATOM 0 H ASP A 105 10.630 -35.037 -52.084 1.00 43.55 H new ATOM 0 HA ASP A 105 10.985 -32.148 -52.277 1.00 31.31 H new ATOM 0 HB2 ASP A 105 11.607 -33.459 -50.280 1.00 30.02 H new ATOM 0 HB3 ASP A 105 12.770 -34.357 -51.236 1.00 30.02 H new ATOM 1707 N THR A 106 12.262 -34.281 -54.294 1.00 22.31 N ATOM 1708 CA THR A 106 12.901 -34.510 -55.540 1.00 2.34 C ATOM 1709 C THR A 106 12.069 -35.543 -56.289 1.00 70.20 C ATOM 1710 O THR A 106 11.328 -36.317 -55.656 1.00 3.35 O ATOM 1711 CB THR A 106 14.363 -35.019 -55.349 1.00 75.42 C ATOM 1712 OG1 THR A 106 15.011 -35.226 -56.617 1.00 10.33 O ATOM 1713 CG2 THR A 106 14.420 -36.301 -54.528 1.00 1.42 C ATOM 0 H THR A 106 11.760 -35.098 -53.946 1.00 22.31 H new ATOM 0 HA THR A 106 12.966 -33.579 -56.102 1.00 2.34 H new ATOM 0 HB THR A 106 14.894 -34.241 -54.800 1.00 75.42 H new ATOM 0 HG1 THR A 106 15.703 -35.913 -56.522 1.00 10.33 H new ATOM 0 HG21 THR A 106 15.457 -36.618 -54.421 1.00 1.42 H new ATOM 0 HG22 THR A 106 13.992 -36.121 -53.542 1.00 1.42 H new ATOM 0 HG23 THR A 106 13.852 -37.082 -55.033 1.00 1.42 H new ATOM 1721 N SER A 107 12.155 -35.549 -57.603 1.00 42.11 N ATOM 1722 CA SER A 107 11.436 -36.512 -58.415 1.00 35.12 C ATOM 1723 C SER A 107 12.089 -37.891 -58.285 1.00 63.34 C ATOM 1724 O SER A 107 11.468 -38.922 -58.565 1.00 51.14 O ATOM 1725 CB SER A 107 11.442 -36.052 -59.871 1.00 71.32 C ATOM 1726 OG SER A 107 10.887 -34.744 -59.984 1.00 74.22 O ATOM 0 H SER A 107 12.722 -34.891 -58.137 1.00 42.11 H new ATOM 0 HA SER A 107 10.404 -36.584 -58.071 1.00 35.12 H new ATOM 0 HB2 SER A 107 12.462 -36.055 -60.255 1.00 71.32 H new ATOM 0 HB3 SER A 107 10.869 -36.750 -60.481 1.00 71.32 H new ATOM 0 HG SER A 107 10.900 -34.463 -60.923 1.00 74.22 H new ATOM 1732 N LEU A 108 13.352 -37.875 -57.835 1.00 24.11 N ATOM 1733 CA LEU A 108 14.175 -39.058 -57.641 1.00 73.51 C ATOM 1734 C LEU A 108 14.373 -39.738 -59.005 1.00 33.41 C ATOM 1735 O LEU A 108 13.884 -40.842 -59.268 1.00 1.41 O ATOM 1736 CB LEU A 108 13.559 -40.012 -56.547 1.00 74.42 C ATOM 1737 CG LEU A 108 14.468 -41.097 -55.865 1.00 62.42 C ATOM 1738 CD1 LEU A 108 15.017 -42.133 -56.830 1.00 12.33 C ATOM 1739 CD2 LEU A 108 15.592 -40.444 -55.086 1.00 62.42 C ATOM 0 H LEU A 108 13.835 -37.010 -57.592 1.00 24.11 H new ATOM 0 HA LEU A 108 15.155 -38.781 -57.254 1.00 73.51 H new ATOM 0 HB2 LEU A 108 13.153 -39.382 -55.756 1.00 74.42 H new ATOM 0 HB3 LEU A 108 12.717 -40.532 -57.004 1.00 74.42 H new ATOM 0 HG LEU A 108 13.819 -41.640 -55.178 1.00 62.42 H new ATOM 0 HD11 LEU A 108 15.634 -42.847 -56.285 1.00 12.33 H new ATOM 0 HD12 LEU A 108 14.191 -42.659 -57.308 1.00 12.33 H new ATOM 0 HD13 LEU A 108 15.621 -41.638 -57.591 1.00 12.33 H new ATOM 0 HD21 LEU A 108 16.209 -41.214 -54.622 1.00 62.42 H new ATOM 0 HD22 LEU A 108 16.204 -39.847 -55.762 1.00 62.42 H new ATOM 0 HD23 LEU A 108 15.173 -39.800 -54.313 1.00 62.42 H new ATOM 1751 N SER A 109 14.997 -39.011 -59.894 1.00 4.40 N ATOM 1752 CA SER A 109 15.310 -39.504 -61.210 1.00 52.42 C ATOM 1753 C SER A 109 16.773 -39.237 -61.537 1.00 35.13 C ATOM 1754 O SER A 109 17.244 -39.483 -62.652 1.00 44.43 O ATOM 1755 CB SER A 109 14.392 -38.832 -62.227 1.00 40.20 C ATOM 1756 OG SER A 109 14.469 -37.418 -62.117 1.00 24.32 O ATOM 0 H SER A 109 15.305 -38.053 -59.724 1.00 4.40 H new ATOM 0 HA SER A 109 15.150 -40.582 -61.247 1.00 52.42 H new ATOM 0 HB2 SER A 109 14.672 -39.139 -63.235 1.00 40.20 H new ATOM 0 HB3 SER A 109 13.364 -39.158 -62.068 1.00 40.20 H new ATOM 0 HG SER A 109 13.875 -37.006 -62.778 1.00 24.32 H new ATOM 1762 N TYR A 110 17.489 -38.750 -60.556 1.00 44.41 N ATOM 1763 CA TYR A 110 18.881 -38.416 -60.716 1.00 30.11 C ATOM 1764 C TYR A 110 19.747 -39.651 -60.531 1.00 32.14 C ATOM 1765 O TYR A 110 19.740 -40.284 -59.468 1.00 44.43 O ATOM 1766 CB TYR A 110 19.291 -37.268 -59.757 1.00 23.32 C ATOM 1767 CG TYR A 110 19.093 -37.551 -58.271 1.00 73.43 C ATOM 1768 CD1 TYR A 110 17.833 -37.492 -57.694 1.00 52.30 C ATOM 1769 CD2 TYR A 110 20.169 -37.862 -57.452 1.00 51.12 C ATOM 1770 CE1 TYR A 110 17.647 -37.735 -56.354 1.00 3.04 C ATOM 1771 CE2 TYR A 110 19.990 -38.109 -56.108 1.00 23.41 C ATOM 1772 CZ TYR A 110 18.727 -38.045 -55.566 1.00 74.33 C ATOM 1773 OH TYR A 110 18.544 -38.282 -54.219 1.00 30.01 O ATOM 0 H TYR A 110 17.122 -38.573 -59.621 1.00 44.41 H new ATOM 0 HA TYR A 110 19.039 -38.053 -61.732 1.00 30.11 H new ATOM 0 HB2 TYR A 110 20.342 -37.034 -59.927 1.00 23.32 H new ATOM 0 HB3 TYR A 110 18.719 -36.378 -60.019 1.00 23.32 H new ATOM 0 HD1 TYR A 110 16.980 -37.250 -58.311 1.00 52.30 H new ATOM 0 HD2 TYR A 110 21.162 -37.911 -57.874 1.00 51.12 H new ATOM 0 HE1 TYR A 110 16.658 -37.682 -55.924 1.00 3.04 H new ATOM 0 HE2 TYR A 110 20.837 -38.352 -55.483 1.00 23.41 H new ATOM 0 HH TYR A 110 19.407 -38.489 -53.803 1.00 30.01 H new ATOM 1783 N ILE A 111 20.435 -40.018 -61.567 1.00 40.45 N ATOM 1784 CA ILE A 111 21.309 -41.147 -61.540 1.00 62.31 C ATOM 1785 C ILE A 111 22.489 -40.915 -62.474 1.00 34.35 C ATOM 1786 O ILE A 111 23.554 -40.503 -61.981 1.00 38.70 O ATOM 1787 CB ILE A 111 20.565 -42.492 -61.829 1.00 41.43 C ATOM 1788 CG1 ILE A 111 21.559 -43.661 -61.852 1.00 51.23 C ATOM 1789 CG2 ILE A 111 19.708 -42.431 -63.104 1.00 60.33 C ATOM 1790 CD1 ILE A 111 20.906 -45.005 -61.973 1.00 72.35 C ATOM 1791 OXT ILE A 111 22.334 -41.058 -63.694 1.00 38.70 O ATOM 0 H ILE A 111 20.404 -39.536 -62.465 1.00 40.45 H new ATOM 0 HA ILE A 111 21.697 -41.250 -60.527 1.00 62.31 H new ATOM 0 HB ILE A 111 19.864 -42.663 -61.012 1.00 41.43 H new ATOM 0 HG12 ILE A 111 22.247 -43.525 -62.686 1.00 51.23 H new ATOM 0 HG13 ILE A 111 22.155 -43.637 -60.940 1.00 51.23 H new ATOM 0 HG21 ILE A 111 19.214 -43.391 -63.257 1.00 60.33 H new ATOM 0 HG22 ILE A 111 18.956 -41.649 -63.000 1.00 60.33 H new ATOM 0 HG23 ILE A 111 20.345 -42.210 -63.960 1.00 60.33 H new ATOM 0 HD11 ILE A 111 21.671 -45.782 -61.983 1.00 72.35 H new ATOM 0 HD12 ILE A 111 20.239 -45.163 -61.125 1.00 72.35 H new ATOM 0 HD13 ILE A 111 20.333 -45.049 -62.899 1.00 72.35 H new TER 1803 ILE A 111