USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1201 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 98 SER OG : rot 100:sc= -1.47 USER MOD Set 1.2: A 107 GLN : amide:sc= -1.36 X(o=-2.8,f=-2.9) USER MOD Set 2.1: A 83 HIS :FLIP no HE2:sc=-0.00439 F(o=-0.78,f=-0.0044) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 CYS SG : rot 44:sc= -3.9! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.778 K(o=-0.78,f=-2.6) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 40 MET CE :methyl 153:sc= -5.4! (180deg=-6.82!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 48 MET CE :methyl -139:sc= -0.0152 (180deg=-0.658) USER MOD Single : A 56 GLN : amide:sc= -0.0861 K(o=-0.086,f=-1.1!) USER MOD Single : A 57 ASN :FLIP amide:sc= -4.37! C(o=-5.5!,f=-4.4!) USER MOD Single : A 59 SER OG : rot 180:sc= -0.554 USER MOD Single : A 64 LYS NZ :NH3+ -149:sc= 0.00812 (180deg=-0.0231) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.674 F(o=-2.4,f=-0.67) USER MOD Single : A 77 TYR OH : rot 10:sc= 0.274 USER MOD Single : A 78 SER OG : rot -170:sc= -0.454 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.0635 USER MOD Single : A 80 LYS NZ :NH3+ -149:sc= -0.0298 (180deg=-0.728) USER MOD Single : A 81 TYR OH : rot 165:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= -0.958 USER MOD Single : A 93 CYS SG : rot -145:sc= -1.88 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot -173:sc= -2.59 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.44 X(o=-0.44,f=-0.15) USER MOD Single : A 108 MET CE :methyl -168:sc= 0 (180deg=-0.202) USER MOD Single : A 109 MET CE :methyl -163:sc= -1.87 (180deg=-2.29!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 104:sc= 0.0438 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 120 THR OG1 : rot 77:sc= 1.13 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc=-0.00921 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -72:sc= 0.32 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 179:sc= 0.0619 (180deg=0.0619) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot -55:sc= 0.181 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.422 -4.574 12.297 1.00 44.54 N ATOM 2 CA GLY A 1 3.595 -4.206 13.690 1.00 72.02 C ATOM 3 C GLY A 1 4.564 -3.055 13.871 1.00 42.24 C ATOM 4 O GLY A 1 4.214 -2.024 14.445 1.00 72.51 O ATOM 0 H1 GLY A 1 2.750 -5.365 12.228 1.00 44.54 H new ATOM 0 H2 GLY A 1 3.053 -3.759 11.766 1.00 44.54 H new ATOM 0 H3 GLY A 1 4.338 -4.862 11.898 1.00 44.54 H new ATOM 0 HA2 GLY A 1 2.628 -3.933 14.113 1.00 72.02 H new ATOM 0 HA3 GLY A 1 3.954 -5.070 14.249 1.00 72.02 H new ATOM 8 N SER A 2 5.788 -3.230 13.379 1.00 35.33 N ATOM 9 CA SER A 2 6.812 -2.199 13.495 1.00 32.10 C ATOM 10 C SER A 2 7.181 -1.960 14.956 1.00 1.22 C ATOM 11 O SER A 2 6.525 -2.470 15.864 1.00 51.31 O ATOM 12 CB SER A 2 6.327 -0.895 12.859 1.00 12.41 C ATOM 13 OG SER A 2 7.211 -0.465 11.838 1.00 14.32 O ATOM 0 H SER A 2 6.093 -4.076 12.897 1.00 35.33 H new ATOM 0 HA SER A 2 7.701 -2.544 12.967 1.00 32.10 H new ATOM 0 HB2 SER A 2 5.329 -1.038 12.444 1.00 12.41 H new ATOM 0 HB3 SER A 2 6.246 -0.122 13.623 1.00 12.41 H new ATOM 0 HG SER A 2 6.878 0.369 11.447 1.00 14.32 H new ATOM 19 N SER A 3 8.234 -1.181 15.174 1.00 44.45 N ATOM 20 CA SER A 3 8.695 -0.876 16.524 1.00 11.02 C ATOM 21 C SER A 3 8.878 -2.155 17.336 1.00 1.51 C ATOM 22 O SER A 3 7.917 -2.708 17.869 1.00 62.03 O ATOM 23 CB SER A 3 7.701 0.050 17.226 1.00 3.32 C ATOM 24 OG SER A 3 7.869 1.393 16.804 1.00 62.33 O ATOM 0 H SER A 3 8.785 -0.749 14.433 1.00 44.45 H new ATOM 0 HA SER A 3 9.659 -0.373 16.449 1.00 11.02 H new ATOM 0 HB2 SER A 3 6.683 -0.276 17.014 1.00 3.32 H new ATOM 0 HB3 SER A 3 7.838 -0.015 18.305 1.00 3.32 H new ATOM 0 HG SER A 3 7.221 1.965 17.266 1.00 62.33 H new ATOM 30 N GLY A 4 10.121 -2.618 17.427 1.00 41.43 N ATOM 31 CA GLY A 4 10.410 -3.827 18.175 1.00 13.22 C ATOM 32 C GLY A 4 11.402 -4.726 17.465 1.00 0.45 C ATOM 33 O GLY A 4 12.530 -4.900 17.925 1.00 25.13 O ATOM 0 H GLY A 4 10.933 -2.177 16.996 1.00 41.43 H new ATOM 0 HA2 GLY A 4 10.805 -3.558 19.155 1.00 13.22 H new ATOM 0 HA3 GLY A 4 9.484 -4.376 18.344 1.00 13.22 H new ATOM 37 N SER A 5 10.982 -5.298 16.342 1.00 33.15 N ATOM 38 CA SER A 5 11.841 -6.188 15.571 1.00 73.32 C ATOM 39 C SER A 5 13.047 -5.435 15.018 1.00 70.25 C ATOM 40 O SER A 5 12.966 -4.243 14.721 1.00 42.41 O ATOM 41 CB SER A 5 11.053 -6.824 14.423 1.00 1.20 C ATOM 42 OG SER A 5 10.100 -7.751 14.912 1.00 72.54 O ATOM 0 H SER A 5 10.052 -5.161 15.946 1.00 33.15 H new ATOM 0 HA SER A 5 12.199 -6.974 16.237 1.00 73.32 H new ATOM 0 HB2 SER A 5 10.548 -6.047 13.850 1.00 1.20 H new ATOM 0 HB3 SER A 5 11.739 -7.328 13.742 1.00 1.20 H new ATOM 0 HG SER A 5 9.608 -8.142 14.160 1.00 72.54 H new ATOM 48 N SER A 6 14.166 -6.139 14.883 1.00 72.24 N ATOM 49 CA SER A 6 15.391 -5.538 14.369 1.00 45.40 C ATOM 50 C SER A 6 16.033 -6.430 13.312 1.00 70.13 C ATOM 51 O SER A 6 15.736 -7.621 13.223 1.00 13.11 O ATOM 52 CB SER A 6 16.380 -5.289 15.511 1.00 34.40 C ATOM 53 OG SER A 6 15.958 -4.207 16.323 1.00 33.42 O ATOM 0 H SER A 6 14.250 -7.127 15.123 1.00 72.24 H new ATOM 0 HA SER A 6 15.132 -4.586 13.907 1.00 45.40 H new ATOM 0 HB2 SER A 6 16.473 -6.189 16.119 1.00 34.40 H new ATOM 0 HB3 SER A 6 17.368 -5.077 15.101 1.00 34.40 H new ATOM 0 HG SER A 6 16.605 -4.069 17.046 1.00 33.42 H new ATOM 59 N GLY A 7 16.917 -5.845 12.509 1.00 21.13 N ATOM 60 CA GLY A 7 17.588 -6.600 11.468 1.00 41.20 C ATOM 61 C GLY A 7 19.076 -6.316 11.412 1.00 10.31 C ATOM 62 O GLY A 7 19.885 -7.233 11.263 1.00 1.33 O ATOM 0 H GLY A 7 17.180 -4.861 12.561 1.00 21.13 H new ATOM 0 HA2 GLY A 7 17.431 -7.665 11.638 1.00 41.20 H new ATOM 0 HA3 GLY A 7 17.139 -6.361 10.504 1.00 41.20 H new ATOM 66 N SER A 8 19.439 -5.043 11.530 1.00 60.12 N ATOM 67 CA SER A 8 20.839 -4.640 11.487 1.00 42.30 C ATOM 68 C SER A 8 21.588 -5.394 10.392 1.00 21.51 C ATOM 69 O SER A 8 22.706 -5.866 10.602 1.00 64.30 O ATOM 70 CB SER A 8 21.506 -4.888 12.841 1.00 72.11 C ATOM 71 OG SER A 8 20.838 -4.185 13.875 1.00 45.15 O ATOM 0 H SER A 8 18.782 -4.273 11.656 1.00 60.12 H new ATOM 0 HA SER A 8 20.877 -3.574 11.262 1.00 42.30 H new ATOM 0 HB2 SER A 8 21.502 -5.955 13.062 1.00 72.11 H new ATOM 0 HB3 SER A 8 22.549 -4.575 12.799 1.00 72.11 H new ATOM 0 HG SER A 8 21.282 -4.361 14.730 1.00 45.15 H new ATOM 77 N ASP A 9 20.964 -5.506 9.225 1.00 10.54 N ATOM 78 CA ASP A 9 21.570 -6.202 8.096 1.00 11.22 C ATOM 79 C ASP A 9 21.602 -5.309 6.860 1.00 3.41 C ATOM 80 O ASP A 9 21.854 -4.108 6.956 1.00 22.03 O ATOM 81 CB ASP A 9 20.802 -7.489 7.792 1.00 24.21 C ATOM 82 CG ASP A 9 21.671 -8.538 7.125 1.00 13.42 C ATOM 83 OD1 ASP A 9 22.452 -9.202 7.839 1.00 52.12 O ATOM 84 OD2 ASP A 9 21.570 -8.694 5.891 1.00 11.15 O ATOM 0 H ASP A 9 20.038 -5.123 9.036 1.00 10.54 H new ATOM 0 HA ASP A 9 22.596 -6.455 8.365 1.00 11.22 H new ATOM 0 HB2 ASP A 9 20.396 -7.894 8.719 1.00 24.21 H new ATOM 0 HB3 ASP A 9 19.955 -7.259 7.146 1.00 24.21 H new ATOM 89 N SER A 10 21.345 -5.903 5.700 1.00 62.20 N ATOM 90 CA SER A 10 21.349 -5.163 4.443 1.00 21.35 C ATOM 91 C SER A 10 20.219 -5.632 3.533 1.00 62.33 C ATOM 92 O SER A 10 19.889 -6.819 3.494 1.00 13.41 O ATOM 93 CB SER A 10 22.695 -5.329 3.734 1.00 74.41 C ATOM 94 OG SER A 10 23.769 -4.968 4.584 1.00 13.22 O ATOM 0 H SER A 10 21.131 -6.896 5.604 1.00 62.20 H new ATOM 0 HA SER A 10 21.194 -4.108 4.670 1.00 21.35 H new ATOM 0 HB2 SER A 10 22.814 -6.363 3.412 1.00 74.41 H new ATOM 0 HB3 SER A 10 22.715 -4.711 2.836 1.00 74.41 H new ATOM 0 HG SER A 10 24.617 -5.085 4.107 1.00 13.22 H new ATOM 100 N LEU A 11 19.629 -4.694 2.800 1.00 4.22 N ATOM 101 CA LEU A 11 18.536 -5.010 1.888 1.00 55.40 C ATOM 102 C LEU A 11 18.756 -4.357 0.528 1.00 63.15 C ATOM 103 O LEU A 11 19.747 -3.658 0.316 1.00 53.25 O ATOM 104 CB LEU A 11 17.203 -4.546 2.479 1.00 3.43 C ATOM 105 CG LEU A 11 16.846 -5.110 3.854 1.00 13.24 C ATOM 106 CD1 LEU A 11 15.925 -4.156 4.600 1.00 24.02 C ATOM 107 CD2 LEU A 11 16.198 -6.480 3.716 1.00 24.01 C ATOM 0 H LEU A 11 19.890 -3.708 2.820 1.00 4.22 H new ATOM 0 HA LEU A 11 18.510 -6.091 1.752 1.00 55.40 H new ATOM 0 HB2 LEU A 11 17.218 -3.458 2.547 1.00 3.43 H new ATOM 0 HB3 LEU A 11 16.408 -4.811 1.782 1.00 3.43 H new ATOM 0 HG LEU A 11 17.765 -5.220 4.430 1.00 13.24 H new ATOM 0 HD11 LEU A 11 15.682 -4.574 5.577 1.00 24.02 H new ATOM 0 HD12 LEU A 11 16.424 -3.196 4.731 1.00 24.02 H new ATOM 0 HD13 LEU A 11 15.008 -4.013 4.028 1.00 24.02 H new ATOM 0 HD21 LEU A 11 15.950 -6.867 4.705 1.00 24.01 H new ATOM 0 HD22 LEU A 11 15.288 -6.394 3.122 1.00 24.01 H new ATOM 0 HD23 LEU A 11 16.891 -7.162 3.223 1.00 24.01 H new ATOM 119 N VAL A 12 17.825 -4.591 -0.393 1.00 4.21 N ATOM 120 CA VAL A 12 17.916 -4.023 -1.733 1.00 63.53 C ATOM 121 C VAL A 12 17.169 -2.698 -1.821 1.00 12.34 C ATOM 122 O VAL A 12 16.529 -2.398 -2.829 1.00 30.24 O ATOM 123 CB VAL A 12 17.351 -4.990 -2.790 1.00 52.15 C ATOM 124 CG1 VAL A 12 17.869 -4.629 -4.175 1.00 31.21 C ATOM 125 CG2 VAL A 12 17.700 -6.428 -2.439 1.00 3.00 C ATOM 0 H VAL A 12 17.000 -5.170 -0.235 1.00 4.21 H new ATOM 0 HA VAL A 12 18.974 -3.853 -1.934 1.00 63.53 H new ATOM 0 HB VAL A 12 16.265 -4.897 -2.798 1.00 52.15 H new ATOM 0 HG11 VAL A 12 17.459 -5.323 -4.909 1.00 31.21 H new ATOM 0 HG12 VAL A 12 17.562 -3.613 -4.425 1.00 31.21 H new ATOM 0 HG13 VAL A 12 18.957 -4.692 -4.184 1.00 31.21 H new ATOM 0 HG21 VAL A 12 17.292 -7.097 -3.197 1.00 3.00 H new ATOM 0 HG22 VAL A 12 18.784 -6.540 -2.401 1.00 3.00 H new ATOM 0 HG23 VAL A 12 17.275 -6.679 -1.467 1.00 3.00 H new ATOM 135 N VAL A 13 17.253 -1.905 -0.756 1.00 42.24 N ATOM 136 CA VAL A 13 16.586 -0.610 -0.713 1.00 4.34 C ATOM 137 C VAL A 13 16.562 0.043 -2.090 1.00 63.43 C ATOM 138 O VAL A 13 17.500 -0.105 -2.874 1.00 40.41 O ATOM 139 CB VAL A 13 17.275 0.344 0.283 1.00 70.45 C ATOM 140 CG1 VAL A 13 18.781 0.336 0.074 1.00 64.14 C ATOM 141 CG2 VAL A 13 16.716 1.752 0.144 1.00 22.25 C ATOM 0 H VAL A 13 17.777 -2.138 0.088 1.00 42.24 H new ATOM 0 HA VAL A 13 15.563 -0.792 -0.383 1.00 4.34 H new ATOM 0 HB VAL A 13 17.071 -0.005 1.295 1.00 70.45 H new ATOM 0 HG11 VAL A 13 19.251 1.015 0.786 1.00 64.14 H new ATOM 0 HG12 VAL A 13 19.164 -0.673 0.228 1.00 64.14 H new ATOM 0 HG13 VAL A 13 19.009 0.660 -0.941 1.00 64.14 H new ATOM 0 HG21 VAL A 13 17.213 2.413 0.854 1.00 22.25 H new ATOM 0 HG22 VAL A 13 16.888 2.113 -0.870 1.00 22.25 H new ATOM 0 HG23 VAL A 13 15.645 1.740 0.348 1.00 22.25 H new ATOM 151 N CYS A 14 15.485 0.764 -2.378 1.00 34.21 N ATOM 152 CA CYS A 14 15.337 1.439 -3.663 1.00 24.34 C ATOM 153 C CYS A 14 14.944 2.900 -3.467 1.00 23.21 C ATOM 154 O CYS A 14 14.840 3.378 -2.338 1.00 34.15 O ATOM 155 CB CYS A 14 14.290 0.727 -4.520 1.00 13.02 C ATOM 156 SG CYS A 14 14.851 -0.844 -5.218 1.00 45.43 S ATOM 0 H CYS A 14 14.701 0.897 -1.739 1.00 34.21 H new ATOM 0 HA CYS A 14 16.298 1.405 -4.176 1.00 24.34 H new ATOM 0 HB2 CYS A 14 13.402 0.547 -3.914 1.00 13.02 H new ATOM 0 HB3 CYS A 14 13.992 1.388 -5.334 1.00 13.02 H new ATOM 0 HG CYS A 14 15.486 -1.521 -4.308 1.00 45.43 H new ATOM 162 N GLU A 15 14.730 3.603 -4.574 1.00 52.53 N ATOM 163 CA GLU A 15 14.351 5.010 -4.523 1.00 14.33 C ATOM 164 C GLU A 15 12.891 5.196 -4.929 1.00 12.42 C ATOM 165 O GLU A 15 12.304 4.336 -5.586 1.00 62.04 O ATOM 166 CB GLU A 15 15.255 5.838 -5.438 1.00 13.41 C ATOM 167 CG GLU A 15 15.139 5.468 -6.907 1.00 61.01 C ATOM 168 CD GLU A 15 16.467 5.543 -7.635 1.00 34.33 C ATOM 169 OE1 GLU A 15 17.341 6.319 -7.194 1.00 12.20 O ATOM 170 OE2 GLU A 15 16.632 4.827 -8.644 1.00 71.15 O ATOM 0 H GLU A 15 14.812 3.222 -5.517 1.00 52.53 H new ATOM 0 HA GLU A 15 14.471 5.355 -3.496 1.00 14.33 H new ATOM 0 HB2 GLU A 15 15.010 6.893 -5.318 1.00 13.41 H new ATOM 0 HB3 GLU A 15 16.290 5.713 -5.121 1.00 13.41 H new ATOM 0 HG2 GLU A 15 14.739 4.458 -6.993 1.00 61.01 H new ATOM 0 HG3 GLU A 15 14.426 6.136 -7.391 1.00 61.01 H new ATOM 177 N VAL A 16 12.312 6.325 -4.534 1.00 15.43 N ATOM 178 CA VAL A 16 10.922 6.625 -4.855 1.00 52.25 C ATOM 179 C VAL A 16 10.808 7.306 -6.215 1.00 62.12 C ATOM 180 O VAL A 16 10.978 8.520 -6.329 1.00 62.42 O ATOM 181 CB VAL A 16 10.280 7.528 -3.786 1.00 45.20 C ATOM 182 CG1 VAL A 16 11.146 8.754 -3.533 1.00 0.13 C ATOM 183 CG2 VAL A 16 8.876 7.935 -4.206 1.00 72.22 C ATOM 0 H VAL A 16 12.784 7.048 -3.991 1.00 15.43 H new ATOM 0 HA VAL A 16 10.391 5.674 -4.881 1.00 52.25 H new ATOM 0 HB VAL A 16 10.207 6.965 -2.855 1.00 45.20 H new ATOM 0 HG11 VAL A 16 10.677 9.381 -2.775 1.00 0.13 H new ATOM 0 HG12 VAL A 16 12.130 8.439 -3.185 1.00 0.13 H new ATOM 0 HG13 VAL A 16 11.252 9.321 -4.458 1.00 0.13 H new ATOM 0 HG21 VAL A 16 8.437 8.573 -3.439 1.00 72.22 H new ATOM 0 HG22 VAL A 16 8.922 8.480 -5.149 1.00 72.22 H new ATOM 0 HG23 VAL A 16 8.261 7.044 -4.332 1.00 72.22 H new ATOM 193 N ASP A 17 10.518 6.515 -7.243 1.00 44.34 N ATOM 194 CA ASP A 17 10.379 7.042 -8.596 1.00 63.23 C ATOM 195 C ASP A 17 9.754 8.433 -8.577 1.00 13.24 C ATOM 196 O ASP A 17 8.832 8.715 -7.812 1.00 11.55 O ATOM 197 CB ASP A 17 9.528 6.099 -9.448 1.00 63.03 C ATOM 198 CG ASP A 17 9.601 6.429 -10.926 1.00 22.24 C ATOM 199 OD1 ASP A 17 10.504 5.901 -11.607 1.00 73.44 O ATOM 200 OD2 ASP A 17 8.756 7.216 -11.401 1.00 51.01 O ATOM 0 H ASP A 17 10.375 5.508 -7.165 1.00 44.34 H new ATOM 0 HA ASP A 17 11.374 7.117 -9.034 1.00 63.23 H new ATOM 0 HB2 ASP A 17 9.860 5.073 -9.291 1.00 63.03 H new ATOM 0 HB3 ASP A 17 8.491 6.152 -9.118 1.00 63.03 H new ATOM 205 N PRO A 18 10.267 9.325 -9.437 1.00 71.33 N ATOM 206 CA PRO A 18 9.775 10.701 -9.538 1.00 3.42 C ATOM 207 C PRO A 18 8.377 10.775 -10.143 1.00 14.14 C ATOM 208 O PRO A 18 7.593 11.662 -9.809 1.00 62.11 O ATOM 209 CB PRO A 18 10.794 11.376 -10.461 1.00 32.32 C ATOM 210 CG PRO A 18 11.360 10.265 -11.276 1.00 23.23 C ATOM 211 CD PRO A 18 11.367 9.057 -10.380 1.00 30.21 C ATOM 0 HA PRO A 18 9.686 11.174 -8.560 1.00 3.42 H new ATOM 0 HB2 PRO A 18 10.320 12.128 -11.092 1.00 32.32 H new ATOM 0 HB3 PRO A 18 11.571 11.883 -9.889 1.00 32.32 H new ATOM 0 HG2 PRO A 18 10.757 10.087 -12.166 1.00 23.23 H new ATOM 0 HG3 PRO A 18 12.367 10.504 -11.616 1.00 23.23 H new ATOM 0 HD2 PRO A 18 11.199 8.139 -10.942 1.00 30.21 H new ATOM 0 HD3 PRO A 18 12.320 8.945 -9.864 1.00 30.21 H new ATOM 219 N GLU A 19 8.072 9.836 -11.034 1.00 60.10 N ATOM 220 CA GLU A 19 6.768 9.796 -11.684 1.00 44.34 C ATOM 221 C GLU A 19 5.692 9.309 -10.718 1.00 45.24 C ATOM 222 O GLU A 19 4.515 9.637 -10.866 1.00 54.32 O ATOM 223 CB GLU A 19 6.815 8.886 -12.913 1.00 55.12 C ATOM 224 CG GLU A 19 6.452 7.441 -12.615 1.00 24.31 C ATOM 225 CD GLU A 19 5.050 7.085 -13.069 1.00 41.54 C ATOM 226 OE1 GLU A 19 4.087 7.691 -12.555 1.00 12.41 O ATOM 227 OE2 GLU A 19 4.916 6.200 -13.941 1.00 13.22 O ATOM 0 H GLU A 19 8.710 9.094 -11.321 1.00 60.10 H new ATOM 0 HA GLU A 19 6.516 10.809 -11.999 1.00 44.34 H new ATOM 0 HB2 GLU A 19 6.132 9.275 -13.669 1.00 55.12 H new ATOM 0 HB3 GLU A 19 7.817 8.919 -13.341 1.00 55.12 H new ATOM 0 HG2 GLU A 19 7.167 6.782 -13.107 1.00 24.31 H new ATOM 0 HG3 GLU A 19 6.539 7.262 -11.543 1.00 24.31 H new ATOM 234 N LEU A 20 6.105 8.526 -9.728 1.00 61.12 N ATOM 235 CA LEU A 20 5.178 7.992 -8.737 1.00 2.52 C ATOM 236 C LEU A 20 5.041 8.944 -7.552 1.00 71.43 C ATOM 237 O LEU A 20 3.954 9.115 -7.002 1.00 32.52 O ATOM 238 CB LEU A 20 5.652 6.621 -8.252 1.00 22.11 C ATOM 239 CG LEU A 20 4.554 5.615 -7.907 1.00 73.13 C ATOM 240 CD1 LEU A 20 5.153 4.245 -7.629 1.00 63.40 C ATOM 241 CD2 LEU A 20 3.744 6.097 -6.713 1.00 33.01 C ATOM 0 H LEU A 20 7.076 8.247 -9.590 1.00 61.12 H new ATOM 0 HA LEU A 20 4.201 7.885 -9.209 1.00 2.52 H new ATOM 0 HB2 LEU A 20 6.287 6.185 -9.023 1.00 22.11 H new ATOM 0 HB3 LEU A 20 6.275 6.766 -7.369 1.00 22.11 H new ATOM 0 HG LEU A 20 3.885 5.529 -8.763 1.00 73.13 H new ATOM 0 HD11 LEU A 20 4.356 3.542 -7.385 1.00 63.40 H new ATOM 0 HD12 LEU A 20 5.687 3.896 -8.512 1.00 63.40 H new ATOM 0 HD13 LEU A 20 5.845 4.314 -6.790 1.00 63.40 H new ATOM 0 HD21 LEU A 20 2.967 5.368 -6.482 1.00 33.01 H new ATOM 0 HD22 LEU A 20 4.401 6.213 -5.851 1.00 33.01 H new ATOM 0 HD23 LEU A 20 3.283 7.056 -6.949 1.00 33.01 H new ATOM 253 N LYS A 21 6.151 9.564 -7.166 1.00 62.42 N ATOM 254 CA LYS A 21 6.157 10.501 -6.050 1.00 3.33 C ATOM 255 C LYS A 21 4.974 11.460 -6.139 1.00 65.12 C ATOM 256 O LYS A 21 4.311 11.736 -5.141 1.00 11.22 O ATOM 257 CB LYS A 21 7.468 11.292 -6.026 1.00 71.54 C ATOM 258 CG LYS A 21 7.697 12.051 -4.731 1.00 52.25 C ATOM 259 CD LYS A 21 8.351 13.399 -4.983 1.00 65.11 C ATOM 260 CE LYS A 21 9.805 13.404 -4.536 1.00 10.44 C ATOM 261 NZ LYS A 21 10.208 14.724 -3.977 1.00 11.30 N ATOM 0 H LYS A 21 7.060 9.434 -7.611 1.00 62.42 H new ATOM 0 HA LYS A 21 6.070 9.928 -5.127 1.00 3.33 H new ATOM 0 HB2 LYS A 21 8.299 10.606 -6.187 1.00 71.54 H new ATOM 0 HB3 LYS A 21 7.472 11.998 -6.857 1.00 71.54 H new ATOM 0 HG2 LYS A 21 6.745 12.197 -4.221 1.00 52.25 H new ATOM 0 HG3 LYS A 21 8.327 11.458 -4.067 1.00 52.25 H new ATOM 0 HD2 LYS A 21 8.295 13.639 -6.045 1.00 65.11 H new ATOM 0 HD3 LYS A 21 7.803 14.176 -4.451 1.00 65.11 H new ATOM 0 HE2 LYS A 21 9.957 12.629 -3.784 1.00 10.44 H new ATOM 0 HE3 LYS A 21 10.446 13.157 -5.382 1.00 10.44 H new ATOM 0 HZ1 LYS A 21 11.205 14.687 -3.684 1.00 11.30 H new ATOM 0 HZ2 LYS A 21 10.087 15.460 -4.702 1.00 11.30 H new ATOM 0 HZ3 LYS A 21 9.613 14.949 -3.154 1.00 11.30 H new ATOM 275 N GLU A 22 4.717 11.963 -7.343 1.00 13.53 N ATOM 276 CA GLU A 22 3.613 12.891 -7.561 1.00 11.44 C ATOM 277 C GLU A 22 2.271 12.204 -7.330 1.00 34.31 C ATOM 278 O GLU A 22 1.375 12.760 -6.693 1.00 0.42 O ATOM 279 CB GLU A 22 3.669 13.461 -8.980 1.00 23.43 C ATOM 280 CG GLU A 22 5.052 13.938 -9.389 1.00 72.14 C ATOM 281 CD GLU A 22 5.004 15.066 -10.402 1.00 73.40 C ATOM 282 OE1 GLU A 22 4.108 15.929 -10.287 1.00 5.13 O ATOM 283 OE2 GLU A 22 5.862 15.085 -11.309 1.00 74.22 O ATOM 0 H GLU A 22 5.257 11.744 -8.180 1.00 13.53 H new ATOM 0 HA GLU A 22 3.712 13.707 -6.845 1.00 11.44 H new ATOM 0 HB2 GLU A 22 3.334 12.698 -9.683 1.00 23.43 H new ATOM 0 HB3 GLU A 22 2.969 14.293 -9.056 1.00 23.43 H new ATOM 0 HG2 GLU A 22 5.593 14.272 -8.504 1.00 72.14 H new ATOM 0 HG3 GLU A 22 5.612 13.102 -9.808 1.00 72.14 H new ATOM 290 N THR A 23 2.136 10.988 -7.853 1.00 2.44 N ATOM 291 CA THR A 23 0.905 10.224 -7.706 1.00 14.00 C ATOM 292 C THR A 23 0.421 10.233 -6.260 1.00 23.33 C ATOM 293 O THR A 23 -0.733 10.562 -5.982 1.00 34.23 O ATOM 294 CB THR A 23 1.088 8.766 -8.164 1.00 64.23 C ATOM 295 OG1 THR A 23 1.096 8.699 -9.595 1.00 52.22 O ATOM 296 CG2 THR A 23 -0.021 7.881 -7.617 1.00 72.11 C ATOM 0 H THR A 23 2.866 10.512 -8.383 1.00 2.44 H new ATOM 0 HA THR A 23 0.159 10.704 -8.340 1.00 14.00 H new ATOM 0 HB THR A 23 2.041 8.406 -7.778 1.00 64.23 H new ATOM 0 HG1 THR A 23 1.215 7.768 -9.878 1.00 52.22 H new ATOM 0 HG21 THR A 23 0.131 6.856 -7.955 1.00 72.11 H new ATOM 0 HG22 THR A 23 -0.006 7.910 -6.527 1.00 72.11 H new ATOM 0 HG23 THR A 23 -0.985 8.242 -7.976 1.00 72.11 H new ATOM 304 N LEU A 24 1.310 9.869 -5.342 1.00 42.52 N ATOM 305 CA LEU A 24 0.974 9.837 -3.923 1.00 74.20 C ATOM 306 C LEU A 24 0.517 11.209 -3.439 1.00 72.22 C ATOM 307 O LEU A 24 -0.531 11.338 -2.807 1.00 33.33 O ATOM 308 CB LEU A 24 2.179 9.370 -3.104 1.00 31.11 C ATOM 309 CG LEU A 24 2.967 8.193 -3.681 1.00 0.30 C ATOM 310 CD1 LEU A 24 4.118 7.820 -2.760 1.00 75.31 C ATOM 311 CD2 LEU A 24 2.053 6.999 -3.908 1.00 73.15 C ATOM 0 H LEU A 24 2.268 9.592 -5.555 1.00 42.52 H new ATOM 0 HA LEU A 24 0.153 9.133 -3.786 1.00 74.20 H new ATOM 0 HB2 LEU A 24 2.860 10.213 -2.983 1.00 31.11 H new ATOM 0 HB3 LEU A 24 1.832 9.096 -2.108 1.00 31.11 H new ATOM 0 HG LEU A 24 3.382 8.494 -4.643 1.00 0.30 H new ATOM 0 HD11 LEU A 24 4.668 6.981 -3.186 1.00 75.31 H new ATOM 0 HD12 LEU A 24 4.787 8.673 -2.650 1.00 75.31 H new ATOM 0 HD13 LEU A 24 3.726 7.538 -1.783 1.00 75.31 H new ATOM 0 HD21 LEU A 24 2.631 6.171 -4.319 1.00 73.15 H new ATOM 0 HD22 LEU A 24 1.608 6.696 -2.960 1.00 73.15 H new ATOM 0 HD23 LEU A 24 1.264 7.273 -4.608 1.00 73.15 H new ATOM 323 N ARG A 25 1.310 12.232 -3.742 1.00 71.24 N ATOM 324 CA ARG A 25 0.986 13.595 -3.339 1.00 72.53 C ATOM 325 C ARG A 25 -0.391 14.002 -3.856 1.00 51.15 C ATOM 326 O ARG A 25 -1.099 14.785 -3.222 1.00 63.32 O ATOM 327 CB ARG A 25 2.046 14.568 -3.857 1.00 0.40 C ATOM 328 CG ARG A 25 1.790 16.014 -3.464 1.00 10.20 C ATOM 329 CD ARG A 25 2.569 16.978 -4.346 1.00 32.43 C ATOM 330 NE ARG A 25 1.686 17.846 -5.120 1.00 13.23 N ATOM 331 CZ ARG A 25 1.137 18.955 -4.637 1.00 4.34 C ATOM 332 NH1 ARG A 25 1.380 19.329 -3.388 1.00 1.30 N ATOM 333 NH2 ARG A 25 0.345 19.693 -5.403 1.00 52.21 N ATOM 0 H ARG A 25 2.181 12.142 -4.265 1.00 71.24 H new ATOM 0 HA ARG A 25 0.971 13.632 -2.250 1.00 72.53 H new ATOM 0 HB2 ARG A 25 3.022 14.265 -3.478 1.00 0.40 H new ATOM 0 HB3 ARG A 25 2.091 14.498 -4.944 1.00 0.40 H new ATOM 0 HG2 ARG A 25 0.724 16.230 -3.540 1.00 10.20 H new ATOM 0 HG3 ARG A 25 2.072 16.164 -2.422 1.00 10.20 H new ATOM 0 HD2 ARG A 25 3.225 17.589 -3.725 1.00 32.43 H new ATOM 0 HD3 ARG A 25 3.208 16.413 -5.025 1.00 32.43 H new ATOM 0 HE ARG A 25 1.479 17.587 -6.085 1.00 13.23 H new ATOM 0 HH11 ARG A 25 1.990 18.765 -2.796 1.00 1.30 H new ATOM 0 HH12 ARG A 25 0.957 20.181 -3.019 1.00 1.30 H new ATOM 0 HH21 ARG A 25 0.157 19.409 -6.364 1.00 52.21 H new ATOM 0 HH22 ARG A 25 -0.076 20.544 -5.031 1.00 52.21 H new ATOM 347 N LYS A 26 -0.764 13.468 -5.014 1.00 61.24 N ATOM 348 CA LYS A 26 -2.055 13.774 -5.619 1.00 13.02 C ATOM 349 C LYS A 26 -3.159 12.917 -5.007 1.00 31.24 C ATOM 350 O LYS A 26 -4.286 13.376 -4.824 1.00 11.12 O ATOM 351 CB LYS A 26 -2.000 13.550 -7.131 1.00 64.42 C ATOM 352 CG LYS A 26 -0.705 14.021 -7.769 1.00 11.35 C ATOM 353 CD LYS A 26 -0.962 15.040 -8.866 1.00 12.11 C ATOM 354 CE LYS A 26 0.113 14.987 -9.940 1.00 44.52 C ATOM 355 NZ LYS A 26 -0.470 14.880 -11.305 1.00 43.34 N ATOM 0 H LYS A 26 -0.190 12.820 -5.553 1.00 61.24 H new ATOM 0 HA LYS A 26 -2.281 14.822 -5.422 1.00 13.02 H new ATOM 0 HB2 LYS A 26 -2.132 12.488 -7.337 1.00 64.42 H new ATOM 0 HB3 LYS A 26 -2.836 14.071 -7.598 1.00 64.42 H new ATOM 0 HG2 LYS A 26 -0.062 14.460 -7.007 1.00 11.35 H new ATOM 0 HG3 LYS A 26 -0.171 13.166 -8.183 1.00 11.35 H new ATOM 0 HD2 LYS A 26 -1.937 14.853 -9.316 1.00 12.11 H new ATOM 0 HD3 LYS A 26 -0.997 16.040 -8.434 1.00 12.11 H new ATOM 0 HE2 LYS A 26 0.732 15.882 -9.879 1.00 44.52 H new ATOM 0 HE3 LYS A 26 0.767 14.135 -9.757 1.00 44.52 H new ATOM 0 HZ1 LYS A 26 0.296 14.847 -12.008 1.00 43.34 H new ATOM 0 HZ2 LYS A 26 -1.040 14.013 -11.372 1.00 43.34 H new ATOM 0 HZ3 LYS A 26 -1.074 15.706 -11.490 1.00 43.34 H new ATOM 369 N PHE A 27 -2.827 11.669 -4.691 1.00 32.13 N ATOM 370 CA PHE A 27 -3.790 10.748 -4.100 1.00 34.12 C ATOM 371 C PHE A 27 -4.283 11.268 -2.753 1.00 13.32 C ATOM 372 O PHE A 27 -5.432 11.044 -2.371 1.00 52.32 O ATOM 373 CB PHE A 27 -3.163 9.364 -3.926 1.00 21.32 C ATOM 374 CG PHE A 27 -4.173 8.251 -3.865 1.00 51.43 C ATOM 375 CD1 PHE A 27 -5.172 8.153 -4.819 1.00 55.55 C ATOM 376 CD2 PHE A 27 -4.121 7.305 -2.854 1.00 2.31 C ATOM 377 CE1 PHE A 27 -6.103 7.132 -4.767 1.00 44.23 C ATOM 378 CE2 PHE A 27 -5.048 6.281 -2.797 1.00 42.40 C ATOM 379 CZ PHE A 27 -6.040 6.195 -3.754 1.00 4.54 C ATOM 0 H PHE A 27 -1.898 11.273 -4.835 1.00 32.13 H new ATOM 0 HA PHE A 27 -4.643 10.671 -4.774 1.00 34.12 H new ATOM 0 HB2 PHE A 27 -2.478 9.178 -4.753 1.00 21.32 H new ATOM 0 HB3 PHE A 27 -2.569 9.355 -3.012 1.00 21.32 H new ATOM 0 HD1 PHE A 27 -5.225 8.883 -5.613 1.00 55.55 H new ATOM 0 HD2 PHE A 27 -3.348 7.368 -2.102 1.00 2.31 H new ATOM 0 HE1 PHE A 27 -6.878 7.067 -5.517 1.00 44.23 H new ATOM 0 HE2 PHE A 27 -4.996 5.549 -2.005 1.00 42.40 H new ATOM 0 HZ PHE A 27 -6.766 5.396 -3.710 1.00 4.54 H new ATOM 389 N ARG A 28 -3.406 11.963 -2.036 1.00 72.30 N ATOM 390 CA ARG A 28 -3.750 12.514 -0.730 1.00 73.42 C ATOM 391 C ARG A 28 -4.594 13.776 -0.879 1.00 35.22 C ATOM 392 O ARG A 28 -5.370 14.126 0.012 1.00 45.13 O ATOM 393 CB ARG A 28 -2.483 12.826 0.065 1.00 2.45 C ATOM 394 CG ARG A 28 -1.330 11.879 -0.227 1.00 74.54 C ATOM 395 CD ARG A 28 -0.626 11.447 1.050 1.00 51.35 C ATOM 396 NE ARG A 28 -0.033 12.579 1.757 1.00 43.13 N ATOM 397 CZ ARG A 28 -0.615 13.192 2.783 1.00 65.43 C ATOM 398 NH1 ARG A 28 -1.799 12.783 3.218 1.00 61.00 N ATOM 399 NH2 ARG A 28 -0.012 14.215 3.375 1.00 71.21 N ATOM 0 H ARG A 28 -2.451 12.158 -2.337 1.00 72.30 H new ATOM 0 HA ARG A 28 -4.334 11.768 -0.191 1.00 73.42 H new ATOM 0 HB2 ARG A 28 -2.168 13.846 -0.155 1.00 2.45 H new ATOM 0 HB3 ARG A 28 -2.714 12.786 1.130 1.00 2.45 H new ATOM 0 HG2 ARG A 28 -1.704 11.000 -0.753 1.00 74.54 H new ATOM 0 HG3 ARG A 28 -0.616 12.367 -0.890 1.00 74.54 H new ATOM 0 HD2 ARG A 28 -1.338 10.944 1.704 1.00 51.35 H new ATOM 0 HD3 ARG A 28 0.152 10.723 0.808 1.00 51.35 H new ATOM 0 HE ARG A 28 0.878 12.918 1.447 1.00 43.13 H new ATOM 0 HH11 ARG A 28 -2.265 11.997 2.765 1.00 61.00 H new ATOM 0 HH12 ARG A 28 -2.244 13.255 4.005 1.00 61.00 H new ATOM 0 HH21 ARG A 28 0.899 14.532 3.043 1.00 71.21 H new ATOM 0 HH22 ARG A 28 -0.459 14.685 4.162 1.00 71.21 H new ATOM 413 N PHE A 29 -4.439 14.456 -2.010 1.00 35.02 N ATOM 414 CA PHE A 29 -5.186 15.680 -2.275 1.00 0.22 C ATOM 415 C PHE A 29 -5.844 15.629 -3.651 1.00 13.11 C ATOM 416 O PHE A 29 -5.885 16.628 -4.369 1.00 1.05 O ATOM 417 CB PHE A 29 -4.262 16.896 -2.184 1.00 11.33 C ATOM 418 CG PHE A 29 -3.092 16.693 -1.265 1.00 51.02 C ATOM 419 CD1 PHE A 29 -3.288 16.325 0.057 1.00 54.21 C ATOM 420 CD2 PHE A 29 -1.795 16.868 -1.722 1.00 52.41 C ATOM 421 CE1 PHE A 29 -2.213 16.138 0.904 1.00 22.45 C ATOM 422 CE2 PHE A 29 -0.717 16.682 -0.878 1.00 65.12 C ATOM 423 CZ PHE A 29 -0.926 16.315 0.437 1.00 43.44 C ATOM 0 H PHE A 29 -3.803 14.180 -2.758 1.00 35.02 H new ATOM 0 HA PHE A 29 -5.968 15.769 -1.521 1.00 0.22 H new ATOM 0 HB2 PHE A 29 -3.893 17.137 -3.181 1.00 11.33 H new ATOM 0 HB3 PHE A 29 -4.838 17.755 -1.841 1.00 11.33 H new ATOM 0 HD1 PHE A 29 -4.292 16.183 0.429 1.00 54.21 H new ATOM 0 HD2 PHE A 29 -1.625 17.153 -2.750 1.00 52.41 H new ATOM 0 HE1 PHE A 29 -2.379 15.853 1.932 1.00 22.45 H new ATOM 0 HE2 PHE A 29 0.288 16.823 -1.246 1.00 65.12 H new ATOM 0 HZ PHE A 29 -0.085 16.167 1.098 1.00 43.44 H new ATOM 433 N ARG A 30 -6.359 14.458 -4.010 1.00 72.31 N ATOM 434 CA ARG A 30 -7.014 14.275 -5.300 1.00 52.11 C ATOM 435 C ARG A 30 -8.418 14.873 -5.286 1.00 61.41 C ATOM 436 O ARG A 30 -8.981 15.138 -4.225 1.00 33.24 O ATOM 437 CB ARG A 30 -7.085 12.788 -5.655 1.00 4.35 C ATOM 438 CG ARG A 30 -7.829 11.952 -4.626 1.00 53.55 C ATOM 439 CD ARG A 30 -7.399 10.494 -4.678 1.00 11.45 C ATOM 440 NE ARG A 30 -8.523 9.602 -4.949 1.00 73.35 N ATOM 441 CZ ARG A 30 -9.404 9.228 -4.028 1.00 73.41 C ATOM 442 NH1 ARG A 30 -9.293 9.667 -2.783 1.00 3.43 N ATOM 443 NH2 ARG A 30 -10.401 8.413 -4.353 1.00 41.31 N ATOM 0 H ARG A 30 -6.336 13.622 -3.426 1.00 72.31 H new ATOM 0 HA ARG A 30 -6.424 14.794 -6.055 1.00 52.11 H new ATOM 0 HB2 ARG A 30 -7.574 12.677 -6.623 1.00 4.35 H new ATOM 0 HB3 ARG A 30 -6.072 12.400 -5.763 1.00 4.35 H new ATOM 0 HG2 ARG A 30 -7.645 12.352 -3.629 1.00 53.55 H new ATOM 0 HG3 ARG A 30 -8.902 12.023 -4.805 1.00 53.55 H new ATOM 0 HD2 ARG A 30 -6.641 10.367 -5.451 1.00 11.45 H new ATOM 0 HD3 ARG A 30 -6.937 10.218 -3.730 1.00 11.45 H new ATOM 0 HE ARG A 30 -8.638 9.246 -5.898 1.00 73.35 H new ATOM 0 HH11 ARG A 30 -8.529 10.294 -2.529 1.00 3.43 H new ATOM 0 HH12 ARG A 30 -9.971 9.378 -2.078 1.00 3.43 H new ATOM 0 HH21 ARG A 30 -10.491 8.074 -5.311 1.00 41.31 H new ATOM 0 HH22 ARG A 30 -11.077 8.126 -3.645 1.00 41.31 H new ATOM 457 N LYS A 31 -8.977 15.083 -6.474 1.00 35.24 N ATOM 458 CA LYS A 31 -10.315 15.649 -6.600 1.00 74.41 C ATOM 459 C LYS A 31 -11.372 14.549 -6.602 1.00 35.40 C ATOM 460 O LYS A 31 -12.453 14.715 -7.168 1.00 45.13 O ATOM 461 CB LYS A 31 -10.423 16.476 -7.883 1.00 2.14 C ATOM 462 CG LYS A 31 -9.384 17.581 -7.982 1.00 71.43 C ATOM 463 CD LYS A 31 -8.137 17.108 -8.710 1.00 41.13 C ATOM 464 CE LYS A 31 -8.073 17.667 -10.124 1.00 62.34 C ATOM 465 NZ LYS A 31 -7.064 18.755 -10.245 1.00 51.20 N ATOM 0 H LYS A 31 -8.524 14.870 -7.363 1.00 35.24 H new ATOM 0 HA LYS A 31 -10.491 16.297 -5.741 1.00 74.41 H new ATOM 0 HB2 LYS A 31 -10.320 15.814 -8.742 1.00 2.14 H new ATOM 0 HB3 LYS A 31 -11.418 16.918 -7.938 1.00 2.14 H new ATOM 0 HG2 LYS A 31 -9.810 18.437 -8.506 1.00 71.43 H new ATOM 0 HG3 LYS A 31 -9.116 17.921 -6.982 1.00 71.43 H new ATOM 0 HD2 LYS A 31 -7.251 17.416 -8.155 1.00 41.13 H new ATOM 0 HD3 LYS A 31 -8.127 16.019 -8.747 1.00 41.13 H new ATOM 0 HE2 LYS A 31 -7.828 16.865 -10.821 1.00 62.34 H new ATOM 0 HE3 LYS A 31 -9.054 18.048 -10.409 1.00 62.34 H new ATOM 0 HZ1 LYS A 31 -7.051 19.109 -11.223 1.00 51.20 H new ATOM 0 HZ2 LYS A 31 -7.311 19.531 -9.599 1.00 51.20 H new ATOM 0 HZ3 LYS A 31 -6.124 18.385 -9.998 1.00 51.20 H new ATOM 479 N GLU A 32 -11.055 13.427 -5.963 1.00 2.20 N ATOM 480 CA GLU A 32 -11.979 12.301 -5.892 1.00 42.24 C ATOM 481 C GLU A 32 -12.630 12.218 -4.514 1.00 61.32 C ATOM 482 O GLU A 32 -12.244 12.932 -3.588 1.00 44.05 O ATOM 483 CB GLU A 32 -11.249 10.993 -6.204 1.00 22.41 C ATOM 484 CG GLU A 32 -10.774 10.889 -7.643 1.00 53.22 C ATOM 485 CD GLU A 32 -9.512 10.061 -7.784 1.00 31.45 C ATOM 486 OE1 GLU A 32 -8.410 10.638 -7.676 1.00 3.01 O ATOM 487 OE2 GLU A 32 -9.627 8.836 -8.000 1.00 12.22 O ATOM 0 H GLU A 32 -10.166 13.274 -5.487 1.00 2.20 H new ATOM 0 HA GLU A 32 -12.761 12.458 -6.635 1.00 42.24 H new ATOM 0 HB2 GLU A 32 -10.390 10.899 -5.539 1.00 22.41 H new ATOM 0 HB3 GLU A 32 -11.913 10.156 -5.988 1.00 22.41 H new ATOM 0 HG2 GLU A 32 -11.563 10.447 -8.251 1.00 53.22 H new ATOM 0 HG3 GLU A 32 -10.593 11.890 -8.035 1.00 53.22 H new ATOM 494 N THR A 33 -13.620 11.340 -4.387 1.00 31.04 N ATOM 495 CA THR A 33 -14.326 11.163 -3.124 1.00 52.22 C ATOM 496 C THR A 33 -14.842 9.736 -2.977 1.00 44.15 C ATOM 497 O THR A 33 -15.888 9.503 -2.374 1.00 11.12 O ATOM 498 CB THR A 33 -15.511 12.140 -3.001 1.00 2.23 C ATOM 499 OG1 THR A 33 -16.376 12.005 -4.133 1.00 75.54 O ATOM 500 CG2 THR A 33 -15.019 13.577 -2.901 1.00 75.01 C ATOM 0 H THR A 33 -13.951 10.741 -5.143 1.00 31.04 H new ATOM 0 HA THR A 33 -13.609 11.371 -2.330 1.00 52.22 H new ATOM 0 HB THR A 33 -16.062 11.897 -2.092 1.00 2.23 H new ATOM 0 HG1 THR A 33 -17.128 12.628 -4.047 1.00 75.54 H new ATOM 0 HG21 THR A 33 -15.873 14.249 -2.815 1.00 75.01 H new ATOM 0 HG22 THR A 33 -14.383 13.684 -2.022 1.00 75.01 H new ATOM 0 HG23 THR A 33 -14.448 13.829 -3.794 1.00 75.01 H new ATOM 508 N ASN A 34 -14.099 8.784 -3.532 1.00 41.45 N ATOM 509 CA ASN A 34 -14.483 7.379 -3.462 1.00 62.34 C ATOM 510 C ASN A 34 -13.307 6.516 -3.013 1.00 52.02 C ATOM 511 O ASN A 34 -12.217 7.023 -2.753 1.00 2.05 O ATOM 512 CB ASN A 34 -14.991 6.899 -4.824 1.00 25.23 C ATOM 513 CG ASN A 34 -14.135 7.401 -5.970 1.00 40.44 C ATOM 514 OD1 ASN A 34 -14.061 8.604 -6.223 1.00 61.11 O ATOM 515 ND2 ASN A 34 -13.484 6.480 -6.669 1.00 44.04 N ATOM 0 H ASN A 34 -13.229 8.960 -4.034 1.00 41.45 H new ATOM 0 HA ASN A 34 -15.283 7.283 -2.728 1.00 62.34 H new ATOM 0 HB2 ASN A 34 -15.010 5.809 -4.838 1.00 25.23 H new ATOM 0 HB3 ASN A 34 -16.017 7.237 -4.966 1.00 25.23 H new ATOM 0 HD21 ASN A 34 -12.892 6.758 -7.452 1.00 44.04 H new ATOM 0 HD22 ASN A 34 -13.575 5.494 -6.423 1.00 44.04 H new ATOM 522 N ASN A 35 -13.538 5.210 -2.925 1.00 42.24 N ATOM 523 CA ASN A 35 -12.498 4.276 -2.507 1.00 51.52 C ATOM 524 C ASN A 35 -11.642 3.849 -3.695 1.00 54.32 C ATOM 525 O ASN A 35 -12.141 3.260 -4.653 1.00 73.54 O ATOM 526 CB ASN A 35 -13.124 3.047 -1.846 1.00 3.21 C ATOM 527 CG ASN A 35 -13.855 3.390 -0.562 1.00 25.14 C ATOM 528 OD1 ASN A 35 -13.784 4.519 -0.077 1.00 23.34 O ATOM 529 ND2 ASN A 35 -14.562 2.413 -0.006 1.00 11.52 N ATOM 0 H ASN A 35 -14.436 4.774 -3.137 1.00 42.24 H new ATOM 0 HA ASN A 35 -11.858 4.782 -1.784 1.00 51.52 H new ATOM 0 HB2 ASN A 35 -13.819 2.578 -2.542 1.00 3.21 H new ATOM 0 HB3 ASN A 35 -12.344 2.316 -1.633 1.00 3.21 H new ATOM 0 HD21 ASN A 35 -15.075 2.583 0.859 1.00 11.52 H new ATOM 0 HD22 ASN A 35 -14.592 1.492 -0.444 1.00 11.52 H new ATOM 536 N ALA A 36 -10.349 4.149 -3.624 1.00 40.31 N ATOM 537 CA ALA A 36 -9.423 3.793 -4.692 1.00 42.21 C ATOM 538 C ALA A 36 -8.171 3.125 -4.133 1.00 53.33 C ATOM 539 O ALA A 36 -7.901 3.197 -2.934 1.00 63.23 O ATOM 540 CB ALA A 36 -9.050 5.027 -5.500 1.00 4.33 C ATOM 0 H ALA A 36 -9.919 4.637 -2.838 1.00 40.31 H new ATOM 0 HA ALA A 36 -9.921 3.080 -5.349 1.00 42.21 H new ATOM 0 HB1 ALA A 36 -8.358 4.746 -6.294 1.00 4.33 H new ATOM 0 HB2 ALA A 36 -9.949 5.460 -5.938 1.00 4.33 H new ATOM 0 HB3 ALA A 36 -8.575 5.760 -4.847 1.00 4.33 H new ATOM 546 N ALA A 37 -7.411 2.477 -5.009 1.00 22.34 N ATOM 547 CA ALA A 37 -6.187 1.797 -4.602 1.00 10.34 C ATOM 548 C ALA A 37 -5.065 2.040 -5.605 1.00 42.43 C ATOM 549 O ALA A 37 -5.313 2.206 -6.800 1.00 42.32 O ATOM 550 CB ALA A 37 -6.439 0.306 -4.441 1.00 74.11 C ATOM 0 H ALA A 37 -7.621 2.408 -6.005 1.00 22.34 H new ATOM 0 HA ALA A 37 -5.876 2.207 -3.641 1.00 10.34 H new ATOM 0 HB1 ALA A 37 -5.516 -0.188 -4.137 1.00 74.11 H new ATOM 0 HB2 ALA A 37 -7.204 0.146 -3.681 1.00 74.11 H new ATOM 0 HB3 ALA A 37 -6.778 -0.110 -5.390 1.00 74.11 H new ATOM 556 N ILE A 38 -3.831 2.061 -5.112 1.00 44.55 N ATOM 557 CA ILE A 38 -2.671 2.284 -5.967 1.00 54.24 C ATOM 558 C ILE A 38 -1.578 1.259 -5.689 1.00 20.41 C ATOM 559 O ILE A 38 -0.911 1.313 -4.656 1.00 45.30 O ATOM 560 CB ILE A 38 -2.093 3.699 -5.775 1.00 11.22 C ATOM 561 CG1 ILE A 38 -3.202 4.747 -5.890 1.00 33.33 C ATOM 562 CG2 ILE A 38 -0.997 3.966 -6.794 1.00 43.43 C ATOM 563 CD1 ILE A 38 -2.685 6.164 -6.000 1.00 14.52 C ATOM 0 H ILE A 38 -3.609 1.926 -4.126 1.00 44.55 H new ATOM 0 HA ILE A 38 -3.013 2.177 -6.996 1.00 54.24 H new ATOM 0 HB ILE A 38 -1.659 3.765 -4.778 1.00 11.22 H new ATOM 0 HG12 ILE A 38 -3.813 4.523 -6.764 1.00 33.33 H new ATOM 0 HG13 ILE A 38 -3.853 4.673 -5.019 1.00 33.33 H new ATOM 0 HG21 ILE A 38 -0.599 4.970 -6.645 1.00 43.43 H new ATOM 0 HG22 ILE A 38 -0.197 3.236 -6.668 1.00 43.43 H new ATOM 0 HG23 ILE A 38 -1.408 3.884 -7.800 1.00 43.43 H new ATOM 0 HD11 ILE A 38 -3.526 6.853 -6.078 1.00 14.52 H new ATOM 0 HD12 ILE A 38 -2.098 6.407 -5.114 1.00 14.52 H new ATOM 0 HD13 ILE A 38 -2.058 6.255 -6.887 1.00 14.52 H new ATOM 575 N ILE A 39 -1.400 0.325 -6.617 1.00 73.35 N ATOM 576 CA ILE A 39 -0.385 -0.712 -6.473 1.00 53.21 C ATOM 577 C ILE A 39 0.923 -0.296 -7.136 1.00 40.34 C ATOM 578 O ILE A 39 0.964 -0.025 -8.336 1.00 43.22 O ATOM 579 CB ILE A 39 -0.855 -2.047 -7.081 1.00 41.42 C ATOM 580 CG1 ILE A 39 -2.198 -2.462 -6.478 1.00 54.43 C ATOM 581 CG2 ILE A 39 0.191 -3.128 -6.854 1.00 60.02 C ATOM 582 CD1 ILE A 39 -3.130 -3.117 -7.473 1.00 73.34 C ATOM 0 H ILE A 39 -1.945 0.265 -7.477 1.00 73.35 H new ATOM 0 HA ILE A 39 -0.220 -0.847 -5.404 1.00 53.21 H new ATOM 0 HB ILE A 39 -0.986 -1.915 -8.155 1.00 41.42 H new ATOM 0 HG12 ILE A 39 -2.019 -3.151 -5.652 1.00 54.43 H new ATOM 0 HG13 ILE A 39 -2.687 -1.582 -6.059 1.00 54.43 H new ATOM 0 HG21 ILE A 39 -0.155 -4.066 -7.289 1.00 60.02 H new ATOM 0 HG22 ILE A 39 1.128 -2.833 -7.326 1.00 60.02 H new ATOM 0 HG23 ILE A 39 0.350 -3.261 -5.784 1.00 60.02 H new ATOM 0 HD11 ILE A 39 -4.063 -3.385 -6.976 1.00 73.34 H new ATOM 0 HD12 ILE A 39 -3.339 -2.423 -8.287 1.00 73.34 H new ATOM 0 HD13 ILE A 39 -2.661 -4.016 -7.874 1.00 73.34 H new ATOM 594 N MET A 40 1.992 -0.249 -6.348 1.00 34.54 N ATOM 595 CA MET A 40 3.303 0.130 -6.859 1.00 43.01 C ATOM 596 C MET A 40 4.278 -1.041 -6.776 1.00 41.44 C ATOM 597 O MET A 40 4.178 -1.884 -5.886 1.00 32.34 O ATOM 598 CB MET A 40 3.853 1.324 -6.077 1.00 41.44 C ATOM 599 CG MET A 40 2.809 2.389 -5.780 1.00 25.41 C ATOM 600 SD MET A 40 3.105 3.233 -4.214 1.00 64.33 S ATOM 601 CE MET A 40 1.656 2.740 -3.285 1.00 50.22 C ATOM 0 H MET A 40 1.975 -0.469 -5.352 1.00 34.54 H new ATOM 0 HA MET A 40 3.190 0.412 -7.906 1.00 43.01 H new ATOM 0 HB2 MET A 40 4.275 0.969 -5.137 1.00 41.44 H new ATOM 0 HB3 MET A 40 4.669 1.774 -6.643 1.00 41.44 H new ATOM 0 HG2 MET A 40 2.802 3.121 -6.587 1.00 25.41 H new ATOM 0 HG3 MET A 40 1.821 1.928 -5.759 1.00 25.41 H new ATOM 0 HE1 MET A 40 1.886 2.750 -2.220 1.00 50.22 H new ATOM 0 HE2 MET A 40 0.841 3.435 -3.487 1.00 50.22 H new ATOM 0 HE3 MET A 40 1.358 1.734 -3.582 1.00 50.22 H new ATOM 611 N LYS A 41 5.222 -1.086 -7.711 1.00 11.44 N ATOM 612 CA LYS A 41 6.217 -2.151 -7.743 1.00 72.20 C ATOM 613 C LYS A 41 7.628 -1.577 -7.820 1.00 31.01 C ATOM 614 O LYS A 41 7.810 -0.372 -8.002 1.00 32.41 O ATOM 615 CB LYS A 41 5.965 -3.075 -8.937 1.00 31.02 C ATOM 616 CG LYS A 41 6.245 -2.423 -10.280 1.00 63.45 C ATOM 617 CD LYS A 41 6.929 -3.387 -11.236 1.00 75.21 C ATOM 618 CE LYS A 41 6.747 -2.959 -12.684 1.00 52.20 C ATOM 619 NZ LYS A 41 7.029 -4.073 -13.631 1.00 1.22 N ATOM 0 H LYS A 41 5.318 -0.397 -8.457 1.00 11.44 H new ATOM 0 HA LYS A 41 6.128 -2.725 -6.821 1.00 72.20 H new ATOM 0 HB2 LYS A 41 6.589 -3.963 -8.837 1.00 31.02 H new ATOM 0 HB3 LYS A 41 4.928 -3.410 -8.914 1.00 31.02 H new ATOM 0 HG2 LYS A 41 5.310 -2.076 -10.719 1.00 63.45 H new ATOM 0 HG3 LYS A 41 6.874 -1.545 -10.135 1.00 63.45 H new ATOM 0 HD2 LYS A 41 7.992 -3.440 -11.002 1.00 75.21 H new ATOM 0 HD3 LYS A 41 6.522 -4.389 -11.098 1.00 75.21 H new ATOM 0 HE2 LYS A 41 5.727 -2.605 -12.833 1.00 52.20 H new ATOM 0 HE3 LYS A 41 7.410 -2.121 -12.901 1.00 52.20 H new ATOM 0 HZ1 LYS A 41 6.894 -3.741 -14.607 1.00 1.22 H new ATOM 0 HZ2 LYS A 41 8.010 -4.394 -13.507 1.00 1.22 H new ATOM 0 HZ3 LYS A 41 6.380 -4.863 -13.441 1.00 1.22 H new ATOM 633 N VAL A 42 8.624 -2.446 -7.682 1.00 13.51 N ATOM 634 CA VAL A 42 10.019 -2.025 -7.738 1.00 41.41 C ATOM 635 C VAL A 42 10.782 -2.794 -8.810 1.00 23.23 C ATOM 636 O VAL A 42 11.048 -3.987 -8.662 1.00 30.40 O ATOM 637 CB VAL A 42 10.721 -2.224 -6.381 1.00 15.50 C ATOM 638 CG1 VAL A 42 10.160 -3.441 -5.663 1.00 72.20 C ATOM 639 CG2 VAL A 42 12.223 -2.353 -6.573 1.00 45.33 C ATOM 0 H VAL A 42 8.491 -3.446 -7.531 1.00 13.51 H new ATOM 0 HA VAL A 42 10.019 -0.964 -7.986 1.00 41.41 H new ATOM 0 HB VAL A 42 10.531 -1.348 -5.761 1.00 15.50 H new ATOM 0 HG11 VAL A 42 10.668 -3.565 -4.707 1.00 72.20 H new ATOM 0 HG12 VAL A 42 9.093 -3.302 -5.492 1.00 72.20 H new ATOM 0 HG13 VAL A 42 10.317 -4.329 -6.275 1.00 72.20 H new ATOM 0 HG21 VAL A 42 12.703 -2.493 -5.604 1.00 45.33 H new ATOM 0 HG22 VAL A 42 12.436 -3.211 -7.211 1.00 45.33 H new ATOM 0 HG23 VAL A 42 12.609 -1.448 -7.042 1.00 45.33 H new ATOM 649 N ASP A 43 11.133 -2.104 -9.890 1.00 34.32 N ATOM 650 CA ASP A 43 11.867 -2.722 -10.987 1.00 41.01 C ATOM 651 C ASP A 43 13.286 -3.083 -10.556 1.00 11.22 C ATOM 652 O ASP A 43 14.104 -2.207 -10.278 1.00 12.54 O ATOM 653 CB ASP A 43 11.911 -1.782 -12.193 1.00 3.32 C ATOM 654 CG ASP A 43 10.643 -1.842 -13.020 1.00 54.41 C ATOM 655 OD1 ASP A 43 9.632 -2.377 -12.518 1.00 71.41 O ATOM 656 OD2 ASP A 43 10.659 -1.354 -14.169 1.00 51.42 O ATOM 0 H ASP A 43 10.921 -1.116 -10.029 1.00 34.32 H new ATOM 0 HA ASP A 43 11.348 -3.638 -11.269 1.00 41.01 H new ATOM 0 HB2 ASP A 43 12.068 -0.760 -11.848 1.00 3.32 H new ATOM 0 HB3 ASP A 43 12.763 -2.041 -12.821 1.00 3.32 H new ATOM 661 N LYS A 44 13.570 -4.380 -10.502 1.00 43.10 N ATOM 662 CA LYS A 44 14.889 -4.859 -10.105 1.00 43.35 C ATOM 663 C LYS A 44 15.969 -4.311 -11.034 1.00 73.52 C ATOM 664 O LYS A 44 17.149 -4.292 -10.685 1.00 31.20 O ATOM 665 CB LYS A 44 14.922 -6.388 -10.112 1.00 75.23 C ATOM 666 CG LYS A 44 16.251 -6.970 -9.662 1.00 73.20 C ATOM 667 CD LYS A 44 17.067 -7.475 -10.841 1.00 33.33 C ATOM 668 CE LYS A 44 18.370 -8.111 -10.384 1.00 43.15 C ATOM 669 NZ LYS A 44 18.714 -9.313 -11.193 1.00 60.13 N ATOM 0 H LYS A 44 12.904 -5.119 -10.728 1.00 43.10 H new ATOM 0 HA LYS A 44 15.089 -4.503 -9.095 1.00 43.35 H new ATOM 0 HB2 LYS A 44 14.132 -6.763 -9.462 1.00 75.23 H new ATOM 0 HB3 LYS A 44 14.702 -6.743 -11.119 1.00 75.23 H new ATOM 0 HG2 LYS A 44 16.818 -6.210 -9.124 1.00 73.20 H new ATOM 0 HG3 LYS A 44 16.073 -7.788 -8.964 1.00 73.20 H new ATOM 0 HD2 LYS A 44 16.483 -8.203 -11.404 1.00 33.33 H new ATOM 0 HD3 LYS A 44 17.282 -6.648 -11.517 1.00 33.33 H new ATOM 0 HE2 LYS A 44 19.176 -7.381 -10.458 1.00 43.15 H new ATOM 0 HE3 LYS A 44 18.289 -8.391 -9.334 1.00 43.15 H new ATOM 0 HZ1 LYS A 44 19.609 -9.718 -10.850 1.00 60.13 H new ATOM 0 HZ2 LYS A 44 17.957 -10.020 -11.103 1.00 60.13 H new ATOM 0 HZ3 LYS A 44 18.817 -9.042 -12.192 1.00 60.13 H new ATOM 683 N ASP A 45 15.556 -3.869 -12.217 1.00 32.11 N ATOM 684 CA ASP A 45 16.487 -3.319 -13.195 1.00 22.11 C ATOM 685 C ASP A 45 16.828 -1.869 -12.866 1.00 1.41 C ATOM 686 O ASP A 45 17.975 -1.444 -13.003 1.00 34.30 O ATOM 687 CB ASP A 45 15.896 -3.411 -14.602 1.00 33.23 C ATOM 688 CG ASP A 45 15.355 -2.081 -15.091 1.00 64.21 C ATOM 689 OD1 ASP A 45 16.141 -1.297 -15.663 1.00 41.34 O ATOM 690 OD2 ASP A 45 14.148 -1.824 -14.900 1.00 71.15 O ATOM 0 H ASP A 45 14.583 -3.881 -12.522 1.00 32.11 H new ATOM 0 HA ASP A 45 17.404 -3.906 -13.156 1.00 22.11 H new ATOM 0 HB2 ASP A 45 16.662 -3.764 -15.292 1.00 33.23 H new ATOM 0 HB3 ASP A 45 15.095 -4.150 -14.609 1.00 33.23 H new ATOM 695 N ARG A 46 15.823 -1.114 -12.433 1.00 65.11 N ATOM 696 CA ARG A 46 16.016 0.289 -12.087 1.00 40.32 C ATOM 697 C ARG A 46 16.097 0.470 -10.574 1.00 63.33 C ATOM 698 O ARG A 46 16.309 1.578 -10.083 1.00 41.04 O ATOM 699 CB ARG A 46 14.874 1.137 -12.652 1.00 72.11 C ATOM 700 CG ARG A 46 14.854 1.197 -14.170 1.00 40.25 C ATOM 701 CD ARG A 46 13.553 1.793 -14.688 1.00 22.35 C ATOM 702 NE ARG A 46 13.781 2.994 -15.487 1.00 71.41 N ATOM 703 CZ ARG A 46 12.837 3.580 -16.215 1.00 5.21 C ATOM 704 NH1 ARG A 46 11.610 3.081 -16.244 1.00 51.30 N ATOM 705 NH2 ARG A 46 13.122 4.671 -16.916 1.00 61.31 N ATOM 0 H ARG A 46 14.868 -1.450 -12.314 1.00 65.11 H new ATOM 0 HA ARG A 46 16.957 0.619 -12.526 1.00 40.32 H new ATOM 0 HB2 ARG A 46 13.925 0.733 -12.300 1.00 72.11 H new ATOM 0 HB3 ARG A 46 14.955 2.150 -12.258 1.00 72.11 H new ATOM 0 HG2 ARG A 46 15.695 1.794 -14.523 1.00 40.25 H new ATOM 0 HG3 ARG A 46 14.983 0.194 -14.576 1.00 40.25 H new ATOM 0 HD2 ARG A 46 13.029 1.051 -15.290 1.00 22.35 H new ATOM 0 HD3 ARG A 46 12.905 2.035 -13.846 1.00 22.35 H new ATOM 0 HE ARG A 46 14.715 3.405 -15.486 1.00 71.41 H new ATOM 0 HH11 ARG A 46 11.387 2.244 -15.706 1.00 51.30 H new ATOM 0 HH12 ARG A 46 10.888 3.534 -16.804 1.00 51.30 H new ATOM 0 HH21 ARG A 46 14.065 5.059 -16.895 1.00 61.31 H new ATOM 0 HH22 ARG A 46 12.398 5.122 -17.475 1.00 61.31 H new ATOM 719 N GLN A 47 15.929 -0.627 -9.842 1.00 54.23 N ATOM 720 CA GLN A 47 15.983 -0.588 -8.386 1.00 13.33 C ATOM 721 C GLN A 47 15.231 0.624 -7.846 1.00 4.33 C ATOM 722 O GLN A 47 15.682 1.277 -6.905 1.00 23.25 O ATOM 723 CB GLN A 47 17.435 -0.557 -7.909 1.00 62.32 C ATOM 724 CG GLN A 47 18.317 -1.601 -8.575 1.00 44.25 C ATOM 725 CD GLN A 47 18.908 -2.584 -7.585 1.00 4.12 C ATOM 726 OE1 GLN A 47 20.003 -2.371 -7.060 1.00 33.43 O ATOM 727 NE2 GLN A 47 18.188 -3.668 -7.323 1.00 51.11 N ATOM 0 H GLN A 47 15.755 -1.553 -10.233 1.00 54.23 H new ATOM 0 HA GLN A 47 15.503 -1.490 -8.005 1.00 13.33 H new ATOM 0 HB2 GLN A 47 17.850 0.433 -8.100 1.00 62.32 H new ATOM 0 HB3 GLN A 47 17.457 -0.709 -6.830 1.00 62.32 H new ATOM 0 HG2 GLN A 47 17.732 -2.145 -9.316 1.00 44.25 H new ATOM 0 HG3 GLN A 47 19.124 -1.101 -9.110 1.00 44.25 H new ATOM 0 HE21 GLN A 47 17.287 -3.804 -7.780 1.00 51.11 H new ATOM 0 HE22 GLN A 47 18.536 -4.365 -6.664 1.00 51.11 H new ATOM 736 N MET A 48 14.084 0.920 -8.447 1.00 14.11 N ATOM 737 CA MET A 48 13.270 2.054 -8.025 1.00 70.22 C ATOM 738 C MET A 48 11.797 1.666 -7.946 1.00 32.31 C ATOM 739 O MET A 48 11.333 0.796 -8.682 1.00 75.44 O ATOM 740 CB MET A 48 13.449 3.226 -8.992 1.00 24.22 C ATOM 741 CG MET A 48 12.434 3.242 -10.123 1.00 33.34 C ATOM 742 SD MET A 48 13.078 4.002 -11.625 1.00 43.14 S ATOM 743 CE MET A 48 13.510 5.632 -11.020 1.00 64.34 C ATOM 0 H MET A 48 13.697 0.390 -9.228 1.00 14.11 H new ATOM 0 HA MET A 48 13.602 2.358 -7.032 1.00 70.22 H new ATOM 0 HB2 MET A 48 13.375 4.160 -8.435 1.00 24.22 H new ATOM 0 HB3 MET A 48 14.452 3.186 -9.416 1.00 24.22 H new ATOM 0 HG2 MET A 48 12.124 2.220 -10.342 1.00 33.34 H new ATOM 0 HG3 MET A 48 11.544 3.783 -9.800 1.00 33.34 H new ATOM 0 HE1 MET A 48 13.226 6.381 -11.759 1.00 64.34 H new ATOM 0 HE2 MET A 48 12.983 5.825 -10.086 1.00 64.34 H new ATOM 0 HE3 MET A 48 14.585 5.683 -10.847 1.00 64.34 H new ATOM 753 N VAL A 49 11.066 2.318 -7.047 1.00 35.44 N ATOM 754 CA VAL A 49 9.644 2.041 -6.871 1.00 44.13 C ATOM 755 C VAL A 49 8.811 2.764 -7.922 1.00 52.44 C ATOM 756 O VAL A 49 8.629 3.980 -7.858 1.00 11.44 O ATOM 757 CB VAL A 49 9.160 2.459 -5.471 1.00 23.22 C ATOM 758 CG1 VAL A 49 7.738 1.976 -5.231 1.00 73.13 C ATOM 759 CG2 VAL A 49 10.101 1.925 -4.400 1.00 74.13 C ATOM 0 H VAL A 49 11.434 3.041 -6.429 1.00 35.44 H new ATOM 0 HA VAL A 49 9.514 0.965 -6.985 1.00 44.13 H new ATOM 0 HB VAL A 49 9.163 3.548 -5.415 1.00 23.22 H new ATOM 0 HG11 VAL A 49 7.413 2.281 -4.236 1.00 73.13 H new ATOM 0 HG12 VAL A 49 7.075 2.411 -5.979 1.00 73.13 H new ATOM 0 HG13 VAL A 49 7.705 0.889 -5.306 1.00 73.13 H new ATOM 0 HG21 VAL A 49 9.743 2.230 -3.417 1.00 74.13 H new ATOM 0 HG22 VAL A 49 10.133 0.837 -4.453 1.00 74.13 H new ATOM 0 HG23 VAL A 49 11.102 2.325 -4.562 1.00 74.13 H new ATOM 769 N VAL A 50 8.304 2.008 -8.892 1.00 13.33 N ATOM 770 CA VAL A 50 7.486 2.576 -9.957 1.00 2.22 C ATOM 771 C VAL A 50 6.065 2.025 -9.913 1.00 2.55 C ATOM 772 O VAL A 50 5.857 0.831 -9.694 1.00 12.41 O ATOM 773 CB VAL A 50 8.093 2.290 -11.343 1.00 3.25 C ATOM 774 CG1 VAL A 50 9.448 2.968 -11.483 1.00 52.01 C ATOM 775 CG2 VAL A 50 8.212 0.791 -11.573 1.00 1.42 C ATOM 0 H VAL A 50 8.446 1.000 -8.962 1.00 13.33 H new ATOM 0 HA VAL A 50 7.459 3.654 -9.795 1.00 2.22 H new ATOM 0 HB VAL A 50 7.428 2.700 -12.103 1.00 3.25 H new ATOM 0 HG11 VAL A 50 9.862 2.755 -12.469 1.00 52.01 H new ATOM 0 HG12 VAL A 50 9.330 4.045 -11.364 1.00 52.01 H new ATOM 0 HG13 VAL A 50 10.125 2.591 -10.716 1.00 52.01 H new ATOM 0 HG21 VAL A 50 8.643 0.607 -12.557 1.00 1.42 H new ATOM 0 HG22 VAL A 50 8.855 0.355 -10.808 1.00 1.42 H new ATOM 0 HG23 VAL A 50 7.223 0.335 -11.519 1.00 1.42 H new ATOM 785 N LEU A 51 5.090 2.903 -10.123 1.00 4.22 N ATOM 786 CA LEU A 51 3.686 2.505 -10.108 1.00 44.20 C ATOM 787 C LEU A 51 3.484 1.196 -10.863 1.00 72.51 C ATOM 788 O LEU A 51 4.205 0.899 -11.815 1.00 2.42 O ATOM 789 CB LEU A 51 2.818 3.603 -10.725 1.00 21.11 C ATOM 790 CG LEU A 51 1.347 3.607 -10.309 1.00 54.13 C ATOM 791 CD1 LEU A 51 0.832 5.033 -10.183 1.00 42.53 C ATOM 792 CD2 LEU A 51 0.509 2.822 -11.308 1.00 14.03 C ATOM 0 H LEU A 51 5.245 3.894 -10.306 1.00 4.22 H new ATOM 0 HA LEU A 51 3.387 2.354 -9.071 1.00 44.20 H new ATOM 0 HB2 LEU A 51 3.251 4.569 -10.466 1.00 21.11 H new ATOM 0 HB3 LEU A 51 2.868 3.512 -11.810 1.00 21.11 H new ATOM 0 HG LEU A 51 1.263 3.125 -9.335 1.00 54.13 H new ATOM 0 HD11 LEU A 51 -0.217 5.016 -9.886 1.00 42.53 H new ATOM 0 HD12 LEU A 51 1.414 5.565 -9.430 1.00 42.53 H new ATOM 0 HD13 LEU A 51 0.929 5.541 -11.142 1.00 42.53 H new ATOM 0 HD21 LEU A 51 -0.535 2.835 -10.996 1.00 14.03 H new ATOM 0 HD22 LEU A 51 0.599 3.276 -12.295 1.00 14.03 H new ATOM 0 HD23 LEU A 51 0.862 1.792 -11.349 1.00 14.03 H new ATOM 804 N GLU A 52 2.496 0.417 -10.433 1.00 61.02 N ATOM 805 CA GLU A 52 2.198 -0.860 -11.070 1.00 63.54 C ATOM 806 C GLU A 52 0.787 -0.863 -11.649 1.00 54.23 C ATOM 807 O GLU A 52 0.570 -1.289 -12.784 1.00 10.44 O ATOM 808 CB GLU A 52 2.353 -2.005 -10.067 1.00 14.45 C ATOM 809 CG GLU A 52 2.227 -3.383 -10.692 1.00 70.41 C ATOM 810 CD GLU A 52 2.996 -3.506 -11.994 1.00 34.52 C ATOM 811 OE1 GLU A 52 2.557 -2.910 -13.000 1.00 22.23 O ATOM 812 OE2 GLU A 52 4.035 -4.198 -12.005 1.00 61.21 O ATOM 0 H GLU A 52 1.889 0.648 -9.647 1.00 61.02 H new ATOM 0 HA GLU A 52 2.907 -1.004 -11.886 1.00 63.54 H new ATOM 0 HB2 GLU A 52 3.326 -1.923 -9.582 1.00 14.45 H new ATOM 0 HB3 GLU A 52 1.599 -1.899 -9.288 1.00 14.45 H new ATOM 0 HG2 GLU A 52 2.590 -4.132 -9.988 1.00 70.41 H new ATOM 0 HG3 GLU A 52 1.175 -3.600 -10.874 1.00 70.41 H new ATOM 819 N ASP A 53 -0.170 -0.386 -10.861 1.00 1.01 N ATOM 820 CA ASP A 53 -1.562 -0.333 -11.294 1.00 2.32 C ATOM 821 C ASP A 53 -2.354 0.666 -10.456 1.00 11.25 C ATOM 822 O ASP A 53 -1.908 1.085 -9.388 1.00 54.21 O ATOM 823 CB ASP A 53 -2.201 -1.719 -11.197 1.00 72.13 C ATOM 824 CG ASP A 53 -2.113 -2.489 -12.500 1.00 71.13 C ATOM 825 OD1 ASP A 53 -2.589 -1.968 -13.532 1.00 3.41 O ATOM 826 OD2 ASP A 53 -1.569 -3.612 -12.489 1.00 65.14 O ATOM 0 H ASP A 53 -0.008 -0.030 -9.919 1.00 1.01 H new ATOM 0 HA ASP A 53 -1.582 -0.004 -12.333 1.00 2.32 H new ATOM 0 HB2 ASP A 53 -1.709 -2.288 -10.408 1.00 72.13 H new ATOM 0 HB3 ASP A 53 -3.247 -1.614 -10.910 1.00 72.13 H new ATOM 831 N GLU A 54 -3.530 1.043 -10.948 1.00 20.35 N ATOM 832 CA GLU A 54 -4.383 1.994 -10.243 1.00 61.35 C ATOM 833 C GLU A 54 -5.857 1.682 -10.481 1.00 73.32 C ATOM 834 O GLU A 54 -6.360 1.819 -11.597 1.00 50.24 O ATOM 835 CB GLU A 54 -4.072 3.422 -10.696 1.00 72.13 C ATOM 836 CG GLU A 54 -3.234 4.207 -9.701 1.00 73.13 C ATOM 837 CD GLU A 54 -3.192 5.689 -10.016 1.00 13.53 C ATOM 838 OE1 GLU A 54 -3.004 6.039 -11.200 1.00 0.45 O ATOM 839 OE2 GLU A 54 -3.347 6.501 -9.078 1.00 62.22 O ATOM 0 H GLU A 54 -3.914 0.705 -11.831 1.00 20.35 H new ATOM 0 HA GLU A 54 -4.179 1.906 -9.176 1.00 61.35 H new ATOM 0 HB2 GLU A 54 -3.547 3.385 -11.651 1.00 72.13 H new ATOM 0 HB3 GLU A 54 -5.009 3.952 -10.867 1.00 72.13 H new ATOM 0 HG2 GLU A 54 -3.638 4.064 -8.699 1.00 73.13 H new ATOM 0 HG3 GLU A 54 -2.218 3.812 -9.695 1.00 73.13 H new ATOM 846 N LEU A 55 -6.545 1.261 -9.426 1.00 3.51 N ATOM 847 CA LEU A 55 -7.962 0.929 -9.518 1.00 34.05 C ATOM 848 C LEU A 55 -8.804 1.905 -8.702 1.00 53.21 C ATOM 849 O LEU A 55 -8.525 2.148 -7.529 1.00 21.15 O ATOM 850 CB LEU A 55 -8.203 -0.500 -9.033 1.00 34.43 C ATOM 851 CG LEU A 55 -7.269 -1.570 -9.601 1.00 52.31 C ATOM 852 CD1 LEU A 55 -7.242 -2.791 -8.695 1.00 5.33 C ATOM 853 CD2 LEU A 55 -7.696 -1.957 -11.009 1.00 33.43 C ATOM 0 H LEU A 55 -6.144 1.141 -8.496 1.00 3.51 H new ATOM 0 HA LEU A 55 -8.261 1.006 -10.563 1.00 34.05 H new ATOM 0 HB2 LEU A 55 -8.118 -0.512 -7.946 1.00 34.43 H new ATOM 0 HB3 LEU A 55 -9.229 -0.776 -9.276 1.00 34.43 H new ATOM 0 HG LEU A 55 -6.261 -1.157 -9.649 1.00 52.31 H new ATOM 0 HD11 LEU A 55 -6.572 -3.541 -9.115 1.00 5.33 H new ATOM 0 HD12 LEU A 55 -6.888 -2.502 -7.705 1.00 5.33 H new ATOM 0 HD13 LEU A 55 -8.247 -3.206 -8.614 1.00 5.33 H new ATOM 0 HD21 LEU A 55 -7.020 -2.719 -11.398 1.00 33.43 H new ATOM 0 HD22 LEU A 55 -8.712 -2.351 -10.986 1.00 33.43 H new ATOM 0 HD23 LEU A 55 -7.662 -1.079 -11.654 1.00 33.43 H new ATOM 865 N GLN A 56 -9.837 2.458 -9.331 1.00 63.12 N ATOM 866 CA GLN A 56 -10.720 3.405 -8.662 1.00 10.22 C ATOM 867 C GLN A 56 -12.068 2.763 -8.348 1.00 4.42 C ATOM 868 O GLN A 56 -12.441 1.757 -8.946 1.00 62.44 O ATOM 869 CB GLN A 56 -10.923 4.647 -9.532 1.00 43.31 C ATOM 870 CG GLN A 56 -9.739 5.600 -9.518 1.00 20.30 C ATOM 871 CD GLN A 56 -8.703 5.258 -10.571 1.00 74.05 C ATOM 872 OE1 GLN A 56 -9.041 4.829 -11.675 1.00 63.30 O ATOM 873 NE2 GLN A 56 -7.432 5.448 -10.235 1.00 60.44 N ATOM 0 H GLN A 56 -10.082 2.266 -10.302 1.00 63.12 H new ATOM 0 HA GLN A 56 -10.251 3.701 -7.723 1.00 10.22 H new ATOM 0 HB2 GLN A 56 -11.115 4.334 -10.558 1.00 43.31 H new ATOM 0 HB3 GLN A 56 -11.811 5.179 -9.190 1.00 43.31 H new ATOM 0 HG2 GLN A 56 -10.094 6.618 -9.680 1.00 20.30 H new ATOM 0 HG3 GLN A 56 -9.272 5.579 -8.533 1.00 20.30 H new ATOM 0 HE21 GLN A 56 -7.197 5.805 -9.309 1.00 60.44 H new ATOM 0 HE22 GLN A 56 -6.691 5.237 -10.903 1.00 60.44 H new ATOM 882 N ASN A 57 -12.792 3.355 -7.404 1.00 54.01 N ATOM 883 CA ASN A 57 -14.099 2.841 -7.009 1.00 62.15 C ATOM 884 C ASN A 57 -14.042 1.334 -6.771 1.00 42.41 C ATOM 885 O ASN A 57 -14.805 0.573 -7.365 1.00 11.13 O ATOM 886 CB ASN A 57 -15.141 3.159 -8.083 1.00 14.12 C ATOM 887 CG ASN A 57 -14.517 3.385 -9.446 1.00 45.32 C ATOM 888 OD1 ASN A 57 -13.969 4.577 -9.656 1.00 72.00 O flip ATOM 889 ND2 ASN A 57 -14.526 2.498 -10.300 1.00 75.45 N flip ATOM 0 H ASN A 57 -12.497 4.190 -6.899 1.00 54.01 H new ATOM 0 HA ASN A 57 -14.387 3.328 -6.077 1.00 62.15 H new ATOM 0 HB2 ASN A 57 -15.856 2.339 -8.146 1.00 14.12 H new ATOM 0 HB3 ASN A 57 -15.700 4.048 -7.791 1.00 14.12 H new ATOM 0 HD21 ASN A 57 -14.958 1.597 -10.095 1.00 75.45 H new ATOM 0 HD22 ASN A 57 -14.101 2.664 -11.212 1.00 75.45 H new ATOM 896 N ILE A 58 -13.132 0.914 -5.899 1.00 32.11 N ATOM 897 CA ILE A 58 -12.976 -0.500 -5.581 1.00 75.44 C ATOM 898 C ILE A 58 -13.060 -0.738 -4.078 1.00 73.40 C ATOM 899 O ILE A 58 -12.501 0.021 -3.286 1.00 71.52 O ATOM 900 CB ILE A 58 -11.636 -1.050 -6.103 1.00 65.12 C ATOM 901 CG1 ILE A 58 -11.000 -1.976 -5.064 1.00 14.03 C ATOM 902 CG2 ILE A 58 -10.693 0.093 -6.448 1.00 52.20 C ATOM 903 CD1 ILE A 58 -10.323 -1.238 -3.930 1.00 34.04 C ATOM 0 H ILE A 58 -12.492 1.532 -5.400 1.00 32.11 H new ATOM 0 HA ILE A 58 -13.792 -1.026 -6.076 1.00 75.44 H new ATOM 0 HB ILE A 58 -11.825 -1.626 -7.009 1.00 65.12 H new ATOM 0 HG12 ILE A 58 -11.769 -2.630 -4.653 1.00 14.03 H new ATOM 0 HG13 ILE A 58 -10.269 -2.615 -5.558 1.00 14.03 H new ATOM 0 HG21 ILE A 58 -9.750 -0.312 -6.816 1.00 52.20 H new ATOM 0 HG22 ILE A 58 -11.145 0.717 -7.219 1.00 52.20 H new ATOM 0 HG23 ILE A 58 -10.508 0.693 -5.557 1.00 52.20 H new ATOM 0 HD11 ILE A 58 -9.895 -1.957 -3.232 1.00 34.04 H new ATOM 0 HD12 ILE A 58 -9.531 -0.605 -4.330 1.00 34.04 H new ATOM 0 HD13 ILE A 58 -11.055 -0.620 -3.410 1.00 34.04 H new ATOM 915 N SER A 59 -13.763 -1.798 -3.690 1.00 23.52 N ATOM 916 CA SER A 59 -13.921 -2.137 -2.281 1.00 33.04 C ATOM 917 C SER A 59 -12.714 -2.916 -1.769 1.00 63.41 C ATOM 918 O SER A 59 -11.860 -3.362 -2.536 1.00 51.52 O ATOM 919 CB SER A 59 -15.197 -2.955 -2.072 1.00 15.11 C ATOM 920 OG SER A 59 -16.148 -2.231 -1.310 1.00 73.45 O ATOM 0 H SER A 59 -14.232 -2.437 -4.332 1.00 23.52 H new ATOM 0 HA SER A 59 -13.996 -1.208 -1.716 1.00 33.04 H new ATOM 0 HB2 SER A 59 -15.626 -3.219 -3.039 1.00 15.11 H new ATOM 0 HB3 SER A 59 -14.955 -3.889 -1.565 1.00 15.11 H new ATOM 0 HG SER A 59 -16.955 -2.775 -1.192 1.00 73.45 H new ATOM 926 N PRO A 60 -12.641 -3.087 -0.441 1.00 21.11 N ATOM 927 CA PRO A 60 -11.543 -3.814 0.204 1.00 1.11 C ATOM 928 C PRO A 60 -11.590 -5.311 -0.084 1.00 43.33 C ATOM 929 O PRO A 60 -10.772 -6.075 0.424 1.00 24.41 O ATOM 930 CB PRO A 60 -11.770 -3.549 1.695 1.00 62.12 C ATOM 931 CG PRO A 60 -13.229 -3.270 1.812 1.00 63.41 C ATOM 932 CD PRO A 60 -13.623 -2.584 0.534 1.00 74.54 C ATOM 0 HA PRO A 60 -10.569 -3.486 -0.158 1.00 1.11 H new ATOM 0 HB2 PRO A 60 -11.482 -4.410 2.298 1.00 62.12 H new ATOM 0 HB3 PRO A 60 -11.176 -2.703 2.042 1.00 62.12 H new ATOM 0 HG2 PRO A 60 -13.793 -4.193 1.950 1.00 63.41 H new ATOM 0 HG3 PRO A 60 -13.437 -2.637 2.675 1.00 63.41 H new ATOM 0 HD2 PRO A 60 -14.643 -2.834 0.242 1.00 74.54 H new ATOM 0 HD3 PRO A 60 -13.575 -1.499 0.629 1.00 74.54 H new ATOM 940 N GLU A 61 -12.553 -5.721 -0.904 1.00 15.42 N ATOM 941 CA GLU A 61 -12.706 -7.127 -1.258 1.00 51.12 C ATOM 942 C GLU A 61 -12.176 -7.394 -2.664 1.00 54.23 C ATOM 943 O GLU A 61 -11.803 -8.519 -2.994 1.00 53.45 O ATOM 944 CB GLU A 61 -14.175 -7.542 -1.168 1.00 54.23 C ATOM 945 CG GLU A 61 -14.513 -8.316 0.096 1.00 2.53 C ATOM 946 CD GLU A 61 -15.759 -9.167 -0.056 1.00 61.23 C ATOM 947 OE1 GLU A 61 -15.733 -10.118 -0.865 1.00 21.34 O ATOM 948 OE2 GLU A 61 -16.759 -8.881 0.634 1.00 11.22 O ATOM 0 H GLU A 61 -13.238 -5.100 -1.335 1.00 15.42 H new ATOM 0 HA GLU A 61 -12.125 -7.719 -0.550 1.00 51.12 H new ATOM 0 HB2 GLU A 61 -14.799 -6.650 -1.215 1.00 54.23 H new ATOM 0 HB3 GLU A 61 -14.425 -8.153 -2.036 1.00 54.23 H new ATOM 0 HG2 GLU A 61 -13.671 -8.955 0.362 1.00 2.53 H new ATOM 0 HG3 GLU A 61 -14.654 -7.616 0.919 1.00 2.53 H new ATOM 955 N GLU A 62 -12.147 -6.351 -3.488 1.00 53.41 N ATOM 956 CA GLU A 62 -11.665 -6.472 -4.858 1.00 61.03 C ATOM 957 C GLU A 62 -10.146 -6.339 -4.915 1.00 4.15 C ATOM 958 O GLU A 62 -9.470 -7.098 -5.610 1.00 61.53 O ATOM 959 CB GLU A 62 -12.315 -5.410 -5.748 1.00 30.22 C ATOM 960 CG GLU A 62 -13.560 -5.898 -6.469 1.00 14.22 C ATOM 961 CD GLU A 62 -13.248 -6.912 -7.552 1.00 41.11 C ATOM 962 OE1 GLU A 62 -13.143 -8.114 -7.228 1.00 53.51 O ATOM 963 OE2 GLU A 62 -13.107 -6.503 -8.724 1.00 14.34 O ATOM 0 H GLU A 62 -12.452 -5.413 -3.230 1.00 53.41 H new ATOM 0 HA GLU A 62 -11.940 -7.461 -5.226 1.00 61.03 H new ATOM 0 HB2 GLU A 62 -12.575 -4.546 -5.137 1.00 30.22 H new ATOM 0 HB3 GLU A 62 -11.587 -5.072 -6.486 1.00 30.22 H new ATOM 0 HG2 GLU A 62 -14.243 -6.343 -5.746 1.00 14.22 H new ATOM 0 HG3 GLU A 62 -14.076 -5.046 -6.912 1.00 14.22 H new ATOM 970 N LEU A 63 -9.616 -5.369 -4.178 1.00 64.20 N ATOM 971 CA LEU A 63 -8.176 -5.135 -4.144 1.00 33.04 C ATOM 972 C LEU A 63 -7.423 -6.419 -3.812 1.00 23.30 C ATOM 973 O LEU A 63 -6.479 -6.795 -4.507 1.00 5.40 O ATOM 974 CB LEU A 63 -7.840 -4.053 -3.114 1.00 50.14 C ATOM 975 CG LEU A 63 -6.873 -2.964 -3.578 1.00 63.33 C ATOM 976 CD1 LEU A 63 -6.203 -2.302 -2.384 1.00 11.23 C ATOM 977 CD2 LEU A 63 -5.830 -3.544 -4.523 1.00 11.41 C ATOM 0 H LEU A 63 -10.161 -4.732 -3.596 1.00 64.20 H new ATOM 0 HA LEU A 63 -7.864 -4.798 -5.133 1.00 33.04 H new ATOM 0 HB2 LEU A 63 -8.769 -3.577 -2.800 1.00 50.14 H new ATOM 0 HB3 LEU A 63 -7.416 -4.536 -2.234 1.00 50.14 H new ATOM 0 HG LEU A 63 -7.441 -2.206 -4.117 1.00 63.33 H new ATOM 0 HD11 LEU A 63 -5.518 -1.529 -2.733 1.00 11.23 H new ATOM 0 HD12 LEU A 63 -6.962 -1.852 -1.744 1.00 11.23 H new ATOM 0 HD13 LEU A 63 -5.648 -3.050 -1.817 1.00 11.23 H new ATOM 0 HD21 LEU A 63 -5.150 -2.755 -4.843 1.00 11.41 H new ATOM 0 HD22 LEU A 63 -5.266 -4.322 -4.009 1.00 11.41 H new ATOM 0 HD23 LEU A 63 -6.326 -3.971 -5.394 1.00 11.41 H new ATOM 989 N LYS A 64 -7.850 -7.091 -2.748 1.00 25.20 N ATOM 990 CA LYS A 64 -7.218 -8.336 -2.326 1.00 14.43 C ATOM 991 C LYS A 64 -7.171 -9.339 -3.474 1.00 40.41 C ATOM 992 O LYS A 64 -6.191 -10.068 -3.635 1.00 24.23 O ATOM 993 CB LYS A 64 -7.975 -8.937 -1.139 1.00 75.52 C ATOM 994 CG LYS A 64 -8.217 -10.432 -1.267 1.00 43.55 C ATOM 995 CD LYS A 64 -8.457 -11.076 0.087 1.00 4.13 C ATOM 996 CE LYS A 64 -9.863 -11.646 0.193 1.00 41.33 C ATOM 997 NZ LYS A 64 -10.390 -11.569 1.583 1.00 15.01 N ATOM 0 H LYS A 64 -8.631 -6.795 -2.162 1.00 25.20 H new ATOM 0 HA LYS A 64 -6.196 -8.112 -2.022 1.00 14.43 H new ATOM 0 HB2 LYS A 64 -7.413 -8.745 -0.225 1.00 75.52 H new ATOM 0 HB3 LYS A 64 -8.934 -8.429 -1.036 1.00 75.52 H new ATOM 0 HG2 LYS A 64 -9.078 -10.608 -1.912 1.00 43.55 H new ATOM 0 HG3 LYS A 64 -7.358 -10.901 -1.747 1.00 43.55 H new ATOM 0 HD2 LYS A 64 -7.728 -11.871 0.247 1.00 4.13 H new ATOM 0 HD3 LYS A 64 -8.302 -10.338 0.874 1.00 4.13 H new ATOM 0 HE2 LYS A 64 -10.527 -11.101 -0.478 1.00 41.33 H new ATOM 0 HE3 LYS A 64 -9.859 -12.685 -0.137 1.00 41.33 H new ATOM 0 HZ1 LYS A 64 -11.038 -12.364 1.753 1.00 15.01 H new ATOM 0 HZ2 LYS A 64 -9.599 -11.616 2.257 1.00 15.01 H new ATOM 0 HZ3 LYS A 64 -10.901 -10.672 1.711 1.00 15.01 H new ATOM 1011 N LEU A 65 -8.234 -9.369 -4.271 1.00 25.32 N ATOM 1012 CA LEU A 65 -8.312 -10.282 -5.406 1.00 32.54 C ATOM 1013 C LEU A 65 -7.343 -9.866 -6.508 1.00 42.13 C ATOM 1014 O LEU A 65 -6.680 -10.706 -7.114 1.00 1.41 O ATOM 1015 CB LEU A 65 -9.740 -10.323 -5.954 1.00 45.10 C ATOM 1016 CG LEU A 65 -10.815 -10.824 -4.990 1.00 15.23 C ATOM 1017 CD1 LEU A 65 -12.194 -10.708 -5.621 1.00 64.24 C ATOM 1018 CD2 LEU A 65 -10.534 -12.261 -4.576 1.00 74.14 C ATOM 0 H LEU A 65 -9.053 -8.772 -4.152 1.00 25.32 H new ATOM 0 HA LEU A 65 -8.033 -11.277 -5.061 1.00 32.54 H new ATOM 0 HB2 LEU A 65 -10.012 -9.319 -6.279 1.00 45.10 H new ATOM 0 HB3 LEU A 65 -9.750 -10.959 -6.839 1.00 45.10 H new ATOM 0 HG LEU A 65 -10.793 -10.200 -4.097 1.00 15.23 H new ATOM 0 HD11 LEU A 65 -12.946 -11.069 -4.920 1.00 64.24 H new ATOM 0 HD12 LEU A 65 -12.396 -9.665 -5.865 1.00 64.24 H new ATOM 0 HD13 LEU A 65 -12.229 -11.306 -6.531 1.00 64.24 H new ATOM 0 HD21 LEU A 65 -11.310 -12.600 -3.890 1.00 74.14 H new ATOM 0 HD22 LEU A 65 -10.527 -12.899 -5.459 1.00 74.14 H new ATOM 0 HD23 LEU A 65 -9.564 -12.314 -4.082 1.00 74.14 H new ATOM 1030 N GLU A 66 -7.267 -8.562 -6.759 1.00 72.13 N ATOM 1031 CA GLU A 66 -6.378 -8.035 -7.788 1.00 63.21 C ATOM 1032 C GLU A 66 -4.917 -8.296 -7.431 1.00 62.04 C ATOM 1033 O GLU A 66 -4.067 -8.440 -8.311 1.00 4.30 O ATOM 1034 CB GLU A 66 -6.608 -6.534 -7.972 1.00 13.44 C ATOM 1035 CG GLU A 66 -8.035 -6.179 -8.354 1.00 20.31 C ATOM 1036 CD GLU A 66 -8.442 -6.762 -9.693 1.00 61.25 C ATOM 1037 OE1 GLU A 66 -8.796 -7.959 -9.736 1.00 71.04 O ATOM 1038 OE2 GLU A 66 -8.406 -6.022 -10.699 1.00 70.55 O ATOM 0 H GLU A 66 -7.809 -7.853 -6.265 1.00 72.13 H new ATOM 0 HA GLU A 66 -6.603 -8.548 -8.723 1.00 63.21 H new ATOM 0 HB2 GLU A 66 -6.350 -6.019 -7.046 1.00 13.44 H new ATOM 0 HB3 GLU A 66 -5.932 -6.163 -8.742 1.00 13.44 H new ATOM 0 HG2 GLU A 66 -8.715 -6.541 -7.583 1.00 20.31 H new ATOM 0 HG3 GLU A 66 -8.139 -5.095 -8.387 1.00 20.31 H new ATOM 1045 N LEU A 67 -4.633 -8.356 -6.134 1.00 74.25 N ATOM 1046 CA LEU A 67 -3.276 -8.600 -5.659 1.00 64.14 C ATOM 1047 C LEU A 67 -2.906 -10.074 -5.798 1.00 75.31 C ATOM 1048 O LEU A 67 -3.745 -10.965 -5.662 1.00 11.51 O ATOM 1049 CB LEU A 67 -3.139 -8.163 -4.200 1.00 30.42 C ATOM 1050 CG LEU A 67 -3.194 -6.657 -3.942 1.00 34.41 C ATOM 1051 CD1 LEU A 67 -3.377 -6.376 -2.459 1.00 32.42 C ATOM 1052 CD2 LEU A 67 -1.935 -5.981 -4.464 1.00 1.20 C ATOM 0 H LEU A 67 -5.324 -8.239 -5.393 1.00 74.25 H new ATOM 0 HA LEU A 67 -2.592 -8.014 -6.273 1.00 64.14 H new ATOM 0 HB2 LEU A 67 -3.932 -8.639 -3.623 1.00 30.42 H new ATOM 0 HB3 LEU A 67 -2.193 -8.543 -3.815 1.00 30.42 H new ATOM 0 HG LEU A 67 -4.051 -6.247 -4.476 1.00 34.41 H new ATOM 0 HD11 LEU A 67 -3.414 -5.299 -2.295 1.00 32.42 H new ATOM 0 HD12 LEU A 67 -4.308 -6.828 -2.115 1.00 32.42 H new ATOM 0 HD13 LEU A 67 -2.541 -6.800 -1.903 1.00 32.42 H new ATOM 0 HD21 LEU A 67 -1.991 -4.910 -4.272 1.00 1.20 H new ATOM 0 HD22 LEU A 67 -1.063 -6.395 -3.958 1.00 1.20 H new ATOM 0 HD23 LEU A 67 -1.848 -6.153 -5.537 1.00 1.20 H new ATOM 1064 N PRO A 68 -1.621 -10.339 -6.073 1.00 52.32 N ATOM 1065 CA PRO A 68 -1.111 -11.704 -6.232 1.00 64.04 C ATOM 1066 C PRO A 68 -1.089 -12.473 -4.916 1.00 31.12 C ATOM 1067 O PRO A 68 -1.632 -12.014 -3.911 1.00 62.50 O ATOM 1068 CB PRO A 68 0.314 -11.492 -6.751 1.00 52.53 C ATOM 1069 CG PRO A 68 0.699 -10.139 -6.258 1.00 51.14 C ATOM 1070 CD PRO A 68 -0.565 -9.327 -6.249 1.00 14.34 C ATOM 0 HA PRO A 68 -1.738 -12.298 -6.897 1.00 64.04 H new ATOM 0 HB2 PRO A 68 0.991 -12.258 -6.374 1.00 52.53 H new ATOM 0 HB3 PRO A 68 0.351 -11.542 -7.839 1.00 52.53 H new ATOM 0 HG2 PRO A 68 1.133 -10.196 -5.260 1.00 51.14 H new ATOM 0 HG3 PRO A 68 1.449 -9.686 -6.906 1.00 51.14 H new ATOM 0 HD2 PRO A 68 -0.568 -8.598 -5.439 1.00 14.34 H new ATOM 0 HD3 PRO A 68 -0.692 -8.771 -7.178 1.00 14.34 H new ATOM 1078 N GLU A 69 -0.458 -13.643 -4.930 1.00 12.33 N ATOM 1079 CA GLU A 69 -0.367 -14.474 -3.735 1.00 74.05 C ATOM 1080 C GLU A 69 1.088 -14.782 -3.395 1.00 41.43 C ATOM 1081 O GLU A 69 1.396 -15.253 -2.300 1.00 55.14 O ATOM 1082 CB GLU A 69 -1.142 -15.779 -3.935 1.00 35.21 C ATOM 1083 CG GLU A 69 -0.999 -16.365 -5.330 1.00 4.14 C ATOM 1084 CD GLU A 69 -2.091 -15.898 -6.273 1.00 72.42 C ATOM 1085 OE1 GLU A 69 -2.428 -14.696 -6.243 1.00 73.23 O ATOM 1086 OE2 GLU A 69 -2.607 -16.737 -7.042 1.00 34.13 O ATOM 0 H GLU A 69 -0.003 -14.036 -5.754 1.00 12.33 H new ATOM 0 HA GLU A 69 -0.807 -13.921 -2.905 1.00 74.05 H new ATOM 0 HB2 GLU A 69 -0.797 -16.512 -3.205 1.00 35.21 H new ATOM 0 HB3 GLU A 69 -2.198 -15.599 -3.732 1.00 35.21 H new ATOM 0 HG2 GLU A 69 -0.028 -16.087 -5.739 1.00 4.14 H new ATOM 0 HG3 GLU A 69 -1.019 -17.453 -5.267 1.00 4.14 H new ATOM 1093 N ARG A 70 1.981 -14.512 -4.343 1.00 12.23 N ATOM 1094 CA ARG A 70 3.404 -14.761 -4.146 1.00 54.51 C ATOM 1095 C ARG A 70 4.240 -13.632 -4.740 1.00 11.35 C ATOM 1096 O ARG A 70 5.446 -13.779 -4.938 1.00 14.22 O ATOM 1097 CB ARG A 70 3.802 -16.094 -4.782 1.00 1.31 C ATOM 1098 CG ARG A 70 3.245 -17.307 -4.055 1.00 13.21 C ATOM 1099 CD ARG A 70 2.609 -18.293 -5.023 1.00 2.04 C ATOM 1100 NE ARG A 70 3.075 -19.659 -4.797 1.00 53.43 N ATOM 1101 CZ ARG A 70 4.310 -20.068 -5.065 1.00 54.23 C ATOM 1102 NH1 ARG A 70 5.199 -19.221 -5.565 1.00 51.24 N ATOM 1103 NH2 ARG A 70 4.658 -21.327 -4.833 1.00 2.25 N ATOM 0 H ARG A 70 1.744 -14.121 -5.255 1.00 12.23 H new ATOM 0 HA ARG A 70 3.595 -14.806 -3.074 1.00 54.51 H new ATOM 0 HB2 ARG A 70 3.457 -16.111 -5.816 1.00 1.31 H new ATOM 0 HB3 ARG A 70 4.889 -16.164 -4.808 1.00 1.31 H new ATOM 0 HG2 ARG A 70 4.045 -17.801 -3.504 1.00 13.21 H new ATOM 0 HG3 ARG A 70 2.505 -16.985 -3.323 1.00 13.21 H new ATOM 0 HD2 ARG A 70 1.525 -18.257 -4.917 1.00 2.04 H new ATOM 0 HD3 ARG A 70 2.839 -17.996 -6.046 1.00 2.04 H new ATOM 0 HE ARG A 70 2.416 -20.336 -4.412 1.00 53.43 H new ATOM 0 HH11 ARG A 70 4.935 -18.252 -5.745 1.00 51.24 H new ATOM 0 HH12 ARG A 70 6.147 -19.538 -5.770 1.00 51.24 H new ATOM 0 HH21 ARG A 70 3.977 -21.982 -4.449 1.00 2.25 H new ATOM 0 HH22 ARG A 70 5.607 -21.640 -5.039 1.00 2.25 H new ATOM 1117 N GLN A 71 3.591 -12.505 -5.020 1.00 21.40 N ATOM 1118 CA GLN A 71 4.277 -11.352 -5.591 1.00 14.20 C ATOM 1119 C GLN A 71 4.193 -10.151 -4.655 1.00 13.11 C ATOM 1120 O GLN A 71 3.165 -9.481 -4.556 1.00 30.12 O ATOM 1121 CB GLN A 71 3.673 -10.997 -6.951 1.00 64.31 C ATOM 1122 CG GLN A 71 4.607 -11.264 -8.120 1.00 64.31 C ATOM 1123 CD GLN A 71 4.205 -10.512 -9.373 1.00 61.31 C ATOM 1124 OE1 GLN A 71 2.903 -10.409 -9.609 1.00 72.43 O flip ATOM 1125 NE2 GLN A 71 5.056 -10.029 -10.120 1.00 73.43 N flip ATOM 0 H GLN A 71 2.593 -12.367 -4.861 1.00 21.40 H new ATOM 0 HA GLN A 71 5.327 -11.613 -5.724 1.00 14.20 H new ATOM 0 HB2 GLN A 71 2.756 -11.568 -7.092 1.00 64.31 H new ATOM 0 HB3 GLN A 71 3.395 -9.943 -6.952 1.00 64.31 H new ATOM 0 HG2 GLN A 71 5.622 -10.981 -7.841 1.00 64.31 H new ATOM 0 HG3 GLN A 71 4.621 -12.333 -8.332 1.00 64.31 H new ATOM 0 HE21 GLN A 71 6.046 -10.133 -9.899 1.00 73.43 H new ATOM 0 HE22 GLN A 71 4.771 -9.525 -10.960 1.00 73.43 H new ATOM 1134 N PRO A 72 5.300 -9.870 -3.951 1.00 60.33 N ATOM 1135 CA PRO A 72 5.377 -8.749 -3.011 1.00 14.20 C ATOM 1136 C PRO A 72 5.366 -7.398 -3.718 1.00 61.00 C ATOM 1137 O PRO A 72 6.023 -7.218 -4.743 1.00 14.21 O ATOM 1138 CB PRO A 72 6.715 -8.971 -2.303 1.00 61.13 C ATOM 1139 CG PRO A 72 7.531 -9.755 -3.272 1.00 42.55 C ATOM 1140 CD PRO A 72 6.561 -10.626 -4.021 1.00 25.14 C ATOM 0 HA PRO A 72 4.521 -8.723 -2.336 1.00 14.20 H new ATOM 0 HB2 PRO A 72 7.195 -8.024 -2.057 1.00 61.13 H new ATOM 0 HB3 PRO A 72 6.582 -9.514 -1.367 1.00 61.13 H new ATOM 0 HG2 PRO A 72 8.069 -9.095 -3.953 1.00 42.55 H new ATOM 0 HG3 PRO A 72 8.278 -10.358 -2.755 1.00 42.55 H new ATOM 0 HD2 PRO A 72 6.877 -10.785 -5.052 1.00 25.14 H new ATOM 0 HD3 PRO A 72 6.466 -11.610 -3.561 1.00 25.14 H new ATOM 1148 N ARG A 73 4.616 -6.451 -3.164 1.00 32.03 N ATOM 1149 CA ARG A 73 4.519 -5.116 -3.742 1.00 21.23 C ATOM 1150 C ARG A 73 3.821 -4.157 -2.782 1.00 4.10 C ATOM 1151 O ARG A 73 3.285 -4.572 -1.755 1.00 13.23 O ATOM 1152 CB ARG A 73 3.762 -5.166 -5.070 1.00 35.44 C ATOM 1153 CG ARG A 73 2.497 -6.008 -5.018 1.00 74.12 C ATOM 1154 CD ARG A 73 2.410 -6.957 -6.203 1.00 44.14 C ATOM 1155 NE ARG A 73 1.742 -6.343 -7.348 1.00 5.04 N ATOM 1156 CZ ARG A 73 1.867 -6.784 -8.595 1.00 64.12 C ATOM 1157 NH1 ARG A 73 2.631 -7.837 -8.856 1.00 50.43 N ATOM 1158 NH2 ARG A 73 1.227 -6.172 -9.584 1.00 24.23 N ATOM 0 H ARG A 73 4.066 -6.584 -2.315 1.00 32.03 H new ATOM 0 HA ARG A 73 5.530 -4.751 -3.922 1.00 21.23 H new ATOM 0 HB2 ARG A 73 3.501 -4.151 -5.368 1.00 35.44 H new ATOM 0 HB3 ARG A 73 4.422 -5.564 -5.840 1.00 35.44 H new ATOM 0 HG2 ARG A 73 2.477 -6.580 -4.090 1.00 74.12 H new ATOM 0 HG3 ARG A 73 1.624 -5.355 -5.009 1.00 74.12 H new ATOM 0 HD2 ARG A 73 3.414 -7.268 -6.493 1.00 44.14 H new ATOM 0 HD3 ARG A 73 1.870 -7.857 -5.908 1.00 44.14 H new ATOM 0 HE ARG A 73 1.147 -5.531 -7.181 1.00 5.04 H new ATOM 0 HH11 ARG A 73 3.124 -8.310 -8.098 1.00 50.43 H new ATOM 0 HH12 ARG A 73 2.725 -8.174 -9.814 1.00 50.43 H new ATOM 0 HH21 ARG A 73 0.639 -5.362 -9.387 1.00 24.23 H new ATOM 0 HH22 ARG A 73 1.324 -6.511 -10.541 1.00 24.23 H new ATOM 1172 N PHE A 74 3.834 -2.872 -3.123 1.00 62.25 N ATOM 1173 CA PHE A 74 3.204 -1.854 -2.293 1.00 3.35 C ATOM 1174 C PHE A 74 1.808 -1.517 -2.808 1.00 62.32 C ATOM 1175 O PHE A 74 1.531 -1.633 -4.002 1.00 53.44 O ATOM 1176 CB PHE A 74 4.066 -0.590 -2.256 1.00 1.31 C ATOM 1177 CG PHE A 74 5.488 -0.845 -1.846 1.00 30.52 C ATOM 1178 CD1 PHE A 74 5.773 -1.627 -0.738 1.00 45.23 C ATOM 1179 CD2 PHE A 74 6.539 -0.305 -2.569 1.00 21.13 C ATOM 1180 CE1 PHE A 74 7.081 -1.863 -0.358 1.00 21.31 C ATOM 1181 CE2 PHE A 74 7.849 -0.538 -2.194 1.00 71.32 C ATOM 1182 CZ PHE A 74 8.120 -1.319 -1.087 1.00 41.14 C ATOM 0 H PHE A 74 4.275 -2.512 -3.969 1.00 62.25 H new ATOM 0 HA PHE A 74 3.112 -2.252 -1.283 1.00 3.35 H new ATOM 0 HB2 PHE A 74 4.058 -0.126 -3.242 1.00 1.31 H new ATOM 0 HB3 PHE A 74 3.620 0.124 -1.564 1.00 1.31 H new ATOM 0 HD1 PHE A 74 4.965 -2.057 -0.165 1.00 45.23 H new ATOM 0 HD2 PHE A 74 6.333 0.305 -3.436 1.00 21.13 H new ATOM 0 HE1 PHE A 74 7.290 -2.473 0.509 1.00 21.31 H new ATOM 0 HE2 PHE A 74 8.659 -0.110 -2.766 1.00 71.32 H new ATOM 0 HZ PHE A 74 9.142 -1.504 -0.792 1.00 41.14 H new ATOM 1192 N VAL A 75 0.933 -1.099 -1.899 1.00 53.15 N ATOM 1193 CA VAL A 75 -0.435 -0.745 -2.261 1.00 42.15 C ATOM 1194 C VAL A 75 -1.013 0.278 -1.289 1.00 64.14 C ATOM 1195 O VAL A 75 -0.959 0.093 -0.073 1.00 35.21 O ATOM 1196 CB VAL A 75 -1.347 -1.985 -2.289 1.00 34.13 C ATOM 1197 CG1 VAL A 75 -2.748 -1.606 -2.746 1.00 62.20 C ATOM 1198 CG2 VAL A 75 -0.757 -3.060 -3.188 1.00 22.22 C ATOM 0 H VAL A 75 1.147 -0.997 -0.907 1.00 53.15 H new ATOM 0 HA VAL A 75 -0.396 -0.311 -3.260 1.00 42.15 H new ATOM 0 HB VAL A 75 -1.416 -2.387 -1.278 1.00 34.13 H new ATOM 0 HG11 VAL A 75 -3.379 -2.495 -2.760 1.00 62.20 H new ATOM 0 HG12 VAL A 75 -3.169 -0.873 -2.058 1.00 62.20 H new ATOM 0 HG13 VAL A 75 -2.701 -1.179 -3.748 1.00 62.20 H new ATOM 0 HG21 VAL A 75 -1.415 -3.929 -3.196 1.00 22.22 H new ATOM 0 HG22 VAL A 75 -0.656 -2.672 -4.202 1.00 22.22 H new ATOM 0 HG23 VAL A 75 0.224 -3.351 -2.812 1.00 22.22 H new ATOM 1208 N VAL A 76 -1.566 1.356 -1.833 1.00 35.02 N ATOM 1209 CA VAL A 76 -2.157 2.408 -1.014 1.00 41.44 C ATOM 1210 C VAL A 76 -3.672 2.451 -1.183 1.00 63.22 C ATOM 1211 O VAL A 76 -4.183 2.989 -2.166 1.00 23.45 O ATOM 1212 CB VAL A 76 -1.574 3.789 -1.368 1.00 25.35 C ATOM 1213 CG1 VAL A 76 -2.341 4.892 -0.654 1.00 73.23 C ATOM 1214 CG2 VAL A 76 -0.094 3.847 -1.017 1.00 60.13 C ATOM 0 H VAL A 76 -1.618 1.525 -2.838 1.00 35.02 H new ATOM 0 HA VAL A 76 -1.916 2.174 0.023 1.00 41.44 H new ATOM 0 HB VAL A 76 -1.678 3.943 -2.442 1.00 25.35 H new ATOM 0 HG11 VAL A 76 -1.915 5.860 -0.916 1.00 73.23 H new ATOM 0 HG12 VAL A 76 -3.388 4.862 -0.957 1.00 73.23 H new ATOM 0 HG13 VAL A 76 -2.271 4.745 0.424 1.00 73.23 H new ATOM 0 HG21 VAL A 76 0.303 4.829 -1.273 1.00 60.13 H new ATOM 0 HG22 VAL A 76 0.034 3.672 0.051 1.00 60.13 H new ATOM 0 HG23 VAL A 76 0.443 3.082 -1.577 1.00 60.13 H new ATOM 1224 N TYR A 77 -4.385 1.880 -0.218 1.00 10.01 N ATOM 1225 CA TYR A 77 -5.843 1.852 -0.261 1.00 24.43 C ATOM 1226 C TYR A 77 -6.433 3.047 0.480 1.00 4.22 C ATOM 1227 O TYR A 77 -6.030 3.357 1.602 1.00 52.32 O ATOM 1228 CB TYR A 77 -6.365 0.550 0.350 1.00 61.34 C ATOM 1229 CG TYR A 77 -7.845 0.329 0.129 1.00 22.20 C ATOM 1230 CD1 TYR A 77 -8.434 0.609 -1.099 1.00 4.33 C ATOM 1231 CD2 TYR A 77 -8.654 -0.159 1.147 1.00 12.12 C ATOM 1232 CE1 TYR A 77 -9.784 0.410 -1.305 1.00 32.44 C ATOM 1233 CE2 TYR A 77 -10.006 -0.362 0.950 1.00 72.43 C ATOM 1234 CZ TYR A 77 -10.567 -0.076 -0.278 1.00 71.51 C ATOM 1235 OH TYR A 77 -11.913 -0.277 -0.478 1.00 62.43 O ATOM 0 H TYR A 77 -3.978 1.431 0.602 1.00 10.01 H new ATOM 0 HA TYR A 77 -6.153 1.907 -1.305 1.00 24.43 H new ATOM 0 HB2 TYR A 77 -5.813 -0.288 -0.076 1.00 61.34 H new ATOM 0 HB3 TYR A 77 -6.163 0.554 1.421 1.00 61.34 H new ATOM 0 HD1 TYR A 77 -7.824 0.989 -1.906 1.00 4.33 H new ATOM 0 HD2 TYR A 77 -8.218 -0.384 2.109 1.00 12.12 H new ATOM 0 HE1 TYR A 77 -10.225 0.633 -2.265 1.00 32.44 H new ATOM 0 HE2 TYR A 77 -10.621 -0.742 1.752 1.00 72.43 H new ATOM 0 HH TYR A 77 -12.121 -0.176 -1.430 1.00 62.43 H new ATOM 1245 N SER A 78 -7.391 3.715 -0.154 1.00 63.23 N ATOM 1246 CA SER A 78 -8.036 4.878 0.442 1.00 74.22 C ATOM 1247 C SER A 78 -9.511 4.600 0.717 1.00 1.11 C ATOM 1248 O SER A 78 -10.354 4.728 -0.171 1.00 10.32 O ATOM 1249 CB SER A 78 -7.898 6.092 -0.478 1.00 44.34 C ATOM 1250 OG SER A 78 -8.379 7.267 0.149 1.00 33.43 O ATOM 0 H SER A 78 -7.738 3.470 -1.081 1.00 63.23 H new ATOM 0 HA SER A 78 -7.541 5.091 1.389 1.00 74.22 H new ATOM 0 HB2 SER A 78 -6.852 6.226 -0.753 1.00 44.34 H new ATOM 0 HB3 SER A 78 -8.451 5.917 -1.401 1.00 44.34 H new ATOM 0 HG SER A 78 -8.427 7.992 -0.508 1.00 33.43 H new ATOM 1256 N TYR A 79 -9.814 4.220 1.953 1.00 44.12 N ATOM 1257 CA TYR A 79 -11.186 3.921 2.346 1.00 51.35 C ATOM 1258 C TYR A 79 -11.907 5.183 2.811 1.00 63.23 C ATOM 1259 O TYR A 79 -11.281 6.215 3.056 1.00 64.23 O ATOM 1260 CB TYR A 79 -11.203 2.871 3.458 1.00 11.33 C ATOM 1261 CG TYR A 79 -12.562 2.685 4.094 1.00 33.24 C ATOM 1262 CD1 TYR A 79 -13.519 1.868 3.506 1.00 13.54 C ATOM 1263 CD2 TYR A 79 -12.888 3.325 5.283 1.00 20.04 C ATOM 1264 CE1 TYR A 79 -14.763 1.696 4.084 1.00 43.21 C ATOM 1265 CE2 TYR A 79 -14.127 3.158 5.869 1.00 33.10 C ATOM 1266 CZ TYR A 79 -15.062 2.343 5.265 1.00 62.43 C ATOM 1267 OH TYR A 79 -16.299 2.172 5.844 1.00 42.21 O ATOM 0 H TYR A 79 -9.128 4.112 2.700 1.00 44.12 H new ATOM 0 HA TYR A 79 -11.709 3.526 1.475 1.00 51.35 H new ATOM 0 HB2 TYR A 79 -10.868 1.917 3.051 1.00 11.33 H new ATOM 0 HB3 TYR A 79 -10.487 3.158 4.228 1.00 11.33 H new ATOM 0 HD1 TYR A 79 -13.288 1.359 2.582 1.00 13.54 H new ATOM 0 HD2 TYR A 79 -12.159 3.965 5.758 1.00 20.04 H new ATOM 0 HE1 TYR A 79 -15.497 1.058 3.613 1.00 43.21 H new ATOM 0 HE2 TYR A 79 -14.363 3.662 6.794 1.00 33.10 H new ATOM 0 HH TYR A 79 -16.348 2.695 6.671 1.00 42.21 H new ATOM 1277 N LYS A 80 -13.226 5.092 2.930 1.00 53.10 N ATOM 1278 CA LYS A 80 -14.035 6.224 3.367 1.00 23.13 C ATOM 1279 C LYS A 80 -14.696 5.933 4.710 1.00 13.50 C ATOM 1280 O LYS A 80 -15.568 5.071 4.810 1.00 32.32 O ATOM 1281 CB LYS A 80 -15.103 6.548 2.320 1.00 3.21 C ATOM 1282 CG LYS A 80 -15.927 7.780 2.653 1.00 11.15 C ATOM 1283 CD LYS A 80 -16.967 8.062 1.582 1.00 64.42 C ATOM 1284 CE LYS A 80 -18.335 7.529 1.979 1.00 30.34 C ATOM 1285 NZ LYS A 80 -19.351 8.614 2.059 1.00 51.43 N ATOM 0 H LYS A 80 -13.759 4.246 2.730 1.00 53.10 H new ATOM 0 HA LYS A 80 -13.377 7.085 3.485 1.00 23.13 H new ATOM 0 HB2 LYS A 80 -14.620 6.694 1.354 1.00 3.21 H new ATOM 0 HB3 LYS A 80 -15.770 5.692 2.217 1.00 3.21 H new ATOM 0 HG2 LYS A 80 -16.422 7.639 3.614 1.00 11.15 H new ATOM 0 HG3 LYS A 80 -15.268 8.642 2.758 1.00 11.15 H new ATOM 0 HD2 LYS A 80 -17.030 9.136 1.409 1.00 64.42 H new ATOM 0 HD3 LYS A 80 -16.656 7.605 0.642 1.00 64.42 H new ATOM 0 HE2 LYS A 80 -18.658 6.782 1.254 1.00 30.34 H new ATOM 0 HE3 LYS A 80 -18.263 7.027 2.944 1.00 30.34 H new ATOM 0 HZ1 LYS A 80 -20.058 8.375 2.783 1.00 51.43 H new ATOM 0 HZ2 LYS A 80 -18.885 9.508 2.313 1.00 51.43 H new ATOM 0 HZ3 LYS A 80 -19.821 8.718 1.137 1.00 51.43 H new ATOM 1299 N TYR A 81 -14.277 6.660 5.741 1.00 41.34 N ATOM 1300 CA TYR A 81 -14.828 6.480 7.078 1.00 72.42 C ATOM 1301 C TYR A 81 -15.722 7.655 7.462 1.00 42.41 C ATOM 1302 O TYR A 81 -15.312 8.813 7.383 1.00 4.04 O ATOM 1303 CB TYR A 81 -13.701 6.326 8.100 1.00 73.22 C ATOM 1304 CG TYR A 81 -13.989 5.294 9.168 1.00 15.51 C ATOM 1305 CD1 TYR A 81 -15.112 5.401 9.980 1.00 42.45 C ATOM 1306 CD2 TYR A 81 -13.139 4.213 9.365 1.00 72.33 C ATOM 1307 CE1 TYR A 81 -15.379 4.462 10.957 1.00 2.52 C ATOM 1308 CE2 TYR A 81 -13.399 3.268 10.339 1.00 52.23 C ATOM 1309 CZ TYR A 81 -14.519 3.397 11.132 1.00 13.44 C ATOM 1310 OH TYR A 81 -14.783 2.459 12.104 1.00 5.43 O ATOM 0 H TYR A 81 -13.557 7.380 5.675 1.00 41.34 H new ATOM 0 HA TYR A 81 -15.433 5.573 7.075 1.00 72.42 H new ATOM 0 HB2 TYR A 81 -12.784 6.051 7.579 1.00 73.22 H new ATOM 0 HB3 TYR A 81 -13.520 7.289 8.577 1.00 73.22 H new ATOM 0 HD1 TYR A 81 -15.787 6.233 9.845 1.00 42.45 H new ATOM 0 HD2 TYR A 81 -12.260 4.109 8.746 1.00 72.33 H new ATOM 0 HE1 TYR A 81 -16.255 4.561 11.580 1.00 2.52 H new ATOM 0 HE2 TYR A 81 -12.728 2.433 10.478 1.00 52.23 H new ATOM 0 HH TYR A 81 -14.235 1.662 11.947 1.00 5.43 H new ATOM 1320 N VAL A 82 -16.946 7.348 7.879 1.00 41.42 N ATOM 1321 CA VAL A 82 -17.898 8.377 8.277 1.00 13.23 C ATOM 1322 C VAL A 82 -17.825 8.643 9.777 1.00 60.54 C ATOM 1323 O VAL A 82 -17.339 7.810 10.543 1.00 53.14 O ATOM 1324 CB VAL A 82 -19.340 7.982 7.906 1.00 33.03 C ATOM 1325 CG1 VAL A 82 -20.320 9.058 8.349 1.00 11.23 C ATOM 1326 CG2 VAL A 82 -19.455 7.727 6.412 1.00 42.21 C ATOM 0 H VAL A 82 -17.301 6.395 7.950 1.00 41.42 H new ATOM 0 HA VAL A 82 -17.628 9.284 7.737 1.00 13.23 H new ATOM 0 HB VAL A 82 -19.591 7.059 8.429 1.00 33.03 H new ATOM 0 HG11 VAL A 82 -21.333 8.761 8.078 1.00 11.23 H new ATOM 0 HG12 VAL A 82 -20.256 9.186 9.430 1.00 11.23 H new ATOM 0 HG13 VAL A 82 -20.074 9.999 7.857 1.00 11.23 H new ATOM 0 HG21 VAL A 82 -20.480 7.449 6.168 1.00 42.21 H new ATOM 0 HG22 VAL A 82 -19.185 8.631 5.867 1.00 42.21 H new ATOM 0 HG23 VAL A 82 -18.783 6.917 6.128 1.00 42.21 H new ATOM 1336 N HIS A 83 -18.312 9.809 10.190 1.00 23.35 N ATOM 1337 CA HIS A 83 -18.303 10.184 11.600 1.00 64.41 C ATOM 1338 C HIS A 83 -19.661 9.918 12.242 1.00 40.24 C ATOM 1339 O HIS A 83 -19.934 8.808 12.702 1.00 53.43 O ATOM 1340 CB HIS A 83 -17.933 11.660 11.754 1.00 71.32 C ATOM 1341 CG HIS A 83 -16.502 11.956 11.428 1.00 60.43 C ATOM 1342 ND1 HIS A 83 -15.817 11.842 10.265 1.00 13.24 N flip ATOM 1343 CD2 HIS A 83 -15.600 12.429 12.356 1.00 32.22 C flip ATOM 1344 CE1 HIS A 83 -14.528 12.245 10.511 1.00 72.24 C flip ATOM 1345 NE2 HIS A 83 -14.423 12.595 11.781 1.00 51.34 N flip ATOM 0 H HIS A 83 -18.717 10.510 9.569 1.00 23.35 H new ATOM 0 HA HIS A 83 -17.556 9.575 12.108 1.00 64.41 H new ATOM 0 HB2 HIS A 83 -18.575 12.257 11.106 1.00 71.32 H new ATOM 0 HB3 HIS A 83 -18.136 11.972 12.779 1.00 71.32 H new ATOM 0 HD1 HIS A 83 -16.190 11.517 9.373 1.00 13.24 H new ATOM 0 HD2 HIS A 83 -15.821 12.633 13.393 1.00 32.22 H new ATOM 0 HE1 HIS A 83 -13.729 12.272 9.785 1.00 72.24 H new ATOM 1354 N ASP A 84 -20.507 10.941 12.270 1.00 50.20 N ATOM 1355 CA ASP A 84 -21.838 10.817 12.855 1.00 4.51 C ATOM 1356 C ASP A 84 -22.644 12.095 12.645 1.00 15.12 C ATOM 1357 O ASP A 84 -23.732 12.066 12.069 1.00 11.10 O ATOM 1358 CB ASP A 84 -21.734 10.506 14.349 1.00 24.31 C ATOM 1359 CG ASP A 84 -23.091 10.308 14.995 1.00 71.23 C ATOM 1360 OD1 ASP A 84 -23.761 9.303 14.674 1.00 40.34 O ATOM 1361 OD2 ASP A 84 -23.483 11.157 15.822 1.00 14.51 O ATOM 0 H ASP A 84 -20.296 11.866 11.895 1.00 50.20 H new ATOM 0 HA ASP A 84 -22.353 9.997 12.355 1.00 4.51 H new ATOM 0 HB2 ASP A 84 -21.134 9.607 14.489 1.00 24.31 H new ATOM 0 HB3 ASP A 84 -21.211 11.320 14.851 1.00 24.31 H new ATOM 1366 N ASP A 85 -22.105 13.214 13.116 1.00 22.35 N ATOM 1367 CA ASP A 85 -22.774 14.502 12.980 1.00 1.43 C ATOM 1368 C ASP A 85 -23.067 14.811 11.516 1.00 70.33 C ATOM 1369 O ASP A 85 -23.873 15.687 11.204 1.00 63.32 O ATOM 1370 CB ASP A 85 -21.916 15.613 13.586 1.00 41.30 C ATOM 1371 CG ASP A 85 -21.471 15.296 15.000 1.00 32.34 C ATOM 1372 OD1 ASP A 85 -22.341 14.987 15.841 1.00 73.15 O ATOM 1373 OD2 ASP A 85 -20.253 15.357 15.267 1.00 4.34 O ATOM 0 H ASP A 85 -21.206 13.255 13.596 1.00 22.35 H new ATOM 0 HA ASP A 85 -23.721 14.450 13.518 1.00 1.43 H new ATOM 0 HB2 ASP A 85 -21.038 15.773 12.959 1.00 41.30 H new ATOM 0 HB3 ASP A 85 -22.481 16.545 13.587 1.00 41.30 H new ATOM 1378 N GLY A 86 -22.405 14.084 10.619 1.00 35.42 N ATOM 1379 CA GLY A 86 -22.608 14.296 9.197 1.00 22.55 C ATOM 1380 C GLY A 86 -21.307 14.525 8.455 1.00 65.12 C ATOM 1381 O GLY A 86 -21.310 14.959 7.303 1.00 53.11 O ATOM 0 H GLY A 86 -21.733 13.353 10.852 1.00 35.42 H new ATOM 0 HA2 GLY A 86 -23.118 13.431 8.773 1.00 22.55 H new ATOM 0 HA3 GLY A 86 -23.263 15.155 9.050 1.00 22.55 H new ATOM 1385 N ARG A 87 -20.191 14.236 9.115 1.00 21.45 N ATOM 1386 CA ARG A 87 -18.876 14.416 8.512 1.00 12.50 C ATOM 1387 C ARG A 87 -18.259 13.071 8.142 1.00 63.34 C ATOM 1388 O ARG A 87 -18.324 12.113 8.913 1.00 64.21 O ATOM 1389 CB ARG A 87 -17.950 15.169 9.469 1.00 73.23 C ATOM 1390 CG ARG A 87 -18.352 16.618 9.692 1.00 34.10 C ATOM 1391 CD ARG A 87 -18.137 17.454 8.440 1.00 14.24 C ATOM 1392 NE ARG A 87 -19.189 18.451 8.262 1.00 54.34 N ATOM 1393 CZ ARG A 87 -19.226 19.607 8.916 1.00 13.22 C ATOM 1394 NH1 ARG A 87 -18.274 19.909 9.787 1.00 5.03 N ATOM 1395 NH2 ARG A 87 -20.216 20.463 8.699 1.00 54.34 N ATOM 0 H ARG A 87 -20.171 13.876 10.069 1.00 21.45 H new ATOM 0 HA ARG A 87 -18.999 15.002 7.601 1.00 12.50 H new ATOM 0 HB2 ARG A 87 -17.936 14.653 10.429 1.00 73.23 H new ATOM 0 HB3 ARG A 87 -16.934 15.139 9.076 1.00 73.23 H new ATOM 0 HG2 ARG A 87 -19.400 16.665 9.987 1.00 34.10 H new ATOM 0 HG3 ARG A 87 -17.771 17.036 10.514 1.00 34.10 H new ATOM 0 HD2 ARG A 87 -17.170 17.954 8.499 1.00 14.24 H new ATOM 0 HD3 ARG A 87 -18.105 16.800 7.568 1.00 14.24 H new ATOM 0 HE ARG A 87 -19.937 18.249 7.599 1.00 54.34 H new ATOM 0 HH11 ARG A 87 -17.511 19.254 9.956 1.00 5.03 H new ATOM 0 HH12 ARG A 87 -18.304 20.797 10.288 1.00 5.03 H new ATOM 0 HH21 ARG A 87 -20.950 20.234 8.029 1.00 54.34 H new ATOM 0 HH22 ARG A 87 -20.243 21.350 9.202 1.00 54.34 H new ATOM 1409 N VAL A 88 -17.659 13.006 6.957 1.00 3.21 N ATOM 1410 CA VAL A 88 -17.029 11.779 6.485 1.00 32.25 C ATOM 1411 C VAL A 88 -15.665 12.064 5.867 1.00 50.52 C ATOM 1412 O VAL A 88 -15.537 12.918 4.988 1.00 23.15 O ATOM 1413 CB VAL A 88 -17.910 11.059 5.448 1.00 21.31 C ATOM 1414 CG1 VAL A 88 -18.317 12.014 4.337 1.00 15.15 C ATOM 1415 CG2 VAL A 88 -17.183 9.848 4.881 1.00 53.11 C ATOM 0 H VAL A 88 -17.596 13.789 6.307 1.00 3.21 H new ATOM 0 HA VAL A 88 -16.903 11.133 7.354 1.00 32.25 H new ATOM 0 HB VAL A 88 -18.816 10.712 5.945 1.00 21.31 H new ATOM 0 HG11 VAL A 88 -18.939 11.487 3.614 1.00 15.15 H new ATOM 0 HG12 VAL A 88 -18.879 12.846 4.760 1.00 15.15 H new ATOM 0 HG13 VAL A 88 -17.425 12.394 3.839 1.00 15.15 H new ATOM 0 HG21 VAL A 88 -17.820 9.351 4.150 1.00 53.11 H new ATOM 0 HG22 VAL A 88 -16.260 10.170 4.399 1.00 53.11 H new ATOM 0 HG23 VAL A 88 -16.947 9.154 5.688 1.00 53.11 H new ATOM 1425 N SER A 89 -14.649 11.344 6.330 1.00 61.10 N ATOM 1426 CA SER A 89 -13.292 11.522 5.825 1.00 52.33 C ATOM 1427 C SER A 89 -12.744 10.212 5.266 1.00 72.20 C ATOM 1428 O SER A 89 -13.213 9.129 5.620 1.00 5.30 O ATOM 1429 CB SER A 89 -12.375 12.040 6.934 1.00 12.44 C ATOM 1430 OG SER A 89 -12.763 13.338 7.352 1.00 42.23 O ATOM 0 H SER A 89 -14.739 10.631 7.054 1.00 61.10 H new ATOM 0 HA SER A 89 -13.325 12.255 5.019 1.00 52.33 H new ATOM 0 HB2 SER A 89 -12.404 11.357 7.783 1.00 12.44 H new ATOM 0 HB3 SER A 89 -11.345 12.062 6.578 1.00 12.44 H new ATOM 0 HG SER A 89 -12.162 13.646 8.063 1.00 42.23 H new ATOM 1436 N TYR A 90 -11.749 10.319 4.393 1.00 54.54 N ATOM 1437 CA TYR A 90 -11.139 9.144 3.783 1.00 42.42 C ATOM 1438 C TYR A 90 -9.748 8.893 4.359 1.00 62.15 C ATOM 1439 O TYR A 90 -8.752 9.463 3.914 1.00 23.44 O ATOM 1440 CB TYR A 90 -11.050 9.318 2.266 1.00 31.03 C ATOM 1441 CG TYR A 90 -12.222 10.070 1.674 1.00 41.11 C ATOM 1442 CD1 TYR A 90 -13.378 9.402 1.291 1.00 53.22 C ATOM 1443 CD2 TYR A 90 -12.171 11.447 1.497 1.00 31.11 C ATOM 1444 CE1 TYR A 90 -14.451 10.085 0.749 1.00 61.32 C ATOM 1445 CE2 TYR A 90 -13.239 12.138 0.957 1.00 73.42 C ATOM 1446 CZ TYR A 90 -14.376 11.452 0.584 1.00 13.13 C ATOM 1447 OH TYR A 90 -15.441 12.135 0.045 1.00 40.40 O ATOM 0 H TYR A 90 -11.348 11.207 4.092 1.00 54.54 H new ATOM 0 HA TYR A 90 -11.768 8.282 4.007 1.00 42.42 H new ATOM 0 HB2 TYR A 90 -10.129 9.847 2.023 1.00 31.03 H new ATOM 0 HB3 TYR A 90 -10.986 8.335 1.799 1.00 31.03 H new ATOM 0 HD1 TYR A 90 -13.440 8.331 1.419 1.00 53.22 H new ATOM 0 HD2 TYR A 90 -11.281 11.987 1.786 1.00 31.11 H new ATOM 0 HE1 TYR A 90 -15.343 9.551 0.456 1.00 61.32 H new ATOM 0 HE2 TYR A 90 -13.184 13.209 0.828 1.00 73.42 H new ATOM 0 HH TYR A 90 -15.227 13.090 -0.002 1.00 40.40 H new ATOM 1457 N PRO A 91 -9.678 8.017 5.372 1.00 33.23 N ATOM 1458 CA PRO A 91 -8.416 7.667 6.030 1.00 13.54 C ATOM 1459 C PRO A 91 -7.500 6.847 5.129 1.00 4.03 C ATOM 1460 O PRO A 91 -7.602 5.621 5.073 1.00 72.23 O ATOM 1461 CB PRO A 91 -8.863 6.837 7.236 1.00 53.30 C ATOM 1462 CG PRO A 91 -10.181 6.269 6.837 1.00 3.12 C ATOM 1463 CD PRO A 91 -10.826 7.300 5.953 1.00 45.20 C ATOM 0 HA PRO A 91 -7.836 8.551 6.295 1.00 13.54 H new ATOM 0 HB2 PRO A 91 -8.145 6.049 7.463 1.00 53.30 H new ATOM 0 HB3 PRO A 91 -8.952 7.454 8.130 1.00 53.30 H new ATOM 0 HG2 PRO A 91 -10.055 5.325 6.307 1.00 3.12 H new ATOM 0 HG3 PRO A 91 -10.798 6.064 7.712 1.00 3.12 H new ATOM 0 HD2 PRO A 91 -11.444 6.839 5.182 1.00 45.20 H new ATOM 0 HD3 PRO A 91 -11.472 7.969 6.521 1.00 45.20 H new ATOM 1471 N LEU A 92 -6.603 7.530 4.426 1.00 4.11 N ATOM 1472 CA LEU A 92 -5.667 6.864 3.527 1.00 45.51 C ATOM 1473 C LEU A 92 -4.599 6.111 4.314 1.00 4.41 C ATOM 1474 O LEU A 92 -4.005 6.651 5.248 1.00 52.42 O ATOM 1475 CB LEU A 92 -5.008 7.885 2.598 1.00 2.50 C ATOM 1476 CG LEU A 92 -5.481 7.874 1.144 1.00 31.05 C ATOM 1477 CD1 LEU A 92 -6.203 9.169 0.807 1.00 10.35 C ATOM 1478 CD2 LEU A 92 -4.306 7.655 0.202 1.00 51.41 C ATOM 0 H LEU A 92 -6.504 8.545 4.461 1.00 4.11 H new ATOM 0 HA LEU A 92 -6.225 6.145 2.928 1.00 45.51 H new ATOM 0 HB2 LEU A 92 -5.178 8.881 3.007 1.00 2.50 H new ATOM 0 HB3 LEU A 92 -3.931 7.715 2.610 1.00 2.50 H new ATOM 0 HG LEU A 92 -6.181 7.049 1.017 1.00 31.05 H new ATOM 0 HD11 LEU A 92 -6.532 9.142 -0.232 1.00 10.35 H new ATOM 0 HD12 LEU A 92 -7.069 9.283 1.459 1.00 10.35 H new ATOM 0 HD13 LEU A 92 -5.526 10.011 0.952 1.00 10.35 H new ATOM 0 HD21 LEU A 92 -4.662 7.650 -0.828 1.00 51.41 H new ATOM 0 HD22 LEU A 92 -3.581 8.458 0.332 1.00 51.41 H new ATOM 0 HD23 LEU A 92 -3.833 6.699 0.427 1.00 51.41 H new ATOM 1490 N CYS A 93 -4.359 4.864 3.928 1.00 33.44 N ATOM 1491 CA CYS A 93 -3.361 4.036 4.597 1.00 44.34 C ATOM 1492 C CYS A 93 -2.460 3.343 3.579 1.00 33.45 C ATOM 1493 O CYS A 93 -2.757 3.321 2.385 1.00 43.05 O ATOM 1494 CB CYS A 93 -4.043 2.995 5.486 1.00 42.53 C ATOM 1495 SG CYS A 93 -5.008 3.702 6.842 1.00 60.44 S ATOM 0 H CYS A 93 -4.841 4.403 3.156 1.00 33.44 H new ATOM 0 HA CYS A 93 -2.744 4.685 5.219 1.00 44.34 H new ATOM 0 HB2 CYS A 93 -4.699 2.380 4.870 1.00 42.53 H new ATOM 0 HB3 CYS A 93 -3.283 2.333 5.901 1.00 42.53 H new ATOM 0 HG CYS A 93 -4.920 2.931 7.885 1.00 60.44 H new ATOM 1501 N PHE A 94 -1.359 2.777 4.061 1.00 4.22 N ATOM 1502 CA PHE A 94 -0.412 2.085 3.194 1.00 31.43 C ATOM 1503 C PHE A 94 -0.457 0.578 3.434 1.00 22.24 C ATOM 1504 O PHE A 94 0.049 0.085 4.443 1.00 71.14 O ATOM 1505 CB PHE A 94 1.006 2.608 3.429 1.00 42.42 C ATOM 1506 CG PHE A 94 2.029 2.001 2.512 1.00 31.23 C ATOM 1507 CD1 PHE A 94 2.174 2.459 1.214 1.00 50.15 C ATOM 1508 CD2 PHE A 94 2.845 0.970 2.950 1.00 5.04 C ATOM 1509 CE1 PHE A 94 3.114 1.902 0.367 1.00 3.32 C ATOM 1510 CE2 PHE A 94 3.789 0.410 2.110 1.00 54.43 C ATOM 1511 CZ PHE A 94 3.922 0.876 0.816 1.00 31.22 C ATOM 0 H PHE A 94 -1.100 2.784 5.048 1.00 4.22 H new ATOM 0 HA PHE A 94 -0.696 2.280 2.160 1.00 31.43 H new ATOM 0 HB2 PHE A 94 1.011 3.690 3.300 1.00 42.42 H new ATOM 0 HB3 PHE A 94 1.292 2.408 4.462 1.00 42.42 H new ATOM 0 HD1 PHE A 94 1.545 3.262 0.858 1.00 50.15 H new ATOM 0 HD2 PHE A 94 2.742 0.600 3.959 1.00 5.04 H new ATOM 0 HE1 PHE A 94 3.216 2.269 -0.644 1.00 3.32 H new ATOM 0 HE2 PHE A 94 4.422 -0.390 2.464 1.00 54.43 H new ATOM 0 HZ PHE A 94 4.657 0.438 0.157 1.00 31.22 H new ATOM 1521 N ILE A 95 -1.065 -0.146 2.501 1.00 52.44 N ATOM 1522 CA ILE A 95 -1.176 -1.595 2.610 1.00 43.10 C ATOM 1523 C ILE A 95 -0.027 -2.290 1.887 1.00 62.44 C ATOM 1524 O ILE A 95 0.128 -2.155 0.673 1.00 63.20 O ATOM 1525 CB ILE A 95 -2.511 -2.103 2.036 1.00 20.02 C ATOM 1526 CG1 ILE A 95 -3.685 -1.531 2.834 1.00 0.31 C ATOM 1527 CG2 ILE A 95 -2.548 -3.624 2.047 1.00 65.44 C ATOM 1528 CD1 ILE A 95 -5.033 -1.801 2.203 1.00 11.20 C ATOM 0 H ILE A 95 -1.489 0.247 1.661 1.00 52.44 H new ATOM 0 HA ILE A 95 -1.133 -1.835 3.672 1.00 43.10 H new ATOM 0 HB ILE A 95 -2.598 -1.764 1.004 1.00 20.02 H new ATOM 0 HG12 ILE A 95 -3.672 -1.954 3.838 1.00 0.31 H new ATOM 0 HG13 ILE A 95 -3.552 -0.454 2.940 1.00 0.31 H new ATOM 0 HG21 ILE A 95 -3.498 -3.968 1.638 1.00 65.44 H new ATOM 0 HG22 ILE A 95 -1.730 -4.012 1.440 1.00 65.44 H new ATOM 0 HG23 ILE A 95 -2.442 -3.983 3.071 1.00 65.44 H new ATOM 0 HD11 ILE A 95 -5.818 -1.367 2.822 1.00 11.20 H new ATOM 0 HD12 ILE A 95 -5.066 -1.354 1.210 1.00 11.20 H new ATOM 0 HD13 ILE A 95 -5.188 -2.877 2.122 1.00 11.20 H new ATOM 1540 N PHE A 96 0.775 -3.035 2.639 1.00 21.12 N ATOM 1541 CA PHE A 96 1.910 -3.753 2.070 1.00 54.10 C ATOM 1542 C PHE A 96 1.556 -5.215 1.813 1.00 11.20 C ATOM 1543 O PHE A 96 1.414 -6.003 2.747 1.00 31.34 O ATOM 1544 CB PHE A 96 3.117 -3.666 3.007 1.00 62.04 C ATOM 1545 CG PHE A 96 4.348 -4.332 2.461 1.00 44.41 C ATOM 1546 CD1 PHE A 96 4.381 -4.794 1.155 1.00 54.44 C ATOM 1547 CD2 PHE A 96 5.472 -4.496 3.253 1.00 64.41 C ATOM 1548 CE1 PHE A 96 5.512 -5.407 0.650 1.00 12.22 C ATOM 1549 CE2 PHE A 96 6.607 -5.109 2.755 1.00 51.32 C ATOM 1550 CZ PHE A 96 6.626 -5.564 1.450 1.00 23.53 C ATOM 0 H PHE A 96 0.660 -3.158 3.645 1.00 21.12 H new ATOM 0 HA PHE A 96 2.163 -3.286 1.118 1.00 54.10 H new ATOM 0 HB2 PHE A 96 3.338 -2.617 3.205 1.00 62.04 H new ATOM 0 HB3 PHE A 96 2.859 -4.123 3.962 1.00 62.04 H new ATOM 0 HD1 PHE A 96 3.513 -4.674 0.524 1.00 54.44 H new ATOM 0 HD2 PHE A 96 5.462 -4.141 4.273 1.00 64.41 H new ATOM 0 HE1 PHE A 96 5.524 -5.763 -0.370 1.00 12.22 H new ATOM 0 HE2 PHE A 96 7.476 -5.232 3.384 1.00 51.32 H new ATOM 0 HZ PHE A 96 7.511 -6.042 1.057 1.00 23.53 H new ATOM 1560 N SER A 97 1.414 -5.567 0.540 1.00 62.20 N ATOM 1561 CA SER A 97 1.072 -6.933 0.158 1.00 3.53 C ATOM 1562 C SER A 97 2.299 -7.838 0.218 1.00 1.32 C ATOM 1563 O SER A 97 3.047 -7.954 -0.753 1.00 14.50 O ATOM 1564 CB SER A 97 0.474 -6.957 -1.250 1.00 22.34 C ATOM 1565 OG SER A 97 0.170 -8.282 -1.651 1.00 61.24 O ATOM 0 H SER A 97 1.530 -4.926 -0.245 1.00 62.20 H new ATOM 0 HA SER A 97 0.332 -7.307 0.865 1.00 3.53 H new ATOM 0 HB2 SER A 97 -0.431 -6.349 -1.275 1.00 22.34 H new ATOM 0 HB3 SER A 97 1.176 -6.512 -1.955 1.00 22.34 H new ATOM 0 HG SER A 97 -0.212 -8.271 -2.553 1.00 61.24 H new ATOM 1571 N SER A 98 2.500 -8.477 1.366 1.00 12.11 N ATOM 1572 CA SER A 98 3.638 -9.368 1.557 1.00 43.14 C ATOM 1573 C SER A 98 3.171 -10.791 1.848 1.00 11.30 C ATOM 1574 O SER A 98 2.896 -11.160 2.990 1.00 25.13 O ATOM 1575 CB SER A 98 4.522 -8.865 2.699 1.00 44.31 C ATOM 1576 OG SER A 98 5.875 -9.237 2.499 1.00 52.22 O ATOM 0 H SER A 98 1.889 -8.394 2.178 1.00 12.11 H new ATOM 0 HA SER A 98 4.219 -9.376 0.635 1.00 43.14 H new ATOM 0 HB2 SER A 98 4.447 -7.780 2.770 1.00 44.31 H new ATOM 0 HB3 SER A 98 4.166 -9.272 3.645 1.00 44.31 H new ATOM 0 HG SER A 98 6.373 -8.476 2.134 1.00 52.22 H new ATOM 1582 N PRO A 99 3.078 -11.611 0.790 1.00 25.10 N ATOM 1583 CA PRO A 99 2.645 -13.006 0.906 1.00 75.41 C ATOM 1584 C PRO A 99 3.677 -13.877 1.614 1.00 61.14 C ATOM 1585 O PRO A 99 4.583 -13.370 2.275 1.00 13.33 O ATOM 1586 CB PRO A 99 2.480 -13.449 -0.550 1.00 41.44 C ATOM 1587 CG PRO A 99 3.392 -12.558 -1.322 1.00 55.11 C ATOM 1588 CD PRO A 99 3.390 -11.239 -0.600 1.00 54.22 C ATOM 0 HA PRO A 99 1.737 -13.102 1.501 1.00 75.41 H new ATOM 0 HB2 PRO A 99 2.749 -14.498 -0.678 1.00 41.44 H new ATOM 0 HB3 PRO A 99 1.447 -13.342 -0.882 1.00 41.44 H new ATOM 0 HG2 PRO A 99 4.398 -12.976 -1.369 1.00 55.11 H new ATOM 0 HG3 PRO A 99 3.047 -12.441 -2.349 1.00 55.11 H new ATOM 0 HD2 PRO A 99 4.355 -10.739 -0.675 1.00 54.22 H new ATOM 0 HD3 PRO A 99 2.645 -10.557 -1.010 1.00 54.22 H new ATOM 1596 N VAL A 100 3.535 -15.191 1.470 1.00 42.41 N ATOM 1597 CA VAL A 100 4.457 -16.132 2.095 1.00 73.12 C ATOM 1598 C VAL A 100 5.067 -17.072 1.061 1.00 53.44 C ATOM 1599 O VAL A 100 6.202 -17.522 1.209 1.00 43.22 O ATOM 1600 CB VAL A 100 3.755 -16.968 3.181 1.00 11.33 C ATOM 1601 CG1 VAL A 100 4.629 -18.140 3.602 1.00 42.42 C ATOM 1602 CG2 VAL A 100 3.403 -16.098 4.378 1.00 2.42 C ATOM 0 H VAL A 100 2.791 -15.628 0.926 1.00 42.41 H new ATOM 0 HA VAL A 100 5.248 -15.541 2.557 1.00 73.12 H new ATOM 0 HB VAL A 100 2.830 -17.367 2.766 1.00 11.33 H new ATOM 0 HG11 VAL A 100 4.116 -18.719 4.370 1.00 42.42 H new ATOM 0 HG12 VAL A 100 4.825 -18.776 2.739 1.00 42.42 H new ATOM 0 HG13 VAL A 100 5.573 -17.766 3.999 1.00 42.42 H new ATOM 0 HG21 VAL A 100 2.908 -16.705 5.136 1.00 2.42 H new ATOM 0 HG22 VAL A 100 4.313 -15.668 4.796 1.00 2.42 H new ATOM 0 HG23 VAL A 100 2.735 -15.297 4.062 1.00 2.42 H new ATOM 1612 N GLY A 101 4.304 -17.364 0.012 1.00 45.13 N ATOM 1613 CA GLY A 101 4.786 -18.250 -1.033 1.00 4.41 C ATOM 1614 C GLY A 101 5.782 -17.572 -1.952 1.00 43.22 C ATOM 1615 O GLY A 101 6.237 -18.165 -2.932 1.00 1.15 O ATOM 0 H GLY A 101 3.361 -17.003 -0.133 1.00 45.13 H new ATOM 0 HA2 GLY A 101 5.252 -19.124 -0.578 1.00 4.41 H new ATOM 0 HA3 GLY A 101 3.940 -18.609 -1.620 1.00 4.41 H new ATOM 1619 N CYS A 102 6.122 -16.326 -1.640 1.00 33.23 N ATOM 1620 CA CYS A 102 7.069 -15.566 -2.447 1.00 21.20 C ATOM 1621 C CYS A 102 8.505 -15.949 -2.104 1.00 62.00 C ATOM 1622 O CYS A 102 8.744 -16.868 -1.321 1.00 45.42 O ATOM 1623 CB CYS A 102 6.864 -14.065 -2.234 1.00 62.34 C ATOM 1624 SG CYS A 102 6.771 -13.573 -0.497 1.00 12.11 S ATOM 0 H CYS A 102 5.755 -15.821 -0.833 1.00 33.23 H new ATOM 0 HA CYS A 102 6.889 -15.804 -3.495 1.00 21.20 H new ATOM 0 HB2 CYS A 102 7.683 -13.526 -2.710 1.00 62.34 H new ATOM 0 HB3 CYS A 102 5.947 -13.759 -2.737 1.00 62.34 H new ATOM 0 HG CYS A 102 6.452 -12.315 -0.419 1.00 12.11 H new ATOM 1630 N LYS A 103 9.459 -15.238 -2.697 1.00 62.43 N ATOM 1631 CA LYS A 103 10.873 -15.502 -2.457 1.00 33.14 C ATOM 1632 C LYS A 103 11.495 -14.401 -1.605 1.00 14.41 C ATOM 1633 O LYS A 103 11.080 -13.242 -1.646 1.00 40.22 O ATOM 1634 CB LYS A 103 11.624 -15.621 -3.784 1.00 64.03 C ATOM 1635 CG LYS A 103 10.811 -16.280 -4.886 1.00 45.55 C ATOM 1636 CD LYS A 103 10.634 -15.354 -6.077 1.00 60.34 C ATOM 1637 CE LYS A 103 11.971 -14.995 -6.709 1.00 73.20 C ATOM 1638 NZ LYS A 103 12.190 -15.716 -7.993 1.00 11.11 N ATOM 0 H LYS A 103 9.278 -14.474 -3.348 1.00 62.43 H new ATOM 0 HA LYS A 103 10.954 -16.445 -1.916 1.00 33.14 H new ATOM 0 HB2 LYS A 103 11.926 -14.626 -4.112 1.00 64.03 H new ATOM 0 HB3 LYS A 103 12.537 -16.195 -3.625 1.00 64.03 H new ATOM 0 HG2 LYS A 103 11.307 -17.196 -5.207 1.00 45.55 H new ATOM 0 HG3 LYS A 103 9.833 -16.565 -4.497 1.00 45.55 H new ATOM 0 HD2 LYS A 103 9.996 -15.833 -6.820 1.00 60.34 H new ATOM 0 HD3 LYS A 103 10.125 -14.444 -5.759 1.00 60.34 H new ATOM 0 HE2 LYS A 103 12.012 -13.920 -6.885 1.00 73.20 H new ATOM 0 HE3 LYS A 103 12.777 -15.236 -6.015 1.00 73.20 H new ATOM 0 HZ1 LYS A 103 13.111 -15.444 -8.391 1.00 11.11 H new ATOM 0 HZ2 LYS A 103 12.176 -16.742 -7.822 1.00 11.11 H new ATOM 0 HZ3 LYS A 103 11.436 -15.467 -8.664 1.00 11.11 H new ATOM 1652 N PRO A 104 12.515 -14.767 -0.815 1.00 43.40 N ATOM 1653 CA PRO A 104 13.218 -13.822 0.059 1.00 35.14 C ATOM 1654 C PRO A 104 14.056 -12.819 -0.725 1.00 24.32 C ATOM 1655 O PRO A 104 14.526 -11.824 -0.174 1.00 52.21 O ATOM 1656 CB PRO A 104 14.117 -14.726 0.906 1.00 11.12 C ATOM 1657 CG PRO A 104 14.331 -15.939 0.070 1.00 62.31 C ATOM 1658 CD PRO A 104 13.062 -16.129 -0.716 1.00 31.42 C ATOM 0 HA PRO A 104 12.527 -13.216 0.644 1.00 35.14 H new ATOM 0 HB2 PRO A 104 15.062 -14.236 1.141 1.00 11.12 H new ATOM 0 HB3 PRO A 104 13.643 -14.978 1.855 1.00 11.12 H new ATOM 0 HG2 PRO A 104 15.186 -15.810 -0.594 1.00 62.31 H new ATOM 0 HG3 PRO A 104 14.539 -16.810 0.692 1.00 62.31 H new ATOM 0 HD2 PRO A 104 13.259 -16.555 -1.700 1.00 31.42 H new ATOM 0 HD3 PRO A 104 12.372 -16.803 -0.208 1.00 31.42 H new ATOM 1666 N GLU A 105 14.240 -13.089 -2.014 1.00 41.41 N ATOM 1667 CA GLU A 105 15.023 -12.209 -2.873 1.00 5.40 C ATOM 1668 C GLU A 105 14.217 -10.974 -3.267 1.00 10.11 C ATOM 1669 O GLU A 105 14.766 -9.882 -3.408 1.00 13.34 O ATOM 1670 CB GLU A 105 15.477 -12.956 -4.128 1.00 52.33 C ATOM 1671 CG GLU A 105 16.691 -13.842 -3.904 1.00 33.13 C ATOM 1672 CD GLU A 105 17.507 -14.044 -5.165 1.00 61.11 C ATOM 1673 OE1 GLU A 105 17.845 -13.037 -5.822 1.00 35.33 O ATOM 1674 OE2 GLU A 105 17.808 -15.211 -5.496 1.00 24.03 O ATOM 0 H GLU A 105 13.858 -13.909 -2.485 1.00 41.41 H new ATOM 0 HA GLU A 105 15.901 -11.886 -2.314 1.00 5.40 H new ATOM 0 HB2 GLU A 105 14.653 -13.569 -4.494 1.00 52.33 H new ATOM 0 HB3 GLU A 105 15.706 -12.231 -4.909 1.00 52.33 H new ATOM 0 HG2 GLU A 105 17.323 -13.398 -3.134 1.00 33.13 H new ATOM 0 HG3 GLU A 105 16.364 -14.812 -3.528 1.00 33.13 H new ATOM 1681 N GLN A 106 12.913 -11.158 -3.443 1.00 54.13 N ATOM 1682 CA GLN A 106 12.031 -10.059 -3.822 1.00 23.22 C ATOM 1683 C GLN A 106 11.451 -9.376 -2.587 1.00 23.51 C ATOM 1684 O GLN A 106 11.618 -8.173 -2.397 1.00 42.55 O ATOM 1685 CB GLN A 106 10.900 -10.571 -4.715 1.00 52.30 C ATOM 1686 CG GLN A 106 11.336 -11.653 -5.690 1.00 14.44 C ATOM 1687 CD GLN A 106 12.148 -11.104 -6.846 1.00 12.42 C ATOM 1688 OE1 GLN A 106 13.221 -11.616 -7.166 1.00 22.44 O ATOM 1689 NE2 GLN A 106 11.640 -10.054 -7.482 1.00 55.30 N ATOM 0 H GLN A 106 12.443 -12.056 -3.330 1.00 54.13 H new ATOM 0 HA GLN A 106 12.619 -9.328 -4.376 1.00 23.22 H new ATOM 0 HB2 GLN A 106 10.100 -10.962 -4.086 1.00 52.30 H new ATOM 0 HB3 GLN A 106 10.484 -9.734 -5.276 1.00 52.30 H new ATOM 0 HG2 GLN A 106 11.926 -12.399 -5.158 1.00 14.44 H new ATOM 0 HG3 GLN A 106 10.455 -12.162 -6.080 1.00 14.44 H new ATOM 0 HE21 GLN A 106 10.747 -9.660 -7.184 1.00 55.30 H new ATOM 0 HE22 GLN A 106 12.143 -9.642 -8.268 1.00 55.30 H new ATOM 1698 N GLN A 107 10.770 -10.154 -1.752 1.00 55.01 N ATOM 1699 CA GLN A 107 10.164 -9.623 -0.536 1.00 41.44 C ATOM 1700 C GLN A 107 11.059 -8.564 0.100 1.00 61.04 C ATOM 1701 O GLN A 107 10.578 -7.533 0.568 1.00 45.43 O ATOM 1702 CB GLN A 107 9.901 -10.751 0.462 1.00 35.42 C ATOM 1703 CG GLN A 107 8.470 -10.784 0.978 1.00 62.02 C ATOM 1704 CD GLN A 107 8.366 -10.368 2.432 1.00 34.53 C ATOM 1705 OE1 GLN A 107 7.911 -11.139 3.278 1.00 15.44 O ATOM 1706 NE2 GLN A 107 8.787 -9.145 2.731 1.00 72.33 N ATOM 0 H GLN A 107 10.624 -11.153 -1.895 1.00 55.01 H new ATOM 0 HA GLN A 107 9.216 -9.158 -0.806 1.00 41.44 H new ATOM 0 HB2 GLN A 107 10.130 -11.705 -0.012 1.00 35.42 H new ATOM 0 HB3 GLN A 107 10.581 -10.644 1.307 1.00 35.42 H new ATOM 0 HG2 GLN A 107 7.853 -10.123 0.370 1.00 62.02 H new ATOM 0 HG3 GLN A 107 8.069 -11.791 0.862 1.00 62.02 H new ATOM 0 HE21 GLN A 107 9.157 -8.540 1.998 1.00 72.33 H new ATOM 0 HE22 GLN A 107 8.741 -8.811 3.694 1.00 72.33 H new ATOM 1715 N MET A 108 12.362 -8.827 0.112 1.00 74.33 N ATOM 1716 CA MET A 108 13.323 -7.895 0.690 1.00 70.21 C ATOM 1717 C MET A 108 13.348 -6.585 -0.090 1.00 73.14 C ATOM 1718 O MET A 108 13.345 -5.503 0.496 1.00 42.13 O ATOM 1719 CB MET A 108 14.721 -8.518 0.707 1.00 2.41 C ATOM 1720 CG MET A 108 14.956 -9.450 1.885 1.00 61.05 C ATOM 1721 SD MET A 108 16.695 -9.561 2.346 1.00 24.13 S ATOM 1722 CE MET A 108 17.433 -10.017 0.779 1.00 51.12 C ATOM 0 H MET A 108 12.776 -9.677 -0.271 1.00 74.33 H new ATOM 0 HA MET A 108 13.014 -7.682 1.713 1.00 70.21 H new ATOM 0 HB2 MET A 108 14.875 -9.071 -0.220 1.00 2.41 H new ATOM 0 HB3 MET A 108 15.465 -7.721 0.730 1.00 2.41 H new ATOM 0 HG2 MET A 108 14.379 -9.100 2.741 1.00 61.05 H new ATOM 0 HG3 MET A 108 14.586 -10.445 1.636 1.00 61.05 H new ATOM 0 HE1 MET A 108 18.465 -10.330 0.940 1.00 51.12 H new ATOM 0 HE2 MET A 108 16.869 -10.839 0.337 1.00 51.12 H new ATOM 0 HE3 MET A 108 17.415 -9.160 0.105 1.00 51.12 H new ATOM 1732 N MET A 109 13.370 -6.691 -1.415 1.00 42.34 N ATOM 1733 CA MET A 109 13.394 -5.513 -2.275 1.00 15.32 C ATOM 1734 C MET A 109 12.324 -4.511 -1.854 1.00 75.32 C ATOM 1735 O MET A 109 12.534 -3.300 -1.917 1.00 41.31 O ATOM 1736 CB MET A 109 13.185 -5.917 -3.736 1.00 22.13 C ATOM 1737 CG MET A 109 14.401 -6.581 -4.362 1.00 51.41 C ATOM 1738 SD MET A 109 14.035 -7.334 -5.959 1.00 51.25 S ATOM 1739 CE MET A 109 13.573 -5.892 -6.916 1.00 24.03 C ATOM 0 H MET A 109 13.372 -7.579 -1.916 1.00 42.34 H new ATOM 0 HA MET A 109 14.370 -5.039 -2.173 1.00 15.32 H new ATOM 0 HB2 MET A 109 12.337 -6.598 -3.798 1.00 22.13 H new ATOM 0 HB3 MET A 109 12.926 -5.031 -4.316 1.00 22.13 H new ATOM 0 HG2 MET A 109 15.191 -5.840 -4.486 1.00 51.41 H new ATOM 0 HG3 MET A 109 14.783 -7.344 -3.684 1.00 51.41 H new ATOM 0 HE1 MET A 109 13.038 -6.206 -7.812 1.00 24.03 H new ATOM 0 HE2 MET A 109 12.929 -5.248 -6.316 1.00 24.03 H new ATOM 0 HE3 MET A 109 14.470 -5.343 -7.202 1.00 24.03 H new ATOM 1749 N TYR A 110 11.175 -5.024 -1.426 1.00 33.40 N ATOM 1750 CA TYR A 110 10.070 -4.174 -0.998 1.00 61.42 C ATOM 1751 C TYR A 110 10.149 -3.891 0.499 1.00 24.34 C ATOM 1752 O TYR A 110 9.792 -2.806 0.957 1.00 20.40 O ATOM 1753 CB TYR A 110 8.732 -4.834 -1.334 1.00 24.24 C ATOM 1754 CG TYR A 110 8.626 -5.291 -2.771 1.00 2.40 C ATOM 1755 CD1 TYR A 110 9.181 -6.497 -3.180 1.00 72.22 C ATOM 1756 CD2 TYR A 110 7.970 -4.517 -3.721 1.00 12.12 C ATOM 1757 CE1 TYR A 110 9.087 -6.918 -4.492 1.00 73.22 C ATOM 1758 CE2 TYR A 110 7.870 -4.930 -5.034 1.00 73.54 C ATOM 1759 CZ TYR A 110 8.430 -6.132 -5.416 1.00 22.32 C ATOM 1760 OH TYR A 110 8.333 -6.548 -6.724 1.00 42.11 O ATOM 0 H TYR A 110 10.985 -6.024 -1.366 1.00 33.40 H new ATOM 0 HA TYR A 110 10.145 -3.227 -1.533 1.00 61.42 H new ATOM 0 HB2 TYR A 110 8.584 -5.691 -0.677 1.00 24.24 H new ATOM 0 HB3 TYR A 110 7.927 -4.130 -1.125 1.00 24.24 H new ATOM 0 HD1 TYR A 110 9.695 -7.116 -2.460 1.00 72.22 H new ATOM 0 HD2 TYR A 110 7.531 -3.575 -3.426 1.00 12.12 H new ATOM 0 HE1 TYR A 110 9.526 -7.858 -4.793 1.00 73.22 H new ATOM 0 HE2 TYR A 110 7.356 -4.316 -5.759 1.00 73.54 H new ATOM 0 HH TYR A 110 7.839 -5.880 -7.244 1.00 42.11 H new ATOM 1770 N ALA A 111 10.621 -4.876 1.257 1.00 51.14 N ATOM 1771 CA ALA A 111 10.751 -4.734 2.702 1.00 54.43 C ATOM 1772 C ALA A 111 11.791 -3.678 3.058 1.00 55.41 C ATOM 1773 O ALA A 111 11.713 -3.048 4.112 1.00 20.00 O ATOM 1774 CB ALA A 111 11.114 -6.070 3.333 1.00 14.31 C ATOM 0 H ALA A 111 10.920 -5.781 0.894 1.00 51.14 H new ATOM 0 HA ALA A 111 9.790 -4.407 3.098 1.00 54.43 H new ATOM 0 HB1 ALA A 111 11.208 -5.949 4.412 1.00 14.31 H new ATOM 0 HB2 ALA A 111 10.333 -6.799 3.116 1.00 14.31 H new ATOM 0 HB3 ALA A 111 12.061 -6.420 2.923 1.00 14.31 H new ATOM 1780 N GLY A 112 12.764 -3.488 2.172 1.00 72.11 N ATOM 1781 CA GLY A 112 13.805 -2.508 2.413 1.00 44.21 C ATOM 1782 C GLY A 112 13.486 -1.159 1.797 1.00 33.44 C ATOM 1783 O GLY A 112 13.983 -0.129 2.251 1.00 1.45 O ATOM 0 H GLY A 112 12.849 -3.996 1.292 1.00 72.11 H new ATOM 0 HA2 GLY A 112 13.946 -2.389 3.487 1.00 44.21 H new ATOM 0 HA3 GLY A 112 14.747 -2.876 2.007 1.00 44.21 H new ATOM 1787 N SER A 113 12.655 -1.166 0.760 1.00 14.32 N ATOM 1788 CA SER A 113 12.274 0.066 0.079 1.00 72.31 C ATOM 1789 C SER A 113 10.931 0.578 0.592 1.00 1.33 C ATOM 1790 O SER A 113 10.572 1.735 0.377 1.00 12.41 O ATOM 1791 CB SER A 113 12.201 -0.164 -1.432 1.00 32.30 C ATOM 1792 OG SER A 113 13.403 -0.734 -1.920 1.00 22.43 O ATOM 0 H SER A 113 12.233 -2.010 0.373 1.00 14.32 H new ATOM 0 HA SER A 113 13.034 0.818 0.289 1.00 72.31 H new ATOM 0 HB2 SER A 113 11.363 -0.822 -1.663 1.00 32.30 H new ATOM 0 HB3 SER A 113 12.012 0.783 -1.938 1.00 32.30 H new ATOM 0 HG SER A 113 13.263 -1.687 -2.101 1.00 22.43 H new ATOM 1798 N LYS A 114 10.194 -0.293 1.273 1.00 73.23 N ATOM 1799 CA LYS A 114 8.891 0.068 1.819 1.00 2.24 C ATOM 1800 C LYS A 114 8.948 1.430 2.506 1.00 24.40 C ATOM 1801 O LYS A 114 8.293 2.378 2.079 1.00 11.13 O ATOM 1802 CB LYS A 114 8.418 -0.997 2.811 1.00 2.54 C ATOM 1803 CG LYS A 114 7.114 -0.644 3.505 1.00 63.11 C ATOM 1804 CD LYS A 114 6.550 -1.831 4.268 1.00 40.11 C ATOM 1805 CE LYS A 114 6.911 -1.767 5.744 1.00 21.45 C ATOM 1806 NZ LYS A 114 6.150 -2.766 6.545 1.00 72.13 N ATOM 0 H LYS A 114 10.477 -1.255 1.460 1.00 73.23 H new ATOM 0 HA LYS A 114 8.182 0.126 0.993 1.00 2.24 H new ATOM 0 HB2 LYS A 114 8.295 -1.943 2.284 1.00 2.54 H new ATOM 0 HB3 LYS A 114 9.191 -1.149 3.564 1.00 2.54 H new ATOM 0 HG2 LYS A 114 7.279 0.186 4.192 1.00 63.11 H new ATOM 0 HG3 LYS A 114 6.387 -0.306 2.766 1.00 63.11 H new ATOM 0 HD2 LYS A 114 5.466 -1.854 4.158 1.00 40.11 H new ATOM 0 HD3 LYS A 114 6.933 -2.757 3.838 1.00 40.11 H new ATOM 0 HE2 LYS A 114 7.980 -1.943 5.864 1.00 21.45 H new ATOM 0 HE3 LYS A 114 6.708 -0.766 6.124 1.00 21.45 H new ATOM 0 HZ1 LYS A 114 6.424 -2.691 7.545 1.00 72.13 H new ATOM 0 HZ2 LYS A 114 5.131 -2.583 6.451 1.00 72.13 H new ATOM 0 HZ3 LYS A 114 6.363 -3.723 6.199 1.00 72.13 H new ATOM 1820 N ASN A 115 9.738 1.516 3.572 1.00 32.14 N ATOM 1821 CA ASN A 115 9.881 2.762 4.317 1.00 70.42 C ATOM 1822 C ASN A 115 10.117 3.937 3.373 1.00 43.12 C ATOM 1823 O ASN A 115 9.497 4.991 3.510 1.00 15.45 O ATOM 1824 CB ASN A 115 11.037 2.654 5.314 1.00 60.11 C ATOM 1825 CG ASN A 115 10.590 2.122 6.662 1.00 41.11 C ATOM 1826 OD1 ASN A 115 9.806 2.761 7.365 1.00 43.42 O ATOM 1827 ND2 ASN A 115 11.088 0.948 7.030 1.00 62.41 N ATOM 0 H ASN A 115 10.288 0.739 3.939 1.00 32.14 H new ATOM 0 HA ASN A 115 8.954 2.938 4.863 1.00 70.42 H new ATOM 0 HB2 ASN A 115 11.806 1.999 4.905 1.00 60.11 H new ATOM 0 HB3 ASN A 115 11.492 3.636 5.447 1.00 60.11 H new ATOM 0 HD21 ASN A 115 10.824 0.541 7.927 1.00 62.41 H new ATOM 0 HD22 ASN A 115 11.735 0.453 6.416 1.00 62.41 H new ATOM 1834 N ARG A 116 11.018 3.747 2.414 1.00 2.02 N ATOM 1835 CA ARG A 116 11.336 4.790 1.447 1.00 5.55 C ATOM 1836 C ARG A 116 10.082 5.249 0.709 1.00 23.02 C ATOM 1837 O ARG A 116 9.767 6.439 0.677 1.00 1.15 O ATOM 1838 CB ARG A 116 12.377 4.287 0.445 1.00 14.14 C ATOM 1839 CG ARG A 116 12.610 5.236 -0.719 1.00 24.22 C ATOM 1840 CD ARG A 116 13.195 6.559 -0.249 1.00 10.52 C ATOM 1841 NE ARG A 116 13.825 7.297 -1.340 1.00 53.40 N ATOM 1842 CZ ARG A 116 15.015 6.990 -1.844 1.00 10.33 C ATOM 1843 NH1 ARG A 116 15.700 5.965 -1.357 1.00 24.22 N ATOM 1844 NH2 ARG A 116 15.522 7.710 -2.837 1.00 33.41 N ATOM 0 H ARG A 116 11.540 2.880 2.286 1.00 2.02 H new ATOM 0 HA ARG A 116 11.747 5.641 1.990 1.00 5.55 H new ATOM 0 HB2 ARG A 116 13.321 4.125 0.965 1.00 14.14 H new ATOM 0 HB3 ARG A 116 12.057 3.320 0.056 1.00 14.14 H new ATOM 0 HG2 ARG A 116 13.286 4.773 -1.438 1.00 24.22 H new ATOM 0 HG3 ARG A 116 11.668 5.417 -1.237 1.00 24.22 H new ATOM 0 HD2 ARG A 116 12.406 7.168 0.192 1.00 10.52 H new ATOM 0 HD3 ARG A 116 13.930 6.373 0.534 1.00 10.52 H new ATOM 0 HE ARG A 116 13.324 8.092 -1.737 1.00 53.40 H new ATOM 0 HH11 ARG A 116 15.314 5.410 -0.594 1.00 24.22 H new ATOM 0 HH12 ARG A 116 16.614 5.731 -1.746 1.00 24.22 H new ATOM 0 HH21 ARG A 116 14.998 8.500 -3.214 1.00 33.41 H new ATOM 0 HH22 ARG A 116 16.436 7.474 -3.223 1.00 33.41 H new ATOM 1858 N LEU A 117 9.371 4.297 0.116 1.00 12.24 N ATOM 1859 CA LEU A 117 8.151 4.602 -0.623 1.00 71.54 C ATOM 1860 C LEU A 117 7.116 5.262 0.283 1.00 43.24 C ATOM 1861 O LEU A 117 6.650 6.368 0.008 1.00 44.51 O ATOM 1862 CB LEU A 117 7.570 3.327 -1.236 1.00 71.21 C ATOM 1863 CG LEU A 117 6.342 3.510 -2.128 1.00 51.02 C ATOM 1864 CD1 LEU A 117 5.149 3.973 -1.307 1.00 34.24 C ATOM 1865 CD2 LEU A 117 6.637 4.498 -3.247 1.00 2.23 C ATOM 0 H LEU A 117 9.618 3.307 0.132 1.00 12.24 H new ATOM 0 HA LEU A 117 8.404 5.299 -1.422 1.00 71.54 H new ATOM 0 HB2 LEU A 117 8.350 2.841 -1.822 1.00 71.21 H new ATOM 0 HB3 LEU A 117 7.308 2.646 -0.427 1.00 71.21 H new ATOM 0 HG LEU A 117 6.097 2.547 -2.576 1.00 51.02 H new ATOM 0 HD11 LEU A 117 4.285 4.098 -1.959 1.00 34.24 H new ATOM 0 HD12 LEU A 117 4.923 3.229 -0.543 1.00 34.24 H new ATOM 0 HD13 LEU A 117 5.383 4.924 -0.829 1.00 34.24 H new ATOM 0 HD21 LEU A 117 5.751 4.615 -3.872 1.00 2.23 H new ATOM 0 HD22 LEU A 117 6.909 5.463 -2.818 1.00 2.23 H new ATOM 0 HD23 LEU A 117 7.462 4.125 -3.854 1.00 2.23 H new ATOM 1877 N VAL A 118 6.762 4.577 1.365 1.00 10.40 N ATOM 1878 CA VAL A 118 5.785 5.099 2.314 1.00 74.55 C ATOM 1879 C VAL A 118 6.139 6.517 2.744 1.00 44.14 C ATOM 1880 O VAL A 118 5.314 7.426 2.659 1.00 20.11 O ATOM 1881 CB VAL A 118 5.685 4.204 3.564 1.00 34.11 C ATOM 1882 CG1 VAL A 118 4.858 4.886 4.643 1.00 11.54 C ATOM 1883 CG2 VAL A 118 5.093 2.849 3.204 1.00 13.42 C ATOM 0 H VAL A 118 7.137 3.660 1.607 1.00 10.40 H new ATOM 0 HA VAL A 118 4.822 5.108 1.804 1.00 74.55 H new ATOM 0 HB VAL A 118 6.689 4.043 3.956 1.00 34.11 H new ATOM 0 HG11 VAL A 118 4.798 4.239 5.518 1.00 11.54 H new ATOM 0 HG12 VAL A 118 5.328 5.829 4.920 1.00 11.54 H new ATOM 0 HG13 VAL A 118 3.854 5.079 4.265 1.00 11.54 H new ATOM 0 HG21 VAL A 118 5.030 2.230 4.099 1.00 13.42 H new ATOM 0 HG22 VAL A 118 4.095 2.987 2.787 1.00 13.42 H new ATOM 0 HG23 VAL A 118 5.729 2.358 2.468 1.00 13.42 H new ATOM 1893 N GLN A 119 7.373 6.700 3.205 1.00 72.31 N ATOM 1894 CA GLN A 119 7.837 8.009 3.648 1.00 34.12 C ATOM 1895 C GLN A 119 7.554 9.072 2.593 1.00 41.34 C ATOM 1896 O GLN A 119 7.217 10.212 2.918 1.00 62.12 O ATOM 1897 CB GLN A 119 9.334 7.965 3.958 1.00 33.41 C ATOM 1898 CG GLN A 119 9.651 7.456 5.355 1.00 31.14 C ATOM 1899 CD GLN A 119 11.017 7.899 5.842 1.00 71.14 C ATOM 1900 OE1 GLN A 119 11.895 8.230 5.044 1.00 24.02 O ATOM 1901 NE2 GLN A 119 11.203 7.909 7.157 1.00 62.24 N ATOM 0 H GLN A 119 8.069 5.958 3.281 1.00 72.31 H new ATOM 0 HA GLN A 119 7.294 8.271 4.556 1.00 34.12 H new ATOM 0 HB2 GLN A 119 9.829 7.327 3.227 1.00 33.41 H new ATOM 0 HB3 GLN A 119 9.750 8.966 3.842 1.00 33.41 H new ATOM 0 HG2 GLN A 119 8.889 7.812 6.049 1.00 31.14 H new ATOM 0 HG3 GLN A 119 9.603 6.367 5.360 1.00 31.14 H new ATOM 0 HE21 GLN A 119 10.447 7.627 7.781 1.00 62.24 H new ATOM 0 HE22 GLN A 119 12.102 8.199 7.543 1.00 62.24 H new ATOM 1910 N THR A 120 7.695 8.694 1.326 1.00 54.13 N ATOM 1911 CA THR A 120 7.456 9.616 0.223 1.00 62.24 C ATOM 1912 C THR A 120 5.997 10.052 0.176 1.00 14.32 C ATOM 1913 O THR A 120 5.697 11.231 -0.018 1.00 24.30 O ATOM 1914 CB THR A 120 7.834 8.982 -1.130 1.00 73.40 C ATOM 1915 OG1 THR A 120 9.125 8.368 -1.040 1.00 35.20 O ATOM 1916 CG2 THR A 120 7.840 10.028 -2.235 1.00 74.40 C ATOM 0 H THR A 120 7.973 7.756 1.039 1.00 54.13 H new ATOM 0 HA THR A 120 8.087 10.488 0.398 1.00 62.24 H new ATOM 0 HB THR A 120 7.088 8.225 -1.372 1.00 73.40 H new ATOM 0 HG1 THR A 120 9.050 7.518 -0.558 1.00 35.20 H new ATOM 0 HG21 THR A 120 8.110 9.557 -3.180 1.00 74.40 H new ATOM 0 HG22 THR A 120 6.848 10.472 -2.321 1.00 74.40 H new ATOM 0 HG23 THR A 120 8.566 10.805 -1.997 1.00 74.40 H new ATOM 1924 N ALA A 121 5.091 9.097 0.356 1.00 21.45 N ATOM 1925 CA ALA A 121 3.663 9.384 0.338 1.00 14.01 C ATOM 1926 C ALA A 121 3.231 10.100 1.614 1.00 54.25 C ATOM 1927 O ALA A 121 2.176 10.733 1.653 1.00 31.12 O ATOM 1928 CB ALA A 121 2.868 8.100 0.156 1.00 22.45 C ATOM 0 H ALA A 121 5.322 8.116 0.516 1.00 21.45 H new ATOM 0 HA ALA A 121 3.461 10.045 -0.505 1.00 14.01 H new ATOM 0 HB1 ALA A 121 1.803 8.330 0.145 1.00 22.45 H new ATOM 0 HB2 ALA A 121 3.148 7.629 -0.787 1.00 22.45 H new ATOM 0 HB3 ALA A 121 3.083 7.419 0.979 1.00 22.45 H new ATOM 1934 N GLU A 122 4.051 9.995 2.654 1.00 62.52 N ATOM 1935 CA GLU A 122 3.752 10.631 3.931 1.00 53.10 C ATOM 1936 C GLU A 122 2.584 9.934 4.625 1.00 3.14 C ATOM 1937 O GLU A 122 1.803 10.567 5.336 1.00 10.41 O ATOM 1938 CB GLU A 122 3.425 12.111 3.723 1.00 31.04 C ATOM 1939 CG GLU A 122 4.274 13.046 4.568 1.00 31.43 C ATOM 1940 CD GLU A 122 5.089 14.012 3.730 1.00 12.33 C ATOM 1941 OE1 GLU A 122 4.488 14.922 3.122 1.00 5.24 O ATOM 1942 OE2 GLU A 122 6.327 13.858 3.684 1.00 62.25 O ATOM 0 H GLU A 122 4.928 9.475 2.637 1.00 62.52 H new ATOM 0 HA GLU A 122 4.634 10.546 4.566 1.00 53.10 H new ATOM 0 HB2 GLU A 122 3.562 12.360 2.671 1.00 31.04 H new ATOM 0 HB3 GLU A 122 2.373 12.278 3.956 1.00 31.04 H new ATOM 0 HG2 GLU A 122 3.627 13.610 5.240 1.00 31.43 H new ATOM 0 HG3 GLU A 122 4.946 12.456 5.192 1.00 31.43 H new ATOM 1949 N LEU A 123 2.474 8.627 4.414 1.00 10.22 N ATOM 1950 CA LEU A 123 1.403 7.843 5.020 1.00 54.54 C ATOM 1951 C LEU A 123 1.777 7.409 6.433 1.00 54.24 C ATOM 1952 O LEU A 123 2.342 6.334 6.634 1.00 24.34 O ATOM 1953 CB LEU A 123 1.095 6.615 4.160 1.00 21.15 C ATOM 1954 CG LEU A 123 0.591 6.896 2.745 1.00 63.32 C ATOM 1955 CD1 LEU A 123 0.823 5.691 1.847 1.00 61.34 C ATOM 1956 CD2 LEU A 123 -0.884 7.268 2.768 1.00 34.22 C ATOM 0 H LEU A 123 3.112 8.088 3.829 1.00 10.22 H new ATOM 0 HA LEU A 123 0.514 8.471 5.078 1.00 54.54 H new ATOM 0 HB2 LEU A 123 1.999 6.010 4.089 1.00 21.15 H new ATOM 0 HB3 LEU A 123 0.348 6.012 4.677 1.00 21.15 H new ATOM 0 HG LEU A 123 1.152 7.739 2.341 1.00 63.32 H new ATOM 0 HD11 LEU A 123 0.458 5.909 0.843 1.00 61.34 H new ATOM 0 HD12 LEU A 123 1.889 5.469 1.805 1.00 61.34 H new ATOM 0 HD13 LEU A 123 0.288 4.830 2.248 1.00 61.34 H new ATOM 0 HD21 LEU A 123 -1.226 7.465 1.752 1.00 34.22 H new ATOM 0 HD22 LEU A 123 -1.460 6.445 3.192 1.00 34.22 H new ATOM 0 HD23 LEU A 123 -1.025 8.161 3.377 1.00 34.22 H new ATOM 1968 N THR A 124 1.456 8.252 7.409 1.00 22.45 N ATOM 1969 CA THR A 124 1.758 7.954 8.804 1.00 13.42 C ATOM 1970 C THR A 124 1.182 6.604 9.216 1.00 12.44 C ATOM 1971 O THR A 124 1.703 5.943 10.113 1.00 22.31 O ATOM 1972 CB THR A 124 1.205 9.044 9.743 1.00 32.32 C ATOM 1973 OG1 THR A 124 1.509 8.719 11.104 1.00 43.00 O ATOM 1974 CG2 THR A 124 -0.300 9.188 9.576 1.00 52.15 C ATOM 0 H THR A 124 0.987 9.146 7.260 1.00 22.45 H new ATOM 0 HA THR A 124 2.844 7.924 8.893 1.00 13.42 H new ATOM 0 HB THR A 124 1.677 9.991 9.482 1.00 32.32 H new ATOM 0 HG1 THR A 124 1.156 9.417 11.694 1.00 43.00 H new ATOM 0 HG21 THR A 124 -0.668 9.963 10.249 1.00 52.15 H new ATOM 0 HG22 THR A 124 -0.527 9.463 8.546 1.00 52.15 H new ATOM 0 HG23 THR A 124 -0.785 8.241 9.814 1.00 52.15 H new ATOM 1982 N LYS A 125 0.102 6.200 8.555 1.00 51.25 N ATOM 1983 CA LYS A 125 -0.545 4.927 8.850 1.00 4.11 C ATOM 1984 C LYS A 125 -0.162 3.870 7.819 1.00 53.13 C ATOM 1985 O LYS A 125 -0.730 3.820 6.727 1.00 71.01 O ATOM 1986 CB LYS A 125 -2.065 5.099 8.879 1.00 4.13 C ATOM 1987 CG LYS A 125 -2.537 6.166 9.852 1.00 10.33 C ATOM 1988 CD LYS A 125 -3.654 5.651 10.745 1.00 34.35 C ATOM 1989 CE LYS A 125 -4.794 6.654 10.846 1.00 23.44 C ATOM 1990 NZ LYS A 125 -5.674 6.377 12.015 1.00 23.54 N ATOM 0 H LYS A 125 -0.344 6.737 7.811 1.00 51.25 H new ATOM 0 HA LYS A 125 -0.204 4.593 9.830 1.00 4.11 H new ATOM 0 HB2 LYS A 125 -2.413 5.353 7.878 1.00 4.13 H new ATOM 0 HB3 LYS A 125 -2.525 4.147 9.145 1.00 4.13 H new ATOM 0 HG2 LYS A 125 -1.700 6.494 10.468 1.00 10.33 H new ATOM 0 HG3 LYS A 125 -2.886 7.037 9.297 1.00 10.33 H new ATOM 0 HD2 LYS A 125 -4.032 4.708 10.350 1.00 34.35 H new ATOM 0 HD3 LYS A 125 -3.260 5.445 11.740 1.00 34.35 H new ATOM 0 HE2 LYS A 125 -4.385 7.661 10.929 1.00 23.44 H new ATOM 0 HE3 LYS A 125 -5.386 6.625 9.931 1.00 23.44 H new ATOM 0 HZ1 LYS A 125 -6.438 7.082 12.049 1.00 23.54 H new ATOM 0 HZ2 LYS A 125 -6.084 5.426 11.923 1.00 23.54 H new ATOM 0 HZ3 LYS A 125 -5.115 6.430 12.890 1.00 23.54 H new ATOM 2004 N VAL A 126 0.801 3.027 8.172 1.00 32.30 N ATOM 2005 CA VAL A 126 1.257 1.969 7.278 1.00 4.03 C ATOM 2006 C VAL A 126 1.159 0.603 7.948 1.00 53.20 C ATOM 2007 O VAL A 126 1.854 0.328 8.927 1.00 54.11 O ATOM 2008 CB VAL A 126 2.712 2.203 6.828 1.00 52.45 C ATOM 2009 CG1 VAL A 126 3.527 2.820 7.953 1.00 10.34 C ATOM 2010 CG2 VAL A 126 3.339 0.901 6.355 1.00 72.40 C ATOM 0 H VAL A 126 1.282 3.055 9.071 1.00 32.30 H new ATOM 0 HA VAL A 126 0.605 1.990 6.404 1.00 4.03 H new ATOM 0 HB VAL A 126 2.707 2.902 5.991 1.00 52.45 H new ATOM 0 HG11 VAL A 126 4.552 2.978 7.616 1.00 10.34 H new ATOM 0 HG12 VAL A 126 3.088 3.776 8.239 1.00 10.34 H new ATOM 0 HG13 VAL A 126 3.527 2.150 8.812 1.00 10.34 H new ATOM 0 HG21 VAL A 126 4.366 1.085 6.041 1.00 72.40 H new ATOM 0 HG22 VAL A 126 3.333 0.177 7.170 1.00 72.40 H new ATOM 0 HG23 VAL A 126 2.768 0.506 5.515 1.00 72.40 H new ATOM 2020 N PHE A 127 0.291 -0.250 7.415 1.00 53.24 N ATOM 2021 CA PHE A 127 0.100 -1.589 7.961 1.00 51.25 C ATOM 2022 C PHE A 127 0.769 -2.637 7.075 1.00 35.13 C ATOM 2023 O PHE A 127 1.043 -2.389 5.902 1.00 20.25 O ATOM 2024 CB PHE A 127 -1.392 -1.898 8.100 1.00 41.14 C ATOM 2025 CG PHE A 127 -2.177 -0.788 8.739 1.00 72.54 C ATOM 2026 CD1 PHE A 127 -1.747 -0.211 9.922 1.00 13.13 C ATOM 2027 CD2 PHE A 127 -3.345 -0.324 8.155 1.00 3.52 C ATOM 2028 CE1 PHE A 127 -2.469 0.810 10.512 1.00 22.14 C ATOM 2029 CE2 PHE A 127 -4.069 0.698 8.741 1.00 72.24 C ATOM 2030 CZ PHE A 127 -3.631 1.265 9.920 1.00 41.32 C ATOM 0 H PHE A 127 -0.292 -0.038 6.605 1.00 53.24 H new ATOM 0 HA PHE A 127 0.563 -1.623 8.947 1.00 51.25 H new ATOM 0 HB2 PHE A 127 -1.806 -2.103 7.113 1.00 41.14 H new ATOM 0 HB3 PHE A 127 -1.513 -2.805 8.692 1.00 41.14 H new ATOM 0 HD1 PHE A 127 -0.838 -0.562 10.389 1.00 13.13 H new ATOM 0 HD2 PHE A 127 -3.693 -0.765 7.233 1.00 3.52 H new ATOM 0 HE1 PHE A 127 -2.124 1.252 11.435 1.00 22.14 H new ATOM 0 HE2 PHE A 127 -4.977 1.052 8.276 1.00 72.24 H new ATOM 0 HZ PHE A 127 -4.196 2.063 10.379 1.00 41.32 H new ATOM 2040 N GLU A 128 1.027 -3.809 7.648 1.00 55.41 N ATOM 2041 CA GLU A 128 1.663 -4.894 6.913 1.00 64.14 C ATOM 2042 C GLU A 128 0.803 -6.154 6.946 1.00 54.31 C ATOM 2043 O GLU A 128 0.575 -6.735 8.008 1.00 12.25 O ATOM 2044 CB GLU A 128 3.046 -5.193 7.495 1.00 43.00 C ATOM 2045 CG GLU A 128 3.852 -6.187 6.674 1.00 12.33 C ATOM 2046 CD GLU A 128 5.096 -6.667 7.397 1.00 72.13 C ATOM 2047 OE1 GLU A 128 4.955 -7.419 8.384 1.00 63.24 O ATOM 2048 OE2 GLU A 128 6.210 -6.290 6.974 1.00 35.40 O ATOM 0 H GLU A 128 0.805 -4.030 8.619 1.00 55.41 H new ATOM 0 HA GLU A 128 1.773 -4.578 5.876 1.00 64.14 H new ATOM 0 HB2 GLU A 128 3.606 -4.261 7.574 1.00 43.00 H new ATOM 0 HB3 GLU A 128 2.929 -5.581 8.507 1.00 43.00 H new ATOM 0 HG2 GLU A 128 3.225 -7.044 6.430 1.00 12.33 H new ATOM 0 HG3 GLU A 128 4.140 -5.724 5.730 1.00 12.33 H new ATOM 2055 N ILE A 129 0.326 -6.569 5.778 1.00 53.23 N ATOM 2056 CA ILE A 129 -0.510 -7.759 5.674 1.00 71.24 C ATOM 2057 C ILE A 129 0.310 -8.969 5.239 1.00 21.23 C ATOM 2058 O ILE A 129 1.069 -8.904 4.274 1.00 43.11 O ATOM 2059 CB ILE A 129 -1.665 -7.550 4.675 1.00 64.03 C ATOM 2060 CG1 ILE A 129 -1.141 -6.925 3.381 1.00 75.31 C ATOM 2061 CG2 ILE A 129 -2.747 -6.678 5.292 1.00 41.50 C ATOM 2062 CD1 ILE A 129 -2.115 -7.020 2.227 1.00 24.32 C ATOM 0 H ILE A 129 0.504 -6.099 4.890 1.00 53.23 H new ATOM 0 HA ILE A 129 -0.926 -7.941 6.665 1.00 71.24 H new ATOM 0 HB ILE A 129 -2.101 -8.520 4.437 1.00 64.03 H new ATOM 0 HG12 ILE A 129 -0.906 -5.876 3.563 1.00 75.31 H new ATOM 0 HG13 ILE A 129 -0.209 -7.416 3.101 1.00 75.31 H new ATOM 0 HG21 ILE A 129 -3.556 -6.539 4.575 1.00 41.50 H new ATOM 0 HG22 ILE A 129 -3.136 -7.161 6.189 1.00 41.50 H new ATOM 0 HG23 ILE A 129 -2.326 -5.708 5.556 1.00 41.50 H new ATOM 0 HD11 ILE A 129 -1.678 -6.557 1.343 1.00 24.32 H new ATOM 0 HD12 ILE A 129 -2.331 -8.068 2.019 1.00 24.32 H new ATOM 0 HD13 ILE A 129 -3.039 -6.504 2.487 1.00 24.32 H new ATOM 2074 N ARG A 130 0.148 -10.075 5.960 1.00 23.02 N ATOM 2075 CA ARG A 130 0.873 -11.301 5.650 1.00 72.03 C ATOM 2076 C ARG A 130 0.321 -11.954 4.385 1.00 45.21 C ATOM 2077 O ARG A 130 1.057 -12.590 3.629 1.00 13.22 O ATOM 2078 CB ARG A 130 0.785 -12.281 6.821 1.00 44.01 C ATOM 2079 CG ARG A 130 1.809 -13.402 6.756 1.00 71.03 C ATOM 2080 CD ARG A 130 3.192 -12.919 7.164 1.00 40.22 C ATOM 2081 NE ARG A 130 3.327 -12.809 8.615 1.00 40.55 N ATOM 2082 CZ ARG A 130 4.360 -12.228 9.214 1.00 52.32 C ATOM 2083 NH1 ARG A 130 5.344 -11.708 8.493 1.00 54.35 N ATOM 2084 NH2 ARG A 130 4.411 -12.166 10.538 1.00 12.15 N ATOM 0 H ARG A 130 -0.478 -10.146 6.762 1.00 23.02 H new ATOM 0 HA ARG A 130 1.918 -11.042 5.479 1.00 72.03 H new ATOM 0 HB2 ARG A 130 0.918 -11.732 7.753 1.00 44.01 H new ATOM 0 HB3 ARG A 130 -0.215 -12.715 6.846 1.00 44.01 H new ATOM 0 HG2 ARG A 130 1.500 -14.217 7.410 1.00 71.03 H new ATOM 0 HG3 ARG A 130 1.847 -13.803 5.743 1.00 71.03 H new ATOM 0 HD2 ARG A 130 3.944 -13.608 6.781 1.00 40.22 H new ATOM 0 HD3 ARG A 130 3.387 -11.949 6.707 1.00 40.22 H new ATOM 0 HE ARG A 130 2.588 -13.200 9.199 1.00 40.55 H new ATOM 0 HH11 ARG A 130 5.309 -11.753 7.475 1.00 54.35 H new ATOM 0 HH12 ARG A 130 6.136 -11.263 8.957 1.00 54.35 H new ATOM 0 HH21 ARG A 130 3.656 -12.565 11.097 1.00 12.15 H new ATOM 0 HH22 ARG A 130 5.205 -11.720 10.997 1.00 12.15 H new ATOM 2098 N THR A 131 -0.979 -11.791 4.161 1.00 60.12 N ATOM 2099 CA THR A 131 -1.630 -12.365 2.990 1.00 32.53 C ATOM 2100 C THR A 131 -2.865 -11.561 2.599 1.00 73.33 C ATOM 2101 O THR A 131 -3.556 -11.007 3.455 1.00 73.14 O ATOM 2102 CB THR A 131 -2.041 -13.829 3.237 1.00 53.12 C ATOM 2103 OG1 THR A 131 -2.969 -14.253 2.232 1.00 62.35 O ATOM 2104 CG2 THR A 131 -2.669 -13.990 4.613 1.00 74.11 C ATOM 0 H THR A 131 -1.602 -11.266 4.775 1.00 60.12 H new ATOM 0 HA THR A 131 -0.905 -12.331 2.177 1.00 32.53 H new ATOM 0 HB THR A 131 -1.145 -14.448 3.189 1.00 53.12 H new ATOM 0 HG1 THR A 131 -3.224 -15.185 2.395 1.00 62.35 H new ATOM 0 HG21 THR A 131 -2.951 -15.032 4.765 1.00 74.11 H new ATOM 0 HG22 THR A 131 -1.951 -13.694 5.378 1.00 74.11 H new ATOM 0 HG23 THR A 131 -3.556 -13.360 4.684 1.00 74.11 H new ATOM 2112 N THR A 132 -3.140 -11.503 1.299 1.00 0.14 N ATOM 2113 CA THR A 132 -4.291 -10.766 0.794 1.00 54.10 C ATOM 2114 C THR A 132 -5.541 -11.074 1.610 1.00 14.32 C ATOM 2115 O THR A 132 -6.305 -10.173 1.957 1.00 40.11 O ATOM 2116 CB THR A 132 -4.564 -11.096 -0.686 1.00 63.24 C ATOM 2117 OG1 THR A 132 -4.623 -12.515 -0.869 1.00 53.00 O ATOM 2118 CG2 THR A 132 -3.482 -10.509 -1.580 1.00 23.12 C ATOM 0 H THR A 132 -2.581 -11.958 0.577 1.00 0.14 H new ATOM 0 HA THR A 132 -4.053 -9.706 0.884 1.00 54.10 H new ATOM 0 HB THR A 132 -5.521 -10.654 -0.963 1.00 63.24 H new ATOM 0 HG1 THR A 132 -4.799 -12.716 -1.812 1.00 53.00 H new ATOM 0 HG21 THR A 132 -3.696 -10.755 -2.620 1.00 23.12 H new ATOM 0 HG22 THR A 132 -3.459 -9.426 -1.461 1.00 23.12 H new ATOM 0 HG23 THR A 132 -2.514 -10.925 -1.301 1.00 23.12 H new ATOM 2126 N ASP A 133 -5.745 -12.350 1.914 1.00 24.52 N ATOM 2127 CA ASP A 133 -6.902 -12.777 2.691 1.00 25.24 C ATOM 2128 C ASP A 133 -7.171 -11.810 3.841 1.00 62.52 C ATOM 2129 O ASP A 133 -8.320 -11.593 4.225 1.00 12.04 O ATOM 2130 CB ASP A 133 -6.684 -14.189 3.238 1.00 71.33 C ATOM 2131 CG ASP A 133 -7.575 -15.214 2.562 1.00 24.35 C ATOM 2132 OD1 ASP A 133 -7.655 -15.202 1.316 1.00 31.22 O ATOM 2133 OD2 ASP A 133 -8.191 -16.028 3.281 1.00 71.23 O ATOM 0 H ASP A 133 -5.123 -13.108 1.634 1.00 24.52 H new ATOM 0 HA ASP A 133 -7.770 -12.781 2.031 1.00 25.24 H new ATOM 0 HB2 ASP A 133 -5.640 -14.472 3.101 1.00 71.33 H new ATOM 0 HB3 ASP A 133 -6.877 -14.194 4.311 1.00 71.33 H new ATOM 2138 N ASP A 134 -6.104 -11.234 4.383 1.00 11.32 N ATOM 2139 CA ASP A 134 -6.226 -10.290 5.489 1.00 5.11 C ATOM 2140 C ASP A 134 -6.995 -9.045 5.059 1.00 34.01 C ATOM 2141 O ASP A 134 -7.922 -8.608 5.743 1.00 20.50 O ATOM 2142 CB ASP A 134 -4.841 -9.895 6.004 1.00 44.34 C ATOM 2143 CG ASP A 134 -4.878 -9.379 7.428 1.00 45.11 C ATOM 2144 OD1 ASP A 134 -5.653 -9.928 8.239 1.00 52.04 O ATOM 2145 OD2 ASP A 134 -4.132 -8.425 7.733 1.00 23.44 O ATOM 0 H ASP A 134 -5.146 -11.403 4.076 1.00 11.32 H new ATOM 0 HA ASP A 134 -6.779 -10.778 6.291 1.00 5.11 H new ATOM 0 HB2 ASP A 134 -4.177 -10.758 5.951 1.00 44.34 H new ATOM 0 HB3 ASP A 134 -4.420 -9.128 5.354 1.00 44.34 H new ATOM 2150 N LEU A 135 -6.608 -8.479 3.922 1.00 5.51 N ATOM 2151 CA LEU A 135 -7.260 -7.283 3.400 1.00 54.11 C ATOM 2152 C LEU A 135 -8.772 -7.477 3.326 1.00 11.25 C ATOM 2153 O LEU A 135 -9.304 -7.914 2.305 1.00 52.21 O ATOM 2154 CB LEU A 135 -6.711 -6.940 2.015 1.00 61.32 C ATOM 2155 CG LEU A 135 -7.529 -5.941 1.196 1.00 23.21 C ATOM 2156 CD1 LEU A 135 -7.969 -4.773 2.066 1.00 44.01 C ATOM 2157 CD2 LEU A 135 -6.725 -5.446 0.002 1.00 55.43 C ATOM 0 H LEU A 135 -5.845 -8.829 3.343 1.00 5.51 H new ATOM 0 HA LEU A 135 -7.049 -6.458 4.081 1.00 54.11 H new ATOM 0 HB2 LEU A 135 -5.703 -6.542 2.134 1.00 61.32 H new ATOM 0 HB3 LEU A 135 -6.624 -7.863 1.442 1.00 61.32 H new ATOM 0 HG LEU A 135 -8.420 -6.447 0.824 1.00 23.21 H new ATOM 0 HD11 LEU A 135 -8.550 -4.072 1.467 1.00 44.01 H new ATOM 0 HD12 LEU A 135 -8.582 -5.142 2.888 1.00 44.01 H new ATOM 0 HD13 LEU A 135 -7.091 -4.267 2.467 1.00 44.01 H new ATOM 0 HD21 LEU A 135 -7.322 -4.736 -0.570 1.00 55.43 H new ATOM 0 HD22 LEU A 135 -5.817 -4.956 0.353 1.00 55.43 H new ATOM 0 HD23 LEU A 135 -6.459 -6.291 -0.633 1.00 55.43 H new ATOM 2169 N THR A 136 -9.460 -7.148 4.416 1.00 42.45 N ATOM 2170 CA THR A 136 -10.909 -7.284 4.475 1.00 42.12 C ATOM 2171 C THR A 136 -11.564 -5.995 4.958 1.00 42.14 C ATOM 2172 O THR A 136 -10.992 -5.263 5.765 1.00 45.20 O ATOM 2173 CB THR A 136 -11.327 -8.438 5.404 1.00 32.51 C ATOM 2174 OG1 THR A 136 -10.427 -8.524 6.514 1.00 14.43 O ATOM 2175 CG2 THR A 136 -11.340 -9.761 4.652 1.00 23.53 C ATOM 0 H THR A 136 -9.036 -6.785 5.270 1.00 42.45 H new ATOM 0 HA THR A 136 -11.247 -7.502 3.462 1.00 42.12 H new ATOM 0 HB THR A 136 -12.334 -8.235 5.768 1.00 32.51 H new ATOM 0 HG1 THR A 136 -9.562 -8.869 6.208 1.00 14.43 H new ATOM 0 HG21 THR A 136 -11.638 -10.561 5.329 1.00 23.53 H new ATOM 0 HG22 THR A 136 -12.048 -9.703 3.825 1.00 23.53 H new ATOM 0 HG23 THR A 136 -10.343 -9.968 4.262 1.00 23.53 H new ATOM 2183 N GLU A 137 -12.766 -5.724 4.460 1.00 72.52 N ATOM 2184 CA GLU A 137 -13.498 -4.522 4.841 1.00 3.03 C ATOM 2185 C GLU A 137 -13.379 -4.267 6.341 1.00 20.33 C ATOM 2186 O GLU A 137 -13.158 -3.136 6.775 1.00 2.13 O ATOM 2187 CB GLU A 137 -14.972 -4.648 4.450 1.00 24.30 C ATOM 2188 CG GLU A 137 -15.770 -3.374 4.664 1.00 31.14 C ATOM 2189 CD GLU A 137 -17.257 -3.633 4.803 1.00 61.52 C ATOM 2190 OE1 GLU A 137 -17.630 -4.583 5.523 1.00 74.22 O ATOM 2191 OE2 GLU A 137 -18.048 -2.886 4.191 1.00 74.14 O ATOM 0 H GLU A 137 -13.254 -6.321 3.792 1.00 72.52 H new ATOM 0 HA GLU A 137 -13.060 -3.677 4.309 1.00 3.03 H new ATOM 0 HB2 GLU A 137 -15.037 -4.935 3.401 1.00 24.30 H new ATOM 0 HB3 GLU A 137 -15.425 -5.452 5.030 1.00 24.30 H new ATOM 0 HG2 GLU A 137 -15.408 -2.869 5.560 1.00 31.14 H new ATOM 0 HG3 GLU A 137 -15.600 -2.698 3.826 1.00 31.14 H new ATOM 2198 N THR A 138 -13.528 -5.327 7.130 1.00 23.22 N ATOM 2199 CA THR A 138 -13.439 -5.219 8.581 1.00 72.13 C ATOM 2200 C THR A 138 -12.006 -4.954 9.026 1.00 65.23 C ATOM 2201 O THR A 138 -11.706 -3.902 9.592 1.00 71.15 O ATOM 2202 CB THR A 138 -13.951 -6.497 9.271 1.00 22.43 C ATOM 2203 OG1 THR A 138 -15.234 -6.858 8.747 1.00 50.51 O ATOM 2204 CG2 THR A 138 -14.052 -6.296 10.776 1.00 63.42 C ATOM 0 H THR A 138 -13.711 -6.270 6.788 1.00 23.22 H new ATOM 0 HA THR A 138 -14.068 -4.379 8.875 1.00 72.13 H new ATOM 0 HB THR A 138 -13.240 -7.299 9.073 1.00 22.43 H new ATOM 0 HG1 THR A 138 -15.551 -7.673 9.190 1.00 50.51 H new ATOM 0 HG21 THR A 138 -14.416 -7.212 11.242 1.00 63.42 H new ATOM 0 HG22 THR A 138 -13.069 -6.051 11.177 1.00 63.42 H new ATOM 0 HG23 THR A 138 -14.744 -5.481 10.989 1.00 63.42 H new ATOM 2212 N TRP A 139 -11.124 -5.913 8.767 1.00 13.40 N ATOM 2213 CA TRP A 139 -9.721 -5.781 9.140 1.00 5.02 C ATOM 2214 C TRP A 139 -9.215 -4.368 8.873 1.00 73.14 C ATOM 2215 O TRP A 139 -8.340 -3.866 9.579 1.00 42.11 O ATOM 2216 CB TRP A 139 -8.869 -6.794 8.372 1.00 34.13 C ATOM 2217 CG TRP A 139 -7.403 -6.489 8.410 1.00 11.54 C ATOM 2218 CD1 TRP A 139 -6.496 -6.934 9.328 1.00 23.30 C ATOM 2219 CD2 TRP A 139 -6.675 -5.667 7.491 1.00 53.02 C ATOM 2220 NE1 TRP A 139 -5.247 -6.440 9.034 1.00 55.22 N ATOM 2221 CE2 TRP A 139 -5.331 -5.661 7.911 1.00 10.54 C ATOM 2222 CE3 TRP A 139 -7.028 -4.938 6.352 1.00 42.22 C ATOM 2223 CZ2 TRP A 139 -4.342 -4.952 7.233 1.00 55.14 C ATOM 2224 CZ3 TRP A 139 -6.046 -4.235 5.679 1.00 25.02 C ATOM 2225 CH2 TRP A 139 -4.716 -4.248 6.121 1.00 41.52 C ATOM 0 H TRP A 139 -11.356 -6.790 8.300 1.00 13.40 H new ATOM 0 HA TRP A 139 -9.637 -5.981 10.208 1.00 5.02 H new ATOM 0 HB2 TRP A 139 -9.037 -7.788 8.788 1.00 34.13 H new ATOM 0 HB3 TRP A 139 -9.200 -6.823 7.334 1.00 34.13 H new ATOM 0 HD1 TRP A 139 -6.726 -7.579 10.163 1.00 23.30 H new ATOM 0 HE1 TRP A 139 -4.396 -6.624 9.566 1.00 55.22 H new ATOM 0 HE3 TRP A 139 -8.050 -4.924 6.004 1.00 42.22 H new ATOM 0 HZ2 TRP A 139 -3.317 -4.958 7.573 1.00 55.14 H new ATOM 0 HZ3 TRP A 139 -6.308 -3.667 4.799 1.00 25.02 H new ATOM 0 HH2 TRP A 139 -3.971 -3.691 5.572 1.00 41.52 H new ATOM 2236 N LEU A 140 -9.772 -3.730 7.849 1.00 42.54 N ATOM 2237 CA LEU A 140 -9.377 -2.372 7.487 1.00 33.31 C ATOM 2238 C LEU A 140 -10.047 -1.350 8.400 1.00 61.03 C ATOM 2239 O LEU A 140 -9.381 -0.655 9.167 1.00 24.21 O ATOM 2240 CB LEU A 140 -9.740 -2.086 6.028 1.00 23.35 C ATOM 2241 CG LEU A 140 -9.739 -0.615 5.614 1.00 10.11 C ATOM 2242 CD1 LEU A 140 -8.422 0.046 5.991 1.00 30.44 C ATOM 2243 CD2 LEU A 140 -9.995 -0.482 4.120 1.00 63.05 C ATOM 0 H LEU A 140 -10.498 -4.131 7.255 1.00 42.54 H new ATOM 0 HA LEU A 140 -8.297 -2.288 7.609 1.00 33.31 H new ATOM 0 HB2 LEU A 140 -9.040 -2.624 5.388 1.00 23.35 H new ATOM 0 HB3 LEU A 140 -10.731 -2.497 5.833 1.00 23.35 H new ATOM 0 HG LEU A 140 -10.542 -0.107 6.148 1.00 10.11 H new ATOM 0 HD11 LEU A 140 -8.441 1.093 5.688 1.00 30.44 H new ATOM 0 HD12 LEU A 140 -8.279 -0.017 7.070 1.00 30.44 H new ATOM 0 HD13 LEU A 140 -7.601 -0.463 5.486 1.00 30.44 H new ATOM 0 HD21 LEU A 140 -9.991 0.572 3.843 1.00 63.05 H new ATOM 0 HD22 LEU A 140 -9.214 -1.005 3.569 1.00 63.05 H new ATOM 0 HD23 LEU A 140 -10.964 -0.917 3.877 1.00 63.05 H new ATOM 2255 N LYS A 141 -11.370 -1.264 8.312 1.00 33.32 N ATOM 2256 CA LYS A 141 -12.133 -0.330 9.132 1.00 43.23 C ATOM 2257 C LYS A 141 -11.730 -0.439 10.599 1.00 43.14 C ATOM 2258 O LYS A 141 -11.939 0.489 11.379 1.00 13.21 O ATOM 2259 CB LYS A 141 -13.632 -0.594 8.983 1.00 72.34 C ATOM 2260 CG LYS A 141 -14.300 0.272 7.928 1.00 32.50 C ATOM 2261 CD LYS A 141 -15.415 -0.477 7.217 1.00 0.02 C ATOM 2262 CE LYS A 141 -16.780 -0.107 7.776 1.00 31.33 C ATOM 2263 NZ LYS A 141 -17.323 -1.172 8.664 1.00 34.30 N ATOM 0 H LYS A 141 -11.937 -1.830 7.681 1.00 33.32 H new ATOM 0 HA LYS A 141 -11.913 0.680 8.787 1.00 43.23 H new ATOM 0 HB2 LYS A 141 -13.784 -1.643 8.730 1.00 72.34 H new ATOM 0 HB3 LYS A 141 -14.120 -0.424 9.943 1.00 72.34 H new ATOM 0 HG2 LYS A 141 -14.704 1.170 8.395 1.00 32.50 H new ATOM 0 HG3 LYS A 141 -13.557 0.598 7.200 1.00 32.50 H new ATOM 0 HD2 LYS A 141 -15.384 -0.252 6.151 1.00 0.02 H new ATOM 0 HD3 LYS A 141 -15.257 -1.551 7.320 1.00 0.02 H new ATOM 0 HE2 LYS A 141 -16.703 0.826 8.334 1.00 31.33 H new ATOM 0 HE3 LYS A 141 -17.474 0.069 6.954 1.00 31.33 H new ATOM 0 HZ1 LYS A 141 -18.254 -0.882 9.025 1.00 34.30 H new ATOM 0 HZ2 LYS A 141 -17.420 -2.057 8.126 1.00 34.30 H new ATOM 0 HZ3 LYS A 141 -16.674 -1.322 9.463 1.00 34.30 H new ATOM 2277 N GLU A 142 -11.151 -1.577 10.966 1.00 20.43 N ATOM 2278 CA GLU A 142 -10.718 -1.806 12.340 1.00 53.14 C ATOM 2279 C GLU A 142 -9.577 -0.865 12.715 1.00 74.43 C ATOM 2280 O GLU A 142 -9.701 -0.056 13.634 1.00 13.24 O ATOM 2281 CB GLU A 142 -10.277 -3.260 12.524 1.00 52.02 C ATOM 2282 CG GLU A 142 -11.425 -4.211 12.819 1.00 31.41 C ATOM 2283 CD GLU A 142 -10.968 -5.477 13.519 1.00 44.44 C ATOM 2284 OE1 GLU A 142 -10.060 -5.389 14.372 1.00 71.20 O ATOM 2285 OE2 GLU A 142 -11.518 -6.555 13.212 1.00 54.11 O ATOM 0 H GLU A 142 -10.971 -2.355 10.332 1.00 20.43 H new ATOM 0 HA GLU A 142 -11.563 -1.604 12.998 1.00 53.14 H new ATOM 0 HB2 GLU A 142 -9.764 -3.592 11.622 1.00 52.02 H new ATOM 0 HB3 GLU A 142 -9.555 -3.312 13.339 1.00 52.02 H new ATOM 0 HG2 GLU A 142 -12.163 -3.703 13.440 1.00 31.41 H new ATOM 0 HG3 GLU A 142 -11.922 -4.475 11.886 1.00 31.41 H new ATOM 2292 N LYS A 143 -8.465 -0.978 11.996 1.00 20.34 N ATOM 2293 CA LYS A 143 -7.301 -0.138 12.252 1.00 64.11 C ATOM 2294 C LYS A 143 -7.683 1.339 12.245 1.00 35.22 C ATOM 2295 O LYS A 143 -7.249 2.106 13.106 1.00 34.23 O ATOM 2296 CB LYS A 143 -6.218 -0.400 11.203 1.00 62.24 C ATOM 2297 CG LYS A 143 -5.876 -1.871 11.036 1.00 44.32 C ATOM 2298 CD LYS A 143 -4.489 -2.185 11.570 1.00 3.42 C ATOM 2299 CE LYS A 143 -3.850 -3.342 10.818 1.00 3.51 C ATOM 2300 NZ LYS A 143 -2.410 -3.501 11.166 1.00 61.42 N ATOM 0 H LYS A 143 -8.346 -1.643 11.232 1.00 20.34 H new ATOM 0 HA LYS A 143 -6.912 -0.390 13.239 1.00 64.11 H new ATOM 0 HB2 LYS A 143 -6.549 -0.001 10.244 1.00 62.24 H new ATOM 0 HB3 LYS A 143 -5.316 0.145 11.481 1.00 62.24 H new ATOM 0 HG2 LYS A 143 -6.614 -2.479 11.559 1.00 44.32 H new ATOM 0 HG3 LYS A 143 -5.930 -2.141 9.981 1.00 44.32 H new ATOM 0 HD2 LYS A 143 -3.857 -1.301 11.485 1.00 3.42 H new ATOM 0 HD3 LYS A 143 -4.553 -2.430 12.630 1.00 3.42 H new ATOM 0 HE2 LYS A 143 -4.383 -4.264 11.049 1.00 3.51 H new ATOM 0 HE3 LYS A 143 -3.948 -3.177 9.745 1.00 3.51 H new ATOM 0 HZ1 LYS A 143 -2.014 -4.310 10.646 1.00 61.42 H new ATOM 0 HZ2 LYS A 143 -1.893 -2.637 10.907 1.00 61.42 H new ATOM 0 HZ3 LYS A 143 -2.316 -3.667 12.188 1.00 61.42 H new ATOM 2314 N LEU A 144 -8.498 1.730 11.272 1.00 64.14 N ATOM 2315 CA LEU A 144 -8.938 3.115 11.155 1.00 71.14 C ATOM 2316 C LEU A 144 -9.797 3.515 12.350 1.00 54.42 C ATOM 2317 O LEU A 144 -9.606 4.581 12.935 1.00 41.01 O ATOM 2318 CB LEU A 144 -9.726 3.311 9.858 1.00 50.42 C ATOM 2319 CG LEU A 144 -9.153 2.631 8.614 1.00 15.10 C ATOM 2320 CD1 LEU A 144 -10.078 2.829 7.423 1.00 20.23 C ATOM 2321 CD2 LEU A 144 -7.763 3.166 8.307 1.00 24.22 C ATOM 0 H LEU A 144 -8.867 1.108 10.553 1.00 64.14 H new ATOM 0 HA LEU A 144 -8.054 3.752 11.137 1.00 71.14 H new ATOM 0 HB2 LEU A 144 -10.740 2.943 10.014 1.00 50.42 H new ATOM 0 HB3 LEU A 144 -9.802 4.380 9.661 1.00 50.42 H new ATOM 0 HG LEU A 144 -9.074 1.562 8.812 1.00 15.10 H new ATOM 0 HD11 LEU A 144 -9.654 2.338 6.547 1.00 20.23 H new ATOM 0 HD12 LEU A 144 -11.054 2.396 7.644 1.00 20.23 H new ATOM 0 HD13 LEU A 144 -10.191 3.895 7.223 1.00 20.23 H new ATOM 0 HD21 LEU A 144 -7.371 2.671 7.419 1.00 24.22 H new ATOM 0 HD22 LEU A 144 -7.818 4.240 8.130 1.00 24.22 H new ATOM 0 HD23 LEU A 144 -7.103 2.971 9.152 1.00 24.22 H new ATOM 2333 N ALA A 145 -10.742 2.653 12.708 1.00 71.21 N ATOM 2334 CA ALA A 145 -11.628 2.915 13.836 1.00 23.01 C ATOM 2335 C ALA A 145 -10.893 3.652 14.951 1.00 32.32 C ATOM 2336 O ALA A 145 -11.081 4.853 15.142 1.00 22.53 O ATOM 2337 CB ALA A 145 -12.215 1.612 14.360 1.00 62.32 C ATOM 0 H ALA A 145 -10.914 1.767 12.233 1.00 71.21 H new ATOM 0 HA ALA A 145 -12.440 3.553 13.488 1.00 23.01 H new ATOM 0 HB1 ALA A 145 -12.874 1.823 15.202 1.00 62.32 H new ATOM 0 HB2 ALA A 145 -12.783 1.124 13.568 1.00 62.32 H new ATOM 0 HB3 ALA A 145 -11.409 0.955 14.686 1.00 62.32 H new ATOM 2343 N SER A 146 -10.056 2.924 15.684 1.00 30.34 N ATOM 2344 CA SER A 146 -9.296 3.507 16.783 1.00 14.31 C ATOM 2345 C SER A 146 -8.245 2.529 17.297 1.00 30.12 C ATOM 2346 O SER A 146 -7.894 2.540 18.477 1.00 53.42 O ATOM 2347 CB SER A 146 -10.236 3.910 17.923 1.00 43.43 C ATOM 2348 OG SER A 146 -9.834 5.139 18.504 1.00 74.40 O ATOM 0 H SER A 146 -9.887 1.929 15.536 1.00 30.34 H new ATOM 0 HA SER A 146 -8.787 4.395 16.409 1.00 14.31 H new ATOM 0 HB2 SER A 146 -11.254 3.999 17.545 1.00 43.43 H new ATOM 0 HB3 SER A 146 -10.245 3.130 18.684 1.00 43.43 H new ATOM 0 HG SER A 146 -10.450 5.376 19.228 1.00 74.40 H new ATOM 2354 N GLY A 147 -7.746 1.681 16.402 1.00 11.31 N ATOM 2355 CA GLY A 147 -6.740 0.708 16.783 1.00 63.05 C ATOM 2356 C GLY A 147 -7.284 -0.707 16.806 1.00 20.44 C ATOM 2357 O GLY A 147 -8.463 -0.939 17.078 1.00 2.42 O ATOM 0 H GLY A 147 -8.021 1.651 15.420 1.00 11.31 H new ATOM 0 HA2 GLY A 147 -5.904 0.762 16.086 1.00 63.05 H new ATOM 0 HA3 GLY A 147 -6.349 0.960 17.769 1.00 63.05 H new ATOM 2361 N PRO A 148 -6.412 -1.685 16.516 1.00 54.03 N ATOM 2362 CA PRO A 148 -6.788 -3.101 16.497 1.00 34.02 C ATOM 2363 C PRO A 148 -7.080 -3.642 17.894 1.00 51.05 C ATOM 2364 O PRO A 148 -7.292 -4.841 18.074 1.00 73.33 O ATOM 2365 CB PRO A 148 -5.557 -3.788 15.904 1.00 23.40 C ATOM 2366 CG PRO A 148 -4.424 -2.874 16.222 1.00 51.45 C ATOM 2367 CD PRO A 148 -4.993 -1.482 16.184 1.00 65.31 C ATOM 0 HA PRO A 148 -7.702 -3.272 15.929 1.00 34.02 H new ATOM 0 HB2 PRO A 148 -5.405 -4.775 16.342 1.00 23.40 H new ATOM 0 HB3 PRO A 148 -5.662 -3.929 14.828 1.00 23.40 H new ATOM 0 HG2 PRO A 148 -4.005 -3.098 17.203 1.00 51.45 H new ATOM 0 HG3 PRO A 148 -3.617 -2.986 15.498 1.00 51.45 H new ATOM 0 HD2 PRO A 148 -4.502 -0.827 16.904 1.00 65.31 H new ATOM 0 HD3 PRO A 148 -4.871 -1.025 15.202 1.00 65.31 H new ATOM 2375 N SER A 149 -7.089 -2.750 18.879 1.00 50.21 N ATOM 2376 CA SER A 149 -7.351 -3.139 20.260 1.00 41.42 C ATOM 2377 C SER A 149 -8.636 -2.494 20.770 1.00 34.51 C ATOM 2378 O SER A 149 -9.588 -3.186 21.131 1.00 72.00 O ATOM 2379 CB SER A 149 -6.177 -2.740 21.155 1.00 2.00 C ATOM 2380 OG SER A 149 -6.436 -3.063 22.510 1.00 0.41 O ATOM 0 H SER A 149 -6.918 -1.753 18.747 1.00 50.21 H new ATOM 0 HA SER A 149 -7.471 -4.222 20.291 1.00 41.42 H new ATOM 0 HB2 SER A 149 -5.273 -3.250 20.823 1.00 2.00 H new ATOM 0 HB3 SER A 149 -5.992 -1.670 21.062 1.00 2.00 H new ATOM 0 HG SER A 149 -5.670 -2.800 23.061 1.00 0.41 H new ATOM 2386 N SER A 150 -8.653 -1.166 20.798 1.00 34.13 N ATOM 2387 CA SER A 150 -9.820 -0.428 21.268 1.00 3.35 C ATOM 2388 C SER A 150 -10.850 -0.273 20.154 1.00 34.03 C ATOM 2389 O SER A 150 -11.414 0.803 19.960 1.00 41.11 O ATOM 2390 CB SER A 150 -9.403 0.949 21.789 1.00 42.43 C ATOM 2391 OG SER A 150 -10.453 1.558 22.519 1.00 32.33 O ATOM 0 H SER A 150 -7.873 -0.579 20.501 1.00 34.13 H new ATOM 0 HA SER A 150 -10.274 -0.994 22.082 1.00 3.35 H new ATOM 0 HB2 SER A 150 -8.524 0.849 22.425 1.00 42.43 H new ATOM 0 HB3 SER A 150 -9.120 1.587 20.952 1.00 42.43 H new ATOM 0 HG SER A 150 -11.260 1.592 21.964 1.00 32.33 H new ATOM 2397 N GLY A 151 -11.093 -1.358 19.425 1.00 64.12 N ATOM 2398 CA GLY A 151 -12.054 -1.322 18.338 1.00 21.11 C ATOM 2399 C GLY A 151 -13.325 -2.081 18.664 1.00 31.00 C ATOM 2400 O GLY A 151 -13.775 -2.917 17.880 1.00 74.42 O ATOM 0 H GLY A 151 -10.641 -2.261 19.568 1.00 64.12 H new ATOM 0 HA2 GLY A 151 -12.302 -0.285 18.110 1.00 21.11 H new ATOM 0 HA3 GLY A 151 -11.601 -1.746 17.442 1.00 21.11 H new TER 2404 GLY A 151