USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1287 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 108 THR OG1 : rot -158:sc= 0.945 USER MOD Set 1.2: A 127 SER OG : rot -94:sc= 1.01 USER MOD Set 2.1: A 80 THR OG1 : rot 160:sc= -0.543 USER MOD Set 2.2: A 81 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: A 109 HIS : no HD1:sc= -2.79! C(o=-3.3!,f=-5.3!) USER MOD Set 3.1: A 60 LYS NZ :NH3+ -141:sc= -0.568 (180deg=0) USER MOD Set 3.2: A 78 GLN : amide:sc= -0.587 K(o=-1.2,f=1.3) USER MOD Single : A 1 THR N :NH3+ 140:sc= -0.715 (180deg=-0.9) USER MOD Single : A 1 THR OG1 : rot -145:sc= 0.654 USER MOD Single : A 4 SER OG : rot -100:sc= 0.0921 USER MOD Single : A 7 LYS NZ :NH3+ -130:sc= 0.296 (180deg=-0.221) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.995 USER MOD Single : A 25 LYS NZ :NH3+ -128:sc= -0.102 (180deg=-2.2!) USER MOD Single : A 36 GLN : amide:sc= -2.69! C(o=-2.7!,f=-5.6!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0952 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -0.844 K(o=-0.84,f=-2.7) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0296 USER MOD Single : A 63 TYR OH : rot 180:sc= 0.0378 USER MOD Single : A 64 TYR OH : rot 31:sc= 0.0203 USER MOD Single : A 65 MET CE :methyl -140:sc= -0.117 (180deg=-0.471) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 HIS : no HE2:sc= -0.0708 K(o=-0.071,f=-4) USER MOD Single : A 98 HIS : no HD1:sc= -0.0511 X(o=-0.051,f=-0.051) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -4.07! K(o=-4.1!,f=-0.39) USER MOD Single : A 121 THR OG1 : rot 83:sc= 0.34 USER MOD Single : A 123 MET CE :methyl 141:sc= -0.872 (180deg=-2.11) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -61:sc= -0.857 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -4.13! C(o=-4.1!,f=-5.5!) USER MOD Single : A 135 MET CE :methyl -137:sc= -0.539 (180deg=-2.88) USER MOD Single : A 136 GLN : amide:sc= -1.05 K(o=-1,f=-0.024) USER MOD Single : A 137 LYS NZ :NH3+ 177:sc= 0.566 (180deg=0.525) USER MOD Single : A 138 MET CE :methyl -123:sc= -0.0317 (180deg=-0.482) USER MOD Single : A 141 MET CE :methyl -149:sc= -0.0633 (180deg=-0.895) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 MET CE :methyl 169:sc= 0 (180deg=-0.18) USER MOD Single : A 153 GLN : amide:sc= -0.681 K(o=-0.68,f=-1.7!) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 163 ASN : amide:sc= -0.323 K(o=-0.32,f=-5.2!) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 168 HIS : no HD1:sc= 0.625 K(o=0.62,f=-2.1!) USER MOD Single : A 169 HIS : no HD1:sc= 0.565 K(o=0.56,f=-3.6!) USER MOD Single : A 170 HIS : no HE2:sc= 0.312 K(o=0.31,f=-1.4) USER MOD Single : A 171 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 172 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.978 2.062 -7.507 1.00 32.03 N ATOM 2 CA THR A 1 -11.824 1.794 -8.960 1.00 63.54 C ATOM 3 C THR A 1 -10.903 0.598 -9.223 1.00 74.52 C ATOM 4 O THR A 1 -11.383 -0.512 -9.447 1.00 75.41 O ATOM 5 CB THR A 1 -11.298 3.047 -9.749 1.00 62.22 C ATOM 6 OG1 THR A 1 -10.221 3.676 -9.025 1.00 21.52 O ATOM 7 CG2 THR A 1 -12.408 4.060 -10.027 1.00 22.21 C ATOM 0 H1 THR A 1 -11.972 3.089 -7.341 1.00 32.03 H new ATOM 0 H2 THR A 1 -12.879 1.663 -7.174 1.00 32.03 H new ATOM 0 H3 THR A 1 -11.191 1.623 -6.988 1.00 32.03 H new ATOM 0 HA THR A 1 -12.823 1.557 -9.325 1.00 63.54 H new ATOM 0 HB THR A 1 -10.930 2.694 -10.712 1.00 62.22 H new ATOM 0 HG1 THR A 1 -10.267 4.647 -9.149 1.00 21.52 H new ATOM 0 HG21 THR A 1 -11.997 4.909 -10.574 1.00 22.21 H new ATOM 0 HG22 THR A 1 -13.190 3.589 -10.622 1.00 22.21 H new ATOM 0 HG23 THR A 1 -12.829 4.406 -9.083 1.00 22.21 H new ATOM 17 N VAL A 2 -9.577 0.835 -9.164 1.00 33.44 N ATOM 18 CA VAL A 2 -8.572 -0.061 -9.763 1.00 65.32 C ATOM 19 C VAL A 2 -8.893 -0.296 -11.267 1.00 14.03 C ATOM 20 O VAL A 2 -9.634 -1.215 -11.645 1.00 64.53 O ATOM 21 CB VAL A 2 -8.382 -1.407 -8.975 1.00 4.43 C ATOM 22 CG1 VAL A 2 -7.393 -2.350 -9.698 1.00 0.52 C ATOM 23 CG2 VAL A 2 -7.914 -1.122 -7.526 1.00 22.12 C ATOM 0 H VAL A 2 -9.176 1.650 -8.701 1.00 33.44 H new ATOM 0 HA VAL A 2 -7.607 0.441 -9.689 1.00 65.32 H new ATOM 0 HB VAL A 2 -9.347 -1.913 -8.935 1.00 4.43 H new ATOM 0 HG11 VAL A 2 -7.285 -3.272 -9.126 1.00 0.52 H new ATOM 0 HG12 VAL A 2 -7.773 -2.583 -10.693 1.00 0.52 H new ATOM 0 HG13 VAL A 2 -6.423 -1.861 -9.786 1.00 0.52 H new ATOM 0 HG21 VAL A 2 -7.787 -2.064 -6.993 1.00 22.12 H new ATOM 0 HG22 VAL A 2 -6.965 -0.587 -7.549 1.00 22.12 H new ATOM 0 HG23 VAL A 2 -8.661 -0.514 -7.015 1.00 22.12 H new ATOM 33 N VAL A 3 -8.376 0.613 -12.100 1.00 73.02 N ATOM 34 CA VAL A 3 -8.610 0.607 -13.556 1.00 32.20 C ATOM 35 C VAL A 3 -7.688 -0.402 -14.297 1.00 24.21 C ATOM 36 O VAL A 3 -7.946 -0.741 -15.456 1.00 64.13 O ATOM 37 CB VAL A 3 -8.470 2.059 -14.157 1.00 40.34 C ATOM 38 CG1 VAL A 3 -9.650 2.956 -13.710 1.00 14.32 C ATOM 39 CG2 VAL A 3 -7.130 2.716 -13.757 1.00 4.13 C ATOM 0 H VAL A 3 -7.780 1.379 -11.786 1.00 73.02 H new ATOM 0 HA VAL A 3 -9.635 0.271 -13.714 1.00 32.20 H new ATOM 0 HB VAL A 3 -8.489 1.960 -15.242 1.00 40.34 H new ATOM 0 HG11 VAL A 3 -9.532 3.952 -14.137 1.00 14.32 H new ATOM 0 HG12 VAL A 3 -10.588 2.522 -14.056 1.00 14.32 H new ATOM 0 HG13 VAL A 3 -9.662 3.026 -12.622 1.00 14.32 H new ATOM 0 HG21 VAL A 3 -7.071 3.715 -14.190 1.00 4.13 H new ATOM 0 HG22 VAL A 3 -7.070 2.787 -12.671 1.00 4.13 H new ATOM 0 HG23 VAL A 3 -6.303 2.110 -14.128 1.00 4.13 H new ATOM 49 N SER A 4 -6.623 -0.888 -13.615 1.00 23.40 N ATOM 50 CA SER A 4 -5.710 -1.934 -14.154 1.00 74.21 C ATOM 51 C SER A 4 -5.009 -2.715 -13.016 1.00 22.21 C ATOM 52 O SER A 4 -4.745 -2.166 -11.946 1.00 5.31 O ATOM 53 CB SER A 4 -4.643 -1.300 -15.082 1.00 5.20 C ATOM 54 OG SER A 4 -3.716 -2.269 -15.563 1.00 24.05 O ATOM 0 H SER A 4 -6.370 -0.570 -12.679 1.00 23.40 H new ATOM 0 HA SER A 4 -6.318 -2.633 -14.728 1.00 74.21 H new ATOM 0 HB2 SER A 4 -5.136 -0.818 -15.926 1.00 5.20 H new ATOM 0 HB3 SER A 4 -4.106 -0.522 -14.540 1.00 5.20 H new ATOM 0 HG SER A 4 -2.891 -2.222 -15.036 1.00 24.05 H new ATOM 60 N VAL A 5 -4.733 -4.013 -13.258 1.00 34.20 N ATOM 61 CA VAL A 5 -3.918 -4.875 -12.357 1.00 44.04 C ATOM 62 C VAL A 5 -2.783 -5.535 -13.177 1.00 73.33 C ATOM 63 O VAL A 5 -3.044 -6.121 -14.234 1.00 10.31 O ATOM 64 CB VAL A 5 -4.773 -6.013 -11.661 1.00 2.30 C ATOM 65 CG1 VAL A 5 -3.907 -6.859 -10.682 1.00 11.40 C ATOM 66 CG2 VAL A 5 -6.001 -5.429 -10.930 1.00 53.44 C ATOM 0 H VAL A 5 -5.069 -4.502 -14.088 1.00 34.20 H new ATOM 0 HA VAL A 5 -3.518 -4.235 -11.571 1.00 44.04 H new ATOM 0 HB VAL A 5 -5.131 -6.672 -12.451 1.00 2.30 H new ATOM 0 HG11 VAL A 5 -4.525 -7.630 -10.222 1.00 11.40 H new ATOM 0 HG12 VAL A 5 -3.091 -7.328 -11.231 1.00 11.40 H new ATOM 0 HG13 VAL A 5 -3.498 -6.212 -9.906 1.00 11.40 H new ATOM 0 HG21 VAL A 5 -6.565 -6.237 -10.464 1.00 53.44 H new ATOM 0 HG22 VAL A 5 -5.669 -4.729 -10.163 1.00 53.44 H new ATOM 0 HG23 VAL A 5 -6.637 -4.908 -11.646 1.00 53.44 H new ATOM 76 N ASP A 6 -1.535 -5.446 -12.683 1.00 11.13 N ATOM 77 CA ASP A 6 -0.343 -6.005 -13.367 1.00 21.31 C ATOM 78 C ASP A 6 0.446 -6.941 -12.420 1.00 63.42 C ATOM 79 O ASP A 6 0.825 -6.541 -11.326 1.00 32.12 O ATOM 80 CB ASP A 6 0.552 -4.845 -13.858 1.00 71.14 C ATOM 81 CG ASP A 6 -0.125 -3.995 -14.951 1.00 12.40 C ATOM 82 OD1 ASP A 6 -0.845 -3.021 -14.623 1.00 70.42 O ATOM 83 OD2 ASP A 6 0.038 -4.323 -16.145 1.00 33.34 O ATOM 0 H ASP A 6 -1.319 -4.986 -11.799 1.00 11.13 H new ATOM 0 HA ASP A 6 -0.667 -6.597 -14.223 1.00 21.31 H new ATOM 0 HB2 ASP A 6 0.808 -4.206 -13.013 1.00 71.14 H new ATOM 0 HB3 ASP A 6 1.486 -5.251 -14.246 1.00 71.14 H new ATOM 88 N LYS A 7 0.696 -8.183 -12.871 1.00 75.23 N ATOM 89 CA LYS A 7 1.395 -9.230 -12.089 1.00 64.11 C ATOM 90 C LYS A 7 2.492 -9.895 -12.957 1.00 21.43 C ATOM 91 O LYS A 7 2.195 -10.405 -14.042 1.00 72.31 O ATOM 92 CB LYS A 7 0.340 -10.280 -11.631 1.00 42.02 C ATOM 93 CG LYS A 7 0.882 -11.524 -10.890 1.00 20.53 C ATOM 94 CD LYS A 7 1.474 -11.218 -9.498 1.00 13.54 C ATOM 95 CE LYS A 7 1.772 -12.511 -8.715 1.00 62.13 C ATOM 96 NZ LYS A 7 0.555 -13.353 -8.510 1.00 33.12 N ATOM 0 H LYS A 7 0.416 -8.496 -13.801 1.00 75.23 H new ATOM 0 HA LYS A 7 1.880 -8.793 -11.216 1.00 64.11 H new ATOM 0 HB2 LYS A 7 -0.378 -9.781 -10.980 1.00 42.02 H new ATOM 0 HB3 LYS A 7 -0.208 -10.618 -12.510 1.00 42.02 H new ATOM 0 HG2 LYS A 7 0.075 -12.248 -10.779 1.00 20.53 H new ATOM 0 HG3 LYS A 7 1.650 -11.994 -11.504 1.00 20.53 H new ATOM 0 HD2 LYS A 7 2.391 -10.640 -9.611 1.00 13.54 H new ATOM 0 HD3 LYS A 7 0.776 -10.601 -8.932 1.00 13.54 H new ATOM 0 HE2 LYS A 7 2.524 -13.090 -9.251 1.00 62.13 H new ATOM 0 HE3 LYS A 7 2.199 -12.254 -7.746 1.00 62.13 H new ATOM 0 HZ1 LYS A 7 0.479 -13.615 -7.506 1.00 33.12 H new ATOM 0 HZ2 LYS A 7 -0.290 -12.817 -8.793 1.00 33.12 H new ATOM 0 HZ3 LYS A 7 0.627 -14.215 -9.088 1.00 33.12 H new ATOM 110 N ASP A 8 3.758 -9.897 -12.477 1.00 60.22 N ATOM 111 CA ASP A 8 4.893 -10.522 -13.208 1.00 74.21 C ATOM 112 C ASP A 8 5.844 -11.248 -12.218 1.00 60.50 C ATOM 113 O ASP A 8 6.554 -10.604 -11.432 1.00 32.50 O ATOM 114 CB ASP A 8 5.672 -9.448 -14.026 1.00 74.20 C ATOM 115 CG ASP A 8 6.478 -10.048 -15.197 1.00 3.34 C ATOM 116 OD1 ASP A 8 7.395 -10.866 -14.958 1.00 53.43 O ATOM 117 OD2 ASP A 8 6.195 -9.712 -16.368 1.00 74.22 O ATOM 0 H ASP A 8 4.022 -9.474 -11.587 1.00 60.22 H new ATOM 0 HA ASP A 8 4.491 -11.260 -13.903 1.00 74.21 H new ATOM 0 HB2 ASP A 8 4.966 -8.714 -14.416 1.00 74.20 H new ATOM 0 HB3 ASP A 8 6.351 -8.915 -13.361 1.00 74.20 H new ATOM 122 N VAL A 9 5.871 -12.589 -12.295 1.00 62.21 N ATOM 123 CA VAL A 9 6.668 -13.458 -11.392 1.00 4.34 C ATOM 124 C VAL A 9 8.178 -13.456 -11.771 1.00 0.50 C ATOM 125 O VAL A 9 9.043 -13.620 -10.906 1.00 40.10 O ATOM 126 CB VAL A 9 6.088 -14.930 -11.402 1.00 60.30 C ATOM 127 CG1 VAL A 9 6.838 -15.877 -10.426 1.00 5.40 C ATOM 128 CG2 VAL A 9 4.566 -14.923 -11.092 1.00 23.22 C ATOM 0 H VAL A 9 5.338 -13.112 -12.990 1.00 62.21 H new ATOM 0 HA VAL A 9 6.590 -13.053 -10.383 1.00 4.34 H new ATOM 0 HB VAL A 9 6.245 -15.322 -12.407 1.00 60.30 H new ATOM 0 HG11 VAL A 9 6.398 -16.873 -10.475 1.00 5.40 H new ATOM 0 HG12 VAL A 9 7.890 -15.931 -10.708 1.00 5.40 H new ATOM 0 HG13 VAL A 9 6.754 -15.493 -9.410 1.00 5.40 H new ATOM 0 HG21 VAL A 9 4.188 -15.945 -11.104 1.00 23.22 H new ATOM 0 HG22 VAL A 9 4.397 -14.485 -10.108 1.00 23.22 H new ATOM 0 HG23 VAL A 9 4.044 -14.334 -11.846 1.00 23.22 H new ATOM 138 N GLU A 10 8.479 -13.228 -13.061 1.00 64.33 N ATOM 139 CA GLU A 10 9.871 -13.225 -13.587 1.00 22.15 C ATOM 140 C GLU A 10 10.613 -11.923 -13.207 1.00 3.31 C ATOM 141 O GLU A 10 11.792 -11.945 -12.841 1.00 22.51 O ATOM 142 CB GLU A 10 9.846 -13.399 -15.129 1.00 42.13 C ATOM 143 CG GLU A 10 9.164 -14.696 -15.594 1.00 10.34 C ATOM 144 CD GLU A 10 9.108 -14.854 -17.120 1.00 4.44 C ATOM 145 OE1 GLU A 10 8.212 -14.263 -17.756 1.00 23.52 O ATOM 146 OE2 GLU A 10 9.953 -15.571 -17.692 1.00 61.10 O ATOM 0 H GLU A 10 7.773 -13.040 -13.773 1.00 64.33 H new ATOM 0 HA GLU A 10 10.410 -14.058 -13.136 1.00 22.15 H new ATOM 0 HB2 GLU A 10 9.330 -12.548 -15.573 1.00 42.13 H new ATOM 0 HB3 GLU A 10 10.869 -13.382 -15.504 1.00 42.13 H new ATOM 0 HG2 GLU A 10 9.696 -15.547 -15.169 1.00 10.34 H new ATOM 0 HG3 GLU A 10 8.149 -14.724 -15.198 1.00 10.34 H new ATOM 153 N ALA A 11 9.888 -10.797 -13.282 1.00 52.51 N ATOM 154 CA ALA A 11 10.409 -9.454 -12.940 1.00 12.52 C ATOM 155 C ALA A 11 10.217 -9.122 -11.435 1.00 70.53 C ATOM 156 O ALA A 11 10.636 -8.050 -10.980 1.00 2.22 O ATOM 157 CB ALA A 11 9.719 -8.402 -13.826 1.00 32.34 C ATOM 0 H ALA A 11 8.914 -10.787 -13.584 1.00 52.51 H new ATOM 0 HA ALA A 11 11.483 -9.443 -13.129 1.00 12.52 H new ATOM 0 HB1 ALA A 11 10.099 -7.411 -13.578 1.00 32.34 H new ATOM 0 HB2 ALA A 11 9.925 -8.618 -14.874 1.00 32.34 H new ATOM 0 HB3 ALA A 11 8.643 -8.431 -13.654 1.00 32.34 H new ATOM 163 N LEU A 12 9.574 -10.057 -10.687 1.00 35.23 N ATOM 164 CA LEU A 12 9.318 -9.946 -9.223 1.00 73.41 C ATOM 165 C LEU A 12 8.544 -8.661 -8.836 1.00 4.33 C ATOM 166 O LEU A 12 8.743 -8.107 -7.759 1.00 73.15 O ATOM 167 CB LEU A 12 10.651 -10.065 -8.413 1.00 73.20 C ATOM 168 CG LEU A 12 11.438 -11.401 -8.590 1.00 13.41 C ATOM 169 CD1 LEU A 12 12.741 -11.397 -7.762 1.00 21.04 C ATOM 170 CD2 LEU A 12 10.551 -12.609 -8.227 1.00 0.35 C ATOM 0 H LEU A 12 9.213 -10.922 -11.089 1.00 35.23 H new ATOM 0 HA LEU A 12 8.672 -10.783 -8.958 1.00 73.41 H new ATOM 0 HB2 LEU A 12 11.303 -9.240 -8.701 1.00 73.20 H new ATOM 0 HB3 LEU A 12 10.423 -9.937 -7.355 1.00 73.20 H new ATOM 0 HG LEU A 12 11.717 -11.490 -9.640 1.00 13.41 H new ATOM 0 HD11 LEU A 12 13.267 -12.341 -7.906 1.00 21.04 H new ATOM 0 HD12 LEU A 12 13.377 -10.574 -8.088 1.00 21.04 H new ATOM 0 HD13 LEU A 12 12.501 -11.273 -6.706 1.00 21.04 H new ATOM 0 HD21 LEU A 12 11.119 -13.530 -8.357 1.00 0.35 H new ATOM 0 HD22 LEU A 12 10.229 -12.525 -7.189 1.00 0.35 H new ATOM 0 HD23 LEU A 12 9.677 -12.627 -8.878 1.00 0.35 H new ATOM 182 N SER A 13 7.634 -8.213 -9.705 1.00 33.21 N ATOM 183 CA SER A 13 6.866 -6.966 -9.482 1.00 43.01 C ATOM 184 C SER A 13 5.357 -7.188 -9.677 1.00 4.04 C ATOM 185 O SER A 13 4.926 -8.052 -10.446 1.00 60.11 O ATOM 186 CB SER A 13 7.376 -5.848 -10.414 1.00 12.23 C ATOM 187 OG SER A 13 7.271 -6.221 -11.783 1.00 20.04 O ATOM 0 H SER A 13 7.404 -8.692 -10.576 1.00 33.21 H new ATOM 0 HA SER A 13 7.021 -6.659 -8.448 1.00 43.01 H new ATOM 0 HB2 SER A 13 6.803 -4.938 -10.239 1.00 12.23 H new ATOM 0 HB3 SER A 13 8.415 -5.621 -10.177 1.00 12.23 H new ATOM 0 HG SER A 13 7.601 -5.491 -12.347 1.00 20.04 H new ATOM 193 N PHE A 14 4.569 -6.384 -8.955 1.00 60.23 N ATOM 194 CA PHE A 14 3.103 -6.432 -8.979 1.00 3.11 C ATOM 195 C PHE A 14 2.549 -4.992 -8.812 1.00 24.43 C ATOM 196 O PHE A 14 2.548 -4.449 -7.713 1.00 14.44 O ATOM 197 CB PHE A 14 2.634 -7.391 -7.840 1.00 24.22 C ATOM 198 CG PHE A 14 1.134 -7.412 -7.579 1.00 45.32 C ATOM 199 CD1 PHE A 14 0.250 -7.866 -8.551 1.00 52.22 C ATOM 200 CD2 PHE A 14 0.613 -6.983 -6.358 1.00 23.23 C ATOM 201 CE1 PHE A 14 -1.105 -7.882 -8.323 1.00 70.51 C ATOM 202 CE2 PHE A 14 -0.744 -7.000 -6.131 1.00 10.33 C ATOM 203 CZ PHE A 14 -1.603 -7.452 -7.111 1.00 70.34 C ATOM 0 H PHE A 14 4.938 -5.670 -8.327 1.00 60.23 H new ATOM 0 HA PHE A 14 2.724 -6.816 -9.926 1.00 3.11 H new ATOM 0 HB2 PHE A 14 2.957 -8.403 -8.084 1.00 24.22 H new ATOM 0 HB3 PHE A 14 3.142 -7.108 -6.918 1.00 24.22 H new ATOM 0 HD1 PHE A 14 0.634 -8.211 -9.500 1.00 52.22 H new ATOM 0 HD2 PHE A 14 1.281 -6.634 -5.584 1.00 23.23 H new ATOM 0 HE1 PHE A 14 -1.779 -8.231 -9.092 1.00 70.51 H new ATOM 0 HE2 PHE A 14 -1.137 -6.659 -5.185 1.00 10.33 H new ATOM 0 HZ PHE A 14 -2.667 -7.469 -6.929 1.00 70.34 H new ATOM 213 N SER A 15 2.067 -4.382 -9.914 1.00 31.21 N ATOM 214 CA SER A 15 1.658 -2.954 -9.934 1.00 31.41 C ATOM 215 C SER A 15 0.140 -2.790 -10.163 1.00 43.43 C ATOM 216 O SER A 15 -0.404 -3.242 -11.167 1.00 13.32 O ATOM 217 CB SER A 15 2.465 -2.175 -11.002 1.00 52.51 C ATOM 218 OG SER A 15 2.318 -2.726 -12.293 1.00 73.01 O ATOM 0 H SER A 15 1.949 -4.856 -10.809 1.00 31.21 H new ATOM 0 HA SER A 15 1.880 -2.535 -8.953 1.00 31.41 H new ATOM 0 HB2 SER A 15 2.138 -1.135 -11.014 1.00 52.51 H new ATOM 0 HB3 SER A 15 3.520 -2.174 -10.728 1.00 52.51 H new ATOM 0 HG SER A 15 2.843 -2.202 -12.934 1.00 73.01 H new ATOM 224 N ILE A 16 -0.542 -2.129 -9.209 1.00 61.41 N ATOM 225 CA ILE A 16 -1.998 -1.878 -9.273 1.00 72.30 C ATOM 226 C ILE A 16 -2.267 -0.401 -9.632 1.00 53.31 C ATOM 227 O ILE A 16 -1.848 0.511 -8.907 1.00 31.15 O ATOM 228 CB ILE A 16 -2.683 -2.227 -7.902 1.00 70.10 C ATOM 229 CG1 ILE A 16 -2.350 -3.692 -7.483 1.00 42.41 C ATOM 230 CG2 ILE A 16 -4.219 -2.003 -7.965 1.00 34.14 C ATOM 231 CD1 ILE A 16 -2.789 -4.061 -6.077 1.00 41.23 C ATOM 0 H ILE A 16 -0.100 -1.753 -8.370 1.00 61.41 H new ATOM 0 HA ILE A 16 -2.422 -2.518 -10.047 1.00 72.30 H new ATOM 0 HB ILE A 16 -2.284 -1.553 -7.144 1.00 70.10 H new ATOM 0 HG12 ILE A 16 -2.824 -4.375 -8.189 1.00 42.41 H new ATOM 0 HG13 ILE A 16 -1.274 -3.844 -7.566 1.00 42.41 H new ATOM 0 HG21 ILE A 16 -4.663 -2.253 -7.002 1.00 34.14 H new ATOM 0 HG22 ILE A 16 -4.425 -0.959 -8.199 1.00 34.14 H new ATOM 0 HG23 ILE A 16 -4.648 -2.640 -8.739 1.00 34.14 H new ATOM 0 HD11 ILE A 16 -2.517 -5.096 -5.871 1.00 41.23 H new ATOM 0 HD12 ILE A 16 -2.296 -3.407 -5.358 1.00 41.23 H new ATOM 0 HD13 ILE A 16 -3.869 -3.945 -5.991 1.00 41.23 H new ATOM 243 N VAL A 17 -2.976 -0.180 -10.744 1.00 24.03 N ATOM 244 CA VAL A 17 -3.338 1.165 -11.232 1.00 33.33 C ATOM 245 C VAL A 17 -4.821 1.465 -10.897 1.00 63.04 C ATOM 246 O VAL A 17 -5.691 0.628 -11.127 1.00 74.51 O ATOM 247 CB VAL A 17 -3.108 1.290 -12.787 1.00 71.24 C ATOM 248 CG1 VAL A 17 -3.308 2.747 -13.286 1.00 31.42 C ATOM 249 CG2 VAL A 17 -1.717 0.743 -13.193 1.00 51.20 C ATOM 0 H VAL A 17 -3.320 -0.933 -11.340 1.00 24.03 H new ATOM 0 HA VAL A 17 -2.695 1.890 -10.733 1.00 33.33 H new ATOM 0 HB VAL A 17 -3.865 0.676 -13.276 1.00 71.24 H new ATOM 0 HG11 VAL A 17 -3.140 2.789 -14.362 1.00 31.42 H new ATOM 0 HG12 VAL A 17 -4.325 3.071 -13.064 1.00 31.42 H new ATOM 0 HG13 VAL A 17 -2.600 3.405 -12.782 1.00 31.42 H new ATOM 0 HG21 VAL A 17 -1.587 0.843 -14.271 1.00 51.20 H new ATOM 0 HG22 VAL A 17 -0.940 1.309 -12.680 1.00 51.20 H new ATOM 0 HG23 VAL A 17 -1.644 -0.308 -12.914 1.00 51.20 H new ATOM 259 N ALA A 18 -5.093 2.668 -10.373 1.00 52.22 N ATOM 260 CA ALA A 18 -6.452 3.133 -10.013 1.00 14.52 C ATOM 261 C ALA A 18 -6.631 4.600 -10.441 1.00 60.23 C ATOM 262 O ALA A 18 -5.645 5.282 -10.713 1.00 34.43 O ATOM 263 CB ALA A 18 -6.688 2.961 -8.504 1.00 25.32 C ATOM 0 H ALA A 18 -4.369 3.360 -10.182 1.00 52.22 H new ATOM 0 HA ALA A 18 -7.192 2.530 -10.539 1.00 14.52 H new ATOM 0 HB1 ALA A 18 -7.690 3.306 -8.251 1.00 25.32 H new ATOM 0 HB2 ALA A 18 -6.589 1.909 -8.238 1.00 25.32 H new ATOM 0 HB3 ALA A 18 -5.953 3.546 -7.952 1.00 25.32 H new ATOM 269 N GLU A 19 -7.881 5.092 -10.504 1.00 53.22 N ATOM 270 CA GLU A 19 -8.151 6.491 -10.923 1.00 43.44 C ATOM 271 C GLU A 19 -9.332 7.084 -10.124 1.00 53.12 C ATOM 272 O GLU A 19 -10.389 6.469 -10.030 1.00 32.24 O ATOM 273 CB GLU A 19 -8.429 6.551 -12.452 1.00 65.44 C ATOM 274 CG GLU A 19 -8.178 7.934 -13.078 1.00 4.05 C ATOM 275 CD GLU A 19 -8.530 7.996 -14.573 1.00 4.14 C ATOM 276 OE1 GLU A 19 -7.867 7.310 -15.369 1.00 54.02 O ATOM 277 OE2 GLU A 19 -9.456 8.731 -14.956 1.00 35.53 O ATOM 0 H GLU A 19 -8.716 4.553 -10.274 1.00 53.22 H new ATOM 0 HA GLU A 19 -7.268 7.093 -10.710 1.00 43.44 H new ATOM 0 HB2 GLU A 19 -7.800 5.816 -12.955 1.00 65.44 H new ATOM 0 HB3 GLU A 19 -9.464 6.263 -12.635 1.00 65.44 H new ATOM 0 HG2 GLU A 19 -8.765 8.680 -12.542 1.00 4.05 H new ATOM 0 HG3 GLU A 19 -7.129 8.200 -12.947 1.00 4.05 H new ATOM 284 N PHE A 20 -9.138 8.287 -9.554 1.00 44.44 N ATOM 285 CA PHE A 20 -10.107 8.917 -8.618 1.00 61.23 C ATOM 286 C PHE A 20 -10.425 10.358 -9.058 1.00 72.24 C ATOM 287 O PHE A 20 -9.521 11.091 -9.481 1.00 74.22 O ATOM 288 CB PHE A 20 -9.523 8.922 -7.173 1.00 63.34 C ATOM 289 CG PHE A 20 -8.952 7.573 -6.731 1.00 62.44 C ATOM 290 CD1 PHE A 20 -9.795 6.510 -6.401 1.00 54.33 C ATOM 291 CD2 PHE A 20 -7.571 7.363 -6.664 1.00 43.55 C ATOM 292 CE1 PHE A 20 -9.275 5.285 -6.035 1.00 51.13 C ATOM 293 CE2 PHE A 20 -7.058 6.138 -6.291 1.00 12.22 C ATOM 294 CZ PHE A 20 -7.911 5.100 -5.973 1.00 14.12 C ATOM 0 H PHE A 20 -8.308 8.855 -9.724 1.00 44.44 H new ATOM 0 HA PHE A 20 -11.030 8.337 -8.632 1.00 61.23 H new ATOM 0 HB2 PHE A 20 -8.738 9.676 -7.111 1.00 63.34 H new ATOM 0 HB3 PHE A 20 -10.306 9.220 -6.476 1.00 63.34 H new ATOM 0 HD1 PHE A 20 -10.866 6.648 -6.432 1.00 54.33 H new ATOM 0 HD2 PHE A 20 -6.897 8.171 -6.908 1.00 43.55 H new ATOM 0 HE1 PHE A 20 -9.940 4.468 -5.796 1.00 51.13 H new ATOM 0 HE2 PHE A 20 -5.989 5.991 -6.248 1.00 12.22 H new ATOM 0 HZ PHE A 20 -7.509 4.143 -5.676 1.00 14.12 H new ATOM 304 N ASP A 21 -11.704 10.764 -8.938 1.00 0.34 N ATOM 305 CA ASP A 21 -12.149 12.134 -9.273 1.00 42.24 C ATOM 306 C ASP A 21 -11.772 13.099 -8.118 1.00 64.20 C ATOM 307 O ASP A 21 -12.588 13.376 -7.223 1.00 4.00 O ATOM 308 CB ASP A 21 -13.677 12.145 -9.522 1.00 41.34 C ATOM 309 CG ASP A 21 -14.127 11.044 -10.491 1.00 31.34 C ATOM 310 OD1 ASP A 21 -14.431 9.930 -10.023 1.00 74.31 O ATOM 311 OD2 ASP A 21 -14.150 11.280 -11.717 1.00 33.53 O ATOM 0 H ASP A 21 -12.455 10.157 -8.608 1.00 0.34 H new ATOM 0 HA ASP A 21 -11.651 12.468 -10.183 1.00 42.24 H new ATOM 0 HB2 ASP A 21 -14.197 12.022 -8.572 1.00 41.34 H new ATOM 0 HB3 ASP A 21 -13.969 13.116 -9.921 1.00 41.34 H new ATOM 316 N ALA A 22 -10.518 13.570 -8.144 1.00 12.11 N ATOM 317 CA ALA A 22 -9.908 14.366 -7.051 1.00 23.11 C ATOM 318 C ALA A 22 -8.523 14.893 -7.476 1.00 21.35 C ATOM 319 O ALA A 22 -7.941 14.395 -8.434 1.00 31.00 O ATOM 320 CB ALA A 22 -9.772 13.504 -5.776 1.00 0.24 C ATOM 0 H ALA A 22 -9.886 13.412 -8.929 1.00 12.11 H new ATOM 0 HA ALA A 22 -10.557 15.216 -6.840 1.00 23.11 H new ATOM 0 HB1 ALA A 22 -9.323 14.099 -4.981 1.00 0.24 H new ATOM 0 HB2 ALA A 22 -10.758 13.162 -5.461 1.00 0.24 H new ATOM 0 HB3 ALA A 22 -9.139 12.642 -5.986 1.00 0.24 H new ATOM 326 N ASP A 23 -7.971 15.870 -6.736 1.00 73.21 N ATOM 327 CA ASP A 23 -6.612 16.399 -7.026 1.00 3.14 C ATOM 328 C ASP A 23 -5.525 15.488 -6.407 1.00 43.30 C ATOM 329 O ASP A 23 -5.825 14.575 -5.623 1.00 32.35 O ATOM 330 CB ASP A 23 -6.459 17.861 -6.535 1.00 64.51 C ATOM 331 CG ASP A 23 -6.713 18.017 -5.033 1.00 75.32 C ATOM 332 OD1 ASP A 23 -7.884 18.153 -4.625 1.00 13.31 O ATOM 333 OD2 ASP A 23 -5.747 17.987 -4.249 1.00 63.40 O ATOM 0 H ASP A 23 -8.433 16.310 -5.940 1.00 73.21 H new ATOM 0 HA ASP A 23 -6.478 16.400 -8.108 1.00 3.14 H new ATOM 0 HB2 ASP A 23 -5.454 18.213 -6.766 1.00 64.51 H new ATOM 0 HB3 ASP A 23 -7.154 18.497 -7.083 1.00 64.51 H new ATOM 338 N VAL A 24 -4.264 15.768 -6.757 1.00 40.24 N ATOM 339 CA VAL A 24 -3.101 14.952 -6.353 1.00 51.34 C ATOM 340 C VAL A 24 -2.865 15.005 -4.830 1.00 4.34 C ATOM 341 O VAL A 24 -2.580 13.981 -4.219 1.00 13.13 O ATOM 342 CB VAL A 24 -1.818 15.425 -7.122 1.00 73.52 C ATOM 343 CG1 VAL A 24 -0.562 14.619 -6.731 1.00 3.20 C ATOM 344 CG2 VAL A 24 -2.040 15.348 -8.640 1.00 42.23 C ATOM 0 H VAL A 24 -4.015 16.572 -7.333 1.00 40.24 H new ATOM 0 HA VAL A 24 -3.315 13.916 -6.614 1.00 51.34 H new ATOM 0 HB VAL A 24 -1.642 16.461 -6.832 1.00 73.52 H new ATOM 0 HG11 VAL A 24 0.296 14.988 -7.293 1.00 3.20 H new ATOM 0 HG12 VAL A 24 -0.374 14.734 -5.664 1.00 3.20 H new ATOM 0 HG13 VAL A 24 -0.720 13.565 -6.960 1.00 3.20 H new ATOM 0 HG21 VAL A 24 -1.139 15.680 -9.157 1.00 42.23 H new ATOM 0 HG22 VAL A 24 -2.263 14.319 -8.923 1.00 42.23 H new ATOM 0 HG23 VAL A 24 -2.876 15.990 -8.919 1.00 42.23 H new ATOM 354 N LYS A 25 -3.028 16.201 -4.231 1.00 4.11 N ATOM 355 CA LYS A 25 -2.858 16.409 -2.765 1.00 55.40 C ATOM 356 C LYS A 25 -3.916 15.609 -1.961 1.00 43.31 C ATOM 357 O LYS A 25 -3.641 15.116 -0.864 1.00 61.51 O ATOM 358 CB LYS A 25 -2.995 17.912 -2.405 1.00 1.22 C ATOM 359 CG LYS A 25 -2.055 18.862 -3.173 1.00 50.11 C ATOM 360 CD LYS A 25 -0.566 18.665 -2.815 1.00 25.34 C ATOM 361 CE LYS A 25 0.334 19.683 -3.529 1.00 61.34 C ATOM 362 NZ LYS A 25 1.749 19.564 -3.106 1.00 51.34 N ATOM 0 H LYS A 25 -3.279 17.049 -4.739 1.00 4.11 H new ATOM 0 HA LYS A 25 -1.861 16.056 -2.502 1.00 55.40 H new ATOM 0 HB2 LYS A 25 -4.024 18.220 -2.588 1.00 1.22 H new ATOM 0 HB3 LYS A 25 -2.812 18.031 -1.337 1.00 1.22 H new ATOM 0 HG2 LYS A 25 -2.188 18.707 -4.244 1.00 50.11 H new ATOM 0 HG3 LYS A 25 -2.339 19.893 -2.962 1.00 50.11 H new ATOM 0 HD2 LYS A 25 -0.436 18.759 -1.737 1.00 25.34 H new ATOM 0 HD3 LYS A 25 -0.258 17.655 -3.086 1.00 25.34 H new ATOM 0 HE2 LYS A 25 0.264 19.536 -4.607 1.00 61.34 H new ATOM 0 HE3 LYS A 25 -0.023 20.692 -3.321 1.00 61.34 H new ATOM 0 HZ1 LYS A 25 2.103 20.497 -2.812 1.00 51.34 H new ATOM 0 HZ2 LYS A 25 1.818 18.900 -2.308 1.00 51.34 H new ATOM 0 HZ3 LYS A 25 2.320 19.211 -3.900 1.00 51.34 H new ATOM 376 N ARG A 26 -5.122 15.501 -2.546 1.00 35.05 N ATOM 377 CA ARG A 26 -6.266 14.767 -1.962 1.00 44.34 C ATOM 378 C ARG A 26 -5.971 13.246 -1.877 1.00 33.23 C ATOM 379 O ARG A 26 -6.184 12.621 -0.828 1.00 23.23 O ATOM 380 CB ARG A 26 -7.542 15.054 -2.806 1.00 52.31 C ATOM 381 CG ARG A 26 -8.864 14.372 -2.353 1.00 53.13 C ATOM 382 CD ARG A 26 -9.345 14.777 -0.940 1.00 20.41 C ATOM 383 NE ARG A 26 -8.580 14.105 0.127 1.00 64.51 N ATOM 384 CZ ARG A 26 -8.654 14.369 1.407 1.00 15.03 C ATOM 385 NH1 ARG A 26 -9.477 15.252 1.872 1.00 61.41 N ATOM 386 NH2 ARG A 26 -7.893 13.733 2.224 1.00 3.10 N ATOM 0 H ARG A 26 -5.335 15.925 -3.449 1.00 35.05 H new ATOM 0 HA ARG A 26 -6.432 15.114 -0.942 1.00 44.34 H new ATOM 0 HB2 ARG A 26 -7.705 16.132 -2.816 1.00 52.31 H new ATOM 0 HB3 ARG A 26 -7.342 14.752 -3.834 1.00 52.31 H new ATOM 0 HG2 ARG A 26 -9.647 14.613 -3.072 1.00 53.13 H new ATOM 0 HG3 ARG A 26 -8.728 13.291 -2.380 1.00 53.13 H new ATOM 0 HD2 ARG A 26 -9.254 15.857 -0.824 1.00 20.41 H new ATOM 0 HD3 ARG A 26 -10.402 14.533 -0.835 1.00 20.41 H new ATOM 0 HE ARG A 26 -7.935 13.368 -0.158 1.00 64.51 H new ATOM 0 HH11 ARG A 26 -10.090 15.763 1.236 1.00 61.41 H new ATOM 0 HH12 ARG A 26 -9.513 15.437 2.874 1.00 61.41 H new ATOM 0 HH21 ARG A 26 -7.241 13.032 1.873 1.00 3.10 H new ATOM 0 HH22 ARG A 26 -7.941 13.929 3.224 1.00 3.10 H new ATOM 400 N VAL A 27 -5.460 12.673 -2.983 1.00 54.33 N ATOM 401 CA VAL A 27 -5.087 11.236 -3.048 1.00 4.12 C ATOM 402 C VAL A 27 -3.777 10.971 -2.244 1.00 21.03 C ATOM 403 O VAL A 27 -3.579 9.898 -1.702 1.00 63.21 O ATOM 404 CB VAL A 27 -4.937 10.730 -4.537 1.00 72.14 C ATOM 405 CG1 VAL A 27 -4.861 9.176 -4.602 1.00 73.51 C ATOM 406 CG2 VAL A 27 -6.081 11.267 -5.441 1.00 62.24 C ATOM 0 H VAL A 27 -5.293 13.182 -3.851 1.00 54.33 H new ATOM 0 HA VAL A 27 -5.899 10.670 -2.593 1.00 4.12 H new ATOM 0 HB VAL A 27 -3.998 11.129 -4.920 1.00 72.14 H new ATOM 0 HG11 VAL A 27 -4.758 8.860 -5.640 1.00 73.51 H new ATOM 0 HG12 VAL A 27 -4.000 8.830 -4.030 1.00 73.51 H new ATOM 0 HG13 VAL A 27 -5.772 8.749 -4.181 1.00 73.51 H new ATOM 0 HG21 VAL A 27 -5.945 10.898 -6.458 1.00 62.24 H new ATOM 0 HG22 VAL A 27 -7.041 10.923 -5.056 1.00 62.24 H new ATOM 0 HG23 VAL A 27 -6.061 12.357 -5.444 1.00 62.24 H new ATOM 416 N TRP A 28 -2.884 11.973 -2.195 1.00 21.10 N ATOM 417 CA TRP A 28 -1.613 11.923 -1.418 1.00 40.13 C ATOM 418 C TRP A 28 -1.867 11.934 0.109 1.00 52.24 C ATOM 419 O TRP A 28 -1.108 11.334 0.870 1.00 74.23 O ATOM 420 CB TRP A 28 -0.717 13.122 -1.830 1.00 4.22 C ATOM 421 CG TRP A 28 0.668 13.147 -1.216 1.00 11.31 C ATOM 422 CD1 TRP A 28 1.115 13.956 -0.204 1.00 2.02 C ATOM 423 CD2 TRP A 28 1.789 12.332 -1.594 1.00 75.51 C ATOM 424 NE1 TRP A 28 2.433 13.693 0.063 1.00 1.12 N ATOM 425 CE2 TRP A 28 2.869 12.705 -0.783 1.00 54.14 C ATOM 426 CE3 TRP A 28 1.983 11.327 -2.552 1.00 30.34 C ATOM 427 CZ2 TRP A 28 4.120 12.107 -0.891 1.00 75.11 C ATOM 428 CZ3 TRP A 28 3.225 10.741 -2.659 1.00 62.43 C ATOM 429 CH2 TRP A 28 4.282 11.136 -1.833 1.00 53.24 C ATOM 0 H TRP A 28 -3.016 12.853 -2.694 1.00 21.10 H new ATOM 0 HA TRP A 28 -1.106 10.986 -1.648 1.00 40.13 H new ATOM 0 HB2 TRP A 28 -0.614 13.119 -2.915 1.00 4.22 H new ATOM 0 HB3 TRP A 28 -1.231 14.045 -1.561 1.00 4.22 H new ATOM 0 HD1 TRP A 28 0.515 14.694 0.309 1.00 2.02 H new ATOM 0 HE1 TRP A 28 2.998 14.156 0.775 1.00 1.12 H new ATOM 0 HE3 TRP A 28 1.172 11.018 -3.195 1.00 30.34 H new ATOM 0 HZ2 TRP A 28 4.937 12.403 -0.249 1.00 75.11 H new ATOM 0 HZ3 TRP A 28 3.385 9.964 -3.392 1.00 62.43 H new ATOM 0 HH2 TRP A 28 5.246 10.662 -1.944 1.00 53.24 H new ATOM 440 N ALA A 29 -2.942 12.621 0.535 1.00 4.20 N ATOM 441 CA ALA A 29 -3.314 12.766 1.966 1.00 1.31 C ATOM 442 C ALA A 29 -3.615 11.410 2.665 1.00 15.24 C ATOM 443 O ALA A 29 -3.427 11.277 3.876 1.00 63.43 O ATOM 444 CB ALA A 29 -4.520 13.704 2.084 1.00 63.42 C ATOM 0 H ALA A 29 -3.583 13.095 -0.101 1.00 4.20 H new ATOM 0 HA ALA A 29 -2.452 13.188 2.482 1.00 1.31 H new ATOM 0 HB1 ALA A 29 -4.795 13.812 3.133 1.00 63.42 H new ATOM 0 HB2 ALA A 29 -4.263 14.681 1.674 1.00 63.42 H new ATOM 0 HB3 ALA A 29 -5.361 13.287 1.529 1.00 63.42 H new ATOM 450 N ILE A 30 -4.074 10.411 1.882 1.00 23.11 N ATOM 451 CA ILE A 30 -4.362 9.046 2.402 1.00 54.02 C ATOM 452 C ILE A 30 -3.043 8.282 2.690 1.00 54.32 C ATOM 453 O ILE A 30 -3.035 7.314 3.423 1.00 53.44 O ATOM 454 CB ILE A 30 -5.261 8.214 1.403 1.00 14.24 C ATOM 455 CG1 ILE A 30 -4.417 7.656 0.216 1.00 50.32 C ATOM 456 CG2 ILE A 30 -6.441 9.074 0.895 1.00 22.14 C ATOM 457 CD1 ILE A 30 -5.188 6.976 -0.888 1.00 33.31 C ATOM 0 H ILE A 30 -4.255 10.519 0.884 1.00 23.11 H new ATOM 0 HA ILE A 30 -4.917 9.165 3.332 1.00 54.02 H new ATOM 0 HB ILE A 30 -5.670 7.360 1.942 1.00 14.24 H new ATOM 0 HG12 ILE A 30 -3.851 8.480 -0.219 1.00 50.32 H new ATOM 0 HG13 ILE A 30 -3.692 6.946 0.615 1.00 50.32 H new ATOM 0 HG21 ILE A 30 -7.050 8.486 0.208 1.00 22.14 H new ATOM 0 HG22 ILE A 30 -7.051 9.391 1.741 1.00 22.14 H new ATOM 0 HG23 ILE A 30 -6.055 9.952 0.377 1.00 22.14 H new ATOM 0 HD11 ILE A 30 -4.496 6.630 -1.656 1.00 33.31 H new ATOM 0 HD12 ILE A 30 -5.733 6.124 -0.480 1.00 33.31 H new ATOM 0 HD13 ILE A 30 -5.894 7.681 -1.327 1.00 33.31 H new ATOM 469 N TRP A 31 -1.943 8.716 2.051 1.00 42.20 N ATOM 470 CA TRP A 31 -0.590 8.140 2.255 1.00 74.01 C ATOM 471 C TRP A 31 0.209 8.926 3.305 1.00 72.44 C ATOM 472 O TRP A 31 1.013 8.355 4.041 1.00 3.22 O ATOM 473 CB TRP A 31 0.174 8.130 0.904 1.00 22.44 C ATOM 474 CG TRP A 31 -0.491 7.253 -0.129 1.00 42.33 C ATOM 475 CD1 TRP A 31 -1.222 7.642 -1.221 1.00 0.22 C ATOM 476 CD2 TRP A 31 -0.498 5.821 -0.132 1.00 13.22 C ATOM 477 NE1 TRP A 31 -1.698 6.536 -1.878 1.00 32.22 N ATOM 478 CE2 TRP A 31 -1.260 5.409 -1.231 1.00 52.02 C ATOM 479 CE3 TRP A 31 0.067 4.851 0.704 1.00 50.32 C ATOM 480 CZ2 TRP A 31 -1.470 4.067 -1.520 1.00 14.42 C ATOM 481 CZ3 TRP A 31 -0.137 3.520 0.412 1.00 12.32 C ATOM 482 CH2 TRP A 31 -0.900 3.135 -0.688 1.00 72.02 C ATOM 0 H TRP A 31 -1.961 9.479 1.374 1.00 42.20 H new ATOM 0 HA TRP A 31 -0.705 7.121 2.625 1.00 74.01 H new ATOM 0 HB2 TRP A 31 0.243 9.148 0.522 1.00 22.44 H new ATOM 0 HB3 TRP A 31 1.194 7.782 1.069 1.00 22.44 H new ATOM 0 HD1 TRP A 31 -1.397 8.665 -1.519 1.00 0.22 H new ATOM 0 HE1 TRP A 31 -2.283 6.550 -2.713 1.00 32.22 H new ATOM 0 HE3 TRP A 31 0.653 5.141 1.564 1.00 50.32 H new ATOM 0 HZ2 TRP A 31 -2.062 3.766 -2.371 1.00 14.42 H new ATOM 0 HZ3 TRP A 31 0.301 2.763 1.046 1.00 12.32 H new ATOM 0 HH2 TRP A 31 -1.046 2.084 -0.890 1.00 72.02 H new ATOM 493 N GLU A 32 -0.031 10.243 3.340 1.00 31.23 N ATOM 494 CA GLU A 32 0.702 11.192 4.195 1.00 43.42 C ATOM 495 C GLU A 32 0.233 11.131 5.664 1.00 54.45 C ATOM 496 O GLU A 32 1.039 11.258 6.595 1.00 13.41 O ATOM 497 CB GLU A 32 0.549 12.618 3.601 1.00 3.32 C ATOM 498 CG GLU A 32 1.336 13.720 4.338 1.00 50.10 C ATOM 499 CD GLU A 32 1.463 15.017 3.521 1.00 32.25 C ATOM 500 OE1 GLU A 32 2.440 15.148 2.745 1.00 52.52 O ATOM 501 OE2 GLU A 32 0.600 15.915 3.648 1.00 60.13 O ATOM 0 H GLU A 32 -0.749 10.688 2.768 1.00 31.23 H new ATOM 0 HA GLU A 32 1.757 10.917 4.208 1.00 43.42 H new ATOM 0 HB2 GLU A 32 0.871 12.598 2.560 1.00 3.32 H new ATOM 0 HB3 GLU A 32 -0.508 12.884 3.603 1.00 3.32 H new ATOM 0 HG2 GLU A 32 0.842 13.940 5.284 1.00 50.10 H new ATOM 0 HG3 GLU A 32 2.333 13.349 4.577 1.00 50.10 H new ATOM 508 N ASP A 33 -1.079 10.932 5.861 1.00 55.41 N ATOM 509 CA ASP A 33 -1.691 10.880 7.204 1.00 71.43 C ATOM 510 C ASP A 33 -2.081 9.431 7.607 1.00 72.32 C ATOM 511 O ASP A 33 -2.837 8.776 6.876 1.00 44.15 O ATOM 512 CB ASP A 33 -2.923 11.802 7.237 1.00 4.03 C ATOM 513 CG ASP A 33 -2.555 13.275 6.998 1.00 4.11 C ATOM 514 OD1 ASP A 33 -2.171 13.964 7.968 1.00 3.45 O ATOM 515 OD2 ASP A 33 -2.640 13.746 5.845 1.00 55.22 O ATOM 0 H ASP A 33 -1.746 10.803 5.100 1.00 55.41 H new ATOM 0 HA ASP A 33 -0.955 11.225 7.930 1.00 71.43 H new ATOM 0 HB2 ASP A 33 -3.636 11.480 6.478 1.00 4.03 H new ATOM 0 HB3 ASP A 33 -3.420 11.706 8.202 1.00 4.03 H new ATOM 520 N PRO A 34 -1.565 8.913 8.781 1.00 15.32 N ATOM 521 CA PRO A 34 -1.921 7.567 9.310 1.00 52.20 C ATOM 522 C PRO A 34 -3.442 7.338 9.481 1.00 75.32 C ATOM 523 O PRO A 34 -3.940 6.268 9.145 1.00 12.32 O ATOM 524 CB PRO A 34 -1.198 7.505 10.686 1.00 15.54 C ATOM 525 CG PRO A 34 -0.800 8.924 10.989 1.00 2.24 C ATOM 526 CD PRO A 34 -0.553 9.568 9.649 1.00 24.14 C ATOM 0 HA PRO A 34 -1.617 6.787 8.612 1.00 52.20 H new ATOM 0 HB2 PRO A 34 -1.856 7.107 11.459 1.00 15.54 H new ATOM 0 HB3 PRO A 34 -0.326 6.852 10.643 1.00 15.54 H new ATOM 0 HG2 PRO A 34 -1.587 9.444 11.535 1.00 2.24 H new ATOM 0 HG3 PRO A 34 0.095 8.956 11.611 1.00 2.24 H new ATOM 0 HD2 PRO A 34 -0.691 10.649 9.687 1.00 24.14 H new ATOM 0 HD3 PRO A 34 0.462 9.389 9.294 1.00 24.14 H new ATOM 534 N ARG A 35 -4.163 8.356 10.010 1.00 72.02 N ATOM 535 CA ARG A 35 -5.641 8.294 10.206 1.00 15.40 C ATOM 536 C ARG A 35 -6.389 8.050 8.869 1.00 31.42 C ATOM 537 O ARG A 35 -7.289 7.205 8.794 1.00 72.21 O ATOM 538 CB ARG A 35 -6.168 9.598 10.889 1.00 41.12 C ATOM 539 CG ARG A 35 -6.165 9.622 12.445 1.00 64.33 C ATOM 540 CD ARG A 35 -4.764 9.552 13.095 1.00 31.42 C ATOM 541 NE ARG A 35 -4.184 8.195 13.088 1.00 24.45 N ATOM 542 CZ ARG A 35 -3.107 7.837 13.740 1.00 63.13 C ATOM 543 NH1 ARG A 35 -2.484 8.651 14.526 1.00 35.24 N ATOM 544 NH2 ARG A 35 -2.657 6.644 13.597 1.00 24.02 N ATOM 0 H ARG A 35 -3.746 9.237 10.312 1.00 72.02 H new ATOM 0 HA ARG A 35 -5.843 7.447 10.862 1.00 15.40 H new ATOM 0 HB2 ARG A 35 -5.566 10.435 10.535 1.00 41.12 H new ATOM 0 HB3 ARG A 35 -7.188 9.772 10.548 1.00 41.12 H new ATOM 0 HG2 ARG A 35 -6.660 10.533 12.781 1.00 64.33 H new ATOM 0 HG3 ARG A 35 -6.760 8.784 12.808 1.00 64.33 H new ATOM 0 HD2 ARG A 35 -4.092 10.229 12.568 1.00 31.42 H new ATOM 0 HD3 ARG A 35 -4.830 9.906 14.124 1.00 31.42 H new ATOM 0 HE ARG A 35 -4.658 7.482 12.533 1.00 24.45 H new ATOM 0 HH11 ARG A 35 -2.829 9.603 14.652 1.00 35.24 H new ATOM 0 HH12 ARG A 35 -1.647 8.342 15.020 1.00 35.24 H new ATOM 0 HH21 ARG A 35 -3.138 5.988 12.981 1.00 24.02 H new ATOM 0 HH22 ARG A 35 -1.819 6.352 14.099 1.00 24.02 H new ATOM 558 N GLN A 36 -5.993 8.792 7.820 1.00 33.54 N ATOM 559 CA GLN A 36 -6.620 8.691 6.480 1.00 53.34 C ATOM 560 C GLN A 36 -6.166 7.411 5.733 1.00 41.24 C ATOM 561 O GLN A 36 -6.852 6.960 4.821 1.00 42.54 O ATOM 562 CB GLN A 36 -6.325 9.967 5.638 1.00 1.22 C ATOM 563 CG GLN A 36 -6.720 11.290 6.343 1.00 41.54 C ATOM 564 CD GLN A 36 -6.706 12.507 5.412 1.00 23.24 C ATOM 565 OE1 GLN A 36 -7.718 12.861 4.823 1.00 34.24 O ATOM 566 NE2 GLN A 36 -5.563 13.139 5.253 1.00 10.24 N ATOM 0 H GLN A 36 -5.237 9.474 7.870 1.00 33.54 H new ATOM 0 HA GLN A 36 -7.698 8.617 6.622 1.00 53.34 H new ATOM 0 HB2 GLN A 36 -5.261 9.996 5.401 1.00 1.22 H new ATOM 0 HB3 GLN A 36 -6.860 9.897 4.691 1.00 1.22 H new ATOM 0 HG2 GLN A 36 -7.717 11.181 6.770 1.00 41.54 H new ATOM 0 HG3 GLN A 36 -6.035 11.469 7.172 1.00 41.54 H new ATOM 0 HE21 GLN A 36 -4.733 12.825 5.755 1.00 10.24 H new ATOM 0 HE22 GLN A 36 -5.507 13.943 4.628 1.00 10.24 H new ATOM 575 N LEU A 37 -5.006 6.850 6.133 1.00 42.13 N ATOM 576 CA LEU A 37 -4.468 5.581 5.573 1.00 71.42 C ATOM 577 C LEU A 37 -5.225 4.356 6.114 1.00 62.44 C ATOM 578 O LEU A 37 -5.733 3.543 5.345 1.00 25.52 O ATOM 579 CB LEU A 37 -2.953 5.478 5.908 1.00 73.12 C ATOM 580 CG LEU A 37 -2.198 4.176 5.479 1.00 22.21 C ATOM 581 CD1 LEU A 37 -2.325 3.872 3.968 1.00 71.35 C ATOM 582 CD2 LEU A 37 -0.719 4.266 5.891 1.00 25.42 C ATOM 0 H LEU A 37 -4.412 7.260 6.853 1.00 42.13 H new ATOM 0 HA LEU A 37 -4.606 5.592 4.492 1.00 71.42 H new ATOM 0 HB2 LEU A 37 -2.449 6.326 5.444 1.00 73.12 H new ATOM 0 HB3 LEU A 37 -2.840 5.591 6.986 1.00 73.12 H new ATOM 0 HG LEU A 37 -2.674 3.345 6.000 1.00 22.21 H new ATOM 0 HD11 LEU A 37 -1.780 2.957 3.734 1.00 71.35 H new ATOM 0 HD12 LEU A 37 -3.376 3.744 3.710 1.00 71.35 H new ATOM 0 HD13 LEU A 37 -1.908 4.700 3.394 1.00 71.35 H new ATOM 0 HD21 LEU A 37 -0.201 3.356 5.589 1.00 25.42 H new ATOM 0 HD22 LEU A 37 -0.257 5.125 5.404 1.00 25.42 H new ATOM 0 HD23 LEU A 37 -0.649 4.381 6.973 1.00 25.42 H new ATOM 594 N GLU A 38 -5.349 4.265 7.450 1.00 10.22 N ATOM 595 CA GLU A 38 -6.026 3.130 8.130 1.00 74.41 C ATOM 596 C GLU A 38 -7.563 3.165 7.955 1.00 10.40 C ATOM 597 O GLU A 38 -8.265 2.235 8.368 1.00 1.23 O ATOM 598 CB GLU A 38 -5.639 3.121 9.625 1.00 34.02 C ATOM 599 CG GLU A 38 -6.101 4.353 10.419 1.00 73.04 C ATOM 600 CD GLU A 38 -5.549 4.372 11.849 1.00 52.04 C ATOM 601 OE1 GLU A 38 -6.176 3.773 12.745 1.00 1.44 O ATOM 602 OE2 GLU A 38 -4.484 4.983 12.085 1.00 64.43 O ATOM 0 H GLU A 38 -4.987 4.969 8.093 1.00 10.22 H new ATOM 0 HA GLU A 38 -5.686 2.207 7.660 1.00 74.41 H new ATOM 0 HB2 GLU A 38 -6.059 2.229 10.089 1.00 34.02 H new ATOM 0 HB3 GLU A 38 -4.555 3.041 9.704 1.00 34.02 H new ATOM 0 HG2 GLU A 38 -5.783 5.256 9.899 1.00 73.04 H new ATOM 0 HG3 GLU A 38 -7.190 4.371 10.453 1.00 73.04 H new ATOM 609 N ARG A 39 -8.069 4.251 7.337 1.00 41.34 N ATOM 610 CA ARG A 39 -9.487 4.400 6.955 1.00 3.02 C ATOM 611 C ARG A 39 -9.894 3.356 5.877 1.00 53.11 C ATOM 612 O ARG A 39 -11.050 2.917 5.813 1.00 21.04 O ATOM 613 CB ARG A 39 -9.714 5.850 6.438 1.00 72.44 C ATOM 614 CG ARG A 39 -11.163 6.165 6.006 1.00 74.14 C ATOM 615 CD ARG A 39 -11.375 7.628 5.567 1.00 51.43 C ATOM 616 NE ARG A 39 -11.043 8.607 6.617 1.00 63.43 N ATOM 617 CZ ARG A 39 -11.370 9.883 6.600 1.00 4.41 C ATOM 618 NH1 ARG A 39 -12.080 10.390 5.637 1.00 44.40 N ATOM 619 NH2 ARG A 39 -11.001 10.640 7.576 1.00 53.53 N ATOM 0 H ARG A 39 -7.498 5.058 7.086 1.00 41.34 H new ATOM 0 HA ARG A 39 -10.116 4.219 7.827 1.00 3.02 H new ATOM 0 HB2 ARG A 39 -9.423 6.550 7.222 1.00 72.44 H new ATOM 0 HB3 ARG A 39 -9.051 6.027 5.591 1.00 72.44 H new ATOM 0 HG2 ARG A 39 -11.439 5.505 5.184 1.00 74.14 H new ATOM 0 HG3 ARG A 39 -11.836 5.942 6.834 1.00 74.14 H new ATOM 0 HD2 ARG A 39 -10.763 7.828 4.687 1.00 51.43 H new ATOM 0 HD3 ARG A 39 -12.415 7.763 5.270 1.00 51.43 H new ATOM 0 HE ARG A 39 -10.517 8.269 7.423 1.00 63.43 H new ATOM 0 HH11 ARG A 39 -12.398 9.797 4.871 1.00 44.40 H new ATOM 0 HH12 ARG A 39 -12.320 11.381 5.648 1.00 44.40 H new ATOM 0 HH21 ARG A 39 -10.462 10.249 8.349 1.00 53.53 H new ATOM 0 HH22 ARG A 39 -11.248 11.630 7.575 1.00 53.53 H new ATOM 633 N TRP A 40 -8.911 2.957 5.052 1.00 64.12 N ATOM 634 CA TRP A 40 -9.120 2.031 3.914 1.00 32.25 C ATOM 635 C TRP A 40 -8.101 0.862 3.911 1.00 30.42 C ATOM 636 O TRP A 40 -8.282 -0.113 3.174 1.00 65.15 O ATOM 637 CB TRP A 40 -9.023 2.831 2.592 1.00 34.13 C ATOM 638 CG TRP A 40 -7.690 3.529 2.375 1.00 13.33 C ATOM 639 CD1 TRP A 40 -7.304 4.754 2.850 1.00 31.41 C ATOM 640 CD2 TRP A 40 -6.576 3.036 1.624 1.00 61.13 C ATOM 641 NE1 TRP A 40 -6.030 5.039 2.436 1.00 52.42 N ATOM 642 CE2 TRP A 40 -5.568 4.004 1.676 1.00 3.41 C ATOM 643 CE3 TRP A 40 -6.347 1.865 0.910 1.00 31.25 C ATOM 644 CZ2 TRP A 40 -4.348 3.834 1.033 1.00 12.44 C ATOM 645 CZ3 TRP A 40 -5.145 1.693 0.271 1.00 13.02 C ATOM 646 CH2 TRP A 40 -4.158 2.673 0.337 1.00 53.12 C ATOM 0 H TRP A 40 -7.944 3.266 5.152 1.00 64.12 H new ATOM 0 HA TRP A 40 -10.110 1.585 4.015 1.00 32.25 H new ATOM 0 HB2 TRP A 40 -9.204 2.153 1.758 1.00 34.13 H new ATOM 0 HB3 TRP A 40 -9.817 3.578 2.575 1.00 34.13 H new ATOM 0 HD1 TRP A 40 -7.915 5.401 3.462 1.00 31.41 H new ATOM 0 HE1 TRP A 40 -5.510 5.888 2.660 1.00 52.42 H new ATOM 0 HE3 TRP A 40 -7.107 1.099 0.859 1.00 31.25 H new ATOM 0 HZ2 TRP A 40 -3.579 4.591 1.081 1.00 12.44 H new ATOM 0 HZ3 TRP A 40 -4.962 0.788 -0.289 1.00 13.02 H new ATOM 0 HH2 TRP A 40 -3.220 2.512 -0.174 1.00 53.12 H new ATOM 657 N TRP A 41 -7.016 0.992 4.706 1.00 1.22 N ATOM 658 CA TRP A 41 -5.900 0.012 4.725 1.00 73.33 C ATOM 659 C TRP A 41 -6.353 -1.330 5.354 1.00 33.12 C ATOM 660 O TRP A 41 -6.403 -1.472 6.585 1.00 60.44 O ATOM 661 CB TRP A 41 -4.673 0.604 5.485 1.00 65.00 C ATOM 662 CG TRP A 41 -3.377 -0.132 5.238 1.00 23.43 C ATOM 663 CD1 TRP A 41 -2.632 -0.864 6.128 1.00 60.51 C ATOM 664 CD2 TRP A 41 -2.681 -0.208 3.986 1.00 40.23 C ATOM 665 NE1 TRP A 41 -1.524 -1.373 5.502 1.00 24.01 N ATOM 666 CE2 TRP A 41 -1.534 -0.986 4.190 1.00 55.40 C ATOM 667 CE3 TRP A 41 -2.919 0.310 2.711 1.00 64.43 C ATOM 668 CZ2 TRP A 41 -0.632 -1.256 3.170 1.00 50.55 C ATOM 669 CZ3 TRP A 41 -2.028 0.043 1.702 1.00 14.33 C ATOM 670 CH2 TRP A 41 -0.893 -0.733 1.932 1.00 4.55 C ATOM 0 H TRP A 41 -6.886 1.773 5.350 1.00 1.22 H new ATOM 0 HA TRP A 41 -5.600 -0.190 3.697 1.00 73.33 H new ATOM 0 HB2 TRP A 41 -4.547 1.646 5.192 1.00 65.00 H new ATOM 0 HB3 TRP A 41 -4.884 0.596 6.554 1.00 65.00 H new ATOM 0 HD1 TRP A 41 -2.882 -1.016 7.168 1.00 60.51 H new ATOM 0 HE1 TRP A 41 -0.807 -1.948 5.944 1.00 24.01 H new ATOM 0 HE3 TRP A 41 -3.794 0.914 2.521 1.00 64.43 H new ATOM 0 HZ2 TRP A 41 0.247 -1.859 3.347 1.00 50.55 H new ATOM 0 HZ3 TRP A 41 -2.209 0.440 0.714 1.00 14.33 H new ATOM 0 HH2 TRP A 41 -0.208 -0.925 1.120 1.00 4.55 H new ATOM 681 N GLY A 42 -6.734 -2.283 4.487 1.00 42.23 N ATOM 682 CA GLY A 42 -7.218 -3.606 4.911 1.00 12.20 C ATOM 683 C GLY A 42 -8.684 -3.862 4.519 1.00 63.44 C ATOM 684 O GLY A 42 -9.444 -2.905 4.316 1.00 14.44 O ATOM 0 H GLY A 42 -6.715 -2.158 3.475 1.00 42.23 H new ATOM 0 HA2 GLY A 42 -6.589 -4.377 4.467 1.00 12.20 H new ATOM 0 HA3 GLY A 42 -7.116 -3.695 5.993 1.00 12.20 H new ATOM 688 N PRO A 43 -9.124 -5.161 4.412 1.00 51.53 N ATOM 689 CA PRO A 43 -10.526 -5.522 4.045 1.00 43.12 C ATOM 690 C PRO A 43 -11.571 -5.102 5.138 1.00 73.33 C ATOM 691 O PRO A 43 -11.177 -4.756 6.260 1.00 4.15 O ATOM 692 CB PRO A 43 -10.447 -7.070 3.864 1.00 51.44 C ATOM 693 CG PRO A 43 -9.299 -7.495 4.726 1.00 1.54 C ATOM 694 CD PRO A 43 -8.284 -6.369 4.642 1.00 12.41 C ATOM 0 HA PRO A 43 -10.875 -5.001 3.153 1.00 43.12 H new ATOM 0 HB2 PRO A 43 -11.374 -7.553 4.173 1.00 51.44 H new ATOM 0 HB3 PRO A 43 -10.280 -7.339 2.821 1.00 51.44 H new ATOM 0 HG2 PRO A 43 -9.621 -7.656 5.755 1.00 1.54 H new ATOM 0 HG3 PRO A 43 -8.872 -8.434 4.374 1.00 1.54 H new ATOM 0 HD2 PRO A 43 -7.702 -6.284 5.559 1.00 12.41 H new ATOM 0 HD3 PRO A 43 -7.576 -6.527 3.828 1.00 12.41 H new ATOM 702 N PRO A 44 -12.926 -5.118 4.830 1.00 4.51 N ATOM 703 CA PRO A 44 -14.003 -4.689 5.792 1.00 41.32 C ATOM 704 C PRO A 44 -13.950 -5.376 7.196 1.00 71.04 C ATOM 705 O PRO A 44 -14.394 -4.796 8.192 1.00 53.03 O ATOM 706 CB PRO A 44 -15.327 -5.053 5.035 1.00 65.42 C ATOM 707 CG PRO A 44 -14.903 -5.975 3.928 1.00 63.32 C ATOM 708 CD PRO A 44 -13.529 -5.503 3.521 1.00 52.30 C ATOM 0 HA PRO A 44 -13.897 -3.633 6.039 1.00 41.32 H new ATOM 0 HB2 PRO A 44 -16.041 -5.538 5.700 1.00 65.42 H new ATOM 0 HB3 PRO A 44 -15.814 -4.161 4.641 1.00 65.42 H new ATOM 0 HG2 PRO A 44 -14.879 -7.011 4.266 1.00 63.32 H new ATOM 0 HG3 PRO A 44 -15.599 -5.930 3.090 1.00 63.32 H new ATOM 0 HD2 PRO A 44 -12.959 -6.289 3.026 1.00 52.30 H new ATOM 0 HD3 PRO A 44 -13.576 -4.660 2.831 1.00 52.30 H new ATOM 716 N THR A 45 -13.409 -6.610 7.256 1.00 13.03 N ATOM 717 CA THR A 45 -13.296 -7.395 8.517 1.00 13.41 C ATOM 718 C THR A 45 -11.945 -7.174 9.253 1.00 15.24 C ATOM 719 O THR A 45 -11.818 -7.528 10.426 1.00 24.31 O ATOM 720 CB THR A 45 -13.492 -8.921 8.235 1.00 54.23 C ATOM 721 OG1 THR A 45 -12.534 -9.366 7.260 1.00 74.25 O ATOM 722 CG2 THR A 45 -14.914 -9.237 7.731 1.00 11.43 C ATOM 0 H THR A 45 -13.038 -7.095 6.439 1.00 13.03 H new ATOM 0 HA THR A 45 -14.088 -7.032 9.173 1.00 13.41 H new ATOM 0 HB THR A 45 -13.343 -9.448 9.178 1.00 54.23 H new ATOM 0 HG1 THR A 45 -12.661 -10.323 7.089 1.00 74.25 H new ATOM 0 HG21 THR A 45 -15.006 -10.308 7.548 1.00 11.43 H new ATOM 0 HG22 THR A 45 -15.642 -8.934 8.483 1.00 11.43 H new ATOM 0 HG23 THR A 45 -15.101 -8.693 6.805 1.00 11.43 H new ATOM 730 N TRP A 46 -10.937 -6.589 8.558 1.00 41.43 N ATOM 731 CA TRP A 46 -9.587 -6.301 9.142 1.00 10.21 C ATOM 732 C TRP A 46 -9.199 -4.792 8.977 1.00 70.23 C ATOM 733 O TRP A 46 -8.442 -4.443 8.059 1.00 55.21 O ATOM 734 CB TRP A 46 -8.496 -7.199 8.472 1.00 63.44 C ATOM 735 CG TRP A 46 -8.643 -8.691 8.688 1.00 72.32 C ATOM 736 CD1 TRP A 46 -9.521 -9.541 8.073 1.00 45.40 C ATOM 737 CD2 TRP A 46 -7.858 -9.511 9.564 1.00 20.43 C ATOM 738 NE1 TRP A 46 -9.355 -10.818 8.545 1.00 40.03 N ATOM 739 CE2 TRP A 46 -8.334 -10.828 9.451 1.00 15.32 C ATOM 740 CE3 TRP A 46 -6.806 -9.254 10.438 1.00 43.51 C ATOM 741 CZ2 TRP A 46 -7.795 -11.884 10.179 1.00 30.43 C ATOM 742 CZ3 TRP A 46 -6.272 -10.301 11.157 1.00 45.32 C ATOM 743 CH2 TRP A 46 -6.762 -11.602 11.026 1.00 31.53 C ATOM 0 H TRP A 46 -11.028 -6.303 7.583 1.00 41.43 H new ATOM 0 HA TRP A 46 -9.638 -6.528 10.207 1.00 10.21 H new ATOM 0 HB2 TRP A 46 -8.501 -7.004 7.400 1.00 63.44 H new ATOM 0 HB3 TRP A 46 -7.520 -6.892 8.847 1.00 63.44 H new ATOM 0 HD1 TRP A 46 -10.241 -9.248 7.323 1.00 45.40 H new ATOM 0 HE1 TRP A 46 -9.906 -11.629 8.264 1.00 40.03 H new ATOM 0 HE3 TRP A 46 -6.416 -8.253 10.551 1.00 43.51 H new ATOM 0 HZ2 TRP A 46 -8.179 -12.888 10.078 1.00 30.43 H new ATOM 0 HZ3 TRP A 46 -5.455 -10.111 11.838 1.00 45.32 H new ATOM 0 HH2 TRP A 46 -6.317 -12.398 11.604 1.00 31.53 H new ATOM 754 N PRO A 47 -9.748 -3.864 9.825 1.00 14.13 N ATOM 755 CA PRO A 47 -9.299 -2.441 9.858 1.00 41.15 C ATOM 756 C PRO A 47 -7.907 -2.263 10.542 1.00 74.23 C ATOM 757 O PRO A 47 -7.689 -2.739 11.665 1.00 12.55 O ATOM 758 CB PRO A 47 -10.422 -1.742 10.673 1.00 22.54 C ATOM 759 CG PRO A 47 -10.952 -2.821 11.578 1.00 1.14 C ATOM 760 CD PRO A 47 -10.883 -4.098 10.764 1.00 75.33 C ATOM 0 HA PRO A 47 -9.159 -2.027 8.859 1.00 41.15 H new ATOM 0 HB2 PRO A 47 -10.033 -0.899 11.244 1.00 22.54 H new ATOM 0 HB3 PRO A 47 -11.203 -1.351 10.020 1.00 22.54 H new ATOM 0 HG2 PRO A 47 -10.354 -2.901 12.486 1.00 1.14 H new ATOM 0 HG3 PRO A 47 -11.975 -2.607 11.888 1.00 1.14 H new ATOM 0 HD2 PRO A 47 -10.705 -4.967 11.398 1.00 75.33 H new ATOM 0 HD3 PRO A 47 -11.814 -4.281 10.228 1.00 75.33 H new ATOM 768 N ALA A 48 -6.972 -1.570 9.857 1.00 31.04 N ATOM 769 CA ALA A 48 -5.629 -1.274 10.410 1.00 11.33 C ATOM 770 C ALA A 48 -5.686 -0.206 11.532 1.00 23.12 C ATOM 771 O ALA A 48 -6.595 0.628 11.567 1.00 42.25 O ATOM 772 CB ALA A 48 -4.678 -0.831 9.291 1.00 54.41 C ATOM 0 H ALA A 48 -7.122 -1.203 8.917 1.00 31.04 H new ATOM 0 HA ALA A 48 -5.248 -2.192 10.857 1.00 11.33 H new ATOM 0 HB1 ALA A 48 -3.696 -0.617 9.712 1.00 54.41 H new ATOM 0 HB2 ALA A 48 -4.590 -1.627 8.552 1.00 54.41 H new ATOM 0 HB3 ALA A 48 -5.071 0.066 8.813 1.00 54.41 H new ATOM 778 N THR A 49 -4.702 -0.249 12.447 1.00 70.31 N ATOM 779 CA THR A 49 -4.603 0.706 13.579 1.00 11.33 C ATOM 780 C THR A 49 -3.141 1.172 13.733 1.00 33.32 C ATOM 781 O THR A 49 -2.315 0.435 14.284 1.00 12.22 O ATOM 782 CB THR A 49 -5.092 0.055 14.922 1.00 43.51 C ATOM 783 OG1 THR A 49 -6.346 -0.614 14.717 1.00 53.24 O ATOM 784 CG2 THR A 49 -5.249 1.094 16.050 1.00 4.03 C ATOM 0 H THR A 49 -3.953 -0.941 12.429 1.00 70.31 H new ATOM 0 HA THR A 49 -5.246 1.559 13.362 1.00 11.33 H new ATOM 0 HB THR A 49 -4.329 -0.661 15.228 1.00 43.51 H new ATOM 0 HG1 THR A 49 -6.643 -1.018 15.559 1.00 53.24 H new ATOM 0 HG21 THR A 49 -5.589 0.596 16.958 1.00 4.03 H new ATOM 0 HG22 THR A 49 -4.289 1.575 16.237 1.00 4.03 H new ATOM 0 HG23 THR A 49 -5.980 1.846 15.753 1.00 4.03 H new ATOM 792 N PHE A 50 -2.817 2.381 13.230 1.00 12.24 N ATOM 793 CA PHE A 50 -1.421 2.884 13.201 1.00 75.15 C ATOM 794 C PHE A 50 -1.005 3.521 14.547 1.00 4.12 C ATOM 795 O PHE A 50 -1.512 4.574 14.941 1.00 14.02 O ATOM 796 CB PHE A 50 -1.203 3.871 12.013 1.00 34.44 C ATOM 797 CG PHE A 50 -1.033 3.166 10.664 1.00 2.21 C ATOM 798 CD1 PHE A 50 -2.116 2.556 10.032 1.00 72.01 C ATOM 799 CD2 PHE A 50 0.219 3.083 10.046 1.00 62.43 C ATOM 800 CE1 PHE A 50 -1.960 1.889 8.830 1.00 3.34 C ATOM 801 CE2 PHE A 50 0.373 2.423 8.841 1.00 50.32 C ATOM 802 CZ PHE A 50 -0.717 1.820 8.237 1.00 32.41 C ATOM 0 H PHE A 50 -3.500 3.029 12.838 1.00 12.24 H new ATOM 0 HA PHE A 50 -0.772 2.022 13.044 1.00 75.15 H new ATOM 0 HB2 PHE A 50 -2.052 4.552 11.955 1.00 34.44 H new ATOM 0 HB3 PHE A 50 -0.320 4.479 12.212 1.00 34.44 H new ATOM 0 HD1 PHE A 50 -3.093 2.605 10.489 1.00 72.01 H new ATOM 0 HD2 PHE A 50 1.077 3.541 10.516 1.00 62.43 H new ATOM 0 HE1 PHE A 50 -2.811 1.423 8.356 1.00 3.34 H new ATOM 0 HE2 PHE A 50 1.344 2.378 8.371 1.00 50.32 H new ATOM 0 HZ PHE A 50 -0.594 1.295 7.301 1.00 32.41 H new ATOM 812 N GLU A 51 -0.091 2.840 15.253 1.00 63.24 N ATOM 813 CA GLU A 51 0.583 3.376 16.453 1.00 63.24 C ATOM 814 C GLU A 51 1.604 4.447 16.063 1.00 72.11 C ATOM 815 O GLU A 51 1.765 5.462 16.754 1.00 73.25 O ATOM 816 CB GLU A 51 1.282 2.227 17.228 1.00 13.24 C ATOM 817 CG GLU A 51 0.336 1.085 17.662 1.00 31.41 C ATOM 818 CD GLU A 51 -0.846 1.558 18.536 1.00 35.02 C ATOM 819 OE1 GLU A 51 -0.607 2.023 19.673 1.00 3.14 O ATOM 820 OE2 GLU A 51 -2.015 1.477 18.090 1.00 12.42 O ATOM 0 H GLU A 51 0.206 1.895 15.009 1.00 63.24 H new ATOM 0 HA GLU A 51 -0.167 3.834 17.098 1.00 63.24 H new ATOM 0 HB2 GLU A 51 2.072 1.811 16.603 1.00 13.24 H new ATOM 0 HB3 GLU A 51 1.762 2.642 18.114 1.00 13.24 H new ATOM 0 HG2 GLU A 51 -0.056 0.592 16.773 1.00 31.41 H new ATOM 0 HG3 GLU A 51 0.909 0.340 18.214 1.00 31.41 H new ATOM 827 N THR A 52 2.290 4.206 14.937 1.00 24.22 N ATOM 828 CA THR A 52 3.292 5.131 14.393 1.00 71.43 C ATOM 829 C THR A 52 3.162 5.221 12.860 1.00 61.30 C ATOM 830 O THR A 52 2.736 4.257 12.212 1.00 14.24 O ATOM 831 CB THR A 52 4.741 4.669 14.779 1.00 3.23 C ATOM 832 OG1 THR A 52 4.783 4.288 16.164 1.00 33.43 O ATOM 833 CG2 THR A 52 5.771 5.781 14.558 1.00 52.12 C ATOM 0 H THR A 52 2.165 3.362 14.377 1.00 24.22 H new ATOM 0 HA THR A 52 3.114 6.116 14.823 1.00 71.43 H new ATOM 0 HB THR A 52 4.989 3.824 14.137 1.00 3.23 H new ATOM 0 HG1 THR A 52 5.690 4.000 16.397 1.00 33.43 H new ATOM 0 HG21 THR A 52 6.761 5.421 14.837 1.00 52.12 H new ATOM 0 HG22 THR A 52 5.773 6.071 13.507 1.00 52.12 H new ATOM 0 HG23 THR A 52 5.512 6.644 15.172 1.00 52.12 H new ATOM 841 N HIS A 53 3.490 6.396 12.301 1.00 12.42 N ATOM 842 CA HIS A 53 3.607 6.606 10.846 1.00 61.25 C ATOM 843 C HIS A 53 4.487 7.848 10.580 1.00 71.41 C ATOM 844 O HIS A 53 4.006 8.986 10.551 1.00 1.21 O ATOM 845 CB HIS A 53 2.200 6.729 10.211 1.00 52.05 C ATOM 846 CG HIS A 53 2.166 6.933 8.718 1.00 23.45 C ATOM 847 ND1 HIS A 53 2.336 8.178 8.173 1.00 3.24 N ATOM 848 CD2 HIS A 53 1.939 6.045 7.715 1.00 61.01 C ATOM 849 CE1 HIS A 53 2.205 8.033 6.877 1.00 11.24 C ATOM 850 NE2 HIS A 53 1.962 6.761 6.547 1.00 45.00 N ATOM 0 H HIS A 53 3.683 7.235 12.848 1.00 12.42 H new ATOM 0 HA HIS A 53 4.091 5.749 10.378 1.00 61.25 H new ATOM 0 HB2 HIS A 53 1.636 5.827 10.448 1.00 52.05 H new ATOM 0 HB3 HIS A 53 1.681 7.563 10.684 1.00 52.05 H new ATOM 0 HD2 HIS A 53 1.773 4.983 7.818 1.00 61.01 H new ATOM 0 HE1 HIS A 53 2.284 8.841 6.165 1.00 11.24 H new ATOM 0 HE2 HIS A 53 1.821 6.394 5.606 1.00 45.00 H new ATOM 858 N GLU A 54 5.798 7.605 10.459 1.00 64.43 N ATOM 859 CA GLU A 54 6.811 8.650 10.241 1.00 11.52 C ATOM 860 C GLU A 54 6.984 8.876 8.737 1.00 74.11 C ATOM 861 O GLU A 54 7.776 8.176 8.096 1.00 72.51 O ATOM 862 CB GLU A 54 8.165 8.231 10.884 1.00 13.45 C ATOM 863 CG GLU A 54 8.040 7.810 12.350 1.00 32.23 C ATOM 864 CD GLU A 54 9.358 7.320 12.976 1.00 3.10 C ATOM 865 OE1 GLU A 54 9.768 6.166 12.699 1.00 62.24 O ATOM 866 OE2 GLU A 54 9.985 8.079 13.747 1.00 43.43 O ATOM 0 H GLU A 54 6.192 6.666 10.510 1.00 64.43 H new ATOM 0 HA GLU A 54 6.483 9.577 10.711 1.00 11.52 H new ATOM 0 HB2 GLU A 54 8.590 7.406 10.312 1.00 13.45 H new ATOM 0 HB3 GLU A 54 8.865 9.063 10.812 1.00 13.45 H new ATOM 0 HG2 GLU A 54 7.667 8.655 12.929 1.00 32.23 H new ATOM 0 HG3 GLU A 54 7.296 7.017 12.427 1.00 32.23 H new ATOM 873 N PHE A 55 6.209 9.817 8.176 1.00 40.41 N ATOM 874 CA PHE A 55 6.226 10.125 6.740 1.00 13.51 C ATOM 875 C PHE A 55 7.471 10.984 6.375 1.00 63.13 C ATOM 876 O PHE A 55 7.366 12.151 5.976 1.00 2.23 O ATOM 877 CB PHE A 55 4.895 10.826 6.354 1.00 43.14 C ATOM 878 CG PHE A 55 4.571 10.747 4.865 1.00 14.14 C ATOM 879 CD1 PHE A 55 4.225 9.528 4.295 1.00 72.41 C ATOM 880 CD2 PHE A 55 4.600 11.871 4.042 1.00 41.04 C ATOM 881 CE1 PHE A 55 3.919 9.427 2.953 1.00 15.12 C ATOM 882 CE2 PHE A 55 4.294 11.771 2.699 1.00 63.44 C ATOM 883 CZ PHE A 55 3.950 10.545 2.157 1.00 15.20 C ATOM 0 H PHE A 55 5.551 10.387 8.708 1.00 40.41 H new ATOM 0 HA PHE A 55 6.306 9.202 6.165 1.00 13.51 H new ATOM 0 HB2 PHE A 55 4.079 10.375 6.919 1.00 43.14 H new ATOM 0 HB3 PHE A 55 4.947 11.874 6.651 1.00 43.14 H new ATOM 0 HD1 PHE A 55 4.195 8.643 4.914 1.00 72.41 H new ATOM 0 HD2 PHE A 55 4.865 12.831 4.459 1.00 41.04 H new ATOM 0 HE1 PHE A 55 3.655 8.469 2.529 1.00 15.12 H new ATOM 0 HE2 PHE A 55 4.323 12.650 2.072 1.00 63.44 H new ATOM 0 HZ PHE A 55 3.706 10.468 1.108 1.00 15.20 H new ATOM 893 N THR A 56 8.659 10.381 6.552 1.00 64.32 N ATOM 894 CA THR A 56 9.959 11.006 6.223 1.00 1.14 C ATOM 895 C THR A 56 10.906 9.978 5.548 1.00 11.12 C ATOM 896 O THR A 56 10.676 8.764 5.629 1.00 64.24 O ATOM 897 CB THR A 56 10.641 11.606 7.504 1.00 42.54 C ATOM 898 OG1 THR A 56 11.864 12.278 7.149 1.00 54.31 O ATOM 899 CG2 THR A 56 10.932 10.531 8.577 1.00 72.02 C ATOM 0 H THR A 56 8.749 9.438 6.930 1.00 64.32 H new ATOM 0 HA THR A 56 9.767 11.820 5.524 1.00 1.14 H new ATOM 0 HB THR A 56 9.937 12.318 7.934 1.00 42.54 H new ATOM 0 HG1 THR A 56 12.279 12.649 7.955 1.00 54.31 H new ATOM 0 HG21 THR A 56 11.403 10.998 9.442 1.00 72.02 H new ATOM 0 HG22 THR A 56 9.998 10.060 8.883 1.00 72.02 H new ATOM 0 HG23 THR A 56 11.600 9.776 8.163 1.00 72.02 H new ATOM 907 N VAL A 57 11.962 10.476 4.884 1.00 62.41 N ATOM 908 CA VAL A 57 13.007 9.635 4.254 1.00 14.41 C ATOM 909 C VAL A 57 13.823 8.895 5.354 1.00 54.54 C ATOM 910 O VAL A 57 14.564 9.520 6.120 1.00 72.30 O ATOM 911 CB VAL A 57 13.932 10.532 3.334 1.00 71.44 C ATOM 912 CG1 VAL A 57 15.193 9.786 2.830 1.00 71.14 C ATOM 913 CG2 VAL A 57 13.110 11.095 2.141 1.00 31.42 C ATOM 0 H VAL A 57 12.120 11.477 4.766 1.00 62.41 H new ATOM 0 HA VAL A 57 12.544 8.878 3.621 1.00 14.41 H new ATOM 0 HB VAL A 57 14.292 11.357 3.949 1.00 71.44 H new ATOM 0 HG11 VAL A 57 15.786 10.454 2.205 1.00 71.14 H new ATOM 0 HG12 VAL A 57 15.790 9.463 3.683 1.00 71.14 H new ATOM 0 HG13 VAL A 57 14.892 8.916 2.247 1.00 71.14 H new ATOM 0 HG21 VAL A 57 13.754 11.711 1.514 1.00 31.42 H new ATOM 0 HG22 VAL A 57 12.712 10.269 1.552 1.00 31.42 H new ATOM 0 HG23 VAL A 57 12.287 11.701 2.520 1.00 31.42 H new ATOM 923 N GLY A 58 13.629 7.564 5.444 1.00 62.43 N ATOM 924 CA GLY A 58 14.275 6.725 6.476 1.00 3.45 C ATOM 925 C GLY A 58 13.401 6.466 7.720 1.00 73.31 C ATOM 926 O GLY A 58 13.895 5.944 8.730 1.00 52.35 O ATOM 0 H GLY A 58 13.025 7.042 4.809 1.00 62.43 H new ATOM 0 HA2 GLY A 58 14.547 5.768 6.032 1.00 3.45 H new ATOM 0 HA3 GLY A 58 15.202 7.205 6.791 1.00 3.45 H new ATOM 930 N GLY A 59 12.100 6.843 7.654 1.00 52.52 N ATOM 931 CA GLY A 59 11.147 6.617 8.763 1.00 70.54 C ATOM 932 C GLY A 59 10.432 5.259 8.698 1.00 71.33 C ATOM 933 O GLY A 59 10.425 4.605 7.654 1.00 72.22 O ATOM 0 H GLY A 59 11.689 7.305 6.843 1.00 52.52 H new ATOM 0 HA2 GLY A 59 11.682 6.691 9.710 1.00 70.54 H new ATOM 0 HA3 GLY A 59 10.400 7.411 8.756 1.00 70.54 H new ATOM 937 N LYS A 60 9.822 4.838 9.827 1.00 64.22 N ATOM 938 CA LYS A 60 9.007 3.589 9.914 1.00 64.34 C ATOM 939 C LYS A 60 7.513 3.918 10.160 1.00 5.44 C ATOM 940 O LYS A 60 7.159 5.045 10.469 1.00 34.54 O ATOM 941 CB LYS A 60 9.522 2.648 11.064 1.00 22.51 C ATOM 942 CG LYS A 60 10.446 1.478 10.631 1.00 30.31 C ATOM 943 CD LYS A 60 11.903 1.879 10.332 1.00 75.22 C ATOM 944 CE LYS A 60 12.799 0.633 10.137 1.00 20.14 C ATOM 945 NZ LYS A 60 14.242 0.973 10.081 1.00 4.41 N ATOM 0 H LYS A 60 9.876 5.349 10.708 1.00 64.22 H new ATOM 0 HA LYS A 60 9.112 3.073 8.960 1.00 64.34 H new ATOM 0 HB2 LYS A 60 10.059 3.258 11.791 1.00 22.51 H new ATOM 0 HB3 LYS A 60 8.656 2.229 11.577 1.00 22.51 H new ATOM 0 HG2 LYS A 60 10.446 0.724 11.418 1.00 30.31 H new ATOM 0 HG3 LYS A 60 10.023 1.010 9.742 1.00 30.31 H new ATOM 0 HD2 LYS A 60 11.936 2.497 9.435 1.00 75.22 H new ATOM 0 HD3 LYS A 60 12.291 2.485 11.151 1.00 75.22 H new ATOM 0 HE2 LYS A 60 12.626 -0.067 10.955 1.00 20.14 H new ATOM 0 HE3 LYS A 60 12.513 0.124 9.216 1.00 20.14 H new ATOM 0 HZ1 LYS A 60 14.710 0.383 9.364 1.00 4.41 H new ATOM 0 HZ2 LYS A 60 14.353 1.976 9.830 1.00 4.41 H new ATOM 0 HZ3 LYS A 60 14.676 0.798 11.010 1.00 4.41 H new ATOM 959 N ALA A 61 6.653 2.887 10.055 1.00 33.15 N ATOM 960 CA ALA A 61 5.219 2.979 10.429 1.00 74.22 C ATOM 961 C ALA A 61 4.773 1.686 11.146 1.00 75.30 C ATOM 962 O ALA A 61 4.934 0.602 10.610 1.00 71.31 O ATOM 963 CB ALA A 61 4.340 3.253 9.194 1.00 32.21 C ATOM 0 H ALA A 61 6.927 1.967 9.710 1.00 33.15 H new ATOM 0 HA ALA A 61 5.095 3.818 11.114 1.00 74.22 H new ATOM 0 HB1 ALA A 61 3.295 3.315 9.498 1.00 32.21 H new ATOM 0 HB2 ALA A 61 4.641 4.194 8.735 1.00 32.21 H new ATOM 0 HB3 ALA A 61 4.461 2.443 8.474 1.00 32.21 H new ATOM 969 N ALA A 62 4.199 1.814 12.352 1.00 32.53 N ATOM 970 CA ALA A 62 3.757 0.661 13.177 1.00 74.12 C ATOM 971 C ALA A 62 2.225 0.553 13.149 1.00 20.21 C ATOM 972 O ALA A 62 1.545 1.559 13.352 1.00 41.44 O ATOM 973 CB ALA A 62 4.239 0.826 14.629 1.00 55.45 C ATOM 0 H ALA A 62 4.024 2.718 12.790 1.00 32.53 H new ATOM 0 HA ALA A 62 4.190 -0.250 12.763 1.00 74.12 H new ATOM 0 HB1 ALA A 62 3.907 -0.027 15.222 1.00 55.45 H new ATOM 0 HB2 ALA A 62 5.328 0.879 14.647 1.00 55.45 H new ATOM 0 HB3 ALA A 62 3.824 1.743 15.048 1.00 55.45 H new ATOM 979 N TYR A 63 1.687 -0.659 12.908 1.00 31.35 N ATOM 980 CA TYR A 63 0.222 -0.889 12.903 1.00 54.35 C ATOM 981 C TYR A 63 -0.155 -2.355 13.187 1.00 4.23 C ATOM 982 O TYR A 63 0.707 -3.220 13.342 1.00 12.23 O ATOM 983 CB TYR A 63 -0.423 -0.417 11.568 1.00 53.54 C ATOM 984 CG TYR A 63 -0.040 -1.204 10.297 1.00 44.32 C ATOM 985 CD1 TYR A 63 1.141 -0.928 9.598 1.00 52.21 C ATOM 986 CD2 TYR A 63 -0.894 -2.181 9.764 1.00 35.44 C ATOM 987 CE1 TYR A 63 1.456 -1.596 8.428 1.00 4.13 C ATOM 988 CE2 TYR A 63 -0.574 -2.858 8.604 1.00 4.22 C ATOM 989 CZ TYR A 63 0.596 -2.555 7.934 1.00 13.22 C ATOM 990 OH TYR A 63 0.895 -3.211 6.758 1.00 13.43 O ATOM 0 H TYR A 63 2.240 -1.494 12.714 1.00 31.35 H new ATOM 0 HA TYR A 63 -0.178 -0.288 13.719 1.00 54.35 H new ATOM 0 HB2 TYR A 63 -1.506 -0.458 11.680 1.00 53.54 H new ATOM 0 HB3 TYR A 63 -0.158 0.629 11.413 1.00 53.54 H new ATOM 0 HD1 TYR A 63 1.819 -0.179 9.979 1.00 52.21 H new ATOM 0 HD2 TYR A 63 -1.820 -2.408 10.271 1.00 35.44 H new ATOM 0 HE1 TYR A 63 2.372 -1.367 7.903 1.00 4.13 H new ATOM 0 HE2 TYR A 63 -1.235 -3.621 8.222 1.00 4.22 H new ATOM 0 HH TYR A 63 0.185 -3.855 6.553 1.00 13.43 H new ATOM 1000 N TYR A 64 -1.476 -2.596 13.298 1.00 74.12 N ATOM 1001 CA TYR A 64 -2.066 -3.947 13.381 1.00 10.25 C ATOM 1002 C TYR A 64 -3.529 -3.923 12.878 1.00 63.31 C ATOM 1003 O TYR A 64 -4.285 -2.998 13.197 1.00 5.43 O ATOM 1004 CB TYR A 64 -1.971 -4.515 14.833 1.00 3.04 C ATOM 1005 CG TYR A 64 -2.510 -3.580 15.932 1.00 34.10 C ATOM 1006 CD1 TYR A 64 -1.683 -2.627 16.541 1.00 24.32 C ATOM 1007 CD2 TYR A 64 -3.844 -3.643 16.355 1.00 1.32 C ATOM 1008 CE1 TYR A 64 -2.166 -1.786 17.517 1.00 51.43 C ATOM 1009 CE2 TYR A 64 -4.330 -2.795 17.331 1.00 14.33 C ATOM 1010 CZ TYR A 64 -3.487 -1.870 17.911 1.00 4.53 C ATOM 1011 OH TYR A 64 -3.968 -1.013 18.883 1.00 32.12 O ATOM 0 H TYR A 64 -2.171 -1.850 13.333 1.00 74.12 H new ATOM 0 HA TYR A 64 -1.495 -4.614 12.736 1.00 10.25 H new ATOM 0 HB2 TYR A 64 -2.519 -5.456 14.876 1.00 3.04 H new ATOM 0 HB3 TYR A 64 -0.928 -4.744 15.050 1.00 3.04 H new ATOM 0 HD1 TYR A 64 -0.649 -2.551 16.239 1.00 24.32 H new ATOM 0 HD2 TYR A 64 -4.506 -4.370 15.909 1.00 1.32 H new ATOM 0 HE1 TYR A 64 -1.511 -1.059 17.975 1.00 51.43 H new ATOM 0 HE2 TYR A 64 -5.364 -2.856 17.638 1.00 14.33 H new ATOM 0 HH TYR A 64 -3.484 -0.162 18.837 1.00 32.12 H new ATOM 1021 N MET A 65 -3.910 -4.929 12.073 1.00 45.34 N ATOM 1022 CA MET A 65 -5.288 -5.077 11.556 1.00 60.53 C ATOM 1023 C MET A 65 -6.138 -5.897 12.548 1.00 32.21 C ATOM 1024 O MET A 65 -5.948 -7.107 12.671 1.00 13.44 O ATOM 1025 CB MET A 65 -5.276 -5.755 10.160 1.00 25.11 C ATOM 1026 CG MET A 65 -4.521 -4.979 9.072 1.00 1.44 C ATOM 1027 SD MET A 65 -4.583 -5.787 7.456 1.00 13.13 S ATOM 1028 CE MET A 65 -3.794 -7.366 7.791 1.00 31.22 C ATOM 0 H MET A 65 -3.275 -5.664 11.761 1.00 45.34 H new ATOM 0 HA MET A 65 -5.731 -4.087 11.450 1.00 60.53 H new ATOM 0 HB2 MET A 65 -4.829 -6.745 10.256 1.00 25.11 H new ATOM 0 HB3 MET A 65 -6.306 -5.901 9.834 1.00 25.11 H new ATOM 0 HG2 MET A 65 -4.944 -3.978 8.988 1.00 1.44 H new ATOM 0 HG3 MET A 65 -3.480 -4.861 9.373 1.00 1.44 H new ATOM 0 HE1 MET A 65 -3.149 -7.635 6.954 1.00 31.22 H new ATOM 0 HE2 MET A 65 -3.197 -7.289 8.699 1.00 31.22 H new ATOM 0 HE3 MET A 65 -4.557 -8.133 7.923 1.00 31.22 H new ATOM 1038 N THR A 66 -7.047 -5.227 13.274 1.00 42.41 N ATOM 1039 CA THR A 66 -7.918 -5.880 14.277 1.00 32.35 C ATOM 1040 C THR A 66 -9.053 -6.670 13.571 1.00 41.23 C ATOM 1041 O THR A 66 -10.013 -6.084 13.075 1.00 21.02 O ATOM 1042 CB THR A 66 -8.507 -4.826 15.276 1.00 71.41 C ATOM 1043 OG1 THR A 66 -7.427 -4.067 15.860 1.00 14.14 O ATOM 1044 CG2 THR A 66 -9.334 -5.482 16.405 1.00 45.00 C ATOM 0 H THR A 66 -7.202 -4.223 13.187 1.00 42.41 H new ATOM 0 HA THR A 66 -7.315 -6.583 14.852 1.00 32.35 H new ATOM 0 HB THR A 66 -9.176 -4.177 14.711 1.00 71.41 H new ATOM 0 HG1 THR A 66 -7.792 -3.406 16.484 1.00 14.14 H new ATOM 0 HG21 THR A 66 -9.720 -4.709 17.070 1.00 45.00 H new ATOM 0 HG22 THR A 66 -10.166 -6.036 15.971 1.00 45.00 H new ATOM 0 HG23 THR A 66 -8.700 -6.164 16.971 1.00 45.00 H new ATOM 1052 N GLY A 67 -8.911 -8.009 13.542 1.00 1.44 N ATOM 1053 CA GLY A 67 -9.752 -8.894 12.714 1.00 12.33 C ATOM 1054 C GLY A 67 -11.205 -9.082 13.177 1.00 31.31 C ATOM 1055 O GLY A 67 -11.644 -8.441 14.137 1.00 2.12 O ATOM 0 H GLY A 67 -8.211 -8.507 14.091 1.00 1.44 H new ATOM 0 HA2 GLY A 67 -9.765 -8.501 11.698 1.00 12.33 H new ATOM 0 HA3 GLY A 67 -9.277 -9.874 12.670 1.00 12.33 H new ATOM 1059 N PRO A 68 -11.985 -10.000 12.503 1.00 25.31 N ATOM 1060 CA PRO A 68 -13.430 -10.227 12.810 1.00 22.23 C ATOM 1061 C PRO A 68 -13.675 -10.848 14.215 1.00 63.13 C ATOM 1062 O PRO A 68 -14.772 -10.735 14.773 1.00 41.03 O ATOM 1063 CB PRO A 68 -13.886 -11.185 11.675 1.00 53.34 C ATOM 1064 CG PRO A 68 -12.632 -11.901 11.260 1.00 21.12 C ATOM 1065 CD PRO A 68 -11.521 -10.878 11.384 1.00 3.35 C ATOM 0 HA PRO A 68 -13.988 -9.292 12.845 1.00 22.23 H new ATOM 0 HB2 PRO A 68 -14.644 -11.884 12.027 1.00 53.34 H new ATOM 0 HB3 PRO A 68 -14.323 -10.634 10.842 1.00 53.34 H new ATOM 0 HG2 PRO A 68 -12.444 -12.764 11.898 1.00 21.12 H new ATOM 0 HG3 PRO A 68 -12.712 -12.272 10.238 1.00 21.12 H new ATOM 0 HD2 PRO A 68 -10.565 -11.348 11.612 1.00 3.35 H new ATOM 0 HD3 PRO A 68 -11.387 -10.315 10.460 1.00 3.35 H new ATOM 1073 N ASP A 69 -12.640 -11.505 14.766 1.00 0.14 N ATOM 1074 CA ASP A 69 -12.666 -12.085 16.130 1.00 1.34 C ATOM 1075 C ASP A 69 -11.837 -11.204 17.115 1.00 4.41 C ATOM 1076 O ASP A 69 -11.667 -11.548 18.292 1.00 13.31 O ATOM 1077 CB ASP A 69 -12.120 -13.539 16.051 1.00 31.25 C ATOM 1078 CG ASP A 69 -12.388 -14.367 17.319 1.00 53.44 C ATOM 1079 OD1 ASP A 69 -13.547 -14.789 17.527 1.00 61.43 O ATOM 1080 OD2 ASP A 69 -11.450 -14.598 18.112 1.00 32.41 O ATOM 0 H ASP A 69 -11.756 -11.652 14.280 1.00 0.14 H new ATOM 0 HA ASP A 69 -13.686 -12.109 16.515 1.00 1.34 H new ATOM 0 HB2 ASP A 69 -12.572 -14.042 15.196 1.00 31.25 H new ATOM 0 HB3 ASP A 69 -11.046 -13.505 15.869 1.00 31.25 H new ATOM 1085 N GLY A 70 -11.376 -10.033 16.625 1.00 1.03 N ATOM 1086 CA GLY A 70 -10.436 -9.174 17.367 1.00 21.53 C ATOM 1087 C GLY A 70 -8.963 -9.529 17.128 1.00 53.52 C ATOM 1088 O GLY A 70 -8.077 -8.947 17.760 1.00 42.31 O ATOM 0 H GLY A 70 -11.643 -9.662 15.713 1.00 1.03 H new ATOM 0 HA2 GLY A 70 -10.602 -8.135 17.081 1.00 21.53 H new ATOM 0 HA3 GLY A 70 -10.651 -9.249 18.433 1.00 21.53 H new ATOM 1092 N THR A 71 -8.709 -10.471 16.198 1.00 74.03 N ATOM 1093 CA THR A 71 -7.352 -10.993 15.896 1.00 75.42 C ATOM 1094 C THR A 71 -6.446 -9.903 15.269 1.00 34.31 C ATOM 1095 O THR A 71 -6.565 -9.593 14.089 1.00 25.11 O ATOM 1096 CB THR A 71 -7.436 -12.228 14.929 1.00 60.52 C ATOM 1097 OG1 THR A 71 -8.387 -13.176 15.447 1.00 61.21 O ATOM 1098 CG2 THR A 71 -6.066 -12.923 14.738 1.00 43.52 C ATOM 0 H THR A 71 -9.441 -10.897 15.629 1.00 74.03 H new ATOM 0 HA THR A 71 -6.909 -11.304 16.842 1.00 75.42 H new ATOM 0 HB THR A 71 -7.754 -11.860 13.953 1.00 60.52 H new ATOM 0 HG1 THR A 71 -8.442 -13.947 14.844 1.00 61.21 H new ATOM 0 HG21 THR A 71 -6.179 -13.770 14.061 1.00 43.52 H new ATOM 0 HG22 THR A 71 -5.354 -12.214 14.316 1.00 43.52 H new ATOM 0 HG23 THR A 71 -5.699 -13.275 15.702 1.00 43.52 H new ATOM 1106 N LYS A 72 -5.564 -9.314 16.080 1.00 32.32 N ATOM 1107 CA LYS A 72 -4.668 -8.220 15.648 1.00 22.34 C ATOM 1108 C LYS A 72 -3.460 -8.760 14.837 1.00 61.42 C ATOM 1109 O LYS A 72 -2.526 -9.338 15.404 1.00 43.10 O ATOM 1110 CB LYS A 72 -4.196 -7.426 16.898 1.00 3.33 C ATOM 1111 CG LYS A 72 -5.348 -6.764 17.695 1.00 13.41 C ATOM 1112 CD LYS A 72 -4.883 -6.182 19.049 1.00 74.24 C ATOM 1113 CE LYS A 72 -6.027 -5.500 19.828 1.00 30.14 C ATOM 1114 NZ LYS A 72 -5.612 -5.100 21.199 1.00 75.04 N ATOM 0 H LYS A 72 -5.445 -9.577 17.058 1.00 32.32 H new ATOM 0 HA LYS A 72 -5.218 -7.553 14.985 1.00 22.34 H new ATOM 0 HB2 LYS A 72 -3.651 -8.099 17.559 1.00 3.33 H new ATOM 0 HB3 LYS A 72 -3.495 -6.653 16.582 1.00 3.33 H new ATOM 0 HG2 LYS A 72 -5.788 -5.968 17.095 1.00 13.41 H new ATOM 0 HG3 LYS A 72 -6.132 -7.501 17.871 1.00 13.41 H new ATOM 0 HD2 LYS A 72 -4.461 -6.981 19.658 1.00 74.24 H new ATOM 0 HD3 LYS A 72 -4.086 -5.459 18.875 1.00 74.24 H new ATOM 0 HE2 LYS A 72 -6.363 -4.619 19.280 1.00 30.14 H new ATOM 0 HE3 LYS A 72 -6.877 -6.179 19.891 1.00 30.14 H new ATOM 0 HZ1 LYS A 72 -6.412 -4.646 21.685 1.00 75.04 H new ATOM 0 HZ2 LYS A 72 -5.316 -5.943 21.732 1.00 75.04 H new ATOM 0 HZ3 LYS A 72 -4.818 -4.431 21.140 1.00 75.04 H new ATOM 1128 N ALA A 73 -3.496 -8.566 13.501 1.00 1.30 N ATOM 1129 CA ALA A 73 -2.391 -8.962 12.601 1.00 44.12 C ATOM 1130 C ALA A 73 -1.387 -7.801 12.487 1.00 3.14 C ATOM 1131 O ALA A 73 -1.634 -6.825 11.767 1.00 12.01 O ATOM 1132 CB ALA A 73 -2.916 -9.366 11.214 1.00 23.41 C ATOM 0 H ALA A 73 -4.285 -8.134 13.019 1.00 1.30 H new ATOM 0 HA ALA A 73 -1.890 -9.833 13.023 1.00 44.12 H new ATOM 0 HB1 ALA A 73 -2.079 -9.651 10.577 1.00 23.41 H new ATOM 0 HB2 ALA A 73 -3.599 -10.209 11.315 1.00 23.41 H new ATOM 0 HB3 ALA A 73 -3.443 -8.524 10.765 1.00 23.41 H new ATOM 1138 N ARG A 74 -0.266 -7.914 13.212 1.00 62.35 N ATOM 1139 CA ARG A 74 0.752 -6.847 13.306 1.00 32.40 C ATOM 1140 C ARG A 74 1.448 -6.615 11.930 1.00 65.12 C ATOM 1141 O ARG A 74 1.681 -7.565 11.176 1.00 10.24 O ATOM 1142 CB ARG A 74 1.800 -7.213 14.406 1.00 12.33 C ATOM 1143 CG ARG A 74 2.587 -6.014 15.006 1.00 13.31 C ATOM 1144 CD ARG A 74 1.744 -5.200 16.004 1.00 32.32 C ATOM 1145 NE ARG A 74 2.446 -4.013 16.519 1.00 22.44 N ATOM 1146 CZ ARG A 74 2.092 -3.327 17.591 1.00 44.31 C ATOM 1147 NH1 ARG A 74 1.051 -3.654 18.295 1.00 42.30 N ATOM 1148 NH2 ARG A 74 2.795 -2.303 17.938 1.00 41.13 N ATOM 0 H ARG A 74 -0.035 -8.747 13.753 1.00 62.35 H new ATOM 0 HA ARG A 74 0.259 -5.916 13.585 1.00 32.40 H new ATOM 0 HB2 ARG A 74 1.285 -7.729 15.216 1.00 12.33 H new ATOM 0 HB3 ARG A 74 2.515 -7.918 13.982 1.00 12.33 H new ATOM 0 HG2 ARG A 74 3.481 -6.384 15.507 1.00 13.31 H new ATOM 0 HG3 ARG A 74 2.921 -5.361 14.199 1.00 13.31 H new ATOM 0 HD2 ARG A 74 0.820 -4.886 15.519 1.00 32.32 H new ATOM 0 HD3 ARG A 74 1.463 -5.840 16.840 1.00 32.32 H new ATOM 0 HE ARG A 74 3.270 -3.695 16.008 1.00 22.44 H new ATOM 0 HH11 ARG A 74 0.484 -4.458 18.025 1.00 42.30 H new ATOM 0 HH12 ARG A 74 0.800 -3.107 19.118 1.00 42.30 H new ATOM 0 HH21 ARG A 74 3.610 -2.034 17.387 1.00 41.13 H new ATOM 0 HH22 ARG A 74 2.536 -1.762 18.763 1.00 41.13 H new ATOM 1162 N GLY A 75 1.735 -5.345 11.601 1.00 30.25 N ATOM 1163 CA GLY A 75 2.487 -4.986 10.385 1.00 34.14 C ATOM 1164 C GLY A 75 3.350 -3.736 10.580 1.00 4.54 C ATOM 1165 O GLY A 75 3.144 -2.968 11.525 1.00 13.31 O ATOM 0 H GLY A 75 1.455 -4.543 12.165 1.00 30.25 H new ATOM 0 HA2 GLY A 75 3.123 -5.822 10.095 1.00 34.14 H new ATOM 0 HA3 GLY A 75 1.788 -4.818 9.565 1.00 34.14 H new ATOM 1169 N TRP A 76 4.323 -3.538 9.673 1.00 13.11 N ATOM 1170 CA TRP A 76 5.249 -2.381 9.698 1.00 12.02 C ATOM 1171 C TRP A 76 5.529 -1.859 8.263 1.00 54.10 C ATOM 1172 O TRP A 76 5.394 -2.595 7.287 1.00 14.04 O ATOM 1173 CB TRP A 76 6.589 -2.786 10.391 1.00 12.34 C ATOM 1174 CG TRP A 76 7.347 -3.871 9.651 1.00 2.42 C ATOM 1175 CD1 TRP A 76 7.124 -5.217 9.714 1.00 11.22 C ATOM 1176 CD2 TRP A 76 8.426 -3.693 8.720 1.00 1.10 C ATOM 1177 NE1 TRP A 76 7.965 -5.876 8.866 1.00 43.04 N ATOM 1178 CE2 TRP A 76 8.781 -4.964 8.255 1.00 11.43 C ATOM 1179 CE3 TRP A 76 9.119 -2.576 8.233 1.00 44.40 C ATOM 1180 CZ2 TRP A 76 9.787 -5.157 7.323 1.00 74.04 C ATOM 1181 CZ3 TRP A 76 10.129 -2.769 7.312 1.00 41.31 C ATOM 1182 CH2 TRP A 76 10.453 -4.054 6.862 1.00 13.41 C ATOM 0 H TRP A 76 4.494 -4.177 8.896 1.00 13.11 H new ATOM 0 HA TRP A 76 4.778 -1.579 10.265 1.00 12.02 H new ATOM 0 HB2 TRP A 76 7.225 -1.905 10.479 1.00 12.34 H new ATOM 0 HB3 TRP A 76 6.376 -3.128 11.404 1.00 12.34 H new ATOM 0 HD1 TRP A 76 6.387 -5.692 10.345 1.00 11.22 H new ATOM 0 HE1 TRP A 76 7.983 -6.884 8.713 1.00 43.04 H new ATOM 0 HE3 TRP A 76 8.867 -1.582 8.572 1.00 44.40 H new ATOM 0 HZ2 TRP A 76 10.038 -6.147 6.971 1.00 74.04 H new ATOM 0 HZ3 TRP A 76 10.676 -1.918 6.934 1.00 41.31 H new ATOM 0 HH2 TRP A 76 11.244 -4.177 6.137 1.00 13.41 H new ATOM 1193 N TRP A 77 5.927 -0.580 8.156 1.00 41.13 N ATOM 1194 CA TRP A 77 6.429 0.036 6.898 1.00 24.41 C ATOM 1195 C TRP A 77 7.836 0.635 7.122 1.00 24.24 C ATOM 1196 O TRP A 77 8.256 0.832 8.266 1.00 13.40 O ATOM 1197 CB TRP A 77 5.503 1.180 6.396 1.00 34.30 C ATOM 1198 CG TRP A 77 4.184 0.792 5.764 1.00 55.04 C ATOM 1199 CD1 TRP A 77 3.554 -0.422 5.742 1.00 22.42 C ATOM 1200 CD2 TRP A 77 3.342 1.683 5.032 1.00 71.13 C ATOM 1201 NE1 TRP A 77 2.374 -0.327 5.046 1.00 21.14 N ATOM 1202 CE2 TRP A 77 2.225 0.962 4.601 1.00 20.42 C ATOM 1203 CE3 TRP A 77 3.441 3.033 4.707 1.00 12.35 C ATOM 1204 CZ2 TRP A 77 1.213 1.554 3.853 1.00 62.33 C ATOM 1205 CZ3 TRP A 77 2.443 3.620 3.966 1.00 15.31 C ATOM 1206 CH2 TRP A 77 1.341 2.880 3.549 1.00 5.31 C ATOM 0 H TRP A 77 5.912 0.069 8.943 1.00 41.13 H new ATOM 0 HA TRP A 77 6.454 -0.758 6.151 1.00 24.41 H new ATOM 0 HB2 TRP A 77 5.290 1.834 7.241 1.00 34.30 H new ATOM 0 HB3 TRP A 77 6.062 1.770 5.670 1.00 34.30 H new ATOM 0 HD1 TRP A 77 3.930 -1.323 6.204 1.00 22.42 H new ATOM 0 HE1 TRP A 77 1.716 -1.090 4.886 1.00 21.14 H new ATOM 0 HE3 TRP A 77 4.292 3.612 5.033 1.00 12.35 H new ATOM 0 HZ2 TRP A 77 0.356 0.985 3.524 1.00 62.33 H new ATOM 0 HZ3 TRP A 77 2.515 4.666 3.705 1.00 15.31 H new ATOM 0 HH2 TRP A 77 0.568 3.365 2.971 1.00 5.31 H new ATOM 1217 N GLN A 78 8.550 0.936 6.020 1.00 33.12 N ATOM 1218 CA GLN A 78 9.758 1.790 6.057 1.00 61.42 C ATOM 1219 C GLN A 78 9.885 2.631 4.773 1.00 1.33 C ATOM 1220 O GLN A 78 10.177 2.103 3.699 1.00 13.54 O ATOM 1221 CB GLN A 78 11.051 0.970 6.289 1.00 65.21 C ATOM 1222 CG GLN A 78 12.334 1.838 6.302 1.00 61.23 C ATOM 1223 CD GLN A 78 13.577 1.097 6.768 1.00 4.11 C ATOM 1224 OE1 GLN A 78 13.705 -0.111 6.605 1.00 30.11 O ATOM 1225 NE2 GLN A 78 14.514 1.822 7.343 1.00 63.44 N ATOM 0 H GLN A 78 8.311 0.599 5.087 1.00 33.12 H new ATOM 0 HA GLN A 78 9.637 2.462 6.907 1.00 61.42 H new ATOM 0 HB2 GLN A 78 10.971 0.439 7.237 1.00 65.21 H new ATOM 0 HB3 GLN A 78 11.139 0.215 5.507 1.00 65.21 H new ATOM 0 HG2 GLN A 78 12.509 2.225 5.298 1.00 61.23 H new ATOM 0 HG3 GLN A 78 12.172 2.698 6.951 1.00 61.23 H new ATOM 0 HE21 GLN A 78 14.379 2.826 7.465 1.00 63.44 H new ATOM 0 HE22 GLN A 78 15.374 1.380 7.666 1.00 63.44 H new ATOM 1234 N PHE A 79 9.683 3.945 4.914 1.00 42.11 N ATOM 1235 CA PHE A 79 9.763 4.911 3.804 1.00 22.22 C ATOM 1236 C PHE A 79 11.232 5.150 3.381 1.00 42.44 C ATOM 1237 O PHE A 79 12.080 5.442 4.226 1.00 31.34 O ATOM 1238 CB PHE A 79 9.109 6.246 4.225 1.00 21.43 C ATOM 1239 CG PHE A 79 7.666 6.117 4.702 1.00 75.12 C ATOM 1240 CD1 PHE A 79 7.373 5.892 6.049 1.00 70.45 C ATOM 1241 CD2 PHE A 79 6.603 6.231 3.810 1.00 5.23 C ATOM 1242 CE1 PHE A 79 6.068 5.794 6.487 1.00 3.24 C ATOM 1243 CE2 PHE A 79 5.301 6.130 4.247 1.00 0.03 C ATOM 1244 CZ PHE A 79 5.036 5.915 5.586 1.00 73.32 C ATOM 0 H PHE A 79 9.457 4.376 5.810 1.00 42.11 H new ATOM 0 HA PHE A 79 9.227 4.499 2.949 1.00 22.22 H new ATOM 0 HB2 PHE A 79 9.704 6.693 5.022 1.00 21.43 H new ATOM 0 HB3 PHE A 79 9.140 6.934 3.380 1.00 21.43 H new ATOM 0 HD1 PHE A 79 8.181 5.793 6.759 1.00 70.45 H new ATOM 0 HD2 PHE A 79 6.802 6.401 2.762 1.00 5.23 H new ATOM 0 HE1 PHE A 79 5.858 5.623 7.533 1.00 3.24 H new ATOM 0 HE2 PHE A 79 4.487 6.219 3.543 1.00 0.03 H new ATOM 0 HZ PHE A 79 4.014 5.842 5.927 1.00 73.32 H new ATOM 1254 N THR A 80 11.524 5.009 2.077 1.00 33.12 N ATOM 1255 CA THR A 80 12.869 5.279 1.515 1.00 21.21 C ATOM 1256 C THR A 80 12.908 6.647 0.785 1.00 0.44 C ATOM 1257 O THR A 80 13.646 7.549 1.178 1.00 12.55 O ATOM 1258 CB THR A 80 13.329 4.149 0.526 1.00 21.41 C ATOM 1259 OG1 THR A 80 12.449 4.092 -0.611 1.00 12.41 O ATOM 1260 CG2 THR A 80 13.373 2.764 1.199 1.00 42.12 C ATOM 0 H THR A 80 10.842 4.706 1.382 1.00 33.12 H new ATOM 0 HA THR A 80 13.558 5.302 2.359 1.00 21.21 H new ATOM 0 HB THR A 80 14.340 4.402 0.207 1.00 21.41 H new ATOM 0 HG1 THR A 80 12.900 3.635 -1.351 1.00 12.41 H new ATOM 0 HG21 THR A 80 13.697 2.017 0.474 1.00 42.12 H new ATOM 0 HG22 THR A 80 14.074 2.787 2.034 1.00 42.12 H new ATOM 0 HG23 THR A 80 12.380 2.506 1.566 1.00 42.12 H new ATOM 1268 N THR A 81 12.103 6.788 -0.283 1.00 22.34 N ATOM 1269 CA THR A 81 12.110 7.989 -1.163 1.00 51.02 C ATOM 1270 C THR A 81 10.736 8.687 -1.172 1.00 20.34 C ATOM 1271 O THR A 81 9.781 8.211 -1.795 1.00 61.43 O ATOM 1272 CB THR A 81 12.526 7.605 -2.628 1.00 70.32 C ATOM 1273 OG1 THR A 81 13.830 6.991 -2.624 1.00 53.42 O ATOM 1274 CG2 THR A 81 12.538 8.816 -3.587 1.00 54.54 C ATOM 0 H THR A 81 11.427 6.079 -0.567 1.00 22.34 H new ATOM 0 HA THR A 81 12.845 8.685 -0.759 1.00 51.02 H new ATOM 0 HB THR A 81 11.774 6.906 -2.993 1.00 70.32 H new ATOM 0 HG1 THR A 81 14.082 6.753 -3.541 1.00 53.42 H new ATOM 0 HG21 THR A 81 12.833 8.488 -4.584 1.00 54.54 H new ATOM 0 HG22 THR A 81 11.542 9.256 -3.630 1.00 54.54 H new ATOM 0 HG23 THR A 81 13.248 9.560 -3.225 1.00 54.54 H new ATOM 1282 N ILE A 82 10.644 9.819 -0.454 1.00 3.30 N ATOM 1283 CA ILE A 82 9.454 10.695 -0.460 1.00 54.22 C ATOM 1284 C ILE A 82 9.830 12.054 -1.084 1.00 23.15 C ATOM 1285 O ILE A 82 10.547 12.848 -0.466 1.00 2.45 O ATOM 1286 CB ILE A 82 8.875 10.924 0.989 1.00 60.04 C ATOM 1287 CG1 ILE A 82 8.599 9.558 1.690 1.00 34.35 C ATOM 1288 CG2 ILE A 82 7.593 11.806 0.949 1.00 42.10 C ATOM 1289 CD1 ILE A 82 7.972 9.657 3.070 1.00 43.03 C ATOM 0 H ILE A 82 11.394 10.156 0.150 1.00 3.30 H new ATOM 0 HA ILE A 82 8.680 10.203 -1.048 1.00 54.22 H new ATOM 0 HB ILE A 82 9.623 11.460 1.573 1.00 60.04 H new ATOM 0 HG12 ILE A 82 7.943 8.966 1.052 1.00 34.35 H new ATOM 0 HG13 ILE A 82 9.540 9.014 1.773 1.00 34.35 H new ATOM 0 HG21 ILE A 82 7.216 11.947 1.962 1.00 42.10 H new ATOM 0 HG22 ILE A 82 7.832 12.776 0.513 1.00 42.10 H new ATOM 0 HG23 ILE A 82 6.831 11.314 0.344 1.00 42.10 H new ATOM 0 HD11 ILE A 82 7.820 8.656 3.473 1.00 43.03 H new ATOM 0 HD12 ILE A 82 8.633 10.218 3.731 1.00 43.03 H new ATOM 0 HD13 ILE A 82 7.012 10.169 2.998 1.00 43.03 H new ATOM 1301 N GLU A 83 9.381 12.293 -2.326 1.00 71.35 N ATOM 1302 CA GLU A 83 9.587 13.591 -3.009 1.00 71.31 C ATOM 1303 C GLU A 83 8.344 14.501 -2.856 1.00 0.32 C ATOM 1304 O GLU A 83 8.478 15.686 -2.520 1.00 23.14 O ATOM 1305 CB GLU A 83 9.924 13.384 -4.506 1.00 61.11 C ATOM 1306 CG GLU A 83 11.178 12.536 -4.778 1.00 51.43 C ATOM 1307 CD GLU A 83 11.606 12.545 -6.260 1.00 54.20 C ATOM 1308 OE1 GLU A 83 10.816 12.115 -7.119 1.00 53.25 O ATOM 1309 OE2 GLU A 83 12.738 12.981 -6.569 1.00 33.15 O ATOM 0 H GLU A 83 8.872 11.607 -2.883 1.00 71.35 H new ATOM 0 HA GLU A 83 10.434 14.085 -2.533 1.00 71.31 H new ATOM 0 HB2 GLU A 83 9.071 12.911 -4.993 1.00 61.11 H new ATOM 0 HB3 GLU A 83 10.056 14.361 -4.972 1.00 61.11 H new ATOM 0 HG2 GLU A 83 12.000 12.908 -4.167 1.00 51.43 H new ATOM 0 HG3 GLU A 83 10.989 11.509 -4.467 1.00 51.43 H new ATOM 1316 N ALA A 84 7.147 13.923 -3.123 1.00 62.22 N ATOM 1317 CA ALA A 84 5.829 14.618 -3.051 1.00 21.41 C ATOM 1318 C ALA A 84 5.629 15.671 -4.195 1.00 72.02 C ATOM 1319 O ALA A 84 6.589 16.334 -4.606 1.00 53.22 O ATOM 1320 CB ALA A 84 5.591 15.233 -1.648 1.00 45.42 C ATOM 0 H ALA A 84 7.064 12.945 -3.399 1.00 62.22 H new ATOM 0 HA ALA A 84 5.067 13.856 -3.212 1.00 21.41 H new ATOM 0 HB1 ALA A 84 4.622 15.732 -1.629 1.00 45.42 H new ATOM 0 HB2 ALA A 84 5.607 14.443 -0.897 1.00 45.42 H new ATOM 0 HB3 ALA A 84 6.376 15.957 -1.430 1.00 45.42 H new ATOM 1326 N PRO A 85 4.376 15.865 -4.744 1.00 51.23 N ATOM 1327 CA PRO A 85 3.122 15.207 -4.279 1.00 30.14 C ATOM 1328 C PRO A 85 2.770 13.891 -5.022 1.00 11.44 C ATOM 1329 O PRO A 85 1.669 13.373 -4.852 1.00 22.14 O ATOM 1330 CB PRO A 85 2.090 16.310 -4.587 1.00 0.42 C ATOM 1331 CG PRO A 85 2.565 16.906 -5.890 1.00 64.01 C ATOM 1332 CD PRO A 85 4.088 16.783 -5.886 1.00 30.10 C ATOM 0 HA PRO A 85 3.180 14.883 -3.240 1.00 30.14 H new ATOM 0 HB2 PRO A 85 1.084 15.900 -4.679 1.00 0.42 H new ATOM 0 HB3 PRO A 85 2.058 17.058 -3.795 1.00 0.42 H new ATOM 0 HG2 PRO A 85 2.134 16.377 -6.740 1.00 64.01 H new ATOM 0 HG3 PRO A 85 2.259 17.949 -5.975 1.00 64.01 H new ATOM 0 HD2 PRO A 85 4.458 16.376 -6.827 1.00 30.10 H new ATOM 0 HD3 PRO A 85 4.566 17.753 -5.748 1.00 30.10 H new ATOM 1340 N ASP A 86 3.696 13.359 -5.840 1.00 1.22 N ATOM 1341 CA ASP A 86 3.415 12.184 -6.703 1.00 2.12 C ATOM 1342 C ASP A 86 4.259 10.938 -6.327 1.00 23.40 C ATOM 1343 O ASP A 86 3.721 9.834 -6.237 1.00 72.12 O ATOM 1344 CB ASP A 86 3.597 12.567 -8.198 1.00 21.11 C ATOM 1345 CG ASP A 86 4.956 13.200 -8.524 1.00 71.54 C ATOM 1346 OD1 ASP A 86 5.083 14.442 -8.443 1.00 75.23 O ATOM 1347 OD2 ASP A 86 5.913 12.466 -8.849 1.00 24.01 O ATOM 0 H ASP A 86 4.646 13.720 -5.926 1.00 1.22 H new ATOM 0 HA ASP A 86 2.377 11.898 -6.534 1.00 2.12 H new ATOM 0 HB2 ASP A 86 3.469 11.673 -8.809 1.00 21.11 H new ATOM 0 HB3 ASP A 86 2.807 13.263 -8.482 1.00 21.11 H new ATOM 1352 N HIS A 87 5.577 11.115 -6.119 1.00 34.13 N ATOM 1353 CA HIS A 87 6.511 9.986 -5.884 1.00 21.23 C ATOM 1354 C HIS A 87 6.606 9.618 -4.374 1.00 40.10 C ATOM 1355 O HIS A 87 7.113 10.395 -3.553 1.00 52.14 O ATOM 1356 CB HIS A 87 7.915 10.333 -6.457 1.00 10.05 C ATOM 1357 CG HIS A 87 8.918 9.187 -6.513 1.00 44.13 C ATOM 1358 ND1 HIS A 87 10.143 9.299 -7.142 1.00 42.14 N ATOM 1359 CD2 HIS A 87 8.882 7.909 -6.037 1.00 33.43 C ATOM 1360 CE1 HIS A 87 10.798 8.164 -7.055 1.00 64.10 C ATOM 1361 NE2 HIS A 87 10.060 7.308 -6.394 1.00 42.42 N ATOM 0 H HIS A 87 6.025 12.031 -6.108 1.00 34.13 H new ATOM 0 HA HIS A 87 6.120 9.111 -6.403 1.00 21.23 H new ATOM 0 HB2 HIS A 87 7.786 10.726 -7.466 1.00 10.05 H new ATOM 0 HB3 HIS A 87 8.343 11.134 -5.855 1.00 10.05 H new ATOM 0 HD1 HIS A 87 10.488 10.139 -7.606 1.00 42.14 H new ATOM 0 HD2 HIS A 87 8.074 7.455 -5.482 1.00 33.43 H new ATOM 0 HE1 HIS A 87 11.780 7.969 -7.460 1.00 64.10 H new ATOM 1370 N LEU A 88 6.120 8.415 -4.049 1.00 62.14 N ATOM 1371 CA LEU A 88 6.281 7.767 -2.733 1.00 21.22 C ATOM 1372 C LEU A 88 6.946 6.389 -2.918 1.00 41.43 C ATOM 1373 O LEU A 88 6.592 5.649 -3.836 1.00 24.21 O ATOM 1374 CB LEU A 88 4.898 7.596 -2.039 1.00 31.41 C ATOM 1375 CG LEU A 88 4.882 6.872 -0.651 1.00 73.13 C ATOM 1376 CD1 LEU A 88 5.817 7.560 0.361 1.00 22.33 C ATOM 1377 CD2 LEU A 88 3.449 6.773 -0.094 1.00 54.41 C ATOM 0 H LEU A 88 5.589 7.846 -4.708 1.00 62.14 H new ATOM 0 HA LEU A 88 6.911 8.395 -2.103 1.00 21.22 H new ATOM 0 HB2 LEU A 88 4.460 8.586 -1.910 1.00 31.41 H new ATOM 0 HB3 LEU A 88 4.246 7.044 -2.716 1.00 31.41 H new ATOM 0 HG LEU A 88 5.256 5.861 -0.809 1.00 73.13 H new ATOM 0 HD11 LEU A 88 5.778 7.028 1.312 1.00 22.33 H new ATOM 0 HD12 LEU A 88 6.838 7.548 -0.020 1.00 22.33 H new ATOM 0 HD13 LEU A 88 5.497 8.592 0.509 1.00 22.33 H new ATOM 0 HD21 LEU A 88 3.468 6.266 0.871 1.00 54.41 H new ATOM 0 HD22 LEU A 88 3.037 7.774 0.031 1.00 54.41 H new ATOM 0 HD23 LEU A 88 2.827 6.209 -0.789 1.00 54.41 H new ATOM 1389 N GLU A 89 7.936 6.076 -2.071 1.00 43.13 N ATOM 1390 CA GLU A 89 8.524 4.725 -1.964 1.00 32.13 C ATOM 1391 C GLU A 89 8.616 4.315 -0.488 1.00 30.21 C ATOM 1392 O GLU A 89 9.109 5.083 0.347 1.00 70.51 O ATOM 1393 CB GLU A 89 9.932 4.652 -2.621 1.00 23.33 C ATOM 1394 CG GLU A 89 9.925 4.735 -4.155 1.00 63.40 C ATOM 1395 CD GLU A 89 11.295 4.476 -4.803 1.00 34.00 C ATOM 1396 OE1 GLU A 89 11.718 3.305 -4.877 1.00 21.44 O ATOM 1397 OE2 GLU A 89 11.954 5.434 -5.243 1.00 20.22 O ATOM 0 H GLU A 89 8.357 6.754 -1.435 1.00 43.13 H new ATOM 0 HA GLU A 89 7.872 4.035 -2.500 1.00 32.13 H new ATOM 0 HB2 GLU A 89 10.544 5.464 -2.229 1.00 23.33 H new ATOM 0 HB3 GLU A 89 10.410 3.719 -2.323 1.00 23.33 H new ATOM 0 HG2 GLU A 89 9.208 4.012 -4.544 1.00 63.40 H new ATOM 0 HG3 GLU A 89 9.575 5.723 -4.453 1.00 63.40 H new ATOM 1404 N PHE A 90 8.141 3.104 -0.187 1.00 51.30 N ATOM 1405 CA PHE A 90 8.221 2.507 1.154 1.00 73.45 C ATOM 1406 C PHE A 90 8.347 0.980 1.054 1.00 43.11 C ATOM 1407 O PHE A 90 8.246 0.407 -0.035 1.00 22.30 O ATOM 1408 CB PHE A 90 6.994 2.908 2.028 1.00 52.43 C ATOM 1409 CG PHE A 90 5.629 2.460 1.491 1.00 72.32 C ATOM 1410 CD1 PHE A 90 5.094 1.211 1.823 1.00 44.10 C ATOM 1411 CD2 PHE A 90 4.878 3.292 0.662 1.00 74.31 C ATOM 1412 CE1 PHE A 90 3.860 0.819 1.344 1.00 11.50 C ATOM 1413 CE2 PHE A 90 3.644 2.896 0.187 1.00 43.34 C ATOM 1414 CZ PHE A 90 3.135 1.661 0.526 1.00 53.12 C ATOM 0 H PHE A 90 7.685 2.502 -0.872 1.00 51.30 H new ATOM 0 HA PHE A 90 9.114 2.896 1.644 1.00 73.45 H new ATOM 0 HB2 PHE A 90 7.128 2.490 3.026 1.00 52.43 H new ATOM 0 HB3 PHE A 90 6.985 3.993 2.136 1.00 52.43 H new ATOM 0 HD1 PHE A 90 5.654 0.544 2.462 1.00 44.10 H new ATOM 0 HD2 PHE A 90 5.268 4.261 0.387 1.00 74.31 H new ATOM 0 HE1 PHE A 90 3.461 -0.149 1.610 1.00 11.50 H new ATOM 0 HE2 PHE A 90 3.076 3.556 -0.452 1.00 43.34 H new ATOM 0 HZ PHE A 90 2.170 1.353 0.152 1.00 53.12 H new ATOM 1424 N ASP A 91 8.562 0.339 2.199 1.00 21.05 N ATOM 1425 CA ASP A 91 8.625 -1.120 2.312 1.00 41.12 C ATOM 1426 C ASP A 91 7.463 -1.629 3.162 1.00 54.41 C ATOM 1427 O ASP A 91 7.509 -1.539 4.389 1.00 13.34 O ATOM 1428 CB ASP A 91 9.977 -1.553 2.918 1.00 40.30 C ATOM 1429 CG ASP A 91 11.130 -1.294 1.950 1.00 14.55 C ATOM 1430 OD1 ASP A 91 11.632 -0.152 1.891 1.00 65.31 O ATOM 1431 OD2 ASP A 91 11.510 -2.213 1.194 1.00 12.33 O ATOM 0 H ASP A 91 8.699 0.821 3.087 1.00 21.05 H new ATOM 0 HA ASP A 91 8.543 -1.556 1.317 1.00 41.12 H new ATOM 0 HB2 ASP A 91 10.151 -1.011 3.847 1.00 40.30 H new ATOM 0 HB3 ASP A 91 9.942 -2.613 3.169 1.00 40.30 H new ATOM 1436 N ASP A 92 6.406 -2.122 2.493 1.00 40.25 N ATOM 1437 CA ASP A 92 5.292 -2.796 3.164 1.00 13.31 C ATOM 1438 C ASP A 92 5.771 -4.174 3.673 1.00 60.43 C ATOM 1439 O ASP A 92 6.292 -4.993 2.902 1.00 40.54 O ATOM 1440 CB ASP A 92 4.078 -2.948 2.210 1.00 5.12 C ATOM 1441 CG ASP A 92 2.865 -3.627 2.888 1.00 25.44 C ATOM 1442 OD1 ASP A 92 2.206 -2.974 3.731 1.00 31.34 O ATOM 1443 OD2 ASP A 92 2.587 -4.812 2.592 1.00 25.10 O ATOM 0 H ASP A 92 6.304 -2.063 1.480 1.00 40.25 H new ATOM 0 HA ASP A 92 4.964 -2.193 4.011 1.00 13.31 H new ATOM 0 HB2 ASP A 92 3.782 -1.964 1.847 1.00 5.12 H new ATOM 0 HB3 ASP A 92 4.376 -3.533 1.340 1.00 5.12 H new ATOM 1448 N GLY A 93 5.627 -4.397 4.977 1.00 31.10 N ATOM 1449 CA GLY A 93 6.071 -5.630 5.619 1.00 71.33 C ATOM 1450 C GLY A 93 5.090 -6.110 6.677 1.00 14.43 C ATOM 1451 O GLY A 93 4.357 -5.319 7.278 1.00 43.21 O ATOM 0 H GLY A 93 5.199 -3.728 5.617 1.00 31.10 H new ATOM 0 HA2 GLY A 93 6.197 -6.406 4.864 1.00 71.33 H new ATOM 0 HA3 GLY A 93 7.047 -5.469 6.077 1.00 71.33 H new ATOM 1455 N PHE A 94 5.079 -7.422 6.907 1.00 21.43 N ATOM 1456 CA PHE A 94 4.269 -8.054 7.966 1.00 20.33 C ATOM 1457 C PHE A 94 5.121 -8.210 9.235 1.00 24.23 C ATOM 1458 O PHE A 94 6.337 -8.404 9.151 1.00 41.11 O ATOM 1459 CB PHE A 94 3.730 -9.425 7.481 1.00 0.02 C ATOM 1460 CG PHE A 94 2.689 -9.314 6.363 1.00 44.21 C ATOM 1461 CD1 PHE A 94 3.070 -9.105 5.033 1.00 43.22 C ATOM 1462 CD2 PHE A 94 1.322 -9.418 6.645 1.00 20.22 C ATOM 1463 CE1 PHE A 94 2.123 -9.006 4.028 1.00 43.32 C ATOM 1464 CE2 PHE A 94 0.378 -9.319 5.637 1.00 14.11 C ATOM 1465 CZ PHE A 94 0.778 -9.111 4.331 1.00 0.21 C ATOM 0 H PHE A 94 5.632 -8.086 6.365 1.00 21.43 H new ATOM 0 HA PHE A 94 3.412 -7.422 8.198 1.00 20.33 H new ATOM 0 HB2 PHE A 94 4.565 -10.031 7.129 1.00 0.02 H new ATOM 0 HB3 PHE A 94 3.288 -9.952 8.327 1.00 0.02 H new ATOM 0 HD1 PHE A 94 4.118 -9.020 4.787 1.00 43.22 H new ATOM 0 HD2 PHE A 94 0.999 -9.578 7.663 1.00 20.22 H new ATOM 0 HE1 PHE A 94 2.435 -8.847 3.006 1.00 43.32 H new ATOM 0 HE2 PHE A 94 -0.673 -9.405 5.872 1.00 14.11 H new ATOM 0 HZ PHE A 94 0.040 -9.030 3.547 1.00 0.21 H new ATOM 1475 N ALA A 95 4.476 -8.105 10.403 1.00 60.04 N ATOM 1476 CA ALA A 95 5.150 -8.175 11.714 1.00 22.53 C ATOM 1477 C ALA A 95 4.521 -9.256 12.617 1.00 2.15 C ATOM 1478 O ALA A 95 3.326 -9.545 12.516 1.00 22.34 O ATOM 1479 CB ALA A 95 5.108 -6.803 12.394 1.00 73.13 C ATOM 0 H ALA A 95 3.467 -7.968 10.470 1.00 60.04 H new ATOM 0 HA ALA A 95 6.190 -8.458 11.550 1.00 22.53 H new ATOM 0 HB1 ALA A 95 5.607 -6.861 13.361 1.00 73.13 H new ATOM 0 HB2 ALA A 95 5.616 -6.070 11.767 1.00 73.13 H new ATOM 0 HB3 ALA A 95 4.071 -6.500 12.538 1.00 73.13 H new ATOM 1485 N ASP A 96 5.350 -9.869 13.479 1.00 42.31 N ATOM 1486 CA ASP A 96 4.907 -10.920 14.421 1.00 32.24 C ATOM 1487 C ASP A 96 4.059 -10.317 15.582 1.00 15.41 C ATOM 1488 O ASP A 96 2.828 -10.296 15.509 1.00 22.20 O ATOM 1489 CB ASP A 96 6.140 -11.699 14.953 1.00 31.00 C ATOM 1490 CG ASP A 96 6.973 -12.348 13.833 1.00 22.42 C ATOM 1491 OD1 ASP A 96 7.769 -11.641 13.183 1.00 31.10 O ATOM 1492 OD2 ASP A 96 6.838 -13.566 13.604 1.00 12.44 O ATOM 0 H ASP A 96 6.345 -9.653 13.545 1.00 42.31 H new ATOM 0 HA ASP A 96 4.261 -11.620 13.891 1.00 32.24 H new ATOM 0 HB2 ASP A 96 6.774 -11.019 15.522 1.00 31.00 H new ATOM 0 HB3 ASP A 96 5.803 -12.473 15.643 1.00 31.00 H new ATOM 1497 N GLU A 97 4.731 -9.822 16.647 1.00 42.31 N ATOM 1498 CA GLU A 97 4.056 -9.155 17.790 1.00 34.34 C ATOM 1499 C GLU A 97 4.728 -7.805 18.160 1.00 4.33 C ATOM 1500 O GLU A 97 4.041 -6.809 18.403 1.00 23.11 O ATOM 1501 CB GLU A 97 4.025 -10.117 19.016 1.00 24.13 C ATOM 1502 CG GLU A 97 5.413 -10.567 19.532 1.00 14.23 C ATOM 1503 CD GLU A 97 5.347 -11.440 20.794 1.00 43.44 C ATOM 1504 OE1 GLU A 97 5.167 -10.883 21.899 1.00 74.11 O ATOM 1505 OE2 GLU A 97 5.473 -12.672 20.687 1.00 13.54 O ATOM 0 H GLU A 97 5.745 -9.871 16.741 1.00 42.31 H new ATOM 0 HA GLU A 97 3.034 -8.923 17.489 1.00 34.34 H new ATOM 0 HB2 GLU A 97 3.494 -9.625 19.831 1.00 24.13 H new ATOM 0 HB3 GLU A 97 3.449 -11.003 18.749 1.00 24.13 H new ATOM 0 HG2 GLU A 97 5.922 -11.121 18.743 1.00 14.23 H new ATOM 0 HG3 GLU A 97 6.017 -9.684 19.742 1.00 14.23 H new ATOM 1512 N HIS A 98 6.081 -7.779 18.186 1.00 34.22 N ATOM 1513 CA HIS A 98 6.864 -6.589 18.627 1.00 73.22 C ATOM 1514 C HIS A 98 7.051 -5.554 17.486 1.00 43.24 C ATOM 1515 O HIS A 98 7.636 -4.496 17.705 1.00 61.55 O ATOM 1516 CB HIS A 98 8.272 -7.021 19.144 1.00 35.10 C ATOM 1517 CG HIS A 98 8.278 -8.097 20.201 1.00 21.41 C ATOM 1518 ND1 HIS A 98 7.676 -7.958 21.427 1.00 62.34 N ATOM 1519 CD2 HIS A 98 8.834 -9.337 20.207 1.00 15.44 C ATOM 1520 CE1 HIS A 98 7.859 -9.050 22.139 1.00 53.14 C ATOM 1521 NE2 HIS A 98 8.557 -9.902 21.424 1.00 52.02 N ATOM 0 H HIS A 98 6.660 -8.571 17.906 1.00 34.22 H new ATOM 0 HA HIS A 98 6.294 -6.121 19.429 1.00 73.22 H new ATOM 0 HB2 HIS A 98 8.860 -7.368 18.294 1.00 35.10 H new ATOM 0 HB3 HIS A 98 8.778 -6.142 19.543 1.00 35.10 H new ATOM 0 HD2 HIS A 98 9.391 -9.793 19.402 1.00 15.44 H new ATOM 0 HE1 HIS A 98 7.496 -9.217 23.142 1.00 53.14 H new ATOM 0 HE2 HIS A 98 8.846 -10.833 21.725 1.00 52.02 H new ATOM 1530 N GLY A 99 6.544 -5.864 16.276 1.00 62.44 N ATOM 1531 CA GLY A 99 6.899 -5.097 15.063 1.00 61.50 C ATOM 1532 C GLY A 99 8.061 -5.730 14.282 1.00 44.14 C ATOM 1533 O GLY A 99 8.544 -5.157 13.304 1.00 3.12 O ATOM 0 H GLY A 99 5.894 -6.632 16.112 1.00 62.44 H new ATOM 0 HA2 GLY A 99 6.026 -5.026 14.414 1.00 61.50 H new ATOM 0 HA3 GLY A 99 7.169 -4.080 15.347 1.00 61.50 H new ATOM 1537 N ALA A 100 8.478 -6.940 14.713 1.00 2.43 N ATOM 1538 CA ALA A 100 9.578 -7.707 14.087 1.00 24.33 C ATOM 1539 C ALA A 100 9.140 -8.288 12.711 1.00 14.12 C ATOM 1540 O ALA A 100 8.047 -8.832 12.617 1.00 20.31 O ATOM 1541 CB ALA A 100 10.025 -8.832 15.040 1.00 34.22 C ATOM 0 H ALA A 100 8.058 -7.416 15.511 1.00 2.43 H new ATOM 0 HA ALA A 100 10.419 -7.037 13.907 1.00 24.33 H new ATOM 0 HB1 ALA A 100 10.835 -9.398 14.580 1.00 34.22 H new ATOM 0 HB2 ALA A 100 10.372 -8.398 15.978 1.00 34.22 H new ATOM 0 HB3 ALA A 100 9.184 -9.497 15.237 1.00 34.22 H new ATOM 1547 N PRO A 101 9.981 -8.176 11.631 1.00 72.35 N ATOM 1548 CA PRO A 101 9.600 -8.628 10.262 1.00 21.24 C ATOM 1549 C PRO A 101 9.418 -10.174 10.127 1.00 52.13 C ATOM 1550 O PRO A 101 10.354 -10.953 10.374 1.00 2.43 O ATOM 1551 CB PRO A 101 10.770 -8.111 9.377 1.00 23.43 C ATOM 1552 CG PRO A 101 11.936 -8.006 10.316 1.00 74.14 C ATOM 1553 CD PRO A 101 11.350 -7.594 11.650 1.00 74.41 C ATOM 0 HA PRO A 101 8.623 -8.240 9.974 1.00 21.24 H new ATOM 0 HB2 PRO A 101 10.981 -8.798 8.558 1.00 23.43 H new ATOM 0 HB3 PRO A 101 10.533 -7.146 8.930 1.00 23.43 H new ATOM 0 HG2 PRO A 101 12.462 -8.958 10.396 1.00 74.14 H new ATOM 0 HG3 PRO A 101 12.659 -7.271 9.962 1.00 74.14 H new ATOM 0 HD2 PRO A 101 11.938 -7.982 12.482 1.00 74.41 H new ATOM 0 HD3 PRO A 101 11.322 -6.510 11.757 1.00 74.41 H new ATOM 1561 N VAL A 102 8.195 -10.588 9.736 1.00 2.52 N ATOM 1562 CA VAL A 102 7.865 -11.990 9.400 1.00 22.04 C ATOM 1563 C VAL A 102 8.711 -12.484 8.196 1.00 30.12 C ATOM 1564 O VAL A 102 8.517 -12.039 7.057 1.00 40.02 O ATOM 1565 CB VAL A 102 6.326 -12.161 9.095 1.00 30.42 C ATOM 1566 CG1 VAL A 102 5.962 -13.607 8.679 1.00 4.20 C ATOM 1567 CG2 VAL A 102 5.477 -11.729 10.304 1.00 64.44 C ATOM 0 H VAL A 102 7.402 -9.954 9.644 1.00 2.52 H new ATOM 0 HA VAL A 102 8.108 -12.601 10.269 1.00 22.04 H new ATOM 0 HB VAL A 102 6.101 -11.511 8.249 1.00 30.42 H new ATOM 0 HG11 VAL A 102 4.892 -13.670 8.481 1.00 4.20 H new ATOM 0 HG12 VAL A 102 6.514 -13.877 7.779 1.00 4.20 H new ATOM 0 HG13 VAL A 102 6.223 -14.294 9.484 1.00 4.20 H new ATOM 0 HG21 VAL A 102 4.420 -11.856 10.070 1.00 64.44 H new ATOM 0 HG22 VAL A 102 5.734 -12.343 11.167 1.00 64.44 H new ATOM 0 HG23 VAL A 102 5.675 -10.682 10.532 1.00 64.44 H new ATOM 1577 N ASP A 103 9.657 -13.391 8.482 1.00 13.14 N ATOM 1578 CA ASP A 103 10.560 -13.995 7.472 1.00 73.14 C ATOM 1579 C ASP A 103 9.770 -14.902 6.494 1.00 15.11 C ATOM 1580 O ASP A 103 10.112 -15.020 5.308 1.00 22.22 O ATOM 1581 CB ASP A 103 11.662 -14.798 8.206 1.00 32.13 C ATOM 1582 CG ASP A 103 12.708 -15.427 7.269 1.00 31.44 C ATOM 1583 OD1 ASP A 103 13.660 -14.726 6.872 1.00 72.23 O ATOM 1584 OD2 ASP A 103 12.585 -16.625 6.925 1.00 22.31 O ATOM 0 H ASP A 103 9.824 -13.734 9.428 1.00 13.14 H new ATOM 0 HA ASP A 103 11.021 -13.206 6.878 1.00 73.14 H new ATOM 0 HB2 ASP A 103 12.170 -14.139 8.910 1.00 32.13 H new ATOM 0 HB3 ASP A 103 11.192 -15.588 8.792 1.00 32.13 H new ATOM 1589 N GLU A 104 8.706 -15.519 7.029 1.00 63.13 N ATOM 1590 CA GLU A 104 7.766 -16.379 6.282 1.00 22.11 C ATOM 1591 C GLU A 104 7.120 -15.632 5.070 1.00 15.45 C ATOM 1592 O GLU A 104 6.841 -16.243 4.039 1.00 74.04 O ATOM 1593 CB GLU A 104 6.669 -16.870 7.271 1.00 42.41 C ATOM 1594 CG GLU A 104 5.666 -17.898 6.719 1.00 21.22 C ATOM 1595 CD GLU A 104 6.266 -19.301 6.490 1.00 1.34 C ATOM 1596 OE1 GLU A 104 6.936 -19.517 5.461 1.00 32.43 O ATOM 1597 OE2 GLU A 104 6.075 -20.191 7.344 1.00 71.13 O ATOM 0 H GLU A 104 8.466 -15.434 8.017 1.00 63.13 H new ATOM 0 HA GLU A 104 8.313 -17.225 5.866 1.00 22.11 H new ATOM 0 HB2 GLU A 104 7.162 -17.305 8.140 1.00 42.41 H new ATOM 0 HB3 GLU A 104 6.111 -16.002 7.622 1.00 42.41 H new ATOM 0 HG2 GLU A 104 4.828 -17.981 7.412 1.00 21.22 H new ATOM 0 HG3 GLU A 104 5.264 -17.528 5.776 1.00 21.22 H new ATOM 1604 N LEU A 105 6.897 -14.302 5.211 1.00 12.03 N ATOM 1605 CA LEU A 105 6.266 -13.451 4.157 1.00 34.14 C ATOM 1606 C LEU A 105 7.247 -12.427 3.525 1.00 24.13 C ATOM 1607 O LEU A 105 6.876 -11.735 2.569 1.00 22.33 O ATOM 1608 CB LEU A 105 5.027 -12.720 4.752 1.00 3.42 C ATOM 1609 CG LEU A 105 3.816 -13.642 5.111 1.00 54.41 C ATOM 1610 CD1 LEU A 105 2.656 -12.846 5.739 1.00 1.13 C ATOM 1611 CD2 LEU A 105 3.336 -14.429 3.874 1.00 40.31 C ATOM 0 H LEU A 105 7.147 -13.785 6.054 1.00 12.03 H new ATOM 0 HA LEU A 105 5.959 -14.115 3.349 1.00 34.14 H new ATOM 0 HB2 LEU A 105 5.337 -12.188 5.652 1.00 3.42 H new ATOM 0 HB3 LEU A 105 4.691 -11.969 4.037 1.00 3.42 H new ATOM 0 HG LEU A 105 4.163 -14.356 5.858 1.00 54.41 H new ATOM 0 HD11 LEU A 105 1.835 -13.523 5.974 1.00 1.13 H new ATOM 0 HD12 LEU A 105 3.000 -12.362 6.653 1.00 1.13 H new ATOM 0 HD13 LEU A 105 2.312 -12.088 5.035 1.00 1.13 H new ATOM 0 HD21 LEU A 105 2.493 -15.063 4.150 1.00 40.31 H new ATOM 0 HD22 LEU A 105 3.026 -13.731 3.097 1.00 40.31 H new ATOM 0 HD23 LEU A 105 4.150 -15.050 3.500 1.00 40.31 H new ATOM 1623 N GLY A 106 8.471 -12.322 4.082 1.00 33.23 N ATOM 1624 CA GLY A 106 9.524 -11.438 3.537 1.00 54.05 C ATOM 1625 C GLY A 106 9.217 -9.933 3.665 1.00 21.02 C ATOM 1626 O GLY A 106 8.411 -9.522 4.510 1.00 3.13 O ATOM 0 H GLY A 106 8.756 -12.841 4.913 1.00 33.23 H new ATOM 0 HA2 GLY A 106 10.462 -11.651 4.050 1.00 54.05 H new ATOM 0 HA3 GLY A 106 9.675 -11.678 2.484 1.00 54.05 H new ATOM 1630 N VAL A 107 9.897 -9.106 2.835 1.00 54.11 N ATOM 1631 CA VAL A 107 9.717 -7.625 2.800 1.00 23.34 C ATOM 1632 C VAL A 107 9.555 -7.149 1.334 1.00 72.42 C ATOM 1633 O VAL A 107 10.412 -7.447 0.491 1.00 44.11 O ATOM 1634 CB VAL A 107 10.947 -6.874 3.452 1.00 14.20 C ATOM 1635 CG1 VAL A 107 10.755 -5.331 3.425 1.00 60.43 C ATOM 1636 CG2 VAL A 107 11.223 -7.377 4.891 1.00 13.42 C ATOM 0 H VAL A 107 10.590 -9.444 2.167 1.00 54.11 H new ATOM 0 HA VAL A 107 8.822 -7.388 3.375 1.00 23.34 H new ATOM 0 HB VAL A 107 11.823 -7.108 2.847 1.00 14.20 H new ATOM 0 HG11 VAL A 107 11.620 -4.849 3.881 1.00 60.43 H new ATOM 0 HG12 VAL A 107 10.655 -4.995 2.393 1.00 60.43 H new ATOM 0 HG13 VAL A 107 9.856 -5.066 3.982 1.00 60.43 H new ATOM 0 HG21 VAL A 107 12.075 -6.839 5.307 1.00 13.42 H new ATOM 0 HG22 VAL A 107 10.344 -7.203 5.512 1.00 13.42 H new ATOM 0 HG23 VAL A 107 11.444 -8.444 4.867 1.00 13.42 H new ATOM 1646 N THR A 108 8.454 -6.431 1.022 1.00 34.25 N ATOM 1647 CA THR A 108 8.206 -5.880 -0.340 1.00 22.52 C ATOM 1648 C THR A 108 8.274 -4.343 -0.350 1.00 22.14 C ATOM 1649 O THR A 108 7.925 -3.692 0.629 1.00 11.35 O ATOM 1650 CB THR A 108 6.834 -6.342 -0.948 1.00 51.31 C ATOM 1651 OG1 THR A 108 6.662 -5.765 -2.257 1.00 21.03 O ATOM 1652 CG2 THR A 108 5.620 -5.996 -0.063 1.00 65.20 C ATOM 0 H THR A 108 7.717 -6.216 1.694 1.00 34.25 H new ATOM 0 HA THR A 108 9.003 -6.283 -0.965 1.00 22.52 H new ATOM 0 HB THR A 108 6.873 -7.430 -1.010 1.00 51.31 H new ATOM 0 HG1 THR A 108 5.709 -5.746 -2.483 1.00 21.03 H new ATOM 0 HG21 THR A 108 4.707 -6.345 -0.545 1.00 65.20 H new ATOM 0 HG22 THR A 108 5.726 -6.482 0.907 1.00 65.20 H new ATOM 0 HG23 THR A 108 5.567 -4.916 0.076 1.00 65.20 H new ATOM 1660 N HIS A 109 8.716 -3.781 -1.482 1.00 51.13 N ATOM 1661 CA HIS A 109 8.888 -2.334 -1.663 1.00 14.51 C ATOM 1662 C HIS A 109 7.792 -1.780 -2.605 1.00 34.02 C ATOM 1663 O HIS A 109 7.850 -1.978 -3.818 1.00 2.02 O ATOM 1664 CB HIS A 109 10.299 -2.053 -2.234 1.00 61.14 C ATOM 1665 CG HIS A 109 10.698 -0.605 -2.204 1.00 71.40 C ATOM 1666 ND1 HIS A 109 11.233 -0.019 -1.094 1.00 60.12 N ATOM 1667 CD2 HIS A 109 10.618 0.380 -3.130 1.00 53.40 C ATOM 1668 CE1 HIS A 109 11.455 1.243 -1.330 1.00 53.43 C ATOM 1669 NE2 HIS A 109 11.098 1.517 -2.552 1.00 0.15 N ATOM 0 H HIS A 109 8.967 -4.325 -2.308 1.00 51.13 H new ATOM 0 HA HIS A 109 8.791 -1.832 -0.701 1.00 14.51 H new ATOM 0 HB2 HIS A 109 11.029 -2.631 -1.668 1.00 61.14 H new ATOM 0 HB3 HIS A 109 10.339 -2.408 -3.264 1.00 61.14 H new ATOM 0 HD2 HIS A 109 10.244 0.283 -4.138 1.00 53.40 H new ATOM 0 HE1 HIS A 109 11.869 1.949 -0.625 1.00 53.43 H new ATOM 0 HE2 HIS A 109 11.166 2.430 -3.001 1.00 0.15 H new ATOM 1678 N ALA A 110 6.813 -1.064 -2.031 1.00 45.15 N ATOM 1679 CA ALA A 110 5.664 -0.518 -2.785 1.00 51.55 C ATOM 1680 C ALA A 110 5.911 0.959 -3.183 1.00 2.34 C ATOM 1681 O ALA A 110 6.213 1.802 -2.326 1.00 43.14 O ATOM 1682 CB ALA A 110 4.383 -0.669 -1.958 1.00 42.10 C ATOM 0 H ALA A 110 6.791 -0.845 -1.035 1.00 45.15 H new ATOM 0 HA ALA A 110 5.547 -1.084 -3.709 1.00 51.55 H new ATOM 0 HB1 ALA A 110 3.539 -0.265 -2.517 1.00 42.10 H new ATOM 0 HB2 ALA A 110 4.208 -1.724 -1.748 1.00 42.10 H new ATOM 0 HB3 ALA A 110 4.490 -0.125 -1.019 1.00 42.10 H new ATOM 1688 N THR A 111 5.763 1.268 -4.491 1.00 62.01 N ATOM 1689 CA THR A 111 6.034 2.618 -5.048 1.00 3.31 C ATOM 1690 C THR A 111 4.718 3.275 -5.504 1.00 51.24 C ATOM 1691 O THR A 111 4.163 2.892 -6.527 1.00 25.40 O ATOM 1692 CB THR A 111 7.017 2.553 -6.278 1.00 63.14 C ATOM 1693 OG1 THR A 111 8.156 1.737 -5.949 1.00 11.03 O ATOM 1694 CG2 THR A 111 7.499 3.952 -6.705 1.00 14.03 C ATOM 0 H THR A 111 5.454 0.593 -5.190 1.00 62.01 H new ATOM 0 HA THR A 111 6.499 3.207 -4.258 1.00 3.31 H new ATOM 0 HB THR A 111 6.469 2.116 -7.113 1.00 63.14 H new ATOM 0 HG1 THR A 111 8.763 1.698 -6.717 1.00 11.03 H new ATOM 0 HG21 THR A 111 8.174 3.860 -7.556 1.00 14.03 H new ATOM 0 HG22 THR A 111 6.641 4.562 -6.987 1.00 14.03 H new ATOM 0 HG23 THR A 111 8.023 4.425 -5.875 1.00 14.03 H new ATOM 1702 N VAL A 112 4.246 4.281 -4.759 1.00 12.12 N ATOM 1703 CA VAL A 112 2.979 4.989 -5.057 1.00 31.14 C ATOM 1704 C VAL A 112 3.268 6.212 -5.948 1.00 31.30 C ATOM 1705 O VAL A 112 3.980 7.123 -5.537 1.00 61.12 O ATOM 1706 CB VAL A 112 2.263 5.445 -3.740 1.00 72.43 C ATOM 1707 CG1 VAL A 112 0.948 6.205 -4.044 1.00 72.02 C ATOM 1708 CG2 VAL A 112 2.017 4.233 -2.809 1.00 25.24 C ATOM 0 H VAL A 112 4.726 4.633 -3.931 1.00 12.12 H new ATOM 0 HA VAL A 112 2.316 4.301 -5.582 1.00 31.14 H new ATOM 0 HB VAL A 112 2.921 6.142 -3.220 1.00 72.43 H new ATOM 0 HG11 VAL A 112 0.477 6.507 -3.108 1.00 72.02 H new ATOM 0 HG12 VAL A 112 1.169 7.090 -4.641 1.00 72.02 H new ATOM 0 HG13 VAL A 112 0.271 5.554 -4.597 1.00 72.02 H new ATOM 0 HG21 VAL A 112 1.519 4.568 -1.899 1.00 25.24 H new ATOM 0 HG22 VAL A 112 1.388 3.504 -3.319 1.00 25.24 H new ATOM 0 HG23 VAL A 112 2.971 3.772 -2.552 1.00 25.24 H new ATOM 1718 N LYS A 113 2.733 6.204 -7.176 1.00 62.22 N ATOM 1719 CA LYS A 113 2.996 7.259 -8.178 1.00 12.11 C ATOM 1720 C LYS A 113 1.670 7.880 -8.679 1.00 50.42 C ATOM 1721 O LYS A 113 0.878 7.217 -9.356 1.00 72.32 O ATOM 1722 CB LYS A 113 3.822 6.624 -9.334 1.00 71.24 C ATOM 1723 CG LYS A 113 5.198 6.068 -8.872 1.00 44.33 C ATOM 1724 CD LYS A 113 5.886 5.160 -9.906 1.00 1.40 C ATOM 1725 CE LYS A 113 6.127 5.856 -11.244 1.00 71.34 C ATOM 1726 NZ LYS A 113 6.846 4.994 -12.209 1.00 60.33 N ATOM 0 H LYS A 113 2.107 5.470 -7.507 1.00 62.22 H new ATOM 0 HA LYS A 113 3.567 8.076 -7.737 1.00 12.11 H new ATOM 0 HB2 LYS A 113 3.244 5.817 -9.784 1.00 71.24 H new ATOM 0 HB3 LYS A 113 3.982 7.372 -10.110 1.00 71.24 H new ATOM 0 HG2 LYS A 113 5.858 6.905 -8.643 1.00 44.33 H new ATOM 0 HG3 LYS A 113 5.060 5.508 -7.947 1.00 44.33 H new ATOM 0 HD2 LYS A 113 6.839 4.818 -9.504 1.00 1.40 H new ATOM 0 HD3 LYS A 113 5.272 4.274 -10.069 1.00 1.40 H new ATOM 0 HE2 LYS A 113 5.170 6.156 -11.672 1.00 71.34 H new ATOM 0 HE3 LYS A 113 6.701 6.767 -11.078 1.00 71.34 H new ATOM 0 HZ1 LYS A 113 6.985 5.512 -13.100 1.00 60.33 H new ATOM 0 HZ2 LYS A 113 7.771 4.728 -11.815 1.00 60.33 H new ATOM 0 HZ3 LYS A 113 6.288 4.136 -12.391 1.00 60.33 H new ATOM 1740 N LEU A 114 1.446 9.159 -8.329 1.00 55.43 N ATOM 1741 CA LEU A 114 0.229 9.921 -8.710 1.00 61.12 C ATOM 1742 C LEU A 114 0.460 10.751 -9.994 1.00 2.22 C ATOM 1743 O LEU A 114 1.568 11.224 -10.244 1.00 33.33 O ATOM 1744 CB LEU A 114 -0.190 10.859 -7.545 1.00 2.15 C ATOM 1745 CG LEU A 114 -0.499 10.160 -6.182 1.00 71.44 C ATOM 1746 CD1 LEU A 114 -0.801 11.184 -5.073 1.00 62.32 C ATOM 1747 CD2 LEU A 114 -1.659 9.163 -6.322 1.00 50.21 C ATOM 0 H LEU A 114 2.104 9.702 -7.770 1.00 55.43 H new ATOM 0 HA LEU A 114 -0.568 9.205 -8.911 1.00 61.12 H new ATOM 0 HB2 LEU A 114 0.606 11.586 -7.386 1.00 2.15 H new ATOM 0 HB3 LEU A 114 -1.074 11.417 -7.854 1.00 2.15 H new ATOM 0 HG LEU A 114 0.396 9.609 -5.893 1.00 71.44 H new ATOM 0 HD11 LEU A 114 -1.011 10.660 -4.141 1.00 62.32 H new ATOM 0 HD12 LEU A 114 0.061 11.837 -4.936 1.00 62.32 H new ATOM 0 HD13 LEU A 114 -1.667 11.782 -5.356 1.00 62.32 H new ATOM 0 HD21 LEU A 114 -1.852 8.692 -5.358 1.00 50.21 H new ATOM 0 HD22 LEU A 114 -2.554 9.690 -6.654 1.00 50.21 H new ATOM 0 HD23 LEU A 114 -1.396 8.399 -7.053 1.00 50.21 H new ATOM 1759 N GLU A 115 -0.600 10.928 -10.799 1.00 41.44 N ATOM 1760 CA GLU A 115 -0.554 11.729 -12.044 1.00 70.14 C ATOM 1761 C GLU A 115 -1.684 12.791 -12.056 1.00 64.25 C ATOM 1762 O GLU A 115 -2.864 12.422 -12.024 1.00 31.04 O ATOM 1763 CB GLU A 115 -0.688 10.798 -13.276 1.00 34.02 C ATOM 1764 CG GLU A 115 -0.696 11.525 -14.643 1.00 3.42 C ATOM 1765 CD GLU A 115 0.604 12.292 -14.959 1.00 2.43 C ATOM 1766 OE1 GLU A 115 1.676 11.655 -15.036 1.00 51.25 O ATOM 1767 OE2 GLU A 115 0.566 13.533 -15.118 1.00 14.03 O ATOM 0 H GLU A 115 -1.516 10.522 -10.609 1.00 41.44 H new ATOM 0 HA GLU A 115 0.404 12.246 -12.087 1.00 70.14 H new ATOM 0 HB2 GLU A 115 0.136 10.084 -13.265 1.00 34.02 H new ATOM 0 HB3 GLU A 115 -1.609 10.223 -13.181 1.00 34.02 H new ATOM 0 HG2 GLU A 115 -0.873 10.792 -15.430 1.00 3.42 H new ATOM 0 HG3 GLU A 115 -1.532 12.224 -14.665 1.00 3.42 H new ATOM 1774 N PRO A 116 -1.344 14.123 -12.097 1.00 71.40 N ATOM 1775 CA PRO A 116 -2.353 15.208 -12.181 1.00 34.25 C ATOM 1776 C PRO A 116 -3.146 15.203 -13.513 1.00 13.21 C ATOM 1777 O PRO A 116 -2.681 15.710 -14.539 1.00 20.21 O ATOM 1778 CB PRO A 116 -1.510 16.506 -12.003 1.00 32.22 C ATOM 1779 CG PRO A 116 -0.118 16.122 -12.414 1.00 51.02 C ATOM 1780 CD PRO A 116 0.039 14.667 -12.025 1.00 51.22 C ATOM 0 HA PRO A 116 -3.131 15.100 -11.426 1.00 34.25 H new ATOM 0 HB2 PRO A 116 -1.896 17.316 -12.623 1.00 32.22 H new ATOM 0 HB3 PRO A 116 -1.535 16.855 -10.971 1.00 32.22 H new ATOM 0 HG2 PRO A 116 0.025 16.258 -13.486 1.00 51.02 H new ATOM 0 HG3 PRO A 116 0.624 16.743 -11.912 1.00 51.02 H new ATOM 0 HD2 PRO A 116 0.710 14.142 -12.705 1.00 51.22 H new ATOM 0 HD3 PRO A 116 0.456 14.565 -11.023 1.00 51.22 H new ATOM 1788 N LEU A 117 -4.353 14.609 -13.478 1.00 12.14 N ATOM 1789 CA LEU A 117 -5.301 14.610 -14.623 1.00 11.24 C ATOM 1790 C LEU A 117 -6.304 15.789 -14.484 1.00 62.41 C ATOM 1791 O LEU A 117 -7.503 15.627 -14.734 1.00 14.31 O ATOM 1792 CB LEU A 117 -6.062 13.256 -14.692 1.00 2.23 C ATOM 1793 CG LEU A 117 -5.209 11.953 -14.668 1.00 11.35 C ATOM 1794 CD1 LEU A 117 -6.118 10.707 -14.706 1.00 52.14 C ATOM 1795 CD2 LEU A 117 -4.181 11.924 -15.814 1.00 5.44 C ATOM 0 H LEU A 117 -4.705 14.113 -12.659 1.00 12.14 H new ATOM 0 HA LEU A 117 -4.737 14.738 -15.547 1.00 11.24 H new ATOM 0 HB2 LEU A 117 -6.759 13.218 -13.855 1.00 2.23 H new ATOM 0 HB3 LEU A 117 -6.659 13.251 -15.604 1.00 2.23 H new ATOM 0 HG LEU A 117 -4.649 11.941 -13.733 1.00 11.35 H new ATOM 0 HD11 LEU A 117 -5.503 9.807 -14.689 1.00 52.14 H new ATOM 0 HD12 LEU A 117 -6.779 10.712 -13.839 1.00 52.14 H new ATOM 0 HD13 LEU A 117 -6.716 10.720 -15.617 1.00 52.14 H new ATOM 0 HD21 LEU A 117 -3.606 11.000 -15.763 1.00 5.44 H new ATOM 0 HD22 LEU A 117 -4.701 11.976 -16.771 1.00 5.44 H new ATOM 0 HD23 LEU A 117 -3.508 12.776 -15.721 1.00 5.44 H new ATOM 1807 N GLU A 118 -5.778 16.957 -14.063 1.00 24.01 N ATOM 1808 CA GLU A 118 -6.534 18.216 -13.882 1.00 74.21 C ATOM 1809 C GLU A 118 -7.595 18.121 -12.734 1.00 14.41 C ATOM 1810 O GLU A 118 -7.300 18.454 -11.582 1.00 52.01 O ATOM 1811 CB GLU A 118 -7.171 18.674 -15.228 1.00 3.41 C ATOM 1812 CG GLU A 118 -7.691 20.119 -15.226 1.00 31.42 C ATOM 1813 CD GLU A 118 -8.390 20.508 -16.540 1.00 1.32 C ATOM 1814 OE1 GLU A 118 -9.604 20.246 -16.674 1.00 21.55 O ATOM 1815 OE2 GLU A 118 -7.731 21.066 -17.443 1.00 32.31 O ATOM 0 H GLU A 118 -4.789 17.055 -13.833 1.00 24.01 H new ATOM 0 HA GLU A 118 -5.822 18.980 -13.569 1.00 74.21 H new ATOM 0 HB2 GLU A 118 -6.430 18.569 -16.021 1.00 3.41 H new ATOM 0 HB3 GLU A 118 -7.996 18.004 -15.472 1.00 3.41 H new ATOM 0 HG2 GLU A 118 -8.388 20.247 -14.398 1.00 31.42 H new ATOM 0 HG3 GLU A 118 -6.858 20.799 -15.049 1.00 31.42 H new ATOM 1822 N ASN A 119 -8.823 17.656 -13.052 1.00 2.32 N ATOM 1823 CA ASN A 119 -9.921 17.497 -12.058 1.00 0.41 C ATOM 1824 C ASN A 119 -9.821 16.131 -11.342 1.00 3.22 C ATOM 1825 O ASN A 119 -10.391 15.939 -10.261 1.00 13.34 O ATOM 1826 CB ASN A 119 -11.306 17.627 -12.755 1.00 72.13 C ATOM 1827 CG ASN A 119 -11.627 19.017 -13.328 1.00 22.23 C ATOM 1828 OD1 ASN A 119 -12.782 19.428 -13.363 1.00 75.11 O ATOM 1829 ND2 ASN A 119 -10.637 19.754 -13.792 1.00 32.33 N ATOM 0 H ASN A 119 -9.086 17.380 -13.998 1.00 2.32 H new ATOM 0 HA ASN A 119 -9.820 18.288 -11.315 1.00 0.41 H new ATOM 0 HB2 ASN A 119 -11.357 16.898 -13.564 1.00 72.13 H new ATOM 0 HB3 ASN A 119 -12.082 17.360 -12.037 1.00 72.13 H new ATOM 0 HD21 ASN A 119 -10.828 20.676 -14.185 1.00 32.33 H new ATOM 0 HD22 ASN A 119 -9.680 19.402 -13.758 1.00 32.33 H new ATOM 1836 N ARG A 120 -9.106 15.186 -11.976 1.00 34.33 N ATOM 1837 CA ARG A 120 -8.889 13.818 -11.443 1.00 71.25 C ATOM 1838 C ARG A 120 -7.382 13.522 -11.277 1.00 52.54 C ATOM 1839 O ARG A 120 -6.533 14.361 -11.584 1.00 75.05 O ATOM 1840 CB ARG A 120 -9.599 12.748 -12.338 1.00 60.21 C ATOM 1841 CG ARG A 120 -9.670 13.094 -13.840 1.00 62.54 C ATOM 1842 CD ARG A 120 -10.346 11.995 -14.673 1.00 40.13 C ATOM 1843 NE ARG A 120 -10.641 12.458 -16.039 1.00 3.45 N ATOM 1844 CZ ARG A 120 -10.813 11.692 -17.096 1.00 40.31 C ATOM 1845 NH1 ARG A 120 -10.661 10.402 -17.026 1.00 15.51 N ATOM 1846 NH2 ARG A 120 -11.139 12.239 -18.223 1.00 74.31 N ATOM 0 H ARG A 120 -8.657 15.345 -12.878 1.00 34.33 H new ATOM 0 HA ARG A 120 -9.341 13.762 -10.453 1.00 71.25 H new ATOM 0 HB2 ARG A 120 -9.077 11.798 -12.224 1.00 60.21 H new ATOM 0 HB3 ARG A 120 -10.613 12.601 -11.966 1.00 60.21 H new ATOM 0 HG2 ARG A 120 -10.217 14.028 -13.967 1.00 62.54 H new ATOM 0 HG3 ARG A 120 -8.661 13.261 -14.218 1.00 62.54 H new ATOM 0 HD2 ARG A 120 -9.698 11.119 -14.716 1.00 40.13 H new ATOM 0 HD3 ARG A 120 -11.270 11.684 -14.186 1.00 40.13 H new ATOM 0 HE ARG A 120 -10.719 13.465 -16.180 1.00 3.45 H new ATOM 0 HH11 ARG A 120 -10.404 9.966 -16.140 1.00 15.51 H new ATOM 0 HH12 ARG A 120 -10.799 9.826 -17.857 1.00 15.51 H new ATOM 0 HH21 ARG A 120 -11.259 13.250 -18.283 1.00 74.31 H new ATOM 0 HH22 ARG A 120 -11.276 11.659 -19.051 1.00 74.31 H new ATOM 1860 N THR A 121 -7.072 12.340 -10.721 1.00 34.51 N ATOM 1861 CA THR A 121 -5.683 11.873 -10.515 1.00 45.13 C ATOM 1862 C THR A 121 -5.615 10.337 -10.619 1.00 11.43 C ATOM 1863 O THR A 121 -6.458 9.632 -10.056 1.00 14.44 O ATOM 1864 CB THR A 121 -5.108 12.343 -9.127 1.00 10.10 C ATOM 1865 OG1 THR A 121 -5.041 13.779 -9.093 1.00 63.44 O ATOM 1866 CG2 THR A 121 -3.706 11.770 -8.827 1.00 2.50 C ATOM 0 H THR A 121 -7.776 11.676 -10.399 1.00 34.51 H new ATOM 0 HA THR A 121 -5.069 12.317 -11.298 1.00 45.13 H new ATOM 0 HB THR A 121 -5.787 11.964 -8.363 1.00 10.10 H new ATOM 0 HG1 THR A 121 -5.920 14.142 -8.856 1.00 63.44 H new ATOM 0 HG21 THR A 121 -3.365 12.131 -7.857 1.00 2.50 H new ATOM 0 HG22 THR A 121 -3.753 10.681 -8.813 1.00 2.50 H new ATOM 0 HG23 THR A 121 -3.008 12.093 -9.600 1.00 2.50 H new ATOM 1874 N ARG A 122 -4.600 9.823 -11.337 1.00 0.21 N ATOM 1875 CA ARG A 122 -4.386 8.380 -11.515 1.00 44.24 C ATOM 1876 C ARG A 122 -3.192 7.911 -10.654 1.00 35.42 C ATOM 1877 O ARG A 122 -2.126 8.518 -10.697 1.00 45.41 O ATOM 1878 CB ARG A 122 -4.133 8.080 -13.010 1.00 4.42 C ATOM 1879 CG ARG A 122 -4.035 6.583 -13.353 1.00 35.32 C ATOM 1880 CD ARG A 122 -3.800 6.340 -14.852 1.00 10.32 C ATOM 1881 NE ARG A 122 -4.920 6.829 -15.680 1.00 31.22 N ATOM 1882 CZ ARG A 122 -4.904 6.959 -16.990 1.00 62.44 C ATOM 1883 NH1 ARG A 122 -3.837 6.711 -17.688 1.00 5.20 N ATOM 1884 NH2 ARG A 122 -5.973 7.359 -17.590 1.00 44.04 N ATOM 0 H ARG A 122 -3.905 10.400 -11.810 1.00 0.21 H new ATOM 0 HA ARG A 122 -5.274 7.837 -11.191 1.00 44.24 H new ATOM 0 HB2 ARG A 122 -4.937 8.522 -13.597 1.00 4.42 H new ATOM 0 HB3 ARG A 122 -3.209 8.571 -13.315 1.00 4.42 H new ATOM 0 HG2 ARG A 122 -3.221 6.135 -12.783 1.00 35.32 H new ATOM 0 HG3 ARG A 122 -4.953 6.082 -13.046 1.00 35.32 H new ATOM 0 HD2 ARG A 122 -2.880 6.837 -15.159 1.00 10.32 H new ATOM 0 HD3 ARG A 122 -3.660 5.273 -15.028 1.00 10.32 H new ATOM 0 HE ARG A 122 -5.780 7.088 -15.196 1.00 31.22 H new ATOM 0 HH11 ARG A 122 -2.982 6.407 -17.222 1.00 5.20 H new ATOM 0 HH12 ARG A 122 -3.854 6.820 -18.702 1.00 5.20 H new ATOM 0 HH21 ARG A 122 -6.813 7.569 -17.050 1.00 44.04 H new ATOM 0 HH22 ARG A 122 -5.979 7.465 -18.604 1.00 44.04 H new ATOM 1898 N MET A 123 -3.376 6.831 -9.888 1.00 60.31 N ATOM 1899 CA MET A 123 -2.323 6.244 -9.029 1.00 44.00 C ATOM 1900 C MET A 123 -1.809 4.910 -9.614 1.00 2.23 C ATOM 1901 O MET A 123 -2.571 4.167 -10.215 1.00 1.55 O ATOM 1902 CB MET A 123 -2.881 6.016 -7.604 1.00 20.24 C ATOM 1903 CG MET A 123 -1.856 5.474 -6.590 1.00 63.14 C ATOM 1904 SD MET A 123 -2.517 5.367 -4.915 1.00 43.10 S ATOM 1905 CE MET A 123 -3.911 4.273 -5.163 1.00 53.34 C ATOM 0 H MET A 123 -4.263 6.330 -9.841 1.00 60.31 H new ATOM 0 HA MET A 123 -1.485 6.940 -8.986 1.00 44.00 H new ATOM 0 HB2 MET A 123 -3.279 6.959 -7.229 1.00 20.24 H new ATOM 0 HB3 MET A 123 -3.717 5.319 -7.663 1.00 20.24 H new ATOM 0 HG2 MET A 123 -1.525 4.486 -6.909 1.00 63.14 H new ATOM 0 HG3 MET A 123 -0.978 6.119 -6.588 1.00 63.14 H new ATOM 0 HE1 MET A 123 -3.991 3.588 -4.319 1.00 53.34 H new ATOM 0 HE2 MET A 123 -4.826 4.861 -5.241 1.00 53.34 H new ATOM 0 HE3 MET A 123 -3.767 3.703 -6.081 1.00 53.34 H new ATOM 1915 N THR A 124 -0.505 4.633 -9.451 1.00 62.42 N ATOM 1916 CA THR A 124 0.098 3.316 -9.769 1.00 22.53 C ATOM 1917 C THR A 124 1.036 2.891 -8.618 1.00 61.31 C ATOM 1918 O THR A 124 2.036 3.564 -8.362 1.00 51.54 O ATOM 1919 CB THR A 124 0.894 3.345 -11.124 1.00 63.23 C ATOM 1920 OG1 THR A 124 0.031 3.769 -12.199 1.00 43.30 O ATOM 1921 CG2 THR A 124 1.495 1.964 -11.472 1.00 13.13 C ATOM 0 H THR A 124 0.167 5.313 -9.095 1.00 62.42 H new ATOM 0 HA THR A 124 -0.711 2.594 -9.881 1.00 22.53 H new ATOM 0 HB THR A 124 1.714 4.052 -11.000 1.00 63.23 H new ATOM 0 HG1 THR A 124 0.537 3.785 -13.038 1.00 43.30 H new ATOM 0 HG21 THR A 124 2.036 2.030 -12.416 1.00 13.13 H new ATOM 0 HG22 THR A 124 2.180 1.656 -10.682 1.00 13.13 H new ATOM 0 HG23 THR A 124 0.693 1.231 -11.564 1.00 13.13 H new ATOM 1929 N ILE A 125 0.697 1.792 -7.910 1.00 22.05 N ATOM 1930 CA ILE A 125 1.513 1.273 -6.783 1.00 34.43 C ATOM 1931 C ILE A 125 2.271 -0.005 -7.211 1.00 50.33 C ATOM 1932 O ILE A 125 1.649 -1.044 -7.425 1.00 70.31 O ATOM 1933 CB ILE A 125 0.629 0.937 -5.525 1.00 53.43 C ATOM 1934 CG1 ILE A 125 -0.368 2.092 -5.204 1.00 25.44 C ATOM 1935 CG2 ILE A 125 1.530 0.632 -4.295 1.00 23.34 C ATOM 1936 CD1 ILE A 125 -1.370 1.766 -4.106 1.00 43.04 C ATOM 0 H ILE A 125 -0.141 1.242 -8.098 1.00 22.05 H new ATOM 0 HA ILE A 125 2.219 2.058 -6.514 1.00 34.43 H new ATOM 0 HB ILE A 125 0.041 0.049 -5.757 1.00 53.43 H new ATOM 0 HG12 ILE A 125 0.199 2.976 -4.912 1.00 25.44 H new ATOM 0 HG13 ILE A 125 -0.913 2.349 -6.112 1.00 25.44 H new ATOM 0 HG21 ILE A 125 0.904 0.402 -3.433 1.00 23.34 H new ATOM 0 HG22 ILE A 125 2.171 -0.221 -4.516 1.00 23.34 H new ATOM 0 HG23 ILE A 125 2.148 1.502 -4.072 1.00 23.34 H new ATOM 0 HD11 ILE A 125 -2.025 2.622 -3.946 1.00 43.04 H new ATOM 0 HD12 ILE A 125 -1.966 0.903 -4.402 1.00 43.04 H new ATOM 0 HD13 ILE A 125 -0.837 1.539 -3.183 1.00 43.04 H new ATOM 1948 N ILE A 126 3.615 0.064 -7.303 1.00 24.40 N ATOM 1949 CA ILE A 126 4.449 -1.070 -7.767 1.00 20.22 C ATOM 1950 C ILE A 126 5.080 -1.802 -6.555 1.00 43.13 C ATOM 1951 O ILE A 126 5.993 -1.284 -5.917 1.00 31.51 O ATOM 1952 CB ILE A 126 5.609 -0.629 -8.765 1.00 43.13 C ATOM 1953 CG1 ILE A 126 5.091 0.260 -9.956 1.00 61.13 C ATOM 1954 CG2 ILE A 126 6.343 -1.881 -9.322 1.00 60.42 C ATOM 1955 CD1 ILE A 126 4.766 1.703 -9.619 1.00 11.12 C ATOM 0 H ILE A 126 4.151 0.897 -7.061 1.00 24.40 H new ATOM 0 HA ILE A 126 3.780 -1.735 -8.314 1.00 20.22 H new ATOM 0 HB ILE A 126 6.301 -0.017 -8.187 1.00 43.13 H new ATOM 0 HG12 ILE A 126 5.845 0.253 -10.743 1.00 61.13 H new ATOM 0 HG13 ILE A 126 4.196 -0.206 -10.368 1.00 61.13 H new ATOM 0 HG21 ILE A 126 7.134 -1.566 -10.003 1.00 60.42 H new ATOM 0 HG22 ILE A 126 6.778 -2.445 -8.497 1.00 60.42 H new ATOM 0 HG23 ILE A 126 5.633 -2.511 -9.857 1.00 60.42 H new ATOM 0 HD11 ILE A 126 4.419 2.217 -10.516 1.00 11.12 H new ATOM 0 HD12 ILE A 126 3.985 1.732 -8.859 1.00 11.12 H new ATOM 0 HD13 ILE A 126 5.660 2.198 -9.240 1.00 11.12 H new ATOM 1967 N SER A 127 4.571 -3.001 -6.258 1.00 3.41 N ATOM 1968 CA SER A 127 5.031 -3.849 -5.140 1.00 44.13 C ATOM 1969 C SER A 127 6.126 -4.822 -5.642 1.00 64.35 C ATOM 1970 O SER A 127 5.836 -5.776 -6.369 1.00 64.43 O ATOM 1971 CB SER A 127 3.812 -4.622 -4.566 1.00 35.45 C ATOM 1972 OG SER A 127 4.156 -5.435 -3.460 1.00 44.33 O ATOM 0 H SER A 127 3.813 -3.423 -6.794 1.00 3.41 H new ATOM 0 HA SER A 127 5.463 -3.236 -4.349 1.00 44.13 H new ATOM 0 HB2 SER A 127 3.044 -3.910 -4.264 1.00 35.45 H new ATOM 0 HB3 SER A 127 3.379 -5.244 -5.349 1.00 35.45 H new ATOM 0 HG SER A 127 4.345 -6.345 -3.770 1.00 44.33 H new ATOM 1978 N THR A 128 7.394 -4.545 -5.282 1.00 55.14 N ATOM 1979 CA THR A 128 8.573 -5.313 -5.764 1.00 53.52 C ATOM 1980 C THR A 128 9.130 -6.235 -4.658 1.00 71.21 C ATOM 1981 O THR A 128 9.364 -5.801 -3.532 1.00 33.02 O ATOM 1982 CB THR A 128 9.708 -4.359 -6.271 1.00 41.21 C ATOM 1983 OG1 THR A 128 10.148 -3.487 -5.213 1.00 62.15 O ATOM 1984 CG2 THR A 128 9.247 -3.505 -7.470 1.00 2.40 C ATOM 0 H THR A 128 7.637 -3.783 -4.649 1.00 55.14 H new ATOM 0 HA THR A 128 8.233 -5.927 -6.598 1.00 53.52 H new ATOM 0 HB THR A 128 10.534 -4.992 -6.594 1.00 41.21 H new ATOM 0 HG1 THR A 128 9.397 -2.934 -4.911 1.00 62.15 H new ATOM 0 HG21 THR A 128 10.063 -2.858 -7.791 1.00 2.40 H new ATOM 0 HG22 THR A 128 8.958 -4.159 -8.293 1.00 2.40 H new ATOM 0 HG23 THR A 128 8.394 -2.894 -7.175 1.00 2.40 H new ATOM 1992 N PHE A 129 9.378 -7.503 -5.004 1.00 74.40 N ATOM 1993 CA PHE A 129 9.737 -8.569 -4.041 1.00 50.13 C ATOM 1994 C PHE A 129 11.240 -8.905 -4.139 1.00 53.04 C ATOM 1995 O PHE A 129 11.816 -8.867 -5.235 1.00 51.12 O ATOM 1996 CB PHE A 129 8.860 -9.819 -4.323 1.00 44.11 C ATOM 1997 CG PHE A 129 7.368 -9.478 -4.400 1.00 5.14 C ATOM 1998 CD1 PHE A 129 6.666 -9.107 -3.262 1.00 35.00 C ATOM 1999 CD2 PHE A 129 6.683 -9.469 -5.617 1.00 13.55 C ATOM 2000 CE1 PHE A 129 5.335 -8.751 -3.332 1.00 44.02 C ATOM 2001 CE2 PHE A 129 5.346 -9.125 -5.682 1.00 13.50 C ATOM 2002 CZ PHE A 129 4.676 -8.756 -4.540 1.00 50.32 C ATOM 0 H PHE A 129 9.337 -7.829 -5.970 1.00 74.40 H new ATOM 0 HA PHE A 129 9.548 -8.225 -3.024 1.00 50.13 H new ATOM 0 HB2 PHE A 129 9.175 -10.277 -5.261 1.00 44.11 H new ATOM 0 HB3 PHE A 129 9.021 -10.558 -3.538 1.00 44.11 H new ATOM 0 HD1 PHE A 129 7.169 -9.097 -2.307 1.00 35.00 H new ATOM 0 HD2 PHE A 129 7.207 -9.735 -6.523 1.00 13.55 H new ATOM 0 HE1 PHE A 129 4.807 -8.467 -2.434 1.00 44.02 H new ATOM 0 HE2 PHE A 129 4.828 -9.146 -6.629 1.00 13.50 H new ATOM 0 HZ PHE A 129 3.636 -8.471 -4.591 1.00 50.32 H new ATOM 2012 N GLU A 130 11.871 -9.243 -2.994 1.00 31.15 N ATOM 2013 CA GLU A 130 13.329 -9.527 -2.927 1.00 75.14 C ATOM 2014 C GLU A 130 13.696 -10.861 -3.635 1.00 22.01 C ATOM 2015 O GLU A 130 14.790 -10.999 -4.188 1.00 30.42 O ATOM 2016 CB GLU A 130 13.793 -9.553 -1.443 1.00 13.54 C ATOM 2017 CG GLU A 130 13.162 -10.679 -0.584 1.00 13.44 C ATOM 2018 CD GLU A 130 13.477 -10.570 0.919 1.00 14.14 C ATOM 2019 OE1 GLU A 130 14.542 -11.060 1.355 1.00 43.15 O ATOM 2020 OE2 GLU A 130 12.659 -9.985 1.674 1.00 2.04 O ATOM 0 H GLU A 130 11.394 -9.327 -2.096 1.00 31.15 H new ATOM 0 HA GLU A 130 13.849 -8.729 -3.456 1.00 75.14 H new ATOM 0 HB2 GLU A 130 14.877 -9.661 -1.418 1.00 13.54 H new ATOM 0 HB3 GLU A 130 13.557 -8.592 -0.986 1.00 13.54 H new ATOM 0 HG2 GLU A 130 12.081 -10.663 -0.720 1.00 13.44 H new ATOM 0 HG3 GLU A 130 13.516 -11.643 -0.950 1.00 13.44 H new ATOM 2027 N SER A 131 12.758 -11.831 -3.604 1.00 20.30 N ATOM 2028 CA SER A 131 12.939 -13.184 -4.191 1.00 65.11 C ATOM 2029 C SER A 131 11.582 -13.770 -4.648 1.00 71.10 C ATOM 2030 O SER A 131 10.510 -13.264 -4.282 1.00 12.42 O ATOM 2031 CB SER A 131 13.619 -14.140 -3.175 1.00 61.50 C ATOM 2032 OG SER A 131 14.913 -13.696 -2.817 1.00 43.11 O ATOM 0 H SER A 131 11.845 -11.700 -3.168 1.00 20.30 H new ATOM 0 HA SER A 131 13.587 -13.087 -5.062 1.00 65.11 H new ATOM 0 HB2 SER A 131 13.001 -14.217 -2.280 1.00 61.50 H new ATOM 0 HB3 SER A 131 13.684 -15.140 -3.605 1.00 61.50 H new ATOM 0 HG SER A 131 15.308 -14.322 -2.175 1.00 43.11 H new ATOM 2038 N GLU A 132 11.650 -14.849 -5.446 1.00 74.55 N ATOM 2039 CA GLU A 132 10.465 -15.484 -6.064 1.00 24.54 C ATOM 2040 C GLU A 132 9.532 -16.168 -5.033 1.00 73.42 C ATOM 2041 O GLU A 132 8.312 -16.094 -5.174 1.00 23.14 O ATOM 2042 CB GLU A 132 10.917 -16.489 -7.148 1.00 54.31 C ATOM 2043 CG GLU A 132 9.769 -17.093 -7.977 1.00 45.12 C ATOM 2044 CD GLU A 132 10.257 -18.073 -9.055 1.00 65.35 C ATOM 2045 OE1 GLU A 132 10.559 -19.242 -8.721 1.00 5.23 O ATOM 2046 OE2 GLU A 132 10.337 -17.693 -10.241 1.00 4.41 O ATOM 0 H GLU A 132 12.529 -15.309 -5.684 1.00 74.55 H new ATOM 0 HA GLU A 132 9.876 -14.689 -6.522 1.00 24.54 H new ATOM 0 HB2 GLU A 132 11.611 -15.988 -7.823 1.00 54.31 H new ATOM 0 HB3 GLU A 132 11.467 -17.299 -6.668 1.00 54.31 H new ATOM 0 HG2 GLU A 132 9.079 -17.610 -7.310 1.00 45.12 H new ATOM 0 HG3 GLU A 132 9.209 -16.288 -8.453 1.00 45.12 H new ATOM 2053 N GLU A 133 10.110 -16.822 -4.006 1.00 34.24 N ATOM 2054 CA GLU A 133 9.324 -17.495 -2.925 1.00 13.43 C ATOM 2055 C GLU A 133 8.400 -16.508 -2.135 1.00 20.34 C ATOM 2056 O GLU A 133 7.334 -16.901 -1.646 1.00 41.31 O ATOM 2057 CB GLU A 133 10.269 -18.326 -1.984 1.00 63.12 C ATOM 2058 CG GLU A 133 11.622 -17.665 -1.589 1.00 20.14 C ATOM 2059 CD GLU A 133 11.502 -16.472 -0.616 1.00 51.12 C ATOM 2060 OE1 GLU A 133 11.425 -16.697 0.608 1.00 51.24 O ATOM 2061 OE2 GLU A 133 11.489 -15.312 -1.075 1.00 15.51 O ATOM 0 H GLU A 133 11.120 -16.905 -3.893 1.00 34.24 H new ATOM 0 HA GLU A 133 8.643 -18.195 -3.409 1.00 13.43 H new ATOM 0 HB2 GLU A 133 9.722 -18.554 -1.069 1.00 63.12 H new ATOM 0 HB3 GLU A 133 10.485 -19.276 -2.472 1.00 63.12 H new ATOM 0 HG2 GLU A 133 12.261 -18.422 -1.135 1.00 20.14 H new ATOM 0 HG3 GLU A 133 12.123 -17.327 -2.496 1.00 20.14 H new ATOM 2068 N GLN A 134 8.813 -15.228 -2.052 1.00 75.33 N ATOM 2069 CA GLN A 134 8.002 -14.144 -1.450 1.00 32.32 C ATOM 2070 C GLN A 134 6.854 -13.730 -2.401 1.00 31.14 C ATOM 2071 O GLN A 134 5.713 -13.514 -1.977 1.00 72.24 O ATOM 2072 CB GLN A 134 8.890 -12.909 -1.169 1.00 42.13 C ATOM 2073 CG GLN A 134 8.196 -11.816 -0.334 1.00 43.33 C ATOM 2074 CD GLN A 134 8.817 -10.438 -0.457 1.00 62.40 C ATOM 2075 OE1 GLN A 134 9.995 -10.280 -0.737 1.00 34.35 O ATOM 2076 NE2 GLN A 134 8.023 -9.428 -0.227 1.00 61.12 N ATOM 0 H GLN A 134 9.719 -14.913 -2.400 1.00 75.33 H new ATOM 0 HA GLN A 134 7.580 -14.516 -0.516 1.00 32.32 H new ATOM 0 HB2 GLN A 134 9.791 -13.233 -0.648 1.00 42.13 H new ATOM 0 HB3 GLN A 134 9.208 -12.479 -2.119 1.00 42.13 H new ATOM 0 HG2 GLN A 134 7.150 -11.757 -0.635 1.00 43.33 H new ATOM 0 HG3 GLN A 134 8.210 -12.114 0.714 1.00 43.33 H new ATOM 0 HE21 GLN A 134 7.043 -9.592 0.005 1.00 61.12 H new ATOM 0 HE22 GLN A 134 8.382 -8.475 -0.279 1.00 61.12 H new ATOM 2085 N MET A 135 7.207 -13.604 -3.696 1.00 64.53 N ATOM 2086 CA MET A 135 6.245 -13.365 -4.802 1.00 42.10 C ATOM 2087 C MET A 135 5.137 -14.462 -4.829 1.00 5.20 C ATOM 2088 O MET A 135 3.967 -14.173 -5.119 1.00 43.42 O ATOM 2089 CB MET A 135 7.045 -13.253 -6.152 1.00 13.24 C ATOM 2090 CG MET A 135 6.339 -13.769 -7.418 1.00 43.51 C ATOM 2091 SD MET A 135 4.787 -12.934 -7.798 1.00 33.22 S ATOM 2092 CE MET A 135 5.318 -11.358 -8.467 1.00 41.21 C ATOM 0 H MET A 135 8.175 -13.665 -4.011 1.00 64.53 H new ATOM 0 HA MET A 135 5.716 -12.424 -4.647 1.00 42.10 H new ATOM 0 HB2 MET A 135 7.303 -12.206 -6.309 1.00 13.24 H new ATOM 0 HB3 MET A 135 7.982 -13.798 -6.039 1.00 13.24 H new ATOM 0 HG2 MET A 135 7.014 -13.658 -8.266 1.00 43.51 H new ATOM 0 HG3 MET A 135 6.145 -14.835 -7.302 1.00 43.51 H new ATOM 0 HE1 MET A 135 4.699 -10.561 -8.055 1.00 41.21 H new ATOM 0 HE2 MET A 135 6.360 -11.182 -8.201 1.00 41.21 H new ATOM 0 HE3 MET A 135 5.218 -11.371 -9.552 1.00 41.21 H new ATOM 2102 N GLN A 136 5.516 -15.709 -4.480 1.00 54.51 N ATOM 2103 CA GLN A 136 4.558 -16.824 -4.328 1.00 33.14 C ATOM 2104 C GLN A 136 3.638 -16.587 -3.106 1.00 75.41 C ATOM 2105 O GLN A 136 2.423 -16.675 -3.227 1.00 61.13 O ATOM 2106 CB GLN A 136 5.296 -18.182 -4.170 1.00 24.14 C ATOM 2107 CG GLN A 136 6.264 -18.549 -5.313 1.00 32.12 C ATOM 2108 CD GLN A 136 5.620 -18.562 -6.703 1.00 31.42 C ATOM 2109 OE1 GLN A 136 5.090 -19.573 -7.145 1.00 24.44 O ATOM 2110 NE2 GLN A 136 5.678 -17.440 -7.400 1.00 14.11 N ATOM 0 H GLN A 136 6.485 -15.970 -4.297 1.00 54.51 H new ATOM 0 HA GLN A 136 3.951 -16.862 -5.233 1.00 33.14 H new ATOM 0 HB2 GLN A 136 5.856 -18.165 -3.235 1.00 24.14 H new ATOM 0 HB3 GLN A 136 4.551 -18.972 -4.081 1.00 24.14 H new ATOM 0 HG2 GLN A 136 7.091 -17.839 -5.315 1.00 32.12 H new ATOM 0 HG3 GLN A 136 6.688 -19.533 -5.113 1.00 32.12 H new ATOM 0 HE21 GLN A 136 6.127 -16.615 -7.002 1.00 14.11 H new ATOM 0 HE22 GLN A 136 5.274 -17.399 -8.336 1.00 14.11 H new ATOM 2119 N LYS A 137 4.250 -16.244 -1.945 1.00 52.41 N ATOM 2120 CA LYS A 137 3.533 -16.049 -0.651 1.00 24.02 C ATOM 2121 C LYS A 137 2.376 -15.034 -0.736 1.00 5.43 C ATOM 2122 O LYS A 137 1.340 -15.227 -0.106 1.00 43.42 O ATOM 2123 CB LYS A 137 4.523 -15.609 0.475 1.00 74.13 C ATOM 2124 CG LYS A 137 5.188 -16.761 1.248 1.00 23.20 C ATOM 2125 CD LYS A 137 4.156 -17.742 1.868 1.00 2.43 C ATOM 2126 CE LYS A 137 4.731 -18.560 3.039 1.00 25.43 C ATOM 2127 NZ LYS A 137 6.063 -19.162 2.733 1.00 40.52 N ATOM 0 H LYS A 137 5.256 -16.094 -1.875 1.00 52.41 H new ATOM 0 HA LYS A 137 3.098 -17.019 -0.409 1.00 24.02 H new ATOM 0 HB2 LYS A 137 5.304 -14.993 0.030 1.00 74.13 H new ATOM 0 HB3 LYS A 137 3.985 -14.979 1.184 1.00 74.13 H new ATOM 0 HG2 LYS A 137 5.847 -17.311 0.576 1.00 23.20 H new ATOM 0 HG3 LYS A 137 5.812 -16.348 2.041 1.00 23.20 H new ATOM 0 HD2 LYS A 137 3.291 -17.178 2.216 1.00 2.43 H new ATOM 0 HD3 LYS A 137 3.802 -18.424 1.095 1.00 2.43 H new ATOM 0 HE2 LYS A 137 4.822 -17.917 3.914 1.00 25.43 H new ATOM 0 HE3 LYS A 137 4.031 -19.354 3.298 1.00 25.43 H new ATOM 0 HZ1 LYS A 137 6.422 -19.657 3.574 1.00 40.52 H new ATOM 0 HZ2 LYS A 137 5.967 -19.838 1.948 1.00 40.52 H new ATOM 0 HZ3 LYS A 137 6.730 -18.411 2.463 1.00 40.52 H new ATOM 2141 N MET A 138 2.576 -13.950 -1.492 1.00 25.01 N ATOM 2142 CA MET A 138 1.540 -12.900 -1.679 1.00 12.35 C ATOM 2143 C MET A 138 0.297 -13.456 -2.404 1.00 33.03 C ATOM 2144 O MET A 138 -0.839 -13.077 -2.108 1.00 5.30 O ATOM 2145 CB MET A 138 2.135 -11.705 -2.457 1.00 71.55 C ATOM 2146 CG MET A 138 3.346 -11.043 -1.781 1.00 15.02 C ATOM 2147 SD MET A 138 2.956 -10.230 -0.208 1.00 11.01 S ATOM 2148 CE MET A 138 3.312 -11.506 1.000 1.00 30.43 C ATOM 0 H MET A 138 3.446 -13.766 -1.991 1.00 25.01 H new ATOM 0 HA MET A 138 1.219 -12.559 -0.694 1.00 12.35 H new ATOM 0 HB2 MET A 138 2.430 -12.045 -3.450 1.00 71.55 H new ATOM 0 HB3 MET A 138 1.357 -10.954 -2.595 1.00 71.55 H new ATOM 0 HG2 MET A 138 4.111 -11.799 -1.608 1.00 15.02 H new ATOM 0 HG3 MET A 138 3.773 -10.308 -2.463 1.00 15.02 H new ATOM 0 HE1 MET A 138 2.423 -11.697 1.600 1.00 30.43 H new ATOM 0 HE2 MET A 138 3.607 -12.421 0.486 1.00 30.43 H new ATOM 0 HE3 MET A 138 4.124 -11.177 1.649 1.00 30.43 H new ATOM 2158 N ALA A 139 0.538 -14.371 -3.346 1.00 60.11 N ATOM 2159 CA ALA A 139 -0.525 -15.056 -4.096 1.00 33.52 C ATOM 2160 C ALA A 139 -1.186 -16.192 -3.257 1.00 15.33 C ATOM 2161 O ALA A 139 -2.397 -16.405 -3.340 1.00 61.25 O ATOM 2162 CB ALA A 139 0.054 -15.575 -5.423 1.00 54.13 C ATOM 0 H ALA A 139 1.479 -14.661 -3.613 1.00 60.11 H new ATOM 0 HA ALA A 139 -1.323 -14.347 -4.315 1.00 33.52 H new ATOM 0 HB1 ALA A 139 -0.728 -16.085 -5.986 1.00 54.13 H new ATOM 0 HB2 ALA A 139 0.434 -14.737 -6.007 1.00 54.13 H new ATOM 0 HB3 ALA A 139 0.867 -16.272 -5.218 1.00 54.13 H new ATOM 2168 N GLU A 140 -0.376 -16.888 -2.424 1.00 33.10 N ATOM 2169 CA GLU A 140 -0.853 -18.007 -1.553 1.00 32.33 C ATOM 2170 C GLU A 140 -1.747 -17.501 -0.392 1.00 3.34 C ATOM 2171 O GLU A 140 -2.758 -18.120 -0.053 1.00 63.34 O ATOM 2172 CB GLU A 140 0.349 -18.804 -0.966 1.00 34.35 C ATOM 2173 CG GLU A 140 1.331 -19.390 -2.006 1.00 21.45 C ATOM 2174 CD GLU A 140 0.662 -20.301 -3.050 1.00 75.51 C ATOM 2175 OE1 GLU A 140 0.387 -21.479 -2.739 1.00 42.44 O ATOM 2176 OE2 GLU A 140 0.406 -19.847 -4.190 1.00 70.40 O ATOM 0 H GLU A 140 0.622 -16.697 -2.332 1.00 33.10 H new ATOM 0 HA GLU A 140 -1.452 -18.662 -2.186 1.00 32.33 H new ATOM 0 HB2 GLU A 140 0.905 -18.148 -0.297 1.00 34.35 H new ATOM 0 HB3 GLU A 140 -0.041 -19.621 -0.360 1.00 34.35 H new ATOM 0 HG2 GLU A 140 1.832 -18.570 -2.521 1.00 21.45 H new ATOM 0 HG3 GLU A 140 2.102 -19.957 -1.484 1.00 21.45 H new ATOM 2183 N MET A 141 -1.341 -16.375 0.210 1.00 42.04 N ATOM 2184 CA MET A 141 -2.071 -15.715 1.325 1.00 71.11 C ATOM 2185 C MET A 141 -3.243 -14.828 0.831 1.00 40.35 C ATOM 2186 O MET A 141 -3.992 -14.287 1.652 1.00 54.04 O ATOM 2187 CB MET A 141 -1.065 -14.857 2.140 1.00 12.12 C ATOM 2188 CG MET A 141 0.039 -15.667 2.848 1.00 24.41 C ATOM 2189 SD MET A 141 -0.538 -16.507 4.343 1.00 3.03 S ATOM 2190 CE MET A 141 -0.872 -15.127 5.446 1.00 31.03 C ATOM 0 H MET A 141 -0.489 -15.884 -0.059 1.00 42.04 H new ATOM 0 HA MET A 141 -2.509 -16.495 1.948 1.00 71.11 H new ATOM 0 HB2 MET A 141 -0.596 -14.136 1.471 1.00 12.12 H new ATOM 0 HB3 MET A 141 -1.616 -14.287 2.888 1.00 12.12 H new ATOM 0 HG2 MET A 141 0.438 -16.407 2.155 1.00 24.41 H new ATOM 0 HG3 MET A 141 0.860 -14.999 3.109 1.00 24.41 H new ATOM 0 HE1 MET A 141 -0.694 -15.434 6.477 1.00 31.03 H new ATOM 0 HE2 MET A 141 -0.214 -14.294 5.197 1.00 31.03 H new ATOM 0 HE3 MET A 141 -1.910 -14.815 5.334 1.00 31.03 H new ATOM 2200 N GLY A 142 -3.380 -14.661 -0.503 1.00 63.33 N ATOM 2201 CA GLY A 142 -4.430 -13.800 -1.089 1.00 72.32 C ATOM 2202 C GLY A 142 -4.197 -12.299 -0.866 1.00 31.51 C ATOM 2203 O GLY A 142 -5.122 -11.493 -0.982 1.00 54.21 O ATOM 0 H GLY A 142 -2.778 -15.110 -1.193 1.00 63.33 H new ATOM 0 HA2 GLY A 142 -4.490 -13.994 -2.160 1.00 72.32 H new ATOM 0 HA3 GLY A 142 -5.394 -14.076 -0.661 1.00 72.32 H new ATOM 2207 N MET A 143 -2.938 -11.936 -0.561 1.00 31.51 N ATOM 2208 CA MET A 143 -2.505 -10.536 -0.337 1.00 14.34 C ATOM 2209 C MET A 143 -2.576 -9.726 -1.660 1.00 34.51 C ATOM 2210 O MET A 143 -2.851 -8.526 -1.646 1.00 5.34 O ATOM 2211 CB MET A 143 -1.067 -10.562 0.264 1.00 60.22 C ATOM 2212 CG MET A 143 -0.480 -9.206 0.708 1.00 3.44 C ATOM 2213 SD MET A 143 0.065 -8.167 -0.669 1.00 21.23 S ATOM 2214 CE MET A 143 0.866 -6.807 0.195 1.00 54.42 C ATOM 0 H MET A 143 -2.180 -12.611 -0.461 1.00 31.51 H new ATOM 0 HA MET A 143 -3.171 -10.036 0.366 1.00 14.34 H new ATOM 0 HB2 MET A 143 -1.069 -11.231 1.125 1.00 60.22 H new ATOM 0 HB3 MET A 143 -0.396 -10.998 -0.476 1.00 60.22 H new ATOM 0 HG2 MET A 143 -1.231 -8.666 1.285 1.00 3.44 H new ATOM 0 HG3 MET A 143 0.365 -9.386 1.373 1.00 3.44 H new ATOM 0 HE1 MET A 143 1.249 -6.090 -0.531 1.00 54.42 H new ATOM 0 HE2 MET A 143 0.144 -6.314 0.846 1.00 54.42 H new ATOM 0 HE3 MET A 143 1.691 -7.192 0.795 1.00 54.42 H new ATOM 2224 N GLU A 144 -2.354 -10.432 -2.792 1.00 64.22 N ATOM 2225 CA GLU A 144 -2.477 -9.880 -4.168 1.00 63.41 C ATOM 2226 C GLU A 144 -3.841 -9.165 -4.398 1.00 11.03 C ATOM 2227 O GLU A 144 -3.886 -7.955 -4.670 1.00 51.03 O ATOM 2228 CB GLU A 144 -2.282 -11.051 -5.187 1.00 3.34 C ATOM 2229 CG GLU A 144 -2.741 -10.774 -6.639 1.00 35.53 C ATOM 2230 CD GLU A 144 -2.532 -11.964 -7.590 1.00 50.35 C ATOM 2231 OE1 GLU A 144 -3.089 -13.053 -7.325 1.00 10.52 O ATOM 2232 OE2 GLU A 144 -1.821 -11.821 -8.607 1.00 1.52 O ATOM 0 H GLU A 144 -2.081 -11.415 -2.779 1.00 64.22 H new ATOM 0 HA GLU A 144 -1.708 -9.121 -4.313 1.00 63.41 H new ATOM 0 HB2 GLU A 144 -1.225 -11.317 -5.206 1.00 3.34 H new ATOM 0 HB3 GLU A 144 -2.823 -11.922 -4.816 1.00 3.34 H new ATOM 0 HG2 GLU A 144 -3.798 -10.507 -6.632 1.00 35.53 H new ATOM 0 HG3 GLU A 144 -2.197 -9.912 -7.025 1.00 35.53 H new ATOM 2239 N GLU A 145 -4.946 -9.922 -4.264 1.00 3.43 N ATOM 2240 CA GLU A 145 -6.311 -9.380 -4.442 1.00 52.21 C ATOM 2241 C GLU A 145 -6.750 -8.540 -3.217 1.00 3.32 C ATOM 2242 O GLU A 145 -7.401 -7.516 -3.381 1.00 11.13 O ATOM 2243 CB GLU A 145 -7.317 -10.522 -4.733 1.00 53.31 C ATOM 2244 CG GLU A 145 -7.375 -11.633 -3.660 1.00 51.35 C ATOM 2245 CD GLU A 145 -8.391 -12.736 -3.992 1.00 54.22 C ATOM 2246 OE1 GLU A 145 -8.067 -13.629 -4.808 1.00 4.12 O ATOM 2247 OE2 GLU A 145 -9.524 -12.708 -3.456 1.00 24.10 O ATOM 0 H GLU A 145 -4.922 -10.915 -4.032 1.00 3.43 H new ATOM 0 HA GLU A 145 -6.299 -8.712 -5.303 1.00 52.21 H new ATOM 0 HB2 GLU A 145 -8.312 -10.090 -4.841 1.00 53.31 H new ATOM 0 HB3 GLU A 145 -7.061 -10.976 -5.690 1.00 53.31 H new ATOM 0 HG2 GLU A 145 -6.386 -12.078 -3.552 1.00 51.35 H new ATOM 0 HG3 GLU A 145 -7.631 -11.189 -2.698 1.00 51.35 H new ATOM 2254 N GLY A 146 -6.344 -8.975 -1.999 1.00 3.52 N ATOM 2255 CA GLY A 146 -6.681 -8.273 -0.742 1.00 64.41 C ATOM 2256 C GLY A 146 -6.217 -6.807 -0.703 1.00 35.41 C ATOM 2257 O GLY A 146 -6.886 -5.945 -0.118 1.00 72.35 O ATOM 0 H GLY A 146 -5.780 -9.814 -1.864 1.00 3.52 H new ATOM 0 HA2 GLY A 146 -7.761 -8.306 -0.597 1.00 64.41 H new ATOM 0 HA3 GLY A 146 -6.231 -8.809 0.094 1.00 64.41 H new ATOM 2261 N MET A 147 -5.068 -6.543 -1.343 1.00 31.25 N ATOM 2262 CA MET A 147 -4.519 -5.185 -1.517 1.00 13.15 C ATOM 2263 C MET A 147 -5.420 -4.326 -2.450 1.00 22.41 C ATOM 2264 O MET A 147 -5.708 -3.165 -2.152 1.00 50.12 O ATOM 2265 CB MET A 147 -3.086 -5.291 -2.090 1.00 34.03 C ATOM 2266 CG MET A 147 -2.378 -3.952 -2.296 1.00 73.13 C ATOM 2267 SD MET A 147 -0.734 -4.142 -3.019 1.00 24.40 S ATOM 2268 CE MET A 147 -0.289 -2.430 -3.288 1.00 2.30 C ATOM 0 H MET A 147 -4.487 -7.271 -1.759 1.00 31.25 H new ATOM 0 HA MET A 147 -4.491 -4.688 -0.547 1.00 13.15 H new ATOM 0 HB2 MET A 147 -2.485 -5.904 -1.418 1.00 34.03 H new ATOM 0 HB3 MET A 147 -3.129 -5.814 -3.045 1.00 34.03 H new ATOM 0 HG2 MET A 147 -2.985 -3.320 -2.944 1.00 73.13 H new ATOM 0 HG3 MET A 147 -2.293 -3.439 -1.338 1.00 73.13 H new ATOM 0 HE1 MET A 147 0.768 -2.365 -3.546 1.00 2.30 H new ATOM 0 HE2 MET A 147 -0.887 -2.022 -4.103 1.00 2.30 H new ATOM 0 HE3 MET A 147 -0.476 -1.858 -2.379 1.00 2.30 H new ATOM 2278 N ARG A 148 -5.871 -4.938 -3.563 1.00 73.33 N ATOM 2279 CA ARG A 148 -6.763 -4.295 -4.563 1.00 73.22 C ATOM 2280 C ARG A 148 -8.104 -3.833 -3.930 1.00 70.12 C ATOM 2281 O ARG A 148 -8.601 -2.746 -4.250 1.00 72.31 O ATOM 2282 CB ARG A 148 -7.042 -5.286 -5.725 1.00 72.12 C ATOM 2283 CG ARG A 148 -8.005 -4.753 -6.819 1.00 54.21 C ATOM 2284 CD ARG A 148 -8.481 -5.849 -7.779 1.00 1.21 C ATOM 2285 NE ARG A 148 -9.169 -6.922 -7.048 1.00 74.34 N ATOM 2286 CZ ARG A 148 -9.570 -8.061 -7.549 1.00 31.52 C ATOM 2287 NH1 ARG A 148 -9.436 -8.339 -8.810 1.00 4.10 N ATOM 2288 NH2 ARG A 148 -10.113 -8.922 -6.762 1.00 13.15 N ATOM 0 H ARG A 148 -5.628 -5.900 -3.800 1.00 73.33 H new ATOM 0 HA ARG A 148 -6.255 -3.409 -4.943 1.00 73.22 H new ATOM 0 HB2 ARG A 148 -6.094 -5.551 -6.193 1.00 72.12 H new ATOM 0 HB3 ARG A 148 -7.459 -6.203 -5.309 1.00 72.12 H new ATOM 0 HG2 ARG A 148 -8.871 -4.294 -6.342 1.00 54.21 H new ATOM 0 HG3 ARG A 148 -7.503 -3.971 -7.389 1.00 54.21 H new ATOM 0 HD2 ARG A 148 -9.153 -5.420 -8.522 1.00 1.21 H new ATOM 0 HD3 ARG A 148 -7.629 -6.260 -8.320 1.00 1.21 H new ATOM 0 HE ARG A 148 -9.351 -6.763 -6.057 1.00 74.34 H new ATOM 0 HH11 ARG A 148 -9.008 -7.660 -9.439 1.00 4.10 H new ATOM 0 HH12 ARG A 148 -9.759 -9.237 -9.171 1.00 4.10 H new ATOM 0 HH21 ARG A 148 -10.223 -8.709 -5.771 1.00 13.15 H new ATOM 0 HH22 ARG A 148 -10.434 -9.818 -7.130 1.00 13.15 H new ATOM 2302 N GLU A 149 -8.662 -4.672 -3.025 1.00 41.13 N ATOM 2303 CA GLU A 149 -9.936 -4.374 -2.313 1.00 41.34 C ATOM 2304 C GLU A 149 -9.817 -3.040 -1.526 1.00 43.01 C ATOM 2305 O GLU A 149 -10.721 -2.194 -1.558 1.00 5.51 O ATOM 2306 CB GLU A 149 -10.320 -5.523 -1.322 1.00 31.52 C ATOM 2307 CG GLU A 149 -10.114 -6.975 -1.829 1.00 33.45 C ATOM 2308 CD GLU A 149 -10.823 -7.321 -3.153 1.00 45.43 C ATOM 2309 OE1 GLU A 149 -12.012 -7.699 -3.126 1.00 60.35 O ATOM 2310 OE2 GLU A 149 -10.193 -7.239 -4.232 1.00 32.22 O ATOM 0 H GLU A 149 -8.249 -5.568 -2.767 1.00 41.13 H new ATOM 0 HA GLU A 149 -10.718 -4.288 -3.067 1.00 41.34 H new ATOM 0 HB2 GLU A 149 -9.738 -5.395 -0.410 1.00 31.52 H new ATOM 0 HB3 GLU A 149 -11.369 -5.402 -1.050 1.00 31.52 H new ATOM 0 HG2 GLU A 149 -9.045 -7.150 -1.953 1.00 33.45 H new ATOM 0 HG3 GLU A 149 -10.463 -7.663 -1.059 1.00 33.45 H new ATOM 2317 N ALA A 150 -8.654 -2.881 -0.851 1.00 62.34 N ATOM 2318 CA ALA A 150 -8.291 -1.664 -0.089 1.00 33.12 C ATOM 2319 C ALA A 150 -8.211 -0.415 -1.000 1.00 74.25 C ATOM 2320 O ALA A 150 -8.697 0.662 -0.648 1.00 53.23 O ATOM 2321 CB ALA A 150 -6.950 -1.890 0.639 1.00 21.41 C ATOM 0 H ALA A 150 -7.934 -3.603 -0.820 1.00 62.34 H new ATOM 0 HA ALA A 150 -9.076 -1.477 0.644 1.00 33.12 H new ATOM 0 HB1 ALA A 150 -6.684 -0.993 1.199 1.00 21.41 H new ATOM 0 HB2 ALA A 150 -7.046 -2.731 1.325 1.00 21.41 H new ATOM 0 HB3 ALA A 150 -6.171 -2.105 -0.092 1.00 21.41 H new ATOM 2327 N ILE A 151 -7.611 -0.587 -2.188 1.00 15.41 N ATOM 2328 CA ILE A 151 -7.401 0.513 -3.158 1.00 73.23 C ATOM 2329 C ILE A 151 -8.747 0.993 -3.795 1.00 33.23 C ATOM 2330 O ILE A 151 -8.848 2.120 -4.299 1.00 61.11 O ATOM 2331 CB ILE A 151 -6.342 0.070 -4.245 1.00 42.51 C ATOM 2332 CG1 ILE A 151 -5.006 -0.346 -3.543 1.00 12.00 C ATOM 2333 CG2 ILE A 151 -6.079 1.178 -5.299 1.00 53.42 C ATOM 2334 CD1 ILE A 151 -3.944 -0.921 -4.462 1.00 52.40 C ATOM 0 H ILE A 151 -7.256 -1.488 -2.508 1.00 15.41 H new ATOM 0 HA ILE A 151 -7.000 1.377 -2.627 1.00 73.23 H new ATOM 0 HB ILE A 151 -6.756 -0.784 -4.781 1.00 42.51 H new ATOM 0 HG12 ILE A 151 -4.593 0.527 -3.038 1.00 12.00 H new ATOM 0 HG13 ILE A 151 -5.233 -1.082 -2.772 1.00 12.00 H new ATOM 0 HG21 ILE A 151 -5.345 0.825 -6.023 1.00 53.42 H new ATOM 0 HG22 ILE A 151 -7.009 1.419 -5.814 1.00 53.42 H new ATOM 0 HG23 ILE A 151 -5.698 2.070 -4.802 1.00 53.42 H new ATOM 0 HD11 ILE A 151 -3.059 -1.177 -3.880 1.00 52.40 H new ATOM 0 HD12 ILE A 151 -4.330 -1.817 -4.949 1.00 52.40 H new ATOM 0 HD13 ILE A 151 -3.679 -0.183 -5.219 1.00 52.40 H new ATOM 2346 N GLU A 152 -9.786 0.143 -3.727 1.00 53.35 N ATOM 2347 CA GLU A 152 -11.168 0.512 -4.128 1.00 22.32 C ATOM 2348 C GLU A 152 -11.984 1.100 -2.950 1.00 2.33 C ATOM 2349 O GLU A 152 -13.057 1.677 -3.156 1.00 43.23 O ATOM 2350 CB GLU A 152 -11.881 -0.699 -4.768 1.00 32.23 C ATOM 2351 CG GLU A 152 -11.166 -1.199 -6.038 1.00 44.34 C ATOM 2352 CD GLU A 152 -11.962 -2.200 -6.873 1.00 4.22 C ATOM 2353 OE1 GLU A 152 -13.174 -1.962 -7.089 1.00 62.31 O ATOM 2354 OE2 GLU A 152 -11.378 -3.193 -7.368 1.00 3.34 O ATOM 0 H GLU A 152 -9.699 -0.817 -3.395 1.00 53.35 H new ATOM 0 HA GLU A 152 -11.097 1.303 -4.874 1.00 22.32 H new ATOM 0 HB2 GLU A 152 -11.935 -1.510 -4.042 1.00 32.23 H new ATOM 0 HB3 GLU A 152 -12.906 -0.424 -5.016 1.00 32.23 H new ATOM 0 HG2 GLU A 152 -10.923 -0.339 -6.663 1.00 44.34 H new ATOM 0 HG3 GLU A 152 -10.222 -1.660 -5.748 1.00 44.34 H new ATOM 2361 N GLN A 153 -11.469 0.942 -1.719 1.00 13.14 N ATOM 2362 CA GLN A 153 -12.011 1.624 -0.515 1.00 22.24 C ATOM 2363 C GLN A 153 -11.506 3.096 -0.428 1.00 42.33 C ATOM 2364 O GLN A 153 -12.007 3.881 0.381 1.00 72.45 O ATOM 2365 CB GLN A 153 -11.625 0.830 0.765 1.00 22.14 C ATOM 2366 CG GLN A 153 -12.342 -0.528 0.928 1.00 41.33 C ATOM 2367 CD GLN A 153 -11.742 -1.407 2.037 1.00 35.33 C ATOM 2368 OE1 GLN A 153 -10.904 -2.262 1.784 1.00 44.10 O ATOM 2369 NE2 GLN A 153 -12.125 -1.168 3.277 1.00 24.43 N ATOM 0 H GLN A 153 -10.668 0.342 -1.523 1.00 13.14 H new ATOM 0 HA GLN A 153 -13.098 1.653 -0.595 1.00 22.24 H new ATOM 0 HB2 GLN A 153 -10.549 0.658 0.757 1.00 22.14 H new ATOM 0 HB3 GLN A 153 -11.843 1.447 1.637 1.00 22.14 H new ATOM 0 HG2 GLN A 153 -13.395 -0.350 1.146 1.00 41.33 H new ATOM 0 HG3 GLN A 153 -12.299 -1.069 -0.017 1.00 41.33 H new ATOM 0 HE21 GLN A 153 -12.825 -0.451 3.465 1.00 24.43 H new ATOM 0 HE22 GLN A 153 -11.721 -1.701 4.047 1.00 24.43 H new ATOM 2378 N ILE A 154 -10.511 3.457 -1.273 1.00 13.43 N ATOM 2379 CA ILE A 154 -10.013 4.852 -1.401 1.00 61.44 C ATOM 2380 C ILE A 154 -11.104 5.789 -1.974 1.00 42.15 C ATOM 2381 O ILE A 154 -11.190 6.968 -1.602 1.00 1.15 O ATOM 2382 CB ILE A 154 -8.736 4.921 -2.312 1.00 41.42 C ATOM 2383 CG1 ILE A 154 -7.599 4.050 -1.705 1.00 32.54 C ATOM 2384 CG2 ILE A 154 -8.262 6.386 -2.539 1.00 70.13 C ATOM 2385 CD1 ILE A 154 -6.335 3.975 -2.540 1.00 75.55 C ATOM 0 H ILE A 154 -10.032 2.795 -1.883 1.00 13.43 H new ATOM 0 HA ILE A 154 -9.750 5.188 -0.398 1.00 61.44 H new ATOM 0 HB ILE A 154 -9.000 4.520 -3.291 1.00 41.42 H new ATOM 0 HG12 ILE A 154 -7.344 4.445 -0.722 1.00 32.54 H new ATOM 0 HG13 ILE A 154 -7.977 3.039 -1.554 1.00 32.54 H new ATOM 0 HG21 ILE A 154 -7.376 6.388 -3.174 1.00 70.13 H new ATOM 0 HG22 ILE A 154 -9.056 6.955 -3.022 1.00 70.13 H new ATOM 0 HG23 ILE A 154 -8.021 6.843 -1.579 1.00 70.13 H new ATOM 0 HD11 ILE A 154 -5.602 3.346 -2.035 1.00 75.55 H new ATOM 0 HD12 ILE A 154 -6.568 3.548 -3.516 1.00 75.55 H new ATOM 0 HD13 ILE A 154 -5.925 4.977 -2.671 1.00 75.55 H new ATOM 2397 N ASP A 155 -11.933 5.245 -2.879 1.00 51.55 N ATOM 2398 CA ASP A 155 -13.107 5.950 -3.443 1.00 44.40 C ATOM 2399 C ASP A 155 -14.077 6.382 -2.312 1.00 65.13 C ATOM 2400 O ASP A 155 -14.671 7.451 -2.364 1.00 5.25 O ATOM 2401 CB ASP A 155 -13.840 5.024 -4.455 1.00 75.31 C ATOM 2402 CG ASP A 155 -12.906 4.506 -5.565 1.00 10.32 C ATOM 2403 OD1 ASP A 155 -12.062 3.629 -5.274 1.00 71.24 O ATOM 2404 OD2 ASP A 155 -12.993 4.966 -6.724 1.00 73.12 O ATOM 0 H ASP A 155 -11.812 4.301 -3.245 1.00 51.55 H new ATOM 0 HA ASP A 155 -12.764 6.845 -3.961 1.00 44.40 H new ATOM 0 HB2 ASP A 155 -14.270 4.176 -3.921 1.00 75.31 H new ATOM 0 HB3 ASP A 155 -14.669 5.569 -4.907 1.00 75.31 H new ATOM 2409 N ALA A 156 -14.191 5.525 -1.280 1.00 51.21 N ATOM 2410 CA ALA A 156 -14.977 5.795 -0.049 1.00 4.45 C ATOM 2411 C ALA A 156 -14.310 6.863 0.856 1.00 33.31 C ATOM 2412 O ALA A 156 -14.985 7.511 1.638 1.00 2.45 O ATOM 2413 CB ALA A 156 -15.215 4.482 0.722 1.00 64.30 C ATOM 0 H ALA A 156 -13.736 4.612 -1.272 1.00 51.21 H new ATOM 0 HA ALA A 156 -15.939 6.207 -0.354 1.00 4.45 H new ATOM 0 HB1 ALA A 156 -15.792 4.689 1.623 1.00 64.30 H new ATOM 0 HB2 ALA A 156 -15.765 3.784 0.091 1.00 64.30 H new ATOM 0 HB3 ALA A 156 -14.256 4.043 0.998 1.00 64.30 H new ATOM 2419 N VAL A 157 -12.976 6.984 0.788 1.00 44.34 N ATOM 2420 CA VAL A 157 -12.211 8.006 1.560 1.00 44.32 C ATOM 2421 C VAL A 157 -12.407 9.426 0.968 1.00 72.53 C ATOM 2422 O VAL A 157 -12.765 10.374 1.683 1.00 73.11 O ATOM 2423 CB VAL A 157 -10.674 7.665 1.584 1.00 14.41 C ATOM 2424 CG1 VAL A 157 -9.850 8.729 2.366 1.00 24.50 C ATOM 2425 CG2 VAL A 157 -10.438 6.251 2.155 1.00 0.12 C ATOM 0 H VAL A 157 -12.390 6.387 0.205 1.00 44.34 H new ATOM 0 HA VAL A 157 -12.599 7.990 2.578 1.00 44.32 H new ATOM 0 HB VAL A 157 -10.321 7.684 0.553 1.00 14.41 H new ATOM 0 HG11 VAL A 157 -8.796 8.452 2.356 1.00 24.50 H new ATOM 0 HG12 VAL A 157 -9.974 9.704 1.894 1.00 24.50 H new ATOM 0 HG13 VAL A 157 -10.203 8.777 3.396 1.00 24.50 H new ATOM 0 HG21 VAL A 157 -9.370 6.035 2.163 1.00 0.12 H new ATOM 0 HG22 VAL A 157 -10.826 6.200 3.172 1.00 0.12 H new ATOM 0 HG23 VAL A 157 -10.952 5.517 1.534 1.00 0.12 H new ATOM 2435 N LEU A 158 -12.176 9.546 -0.355 1.00 33.23 N ATOM 2436 CA LEU A 158 -12.140 10.851 -1.059 1.00 62.40 C ATOM 2437 C LEU A 158 -13.566 11.385 -1.342 1.00 73.23 C ATOM 2438 O LEU A 158 -13.788 12.600 -1.360 1.00 53.23 O ATOM 2439 CB LEU A 158 -11.327 10.721 -2.380 1.00 65.14 C ATOM 2440 CG LEU A 158 -9.903 10.077 -2.244 1.00 2.34 C ATOM 2441 CD1 LEU A 158 -9.151 10.074 -3.585 1.00 3.22 C ATOM 2442 CD2 LEU A 158 -9.068 10.758 -1.138 1.00 72.04 C ATOM 0 H LEU A 158 -12.009 8.747 -0.966 1.00 33.23 H new ATOM 0 HA LEU A 158 -11.646 11.573 -0.409 1.00 62.40 H new ATOM 0 HB2 LEU A 158 -11.908 10.127 -3.085 1.00 65.14 H new ATOM 0 HB3 LEU A 158 -11.216 11.714 -2.816 1.00 65.14 H new ATOM 0 HG LEU A 158 -10.052 9.039 -1.948 1.00 2.34 H new ATOM 0 HD11 LEU A 158 -8.169 9.620 -3.451 1.00 3.22 H new ATOM 0 HD12 LEU A 158 -9.718 9.501 -4.319 1.00 3.22 H new ATOM 0 HD13 LEU A 158 -9.032 11.098 -3.938 1.00 3.22 H new ATOM 0 HD21 LEU A 158 -8.089 10.282 -1.076 1.00 72.04 H new ATOM 0 HD22 LEU A 158 -8.944 11.815 -1.374 1.00 72.04 H new ATOM 0 HD23 LEU A 158 -9.581 10.658 -0.181 1.00 72.04 H new ATOM 2454 N SER A 159 -14.520 10.462 -1.572 1.00 21.23 N ATOM 2455 CA SER A 159 -15.957 10.799 -1.740 1.00 13.23 C ATOM 2456 C SER A 159 -16.646 10.890 -0.367 1.00 14.21 C ATOM 2457 O SER A 159 -17.208 11.927 0.002 1.00 13.44 O ATOM 2458 CB SER A 159 -16.669 9.712 -2.583 1.00 25.53 C ATOM 2459 OG SER A 159 -18.033 10.031 -2.829 1.00 22.14 O ATOM 0 H SER A 159 -14.323 9.464 -1.647 1.00 21.23 H new ATOM 0 HA SER A 159 -16.023 11.760 -2.250 1.00 13.23 H new ATOM 0 HB2 SER A 159 -16.148 9.593 -3.533 1.00 25.53 H new ATOM 0 HB3 SER A 159 -16.609 8.755 -2.064 1.00 25.53 H new ATOM 0 HG SER A 159 -18.444 9.321 -3.365 1.00 22.14 H new ATOM 2465 N GLU A 160 -16.550 9.768 0.374 1.00 13.33 N ATOM 2466 CA GLU A 160 -17.255 9.518 1.646 1.00 42.24 C ATOM 2467 C GLU A 160 -18.759 9.896 1.569 1.00 52.44 C ATOM 2468 O GLU A 160 -19.157 10.975 2.023 1.00 34.51 O ATOM 2469 CB GLU A 160 -16.529 10.196 2.833 1.00 5.32 C ATOM 2470 CG GLU A 160 -16.809 9.529 4.186 1.00 42.44 C ATOM 2471 CD GLU A 160 -16.051 10.185 5.349 1.00 71.02 C ATOM 2472 OE1 GLU A 160 -14.899 9.789 5.617 1.00 21.42 O ATOM 2473 OE2 GLU A 160 -16.596 11.111 5.987 1.00 21.53 O ATOM 0 H GLU A 160 -15.960 8.985 0.093 1.00 13.33 H new ATOM 0 HA GLU A 160 -17.227 8.444 1.829 1.00 42.24 H new ATOM 0 HB2 GLU A 160 -15.455 10.183 2.646 1.00 5.32 H new ATOM 0 HB3 GLU A 160 -16.831 11.242 2.883 1.00 5.32 H new ATOM 0 HG2 GLU A 160 -17.879 9.569 4.389 1.00 42.44 H new ATOM 0 HG3 GLU A 160 -16.534 8.476 4.129 1.00 42.44 H new ATOM 2480 N PRO A 161 -19.603 9.022 0.934 1.00 0.41 N ATOM 2481 CA PRO A 161 -21.033 9.324 0.690 1.00 71.31 C ATOM 2482 C PRO A 161 -21.895 9.324 1.997 1.00 45.20 C ATOM 2483 O PRO A 161 -22.005 10.363 2.661 1.00 44.04 O ATOM 2484 CB PRO A 161 -21.455 8.237 -0.341 1.00 65.31 C ATOM 2485 CG PRO A 161 -20.520 7.081 -0.081 1.00 31.24 C ATOM 2486 CD PRO A 161 -19.213 7.692 0.390 1.00 33.14 C ATOM 0 HA PRO A 161 -21.193 10.334 0.313 1.00 71.31 H new ATOM 0 HB2 PRO A 161 -22.496 7.943 -0.204 1.00 65.31 H new ATOM 0 HB3 PRO A 161 -21.359 8.602 -1.364 1.00 65.31 H new ATOM 0 HG2 PRO A 161 -20.931 6.410 0.674 1.00 31.24 H new ATOM 0 HG3 PRO A 161 -20.370 6.490 -0.985 1.00 31.24 H new ATOM 0 HD2 PRO A 161 -18.737 7.075 1.152 1.00 33.14 H new ATOM 0 HD3 PRO A 161 -18.502 7.791 -0.430 1.00 33.14 H new ATOM 2494 N ALA A 162 -22.470 8.165 2.370 1.00 14.52 N ATOM 2495 CA ALA A 162 -23.266 8.018 3.617 1.00 72.54 C ATOM 2496 C ALA A 162 -23.402 6.541 4.034 1.00 42.14 C ATOM 2497 O ALA A 162 -24.242 6.193 4.873 1.00 34.24 O ATOM 2498 CB ALA A 162 -24.647 8.680 3.440 1.00 62.14 C ATOM 0 H ALA A 162 -22.400 7.306 1.824 1.00 14.52 H new ATOM 0 HA ALA A 162 -22.736 8.526 4.423 1.00 72.54 H new ATOM 0 HB1 ALA A 162 -25.224 8.568 4.358 1.00 62.14 H new ATOM 0 HB2 ALA A 162 -24.517 9.740 3.220 1.00 62.14 H new ATOM 0 HB3 ALA A 162 -25.177 8.201 2.617 1.00 62.14 H new ATOM 2504 N ASN A 163 -22.517 5.684 3.488 1.00 1.41 N ATOM 2505 CA ASN A 163 -22.591 4.227 3.688 1.00 43.20 C ATOM 2506 C ASN A 163 -21.208 3.546 3.488 1.00 73.50 C ATOM 2507 O ASN A 163 -20.771 2.777 4.353 1.00 33.00 O ATOM 2508 CB ASN A 163 -23.675 3.607 2.759 1.00 40.20 C ATOM 2509 CG ASN A 163 -23.473 3.873 1.256 1.00 23.13 C ATOM 2510 OD1 ASN A 163 -22.929 4.899 0.853 1.00 22.42 O ATOM 2511 ND2 ASN A 163 -23.911 2.949 0.418 1.00 51.11 N ATOM 0 H ASN A 163 -21.738 5.981 2.901 1.00 1.41 H new ATOM 0 HA ASN A 163 -22.883 4.043 4.722 1.00 43.20 H new ATOM 0 HB2 ASN A 163 -23.699 2.530 2.922 1.00 40.20 H new ATOM 0 HB3 ASN A 163 -24.650 3.995 3.054 1.00 40.20 H new ATOM 0 HD21 ASN A 163 -23.801 3.079 -0.588 1.00 51.11 H new ATOM 0 HD22 ASN A 163 -24.359 2.106 0.777 1.00 51.11 H new ATOM 2518 N ALA A 164 -20.553 3.816 2.325 1.00 15.30 N ATOM 2519 CA ALA A 164 -19.214 3.265 1.941 1.00 33.44 C ATOM 2520 C ALA A 164 -19.251 1.753 1.542 1.00 41.42 C ATOM 2521 O ALA A 164 -18.494 1.326 0.662 1.00 52.45 O ATOM 2522 CB ALA A 164 -18.142 3.532 3.020 1.00 54.41 C ATOM 0 H ALA A 164 -20.944 4.433 1.613 1.00 15.30 H new ATOM 0 HA ALA A 164 -18.927 3.812 1.043 1.00 33.44 H new ATOM 0 HB1 ALA A 164 -17.189 3.114 2.697 1.00 54.41 H new ATOM 0 HB2 ALA A 164 -18.036 4.606 3.169 1.00 54.41 H new ATOM 0 HB3 ALA A 164 -18.444 3.064 3.957 1.00 54.41 H new ATOM 2528 N LEU A 165 -20.114 0.951 2.208 1.00 3.24 N ATOM 2529 CA LEU A 165 -20.291 -0.493 1.916 1.00 61.24 C ATOM 2530 C LEU A 165 -21.176 -0.720 0.664 1.00 42.31 C ATOM 2531 O LEU A 165 -21.736 0.235 0.097 1.00 4.20 O ATOM 2532 CB LEU A 165 -20.902 -1.204 3.157 1.00 33.41 C ATOM 2533 CG LEU A 165 -20.111 -1.038 4.494 1.00 72.11 C ATOM 2534 CD1 LEU A 165 -20.831 -1.745 5.661 1.00 12.51 C ATOM 2535 CD2 LEU A 165 -18.649 -1.528 4.356 1.00 62.12 C ATOM 0 H LEU A 165 -20.709 1.287 2.965 1.00 3.24 H new ATOM 0 HA LEU A 165 -19.312 -0.921 1.699 1.00 61.24 H new ATOM 0 HB2 LEU A 165 -21.914 -0.827 3.306 1.00 33.41 H new ATOM 0 HB3 LEU A 165 -20.987 -2.268 2.937 1.00 33.41 H new ATOM 0 HG LEU A 165 -20.076 0.027 4.722 1.00 72.11 H new ATOM 0 HD11 LEU A 165 -20.256 -1.612 6.577 1.00 12.51 H new ATOM 0 HD12 LEU A 165 -21.824 -1.315 5.790 1.00 12.51 H new ATOM 0 HD13 LEU A 165 -20.922 -2.809 5.441 1.00 12.51 H new ATOM 0 HD21 LEU A 165 -18.130 -1.397 5.306 1.00 62.12 H new ATOM 0 HD22 LEU A 165 -18.643 -2.583 4.082 1.00 62.12 H new ATOM 0 HD23 LEU A 165 -18.143 -0.950 3.583 1.00 62.12 H new ATOM 2547 N GLU A 166 -21.315 -2.008 0.264 1.00 44.15 N ATOM 2548 CA GLU A 166 -21.959 -2.425 -1.011 1.00 14.04 C ATOM 2549 C GLU A 166 -21.153 -1.911 -2.237 1.00 11.43 C ATOM 2550 O GLU A 166 -20.052 -1.367 -2.083 1.00 2.11 O ATOM 2551 CB GLU A 166 -23.464 -1.987 -1.079 1.00 22.30 C ATOM 2552 CG GLU A 166 -24.373 -2.592 0.015 1.00 72.23 C ATOM 2553 CD GLU A 166 -24.492 -4.126 -0.061 1.00 53.44 C ATOM 2554 OE1 GLU A 166 -25.307 -4.634 -0.864 1.00 10.13 O ATOM 2555 OE2 GLU A 166 -23.773 -4.831 0.677 1.00 73.11 O ATOM 0 H GLU A 166 -20.981 -2.795 0.821 1.00 44.15 H new ATOM 0 HA GLU A 166 -21.949 -3.515 -1.041 1.00 14.04 H new ATOM 0 HB2 GLU A 166 -23.513 -0.900 -1.011 1.00 22.30 H new ATOM 0 HB3 GLU A 166 -23.863 -2.263 -2.055 1.00 22.30 H new ATOM 0 HG2 GLU A 166 -23.983 -2.314 0.994 1.00 72.23 H new ATOM 0 HG3 GLU A 166 -25.368 -2.154 -0.068 1.00 72.23 H new ATOM 2562 N HIS A 167 -21.694 -2.130 -3.456 1.00 43.40 N ATOM 2563 CA HIS A 167 -21.076 -1.668 -4.736 1.00 50.21 C ATOM 2564 C HIS A 167 -19.682 -2.323 -4.989 1.00 24.52 C ATOM 2565 O HIS A 167 -18.880 -1.818 -5.790 1.00 42.41 O ATOM 2566 CB HIS A 167 -20.978 -0.111 -4.767 1.00 42.52 C ATOM 2567 CG HIS A 167 -22.271 0.594 -4.449 1.00 54.53 C ATOM 2568 ND1 HIS A 167 -22.613 0.990 -3.170 1.00 43.35 N ATOM 2569 CD2 HIS A 167 -23.311 0.965 -5.238 1.00 13.23 C ATOM 2570 CE1 HIS A 167 -23.796 1.562 -3.186 1.00 30.11 C ATOM 2571 NE2 HIS A 167 -24.239 1.562 -4.425 1.00 31.32 N ATOM 0 H HIS A 167 -22.572 -2.632 -3.589 1.00 43.40 H new ATOM 0 HA HIS A 167 -21.728 -1.992 -5.547 1.00 50.21 H new ATOM 0 HB2 HIS A 167 -20.218 0.209 -4.054 1.00 42.52 H new ATOM 0 HB3 HIS A 167 -20.640 0.201 -5.755 1.00 42.52 H new ATOM 0 HD2 HIS A 167 -23.392 0.818 -6.305 1.00 13.23 H new ATOM 0 HE1 HIS A 167 -24.316 1.963 -2.329 1.00 30.11 H new ATOM 0 HE2 HIS A 167 -25.133 1.946 -4.732 1.00 31.32 H new ATOM 2580 N HIS A 168 -19.424 -3.457 -4.305 1.00 51.51 N ATOM 2581 CA HIS A 168 -18.157 -4.212 -4.415 1.00 52.03 C ATOM 2582 C HIS A 168 -17.993 -4.807 -5.835 1.00 71.22 C ATOM 2583 O HIS A 168 -18.936 -5.393 -6.367 1.00 63.14 O ATOM 2584 CB HIS A 168 -18.116 -5.341 -3.351 1.00 4.22 C ATOM 2585 CG HIS A 168 -16.853 -6.165 -3.376 1.00 22.41 C ATOM 2586 ND1 HIS A 168 -16.706 -7.298 -4.152 1.00 42.25 N ATOM 2587 CD2 HIS A 168 -15.665 -5.997 -2.744 1.00 51.12 C ATOM 2588 CE1 HIS A 168 -15.496 -7.784 -3.996 1.00 64.24 C ATOM 2589 NE2 HIS A 168 -14.845 -7.019 -3.149 1.00 21.33 N ATOM 0 H HIS A 168 -20.091 -3.877 -3.658 1.00 51.51 H new ATOM 0 HA HIS A 168 -17.330 -3.525 -4.236 1.00 52.03 H new ATOM 0 HB2 HIS A 168 -18.228 -4.897 -2.362 1.00 4.22 H new ATOM 0 HB3 HIS A 168 -18.970 -6.000 -3.503 1.00 4.22 H new ATOM 0 HD2 HIS A 168 -15.412 -5.207 -2.052 1.00 51.12 H new ATOM 0 HE1 HIS A 168 -15.102 -8.664 -4.482 1.00 64.24 H new ATOM 0 HE2 HIS A 168 -13.883 -7.162 -2.842 1.00 21.33 H new ATOM 2598 N HIS A 169 -16.787 -4.649 -6.414 1.00 14.45 N ATOM 2599 CA HIS A 169 -16.464 -5.079 -7.796 1.00 31.12 C ATOM 2600 C HIS A 169 -16.816 -6.571 -8.082 1.00 30.31 C ATOM 2601 O HIS A 169 -16.045 -7.486 -7.779 1.00 12.14 O ATOM 2602 CB HIS A 169 -14.975 -4.756 -8.115 1.00 61.44 C ATOM 2603 CG HIS A 169 -13.980 -5.241 -7.082 1.00 64.02 C ATOM 2604 ND1 HIS A 169 -13.794 -4.607 -5.867 1.00 34.40 N ATOM 2605 CD2 HIS A 169 -13.112 -6.283 -7.082 1.00 11.45 C ATOM 2606 CE1 HIS A 169 -12.869 -5.231 -5.178 1.00 34.52 C ATOM 2607 NE2 HIS A 169 -12.441 -6.249 -5.886 1.00 72.35 N ATOM 0 H HIS A 169 -15.999 -4.215 -5.934 1.00 14.45 H new ATOM 0 HA HIS A 169 -17.101 -4.508 -8.471 1.00 31.12 H new ATOM 0 HB2 HIS A 169 -14.721 -5.199 -9.078 1.00 61.44 H new ATOM 0 HB3 HIS A 169 -14.868 -3.677 -8.222 1.00 61.44 H new ATOM 0 HD2 HIS A 169 -12.975 -7.004 -7.874 1.00 11.45 H new ATOM 0 HE1 HIS A 169 -12.519 -4.954 -4.195 1.00 34.52 H new ATOM 0 HE2 HIS A 169 -11.722 -6.911 -5.593 1.00 72.35 H new ATOM 2616 N HIS A 170 -18.041 -6.788 -8.608 1.00 10.45 N ATOM 2617 CA HIS A 170 -18.490 -8.093 -9.135 1.00 42.42 C ATOM 2618 C HIS A 170 -18.401 -8.078 -10.683 1.00 22.33 C ATOM 2619 O HIS A 170 -19.150 -7.349 -11.347 1.00 22.11 O ATOM 2620 CB HIS A 170 -19.922 -8.444 -8.623 1.00 4.03 C ATOM 2621 CG HIS A 170 -20.966 -7.362 -8.790 1.00 3.14 C ATOM 2622 ND1 HIS A 170 -21.201 -6.393 -7.839 1.00 52.14 N ATOM 2623 CD2 HIS A 170 -21.850 -7.110 -9.790 1.00 42.04 C ATOM 2624 CE1 HIS A 170 -22.171 -5.601 -8.243 1.00 23.33 C ATOM 2625 NE2 HIS A 170 -22.583 -6.010 -9.423 1.00 25.20 N ATOM 0 H HIS A 170 -18.750 -6.058 -8.679 1.00 10.45 H new ATOM 0 HA HIS A 170 -17.834 -8.881 -8.765 1.00 42.42 H new ATOM 0 HB2 HIS A 170 -20.265 -9.337 -9.145 1.00 4.03 H new ATOM 0 HB3 HIS A 170 -19.857 -8.699 -7.565 1.00 4.03 H new ATOM 0 HD1 HIS A 170 -20.699 -6.303 -6.956 1.00 52.14 H new ATOM 0 HD2 HIS A 170 -21.956 -7.672 -10.706 1.00 42.04 H new ATOM 0 HE1 HIS A 170 -22.563 -4.756 -7.697 1.00 23.33 H new ATOM 2634 N HIS A 171 -17.449 -8.876 -11.227 1.00 62.03 N ATOM 2635 CA HIS A 171 -17.093 -8.934 -12.675 1.00 40.01 C ATOM 2636 C HIS A 171 -16.364 -7.645 -13.160 1.00 10.30 C ATOM 2637 O HIS A 171 -16.776 -6.524 -12.826 1.00 25.13 O ATOM 2638 CB HIS A 171 -18.318 -9.265 -13.578 1.00 61.24 C ATOM 2639 CG HIS A 171 -19.002 -10.563 -13.221 1.00 1.30 C ATOM 2640 ND1 HIS A 171 -20.275 -10.629 -12.697 1.00 23.53 N ATOM 2641 CD2 HIS A 171 -18.581 -11.849 -13.312 1.00 13.45 C ATOM 2642 CE1 HIS A 171 -20.604 -11.882 -12.482 1.00 53.11 C ATOM 2643 NE2 HIS A 171 -19.598 -12.642 -12.844 1.00 22.33 N ATOM 0 H HIS A 171 -16.891 -9.515 -10.660 1.00 62.03 H new ATOM 0 HA HIS A 171 -16.389 -9.760 -12.775 1.00 40.01 H new ATOM 0 HB2 HIS A 171 -19.041 -8.452 -13.507 1.00 61.24 H new ATOM 0 HB3 HIS A 171 -17.991 -9.311 -14.617 1.00 61.24 H new ATOM 0 HD2 HIS A 171 -17.624 -12.186 -13.683 1.00 13.45 H new ATOM 0 HE1 HIS A 171 -21.543 -12.228 -12.076 1.00 53.11 H new ATOM 0 HE2 HIS A 171 -19.575 -13.660 -12.787 1.00 22.33 H new ATOM 2652 N HIS A 172 -15.263 -7.837 -13.937 1.00 33.44 N ATOM 2653 CA HIS A 172 -14.411 -6.743 -14.475 1.00 75.53 C ATOM 2654 C HIS A 172 -13.793 -5.896 -13.337 1.00 20.31 C ATOM 2655 O HIS A 172 -12.704 -5.326 -13.474 1.00 70.20 O ATOM 2656 CB HIS A 172 -15.223 -5.867 -15.478 1.00 1.20 C ATOM 2657 CG HIS A 172 -14.467 -4.718 -16.099 1.00 21.44 C ATOM 2658 ND1 HIS A 172 -14.526 -3.430 -15.608 1.00 24.13 N ATOM 2659 CD2 HIS A 172 -13.653 -4.663 -17.183 1.00 30.34 C ATOM 2660 CE1 HIS A 172 -13.787 -2.639 -16.354 1.00 63.22 C ATOM 2661 NE2 HIS A 172 -13.249 -3.357 -17.317 1.00 25.20 N ATOM 0 H HIS A 172 -14.940 -8.765 -14.209 1.00 33.44 H new ATOM 0 HA HIS A 172 -13.579 -7.191 -15.019 1.00 75.53 H new ATOM 0 HB2 HIS A 172 -15.593 -6.509 -16.277 1.00 1.20 H new ATOM 0 HB3 HIS A 172 -16.095 -5.467 -14.961 1.00 1.20 H new ATOM 0 HD2 HIS A 172 -13.375 -5.490 -17.820 1.00 30.34 H new ATOM 0 HE1 HIS A 172 -13.645 -1.579 -16.202 1.00 63.22 H new ATOM 0 HE2 HIS A 172 -12.631 -3.001 -18.046 1.00 25.20 H new TER 2670 HIS A 172