USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1150 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 113 CYS SG : rot 79:sc= -3.86! USER MOD Set 1.2: A 114 SER OG : rot 171:sc= 0.567 USER MOD Set 1.3: A 117 THR OG1 : rot 90:sc= 0.641 USER MOD Set 2.1: A 79 MET CE :methyl -138:sc= -0.546 (180deg=-2.13!) USER MOD Set 2.2: A 89 HIS : no HE2:sc= -3.51! C(o=-4.1!,f=-5.4!) USER MOD Set 3.1: A 31 HIS : no HD1:sc= -3.74 X(o=-5,f=-5.3!) USER MOD Set 3.2: A 33 GLN : amide:sc= -1.3 K(o=-5,f=-5.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 66:sc= 0.362 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 0.628 K(o=0.63,f=-2!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0.267 USER MOD Single : A 45 HIS : no HD1:sc= -0.271 K(o=-0.27,f=-3.3!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.168 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.323 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc=-0.00322 USER MOD Single : A 78 THR OG1 : rot 58:sc= 1.38 USER MOD Single : A 87 THR OG1 : rot 119:sc= 0.253 USER MOD Single : A 88 ASN : amide:sc= -2.94! K(o=-2.9!,f=-1.1) USER MOD Single : A 102 HIS : no HD1:sc= -0.378 X(o=-0.38,f=-0.18) USER MOD Single : A 103 CYS SG : rot 42:sc= -3.54! USER MOD Single : A 104 THR OG1 : rot -94:sc= -1.05 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -109:sc= 0 (180deg=-1.84) USER MOD Single : A 123 SER OG : rot 87:sc= 0.0348 USER MOD Single : A 135 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 141 TYR OH : rot 180:sc= -0.153 USER MOD Single : A 146 HIS : no HE2:sc= 0.218 K(o=0.22,f=-0.85) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= 0.157 K(o=0.16,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.064 15.190 12.602 1.00 72.23 N ATOM 2 CA MET A 1 -3.387 13.923 12.228 1.00 54.33 C ATOM 3 C MET A 1 -3.314 13.759 10.685 1.00 63.24 C ATOM 4 O MET A 1 -4.321 13.477 10.026 1.00 11.33 O ATOM 5 CB MET A 1 -4.089 12.708 12.918 1.00 3.21 C ATOM 6 CG MET A 1 -5.603 12.580 12.672 1.00 24.34 C ATOM 7 SD MET A 1 -6.318 11.119 13.468 1.00 71.13 S ATOM 8 CE MET A 1 -8.031 11.217 12.938 1.00 1.13 C ATOM 0 H1 MET A 1 -4.098 15.273 13.638 1.00 72.23 H new ATOM 0 H2 MET A 1 -3.537 15.995 12.208 1.00 72.23 H new ATOM 0 H3 MET A 1 -5.032 15.191 12.222 1.00 72.23 H new ATOM 0 HA MET A 1 -2.359 13.958 12.588 1.00 54.33 H new ATOM 0 HB2 MET A 1 -3.606 11.792 12.577 1.00 3.21 H new ATOM 0 HB3 MET A 1 -3.919 12.777 13.992 1.00 3.21 H new ATOM 0 HG2 MET A 1 -6.104 13.474 13.044 1.00 24.34 H new ATOM 0 HG3 MET A 1 -5.790 12.533 11.599 1.00 24.34 H new ATOM 0 HE1 MET A 1 -8.589 10.379 13.355 1.00 1.13 H new ATOM 0 HE2 MET A 1 -8.467 12.153 13.287 1.00 1.13 H new ATOM 0 HE3 MET A 1 -8.078 11.179 11.850 1.00 1.13 H new ATOM 20 N ALA A 2 -2.119 13.969 10.094 1.00 3.31 N ATOM 21 CA ALA A 2 -1.899 13.751 8.643 1.00 20.24 C ATOM 22 C ALA A 2 -1.594 12.254 8.363 1.00 31.41 C ATOM 23 O ALA A 2 -0.446 11.852 8.114 1.00 14.24 O ATOM 24 CB ALA A 2 -0.796 14.684 8.117 1.00 63.52 C ATOM 0 H ALA A 2 -1.291 14.289 10.596 1.00 3.31 H new ATOM 0 HA ALA A 2 -2.811 14.001 8.100 1.00 20.24 H new ATOM 0 HB1 ALA A 2 -0.649 14.509 7.051 1.00 63.52 H new ATOM 0 HB2 ALA A 2 -1.090 15.721 8.277 1.00 63.52 H new ATOM 0 HB3 ALA A 2 0.134 14.484 8.649 1.00 63.52 H new ATOM 30 N THR A 3 -2.654 11.428 8.459 1.00 61.34 N ATOM 31 CA THR A 3 -2.580 9.960 8.288 1.00 64.12 C ATOM 32 C THR A 3 -3.833 9.430 7.547 1.00 13.21 C ATOM 33 O THR A 3 -4.968 9.758 7.902 1.00 14.34 O ATOM 34 CB THR A 3 -2.422 9.223 9.669 1.00 23.34 C ATOM 35 OG1 THR A 3 -1.194 9.630 10.299 1.00 64.34 O ATOM 36 CG2 THR A 3 -2.423 7.687 9.525 1.00 53.31 C ATOM 0 H THR A 3 -3.596 11.763 8.659 1.00 61.34 H new ATOM 0 HA THR A 3 -1.695 9.748 7.687 1.00 64.12 H new ATOM 0 HB THR A 3 -3.282 9.502 10.278 1.00 23.34 H new ATOM 0 HG1 THR A 3 -1.100 9.170 11.159 1.00 64.34 H new ATOM 0 HG21 THR A 3 -2.311 7.229 10.508 1.00 53.31 H new ATOM 0 HG22 THR A 3 -3.364 7.364 9.079 1.00 53.31 H new ATOM 0 HG23 THR A 3 -1.595 7.381 8.886 1.00 53.31 H new ATOM 44 N LEU A 4 -3.589 8.606 6.520 1.00 54.22 N ATOM 45 CA LEU A 4 -4.624 8.017 5.637 1.00 35.43 C ATOM 46 C LEU A 4 -4.733 6.516 5.923 1.00 60.53 C ATOM 47 O LEU A 4 -3.758 5.809 5.770 1.00 3.30 O ATOM 48 CB LEU A 4 -4.244 8.239 4.140 1.00 61.24 C ATOM 49 CG LEU A 4 -4.617 9.613 3.496 1.00 52.24 C ATOM 50 CD1 LEU A 4 -4.159 10.816 4.334 1.00 35.53 C ATOM 51 CD2 LEU A 4 -4.045 9.696 2.073 1.00 23.52 C ATOM 0 H LEU A 4 -2.644 8.318 6.267 1.00 54.22 H new ATOM 0 HA LEU A 4 -5.581 8.501 5.832 1.00 35.43 H new ATOM 0 HB2 LEU A 4 -3.167 8.104 4.043 1.00 61.24 H new ATOM 0 HB3 LEU A 4 -4.718 7.453 3.553 1.00 61.24 H new ATOM 0 HG LEU A 4 -5.705 9.663 3.459 1.00 52.24 H new ATOM 0 HD11 LEU A 4 -4.448 11.740 3.833 1.00 35.53 H new ATOM 0 HD12 LEU A 4 -4.628 10.774 5.317 1.00 35.53 H new ATOM 0 HD13 LEU A 4 -3.075 10.789 4.448 1.00 35.53 H new ATOM 0 HD21 LEU A 4 -4.309 10.656 1.630 1.00 23.52 H new ATOM 0 HD22 LEU A 4 -2.960 9.600 2.111 1.00 23.52 H new ATOM 0 HD23 LEU A 4 -4.460 8.891 1.467 1.00 23.52 H new ATOM 63 N ARG A 5 -5.913 6.033 6.318 1.00 3.25 N ATOM 64 CA ARG A 5 -6.146 4.595 6.567 1.00 73.14 C ATOM 65 C ARG A 5 -7.263 4.070 5.640 1.00 63.32 C ATOM 66 O ARG A 5 -8.398 4.559 5.663 1.00 24.32 O ATOM 67 CB ARG A 5 -6.479 4.358 8.057 1.00 64.24 C ATOM 68 CG ARG A 5 -6.776 2.885 8.433 1.00 4.54 C ATOM 69 CD ARG A 5 -7.036 2.713 9.938 1.00 43.23 C ATOM 70 NE ARG A 5 -8.072 3.642 10.439 1.00 22.45 N ATOM 71 CZ ARG A 5 -8.426 3.783 11.692 1.00 22.41 C ATOM 72 NH1 ARG A 5 -7.929 3.037 12.624 1.00 50.15 N ATOM 73 NH2 ARG A 5 -9.292 4.687 12.003 1.00 70.23 N ATOM 0 H ARG A 5 -6.734 6.617 6.476 1.00 3.25 H new ATOM 0 HA ARG A 5 -5.237 4.037 6.340 1.00 73.14 H new ATOM 0 HB2 ARG A 5 -5.643 4.711 8.661 1.00 64.24 H new ATOM 0 HB3 ARG A 5 -7.343 4.967 8.322 1.00 64.24 H new ATOM 0 HG2 ARG A 5 -7.644 2.537 7.874 1.00 4.54 H new ATOM 0 HG3 ARG A 5 -5.934 2.259 8.137 1.00 4.54 H new ATOM 0 HD2 ARG A 5 -7.345 1.687 10.136 1.00 43.23 H new ATOM 0 HD3 ARG A 5 -6.108 2.878 10.486 1.00 43.23 H new ATOM 0 HE ARG A 5 -8.551 4.222 9.750 1.00 22.45 H new ATOM 0 HH11 ARG A 5 -7.244 2.318 12.391 1.00 50.15 H new ATOM 0 HH12 ARG A 5 -8.222 3.168 13.592 1.00 50.15 H new ATOM 0 HH21 ARG A 5 -9.692 5.281 11.277 1.00 70.23 H new ATOM 0 HH22 ARG A 5 -9.577 4.808 12.975 1.00 70.23 H new ATOM 87 N ARG A 6 -6.914 3.074 4.816 1.00 5.32 N ATOM 88 CA ARG A 6 -7.805 2.475 3.802 1.00 64.24 C ATOM 89 C ARG A 6 -7.936 0.961 4.058 1.00 40.34 C ATOM 90 O ARG A 6 -6.989 0.332 4.529 1.00 0.23 O ATOM 91 CB ARG A 6 -7.217 2.730 2.388 1.00 54.04 C ATOM 92 CG ARG A 6 -7.019 4.217 1.996 1.00 74.20 C ATOM 93 CD ARG A 6 -8.323 4.931 1.567 1.00 21.04 C ATOM 94 NE ARG A 6 -9.228 5.276 2.686 1.00 23.41 N ATOM 95 CZ ARG A 6 -10.285 6.068 2.587 1.00 35.22 C ATOM 96 NH1 ARG A 6 -10.606 6.625 1.456 1.00 41.05 N ATOM 97 NH2 ARG A 6 -11.007 6.304 3.630 1.00 45.21 N ATOM 0 H ARG A 6 -5.986 2.650 4.832 1.00 5.32 H new ATOM 0 HA ARG A 6 -8.794 2.930 3.866 1.00 64.24 H new ATOM 0 HB2 ARG A 6 -6.254 2.225 2.320 1.00 54.04 H new ATOM 0 HB3 ARG A 6 -7.874 2.265 1.653 1.00 54.04 H new ATOM 0 HG2 ARG A 6 -6.585 4.751 2.842 1.00 74.20 H new ATOM 0 HG3 ARG A 6 -6.299 4.275 1.179 1.00 74.20 H new ATOM 0 HD2 ARG A 6 -8.063 5.844 1.031 1.00 21.04 H new ATOM 0 HD3 ARG A 6 -8.859 4.291 0.866 1.00 21.04 H new ATOM 0 HE ARG A 6 -9.023 4.874 3.601 1.00 23.41 H new ATOM 0 HH11 ARG A 6 -10.040 6.455 0.625 1.00 41.05 H new ATOM 0 HH12 ARG A 6 -11.424 7.232 1.400 1.00 41.05 H new ATOM 0 HH21 ARG A 6 -10.763 5.881 4.526 1.00 45.21 H new ATOM 0 HH22 ARG A 6 -11.822 6.913 3.559 1.00 45.21 H new ATOM 111 N SER A 7 -9.109 0.394 3.749 1.00 3.21 N ATOM 112 CA SER A 7 -9.393 -1.052 3.943 1.00 41.23 C ATOM 113 C SER A 7 -10.430 -1.557 2.912 1.00 3.23 C ATOM 114 O SER A 7 -11.291 -0.791 2.462 1.00 13.33 O ATOM 115 CB SER A 7 -9.897 -1.310 5.387 1.00 50.14 C ATOM 116 OG SER A 7 -11.072 -0.568 5.676 1.00 5.11 O ATOM 0 H SER A 7 -9.893 0.915 3.357 1.00 3.21 H new ATOM 0 HA SER A 7 -8.467 -1.605 3.789 1.00 41.23 H new ATOM 0 HB2 SER A 7 -10.098 -2.373 5.517 1.00 50.14 H new ATOM 0 HB3 SER A 7 -9.115 -1.044 6.098 1.00 50.14 H new ATOM 0 HG SER A 7 -11.361 -0.757 6.593 1.00 5.11 H new ATOM 122 N VAL A 8 -10.346 -2.853 2.544 1.00 43.22 N ATOM 123 CA VAL A 8 -11.249 -3.473 1.543 1.00 61.35 C ATOM 124 C VAL A 8 -11.531 -4.965 1.872 1.00 23.31 C ATOM 125 O VAL A 8 -10.623 -5.699 2.268 1.00 51.25 O ATOM 126 CB VAL A 8 -10.640 -3.339 0.092 1.00 21.41 C ATOM 127 CG1 VAL A 8 -9.295 -4.105 -0.044 1.00 73.30 C ATOM 128 CG2 VAL A 8 -11.654 -3.765 -0.997 1.00 54.43 C ATOM 0 H VAL A 8 -9.656 -3.498 2.928 1.00 43.22 H new ATOM 0 HA VAL A 8 -12.198 -2.938 1.581 1.00 61.35 H new ATOM 0 HB VAL A 8 -10.423 -2.283 -0.066 1.00 21.41 H new ATOM 0 HG11 VAL A 8 -8.910 -3.987 -1.057 1.00 73.30 H new ATOM 0 HG12 VAL A 8 -8.574 -3.703 0.667 1.00 73.30 H new ATOM 0 HG13 VAL A 8 -9.456 -5.163 0.162 1.00 73.30 H new ATOM 0 HG21 VAL A 8 -11.197 -3.658 -1.981 1.00 54.43 H new ATOM 0 HG22 VAL A 8 -11.940 -4.805 -0.841 1.00 54.43 H new ATOM 0 HG23 VAL A 8 -12.539 -3.132 -0.937 1.00 54.43 H new ATOM 138 N GLU A 9 -12.797 -5.400 1.701 1.00 5.13 N ATOM 139 CA GLU A 9 -13.198 -6.811 1.896 1.00 44.53 C ATOM 140 C GLU A 9 -13.000 -7.604 0.584 1.00 3.34 C ATOM 141 O GLU A 9 -13.719 -7.407 -0.398 1.00 64.12 O ATOM 142 CB GLU A 9 -14.668 -6.910 2.408 1.00 65.40 C ATOM 143 CG GLU A 9 -14.846 -6.642 3.922 1.00 62.43 C ATOM 144 CD GLU A 9 -14.406 -5.238 4.385 1.00 44.03 C ATOM 145 OE1 GLU A 9 -15.196 -4.277 4.240 1.00 72.25 O ATOM 146 OE2 GLU A 9 -13.272 -5.090 4.899 1.00 55.34 O ATOM 0 H GLU A 9 -13.566 -4.789 1.426 1.00 5.13 H new ATOM 0 HA GLU A 9 -12.560 -7.253 2.661 1.00 44.53 H new ATOM 0 HB2 GLU A 9 -15.280 -6.199 1.853 1.00 65.40 H new ATOM 0 HB3 GLU A 9 -15.051 -7.905 2.182 1.00 65.40 H new ATOM 0 HG2 GLU A 9 -15.895 -6.783 4.181 1.00 62.43 H new ATOM 0 HG3 GLU A 9 -14.278 -7.388 4.478 1.00 62.43 H new ATOM 153 N VAL A 10 -11.992 -8.479 0.594 1.00 34.12 N ATOM 154 CA VAL A 10 -11.592 -9.311 -0.554 1.00 45.33 C ATOM 155 C VAL A 10 -12.124 -10.756 -0.382 1.00 10.43 C ATOM 156 O VAL A 10 -11.962 -11.354 0.682 1.00 35.43 O ATOM 157 CB VAL A 10 -10.026 -9.314 -0.666 1.00 51.34 C ATOM 158 CG1 VAL A 10 -9.534 -10.234 -1.798 1.00 54.14 C ATOM 159 CG2 VAL A 10 -9.484 -7.871 -0.841 1.00 12.55 C ATOM 0 H VAL A 10 -11.414 -8.636 1.419 1.00 34.12 H new ATOM 0 HA VAL A 10 -12.019 -8.898 -1.468 1.00 45.33 H new ATOM 0 HB VAL A 10 -9.631 -9.716 0.267 1.00 51.34 H new ATOM 0 HG11 VAL A 10 -8.445 -10.207 -1.841 1.00 54.14 H new ATOM 0 HG12 VAL A 10 -9.864 -11.255 -1.607 1.00 54.14 H new ATOM 0 HG13 VAL A 10 -9.943 -9.892 -2.749 1.00 54.14 H new ATOM 0 HG21 VAL A 10 -8.397 -7.897 -0.916 1.00 12.55 H new ATOM 0 HG22 VAL A 10 -9.900 -7.434 -1.748 1.00 12.55 H new ATOM 0 HG23 VAL A 10 -9.773 -7.267 0.019 1.00 12.55 H new ATOM 169 N ALA A 11 -12.763 -11.307 -1.433 1.00 34.01 N ATOM 170 CA ALA A 11 -13.234 -12.708 -1.441 1.00 42.54 C ATOM 171 C ALA A 11 -12.051 -13.697 -1.663 1.00 75.23 C ATOM 172 O ALA A 11 -11.891 -14.259 -2.752 1.00 14.33 O ATOM 173 CB ALA A 11 -14.337 -12.877 -2.508 1.00 32.03 C ATOM 0 H ALA A 11 -12.966 -10.799 -2.294 1.00 34.01 H new ATOM 0 HA ALA A 11 -13.661 -12.947 -0.467 1.00 42.54 H new ATOM 0 HB1 ALA A 11 -14.683 -13.911 -2.513 1.00 32.03 H new ATOM 0 HB2 ALA A 11 -15.172 -12.216 -2.276 1.00 32.03 H new ATOM 0 HB3 ALA A 11 -13.936 -12.624 -3.489 1.00 32.03 H new ATOM 179 N ALA A 12 -11.217 -13.883 -0.615 1.00 35.23 N ATOM 180 CA ALA A 12 -9.996 -14.724 -0.682 1.00 74.20 C ATOM 181 C ALA A 12 -9.405 -14.983 0.732 1.00 22.04 C ATOM 182 O ALA A 12 -9.646 -14.200 1.656 1.00 53.23 O ATOM 183 CB ALA A 12 -8.942 -14.048 -1.581 1.00 0.45 C ATOM 0 H ALA A 12 -11.369 -13.457 0.299 1.00 35.23 H new ATOM 0 HA ALA A 12 -10.273 -15.688 -1.109 1.00 74.20 H new ATOM 0 HB1 ALA A 12 -8.049 -14.671 -1.626 1.00 0.45 H new ATOM 0 HB2 ALA A 12 -9.347 -13.922 -2.585 1.00 0.45 H new ATOM 0 HB3 ALA A 12 -8.684 -13.072 -1.169 1.00 0.45 H new ATOM 189 N PRO A 13 -8.624 -16.101 0.918 1.00 72.43 N ATOM 190 CA PRO A 13 -7.842 -16.345 2.165 1.00 4.20 C ATOM 191 C PRO A 13 -6.646 -15.358 2.303 1.00 63.33 C ATOM 192 O PRO A 13 -5.960 -15.094 1.309 1.00 3.34 O ATOM 193 CB PRO A 13 -7.335 -17.813 1.998 1.00 32.02 C ATOM 194 CG PRO A 13 -8.098 -18.385 0.833 1.00 73.22 C ATOM 195 CD PRO A 13 -8.445 -17.217 -0.052 1.00 0.05 C ATOM 0 HA PRO A 13 -8.440 -16.195 3.064 1.00 4.20 H new ATOM 0 HB2 PRO A 13 -6.261 -17.836 1.811 1.00 32.02 H new ATOM 0 HB3 PRO A 13 -7.513 -18.393 2.904 1.00 32.02 H new ATOM 0 HG2 PRO A 13 -7.496 -19.117 0.294 1.00 73.22 H new ATOM 0 HG3 PRO A 13 -8.998 -18.899 1.171 1.00 73.22 H new ATOM 0 HD2 PRO A 13 -7.652 -17.005 -0.769 1.00 0.05 H new ATOM 0 HD3 PRO A 13 -9.353 -17.402 -0.626 1.00 0.05 H new ATOM 203 N ALA A 14 -6.401 -14.838 3.533 1.00 11.34 N ATOM 204 CA ALA A 14 -5.299 -13.868 3.830 1.00 51.13 C ATOM 205 C ALA A 14 -3.900 -14.346 3.370 1.00 33.33 C ATOM 206 O ALA A 14 -3.053 -13.528 3.016 1.00 10.55 O ATOM 207 CB ALA A 14 -5.279 -13.540 5.338 1.00 21.33 C ATOM 0 H ALA A 14 -6.959 -15.076 4.353 1.00 11.34 H new ATOM 0 HA ALA A 14 -5.517 -12.972 3.249 1.00 51.13 H new ATOM 0 HB1 ALA A 14 -4.475 -12.834 5.546 1.00 21.33 H new ATOM 0 HB2 ALA A 14 -6.233 -13.099 5.627 1.00 21.33 H new ATOM 0 HB3 ALA A 14 -5.115 -14.455 5.907 1.00 21.33 H new ATOM 213 N ALA A 15 -3.672 -15.668 3.407 1.00 2.34 N ATOM 214 CA ALA A 15 -2.421 -16.284 2.908 1.00 50.44 C ATOM 215 C ALA A 15 -2.258 -16.102 1.379 1.00 65.14 C ATOM 216 O ALA A 15 -1.197 -15.687 0.908 1.00 64.40 O ATOM 217 CB ALA A 15 -2.384 -17.771 3.290 1.00 43.14 C ATOM 0 H ALA A 15 -4.342 -16.341 3.780 1.00 2.34 H new ATOM 0 HA ALA A 15 -1.581 -15.774 3.380 1.00 50.44 H new ATOM 0 HB1 ALA A 15 -1.462 -18.219 2.920 1.00 43.14 H new ATOM 0 HB2 ALA A 15 -2.426 -17.869 4.375 1.00 43.14 H new ATOM 0 HB3 ALA A 15 -3.239 -18.282 2.846 1.00 43.14 H new ATOM 223 N ASP A 16 -3.315 -16.448 0.619 1.00 2.42 N ATOM 224 CA ASP A 16 -3.365 -16.252 -0.853 1.00 15.12 C ATOM 225 C ASP A 16 -3.198 -14.770 -1.261 1.00 70.03 C ATOM 226 O ASP A 16 -2.544 -14.462 -2.262 1.00 15.12 O ATOM 227 CB ASP A 16 -4.698 -16.807 -1.408 1.00 31.41 C ATOM 228 CG ASP A 16 -4.814 -18.333 -1.280 1.00 41.51 C ATOM 229 OD1 ASP A 16 -4.746 -18.855 -0.147 1.00 52.31 O ATOM 230 OD2 ASP A 16 -4.987 -19.021 -2.306 1.00 21.50 O ATOM 0 H ASP A 16 -4.160 -16.871 1.002 1.00 2.42 H new ATOM 0 HA ASP A 16 -2.525 -16.798 -1.282 1.00 15.12 H new ATOM 0 HB2 ASP A 16 -5.528 -16.340 -0.878 1.00 31.41 H new ATOM 0 HB3 ASP A 16 -4.792 -16.528 -2.457 1.00 31.41 H new ATOM 235 N VAL A 17 -3.808 -13.859 -0.488 1.00 23.45 N ATOM 236 CA VAL A 17 -3.686 -12.405 -0.727 1.00 63.32 C ATOM 237 C VAL A 17 -2.259 -11.909 -0.369 1.00 71.53 C ATOM 238 O VAL A 17 -1.729 -10.999 -1.011 1.00 62.22 O ATOM 239 CB VAL A 17 -4.776 -11.578 0.044 1.00 72.41 C ATOM 240 CG1 VAL A 17 -4.746 -10.091 -0.386 1.00 24.52 C ATOM 241 CG2 VAL A 17 -6.189 -12.177 -0.168 1.00 51.34 C ATOM 0 H VAL A 17 -4.394 -14.100 0.312 1.00 23.45 H new ATOM 0 HA VAL A 17 -3.858 -12.240 -1.791 1.00 63.32 H new ATOM 0 HB VAL A 17 -4.543 -11.633 1.107 1.00 72.41 H new ATOM 0 HG11 VAL A 17 -5.510 -9.538 0.161 1.00 24.52 H new ATOM 0 HG12 VAL A 17 -3.765 -9.669 -0.167 1.00 24.52 H new ATOM 0 HG13 VAL A 17 -4.942 -10.018 -1.456 1.00 24.52 H new ATOM 0 HG21 VAL A 17 -6.922 -11.583 0.378 1.00 51.34 H new ATOM 0 HG22 VAL A 17 -6.433 -12.167 -1.230 1.00 51.34 H new ATOM 0 HG23 VAL A 17 -6.208 -13.203 0.199 1.00 51.34 H new ATOM 251 N TRP A 18 -1.649 -12.522 0.669 1.00 45.02 N ATOM 252 CA TRP A 18 -0.246 -12.235 1.062 1.00 34.10 C ATOM 253 C TRP A 18 0.756 -12.719 -0.025 1.00 14.23 C ATOM 254 O TRP A 18 1.834 -12.159 -0.167 1.00 3.24 O ATOM 255 CB TRP A 18 0.093 -12.862 2.451 1.00 52.23 C ATOM 256 CG TRP A 18 1.493 -12.535 2.948 1.00 45.44 C ATOM 257 CD1 TRP A 18 2.529 -13.407 3.160 1.00 23.24 C ATOM 258 CD2 TRP A 18 2.015 -11.221 3.245 1.00 12.11 C ATOM 259 NE1 TRP A 18 3.643 -12.723 3.575 1.00 71.25 N ATOM 260 CE2 TRP A 18 3.356 -11.381 3.633 1.00 43.02 C ATOM 261 CE3 TRP A 18 1.474 -9.929 3.220 1.00 44.11 C ATOM 262 CZ2 TRP A 18 4.163 -10.301 3.997 1.00 3.45 C ATOM 263 CZ3 TRP A 18 2.276 -8.856 3.577 1.00 25.11 C ATOM 264 CH2 TRP A 18 3.611 -9.050 3.957 1.00 42.43 C ATOM 0 H TRP A 18 -2.106 -13.222 1.254 1.00 45.02 H new ATOM 0 HA TRP A 18 -0.146 -11.153 1.150 1.00 34.10 H new ATOM 0 HB2 TRP A 18 -0.634 -12.512 3.184 1.00 52.23 H new ATOM 0 HB3 TRP A 18 -0.016 -13.945 2.387 1.00 52.23 H new ATOM 0 HD1 TRP A 18 2.476 -14.477 3.021 1.00 23.24 H new ATOM 0 HE1 TRP A 18 4.543 -13.145 3.804 1.00 71.25 H new ATOM 0 HE3 TRP A 18 0.447 -9.771 2.927 1.00 44.11 H new ATOM 0 HZ2 TRP A 18 5.189 -10.449 4.300 1.00 3.45 H new ATOM 0 HZ3 TRP A 18 1.866 -7.857 3.562 1.00 25.11 H new ATOM 0 HH2 TRP A 18 4.215 -8.196 4.223 1.00 42.43 H new ATOM 275 N THR A 19 0.390 -13.773 -0.782 1.00 14.42 N ATOM 276 CA THR A 19 1.174 -14.240 -1.965 1.00 53.10 C ATOM 277 C THR A 19 1.205 -13.160 -3.098 1.00 73.44 C ATOM 278 O THR A 19 2.075 -13.175 -3.975 1.00 31.13 O ATOM 279 CB THR A 19 0.582 -15.591 -2.518 1.00 3.12 C ATOM 280 OG1 THR A 19 0.433 -16.537 -1.442 1.00 51.23 O ATOM 281 CG2 THR A 19 1.463 -16.227 -3.616 1.00 71.12 C ATOM 0 H THR A 19 -0.448 -14.326 -0.601 1.00 14.42 H new ATOM 0 HA THR A 19 2.199 -14.409 -1.636 1.00 53.10 H new ATOM 0 HB THR A 19 -0.384 -15.349 -2.962 1.00 3.12 H new ATOM 0 HG1 THR A 19 -0.242 -16.211 -0.811 1.00 51.23 H new ATOM 0 HG21 THR A 19 1.005 -17.155 -3.958 1.00 71.12 H new ATOM 0 HG22 THR A 19 1.554 -15.537 -4.454 1.00 71.12 H new ATOM 0 HG23 THR A 19 2.453 -16.439 -3.211 1.00 71.12 H new ATOM 289 N LEU A 20 0.227 -12.240 -3.061 1.00 71.42 N ATOM 290 CA LEU A 20 0.116 -11.095 -3.997 1.00 60.31 C ATOM 291 C LEU A 20 0.856 -9.816 -3.485 1.00 53.00 C ATOM 292 O LEU A 20 1.529 -9.133 -4.268 1.00 13.24 O ATOM 293 CB LEU A 20 -1.391 -10.805 -4.223 1.00 71.21 C ATOM 294 CG LEU A 20 -1.762 -9.582 -5.116 1.00 4.34 C ATOM 295 CD1 LEU A 20 -1.238 -9.732 -6.555 1.00 33.13 C ATOM 296 CD2 LEU A 20 -3.281 -9.349 -5.101 1.00 62.00 C ATOM 0 H LEU A 20 -0.524 -12.266 -2.371 1.00 71.42 H new ATOM 0 HA LEU A 20 0.604 -11.363 -4.934 1.00 60.31 H new ATOM 0 HB2 LEU A 20 -1.842 -11.693 -4.665 1.00 71.21 H new ATOM 0 HB3 LEU A 20 -1.856 -10.663 -3.248 1.00 71.21 H new ATOM 0 HG LEU A 20 -1.270 -8.706 -4.693 1.00 4.34 H new ATOM 0 HD11 LEU A 20 -1.521 -8.856 -7.138 1.00 33.13 H new ATOM 0 HD12 LEU A 20 -0.152 -9.822 -6.539 1.00 33.13 H new ATOM 0 HD13 LEU A 20 -1.669 -10.625 -7.008 1.00 33.13 H new ATOM 0 HD21 LEU A 20 -3.524 -8.492 -5.729 1.00 62.00 H new ATOM 0 HD22 LEU A 20 -3.789 -10.234 -5.483 1.00 62.00 H new ATOM 0 HD23 LEU A 20 -3.609 -9.155 -4.080 1.00 62.00 H new ATOM 308 N VAL A 21 0.711 -9.495 -2.179 1.00 25.23 N ATOM 309 CA VAL A 21 1.305 -8.256 -1.562 1.00 24.03 C ATOM 310 C VAL A 21 2.532 -8.540 -0.632 1.00 41.20 C ATOM 311 O VAL A 21 2.967 -7.651 0.116 1.00 70.32 O ATOM 312 CB VAL A 21 0.211 -7.447 -0.759 1.00 60.24 C ATOM 313 CG1 VAL A 21 -0.941 -6.997 -1.689 1.00 3.21 C ATOM 314 CG2 VAL A 21 -0.325 -8.261 0.447 1.00 54.21 C ATOM 0 H VAL A 21 0.188 -10.070 -1.519 1.00 25.23 H new ATOM 0 HA VAL A 21 1.671 -7.662 -2.399 1.00 24.03 H new ATOM 0 HB VAL A 21 0.688 -6.551 -0.361 1.00 60.24 H new ATOM 0 HG11 VAL A 21 -1.680 -6.442 -1.111 1.00 3.21 H new ATOM 0 HG12 VAL A 21 -0.544 -6.358 -2.478 1.00 3.21 H new ATOM 0 HG13 VAL A 21 -1.412 -7.873 -2.135 1.00 3.21 H new ATOM 0 HG21 VAL A 21 -1.076 -7.675 0.977 1.00 54.21 H new ATOM 0 HG22 VAL A 21 -0.774 -9.188 0.090 1.00 54.21 H new ATOM 0 HG23 VAL A 21 0.498 -8.494 1.123 1.00 54.21 H new ATOM 324 N GLY A 22 3.090 -9.760 -0.703 1.00 3.34 N ATOM 325 CA GLY A 22 4.242 -10.172 0.136 1.00 4.45 C ATOM 326 C GLY A 22 5.594 -9.677 -0.372 1.00 54.52 C ATOM 327 O GLY A 22 6.585 -9.700 0.361 1.00 75.45 O ATOM 0 H GLY A 22 2.762 -10.489 -1.337 1.00 3.34 H new ATOM 0 HA2 GLY A 22 4.090 -9.802 1.150 1.00 4.45 H new ATOM 0 HA3 GLY A 22 4.264 -11.260 0.194 1.00 4.45 H new ATOM 331 N ASP A 23 5.646 -9.263 -1.641 1.00 73.40 N ATOM 332 CA ASP A 23 6.852 -8.679 -2.254 1.00 44.32 C ATOM 333 C ASP A 23 6.714 -7.141 -2.351 1.00 1.21 C ATOM 334 O ASP A 23 5.656 -6.621 -2.734 1.00 21.23 O ATOM 335 CB ASP A 23 7.095 -9.265 -3.674 1.00 34.12 C ATOM 336 CG ASP A 23 7.503 -10.745 -3.693 1.00 3.13 C ATOM 337 OD1 ASP A 23 6.676 -11.618 -3.339 1.00 33.01 O ATOM 338 OD2 ASP A 23 8.657 -11.052 -4.063 1.00 13.52 O ATOM 0 H ASP A 23 4.852 -9.322 -2.278 1.00 73.40 H new ATOM 0 HA ASP A 23 7.703 -8.929 -1.620 1.00 44.32 H new ATOM 0 HB2 ASP A 23 6.186 -9.145 -4.263 1.00 34.12 H new ATOM 0 HB3 ASP A 23 7.873 -8.681 -4.166 1.00 34.12 H new ATOM 343 N PHE A 24 7.809 -6.436 -2.031 1.00 52.45 N ATOM 344 CA PHE A 24 7.934 -4.973 -2.217 1.00 41.24 C ATOM 345 C PHE A 24 7.857 -4.592 -3.731 1.00 15.21 C ATOM 346 O PHE A 24 7.476 -3.472 -4.087 1.00 32.42 O ATOM 347 CB PHE A 24 9.274 -4.519 -1.577 1.00 72.24 C ATOM 348 CG PHE A 24 9.557 -3.013 -1.601 1.00 20.53 C ATOM 349 CD1 PHE A 24 8.658 -2.107 -1.038 1.00 22.13 C ATOM 350 CD2 PHE A 24 10.730 -2.507 -2.167 1.00 31.24 C ATOM 351 CE1 PHE A 24 8.923 -0.751 -1.046 1.00 2.43 C ATOM 352 CE2 PHE A 24 10.987 -1.149 -2.172 1.00 45.32 C ATOM 353 CZ PHE A 24 10.083 -0.273 -1.611 1.00 41.21 C ATOM 0 H PHE A 24 8.644 -6.865 -1.631 1.00 52.45 H new ATOM 0 HA PHE A 24 7.106 -4.459 -1.728 1.00 41.24 H new ATOM 0 HB2 PHE A 24 9.290 -4.854 -0.540 1.00 72.24 H new ATOM 0 HB3 PHE A 24 10.089 -5.029 -2.090 1.00 72.24 H new ATOM 0 HD1 PHE A 24 7.744 -2.470 -0.591 1.00 22.13 H new ATOM 0 HD2 PHE A 24 11.445 -3.186 -2.607 1.00 31.24 H new ATOM 0 HE1 PHE A 24 8.216 -0.063 -0.607 1.00 2.43 H new ATOM 0 HE2 PHE A 24 11.897 -0.774 -2.616 1.00 45.32 H new ATOM 0 HZ PHE A 24 10.285 0.788 -1.615 1.00 41.21 H new ATOM 363 N SER A 25 8.191 -5.561 -4.607 1.00 14.34 N ATOM 364 CA SER A 25 8.159 -5.389 -6.082 1.00 12.24 C ATOM 365 C SER A 25 6.783 -5.748 -6.699 1.00 4.05 C ATOM 366 O SER A 25 6.435 -5.234 -7.766 1.00 31.32 O ATOM 367 CB SER A 25 9.238 -6.279 -6.729 1.00 55.24 C ATOM 368 OG SER A 25 9.010 -7.654 -6.460 1.00 15.15 O ATOM 0 H SER A 25 8.492 -6.491 -4.315 1.00 14.34 H new ATOM 0 HA SER A 25 8.348 -4.334 -6.282 1.00 12.24 H new ATOM 0 HB2 SER A 25 9.248 -6.115 -7.807 1.00 55.24 H new ATOM 0 HB3 SER A 25 10.220 -5.992 -6.354 1.00 55.24 H new ATOM 0 HG SER A 25 9.711 -8.191 -6.886 1.00 15.15 H new ATOM 374 N ALA A 26 5.969 -6.574 -5.996 1.00 15.45 N ATOM 375 CA ALA A 26 4.764 -7.220 -6.595 1.00 15.24 C ATOM 376 C ALA A 26 3.552 -6.279 -6.614 1.00 21.12 C ATOM 377 O ALA A 26 2.452 -6.673 -7.020 1.00 0.11 O ATOM 378 CB ALA A 26 4.412 -8.518 -5.854 1.00 11.15 C ATOM 0 H ALA A 26 6.121 -6.811 -5.016 1.00 15.45 H new ATOM 0 HA ALA A 26 5.015 -7.458 -7.629 1.00 15.24 H new ATOM 0 HB1 ALA A 26 3.531 -8.969 -6.309 1.00 11.15 H new ATOM 0 HB2 ALA A 26 5.250 -9.212 -5.918 1.00 11.15 H new ATOM 0 HB3 ALA A 26 4.205 -8.295 -4.807 1.00 11.15 H new ATOM 384 N ILE A 27 3.770 -5.030 -6.187 1.00 53.34 N ATOM 385 CA ILE A 27 2.744 -3.992 -6.200 1.00 62.42 C ATOM 386 C ILE A 27 2.342 -3.597 -7.649 1.00 3.23 C ATOM 387 O ILE A 27 1.212 -3.179 -7.883 1.00 74.15 O ATOM 388 CB ILE A 27 3.194 -2.744 -5.355 1.00 13.41 C ATOM 389 CG1 ILE A 27 1.978 -1.797 -5.133 1.00 40.13 C ATOM 390 CG2 ILE A 27 4.389 -2.014 -6.014 1.00 32.34 C ATOM 391 CD1 ILE A 27 2.174 -0.662 -4.150 1.00 20.40 C ATOM 0 H ILE A 27 4.668 -4.714 -5.822 1.00 53.34 H new ATOM 0 HA ILE A 27 1.851 -4.403 -5.728 1.00 62.42 H new ATOM 0 HB ILE A 27 3.544 -3.084 -4.380 1.00 13.41 H new ATOM 0 HG12 ILE A 27 1.699 -1.369 -6.096 1.00 40.13 H new ATOM 0 HG13 ILE A 27 1.135 -2.399 -4.795 1.00 40.13 H new ATOM 0 HG21 ILE A 27 4.673 -1.157 -5.403 1.00 32.34 H new ATOM 0 HG22 ILE A 27 5.234 -2.698 -6.095 1.00 32.34 H new ATOM 0 HG23 ILE A 27 4.103 -1.672 -7.009 1.00 32.34 H new ATOM 0 HD11 ILE A 27 1.257 -0.076 -4.084 1.00 20.40 H new ATOM 0 HD12 ILE A 27 2.416 -1.069 -3.168 1.00 20.40 H new ATOM 0 HD13 ILE A 27 2.989 -0.023 -4.490 1.00 20.40 H new ATOM 403 N HIS A 28 3.255 -3.798 -8.634 1.00 75.41 N ATOM 404 CA HIS A 28 2.938 -3.528 -10.061 1.00 72.42 C ATOM 405 C HIS A 28 2.016 -4.621 -10.669 1.00 71.24 C ATOM 406 O HIS A 28 1.560 -4.491 -11.805 1.00 43.22 O ATOM 407 CB HIS A 28 4.237 -3.338 -10.907 1.00 35.10 C ATOM 408 CG HIS A 28 4.977 -4.590 -11.315 1.00 42.23 C ATOM 409 ND1 HIS A 28 6.001 -5.139 -10.575 1.00 31.25 N ATOM 410 CD2 HIS A 28 4.868 -5.365 -12.422 1.00 2.24 C ATOM 411 CE1 HIS A 28 6.481 -6.189 -11.206 1.00 54.30 C ATOM 412 NE2 HIS A 28 5.818 -6.348 -12.329 1.00 62.24 N ATOM 0 H HIS A 28 4.202 -4.141 -8.471 1.00 75.41 H new ATOM 0 HA HIS A 28 2.383 -2.590 -10.094 1.00 72.42 H new ATOM 0 HB2 HIS A 28 3.975 -2.789 -11.811 1.00 35.10 H new ATOM 0 HB3 HIS A 28 4.922 -2.709 -10.339 1.00 35.10 H new ATOM 0 HD1 HIS A 28 6.335 -4.787 -9.678 1.00 31.25 H new ATOM 0 HD2 HIS A 28 4.162 -5.232 -13.229 1.00 2.24 H new ATOM 0 HE1 HIS A 28 7.288 -6.817 -10.858 1.00 54.30 H new ATOM 421 N ARG A 29 1.761 -5.701 -9.902 1.00 1.35 N ATOM 422 CA ARG A 29 0.858 -6.795 -10.321 1.00 14.35 C ATOM 423 C ARG A 29 -0.627 -6.461 -10.022 1.00 1.24 C ATOM 424 O ARG A 29 -1.508 -6.867 -10.782 1.00 14.44 O ATOM 425 CB ARG A 29 1.257 -8.123 -9.620 1.00 14.14 C ATOM 426 CG ARG A 29 2.688 -8.612 -9.937 1.00 4.13 C ATOM 427 CD ARG A 29 3.052 -9.899 -9.170 1.00 31.43 C ATOM 428 NE ARG A 29 2.156 -11.031 -9.487 1.00 51.34 N ATOM 429 CZ ARG A 29 2.049 -12.143 -8.778 1.00 21.10 C ATOM 430 NH1 ARG A 29 2.739 -12.324 -7.691 1.00 4.42 N ATOM 431 NH2 ARG A 29 1.246 -13.075 -9.173 1.00 32.53 N ATOM 0 H ARG A 29 2.173 -5.840 -8.979 1.00 1.35 H new ATOM 0 HA ARG A 29 0.963 -6.912 -11.400 1.00 14.35 H new ATOM 0 HB2 ARG A 29 1.162 -7.992 -8.542 1.00 14.14 H new ATOM 0 HB3 ARG A 29 0.549 -8.899 -9.911 1.00 14.14 H new ATOM 0 HG2 ARG A 29 2.779 -8.793 -11.008 1.00 4.13 H new ATOM 0 HG3 ARG A 29 3.401 -7.828 -9.685 1.00 4.13 H new ATOM 0 HD2 ARG A 29 4.079 -10.178 -9.406 1.00 31.43 H new ATOM 0 HD3 ARG A 29 3.013 -9.701 -8.099 1.00 31.43 H new ATOM 0 HE ARG A 29 1.573 -10.948 -10.320 1.00 51.34 H new ATOM 0 HH11 ARG A 29 3.380 -11.600 -7.368 1.00 4.42 H new ATOM 0 HH12 ARG A 29 2.639 -13.190 -7.162 1.00 4.42 H new ATOM 0 HH21 ARG A 29 0.700 -12.950 -10.026 1.00 32.53 H new ATOM 0 HH22 ARG A 29 1.158 -13.935 -8.632 1.00 32.53 H new ATOM 445 N TRP A 30 -0.896 -5.693 -8.940 1.00 75.22 N ATOM 446 CA TRP A 30 -2.288 -5.437 -8.463 1.00 25.44 C ATOM 447 C TRP A 30 -2.664 -3.943 -8.502 1.00 54.11 C ATOM 448 O TRP A 30 -3.849 -3.601 -8.641 1.00 70.11 O ATOM 449 CB TRP A 30 -2.513 -5.998 -7.029 1.00 72.12 C ATOM 450 CG TRP A 30 -1.648 -5.395 -5.940 1.00 13.25 C ATOM 451 CD1 TRP A 30 -0.394 -5.789 -5.581 1.00 54.14 C ATOM 452 CD2 TRP A 30 -1.989 -4.310 -5.051 1.00 34.33 C ATOM 453 NE1 TRP A 30 0.063 -5.015 -4.549 1.00 63.24 N ATOM 454 CE2 TRP A 30 -0.893 -4.107 -4.203 1.00 24.14 C ATOM 455 CE3 TRP A 30 -3.111 -3.487 -4.900 1.00 24.42 C ATOM 456 CZ2 TRP A 30 -0.881 -3.128 -3.210 1.00 50.42 C ATOM 457 CZ3 TRP A 30 -3.101 -2.516 -3.913 1.00 14.43 C ATOM 458 CH2 TRP A 30 -1.990 -2.342 -3.082 1.00 51.34 C ATOM 0 H TRP A 30 -0.175 -5.239 -8.379 1.00 75.22 H new ATOM 0 HA TRP A 30 -2.942 -5.964 -9.158 1.00 25.44 H new ATOM 0 HB2 TRP A 30 -3.559 -5.848 -6.761 1.00 72.12 H new ATOM 0 HB3 TRP A 30 -2.341 -7.074 -7.049 1.00 72.12 H new ATOM 0 HD1 TRP A 30 0.158 -6.594 -6.043 1.00 54.14 H new ATOM 0 HE1 TRP A 30 0.978 -5.104 -4.107 1.00 63.24 H new ATOM 0 HE3 TRP A 30 -3.970 -3.607 -5.543 1.00 24.42 H new ATOM 0 HZ2 TRP A 30 -0.025 -2.996 -2.565 1.00 50.42 H new ATOM 0 HZ3 TRP A 30 -3.966 -1.882 -3.783 1.00 14.43 H new ATOM 0 HH2 TRP A 30 -2.009 -1.572 -2.325 1.00 51.34 H new ATOM 469 N HIS A 31 -1.666 -3.053 -8.348 1.00 20.13 N ATOM 470 CA HIS A 31 -1.901 -1.601 -8.268 1.00 72.41 C ATOM 471 C HIS A 31 -1.747 -0.965 -9.680 1.00 0.04 C ATOM 472 O HIS A 31 -0.619 -0.852 -10.172 1.00 64.25 O ATOM 473 CB HIS A 31 -0.934 -0.942 -7.262 1.00 10.25 C ATOM 474 CG HIS A 31 -1.388 0.413 -6.814 1.00 35.31 C ATOM 475 ND1 HIS A 31 -1.071 1.556 -7.503 1.00 32.24 N ATOM 476 CD2 HIS A 31 -2.172 0.735 -5.768 1.00 32.31 C ATOM 477 CE1 HIS A 31 -1.662 2.535 -6.852 1.00 64.11 C ATOM 478 NE2 HIS A 31 -2.337 2.085 -5.799 1.00 12.11 N ATOM 0 H HIS A 31 -0.684 -3.318 -8.276 1.00 20.13 H new ATOM 0 HA HIS A 31 -2.917 -1.429 -7.913 1.00 72.41 H new ATOM 0 HB2 HIS A 31 -0.828 -1.589 -6.392 1.00 10.25 H new ATOM 0 HB3 HIS A 31 0.052 -0.856 -7.718 1.00 10.25 H new ATOM 0 HD2 HIS A 31 -2.590 0.052 -5.043 1.00 32.31 H new ATOM 0 HE1 HIS A 31 -1.606 3.575 -7.138 1.00 64.11 H new ATOM 0 HE2 HIS A 31 -2.876 2.646 -5.139 1.00 12.11 H new ATOM 486 N PRO A 32 -2.867 -0.532 -10.350 1.00 4.24 N ATOM 487 CA PRO A 32 -2.842 -0.103 -11.783 1.00 13.24 C ATOM 488 C PRO A 32 -2.123 1.254 -12.051 1.00 71.03 C ATOM 489 O PRO A 32 -1.928 1.626 -13.211 1.00 71.15 O ATOM 490 CB PRO A 32 -4.343 -0.052 -12.158 1.00 72.24 C ATOM 491 CG PRO A 32 -5.046 0.244 -10.869 1.00 64.24 C ATOM 492 CD PRO A 32 -4.239 -0.431 -9.778 1.00 63.52 C ATOM 0 HA PRO A 32 -2.255 -0.792 -12.390 1.00 13.24 H new ATOM 0 HB2 PRO A 32 -4.539 0.719 -12.903 1.00 72.24 H new ATOM 0 HB3 PRO A 32 -4.677 -0.998 -12.583 1.00 72.24 H new ATOM 0 HG2 PRO A 32 -5.108 1.319 -10.698 1.00 64.24 H new ATOM 0 HG3 PRO A 32 -6.068 -0.135 -10.888 1.00 64.24 H new ATOM 0 HD2 PRO A 32 -4.245 0.154 -8.858 1.00 63.52 H new ATOM 0 HD3 PRO A 32 -4.642 -1.414 -9.534 1.00 63.52 H new ATOM 500 N GLN A 33 -1.730 1.981 -10.988 1.00 74.53 N ATOM 501 CA GLN A 33 -0.890 3.203 -11.116 1.00 41.23 C ATOM 502 C GLN A 33 0.618 2.851 -11.112 1.00 32.11 C ATOM 503 O GLN A 33 1.428 3.575 -11.703 1.00 64.32 O ATOM 504 CB GLN A 33 -1.243 4.226 -9.995 1.00 52.15 C ATOM 505 CG GLN A 33 -2.487 5.126 -10.293 1.00 44.11 C ATOM 506 CD GLN A 33 -3.473 5.274 -9.128 1.00 74.34 C ATOM 507 OE1 GLN A 33 -4.036 6.338 -8.903 1.00 20.04 O ATOM 508 NE2 GLN A 33 -3.747 4.187 -8.424 1.00 74.24 N ATOM 0 H GLN A 33 -1.978 1.749 -10.026 1.00 74.53 H new ATOM 0 HA GLN A 33 -1.108 3.669 -12.077 1.00 41.23 H new ATOM 0 HB2 GLN A 33 -1.421 3.680 -9.068 1.00 52.15 H new ATOM 0 HB3 GLN A 33 -0.380 4.869 -9.825 1.00 52.15 H new ATOM 0 HG2 GLN A 33 -2.139 6.117 -10.583 1.00 44.11 H new ATOM 0 HG3 GLN A 33 -3.019 4.712 -11.150 1.00 44.11 H new ATOM 0 HE21 GLN A 33 -3.265 3.312 -8.629 1.00 74.24 H new ATOM 0 HE22 GLN A 33 -4.440 4.225 -7.676 1.00 74.24 H new ATOM 517 N VAL A 34 0.991 1.743 -10.441 1.00 72.24 N ATOM 518 CA VAL A 34 2.377 1.236 -10.465 1.00 73.13 C ATOM 519 C VAL A 34 2.620 0.422 -11.766 1.00 62.44 C ATOM 520 O VAL A 34 2.093 -0.687 -11.919 1.00 22.32 O ATOM 521 CB VAL A 34 2.694 0.341 -9.207 1.00 23.51 C ATOM 522 CG1 VAL A 34 4.179 -0.107 -9.214 1.00 34.44 C ATOM 523 CG2 VAL A 34 2.334 1.072 -7.885 1.00 1.24 C ATOM 0 H VAL A 34 0.352 1.183 -9.876 1.00 72.24 H new ATOM 0 HA VAL A 34 3.046 2.096 -10.439 1.00 73.13 H new ATOM 0 HB VAL A 34 2.070 -0.551 -9.265 1.00 23.51 H new ATOM 0 HG11 VAL A 34 4.377 -0.724 -8.337 1.00 34.44 H new ATOM 0 HG12 VAL A 34 4.381 -0.684 -10.117 1.00 34.44 H new ATOM 0 HG13 VAL A 34 4.824 0.771 -9.193 1.00 34.44 H new ATOM 0 HG21 VAL A 34 2.565 0.426 -7.038 1.00 1.24 H new ATOM 0 HG22 VAL A 34 2.913 1.992 -7.809 1.00 1.24 H new ATOM 0 HG23 VAL A 34 1.271 1.311 -7.879 1.00 1.24 H new ATOM 533 N SER A 35 3.397 1.000 -12.706 1.00 33.21 N ATOM 534 CA SER A 35 3.722 0.346 -14.002 1.00 31.22 C ATOM 535 C SER A 35 4.728 -0.814 -13.800 1.00 22.42 C ATOM 536 O SER A 35 4.357 -1.990 -13.884 1.00 41.42 O ATOM 537 CB SER A 35 4.275 1.390 -15.011 1.00 14.21 C ATOM 538 OG SER A 35 3.358 2.457 -15.210 1.00 61.23 O ATOM 0 H SER A 35 3.815 1.924 -12.595 1.00 33.21 H new ATOM 0 HA SER A 35 2.805 -0.077 -14.412 1.00 31.22 H new ATOM 0 HB2 SER A 35 5.222 1.786 -14.644 1.00 14.21 H new ATOM 0 HB3 SER A 35 4.481 0.903 -15.964 1.00 14.21 H new ATOM 0 HG SER A 35 3.735 3.098 -15.848 1.00 61.23 H new ATOM 544 N ALA A 36 5.992 -0.457 -13.492 1.00 34.44 N ATOM 545 CA ALA A 36 7.089 -1.422 -13.249 1.00 2.35 C ATOM 546 C ALA A 36 8.335 -0.692 -12.668 1.00 50.41 C ATOM 547 O ALA A 36 9.035 0.013 -13.406 1.00 41.23 O ATOM 548 CB ALA A 36 7.459 -2.195 -14.540 1.00 51.01 C ATOM 0 H ALA A 36 6.284 0.516 -13.404 1.00 34.44 H new ATOM 0 HA ALA A 36 6.739 -2.151 -12.518 1.00 2.35 H new ATOM 0 HB1 ALA A 36 8.267 -2.895 -14.326 1.00 51.01 H new ATOM 0 HB2 ALA A 36 6.588 -2.745 -14.897 1.00 51.01 H new ATOM 0 HB3 ALA A 36 7.782 -1.490 -15.306 1.00 51.01 H new ATOM 554 N PRO A 37 8.614 -0.822 -11.329 1.00 4.13 N ATOM 555 CA PRO A 37 9.758 -0.137 -10.670 1.00 44.42 C ATOM 556 C PRO A 37 11.115 -0.904 -10.775 1.00 33.31 C ATOM 557 O PRO A 37 11.160 -2.091 -11.125 1.00 53.44 O ATOM 558 CB PRO A 37 9.267 -0.040 -9.212 1.00 40.45 C ATOM 559 CG PRO A 37 8.469 -1.300 -8.998 1.00 32.34 C ATOM 560 CD PRO A 37 7.829 -1.628 -10.344 1.00 64.53 C ATOM 0 HA PRO A 37 9.994 0.819 -11.138 1.00 44.42 H new ATOM 0 HB2 PRO A 37 10.103 0.024 -8.515 1.00 40.45 H new ATOM 0 HB3 PRO A 37 8.655 0.849 -9.058 1.00 40.45 H new ATOM 0 HG2 PRO A 37 9.110 -2.115 -8.662 1.00 32.34 H new ATOM 0 HG3 PRO A 37 7.709 -1.155 -8.230 1.00 32.34 H new ATOM 0 HD2 PRO A 37 7.888 -2.694 -10.564 1.00 64.53 H new ATOM 0 HD3 PRO A 37 6.773 -1.358 -10.359 1.00 64.53 H new ATOM 568 N THR A 38 12.207 -0.191 -10.443 1.00 44.43 N ATOM 569 CA THR A 38 13.597 -0.706 -10.489 1.00 12.43 C ATOM 570 C THR A 38 14.068 -1.091 -9.070 1.00 32.02 C ATOM 571 O THR A 38 14.214 -0.215 -8.221 1.00 32.41 O ATOM 572 CB THR A 38 14.578 0.371 -11.086 1.00 4.30 C ATOM 573 OG1 THR A 38 14.168 0.722 -12.417 1.00 34.12 O ATOM 574 CG2 THR A 38 16.042 -0.114 -11.123 1.00 71.34 C ATOM 0 H THR A 38 12.152 0.778 -10.129 1.00 44.43 H new ATOM 0 HA THR A 38 13.607 -1.586 -11.132 1.00 12.43 H new ATOM 0 HB THR A 38 14.531 1.239 -10.428 1.00 4.30 H new ATOM 0 HG1 THR A 38 14.781 1.394 -12.782 1.00 34.12 H new ATOM 0 HG21 THR A 38 16.674 0.668 -11.544 1.00 71.34 H new ATOM 0 HG22 THR A 38 16.375 -0.344 -10.111 1.00 71.34 H new ATOM 0 HG23 THR A 38 16.113 -1.009 -11.741 1.00 71.34 H new ATOM 582 N LEU A 39 14.327 -2.388 -8.828 1.00 30.13 N ATOM 583 CA LEU A 39 14.724 -2.892 -7.486 1.00 53.41 C ATOM 584 C LEU A 39 16.262 -2.888 -7.313 1.00 61.24 C ATOM 585 O LEU A 39 16.997 -3.306 -8.214 1.00 72.13 O ATOM 586 CB LEU A 39 14.115 -4.310 -7.215 1.00 31.50 C ATOM 587 CG LEU A 39 12.724 -4.342 -6.505 1.00 74.42 C ATOM 588 CD1 LEU A 39 12.814 -3.768 -5.076 1.00 3.22 C ATOM 589 CD2 LEU A 39 11.641 -3.630 -7.342 1.00 72.12 C ATOM 0 H LEU A 39 14.270 -3.114 -9.542 1.00 30.13 H new ATOM 0 HA LEU A 39 14.315 -2.211 -6.740 1.00 53.41 H new ATOM 0 HB2 LEU A 39 14.025 -4.831 -8.168 1.00 31.50 H new ATOM 0 HB3 LEU A 39 14.822 -4.876 -6.608 1.00 31.50 H new ATOM 0 HG LEU A 39 12.422 -5.386 -6.419 1.00 74.42 H new ATOM 0 HD11 LEU A 39 11.831 -3.803 -4.607 1.00 3.22 H new ATOM 0 HD12 LEU A 39 13.517 -4.360 -4.490 1.00 3.22 H new ATOM 0 HD13 LEU A 39 13.158 -2.735 -5.120 1.00 3.22 H new ATOM 0 HD21 LEU A 39 10.688 -3.673 -6.816 1.00 72.12 H new ATOM 0 HD22 LEU A 39 11.925 -2.589 -7.494 1.00 72.12 H new ATOM 0 HD23 LEU A 39 11.544 -4.125 -8.309 1.00 72.12 H new ATOM 601 N ARG A 40 16.735 -2.396 -6.144 1.00 21.11 N ATOM 602 CA ARG A 40 18.179 -2.296 -5.822 1.00 73.22 C ATOM 603 C ARG A 40 18.588 -3.328 -4.740 1.00 10.33 C ATOM 604 O ARG A 40 18.079 -3.269 -3.620 1.00 35.31 O ATOM 605 CB ARG A 40 18.505 -0.856 -5.320 1.00 13.25 C ATOM 606 CG ARG A 40 18.191 0.276 -6.326 1.00 15.45 C ATOM 607 CD ARG A 40 18.946 0.103 -7.660 1.00 14.30 C ATOM 608 NE ARG A 40 18.742 1.232 -8.581 1.00 23.23 N ATOM 609 CZ ARG A 40 19.263 1.333 -9.788 1.00 61.51 C ATOM 610 NH1 ARG A 40 20.035 0.402 -10.269 1.00 51.44 N ATOM 611 NH2 ARG A 40 19.017 2.379 -10.503 1.00 31.04 N ATOM 0 H ARG A 40 16.127 -2.057 -5.398 1.00 21.11 H new ATOM 0 HA ARG A 40 18.745 -2.511 -6.729 1.00 73.22 H new ATOM 0 HB2 ARG A 40 17.945 -0.672 -4.403 1.00 13.25 H new ATOM 0 HB3 ARG A 40 19.563 -0.809 -5.062 1.00 13.25 H new ATOM 0 HG2 ARG A 40 17.118 0.300 -6.519 1.00 15.45 H new ATOM 0 HG3 ARG A 40 18.456 1.236 -5.883 1.00 15.45 H new ATOM 0 HD2 ARG A 40 20.011 -0.007 -7.458 1.00 14.30 H new ATOM 0 HD3 ARG A 40 18.616 -0.817 -8.142 1.00 14.30 H new ATOM 0 HE ARG A 40 18.150 1.998 -8.260 1.00 23.23 H new ATOM 0 HH11 ARG A 40 20.247 -0.424 -9.710 1.00 51.44 H new ATOM 0 HH12 ARG A 40 20.428 0.499 -11.205 1.00 51.44 H new ATOM 0 HH21 ARG A 40 18.423 3.121 -10.133 1.00 31.04 H new ATOM 0 HH22 ARG A 40 19.417 2.464 -11.438 1.00 31.04 H new ATOM 625 N GLY A 41 19.556 -4.213 -5.087 1.00 62.23 N ATOM 626 CA GLY A 41 20.136 -5.244 -4.184 1.00 31.31 C ATOM 627 C GLY A 41 19.165 -6.042 -3.280 1.00 0.22 C ATOM 628 O GLY A 41 17.942 -6.011 -3.461 1.00 65.13 O ATOM 0 H GLY A 41 19.965 -4.232 -6.021 1.00 62.23 H new ATOM 0 HA2 GLY A 41 20.684 -5.958 -4.799 1.00 31.31 H new ATOM 0 HA3 GLY A 41 20.865 -4.753 -3.540 1.00 31.31 H new ATOM 632 N ALA A 42 19.758 -6.802 -2.330 1.00 11.50 N ATOM 633 CA ALA A 42 19.030 -7.558 -1.276 1.00 12.23 C ATOM 634 C ALA A 42 17.980 -8.564 -1.838 1.00 60.32 C ATOM 635 O ALA A 42 18.330 -9.696 -2.198 1.00 23.45 O ATOM 636 CB ALA A 42 18.413 -6.589 -0.243 1.00 74.34 C ATOM 0 H ALA A 42 20.770 -6.911 -2.271 1.00 11.50 H new ATOM 0 HA ALA A 42 19.769 -8.179 -0.769 1.00 12.23 H new ATOM 0 HB1 ALA A 42 17.884 -7.160 0.521 1.00 74.34 H new ATOM 0 HB2 ALA A 42 19.205 -6.003 0.225 1.00 74.34 H new ATOM 0 HB3 ALA A 42 17.714 -5.919 -0.744 1.00 74.34 H new ATOM 642 N SER A 43 16.719 -8.093 -1.967 1.00 51.10 N ATOM 643 CA SER A 43 15.521 -8.907 -2.312 1.00 52.34 C ATOM 644 C SER A 43 14.251 -8.052 -2.071 1.00 3.23 C ATOM 645 O SER A 43 14.245 -7.216 -1.161 1.00 63.55 O ATOM 646 CB SER A 43 15.421 -10.213 -1.451 1.00 3.12 C ATOM 647 OG SER A 43 14.218 -10.935 -1.703 1.00 11.31 O ATOM 0 H SER A 43 16.495 -7.107 -1.831 1.00 51.10 H new ATOM 0 HA SER A 43 15.609 -9.203 -3.357 1.00 52.34 H new ATOM 0 HB2 SER A 43 16.278 -10.853 -1.664 1.00 3.12 H new ATOM 0 HB3 SER A 43 15.472 -9.953 -0.394 1.00 3.12 H new ATOM 0 HG SER A 43 14.198 -11.742 -1.147 1.00 11.31 H new ATOM 653 N PRO A 44 13.136 -8.255 -2.850 1.00 52.33 N ATOM 654 CA PRO A 44 11.802 -7.660 -2.516 1.00 64.02 C ATOM 655 C PRO A 44 11.249 -8.148 -1.136 1.00 4.44 C ATOM 656 O PRO A 44 10.294 -7.580 -0.600 1.00 25.24 O ATOM 657 CB PRO A 44 10.896 -8.129 -3.691 1.00 22.30 C ATOM 658 CG PRO A 44 11.605 -9.319 -4.265 1.00 5.42 C ATOM 659 CD PRO A 44 13.079 -9.016 -4.124 1.00 54.43 C ATOM 0 HA PRO A 44 11.851 -6.576 -2.413 1.00 64.02 H new ATOM 0 HB2 PRO A 44 9.898 -8.393 -3.341 1.00 22.30 H new ATOM 0 HB3 PRO A 44 10.775 -7.343 -4.436 1.00 22.30 H new ATOM 0 HG2 PRO A 44 11.339 -10.231 -3.730 1.00 5.42 H new ATOM 0 HG3 PRO A 44 11.334 -9.472 -5.310 1.00 5.42 H new ATOM 0 HD2 PRO A 44 13.677 -9.926 -4.079 1.00 54.43 H new ATOM 0 HD3 PRO A 44 13.454 -8.430 -4.963 1.00 54.43 H new ATOM 667 N HIS A 45 11.862 -9.221 -0.588 1.00 44.14 N ATOM 668 CA HIS A 45 11.535 -9.774 0.744 1.00 12.25 C ATOM 669 C HIS A 45 12.473 -9.244 1.862 1.00 1.14 C ATOM 670 O HIS A 45 12.118 -9.315 3.046 1.00 53.24 O ATOM 671 CB HIS A 45 11.588 -11.325 0.696 1.00 53.03 C ATOM 672 CG HIS A 45 10.452 -11.936 -0.080 1.00 64.25 C ATOM 673 ND1 HIS A 45 9.368 -12.537 0.526 1.00 35.42 N ATOM 674 CD2 HIS A 45 10.204 -11.992 -1.402 1.00 1.55 C ATOM 675 CE1 HIS A 45 8.507 -12.919 -0.379 1.00 13.04 C ATOM 676 NE2 HIS A 45 8.986 -12.610 -1.557 1.00 42.10 N ATOM 0 H HIS A 45 12.605 -9.732 -1.064 1.00 44.14 H new ATOM 0 HA HIS A 45 10.527 -9.441 0.992 1.00 12.25 H new ATOM 0 HB2 HIS A 45 12.532 -11.636 0.249 1.00 53.03 H new ATOM 0 HB3 HIS A 45 11.574 -11.714 1.714 1.00 53.03 H new ATOM 0 HD2 HIS A 45 10.841 -11.622 -2.191 1.00 1.55 H new ATOM 0 HE1 HIS A 45 7.562 -13.406 -0.188 1.00 13.04 H new ATOM 0 HE2 HIS A 45 8.528 -12.798 -2.449 1.00 42.10 H new ATOM 685 N THR A 46 13.663 -8.736 1.493 1.00 32.02 N ATOM 686 CA THR A 46 14.680 -8.268 2.479 1.00 3.12 C ATOM 687 C THR A 46 14.652 -6.718 2.639 1.00 50.03 C ATOM 688 O THR A 46 14.796 -5.997 1.643 1.00 3.44 O ATOM 689 CB THR A 46 16.121 -8.735 2.062 1.00 74.30 C ATOM 690 OG1 THR A 46 16.150 -10.172 1.932 1.00 11.34 O ATOM 691 CG2 THR A 46 17.197 -8.293 3.076 1.00 10.03 C ATOM 0 H THR A 46 13.953 -8.635 0.520 1.00 32.02 H new ATOM 0 HA THR A 46 14.426 -8.716 3.440 1.00 3.12 H new ATOM 0 HB THR A 46 16.350 -8.262 1.107 1.00 74.30 H new ATOM 0 HG1 THR A 46 17.050 -10.459 1.670 1.00 11.34 H new ATOM 0 HG21 THR A 46 18.175 -8.640 2.743 1.00 10.03 H new ATOM 0 HG22 THR A 46 17.203 -7.205 3.149 1.00 10.03 H new ATOM 0 HG23 THR A 46 16.974 -8.721 4.053 1.00 10.03 H new ATOM 699 N PRO A 47 14.453 -6.179 3.898 1.00 11.25 N ATOM 700 CA PRO A 47 14.482 -4.713 4.169 1.00 42.35 C ATOM 701 C PRO A 47 15.819 -4.033 3.744 1.00 54.12 C ATOM 702 O PRO A 47 16.910 -4.485 4.116 1.00 15.42 O ATOM 703 CB PRO A 47 14.239 -4.617 5.706 1.00 70.11 C ATOM 704 CG PRO A 47 14.544 -5.986 6.241 1.00 42.14 C ATOM 705 CD PRO A 47 14.152 -6.946 5.141 1.00 60.20 C ATOM 0 HA PRO A 47 13.732 -4.180 3.585 1.00 42.35 H new ATOM 0 HB2 PRO A 47 14.884 -3.865 6.160 1.00 70.11 H new ATOM 0 HB3 PRO A 47 13.211 -4.329 5.925 1.00 70.11 H new ATOM 0 HG2 PRO A 47 15.601 -6.084 6.489 1.00 42.14 H new ATOM 0 HG3 PRO A 47 13.983 -6.185 7.154 1.00 42.14 H new ATOM 0 HD2 PRO A 47 14.725 -7.872 5.192 1.00 60.20 H new ATOM 0 HD3 PRO A 47 13.098 -7.219 5.201 1.00 60.20 H new ATOM 713 N GLY A 48 15.704 -2.965 2.933 1.00 33.44 N ATOM 714 CA GLY A 48 16.860 -2.220 2.410 1.00 24.31 C ATOM 715 C GLY A 48 16.789 -2.026 0.895 1.00 43.41 C ATOM 716 O GLY A 48 17.392 -1.091 0.356 1.00 40.21 O ATOM 0 H GLY A 48 14.805 -2.596 2.623 1.00 33.44 H new ATOM 0 HA2 GLY A 48 16.912 -1.246 2.897 1.00 24.31 H new ATOM 0 HA3 GLY A 48 17.777 -2.752 2.663 1.00 24.31 H new ATOM 720 N ALA A 49 16.057 -2.928 0.202 1.00 71.03 N ATOM 721 CA ALA A 49 15.858 -2.855 -1.263 1.00 20.41 C ATOM 722 C ALA A 49 14.982 -1.639 -1.660 1.00 54.43 C ATOM 723 O ALA A 49 13.989 -1.350 -0.999 1.00 5.12 O ATOM 724 CB ALA A 49 15.228 -4.161 -1.779 1.00 52.14 C ATOM 0 H ALA A 49 15.590 -3.722 0.640 1.00 71.03 H new ATOM 0 HA ALA A 49 16.836 -2.723 -1.727 1.00 20.41 H new ATOM 0 HB1 ALA A 49 15.086 -4.095 -2.858 1.00 52.14 H new ATOM 0 HB2 ALA A 49 15.887 -4.998 -1.550 1.00 52.14 H new ATOM 0 HB3 ALA A 49 14.264 -4.316 -1.295 1.00 52.14 H new ATOM 730 N GLU A 50 15.356 -0.943 -2.752 1.00 31.01 N ATOM 731 CA GLU A 50 14.672 0.304 -3.209 1.00 44.42 C ATOM 732 C GLU A 50 13.961 0.070 -4.557 1.00 44.31 C ATOM 733 O GLU A 50 14.559 -0.511 -5.453 1.00 24.11 O ATOM 734 CB GLU A 50 15.707 1.456 -3.369 1.00 30.44 C ATOM 735 CG GLU A 50 16.565 1.727 -2.125 1.00 22.23 C ATOM 736 CD GLU A 50 17.534 2.911 -2.286 1.00 32.23 C ATOM 737 OE1 GLU A 50 18.509 2.778 -3.053 1.00 1.51 O ATOM 738 OE2 GLU A 50 17.341 3.966 -1.629 1.00 12.35 O ATOM 0 H GLU A 50 16.137 -1.220 -3.347 1.00 31.01 H new ATOM 0 HA GLU A 50 13.932 0.580 -2.458 1.00 44.42 H new ATOM 0 HB2 GLU A 50 16.367 1.220 -4.204 1.00 30.44 H new ATOM 0 HB3 GLU A 50 15.175 2.370 -3.632 1.00 30.44 H new ATOM 0 HG2 GLU A 50 15.908 1.920 -1.277 1.00 22.23 H new ATOM 0 HG3 GLU A 50 17.138 0.830 -1.887 1.00 22.23 H new ATOM 745 N ARG A 51 12.694 0.527 -4.704 1.00 23.13 N ATOM 746 CA ARG A 51 11.952 0.440 -5.991 1.00 20.21 C ATOM 747 C ARG A 51 11.810 1.858 -6.627 1.00 14.33 C ATOM 748 O ARG A 51 11.249 2.776 -6.026 1.00 54.11 O ATOM 749 CB ARG A 51 10.572 -0.283 -5.800 1.00 75.15 C ATOM 750 CG ARG A 51 9.463 0.518 -5.086 1.00 35.32 C ATOM 751 CD ARG A 51 8.172 -0.297 -4.874 1.00 71.34 C ATOM 752 NE ARG A 51 7.106 0.522 -4.267 1.00 54.03 N ATOM 753 CZ ARG A 51 6.134 0.088 -3.486 1.00 22.42 C ATOM 754 NH1 ARG A 51 6.048 -1.161 -3.138 1.00 51.34 N ATOM 755 NH2 ARG A 51 5.254 0.930 -3.049 1.00 22.34 N ATOM 0 H ARG A 51 12.162 0.960 -3.949 1.00 23.13 H new ATOM 0 HA ARG A 51 12.522 -0.172 -6.690 1.00 20.21 H new ATOM 0 HB2 ARG A 51 10.202 -0.575 -6.783 1.00 75.15 H new ATOM 0 HB3 ARG A 51 10.744 -1.201 -5.238 1.00 75.15 H new ATOM 0 HG2 ARG A 51 9.834 0.859 -4.119 1.00 35.32 H new ATOM 0 HG3 ARG A 51 9.232 1.408 -5.671 1.00 35.32 H new ATOM 0 HD2 ARG A 51 7.829 -0.691 -5.831 1.00 71.34 H new ATOM 0 HD3 ARG A 51 8.383 -1.153 -4.234 1.00 71.34 H new ATOM 0 HE ARG A 51 7.121 1.521 -4.471 1.00 54.03 H new ATOM 0 HH11 ARG A 51 6.741 -1.832 -3.469 1.00 51.34 H new ATOM 0 HH12 ARG A 51 5.287 -1.471 -2.533 1.00 51.34 H new ATOM 0 HH21 ARG A 51 5.317 1.914 -3.309 1.00 22.34 H new ATOM 0 HH22 ARG A 51 4.497 0.609 -2.445 1.00 22.34 H new ATOM 769 N VAL A 52 12.372 2.043 -7.840 1.00 52.23 N ATOM 770 CA VAL A 52 12.412 3.360 -8.533 1.00 73.44 C ATOM 771 C VAL A 52 11.599 3.307 -9.855 1.00 14.43 C ATOM 772 O VAL A 52 11.980 2.616 -10.800 1.00 13.10 O ATOM 773 CB VAL A 52 13.895 3.800 -8.833 1.00 20.41 C ATOM 774 CG1 VAL A 52 13.940 5.220 -9.457 1.00 71.23 C ATOM 775 CG2 VAL A 52 14.782 3.724 -7.560 1.00 64.23 C ATOM 0 H VAL A 52 12.811 1.290 -8.370 1.00 52.23 H new ATOM 0 HA VAL A 52 11.961 4.097 -7.869 1.00 73.44 H new ATOM 0 HB VAL A 52 14.303 3.098 -9.560 1.00 20.41 H new ATOM 0 HG11 VAL A 52 14.975 5.498 -9.654 1.00 71.23 H new ATOM 0 HG12 VAL A 52 13.379 5.225 -10.392 1.00 71.23 H new ATOM 0 HG13 VAL A 52 13.497 5.936 -8.765 1.00 71.23 H new ATOM 0 HG21 VAL A 52 15.798 4.035 -7.805 1.00 64.23 H new ATOM 0 HG22 VAL A 52 14.376 4.384 -6.794 1.00 64.23 H new ATOM 0 HG23 VAL A 52 14.796 2.700 -7.187 1.00 64.23 H new ATOM 785 N PHE A 53 10.502 4.070 -9.908 1.00 40.12 N ATOM 786 CA PHE A 53 9.516 4.026 -11.015 1.00 20.13 C ATOM 787 C PHE A 53 10.079 4.656 -12.317 1.00 41.30 C ATOM 788 O PHE A 53 9.971 5.867 -12.531 1.00 75.14 O ATOM 789 CB PHE A 53 8.201 4.740 -10.573 1.00 1.03 C ATOM 790 CG PHE A 53 7.379 4.012 -9.496 1.00 51.12 C ATOM 791 CD1 PHE A 53 7.981 3.450 -8.365 1.00 13.44 C ATOM 792 CD2 PHE A 53 5.994 3.904 -9.614 1.00 25.23 C ATOM 793 CE1 PHE A 53 7.232 2.809 -7.402 1.00 44.23 C ATOM 794 CE2 PHE A 53 5.250 3.263 -8.650 1.00 74.22 C ATOM 795 CZ PHE A 53 5.867 2.714 -7.545 1.00 45.44 C ATOM 0 H PHE A 53 10.263 4.745 -9.181 1.00 40.12 H new ATOM 0 HA PHE A 53 9.300 2.981 -11.238 1.00 20.13 H new ATOM 0 HB2 PHE A 53 8.455 5.733 -10.201 1.00 1.03 H new ATOM 0 HB3 PHE A 53 7.572 4.880 -11.452 1.00 1.03 H new ATOM 0 HD1 PHE A 53 9.052 3.520 -8.244 1.00 13.44 H new ATOM 0 HD2 PHE A 53 5.498 4.329 -10.474 1.00 25.23 H new ATOM 0 HE1 PHE A 53 7.716 2.382 -6.536 1.00 44.23 H new ATOM 0 HE2 PHE A 53 4.178 3.189 -8.759 1.00 74.22 H new ATOM 0 HZ PHE A 53 5.279 2.210 -6.793 1.00 45.44 H new ATOM 805 N GLY A 54 10.708 3.822 -13.167 1.00 62.22 N ATOM 806 CA GLY A 54 11.251 4.268 -14.462 1.00 73.32 C ATOM 807 C GLY A 54 12.703 4.752 -14.375 1.00 2.51 C ATOM 808 O GLY A 54 13.568 4.238 -15.091 1.00 31.41 O ATOM 0 H GLY A 54 10.853 2.830 -12.977 1.00 62.22 H new ATOM 0 HA2 GLY A 54 11.191 3.446 -15.176 1.00 73.32 H new ATOM 0 HA3 GLY A 54 10.629 5.074 -14.851 1.00 73.32 H new ATOM 812 N ALA A 55 12.945 5.747 -13.492 1.00 35.33 N ATOM 813 CA ALA A 55 14.276 6.382 -13.271 1.00 25.05 C ATOM 814 C ALA A 55 14.744 7.211 -14.503 1.00 62.42 C ATOM 815 O ALA A 55 15.301 6.662 -15.463 1.00 22.33 O ATOM 816 CB ALA A 55 15.355 5.354 -12.841 1.00 61.11 C ATOM 0 H ALA A 55 12.213 6.142 -12.901 1.00 35.33 H new ATOM 0 HA ALA A 55 14.146 7.078 -12.442 1.00 25.05 H new ATOM 0 HB1 ALA A 55 16.306 5.865 -12.692 1.00 61.11 H new ATOM 0 HB2 ALA A 55 15.051 4.875 -11.910 1.00 61.11 H new ATOM 0 HB3 ALA A 55 15.467 4.598 -13.618 1.00 61.11 H new ATOM 822 N GLY A 56 14.509 8.538 -14.474 1.00 62.12 N ATOM 823 CA GLY A 56 14.935 9.438 -15.570 1.00 3.30 C ATOM 824 C GLY A 56 13.813 9.795 -16.550 1.00 1.33 C ATOM 825 O GLY A 56 14.057 9.960 -17.750 1.00 43.54 O ATOM 0 H GLY A 56 14.029 9.011 -13.708 1.00 62.12 H new ATOM 0 HA2 GLY A 56 15.334 10.356 -15.139 1.00 3.30 H new ATOM 0 HA3 GLY A 56 15.748 8.965 -16.120 1.00 3.30 H new ATOM 829 N THR A 57 12.582 9.939 -16.023 1.00 1.51 N ATOM 830 CA THR A 57 11.391 10.340 -16.814 1.00 70.52 C ATOM 831 C THR A 57 11.016 11.824 -16.534 1.00 21.42 C ATOM 832 O THR A 57 11.418 12.715 -17.293 1.00 51.31 O ATOM 833 CB THR A 57 10.171 9.372 -16.556 1.00 62.14 C ATOM 834 OG1 THR A 57 9.807 9.363 -15.160 1.00 43.42 O ATOM 835 CG2 THR A 57 10.479 7.931 -17.005 1.00 4.32 C ATOM 0 H THR A 57 12.380 9.782 -15.036 1.00 1.51 H new ATOM 0 HA THR A 57 11.646 10.255 -17.870 1.00 70.52 H new ATOM 0 HB THR A 57 9.339 9.752 -17.148 1.00 62.14 H new ATOM 0 HG1 THR A 57 9.048 8.758 -15.024 1.00 43.42 H new ATOM 0 HG21 THR A 57 9.614 7.297 -16.810 1.00 4.32 H new ATOM 0 HG22 THR A 57 10.703 7.922 -18.072 1.00 4.32 H new ATOM 0 HG23 THR A 57 11.338 7.553 -16.451 1.00 4.32 H new ATOM 843 N GLU A 58 10.293 12.086 -15.422 1.00 25.21 N ATOM 844 CA GLU A 58 9.839 13.448 -15.025 1.00 42.13 C ATOM 845 C GLU A 58 9.178 13.409 -13.626 1.00 51.44 C ATOM 846 O GLU A 58 9.306 14.348 -12.828 1.00 12.43 O ATOM 847 CB GLU A 58 8.868 14.097 -16.077 1.00 43.53 C ATOM 848 CG GLU A 58 7.441 13.483 -16.198 1.00 33.13 C ATOM 849 CD GLU A 58 7.425 12.027 -16.695 1.00 61.11 C ATOM 850 OE1 GLU A 58 7.610 11.807 -17.908 1.00 70.42 O ATOM 851 OE2 GLU A 58 7.246 11.095 -15.876 1.00 43.10 O ATOM 0 H GLU A 58 10.004 11.358 -14.768 1.00 25.21 H new ATOM 0 HA GLU A 58 10.726 14.080 -14.987 1.00 42.13 H new ATOM 0 HB2 GLU A 58 8.762 15.154 -15.833 1.00 43.53 H new ATOM 0 HB3 GLU A 58 9.344 14.042 -17.056 1.00 43.53 H new ATOM 0 HG2 GLU A 58 6.953 13.529 -15.224 1.00 33.13 H new ATOM 0 HG3 GLU A 58 6.850 14.095 -16.879 1.00 33.13 H new ATOM 858 N GLU A 59 8.461 12.303 -13.344 1.00 0.44 N ATOM 859 CA GLU A 59 7.795 12.069 -12.045 1.00 72.14 C ATOM 860 C GLU A 59 8.119 10.634 -11.545 1.00 64.42 C ATOM 861 O GLU A 59 7.272 9.924 -10.988 1.00 72.34 O ATOM 862 CB GLU A 59 6.258 12.324 -12.193 1.00 5.45 C ATOM 863 CG GLU A 59 5.495 12.447 -10.853 1.00 64.23 C ATOM 864 CD GLU A 59 3.974 12.615 -11.024 1.00 75.20 C ATOM 865 OE1 GLU A 59 3.254 11.592 -11.101 1.00 44.05 O ATOM 866 OE2 GLU A 59 3.489 13.766 -11.098 1.00 24.23 O ATOM 0 H GLU A 59 8.327 11.544 -14.012 1.00 0.44 H new ATOM 0 HA GLU A 59 8.168 12.764 -11.293 1.00 72.14 H new ATOM 0 HB2 GLU A 59 6.108 13.238 -12.767 1.00 5.45 H new ATOM 0 HB3 GLU A 59 5.822 11.510 -12.771 1.00 5.45 H new ATOM 0 HG2 GLU A 59 5.689 11.559 -10.251 1.00 64.23 H new ATOM 0 HG3 GLU A 59 5.886 13.300 -10.298 1.00 64.23 H new ATOM 873 N GLU A 60 9.380 10.224 -11.766 1.00 3.44 N ATOM 874 CA GLU A 60 9.922 8.947 -11.263 1.00 70.03 C ATOM 875 C GLU A 60 9.920 8.906 -9.709 1.00 24.14 C ATOM 876 O GLU A 60 10.506 9.766 -9.044 1.00 41.44 O ATOM 877 CB GLU A 60 11.353 8.665 -11.830 1.00 15.31 C ATOM 878 CG GLU A 60 12.471 9.688 -11.483 1.00 10.23 C ATOM 879 CD GLU A 60 12.385 11.010 -12.266 1.00 33.22 C ATOM 880 OE1 GLU A 60 12.956 11.089 -13.369 1.00 14.15 O ATOM 881 OE2 GLU A 60 11.744 11.972 -11.791 1.00 53.24 O ATOM 0 H GLU A 60 10.056 10.770 -12.300 1.00 3.44 H new ATOM 0 HA GLU A 60 9.265 8.154 -11.620 1.00 70.03 H new ATOM 0 HB2 GLU A 60 11.670 7.685 -11.474 1.00 15.31 H new ATOM 0 HB3 GLU A 60 11.279 8.601 -12.916 1.00 15.31 H new ATOM 0 HG2 GLU A 60 12.428 9.908 -10.416 1.00 10.23 H new ATOM 0 HG3 GLU A 60 13.440 9.228 -11.675 1.00 10.23 H new ATOM 888 N LEU A 61 9.244 7.897 -9.150 1.00 32.31 N ATOM 889 CA LEU A 61 9.033 7.763 -7.697 1.00 3.52 C ATOM 890 C LEU A 61 10.077 6.805 -7.082 1.00 32.25 C ATOM 891 O LEU A 61 10.122 5.625 -7.432 1.00 65.34 O ATOM 892 CB LEU A 61 7.587 7.256 -7.436 1.00 42.33 C ATOM 893 CG LEU A 61 7.176 7.050 -5.943 1.00 71.12 C ATOM 894 CD1 LEU A 61 7.287 8.360 -5.137 1.00 14.11 C ATOM 895 CD2 LEU A 61 5.758 6.441 -5.840 1.00 5.40 C ATOM 0 H LEU A 61 8.823 7.143 -9.693 1.00 32.31 H new ATOM 0 HA LEU A 61 9.159 8.735 -7.220 1.00 3.52 H new ATOM 0 HB2 LEU A 61 6.891 7.964 -7.886 1.00 42.33 H new ATOM 0 HB3 LEU A 61 7.459 6.308 -7.958 1.00 42.33 H new ATOM 0 HG LEU A 61 7.877 6.342 -5.501 1.00 71.12 H new ATOM 0 HD11 LEU A 61 6.993 8.177 -4.103 1.00 14.11 H new ATOM 0 HD12 LEU A 61 8.316 8.718 -5.164 1.00 14.11 H new ATOM 0 HD13 LEU A 61 6.630 9.112 -5.573 1.00 14.11 H new ATOM 0 HD21 LEU A 61 5.495 6.307 -4.791 1.00 5.40 H new ATOM 0 HD22 LEU A 61 5.039 7.111 -6.312 1.00 5.40 H new ATOM 0 HD23 LEU A 61 5.739 5.475 -6.345 1.00 5.40 H new ATOM 907 N VAL A 62 10.926 7.323 -6.179 1.00 45.45 N ATOM 908 CA VAL A 62 11.941 6.507 -5.483 1.00 74.04 C ATOM 909 C VAL A 62 11.423 6.115 -4.084 1.00 20.13 C ATOM 910 O VAL A 62 11.205 6.983 -3.233 1.00 34.54 O ATOM 911 CB VAL A 62 13.312 7.262 -5.345 1.00 53.13 C ATOM 912 CG1 VAL A 62 14.394 6.373 -4.672 1.00 5.32 C ATOM 913 CG2 VAL A 62 13.797 7.800 -6.716 1.00 21.45 C ATOM 0 H VAL A 62 10.931 8.307 -5.911 1.00 45.45 H new ATOM 0 HA VAL A 62 12.114 5.614 -6.083 1.00 74.04 H new ATOM 0 HB VAL A 62 13.146 8.118 -4.691 1.00 53.13 H new ATOM 0 HG11 VAL A 62 15.327 6.931 -4.595 1.00 5.32 H new ATOM 0 HG12 VAL A 62 14.060 6.085 -3.675 1.00 5.32 H new ATOM 0 HG13 VAL A 62 14.555 5.478 -5.273 1.00 5.32 H new ATOM 0 HG21 VAL A 62 14.748 8.317 -6.588 1.00 21.45 H new ATOM 0 HG22 VAL A 62 13.927 6.968 -7.408 1.00 21.45 H new ATOM 0 HG23 VAL A 62 13.058 8.493 -7.117 1.00 21.45 H new ATOM 923 N GLU A 63 11.214 4.810 -3.877 1.00 73.02 N ATOM 924 CA GLU A 63 10.785 4.233 -2.590 1.00 24.20 C ATOM 925 C GLU A 63 11.851 3.259 -2.057 1.00 51.12 C ATOM 926 O GLU A 63 12.719 2.811 -2.803 1.00 41.42 O ATOM 927 CB GLU A 63 9.418 3.510 -2.746 1.00 24.42 C ATOM 928 CG GLU A 63 8.268 4.437 -3.189 1.00 61.42 C ATOM 929 CD GLU A 63 6.887 3.765 -3.178 1.00 5.33 C ATOM 930 OE1 GLU A 63 6.337 3.546 -2.080 1.00 63.34 O ATOM 931 OE2 GLU A 63 6.354 3.432 -4.256 1.00 2.33 O ATOM 0 H GLU A 63 11.339 4.110 -4.609 1.00 73.02 H new ATOM 0 HA GLU A 63 10.666 5.043 -1.871 1.00 24.20 H new ATOM 0 HB2 GLU A 63 9.524 2.706 -3.474 1.00 24.42 H new ATOM 0 HB3 GLU A 63 9.153 3.047 -1.796 1.00 24.42 H new ATOM 0 HG2 GLU A 63 8.243 5.307 -2.533 1.00 61.42 H new ATOM 0 HG3 GLU A 63 8.476 4.802 -4.195 1.00 61.42 H new ATOM 938 N ARG A 64 11.753 2.920 -0.761 1.00 64.33 N ATOM 939 CA ARG A 64 12.725 2.054 -0.069 1.00 3.25 C ATOM 940 C ARG A 64 12.037 1.227 1.038 1.00 11.11 C ATOM 941 O ARG A 64 11.308 1.775 1.868 1.00 55.40 O ATOM 942 CB ARG A 64 13.867 2.911 0.538 1.00 64.14 C ATOM 943 CG ARG A 64 14.976 2.087 1.238 1.00 32.41 C ATOM 944 CD ARG A 64 16.183 2.942 1.665 1.00 54.33 C ATOM 945 NE ARG A 64 17.273 2.100 2.201 1.00 10.21 N ATOM 946 CZ ARG A 64 18.470 1.959 1.661 1.00 43.51 C ATOM 947 NH1 ARG A 64 18.815 2.608 0.594 1.00 21.33 N ATOM 948 NH2 ARG A 64 19.326 1.159 2.205 1.00 13.31 N ATOM 0 H ARG A 64 10.994 3.240 -0.160 1.00 64.33 H new ATOM 0 HA ARG A 64 13.147 1.364 -0.799 1.00 3.25 H new ATOM 0 HB2 ARG A 64 14.319 3.508 -0.254 1.00 64.14 H new ATOM 0 HB3 ARG A 64 13.439 3.609 1.258 1.00 64.14 H new ATOM 0 HG2 ARG A 64 14.557 1.596 2.116 1.00 32.41 H new ATOM 0 HG3 ARG A 64 15.316 1.300 0.565 1.00 32.41 H new ATOM 0 HD2 ARG A 64 16.548 3.513 0.811 1.00 54.33 H new ATOM 0 HD3 ARG A 64 15.872 3.663 2.421 1.00 54.33 H new ATOM 0 HE ARG A 64 17.085 1.584 3.061 1.00 10.21 H new ATOM 0 HH11 ARG A 64 18.155 3.247 0.150 1.00 21.33 H new ATOM 0 HH12 ARG A 64 19.746 2.480 0.198 1.00 21.33 H new ATOM 0 HH21 ARG A 64 19.076 0.640 3.047 1.00 13.31 H new ATOM 0 HH22 ARG A 64 20.252 1.046 1.793 1.00 13.31 H new ATOM 962 N LEU A 65 12.291 -0.093 1.036 1.00 63.32 N ATOM 963 CA LEU A 65 11.750 -1.041 2.028 1.00 22.21 C ATOM 964 C LEU A 65 12.456 -0.871 3.392 1.00 5.10 C ATOM 965 O LEU A 65 13.648 -1.155 3.526 1.00 2.05 O ATOM 966 CB LEU A 65 11.909 -2.497 1.493 1.00 35.24 C ATOM 967 CG LEU A 65 11.342 -3.643 2.392 1.00 3.34 C ATOM 968 CD1 LEU A 65 9.883 -3.372 2.773 1.00 2.03 C ATOM 969 CD2 LEU A 65 11.487 -5.025 1.703 1.00 5.34 C ATOM 0 H LEU A 65 12.885 -0.538 0.337 1.00 63.32 H new ATOM 0 HA LEU A 65 10.691 -0.834 2.180 1.00 22.21 H new ATOM 0 HB2 LEU A 65 11.422 -2.556 0.519 1.00 35.24 H new ATOM 0 HB3 LEU A 65 12.970 -2.686 1.331 1.00 35.24 H new ATOM 0 HG LEU A 65 11.932 -3.666 3.308 1.00 3.34 H new ATOM 0 HD11 LEU A 65 9.513 -4.185 3.398 1.00 2.03 H new ATOM 0 HD12 LEU A 65 9.819 -2.433 3.323 1.00 2.03 H new ATOM 0 HD13 LEU A 65 9.277 -3.305 1.869 1.00 2.03 H new ATOM 0 HD21 LEU A 65 11.083 -5.800 2.354 1.00 5.34 H new ATOM 0 HD22 LEU A 65 10.939 -5.021 0.761 1.00 5.34 H new ATOM 0 HD23 LEU A 65 12.541 -5.226 1.509 1.00 5.34 H new ATOM 981 N VAL A 66 11.706 -0.384 4.389 1.00 25.50 N ATOM 982 CA VAL A 66 12.222 -0.144 5.756 1.00 1.42 C ATOM 983 C VAL A 66 12.223 -1.450 6.580 1.00 43.53 C ATOM 984 O VAL A 66 13.219 -1.805 7.224 1.00 21.31 O ATOM 985 CB VAL A 66 11.345 0.943 6.489 1.00 61.55 C ATOM 986 CG1 VAL A 66 11.822 1.203 7.943 1.00 65.31 C ATOM 987 CG2 VAL A 66 11.310 2.257 5.673 1.00 43.14 C ATOM 0 H VAL A 66 10.721 -0.143 4.277 1.00 25.50 H new ATOM 0 HA VAL A 66 13.247 0.217 5.671 1.00 1.42 H new ATOM 0 HB VAL A 66 10.331 0.548 6.556 1.00 61.55 H new ATOM 0 HG11 VAL A 66 11.187 1.959 8.405 1.00 65.31 H new ATOM 0 HG12 VAL A 66 11.761 0.278 8.517 1.00 65.31 H new ATOM 0 HG13 VAL A 66 12.854 1.555 7.930 1.00 65.31 H new ATOM 0 HG21 VAL A 66 10.700 2.994 6.196 1.00 43.14 H new ATOM 0 HG22 VAL A 66 12.324 2.641 5.558 1.00 43.14 H new ATOM 0 HG23 VAL A 66 10.882 2.063 4.690 1.00 43.14 H new ATOM 997 N GLU A 67 11.088 -2.154 6.530 1.00 34.04 N ATOM 998 CA GLU A 67 10.848 -3.401 7.283 1.00 73.24 C ATOM 999 C GLU A 67 9.756 -4.227 6.577 1.00 32.31 C ATOM 1000 O GLU A 67 8.890 -3.666 5.926 1.00 43.25 O ATOM 1001 CB GLU A 67 10.423 -3.069 8.751 1.00 25.35 C ATOM 1002 CG GLU A 67 10.204 -4.292 9.673 1.00 2.33 C ATOM 1003 CD GLU A 67 11.451 -5.186 9.783 1.00 31.23 C ATOM 1004 OE1 GLU A 67 12.383 -4.824 10.529 1.00 21.35 O ATOM 1005 OE2 GLU A 67 11.510 -6.245 9.117 1.00 11.21 O ATOM 0 H GLU A 67 10.293 -1.873 5.957 1.00 34.04 H new ATOM 0 HA GLU A 67 11.767 -3.986 7.316 1.00 73.24 H new ATOM 0 HB2 GLU A 67 11.187 -2.432 9.197 1.00 25.35 H new ATOM 0 HB3 GLU A 67 9.501 -2.488 8.721 1.00 25.35 H new ATOM 0 HG2 GLU A 67 9.922 -3.946 10.667 1.00 2.33 H new ATOM 0 HG3 GLU A 67 9.371 -4.883 9.293 1.00 2.33 H new ATOM 1012 N ARG A 68 9.794 -5.557 6.695 1.00 51.13 N ATOM 1013 CA ARG A 68 8.723 -6.420 6.150 1.00 42.31 C ATOM 1014 C ARG A 68 8.420 -7.565 7.137 1.00 73.04 C ATOM 1015 O ARG A 68 9.224 -8.486 7.310 1.00 23.23 O ATOM 1016 CB ARG A 68 9.101 -6.966 4.748 1.00 62.54 C ATOM 1017 CG ARG A 68 7.900 -7.556 3.964 1.00 24.11 C ATOM 1018 CD ARG A 68 8.330 -8.263 2.683 1.00 52.54 C ATOM 1019 NE ARG A 68 9.139 -9.441 3.008 1.00 41.40 N ATOM 1020 CZ ARG A 68 8.721 -10.677 3.001 1.00 74.31 C ATOM 1021 NH1 ARG A 68 7.528 -10.987 2.595 1.00 2.34 N ATOM 1022 NH2 ARG A 68 9.516 -11.609 3.393 1.00 33.32 N ATOM 0 H ARG A 68 10.547 -6.065 7.159 1.00 51.13 H new ATOM 0 HA ARG A 68 7.820 -5.821 6.027 1.00 42.31 H new ATOM 0 HB2 ARG A 68 9.546 -6.161 4.162 1.00 62.54 H new ATOM 0 HB3 ARG A 68 9.863 -7.737 4.861 1.00 62.54 H new ATOM 0 HG2 ARG A 68 7.364 -8.260 4.601 1.00 24.11 H new ATOM 0 HG3 ARG A 68 7.203 -6.755 3.717 1.00 24.11 H new ATOM 0 HD2 ARG A 68 7.452 -8.561 2.110 1.00 52.54 H new ATOM 0 HD3 ARG A 68 8.903 -7.580 2.056 1.00 52.54 H new ATOM 0 HE ARG A 68 10.114 -9.281 3.262 1.00 41.40 H new ATOM 0 HH11 ARG A 68 6.894 -10.257 2.272 1.00 2.34 H new ATOM 0 HH12 ARG A 68 7.225 -11.961 2.599 1.00 2.34 H new ATOM 0 HH21 ARG A 68 10.459 -11.377 3.704 1.00 33.32 H new ATOM 0 HH22 ARG A 68 9.203 -12.580 3.393 1.00 33.32 H new ATOM 1036 N ASP A 69 7.251 -7.479 7.780 1.00 22.42 N ATOM 1037 CA ASP A 69 6.824 -8.420 8.827 1.00 71.23 C ATOM 1038 C ASP A 69 6.028 -9.580 8.198 1.00 51.52 C ATOM 1039 O ASP A 69 4.804 -9.666 8.338 1.00 20.21 O ATOM 1040 CB ASP A 69 5.986 -7.662 9.891 1.00 44.01 C ATOM 1041 CG ASP A 69 6.626 -6.326 10.301 1.00 15.44 C ATOM 1042 OD1 ASP A 69 6.397 -5.304 9.606 1.00 24.11 O ATOM 1043 OD2 ASP A 69 7.371 -6.294 11.300 1.00 60.52 O ATOM 0 H ASP A 69 6.566 -6.748 7.588 1.00 22.42 H new ATOM 0 HA ASP A 69 7.696 -8.847 9.322 1.00 71.23 H new ATOM 0 HB2 ASP A 69 4.987 -7.477 9.497 1.00 44.01 H new ATOM 0 HB3 ASP A 69 5.870 -8.291 10.773 1.00 44.01 H new ATOM 1048 N GLU A 70 6.740 -10.457 7.470 1.00 11.42 N ATOM 1049 CA GLU A 70 6.125 -11.626 6.795 1.00 74.54 C ATOM 1050 C GLU A 70 5.516 -12.620 7.816 1.00 53.31 C ATOM 1051 O GLU A 70 4.493 -13.259 7.545 1.00 2.43 O ATOM 1052 CB GLU A 70 7.170 -12.326 5.888 1.00 30.13 C ATOM 1053 CG GLU A 70 6.636 -13.547 5.115 1.00 34.21 C ATOM 1054 CD GLU A 70 7.646 -14.128 4.114 1.00 70.42 C ATOM 1055 OE1 GLU A 70 8.592 -14.804 4.549 1.00 3.22 O ATOM 1056 OE2 GLU A 70 7.513 -13.880 2.893 1.00 73.32 O ATOM 0 H GLU A 70 7.748 -10.383 7.330 1.00 11.42 H new ATOM 0 HA GLU A 70 5.306 -11.267 6.172 1.00 74.54 H new ATOM 0 HB2 GLU A 70 7.554 -11.599 5.172 1.00 30.13 H new ATOM 0 HB3 GLU A 70 8.012 -12.643 6.504 1.00 30.13 H new ATOM 0 HG2 GLU A 70 6.354 -14.323 5.827 1.00 34.21 H new ATOM 0 HG3 GLU A 70 5.730 -13.261 4.580 1.00 34.21 H new ATOM 1063 N SER A 71 6.144 -12.697 9.003 1.00 71.41 N ATOM 1064 CA SER A 71 5.663 -13.522 10.140 1.00 44.53 C ATOM 1065 C SER A 71 4.317 -13.002 10.729 1.00 45.24 C ATOM 1066 O SER A 71 3.651 -13.714 11.481 1.00 24.21 O ATOM 1067 CB SER A 71 6.741 -13.557 11.252 1.00 51.30 C ATOM 1068 OG SER A 71 7.989 -14.016 10.749 1.00 3.41 O ATOM 0 H SER A 71 7.004 -12.188 9.207 1.00 71.41 H new ATOM 0 HA SER A 71 5.482 -14.527 9.758 1.00 44.53 H new ATOM 0 HB2 SER A 71 6.862 -12.560 11.675 1.00 51.30 H new ATOM 0 HB3 SER A 71 6.411 -14.209 12.061 1.00 51.30 H new ATOM 0 HG SER A 71 8.650 -14.026 11.473 1.00 3.41 H new ATOM 1074 N ALA A 72 3.927 -11.754 10.373 1.00 40.23 N ATOM 1075 CA ALA A 72 2.683 -11.103 10.868 1.00 54.01 C ATOM 1076 C ALA A 72 1.789 -10.567 9.714 1.00 13.13 C ATOM 1077 O ALA A 72 0.762 -9.936 9.981 1.00 4.11 O ATOM 1078 CB ALA A 72 3.053 -9.968 11.846 1.00 5.15 C ATOM 0 H ALA A 72 4.464 -11.168 9.734 1.00 40.23 H new ATOM 0 HA ALA A 72 2.094 -11.859 11.387 1.00 54.01 H new ATOM 0 HB1 ALA A 72 2.143 -9.490 12.210 1.00 5.15 H new ATOM 0 HB2 ALA A 72 3.608 -10.380 12.689 1.00 5.15 H new ATOM 0 HB3 ALA A 72 3.669 -9.231 11.331 1.00 5.15 H new ATOM 1084 N ARG A 73 2.184 -10.843 8.447 1.00 50.41 N ATOM 1085 CA ARG A 73 1.502 -10.328 7.223 1.00 5.42 C ATOM 1086 C ARG A 73 1.400 -8.774 7.208 1.00 51.51 C ATOM 1087 O ARG A 73 0.305 -8.193 7.184 1.00 22.32 O ATOM 1088 CB ARG A 73 0.114 -11.005 7.025 1.00 11.44 C ATOM 1089 CG ARG A 73 0.181 -12.512 6.709 1.00 23.13 C ATOM 1090 CD ARG A 73 -1.211 -13.164 6.606 1.00 1.11 C ATOM 1091 NE ARG A 73 -1.113 -14.602 6.307 1.00 3.22 N ATOM 1092 CZ ARG A 73 -1.863 -15.543 6.831 1.00 4.25 C ATOM 1093 NH1 ARG A 73 -2.782 -15.267 7.709 1.00 11.22 N ATOM 1094 NH2 ARG A 73 -1.665 -16.765 6.482 1.00 53.13 N ATOM 0 H ARG A 73 2.990 -11.433 8.239 1.00 50.41 H new ATOM 0 HA ARG A 73 2.126 -10.600 6.371 1.00 5.42 H new ATOM 0 HB2 ARG A 73 -0.479 -10.861 7.928 1.00 11.44 H new ATOM 0 HB3 ARG A 73 -0.411 -10.499 6.215 1.00 11.44 H new ATOM 0 HG2 ARG A 73 0.716 -12.658 5.770 1.00 23.13 H new ATOM 0 HG3 ARG A 73 0.756 -13.016 7.486 1.00 23.13 H new ATOM 0 HD2 ARG A 73 -1.750 -13.022 7.542 1.00 1.11 H new ATOM 0 HD3 ARG A 73 -1.789 -12.668 5.827 1.00 1.11 H new ATOM 0 HE ARG A 73 -0.402 -14.892 5.636 1.00 3.22 H new ATOM 0 HH11 ARG A 73 -2.932 -14.302 8.004 1.00 11.22 H new ATOM 0 HH12 ARG A 73 -3.353 -16.015 8.102 1.00 11.22 H new ATOM 0 HH21 ARG A 73 -0.934 -16.991 5.807 1.00 53.13 H new ATOM 0 HH22 ARG A 73 -2.239 -17.508 6.880 1.00 53.13 H new ATOM 1108 N ARG A 74 2.574 -8.127 7.236 1.00 4.33 N ATOM 1109 CA ARG A 74 2.712 -6.659 7.214 1.00 51.52 C ATOM 1110 C ARG A 74 3.950 -6.245 6.371 1.00 24.51 C ATOM 1111 O ARG A 74 4.945 -6.967 6.313 1.00 15.30 O ATOM 1112 CB ARG A 74 2.808 -6.130 8.671 1.00 60.23 C ATOM 1113 CG ARG A 74 3.044 -4.609 8.802 1.00 55.32 C ATOM 1114 CD ARG A 74 3.123 -4.141 10.260 1.00 34.34 C ATOM 1115 NE ARG A 74 1.872 -4.387 10.989 1.00 52.33 N ATOM 1116 CZ ARG A 74 1.700 -4.222 12.280 1.00 23.22 C ATOM 1117 NH1 ARG A 74 2.667 -3.828 13.051 1.00 62.10 N ATOM 1118 NH2 ARG A 74 0.540 -4.456 12.790 1.00 11.10 N ATOM 0 H ARG A 74 3.469 -8.614 7.275 1.00 4.33 H new ATOM 0 HA ARG A 74 1.835 -6.214 6.743 1.00 51.52 H new ATOM 0 HB2 ARG A 74 1.887 -6.385 9.195 1.00 60.23 H new ATOM 0 HB3 ARG A 74 3.619 -6.653 9.178 1.00 60.23 H new ATOM 0 HG2 ARG A 74 3.969 -4.345 8.290 1.00 55.32 H new ATOM 0 HG3 ARG A 74 2.237 -4.077 8.298 1.00 55.32 H new ATOM 0 HD2 ARG A 74 3.942 -4.657 10.762 1.00 34.34 H new ATOM 0 HD3 ARG A 74 3.354 -3.076 10.286 1.00 34.34 H new ATOM 0 HE ARG A 74 1.071 -4.713 10.448 1.00 52.33 H new ATOM 0 HH11 ARG A 74 3.588 -3.638 12.657 1.00 62.10 H new ATOM 0 HH12 ARG A 74 2.505 -3.708 14.051 1.00 62.10 H new ATOM 0 HH21 ARG A 74 -0.227 -4.764 12.192 1.00 11.10 H new ATOM 0 HH22 ARG A 74 0.389 -4.333 13.791 1.00 11.10 H new ATOM 1132 N LEU A 75 3.857 -5.085 5.703 1.00 44.11 N ATOM 1133 CA LEU A 75 4.892 -4.568 4.775 1.00 41.52 C ATOM 1134 C LEU A 75 5.102 -3.040 5.001 1.00 14.51 C ATOM 1135 O LEU A 75 4.261 -2.241 4.635 1.00 33.40 O ATOM 1136 CB LEU A 75 4.423 -4.905 3.317 1.00 75.33 C ATOM 1137 CG LEU A 75 5.149 -4.205 2.121 1.00 4.50 C ATOM 1138 CD1 LEU A 75 6.661 -4.443 2.146 1.00 62.11 C ATOM 1139 CD2 LEU A 75 4.542 -4.654 0.773 1.00 75.34 C ATOM 0 H LEU A 75 3.051 -4.466 5.789 1.00 44.11 H new ATOM 0 HA LEU A 75 5.860 -5.036 4.954 1.00 41.52 H new ATOM 0 HB2 LEU A 75 4.518 -5.982 3.178 1.00 75.33 H new ATOM 0 HB3 LEU A 75 3.362 -4.667 3.246 1.00 75.33 H new ATOM 0 HG LEU A 75 4.992 -3.132 2.231 1.00 4.50 H new ATOM 0 HD11 LEU A 75 7.123 -3.938 1.297 1.00 62.11 H new ATOM 0 HD12 LEU A 75 7.076 -4.048 3.073 1.00 62.11 H new ATOM 0 HD13 LEU A 75 6.862 -5.513 2.086 1.00 62.11 H new ATOM 0 HD21 LEU A 75 5.062 -4.155 -0.045 1.00 75.34 H new ATOM 0 HD22 LEU A 75 4.650 -5.733 0.667 1.00 75.34 H new ATOM 0 HD23 LEU A 75 3.485 -4.391 0.745 1.00 75.34 H new ATOM 1151 N VAL A 76 6.249 -2.648 5.588 1.00 42.12 N ATOM 1152 CA VAL A 76 6.535 -1.235 5.984 1.00 22.33 C ATOM 1153 C VAL A 76 7.637 -0.614 5.083 1.00 4.34 C ATOM 1154 O VAL A 76 8.730 -1.159 4.952 1.00 31.04 O ATOM 1155 CB VAL A 76 6.985 -1.143 7.493 1.00 71.44 C ATOM 1156 CG1 VAL A 76 7.254 0.328 7.932 1.00 4.23 C ATOM 1157 CG2 VAL A 76 5.949 -1.824 8.424 1.00 14.14 C ATOM 0 H VAL A 76 7.009 -3.293 5.805 1.00 42.12 H new ATOM 0 HA VAL A 76 5.609 -0.674 5.855 1.00 22.33 H new ATOM 0 HB VAL A 76 7.928 -1.682 7.583 1.00 71.44 H new ATOM 0 HG11 VAL A 76 7.561 0.345 8.978 1.00 4.23 H new ATOM 0 HG12 VAL A 76 8.045 0.753 7.314 1.00 4.23 H new ATOM 0 HG13 VAL A 76 6.344 0.916 7.812 1.00 4.23 H new ATOM 0 HG21 VAL A 76 6.283 -1.746 9.459 1.00 14.14 H new ATOM 0 HG22 VAL A 76 4.983 -1.330 8.317 1.00 14.14 H new ATOM 0 HG23 VAL A 76 5.851 -2.875 8.152 1.00 14.14 H new ATOM 1167 N TYR A 77 7.352 0.555 4.500 1.00 44.21 N ATOM 1168 CA TYR A 77 8.265 1.226 3.550 1.00 41.54 C ATOM 1169 C TYR A 77 8.070 2.760 3.532 1.00 73.11 C ATOM 1170 O TYR A 77 7.214 3.303 4.232 1.00 71.43 O ATOM 1171 CB TYR A 77 8.115 0.607 2.130 1.00 71.12 C ATOM 1172 CG TYR A 77 6.677 0.566 1.562 1.00 3.03 C ATOM 1173 CD1 TYR A 77 5.778 -0.441 1.940 1.00 62.13 C ATOM 1174 CD2 TYR A 77 6.228 1.512 0.637 1.00 0.00 C ATOM 1175 CE1 TYR A 77 4.496 -0.495 1.425 1.00 23.34 C ATOM 1176 CE2 TYR A 77 4.947 1.455 0.118 1.00 74.34 C ATOM 1177 CZ TYR A 77 4.085 0.454 0.514 1.00 0.03 C ATOM 1178 OH TYR A 77 2.812 0.395 -0.013 1.00 62.34 O ATOM 0 H TYR A 77 6.486 1.067 4.668 1.00 44.21 H new ATOM 0 HA TYR A 77 9.286 1.055 3.892 1.00 41.54 H new ATOM 0 HB2 TYR A 77 8.742 1.172 1.440 1.00 71.12 H new ATOM 0 HB3 TYR A 77 8.505 -0.411 2.155 1.00 71.12 H new ATOM 0 HD1 TYR A 77 6.094 -1.192 2.649 1.00 62.13 H new ATOM 0 HD2 TYR A 77 6.893 2.302 0.321 1.00 0.00 H new ATOM 0 HE1 TYR A 77 3.819 -1.278 1.735 1.00 23.34 H new ATOM 0 HE2 TYR A 77 4.622 2.195 -0.598 1.00 74.34 H new ATOM 0 HH TYR A 77 2.682 1.138 -0.639 1.00 62.34 H new ATOM 1188 N THR A 78 8.899 3.444 2.727 1.00 72.54 N ATOM 1189 CA THR A 78 8.930 4.928 2.629 1.00 24.21 C ATOM 1190 C THR A 78 9.189 5.373 1.183 1.00 75.24 C ATOM 1191 O THR A 78 9.726 4.602 0.398 1.00 60.01 O ATOM 1192 CB THR A 78 10.066 5.530 3.549 1.00 44.00 C ATOM 1193 OG1 THR A 78 10.103 6.971 3.459 1.00 5.23 O ATOM 1194 CG2 THR A 78 11.466 4.983 3.199 1.00 62.34 C ATOM 0 H THR A 78 9.576 2.986 2.117 1.00 72.54 H new ATOM 0 HA THR A 78 7.958 5.295 2.959 1.00 24.21 H new ATOM 0 HB THR A 78 9.816 5.224 4.565 1.00 44.00 H new ATOM 0 HG1 THR A 78 9.229 7.337 3.708 1.00 5.23 H new ATOM 0 HG21 THR A 78 12.207 5.430 3.861 1.00 62.34 H new ATOM 0 HG22 THR A 78 11.475 3.900 3.323 1.00 62.34 H new ATOM 0 HG23 THR A 78 11.706 5.232 2.165 1.00 62.34 H new ATOM 1202 N MET A 79 8.803 6.614 0.824 1.00 44.11 N ATOM 1203 CA MET A 79 9.316 7.280 -0.401 1.00 73.32 C ATOM 1204 C MET A 79 10.232 8.481 -0.018 1.00 10.51 C ATOM 1205 O MET A 79 9.737 9.558 0.335 1.00 10.13 O ATOM 1206 CB MET A 79 8.165 7.688 -1.382 1.00 45.41 C ATOM 1207 CG MET A 79 6.992 8.472 -0.791 1.00 44.03 C ATOM 1208 SD MET A 79 5.755 8.885 -2.049 1.00 12.40 S ATOM 1209 CE MET A 79 4.442 9.599 -1.065 1.00 12.32 C ATOM 0 H MET A 79 8.141 7.177 1.359 1.00 44.11 H new ATOM 0 HA MET A 79 9.924 6.560 -0.949 1.00 73.32 H new ATOM 0 HB2 MET A 79 8.600 8.283 -2.185 1.00 45.41 H new ATOM 0 HB3 MET A 79 7.770 6.780 -1.837 1.00 45.41 H new ATOM 0 HG2 MET A 79 6.524 7.885 -0.001 1.00 44.03 H new ATOM 0 HG3 MET A 79 7.362 9.388 -0.331 1.00 44.03 H new ATOM 0 HE1 MET A 79 3.479 9.234 -1.423 1.00 12.32 H new ATOM 0 HE2 MET A 79 4.573 9.313 -0.021 1.00 12.32 H new ATOM 0 HE3 MET A 79 4.473 10.685 -1.150 1.00 12.32 H new ATOM 1219 N PRO A 80 11.606 8.292 -0.027 1.00 52.41 N ATOM 1220 CA PRO A 80 12.589 9.398 0.207 1.00 44.13 C ATOM 1221 C PRO A 80 12.508 10.514 -0.876 1.00 52.31 C ATOM 1222 O PRO A 80 12.925 11.656 -0.638 1.00 5.41 O ATOM 1223 CB PRO A 80 13.970 8.669 0.186 1.00 52.23 C ATOM 1224 CG PRO A 80 13.722 7.406 -0.585 1.00 25.13 C ATOM 1225 CD PRO A 80 12.309 6.991 -0.224 1.00 13.45 C ATOM 0 HA PRO A 80 12.399 9.926 1.142 1.00 44.13 H new ATOM 0 HB2 PRO A 80 14.734 9.282 -0.293 1.00 52.23 H new ATOM 0 HB3 PRO A 80 14.320 8.454 1.196 1.00 52.23 H new ATOM 0 HG2 PRO A 80 13.821 7.573 -1.657 1.00 25.13 H new ATOM 0 HG3 PRO A 80 14.441 6.632 -0.315 1.00 25.13 H new ATOM 0 HD2 PRO A 80 11.848 6.401 -1.017 1.00 13.45 H new ATOM 0 HD3 PRO A 80 12.288 6.382 0.680 1.00 13.45 H new ATOM 1233 N ASP A 81 11.970 10.165 -2.065 1.00 53.11 N ATOM 1234 CA ASP A 81 11.685 11.128 -3.151 1.00 53.20 C ATOM 1235 C ASP A 81 10.161 11.146 -3.456 1.00 1.12 C ATOM 1236 O ASP A 81 9.700 10.420 -4.345 1.00 70.45 O ATOM 1237 CB ASP A 81 12.506 10.765 -4.417 1.00 73.42 C ATOM 1238 CG ASP A 81 14.028 10.869 -4.204 1.00 63.30 C ATOM 1239 OD1 ASP A 81 14.612 9.978 -3.547 1.00 42.33 O ATOM 1240 OD2 ASP A 81 14.649 11.844 -4.684 1.00 5.42 O ATOM 0 H ASP A 81 11.720 9.204 -2.299 1.00 53.11 H new ATOM 0 HA ASP A 81 11.981 12.128 -2.833 1.00 53.20 H new ATOM 0 HB2 ASP A 81 12.257 9.749 -4.724 1.00 73.42 H new ATOM 0 HB3 ASP A 81 12.214 11.426 -5.233 1.00 73.42 H new ATOM 1245 N PRO A 82 9.341 11.932 -2.678 1.00 72.41 N ATOM 1246 CA PRO A 82 7.893 12.077 -2.934 1.00 72.11 C ATOM 1247 C PRO A 82 7.551 13.289 -3.864 1.00 64.41 C ATOM 1248 O PRO A 82 8.216 14.330 -3.808 1.00 25.53 O ATOM 1249 CB PRO A 82 7.342 12.281 -1.503 1.00 73.31 C ATOM 1250 CG PRO A 82 8.421 13.044 -0.777 1.00 24.11 C ATOM 1251 CD PRO A 82 9.743 12.708 -1.467 1.00 53.35 C ATOM 0 HA PRO A 82 7.466 11.226 -3.465 1.00 72.11 H new ATOM 0 HB2 PRO A 82 6.405 12.838 -1.516 1.00 73.31 H new ATOM 0 HB3 PRO A 82 7.139 11.326 -1.018 1.00 73.31 H new ATOM 0 HG2 PRO A 82 8.228 14.116 -0.814 1.00 24.11 H new ATOM 0 HG3 PRO A 82 8.452 12.762 0.275 1.00 24.11 H new ATOM 0 HD2 PRO A 82 10.291 13.611 -1.737 1.00 53.35 H new ATOM 0 HD3 PRO A 82 10.393 12.122 -0.817 1.00 53.35 H new ATOM 1259 N PRO A 83 6.508 13.168 -4.756 1.00 21.21 N ATOM 1260 CA PRO A 83 5.995 14.314 -5.549 1.00 42.33 C ATOM 1261 C PRO A 83 4.929 15.157 -4.780 1.00 13.41 C ATOM 1262 O PRO A 83 4.366 16.104 -5.330 1.00 44.41 O ATOM 1263 CB PRO A 83 5.397 13.609 -6.789 1.00 33.01 C ATOM 1264 CG PRO A 83 4.878 12.297 -6.263 1.00 62.20 C ATOM 1265 CD PRO A 83 5.786 11.908 -5.097 1.00 11.44 C ATOM 0 HA PRO A 83 6.766 15.046 -5.788 1.00 42.33 H new ATOM 0 HB2 PRO A 83 4.598 14.201 -7.236 1.00 33.01 H new ATOM 0 HB3 PRO A 83 6.151 13.457 -7.561 1.00 33.01 H new ATOM 0 HG2 PRO A 83 3.843 12.393 -5.934 1.00 62.20 H new ATOM 0 HG3 PRO A 83 4.896 11.533 -7.040 1.00 62.20 H new ATOM 0 HD2 PRO A 83 5.209 11.538 -4.249 1.00 11.44 H new ATOM 0 HD3 PRO A 83 6.480 11.116 -5.380 1.00 11.44 H new ATOM 1273 N PHE A 84 4.686 14.809 -3.495 1.00 64.50 N ATOM 1274 CA PHE A 84 3.671 15.470 -2.630 1.00 52.42 C ATOM 1275 C PHE A 84 4.346 16.403 -1.582 1.00 11.40 C ATOM 1276 O PHE A 84 5.509 16.173 -1.223 1.00 44.41 O ATOM 1277 CB PHE A 84 2.820 14.377 -1.923 1.00 3.34 C ATOM 1278 CG PHE A 84 2.123 13.425 -2.895 1.00 33.01 C ATOM 1279 CD1 PHE A 84 1.022 13.847 -3.641 1.00 61.21 C ATOM 1280 CD2 PHE A 84 2.577 12.117 -3.075 1.00 53.31 C ATOM 1281 CE1 PHE A 84 0.402 12.991 -4.536 1.00 2.42 C ATOM 1282 CE2 PHE A 84 1.955 11.264 -3.967 1.00 34.52 C ATOM 1283 CZ PHE A 84 0.869 11.700 -4.698 1.00 40.42 C ATOM 0 H PHE A 84 5.189 14.058 -3.023 1.00 64.50 H new ATOM 0 HA PHE A 84 3.026 16.092 -3.251 1.00 52.42 H new ATOM 0 HB2 PHE A 84 3.463 13.799 -1.259 1.00 3.34 H new ATOM 0 HB3 PHE A 84 2.069 14.860 -1.298 1.00 3.34 H new ATOM 0 HD1 PHE A 84 0.649 14.853 -3.519 1.00 61.21 H new ATOM 0 HD2 PHE A 84 3.427 11.766 -2.509 1.00 53.31 H new ATOM 0 HE1 PHE A 84 -0.448 13.333 -5.108 1.00 2.42 H new ATOM 0 HE2 PHE A 84 2.319 10.255 -4.092 1.00 34.52 H new ATOM 0 HZ PHE A 84 0.384 11.033 -5.396 1.00 40.42 H new ATOM 1293 N PRO A 85 3.631 17.483 -1.082 1.00 43.41 N ATOM 1294 CA PRO A 85 4.182 18.428 -0.060 1.00 41.21 C ATOM 1295 C PRO A 85 4.265 17.806 1.367 1.00 73.42 C ATOM 1296 O PRO A 85 3.481 18.151 2.262 1.00 42.35 O ATOM 1297 CB PRO A 85 3.196 19.646 -0.107 1.00 52.03 C ATOM 1298 CG PRO A 85 2.307 19.400 -1.296 1.00 15.14 C ATOM 1299 CD PRO A 85 2.261 17.899 -1.481 1.00 30.41 C ATOM 0 HA PRO A 85 5.213 18.705 -0.281 1.00 41.21 H new ATOM 0 HB2 PRO A 85 2.613 19.714 0.811 1.00 52.03 H new ATOM 0 HB3 PRO A 85 3.738 20.586 -0.211 1.00 52.03 H new ATOM 0 HG2 PRO A 85 1.308 19.803 -1.126 1.00 15.14 H new ATOM 0 HG3 PRO A 85 2.701 19.891 -2.186 1.00 15.14 H new ATOM 0 HD2 PRO A 85 1.498 17.436 -0.855 1.00 30.41 H new ATOM 0 HD3 PRO A 85 2.038 17.624 -2.512 1.00 30.41 H new ATOM 1307 N ILE A 86 5.214 16.866 1.553 1.00 13.13 N ATOM 1308 CA ILE A 86 5.386 16.085 2.811 1.00 53.44 C ATOM 1309 C ILE A 86 6.891 15.918 3.150 1.00 14.31 C ATOM 1310 O ILE A 86 7.740 15.957 2.250 1.00 61.31 O ATOM 1311 CB ILE A 86 4.706 14.660 2.696 1.00 4.34 C ATOM 1312 CG1 ILE A 86 5.345 13.815 1.550 1.00 3.42 C ATOM 1313 CG2 ILE A 86 3.178 14.781 2.494 1.00 63.33 C ATOM 1314 CD1 ILE A 86 4.707 12.456 1.321 1.00 73.14 C ATOM 0 H ILE A 86 5.892 16.620 0.832 1.00 13.13 H new ATOM 0 HA ILE A 86 4.898 16.640 3.612 1.00 53.44 H new ATOM 0 HB ILE A 86 4.884 14.141 3.638 1.00 4.34 H new ATOM 0 HG12 ILE A 86 5.289 14.386 0.623 1.00 3.42 H new ATOM 0 HG13 ILE A 86 6.402 13.670 1.772 1.00 3.42 H new ATOM 0 HG21 ILE A 86 2.741 13.785 2.419 1.00 63.33 H new ATOM 0 HG22 ILE A 86 2.739 15.307 3.342 1.00 63.33 H new ATOM 0 HG23 ILE A 86 2.975 15.337 1.578 1.00 63.33 H new ATOM 0 HD11 ILE A 86 5.220 11.946 0.506 1.00 73.14 H new ATOM 0 HD12 ILE A 86 4.786 11.859 2.230 1.00 73.14 H new ATOM 0 HD13 ILE A 86 3.656 12.586 1.063 1.00 73.14 H new ATOM 1326 N THR A 87 7.226 15.737 4.450 1.00 53.44 N ATOM 1327 CA THR A 87 8.636 15.504 4.887 1.00 50.14 C ATOM 1328 C THR A 87 8.928 13.986 5.028 1.00 41.33 C ATOM 1329 O THR A 87 9.317 13.349 4.038 1.00 4.12 O ATOM 1330 CB THR A 87 8.987 16.282 6.206 1.00 51.04 C ATOM 1331 OG1 THR A 87 8.564 17.650 6.095 1.00 31.44 O ATOM 1332 CG2 THR A 87 10.499 16.244 6.522 1.00 4.24 C ATOM 0 H THR A 87 6.550 15.747 5.214 1.00 53.44 H new ATOM 0 HA THR A 87 9.286 15.903 4.108 1.00 50.14 H new ATOM 0 HB THR A 87 8.460 15.787 7.021 1.00 51.04 H new ATOM 0 HG1 THR A 87 7.904 17.846 6.792 1.00 31.44 H new ATOM 0 HG21 THR A 87 10.692 16.795 7.442 1.00 4.24 H new ATOM 0 HG22 THR A 87 10.819 15.209 6.644 1.00 4.24 H new ATOM 0 HG23 THR A 87 11.054 16.701 5.702 1.00 4.24 H new ATOM 1340 N ASN A 88 8.739 13.383 6.233 1.00 45.44 N ATOM 1341 CA ASN A 88 8.914 11.923 6.388 1.00 22.44 C ATOM 1342 C ASN A 88 7.602 11.199 6.009 1.00 15.31 C ATOM 1343 O ASN A 88 6.536 11.509 6.538 1.00 3.02 O ATOM 1344 CB ASN A 88 9.410 11.520 7.819 1.00 71.53 C ATOM 1345 CG ASN A 88 8.365 11.531 8.951 1.00 24.24 C ATOM 1346 OD1 ASN A 88 8.388 10.678 9.828 1.00 12.34 O ATOM 1347 ND2 ASN A 88 7.466 12.493 8.966 1.00 74.23 N ATOM 0 H ASN A 88 8.473 13.874 7.086 1.00 45.44 H new ATOM 0 HA ASN A 88 9.703 11.606 5.706 1.00 22.44 H new ATOM 0 HB2 ASN A 88 9.835 10.518 7.760 1.00 71.53 H new ATOM 0 HB3 ASN A 88 10.220 12.194 8.099 1.00 71.53 H new ATOM 0 HD21 ASN A 88 6.776 12.534 9.716 1.00 74.23 H new ATOM 0 HD22 ASN A 88 7.460 13.197 8.228 1.00 74.23 H new ATOM 1354 N HIS A 89 7.676 10.296 5.022 1.00 31.32 N ATOM 1355 CA HIS A 89 6.528 9.457 4.606 1.00 30.45 C ATOM 1356 C HIS A 89 6.718 7.977 5.014 1.00 24.53 C ATOM 1357 O HIS A 89 7.684 7.340 4.632 1.00 1.34 O ATOM 1358 CB HIS A 89 6.322 9.556 3.079 1.00 74.43 C ATOM 1359 CG HIS A 89 5.185 8.703 2.573 1.00 74.13 C ATOM 1360 ND1 HIS A 89 5.422 7.498 1.961 1.00 64.41 N ATOM 1361 CD2 HIS A 89 3.847 8.911 2.630 1.00 3.33 C ATOM 1362 CE1 HIS A 89 4.241 7.006 1.658 1.00 13.11 C ATOM 1363 NE2 HIS A 89 3.255 7.825 2.044 1.00 23.41 N ATOM 0 H HIS A 89 8.527 10.122 4.487 1.00 31.32 H new ATOM 0 HA HIS A 89 5.644 9.834 5.120 1.00 30.45 H new ATOM 0 HB2 HIS A 89 6.134 10.596 2.812 1.00 74.43 H new ATOM 0 HB3 HIS A 89 7.242 9.259 2.575 1.00 74.43 H new ATOM 0 HD1 HIS A 89 6.330 7.071 1.778 1.00 64.41 H new ATOM 0 HD2 HIS A 89 3.345 9.768 3.055 1.00 3.33 H new ATOM 0 HE1 HIS A 89 4.086 6.060 1.160 1.00 13.11 H new ATOM 1371 N ARG A 90 5.781 7.454 5.814 1.00 51.05 N ATOM 1372 CA ARG A 90 5.639 6.005 6.099 1.00 13.13 C ATOM 1373 C ARG A 90 4.433 5.445 5.302 1.00 61.02 C ATOM 1374 O ARG A 90 3.440 6.144 5.098 1.00 33.21 O ATOM 1375 CB ARG A 90 5.441 5.745 7.634 1.00 43.13 C ATOM 1376 CG ARG A 90 6.723 5.499 8.478 1.00 65.44 C ATOM 1377 CD ARG A 90 7.655 6.725 8.631 1.00 35.20 C ATOM 1378 NE ARG A 90 8.479 6.985 7.432 1.00 34.20 N ATOM 1379 CZ ARG A 90 9.559 7.739 7.393 1.00 43.42 C ATOM 1380 NH1 ARG A 90 10.057 8.271 8.466 1.00 32.34 N ATOM 1381 NH2 ARG A 90 10.139 7.949 6.259 1.00 32.22 N ATOM 0 H ARG A 90 5.086 8.027 6.293 1.00 51.05 H new ATOM 0 HA ARG A 90 6.553 5.497 5.792 1.00 13.13 H new ATOM 0 HB2 ARG A 90 4.915 6.601 8.058 1.00 43.13 H new ATOM 0 HB3 ARG A 90 4.788 4.880 7.750 1.00 43.13 H new ATOM 0 HG2 ARG A 90 6.426 5.162 9.471 1.00 65.44 H new ATOM 0 HG3 ARG A 90 7.289 4.687 8.022 1.00 65.44 H new ATOM 0 HD2 ARG A 90 7.052 7.607 8.847 1.00 35.20 H new ATOM 0 HD3 ARG A 90 8.311 6.570 9.488 1.00 35.20 H new ATOM 0 HE ARG A 90 8.187 6.543 6.560 1.00 34.20 H new ATOM 0 HH11 ARG A 90 9.611 8.110 9.369 1.00 32.34 H new ATOM 0 HH12 ARG A 90 10.894 8.851 8.407 1.00 32.34 H new ATOM 0 HH21 ARG A 90 9.761 7.533 5.408 1.00 32.22 H new ATOM 0 HH22 ARG A 90 10.976 8.531 6.214 1.00 32.22 H new ATOM 1395 N ALA A 91 4.535 4.184 4.869 1.00 53.11 N ATOM 1396 CA ALA A 91 3.444 3.457 4.182 1.00 52.34 C ATOM 1397 C ALA A 91 3.490 1.968 4.565 1.00 23.32 C ATOM 1398 O ALA A 91 4.551 1.347 4.528 1.00 24.04 O ATOM 1399 CB ALA A 91 3.554 3.632 2.659 1.00 73.53 C ATOM 0 H ALA A 91 5.382 3.628 4.983 1.00 53.11 H new ATOM 0 HA ALA A 91 2.487 3.871 4.499 1.00 52.34 H new ATOM 0 HB1 ALA A 91 2.744 3.090 2.171 1.00 73.53 H new ATOM 0 HB2 ALA A 91 3.486 4.691 2.409 1.00 73.53 H new ATOM 0 HB3 ALA A 91 4.511 3.239 2.316 1.00 73.53 H new ATOM 1405 N VAL A 92 2.334 1.399 4.930 1.00 2.24 N ATOM 1406 CA VAL A 92 2.240 0.020 5.437 1.00 33.22 C ATOM 1407 C VAL A 92 1.083 -0.772 4.771 1.00 12.44 C ATOM 1408 O VAL A 92 -0.051 -0.303 4.699 1.00 52.24 O ATOM 1409 CB VAL A 92 2.124 0.018 7.012 1.00 33.22 C ATOM 1410 CG1 VAL A 92 1.001 0.951 7.528 1.00 42.40 C ATOM 1411 CG2 VAL A 92 1.972 -1.413 7.576 1.00 15.15 C ATOM 0 H VAL A 92 1.436 1.880 4.883 1.00 2.24 H new ATOM 0 HA VAL A 92 3.160 -0.498 5.164 1.00 33.22 H new ATOM 0 HB VAL A 92 3.064 0.422 7.387 1.00 33.22 H new ATOM 0 HG11 VAL A 92 0.966 0.911 8.617 1.00 42.40 H new ATOM 0 HG12 VAL A 92 1.202 1.974 7.209 1.00 42.40 H new ATOM 0 HG13 VAL A 92 0.043 0.626 7.122 1.00 42.40 H new ATOM 0 HG21 VAL A 92 1.895 -1.370 8.662 1.00 15.15 H new ATOM 0 HG22 VAL A 92 1.072 -1.872 7.167 1.00 15.15 H new ATOM 0 HG23 VAL A 92 2.841 -2.008 7.297 1.00 15.15 H new ATOM 1421 N LEU A 93 1.416 -1.981 4.278 1.00 75.13 N ATOM 1422 CA LEU A 93 0.479 -2.931 3.646 1.00 62.02 C ATOM 1423 C LEU A 93 0.201 -4.087 4.640 1.00 42.42 C ATOM 1424 O LEU A 93 1.137 -4.739 5.091 1.00 40.10 O ATOM 1425 CB LEU A 93 1.098 -3.522 2.312 1.00 65.34 C ATOM 1426 CG LEU A 93 0.270 -3.366 0.994 1.00 51.24 C ATOM 1427 CD1 LEU A 93 -1.205 -3.758 1.191 1.00 55.12 C ATOM 1428 CD2 LEU A 93 0.425 -1.956 0.404 1.00 2.42 C ATOM 0 H LEU A 93 2.372 -2.334 4.309 1.00 75.13 H new ATOM 0 HA LEU A 93 -0.446 -2.411 3.397 1.00 62.02 H new ATOM 0 HB2 LEU A 93 2.069 -3.052 2.156 1.00 65.34 H new ATOM 0 HB3 LEU A 93 1.281 -4.585 2.469 1.00 65.34 H new ATOM 0 HG LEU A 93 0.678 -4.066 0.265 1.00 51.24 H new ATOM 0 HD11 LEU A 93 -1.743 -3.635 0.251 1.00 55.12 H new ATOM 0 HD12 LEU A 93 -1.265 -4.799 1.510 1.00 55.12 H new ATOM 0 HD13 LEU A 93 -1.653 -3.119 1.952 1.00 55.12 H new ATOM 0 HD21 LEU A 93 -0.162 -1.878 -0.511 1.00 2.42 H new ATOM 0 HD22 LEU A 93 0.072 -1.219 1.125 1.00 2.42 H new ATOM 0 HD23 LEU A 93 1.475 -1.769 0.179 1.00 2.42 H new ATOM 1440 N GLU A 94 -1.067 -4.337 4.978 1.00 0.21 N ATOM 1441 CA GLU A 94 -1.468 -5.482 5.834 1.00 65.04 C ATOM 1442 C GLU A 94 -2.597 -6.282 5.168 1.00 23.32 C ATOM 1443 O GLU A 94 -3.407 -5.716 4.429 1.00 20.14 O ATOM 1444 CB GLU A 94 -1.932 -5.002 7.243 1.00 53.31 C ATOM 1445 CG GLU A 94 -0.847 -4.295 8.075 1.00 72.24 C ATOM 1446 CD GLU A 94 -1.296 -3.999 9.512 1.00 14.11 C ATOM 1447 OE1 GLU A 94 -1.870 -2.919 9.767 1.00 21.54 O ATOM 1448 OE2 GLU A 94 -1.088 -4.858 10.396 1.00 14.41 O ATOM 0 H GLU A 94 -1.850 -3.760 4.672 1.00 0.21 H new ATOM 0 HA GLU A 94 -0.594 -6.122 5.956 1.00 65.04 H new ATOM 0 HB2 GLU A 94 -2.776 -4.323 7.120 1.00 53.31 H new ATOM 0 HB3 GLU A 94 -2.295 -5.864 7.803 1.00 53.31 H new ATOM 0 HG2 GLU A 94 0.048 -4.917 8.100 1.00 72.24 H new ATOM 0 HG3 GLU A 94 -0.572 -3.361 7.586 1.00 72.24 H new ATOM 1455 N VAL A 95 -2.645 -7.602 5.425 1.00 63.44 N ATOM 1456 CA VAL A 95 -3.786 -8.459 5.036 1.00 41.04 C ATOM 1457 C VAL A 95 -4.314 -9.207 6.280 1.00 20.51 C ATOM 1458 O VAL A 95 -3.663 -10.104 6.827 1.00 11.32 O ATOM 1459 CB VAL A 95 -3.424 -9.455 3.863 1.00 5.30 C ATOM 1460 CG1 VAL A 95 -3.259 -8.682 2.538 1.00 60.23 C ATOM 1461 CG2 VAL A 95 -2.154 -10.281 4.162 1.00 65.14 C ATOM 0 H VAL A 95 -1.899 -8.105 5.906 1.00 63.44 H new ATOM 0 HA VAL A 95 -4.576 -7.818 4.645 1.00 41.04 H new ATOM 0 HB VAL A 95 -4.251 -10.159 3.772 1.00 5.30 H new ATOM 0 HG11 VAL A 95 -3.010 -9.380 1.738 1.00 60.23 H new ATOM 0 HG12 VAL A 95 -4.191 -8.171 2.296 1.00 60.23 H new ATOM 0 HG13 VAL A 95 -2.459 -7.949 2.642 1.00 60.23 H new ATOM 0 HG21 VAL A 95 -1.949 -10.949 3.325 1.00 65.14 H new ATOM 0 HG22 VAL A 95 -1.308 -9.609 4.305 1.00 65.14 H new ATOM 0 HG23 VAL A 95 -2.307 -10.869 5.067 1.00 65.14 H new ATOM 1471 N VAL A 96 -5.511 -8.807 6.721 1.00 24.41 N ATOM 1472 CA VAL A 96 -6.141 -9.303 7.950 1.00 15.23 C ATOM 1473 C VAL A 96 -6.846 -10.652 7.690 1.00 61.32 C ATOM 1474 O VAL A 96 -7.667 -10.743 6.767 1.00 24.01 O ATOM 1475 CB VAL A 96 -7.183 -8.252 8.497 1.00 33.45 C ATOM 1476 CG1 VAL A 96 -7.932 -8.761 9.761 1.00 41.41 C ATOM 1477 CG2 VAL A 96 -6.501 -6.885 8.765 1.00 40.13 C ATOM 0 H VAL A 96 -6.079 -8.119 6.227 1.00 24.41 H new ATOM 0 HA VAL A 96 -5.361 -9.451 8.697 1.00 15.23 H new ATOM 0 HB VAL A 96 -7.935 -8.116 7.720 1.00 33.45 H new ATOM 0 HG11 VAL A 96 -8.637 -8.001 10.097 1.00 41.41 H new ATOM 0 HG12 VAL A 96 -8.473 -9.676 9.520 1.00 41.41 H new ATOM 0 HG13 VAL A 96 -7.212 -8.964 10.554 1.00 41.41 H new ATOM 0 HG21 VAL A 96 -7.240 -6.177 9.141 1.00 40.13 H new ATOM 0 HG22 VAL A 96 -5.710 -7.012 9.504 1.00 40.13 H new ATOM 0 HG23 VAL A 96 -6.073 -6.504 7.838 1.00 40.13 H new ATOM 1487 N PRO A 97 -6.526 -11.729 8.479 1.00 65.30 N ATOM 1488 CA PRO A 97 -7.285 -13.005 8.442 1.00 64.42 C ATOM 1489 C PRO A 97 -8.698 -12.857 9.068 1.00 72.10 C ATOM 1490 O PRO A 97 -8.964 -13.328 10.184 1.00 12.32 O ATOM 1491 CB PRO A 97 -6.380 -14.003 9.238 1.00 51.35 C ATOM 1492 CG PRO A 97 -5.063 -13.290 9.406 1.00 13.12 C ATOM 1493 CD PRO A 97 -5.390 -11.817 9.433 1.00 50.42 C ATOM 0 HA PRO A 97 -7.479 -13.349 7.426 1.00 64.42 H new ATOM 0 HB2 PRO A 97 -6.820 -14.250 10.204 1.00 51.35 H new ATOM 0 HB3 PRO A 97 -6.255 -14.940 8.696 1.00 51.35 H new ATOM 0 HG2 PRO A 97 -4.568 -13.597 10.327 1.00 13.12 H new ATOM 0 HG3 PRO A 97 -4.385 -13.524 8.586 1.00 13.12 H new ATOM 0 HD2 PRO A 97 -5.670 -11.481 10.431 1.00 50.42 H new ATOM 0 HD3 PRO A 97 -4.544 -11.207 9.116 1.00 50.42 H new ATOM 1501 N ARG A 98 -9.592 -12.167 8.335 1.00 11.33 N ATOM 1502 CA ARG A 98 -10.982 -11.900 8.771 1.00 5.53 C ATOM 1503 C ARG A 98 -11.814 -13.210 8.725 1.00 34.41 C ATOM 1504 O ARG A 98 -12.686 -13.449 9.564 1.00 14.14 O ATOM 1505 CB ARG A 98 -11.609 -10.808 7.846 1.00 24.12 C ATOM 1506 CG ARG A 98 -12.863 -10.104 8.419 1.00 21.22 C ATOM 1507 CD ARG A 98 -13.479 -9.076 7.439 1.00 2.41 C ATOM 1508 NE ARG A 98 -14.402 -8.139 8.116 1.00 11.32 N ATOM 1509 CZ ARG A 98 -15.556 -7.710 7.646 1.00 52.42 C ATOM 1510 NH1 ARG A 98 -16.069 -8.190 6.556 1.00 52.00 N ATOM 1511 NH2 ARG A 98 -16.212 -6.812 8.299 1.00 24.00 N ATOM 0 H ARG A 98 -9.372 -11.776 7.419 1.00 11.33 H new ATOM 0 HA ARG A 98 -10.984 -11.535 9.798 1.00 5.53 H new ATOM 0 HB2 ARG A 98 -10.851 -10.053 7.636 1.00 24.12 H new ATOM 0 HB3 ARG A 98 -11.873 -11.268 6.894 1.00 24.12 H new ATOM 0 HG2 ARG A 98 -13.613 -10.855 8.668 1.00 21.22 H new ATOM 0 HG3 ARG A 98 -12.597 -9.599 9.348 1.00 21.22 H new ATOM 0 HD2 ARG A 98 -12.680 -8.512 6.958 1.00 2.41 H new ATOM 0 HD3 ARG A 98 -14.015 -9.605 6.651 1.00 2.41 H new ATOM 0 HE ARG A 98 -14.119 -7.792 9.033 1.00 11.32 H new ATOM 0 HH11 ARG A 98 -15.577 -8.919 6.039 1.00 52.00 H new ATOM 0 HH12 ARG A 98 -16.964 -7.839 6.216 1.00 52.00 H new ATOM 0 HH21 ARG A 98 -15.837 -6.440 9.171 1.00 24.00 H new ATOM 0 HH22 ARG A 98 -17.106 -6.474 7.943 1.00 24.00 H new ATOM 1525 N ASP A 99 -11.497 -14.043 7.722 1.00 5.13 N ATOM 1526 CA ASP A 99 -12.112 -15.368 7.488 1.00 22.30 C ATOM 1527 C ASP A 99 -11.207 -16.171 6.509 1.00 54.11 C ATOM 1528 O ASP A 99 -10.361 -15.583 5.821 1.00 74.21 O ATOM 1529 CB ASP A 99 -13.549 -15.174 6.923 1.00 11.41 C ATOM 1530 CG ASP A 99 -14.335 -16.478 6.752 1.00 61.42 C ATOM 1531 OD1 ASP A 99 -14.857 -17.004 7.751 1.00 4.53 O ATOM 1532 OD2 ASP A 99 -14.425 -16.986 5.620 1.00 21.23 O ATOM 0 H ASP A 99 -10.786 -13.811 7.029 1.00 5.13 H new ATOM 0 HA ASP A 99 -12.194 -15.930 8.418 1.00 22.30 H new ATOM 0 HB2 ASP A 99 -14.103 -14.513 7.589 1.00 11.41 H new ATOM 0 HB3 ASP A 99 -13.484 -14.672 5.957 1.00 11.41 H new ATOM 1537 N ASP A 100 -11.383 -17.503 6.429 1.00 21.10 N ATOM 1538 CA ASP A 100 -10.605 -18.361 5.489 1.00 51.13 C ATOM 1539 C ASP A 100 -11.019 -18.134 4.005 1.00 4.11 C ATOM 1540 O ASP A 100 -10.391 -18.672 3.093 1.00 14.40 O ATOM 1541 CB ASP A 100 -10.745 -19.857 5.877 1.00 55.03 C ATOM 1542 CG ASP A 100 -12.204 -20.349 5.916 1.00 62.24 C ATOM 1543 OD1 ASP A 100 -12.889 -20.097 6.928 1.00 64.23 O ATOM 1544 OD2 ASP A 100 -12.666 -21.004 4.952 1.00 14.14 O ATOM 0 H ASP A 100 -12.054 -18.017 7.000 1.00 21.10 H new ATOM 0 HA ASP A 100 -9.558 -18.071 5.576 1.00 51.13 H new ATOM 0 HB2 ASP A 100 -10.185 -20.463 5.165 1.00 55.03 H new ATOM 0 HB3 ASP A 100 -10.291 -20.014 6.855 1.00 55.03 H new ATOM 1549 N ARG A 101 -12.100 -17.363 3.790 1.00 33.23 N ATOM 1550 CA ARG A 101 -12.619 -16.997 2.446 1.00 25.11 C ATOM 1551 C ARG A 101 -12.766 -15.469 2.281 1.00 44.51 C ATOM 1552 O ARG A 101 -13.142 -15.004 1.202 1.00 14.43 O ATOM 1553 CB ARG A 101 -13.985 -17.703 2.220 1.00 30.53 C ATOM 1554 CG ARG A 101 -13.904 -19.236 2.363 1.00 62.42 C ATOM 1555 CD ARG A 101 -15.263 -19.946 2.369 1.00 65.35 C ATOM 1556 NE ARG A 101 -15.110 -21.384 2.670 1.00 24.23 N ATOM 1557 CZ ARG A 101 -15.931 -22.341 2.294 1.00 22.03 C ATOM 1558 NH1 ARG A 101 -16.978 -22.076 1.569 1.00 44.22 N ATOM 1559 NH2 ARG A 101 -15.688 -23.559 2.654 1.00 43.21 N ATOM 0 H ARG A 101 -12.651 -16.967 4.552 1.00 33.23 H new ATOM 0 HA ARG A 101 -11.901 -17.329 1.697 1.00 25.11 H new ATOM 0 HB2 ARG A 101 -14.710 -17.315 2.935 1.00 30.53 H new ATOM 0 HB3 ARG A 101 -14.355 -17.456 1.225 1.00 30.53 H new ATOM 0 HG2 ARG A 101 -13.304 -19.634 1.544 1.00 62.42 H new ATOM 0 HG3 ARG A 101 -13.379 -19.475 3.288 1.00 62.42 H new ATOM 0 HD2 ARG A 101 -15.915 -19.484 3.110 1.00 65.35 H new ATOM 0 HD3 ARG A 101 -15.745 -19.824 1.399 1.00 65.35 H new ATOM 0 HE ARG A 101 -14.295 -21.660 3.218 1.00 24.23 H new ATOM 0 HH11 ARG A 101 -17.172 -21.116 1.284 1.00 44.22 H new ATOM 0 HH12 ARG A 101 -17.605 -22.828 1.285 1.00 44.22 H new ATOM 0 HH21 ARG A 101 -14.868 -23.769 3.223 1.00 43.21 H new ATOM 0 HH22 ARG A 101 -16.317 -24.310 2.369 1.00 43.21 H new ATOM 1573 N HIS A 102 -12.478 -14.692 3.347 1.00 33.03 N ATOM 1574 CA HIS A 102 -12.545 -13.206 3.321 1.00 43.02 C ATOM 1575 C HIS A 102 -11.308 -12.597 4.021 1.00 51.05 C ATOM 1576 O HIS A 102 -11.014 -12.925 5.168 1.00 40.44 O ATOM 1577 CB HIS A 102 -13.840 -12.679 4.006 1.00 2.23 C ATOM 1578 CG HIS A 102 -15.132 -13.010 3.291 1.00 2.20 C ATOM 1579 ND1 HIS A 102 -16.323 -13.220 3.948 1.00 53.14 N ATOM 1580 CD2 HIS A 102 -15.427 -13.102 1.971 1.00 14.21 C ATOM 1581 CE1 HIS A 102 -17.285 -13.420 3.074 1.00 73.43 C ATOM 1582 NE2 HIS A 102 -16.769 -13.352 1.866 1.00 44.32 N ATOM 0 H HIS A 102 -12.193 -15.071 4.250 1.00 33.03 H new ATOM 0 HA HIS A 102 -12.560 -12.900 2.275 1.00 43.02 H new ATOM 0 HB2 HIS A 102 -13.888 -13.086 5.016 1.00 2.23 H new ATOM 0 HB3 HIS A 102 -13.765 -11.596 4.103 1.00 2.23 H new ATOM 0 HD2 HIS A 102 -14.731 -12.997 1.152 1.00 14.21 H new ATOM 0 HE1 HIS A 102 -18.322 -13.608 3.308 1.00 73.43 H new ATOM 0 HE2 HIS A 102 -17.285 -13.467 0.993 1.00 44.32 H new ATOM 1591 N CYS A 103 -10.610 -11.681 3.335 1.00 35.04 N ATOM 1592 CA CYS A 103 -9.411 -10.996 3.871 1.00 45.02 C ATOM 1593 C CYS A 103 -9.537 -9.479 3.691 1.00 2.34 C ATOM 1594 O CYS A 103 -9.909 -9.014 2.615 1.00 13.23 O ATOM 1595 CB CYS A 103 -8.141 -11.491 3.153 1.00 10.33 C ATOM 1596 SG CYS A 103 -6.631 -10.621 3.640 1.00 14.32 S ATOM 0 H CYS A 103 -10.857 -11.389 2.389 1.00 35.04 H new ATOM 0 HA CYS A 103 -9.335 -11.227 4.933 1.00 45.02 H new ATOM 0 HB2 CYS A 103 -8.015 -12.555 3.353 1.00 10.33 H new ATOM 0 HB3 CYS A 103 -8.279 -11.383 2.077 1.00 10.33 H new ATOM 0 HG CYS A 103 -6.630 -10.441 4.927 1.00 14.32 H new ATOM 1602 N THR A 104 -9.221 -8.702 4.739 1.00 33.35 N ATOM 1603 CA THR A 104 -9.269 -7.227 4.666 1.00 21.04 C ATOM 1604 C THR A 104 -7.863 -6.660 4.409 1.00 42.25 C ATOM 1605 O THR A 104 -6.996 -6.726 5.282 1.00 71.34 O ATOM 1606 CB THR A 104 -9.868 -6.581 5.959 1.00 42.11 C ATOM 1607 OG1 THR A 104 -11.188 -7.093 6.189 1.00 42.43 O ATOM 1608 CG2 THR A 104 -9.934 -5.042 5.859 1.00 31.52 C ATOM 0 H THR A 104 -8.930 -9.066 5.646 1.00 33.35 H new ATOM 0 HA THR A 104 -9.929 -6.973 3.837 1.00 21.04 H new ATOM 0 HB THR A 104 -9.210 -6.839 6.788 1.00 42.11 H new ATOM 0 HG1 THR A 104 -11.847 -6.492 5.783 1.00 42.43 H new ATOM 0 HG21 THR A 104 -10.356 -4.635 6.778 1.00 31.52 H new ATOM 0 HG22 THR A 104 -8.930 -4.643 5.713 1.00 31.52 H new ATOM 0 HG23 THR A 104 -10.563 -4.759 5.015 1.00 31.52 H new ATOM 1616 N VAL A 105 -7.643 -6.085 3.215 1.00 33.23 N ATOM 1617 CA VAL A 105 -6.345 -5.485 2.854 1.00 22.34 C ATOM 1618 C VAL A 105 -6.314 -4.021 3.340 1.00 51.52 C ATOM 1619 O VAL A 105 -6.990 -3.151 2.778 1.00 62.03 O ATOM 1620 CB VAL A 105 -6.076 -5.557 1.309 1.00 70.32 C ATOM 1621 CG1 VAL A 105 -4.651 -5.058 0.951 1.00 2.51 C ATOM 1622 CG2 VAL A 105 -6.310 -6.989 0.779 1.00 44.53 C ATOM 0 H VAL A 105 -8.348 -6.022 2.481 1.00 33.23 H new ATOM 0 HA VAL A 105 -5.554 -6.055 3.341 1.00 22.34 H new ATOM 0 HB VAL A 105 -6.786 -4.890 0.820 1.00 70.32 H new ATOM 0 HG11 VAL A 105 -4.503 -5.123 -0.127 1.00 2.51 H new ATOM 0 HG12 VAL A 105 -4.537 -4.022 1.271 1.00 2.51 H new ATOM 0 HG13 VAL A 105 -3.911 -5.678 1.457 1.00 2.51 H new ATOM 0 HG21 VAL A 105 -6.118 -7.016 -0.294 1.00 44.53 H new ATOM 0 HG22 VAL A 105 -5.636 -7.679 1.286 1.00 44.53 H new ATOM 0 HG23 VAL A 105 -7.342 -7.284 0.970 1.00 44.53 H new ATOM 1632 N VAL A 106 -5.552 -3.777 4.414 1.00 43.24 N ATOM 1633 CA VAL A 106 -5.440 -2.453 5.048 1.00 65.12 C ATOM 1634 C VAL A 106 -4.137 -1.754 4.597 1.00 20.30 C ATOM 1635 O VAL A 106 -3.040 -2.240 4.869 1.00 41.43 O ATOM 1636 CB VAL A 106 -5.466 -2.560 6.621 1.00 34.45 C ATOM 1637 CG1 VAL A 106 -5.440 -1.155 7.289 1.00 71.23 C ATOM 1638 CG2 VAL A 106 -6.685 -3.381 7.107 1.00 53.20 C ATOM 0 H VAL A 106 -4.992 -4.496 4.872 1.00 43.24 H new ATOM 0 HA VAL A 106 -6.300 -1.863 4.733 1.00 65.12 H new ATOM 0 HB VAL A 106 -4.562 -3.088 6.926 1.00 34.45 H new ATOM 0 HG11 VAL A 106 -5.459 -1.267 8.373 1.00 71.23 H new ATOM 0 HG12 VAL A 106 -4.532 -0.629 6.994 1.00 71.23 H new ATOM 0 HG13 VAL A 106 -6.311 -0.583 6.968 1.00 71.23 H new ATOM 0 HG21 VAL A 106 -6.675 -3.437 8.196 1.00 53.20 H new ATOM 0 HG22 VAL A 106 -7.604 -2.897 6.777 1.00 53.20 H new ATOM 0 HG23 VAL A 106 -6.635 -4.387 6.691 1.00 53.20 H new ATOM 1648 N TRP A 107 -4.272 -0.609 3.914 1.00 53.32 N ATOM 1649 CA TRP A 107 -3.126 0.199 3.450 1.00 44.15 C ATOM 1650 C TRP A 107 -3.192 1.595 4.105 1.00 51.44 C ATOM 1651 O TRP A 107 -4.169 2.330 3.924 1.00 2.14 O ATOM 1652 CB TRP A 107 -3.134 0.295 1.902 1.00 63.45 C ATOM 1653 CG TRP A 107 -1.878 0.864 1.262 1.00 31.23 C ATOM 1654 CD1 TRP A 107 -0.686 1.200 1.860 1.00 53.11 C ATOM 1655 CD2 TRP A 107 -1.706 1.135 -0.129 1.00 61.32 C ATOM 1656 NE1 TRP A 107 0.198 1.666 0.922 1.00 41.20 N ATOM 1657 CE2 TRP A 107 -0.403 1.636 -0.308 1.00 34.11 C ATOM 1658 CE3 TRP A 107 -2.538 1.003 -1.238 1.00 24.22 C ATOM 1659 CZ2 TRP A 107 0.088 2.005 -1.557 1.00 34.44 C ATOM 1660 CZ3 TRP A 107 -2.055 1.368 -2.472 1.00 22.12 C ATOM 1661 CH2 TRP A 107 -0.750 1.864 -2.629 1.00 22.02 C ATOM 0 H TRP A 107 -5.178 -0.213 3.665 1.00 53.32 H new ATOM 0 HA TRP A 107 -2.191 -0.277 3.745 1.00 44.15 H new ATOM 0 HB2 TRP A 107 -3.304 -0.703 1.497 1.00 63.45 H new ATOM 0 HB3 TRP A 107 -3.982 0.910 1.601 1.00 63.45 H new ATOM 0 HD1 TRP A 107 -0.477 1.110 2.916 1.00 53.11 H new ATOM 0 HE1 TRP A 107 1.149 1.984 1.110 1.00 41.20 H new ATOM 0 HE3 TRP A 107 -3.543 0.621 -1.131 1.00 24.22 H new ATOM 0 HZ2 TRP A 107 1.091 2.388 -1.675 1.00 34.44 H new ATOM 0 HZ3 TRP A 107 -2.692 1.271 -3.339 1.00 22.12 H new ATOM 0 HH2 TRP A 107 -0.402 2.139 -3.614 1.00 22.02 H new ATOM 1672 N THR A 108 -2.134 1.959 4.845 1.00 35.01 N ATOM 1673 CA THR A 108 -2.107 3.182 5.672 1.00 62.53 C ATOM 1674 C THR A 108 -0.826 4.007 5.392 1.00 30.23 C ATOM 1675 O THR A 108 0.277 3.467 5.415 1.00 44.41 O ATOM 1676 CB THR A 108 -2.212 2.815 7.196 1.00 25.15 C ATOM 1677 OG1 THR A 108 -3.394 2.023 7.427 1.00 22.43 O ATOM 1678 CG2 THR A 108 -2.259 4.054 8.109 1.00 20.04 C ATOM 0 H THR A 108 -1.272 1.416 4.889 1.00 35.01 H new ATOM 0 HA THR A 108 -2.967 3.796 5.406 1.00 62.53 H new ATOM 0 HB THR A 108 -1.312 2.253 7.445 1.00 25.15 H new ATOM 0 HG1 THR A 108 -3.454 1.795 8.378 1.00 22.43 H new ATOM 0 HG21 THR A 108 -2.331 3.737 9.149 1.00 20.04 H new ATOM 0 HG22 THR A 108 -1.352 4.642 7.971 1.00 20.04 H new ATOM 0 HG23 THR A 108 -3.127 4.661 7.854 1.00 20.04 H new ATOM 1686 N ALA A 109 -0.989 5.322 5.136 1.00 52.13 N ATOM 1687 CA ALA A 109 0.121 6.247 4.821 1.00 61.03 C ATOM 1688 C ALA A 109 0.194 7.390 5.852 1.00 64.33 C ATOM 1689 O ALA A 109 -0.719 8.210 5.957 1.00 31.25 O ATOM 1690 CB ALA A 109 -0.036 6.821 3.403 1.00 51.21 C ATOM 0 H ALA A 109 -1.902 5.776 5.142 1.00 52.13 H new ATOM 0 HA ALA A 109 1.052 5.681 4.867 1.00 61.03 H new ATOM 0 HB1 ALA A 109 0.791 7.499 3.191 1.00 51.21 H new ATOM 0 HB2 ALA A 109 -0.032 6.007 2.678 1.00 51.21 H new ATOM 0 HB3 ALA A 109 -0.978 7.365 3.333 1.00 51.21 H new ATOM 1696 N MET A 110 1.298 7.429 6.597 1.00 34.44 N ATOM 1697 CA MET A 110 1.606 8.501 7.559 1.00 13.42 C ATOM 1698 C MET A 110 2.577 9.478 6.899 1.00 15.05 C ATOM 1699 O MET A 110 3.471 9.050 6.178 1.00 0.31 O ATOM 1700 CB MET A 110 2.254 7.924 8.841 1.00 21.41 C ATOM 1701 CG MET A 110 1.317 7.081 9.703 1.00 21.13 C ATOM 1702 SD MET A 110 0.628 5.638 8.851 1.00 10.15 S ATOM 1703 CE MET A 110 2.065 4.603 8.566 1.00 74.41 C ATOM 0 H MET A 110 2.018 6.708 6.553 1.00 34.44 H new ATOM 0 HA MET A 110 0.681 9.005 7.840 1.00 13.42 H new ATOM 0 HB2 MET A 110 3.111 7.314 8.556 1.00 21.41 H new ATOM 0 HB3 MET A 110 2.636 8.749 9.442 1.00 21.41 H new ATOM 0 HG2 MET A 110 1.859 6.744 10.587 1.00 21.13 H new ATOM 0 HG3 MET A 110 0.498 7.709 10.052 1.00 21.13 H new ATOM 0 HE1 MET A 110 2.307 4.601 7.503 1.00 74.41 H new ATOM 0 HE2 MET A 110 2.912 4.993 9.131 1.00 74.41 H new ATOM 0 HE3 MET A 110 1.850 3.585 8.891 1.00 74.41 H new ATOM 1713 N PHE A 111 2.402 10.782 7.129 1.00 21.04 N ATOM 1714 CA PHE A 111 3.328 11.788 6.583 1.00 23.13 C ATOM 1715 C PHE A 111 3.296 13.114 7.354 1.00 13.04 C ATOM 1716 O PHE A 111 2.285 13.485 7.951 1.00 1.53 O ATOM 1717 CB PHE A 111 3.091 12.001 5.051 1.00 23.12 C ATOM 1718 CG PHE A 111 1.623 12.082 4.619 1.00 43.10 C ATOM 1719 CD1 PHE A 111 0.822 13.163 4.984 1.00 30.12 C ATOM 1720 CD2 PHE A 111 1.046 11.071 3.845 1.00 64.21 C ATOM 1721 CE1 PHE A 111 -0.495 13.231 4.589 1.00 24.11 C ATOM 1722 CE2 PHE A 111 -0.272 11.145 3.449 1.00 62.01 C ATOM 1723 CZ PHE A 111 -1.039 12.225 3.822 1.00 41.14 C ATOM 0 H PHE A 111 1.637 11.167 7.683 1.00 21.04 H new ATOM 0 HA PHE A 111 4.334 11.390 6.716 1.00 23.13 H new ATOM 0 HB2 PHE A 111 3.593 12.920 4.747 1.00 23.12 H new ATOM 0 HB3 PHE A 111 3.567 11.183 4.510 1.00 23.12 H new ATOM 0 HD1 PHE A 111 1.240 13.957 5.584 1.00 30.12 H new ATOM 0 HD2 PHE A 111 1.642 10.219 3.553 1.00 64.21 H new ATOM 0 HE1 PHE A 111 -1.103 14.075 4.881 1.00 24.11 H new ATOM 0 HE2 PHE A 111 -0.702 10.358 2.848 1.00 62.01 H new ATOM 0 HZ PHE A 111 -2.072 12.284 3.512 1.00 41.14 H new ATOM 1733 N ASP A 112 4.439 13.814 7.331 1.00 70.33 N ATOM 1734 CA ASP A 112 4.583 15.144 7.932 1.00 33.01 C ATOM 1735 C ASP A 112 4.083 16.213 6.938 1.00 51.10 C ATOM 1736 O ASP A 112 4.856 16.733 6.121 1.00 50.01 O ATOM 1737 CB ASP A 112 6.063 15.369 8.326 1.00 33.43 C ATOM 1738 CG ASP A 112 6.307 16.672 9.100 1.00 3.04 C ATOM 1739 OD1 ASP A 112 6.184 16.665 10.342 1.00 2.52 O ATOM 1740 OD2 ASP A 112 6.621 17.708 8.475 1.00 72.42 O ATOM 0 H ASP A 112 5.293 13.470 6.892 1.00 70.33 H new ATOM 0 HA ASP A 112 3.979 15.222 8.836 1.00 33.01 H new ATOM 0 HB2 ASP A 112 6.399 14.528 8.933 1.00 33.43 H new ATOM 0 HB3 ASP A 112 6.673 15.374 7.423 1.00 33.43 H new ATOM 1745 N CYS A 113 2.768 16.460 6.955 1.00 23.13 N ATOM 1746 CA CYS A 113 2.128 17.486 6.090 1.00 10.40 C ATOM 1747 C CYS A 113 1.231 18.453 6.890 1.00 25.40 C ATOM 1748 O CYS A 113 0.841 18.168 8.031 1.00 20.53 O ATOM 1749 CB CYS A 113 1.297 16.798 4.994 1.00 51.44 C ATOM 1750 SG CYS A 113 0.534 17.934 3.810 1.00 35.35 S ATOM 0 H CYS A 113 2.113 15.965 7.560 1.00 23.13 H new ATOM 0 HA CYS A 113 2.927 18.076 5.642 1.00 10.40 H new ATOM 0 HB2 CYS A 113 1.938 16.103 4.451 1.00 51.44 H new ATOM 0 HB3 CYS A 113 0.514 16.206 5.467 1.00 51.44 H new ATOM 0 HG CYS A 113 1.425 18.326 2.949 1.00 35.35 H new ATOM 1756 N SER A 114 0.898 19.595 6.258 1.00 50.15 N ATOM 1757 CA SER A 114 -0.002 20.612 6.840 1.00 11.44 C ATOM 1758 C SER A 114 -1.485 20.155 6.788 1.00 54.03 C ATOM 1759 O SER A 114 -1.898 19.535 5.802 1.00 51.10 O ATOM 1760 CB SER A 114 0.149 21.955 6.085 1.00 45.22 C ATOM 1761 OG SER A 114 -0.254 21.849 4.728 1.00 51.45 O ATOM 0 H SER A 114 1.245 19.839 5.330 1.00 50.15 H new ATOM 0 HA SER A 114 0.282 20.743 7.884 1.00 11.44 H new ATOM 0 HB2 SER A 114 -0.448 22.720 6.582 1.00 45.22 H new ATOM 0 HB3 SER A 114 1.188 22.282 6.130 1.00 45.22 H new ATOM 0 HG SER A 114 -0.283 22.742 4.325 1.00 51.45 H new ATOM 1767 N PRO A 115 -2.308 20.446 7.856 1.00 53.53 N ATOM 1768 CA PRO A 115 -3.791 20.233 7.841 1.00 62.21 C ATOM 1769 C PRO A 115 -4.496 20.801 6.575 1.00 71.24 C ATOM 1770 O PRO A 115 -5.403 20.169 6.021 1.00 65.43 O ATOM 1771 CB PRO A 115 -4.258 20.981 9.113 1.00 11.03 C ATOM 1772 CG PRO A 115 -3.097 20.871 10.052 1.00 61.52 C ATOM 1773 CD PRO A 115 -1.854 20.953 9.186 1.00 54.15 C ATOM 0 HA PRO A 115 -4.043 19.173 7.821 1.00 62.21 H new ATOM 0 HB2 PRO A 115 -4.498 22.022 8.897 1.00 11.03 H new ATOM 0 HB3 PRO A 115 -5.155 20.528 9.535 1.00 11.03 H new ATOM 0 HG2 PRO A 115 -3.113 21.674 10.789 1.00 61.52 H new ATOM 0 HG3 PRO A 115 -3.128 19.931 10.603 1.00 61.52 H new ATOM 0 HD2 PRO A 115 -1.481 21.975 9.118 1.00 54.15 H new ATOM 0 HD3 PRO A 115 -1.045 20.345 9.590 1.00 54.15 H new ATOM 1781 N GLU A 116 -4.045 21.991 6.127 1.00 61.50 N ATOM 1782 CA GLU A 116 -4.563 22.665 4.910 1.00 64.34 C ATOM 1783 C GLU A 116 -4.404 21.797 3.636 1.00 31.41 C ATOM 1784 O GLU A 116 -5.316 21.736 2.808 1.00 2.43 O ATOM 1785 CB GLU A 116 -3.839 24.022 4.726 1.00 10.22 C ATOM 1786 CG GLU A 116 -4.065 25.019 5.881 1.00 53.10 C ATOM 1787 CD GLU A 116 -3.246 26.314 5.730 1.00 43.05 C ATOM 1788 OE1 GLU A 116 -2.071 26.336 6.149 1.00 12.52 O ATOM 1789 OE2 GLU A 116 -3.763 27.307 5.173 1.00 2.13 O ATOM 0 H GLU A 116 -3.309 22.516 6.598 1.00 61.50 H new ATOM 0 HA GLU A 116 -5.632 22.826 5.051 1.00 64.34 H new ATOM 0 HB2 GLU A 116 -2.769 23.840 4.622 1.00 10.22 H new ATOM 0 HB3 GLU A 116 -4.176 24.478 3.795 1.00 10.22 H new ATOM 0 HG2 GLU A 116 -5.124 25.270 5.934 1.00 53.10 H new ATOM 0 HG3 GLU A 116 -3.804 24.539 6.824 1.00 53.10 H new ATOM 1796 N THR A 117 -3.241 21.135 3.487 1.00 60.22 N ATOM 1797 CA THR A 117 -2.973 20.234 2.332 1.00 72.11 C ATOM 1798 C THR A 117 -3.577 18.825 2.561 1.00 33.44 C ATOM 1799 O THR A 117 -3.916 18.126 1.604 1.00 61.33 O ATOM 1800 CB THR A 117 -1.433 20.105 2.042 1.00 13.13 C ATOM 1801 OG1 THR A 117 -0.855 21.414 1.928 1.00 60.34 O ATOM 1802 CG2 THR A 117 -1.129 19.324 0.746 1.00 33.50 C ATOM 0 H THR A 117 -2.467 21.202 4.148 1.00 60.22 H new ATOM 0 HA THR A 117 -3.454 20.687 1.465 1.00 72.11 H new ATOM 0 HB THR A 117 -1.002 19.551 2.876 1.00 13.13 H new ATOM 0 HG1 THR A 117 -0.556 21.718 2.811 1.00 60.34 H new ATOM 0 HG21 THR A 117 -0.050 19.268 0.599 1.00 33.50 H new ATOM 0 HG22 THR A 117 -1.537 18.316 0.824 1.00 33.50 H new ATOM 0 HG23 THR A 117 -1.584 19.835 -0.102 1.00 33.50 H new ATOM 1810 N ALA A 118 -3.733 18.433 3.847 1.00 50.22 N ATOM 1811 CA ALA A 118 -4.198 17.077 4.242 1.00 33.44 C ATOM 1812 C ALA A 118 -5.599 16.742 3.674 1.00 45.53 C ATOM 1813 O ALA A 118 -5.838 15.606 3.272 1.00 43.21 O ATOM 1814 CB ALA A 118 -4.181 16.933 5.773 1.00 31.22 C ATOM 0 H ALA A 118 -3.541 19.044 4.641 1.00 50.22 H new ATOM 0 HA ALA A 118 -3.504 16.358 3.808 1.00 33.44 H new ATOM 0 HB1 ALA A 118 -4.524 15.936 6.048 1.00 31.22 H new ATOM 0 HB2 ALA A 118 -3.166 17.083 6.141 1.00 31.22 H new ATOM 0 HB3 ALA A 118 -4.841 17.679 6.216 1.00 31.22 H new ATOM 1820 N ARG A 119 -6.500 17.748 3.616 1.00 30.21 N ATOM 1821 CA ARG A 119 -7.864 17.585 3.029 1.00 42.33 C ATOM 1822 C ARG A 119 -7.804 17.171 1.530 1.00 71.11 C ATOM 1823 O ARG A 119 -8.662 16.419 1.045 1.00 41.44 O ATOM 1824 CB ARG A 119 -8.692 18.891 3.187 1.00 52.35 C ATOM 1825 CG ARG A 119 -8.098 20.125 2.469 1.00 71.30 C ATOM 1826 CD ARG A 119 -8.989 21.378 2.565 1.00 30.31 C ATOM 1827 NE ARG A 119 -10.323 21.163 1.967 1.00 22.55 N ATOM 1828 CZ ARG A 119 -10.675 21.469 0.732 1.00 52.02 C ATOM 1829 NH1 ARG A 119 -9.819 21.958 -0.119 1.00 73.11 N ATOM 1830 NH2 ARG A 119 -11.888 21.248 0.343 1.00 34.41 N ATOM 0 H ARG A 119 -6.313 18.687 3.968 1.00 30.21 H new ATOM 0 HA ARG A 119 -8.356 16.783 3.579 1.00 42.33 H new ATOM 0 HB2 ARG A 119 -9.698 18.715 2.806 1.00 52.35 H new ATOM 0 HB3 ARG A 119 -8.789 19.117 4.249 1.00 52.35 H new ATOM 0 HG2 ARG A 119 -7.121 20.350 2.897 1.00 71.30 H new ATOM 0 HG3 ARG A 119 -7.937 19.882 1.419 1.00 71.30 H new ATOM 0 HD2 ARG A 119 -9.103 21.661 3.611 1.00 30.31 H new ATOM 0 HD3 ARG A 119 -8.497 22.211 2.062 1.00 30.31 H new ATOM 0 HE ARG A 119 -11.036 20.740 2.562 1.00 22.55 H new ATOM 0 HH11 ARG A 119 -8.851 22.113 0.163 1.00 73.11 H new ATOM 0 HH12 ARG A 119 -10.116 22.186 -1.068 1.00 73.11 H new ATOM 0 HH21 ARG A 119 -12.564 20.840 0.989 1.00 34.41 H new ATOM 0 HH22 ARG A 119 -12.169 21.481 -0.609 1.00 34.41 H new ATOM 1844 N GLU A 120 -6.775 17.668 0.817 1.00 44.11 N ATOM 1845 CA GLU A 120 -6.493 17.279 -0.578 1.00 13.42 C ATOM 1846 C GLU A 120 -5.904 15.866 -0.635 1.00 21.24 C ATOM 1847 O GLU A 120 -6.318 15.069 -1.454 1.00 35.03 O ATOM 1848 CB GLU A 120 -5.529 18.304 -1.269 1.00 74.52 C ATOM 1849 CG GLU A 120 -6.225 19.319 -2.195 1.00 45.15 C ATOM 1850 CD GLU A 120 -7.302 20.172 -1.491 1.00 62.34 C ATOM 1851 OE1 GLU A 120 -6.947 21.098 -0.727 1.00 20.33 O ATOM 1852 OE2 GLU A 120 -8.508 19.915 -1.697 1.00 52.33 O ATOM 0 H GLU A 120 -6.116 18.350 1.192 1.00 44.11 H new ATOM 0 HA GLU A 120 -7.437 17.285 -1.124 1.00 13.42 H new ATOM 0 HB2 GLU A 120 -4.987 18.850 -0.497 1.00 74.52 H new ATOM 0 HB3 GLU A 120 -4.789 17.752 -1.848 1.00 74.52 H new ATOM 0 HG2 GLU A 120 -5.472 19.982 -2.622 1.00 45.15 H new ATOM 0 HG3 GLU A 120 -6.685 18.783 -3.025 1.00 45.15 H new ATOM 1859 N LEU A 121 -4.958 15.562 0.262 1.00 42.10 N ATOM 1860 CA LEU A 121 -4.213 14.285 0.235 1.00 31.33 C ATOM 1861 C LEU A 121 -5.118 13.078 0.565 1.00 55.43 C ATOM 1862 O LEU A 121 -4.945 12.007 0.001 1.00 3.52 O ATOM 1863 CB LEU A 121 -3.000 14.348 1.196 1.00 61.04 C ATOM 1864 CG LEU A 121 -1.971 15.486 0.903 1.00 52.30 C ATOM 1865 CD1 LEU A 121 -0.796 15.459 1.894 1.00 33.01 C ATOM 1866 CD2 LEU A 121 -1.468 15.438 -0.556 1.00 61.45 C ATOM 0 H LEU A 121 -4.685 16.184 1.023 1.00 42.10 H new ATOM 0 HA LEU A 121 -3.847 14.139 -0.781 1.00 31.33 H new ATOM 0 HB2 LEU A 121 -3.370 14.470 2.214 1.00 61.04 H new ATOM 0 HB3 LEU A 121 -2.479 13.392 1.159 1.00 61.04 H new ATOM 0 HG LEU A 121 -2.496 16.432 1.040 1.00 52.30 H new ATOM 0 HD11 LEU A 121 -0.102 16.265 1.657 1.00 33.01 H new ATOM 0 HD12 LEU A 121 -1.173 15.590 2.908 1.00 33.01 H new ATOM 0 HD13 LEU A 121 -0.279 14.502 1.820 1.00 33.01 H new ATOM 0 HD21 LEU A 121 -0.754 16.245 -0.721 1.00 61.45 H new ATOM 0 HD22 LEU A 121 -0.982 14.480 -0.742 1.00 61.45 H new ATOM 0 HD23 LEU A 121 -2.312 15.555 -1.236 1.00 61.45 H new ATOM 1878 N GLU A 122 -6.101 13.273 1.461 1.00 0.45 N ATOM 1879 CA GLU A 122 -7.098 12.231 1.801 1.00 32.30 C ATOM 1880 C GLU A 122 -7.944 11.848 0.564 1.00 10.35 C ATOM 1881 O GLU A 122 -8.177 10.670 0.309 1.00 42.25 O ATOM 1882 CB GLU A 122 -8.000 12.723 2.966 1.00 40.31 C ATOM 1883 CG GLU A 122 -7.239 12.969 4.286 1.00 41.12 C ATOM 1884 CD GLU A 122 -8.078 13.676 5.366 1.00 14.34 C ATOM 1885 OE1 GLU A 122 -8.366 14.880 5.202 1.00 53.11 O ATOM 1886 OE2 GLU A 122 -8.460 13.034 6.371 1.00 62.31 O ATOM 0 H GLU A 122 -6.230 14.148 1.969 1.00 0.45 H new ATOM 0 HA GLU A 122 -6.570 11.334 2.125 1.00 32.30 H new ATOM 0 HB2 GLU A 122 -8.493 13.647 2.665 1.00 40.31 H new ATOM 0 HB3 GLU A 122 -8.784 11.986 3.142 1.00 40.31 H new ATOM 0 HG2 GLU A 122 -6.892 12.013 4.678 1.00 41.12 H new ATOM 0 HG3 GLU A 122 -6.353 13.569 4.077 1.00 41.12 H new ATOM 1893 N SER A 123 -8.378 12.862 -0.197 1.00 21.11 N ATOM 1894 CA SER A 123 -9.139 12.666 -1.456 1.00 50.43 C ATOM 1895 C SER A 123 -8.265 12.064 -2.598 1.00 53.21 C ATOM 1896 O SER A 123 -8.595 11.027 -3.157 1.00 54.44 O ATOM 1897 CB SER A 123 -9.734 14.018 -1.916 1.00 32.13 C ATOM 1898 OG SER A 123 -10.559 14.605 -0.912 1.00 54.34 O ATOM 0 H SER A 123 -8.216 13.842 0.035 1.00 21.11 H new ATOM 0 HA SER A 123 -9.934 11.950 -1.246 1.00 50.43 H new ATOM 0 HB2 SER A 123 -8.925 14.704 -2.168 1.00 32.13 H new ATOM 0 HB3 SER A 123 -10.318 13.867 -2.824 1.00 32.13 H new ATOM 0 HG SER A 123 -10.005 15.139 -0.305 1.00 54.34 H new ATOM 1904 N VAL A 124 -7.154 12.745 -2.923 1.00 32.45 N ATOM 1905 CA VAL A 124 -6.277 12.429 -4.083 1.00 5.42 C ATOM 1906 C VAL A 124 -5.439 11.136 -3.867 1.00 52.11 C ATOM 1907 O VAL A 124 -5.406 10.258 -4.735 1.00 24.42 O ATOM 1908 CB VAL A 124 -5.330 13.660 -4.382 1.00 25.44 C ATOM 1909 CG1 VAL A 124 -4.366 13.399 -5.564 1.00 24.32 C ATOM 1910 CG2 VAL A 124 -6.164 14.944 -4.637 1.00 24.43 C ATOM 0 H VAL A 124 -6.827 13.546 -2.383 1.00 32.45 H new ATOM 0 HA VAL A 124 -6.922 12.241 -4.941 1.00 5.42 H new ATOM 0 HB VAL A 124 -4.714 13.804 -3.494 1.00 25.44 H new ATOM 0 HG11 VAL A 124 -3.740 14.277 -5.724 1.00 24.32 H new ATOM 0 HG12 VAL A 124 -3.735 12.540 -5.336 1.00 24.32 H new ATOM 0 HG13 VAL A 124 -4.943 13.195 -6.466 1.00 24.32 H new ATOM 0 HG21 VAL A 124 -5.494 15.779 -4.841 1.00 24.43 H new ATOM 0 HG22 VAL A 124 -6.820 14.788 -5.494 1.00 24.43 H new ATOM 0 HG23 VAL A 124 -6.765 15.168 -3.756 1.00 24.43 H new ATOM 1920 N ILE A 125 -4.761 11.032 -2.713 1.00 31.33 N ATOM 1921 CA ILE A 125 -3.938 9.842 -2.372 1.00 65.55 C ATOM 1922 C ILE A 125 -4.824 8.695 -1.811 1.00 1.43 C ATOM 1923 O ILE A 125 -4.719 7.553 -2.257 1.00 4.14 O ATOM 1924 CB ILE A 125 -2.795 10.192 -1.338 1.00 32.32 C ATOM 1925 CG1 ILE A 125 -1.881 11.341 -1.871 1.00 33.12 C ATOM 1926 CG2 ILE A 125 -1.952 8.944 -0.958 1.00 10.24 C ATOM 1927 CD1 ILE A 125 -0.775 11.770 -0.909 1.00 74.02 C ATOM 0 H ILE A 125 -4.761 11.755 -1.994 1.00 31.33 H new ATOM 0 HA ILE A 125 -3.467 9.508 -3.296 1.00 65.55 H new ATOM 0 HB ILE A 125 -3.285 10.542 -0.429 1.00 32.32 H new ATOM 0 HG12 ILE A 125 -1.426 11.021 -2.808 1.00 33.12 H new ATOM 0 HG13 ILE A 125 -2.503 12.207 -2.098 1.00 33.12 H new ATOM 0 HG21 ILE A 125 -1.178 9.231 -0.246 1.00 10.24 H new ATOM 0 HG22 ILE A 125 -2.599 8.191 -0.508 1.00 10.24 H new ATOM 0 HG23 ILE A 125 -1.486 8.533 -1.854 1.00 10.24 H new ATOM 0 HD11 ILE A 125 -0.190 12.571 -1.361 1.00 74.02 H new ATOM 0 HD12 ILE A 125 -1.219 12.125 0.021 1.00 74.02 H new ATOM 0 HD13 ILE A 125 -0.125 10.920 -0.700 1.00 74.02 H new ATOM 1939 N GLY A 126 -5.697 9.023 -0.835 1.00 3.44 N ATOM 1940 CA GLY A 126 -6.537 8.015 -0.156 1.00 53.40 C ATOM 1941 C GLY A 126 -7.648 7.428 -1.037 1.00 3.52 C ATOM 1942 O GLY A 126 -7.544 6.284 -1.491 1.00 11.05 O ATOM 0 H GLY A 126 -5.838 9.976 -0.500 1.00 3.44 H new ATOM 0 HA2 GLY A 126 -5.900 7.203 0.195 1.00 53.40 H new ATOM 0 HA3 GLY A 126 -6.989 8.469 0.726 1.00 53.40 H new ATOM 1946 N ASP A 127 -8.724 8.205 -1.265 1.00 44.32 N ATOM 1947 CA ASP A 127 -9.861 7.787 -2.124 1.00 12.35 C ATOM 1948 C ASP A 127 -9.429 7.617 -3.605 1.00 34.53 C ATOM 1949 O ASP A 127 -10.035 6.844 -4.354 1.00 15.14 O ATOM 1950 CB ASP A 127 -11.013 8.812 -2.014 1.00 73.21 C ATOM 1951 CG ASP A 127 -11.519 8.986 -0.573 1.00 22.55 C ATOM 1952 OD1 ASP A 127 -12.427 8.235 -0.153 1.00 20.24 O ATOM 1953 OD2 ASP A 127 -11.008 9.858 0.146 1.00 14.25 O ATOM 0 H ASP A 127 -8.835 9.136 -0.864 1.00 44.32 H new ATOM 0 HA ASP A 127 -10.208 6.816 -1.770 1.00 12.35 H new ATOM 0 HB2 ASP A 127 -10.674 9.776 -2.394 1.00 73.21 H new ATOM 0 HB3 ASP A 127 -11.840 8.492 -2.649 1.00 73.21 H new ATOM 1958 N GLY A 128 -8.379 8.349 -4.005 1.00 22.30 N ATOM 1959 CA GLY A 128 -7.814 8.245 -5.348 1.00 43.03 C ATOM 1960 C GLY A 128 -6.872 7.047 -5.504 1.00 2.42 C ATOM 1961 O GLY A 128 -7.322 5.953 -5.827 1.00 75.33 O ATOM 0 H GLY A 128 -7.904 9.025 -3.407 1.00 22.30 H new ATOM 0 HA2 GLY A 128 -8.624 8.161 -6.073 1.00 43.03 H new ATOM 0 HA3 GLY A 128 -7.271 9.161 -5.581 1.00 43.03 H new ATOM 1965 N VAL A 129 -5.574 7.254 -5.220 1.00 74.31 N ATOM 1966 CA VAL A 129 -4.493 6.271 -5.511 1.00 63.44 C ATOM 1967 C VAL A 129 -4.718 4.891 -4.824 1.00 64.24 C ATOM 1968 O VAL A 129 -4.656 3.835 -5.477 1.00 41.13 O ATOM 1969 CB VAL A 129 -3.092 6.856 -5.089 1.00 61.55 C ATOM 1970 CG1 VAL A 129 -1.932 5.872 -5.402 1.00 24.32 C ATOM 1971 CG2 VAL A 129 -2.843 8.234 -5.752 1.00 55.22 C ATOM 0 H VAL A 129 -5.235 8.109 -4.780 1.00 74.31 H new ATOM 0 HA VAL A 129 -4.516 6.098 -6.587 1.00 63.44 H new ATOM 0 HB VAL A 129 -3.114 6.995 -4.008 1.00 61.55 H new ATOM 0 HG11 VAL A 129 -0.985 6.316 -5.095 1.00 24.32 H new ATOM 0 HG12 VAL A 129 -2.089 4.940 -4.859 1.00 24.32 H new ATOM 0 HG13 VAL A 129 -1.907 5.668 -6.472 1.00 24.32 H new ATOM 0 HG21 VAL A 129 -1.869 8.615 -5.444 1.00 55.22 H new ATOM 0 HG22 VAL A 129 -2.864 8.125 -6.836 1.00 55.22 H new ATOM 0 HG23 VAL A 129 -3.621 8.932 -5.443 1.00 55.22 H new ATOM 1981 N PHE A 130 -5.007 4.925 -3.516 1.00 2.51 N ATOM 1982 CA PHE A 130 -5.104 3.716 -2.665 1.00 34.24 C ATOM 1983 C PHE A 130 -6.383 2.912 -2.946 1.00 53.04 C ATOM 1984 O PHE A 130 -6.311 1.716 -3.228 1.00 51.43 O ATOM 1985 CB PHE A 130 -5.038 4.103 -1.156 1.00 31.43 C ATOM 1986 CG PHE A 130 -3.666 4.536 -0.625 1.00 4.34 C ATOM 1987 CD1 PHE A 130 -2.671 5.020 -1.477 1.00 60.45 C ATOM 1988 CD2 PHE A 130 -3.372 4.435 0.736 1.00 44.34 C ATOM 1989 CE1 PHE A 130 -1.436 5.392 -0.987 1.00 12.24 C ATOM 1990 CE2 PHE A 130 -2.136 4.805 1.222 1.00 51.41 C ATOM 1991 CZ PHE A 130 -1.168 5.281 0.360 1.00 73.10 C ATOM 0 H PHE A 130 -5.182 5.793 -3.010 1.00 2.51 H new ATOM 0 HA PHE A 130 -4.253 3.081 -2.912 1.00 34.24 H new ATOM 0 HB2 PHE A 130 -5.745 4.914 -0.980 1.00 31.43 H new ATOM 0 HB3 PHE A 130 -5.379 3.250 -0.569 1.00 31.43 H new ATOM 0 HD1 PHE A 130 -2.871 5.104 -2.535 1.00 60.45 H new ATOM 0 HD2 PHE A 130 -4.123 4.062 1.417 1.00 44.34 H new ATOM 0 HE1 PHE A 130 -0.680 5.770 -1.659 1.00 12.24 H new ATOM 0 HE2 PHE A 130 -1.925 4.722 2.278 1.00 51.41 H new ATOM 0 HZ PHE A 130 -0.199 5.567 0.742 1.00 73.10 H new ATOM 2001 N ALA A 131 -7.549 3.587 -2.875 1.00 21.55 N ATOM 2002 CA ALA A 131 -8.865 2.934 -3.072 1.00 71.22 C ATOM 2003 C ALA A 131 -8.997 2.312 -4.482 1.00 3.42 C ATOM 2004 O ALA A 131 -9.617 1.269 -4.640 1.00 51.25 O ATOM 2005 CB ALA A 131 -10.008 3.922 -2.794 1.00 63.04 C ATOM 0 H ALA A 131 -7.608 4.587 -2.682 1.00 21.55 H new ATOM 0 HA ALA A 131 -8.935 2.116 -2.355 1.00 71.22 H new ATOM 0 HB1 ALA A 131 -10.965 3.423 -2.944 1.00 63.04 H new ATOM 0 HB2 ALA A 131 -9.941 4.276 -1.765 1.00 63.04 H new ATOM 0 HB3 ALA A 131 -9.930 4.770 -3.475 1.00 63.04 H new ATOM 2011 N VAL A 132 -8.372 2.947 -5.490 1.00 12.51 N ATOM 2012 CA VAL A 132 -8.249 2.384 -6.858 1.00 21.32 C ATOM 2013 C VAL A 132 -7.534 1.000 -6.839 1.00 10.44 C ATOM 2014 O VAL A 132 -8.045 0.021 -7.403 1.00 40.31 O ATOM 2015 CB VAL A 132 -7.498 3.421 -7.804 1.00 10.44 C ATOM 2016 CG1 VAL A 132 -6.738 2.750 -8.963 1.00 62.42 C ATOM 2017 CG2 VAL A 132 -8.481 4.477 -8.364 1.00 54.11 C ATOM 0 H VAL A 132 -7.937 3.864 -5.385 1.00 12.51 H new ATOM 0 HA VAL A 132 -9.249 2.216 -7.258 1.00 21.32 H new ATOM 0 HB VAL A 132 -6.755 3.911 -7.174 1.00 10.44 H new ATOM 0 HG11 VAL A 132 -6.249 3.514 -9.568 1.00 62.42 H new ATOM 0 HG12 VAL A 132 -5.987 2.070 -8.560 1.00 62.42 H new ATOM 0 HG13 VAL A 132 -7.439 2.190 -9.582 1.00 62.42 H new ATOM 0 HG21 VAL A 132 -7.941 5.172 -9.007 1.00 54.11 H new ATOM 0 HG22 VAL A 132 -9.260 3.979 -8.942 1.00 54.11 H new ATOM 0 HG23 VAL A 132 -8.936 5.025 -7.539 1.00 54.11 H new ATOM 2027 N GLY A 133 -6.374 0.933 -6.159 1.00 33.22 N ATOM 2028 CA GLY A 133 -5.582 -0.302 -6.081 1.00 72.54 C ATOM 2029 C GLY A 133 -6.257 -1.414 -5.269 1.00 62.25 C ATOM 2030 O GLY A 133 -6.243 -2.579 -5.672 1.00 42.15 O ATOM 0 H GLY A 133 -5.967 1.722 -5.657 1.00 33.22 H new ATOM 0 HA2 GLY A 133 -5.391 -0.666 -7.091 1.00 72.54 H new ATOM 0 HA3 GLY A 133 -4.613 -0.075 -5.635 1.00 72.54 H new ATOM 2034 N LEU A 134 -6.874 -1.035 -4.133 1.00 70.25 N ATOM 2035 CA LEU A 134 -7.538 -1.981 -3.204 1.00 54.03 C ATOM 2036 C LEU A 134 -8.821 -2.594 -3.814 1.00 13.12 C ATOM 2037 O LEU A 134 -9.108 -3.779 -3.610 1.00 31.32 O ATOM 2038 CB LEU A 134 -7.864 -1.272 -1.865 1.00 33.23 C ATOM 2039 CG LEU A 134 -6.645 -0.784 -1.021 1.00 64.14 C ATOM 2040 CD1 LEU A 134 -7.111 -0.215 0.328 1.00 33.43 C ATOM 2041 CD2 LEU A 134 -5.601 -1.908 -0.830 1.00 33.43 C ATOM 0 H LEU A 134 -6.928 -0.063 -3.830 1.00 70.25 H new ATOM 0 HA LEU A 134 -6.844 -2.801 -3.020 1.00 54.03 H new ATOM 0 HB2 LEU A 134 -8.497 -0.411 -2.080 1.00 33.23 H new ATOM 0 HB3 LEU A 134 -8.452 -1.955 -1.252 1.00 33.23 H new ATOM 0 HG LEU A 134 -6.155 0.018 -1.573 1.00 64.14 H new ATOM 0 HD11 LEU A 134 -6.246 0.119 0.900 1.00 33.43 H new ATOM 0 HD12 LEU A 134 -7.780 0.628 0.156 1.00 33.43 H new ATOM 0 HD13 LEU A 134 -7.639 -0.988 0.886 1.00 33.43 H new ATOM 0 HD21 LEU A 134 -4.766 -1.533 -0.238 1.00 33.43 H new ATOM 0 HD22 LEU A 134 -6.063 -2.750 -0.314 1.00 33.43 H new ATOM 0 HD23 LEU A 134 -5.237 -2.236 -1.804 1.00 33.43 H new ATOM 2053 N ASN A 135 -9.585 -1.770 -4.562 1.00 14.40 N ATOM 2054 CA ASN A 135 -10.794 -2.233 -5.283 1.00 71.40 C ATOM 2055 C ASN A 135 -10.400 -3.204 -6.418 1.00 5.03 C ATOM 2056 O ASN A 135 -11.025 -4.248 -6.579 1.00 51.51 O ATOM 2057 CB ASN A 135 -11.618 -1.038 -5.841 1.00 24.32 C ATOM 2058 CG ASN A 135 -12.328 -0.214 -4.754 1.00 43.53 C ATOM 2059 OD1 ASN A 135 -11.904 -0.161 -3.602 1.00 14.42 O ATOM 2060 ND2 ASN A 135 -13.407 0.452 -5.120 1.00 64.53 N ATOM 0 H ASN A 135 -9.386 -0.777 -4.684 1.00 14.40 H new ATOM 0 HA ASN A 135 -11.428 -2.763 -4.572 1.00 71.40 H new ATOM 0 HB2 ASN A 135 -10.954 -0.383 -6.405 1.00 24.32 H new ATOM 0 HB3 ASN A 135 -12.362 -1.417 -6.541 1.00 24.32 H new ATOM 0 HD21 ASN A 135 -13.907 1.026 -4.441 1.00 64.53 H new ATOM 0 HD22 ASN A 135 -13.741 0.393 -6.082 1.00 64.53 H new ATOM 2067 N ALA A 136 -9.329 -2.858 -7.165 1.00 11.30 N ATOM 2068 CA ALA A 136 -8.773 -3.718 -8.241 1.00 55.52 C ATOM 2069 C ALA A 136 -8.279 -5.079 -7.690 1.00 64.35 C ATOM 2070 O ALA A 136 -8.424 -6.121 -8.342 1.00 40.34 O ATOM 2071 CB ALA A 136 -7.631 -2.979 -8.963 1.00 23.43 C ATOM 0 H ALA A 136 -8.825 -1.980 -7.043 1.00 11.30 H new ATOM 0 HA ALA A 136 -9.572 -3.928 -8.952 1.00 55.52 H new ATOM 0 HB1 ALA A 136 -7.227 -3.615 -9.751 1.00 23.43 H new ATOM 0 HB2 ALA A 136 -8.014 -2.057 -9.401 1.00 23.43 H new ATOM 0 HB3 ALA A 136 -6.843 -2.741 -8.249 1.00 23.43 H new ATOM 2077 N LEU A 137 -7.696 -5.047 -6.475 1.00 2.30 N ATOM 2078 CA LEU A 137 -7.224 -6.260 -5.765 1.00 62.42 C ATOM 2079 C LEU A 137 -8.427 -7.163 -5.388 1.00 74.33 C ATOM 2080 O LEU A 137 -8.366 -8.386 -5.526 1.00 55.31 O ATOM 2081 CB LEU A 137 -6.383 -5.832 -4.515 1.00 33.13 C ATOM 2082 CG LEU A 137 -5.523 -6.940 -3.805 1.00 43.53 C ATOM 2083 CD1 LEU A 137 -4.381 -6.328 -2.965 1.00 12.34 C ATOM 2084 CD2 LEU A 137 -6.371 -7.891 -2.930 1.00 24.32 C ATOM 0 H LEU A 137 -7.538 -4.183 -5.956 1.00 2.30 H new ATOM 0 HA LEU A 137 -6.579 -6.850 -6.416 1.00 62.42 H new ATOM 0 HB2 LEU A 137 -5.712 -5.029 -4.820 1.00 33.13 H new ATOM 0 HB3 LEU A 137 -7.067 -5.413 -3.777 1.00 33.13 H new ATOM 0 HG LEU A 137 -5.088 -7.533 -4.609 1.00 43.53 H new ATOM 0 HD11 LEU A 137 -3.810 -7.126 -2.491 1.00 12.34 H new ATOM 0 HD12 LEU A 137 -3.724 -5.747 -3.612 1.00 12.34 H new ATOM 0 HD13 LEU A 137 -4.802 -5.678 -2.198 1.00 12.34 H new ATOM 0 HD21 LEU A 137 -5.722 -8.634 -2.466 1.00 24.32 H new ATOM 0 HD22 LEU A 137 -6.878 -7.317 -2.154 1.00 24.32 H new ATOM 0 HD23 LEU A 137 -7.112 -8.394 -3.552 1.00 24.32 H new ATOM 2096 N ALA A 138 -9.514 -6.540 -4.918 1.00 72.35 N ATOM 2097 CA ALA A 138 -10.770 -7.255 -4.608 1.00 72.11 C ATOM 2098 C ALA A 138 -11.404 -7.865 -5.893 1.00 23.14 C ATOM 2099 O ALA A 138 -11.972 -8.968 -5.854 1.00 53.22 O ATOM 2100 CB ALA A 138 -11.757 -6.304 -3.918 1.00 30.50 C ATOM 0 H ALA A 138 -9.554 -5.536 -4.741 1.00 72.35 H new ATOM 0 HA ALA A 138 -10.538 -8.078 -3.932 1.00 72.11 H new ATOM 0 HB1 ALA A 138 -12.680 -6.838 -3.693 1.00 30.50 H new ATOM 0 HB2 ALA A 138 -11.318 -5.933 -2.992 1.00 30.50 H new ATOM 0 HB3 ALA A 138 -11.975 -5.465 -4.578 1.00 30.50 H new ATOM 2106 N GLU A 139 -11.254 -7.142 -7.033 1.00 13.33 N ATOM 2107 CA GLU A 139 -11.842 -7.525 -8.337 1.00 74.24 C ATOM 2108 C GLU A 139 -11.273 -8.846 -8.907 1.00 4.44 C ATOM 2109 O GLU A 139 -12.044 -9.679 -9.408 1.00 22.00 O ATOM 2110 CB GLU A 139 -11.726 -6.360 -9.368 1.00 64.35 C ATOM 2111 CG GLU A 139 -12.681 -5.179 -9.086 1.00 20.13 C ATOM 2112 CD GLU A 139 -12.570 -4.050 -10.119 1.00 24.45 C ATOM 2113 OE1 GLU A 139 -13.215 -4.149 -11.185 1.00 20.54 O ATOM 2114 OE2 GLU A 139 -11.832 -3.071 -9.881 1.00 71.52 O ATOM 0 H GLU A 139 -10.719 -6.274 -7.070 1.00 13.33 H new ATOM 0 HA GLU A 139 -12.899 -7.716 -8.150 1.00 74.24 H new ATOM 0 HB2 GLU A 139 -10.700 -5.992 -9.372 1.00 64.35 H new ATOM 0 HB3 GLU A 139 -11.929 -6.749 -10.366 1.00 64.35 H new ATOM 0 HG2 GLU A 139 -13.707 -5.546 -9.068 1.00 20.13 H new ATOM 0 HG3 GLU A 139 -12.469 -4.778 -8.095 1.00 20.13 H new ATOM 2121 N ARG A 140 -9.950 -9.055 -8.798 1.00 75.22 N ATOM 2122 CA ARG A 140 -9.297 -10.273 -9.347 1.00 33.53 C ATOM 2123 C ARG A 140 -9.788 -11.572 -8.641 1.00 3.23 C ATOM 2124 O ARG A 140 -9.873 -12.627 -9.267 1.00 44.34 O ATOM 2125 CB ARG A 140 -7.748 -10.175 -9.261 1.00 13.31 C ATOM 2126 CG ARG A 140 -7.181 -10.122 -7.826 1.00 32.34 C ATOM 2127 CD ARG A 140 -5.667 -10.374 -7.767 1.00 52.23 C ATOM 2128 NE ARG A 140 -4.909 -9.414 -8.576 1.00 61.14 N ATOM 2129 CZ ARG A 140 -3.807 -9.674 -9.237 1.00 55.11 C ATOM 2130 NH1 ARG A 140 -3.269 -10.860 -9.219 1.00 45.10 N ATOM 2131 NH2 ARG A 140 -3.258 -8.738 -9.923 1.00 55.23 N ATOM 0 H ARG A 140 -9.309 -8.407 -8.340 1.00 75.22 H new ATOM 0 HA ARG A 140 -9.587 -10.331 -10.396 1.00 33.53 H new ATOM 0 HB2 ARG A 140 -7.315 -11.032 -9.776 1.00 13.31 H new ATOM 0 HB3 ARG A 140 -7.424 -9.283 -9.798 1.00 13.31 H new ATOM 0 HG2 ARG A 140 -7.398 -9.146 -7.392 1.00 32.34 H new ATOM 0 HG3 ARG A 140 -7.691 -10.865 -7.212 1.00 32.34 H new ATOM 0 HD2 ARG A 140 -5.332 -10.317 -6.731 1.00 52.23 H new ATOM 0 HD3 ARG A 140 -5.456 -11.385 -8.115 1.00 52.23 H new ATOM 0 HE ARG A 140 -5.270 -8.462 -8.629 1.00 61.14 H new ATOM 0 HH11 ARG A 140 -3.705 -11.610 -8.683 1.00 45.10 H new ATOM 0 HH12 ARG A 140 -2.411 -11.039 -9.741 1.00 45.10 H new ATOM 0 HH21 ARG A 140 -3.679 -7.809 -9.948 1.00 55.23 H new ATOM 0 HH22 ARG A 140 -2.400 -8.923 -10.443 1.00 55.23 H new ATOM 2145 N TYR A 141 -10.124 -11.473 -7.336 1.00 43.42 N ATOM 2146 CA TYR A 141 -10.535 -12.643 -6.520 1.00 55.25 C ATOM 2147 C TYR A 141 -12.065 -12.924 -6.573 1.00 34.53 C ATOM 2148 O TYR A 141 -12.484 -14.057 -6.308 1.00 44.21 O ATOM 2149 CB TYR A 141 -10.074 -12.459 -5.054 1.00 73.44 C ATOM 2150 CG TYR A 141 -8.543 -12.487 -4.844 1.00 44.05 C ATOM 2151 CD1 TYR A 141 -7.814 -13.678 -4.963 1.00 4.21 C ATOM 2152 CD2 TYR A 141 -7.835 -11.342 -4.482 1.00 62.34 C ATOM 2153 CE1 TYR A 141 -6.449 -13.711 -4.723 1.00 60.31 C ATOM 2154 CE2 TYR A 141 -6.480 -11.370 -4.249 1.00 41.35 C ATOM 2155 CZ TYR A 141 -5.786 -12.556 -4.367 1.00 71.41 C ATOM 2156 OH TYR A 141 -4.427 -12.582 -4.136 1.00 72.42 O ATOM 0 H TYR A 141 -10.119 -10.592 -6.821 1.00 43.42 H new ATOM 0 HA TYR A 141 -10.046 -13.514 -6.956 1.00 55.25 H new ATOM 0 HB2 TYR A 141 -10.459 -11.509 -4.684 1.00 73.44 H new ATOM 0 HB3 TYR A 141 -10.524 -13.244 -4.446 1.00 73.44 H new ATOM 0 HD1 TYR A 141 -8.325 -14.586 -5.247 1.00 4.21 H new ATOM 0 HD2 TYR A 141 -8.366 -10.407 -4.382 1.00 62.34 H new ATOM 0 HE1 TYR A 141 -5.906 -14.640 -4.815 1.00 60.31 H new ATOM 0 HE2 TYR A 141 -5.960 -10.464 -3.974 1.00 41.35 H new ATOM 0 HH TYR A 141 -4.119 -11.683 -3.896 1.00 72.42 H new ATOM 2166 N GLY A 142 -12.893 -11.907 -6.897 1.00 73.43 N ATOM 2167 CA GLY A 142 -14.362 -12.108 -6.995 1.00 34.15 C ATOM 2168 C GLY A 142 -15.201 -10.819 -7.037 1.00 5.24 C ATOM 2169 O GLY A 142 -16.435 -10.894 -7.011 1.00 55.12 O ATOM 0 H GLY A 142 -12.581 -10.956 -7.092 1.00 73.43 H new ATOM 0 HA2 GLY A 142 -14.573 -12.689 -7.893 1.00 34.15 H new ATOM 0 HA3 GLY A 142 -14.688 -12.706 -6.144 1.00 34.15 H new ATOM 2173 N ARG A 143 -14.528 -9.652 -7.123 1.00 72.44 N ATOM 2174 CA ARG A 143 -15.156 -8.300 -7.180 1.00 14.44 C ATOM 2175 C ARG A 143 -16.071 -8.002 -5.958 1.00 14.04 C ATOM 2176 O ARG A 143 -15.604 -7.474 -4.941 1.00 43.31 O ATOM 2177 CB ARG A 143 -15.898 -8.046 -8.535 1.00 14.03 C ATOM 2178 CG ARG A 143 -15.107 -8.425 -9.812 1.00 62.45 C ATOM 2179 CD ARG A 143 -15.725 -7.854 -11.100 1.00 73.44 C ATOM 2180 NE ARG A 143 -15.552 -6.389 -11.195 1.00 71.34 N ATOM 2181 CZ ARG A 143 -16.340 -5.569 -11.851 1.00 11.54 C ATOM 2182 NH1 ARG A 143 -17.458 -5.975 -12.365 1.00 25.45 N ATOM 2183 NH2 ARG A 143 -16.013 -4.326 -11.948 1.00 12.24 N ATOM 0 H ARG A 143 -13.509 -9.615 -7.156 1.00 72.44 H new ATOM 0 HA ARG A 143 -14.331 -7.589 -7.126 1.00 14.44 H new ATOM 0 HB2 ARG A 143 -16.832 -8.607 -8.528 1.00 14.03 H new ATOM 0 HB3 ARG A 143 -16.161 -6.990 -8.592 1.00 14.03 H new ATOM 0 HG2 ARG A 143 -14.083 -8.064 -9.717 1.00 62.45 H new ATOM 0 HG3 ARG A 143 -15.057 -9.511 -9.891 1.00 62.45 H new ATOM 0 HD2 ARG A 143 -15.264 -8.330 -11.965 1.00 73.44 H new ATOM 0 HD3 ARG A 143 -16.787 -8.096 -11.131 1.00 73.44 H new ATOM 0 HE ARG A 143 -14.753 -5.981 -10.710 1.00 71.34 H new ATOM 0 HH11 ARG A 143 -17.742 -6.950 -12.264 1.00 25.45 H new ATOM 0 HH12 ARG A 143 -18.054 -5.320 -12.871 1.00 25.45 H new ATOM 0 HH21 ARG A 143 -15.151 -3.990 -11.518 1.00 12.24 H new ATOM 0 HH22 ARG A 143 -16.616 -3.678 -12.455 1.00 12.24 H new ATOM 2197 N LEU A 144 -17.374 -8.343 -6.063 1.00 22.54 N ATOM 2198 CA LEU A 144 -18.370 -8.097 -4.995 1.00 61.35 C ATOM 2199 C LEU A 144 -18.930 -9.441 -4.475 1.00 32.51 C ATOM 2200 O LEU A 144 -19.680 -10.125 -5.184 1.00 75.42 O ATOM 2201 CB LEU A 144 -19.546 -7.193 -5.494 1.00 63.22 C ATOM 2202 CG LEU A 144 -19.213 -5.705 -5.895 1.00 75.22 C ATOM 2203 CD1 LEU A 144 -18.516 -5.616 -7.271 1.00 33.23 C ATOM 2204 CD2 LEU A 144 -20.487 -4.813 -5.851 1.00 55.45 C ATOM 0 H LEU A 144 -17.765 -8.796 -6.889 1.00 22.54 H new ATOM 0 HA LEU A 144 -17.863 -7.571 -4.186 1.00 61.35 H new ATOM 0 HB2 LEU A 144 -19.998 -7.679 -6.358 1.00 63.22 H new ATOM 0 HB3 LEU A 144 -20.303 -7.167 -4.711 1.00 63.22 H new ATOM 0 HG LEU A 144 -18.509 -5.324 -5.155 1.00 75.22 H new ATOM 0 HD11 LEU A 144 -18.306 -4.572 -7.506 1.00 33.23 H new ATOM 0 HD12 LEU A 144 -17.582 -6.177 -7.243 1.00 33.23 H new ATOM 0 HD13 LEU A 144 -19.168 -6.036 -8.037 1.00 33.23 H new ATOM 0 HD21 LEU A 144 -20.227 -3.793 -6.132 1.00 55.45 H new ATOM 0 HD22 LEU A 144 -21.229 -5.203 -6.548 1.00 55.45 H new ATOM 0 HD23 LEU A 144 -20.899 -4.817 -4.842 1.00 55.45 H new ATOM 2216 N GLU A 145 -18.533 -9.832 -3.250 1.00 50.12 N ATOM 2217 CA GLU A 145 -19.156 -10.966 -2.527 1.00 60.20 C ATOM 2218 C GLU A 145 -20.420 -10.489 -1.769 1.00 42.55 C ATOM 2219 O GLU A 145 -21.415 -11.213 -1.669 1.00 34.42 O ATOM 2220 CB GLU A 145 -18.111 -11.681 -1.600 1.00 65.51 C ATOM 2221 CG GLU A 145 -17.151 -10.767 -0.769 1.00 72.21 C ATOM 2222 CD GLU A 145 -17.795 -10.064 0.443 1.00 53.04 C ATOM 2223 OE1 GLU A 145 -18.147 -10.757 1.418 1.00 53.22 O ATOM 2224 OE2 GLU A 145 -17.955 -8.822 0.425 1.00 32.10 O ATOM 0 H GLU A 145 -17.779 -9.379 -2.734 1.00 50.12 H new ATOM 0 HA GLU A 145 -19.484 -11.716 -3.246 1.00 60.20 H new ATOM 0 HB2 GLU A 145 -18.657 -12.319 -0.905 1.00 65.51 H new ATOM 0 HB3 GLU A 145 -17.500 -12.336 -2.221 1.00 65.51 H new ATOM 0 HG2 GLU A 145 -16.316 -11.372 -0.416 1.00 72.21 H new ATOM 0 HG3 GLU A 145 -16.736 -10.007 -1.431 1.00 72.21 H new ATOM 2231 N HIS A 146 -20.347 -9.250 -1.252 1.00 43.34 N ATOM 2232 CA HIS A 146 -21.466 -8.500 -0.634 1.00 3.11 C ATOM 2233 C HIS A 146 -21.277 -6.984 -0.934 1.00 42.42 C ATOM 2234 O HIS A 146 -20.440 -6.623 -1.774 1.00 1.33 O ATOM 2235 CB HIS A 146 -21.518 -8.745 0.906 1.00 41.34 C ATOM 2236 CG HIS A 146 -21.847 -10.167 1.313 1.00 42.11 C ATOM 2237 ND1 HIS A 146 -20.992 -10.961 2.047 1.00 54.01 N ATOM 2238 CD2 HIS A 146 -22.960 -10.922 1.106 1.00 33.04 C ATOM 2239 CE1 HIS A 146 -21.549 -12.134 2.263 1.00 62.32 C ATOM 2240 NE2 HIS A 146 -22.741 -12.141 1.706 1.00 61.13 N ATOM 0 H HIS A 146 -19.476 -8.719 -1.251 1.00 43.34 H new ATOM 0 HA HIS A 146 -22.409 -8.847 -1.056 1.00 3.11 H new ATOM 0 HB2 HIS A 146 -20.554 -8.473 1.336 1.00 41.34 H new ATOM 0 HB3 HIS A 146 -22.261 -8.076 1.341 1.00 41.34 H new ATOM 0 HD1 HIS A 146 -20.067 -10.682 2.374 1.00 54.01 H new ATOM 0 HD2 HIS A 146 -23.849 -10.621 0.571 1.00 33.04 H new ATOM 0 HE1 HIS A 146 -21.102 -12.953 2.806 1.00 62.32 H new ATOM 2249 N HIS A 147 -22.071 -6.120 -0.252 1.00 41.43 N ATOM 2250 CA HIS A 147 -21.957 -4.629 -0.299 1.00 40.55 C ATOM 2251 C HIS A 147 -22.399 -4.004 -1.651 1.00 72.03 C ATOM 2252 O HIS A 147 -22.366 -4.648 -2.703 1.00 43.10 O ATOM 2253 CB HIS A 147 -20.523 -4.138 0.065 1.00 10.24 C ATOM 2254 CG HIS A 147 -20.083 -4.491 1.460 1.00 44.03 C ATOM 2255 ND1 HIS A 147 -20.386 -3.715 2.559 1.00 22.42 N ATOM 2256 CD2 HIS A 147 -19.364 -5.539 1.932 1.00 53.40 C ATOM 2257 CE1 HIS A 147 -19.875 -4.263 3.637 1.00 11.45 C ATOM 2258 NE2 HIS A 147 -19.252 -5.369 3.287 1.00 14.31 N ATOM 0 H HIS A 147 -22.823 -6.440 0.358 1.00 41.43 H new ATOM 0 HA HIS A 147 -22.658 -4.279 0.459 1.00 40.55 H new ATOM 0 HB2 HIS A 147 -19.815 -4.564 -0.646 1.00 10.24 H new ATOM 0 HB3 HIS A 147 -20.481 -3.055 -0.053 1.00 10.24 H new ATOM 0 HD2 HIS A 147 -18.957 -6.353 1.351 1.00 53.40 H new ATOM 0 HE1 HIS A 147 -19.952 -3.873 4.641 1.00 11.45 H new ATOM 0 HE2 HIS A 147 -18.764 -5.999 3.923 1.00 14.31 H new ATOM 2267 N HIS A 148 -22.817 -2.725 -1.582 1.00 43.23 N ATOM 2268 CA HIS A 148 -23.145 -1.894 -2.766 1.00 21.33 C ATOM 2269 C HIS A 148 -23.134 -0.392 -2.384 1.00 30.13 C ATOM 2270 O HIS A 148 -23.647 -0.021 -1.318 1.00 35.00 O ATOM 2271 CB HIS A 148 -24.506 -2.303 -3.407 1.00 70.23 C ATOM 2272 CG HIS A 148 -25.690 -2.319 -2.466 1.00 72.44 C ATOM 2273 ND1 HIS A 148 -26.536 -1.245 -2.292 1.00 32.22 N ATOM 2274 CD2 HIS A 148 -26.194 -3.310 -1.681 1.00 13.30 C ATOM 2275 CE1 HIS A 148 -27.496 -1.566 -1.447 1.00 40.32 C ATOM 2276 NE2 HIS A 148 -27.316 -2.811 -1.063 1.00 64.13 N ATOM 0 H HIS A 148 -22.939 -2.232 -0.697 1.00 43.23 H new ATOM 0 HA HIS A 148 -22.378 -2.068 -3.520 1.00 21.33 H new ATOM 0 HB2 HIS A 148 -24.723 -1.616 -4.225 1.00 70.23 H new ATOM 0 HB3 HIS A 148 -24.398 -3.296 -3.844 1.00 70.23 H new ATOM 0 HD2 HIS A 148 -25.788 -4.304 -1.565 1.00 13.30 H new ATOM 0 HE1 HIS A 148 -28.296 -0.916 -1.124 1.00 40.32 H new ATOM 0 HE2 HIS A 148 -27.912 -3.323 -0.413 1.00 64.13 H new ATOM 2285 N HIS A 149 -22.555 0.445 -3.276 1.00 30.11 N ATOM 2286 CA HIS A 149 -22.356 1.904 -3.064 1.00 5.30 C ATOM 2287 C HIS A 149 -21.447 2.207 -1.840 1.00 63.13 C ATOM 2288 O HIS A 149 -21.884 2.791 -0.839 1.00 21.51 O ATOM 2289 CB HIS A 149 -23.707 2.678 -3.005 1.00 61.30 C ATOM 2290 CG HIS A 149 -24.386 2.810 -4.343 1.00 24.30 C ATOM 2291 ND1 HIS A 149 -24.285 3.945 -5.121 1.00 1.01 N ATOM 2292 CD2 HIS A 149 -25.167 1.955 -5.039 1.00 34.43 C ATOM 2293 CE1 HIS A 149 -24.970 3.781 -6.230 1.00 44.43 C ATOM 2294 NE2 HIS A 149 -25.514 2.583 -6.209 1.00 13.13 N ATOM 0 H HIS A 149 -22.206 0.124 -4.179 1.00 30.11 H new ATOM 0 HA HIS A 149 -21.823 2.275 -3.939 1.00 5.30 H new ATOM 0 HB2 HIS A 149 -24.379 2.167 -2.315 1.00 61.30 H new ATOM 0 HB3 HIS A 149 -23.528 3.673 -2.598 1.00 61.30 H new ATOM 0 HD2 HIS A 149 -25.463 0.963 -4.732 1.00 34.43 H new ATOM 0 HE1 HIS A 149 -25.070 4.506 -7.024 1.00 44.43 H new ATOM 0 HE2 HIS A 149 -26.099 2.185 -6.944 1.00 13.13 H new ATOM 2303 N HIS A 150 -20.183 1.762 -1.951 1.00 25.33 N ATOM 2304 CA HIS A 150 -19.111 2.045 -0.973 1.00 10.43 C ATOM 2305 C HIS A 150 -17.724 1.767 -1.607 1.00 54.42 C ATOM 2306 O HIS A 150 -17.518 0.723 -2.232 1.00 71.42 O ATOM 2307 CB HIS A 150 -19.289 1.214 0.330 1.00 23.10 C ATOM 2308 CG HIS A 150 -18.228 1.491 1.367 1.00 3.32 C ATOM 2309 ND1 HIS A 150 -17.247 0.581 1.704 1.00 15.42 N ATOM 2310 CD2 HIS A 150 -17.988 2.590 2.125 1.00 65.43 C ATOM 2311 CE1 HIS A 150 -16.454 1.105 2.615 1.00 60.14 C ATOM 2312 NE2 HIS A 150 -16.880 2.319 2.887 1.00 72.13 N ATOM 0 H HIS A 150 -19.870 1.187 -2.733 1.00 25.33 H new ATOM 0 HA HIS A 150 -19.175 3.099 -0.702 1.00 10.43 H new ATOM 0 HB2 HIS A 150 -20.269 1.428 0.757 1.00 23.10 H new ATOM 0 HB3 HIS A 150 -19.274 0.153 0.080 1.00 23.10 H new ATOM 0 HD2 HIS A 150 -18.561 3.505 2.128 1.00 65.43 H new ATOM 0 HE1 HIS A 150 -15.599 0.620 3.063 1.00 60.14 H new ATOM 0 HE2 HIS A 150 -16.454 2.958 3.558 1.00 72.13 H new ATOM 2321 N HIS A 151 -16.777 2.711 -1.430 1.00 71.34 N ATOM 2322 CA HIS A 151 -15.381 2.571 -1.919 1.00 71.11 C ATOM 2323 C HIS A 151 -14.387 2.486 -0.745 1.00 42.30 C ATOM 2324 O HIS A 151 -14.602 3.069 0.326 1.00 1.21 O ATOM 2325 CB HIS A 151 -15.026 3.740 -2.882 1.00 52.52 C ATOM 2326 CG HIS A 151 -15.152 5.127 -2.288 1.00 30.01 C ATOM 2327 ND1 HIS A 151 -16.292 5.896 -2.404 1.00 43.44 N ATOM 2328 CD2 HIS A 151 -14.265 5.894 -1.600 1.00 34.25 C ATOM 2329 CE1 HIS A 151 -16.106 7.056 -1.811 1.00 13.32 C ATOM 2330 NE2 HIS A 151 -14.890 7.082 -1.320 1.00 64.32 N ATOM 0 H HIS A 151 -16.953 3.591 -0.946 1.00 71.34 H new ATOM 0 HA HIS A 151 -15.303 1.638 -2.476 1.00 71.11 H new ATOM 0 HB2 HIS A 151 -14.002 3.604 -3.231 1.00 52.52 H new ATOM 0 HB3 HIS A 151 -15.672 3.677 -3.757 1.00 52.52 H new ATOM 0 HD2 HIS A 151 -13.257 5.619 -1.326 1.00 34.25 H new ATOM 0 HE1 HIS A 151 -16.832 7.852 -1.741 1.00 13.32 H new ATOM 0 HE2 HIS A 151 -14.475 7.862 -0.811 1.00 64.32 H new TER 2339 HIS A 151