USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot -149:sc= -0.465 USER MOD Set 1.2: A 139 TYR OH : rot -123:sc= -0.34 USER MOD Set 2.1: A 138 HIS : no HE2:sc= -0.66 X(o=-3.7,f=-3.5!) USER MOD Set 2.2: A 141 GLN : amide:sc= -3.05! K(o=-3.7!,f=-0.81) USER MOD Set 3.1: A 30 CYS SG : rot 153:sc= 0.669 USER MOD Set 3.2: A 32 ASN : amide:sc= -3.13! C(o=-6.7!,f=-4.4!) USER MOD Set 3.3: A 35 HIS : no HE2:sc= -4.16! C(o=-6.7!,f=-11!) USER MOD Set 3.4: A 127 LYS NZ :NH3+ -139:sc= -0.0274 (180deg=-1.59!) USER MOD Set 4.1: A 113 SER OG : rot 110:sc= 0.0506 USER MOD Set 4.2: A 116 HIS : no HE2:sc= -2.56 X(o=-3.1,f=-2.9!) USER MOD Set 4.3: A 119 LYS NZ :NH3+ -151:sc= -0.581 (180deg=0) USER MOD Set 5.1: A 90 SER OG : rot -67:sc= 2.09 USER MOD Set 5.2: A 92 THR OG1 : rot 41:sc= 1.32 USER MOD Set 5.3: A 97 CYS SG : rot -171:sc= 1.34 USER MOD Set 6.1: A 77 GLN : amide:sc= -3.3! K(o=-8.6!,f=-2.5) USER MOD Set 6.2: A 91 GLN : amide:sc= -5.29! C(o=-8.6!,f=-2.5!) USER MOD Set 7.1: A 72 SER OG : rot -175:sc= 1.91 USER MOD Set 7.2: A 75 THR OG1 : rot 162:sc= 2.3 USER MOD Set 8.1: A 31 SER OG : rot -25:sc= 1.34 USER MOD Set 8.2: A 108 TYR OH : rot -7:sc= 1.09 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -150:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= 0.629 K(o=0.63,f=-0.19) USER MOD Single : A 55 HIS : no HD1:sc= -4.91! C(o=-4.9!,f=-4.7!) USER MOD Single : A 57 GLN : amide:sc= 0.358 X(o=0.36,f=0) USER MOD Single : A 59 GLN : amide:sc= -1.86! C(o=-1.9!,f=-3.4!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0.139 USER MOD Single : A 69 TYR OH : rot 166:sc= 0.89 USER MOD Single : A 71 LYS NZ :NH3+ 153:sc= 0.287 (180deg=-0.255) USER MOD Single : A 73 THR OG1 : rot 180:sc=-0.00578 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -163:sc= -1.96 (180deg=-2.48) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0128 USER MOD Single : A 88 TYR OH : rot 27:sc= 1.32 USER MOD Single : A 94 ASN : amide:sc= -0.385 K(o=-0.38,f=-8.9!) USER MOD Single : A 106 ASN : amide:sc= 0.0251 X(o=0.025,f=0) USER MOD Single : A 107 HIS : no HD1:sc= -0.0673 X(o=-0.067,f=-0.18) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 111 TYR OH : rot -110:sc= -0.0926 USER MOD Single : A 114 LYS NZ :NH3+ -164:sc= -0.0606 (180deg=-0.346) USER MOD Single : A 115 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0488) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.354) USER MOD Single : A 128 ASN : amide:sc= 0.2 X(o=0.2,f=0) USER MOD Single : A 130 SER OG : rot 92:sc= 0.0361 USER MOD Single : A 131 CYS SG : rot 180:sc= -3.57 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 36:sc= 1.01 USER MOD Single : A 142 LYS NZ :NH3+ -140:sc= -0.0527 (180deg=-0.769) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -8.886 5.362 2.228 1.00 0.00 N ATOM 22 CA CYS A 30 -9.243 3.961 1.968 1.00 0.00 C ATOM 23 C CYS A 30 -10.772 3.740 1.983 1.00 0.00 C ATOM 24 O CYS A 30 -11.549 4.692 1.962 1.00 0.00 O ATOM 25 CB CYS A 30 -8.566 3.076 3.030 1.00 0.00 C ATOM 26 SG CYS A 30 -9.039 3.510 4.748 1.00 0.00 S ATOM 0 HA CYS A 30 -8.894 3.693 0.971 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -8.824 2.034 2.842 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.484 3.160 2.927 1.00 0.00 H new ATOM 0 HG CYS A 30 -8.938 2.458 5.505 1.00 0.00 H new ATOM 27 N SER A 31 -11.157 2.514 1.669 1.00 0.00 N ATOM 28 CA SER A 31 -12.520 1.997 1.954 1.00 0.00 C ATOM 29 C SER A 31 -12.532 0.981 3.114 1.00 0.00 C ATOM 30 O SER A 31 -13.488 0.232 3.323 1.00 0.00 O ATOM 31 CB SER A 31 -13.152 1.335 0.735 1.00 0.00 C ATOM 32 OG SER A 31 -13.101 2.204 -0.399 1.00 0.00 O ATOM 0 H SER A 31 -10.548 1.837 1.210 1.00 0.00 H new ATOM 0 HA SER A 31 -13.103 2.874 2.236 1.00 0.00 H new ATOM 0 HB2 SER A 31 -12.630 0.405 0.510 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.188 1.075 0.953 1.00 0.00 H new ATOM 0 HG SER A 31 -13.060 3.135 -0.096 1.00 0.00 H new ATOM 33 N ASN A 32 -11.481 1.041 3.919 1.00 0.00 N ATOM 34 CA ASN A 32 -11.316 0.221 5.131 1.00 0.00 C ATOM 35 C ASN A 32 -11.852 1.036 6.322 1.00 0.00 C ATOM 36 O ASN A 32 -12.279 2.175 6.135 1.00 0.00 O ATOM 37 CB ASN A 32 -9.818 -0.129 5.178 1.00 0.00 C ATOM 38 CG ASN A 32 -9.025 0.155 6.462 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.661 1.272 6.810 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.748 -0.882 7.210 1.00 0.00 N ATOM 0 H ASN A 32 -10.697 1.672 3.752 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.875 -0.715 5.152 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.722 -1.193 4.961 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.329 0.407 4.365 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.230 -0.759 8.080 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -9.050 -1.813 6.923 1.00 0.00 H new ATOM 41 N GLY A 33 -12.005 0.359 7.472 1.00 0.00 N ATOM 42 CA GLY A 33 -12.338 0.978 8.796 1.00 0.00 C ATOM 43 C GLY A 33 -11.986 2.469 8.862 1.00 0.00 C ATOM 44 O GLY A 33 -12.808 3.322 9.190 1.00 0.00 O ATOM 0 H GLY A 33 -11.902 -0.654 7.524 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.403 0.852 8.993 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.803 0.448 9.584 1.00 0.00 H new ATOM 45 N GLY A 34 -10.697 2.710 8.602 1.00 0.00 N ATOM 46 CA GLY A 34 -10.189 4.009 8.165 1.00 0.00 C ATOM 47 C GLY A 34 -8.795 4.344 8.701 1.00 0.00 C ATOM 48 O GLY A 34 -8.603 4.815 9.822 1.00 0.00 O ATOM 0 H GLY A 34 -9.971 1.999 8.691 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.163 4.030 7.076 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.885 4.785 8.482 1.00 0.00 H new ATOM 49 N HIS A 35 -7.834 4.016 7.839 1.00 0.00 N ATOM 50 CA HIS A 35 -6.407 4.257 8.096 1.00 0.00 C ATOM 51 C HIS A 35 -5.760 4.959 6.891 1.00 0.00 C ATOM 52 O HIS A 35 -6.305 4.943 5.791 1.00 0.00 O ATOM 53 CB HIS A 35 -5.688 2.937 8.406 1.00 0.00 C ATOM 54 CG HIS A 35 -6.322 2.154 9.558 1.00 0.00 C ATOM 55 ND1 HIS A 35 -7.286 1.247 9.408 1.00 0.00 N ATOM 56 CD2 HIS A 35 -6.127 2.352 10.851 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.696 0.883 10.610 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.985 1.576 11.497 1.00 0.00 N ATOM 0 H HIS A 35 -8.019 3.574 6.939 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.313 4.909 8.965 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.686 2.314 7.511 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.647 3.148 8.650 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -7.645 0.895 8.520 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.405 3.020 11.296 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -8.465 0.158 10.832 1.00 0.00 H new ATOM 59 N PHE A 36 -4.532 5.414 7.100 1.00 0.00 N ATOM 60 CA PHE A 36 -3.805 6.226 6.104 1.00 0.00 C ATOM 61 C PHE A 36 -2.491 5.536 5.780 1.00 0.00 C ATOM 62 O PHE A 36 -1.768 5.136 6.695 1.00 0.00 O ATOM 63 CB PHE A 36 -3.528 7.631 6.650 1.00 0.00 C ATOM 64 CG PHE A 36 -4.800 8.454 6.824 1.00 0.00 C ATOM 65 CD1 PHE A 36 -5.389 9.075 5.702 1.00 0.00 C ATOM 66 CD2 PHE A 36 -5.414 8.543 8.098 1.00 0.00 C ATOM 67 CE1 PHE A 36 -6.608 9.772 5.841 1.00 0.00 C ATOM 68 CE2 PHE A 36 -6.626 9.235 8.242 1.00 0.00 C ATOM 69 CZ PHE A 36 -7.219 9.845 7.111 1.00 0.00 C ATOM 0 H PHE A 36 -4.005 5.238 7.955 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.414 6.322 5.205 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -3.018 7.550 7.610 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.852 8.153 5.973 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.907 9.017 4.737 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -4.950 8.079 8.956 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -7.068 10.244 4.985 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.103 9.302 9.209 1.00 0.00 H new ATOM 0 HZ PHE A 36 -8.154 10.375 7.222 1.00 0.00 H new ATOM 70 N LEU A 37 -2.227 5.398 4.485 1.00 0.00 N ATOM 71 CA LEU A 37 -1.027 4.684 3.998 1.00 0.00 C ATOM 72 C LEU A 37 0.263 5.416 4.358 1.00 0.00 C ATOM 73 O LEU A 37 0.590 6.463 3.810 1.00 0.00 O ATOM 74 CB LEU A 37 -1.074 4.369 2.507 1.00 0.00 C ATOM 75 CG LEU A 37 -2.083 3.242 2.270 1.00 0.00 C ATOM 76 CD1 LEU A 37 -3.397 3.823 1.748 1.00 0.00 C ATOM 77 CD2 LEU A 37 -1.522 2.228 1.264 1.00 0.00 C ATOM 0 H LEU A 37 -2.822 5.768 3.744 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.031 3.727 4.520 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.361 5.257 1.943 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.087 4.072 2.153 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.268 2.731 3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.111 3.016 1.581 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.803 4.521 2.480 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.216 4.347 0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.250 1.432 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.319 2.729 0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.598 1.802 1.654 1.00 0.00 H new ATOM 78 N ARG A 38 0.811 4.933 5.470 1.00 0.00 N ATOM 79 CA ARG A 38 2.068 5.425 6.034 1.00 0.00 C ATOM 80 C ARG A 38 3.231 4.493 5.673 1.00 0.00 C ATOM 81 O ARG A 38 3.214 3.291 5.970 1.00 0.00 O ATOM 82 CB ARG A 38 1.910 5.600 7.542 1.00 0.00 C ATOM 83 CG ARG A 38 3.158 6.235 8.161 1.00 0.00 C ATOM 84 CD ARG A 38 2.961 6.988 9.480 1.00 0.00 C ATOM 85 NE ARG A 38 2.422 6.129 10.546 1.00 0.00 N ATOM 86 CZ ARG A 38 1.221 6.211 11.107 1.00 0.00 C ATOM 87 NH1 ARG A 38 0.174 6.699 10.452 1.00 0.00 N ATOM 88 NH2 ARG A 38 0.970 5.507 12.200 1.00 0.00 N ATOM 0 H ARG A 38 0.390 4.179 6.013 1.00 0.00 H new ATOM 0 HA ARG A 38 2.308 6.397 5.604 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.041 6.224 7.749 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.724 4.631 8.005 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.895 5.449 8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.585 6.926 7.434 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.915 7.405 9.802 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.285 7.827 9.318 1.00 0.00 H new ATOM 0 HE ARG A 38 3.036 5.392 10.891 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.280 7.024 9.491 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.736 6.749 10.910 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.695 4.911 12.601 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.052 5.560 12.641 1.00 0.00 H new ATOM 89 N ILE A 39 4.236 5.138 5.105 1.00 0.00 N ATOM 90 CA ILE A 39 5.514 4.502 4.749 1.00 0.00 C ATOM 91 C ILE A 39 6.538 5.122 5.702 1.00 0.00 C ATOM 92 O ILE A 39 6.975 6.261 5.561 1.00 0.00 O ATOM 93 CB ILE A 39 5.848 4.718 3.264 1.00 0.00 C ATOM 94 CG1 ILE A 39 4.741 4.271 2.295 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.104 3.917 2.896 1.00 0.00 C ATOM 96 CD1 ILE A 39 3.637 5.319 2.059 1.00 0.00 C ATOM 0 H ILE A 39 4.197 6.130 4.871 1.00 0.00 H new ATOM 0 HA ILE A 39 5.494 3.418 4.861 1.00 0.00 H new ATOM 0 HB ILE A 39 5.982 5.794 3.156 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.195 4.018 1.337 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.283 3.360 2.681 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.339 4.072 1.843 1.00 0.00 H new ATOM 0 HG22 ILE A 39 7.942 4.252 3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 39 6.925 2.857 3.076 1.00 0.00 H new ATOM 0 HD11 ILE A 39 2.899 4.920 1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.152 5.556 3.006 1.00 0.00 H new ATOM 0 HD13 ILE A 39 4.078 6.224 1.640 1.00 0.00 H new ATOM 97 N LEU A 40 6.672 4.383 6.793 1.00 0.00 N ATOM 98 CA LEU A 40 7.370 4.818 8.010 1.00 0.00 C ATOM 99 C LEU A 40 8.849 5.125 7.777 1.00 0.00 C ATOM 100 O LEU A 40 9.518 4.271 7.196 1.00 0.00 O ATOM 101 CB LEU A 40 7.294 3.746 9.113 1.00 0.00 C ATOM 102 CG LEU A 40 5.972 3.566 9.856 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.720 4.780 10.732 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.787 3.269 8.949 1.00 0.00 C ATOM 0 H LEU A 40 6.292 3.439 6.866 1.00 0.00 H new ATOM 0 HA LEU A 40 6.859 5.731 8.315 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.557 2.788 8.664 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.063 3.974 9.852 1.00 0.00 H new ATOM 0 HG LEU A 40 6.069 2.677 10.479 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.777 4.655 11.264 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.532 4.884 11.452 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.670 5.674 10.110 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.887 3.155 9.553 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.651 4.091 8.247 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.973 2.348 8.397 1.00 0.00 H new ATOM 105 N PRO A 41 9.392 6.103 8.519 1.00 0.00 N ATOM 106 CA PRO A 41 10.836 6.447 8.496 1.00 0.00 C ATOM 107 C PRO A 41 11.706 5.244 8.892 1.00 0.00 C ATOM 108 O PRO A 41 12.750 5.004 8.294 1.00 0.00 O ATOM 109 CB PRO A 41 10.964 7.613 9.475 1.00 0.00 C ATOM 110 CG PRO A 41 9.836 7.401 10.476 1.00 0.00 C ATOM 111 CD PRO A 41 8.704 6.827 9.615 1.00 0.00 C ATOM 0 HA PRO A 41 11.187 6.721 7.501 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.936 7.612 9.968 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.866 8.571 8.965 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.126 6.713 11.270 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.543 8.335 10.956 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.068 6.157 10.193 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.063 7.618 9.225 1.00 0.00 H new ATOM 112 N ASP A 42 11.113 4.383 9.727 1.00 0.00 N ATOM 113 CA ASP A 42 11.659 3.109 10.231 1.00 0.00 C ATOM 114 C ASP A 42 11.698 1.968 9.198 1.00 0.00 C ATOM 115 O ASP A 42 12.108 0.858 9.537 1.00 0.00 O ATOM 116 CB ASP A 42 10.766 2.691 11.413 1.00 0.00 C ATOM 117 CG ASP A 42 11.128 3.429 12.703 1.00 0.00 C ATOM 118 OD1 ASP A 42 10.601 4.554 12.857 1.00 0.00 O ATOM 119 OD2 ASP A 42 11.881 2.848 13.506 1.00 0.00 O ATOM 0 H ASP A 42 10.179 4.565 10.095 1.00 0.00 H new ATOM 0 HA ASP A 42 12.700 3.277 10.507 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.723 2.888 11.165 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.858 1.617 11.573 1.00 0.00 H new ATOM 120 N GLY A 43 11.252 2.237 7.978 1.00 0.00 N ATOM 121 CA GLY A 43 11.111 1.242 6.896 1.00 0.00 C ATOM 122 C GLY A 43 9.953 0.260 7.136 1.00 0.00 C ATOM 123 O GLY A 43 10.037 -0.908 6.757 1.00 0.00 O ATOM 0 H GLY A 43 10.968 3.175 7.695 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.951 1.760 5.951 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.042 0.683 6.800 1.00 0.00 H new ATOM 124 N THR A 44 8.786 0.791 7.503 1.00 0.00 N ATOM 125 CA THR A 44 7.617 -0.036 7.883 1.00 0.00 C ATOM 126 C THR A 44 6.377 0.513 7.139 1.00 0.00 C ATOM 127 O THR A 44 6.393 1.664 6.716 1.00 0.00 O ATOM 128 CB THR A 44 7.385 0.043 9.391 1.00 0.00 C ATOM 129 OG1 THR A 44 8.631 -0.006 10.091 1.00 0.00 O ATOM 130 CG2 THR A 44 6.447 -1.043 9.915 1.00 0.00 C ATOM 0 H THR A 44 8.615 1.796 7.548 1.00 0.00 H new ATOM 0 HA THR A 44 7.794 -1.077 7.614 1.00 0.00 H new ATOM 0 HB THR A 44 6.894 0.999 9.576 1.00 0.00 H new ATOM 0 HG1 THR A 44 8.467 0.047 11.056 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.325 -0.930 10.992 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.476 -0.951 9.428 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.870 -2.024 9.699 1.00 0.00 H new ATOM 131 N VAL A 45 5.394 -0.325 6.857 1.00 0.00 N ATOM 132 CA VAL A 45 4.127 0.173 6.292 1.00 0.00 C ATOM 133 C VAL A 45 2.953 -0.151 7.230 1.00 0.00 C ATOM 134 O VAL A 45 2.609 -1.303 7.498 1.00 0.00 O ATOM 135 CB VAL A 45 3.910 -0.233 4.824 1.00 0.00 C ATOM 136 CG1 VAL A 45 2.608 0.306 4.232 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.027 0.342 3.950 1.00 0.00 C ATOM 0 H VAL A 45 5.434 -1.334 7.002 1.00 0.00 H new ATOM 0 HA VAL A 45 4.187 1.260 6.239 1.00 0.00 H new ATOM 0 HB VAL A 45 3.889 -1.323 4.829 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.518 -0.018 3.195 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.763 -0.075 4.805 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.613 1.395 4.273 1.00 0.00 H new ATOM 0 HG21 VAL A 45 4.865 0.049 2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.024 1.429 4.025 1.00 0.00 H new ATOM 0 HG23 VAL A 45 5.989 -0.043 4.289 1.00 0.00 H new ATOM 138 N ASP A 46 2.427 0.945 7.768 1.00 0.00 N ATOM 139 CA ASP A 46 1.298 0.912 8.722 1.00 0.00 C ATOM 140 C ASP A 46 0.207 1.906 8.309 1.00 0.00 C ATOM 141 O ASP A 46 0.429 2.777 7.467 1.00 0.00 O ATOM 142 CB ASP A 46 1.728 1.266 10.148 1.00 0.00 C ATOM 143 CG ASP A 46 2.820 0.365 10.717 1.00 0.00 C ATOM 144 OD1 ASP A 46 4.003 0.729 10.530 1.00 0.00 O ATOM 145 OD2 ASP A 46 2.464 -0.634 11.371 1.00 0.00 O ATOM 0 H ASP A 46 2.763 1.886 7.562 1.00 0.00 H new ATOM 0 HA ASP A 46 0.921 -0.111 8.703 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.080 2.298 10.163 1.00 0.00 H new ATOM 0 HB3 ASP A 46 0.856 1.217 10.801 1.00 0.00 H new ATOM 146 N GLY A 47 -1.002 1.574 8.733 1.00 0.00 N ATOM 147 CA GLY A 47 -2.134 2.513 8.742 1.00 0.00 C ATOM 148 C GLY A 47 -1.969 3.349 10.017 1.00 0.00 C ATOM 149 O GLY A 47 -0.853 3.693 10.399 1.00 0.00 O ATOM 0 H GLY A 47 -1.236 0.645 9.083 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.125 3.146 7.855 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.085 1.980 8.743 1.00 0.00 H new ATOM 150 N THR A 48 -3.066 3.528 10.733 1.00 0.00 N ATOM 151 CA THR A 48 -3.018 4.365 11.946 1.00 0.00 C ATOM 152 C THR A 48 -3.725 3.890 13.212 1.00 0.00 C ATOM 153 O THR A 48 -4.936 3.993 13.368 1.00 0.00 O ATOM 154 CB THR A 48 -3.262 5.853 11.676 1.00 0.00 C ATOM 155 OG1 THR A 48 -3.407 6.578 12.900 1.00 0.00 O ATOM 156 CG2 THR A 48 -4.500 6.113 10.797 1.00 0.00 C ATOM 0 H THR A 48 -3.978 3.125 10.516 1.00 0.00 H new ATOM 0 HA THR A 48 -1.972 4.217 12.216 1.00 0.00 H new ATOM 0 HB THR A 48 -2.384 6.201 11.132 1.00 0.00 H new ATOM 0 HG1 THR A 48 -4.000 7.345 12.757 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.618 7.186 10.643 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.372 5.620 9.833 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.387 5.718 11.292 1.00 0.00 H new ATOM 157 N ARG A 49 -2.905 3.230 14.035 1.00 0.00 N ATOM 158 CA ARG A 49 -3.151 3.119 15.488 1.00 0.00 C ATOM 159 C ARG A 49 -3.001 4.477 16.199 1.00 0.00 C ATOM 160 O ARG A 49 -3.767 4.814 17.101 1.00 0.00 O ATOM 161 CB ARG A 49 -2.146 2.170 16.158 1.00 0.00 C ATOM 162 CG ARG A 49 -2.228 0.768 15.576 1.00 0.00 C ATOM 163 CD ARG A 49 -1.587 -0.286 16.466 1.00 0.00 C ATOM 164 NE ARG A 49 -1.529 -1.549 15.700 1.00 0.00 N ATOM 165 CZ ARG A 49 -2.357 -2.584 15.803 1.00 0.00 C ATOM 166 NH1 ARG A 49 -3.447 -2.564 16.560 1.00 0.00 N ATOM 167 NH2 ARG A 49 -2.006 -3.754 15.292 1.00 0.00 N ATOM 0 H ARG A 49 -2.056 2.758 13.722 1.00 0.00 H new ATOM 0 HA ARG A 49 -4.170 2.743 15.583 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.136 2.559 16.030 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -2.340 2.132 17.230 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.274 0.510 15.413 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -1.741 0.757 14.601 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.586 0.025 16.767 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -2.167 -0.419 17.379 1.00 0.00 H new ATOM 0 HE ARG A 49 -0.773 -1.636 15.020 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.680 -1.728 17.096 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -4.051 -3.384 16.606 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -1.106 -3.856 14.823 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -2.636 -4.553 15.367 1.00 0.00 H new ATOM 168 N ASP A 50 -2.096 5.288 15.657 1.00 0.00 N ATOM 169 CA ASP A 50 -1.618 6.564 16.219 1.00 0.00 C ATOM 170 C ASP A 50 -0.781 7.249 15.140 1.00 0.00 C ATOM 171 O ASP A 50 0.381 6.893 14.907 1.00 0.00 O ATOM 172 CB ASP A 50 -0.753 6.258 17.449 1.00 0.00 C ATOM 173 CG ASP A 50 -0.408 7.537 18.223 1.00 0.00 C ATOM 174 OD1 ASP A 50 -1.223 7.913 19.094 1.00 0.00 O ATOM 175 OD2 ASP A 50 0.629 8.151 17.880 1.00 0.00 O ATOM 0 H ASP A 50 -1.648 5.068 14.767 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.443 7.210 16.519 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.282 5.566 18.104 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.165 5.762 17.135 1.00 0.00 H new ATOM 176 N ARG A 51 -1.405 8.207 14.484 1.00 0.00 N ATOM 177 CA ARG A 51 -0.840 8.832 13.269 1.00 0.00 C ATOM 178 C ARG A 51 0.406 9.677 13.593 1.00 0.00 C ATOM 179 O ARG A 51 0.335 10.738 14.197 1.00 0.00 O ATOM 180 CB ARG A 51 -1.931 9.685 12.617 1.00 0.00 C ATOM 181 CG ARG A 51 -1.829 9.673 11.084 1.00 0.00 C ATOM 182 CD ARG A 51 -2.518 10.936 10.592 1.00 0.00 C ATOM 183 NE ARG A 51 -2.457 11.070 9.124 1.00 0.00 N ATOM 184 CZ ARG A 51 -3.426 11.547 8.355 1.00 0.00 C ATOM 185 NH1 ARG A 51 -4.556 12.046 8.847 1.00 0.00 N ATOM 186 NH2 ARG A 51 -3.259 11.633 7.041 1.00 0.00 N ATOM 0 H ARG A 51 -2.311 8.583 14.762 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.515 8.054 12.579 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.911 9.314 12.918 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.854 10.711 12.978 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.787 9.651 10.765 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.307 8.785 10.671 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -3.560 10.927 10.911 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.051 11.806 11.054 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.598 10.771 8.662 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.705 12.073 9.856 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.274 12.402 8.216 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.381 11.331 6.618 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.008 12.001 6.455 1.00 0.00 H new ATOM 187 N SER A 52 1.532 9.180 13.087 1.00 0.00 N ATOM 188 CA SER A 52 2.848 9.851 13.176 1.00 0.00 C ATOM 189 C SER A 52 2.977 11.127 12.328 1.00 0.00 C ATOM 190 O SER A 52 4.076 11.587 12.009 1.00 0.00 O ATOM 191 CB SER A 52 3.903 8.831 12.745 1.00 0.00 C ATOM 192 OG SER A 52 3.723 7.598 13.459 1.00 0.00 O ATOM 0 H SER A 52 1.568 8.288 12.594 1.00 0.00 H new ATOM 0 HA SER A 52 2.981 10.185 14.205 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.829 8.652 11.672 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.901 9.227 12.935 1.00 0.00 H new ATOM 0 HG SER A 52 4.403 6.952 13.174 1.00 0.00 H new ATOM 193 N ASP A 53 1.828 11.613 11.853 1.00 0.00 N ATOM 194 CA ASP A 53 1.566 12.891 11.153 1.00 0.00 C ATOM 195 C ASP A 53 2.178 13.146 9.769 1.00 0.00 C ATOM 196 O ASP A 53 1.520 13.707 8.905 1.00 0.00 O ATOM 197 CB ASP A 53 1.833 14.104 12.060 1.00 0.00 C ATOM 198 CG ASP A 53 0.874 14.226 13.248 1.00 0.00 C ATOM 199 OD1 ASP A 53 -0.341 14.009 13.043 1.00 0.00 O ATOM 200 OD2 ASP A 53 1.373 14.618 14.324 1.00 0.00 O ATOM 0 H ASP A 53 0.967 11.075 11.955 1.00 0.00 H new ATOM 0 HA ASP A 53 0.508 12.762 10.926 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.854 14.043 12.437 1.00 0.00 H new ATOM 0 HB3 ASP A 53 1.768 15.012 11.461 1.00 0.00 H new ATOM 201 N GLN A 54 3.443 12.774 9.599 1.00 0.00 N ATOM 202 CA GLN A 54 4.212 13.058 8.382 1.00 0.00 C ATOM 203 C GLN A 54 4.150 11.934 7.330 1.00 0.00 C ATOM 204 O GLN A 54 3.461 12.089 6.330 1.00 0.00 O ATOM 205 CB GLN A 54 5.659 13.386 8.759 1.00 0.00 C ATOM 206 CG GLN A 54 6.521 13.829 7.568 1.00 0.00 C ATOM 207 CD GLN A 54 8.031 13.863 7.888 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.472 13.852 9.030 1.00 0.00 O ATOM 209 NE2 GLN A 54 8.858 13.751 6.875 1.00 0.00 N ATOM 0 H GLN A 54 3.972 12.262 10.305 1.00 0.00 H new ATOM 0 HA GLN A 54 3.748 13.921 7.904 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.659 14.176 9.510 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.113 12.508 9.219 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.349 13.152 6.732 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.202 14.820 7.246 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.499 13.759 5.920 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.860 13.656 7.042 1.00 0.00 H new ATOM 210 N HIS A 55 4.634 10.768 7.727 1.00 0.00 N ATOM 211 CA HIS A 55 5.049 9.663 6.819 1.00 0.00 C ATOM 212 C HIS A 55 3.938 9.031 5.942 1.00 0.00 C ATOM 213 O HIS A 55 4.201 8.143 5.135 1.00 0.00 O ATOM 214 CB HIS A 55 5.827 8.633 7.656 1.00 0.00 C ATOM 215 CG HIS A 55 6.750 9.294 8.683 1.00 0.00 C ATOM 216 ND1 HIS A 55 6.520 9.339 9.991 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.757 10.138 8.421 1.00 0.00 C ATOM 218 CE1 HIS A 55 7.357 10.208 10.539 1.00 0.00 C ATOM 219 NE2 HIS A 55 8.121 10.703 9.564 1.00 0.00 N ATOM 0 H HIS A 55 4.760 10.539 8.713 1.00 0.00 H new ATOM 0 HA HIS A 55 5.688 10.100 6.052 1.00 0.00 H new ATOM 0 HB2 HIS A 55 5.122 7.981 8.172 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.419 8.002 6.993 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.194 10.325 7.451 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.411 10.468 11.586 1.00 0.00 H new ATOM 0 HE2 HIS A 55 8.859 11.398 9.678 1.00 0.00 H new ATOM 220 N ILE A 56 2.718 9.325 6.370 1.00 0.00 N ATOM 221 CA ILE A 56 1.448 9.165 5.607 1.00 0.00 C ATOM 222 C ILE A 56 1.410 9.863 4.249 1.00 0.00 C ATOM 223 O ILE A 56 2.307 10.604 3.855 1.00 0.00 O ATOM 224 CB ILE A 56 0.266 9.591 6.514 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.430 10.972 7.187 1.00 0.00 C ATOM 226 CG2 ILE A 56 -0.039 8.551 7.594 1.00 0.00 C ATOM 227 CD1 ILE A 56 0.101 12.155 6.276 1.00 0.00 C ATOM 0 H ILE A 56 2.559 9.702 7.304 1.00 0.00 H new ATOM 0 HA ILE A 56 1.367 8.110 5.345 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.570 9.667 5.819 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.213 11.014 8.066 1.00 0.00 H new ATOM 0 HG13 ILE A 56 1.457 11.073 7.539 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.874 8.894 8.204 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.299 7.603 7.123 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.839 8.414 8.225 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.241 13.087 6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 56 0.761 12.141 5.409 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.935 12.082 5.944 1.00 0.00 H new ATOM 228 N GLN A 57 0.415 9.383 3.511 1.00 0.00 N ATOM 229 CA GLN A 57 -0.003 9.866 2.174 1.00 0.00 C ATOM 230 C GLN A 57 0.943 9.360 1.094 1.00 0.00 C ATOM 231 O GLN A 57 2.158 9.520 1.119 1.00 0.00 O ATOM 232 CB GLN A 57 -0.181 11.379 2.052 1.00 0.00 C ATOM 233 CG GLN A 57 -1.384 11.890 2.852 1.00 0.00 C ATOM 234 CD GLN A 57 -1.557 13.387 2.614 1.00 0.00 C ATOM 235 OE1 GLN A 57 -2.360 13.825 1.803 1.00 0.00 O ATOM 236 NE2 GLN A 57 -0.782 14.203 3.284 1.00 0.00 N ATOM 0 H GLN A 57 -0.160 8.605 3.835 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.999 9.446 2.031 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.723 11.878 2.401 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.307 11.644 1.002 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -2.286 11.357 2.552 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -1.237 11.695 3.914 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -0.114 13.832 3.960 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.847 15.209 3.130 1.00 0.00 H new ATOM 237 N LEU A 58 0.294 8.762 0.113 1.00 0.00 N ATOM 238 CA LEU A 58 0.996 8.117 -0.997 1.00 0.00 C ATOM 239 C LEU A 58 0.844 8.917 -2.297 1.00 0.00 C ATOM 240 O LEU A 58 -0.150 9.610 -2.540 1.00 0.00 O ATOM 241 CB LEU A 58 0.525 6.658 -1.082 1.00 0.00 C ATOM 242 CG LEU A 58 -0.806 6.432 -1.829 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.582 6.190 -3.323 1.00 0.00 C ATOM 244 CD2 LEU A 58 -1.493 5.178 -1.280 1.00 0.00 C ATOM 0 H LEU A 58 -0.723 8.706 0.056 1.00 0.00 H new ATOM 0 HA LEU A 58 2.072 8.102 -0.822 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.301 6.072 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.424 6.268 -0.069 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.410 7.327 -1.685 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.542 6.035 -3.815 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.085 7.056 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.042 5.307 -3.459 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.433 5.018 -1.807 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.844 4.314 -1.425 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.691 5.308 -0.216 1.00 0.00 H new ATOM 245 N GLN A 59 1.965 8.928 -2.999 1.00 0.00 N ATOM 246 CA GLN A 59 2.110 9.420 -4.362 1.00 0.00 C ATOM 247 C GLN A 59 2.754 8.291 -5.172 1.00 0.00 C ATOM 248 O GLN A 59 3.184 7.276 -4.616 1.00 0.00 O ATOM 249 CB GLN A 59 3.071 10.621 -4.315 1.00 0.00 C ATOM 250 CG GLN A 59 2.702 11.783 -5.255 1.00 0.00 C ATOM 251 CD GLN A 59 2.647 11.397 -6.732 1.00 0.00 C ATOM 252 OE1 GLN A 59 1.604 11.118 -7.305 1.00 0.00 O ATOM 253 NE2 GLN A 59 3.783 11.258 -7.372 1.00 0.00 N ATOM 0 H GLN A 59 2.843 8.577 -2.616 1.00 0.00 H new ATOM 0 HA GLN A 59 1.158 9.717 -4.803 1.00 0.00 H new ATOM 0 HB2 GLN A 59 3.109 10.998 -3.293 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.074 10.275 -4.565 1.00 0.00 H new ATOM 0 HG2 GLN A 59 1.732 12.182 -4.958 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.429 12.585 -5.127 1.00 0.00 H new ATOM 0 HE21 GLN A 59 4.662 11.487 -6.907 1.00 0.00 H new ATOM 0 HE22 GLN A 59 3.788 10.921 -8.335 1.00 0.00 H new ATOM 254 N LEU A 60 2.688 8.428 -6.482 1.00 0.00 N ATOM 255 CA LEU A 60 3.102 7.317 -7.332 1.00 0.00 C ATOM 256 C LEU A 60 3.729 7.694 -8.679 1.00 0.00 C ATOM 257 O LEU A 60 3.588 8.810 -9.187 1.00 0.00 O ATOM 258 CB LEU A 60 1.934 6.348 -7.459 1.00 0.00 C ATOM 259 CG LEU A 60 0.739 6.784 -8.301 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.161 5.574 -8.189 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.019 8.006 -7.801 1.00 0.00 C ATOM 0 H LEU A 60 2.365 9.262 -6.972 1.00 0.00 H new ATOM 0 HA LEU A 60 3.942 6.831 -6.835 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.315 5.416 -7.876 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.573 6.124 -6.455 1.00 0.00 H new ATOM 0 HG LEU A 60 1.063 7.080 -9.299 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.076 5.747 -8.756 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.353 4.700 -8.588 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.410 5.401 -7.142 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.846 8.223 -8.477 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.409 7.809 -6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.654 8.862 -7.765 1.00 0.00 H new ATOM 262 N SER A 61 4.588 6.774 -9.102 1.00 0.00 N ATOM 263 CA SER A 61 5.304 6.820 -10.393 1.00 0.00 C ATOM 264 C SER A 61 5.299 5.482 -11.130 1.00 0.00 C ATOM 265 O SER A 61 5.861 4.478 -10.679 1.00 0.00 O ATOM 266 CB SER A 61 6.756 7.244 -10.197 1.00 0.00 C ATOM 267 OG SER A 61 7.277 6.689 -8.977 1.00 0.00 O ATOM 0 H SER A 61 4.819 5.949 -8.549 1.00 0.00 H new ATOM 0 HA SER A 61 4.765 7.550 -10.997 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.357 6.910 -11.043 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.824 8.332 -10.168 1.00 0.00 H new ATOM 0 HG SER A 61 8.210 6.967 -8.863 1.00 0.00 H new ATOM 268 N ALA A 62 4.663 5.497 -12.295 1.00 0.00 N ATOM 269 CA ALA A 62 4.609 4.295 -13.145 1.00 0.00 C ATOM 270 C ALA A 62 5.742 4.123 -14.155 1.00 0.00 C ATOM 271 O ALA A 62 5.942 4.899 -15.080 1.00 0.00 O ATOM 272 CB ALA A 62 3.240 4.148 -13.823 1.00 0.00 C ATOM 0 H ALA A 62 4.181 6.311 -12.676 1.00 0.00 H new ATOM 0 HA ALA A 62 4.762 3.479 -12.439 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.235 3.251 -14.442 1.00 0.00 H new ATOM 0 HB2 ALA A 62 2.464 4.068 -13.062 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.047 5.021 -14.447 1.00 0.00 H new ATOM 273 N GLU A 63 6.366 2.960 -13.993 1.00 0.00 N ATOM 274 CA GLU A 63 7.521 2.440 -14.750 1.00 0.00 C ATOM 275 C GLU A 63 7.159 2.078 -16.205 1.00 0.00 C ATOM 276 O GLU A 63 7.999 2.059 -17.103 1.00 0.00 O ATOM 277 CB GLU A 63 7.991 1.189 -13.988 1.00 0.00 C ATOM 278 CG GLU A 63 9.251 0.510 -14.548 1.00 0.00 C ATOM 279 CD GLU A 63 10.525 1.299 -14.271 1.00 0.00 C ATOM 280 OE1 GLU A 63 10.786 2.281 -14.996 1.00 0.00 O ATOM 281 OE2 GLU A 63 11.230 0.892 -13.314 1.00 0.00 O ATOM 0 H GLU A 63 6.061 2.300 -13.277 1.00 0.00 H new ATOM 0 HA GLU A 63 8.299 3.200 -14.821 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.179 1.466 -12.951 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.179 0.462 -13.982 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.345 -0.485 -14.113 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.138 0.378 -15.624 1.00 0.00 H new ATOM 282 N SER A 64 5.922 1.626 -16.329 1.00 0.00 N ATOM 283 CA SER A 64 5.234 1.182 -17.550 1.00 0.00 C ATOM 284 C SER A 64 3.741 1.172 -17.199 1.00 0.00 C ATOM 285 O SER A 64 3.399 1.209 -16.015 1.00 0.00 O ATOM 286 CB SER A 64 5.711 -0.214 -17.955 1.00 0.00 C ATOM 287 OG SER A 64 5.125 -0.591 -19.211 1.00 0.00 O ATOM 0 H SER A 64 5.314 1.550 -15.514 1.00 0.00 H new ATOM 0 HA SER A 64 5.440 1.838 -18.395 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.798 -0.227 -18.034 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.439 -0.937 -17.186 1.00 0.00 H new ATOM 0 HG SER A 64 5.438 -1.485 -19.463 1.00 0.00 H new ATOM 288 N VAL A 65 2.911 0.832 -18.182 1.00 0.00 N ATOM 289 CA VAL A 65 1.439 0.901 -18.191 1.00 0.00 C ATOM 290 C VAL A 65 0.755 1.254 -16.840 1.00 0.00 C ATOM 291 O VAL A 65 0.604 2.432 -16.522 1.00 0.00 O ATOM 292 CB VAL A 65 0.911 -0.352 -18.936 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.269 -1.689 -18.281 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.588 -0.248 -19.238 1.00 0.00 C ATOM 0 H VAL A 65 3.271 0.472 -19.066 1.00 0.00 H new ATOM 0 HA VAL A 65 1.131 1.786 -18.747 1.00 0.00 H new ATOM 0 HB VAL A 65 1.449 -0.356 -19.884 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.857 -2.506 -18.873 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.353 -1.790 -18.228 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.852 -1.724 -17.275 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.917 -1.146 -19.760 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.141 -0.148 -18.304 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.773 0.625 -19.865 1.00 0.00 H new ATOM 295 N GLY A 66 0.493 0.244 -16.015 1.00 0.00 N ATOM 296 CA GLY A 66 -0.054 0.392 -14.640 1.00 0.00 C ATOM 297 C GLY A 66 0.966 0.021 -13.557 1.00 0.00 C ATOM 298 O GLY A 66 0.649 0.087 -12.376 1.00 0.00 O ATOM 0 H GLY A 66 0.654 -0.729 -16.276 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.378 1.422 -14.491 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -0.937 -0.239 -14.534 1.00 0.00 H new ATOM 299 N GLU A 67 2.221 -0.127 -13.928 1.00 0.00 N ATOM 300 CA GLU A 67 3.261 -0.679 -13.049 1.00 0.00 C ATOM 301 C GLU A 67 3.925 0.437 -12.262 1.00 0.00 C ATOM 302 O GLU A 67 4.802 1.146 -12.752 1.00 0.00 O ATOM 303 CB GLU A 67 4.307 -1.378 -13.898 1.00 0.00 C ATOM 304 CG GLU A 67 3.690 -2.500 -14.746 1.00 0.00 C ATOM 305 CD GLU A 67 4.646 -3.127 -15.765 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.822 -3.359 -15.401 1.00 0.00 O ATOM 307 OE2 GLU A 67 4.178 -3.329 -16.903 1.00 0.00 O ATOM 0 H GLU A 67 2.563 0.131 -14.854 1.00 0.00 H new ATOM 0 HA GLU A 67 2.806 -1.385 -12.354 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.791 -0.652 -14.551 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.082 -1.793 -13.253 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.325 -3.282 -14.080 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.824 -2.103 -15.276 1.00 0.00 H new ATOM 308 N VAL A 68 3.629 0.432 -10.979 1.00 0.00 N ATOM 309 CA VAL A 68 3.832 1.624 -10.153 1.00 0.00 C ATOM 310 C VAL A 68 4.598 1.515 -8.841 1.00 0.00 C ATOM 311 O VAL A 68 4.178 0.902 -7.861 1.00 0.00 O ATOM 312 CB VAL A 68 2.518 2.348 -10.011 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.412 1.479 -9.381 1.00 0.00 C ATOM 314 CG2 VAL A 68 2.568 3.637 -9.251 1.00 0.00 C ATOM 0 H VAL A 68 3.250 -0.373 -10.480 1.00 0.00 H new ATOM 0 HA VAL A 68 4.562 2.206 -10.716 1.00 0.00 H new ATOM 0 HB VAL A 68 2.281 2.580 -11.049 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.492 2.059 -9.307 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.239 0.602 -10.005 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.722 1.161 -8.386 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.570 4.074 -9.209 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.925 3.449 -8.238 1.00 0.00 H new ATOM 0 HG23 VAL A 68 3.246 4.328 -9.752 1.00 0.00 H new ATOM 315 N TYR A 69 5.536 2.431 -8.816 1.00 0.00 N ATOM 316 CA TYR A 69 6.381 2.699 -7.655 1.00 0.00 C ATOM 317 C TYR A 69 5.683 3.702 -6.737 1.00 0.00 C ATOM 318 O TYR A 69 5.336 4.803 -7.163 1.00 0.00 O ATOM 319 CB TYR A 69 7.695 3.331 -8.124 1.00 0.00 C ATOM 320 CG TYR A 69 8.715 2.351 -8.717 1.00 0.00 C ATOM 321 CD1 TYR A 69 9.005 1.121 -8.093 1.00 0.00 C ATOM 322 CD2 TYR A 69 9.294 2.728 -9.945 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.880 0.219 -8.742 1.00 0.00 C ATOM 324 CE2 TYR A 69 10.158 1.835 -10.591 1.00 0.00 C ATOM 325 CZ TYR A 69 10.417 0.575 -9.999 1.00 0.00 C ATOM 326 OH TYR A 69 10.994 -0.378 -10.775 1.00 0.00 O ATOM 0 H TYR A 69 5.745 3.029 -9.615 1.00 0.00 H new ATOM 0 HA TYR A 69 6.568 1.764 -7.127 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.468 4.091 -8.872 1.00 0.00 H new ATOM 0 HB3 TYR A 69 8.155 3.843 -7.279 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.567 0.872 -7.138 1.00 0.00 H new ATOM 0 HD2 TYR A 69 9.075 3.691 -10.382 1.00 0.00 H new ATOM 0 HE1 TYR A 69 10.133 -0.726 -8.284 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.621 2.104 -11.529 1.00 0.00 H new ATOM 0 HH TYR A 69 11.117 -0.030 -11.683 1.00 0.00 H new ATOM 327 N ILE A 70 5.288 3.204 -5.568 1.00 0.00 N ATOM 328 CA ILE A 70 4.523 4.029 -4.627 1.00 0.00 C ATOM 329 C ILE A 70 5.429 4.704 -3.600 1.00 0.00 C ATOM 330 O ILE A 70 5.673 4.228 -2.493 1.00 0.00 O ATOM 331 CB ILE A 70 3.296 3.280 -4.083 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.420 2.980 -5.300 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.491 4.106 -3.078 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.490 1.776 -5.110 1.00 0.00 C ATOM 0 H ILE A 70 5.478 2.253 -5.251 1.00 0.00 H new ATOM 0 HA ILE A 70 4.084 4.872 -5.161 1.00 0.00 H new ATOM 0 HB ILE A 70 3.620 2.385 -3.552 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.818 3.860 -5.529 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.062 2.799 -6.162 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.638 3.524 -2.730 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.124 4.365 -2.230 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.137 5.018 -3.558 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.901 1.625 -6.014 1.00 0.00 H new ATOM 0 HD12 ILE A 70 2.085 0.884 -4.912 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.822 1.961 -4.268 1.00 0.00 H new ATOM 335 N LYS A 71 5.569 5.968 -3.946 1.00 0.00 N ATOM 336 CA LYS A 71 6.486 6.932 -3.341 1.00 0.00 C ATOM 337 C LYS A 71 5.695 7.747 -2.326 1.00 0.00 C ATOM 338 O LYS A 71 4.695 8.398 -2.656 1.00 0.00 O ATOM 339 CB LYS A 71 6.970 7.815 -4.491 1.00 0.00 C ATOM 340 CG LYS A 71 8.119 8.749 -4.087 1.00 0.00 C ATOM 341 CD LYS A 71 8.088 10.029 -4.924 1.00 0.00 C ATOM 342 CE LYS A 71 7.037 11.039 -4.421 1.00 0.00 C ATOM 343 NZ LYS A 71 7.427 11.560 -3.106 1.00 0.00 N ATOM 0 H LYS A 71 5.018 6.380 -4.699 1.00 0.00 H new ATOM 0 HA LYS A 71 7.332 6.470 -2.832 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.297 7.181 -5.316 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.136 8.412 -4.859 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.039 8.997 -3.029 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.074 8.241 -4.224 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.073 10.495 -4.905 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.875 9.775 -5.962 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.941 11.860 -5.132 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.061 10.558 -4.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.024 12.510 -2.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.070 10.927 -2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 8.464 11.613 -3.047 1.00 0.00 H new ATOM 344 N SER A 72 6.014 7.537 -1.059 1.00 0.00 N ATOM 345 CA SER A 72 5.456 8.359 0.021 1.00 0.00 C ATOM 346 C SER A 72 5.662 9.848 -0.265 1.00 0.00 C ATOM 347 O SER A 72 6.787 10.318 -0.389 1.00 0.00 O ATOM 348 CB SER A 72 6.169 8.005 1.319 1.00 0.00 C ATOM 349 OG SER A 72 5.734 8.926 2.324 1.00 0.00 O ATOM 0 H SER A 72 6.655 6.808 -0.746 1.00 0.00 H new ATOM 0 HA SER A 72 4.387 8.163 0.098 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.939 6.981 1.614 1.00 0.00 H new ATOM 0 HB3 SER A 72 7.250 8.064 1.189 1.00 0.00 H new ATOM 0 HG SER A 72 6.239 8.771 3.150 1.00 0.00 H new ATOM 350 N THR A 73 4.557 10.591 -0.273 1.00 0.00 N ATOM 351 CA THR A 73 4.557 12.050 -0.494 1.00 0.00 C ATOM 352 C THR A 73 5.467 12.785 0.511 1.00 0.00 C ATOM 353 O THR A 73 6.221 13.674 0.146 1.00 0.00 O ATOM 354 CB THR A 73 3.115 12.566 -0.361 1.00 0.00 C ATOM 355 OG1 THR A 73 2.232 11.657 -1.043 1.00 0.00 O ATOM 356 CG2 THR A 73 2.949 13.972 -0.943 1.00 0.00 C ATOM 0 H THR A 73 3.626 10.202 -0.126 1.00 0.00 H new ATOM 0 HA THR A 73 4.948 12.248 -1.492 1.00 0.00 H new ATOM 0 HB THR A 73 2.871 12.621 0.700 1.00 0.00 H new ATOM 0 HG1 THR A 73 1.309 11.976 -0.963 1.00 0.00 H new ATOM 0 HG21 THR A 73 1.914 14.294 -0.826 1.00 0.00 H new ATOM 0 HG22 THR A 73 3.606 14.664 -0.416 1.00 0.00 H new ATOM 0 HG23 THR A 73 3.208 13.960 -2.002 1.00 0.00 H new ATOM 357 N GLU A 74 5.463 12.279 1.748 1.00 0.00 N ATOM 358 CA GLU A 74 6.135 12.913 2.891 1.00 0.00 C ATOM 359 C GLU A 74 7.419 12.254 3.432 1.00 0.00 C ATOM 360 O GLU A 74 8.144 12.885 4.201 1.00 0.00 O ATOM 361 CB GLU A 74 5.090 13.085 3.986 1.00 0.00 C ATOM 362 CG GLU A 74 4.147 14.234 3.620 1.00 0.00 C ATOM 363 CD GLU A 74 3.031 14.420 4.641 1.00 0.00 C ATOM 364 OE1 GLU A 74 3.267 15.166 5.604 1.00 0.00 O ATOM 365 OE2 GLU A 74 1.921 13.910 4.358 1.00 0.00 O ATOM 0 H GLU A 74 4.989 11.409 1.989 1.00 0.00 H new ATOM 0 HA GLU A 74 6.529 13.860 2.520 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.524 12.162 4.110 1.00 0.00 H new ATOM 0 HB3 GLU A 74 5.578 13.291 4.939 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.719 15.158 3.540 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.710 14.043 2.640 1.00 0.00 H new ATOM 366 N THR A 75 7.608 10.968 3.146 1.00 0.00 N ATOM 367 CA THR A 75 8.845 10.238 3.496 1.00 0.00 C ATOM 368 C THR A 75 9.739 9.920 2.282 1.00 0.00 C ATOM 369 O THR A 75 10.903 9.575 2.460 1.00 0.00 O ATOM 370 CB THR A 75 8.592 8.897 4.215 1.00 0.00 C ATOM 371 OG1 THR A 75 7.215 8.726 4.565 1.00 0.00 O ATOM 372 CG2 THR A 75 9.475 8.774 5.460 1.00 0.00 C ATOM 0 H THR A 75 6.915 10.394 2.666 1.00 0.00 H new ATOM 0 HA THR A 75 9.349 10.935 4.165 1.00 0.00 H new ATOM 0 HB THR A 75 8.854 8.104 3.515 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.040 7.780 4.753 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.280 7.821 5.952 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.524 8.824 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.250 9.589 6.148 1.00 0.00 H new ATOM 373 N GLY A 76 9.127 9.859 1.098 1.00 0.00 N ATOM 374 CA GLY A 76 9.790 9.467 -0.178 1.00 0.00 C ATOM 375 C GLY A 76 9.926 7.958 -0.386 1.00 0.00 C ATOM 376 O GLY A 76 9.970 7.483 -1.526 1.00 0.00 O ATOM 0 H GLY A 76 8.139 10.082 0.981 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.224 9.886 -1.010 1.00 0.00 H new ATOM 0 HA3 GLY A 76 10.783 9.916 -0.210 1.00 0.00 H new ATOM 377 N GLN A 77 10.163 7.251 0.717 1.00 0.00 N ATOM 378 CA GLN A 77 10.279 5.783 0.767 1.00 0.00 C ATOM 379 C GLN A 77 9.071 5.085 0.118 1.00 0.00 C ATOM 380 O GLN A 77 7.946 5.574 0.145 1.00 0.00 O ATOM 381 CB GLN A 77 10.395 5.317 2.220 1.00 0.00 C ATOM 382 CG GLN A 77 11.622 5.899 2.919 1.00 0.00 C ATOM 383 CD GLN A 77 11.670 5.532 4.401 1.00 0.00 C ATOM 384 OE1 GLN A 77 10.770 4.958 5.000 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.769 5.850 5.045 1.00 0.00 N ATOM 0 H GLN A 77 10.284 7.690 1.630 1.00 0.00 H new ATOM 0 HA GLN A 77 11.174 5.513 0.206 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.497 5.608 2.765 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.446 4.229 2.247 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.524 5.536 2.427 1.00 0.00 H new ATOM 0 HG3 GLN A 77 11.617 6.984 2.815 1.00 0.00 H new ATOM 0 HE21 GLN A 77 13.526 6.328 4.557 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.866 5.619 6.034 1.00 0.00 H new ATOM 386 N TYR A 78 9.351 3.884 -0.384 1.00 0.00 N ATOM 387 CA TYR A 78 8.384 3.125 -1.196 1.00 0.00 C ATOM 388 C TYR A 78 7.568 2.121 -0.382 1.00 0.00 C ATOM 389 O TYR A 78 8.097 1.365 0.446 1.00 0.00 O ATOM 390 CB TYR A 78 9.119 2.422 -2.340 1.00 0.00 C ATOM 391 CG TYR A 78 9.758 3.415 -3.312 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.013 3.979 -2.967 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.015 3.893 -4.410 1.00 0.00 C ATOM 394 CE1 TYR A 78 11.497 5.088 -3.687 1.00 0.00 C ATOM 395 CE2 TYR A 78 9.504 4.995 -5.147 1.00 0.00 C ATOM 396 CZ TYR A 78 10.720 5.583 -4.757 1.00 0.00 C ATOM 397 OH TYR A 78 11.143 6.695 -5.421 1.00 0.00 O ATOM 0 H TYR A 78 10.242 3.408 -0.245 1.00 0.00 H new ATOM 0 HA TYR A 78 7.666 3.841 -1.597 1.00 0.00 H new ATOM 0 HB2 TYR A 78 9.891 1.771 -1.928 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.420 1.785 -2.881 1.00 0.00 H new ATOM 0 HD1 TYR A 78 11.593 3.561 -2.158 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.083 3.422 -4.685 1.00 0.00 H new ATOM 0 HE1 TYR A 78 12.439 5.548 -3.427 1.00 0.00 H new ATOM 0 HE2 TYR A 78 8.954 5.378 -5.994 1.00 0.00 H new ATOM 0 HH TYR A 78 10.505 6.914 -6.132 1.00 0.00 H new ATOM 398 N LEU A 79 6.262 2.185 -0.637 1.00 0.00 N ATOM 399 CA LEU A 79 5.313 1.154 -0.183 1.00 0.00 C ATOM 400 C LEU A 79 5.715 -0.145 -0.909 1.00 0.00 C ATOM 401 O LEU A 79 5.765 -0.189 -2.133 1.00 0.00 O ATOM 402 CB LEU A 79 3.920 1.571 -0.647 1.00 0.00 C ATOM 403 CG LEU A 79 2.787 0.838 0.080 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.235 1.772 1.153 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.665 0.608 -0.932 1.00 0.00 C ATOM 0 H LEU A 79 5.828 2.945 -1.160 1.00 0.00 H new ATOM 0 HA LEU A 79 5.321 1.024 0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.802 2.644 -0.497 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.832 1.387 -1.718 1.00 0.00 H new ATOM 0 HG LEU A 79 3.142 -0.098 0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.425 1.274 1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.028 2.029 1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.856 2.681 0.685 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.839 0.087 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.315 1.568 -1.312 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.039 0.005 -1.759 1.00 0.00 H new ATOM 406 N ALA A 80 6.184 -1.105 -0.124 1.00 0.00 N ATOM 407 CA ALA A 80 6.805 -2.344 -0.653 1.00 0.00 C ATOM 408 C ALA A 80 6.176 -3.577 -0.036 1.00 0.00 C ATOM 409 O ALA A 80 5.652 -3.514 1.065 1.00 0.00 O ATOM 410 CB ALA A 80 8.288 -2.314 -0.318 1.00 0.00 C ATOM 0 H ALA A 80 6.152 -1.062 0.895 1.00 0.00 H new ATOM 0 HA ALA A 80 6.650 -2.389 -1.731 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.765 -3.217 -0.698 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.747 -1.439 -0.779 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.416 -2.264 0.763 1.00 0.00 H new ATOM 411 N MET A 81 6.387 -4.721 -0.695 1.00 0.00 N ATOM 412 CA MET A 81 5.920 -6.005 -0.149 1.00 0.00 C ATOM 413 C MET A 81 7.015 -7.079 -0.265 1.00 0.00 C ATOM 414 O MET A 81 7.722 -7.168 -1.261 1.00 0.00 O ATOM 415 CB MET A 81 4.617 -6.440 -0.796 1.00 0.00 C ATOM 416 CG MET A 81 4.074 -7.682 -0.079 1.00 0.00 C ATOM 417 SD MET A 81 2.275 -8.038 -0.160 1.00 0.00 S ATOM 418 CE MET A 81 1.581 -6.902 -1.335 1.00 0.00 C ATOM 0 H MET A 81 6.869 -4.788 -1.591 1.00 0.00 H new ATOM 0 HA MET A 81 5.712 -5.869 0.912 1.00 0.00 H new ATOM 0 HB2 MET A 81 3.888 -5.632 -0.747 1.00 0.00 H new ATOM 0 HB3 MET A 81 4.779 -6.659 -1.851 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.600 -8.549 -0.478 1.00 0.00 H new ATOM 0 HG3 MET A 81 4.347 -7.601 0.973 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.500 -6.859 -1.205 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.005 -5.910 -1.177 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.812 -7.238 -2.346 1.00 0.00 H new ATOM 419 N ASP A 82 7.135 -7.849 0.811 1.00 0.00 N ATOM 420 CA ASP A 82 8.081 -8.961 0.906 1.00 0.00 C ATOM 421 C ASP A 82 7.347 -10.303 0.821 1.00 0.00 C ATOM 422 O ASP A 82 6.210 -10.444 1.275 1.00 0.00 O ATOM 423 CB ASP A 82 8.821 -8.823 2.250 1.00 0.00 C ATOM 424 CG ASP A 82 10.067 -9.696 2.411 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.822 -9.811 1.420 1.00 0.00 O ATOM 426 OD2 ASP A 82 10.146 -10.327 3.476 1.00 0.00 O ATOM 0 H ASP A 82 6.573 -7.719 1.652 1.00 0.00 H new ATOM 0 HA ASP A 82 8.791 -8.932 0.079 1.00 0.00 H new ATOM 0 HB2 ASP A 82 9.111 -7.780 2.379 1.00 0.00 H new ATOM 0 HB3 ASP A 82 8.125 -9.063 3.054 1.00 0.00 H new ATOM 427 N THR A 83 8.187 -11.286 0.527 1.00 0.00 N ATOM 428 CA THR A 83 7.811 -12.716 0.351 1.00 0.00 C ATOM 429 C THR A 83 7.005 -13.315 1.508 1.00 0.00 C ATOM 430 O THR A 83 6.254 -14.274 1.317 1.00 0.00 O ATOM 431 CB THR A 83 9.062 -13.578 0.139 1.00 0.00 C ATOM 432 OG1 THR A 83 10.074 -13.146 1.059 1.00 0.00 O ATOM 433 CG2 THR A 83 9.547 -13.523 -1.312 1.00 0.00 C ATOM 0 H THR A 83 9.185 -11.124 0.396 1.00 0.00 H new ATOM 0 HA THR A 83 7.164 -12.725 -0.526 1.00 0.00 H new ATOM 0 HB THR A 83 8.822 -14.623 0.334 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.880 -13.689 0.937 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.435 -14.146 -1.423 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.761 -13.890 -1.972 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.791 -12.494 -1.575 1.00 0.00 H new ATOM 434 N ASP A 84 7.269 -12.806 2.695 1.00 0.00 N ATOM 435 CA ASP A 84 6.564 -13.139 3.953 1.00 0.00 C ATOM 436 C ASP A 84 5.099 -12.692 4.105 1.00 0.00 C ATOM 437 O ASP A 84 4.498 -12.965 5.139 1.00 0.00 O ATOM 438 CB ASP A 84 7.420 -12.606 5.107 1.00 0.00 C ATOM 439 CG ASP A 84 8.656 -13.491 5.337 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.657 -13.262 4.623 1.00 0.00 O ATOM 441 OD2 ASP A 84 8.546 -14.389 6.193 1.00 0.00 O ATOM 0 H ASP A 84 8.009 -12.118 2.833 1.00 0.00 H new ATOM 0 HA ASP A 84 6.460 -14.224 3.951 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.736 -11.586 4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.823 -12.567 6.018 1.00 0.00 H new ATOM 442 N GLY A 85 4.567 -11.975 3.122 1.00 0.00 N ATOM 443 CA GLY A 85 3.155 -11.536 3.115 1.00 0.00 C ATOM 444 C GLY A 85 2.891 -10.419 4.115 1.00 0.00 C ATOM 445 O GLY A 85 1.938 -10.472 4.901 1.00 0.00 O ATOM 0 H GLY A 85 5.094 -11.676 2.301 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.888 -11.195 2.115 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.512 -12.385 3.345 1.00 0.00 H new ATOM 446 N LEU A 86 3.580 -9.321 3.839 1.00 0.00 N ATOM 447 CA LEU A 86 3.650 -8.120 4.684 1.00 0.00 C ATOM 448 C LEU A 86 4.303 -6.963 3.913 1.00 0.00 C ATOM 449 O LEU A 86 5.181 -7.167 3.065 1.00 0.00 O ATOM 450 CB LEU A 86 4.297 -8.440 6.037 1.00 0.00 C ATOM 451 CG LEU A 86 5.729 -8.961 5.914 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.679 -7.767 5.925 1.00 0.00 C ATOM 453 CD2 LEU A 86 6.063 -9.886 7.088 1.00 0.00 C ATOM 0 H LEU A 86 4.132 -9.231 2.986 1.00 0.00 H new ATOM 0 HA LEU A 86 2.645 -7.777 4.929 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.296 -7.541 6.654 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.691 -9.183 6.555 1.00 0.00 H new ATOM 0 HG LEU A 86 5.833 -9.525 4.987 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.707 -8.119 5.838 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.448 -7.111 5.086 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.562 -7.217 6.859 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.086 -10.249 6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.965 -9.336 8.024 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.376 -10.733 7.091 1.00 0.00 H new ATOM 454 N LEU A 87 3.804 -5.768 4.219 1.00 0.00 N ATOM 455 CA LEU A 87 4.275 -4.521 3.600 1.00 0.00 C ATOM 456 C LEU A 87 5.326 -3.814 4.461 1.00 0.00 C ATOM 457 O LEU A 87 5.103 -3.462 5.621 1.00 0.00 O ATOM 458 CB LEU A 87 3.119 -3.535 3.347 1.00 0.00 C ATOM 459 CG LEU A 87 1.920 -4.120 2.601 1.00 0.00 C ATOM 460 CD1 LEU A 87 0.649 -3.323 2.921 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.137 -4.252 1.097 1.00 0.00 C ATOM 0 H LEU A 87 3.060 -5.631 4.904 1.00 0.00 H new ATOM 0 HA LEU A 87 4.721 -4.815 2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.776 -3.147 4.306 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.503 -2.687 2.779 1.00 0.00 H new ATOM 0 HG LEU A 87 1.797 -5.141 2.963 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -0.195 -3.753 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.454 -3.364 3.993 1.00 0.00 H new ATOM 0 HD13 LEU A 87 0.784 -2.285 2.616 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.244 -4.674 0.636 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.335 -3.269 0.670 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.987 -4.908 0.908 1.00 0.00 H new ATOM 462 N TYR A 88 6.426 -3.481 3.786 1.00 0.00 N ATOM 463 CA TYR A 88 7.568 -2.757 4.391 1.00 0.00 C ATOM 464 C TYR A 88 7.848 -1.439 3.668 1.00 0.00 C ATOM 465 O TYR A 88 7.488 -1.277 2.495 1.00 0.00 O ATOM 466 CB TYR A 88 8.840 -3.620 4.479 1.00 0.00 C ATOM 467 CG TYR A 88 9.519 -4.028 3.181 1.00 0.00 C ATOM 468 CD1 TYR A 88 8.874 -4.886 2.256 1.00 0.00 C ATOM 469 CD2 TYR A 88 10.898 -3.743 3.079 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.638 -5.483 1.239 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.660 -4.349 2.076 1.00 0.00 C ATOM 472 CZ TYR A 88 11.020 -5.222 1.170 1.00 0.00 C ATOM 473 OH TYR A 88 11.804 -5.913 0.297 1.00 0.00 O ATOM 0 H TYR A 88 6.561 -3.702 2.799 1.00 0.00 H new ATOM 0 HA TYR A 88 7.272 -2.524 5.414 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.570 -3.078 5.081 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.589 -4.530 5.024 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.814 -5.078 2.331 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.363 -3.059 3.774 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.170 -6.136 0.517 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.719 -4.153 1.996 1.00 0.00 H new ATOM 0 HH TYR A 88 11.263 -6.208 -0.466 1.00 0.00 H new ATOM 474 N GLY A 89 8.528 -0.528 4.359 1.00 0.00 N ATOM 475 CA GLY A 89 8.797 0.834 3.863 1.00 0.00 C ATOM 476 C GLY A 89 10.178 0.959 3.205 1.00 0.00 C ATOM 477 O GLY A 89 11.004 1.772 3.613 1.00 0.00 O ATOM 0 H GLY A 89 8.914 -0.708 5.286 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.028 1.113 3.142 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.728 1.539 4.691 1.00 0.00 H new ATOM 478 N SER A 90 10.372 0.134 2.183 1.00 0.00 N ATOM 479 CA SER A 90 11.634 0.047 1.409 1.00 0.00 C ATOM 480 C SER A 90 12.042 1.351 0.712 1.00 0.00 C ATOM 481 O SER A 90 11.403 1.823 -0.224 1.00 0.00 O ATOM 482 CB SER A 90 11.545 -1.114 0.419 1.00 0.00 C ATOM 483 OG SER A 90 12.540 -1.041 -0.608 1.00 0.00 O ATOM 0 H SER A 90 9.653 -0.510 1.852 1.00 0.00 H new ATOM 0 HA SER A 90 12.432 -0.138 2.129 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.653 -2.055 0.958 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.556 -1.121 -0.039 1.00 0.00 H new ATOM 0 HG SER A 90 12.359 -0.270 -1.185 1.00 0.00 H new ATOM 484 N GLN A 91 13.213 1.837 1.137 1.00 0.00 N ATOM 485 CA GLN A 91 13.913 3.001 0.570 1.00 0.00 C ATOM 486 C GLN A 91 14.204 2.833 -0.940 1.00 0.00 C ATOM 487 O GLN A 91 14.156 3.780 -1.711 1.00 0.00 O ATOM 488 CB GLN A 91 15.240 3.175 1.303 1.00 0.00 C ATOM 489 CG GLN A 91 15.105 3.704 2.739 1.00 0.00 C ATOM 490 CD GLN A 91 14.504 2.666 3.707 1.00 0.00 C ATOM 491 OE1 GLN A 91 14.812 1.475 3.683 1.00 0.00 O ATOM 492 NE2 GLN A 91 13.561 3.077 4.510 1.00 0.00 N ATOM 0 H GLN A 91 13.721 1.416 1.915 1.00 0.00 H new ATOM 0 HA GLN A 91 13.268 3.871 0.692 1.00 0.00 H new ATOM 0 HB2 GLN A 91 15.756 2.215 1.329 1.00 0.00 H new ATOM 0 HB3 GLN A 91 15.869 3.860 0.734 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.087 4.007 3.103 1.00 0.00 H new ATOM 0 HG3 GLN A 91 14.478 4.595 2.735 1.00 0.00 H new ATOM 0 HE21 GLN A 91 13.304 4.064 4.532 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.081 2.411 5.116 1.00 0.00 H new ATOM 493 N THR A 92 14.569 1.603 -1.278 1.00 0.00 N ATOM 494 CA THR A 92 14.772 1.114 -2.662 1.00 0.00 C ATOM 495 C THR A 92 13.438 0.933 -3.394 1.00 0.00 C ATOM 496 O THR A 92 12.483 0.403 -2.808 1.00 0.00 O ATOM 497 CB THR A 92 15.450 -0.256 -2.683 1.00 0.00 C ATOM 498 OG1 THR A 92 15.128 -1.023 -1.511 1.00 0.00 O ATOM 499 CG2 THR A 92 16.959 -0.142 -2.888 1.00 0.00 C ATOM 0 H THR A 92 14.742 0.881 -0.579 1.00 0.00 H new ATOM 0 HA THR A 92 15.392 1.867 -3.149 1.00 0.00 H new ATOM 0 HB THR A 92 15.054 -0.797 -3.542 1.00 0.00 H new ATOM 0 HG1 THR A 92 14.178 -0.910 -1.297 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.401 -1.138 -2.897 1.00 0.00 H new ATOM 0 HG22 THR A 92 17.161 0.353 -3.838 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.394 0.441 -2.076 1.00 0.00 H new ATOM 500 N PRO A 93 13.428 1.248 -4.686 1.00 0.00 N ATOM 501 CA PRO A 93 12.432 0.662 -5.574 1.00 0.00 C ATOM 502 C PRO A 93 12.976 -0.573 -6.311 1.00 0.00 C ATOM 503 O PRO A 93 14.122 -0.622 -6.745 1.00 0.00 O ATOM 504 CB PRO A 93 12.027 1.760 -6.536 1.00 0.00 C ATOM 505 CG PRO A 93 13.308 2.582 -6.674 1.00 0.00 C ATOM 506 CD PRO A 93 13.997 2.451 -5.312 1.00 0.00 C ATOM 0 HA PRO A 93 11.572 0.300 -5.010 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.700 1.357 -7.495 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.204 2.357 -6.144 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.940 2.201 -7.476 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.088 3.623 -6.909 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.077 2.357 -5.428 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.818 3.333 -4.697 1.00 0.00 H new ATOM 507 N ASN A 94 12.253 -1.627 -6.018 1.00 0.00 N ATOM 508 CA ASN A 94 12.385 -2.941 -6.673 1.00 0.00 C ATOM 509 C ASN A 94 11.000 -3.336 -7.206 1.00 0.00 C ATOM 510 O ASN A 94 10.009 -2.671 -6.909 1.00 0.00 O ATOM 511 CB ASN A 94 12.919 -3.899 -5.586 1.00 0.00 C ATOM 512 CG ASN A 94 12.927 -5.395 -5.955 1.00 0.00 C ATOM 513 OD1 ASN A 94 11.979 -6.120 -5.708 1.00 0.00 O ATOM 514 ND2 ASN A 94 13.936 -5.852 -6.651 1.00 0.00 N ATOM 0 H ASN A 94 11.530 -1.611 -5.298 1.00 0.00 H new ATOM 0 HA ASN A 94 13.069 -2.956 -7.522 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.937 -3.601 -5.334 1.00 0.00 H new ATOM 0 HB3 ASN A 94 12.317 -3.769 -4.687 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.929 -6.815 -6.987 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.729 -5.245 -6.858 1.00 0.00 H new ATOM 515 N GLU A 95 10.925 -4.465 -7.889 1.00 0.00 N ATOM 516 CA GLU A 95 9.647 -5.107 -8.291 1.00 0.00 C ATOM 517 C GLU A 95 8.664 -5.228 -7.118 1.00 0.00 C ATOM 518 O GLU A 95 7.459 -5.135 -7.271 1.00 0.00 O ATOM 519 CB GLU A 95 9.941 -6.547 -8.708 1.00 0.00 C ATOM 520 CG GLU A 95 10.904 -6.658 -9.888 1.00 0.00 C ATOM 521 CD GLU A 95 11.563 -8.036 -9.890 1.00 0.00 C ATOM 522 OE1 GLU A 95 10.953 -8.967 -10.449 1.00 0.00 O ATOM 523 OE2 GLU A 95 12.649 -8.116 -9.266 1.00 0.00 O ATOM 0 H GLU A 95 11.750 -4.982 -8.193 1.00 0.00 H new ATOM 0 HA GLU A 95 9.218 -4.494 -9.084 1.00 0.00 H new ATOM 0 HB2 GLU A 95 10.359 -7.085 -7.857 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.004 -7.040 -8.967 1.00 0.00 H new ATOM 0 HG2 GLU A 95 10.367 -6.500 -10.823 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.665 -5.881 -9.822 1.00 0.00 H new ATOM 524 N GLU A 96 9.225 -5.520 -5.951 1.00 0.00 N ATOM 525 CA GLU A 96 8.521 -5.601 -4.654 1.00 0.00 C ATOM 526 C GLU A 96 7.783 -4.315 -4.262 1.00 0.00 C ATOM 527 O GLU A 96 6.732 -4.353 -3.616 1.00 0.00 O ATOM 528 CB GLU A 96 9.542 -5.895 -3.566 1.00 0.00 C ATOM 529 CG GLU A 96 9.865 -7.382 -3.686 1.00 0.00 C ATOM 530 CD GLU A 96 10.324 -8.130 -2.424 1.00 0.00 C ATOM 531 OE1 GLU A 96 10.504 -7.484 -1.363 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.535 -9.354 -2.559 1.00 0.00 O ATOM 0 H GLU A 96 10.222 -5.717 -5.867 1.00 0.00 H new ATOM 0 HA GLU A 96 7.773 -6.387 -4.759 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.438 -5.289 -3.697 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.141 -5.661 -2.580 1.00 0.00 H new ATOM 0 HG2 GLU A 96 8.977 -7.886 -4.067 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.643 -7.494 -4.441 1.00 0.00 H new ATOM 533 N CYS A 97 8.423 -3.213 -4.634 1.00 0.00 N ATOM 534 CA CYS A 97 8.014 -1.842 -4.298 1.00 0.00 C ATOM 535 C CYS A 97 7.174 -1.235 -5.444 1.00 0.00 C ATOM 536 O CYS A 97 6.547 -0.186 -5.317 1.00 0.00 O ATOM 537 CB CYS A 97 9.308 -1.070 -4.030 1.00 0.00 C ATOM 538 SG CYS A 97 10.554 -1.980 -3.046 1.00 0.00 S ATOM 0 H CYS A 97 9.272 -3.244 -5.198 1.00 0.00 H new ATOM 0 HA CYS A 97 7.372 -1.803 -3.418 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.753 -0.791 -4.985 1.00 0.00 H new ATOM 0 HB3 CYS A 97 9.061 -0.144 -3.511 1.00 0.00 H new ATOM 0 HG CYS A 97 11.522 -1.175 -2.720 1.00 0.00 H new ATOM 539 N LEU A 98 7.287 -1.899 -6.589 1.00 0.00 N ATOM 540 CA LEU A 98 6.466 -1.694 -7.789 1.00 0.00 C ATOM 541 C LEU A 98 5.184 -2.512 -7.619 1.00 0.00 C ATOM 542 O LEU A 98 5.147 -3.638 -7.134 1.00 0.00 O ATOM 543 CB LEU A 98 7.234 -2.170 -9.019 1.00 0.00 C ATOM 544 CG LEU A 98 6.629 -1.590 -10.300 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.814 -0.103 -10.379 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.485 -2.030 -11.470 1.00 0.00 C ATOM 0 H LEU A 98 7.985 -2.631 -6.717 1.00 0.00 H new ATOM 0 HA LEU A 98 6.226 -0.639 -7.920 1.00 0.00 H new ATOM 0 HB2 LEU A 98 8.279 -1.871 -8.938 1.00 0.00 H new ATOM 0 HB3 LEU A 98 7.216 -3.259 -9.065 1.00 0.00 H new ATOM 0 HG LEU A 98 5.584 -1.900 -10.311 1.00 0.00 H new ATOM 0 HD11 LEU A 98 6.371 0.270 -11.302 1.00 0.00 H new ATOM 0 HD12 LEU A 98 6.327 0.370 -9.526 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.878 0.132 -10.366 1.00 0.00 H new ATOM 0 HD21 LEU A 98 7.072 -1.628 -12.395 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.502 -1.661 -11.336 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.498 -3.119 -11.522 1.00 0.00 H new ATOM 547 N PHE A 99 4.128 -1.781 -7.875 1.00 0.00 N ATOM 548 CA PHE A 99 2.776 -2.307 -7.864 1.00 0.00 C ATOM 549 C PHE A 99 2.117 -2.202 -9.239 1.00 0.00 C ATOM 550 O PHE A 99 2.820 -2.051 -10.226 1.00 0.00 O ATOM 551 CB PHE A 99 1.944 -1.595 -6.778 1.00 0.00 C ATOM 552 CG PHE A 99 2.324 -2.011 -5.345 1.00 0.00 C ATOM 553 CD1 PHE A 99 3.522 -1.534 -4.773 1.00 0.00 C ATOM 554 CD2 PHE A 99 1.513 -2.938 -4.648 1.00 0.00 C ATOM 555 CE1 PHE A 99 3.930 -2.015 -3.507 1.00 0.00 C ATOM 556 CE2 PHE A 99 1.911 -3.411 -3.378 1.00 0.00 C ATOM 557 CZ PHE A 99 3.115 -2.940 -2.823 1.00 0.00 C ATOM 0 H PHE A 99 4.179 -0.788 -8.101 1.00 0.00 H new ATOM 0 HA PHE A 99 2.822 -3.369 -7.623 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.072 -0.517 -6.881 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.888 -1.808 -6.942 1.00 0.00 H new ATOM 0 HD1 PHE A 99 4.123 -0.807 -5.298 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.589 -3.284 -5.087 1.00 0.00 H new ATOM 0 HE1 PHE A 99 4.857 -1.677 -3.068 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.301 -4.123 -2.842 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.422 -3.295 -1.850 1.00 0.00 H new ATOM 558 N LEU A 100 0.872 -2.656 -9.308 1.00 0.00 N ATOM 559 CA LEU A 100 0.063 -2.541 -10.525 1.00 0.00 C ATOM 560 C LEU A 100 -1.250 -1.830 -10.244 1.00 0.00 C ATOM 561 O LEU A 100 -2.025 -2.247 -9.381 1.00 0.00 O ATOM 562 CB LEU A 100 -0.223 -3.970 -10.997 1.00 0.00 C ATOM 563 CG LEU A 100 -0.543 -3.977 -12.485 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.777 -4.162 -13.224 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.489 -5.140 -12.822 1.00 0.00 C ATOM 0 H LEU A 100 0.393 -3.112 -8.531 1.00 0.00 H new ATOM 0 HA LEU A 100 0.595 -1.961 -11.279 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.640 -4.606 -10.800 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.060 -4.386 -10.436 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.033 -3.048 -12.776 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.594 -4.173 -14.298 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.450 -3.340 -12.979 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.233 -5.106 -12.924 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.709 -5.132 -13.890 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.014 -6.084 -12.556 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.416 -5.030 -12.260 1.00 0.00 H new ATOM 566 N GLU A 101 -1.454 -0.748 -10.985 1.00 0.00 N ATOM 567 CA GLU A 101 -2.659 0.091 -10.872 1.00 0.00 C ATOM 568 C GLU A 101 -3.945 -0.601 -11.325 1.00 0.00 C ATOM 569 O GLU A 101 -4.233 -0.777 -12.512 1.00 0.00 O ATOM 570 CB GLU A 101 -2.474 1.407 -11.627 1.00 0.00 C ATOM 571 CG GLU A 101 -1.748 2.451 -10.780 1.00 0.00 C ATOM 572 CD GLU A 101 -1.620 3.761 -11.563 1.00 0.00 C ATOM 573 OE1 GLU A 101 -2.618 4.505 -11.580 1.00 0.00 O ATOM 574 OE2 GLU A 101 -0.510 3.981 -12.101 1.00 0.00 O ATOM 0 H GLU A 101 -0.791 -0.419 -11.687 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.780 0.289 -9.807 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.910 1.225 -12.542 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.448 1.795 -11.925 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.294 2.623 -9.853 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -0.759 2.084 -10.504 1.00 0.00 H new ATOM 575 N ARG A 102 -4.665 -1.064 -10.314 1.00 0.00 N ATOM 576 CA ARG A 102 -5.955 -1.747 -10.435 1.00 0.00 C ATOM 577 C ARG A 102 -7.067 -0.828 -9.906 1.00 0.00 C ATOM 578 O ARG A 102 -7.382 -0.787 -8.714 1.00 0.00 O ATOM 579 CB ARG A 102 -5.923 -2.984 -9.547 1.00 0.00 C ATOM 580 CG ARG A 102 -4.845 -4.052 -9.739 1.00 0.00 C ATOM 581 CD ARG A 102 -5.185 -4.991 -10.887 1.00 0.00 C ATOM 582 NE ARG A 102 -6.344 -5.842 -10.529 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.572 -7.083 -10.974 1.00 0.00 C ATOM 584 NH1 ARG A 102 -5.727 -7.701 -11.788 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.658 -7.749 -10.639 1.00 0.00 N ATOM 0 H ARG A 102 -4.358 -0.973 -9.345 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.139 -2.007 -11.477 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.852 -2.638 -8.516 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.888 -3.479 -9.651 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.886 -3.571 -9.933 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.733 -4.626 -8.819 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.412 -4.414 -11.783 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.324 -5.617 -11.121 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.029 -5.446 -9.886 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.875 -7.230 -12.092 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.929 -8.648 -12.110 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.351 -7.320 -10.026 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.806 -8.694 -10.993 1.00 0.00 H new ATOM 586 N LEU A 103 -7.811 -0.266 -10.833 1.00 0.00 N ATOM 587 CA LEU A 103 -8.874 0.709 -10.511 1.00 0.00 C ATOM 588 C LEU A 103 -10.165 0.064 -9.984 1.00 0.00 C ATOM 589 O LEU A 103 -10.773 -0.831 -10.567 1.00 0.00 O ATOM 590 CB LEU A 103 -9.148 1.622 -11.706 1.00 0.00 C ATOM 591 CG LEU A 103 -10.150 2.773 -11.486 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.861 3.646 -10.251 1.00 0.00 C ATOM 593 CD2 LEU A 103 -10.205 3.640 -12.746 1.00 0.00 C ATOM 0 H LEU A 103 -7.711 -0.458 -11.830 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.497 1.314 -9.687 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -8.200 2.054 -12.028 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -9.513 1.006 -12.528 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.115 2.307 -11.289 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.615 4.429 -10.175 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.888 3.028 -9.354 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.875 4.100 -10.349 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.912 4.456 -12.596 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -9.216 4.050 -12.949 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.526 3.032 -13.592 1.00 0.00 H new ATOM 594 N GLU A 104 -10.575 0.660 -8.880 1.00 0.00 N ATOM 595 CA GLU A 104 -11.814 0.384 -8.139 1.00 0.00 C ATOM 596 C GLU A 104 -12.669 1.654 -8.252 1.00 0.00 C ATOM 597 O GLU A 104 -12.489 2.610 -7.501 1.00 0.00 O ATOM 598 CB GLU A 104 -11.403 0.075 -6.691 1.00 0.00 C ATOM 599 CG GLU A 104 -12.534 -0.120 -5.664 1.00 0.00 C ATOM 600 CD GLU A 104 -13.553 -1.210 -6.020 1.00 0.00 C ATOM 601 OE1 GLU A 104 -14.537 -0.856 -6.692 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.366 -2.342 -5.535 1.00 0.00 O ATOM 0 H GLU A 104 -10.024 1.398 -8.441 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.389 -0.461 -8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -10.794 -0.829 -6.698 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -10.765 0.886 -6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -12.090 -0.361 -4.698 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.063 0.826 -5.545 1.00 0.00 H new ATOM 603 N GLU A 105 -13.339 1.712 -9.400 1.00 0.00 N ATOM 604 CA GLU A 105 -14.257 2.779 -9.861 1.00 0.00 C ATOM 605 C GLU A 105 -14.138 4.190 -9.260 1.00 0.00 C ATOM 606 O GLU A 105 -13.515 5.047 -9.881 1.00 0.00 O ATOM 607 CB GLU A 105 -15.707 2.283 -9.838 1.00 0.00 C ATOM 608 CG GLU A 105 -15.986 1.186 -10.873 1.00 0.00 C ATOM 609 CD GLU A 105 -15.821 1.681 -12.309 1.00 0.00 C ATOM 610 OE1 GLU A 105 -16.814 2.227 -12.843 1.00 0.00 O ATOM 611 OE2 GLU A 105 -14.716 1.472 -12.853 1.00 0.00 O ATOM 0 H GLU A 105 -13.257 0.966 -10.091 1.00 0.00 H new ATOM 0 HA GLU A 105 -13.904 2.959 -10.877 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.938 1.902 -8.843 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -16.375 3.125 -10.021 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -15.310 0.348 -10.701 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -17.000 0.811 -10.736 1.00 0.00 H new ATOM 612 N ASN A 106 -14.582 4.343 -8.020 1.00 0.00 N ATOM 613 CA ASN A 106 -14.696 5.622 -7.301 1.00 0.00 C ATOM 614 C ASN A 106 -13.363 6.142 -6.733 1.00 0.00 C ATOM 615 O ASN A 106 -13.158 6.220 -5.514 1.00 0.00 O ATOM 616 CB ASN A 106 -15.765 5.392 -6.239 1.00 0.00 C ATOM 617 CG ASN A 106 -16.437 6.693 -5.797 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.432 7.147 -6.353 1.00 0.00 O ATOM 619 ND2 ASN A 106 -15.854 7.358 -4.832 1.00 0.00 N ATOM 0 H ASN A 106 -14.888 3.550 -7.456 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.981 6.425 -7.980 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.521 4.710 -6.630 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.315 4.906 -5.373 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.227 8.261 -4.537 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.027 6.974 -4.375 1.00 0.00 H new ATOM 620 N HIS A 107 -12.391 6.155 -7.643 1.00 0.00 N ATOM 621 CA HIS A 107 -11.024 6.734 -7.524 1.00 0.00 C ATOM 622 C HIS A 107 -10.038 5.791 -6.818 1.00 0.00 C ATOM 623 O HIS A 107 -8.839 5.820 -7.062 1.00 0.00 O ATOM 624 CB HIS A 107 -10.998 8.111 -6.863 1.00 0.00 C ATOM 625 CG HIS A 107 -12.037 9.069 -7.469 1.00 0.00 C ATOM 626 ND1 HIS A 107 -12.467 9.071 -8.728 1.00 0.00 N ATOM 627 CD2 HIS A 107 -12.893 9.791 -6.755 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.598 9.754 -8.789 1.00 0.00 C ATOM 629 NE2 HIS A 107 -13.868 10.191 -7.565 1.00 0.00 N ATOM 0 H HIS A 107 -12.534 5.732 -8.560 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.695 6.863 -8.555 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.187 8.002 -5.795 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -10.003 8.544 -6.969 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -12.811 10.014 -5.701 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.193 9.925 -9.674 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -14.684 10.740 -7.293 1.00 0.00 H new ATOM 630 N TYR A 108 -10.606 4.993 -5.920 1.00 0.00 N ATOM 631 CA TYR A 108 -9.926 3.902 -5.204 1.00 0.00 C ATOM 632 C TYR A 108 -9.092 3.034 -6.128 1.00 0.00 C ATOM 633 O TYR A 108 -9.501 2.616 -7.219 1.00 0.00 O ATOM 634 CB TYR A 108 -10.926 3.020 -4.465 1.00 0.00 C ATOM 635 CG TYR A 108 -11.634 3.776 -3.344 1.00 0.00 C ATOM 636 CD1 TYR A 108 -10.876 4.240 -2.253 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.038 3.940 -3.411 1.00 0.00 C ATOM 638 CE1 TYR A 108 -11.531 4.856 -1.183 1.00 0.00 C ATOM 639 CE2 TYR A 108 -13.697 4.559 -2.333 1.00 0.00 C ATOM 640 CZ TYR A 108 -12.932 4.982 -1.213 1.00 0.00 C ATOM 641 OH TYR A 108 -13.560 5.102 -0.012 1.00 0.00 O ATOM 0 H TYR A 108 -11.587 5.086 -5.656 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.259 4.382 -4.488 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -11.666 2.641 -5.170 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.409 2.155 -4.049 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -9.803 4.122 -2.243 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -13.592 3.597 -4.272 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -10.967 5.231 -0.342 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -14.766 4.710 -2.356 1.00 0.00 H new ATOM 0 HH TYR A 108 -12.912 4.969 0.711 1.00 0.00 H new ATOM 642 N ASN A 109 -7.836 2.960 -5.741 1.00 0.00 N ATOM 643 CA ASN A 109 -6.873 2.099 -6.410 1.00 0.00 C ATOM 644 C ASN A 109 -6.423 0.943 -5.524 1.00 0.00 C ATOM 645 O ASN A 109 -6.206 1.062 -4.316 1.00 0.00 O ATOM 646 CB ASN A 109 -5.690 2.965 -6.811 1.00 0.00 C ATOM 647 CG ASN A 109 -5.626 3.130 -8.335 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.466 2.176 -9.084 1.00 0.00 O ATOM 649 ND2 ASN A 109 -5.842 4.338 -8.814 1.00 0.00 N ATOM 0 H ASN A 109 -7.452 3.490 -4.959 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.337 1.645 -7.286 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -5.773 3.944 -6.338 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.765 2.514 -6.451 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -5.878 4.488 -9.822 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -5.974 5.123 -8.177 1.00 0.00 H new ATOM 650 N THR A 110 -6.574 -0.207 -6.135 1.00 0.00 N ATOM 651 CA THR A 110 -6.020 -1.457 -5.592 1.00 0.00 C ATOM 652 C THR A 110 -4.741 -1.746 -6.396 1.00 0.00 C ATOM 653 O THR A 110 -4.521 -1.170 -7.462 1.00 0.00 O ATOM 654 CB THR A 110 -7.025 -2.619 -5.613 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.279 -3.110 -6.926 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.338 -2.261 -4.915 1.00 0.00 C ATOM 0 H THR A 110 -7.077 -0.319 -7.015 1.00 0.00 H new ATOM 0 HA THR A 110 -5.787 -1.346 -4.533 1.00 0.00 H new ATOM 0 HB THR A 110 -6.549 -3.422 -5.051 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.196 -3.451 -6.976 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.016 -3.114 -4.956 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.139 -2.005 -3.874 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.796 -1.409 -5.417 1.00 0.00 H new ATOM 657 N TYR A 111 -3.802 -2.419 -5.752 1.00 0.00 N ATOM 658 CA TYR A 111 -2.450 -2.536 -6.327 1.00 0.00 C ATOM 659 C TYR A 111 -1.786 -3.893 -6.066 1.00 0.00 C ATOM 660 O TYR A 111 -1.335 -4.163 -4.944 1.00 0.00 O ATOM 661 CB TYR A 111 -1.541 -1.416 -5.806 1.00 0.00 C ATOM 662 CG TYR A 111 -2.056 0.008 -5.975 1.00 0.00 C ATOM 663 CD1 TYR A 111 -1.661 0.716 -7.134 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.645 0.662 -4.875 1.00 0.00 C ATOM 665 CE1 TYR A 111 -1.788 2.117 -7.161 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.775 2.066 -4.894 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.332 2.775 -6.037 1.00 0.00 C ATOM 668 OH TYR A 111 -2.358 4.122 -5.999 1.00 0.00 O ATOM 0 H TYR A 111 -3.933 -2.885 -4.854 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.580 -2.446 -7.405 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.358 -1.590 -4.746 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.579 -1.494 -6.312 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.266 0.187 -7.989 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.994 0.094 -4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -1.474 2.680 -8.028 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.204 2.590 -4.053 1.00 0.00 H new ATOM 0 HH TYR A 111 -1.719 4.443 -5.328 1.00 0.00 H new ATOM 669 N ILE A 112 -1.692 -4.691 -7.121 1.00 0.00 N ATOM 670 CA ILE A 112 -0.962 -5.978 -7.056 1.00 0.00 C ATOM 671 C ILE A 112 0.533 -5.615 -6.979 1.00 0.00 C ATOM 672 O ILE A 112 1.019 -4.874 -7.816 1.00 0.00 O ATOM 673 CB ILE A 112 -1.063 -6.891 -8.302 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.469 -6.962 -8.920 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.431 -8.272 -8.020 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.405 -8.118 -8.549 1.00 0.00 C ATOM 0 H ILE A 112 -2.104 -4.484 -8.031 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.396 -6.520 -6.216 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.472 -6.421 -9.088 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -2.982 -6.034 -8.668 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.348 -6.976 -10.003 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.513 -8.898 -8.909 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.620 -8.145 -7.761 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.954 -8.749 -7.191 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.351 -8.005 -9.079 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.943 -9.065 -8.830 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.587 -8.108 -7.474 1.00 0.00 H new ATOM 677 N SER A 113 1.265 -6.303 -6.119 1.00 0.00 N ATOM 678 CA SER A 113 2.737 -6.184 -6.058 1.00 0.00 C ATOM 679 C SER A 113 3.331 -6.881 -7.286 1.00 0.00 C ATOM 680 O SER A 113 3.076 -8.063 -7.505 1.00 0.00 O ATOM 681 CB SER A 113 3.283 -6.820 -4.776 1.00 0.00 C ATOM 682 OG SER A 113 4.711 -6.704 -4.717 1.00 0.00 O ATOM 0 H SER A 113 0.873 -6.958 -5.443 1.00 0.00 H new ATOM 0 HA SER A 113 3.016 -5.130 -6.051 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.838 -6.336 -3.907 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.997 -7.871 -4.736 1.00 0.00 H new ATOM 0 HG SER A 113 4.959 -6.066 -4.016 1.00 0.00 H new ATOM 683 N LYS A 114 4.023 -6.102 -8.112 1.00 0.00 N ATOM 684 CA LYS A 114 4.653 -6.569 -9.360 1.00 0.00 C ATOM 685 C LYS A 114 5.362 -7.922 -9.208 1.00 0.00 C ATOM 686 O LYS A 114 5.045 -8.866 -9.932 1.00 0.00 O ATOM 687 CB LYS A 114 5.650 -5.502 -9.845 1.00 0.00 C ATOM 688 CG LYS A 114 6.281 -5.773 -11.211 1.00 0.00 C ATOM 689 CD LYS A 114 5.626 -5.008 -12.366 1.00 0.00 C ATOM 690 CE LYS A 114 4.224 -5.492 -12.758 1.00 0.00 C ATOM 691 NZ LYS A 114 4.292 -6.887 -13.190 1.00 0.00 N ATOM 0 H LYS A 114 4.169 -5.108 -7.937 1.00 0.00 H new ATOM 0 HA LYS A 114 3.860 -6.719 -10.093 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.138 -4.540 -9.884 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.447 -5.410 -9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 114 7.338 -5.511 -11.169 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.225 -6.841 -11.419 1.00 0.00 H new ATOM 0 HD2 LYS A 114 5.566 -3.954 -12.095 1.00 0.00 H new ATOM 0 HD3 LYS A 114 6.274 -5.076 -13.240 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.545 -5.395 -11.911 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.824 -4.871 -13.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.422 -7.134 -13.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.112 -7.017 -13.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.390 -7.504 -12.358 1.00 0.00 H new ATOM 692 N LYS A 115 6.188 -8.031 -8.167 1.00 0.00 N ATOM 693 CA LYS A 115 6.863 -9.298 -7.836 1.00 0.00 C ATOM 694 C LYS A 115 5.843 -10.414 -7.508 1.00 0.00 C ATOM 695 O LYS A 115 5.778 -11.435 -8.207 1.00 0.00 O ATOM 696 CB LYS A 115 7.823 -9.074 -6.664 1.00 0.00 C ATOM 697 CG LYS A 115 8.519 -10.406 -6.401 1.00 0.00 C ATOM 698 CD LYS A 115 8.718 -10.731 -4.929 1.00 0.00 C ATOM 699 CE LYS A 115 8.727 -12.243 -4.786 1.00 0.00 C ATOM 700 NZ LYS A 115 9.873 -12.864 -5.451 1.00 0.00 N ATOM 0 H LYS A 115 6.409 -7.261 -7.536 1.00 0.00 H new ATOM 0 HA LYS A 115 7.430 -9.627 -8.706 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.551 -8.299 -6.904 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.281 -8.740 -5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.936 -11.204 -6.861 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.491 -10.397 -6.893 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.655 -10.307 -4.567 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.919 -10.295 -4.330 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.740 -12.504 -3.728 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.806 -12.649 -5.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.898 -13.879 -5.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.786 -12.741 -6.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.751 -12.415 -5.121 1.00 0.00 H new ATOM 701 N HIS A 116 4.993 -10.142 -6.531 1.00 0.00 N ATOM 702 CA HIS A 116 3.988 -11.080 -6.008 1.00 0.00 C ATOM 703 C HIS A 116 2.729 -11.207 -6.881 1.00 0.00 C ATOM 704 O HIS A 116 1.686 -11.689 -6.433 1.00 0.00 O ATOM 705 CB HIS A 116 3.603 -10.619 -4.597 1.00 0.00 C ATOM 706 CG HIS A 116 4.806 -10.530 -3.661 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.281 -9.411 -3.130 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.542 -11.550 -3.212 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.289 -9.737 -2.349 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.460 -11.050 -2.395 1.00 0.00 N ATOM 0 H HIS A 116 4.975 -9.238 -6.060 1.00 0.00 H new ATOM 0 HA HIS A 116 4.437 -12.073 -6.004 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.120 -9.644 -4.656 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.872 -11.311 -4.179 1.00 0.00 H new ATOM 0 HD1 HIS A 116 4.929 -8.468 -3.297 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.413 -12.591 -3.467 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.880 -9.047 -1.766 1.00 0.00 H new ATOM 711 N ALA A 117 2.899 -10.913 -8.171 1.00 0.00 N ATOM 712 CA ALA A 117 1.927 -11.208 -9.231 1.00 0.00 C ATOM 713 C ALA A 117 1.598 -12.713 -9.239 1.00 0.00 C ATOM 714 O ALA A 117 0.424 -13.076 -9.240 1.00 0.00 O ATOM 715 CB ALA A 117 2.505 -10.791 -10.586 1.00 0.00 C ATOM 0 H ALA A 117 3.739 -10.450 -8.519 1.00 0.00 H new ATOM 0 HA ALA A 117 1.010 -10.649 -9.044 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.783 -11.010 -11.373 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.719 -9.722 -10.577 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.426 -11.343 -10.774 1.00 0.00 H new ATOM 716 N GLU A 118 2.607 -13.512 -8.883 1.00 0.00 N ATOM 717 CA GLU A 118 2.460 -14.973 -8.745 1.00 0.00 C ATOM 718 C GLU A 118 1.568 -15.460 -7.581 1.00 0.00 C ATOM 719 O GLU A 118 1.189 -16.628 -7.522 1.00 0.00 O ATOM 720 CB GLU A 118 3.828 -15.682 -8.796 1.00 0.00 C ATOM 721 CG GLU A 118 4.895 -15.025 -7.910 1.00 0.00 C ATOM 722 CD GLU A 118 6.277 -15.675 -8.046 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.808 -15.681 -9.177 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.807 -16.095 -6.987 1.00 0.00 O ATOM 0 H GLU A 118 3.547 -13.172 -8.682 1.00 0.00 H new ATOM 0 HA GLU A 118 1.887 -15.275 -9.622 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.701 -16.720 -8.488 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.182 -15.696 -9.827 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.971 -13.968 -8.167 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.577 -15.078 -6.869 1.00 0.00 H new ATOM 725 N LYS A 119 1.225 -14.535 -6.692 1.00 0.00 N ATOM 726 CA LYS A 119 0.313 -14.732 -5.545 1.00 0.00 C ATOM 727 C LYS A 119 -0.948 -13.849 -5.603 1.00 0.00 C ATOM 728 O LYS A 119 -1.939 -14.171 -4.952 1.00 0.00 O ATOM 729 CB LYS A 119 1.144 -14.431 -4.300 1.00 0.00 C ATOM 730 CG LYS A 119 2.000 -15.635 -3.909 1.00 0.00 C ATOM 731 CD LYS A 119 3.359 -15.230 -3.344 1.00 0.00 C ATOM 732 CE LYS A 119 4.356 -14.918 -4.461 1.00 0.00 C ATOM 733 NZ LYS A 119 5.705 -14.817 -3.896 1.00 0.00 N ATOM 0 H LYS A 119 1.585 -13.582 -6.743 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.073 -15.751 -5.547 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.785 -13.569 -4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.485 -14.165 -3.474 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.466 -16.231 -3.169 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.148 -16.270 -4.783 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.243 -14.356 -2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.749 -16.033 -2.719 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.325 -15.700 -5.220 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.086 -13.984 -4.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 6.274 -14.163 -4.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.647 -14.460 -2.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.152 -15.756 -3.895 1.00 0.00 H new ATOM 734 N ASN A 120 -0.950 -12.876 -6.526 1.00 0.00 N ATOM 735 CA ASN A 120 -1.955 -11.799 -6.684 1.00 0.00 C ATOM 736 C ASN A 120 -2.074 -10.897 -5.440 1.00 0.00 C ATOM 737 O ASN A 120 -3.139 -10.377 -5.113 1.00 0.00 O ATOM 738 CB ASN A 120 -3.334 -12.366 -7.059 1.00 0.00 C ATOM 739 CG ASN A 120 -3.278 -13.279 -8.285 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.404 -12.865 -9.430 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.099 -14.560 -8.060 1.00 0.00 N ATOM 0 H ASN A 120 -0.210 -12.810 -7.225 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.594 -11.176 -7.502 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.736 -12.923 -6.213 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.021 -11.543 -7.254 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.064 -15.215 -8.841 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -2.994 -14.900 -7.104 1.00 0.00 H new ATOM 742 N TRP A 121 -0.926 -10.625 -4.840 1.00 0.00 N ATOM 743 CA TRP A 121 -0.910 -9.848 -3.582 1.00 0.00 C ATOM 744 C TRP A 121 -1.104 -8.355 -3.769 1.00 0.00 C ATOM 745 O TRP A 121 -0.252 -7.656 -4.320 1.00 0.00 O ATOM 746 CB TRP A 121 0.348 -10.076 -2.742 1.00 0.00 C ATOM 747 CG TRP A 121 0.391 -11.449 -2.079 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.614 -12.325 -1.995 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.490 -11.993 -1.420 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.191 -13.403 -1.350 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.069 -13.243 -0.950 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.784 -11.520 -1.138 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.928 -14.045 -0.161 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.655 -12.323 -0.390 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.232 -13.569 0.111 1.00 0.00 C ATOM 0 H TRP A 121 -0.010 -10.915 -5.181 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.774 -10.239 -3.045 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.226 -9.959 -3.377 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.407 -9.307 -1.972 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.609 -12.179 -2.389 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.752 -14.238 -1.183 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.102 -10.551 -1.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.596 -14.998 0.224 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.661 -11.983 -0.196 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.907 -14.165 0.707 1.00 0.00 H new ATOM 756 N PHE A 122 -2.252 -7.919 -3.281 1.00 0.00 N ATOM 757 CA PHE A 122 -2.560 -6.491 -3.235 1.00 0.00 C ATOM 758 C PHE A 122 -2.130 -5.922 -1.880 1.00 0.00 C ATOM 759 O PHE A 122 -2.185 -6.587 -0.847 1.00 0.00 O ATOM 760 CB PHE A 122 -4.058 -6.217 -3.399 1.00 0.00 C ATOM 761 CG PHE A 122 -4.658 -6.668 -4.722 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.065 -8.016 -4.861 1.00 0.00 C ATOM 763 CD2 PHE A 122 -5.045 -5.701 -5.672 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.882 -8.404 -5.945 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.880 -6.075 -6.756 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.285 -7.422 -6.873 1.00 0.00 C ATOM 0 H PHE A 122 -2.985 -8.524 -2.912 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.023 -6.020 -4.059 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.592 -6.712 -2.588 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.230 -5.146 -3.287 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.749 -8.751 -4.135 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.707 -4.680 -5.575 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.192 -9.432 -6.061 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.201 -5.341 -7.480 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.922 -7.709 -7.697 1.00 0.00 H new ATOM 767 N VAL A 123 -1.656 -4.690 -1.966 1.00 0.00 N ATOM 768 CA VAL A 123 -1.529 -3.794 -0.805 1.00 0.00 C ATOM 769 C VAL A 123 -2.883 -3.727 -0.088 1.00 0.00 C ATOM 770 O VAL A 123 -3.919 -3.616 -0.752 1.00 0.00 O ATOM 771 CB VAL A 123 -1.053 -2.424 -1.324 1.00 0.00 C ATOM 772 CG1 VAL A 123 -1.934 -1.873 -2.452 1.00 0.00 C ATOM 773 CG2 VAL A 123 -0.997 -1.370 -0.237 1.00 0.00 C ATOM 0 H VAL A 123 -1.344 -4.272 -2.843 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.800 -4.152 -0.078 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.050 -2.620 -1.702 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.548 -0.906 -2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.925 -2.567 -3.293 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -2.955 -1.754 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.655 -0.426 -0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.990 -1.236 0.191 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.305 -1.688 0.543 1.00 0.00 H new ATOM 774 N GLY A 124 -2.847 -3.615 1.240 1.00 0.00 N ATOM 775 CA GLY A 124 -4.079 -3.708 2.037 1.00 0.00 C ATOM 776 C GLY A 124 -3.934 -3.131 3.426 1.00 0.00 C ATOM 777 O GLY A 124 -2.853 -2.864 3.927 1.00 0.00 O ATOM 0 H GLY A 124 -1.997 -3.462 1.782 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.882 -3.186 1.516 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.376 -4.754 2.114 1.00 0.00 H new ATOM 778 N LEU A 125 -5.107 -2.670 3.829 1.00 0.00 N ATOM 779 CA LEU A 125 -5.296 -2.019 5.122 1.00 0.00 C ATOM 780 C LEU A 125 -5.839 -2.952 6.193 1.00 0.00 C ATOM 781 O LEU A 125 -7.007 -3.356 6.220 1.00 0.00 O ATOM 782 CB LEU A 125 -6.089 -0.730 4.933 1.00 0.00 C ATOM 783 CG LEU A 125 -5.122 0.422 5.202 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.904 0.464 4.297 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.867 1.754 5.058 1.00 0.00 C ATOM 0 H LEU A 125 -5.958 -2.735 3.271 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.321 -1.739 5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.493 -0.669 3.923 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.936 -0.692 5.618 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.752 0.255 6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.280 1.316 4.566 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -3.332 -0.456 4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.225 0.563 3.260 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -5.180 2.578 5.249 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -6.265 1.841 4.047 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -6.687 1.792 5.775 1.00 0.00 H new ATOM 786 N LYS A 126 -4.859 -3.317 6.991 1.00 0.00 N ATOM 787 CA LYS A 126 -5.020 -4.268 8.086 1.00 0.00 C ATOM 788 C LYS A 126 -5.990 -3.679 9.126 1.00 0.00 C ATOM 789 O LYS A 126 -5.700 -2.669 9.771 1.00 0.00 O ATOM 790 CB LYS A 126 -3.628 -4.513 8.696 1.00 0.00 C ATOM 791 CG LYS A 126 -3.392 -5.876 9.376 1.00 0.00 C ATOM 792 CD LYS A 126 -4.251 -6.079 10.634 1.00 0.00 C ATOM 793 CE LYS A 126 -3.928 -5.042 11.706 1.00 0.00 C ATOM 794 NZ LYS A 126 -2.829 -5.502 12.558 1.00 0.00 N ATOM 0 H LYS A 126 -3.908 -2.959 6.901 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.435 -5.214 7.739 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.886 -4.396 7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.438 -3.730 9.430 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -3.607 -6.673 8.664 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.339 -5.964 9.644 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -5.306 -6.014 10.369 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -4.084 -7.080 11.032 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.658 -4.097 11.235 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.812 -4.854 12.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -2.326 -4.680 12.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.210 -6.077 13.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -2.169 -6.075 11.994 1.00 0.00 H new ATOM 795 N LYS A 127 -7.101 -4.404 9.318 1.00 0.00 N ATOM 796 CA LYS A 127 -8.319 -3.979 10.034 1.00 0.00 C ATOM 797 C LYS A 127 -8.258 -3.725 11.563 1.00 0.00 C ATOM 798 O LYS A 127 -9.163 -4.069 12.320 1.00 0.00 O ATOM 799 CB LYS A 127 -9.454 -4.958 9.686 1.00 0.00 C ATOM 800 CG LYS A 127 -10.066 -4.763 8.303 1.00 0.00 C ATOM 801 CD LYS A 127 -10.838 -3.444 8.188 1.00 0.00 C ATOM 802 CE LYS A 127 -11.746 -3.378 6.956 1.00 0.00 C ATOM 803 NZ LYS A 127 -10.975 -3.453 5.697 1.00 0.00 N ATOM 0 H LYS A 127 -7.182 -5.355 8.959 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.488 -2.966 9.669 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.071 -5.976 9.758 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.241 -4.860 10.433 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.276 -4.785 7.552 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.737 -5.594 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.443 -3.306 9.084 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.128 -2.618 8.152 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -12.465 -4.197 6.991 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -12.318 -2.451 6.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.368 -2.780 5.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -9.980 -3.215 5.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.033 -4.417 5.311 1.00 0.00 H new ATOM 804 N ASN A 128 -7.182 -3.080 11.997 1.00 0.00 N ATOM 805 CA ASN A 128 -6.953 -2.640 13.377 1.00 0.00 C ATOM 806 C ASN A 128 -6.352 -1.222 13.365 1.00 0.00 C ATOM 807 O ASN A 128 -7.031 -0.262 13.733 1.00 0.00 O ATOM 808 CB ASN A 128 -5.983 -3.582 14.089 1.00 0.00 C ATOM 809 CG ASN A 128 -6.554 -4.828 14.798 1.00 0.00 C ATOM 810 OD1 ASN A 128 -5.816 -5.539 15.466 1.00 0.00 O ATOM 811 ND2 ASN A 128 -7.820 -5.127 14.663 1.00 0.00 N ATOM 0 H ASN A 128 -6.411 -2.837 11.375 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.906 -2.645 13.907 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.253 -3.924 13.355 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.439 -2.998 14.831 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -8.199 -5.958 15.116 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.429 -4.529 14.104 1.00 0.00 H new ATOM 812 N GLY A 129 -5.049 -1.152 13.073 1.00 0.00 N ATOM 813 CA GLY A 129 -4.354 0.113 12.837 1.00 0.00 C ATOM 814 C GLY A 129 -3.021 0.007 12.083 1.00 0.00 C ATOM 815 O GLY A 129 -2.124 0.833 12.285 1.00 0.00 O ATOM 0 H GLY A 129 -4.448 -1.973 12.994 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -5.017 0.772 12.276 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -4.170 0.591 13.799 1.00 0.00 H new ATOM 816 N SER A 130 -2.934 -0.952 11.176 1.00 0.00 N ATOM 817 CA SER A 130 -1.728 -1.168 10.354 1.00 0.00 C ATOM 818 C SER A 130 -2.065 -1.460 8.880 1.00 0.00 C ATOM 819 O SER A 130 -3.206 -1.290 8.451 1.00 0.00 O ATOM 820 CB SER A 130 -0.811 -2.228 11.003 1.00 0.00 C ATOM 821 OG SER A 130 0.446 -2.238 10.310 1.00 0.00 O ATOM 0 H SER A 130 -3.690 -1.608 10.980 1.00 0.00 H new ATOM 0 HA SER A 130 -1.163 -0.236 10.328 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.659 -2.000 12.058 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.277 -3.212 10.953 1.00 0.00 H new ATOM 0 HG SER A 130 1.071 -1.630 10.757 1.00 0.00 H new ATOM 822 N CYS A 131 -1.025 -1.755 8.088 1.00 0.00 N ATOM 823 CA CYS A 131 -1.133 -2.066 6.654 1.00 0.00 C ATOM 824 C CYS A 131 -0.588 -3.470 6.354 1.00 0.00 C ATOM 825 O CYS A 131 -1.293 -4.306 5.794 1.00 0.00 O ATOM 826 CB CYS A 131 -0.342 -1.072 5.801 1.00 0.00 C ATOM 827 SG CYS A 131 -0.991 0.631 5.716 1.00 0.00 S ATOM 0 H CYS A 131 -0.065 -1.785 8.432 1.00 0.00 H new ATOM 0 HA CYS A 131 -2.193 -2.006 6.405 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.677 -1.029 6.185 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -0.284 -1.465 4.786 1.00 0.00 H new ATOM 0 HG CYS A 131 -0.217 1.353 4.962 1.00 0.00 H new ATOM 828 N LYS A 132 0.686 -3.654 6.711 1.00 0.00 N ATOM 829 CA LYS A 132 1.525 -4.868 6.583 1.00 0.00 C ATOM 830 C LYS A 132 0.893 -6.234 6.329 1.00 0.00 C ATOM 831 O LYS A 132 0.959 -7.167 7.135 1.00 0.00 O ATOM 832 CB LYS A 132 2.557 -4.891 7.717 1.00 0.00 C ATOM 833 CG LYS A 132 1.837 -4.719 9.058 1.00 0.00 C ATOM 834 CD LYS A 132 2.484 -5.451 10.220 1.00 0.00 C ATOM 835 CE LYS A 132 1.435 -5.457 11.326 1.00 0.00 C ATOM 836 NZ LYS A 132 1.875 -6.409 12.345 1.00 0.00 N ATOM 0 H LYS A 132 1.213 -2.892 7.137 1.00 0.00 H new ATOM 0 HA LYS A 132 1.982 -4.734 5.603 1.00 0.00 H new ATOM 0 HB2 LYS A 132 3.108 -5.832 7.704 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.286 -4.093 7.577 1.00 0.00 H new ATOM 0 HG2 LYS A 132 1.789 -3.656 9.296 1.00 0.00 H new ATOM 0 HG3 LYS A 132 0.810 -5.069 8.952 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.764 -6.466 9.938 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.395 -4.947 10.544 1.00 0.00 H new ATOM 0 HE2 LYS A 132 1.324 -4.461 11.754 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.461 -5.743 10.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 1.179 -6.438 13.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.962 -7.355 11.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.798 -6.112 12.722 1.00 0.00 H new ATOM 837 N ARG A 133 0.445 -6.372 5.084 1.00 0.00 N ATOM 838 CA ARG A 133 -0.087 -7.648 4.605 1.00 0.00 C ATOM 839 C ARG A 133 0.334 -8.100 3.191 1.00 0.00 C ATOM 840 O ARG A 133 1.162 -7.457 2.542 1.00 0.00 O ATOM 841 CB ARG A 133 -1.603 -7.610 4.829 1.00 0.00 C ATOM 842 CG ARG A 133 -2.127 -8.990 5.235 1.00 0.00 C ATOM 843 CD ARG A 133 -1.632 -9.456 6.603 1.00 0.00 C ATOM 844 NE ARG A 133 -2.221 -10.784 6.843 1.00 0.00 N ATOM 845 CZ ARG A 133 -1.609 -11.968 6.684 1.00 0.00 C ATOM 846 NH1 ARG A 133 -0.315 -12.083 6.448 1.00 0.00 N ATOM 847 NH2 ARG A 133 -2.312 -13.077 6.857 1.00 0.00 N ATOM 0 H ARG A 133 0.439 -5.623 4.392 1.00 0.00 H new ATOM 0 HA ARG A 133 0.377 -8.443 5.188 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.842 -6.882 5.605 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.102 -7.280 3.918 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.217 -8.968 5.241 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.827 -9.719 4.482 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.543 -9.507 6.622 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.932 -8.754 7.381 1.00 0.00 H new ATOM 0 HE ARG A 133 -3.190 -10.806 7.162 1.00 0.00 H new ATOM 0 HH11 ARG A 133 0.267 -11.248 6.379 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.103 -13.007 6.335 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -3.299 -13.021 7.106 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -1.866 -13.987 6.741 1.00 0.00 H new ATOM 848 N GLY A 134 -0.317 -9.170 2.728 1.00 0.00 N ATOM 849 CA GLY A 134 0.044 -9.992 1.559 1.00 0.00 C ATOM 850 C GLY A 134 -1.008 -11.066 1.230 1.00 0.00 C ATOM 851 O GLY A 134 -1.933 -10.767 0.488 1.00 0.00 O ATOM 0 H GLY A 134 -1.163 -9.511 3.184 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.176 -9.344 0.693 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.003 -10.476 1.744 1.00 0.00 H new ATOM 852 N PRO A 135 -0.956 -12.267 1.842 1.00 0.00 N ATOM 853 CA PRO A 135 -1.780 -13.425 1.410 1.00 0.00 C ATOM 854 C PRO A 135 -3.279 -13.366 1.721 1.00 0.00 C ATOM 855 O PRO A 135 -4.074 -14.045 1.070 1.00 0.00 O ATOM 856 CB PRO A 135 -1.065 -14.622 2.009 1.00 0.00 C ATOM 857 CG PRO A 135 -0.564 -14.087 3.345 1.00 0.00 C ATOM 858 CD PRO A 135 -0.155 -12.642 3.021 1.00 0.00 C ATOM 0 HA PRO A 135 -1.838 -13.461 0.322 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.737 -15.470 2.140 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.245 -14.961 1.376 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.341 -14.123 4.109 1.00 0.00 H new ATOM 0 HG3 PRO A 135 0.278 -14.668 3.720 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.357 -11.978 3.861 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.912 -12.573 2.810 1.00 0.00 H new ATOM 859 N ARG A 136 -3.613 -12.618 2.759 1.00 0.00 N ATOM 860 CA ARG A 136 -5.006 -12.328 3.141 1.00 0.00 C ATOM 861 C ARG A 136 -5.726 -11.445 2.099 1.00 0.00 C ATOM 862 O ARG A 136 -6.790 -11.803 1.616 1.00 0.00 O ATOM 863 CB ARG A 136 -4.893 -11.587 4.469 1.00 0.00 C ATOM 864 CG ARG A 136 -6.213 -11.451 5.238 1.00 0.00 C ATOM 865 CD ARG A 136 -6.076 -10.399 6.331 1.00 0.00 C ATOM 866 NE ARG A 136 -6.155 -9.043 5.729 1.00 0.00 N ATOM 867 CZ ARG A 136 -5.543 -7.942 6.179 1.00 0.00 C ATOM 868 NH1 ARG A 136 -4.886 -7.911 7.322 1.00 0.00 N ATOM 869 NH2 ARG A 136 -5.718 -6.797 5.536 1.00 0.00 N ATOM 0 H ARG A 136 -2.925 -12.185 3.374 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.594 -13.243 3.208 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.172 -12.107 5.100 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.493 -10.591 4.281 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.015 -11.173 4.554 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.487 -12.410 5.678 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.865 -10.525 7.073 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.126 -10.522 6.852 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.731 -8.942 4.893 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.830 -8.749 7.901 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -4.434 -7.049 7.627 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -6.314 -6.763 4.709 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -5.257 -5.950 5.868 1.00 0.00 H new ATOM 870 N THR A 137 -4.984 -10.452 1.612 1.00 0.00 N ATOM 871 CA THR A 137 -5.479 -9.300 0.835 1.00 0.00 C ATOM 872 C THR A 137 -5.693 -9.528 -0.667 1.00 0.00 C ATOM 873 O THR A 137 -4.746 -9.524 -1.459 1.00 0.00 O ATOM 874 CB THR A 137 -4.563 -8.096 1.067 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.201 -8.518 1.219 1.00 0.00 O ATOM 876 CG2 THR A 137 -5.053 -7.268 2.247 1.00 0.00 C ATOM 0 H THR A 137 -3.974 -10.420 1.751 1.00 0.00 H new ATOM 0 HA THR A 137 -6.484 -9.119 1.215 1.00 0.00 H new ATOM 0 HB THR A 137 -4.598 -7.450 0.190 1.00 0.00 H new ATOM 0 HG1 THR A 137 -3.029 -9.285 0.633 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.388 -6.417 2.395 1.00 0.00 H new ATOM 0 HG22 THR A 137 -6.062 -6.909 2.046 1.00 0.00 H new ATOM 0 HG23 THR A 137 -5.060 -7.884 3.146 1.00 0.00 H new ATOM 877 N HIS A 138 -6.973 -9.601 -1.017 1.00 0.00 N ATOM 878 CA HIS A 138 -7.433 -9.718 -2.420 1.00 0.00 C ATOM 879 C HIS A 138 -8.694 -8.885 -2.717 1.00 0.00 C ATOM 880 O HIS A 138 -9.348 -8.352 -1.818 1.00 0.00 O ATOM 881 CB HIS A 138 -7.647 -11.186 -2.808 1.00 0.00 C ATOM 882 CG HIS A 138 -8.747 -11.901 -2.021 1.00 0.00 C ATOM 883 ND1 HIS A 138 -10.049 -11.602 -1.971 1.00 0.00 N ATOM 884 CD2 HIS A 138 -8.534 -12.916 -1.190 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.628 -12.405 -1.085 1.00 0.00 C ATOM 886 NE2 HIS A 138 -9.696 -13.219 -0.604 1.00 0.00 N ATOM 0 H HIS A 138 -7.735 -9.582 -0.340 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.636 -9.303 -3.037 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.888 -11.236 -3.870 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.710 -11.725 -2.668 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -10.518 -10.881 -2.519 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -7.588 -13.409 -1.019 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.671 -12.397 -0.806 1.00 0.00 H new ATOM 887 N TYR A 139 -8.899 -8.642 -4.014 1.00 0.00 N ATOM 888 CA TYR A 139 -10.117 -7.982 -4.523 1.00 0.00 C ATOM 889 C TYR A 139 -11.441 -8.478 -3.940 1.00 0.00 C ATOM 890 O TYR A 139 -11.633 -9.666 -3.686 1.00 0.00 O ATOM 891 CB TYR A 139 -10.159 -7.991 -6.050 1.00 0.00 C ATOM 892 CG TYR A 139 -10.309 -6.574 -6.643 1.00 0.00 C ATOM 893 CD1 TYR A 139 -11.145 -5.604 -6.039 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.517 -6.262 -7.773 1.00 0.00 C ATOM 895 CE1 TYR A 139 -11.175 -4.293 -6.550 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.551 -4.949 -8.298 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.376 -3.987 -7.676 1.00 0.00 C ATOM 898 OH TYR A 139 -10.318 -2.688 -8.097 1.00 0.00 O ATOM 0 H TYR A 139 -8.232 -8.894 -4.743 1.00 0.00 H new ATOM 0 HA TYR A 139 -10.027 -6.957 -4.162 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.246 -8.447 -6.433 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.990 -8.612 -6.384 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.757 -5.869 -5.190 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -8.894 -7.017 -8.229 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.795 -3.537 -6.092 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.956 -4.687 -9.160 1.00 0.00 H new ATOM 0 HH TYR A 139 -10.597 -2.635 -9.035 1.00 0.00 H new ATOM 899 N GLY A 140 -12.138 -7.463 -3.431 1.00 0.00 N ATOM 900 CA GLY A 140 -13.441 -7.599 -2.754 1.00 0.00 C ATOM 901 C GLY A 140 -13.318 -7.041 -1.331 1.00 0.00 C ATOM 902 O GLY A 140 -14.204 -6.341 -0.843 1.00 0.00 O ATOM 0 H GLY A 140 -11.811 -6.498 -3.475 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.211 -7.060 -3.306 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.744 -8.646 -2.724 1.00 0.00 H new ATOM 903 N GLN A 141 -12.145 -7.261 -0.747 1.00 0.00 N ATOM 904 CA GLN A 141 -11.792 -6.660 0.547 1.00 0.00 C ATOM 905 C GLN A 141 -11.623 -5.165 0.414 1.00 0.00 C ATOM 906 O GLN A 141 -10.728 -4.632 -0.250 1.00 0.00 O ATOM 907 CB GLN A 141 -10.472 -7.220 1.063 1.00 0.00 C ATOM 908 CG GLN A 141 -10.597 -8.723 1.359 1.00 0.00 C ATOM 909 CD GLN A 141 -9.248 -9.369 1.659 1.00 0.00 C ATOM 910 OE1 GLN A 141 -8.463 -8.951 2.496 1.00 0.00 O ATOM 911 NE2 GLN A 141 -8.968 -10.410 0.906 1.00 0.00 N ATOM 0 H GLN A 141 -11.416 -7.852 -1.146 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.602 -6.894 1.238 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.688 -7.054 0.325 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -10.175 -6.690 1.968 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -11.264 -8.869 2.208 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -11.054 -9.222 0.505 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -9.644 -10.736 0.215 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -8.075 -10.891 1.013 1.00 0.00 H new ATOM 912 N LYS A 142 -12.469 -4.548 1.205 1.00 0.00 N ATOM 913 CA LYS A 142 -12.378 -3.123 1.556 1.00 0.00 C ATOM 914 C LYS A 142 -10.987 -2.701 2.025 1.00 0.00 C ATOM 915 O LYS A 142 -10.554 -1.568 1.794 1.00 0.00 O ATOM 916 CB LYS A 142 -13.344 -2.869 2.693 1.00 0.00 C ATOM 917 CG LYS A 142 -14.765 -3.048 2.189 1.00 0.00 C ATOM 918 CD LYS A 142 -15.675 -2.694 3.362 1.00 0.00 C ATOM 919 CE LYS A 142 -16.533 -3.902 3.723 1.00 0.00 C ATOM 920 NZ LYS A 142 -17.410 -4.063 2.566 1.00 0.00 N ATOM 0 H LYS A 142 -13.262 -5.020 1.639 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.608 -2.548 0.659 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -13.147 -3.558 3.514 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.208 -1.860 3.083 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.960 -2.400 1.334 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.936 -4.072 1.858 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -15.077 -2.390 4.221 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -16.311 -1.848 3.100 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -15.924 -4.790 3.890 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -17.103 -3.730 4.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -18.367 -4.312 2.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -17.446 -3.172 2.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.043 -4.820 1.955 1.00 0.00 H new ATOM 921 N ALA A 143 -10.283 -3.682 2.593 1.00 0.00 N ATOM 922 CA ALA A 143 -8.885 -3.572 3.004 1.00 0.00 C ATOM 923 C ALA A 143 -7.965 -3.038 1.899 1.00 0.00 C ATOM 924 O ALA A 143 -7.237 -2.079 2.150 1.00 0.00 O ATOM 925 CB ALA A 143 -8.370 -4.925 3.504 1.00 0.00 C ATOM 0 H ALA A 143 -10.683 -4.601 2.785 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.860 -2.841 3.812 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.327 -4.828 3.807 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.967 -5.249 4.357 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.449 -5.662 2.705 1.00 0.00 H new ATOM 926 N ILE A 144 -8.156 -3.495 0.661 1.00 0.00 N ATOM 927 CA ILE A 144 -7.261 -3.151 -0.458 1.00 0.00 C ATOM 928 C ILE A 144 -7.613 -1.870 -1.236 1.00 0.00 C ATOM 929 O ILE A 144 -6.799 -1.357 -1.998 1.00 0.00 O ATOM 930 CB ILE A 144 -7.051 -4.339 -1.438 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.307 -4.720 -2.201 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.364 -5.499 -0.705 1.00 0.00 C ATOM 933 CD1 ILE A 144 -7.929 -5.501 -3.459 1.00 0.00 C ATOM 0 H ILE A 144 -8.927 -4.110 0.401 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.321 -2.929 0.047 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.376 -4.021 -2.232 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.959 -5.323 -1.569 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.865 -3.824 -2.472 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.218 -6.330 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.397 -5.168 -0.326 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.988 -5.824 0.128 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -8.833 -5.773 -4.004 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.294 -4.883 -4.094 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.389 -6.405 -3.177 1.00 0.00 H new ATOM 934 N LEU A 145 -8.772 -1.274 -0.936 1.00 0.00 N ATOM 935 CA LEU A 145 -9.295 -0.170 -1.772 1.00 0.00 C ATOM 936 C LEU A 145 -8.856 1.191 -1.222 1.00 0.00 C ATOM 937 O LEU A 145 -9.245 1.548 -0.109 1.00 0.00 O ATOM 938 CB LEU A 145 -10.824 -0.114 -1.885 1.00 0.00 C ATOM 939 CG LEU A 145 -11.626 -1.423 -1.803 1.00 0.00 C ATOM 940 CD1 LEU A 145 -13.110 -1.085 -1.975 1.00 0.00 C ATOM 941 CD2 LEU A 145 -11.232 -2.469 -2.830 1.00 0.00 C ATOM 0 H LEU A 145 -9.360 -1.524 -0.141 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.881 -0.378 -2.759 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -11.188 0.545 -1.097 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.066 0.361 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.409 -1.865 -0.831 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -13.700 -2.000 -1.920 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -13.422 -0.404 -1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -13.265 -0.610 -2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -11.848 -3.358 -2.699 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -11.381 -2.069 -3.833 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -10.183 -2.732 -2.697 1.00 0.00 H new ATOM 942 N PHE A 146 -7.806 1.743 -1.840 1.00 0.00 N ATOM 943 CA PHE A 146 -7.400 3.153 -1.601 1.00 0.00 C ATOM 944 C PHE A 146 -6.926 4.005 -2.754 1.00 0.00 C ATOM 945 O PHE A 146 -6.031 3.662 -3.532 1.00 0.00 O ATOM 946 CB PHE A 146 -6.420 3.270 -0.415 1.00 0.00 C ATOM 947 CG PHE A 146 -5.599 2.017 -0.162 1.00 0.00 C ATOM 948 CD1 PHE A 146 -4.634 1.624 -1.111 1.00 0.00 C ATOM 949 CD2 PHE A 146 -5.933 1.200 0.946 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.001 0.375 -0.958 1.00 0.00 C ATOM 951 CE2 PHE A 146 -5.295 -0.042 1.098 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.332 -0.445 0.142 1.00 0.00 C ATOM 0 H PHE A 146 -7.217 1.246 -2.509 1.00 0.00 H new ATOM 0 HA PHE A 146 -8.371 3.596 -1.377 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.743 4.104 -0.598 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -6.984 3.510 0.486 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.384 2.269 -1.941 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -6.669 1.528 1.665 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.266 0.047 -1.678 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -5.536 -0.682 1.934 1.00 0.00 H new ATOM 0 HZ PHE A 146 -3.840 -1.400 0.257 1.00 0.00 H new ATOM 953 N LEU A 147 -7.448 5.219 -2.721 1.00 0.00 N ATOM 954 CA LEU A 147 -7.109 6.237 -3.725 1.00 0.00 C ATOM 955 C LEU A 147 -5.770 6.950 -3.420 1.00 0.00 C ATOM 956 O LEU A 147 -5.406 7.098 -2.252 1.00 0.00 O ATOM 957 CB LEU A 147 -8.283 7.202 -3.954 1.00 0.00 C ATOM 958 CG LEU A 147 -8.874 7.833 -2.700 1.00 0.00 C ATOM 959 CD1 LEU A 147 -8.037 9.021 -2.230 1.00 0.00 C ATOM 960 CD2 LEU A 147 -10.298 8.319 -2.987 1.00 0.00 C ATOM 0 H LEU A 147 -8.111 5.533 -2.012 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.942 5.724 -4.672 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.949 8.000 -4.617 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.075 6.664 -4.476 1.00 0.00 H new ATOM 0 HG LEU A 147 -8.881 7.075 -1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.485 9.450 -1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -7.024 8.686 -2.005 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.004 9.776 -3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -10.717 8.770 -2.087 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -10.276 9.059 -3.787 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -10.916 7.474 -3.291 1.00 0.00 H new ATOM 961 N PRO A 148 -4.951 7.169 -4.461 1.00 0.00 N ATOM 962 CA PRO A 148 -3.838 8.127 -4.393 1.00 0.00 C ATOM 963 C PRO A 148 -4.353 9.566 -4.276 1.00 0.00 C ATOM 964 O PRO A 148 -5.552 9.823 -4.174 1.00 0.00 O ATOM 965 CB PRO A 148 -2.999 7.889 -5.646 1.00 0.00 C ATOM 966 CG PRO A 148 -3.836 6.998 -6.555 1.00 0.00 C ATOM 967 CD PRO A 148 -4.805 6.279 -5.621 1.00 0.00 C ATOM 0 HA PRO A 148 -3.226 7.979 -3.503 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -2.759 8.831 -6.138 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -2.053 7.410 -5.396 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.370 7.586 -7.301 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.211 6.289 -7.097 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -5.765 6.105 -6.107 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -4.416 5.305 -5.324 1.00 0.00 H new