USER MOD reduce.3.24.130724 H: found=0, std=0, add=1022, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1022 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 112 GLN : amide:sc= -3.38! K(o=-4.4!,f=0.19) USER MOD Set 1.2: A 113 THR OG1 : rot 180:sc= 0.116 USER MOD Set 1.3: A 116 ASN : amide:sc= -1.13 K(o=-4.4,f=0.19) USER MOD Set 2.1: A 109 ASN : amide:sc= 0.817 K(o=1.8,f=-4.9) USER MOD Set 2.2: A 110 LYS NZ :NH3+ -171:sc= 0.943 (180deg=0) USER MOD Set 3.1: A 96 ASN : amide:sc= -1.22 K(o=-1.3,f=-6.3!) USER MOD Set 3.2: A 98 ASN : amide:sc= -0.126 K(o=-1.3,f=-6.3) USER MOD Set 4.1: A 72 SER OG : rot -130:sc= 0.266 USER MOD Set 4.2: A 75 ASN : amide:sc= -2.05! C(o=-1.8!,f=-4.6!) USER MOD Set 5.1: A 17 SER OG : rot 150:sc= 0.344 USER MOD Set 5.2: A 67 LYS NZ :NH3+ -176:sc= 0.864 (180deg=0.28) USER MOD Set 6.1: A 28 SER OG : rot -86:sc= 1.53 USER MOD Set 6.2: A 33 ASN : amide:sc= -0.452 K(o=4.4,f=-13!) USER MOD Set 6.3: A 35 LYS NZ :NH3+ 171:sc= 3.28 (180deg=0.756) USER MOD Set 7.1: A 27 SER OG : rot 98:sc= 0.773 USER MOD Set 7.2: A 29 GLN : amide:sc= -0.166 K(o=1.1,f=0.28) USER MOD Set 7.3: A 36 HIS : no HE2:sc= 0.469 K(o=1.1,f=-4.2!) USER MOD Set 8.1: A 6 TYR OH : rot -11:sc= 1.92 USER MOD Set 8.2: A 120 LYS NZ :NH3+ 168:sc= -0.626! (180deg=-1.88!) USER MOD Single : A 1 CYS N :NH3+ 147:sc= 0.721 (180deg=0.212) USER MOD Single : A 1 CYS SG : rot 180:sc= 0.184 USER MOD Single : A 2 LYS NZ :NH3+ 166:sc= -0.0398 (180deg=-0.307) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 152:sc= 2.3 (180deg=-0.419) USER MOD Single : A 7 LYS NZ :NH3+ -165:sc= 0.918 (180deg=0.755) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -153:sc= 0.805 (180deg=-0.324!) USER MOD Single : A 23 GLN : amide:sc= -1.93 K(o=-1.9,f=-5.7!) USER MOD Single : A 25 HIS : no HD1:sc= 0.0913 K(o=2.3,f=-11!) USER MOD Single : A 26 SER OG : rot 95:sc= 0.706 USER MOD Single : A 31 MET CE :methyl -159:sc= -0.0909 (180deg=-0.55) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl -158:sc= -0.428 (180deg=-1.01) USER MOD Single : A 46 ASN : amide:sc= -0.952! C(o=-0.95!,f=-3.7!) USER MOD Single : A 47 MET CE :methyl -168:sc= -0.0244 (180deg=-0.243) USER MOD Single : A 55 SER OG : rot 7:sc= -1.03 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 158:sc= 1.2 (180deg=0.393) USER MOD Single : A 61 GLN : amide:sc= -0.0819 X(o=-0.082,f=-0.2) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.105 USER MOD Single : A 71 TYR OH : rot 74:sc= 1.18 USER MOD Single : A 74 HIS : no HE2:sc= 0.258 K(o=0.26,f=-5.4!) USER MOD Single : A 81 LYS NZ :NH3+ -110:sc= 0.554 (180deg=0.105) USER MOD Single : A 82 LYS NZ :NH3+ -142:sc= 0.97 (180deg=-0.367!) USER MOD Single : A 87 LYS NZ :NH3+ 160:sc= 1.39 (180deg=0.607) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -1.31! K(o=-1.3!,f=-0.0093) USER MOD Single : A 104 TYR OH : rot 30:sc= 0.63 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.0178 K(o=-0.018,f=-0.78) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.149 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 -2.416 -26.951 3.721 1.00 0.00 N ATOM 2 CA CYS A 1 -3.864 -26.821 3.579 1.00 0.00 C ATOM 3 C CYS A 1 -4.489 -27.300 4.862 1.00 0.00 C ATOM 4 O CYS A 1 -3.767 -27.795 5.722 1.00 0.00 O ATOM 5 CB CYS A 1 -4.314 -27.682 2.407 1.00 0.00 C ATOM 6 SG CYS A 1 -3.376 -27.356 0.900 1.00 0.00 S ATOM 0 H1 CYS A 1 -1.996 -27.180 2.798 1.00 0.00 H new ATOM 0 H2 CYS A 1 -2.019 -26.055 4.069 1.00 0.00 H new ATOM 0 H3 CYS A 1 -2.200 -27.711 4.398 1.00 0.00 H new ATOM 0 HA CYS A 1 -4.161 -25.790 3.389 1.00 0.00 H new ATOM 0 HB2 CYS A 1 -4.210 -28.734 2.674 1.00 0.00 H new ATOM 0 HB3 CYS A 1 -5.372 -27.504 2.217 1.00 0.00 H new ATOM 0 HG CYS A 1 -3.809 -28.124 -0.055 1.00 0.00 H new ATOM 14 N LYS A 2 -5.784 -27.141 5.007 1.00 0.00 N ATOM 15 CA LYS A 2 -6.485 -27.609 6.184 1.00 0.00 C ATOM 16 C LYS A 2 -7.928 -27.827 5.816 1.00 0.00 C ATOM 17 O LYS A 2 -8.373 -28.955 5.669 1.00 0.00 O ATOM 18 CB LYS A 2 -6.359 -26.621 7.361 1.00 0.00 C ATOM 19 CG LYS A 2 -7.031 -27.107 8.638 1.00 0.00 C ATOM 20 CD LYS A 2 -6.859 -26.118 9.777 1.00 0.00 C ATOM 21 CE LYS A 2 -7.534 -26.617 11.048 1.00 0.00 C ATOM 22 NZ LYS A 2 -6.977 -27.926 11.496 1.00 0.00 N ATOM 0 H LYS A 2 -6.381 -26.686 4.316 1.00 0.00 H new ATOM 0 HA LYS A 2 -6.037 -28.544 6.520 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -5.303 -26.441 7.562 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -6.796 -25.665 7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -8.093 -27.266 8.452 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -6.610 -28.070 8.926 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -5.797 -25.957 9.965 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -7.282 -25.154 9.492 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -7.408 -25.879 11.840 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -8.605 -26.719 10.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -7.282 -28.118 12.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -7.322 -28.682 10.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -5.938 -27.892 11.459 1.00 0.00 H new ATOM 36 N THR A 3 -8.639 -26.752 5.622 1.00 0.00 N ATOM 37 CA THR A 3 -9.989 -26.831 5.187 1.00 0.00 C ATOM 38 C THR A 3 -9.979 -26.879 3.659 1.00 0.00 C ATOM 39 O THR A 3 -10.169 -25.858 2.984 1.00 0.00 O ATOM 40 CB THR A 3 -10.794 -25.620 5.702 1.00 0.00 C ATOM 41 OG1 THR A 3 -10.530 -25.454 7.118 1.00 0.00 O ATOM 42 CG2 THR A 3 -12.293 -25.835 5.499 1.00 0.00 C ATOM 0 H THR A 3 -8.293 -25.803 5.763 1.00 0.00 H new ATOM 0 HA THR A 3 -10.470 -27.725 5.584 1.00 0.00 H new ATOM 0 HB THR A 3 -10.491 -24.733 5.145 1.00 0.00 H new ATOM 0 HG1 THR A 3 -11.035 -24.686 7.457 1.00 0.00 H new ATOM 0 HG21 THR A 3 -12.839 -24.967 5.870 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.501 -25.968 4.437 1.00 0.00 H new ATOM 0 HG23 THR A 3 -12.610 -26.724 6.045 1.00 0.00 H new ATOM 50 N LYS A 4 -9.620 -28.067 3.144 1.00 0.00 N ATOM 51 CA LYS A 4 -9.487 -28.341 1.716 1.00 0.00 C ATOM 52 C LYS A 4 -8.258 -27.537 1.157 1.00 0.00 C ATOM 53 O LYS A 4 -7.468 -26.952 1.937 1.00 0.00 O ATOM 54 CB LYS A 4 -10.823 -27.974 0.983 1.00 0.00 C ATOM 55 CG LYS A 4 -11.005 -28.534 -0.434 1.00 0.00 C ATOM 56 CD LYS A 4 -12.262 -28.016 -1.106 1.00 0.00 C ATOM 57 CE LYS A 4 -12.237 -26.492 -1.265 1.00 0.00 C ATOM 58 NZ LYS A 4 -10.979 -26.003 -1.891 1.00 0.00 N ATOM 0 H LYS A 4 -9.411 -28.877 3.728 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.304 -29.401 1.540 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.655 -28.321 1.596 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.896 -26.888 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -10.138 -28.270 -1.040 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -11.043 -29.622 -0.389 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -12.368 -28.482 -2.086 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -13.134 -28.306 -0.519 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -13.086 -26.180 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -12.357 -26.026 -0.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.166 -25.115 -2.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.266 -25.835 -1.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.624 -26.716 -2.559 1.00 0.00 H new ATOM 72 N ASP A 5 -8.044 -27.605 -0.140 1.00 0.00 N ATOM 73 CA ASP A 5 -7.036 -26.816 -0.836 1.00 0.00 C ATOM 74 C ASP A 5 -7.528 -25.378 -0.967 1.00 0.00 C ATOM 75 O ASP A 5 -8.723 -25.095 -0.746 1.00 0.00 O ATOM 76 CB ASP A 5 -6.858 -27.363 -2.271 1.00 0.00 C ATOM 77 CG ASP A 5 -8.033 -26.996 -3.203 1.00 0.00 C ATOM 78 OD1 ASP A 5 -9.158 -27.520 -3.019 1.00 0.00 O ATOM 79 OD2 ASP A 5 -7.852 -26.171 -4.124 1.00 0.00 O ATOM 0 H ASP A 5 -8.574 -28.221 -0.757 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.101 -26.865 -0.278 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -5.931 -26.972 -2.691 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -6.757 -28.448 -2.231 1.00 0.00 H new ATOM 84 N TYR A 6 -6.647 -24.495 -1.341 1.00 0.00 N ATOM 85 CA TYR A 6 -7.019 -23.161 -1.660 1.00 0.00 C ATOM 86 C TYR A 6 -6.301 -22.810 -2.934 1.00 0.00 C ATOM 87 O TYR A 6 -5.164 -23.237 -3.133 1.00 0.00 O ATOM 88 CB TYR A 6 -6.693 -22.141 -0.522 1.00 0.00 C ATOM 89 CG TYR A 6 -5.218 -21.767 -0.310 1.00 0.00 C ATOM 90 CD1 TYR A 6 -4.626 -20.749 -1.065 1.00 0.00 C ATOM 91 CD2 TYR A 6 -4.437 -22.395 0.657 1.00 0.00 C ATOM 92 CE1 TYR A 6 -3.315 -20.375 -0.869 1.00 0.00 C ATOM 93 CE2 TYR A 6 -3.112 -22.023 0.856 1.00 0.00 C ATOM 94 CZ TYR A 6 -2.557 -21.013 0.086 1.00 0.00 C ATOM 95 OH TYR A 6 -1.243 -20.619 0.291 1.00 0.00 O ATOM 0 H TYR A 6 -5.649 -24.688 -1.431 1.00 0.00 H new ATOM 0 HA TYR A 6 -8.101 -23.101 -1.781 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -7.248 -21.224 -0.722 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -7.076 -22.547 0.414 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -5.211 -20.244 -1.820 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -4.866 -23.181 1.260 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -2.883 -19.583 -1.463 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -2.517 -22.520 1.608 1.00 0.00 H new ATOM 0 HH TYR A 6 -0.967 -20.015 -0.429 1.00 0.00 H new ATOM 105 N LYS A 7 -6.957 -22.110 -3.809 1.00 0.00 N ATOM 106 CA LYS A 7 -6.342 -21.684 -5.033 1.00 0.00 C ATOM 107 C LYS A 7 -6.566 -20.216 -5.248 1.00 0.00 C ATOM 108 O LYS A 7 -7.503 -19.799 -5.921 1.00 0.00 O ATOM 109 CB LYS A 7 -6.758 -22.526 -6.260 1.00 0.00 C ATOM 110 CG LYS A 7 -6.140 -23.929 -6.295 1.00 0.00 C ATOM 111 CD LYS A 7 -6.489 -24.677 -7.582 1.00 0.00 C ATOM 112 CE LYS A 7 -7.944 -25.131 -7.620 1.00 0.00 C ATOM 113 NZ LYS A 7 -8.212 -26.223 -6.651 1.00 0.00 N ATOM 0 H LYS A 7 -7.928 -21.818 -3.698 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.271 -21.857 -4.927 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.844 -22.619 -6.272 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.473 -21.992 -7.167 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.057 -23.850 -6.204 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -6.491 -24.501 -5.436 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -6.291 -24.032 -8.438 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -5.838 -25.546 -7.681 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -8.594 -24.284 -7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.192 -25.470 -8.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -9.122 -26.673 -6.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -7.453 -26.931 -6.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -8.249 -25.831 -5.688 1.00 0.00 H new ATOM 127 N THR A 8 -5.747 -19.458 -4.600 1.00 0.00 N ATOM 128 CA THR A 8 -5.763 -18.039 -4.681 1.00 0.00 C ATOM 129 C THR A 8 -4.343 -17.650 -5.102 1.00 0.00 C ATOM 130 O THR A 8 -3.474 -18.524 -5.176 1.00 0.00 O ATOM 131 CB THR A 8 -6.097 -17.437 -3.283 1.00 0.00 C ATOM 132 OG1 THR A 8 -7.172 -18.187 -2.682 1.00 0.00 O ATOM 133 CG2 THR A 8 -6.547 -15.982 -3.408 1.00 0.00 C ATOM 0 H THR A 8 -5.025 -19.823 -3.979 1.00 0.00 H new ATOM 0 HA THR A 8 -6.511 -17.669 -5.382 1.00 0.00 H new ATOM 0 HB THR A 8 -5.197 -17.487 -2.670 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.382 -17.810 -1.802 1.00 0.00 H new ATOM 0 HG21 THR A 8 -6.774 -15.585 -2.419 1.00 0.00 H new ATOM 0 HG22 THR A 8 -5.750 -15.392 -3.861 1.00 0.00 H new ATOM 0 HG23 THR A 8 -7.438 -15.929 -4.033 1.00 0.00 H new ATOM 141 N ARG A 9 -4.085 -16.401 -5.386 1.00 0.00 N ATOM 142 CA ARG A 9 -2.753 -16.035 -5.750 1.00 0.00 C ATOM 143 C ARG A 9 -2.036 -15.555 -4.530 1.00 0.00 C ATOM 144 O ARG A 9 -2.417 -14.545 -3.939 1.00 0.00 O ATOM 145 CB ARG A 9 -2.736 -14.976 -6.840 1.00 0.00 C ATOM 146 CG ARG A 9 -3.361 -15.432 -8.147 1.00 0.00 C ATOM 147 CD ARG A 9 -3.169 -14.401 -9.239 1.00 0.00 C ATOM 148 NE ARG A 9 -3.912 -14.749 -10.454 1.00 0.00 N ATOM 149 CZ ARG A 9 -4.315 -13.850 -11.363 1.00 0.00 C ATOM 150 NH1 ARG A 9 -3.783 -12.633 -11.376 1.00 0.00 N ATOM 151 NH2 ARG A 9 -5.202 -14.186 -12.296 1.00 0.00 N ATOM 0 H ARG A 9 -4.764 -15.640 -5.372 1.00 0.00 H new ATOM 0 HA ARG A 9 -2.246 -16.910 -6.157 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -3.266 -14.092 -6.484 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -1.705 -14.676 -7.026 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -2.915 -16.378 -8.455 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -4.425 -15.614 -7.999 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -3.497 -13.426 -8.879 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -2.108 -14.314 -9.474 1.00 0.00 H new ATOM 0 HE ARG A 9 -4.135 -15.731 -10.617 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -3.067 -12.382 -10.694 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -4.090 -11.949 -12.068 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -5.580 -15.133 -12.323 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -5.504 -13.497 -12.984 1.00 0.00 H new ATOM 165 N ASP A 10 -1.046 -16.309 -4.127 1.00 0.00 N ATOM 166 CA ASP A 10 -0.257 -15.985 -2.959 1.00 0.00 C ATOM 167 C ASP A 10 0.717 -14.917 -3.318 1.00 0.00 C ATOM 168 O ASP A 10 1.815 -15.191 -3.822 1.00 0.00 O ATOM 169 CB ASP A 10 0.504 -17.194 -2.468 1.00 0.00 C ATOM 170 CG ASP A 10 0.291 -17.509 -0.996 1.00 0.00 C ATOM 171 OD1 ASP A 10 -0.610 -18.308 -0.666 1.00 0.00 O ATOM 172 OD2 ASP A 10 1.073 -17.048 -0.144 1.00 0.00 O ATOM 0 H ASP A 10 -0.761 -17.168 -4.598 1.00 0.00 H new ATOM 0 HA ASP A 10 -0.927 -15.649 -2.167 1.00 0.00 H new ATOM 0 HB2 ASP A 10 0.209 -18.060 -3.060 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.568 -17.036 -2.644 1.00 0.00 H new ATOM 177 N VAL A 11 0.296 -13.715 -3.147 1.00 0.00 N ATOM 178 CA VAL A 11 1.122 -12.575 -3.418 1.00 0.00 C ATOM 179 C VAL A 11 2.147 -12.423 -2.335 1.00 0.00 C ATOM 180 O VAL A 11 1.935 -11.797 -1.310 1.00 0.00 O ATOM 181 CB VAL A 11 0.334 -11.248 -3.609 1.00 0.00 C ATOM 182 CG1 VAL A 11 -0.340 -11.199 -4.951 1.00 0.00 C ATOM 183 CG2 VAL A 11 -0.700 -11.088 -2.525 1.00 0.00 C ATOM 0 H VAL A 11 -0.639 -13.484 -2.812 1.00 0.00 H new ATOM 0 HA VAL A 11 1.606 -12.769 -4.375 1.00 0.00 H new ATOM 0 HB VAL A 11 1.053 -10.431 -3.551 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -0.882 -10.259 -5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.411 -11.272 -5.738 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -1.038 -12.031 -5.038 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -1.242 -10.154 -2.674 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.399 -11.923 -2.563 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -0.208 -11.071 -1.553 1.00 0.00 H new ATOM 193 N THR A 12 3.200 -13.094 -2.485 1.00 0.00 N ATOM 194 CA THR A 12 4.232 -12.945 -1.537 1.00 0.00 C ATOM 195 C THR A 12 5.379 -12.186 -2.113 1.00 0.00 C ATOM 196 O THR A 12 6.064 -11.455 -1.416 1.00 0.00 O ATOM 197 CB THR A 12 4.708 -14.266 -0.982 1.00 0.00 C ATOM 198 OG1 THR A 12 5.431 -15.005 -1.977 1.00 0.00 O ATOM 199 CG2 THR A 12 3.543 -15.088 -0.539 1.00 0.00 C ATOM 0 H THR A 12 3.383 -13.750 -3.244 1.00 0.00 H new ATOM 0 HA THR A 12 3.809 -12.379 -0.707 1.00 0.00 H new ATOM 0 HB THR A 12 5.363 -14.055 -0.136 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.732 -15.857 -1.597 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.899 -16.038 -0.141 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.994 -14.553 0.235 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.885 -15.274 -1.388 1.00 0.00 H new ATOM 207 N ASP A 13 5.544 -12.334 -3.384 1.00 0.00 N ATOM 208 CA ASP A 13 6.583 -11.714 -4.148 1.00 0.00 C ATOM 209 C ASP A 13 6.227 -10.269 -4.368 1.00 0.00 C ATOM 210 O ASP A 13 7.072 -9.374 -4.212 1.00 0.00 O ATOM 211 CB ASP A 13 6.740 -12.460 -5.488 1.00 0.00 C ATOM 212 CG ASP A 13 5.430 -12.550 -6.265 1.00 0.00 C ATOM 213 OD1 ASP A 13 4.403 -13.005 -5.654 1.00 0.00 O ATOM 214 OD2 ASP A 13 5.397 -12.134 -7.419 1.00 0.00 O ATOM 0 H ASP A 13 4.929 -12.919 -3.950 1.00 0.00 H new ATOM 0 HA ASP A 13 7.533 -11.762 -3.616 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.486 -11.951 -6.098 1.00 0.00 H new ATOM 0 HB3 ASP A 13 7.116 -13.465 -5.298 1.00 0.00 H new ATOM 219 N ASP A 14 4.956 -10.018 -4.608 1.00 0.00 N ATOM 220 CA ASP A 14 4.515 -8.645 -4.843 1.00 0.00 C ATOM 221 C ASP A 14 4.452 -7.924 -3.539 1.00 0.00 C ATOM 222 O ASP A 14 4.817 -6.748 -3.418 1.00 0.00 O ATOM 223 CB ASP A 14 3.161 -8.552 -5.513 1.00 0.00 C ATOM 224 CG ASP A 14 2.912 -7.136 -5.948 1.00 0.00 C ATOM 225 OD1 ASP A 14 3.544 -6.702 -6.916 1.00 0.00 O ATOM 226 OD2 ASP A 14 2.159 -6.401 -5.286 1.00 0.00 O ATOM 0 H ASP A 14 4.220 -10.723 -4.647 1.00 0.00 H new ATOM 0 HA ASP A 14 5.240 -8.194 -5.520 1.00 0.00 H new ATOM 0 HB2 ASP A 14 3.123 -9.220 -6.374 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.380 -8.875 -4.824 1.00 0.00 H new ATOM 231 N VAL A 15 4.042 -8.646 -2.540 1.00 0.00 N ATOM 232 CA VAL A 15 3.974 -8.119 -1.220 1.00 0.00 C ATOM 233 C VAL A 15 5.392 -7.965 -0.635 1.00 0.00 C ATOM 234 O VAL A 15 5.625 -7.155 0.234 1.00 0.00 O ATOM 235 CB VAL A 15 3.000 -8.944 -0.322 1.00 0.00 C ATOM 236 CG1 VAL A 15 2.991 -8.434 1.114 1.00 0.00 C ATOM 237 CG2 VAL A 15 1.584 -8.836 -0.899 1.00 0.00 C ATOM 0 H VAL A 15 3.746 -9.619 -2.622 1.00 0.00 H new ATOM 0 HA VAL A 15 3.544 -7.118 -1.254 1.00 0.00 H new ATOM 0 HB VAL A 15 3.339 -9.980 -0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.301 -9.033 1.709 1.00 0.00 H new ATOM 0 HG12 VAL A 15 3.994 -8.512 1.534 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.671 -7.392 1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 15 0.894 -9.409 -0.280 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.276 -7.791 -0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.574 -9.232 -1.915 1.00 0.00 H new ATOM 247 N LYS A 16 6.356 -8.701 -1.181 1.00 0.00 N ATOM 248 CA LYS A 16 7.754 -8.518 -0.783 1.00 0.00 C ATOM 249 C LYS A 16 8.258 -7.179 -1.370 1.00 0.00 C ATOM 250 O LYS A 16 9.091 -6.496 -0.782 1.00 0.00 O ATOM 251 CB LYS A 16 8.639 -9.675 -1.271 1.00 0.00 C ATOM 252 CG LYS A 16 9.652 -10.176 -0.230 1.00 0.00 C ATOM 253 CD LYS A 16 8.968 -10.915 0.942 1.00 0.00 C ATOM 254 CE LYS A 16 8.315 -12.221 0.475 1.00 0.00 C ATOM 255 NZ LYS A 16 7.598 -12.945 1.561 1.00 0.00 N ATOM 0 H LYS A 16 6.202 -9.419 -1.889 1.00 0.00 H new ATOM 0 HA LYS A 16 7.813 -8.504 0.305 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.000 -10.506 -1.568 1.00 0.00 H new ATOM 0 HB3 LYS A 16 9.179 -9.354 -2.162 1.00 0.00 H new ATOM 0 HG2 LYS A 16 10.365 -10.845 -0.712 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.220 -9.330 0.158 1.00 0.00 H new ATOM 0 HD2 LYS A 16 9.704 -11.131 1.717 1.00 0.00 H new ATOM 0 HD3 LYS A 16 8.213 -10.269 1.390 1.00 0.00 H new ATOM 0 HE2 LYS A 16 7.613 -12.000 -0.329 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.082 -12.874 0.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.581 -13.963 1.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.089 -12.789 2.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.623 -12.589 1.631 1.00 0.00 H new ATOM 269 N SER A 17 7.718 -6.821 -2.535 1.00 0.00 N ATOM 270 CA SER A 17 7.967 -5.524 -3.158 1.00 0.00 C ATOM 271 C SER A 17 7.398 -4.423 -2.239 1.00 0.00 C ATOM 272 O SER A 17 8.000 -3.352 -2.062 1.00 0.00 O ATOM 273 CB SER A 17 7.309 -5.503 -4.563 1.00 0.00 C ATOM 274 OG SER A 17 7.344 -4.221 -5.185 1.00 0.00 O ATOM 0 H SER A 17 7.095 -7.424 -3.073 1.00 0.00 H new ATOM 0 HA SER A 17 9.034 -5.346 -3.287 1.00 0.00 H new ATOM 0 HB2 SER A 17 7.816 -6.224 -5.204 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.272 -5.828 -4.476 1.00 0.00 H new ATOM 0 HG SER A 17 7.382 -4.330 -6.158 1.00 0.00 H new ATOM 280 N ILE A 18 6.253 -4.723 -1.648 1.00 0.00 N ATOM 281 CA ILE A 18 5.624 -3.877 -0.650 1.00 0.00 C ATOM 282 C ILE A 18 6.532 -3.748 0.574 1.00 0.00 C ATOM 283 O ILE A 18 6.705 -2.655 1.117 1.00 0.00 O ATOM 284 CB ILE A 18 4.248 -4.468 -0.251 1.00 0.00 C ATOM 285 CG1 ILE A 18 3.209 -4.184 -1.352 1.00 0.00 C ATOM 286 CG2 ILE A 18 3.799 -4.004 1.138 1.00 0.00 C ATOM 287 CD1 ILE A 18 1.875 -4.866 -1.152 1.00 0.00 C ATOM 0 H ILE A 18 5.728 -5.573 -1.852 1.00 0.00 H new ATOM 0 HA ILE A 18 5.467 -2.883 -1.068 1.00 0.00 H new ATOM 0 HB ILE A 18 4.347 -5.550 -0.169 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.046 -3.108 -1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.621 -4.497 -2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 18 2.830 -4.444 1.373 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.531 -4.320 1.881 1.00 0.00 H new ATOM 0 HG23 ILE A 18 3.716 -2.917 1.149 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.208 -4.609 -1.975 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.019 -5.946 -1.126 1.00 0.00 H new ATOM 0 HD13 ILE A 18 1.435 -4.536 -0.211 1.00 0.00 H new ATOM 299 N VAL A 19 7.111 -4.867 0.978 1.00 0.00 N ATOM 300 CA VAL A 19 8.039 -4.912 2.090 1.00 0.00 C ATOM 301 C VAL A 19 9.209 -3.981 1.862 1.00 0.00 C ATOM 302 O VAL A 19 9.601 -3.258 2.771 1.00 0.00 O ATOM 303 CB VAL A 19 8.523 -6.340 2.368 1.00 0.00 C ATOM 304 CG1 VAL A 19 9.593 -6.364 3.449 1.00 0.00 C ATOM 305 CG2 VAL A 19 7.368 -7.159 2.819 1.00 0.00 C ATOM 0 H VAL A 19 6.948 -5.773 0.539 1.00 0.00 H new ATOM 0 HA VAL A 19 7.501 -4.570 2.974 1.00 0.00 H new ATOM 0 HB VAL A 19 8.952 -6.742 1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 19 9.914 -7.392 3.621 1.00 0.00 H new ATOM 0 HG12 VAL A 19 10.447 -5.766 3.129 1.00 0.00 H new ATOM 0 HG13 VAL A 19 9.187 -5.951 4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.700 -8.177 3.020 1.00 0.00 H new ATOM 0 HG22 VAL A 19 6.949 -6.728 3.728 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.606 -7.173 2.040 1.00 0.00 H new ATOM 315 N ARG A 20 9.739 -3.974 0.640 1.00 0.00 N ATOM 316 CA ARG A 20 10.794 -3.032 0.287 1.00 0.00 C ATOM 317 C ARG A 20 10.343 -1.607 0.597 1.00 0.00 C ATOM 318 O ARG A 20 11.061 -0.848 1.244 1.00 0.00 O ATOM 319 CB ARG A 20 11.172 -3.103 -1.200 1.00 0.00 C ATOM 320 CG ARG A 20 12.082 -1.946 -1.588 1.00 0.00 C ATOM 321 CD ARG A 20 12.253 -1.766 -3.073 1.00 0.00 C ATOM 322 NE ARG A 20 12.765 -0.421 -3.321 1.00 0.00 N ATOM 323 CZ ARG A 20 13.198 0.097 -4.450 1.00 0.00 C ATOM 324 NH1 ARG A 20 13.288 -0.643 -5.561 1.00 0.00 N ATOM 325 NH2 ARG A 20 13.540 1.382 -4.454 1.00 0.00 N ATOM 0 H ARG A 20 9.458 -4.603 -0.113 1.00 0.00 H new ATOM 0 HA ARG A 20 11.668 -3.305 0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 20 11.672 -4.049 -1.407 1.00 0.00 H new ATOM 0 HB3 ARG A 20 10.269 -3.080 -1.810 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.680 -1.025 -1.166 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.062 -2.102 -1.137 1.00 0.00 H new ATOM 0 HD2 ARG A 20 12.942 -2.512 -3.468 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.301 -1.909 -3.584 1.00 0.00 H new ATOM 0 HE ARG A 20 12.790 0.199 -2.511 1.00 0.00 H new ATOM 0 HH11 ARG A 20 13.018 -1.627 -5.542 1.00 0.00 H new ATOM 0 HH12 ARG A 20 13.626 -0.224 -6.427 1.00 0.00 H new ATOM 0 HH21 ARG A 20 13.462 1.933 -3.599 1.00 0.00 H new ATOM 0 HH22 ARG A 20 13.880 1.817 -5.312 1.00 0.00 H new ATOM 339 N PHE A 21 9.140 -1.278 0.161 1.00 0.00 N ATOM 340 CA PHE A 21 8.624 0.050 0.334 1.00 0.00 C ATOM 341 C PHE A 21 8.409 0.406 1.793 1.00 0.00 C ATOM 342 O PHE A 21 8.773 1.492 2.215 1.00 0.00 O ATOM 343 CB PHE A 21 7.351 0.277 -0.444 1.00 0.00 C ATOM 344 CG PHE A 21 6.886 1.698 -0.336 1.00 0.00 C ATOM 345 CD1 PHE A 21 7.595 2.706 -0.959 1.00 0.00 C ATOM 346 CD2 PHE A 21 5.770 2.032 0.411 1.00 0.00 C ATOM 347 CE1 PHE A 21 7.207 4.012 -0.843 1.00 0.00 C ATOM 348 CE2 PHE A 21 5.373 3.344 0.528 1.00 0.00 C ATOM 349 CZ PHE A 21 6.094 4.338 -0.099 1.00 0.00 C ATOM 0 H PHE A 21 8.508 -1.921 -0.316 1.00 0.00 H new ATOM 0 HA PHE A 21 9.392 0.713 -0.065 1.00 0.00 H new ATOM 0 HB2 PHE A 21 7.514 0.025 -1.492 1.00 0.00 H new ATOM 0 HB3 PHE A 21 6.573 -0.390 -0.073 1.00 0.00 H new ATOM 0 HD1 PHE A 21 8.468 2.460 -1.546 1.00 0.00 H new ATOM 0 HD2 PHE A 21 5.206 1.256 0.907 1.00 0.00 H new ATOM 0 HE1 PHE A 21 7.773 4.789 -1.335 1.00 0.00 H new ATOM 0 HE2 PHE A 21 4.498 3.595 1.110 1.00 0.00 H new ATOM 0 HZ PHE A 21 5.787 5.369 -0.007 1.00 0.00 H new ATOM 359 N VAL A 22 7.806 -0.483 2.563 1.00 0.00 N ATOM 360 CA VAL A 22 7.592 -0.197 3.958 1.00 0.00 C ATOM 361 C VAL A 22 8.917 -0.097 4.706 1.00 0.00 C ATOM 362 O VAL A 22 9.041 0.707 5.630 1.00 0.00 O ATOM 363 CB VAL A 22 6.593 -1.150 4.658 1.00 0.00 C ATOM 364 CG1 VAL A 22 5.193 -0.972 4.084 1.00 0.00 C ATOM 365 CG2 VAL A 22 7.027 -2.576 4.521 1.00 0.00 C ATOM 0 H VAL A 22 7.464 -1.391 2.248 1.00 0.00 H new ATOM 0 HA VAL A 22 7.107 0.779 3.992 1.00 0.00 H new ATOM 0 HB VAL A 22 6.574 -0.896 5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.504 -1.650 4.588 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.866 0.057 4.236 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.206 -1.195 3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.308 -3.225 5.021 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.080 -2.840 3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 22 8.009 -2.703 4.977 1.00 0.00 H new ATOM 375 N GLN A 23 9.907 -0.882 4.290 1.00 0.00 N ATOM 376 CA GLN A 23 11.258 -0.725 4.805 1.00 0.00 C ATOM 377 C GLN A 23 11.802 0.684 4.495 1.00 0.00 C ATOM 378 O GLN A 23 12.155 1.444 5.409 1.00 0.00 O ATOM 379 CB GLN A 23 12.189 -1.783 4.212 1.00 0.00 C ATOM 380 CG GLN A 23 11.986 -3.197 4.744 1.00 0.00 C ATOM 381 CD GLN A 23 12.370 -3.357 6.206 1.00 0.00 C ATOM 382 OE1 GLN A 23 12.277 -2.439 7.005 1.00 0.00 O ATOM 383 NE2 GLN A 23 12.817 -4.530 6.559 1.00 0.00 N ATOM 0 H GLN A 23 9.798 -1.627 3.602 1.00 0.00 H new ATOM 0 HA GLN A 23 11.220 -0.856 5.886 1.00 0.00 H new ATOM 0 HB2 GLN A 23 12.056 -1.796 3.130 1.00 0.00 H new ATOM 0 HB3 GLN A 23 13.220 -1.485 4.402 1.00 0.00 H new ATOM 0 HG2 GLN A 23 10.940 -3.477 4.619 1.00 0.00 H new ATOM 0 HG3 GLN A 23 12.575 -3.890 4.144 1.00 0.00 H new ATOM 0 HE21 GLN A 23 12.884 -5.279 5.870 1.00 0.00 H new ATOM 0 HE22 GLN A 23 13.100 -4.699 7.524 1.00 0.00 H new ATOM 392 N GLU A 24 11.799 1.063 3.214 1.00 0.00 N ATOM 393 CA GLU A 24 12.350 2.356 2.802 1.00 0.00 C ATOM 394 C GLU A 24 11.429 3.537 3.136 1.00 0.00 C ATOM 395 O GLU A 24 11.793 4.689 2.904 1.00 0.00 O ATOM 396 CB GLU A 24 12.745 2.403 1.304 1.00 0.00 C ATOM 397 CG GLU A 24 11.604 2.168 0.321 1.00 0.00 C ATOM 398 CD GLU A 24 11.981 2.478 -1.120 1.00 0.00 C ATOM 399 OE1 GLU A 24 12.690 1.676 -1.755 1.00 0.00 O ATOM 400 OE2 GLU A 24 11.555 3.537 -1.637 1.00 0.00 O ATOM 0 H GLU A 24 11.425 0.499 2.451 1.00 0.00 H new ATOM 0 HA GLU A 24 13.261 2.461 3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 24 13.190 3.376 1.093 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.517 1.654 1.125 1.00 0.00 H new ATOM 0 HG2 GLU A 24 11.282 1.129 0.390 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.753 2.785 0.608 1.00 0.00 H new ATOM 407 N HIS A 25 10.251 3.270 3.703 1.00 0.00 N ATOM 408 CA HIS A 25 9.305 4.356 4.034 1.00 0.00 C ATOM 409 C HIS A 25 9.799 5.155 5.244 1.00 0.00 C ATOM 410 O HIS A 25 9.270 6.212 5.562 1.00 0.00 O ATOM 411 CB HIS A 25 7.832 3.830 4.223 1.00 0.00 C ATOM 412 CG HIS A 25 7.291 3.729 5.651 1.00 0.00 C ATOM 413 ND1 HIS A 25 7.677 2.766 6.555 1.00 0.00 N ATOM 414 CD2 HIS A 25 6.373 4.493 6.302 1.00 0.00 C ATOM 415 CE1 HIS A 25 7.030 2.938 7.686 1.00 0.00 C ATOM 416 NE2 HIS A 25 6.234 3.974 7.559 1.00 0.00 N ATOM 0 H HIS A 25 9.927 2.333 3.942 1.00 0.00 H new ATOM 0 HA HIS A 25 9.271 5.035 3.182 1.00 0.00 H new ATOM 0 HB2 HIS A 25 7.167 4.483 3.658 1.00 0.00 H new ATOM 0 HB3 HIS A 25 7.768 2.841 3.769 1.00 0.00 H new ATOM 0 HD2 HIS A 25 5.851 5.349 5.901 1.00 0.00 H new ATOM 0 HE1 HIS A 25 7.136 2.329 8.572 1.00 0.00 H new ATOM 0 HE2 HIS A 25 5.611 4.334 8.282 1.00 0.00 H new ATOM 425 N SER A 26 10.834 4.648 5.860 1.00 0.00 N ATOM 426 CA SER A 26 11.462 5.217 7.041 1.00 0.00 C ATOM 427 C SER A 26 12.393 6.415 6.669 1.00 0.00 C ATOM 428 O SER A 26 13.468 6.571 7.221 1.00 0.00 O ATOM 429 CB SER A 26 12.253 4.090 7.691 1.00 0.00 C ATOM 430 OG SER A 26 11.423 2.927 7.793 1.00 0.00 O ATOM 0 H SER A 26 11.288 3.790 5.545 1.00 0.00 H new ATOM 0 HA SER A 26 10.713 5.617 7.725 1.00 0.00 H new ATOM 0 HB2 SER A 26 13.141 3.866 7.101 1.00 0.00 H new ATOM 0 HB3 SER A 26 12.596 4.394 8.680 1.00 0.00 H new ATOM 0 HG SER A 26 11.574 2.348 7.017 1.00 0.00 H new ATOM 436 N SER A 27 11.899 7.260 5.767 1.00 0.00 N ATOM 437 CA SER A 27 12.570 8.456 5.274 1.00 0.00 C ATOM 438 C SER A 27 13.847 8.143 4.461 1.00 0.00 C ATOM 439 O SER A 27 14.967 8.216 4.951 1.00 0.00 O ATOM 440 CB SER A 27 12.817 9.509 6.401 1.00 0.00 C ATOM 441 OG SER A 27 13.263 10.771 5.878 1.00 0.00 O ATOM 0 H SER A 27 10.982 7.122 5.343 1.00 0.00 H new ATOM 0 HA SER A 27 11.878 8.917 4.569 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.896 9.657 6.966 1.00 0.00 H new ATOM 0 HB3 SER A 27 13.561 9.124 7.099 1.00 0.00 H new ATOM 0 HG SER A 27 12.501 11.384 5.809 1.00 0.00 H new ATOM 447 N SER A 28 13.648 7.709 3.236 1.00 0.00 N ATOM 448 CA SER A 28 14.729 7.568 2.307 1.00 0.00 C ATOM 449 C SER A 28 14.639 8.746 1.357 1.00 0.00 C ATOM 450 O SER A 28 13.783 8.784 0.476 1.00 0.00 O ATOM 451 CB SER A 28 14.670 6.208 1.587 1.00 0.00 C ATOM 452 OG SER A 28 13.352 5.908 1.134 1.00 0.00 O ATOM 0 H SER A 28 12.735 7.447 2.865 1.00 0.00 H new ATOM 0 HA SER A 28 15.695 7.577 2.812 1.00 0.00 H new ATOM 0 HB2 SER A 28 15.354 6.216 0.738 1.00 0.00 H new ATOM 0 HB3 SER A 28 15.010 5.423 2.263 1.00 0.00 H new ATOM 0 HG SER A 28 12.849 5.475 1.855 1.00 0.00 H new ATOM 458 N GLN A 29 15.454 9.729 1.598 1.00 0.00 N ATOM 459 CA GLN A 29 15.337 10.979 0.899 1.00 0.00 C ATOM 460 C GLN A 29 16.196 11.031 -0.345 1.00 0.00 C ATOM 461 O GLN A 29 17.221 10.360 -0.443 1.00 0.00 O ATOM 462 CB GLN A 29 15.663 12.137 1.839 1.00 0.00 C ATOM 463 CG GLN A 29 14.876 12.075 3.139 1.00 0.00 C ATOM 464 CD GLN A 29 15.015 13.314 3.990 1.00 0.00 C ATOM 465 OE1 GLN A 29 15.197 14.422 3.482 1.00 0.00 O ATOM 466 NE2 GLN A 29 14.898 13.145 5.279 1.00 0.00 N ATOM 0 H GLN A 29 16.213 9.691 2.278 1.00 0.00 H new ATOM 0 HA GLN A 29 14.304 11.071 0.564 1.00 0.00 H new ATOM 0 HB2 GLN A 29 16.730 12.128 2.064 1.00 0.00 H new ATOM 0 HB3 GLN A 29 15.451 13.080 1.335 1.00 0.00 H new ATOM 0 HG2 GLN A 29 13.822 11.919 2.909 1.00 0.00 H new ATOM 0 HG3 GLN A 29 15.208 11.210 3.714 1.00 0.00 H new ATOM 0 HE21 GLN A 29 14.748 12.211 5.659 1.00 0.00 H new ATOM 0 HE22 GLN A 29 14.957 13.947 5.906 1.00 0.00 H new ATOM 475 N GLY A 30 15.743 11.803 -1.301 1.00 0.00 N ATOM 476 CA GLY A 30 16.462 12.009 -2.516 1.00 0.00 C ATOM 477 C GLY A 30 15.908 13.203 -3.236 1.00 0.00 C ATOM 478 O GLY A 30 15.208 14.020 -2.624 1.00 0.00 O ATOM 0 H GLY A 30 14.857 12.306 -1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 30 17.520 12.160 -2.302 1.00 0.00 H new ATOM 0 HA3 GLY A 30 16.387 11.124 -3.148 1.00 0.00 H new ATOM 482 N MET A 31 16.211 13.324 -4.514 1.00 0.00 N ATOM 483 CA MET A 31 15.682 14.415 -5.328 1.00 0.00 C ATOM 484 C MET A 31 14.282 14.051 -5.809 1.00 0.00 C ATOM 485 O MET A 31 13.314 14.678 -5.426 1.00 0.00 O ATOM 486 CB MET A 31 16.655 14.748 -6.495 1.00 0.00 C ATOM 487 CG MET A 31 16.189 15.848 -7.474 1.00 0.00 C ATOM 488 SD MET A 31 15.041 15.261 -8.757 1.00 0.00 S ATOM 489 CE MET A 31 16.103 14.170 -9.709 1.00 0.00 C ATOM 0 H MET A 31 16.822 12.681 -5.017 1.00 0.00 H new ATOM 0 HA MET A 31 15.600 15.323 -4.730 1.00 0.00 H new ATOM 0 HB2 MET A 31 17.611 15.051 -6.069 1.00 0.00 H new ATOM 0 HB3 MET A 31 16.834 13.836 -7.064 1.00 0.00 H new ATOM 0 HG2 MET A 31 15.707 16.644 -6.907 1.00 0.00 H new ATOM 0 HG3 MET A 31 17.064 16.285 -7.956 1.00 0.00 H new ATOM 0 HE1 MET A 31 15.684 14.033 -10.706 1.00 0.00 H new ATOM 0 HE2 MET A 31 17.097 14.610 -9.791 1.00 0.00 H new ATOM 0 HE3 MET A 31 16.174 13.204 -9.209 1.00 0.00 H new ATOM 499 N ARG A 32 14.191 12.994 -6.600 1.00 0.00 N ATOM 500 CA ARG A 32 12.903 12.512 -7.093 1.00 0.00 C ATOM 501 C ARG A 32 12.209 11.678 -6.019 1.00 0.00 C ATOM 502 O ARG A 32 11.003 11.501 -6.045 1.00 0.00 O ATOM 503 CB ARG A 32 13.096 11.703 -8.412 1.00 0.00 C ATOM 504 CG ARG A 32 11.868 10.909 -8.898 1.00 0.00 C ATOM 505 CD ARG A 32 10.645 11.783 -9.205 1.00 0.00 C ATOM 506 NE ARG A 32 10.792 12.585 -10.429 1.00 0.00 N ATOM 507 CZ ARG A 32 9.965 12.486 -11.497 1.00 0.00 C ATOM 508 NH1 ARG A 32 9.001 11.546 -11.527 1.00 0.00 N ATOM 509 NH2 ARG A 32 10.115 13.315 -12.537 1.00 0.00 N ATOM 0 H ARG A 32 14.993 12.450 -6.917 1.00 0.00 H new ATOM 0 HA ARG A 32 12.264 13.365 -7.319 1.00 0.00 H new ATOM 0 HB2 ARG A 32 13.393 12.395 -9.200 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.923 11.007 -8.271 1.00 0.00 H new ATOM 0 HG2 ARG A 32 12.139 10.352 -9.795 1.00 0.00 H new ATOM 0 HG3 ARG A 32 11.597 10.176 -8.138 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.767 11.145 -9.301 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.464 12.450 -8.362 1.00 0.00 H new ATOM 0 HE ARG A 32 11.561 13.254 -10.476 1.00 0.00 H new ATOM 0 HH11 ARG A 32 8.891 10.904 -10.742 1.00 0.00 H new ATOM 0 HH12 ARG A 32 8.381 11.477 -12.334 1.00 0.00 H new ATOM 0 HH21 ARG A 32 10.852 14.020 -12.525 1.00 0.00 H new ATOM 0 HH22 ARG A 32 9.493 13.241 -13.342 1.00 0.00 H new ATOM 523 N ASN A 33 12.979 11.207 -5.061 1.00 0.00 N ATOM 524 CA ASN A 33 12.429 10.370 -4.018 1.00 0.00 C ATOM 525 C ASN A 33 11.662 11.259 -3.046 1.00 0.00 C ATOM 526 O ASN A 33 12.254 12.009 -2.263 1.00 0.00 O ATOM 527 CB ASN A 33 13.531 9.581 -3.305 1.00 0.00 C ATOM 528 CG ASN A 33 13.012 8.353 -2.558 1.00 0.00 C ATOM 529 OD1 ASN A 33 11.862 8.302 -2.091 1.00 0.00 O ATOM 530 ND2 ASN A 33 13.859 7.343 -2.447 1.00 0.00 N ATOM 0 H ASN A 33 13.980 11.388 -4.983 1.00 0.00 H new ATOM 0 HA ASN A 33 11.751 9.635 -4.452 1.00 0.00 H new ATOM 0 HB2 ASN A 33 14.273 9.264 -4.038 1.00 0.00 H new ATOM 0 HB3 ASN A 33 14.040 10.238 -2.600 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.575 6.489 -1.966 1.00 0.00 H new ATOM 0 HD22 ASN A 33 14.796 7.418 -2.842 1.00 0.00 H new ATOM 537 N ILE A 34 10.350 11.189 -3.171 1.00 0.00 N ATOM 538 CA ILE A 34 9.339 11.990 -2.448 1.00 0.00 C ATOM 539 C ILE A 34 9.569 12.089 -0.934 1.00 0.00 C ATOM 540 O ILE A 34 9.306 13.148 -0.326 1.00 0.00 O ATOM 541 CB ILE A 34 7.924 11.384 -2.718 1.00 0.00 C ATOM 542 CG1 ILE A 34 6.795 12.137 -1.992 1.00 0.00 C ATOM 543 CG2 ILE A 34 7.888 9.897 -2.370 1.00 0.00 C ATOM 544 CD1 ILE A 34 5.414 11.542 -2.242 1.00 0.00 C ATOM 0 H ILE A 34 9.918 10.532 -3.820 1.00 0.00 H new ATOM 0 HA ILE A 34 9.423 13.007 -2.830 1.00 0.00 H new ATOM 0 HB ILE A 34 7.742 11.502 -3.786 1.00 0.00 H new ATOM 0 HG12 ILE A 34 6.996 12.133 -0.921 1.00 0.00 H new ATOM 0 HG13 ILE A 34 6.798 13.179 -2.313 1.00 0.00 H new ATOM 0 HG21 ILE A 34 6.892 9.501 -2.567 1.00 0.00 H new ATOM 0 HG22 ILE A 34 8.618 9.363 -2.979 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.129 9.764 -1.315 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.665 12.121 -1.701 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.193 11.570 -3.309 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.395 10.509 -1.895 1.00 0.00 H new ATOM 556 N LYS A 35 10.098 11.037 -0.352 1.00 0.00 N ATOM 557 CA LYS A 35 10.219 10.919 1.084 1.00 0.00 C ATOM 558 C LYS A 35 11.191 11.942 1.616 1.00 0.00 C ATOM 559 O LYS A 35 12.344 11.963 1.220 1.00 0.00 O ATOM 560 CB LYS A 35 10.705 9.525 1.469 1.00 0.00 C ATOM 561 CG LYS A 35 10.126 8.409 0.624 1.00 0.00 C ATOM 562 CD LYS A 35 10.383 7.063 1.243 1.00 0.00 C ATOM 563 CE LYS A 35 10.206 5.943 0.240 1.00 0.00 C ATOM 564 NZ LYS A 35 11.288 5.957 -0.764 1.00 0.00 N ATOM 0 H LYS A 35 10.459 10.233 -0.865 1.00 0.00 H new ATOM 0 HA LYS A 35 9.234 11.091 1.519 1.00 0.00 H new ATOM 0 HB2 LYS A 35 11.792 9.497 1.392 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.455 9.341 2.514 1.00 0.00 H new ATOM 0 HG2 LYS A 35 9.053 8.558 0.507 1.00 0.00 H new ATOM 0 HG3 LYS A 35 10.563 8.442 -0.374 1.00 0.00 H new ATOM 0 HD2 LYS A 35 11.396 7.035 1.645 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.703 6.912 2.081 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.198 4.984 0.758 1.00 0.00 H new ATOM 0 HE3 LYS A 35 9.242 6.045 -0.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 11.233 5.097 -1.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 11.186 6.794 -1.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.209 5.990 -0.282 1.00 0.00 H new ATOM 578 N HIS A 36 10.709 12.833 2.443 1.00 0.00 N ATOM 579 CA HIS A 36 11.563 13.802 3.078 1.00 0.00 C ATOM 580 C HIS A 36 11.206 13.951 4.536 1.00 0.00 C ATOM 581 O HIS A 36 11.712 13.206 5.371 1.00 0.00 O ATOM 582 CB HIS A 36 11.592 15.166 2.344 1.00 0.00 C ATOM 583 CG HIS A 36 12.219 15.129 0.964 1.00 0.00 C ATOM 584 ND1 HIS A 36 11.511 14.827 -0.178 1.00 0.00 N ATOM 585 CD2 HIS A 36 13.490 15.378 0.551 1.00 0.00 C ATOM 586 CE1 HIS A 36 12.304 14.900 -1.224 1.00 0.00 C ATOM 587 NE2 HIS A 36 13.508 15.228 -0.818 1.00 0.00 N ATOM 0 H HIS A 36 9.723 12.907 2.693 1.00 0.00 H new ATOM 0 HA HIS A 36 12.581 13.418 3.013 1.00 0.00 H new ATOM 0 HB2 HIS A 36 10.571 15.537 2.255 1.00 0.00 H new ATOM 0 HB3 HIS A 36 12.139 15.882 2.958 1.00 0.00 H new ATOM 0 HD1 HIS A 36 10.521 14.583 -0.208 1.00 0.00 H new ATOM 0 HD2 HIS A 36 14.328 15.644 1.178 1.00 0.00 H new ATOM 0 HE1 HIS A 36 12.013 14.720 -2.248 1.00 0.00 H new ATOM 596 N VAL A 37 10.281 14.842 4.840 1.00 0.00 N ATOM 597 CA VAL A 37 9.920 15.106 6.236 1.00 0.00 C ATOM 598 C VAL A 37 8.406 15.301 6.402 1.00 0.00 C ATOM 599 O VAL A 37 7.663 14.350 6.601 1.00 0.00 O ATOM 600 CB VAL A 37 10.701 16.339 6.871 1.00 0.00 C ATOM 601 CG1 VAL A 37 10.373 16.502 8.356 1.00 0.00 C ATOM 602 CG2 VAL A 37 12.216 16.218 6.692 1.00 0.00 C ATOM 0 H VAL A 37 9.766 15.394 4.154 1.00 0.00 H new ATOM 0 HA VAL A 37 10.227 14.216 6.785 1.00 0.00 H new ATOM 0 HB VAL A 37 10.363 17.224 6.332 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.923 17.353 8.759 1.00 0.00 H new ATOM 0 HG12 VAL A 37 9.303 16.672 8.476 1.00 0.00 H new ATOM 0 HG13 VAL A 37 10.659 15.598 8.893 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.706 17.082 7.141 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.568 15.308 7.178 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.455 16.178 5.629 1.00 0.00 H new ATOM 612 N GLY A 38 7.970 16.526 6.248 1.00 0.00 N ATOM 613 CA GLY A 38 6.585 16.874 6.513 1.00 0.00 C ATOM 614 C GLY A 38 5.756 17.133 5.268 1.00 0.00 C ATOM 615 O GLY A 38 4.791 16.411 5.018 1.00 0.00 O ATOM 0 H GLY A 38 8.551 17.305 5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 38 6.123 16.067 7.082 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.560 17.763 7.143 1.00 0.00 H new ATOM 619 N PRO A 39 6.047 18.210 4.495 1.00 0.00 N ATOM 620 CA PRO A 39 5.313 18.500 3.254 1.00 0.00 C ATOM 621 C PRO A 39 5.546 17.409 2.215 1.00 0.00 C ATOM 622 O PRO A 39 4.614 16.773 1.745 1.00 0.00 O ATOM 623 CB PRO A 39 5.908 19.838 2.776 1.00 0.00 C ATOM 624 CG PRO A 39 6.574 20.415 3.978 1.00 0.00 C ATOM 625 CD PRO A 39 7.060 19.247 4.780 1.00 0.00 C ATOM 0 HA PRO A 39 4.235 18.546 3.408 1.00 0.00 H new ATOM 0 HB2 PRO A 39 6.620 19.686 1.965 1.00 0.00 H new ATOM 0 HB3 PRO A 39 5.131 20.503 2.398 1.00 0.00 H new ATOM 0 HG2 PRO A 39 7.402 21.064 3.692 1.00 0.00 H new ATOM 0 HG3 PRO A 39 5.878 21.023 4.556 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.058 18.933 4.473 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.112 19.480 5.843 1.00 0.00 H new ATOM 633 N SER A 40 6.795 17.190 1.885 1.00 0.00 N ATOM 634 CA SER A 40 7.159 16.171 0.956 1.00 0.00 C ATOM 635 C SER A 40 7.275 14.840 1.696 1.00 0.00 C ATOM 636 O SER A 40 8.241 14.608 2.454 1.00 0.00 O ATOM 637 CB SER A 40 8.475 16.548 0.306 1.00 0.00 C ATOM 638 OG SER A 40 8.440 17.895 -0.132 1.00 0.00 O ATOM 0 H SER A 40 7.583 17.719 2.259 1.00 0.00 H new ATOM 0 HA SER A 40 6.401 16.070 0.179 1.00 0.00 H new ATOM 0 HB2 SER A 40 9.291 16.410 1.015 1.00 0.00 H new ATOM 0 HB3 SER A 40 8.673 15.889 -0.539 1.00 0.00 H new ATOM 0 HG SER A 40 9.297 18.126 -0.548 1.00 0.00 H new ATOM 644 N GLY A 41 6.280 14.023 1.524 1.00 0.00 N ATOM 645 CA GLY A 41 6.206 12.749 2.157 1.00 0.00 C ATOM 646 C GLY A 41 4.777 12.320 2.177 1.00 0.00 C ATOM 647 O GLY A 41 4.162 12.275 1.132 1.00 0.00 O ATOM 0 H GLY A 41 5.481 14.232 0.925 1.00 0.00 H new ATOM 0 HA2 GLY A 41 6.814 12.021 1.619 1.00 0.00 H new ATOM 0 HA3 GLY A 41 6.600 12.805 3.172 1.00 0.00 H new ATOM 651 N ARG A 42 4.242 12.086 3.378 1.00 0.00 N ATOM 652 CA ARG A 42 2.828 11.703 3.589 1.00 0.00 C ATOM 653 C ARG A 42 2.506 10.367 2.923 1.00 0.00 C ATOM 654 O ARG A 42 2.127 10.308 1.769 1.00 0.00 O ATOM 655 CB ARG A 42 1.850 12.796 3.089 1.00 0.00 C ATOM 656 CG ARG A 42 2.099 14.181 3.667 1.00 0.00 C ATOM 657 CD ARG A 42 1.882 14.225 5.169 1.00 0.00 C ATOM 658 NE ARG A 42 2.242 15.537 5.710 1.00 0.00 N ATOM 659 CZ ARG A 42 1.573 16.209 6.656 1.00 0.00 C ATOM 660 NH1 ARG A 42 0.501 15.670 7.251 1.00 0.00 N ATOM 661 NH2 ARG A 42 1.995 17.423 7.023 1.00 0.00 N ATOM 0 H ARG A 42 4.776 12.155 4.244 1.00 0.00 H new ATOM 0 HA ARG A 42 2.693 11.596 4.665 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.914 12.853 2.002 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.832 12.493 3.332 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.120 14.489 3.440 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.435 14.898 3.185 1.00 0.00 H new ATOM 0 HD2 ARG A 42 0.838 14.007 5.396 1.00 0.00 H new ATOM 0 HD3 ARG A 42 2.481 13.452 5.650 1.00 0.00 H new ATOM 0 HE ARG A 42 3.079 15.980 5.332 1.00 0.00 H new ATOM 0 HH11 ARG A 42 0.185 14.737 6.985 1.00 0.00 H new ATOM 0 HH12 ARG A 42 0.000 16.192 7.970 1.00 0.00 H new ATOM 0 HH21 ARG A 42 2.820 17.830 6.583 1.00 0.00 H new ATOM 0 HH22 ARG A 42 1.492 17.942 7.743 1.00 0.00 H new ATOM 675 N PHE A 43 2.605 9.304 3.665 1.00 0.00 N ATOM 676 CA PHE A 43 2.413 8.000 3.082 1.00 0.00 C ATOM 677 C PHE A 43 1.114 7.454 3.537 1.00 0.00 C ATOM 678 O PHE A 43 1.005 6.861 4.599 1.00 0.00 O ATOM 679 CB PHE A 43 3.560 7.053 3.454 1.00 0.00 C ATOM 680 CG PHE A 43 4.907 7.642 3.183 1.00 0.00 C ATOM 681 CD1 PHE A 43 5.369 7.788 1.889 1.00 0.00 C ATOM 682 CD2 PHE A 43 5.705 8.071 4.231 1.00 0.00 C ATOM 683 CE1 PHE A 43 6.596 8.354 1.645 1.00 0.00 C ATOM 684 CE2 PHE A 43 6.934 8.632 3.994 1.00 0.00 C ATOM 685 CZ PHE A 43 7.380 8.775 2.703 1.00 0.00 C ATOM 0 H PHE A 43 2.815 9.308 4.663 1.00 0.00 H new ATOM 0 HA PHE A 43 2.408 8.093 1.996 1.00 0.00 H new ATOM 0 HB2 PHE A 43 3.486 6.797 4.511 1.00 0.00 H new ATOM 0 HB3 PHE A 43 3.455 6.124 2.893 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.760 7.454 1.062 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.355 7.962 5.247 1.00 0.00 H new ATOM 0 HE1 PHE A 43 6.947 8.470 0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.549 8.960 4.819 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.347 9.218 2.514 1.00 0.00 H new ATOM 695 N THR A 44 0.119 7.740 2.769 1.00 0.00 N ATOM 696 CA THR A 44 -1.198 7.298 3.031 1.00 0.00 C ATOM 697 C THR A 44 -1.553 6.263 1.994 1.00 0.00 C ATOM 698 O THR A 44 -1.103 6.380 0.839 1.00 0.00 O ATOM 699 CB THR A 44 -2.181 8.491 2.987 1.00 0.00 C ATOM 700 OG1 THR A 44 -2.063 9.168 1.720 1.00 0.00 O ATOM 701 CG2 THR A 44 -1.868 9.472 4.115 1.00 0.00 C ATOM 0 H THR A 44 0.206 8.302 1.922 1.00 0.00 H new ATOM 0 HA THR A 44 -1.265 6.859 4.026 1.00 0.00 H new ATOM 0 HB THR A 44 -3.197 8.116 3.110 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.688 9.923 1.693 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.566 10.308 4.074 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.964 8.965 5.075 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.850 9.844 4.002 1.00 0.00 H new ATOM 709 N MET A 45 -2.326 5.246 2.394 1.00 0.00 N ATOM 710 CA MET A 45 -2.692 4.123 1.508 1.00 0.00 C ATOM 711 C MET A 45 -3.113 4.573 0.111 1.00 0.00 C ATOM 712 O MET A 45 -2.641 4.042 -0.864 1.00 0.00 O ATOM 713 CB MET A 45 -3.811 3.222 2.097 1.00 0.00 C ATOM 714 CG MET A 45 -5.182 3.904 2.239 1.00 0.00 C ATOM 715 SD MET A 45 -6.548 2.743 2.463 1.00 0.00 S ATOM 716 CE MET A 45 -6.485 1.832 0.922 1.00 0.00 C ATOM 0 H MET A 45 -2.716 5.174 3.334 1.00 0.00 H new ATOM 0 HA MET A 45 -1.774 3.540 1.429 1.00 0.00 H new ATOM 0 HB2 MET A 45 -3.922 2.343 1.462 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.494 2.868 3.078 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.153 4.586 3.089 1.00 0.00 H new ATOM 0 HG3 MET A 45 -5.372 4.508 1.352 1.00 0.00 H new ATOM 0 HE1 MET A 45 -7.455 1.372 0.731 1.00 0.00 H new ATOM 0 HE2 MET A 45 -6.240 2.513 0.107 1.00 0.00 H new ATOM 0 HE3 MET A 45 -5.722 1.056 0.989 1.00 0.00 H new ATOM 726 N ASN A 46 -3.934 5.610 0.032 1.00 0.00 N ATOM 727 CA ASN A 46 -4.519 6.007 -1.236 1.00 0.00 C ATOM 728 C ASN A 46 -3.469 6.567 -2.187 1.00 0.00 C ATOM 729 O ASN A 46 -3.490 6.265 -3.374 1.00 0.00 O ATOM 730 CB ASN A 46 -5.665 7.002 -1.035 1.00 0.00 C ATOM 731 CG ASN A 46 -6.485 7.213 -2.303 1.00 0.00 C ATOM 732 OD1 ASN A 46 -6.176 8.061 -3.127 1.00 0.00 O ATOM 733 ND2 ASN A 46 -7.537 6.428 -2.470 1.00 0.00 N ATOM 0 H ASN A 46 -4.208 6.187 0.827 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.934 5.109 -1.695 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -6.318 6.643 -0.240 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.258 7.958 -0.706 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.116 6.521 -3.305 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.769 5.729 -1.764 1.00 0.00 H new ATOM 740 N MET A 47 -2.507 7.323 -1.649 1.00 0.00 N ATOM 741 CA MET A 47 -1.459 7.901 -2.483 1.00 0.00 C ATOM 742 C MET A 47 -0.514 6.804 -2.920 1.00 0.00 C ATOM 743 O MET A 47 -0.041 6.782 -4.061 1.00 0.00 O ATOM 744 CB MET A 47 -0.672 8.984 -1.728 1.00 0.00 C ATOM 745 CG MET A 47 0.437 9.628 -2.565 1.00 0.00 C ATOM 746 SD MET A 47 1.461 10.798 -1.644 1.00 0.00 S ATOM 747 CE MET A 47 0.259 12.035 -1.161 1.00 0.00 C ATOM 0 H MET A 47 -2.435 7.544 -0.656 1.00 0.00 H new ATOM 0 HA MET A 47 -1.927 8.368 -3.349 1.00 0.00 H new ATOM 0 HB2 MET A 47 -1.363 9.759 -1.396 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.232 8.545 -0.833 1.00 0.00 H new ATOM 0 HG2 MET A 47 1.075 8.843 -2.971 1.00 0.00 H new ATOM 0 HG3 MET A 47 -0.014 10.143 -3.413 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.776 12.914 -0.777 1.00 0.00 H new ATOM 0 HE2 MET A 47 -0.341 12.316 -2.026 1.00 0.00 H new ATOM 0 HE3 MET A 47 -0.390 11.628 -0.386 1.00 0.00 H new ATOM 757 N LEU A 48 -0.286 5.864 -2.017 1.00 0.00 N ATOM 758 CA LEU A 48 0.622 4.764 -2.269 1.00 0.00 C ATOM 759 C LEU A 48 0.065 3.836 -3.341 1.00 0.00 C ATOM 760 O LEU A 48 0.813 3.244 -4.055 1.00 0.00 O ATOM 761 CB LEU A 48 0.905 3.955 -0.993 1.00 0.00 C ATOM 762 CG LEU A 48 1.421 4.726 0.229 1.00 0.00 C ATOM 763 CD1 LEU A 48 1.765 3.767 1.351 1.00 0.00 C ATOM 764 CD2 LEU A 48 2.606 5.616 -0.128 1.00 0.00 C ATOM 0 H LEU A 48 -0.723 5.844 -1.096 1.00 0.00 H new ATOM 0 HA LEU A 48 1.559 5.200 -2.617 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -0.015 3.445 -0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.635 3.183 -1.238 1.00 0.00 H new ATOM 0 HG LEU A 48 0.624 5.384 0.575 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.130 4.329 2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.875 3.205 1.635 1.00 0.00 H new ATOM 0 HD13 LEU A 48 2.538 3.076 1.015 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.944 6.146 0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.419 5.002 -0.515 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.303 6.338 -0.887 1.00 0.00 H new ATOM 776 N VAL A 49 -1.258 3.732 -3.438 1.00 0.00 N ATOM 777 CA VAL A 49 -1.911 2.912 -4.406 1.00 0.00 C ATOM 778 C VAL A 49 -1.831 3.540 -5.780 1.00 0.00 C ATOM 779 O VAL A 49 -1.574 2.864 -6.786 1.00 0.00 O ATOM 780 CB VAL A 49 -3.374 2.777 -4.014 1.00 0.00 C ATOM 781 CG1 VAL A 49 -4.132 2.201 -5.126 1.00 0.00 C ATOM 782 CG2 VAL A 49 -3.497 1.913 -2.807 1.00 0.00 C ATOM 0 H VAL A 49 -1.902 4.232 -2.826 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.423 1.938 -4.436 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.777 3.763 -3.783 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.180 2.106 -4.841 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.050 2.851 -5.997 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.731 1.217 -5.369 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.548 1.820 -2.531 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.090 0.925 -3.024 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -2.943 2.360 -1.981 1.00 0.00 H new ATOM 792 N ASP A 50 -2.089 4.818 -5.805 1.00 0.00 N ATOM 793 CA ASP A 50 -2.069 5.610 -7.029 1.00 0.00 C ATOM 794 C ASP A 50 -0.705 5.404 -7.690 1.00 0.00 C ATOM 795 O ASP A 50 -0.587 4.956 -8.835 1.00 0.00 O ATOM 796 CB ASP A 50 -2.293 7.104 -6.657 1.00 0.00 C ATOM 797 CG ASP A 50 -2.970 7.936 -7.749 1.00 0.00 C ATOM 798 OD1 ASP A 50 -4.109 7.574 -8.152 1.00 0.00 O ATOM 799 OD2 ASP A 50 -2.408 8.961 -8.183 1.00 0.00 O ATOM 0 H ASP A 50 -2.323 5.357 -4.971 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.855 5.308 -7.721 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.899 7.153 -5.752 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.329 7.555 -6.420 1.00 0.00 H new ATOM 804 N ILE A 51 0.314 5.599 -6.905 1.00 0.00 N ATOM 805 CA ILE A 51 1.656 5.479 -7.332 1.00 0.00 C ATOM 806 C ILE A 51 2.131 4.052 -7.493 1.00 0.00 C ATOM 807 O ILE A 51 3.065 3.783 -8.226 1.00 0.00 O ATOM 808 CB ILE A 51 2.464 6.234 -6.366 1.00 0.00 C ATOM 809 CG1 ILE A 51 3.689 6.768 -6.997 1.00 0.00 C ATOM 810 CG2 ILE A 51 2.734 5.442 -5.149 1.00 0.00 C ATOM 811 CD1 ILE A 51 4.309 7.866 -6.204 1.00 0.00 C ATOM 0 H ILE A 51 0.219 5.853 -5.922 1.00 0.00 H new ATOM 0 HA ILE A 51 1.756 5.885 -8.339 1.00 0.00 H new ATOM 0 HB ILE A 51 1.885 7.098 -6.039 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.411 5.961 -7.120 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.449 7.136 -7.995 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.334 6.032 -4.457 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.791 5.173 -4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.276 4.536 -5.418 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.205 8.221 -6.713 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.599 8.687 -6.103 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.577 7.494 -5.215 1.00 0.00 H new ATOM 823 N PHE A 52 1.500 3.194 -6.789 1.00 0.00 N ATOM 824 CA PHE A 52 1.726 1.725 -6.859 1.00 0.00 C ATOM 825 C PHE A 52 1.546 1.269 -8.305 1.00 0.00 C ATOM 826 O PHE A 52 2.352 0.500 -8.839 1.00 0.00 O ATOM 827 CB PHE A 52 0.712 1.020 -5.939 1.00 0.00 C ATOM 828 CG PHE A 52 0.871 -0.451 -5.681 1.00 0.00 C ATOM 829 CD1 PHE A 52 1.786 -0.908 -4.750 1.00 0.00 C ATOM 830 CD2 PHE A 52 0.053 -1.367 -6.306 1.00 0.00 C ATOM 831 CE1 PHE A 52 1.883 -2.254 -4.455 1.00 0.00 C ATOM 832 CE2 PHE A 52 0.155 -2.710 -6.025 1.00 0.00 C ATOM 833 CZ PHE A 52 1.067 -3.156 -5.096 1.00 0.00 C ATOM 0 H PHE A 52 0.782 3.458 -6.115 1.00 0.00 H new ATOM 0 HA PHE A 52 2.735 1.474 -6.530 1.00 0.00 H new ATOM 0 HB2 PHE A 52 0.732 1.528 -4.975 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.281 1.176 -6.361 1.00 0.00 H new ATOM 0 HD1 PHE A 52 2.433 -0.204 -4.247 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.677 -1.027 -7.025 1.00 0.00 H new ATOM 0 HE1 PHE A 52 2.598 -2.597 -3.722 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.483 -3.417 -6.535 1.00 0.00 H new ATOM 0 HZ PHE A 52 1.141 -4.210 -4.871 1.00 0.00 H new ATOM 843 N LEU A 53 0.502 1.790 -8.927 1.00 0.00 N ATOM 844 CA LEU A 53 0.199 1.525 -10.321 1.00 0.00 C ATOM 845 C LEU A 53 1.094 2.338 -11.254 1.00 0.00 C ATOM 846 O LEU A 53 1.507 1.862 -12.299 1.00 0.00 O ATOM 847 CB LEU A 53 -1.276 1.848 -10.632 1.00 0.00 C ATOM 848 CG LEU A 53 -2.328 0.738 -10.414 1.00 0.00 C ATOM 849 CD1 LEU A 53 -2.307 0.158 -9.029 1.00 0.00 C ATOM 850 CD2 LEU A 53 -3.701 1.255 -10.708 1.00 0.00 C ATOM 0 H LEU A 53 -0.165 2.415 -8.473 1.00 0.00 H new ATOM 0 HA LEU A 53 0.385 0.464 -10.491 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.565 2.705 -10.023 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.335 2.163 -11.674 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.065 -0.063 -11.105 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -3.071 -0.615 -8.947 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.327 -0.277 -8.832 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.507 0.945 -8.302 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.431 0.461 -10.550 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.925 2.091 -10.045 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.749 1.591 -11.744 1.00 0.00 H new ATOM 862 N GLY A 54 1.406 3.539 -10.851 1.00 0.00 N ATOM 863 CA GLY A 54 2.127 4.447 -11.726 1.00 0.00 C ATOM 864 C GLY A 54 1.134 5.384 -12.366 1.00 0.00 C ATOM 865 O GLY A 54 1.032 5.492 -13.580 1.00 0.00 O ATOM 0 H GLY A 54 1.178 3.918 -9.932 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.868 5.010 -11.159 1.00 0.00 H new ATOM 0 HA3 GLY A 54 2.667 3.888 -12.490 1.00 0.00 H new ATOM 869 N SER A 55 0.369 6.000 -11.509 1.00 0.00 N ATOM 870 CA SER A 55 -0.725 6.882 -11.836 1.00 0.00 C ATOM 871 C SER A 55 -0.337 8.178 -12.559 1.00 0.00 C ATOM 872 O SER A 55 0.832 8.498 -12.774 1.00 0.00 O ATOM 873 CB SER A 55 -1.297 7.287 -10.537 1.00 0.00 C ATOM 874 OG SER A 55 -0.237 7.834 -9.762 1.00 0.00 O ATOM 0 H SER A 55 0.497 5.896 -10.502 1.00 0.00 H new ATOM 0 HA SER A 55 -1.388 6.342 -12.512 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.089 8.022 -10.678 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.743 6.431 -10.030 1.00 0.00 H new ATOM 0 HG SER A 55 0.568 7.908 -10.315 1.00 0.00 H new ATOM 880 N LYS A 56 -1.371 8.959 -12.814 1.00 0.00 N ATOM 881 CA LYS A 56 -1.272 10.258 -13.415 1.00 0.00 C ATOM 882 C LYS A 56 -0.907 11.320 -12.364 1.00 0.00 C ATOM 883 O LYS A 56 -0.298 12.358 -12.692 1.00 0.00 O ATOM 884 CB LYS A 56 -2.621 10.628 -14.066 1.00 0.00 C ATOM 885 CG LYS A 56 -3.823 10.478 -13.116 1.00 0.00 C ATOM 886 CD LYS A 56 -5.133 10.985 -13.713 1.00 0.00 C ATOM 887 CE LYS A 56 -5.131 12.499 -13.886 1.00 0.00 C ATOM 888 NZ LYS A 56 -6.439 13.001 -14.386 1.00 0.00 N ATOM 0 H LYS A 56 -2.330 8.689 -12.598 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.487 10.230 -14.171 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.574 11.658 -14.420 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.778 9.997 -14.941 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -3.937 9.427 -12.848 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -3.618 11.021 -12.194 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -5.299 10.510 -14.680 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -5.962 10.695 -13.068 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.901 12.973 -12.932 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -4.342 12.784 -14.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -6.397 14.035 -14.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -6.647 12.568 -15.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -7.188 12.752 -13.709 1.00 0.00 H new ATOM 902 N SER A 57 -1.278 11.089 -11.116 1.00 0.00 N ATOM 903 CA SER A 57 -1.049 12.080 -10.095 1.00 0.00 C ATOM 904 C SER A 57 0.331 11.864 -9.486 1.00 0.00 C ATOM 905 O SER A 57 1.159 12.801 -9.420 1.00 0.00 O ATOM 906 CB SER A 57 -2.122 11.912 -9.028 1.00 0.00 C ATOM 907 OG SER A 57 -3.380 11.622 -9.638 1.00 0.00 O ATOM 0 H SER A 57 -1.732 10.234 -10.795 1.00 0.00 H new ATOM 0 HA SER A 57 -1.094 13.085 -10.514 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.845 11.107 -8.347 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.199 12.822 -8.432 1.00 0.00 H new ATOM 0 HG SER A 57 -4.063 11.514 -8.944 1.00 0.00 H new ATOM 913 N ALA A 58 0.626 10.620 -9.196 1.00 0.00 N ATOM 914 CA ALA A 58 1.859 10.215 -8.662 1.00 0.00 C ATOM 915 C ALA A 58 2.704 9.711 -9.798 1.00 0.00 C ATOM 916 O ALA A 58 2.669 8.543 -10.165 1.00 0.00 O ATOM 917 CB ALA A 58 1.633 9.154 -7.638 1.00 0.00 C ATOM 0 H ALA A 58 -0.026 9.849 -9.339 1.00 0.00 H new ATOM 0 HA ALA A 58 2.370 11.043 -8.171 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.590 8.839 -7.223 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.003 9.547 -6.840 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.140 8.300 -8.102 1.00 0.00 H new ATOM 923 N LYS A 59 3.436 10.632 -10.347 1.00 0.00 N ATOM 924 CA LYS A 59 4.269 10.480 -11.549 1.00 0.00 C ATOM 925 C LYS A 59 5.552 9.652 -11.335 1.00 0.00 C ATOM 926 O LYS A 59 6.545 9.849 -12.046 1.00 0.00 O ATOM 927 CB LYS A 59 4.561 11.870 -12.100 1.00 0.00 C ATOM 928 CG LYS A 59 3.285 12.601 -12.495 1.00 0.00 C ATOM 929 CD LYS A 59 3.524 14.065 -12.794 1.00 0.00 C ATOM 930 CE LYS A 59 2.220 14.768 -13.159 1.00 0.00 C ATOM 931 NZ LYS A 59 1.166 14.573 -12.122 1.00 0.00 N ATOM 0 H LYS A 59 3.486 11.575 -9.961 1.00 0.00 H new ATOM 0 HA LYS A 59 3.709 9.894 -12.277 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.097 12.453 -11.351 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.216 11.787 -12.967 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.852 12.121 -13.372 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.555 12.512 -11.690 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.972 14.549 -11.926 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.235 14.161 -13.614 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.408 15.834 -13.288 1.00 0.00 H new ATOM 0 HE3 LYS A 59 1.860 14.389 -14.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 0.458 15.331 -12.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 0.704 13.652 -12.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.600 14.600 -11.177 1.00 0.00 H new ATOM 945 N ILE A 60 5.502 8.753 -10.350 1.00 0.00 N ATOM 946 CA ILE A 60 6.576 7.858 -9.977 1.00 0.00 C ATOM 947 C ILE A 60 7.741 8.583 -9.300 1.00 0.00 C ATOM 948 O ILE A 60 8.415 9.422 -9.897 1.00 0.00 O ATOM 949 CB ILE A 60 7.047 7.032 -11.172 1.00 0.00 C ATOM 950 CG1 ILE A 60 5.921 6.093 -11.655 1.00 0.00 C ATOM 951 CG2 ILE A 60 8.309 6.262 -10.824 1.00 0.00 C ATOM 952 CD1 ILE A 60 6.264 5.296 -12.901 1.00 0.00 C ATOM 0 H ILE A 60 4.671 8.631 -9.771 1.00 0.00 H new ATOM 0 HA ILE A 60 6.169 7.172 -9.234 1.00 0.00 H new ATOM 0 HB ILE A 60 7.290 7.707 -11.993 1.00 0.00 H new ATOM 0 HG12 ILE A 60 5.672 5.400 -10.851 1.00 0.00 H new ATOM 0 HG13 ILE A 60 5.028 6.687 -11.852 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.630 5.679 -11.688 1.00 0.00 H new ATOM 0 HG22 ILE A 60 9.097 6.962 -10.546 1.00 0.00 H new ATOM 0 HG23 ILE A 60 8.107 5.592 -9.989 1.00 0.00 H new ATOM 0 HD11 ILE A 60 5.419 4.663 -13.172 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.483 5.980 -13.721 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.137 4.673 -12.706 1.00 0.00 H new ATOM 964 N GLN A 61 7.990 8.243 -8.043 1.00 0.00 N ATOM 965 CA GLN A 61 9.018 8.930 -7.307 1.00 0.00 C ATOM 966 C GLN A 61 10.208 8.013 -6.967 1.00 0.00 C ATOM 967 O GLN A 61 11.009 8.343 -6.110 1.00 0.00 O ATOM 968 CB GLN A 61 8.473 9.643 -6.043 1.00 0.00 C ATOM 969 CG GLN A 61 7.045 10.224 -6.129 1.00 0.00 C ATOM 970 CD GLN A 61 6.733 11.089 -7.344 1.00 0.00 C ATOM 971 OE1 GLN A 61 7.585 11.748 -7.908 1.00 0.00 O ATOM 972 NE2 GLN A 61 5.473 11.072 -7.748 1.00 0.00 N ATOM 0 H GLN A 61 7.501 7.510 -7.529 1.00 0.00 H new ATOM 0 HA GLN A 61 9.391 9.708 -7.973 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.502 8.935 -5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 61 9.155 10.455 -5.791 1.00 0.00 H new ATOM 0 HG2 GLN A 61 6.338 9.395 -6.111 1.00 0.00 H new ATOM 0 HG3 GLN A 61 6.864 10.817 -5.233 1.00 0.00 H new ATOM 0 HE21 GLN A 61 4.785 10.507 -7.250 1.00 0.00 H new ATOM 0 HE22 GLN A 61 5.190 11.624 -8.558 1.00 0.00 H new ATOM 981 N SER A 62 10.305 6.873 -7.682 1.00 0.00 N ATOM 982 CA SER A 62 11.365 5.852 -7.482 1.00 0.00 C ATOM 983 C SER A 62 11.201 5.078 -6.144 1.00 0.00 C ATOM 984 O SER A 62 11.419 5.613 -5.064 1.00 0.00 O ATOM 985 CB SER A 62 12.769 6.475 -7.604 1.00 0.00 C ATOM 986 OG SER A 62 12.896 7.154 -8.846 1.00 0.00 O ATOM 0 H SER A 62 9.646 6.629 -8.422 1.00 0.00 H new ATOM 0 HA SER A 62 11.251 5.119 -8.281 1.00 0.00 H new ATOM 0 HB2 SER A 62 12.940 7.170 -6.782 1.00 0.00 H new ATOM 0 HB3 SER A 62 13.529 5.697 -7.527 1.00 0.00 H new ATOM 0 HG SER A 62 13.791 7.548 -8.913 1.00 0.00 H new ATOM 992 N GLY A 63 10.779 3.830 -6.247 1.00 0.00 N ATOM 993 CA GLY A 63 10.562 2.994 -5.080 1.00 0.00 C ATOM 994 C GLY A 63 9.533 1.955 -5.407 1.00 0.00 C ATOM 995 O GLY A 63 9.778 1.084 -6.229 1.00 0.00 O ATOM 0 H GLY A 63 10.578 3.370 -7.135 1.00 0.00 H new ATOM 0 HA2 GLY A 63 11.495 2.518 -4.780 1.00 0.00 H new ATOM 0 HA3 GLY A 63 10.229 3.602 -4.239 1.00 0.00 H new ATOM 999 N ILE A 64 8.364 2.071 -4.802 1.00 0.00 N ATOM 1000 CA ILE A 64 7.218 1.212 -5.151 1.00 0.00 C ATOM 1001 C ILE A 64 6.452 1.951 -6.234 1.00 0.00 C ATOM 1002 O ILE A 64 5.484 1.462 -6.813 1.00 0.00 O ATOM 1003 CB ILE A 64 6.282 1.017 -3.908 1.00 0.00 C ATOM 1004 CG1 ILE A 64 5.555 -0.330 -3.933 1.00 0.00 C ATOM 1005 CG2 ILE A 64 5.256 2.162 -3.771 1.00 0.00 C ATOM 1006 CD1 ILE A 64 4.691 -0.596 -2.714 1.00 0.00 C ATOM 0 H ILE A 64 8.171 2.749 -4.064 1.00 0.00 H new ATOM 0 HA ILE A 64 7.555 0.229 -5.480 1.00 0.00 H new ATOM 0 HB ILE A 64 6.938 1.034 -3.038 1.00 0.00 H new ATOM 0 HG12 ILE A 64 4.929 -0.375 -4.824 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.294 -1.127 -4.021 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.629 1.986 -2.897 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.782 3.110 -3.655 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.632 2.200 -4.664 1.00 0.00 H new ATOM 0 HD11 ILE A 64 4.213 -1.570 -2.813 1.00 0.00 H new ATOM 0 HD12 ILE A 64 5.312 -0.586 -1.818 1.00 0.00 H new ATOM 0 HD13 ILE A 64 3.927 0.177 -2.634 1.00 0.00 H new ATOM 1018 N PHE A 65 6.922 3.148 -6.477 1.00 0.00 N ATOM 1019 CA PHE A 65 6.299 4.058 -7.355 1.00 0.00 C ATOM 1020 C PHE A 65 6.470 3.570 -8.766 1.00 0.00 C ATOM 1021 O PHE A 65 7.553 3.659 -9.327 1.00 0.00 O ATOM 1022 CB PHE A 65 6.882 5.482 -7.152 1.00 0.00 C ATOM 1023 CG PHE A 65 7.034 5.879 -5.694 1.00 0.00 C ATOM 1024 CD1 PHE A 65 5.991 5.752 -4.823 1.00 0.00 C ATOM 1025 CD2 PHE A 65 8.226 6.336 -5.217 1.00 0.00 C ATOM 1026 CE1 PHE A 65 6.123 6.090 -3.490 1.00 0.00 C ATOM 1027 CE2 PHE A 65 8.387 6.663 -3.887 1.00 0.00 C ATOM 1028 CZ PHE A 65 7.331 6.542 -3.024 1.00 0.00 C ATOM 0 H PHE A 65 7.774 3.510 -6.049 1.00 0.00 H new ATOM 0 HA PHE A 65 5.232 4.119 -7.143 1.00 0.00 H new ATOM 0 HB2 PHE A 65 7.856 5.539 -7.638 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.235 6.204 -7.650 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.043 5.380 -5.183 1.00 0.00 H new ATOM 0 HD2 PHE A 65 9.061 6.444 -5.894 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.281 5.999 -2.820 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.343 7.013 -3.527 1.00 0.00 H new ATOM 0 HZ PHE A 65 7.449 6.801 -1.982 1.00 0.00 H new ATOM 1038 N GLY A 66 5.420 2.993 -9.281 1.00 0.00 N ATOM 1039 CA GLY A 66 5.416 2.463 -10.598 1.00 0.00 C ATOM 1040 C GLY A 66 5.678 0.978 -10.632 1.00 0.00 C ATOM 1041 O GLY A 66 5.878 0.430 -11.706 1.00 0.00 O ATOM 0 H GLY A 66 4.536 2.881 -8.784 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.452 2.668 -11.064 1.00 0.00 H new ATOM 0 HA3 GLY A 66 6.173 2.974 -11.193 1.00 0.00 H new ATOM 1045 N LYS A 67 5.682 0.298 -9.458 1.00 0.00 N ATOM 1046 CA LYS A 67 5.971 -1.143 -9.480 1.00 0.00 C ATOM 1047 C LYS A 67 4.926 -2.012 -10.207 1.00 0.00 C ATOM 1048 O LYS A 67 5.274 -3.056 -10.753 1.00 0.00 O ATOM 1049 CB LYS A 67 6.324 -1.734 -8.079 1.00 0.00 C ATOM 1050 CG LYS A 67 5.293 -1.567 -6.951 1.00 0.00 C ATOM 1051 CD LYS A 67 3.951 -2.244 -7.191 1.00 0.00 C ATOM 1052 CE LYS A 67 4.053 -3.751 -7.342 1.00 0.00 C ATOM 1053 NZ LYS A 67 4.466 -4.429 -6.102 1.00 0.00 N ATOM 0 H LYS A 67 5.499 0.701 -8.539 1.00 0.00 H new ATOM 0 HA LYS A 67 6.871 -1.196 -10.092 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.515 -2.800 -8.203 1.00 0.00 H new ATOM 0 HB3 LYS A 67 7.258 -1.279 -7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.721 -1.961 -6.029 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.121 -0.502 -6.793 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.283 -2.014 -6.361 1.00 0.00 H new ATOM 0 HD3 LYS A 67 3.498 -1.826 -8.090 1.00 0.00 H new ATOM 0 HE2 LYS A 67 3.087 -4.144 -7.660 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.768 -3.984 -8.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 4.584 -5.446 -6.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.368 -4.030 -5.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 3.739 -4.290 -5.372 1.00 0.00 H new ATOM 1067 N GLY A 68 3.656 -1.629 -10.183 1.00 0.00 N ATOM 1068 CA GLY A 68 2.673 -2.510 -10.780 1.00 0.00 C ATOM 1069 C GLY A 68 1.376 -1.856 -11.145 1.00 0.00 C ATOM 1070 O GLY A 68 0.543 -1.588 -10.293 1.00 0.00 O ATOM 0 H GLY A 68 3.299 -0.763 -9.780 1.00 0.00 H new ATOM 0 HA2 GLY A 68 3.103 -2.955 -11.677 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.469 -3.325 -10.086 1.00 0.00 H new ATOM 1074 N SER A 69 1.176 -1.689 -12.420 1.00 0.00 N ATOM 1075 CA SER A 69 0.004 -1.079 -12.985 1.00 0.00 C ATOM 1076 C SER A 69 -1.017 -2.142 -13.355 1.00 0.00 C ATOM 1077 O SER A 69 -2.019 -1.866 -13.996 1.00 0.00 O ATOM 1078 CB SER A 69 0.446 -0.296 -14.209 1.00 0.00 C ATOM 1079 OG SER A 69 1.458 -1.025 -14.911 1.00 0.00 O ATOM 0 H SER A 69 1.852 -1.986 -13.124 1.00 0.00 H new ATOM 0 HA SER A 69 -0.472 -0.412 -12.266 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.406 -0.116 -14.864 1.00 0.00 H new ATOM 0 HB3 SER A 69 0.829 0.679 -13.909 1.00 0.00 H new ATOM 0 HG SER A 69 1.739 -0.517 -15.701 1.00 0.00 H new ATOM 1085 N ALA A 70 -0.760 -3.364 -12.913 1.00 0.00 N ATOM 1086 CA ALA A 70 -1.637 -4.477 -13.213 1.00 0.00 C ATOM 1087 C ALA A 70 -2.675 -4.642 -12.135 1.00 0.00 C ATOM 1088 O ALA A 70 -3.445 -5.591 -12.118 1.00 0.00 O ATOM 1089 CB ALA A 70 -0.848 -5.757 -13.442 1.00 0.00 C ATOM 0 H ALA A 70 0.051 -3.606 -12.344 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.161 -4.257 -14.143 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.535 -6.573 -13.665 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.165 -5.618 -14.280 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.277 -5.998 -12.545 1.00 0.00 H new ATOM 1095 N TYR A 71 -2.678 -3.720 -11.243 1.00 0.00 N ATOM 1096 CA TYR A 71 -3.665 -3.679 -10.210 1.00 0.00 C ATOM 1097 C TYR A 71 -4.719 -2.696 -10.577 1.00 0.00 C ATOM 1098 O TYR A 71 -4.438 -1.688 -11.190 1.00 0.00 O ATOM 1099 CB TYR A 71 -3.055 -3.260 -8.885 1.00 0.00 C ATOM 1100 CG TYR A 71 -2.287 -4.340 -8.163 1.00 0.00 C ATOM 1101 CD1 TYR A 71 -0.995 -4.703 -8.539 1.00 0.00 C ATOM 1102 CD2 TYR A 71 -2.858 -4.988 -7.080 1.00 0.00 C ATOM 1103 CE1 TYR A 71 -0.306 -5.686 -7.846 1.00 0.00 C ATOM 1104 CE2 TYR A 71 -2.181 -5.964 -6.392 1.00 0.00 C ATOM 1105 CZ TYR A 71 -0.910 -6.311 -6.771 1.00 0.00 C ATOM 1106 OH TYR A 71 -0.245 -7.282 -6.075 1.00 0.00 O ATOM 0 H TYR A 71 -1.994 -2.964 -11.203 1.00 0.00 H new ATOM 0 HA TYR A 71 -4.087 -4.678 -10.104 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.387 -2.417 -9.061 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.852 -2.904 -8.232 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.526 -4.213 -9.379 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -3.857 -4.720 -6.770 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.695 -5.962 -8.144 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -2.649 -6.458 -5.553 1.00 0.00 H new ATOM 0 HH TYR A 71 0.450 -6.869 -5.521 1.00 0.00 H new ATOM 1116 N SER A 72 -5.924 -3.004 -10.252 1.00 0.00 N ATOM 1117 CA SER A 72 -6.962 -2.053 -10.383 1.00 0.00 C ATOM 1118 C SER A 72 -6.832 -1.118 -9.190 1.00 0.00 C ATOM 1119 O SER A 72 -6.533 -1.581 -8.082 1.00 0.00 O ATOM 1120 CB SER A 72 -8.320 -2.755 -10.417 1.00 0.00 C ATOM 1121 OG SER A 72 -9.398 -1.832 -10.384 1.00 0.00 O ATOM 0 H SER A 72 -6.214 -3.913 -9.892 1.00 0.00 H new ATOM 0 HA SER A 72 -6.887 -1.490 -11.313 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.391 -3.363 -11.319 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.398 -3.434 -9.568 1.00 0.00 H new ATOM 0 HG SER A 72 -10.033 -2.095 -9.685 1.00 0.00 H new ATOM 1127 N ARG A 73 -7.030 0.174 -9.428 1.00 0.00 N ATOM 1128 CA ARG A 73 -6.852 1.244 -8.425 1.00 0.00 C ATOM 1129 C ARG A 73 -7.447 0.867 -7.063 1.00 0.00 C ATOM 1130 O ARG A 73 -6.734 0.755 -6.080 1.00 0.00 O ATOM 1131 CB ARG A 73 -7.475 2.550 -8.972 1.00 0.00 C ATOM 1132 CG ARG A 73 -7.328 3.808 -8.099 1.00 0.00 C ATOM 1133 CD ARG A 73 -5.872 4.100 -7.747 1.00 0.00 C ATOM 1134 NE ARG A 73 -5.663 5.480 -7.269 1.00 0.00 N ATOM 1135 CZ ARG A 73 -5.880 5.958 -6.032 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -6.500 5.238 -5.102 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -5.512 7.198 -5.760 1.00 0.00 N ATOM 0 H ARG A 73 -7.325 0.525 -10.339 1.00 0.00 H new ATOM 0 HA ARG A 73 -5.785 1.391 -8.256 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.029 2.758 -9.945 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -8.538 2.375 -9.139 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.751 4.664 -8.624 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -7.903 3.681 -7.182 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -5.542 3.401 -6.979 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.249 3.927 -8.625 1.00 0.00 H new ATOM 0 HE ARG A 73 -5.314 6.148 -7.956 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.825 4.296 -5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -6.650 5.628 -4.171 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.074 7.770 -6.482 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -5.666 7.583 -4.828 1.00 0.00 H new ATOM 1151 N HIS A 74 -8.715 0.542 -7.045 1.00 0.00 N ATOM 1152 CA HIS A 74 -9.384 0.270 -5.776 1.00 0.00 C ATOM 1153 C HIS A 74 -9.126 -1.142 -5.276 1.00 0.00 C ATOM 1154 O HIS A 74 -9.394 -1.459 -4.123 1.00 0.00 O ATOM 1155 CB HIS A 74 -10.886 0.572 -5.814 1.00 0.00 C ATOM 1156 CG HIS A 74 -11.243 2.037 -5.927 1.00 0.00 C ATOM 1157 ND1 HIS A 74 -10.954 2.979 -4.957 1.00 0.00 N ATOM 1158 CD2 HIS A 74 -11.884 2.714 -6.907 1.00 0.00 C ATOM 1159 CE1 HIS A 74 -11.404 4.148 -5.322 1.00 0.00 C ATOM 1160 NE2 HIS A 74 -11.974 4.025 -6.507 1.00 0.00 N ATOM 0 H HIS A 74 -9.305 0.457 -7.873 1.00 0.00 H new ATOM 0 HA HIS A 74 -8.938 0.961 -5.061 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -11.326 0.041 -6.658 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -11.344 0.171 -4.910 1.00 0.00 H new ATOM 0 HD1 HIS A 74 -10.461 2.788 -4.084 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -12.256 2.300 -7.833 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -11.324 5.062 -4.752 1.00 0.00 H new ATOM 1169 N ASN A 75 -8.581 -1.979 -6.120 1.00 0.00 N ATOM 1170 CA ASN A 75 -8.288 -3.336 -5.717 1.00 0.00 C ATOM 1171 C ASN A 75 -6.929 -3.386 -5.070 1.00 0.00 C ATOM 1172 O ASN A 75 -6.691 -4.166 -4.164 1.00 0.00 O ATOM 1173 CB ASN A 75 -8.454 -4.342 -6.861 1.00 0.00 C ATOM 1174 CG ASN A 75 -9.904 -4.377 -7.347 1.00 0.00 C ATOM 1175 OD1 ASN A 75 -10.282 -3.640 -8.264 1.00 0.00 O ATOM 1176 ND2 ASN A 75 -10.734 -5.174 -6.716 1.00 0.00 N ATOM 0 H ASN A 75 -8.332 -1.751 -7.083 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.024 -3.646 -4.975 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -7.795 -4.073 -7.687 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.154 -5.335 -6.525 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.719 -5.196 -6.979 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.394 -5.772 -5.963 1.00 0.00 H new ATOM 1183 N ALA A 76 -6.047 -2.496 -5.489 1.00 0.00 N ATOM 1184 CA ALA A 76 -4.780 -2.330 -4.807 1.00 0.00 C ATOM 1185 C ALA A 76 -5.087 -1.799 -3.404 1.00 0.00 C ATOM 1186 O ALA A 76 -4.520 -2.252 -2.415 1.00 0.00 O ATOM 1187 CB ALA A 76 -3.892 -1.372 -5.576 1.00 0.00 C ATOM 0 H ALA A 76 -6.185 -1.882 -6.292 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.244 -3.277 -4.739 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.943 -1.256 -5.053 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.709 -1.768 -6.575 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.384 -0.403 -5.654 1.00 0.00 H new ATOM 1193 N GLU A 77 -6.057 -0.885 -3.339 1.00 0.00 N ATOM 1194 CA GLU A 77 -6.583 -0.361 -2.074 1.00 0.00 C ATOM 1195 C GLU A 77 -7.181 -1.493 -1.234 1.00 0.00 C ATOM 1196 O GLU A 77 -7.064 -1.508 0.006 1.00 0.00 O ATOM 1197 CB GLU A 77 -7.661 0.687 -2.364 1.00 0.00 C ATOM 1198 CG GLU A 77 -7.125 1.936 -3.022 1.00 0.00 C ATOM 1199 CD GLU A 77 -8.189 2.795 -3.648 1.00 0.00 C ATOM 1200 OE1 GLU A 77 -9.170 3.147 -2.982 1.00 0.00 O ATOM 1201 OE2 GLU A 77 -8.063 3.141 -4.841 1.00 0.00 O ATOM 0 H GLU A 77 -6.503 -0.485 -4.165 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.766 0.096 -1.516 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.422 0.245 -3.007 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.152 0.960 -1.430 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -6.586 2.524 -2.279 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -6.403 1.651 -3.788 1.00 0.00 H new ATOM 1208 N ARG A 78 -7.745 -2.484 -1.918 1.00 0.00 N ATOM 1209 CA ARG A 78 -8.416 -3.589 -1.275 1.00 0.00 C ATOM 1210 C ARG A 78 -7.383 -4.430 -0.566 1.00 0.00 C ATOM 1211 O ARG A 78 -7.645 -5.011 0.475 1.00 0.00 O ATOM 1212 CB ARG A 78 -9.143 -4.458 -2.309 1.00 0.00 C ATOM 1213 CG ARG A 78 -10.013 -5.542 -1.706 1.00 0.00 C ATOM 1214 CD ARG A 78 -11.324 -4.969 -1.206 1.00 0.00 C ATOM 1215 NE ARG A 78 -12.175 -4.572 -2.331 1.00 0.00 N ATOM 1216 CZ ARG A 78 -13.059 -3.570 -2.365 1.00 0.00 C ATOM 1217 NH1 ARG A 78 -13.149 -2.709 -1.341 1.00 0.00 N ATOM 1218 NH2 ARG A 78 -13.845 -3.428 -3.435 1.00 0.00 N ATOM 0 H ARG A 78 -7.745 -2.536 -2.937 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.150 -3.199 -0.569 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.763 -3.816 -2.935 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.404 -4.922 -2.962 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -10.209 -6.313 -2.451 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -9.484 -6.022 -0.883 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -11.841 -5.709 -0.595 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -11.131 -4.107 -0.567 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.082 -5.123 -3.185 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -12.541 -2.816 -0.529 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.826 -1.947 -1.374 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -13.767 -4.080 -4.215 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.523 -2.667 -3.472 1.00 0.00 H new ATOM 1232 N LEU A 79 -6.197 -4.456 -1.123 1.00 0.00 N ATOM 1233 CA LEU A 79 -5.131 -5.232 -0.581 1.00 0.00 C ATOM 1234 C LEU A 79 -4.592 -4.619 0.640 1.00 0.00 C ATOM 1235 O LEU A 79 -4.415 -5.293 1.623 1.00 0.00 O ATOM 1236 CB LEU A 79 -4.032 -5.321 -1.510 1.00 0.00 C ATOM 1237 CG LEU A 79 -3.494 -6.675 -1.707 1.00 0.00 C ATOM 1238 CD1 LEU A 79 -2.313 -6.541 -2.522 1.00 0.00 C ATOM 1239 CD2 LEU A 79 -3.153 -7.409 -0.425 1.00 0.00 C ATOM 0 H LEU A 79 -5.953 -3.936 -1.966 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.548 -6.217 -0.370 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.359 -4.932 -2.474 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.227 -4.674 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.268 -7.280 -2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.877 -7.525 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.580 -6.089 -3.477 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.588 -5.908 -2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.763 -8.398 -0.665 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.400 -6.846 0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.050 -7.511 0.186 1.00 0.00 H new ATOM 1251 N PHE A 80 -4.320 -3.323 0.582 1.00 0.00 N ATOM 1252 CA PHE A 80 -3.843 -2.602 1.757 1.00 0.00 C ATOM 1253 C PHE A 80 -4.870 -2.717 2.859 1.00 0.00 C ATOM 1254 O PHE A 80 -4.560 -2.621 4.038 1.00 0.00 O ATOM 1255 CB PHE A 80 -3.562 -1.132 1.439 1.00 0.00 C ATOM 1256 CG PHE A 80 -2.313 -0.890 0.618 1.00 0.00 C ATOM 1257 CD1 PHE A 80 -2.334 -0.975 -0.760 1.00 0.00 C ATOM 1258 CD2 PHE A 80 -1.116 -0.574 1.242 1.00 0.00 C ATOM 1259 CE1 PHE A 80 -1.192 -0.748 -1.506 1.00 0.00 C ATOM 1260 CE2 PHE A 80 0.032 -0.347 0.505 1.00 0.00 C ATOM 1261 CZ PHE A 80 -0.007 -0.434 -0.872 1.00 0.00 C ATOM 0 H PHE A 80 -4.420 -2.752 -0.257 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.903 -3.048 2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -4.418 -0.720 0.904 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -3.477 -0.581 2.376 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -3.257 -1.223 -1.263 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -1.080 -0.504 2.319 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -1.227 -0.816 -2.583 1.00 0.00 H new ATOM 0 HE2 PHE A 80 0.957 -0.102 1.006 1.00 0.00 H new ATOM 0 HZ PHE A 80 0.887 -0.257 -1.451 1.00 0.00 H new ATOM 1271 N LYS A 81 -6.080 -3.009 2.457 1.00 0.00 N ATOM 1272 CA LYS A 81 -7.136 -3.186 3.406 1.00 0.00 C ATOM 1273 C LYS A 81 -7.204 -4.613 3.912 1.00 0.00 C ATOM 1274 O LYS A 81 -7.526 -4.844 5.081 1.00 0.00 O ATOM 1275 CB LYS A 81 -8.467 -2.639 2.908 1.00 0.00 C ATOM 1276 CG LYS A 81 -8.582 -1.130 3.111 1.00 0.00 C ATOM 1277 CD LYS A 81 -8.822 -0.801 4.593 1.00 0.00 C ATOM 1278 CE LYS A 81 -8.744 0.696 4.905 1.00 0.00 C ATOM 1279 NZ LYS A 81 -7.362 1.214 4.842 1.00 0.00 N ATOM 0 H LYS A 81 -6.353 -3.128 1.481 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.896 -2.577 4.278 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.580 -2.871 1.849 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -9.282 -3.138 3.432 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.671 -0.641 2.767 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.401 -0.738 2.508 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.803 -1.175 4.886 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.086 -1.329 5.199 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -9.367 1.244 4.198 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -9.153 0.879 5.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -7.036 1.450 5.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.738 0.490 4.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.338 2.068 4.249 1.00 0.00 H new ATOM 1293 N LYS A 82 -6.838 -5.582 3.071 1.00 0.00 N ATOM 1294 CA LYS A 82 -6.801 -6.940 3.551 1.00 0.00 C ATOM 1295 C LYS A 82 -5.612 -7.042 4.478 1.00 0.00 C ATOM 1296 O LYS A 82 -5.688 -7.612 5.524 1.00 0.00 O ATOM 1297 CB LYS A 82 -6.655 -7.955 2.419 1.00 0.00 C ATOM 1298 CG LYS A 82 -7.044 -9.369 2.860 1.00 0.00 C ATOM 1299 CD LYS A 82 -6.739 -10.398 1.797 1.00 0.00 C ATOM 1300 CE LYS A 82 -5.276 -10.778 1.822 1.00 0.00 C ATOM 1301 NZ LYS A 82 -4.951 -11.679 2.953 1.00 0.00 N ATOM 0 H LYS A 82 -6.575 -5.449 2.094 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.739 -7.171 4.056 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -7.280 -7.653 1.579 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -5.624 -7.957 2.065 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.509 -9.623 3.775 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -8.108 -9.395 3.095 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.352 -11.285 1.956 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.000 -10.002 0.816 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.013 -11.266 0.884 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.669 -9.875 1.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.018 -11.429 3.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.672 -11.577 3.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.935 -12.664 2.619 1.00 0.00 H new ATOM 1315 N LEU A 83 -4.549 -6.376 4.078 1.00 0.00 N ATOM 1316 CA LEU A 83 -3.295 -6.289 4.803 1.00 0.00 C ATOM 1317 C LEU A 83 -3.481 -5.729 6.208 1.00 0.00 C ATOM 1318 O LEU A 83 -2.815 -6.180 7.150 1.00 0.00 O ATOM 1319 CB LEU A 83 -2.325 -5.414 4.006 1.00 0.00 C ATOM 1320 CG LEU A 83 -1.162 -6.095 3.253 1.00 0.00 C ATOM 1321 CD1 LEU A 83 -1.602 -7.359 2.621 1.00 0.00 C ATOM 1322 CD2 LEU A 83 -0.608 -5.164 2.185 1.00 0.00 C ATOM 0 H LEU A 83 -4.533 -5.857 3.200 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.892 -7.295 4.916 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.909 -4.854 3.276 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.893 -4.687 4.694 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.383 -6.321 3.981 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.762 -7.816 2.098 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.967 -8.042 3.388 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -2.402 -7.151 1.910 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.211 -5.657 1.662 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.396 -4.917 1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -0.242 -4.250 2.653 1.00 0.00 H new ATOM 1334 N ILE A 84 -4.362 -4.738 6.366 1.00 0.00 N ATOM 1335 CA ILE A 84 -4.617 -4.207 7.689 1.00 0.00 C ATOM 1336 C ILE A 84 -5.483 -5.143 8.506 1.00 0.00 C ATOM 1337 O ILE A 84 -5.475 -5.075 9.733 1.00 0.00 O ATOM 1338 CB ILE A 84 -5.146 -2.734 7.709 1.00 0.00 C ATOM 1339 CG1 ILE A 84 -6.502 -2.533 7.006 1.00 0.00 C ATOM 1340 CG2 ILE A 84 -4.120 -1.801 7.134 1.00 0.00 C ATOM 1341 CD1 ILE A 84 -7.725 -2.880 7.842 1.00 0.00 C ATOM 0 H ILE A 84 -4.893 -4.303 5.612 1.00 0.00 H new ATOM 0 HA ILE A 84 -3.641 -4.149 8.170 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.320 -2.501 8.759 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.580 -1.492 6.693 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.517 -3.140 6.101 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.503 -0.781 7.155 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.206 -1.857 7.724 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.905 -2.086 6.104 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.628 -2.704 7.257 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.680 -3.929 8.134 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.744 -2.256 8.735 1.00 0.00 H new ATOM 1353 N LEU A 85 -6.246 -5.991 7.825 1.00 0.00 N ATOM 1354 CA LEU A 85 -7.014 -7.028 8.487 1.00 0.00 C ATOM 1355 C LEU A 85 -6.114 -8.196 8.877 1.00 0.00 C ATOM 1356 O LEU A 85 -6.211 -8.721 9.987 1.00 0.00 O ATOM 1357 CB LEU A 85 -8.161 -7.497 7.607 1.00 0.00 C ATOM 1358 CG LEU A 85 -9.288 -6.501 7.501 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -10.189 -6.826 6.321 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -10.107 -6.489 8.788 1.00 0.00 C ATOM 0 H LEU A 85 -6.346 -5.977 6.810 1.00 0.00 H new ATOM 0 HA LEU A 85 -7.440 -6.608 9.398 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -7.779 -7.708 6.608 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.552 -8.434 8.003 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.853 -5.514 7.344 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.994 -6.094 6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.607 -6.796 5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.613 -7.822 6.450 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.917 -5.765 8.697 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.524 -7.481 8.963 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.466 -6.212 9.625 1.00 0.00 H new ATOM 1372 N ASP A 86 -5.204 -8.559 7.955 1.00 0.00 N ATOM 1373 CA ASP A 86 -4.219 -9.636 8.164 1.00 0.00 C ATOM 1374 C ASP A 86 -3.270 -9.223 9.278 1.00 0.00 C ATOM 1375 O ASP A 86 -2.695 -10.072 9.976 1.00 0.00 O ATOM 1376 CB ASP A 86 -3.352 -9.913 6.904 1.00 0.00 C ATOM 1377 CG ASP A 86 -4.080 -10.290 5.617 1.00 0.00 C ATOM 1378 OD1 ASP A 86 -4.953 -11.175 5.619 1.00 0.00 O ATOM 1379 OD2 ASP A 86 -3.723 -9.743 4.550 1.00 0.00 O ATOM 0 H ASP A 86 -5.131 -8.112 7.041 1.00 0.00 H new ATOM 0 HA ASP A 86 -4.782 -10.538 8.405 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.755 -9.023 6.704 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -2.656 -10.717 7.145 1.00 0.00 H new ATOM 1384 N LYS A 87 -3.083 -7.888 9.398 1.00 0.00 N ATOM 1385 CA LYS A 87 -2.302 -7.241 10.444 1.00 0.00 C ATOM 1386 C LYS A 87 -0.861 -7.181 10.127 1.00 0.00 C ATOM 1387 O LYS A 87 -0.019 -6.928 10.990 1.00 0.00 O ATOM 1388 CB LYS A 87 -2.538 -7.799 11.831 1.00 0.00 C ATOM 1389 CG LYS A 87 -3.204 -6.780 12.704 1.00 0.00 C ATOM 1390 CD LYS A 87 -4.653 -6.588 12.339 1.00 0.00 C ATOM 1391 CE LYS A 87 -5.180 -5.274 12.876 1.00 0.00 C ATOM 1392 NZ LYS A 87 -4.490 -4.123 12.242 1.00 0.00 N ATOM 0 H LYS A 87 -3.490 -7.222 8.741 1.00 0.00 H new ATOM 0 HA LYS A 87 -2.678 -6.218 10.465 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -3.158 -8.693 11.768 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -1.589 -8.100 12.274 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -3.130 -7.091 13.746 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -2.679 -5.829 12.617 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.765 -6.613 11.255 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.244 -7.412 12.739 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.252 -5.206 12.692 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.039 -5.236 13.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.069 -3.267 12.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -3.566 -3.978 12.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.350 -4.317 11.230 1.00 0.00 H new ATOM 1406 N ILE A 88 -0.567 -7.404 8.880 1.00 0.00 N ATOM 1407 CA ILE A 88 0.728 -7.125 8.360 1.00 0.00 C ATOM 1408 C ILE A 88 0.880 -5.613 8.379 1.00 0.00 C ATOM 1409 O ILE A 88 1.931 -5.071 8.722 1.00 0.00 O ATOM 1410 CB ILE A 88 0.892 -7.675 6.906 1.00 0.00 C ATOM 1411 CG1 ILE A 88 1.182 -9.193 6.888 1.00 0.00 C ATOM 1412 CG2 ILE A 88 1.965 -6.915 6.123 1.00 0.00 C ATOM 1413 CD1 ILE A 88 0.047 -10.086 7.319 1.00 0.00 C ATOM 0 H ILE A 88 -1.223 -7.785 8.198 1.00 0.00 H new ATOM 0 HA ILE A 88 1.496 -7.612 8.961 1.00 0.00 H new ATOM 0 HB ILE A 88 -0.065 -7.512 6.409 1.00 0.00 H new ATOM 0 HG12 ILE A 88 1.477 -9.475 5.877 1.00 0.00 H new ATOM 0 HG13 ILE A 88 2.037 -9.387 7.535 1.00 0.00 H new ATOM 0 HG21 ILE A 88 2.045 -7.331 5.118 1.00 0.00 H new ATOM 0 HG22 ILE A 88 1.691 -5.862 6.059 1.00 0.00 H new ATOM 0 HG23 ILE A 88 2.924 -7.011 6.633 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.364 -11.128 7.267 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.238 -9.844 8.343 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.807 -9.933 6.659 1.00 0.00 H new ATOM 1425 N LEU A 89 -0.212 -4.953 8.059 1.00 0.00 N ATOM 1426 CA LEU A 89 -0.258 -3.540 8.069 1.00 0.00 C ATOM 1427 C LEU A 89 -1.092 -3.040 9.201 1.00 0.00 C ATOM 1428 O LEU A 89 -2.064 -3.695 9.631 1.00 0.00 O ATOM 1429 CB LEU A 89 -0.846 -2.980 6.802 1.00 0.00 C ATOM 1430 CG LEU A 89 -0.108 -3.190 5.509 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -0.773 -2.323 4.477 1.00 0.00 C ATOM 1432 CD2 LEU A 89 1.348 -2.821 5.674 1.00 0.00 C ATOM 0 H LEU A 89 -1.087 -5.400 7.786 1.00 0.00 H new ATOM 0 HA LEU A 89 0.776 -3.210 8.171 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.844 -3.403 6.686 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.969 -1.906 6.941 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.141 -4.235 5.202 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.267 -2.445 3.519 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.818 -2.615 4.375 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.716 -1.280 4.787 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.872 -2.977 4.731 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.427 -1.773 5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.796 -3.446 6.446 1.00 0.00 H new ATOM 1444 N ASP A 90 -0.738 -1.879 9.643 1.00 0.00 N ATOM 1445 CA ASP A 90 -1.435 -1.158 10.659 1.00 0.00 C ATOM 1446 C ASP A 90 -1.349 0.307 10.282 1.00 0.00 C ATOM 1447 O ASP A 90 -0.268 0.836 10.125 1.00 0.00 O ATOM 1448 CB ASP A 90 -0.847 -1.436 12.078 1.00 0.00 C ATOM 1449 CG ASP A 90 -1.164 -2.844 12.609 1.00 0.00 C ATOM 1450 OD1 ASP A 90 -2.313 -3.070 13.083 1.00 0.00 O ATOM 1451 OD2 ASP A 90 -0.284 -3.736 12.557 1.00 0.00 O ATOM 0 H ASP A 90 0.081 -1.384 9.291 1.00 0.00 H new ATOM 0 HA ASP A 90 -2.475 -1.478 10.717 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.234 -1.303 12.047 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -1.239 -0.696 12.776 1.00 0.00 H new ATOM 1456 N GLU A 91 -2.477 0.919 10.050 1.00 0.00 N ATOM 1457 CA GLU A 91 -2.537 2.318 9.608 1.00 0.00 C ATOM 1458 C GLU A 91 -2.707 3.286 10.778 1.00 0.00 C ATOM 1459 O GLU A 91 -3.251 2.925 11.834 1.00 0.00 O ATOM 1460 CB GLU A 91 -3.719 2.501 8.656 1.00 0.00 C ATOM 1461 CG GLU A 91 -3.611 1.726 7.362 1.00 0.00 C ATOM 1462 CD GLU A 91 -4.901 1.743 6.572 1.00 0.00 C ATOM 1463 OE1 GLU A 91 -5.820 0.952 6.894 1.00 0.00 O ATOM 1464 OE2 GLU A 91 -5.028 2.515 5.600 1.00 0.00 O ATOM 0 H GLU A 91 -3.390 0.477 10.157 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.593 2.541 9.111 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.632 2.200 9.169 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.820 3.561 8.422 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.810 2.148 6.755 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.335 0.694 7.581 1.00 0.00 H new ATOM 1471 N ASP A 92 -2.269 4.516 10.559 1.00 0.00 N ATOM 1472 CA ASP A 92 -2.382 5.589 11.548 1.00 0.00 C ATOM 1473 C ASP A 92 -3.595 6.393 11.195 1.00 0.00 C ATOM 1474 O ASP A 92 -3.816 6.686 10.021 1.00 0.00 O ATOM 1475 CB ASP A 92 -1.204 6.582 11.484 1.00 0.00 C ATOM 1476 CG ASP A 92 0.162 5.966 11.526 1.00 0.00 C ATOM 1477 OD1 ASP A 92 0.627 5.608 12.621 1.00 0.00 O ATOM 1478 OD2 ASP A 92 0.792 5.880 10.453 1.00 0.00 O ATOM 0 H ASP A 92 -1.823 4.804 9.688 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.414 5.126 12.534 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.293 7.165 10.567 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.294 7.280 12.316 1.00 0.00 H new ATOM 1483 N LEU A 93 -4.366 6.774 12.170 1.00 0.00 N ATOM 1484 CA LEU A 93 -5.548 7.555 11.908 1.00 0.00 C ATOM 1485 C LEU A 93 -5.359 8.993 12.338 1.00 0.00 C ATOM 1486 O LEU A 93 -5.160 9.290 13.512 1.00 0.00 O ATOM 1487 CB LEU A 93 -6.789 6.938 12.554 1.00 0.00 C ATOM 1488 CG LEU A 93 -7.212 5.564 12.014 1.00 0.00 C ATOM 1489 CD1 LEU A 93 -8.429 5.053 12.765 1.00 0.00 C ATOM 1490 CD2 LEU A 93 -7.500 5.633 10.513 1.00 0.00 C ATOM 0 H LEU A 93 -4.202 6.560 13.154 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.710 7.549 10.830 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.610 6.847 13.625 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.622 7.629 12.428 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.388 4.868 12.170 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.717 4.078 12.371 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.190 4.960 13.824 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.255 5.753 12.639 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -7.798 4.648 10.154 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -8.305 6.345 10.329 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.603 5.956 9.985 1.00 0.00 H new ATOM 1502 N TYR A 94 -5.414 9.862 11.378 1.00 0.00 N ATOM 1503 CA TYR A 94 -5.259 11.270 11.570 1.00 0.00 C ATOM 1504 C TYR A 94 -6.459 11.942 10.968 1.00 0.00 C ATOM 1505 O TYR A 94 -6.632 11.948 9.756 1.00 0.00 O ATOM 1506 CB TYR A 94 -3.972 11.742 10.883 1.00 0.00 C ATOM 1507 CG TYR A 94 -3.734 13.240 10.911 1.00 0.00 C ATOM 1508 CD1 TYR A 94 -3.207 13.863 12.030 1.00 0.00 C ATOM 1509 CD2 TYR A 94 -4.022 14.023 9.798 1.00 0.00 C ATOM 1510 CE1 TYR A 94 -2.975 15.225 12.043 1.00 0.00 C ATOM 1511 CE2 TYR A 94 -3.797 15.381 9.804 1.00 0.00 C ATOM 1512 CZ TYR A 94 -3.274 15.978 10.926 1.00 0.00 C ATOM 1513 OH TYR A 94 -3.042 17.331 10.931 1.00 0.00 O ATOM 0 H TYR A 94 -5.574 9.601 10.405 1.00 0.00 H new ATOM 0 HA TYR A 94 -5.185 11.517 12.629 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -3.124 11.247 11.357 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.993 11.413 9.844 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.974 13.275 12.906 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -4.430 13.557 8.913 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -2.562 15.697 12.922 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -4.030 15.974 8.932 1.00 0.00 H new ATOM 0 HH TYR A 94 -3.306 17.711 10.067 1.00 0.00 H new ATOM 1523 N ILE A 95 -7.299 12.457 11.787 1.00 0.00 N ATOM 1524 CA ILE A 95 -8.492 13.061 11.314 1.00 0.00 C ATOM 1525 C ILE A 95 -8.415 14.566 11.569 1.00 0.00 C ATOM 1526 O ILE A 95 -7.741 15.006 12.503 1.00 0.00 O ATOM 1527 CB ILE A 95 -9.726 12.405 12.006 1.00 0.00 C ATOM 1528 CG1 ILE A 95 -10.993 12.710 11.271 1.00 0.00 C ATOM 1529 CG2 ILE A 95 -9.871 12.866 13.433 1.00 0.00 C ATOM 1530 CD1 ILE A 95 -12.183 11.973 11.818 1.00 0.00 C ATOM 0 H ILE A 95 -7.182 12.473 12.800 1.00 0.00 H new ATOM 0 HA ILE A 95 -8.606 12.904 10.241 1.00 0.00 H new ATOM 0 HB ILE A 95 -9.551 11.329 11.992 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.184 13.782 11.318 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.867 12.454 10.219 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -10.741 12.388 13.883 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.977 12.596 13.995 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.000 13.948 13.454 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.070 12.237 11.243 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.010 10.899 11.747 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.333 12.248 12.862 1.00 0.00 H new ATOM 1542 N ASN A 96 -9.031 15.346 10.727 1.00 0.00 N ATOM 1543 CA ASN A 96 -9.024 16.785 10.913 1.00 0.00 C ATOM 1544 C ASN A 96 -10.381 17.217 11.463 1.00 0.00 C ATOM 1545 O ASN A 96 -11.239 16.378 11.688 1.00 0.00 O ATOM 1546 CB ASN A 96 -8.693 17.528 9.592 1.00 0.00 C ATOM 1547 CG ASN A 96 -9.814 17.513 8.560 1.00 0.00 C ATOM 1548 OD1 ASN A 96 -10.625 16.602 8.505 1.00 0.00 O ATOM 1549 ND2 ASN A 96 -9.855 18.523 7.737 1.00 0.00 N ATOM 0 H ASN A 96 -9.544 15.021 9.907 1.00 0.00 H new ATOM 0 HA ASN A 96 -8.242 17.049 11.625 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -8.445 18.563 9.825 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -7.804 17.079 9.150 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -10.580 18.568 7.021 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -9.162 19.268 7.809 1.00 0.00 H new ATOM 1556 N ALA A 97 -10.594 18.523 11.613 1.00 0.00 N ATOM 1557 CA ALA A 97 -11.841 19.073 12.190 1.00 0.00 C ATOM 1558 C ALA A 97 -13.041 18.998 11.216 1.00 0.00 C ATOM 1559 O ALA A 97 -14.030 19.693 11.385 1.00 0.00 O ATOM 1560 CB ALA A 97 -11.604 20.512 12.632 1.00 0.00 C ATOM 0 H ALA A 97 -9.916 19.236 11.342 1.00 0.00 H new ATOM 0 HA ALA A 97 -12.103 18.455 13.049 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.522 20.918 13.057 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -10.814 20.537 13.383 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -11.306 21.112 11.772 1.00 0.00 H new ATOM 1566 N ASN A 98 -12.923 18.170 10.207 1.00 0.00 N ATOM 1567 CA ASN A 98 -13.992 17.946 9.244 1.00 0.00 C ATOM 1568 C ASN A 98 -14.411 16.509 9.289 1.00 0.00 C ATOM 1569 O ASN A 98 -15.183 16.061 8.443 1.00 0.00 O ATOM 1570 CB ASN A 98 -13.527 18.241 7.827 1.00 0.00 C ATOM 1571 CG ASN A 98 -13.265 19.680 7.538 1.00 0.00 C ATOM 1572 OD1 ASN A 98 -12.159 20.177 7.726 1.00 0.00 O ATOM 1573 ND2 ASN A 98 -14.242 20.359 7.048 1.00 0.00 N ATOM 0 H ASN A 98 -12.080 17.626 10.023 1.00 0.00 H new ATOM 0 HA ASN A 98 -14.817 18.609 9.505 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -12.616 17.675 7.634 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -14.282 17.877 7.130 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -14.109 21.340 6.804 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -15.149 19.916 6.904 1.00 0.00 H new ATOM 1580 N ASP A 99 -13.841 15.780 10.248 1.00 0.00 N ATOM 1581 CA ASP A 99 -14.062 14.338 10.415 1.00 0.00 C ATOM 1582 C ASP A 99 -13.577 13.556 9.190 1.00 0.00 C ATOM 1583 O ASP A 99 -14.021 12.441 8.901 1.00 0.00 O ATOM 1584 CB ASP A 99 -15.519 13.985 10.784 1.00 0.00 C ATOM 1585 CG ASP A 99 -15.867 14.347 12.218 1.00 0.00 C ATOM 1586 OD1 ASP A 99 -16.317 15.489 12.458 1.00 0.00 O ATOM 1587 OD2 ASP A 99 -15.678 13.486 13.113 1.00 0.00 O ATOM 0 H ASP A 99 -13.205 16.176 10.940 1.00 0.00 H new ATOM 0 HA ASP A 99 -13.458 14.030 11.269 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -16.197 14.506 10.108 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -15.678 12.917 10.635 1.00 0.00 H new ATOM 1592 N GLN A 100 -12.590 14.117 8.523 1.00 0.00 N ATOM 1593 CA GLN A 100 -11.973 13.472 7.392 1.00 0.00 C ATOM 1594 C GLN A 100 -10.775 12.704 7.900 1.00 0.00 C ATOM 1595 O GLN A 100 -9.745 13.300 8.259 1.00 0.00 O ATOM 1596 CB GLN A 100 -11.526 14.488 6.359 1.00 0.00 C ATOM 1597 CG GLN A 100 -12.649 15.332 5.778 1.00 0.00 C ATOM 1598 CD GLN A 100 -12.145 16.407 4.829 1.00 0.00 C ATOM 1599 OE1 GLN A 100 -12.827 16.796 3.902 1.00 0.00 O ATOM 1600 NE2 GLN A 100 -10.947 16.899 5.061 1.00 0.00 N ATOM 0 H GLN A 100 -12.197 15.030 8.752 1.00 0.00 H new ATOM 0 HA GLN A 100 -12.692 12.808 6.912 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -10.789 15.150 6.814 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -11.024 13.964 5.546 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -13.348 14.684 5.248 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -13.203 15.802 6.591 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -10.397 16.553 5.847 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -10.568 17.627 4.455 1.00 0.00 H new ATOM 1609 N ALA A 101 -10.938 11.417 8.007 1.00 0.00 N ATOM 1610 CA ALA A 101 -9.911 10.553 8.532 1.00 0.00 C ATOM 1611 C ALA A 101 -8.914 10.165 7.468 1.00 0.00 C ATOM 1612 O ALA A 101 -9.258 9.518 6.480 1.00 0.00 O ATOM 1613 CB ALA A 101 -10.528 9.313 9.165 1.00 0.00 C ATOM 0 H ALA A 101 -11.791 10.931 7.732 1.00 0.00 H new ATOM 0 HA ALA A 101 -9.373 11.108 9.301 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -9.737 8.672 9.556 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -11.189 9.611 9.979 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.099 8.767 8.414 1.00 0.00 H new ATOM 1619 N ILE A 102 -7.704 10.583 7.661 1.00 0.00 N ATOM 1620 CA ILE A 102 -6.637 10.259 6.834 1.00 0.00 C ATOM 1621 C ILE A 102 -5.856 9.137 7.501 1.00 0.00 C ATOM 1622 O ILE A 102 -5.579 9.186 8.704 1.00 0.00 O ATOM 1623 CB ILE A 102 -5.770 11.522 6.604 1.00 0.00 C ATOM 1624 CG1 ILE A 102 -6.326 12.404 5.473 1.00 0.00 C ATOM 1625 CG2 ILE A 102 -4.314 11.220 6.446 1.00 0.00 C ATOM 1626 CD1 ILE A 102 -6.404 11.725 4.113 1.00 0.00 C ATOM 0 H ILE A 102 -7.444 11.186 8.441 1.00 0.00 H new ATOM 0 HA ILE A 102 -6.973 9.915 5.856 1.00 0.00 H new ATOM 0 HB ILE A 102 -5.840 12.109 7.520 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -7.324 12.742 5.752 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.701 13.293 5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -3.765 12.148 6.288 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -3.945 10.728 7.346 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -4.170 10.563 5.588 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.807 12.424 3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.406 11.412 3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.054 10.853 4.179 1.00 0.00 H new ATOM 1638 N ALA A 103 -5.560 8.132 6.743 1.00 0.00 N ATOM 1639 CA ALA A 103 -4.858 6.985 7.246 1.00 0.00 C ATOM 1640 C ALA A 103 -3.486 6.880 6.617 1.00 0.00 C ATOM 1641 O ALA A 103 -3.357 6.860 5.378 1.00 0.00 O ATOM 1642 CB ALA A 103 -5.664 5.722 6.996 1.00 0.00 C ATOM 0 H ALA A 103 -5.797 8.078 5.752 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.728 7.103 8.322 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.120 4.860 7.383 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.627 5.799 7.501 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -5.825 5.599 5.925 1.00 0.00 H new ATOM 1648 N TYR A 104 -2.473 6.828 7.446 1.00 0.00 N ATOM 1649 CA TYR A 104 -1.111 6.684 6.981 1.00 0.00 C ATOM 1650 C TYR A 104 -0.738 5.224 7.063 1.00 0.00 C ATOM 1651 O TYR A 104 -1.331 4.484 7.830 1.00 0.00 O ATOM 1652 CB TYR A 104 -0.118 7.506 7.806 1.00 0.00 C ATOM 1653 CG TYR A 104 -0.289 9.009 7.769 1.00 0.00 C ATOM 1654 CD1 TYR A 104 -1.168 9.656 8.626 1.00 0.00 C ATOM 1655 CD2 TYR A 104 0.471 9.785 6.901 1.00 0.00 C ATOM 1656 CE1 TYR A 104 -1.287 11.032 8.614 1.00 0.00 C ATOM 1657 CE2 TYR A 104 0.350 11.158 6.880 1.00 0.00 C ATOM 1658 CZ TYR A 104 -0.529 11.777 7.739 1.00 0.00 C ATOM 1659 OH TYR A 104 -0.635 13.156 7.745 1.00 0.00 O ATOM 0 H TYR A 104 -2.566 6.884 8.460 1.00 0.00 H new ATOM 0 HA TYR A 104 -1.060 7.054 5.957 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -0.186 7.181 8.844 1.00 0.00 H new ATOM 0 HB3 TYR A 104 0.889 7.269 7.463 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -1.767 9.076 9.312 1.00 0.00 H new ATOM 0 HD2 TYR A 104 1.168 9.304 6.231 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -1.973 11.522 9.289 1.00 0.00 H new ATOM 0 HE2 TYR A 104 0.942 11.745 6.193 1.00 0.00 H new ATOM 0 HH TYR A 104 -0.865 13.463 8.647 1.00 0.00 H new ATOM 1669 N VAL A 105 0.211 4.811 6.272 1.00 0.00 N ATOM 1670 CA VAL A 105 0.568 3.419 6.208 1.00 0.00 C ATOM 1671 C VAL A 105 1.805 3.050 6.996 1.00 0.00 C ATOM 1672 O VAL A 105 2.928 3.551 6.753 1.00 0.00 O ATOM 1673 CB VAL A 105 0.608 2.886 4.754 1.00 0.00 C ATOM 1674 CG1 VAL A 105 1.282 1.515 4.651 1.00 0.00 C ATOM 1675 CG2 VAL A 105 -0.799 2.755 4.289 1.00 0.00 C ATOM 0 H VAL A 105 0.754 5.419 5.660 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.245 2.901 6.717 1.00 0.00 H new ATOM 0 HB VAL A 105 1.186 3.582 4.146 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.284 1.188 3.611 1.00 0.00 H new ATOM 0 HG12 VAL A 105 2.309 1.586 5.011 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.734 0.794 5.258 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.811 2.381 3.265 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.333 2.059 4.936 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -1.286 3.729 4.325 1.00 0.00 H new ATOM 1685 N MET A 106 1.584 2.151 7.915 1.00 0.00 N ATOM 1686 CA MET A 106 2.616 1.589 8.766 1.00 0.00 C ATOM 1687 C MET A 106 2.448 0.077 8.786 1.00 0.00 C ATOM 1688 O MET A 106 1.618 -0.477 8.057 1.00 0.00 O ATOM 1689 CB MET A 106 2.530 2.120 10.216 1.00 0.00 C ATOM 1690 CG MET A 106 2.739 3.607 10.390 1.00 0.00 C ATOM 1691 SD MET A 106 4.379 4.179 9.890 1.00 0.00 S ATOM 1692 CE MET A 106 4.204 5.919 10.293 1.00 0.00 C ATOM 0 H MET A 106 0.656 1.773 8.104 1.00 0.00 H new ATOM 0 HA MET A 106 3.586 1.880 8.363 1.00 0.00 H new ATOM 0 HB2 MET A 106 1.551 1.861 10.619 1.00 0.00 H new ATOM 0 HB3 MET A 106 3.272 1.596 10.819 1.00 0.00 H new ATOM 0 HG2 MET A 106 1.986 4.140 9.809 1.00 0.00 H new ATOM 0 HG3 MET A 106 2.578 3.867 11.436 1.00 0.00 H new ATOM 0 HE1 MET A 106 5.128 6.443 10.050 1.00 0.00 H new ATOM 0 HE2 MET A 106 3.383 6.345 9.717 1.00 0.00 H new ATOM 0 HE3 MET A 106 3.994 6.027 11.357 1.00 0.00 H new ATOM 1702 N LEU A 107 3.207 -0.574 9.614 1.00 0.00 N ATOM 1703 CA LEU A 107 3.182 -1.998 9.760 1.00 0.00 C ATOM 1704 C LEU A 107 3.407 -2.284 11.231 1.00 0.00 C ATOM 1705 O LEU A 107 4.274 -1.645 11.843 1.00 0.00 O ATOM 1706 CB LEU A 107 4.268 -2.672 8.861 1.00 0.00 C ATOM 1707 CG LEU A 107 5.778 -2.376 9.139 1.00 0.00 C ATOM 1708 CD1 LEU A 107 6.644 -3.286 8.290 1.00 0.00 C ATOM 1709 CD2 LEU A 107 6.152 -0.921 8.843 1.00 0.00 C ATOM 0 H LEU A 107 3.882 -0.115 10.226 1.00 0.00 H new ATOM 0 HA LEU A 107 2.228 -2.413 9.435 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.127 -3.751 8.929 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.062 -2.388 7.829 1.00 0.00 H new ATOM 0 HG LEU A 107 5.949 -2.559 10.200 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.695 -3.076 8.487 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.429 -4.326 8.536 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.431 -3.111 7.235 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.211 -0.768 9.052 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.954 -0.701 7.794 1.00 0.00 H new ATOM 0 HD23 LEU A 107 5.558 -0.258 9.472 1.00 0.00 H new ATOM 1721 N GLY A 108 2.625 -3.172 11.821 1.00 0.00 N ATOM 1722 CA GLY A 108 2.757 -3.368 13.241 1.00 0.00 C ATOM 1723 C GLY A 108 2.710 -4.812 13.725 1.00 0.00 C ATOM 1724 O GLY A 108 3.752 -5.419 13.985 1.00 0.00 O ATOM 0 H GLY A 108 1.921 -3.745 11.356 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.702 -2.929 13.562 1.00 0.00 H new ATOM 0 HA3 GLY A 108 1.962 -2.813 13.739 1.00 0.00 H new ATOM 1728 N ASN A 109 1.517 -5.367 13.799 1.00 0.00 N ATOM 1729 CA ASN A 109 1.288 -6.652 14.497 1.00 0.00 C ATOM 1730 C ASN A 109 2.005 -7.868 13.885 1.00 0.00 C ATOM 1731 O ASN A 109 2.685 -8.603 14.595 1.00 0.00 O ATOM 1732 CB ASN A 109 -0.211 -6.923 14.693 1.00 0.00 C ATOM 1733 CG ASN A 109 -0.502 -8.114 15.613 1.00 0.00 C ATOM 1734 OD1 ASN A 109 -0.657 -9.265 15.176 1.00 0.00 O ATOM 1735 ND2 ASN A 109 -0.589 -7.849 16.889 1.00 0.00 N ATOM 0 H ASN A 109 0.677 -4.960 13.388 1.00 0.00 H new ATOM 0 HA ASN A 109 1.756 -6.522 15.473 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.682 -6.031 15.106 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -0.669 -7.104 13.721 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -0.789 -8.597 17.553 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -0.457 -6.894 17.222 1.00 0.00 H new ATOM 1742 N LYS A 110 1.857 -8.101 12.593 1.00 0.00 N ATOM 1743 CA LYS A 110 2.522 -9.253 11.972 1.00 0.00 C ATOM 1744 C LYS A 110 3.801 -8.806 11.302 1.00 0.00 C ATOM 1745 O LYS A 110 4.562 -9.624 10.762 1.00 0.00 O ATOM 1746 CB LYS A 110 1.631 -9.928 10.917 1.00 0.00 C ATOM 1747 CG LYS A 110 0.227 -10.268 11.364 1.00 0.00 C ATOM 1748 CD LYS A 110 0.192 -11.105 12.607 1.00 0.00 C ATOM 1749 CE LYS A 110 -1.240 -11.400 12.992 1.00 0.00 C ATOM 1750 NZ LYS A 110 -1.329 -11.857 14.389 1.00 0.00 N ATOM 0 H LYS A 110 1.299 -7.529 11.959 1.00 0.00 H new ATOM 0 HA LYS A 110 2.731 -9.972 12.764 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.567 -9.272 10.049 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.120 -10.845 10.588 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.326 -9.345 11.539 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.285 -10.799 10.561 1.00 0.00 H new ATOM 0 HD2 LYS A 110 0.732 -12.037 12.443 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.696 -10.583 13.421 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.847 -10.505 12.859 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.648 -12.163 12.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.293 -12.197 14.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.651 -12.630 14.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -1.106 -11.067 15.028 1.00 0.00 H new ATOM 1764 N ALA A 111 4.041 -7.507 11.375 1.00 0.00 N ATOM 1765 CA ALA A 111 5.145 -6.838 10.704 1.00 0.00 C ATOM 1766 C ALA A 111 6.498 -7.474 10.972 1.00 0.00 C ATOM 1767 O ALA A 111 7.338 -7.494 10.091 1.00 0.00 O ATOM 1768 CB ALA A 111 5.193 -5.390 11.094 1.00 0.00 C ATOM 0 H ALA A 111 3.457 -6.871 11.918 1.00 0.00 H new ATOM 0 HA ALA A 111 4.950 -6.941 9.637 1.00 0.00 H new ATOM 0 HB1 ALA A 111 6.024 -4.903 10.584 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.259 -4.905 10.810 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.331 -5.308 12.172 1.00 0.00 H new ATOM 1774 N GLN A 112 6.701 -8.026 12.162 1.00 0.00 N ATOM 1775 CA GLN A 112 8.000 -8.602 12.495 1.00 0.00 C ATOM 1776 C GLN A 112 8.301 -9.808 11.591 1.00 0.00 C ATOM 1777 O GLN A 112 9.419 -9.979 11.121 1.00 0.00 O ATOM 1778 CB GLN A 112 8.117 -8.924 14.022 1.00 0.00 C ATOM 1779 CG GLN A 112 7.513 -10.250 14.537 1.00 0.00 C ATOM 1780 CD GLN A 112 8.536 -11.394 14.527 1.00 0.00 C ATOM 1781 OE1 GLN A 112 9.256 -11.590 15.491 1.00 0.00 O ATOM 1782 NE2 GLN A 112 8.571 -12.163 13.472 1.00 0.00 N ATOM 0 H GLN A 112 5.999 -8.087 12.900 1.00 0.00 H new ATOM 0 HA GLN A 112 8.772 -7.859 12.296 1.00 0.00 H new ATOM 0 HB2 GLN A 112 9.175 -8.916 14.284 1.00 0.00 H new ATOM 0 HB3 GLN A 112 7.647 -8.108 14.571 1.00 0.00 H new ATOM 0 HG2 GLN A 112 7.139 -10.108 15.551 1.00 0.00 H new ATOM 0 HG3 GLN A 112 6.659 -10.523 13.918 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.955 -11.972 12.681 1.00 0.00 H new ATOM 0 HE22 GLN A 112 9.214 -12.954 13.439 1.00 0.00 H new ATOM 1791 N THR A 113 7.274 -10.591 11.283 1.00 0.00 N ATOM 1792 CA THR A 113 7.431 -11.768 10.455 1.00 0.00 C ATOM 1793 C THR A 113 7.527 -11.345 8.994 1.00 0.00 C ATOM 1794 O THR A 113 8.128 -12.023 8.166 1.00 0.00 O ATOM 1795 CB THR A 113 6.245 -12.709 10.668 1.00 0.00 C ATOM 1796 OG1 THR A 113 5.979 -12.771 12.080 1.00 0.00 O ATOM 1797 CG2 THR A 113 6.584 -14.108 10.175 1.00 0.00 C ATOM 0 H THR A 113 6.319 -10.425 11.600 1.00 0.00 H new ATOM 0 HA THR A 113 8.344 -12.296 10.730 1.00 0.00 H new ATOM 0 HB THR A 113 5.380 -12.340 10.117 1.00 0.00 H new ATOM 0 HG1 THR A 113 5.220 -13.368 12.244 1.00 0.00 H new ATOM 0 HG21 THR A 113 5.730 -14.766 10.333 1.00 0.00 H new ATOM 0 HG22 THR A 113 6.822 -14.071 9.112 1.00 0.00 H new ATOM 0 HG23 THR A 113 7.443 -14.490 10.726 1.00 0.00 H new ATOM 1805 N VAL A 114 6.957 -10.194 8.717 1.00 0.00 N ATOM 1806 CA VAL A 114 7.024 -9.573 7.408 1.00 0.00 C ATOM 1807 C VAL A 114 8.472 -9.148 7.152 1.00 0.00 C ATOM 1808 O VAL A 114 9.004 -9.337 6.061 1.00 0.00 O ATOM 1809 CB VAL A 114 6.096 -8.331 7.366 1.00 0.00 C ATOM 1810 CG1 VAL A 114 6.122 -7.638 6.019 1.00 0.00 C ATOM 1811 CG2 VAL A 114 4.684 -8.712 7.747 1.00 0.00 C ATOM 0 H VAL A 114 6.427 -9.654 9.401 1.00 0.00 H new ATOM 0 HA VAL A 114 6.698 -10.276 6.642 1.00 0.00 H new ATOM 0 HB VAL A 114 6.478 -7.618 8.097 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.456 -6.775 6.041 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.137 -7.308 5.799 1.00 0.00 H new ATOM 0 HG13 VAL A 114 5.791 -8.332 5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 114 4.047 -7.828 7.712 1.00 0.00 H new ATOM 0 HG22 VAL A 114 4.307 -9.459 7.048 1.00 0.00 H new ATOM 0 HG23 VAL A 114 4.678 -9.124 8.756 1.00 0.00 H new ATOM 1821 N LEU A 115 9.105 -8.626 8.197 1.00 0.00 N ATOM 1822 CA LEU A 115 10.505 -8.215 8.152 1.00 0.00 C ATOM 1823 C LEU A 115 11.404 -9.441 8.116 1.00 0.00 C ATOM 1824 O LEU A 115 12.501 -9.400 7.580 1.00 0.00 O ATOM 1825 CB LEU A 115 10.852 -7.347 9.360 1.00 0.00 C ATOM 1826 CG LEU A 115 9.976 -6.111 9.558 1.00 0.00 C ATOM 1827 CD1 LEU A 115 10.387 -5.348 10.804 1.00 0.00 C ATOM 1828 CD2 LEU A 115 10.011 -5.205 8.337 1.00 0.00 C ATOM 0 H LEU A 115 8.661 -8.475 9.103 1.00 0.00 H new ATOM 0 HA LEU A 115 10.664 -7.627 7.248 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.789 -7.963 10.257 1.00 0.00 H new ATOM 0 HB3 LEU A 115 11.889 -7.024 9.267 1.00 0.00 H new ATOM 0 HG LEU A 115 8.950 -6.454 9.690 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.748 -4.473 10.922 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.284 -5.993 11.676 1.00 0.00 H new ATOM 0 HD13 LEU A 115 11.425 -5.029 10.710 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.377 -4.335 8.511 1.00 0.00 H new ATOM 0 HD22 LEU A 115 11.035 -4.878 8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.646 -5.752 7.468 1.00 0.00 H new ATOM 1840 N ASN A 116 10.927 -10.535 8.709 1.00 0.00 N ATOM 1841 CA ASN A 116 11.620 -11.823 8.621 1.00 0.00 C ATOM 1842 C ASN A 116 11.454 -12.412 7.229 1.00 0.00 C ATOM 1843 O ASN A 116 12.084 -13.398 6.881 1.00 0.00 O ATOM 1844 CB ASN A 116 11.129 -12.844 9.685 1.00 0.00 C ATOM 1845 CG ASN A 116 11.533 -12.534 11.113 1.00 0.00 C ATOM 1846 OD1 ASN A 116 10.839 -12.913 12.043 1.00 0.00 O ATOM 1847 ND2 ASN A 116 12.645 -11.866 11.307 1.00 0.00 N ATOM 0 H ASN A 116 10.066 -10.557 9.255 1.00 0.00 H new ATOM 0 HA ASN A 116 12.674 -11.629 8.821 1.00 0.00 H new ATOM 0 HB2 ASN A 116 10.042 -12.900 9.636 1.00 0.00 H new ATOM 0 HB3 ASN A 116 11.511 -13.830 9.422 1.00 0.00 H new ATOM 0 HD21 ASN A 116 12.951 -11.650 12.256 1.00 0.00 H new ATOM 0 HD22 ASN A 116 13.204 -11.563 10.509 1.00 0.00 H new ATOM 1854 N GLY A 117 10.559 -11.814 6.457 1.00 0.00 N ATOM 1855 CA GLY A 117 10.327 -12.229 5.100 1.00 0.00 C ATOM 1856 C GLY A 117 9.319 -13.350 4.988 1.00 0.00 C ATOM 1857 O GLY A 117 8.778 -13.608 3.894 1.00 0.00 O ATOM 0 H GLY A 117 9.980 -11.031 6.761 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.978 -11.375 4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.270 -12.551 4.658 1.00 0.00 H new ATOM 1861 N ASN A 118 8.994 -13.958 6.104 1.00 0.00 N ATOM 1862 CA ASN A 118 8.143 -15.133 6.126 1.00 0.00 C ATOM 1863 C ASN A 118 6.684 -14.750 6.286 1.00 0.00 C ATOM 1864 O ASN A 118 6.046 -15.022 7.289 1.00 0.00 O ATOM 1865 CB ASN A 118 8.578 -16.118 7.223 1.00 0.00 C ATOM 1866 CG ASN A 118 7.829 -17.450 7.157 1.00 0.00 C ATOM 1867 OD1 ASN A 118 7.413 -17.894 6.092 1.00 0.00 O ATOM 1868 ND2 ASN A 118 7.665 -18.091 8.290 1.00 0.00 N ATOM 0 H ASN A 118 9.310 -13.655 7.025 1.00 0.00 H new ATOM 0 HA ASN A 118 8.253 -15.637 5.166 1.00 0.00 H new ATOM 0 HB2 ASN A 118 9.648 -16.304 7.134 1.00 0.00 H new ATOM 0 HB3 ASN A 118 8.414 -15.662 8.199 1.00 0.00 H new ATOM 0 HD21 ASN A 118 7.179 -18.988 8.303 1.00 0.00 H new ATOM 0 HD22 ASN A 118 8.024 -17.693 9.158 1.00 0.00 H new ATOM 1875 N LEU A 119 6.195 -14.046 5.327 1.00 0.00 N ATOM 1876 CA LEU A 119 4.831 -13.697 5.282 1.00 0.00 C ATOM 1877 C LEU A 119 4.308 -13.999 3.893 1.00 0.00 C ATOM 1878 O LEU A 119 4.971 -13.730 2.855 1.00 0.00 O ATOM 1879 CB LEU A 119 4.554 -12.221 5.759 1.00 0.00 C ATOM 1880 CG LEU A 119 4.804 -11.034 4.791 1.00 0.00 C ATOM 1881 CD1 LEU A 119 6.089 -11.186 4.054 1.00 0.00 C ATOM 1882 CD2 LEU A 119 3.626 -10.796 3.849 1.00 0.00 C ATOM 0 H LEU A 119 6.745 -13.694 4.543 1.00 0.00 H new ATOM 0 HA LEU A 119 4.279 -14.302 6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.511 -12.171 6.071 1.00 0.00 H new ATOM 0 HB3 LEU A 119 5.161 -12.048 6.648 1.00 0.00 H new ATOM 0 HG LEU A 119 4.892 -10.138 5.406 1.00 0.00 H new ATOM 0 HD11 LEU A 119 6.228 -10.336 3.386 1.00 0.00 H new ATOM 0 HD12 LEU A 119 6.914 -11.228 4.765 1.00 0.00 H new ATOM 0 HD13 LEU A 119 6.067 -12.106 3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.850 -9.956 3.192 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.453 -11.690 3.249 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.733 -10.573 4.433 1.00 0.00 H new ATOM 1894 N LYS A 120 3.244 -14.638 3.897 1.00 0.00 N ATOM 1895 CA LYS A 120 2.534 -15.042 2.731 1.00 0.00 C ATOM 1896 C LYS A 120 1.076 -14.658 2.864 1.00 0.00 C ATOM 1897 O LYS A 120 0.460 -14.959 3.886 1.00 0.00 O ATOM 1898 CB LYS A 120 2.706 -16.552 2.490 1.00 0.00 C ATOM 1899 CG LYS A 120 2.485 -17.395 3.742 1.00 0.00 C ATOM 1900 CD LYS A 120 2.495 -18.916 3.492 1.00 0.00 C ATOM 1901 CE LYS A 120 1.205 -19.457 2.823 1.00 0.00 C ATOM 1902 NZ LYS A 120 1.084 -19.159 1.380 1.00 0.00 N ATOM 0 H LYS A 120 2.786 -14.929 4.761 1.00 0.00 H new ATOM 0 HA LYS A 120 2.943 -14.528 1.861 1.00 0.00 H new ATOM 0 HB2 LYS A 120 2.006 -16.871 1.718 1.00 0.00 H new ATOM 0 HB3 LYS A 120 3.709 -16.739 2.107 1.00 0.00 H new ATOM 0 HG2 LYS A 120 3.259 -17.153 4.470 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.530 -17.118 4.188 1.00 0.00 H new ATOM 0 HD2 LYS A 120 3.349 -19.164 2.862 1.00 0.00 H new ATOM 0 HD3 LYS A 120 2.641 -19.429 4.443 1.00 0.00 H new ATOM 0 HE2 LYS A 120 1.166 -20.538 2.961 1.00 0.00 H new ATOM 0 HE3 LYS A 120 0.341 -19.039 3.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 0.309 -19.721 0.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 0.883 -18.147 1.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 1.975 -19.399 0.900 1.00 0.00 H new ATOM 1916 N VAL A 121 0.535 -13.976 1.886 1.00 0.00 N ATOM 1917 CA VAL A 121 -0.858 -13.633 1.904 1.00 0.00 C ATOM 1918 C VAL A 121 -1.445 -13.941 0.551 1.00 0.00 C ATOM 1919 O VAL A 121 -0.720 -14.209 -0.403 1.00 0.00 O ATOM 1920 CB VAL A 121 -1.150 -12.144 2.246 1.00 0.00 C ATOM 1921 CG1 VAL A 121 -0.500 -11.692 3.541 1.00 0.00 C ATOM 1922 CG2 VAL A 121 -0.817 -11.237 1.093 1.00 0.00 C ATOM 0 H VAL A 121 1.044 -13.648 1.065 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.311 -14.225 2.699 1.00 0.00 H new ATOM 0 HB VAL A 121 -2.224 -12.071 2.417 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.742 -10.645 3.723 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.872 -12.299 4.366 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.581 -11.807 3.465 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.034 -10.205 1.368 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.241 -11.333 0.848 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -1.417 -11.515 0.226 1.00 0.00 H new ATOM 1932 N ASP A 122 -2.714 -13.862 0.472 1.00 0.00 N ATOM 1933 CA ASP A 122 -3.448 -14.146 -0.724 1.00 0.00 C ATOM 1934 C ASP A 122 -3.998 -12.858 -1.306 1.00 0.00 C ATOM 1935 O ASP A 122 -4.022 -11.834 -0.629 1.00 0.00 O ATOM 1936 CB ASP A 122 -4.602 -15.036 -0.346 1.00 0.00 C ATOM 1937 CG ASP A 122 -5.637 -14.308 0.513 1.00 0.00 C ATOM 1938 OD1 ASP A 122 -5.330 -14.002 1.710 1.00 0.00 O ATOM 1939 OD2 ASP A 122 -6.729 -14.018 0.009 1.00 0.00 O ATOM 0 H ASP A 122 -3.304 -13.589 1.258 1.00 0.00 H new ATOM 0 HA ASP A 122 -2.802 -14.624 -1.460 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -5.082 -15.410 -1.251 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.227 -15.903 0.197 1.00 0.00 H new ATOM 1944 N PHE A 123 -4.355 -12.883 -2.573 1.00 0.00 N ATOM 1945 CA PHE A 123 -5.047 -11.776 -3.184 1.00 0.00 C ATOM 1946 C PHE A 123 -5.781 -12.250 -4.445 1.00 0.00 C ATOM 1947 O PHE A 123 -5.407 -13.280 -5.058 1.00 0.00 O ATOM 1948 CB PHE A 123 -4.090 -10.597 -3.471 1.00 0.00 C ATOM 1949 CG PHE A 123 -4.774 -9.331 -3.917 1.00 0.00 C ATOM 1950 CD1 PHE A 123 -5.708 -8.687 -3.092 1.00 0.00 C ATOM 1951 CD2 PHE A 123 -4.501 -8.790 -5.160 1.00 0.00 C ATOM 1952 CE1 PHE A 123 -6.335 -7.537 -3.517 1.00 0.00 C ATOM 1953 CE2 PHE A 123 -5.132 -7.639 -5.581 1.00 0.00 C ATOM 1954 CZ PHE A 123 -6.048 -7.017 -4.762 1.00 0.00 C ATOM 0 H PHE A 123 -4.174 -13.666 -3.201 1.00 0.00 H new ATOM 0 HA PHE A 123 -5.792 -11.399 -2.483 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -3.514 -10.386 -2.570 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -3.379 -10.901 -4.240 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -5.937 -9.095 -2.119 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.786 -9.275 -5.808 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -7.050 -7.043 -2.876 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.908 -7.225 -6.553 1.00 0.00 H new ATOM 0 HZ PHE A 123 -6.544 -6.118 -5.096 1.00 0.00 H new ATOM 1964 N MET A 124 -6.802 -11.514 -4.821 1.00 0.00 N ATOM 1965 CA MET A 124 -7.629 -11.795 -5.982 1.00 0.00 C ATOM 1966 C MET A 124 -7.636 -10.488 -6.773 1.00 0.00 C ATOM 1967 O MET A 124 -7.554 -9.433 -6.171 1.00 0.00 O ATOM 1968 CB MET A 124 -9.062 -12.142 -5.518 1.00 0.00 C ATOM 1969 CG MET A 124 -9.923 -13.006 -6.473 1.00 0.00 C ATOM 1970 SD MET A 124 -10.028 -12.406 -8.176 1.00 0.00 S ATOM 1971 CE MET A 124 -11.341 -13.438 -8.822 1.00 0.00 C ATOM 0 H MET A 124 -7.092 -10.677 -4.315 1.00 0.00 H new ATOM 0 HA MET A 124 -7.260 -12.633 -6.573 1.00 0.00 H new ATOM 0 HB2 MET A 124 -8.992 -12.662 -4.562 1.00 0.00 H new ATOM 0 HB3 MET A 124 -9.594 -11.208 -5.335 1.00 0.00 H new ATOM 0 HG2 MET A 124 -9.517 -14.018 -6.486 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.932 -13.072 -6.066 1.00 0.00 H new ATOM 0 HE1 MET A 124 -11.522 -13.185 -9.867 1.00 0.00 H new ATOM 0 HE2 MET A 124 -11.050 -14.486 -8.747 1.00 0.00 H new ATOM 0 HE3 MET A 124 -12.251 -13.272 -8.246 1.00 0.00 H new ATOM 1981 N GLU A 125 -7.739 -10.561 -8.080 1.00 0.00 N ATOM 1982 CA GLU A 125 -7.635 -9.388 -8.955 1.00 0.00 C ATOM 1983 C GLU A 125 -8.794 -8.417 -8.744 1.00 0.00 C ATOM 1984 O GLU A 125 -8.650 -7.204 -8.918 1.00 0.00 O ATOM 1985 CB GLU A 125 -7.589 -9.845 -10.413 1.00 0.00 C ATOM 1986 CG GLU A 125 -6.510 -10.870 -10.654 1.00 0.00 C ATOM 1987 CD GLU A 125 -6.423 -11.369 -12.076 1.00 0.00 C ATOM 1988 OE1 GLU A 125 -7.253 -12.191 -12.480 1.00 0.00 O ATOM 1989 OE2 GLU A 125 -5.416 -11.050 -12.752 1.00 0.00 O ATOM 0 H GLU A 125 -7.898 -11.435 -8.581 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.717 -8.857 -8.703 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.556 -10.265 -10.691 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -7.419 -8.982 -11.057 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -5.549 -10.439 -10.375 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -6.681 -11.721 -9.994 1.00 0.00 H new ATOM 1996 N THR A 126 -9.934 -8.951 -8.407 1.00 0.00 N ATOM 1997 CA THR A 126 -11.128 -8.186 -8.158 1.00 0.00 C ATOM 1998 C THR A 126 -11.942 -9.005 -7.145 1.00 0.00 C ATOM 1999 O THR A 126 -11.467 -10.062 -6.722 1.00 0.00 O ATOM 2000 CB THR A 126 -11.917 -7.974 -9.508 1.00 0.00 C ATOM 2001 OG1 THR A 126 -11.002 -7.506 -10.518 1.00 0.00 O ATOM 2002 CG2 THR A 126 -13.021 -6.922 -9.376 1.00 0.00 C ATOM 0 H THR A 126 -10.064 -9.956 -8.294 1.00 0.00 H new ATOM 0 HA THR A 126 -10.914 -7.193 -7.764 1.00 0.00 H new ATOM 0 HB THR A 126 -12.368 -8.931 -9.771 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.485 -7.373 -11.361 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.535 -6.812 -10.331 1.00 0.00 H new ATOM 0 HG22 THR A 126 -13.734 -7.237 -8.614 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.581 -5.967 -9.089 1.00 0.00 H new ATOM 2010 N GLU A 127 -13.071 -8.513 -6.717 1.00 0.00 N ATOM 2011 CA GLU A 127 -13.935 -9.250 -5.844 1.00 0.00 C ATOM 2012 C GLU A 127 -14.771 -10.218 -6.682 1.00 0.00 C ATOM 2013 O GLU A 127 -14.436 -11.420 -6.724 1.00 0.00 O ATOM 2014 CB GLU A 127 -14.855 -8.304 -5.043 1.00 0.00 C ATOM 2015 CG GLU A 127 -14.162 -7.376 -4.025 1.00 0.00 C ATOM 2016 CD GLU A 127 -13.252 -6.310 -4.627 1.00 0.00 C ATOM 2017 OE1 GLU A 127 -13.761 -5.352 -5.250 1.00 0.00 O ATOM 2018 OE2 GLU A 127 -12.033 -6.331 -4.368 1.00 0.00 O ATOM 0 H GLU A 127 -13.417 -7.586 -6.966 1.00 0.00 H new ATOM 0 HA GLU A 127 -13.329 -9.805 -5.127 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -15.407 -7.685 -5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -15.588 -8.910 -4.510 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -14.929 -6.881 -3.429 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -13.574 -7.989 -3.342 1.00 0.00 H new TER 2025 GLU A 127