USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=34 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 28 TYR OH : rot -90:sc= 0.711 USER MOD Set 1.2: A 47 SER OG : rot -76:sc= 2.18 USER MOD Set 2.1: A 35 ASN : amide:sc= -5.09! C(o=-5.2!,f=-11!) USER MOD Set 2.2: A 89 LYS NZ :NH3+ -141:sc= -0.134 (180deg=0) USER MOD Single : A 12 SER OG : rot 25:sc= 0.451 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -1.08 K(o=-1.1,f=-1.8) USER MOD Single : A 21 MET CE :methyl -121:sc= -2.37! (180deg=-6.23!) USER MOD Single : A 30 THR OG1 : rot -170:sc= 0.0449 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc=-0.00988 X(o=-0.0099,f=0) USER MOD Single : A 34 THR OG1 : rot 82:sc= 1.15 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0539) USER MOD Single : A 44 TYR OH : rot 25:sc= 1.33 USER MOD Single : A 48 SER OG : rot 97:sc= -0.398 USER MOD Single : A 52 THR OG1 : rot 23:sc= -0.81 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot -160:sc= -0.866 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.455 X(o=-0.45,f=-0.053) USER MOD Single : A 63 LYS NZ :NH3+ -138:sc= 1.19 (180deg=0.922) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot 180:sc= -0.16 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -130:sc= -0.113 (180deg=-0.667) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.06 X(o=-1.1,f=-0.59) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.21) USER MOD Single : A 100 MET CE :methyl 146:sc= -4.98! (180deg=-6.81!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0.257 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 163:sc= -0.789 (180deg=-2!) USER MOD Single : A 112 THR OG1 : rot -59:sc= 1.22 USER MOD Single : A 113 MET CE :methyl 139:sc= -2.98 (180deg=-4.72!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -1.52 K(o=-1.5,f=-0.96) USER MOD Single : A 122 THR OG1 : rot 180:sc=-0.00163 USER MOD Single : A 123 THR OG1 : rot 53:sc= 0.114 USER MOD Single : A 127 LYS NZ :NH3+ -167:sc= -0.062 (180deg=-0.364) USER MOD Single : A 132 ASN : amide:sc= -0.154 X(o=-0.15,f=-0.16) USER MOD Single : A 134 THR OG1 : rot -55:sc= 1.09 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0568 USER MOD Single : A 139 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0132) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 0.444 -6.577 -1.056 1.00 54.02 N ATOM 2 CA SER A 12 0.908 -5.240 -0.704 1.00 62.41 C ATOM 3 C SER A 12 1.552 -5.236 0.679 1.00 43.01 C ATOM 4 O SER A 12 0.966 -4.754 1.647 1.00 4.04 O ATOM 5 CB SER A 12 -0.255 -4.247 -0.741 1.00 21.13 C ATOM 6 OG SER A 12 -1.150 -4.548 -1.798 1.00 24.25 O ATOM 0 HA SER A 12 1.657 -4.937 -1.436 1.00 62.41 H new ATOM 0 HB2 SER A 12 -0.788 -4.271 0.209 1.00 21.13 H new ATOM 0 HB3 SER A 12 0.131 -3.235 -0.864 1.00 21.13 H new ATOM 0 HG SER A 12 -1.078 -5.498 -2.027 1.00 24.25 H new ATOM 12 N GLY A 13 2.764 -5.777 0.763 1.00 71.45 N ATOM 13 CA GLY A 13 3.469 -5.826 2.030 1.00 34.42 C ATOM 14 C GLY A 13 4.782 -6.578 1.935 1.00 75.01 C ATOM 15 O GLY A 13 5.851 -5.970 1.884 1.00 45.12 O ATOM 0 H GLY A 13 3.270 -6.182 -0.025 1.00 71.45 H new ATOM 0 HA2 GLY A 13 3.660 -4.810 2.375 1.00 34.42 H new ATOM 0 HA3 GLY A 13 2.834 -6.303 2.777 1.00 34.42 H new ATOM 19 N LEU A 14 4.702 -7.904 1.913 1.00 51.14 N ATOM 20 CA LEU A 14 5.894 -8.741 1.825 1.00 52.54 C ATOM 21 C LEU A 14 5.905 -9.537 0.524 1.00 44.44 C ATOM 22 O LEU A 14 5.409 -10.662 0.467 1.00 12.33 O ATOM 23 CB LEU A 14 5.961 -9.693 3.019 1.00 24.34 C ATOM 24 CG LEU A 14 6.945 -9.313 4.127 1.00 52.53 C ATOM 25 CD1 LEU A 14 8.376 -9.380 3.616 1.00 13.50 C ATOM 26 CD2 LEU A 14 6.632 -7.923 4.663 1.00 65.02 C ATOM 0 H LEU A 14 3.825 -8.423 1.955 1.00 51.14 H new ATOM 0 HA LEU A 14 6.768 -8.089 1.838 1.00 52.54 H new ATOM 0 HB2 LEU A 14 4.965 -9.767 3.455 1.00 24.34 H new ATOM 0 HB3 LEU A 14 6.223 -10.685 2.652 1.00 24.34 H new ATOM 0 HG LEU A 14 6.839 -10.028 4.943 1.00 52.53 H new ATOM 0 HD11 LEU A 14 9.062 -9.106 4.418 1.00 13.50 H new ATOM 0 HD12 LEU A 14 8.596 -10.394 3.281 1.00 13.50 H new ATOM 0 HD13 LEU A 14 8.498 -8.688 2.783 1.00 13.50 H new ATOM 0 HD21 LEU A 14 7.341 -7.668 5.450 1.00 65.02 H new ATOM 0 HD22 LEU A 14 6.710 -7.195 3.855 1.00 65.02 H new ATOM 0 HD23 LEU A 14 5.620 -7.908 5.068 1.00 65.02 H new ATOM 38 N VAL A 15 6.478 -8.946 -0.521 1.00 13.23 N ATOM 39 CA VAL A 15 6.557 -9.601 -1.821 1.00 5.22 C ATOM 40 C VAL A 15 7.143 -11.003 -1.695 1.00 15.03 C ATOM 41 O VAL A 15 8.151 -11.224 -1.024 1.00 11.23 O ATOM 42 CB VAL A 15 7.414 -8.786 -2.808 1.00 72.02 C ATOM 43 CG1 VAL A 15 7.545 -9.521 -4.134 1.00 3.34 C ATOM 44 CG2 VAL A 15 6.817 -7.402 -3.013 1.00 45.34 C ATOM 0 H VAL A 15 6.894 -8.015 -0.492 1.00 13.23 H new ATOM 0 HA VAL A 15 5.539 -9.669 -2.204 1.00 5.22 H new ATOM 0 HB VAL A 15 8.412 -8.668 -2.385 1.00 72.02 H new ATOM 0 HG11 VAL A 15 8.154 -8.930 -4.819 1.00 3.34 H new ATOM 0 HG12 VAL A 15 8.020 -10.488 -3.969 1.00 3.34 H new ATOM 0 HG13 VAL A 15 6.556 -9.672 -4.566 1.00 3.34 H new ATOM 0 HG21 VAL A 15 7.435 -6.839 -3.713 1.00 45.34 H new ATOM 0 HG22 VAL A 15 5.808 -7.497 -3.414 1.00 45.34 H new ATOM 0 HG23 VAL A 15 6.780 -6.877 -2.059 1.00 45.34 H new ATOM 54 N PRO A 16 6.496 -11.975 -2.355 1.00 65.33 N ATOM 55 CA PRO A 16 6.936 -13.374 -2.334 1.00 15.33 C ATOM 56 C PRO A 16 8.238 -13.584 -3.099 1.00 34.42 C ATOM 57 O PRO A 16 8.615 -12.766 -3.938 1.00 20.14 O ATOM 58 CB PRO A 16 5.786 -14.117 -3.019 1.00 43.12 C ATOM 59 CG PRO A 16 5.144 -13.097 -3.894 1.00 51.42 C ATOM 60 CD PRO A 16 5.288 -11.784 -3.175 1.00 30.13 C ATOM 0 HA PRO A 16 7.143 -13.721 -1.322 1.00 15.33 H new ATOM 0 HB2 PRO A 16 6.152 -14.963 -3.600 1.00 43.12 H new ATOM 0 HB3 PRO A 16 5.080 -14.513 -2.289 1.00 43.12 H new ATOM 0 HG2 PRO A 16 5.626 -13.062 -4.871 1.00 51.42 H new ATOM 0 HG3 PRO A 16 4.094 -13.335 -4.065 1.00 51.42 H new ATOM 0 HD2 PRO A 16 5.403 -10.954 -3.873 1.00 30.13 H new ATOM 0 HD3 PRO A 16 4.415 -11.565 -2.560 1.00 30.13 H new ATOM 68 N ARG A 17 8.920 -14.686 -2.804 1.00 72.35 N ATOM 69 CA ARG A 17 10.180 -15.004 -3.465 1.00 4.34 C ATOM 70 C ARG A 17 10.747 -16.323 -2.949 1.00 3.05 C ATOM 71 O ARG A 17 10.262 -16.876 -1.963 1.00 13.35 O ATOM 72 CB ARG A 17 11.194 -13.879 -3.243 1.00 72.41 C ATOM 73 CG ARG A 17 11.451 -13.039 -4.483 1.00 5.31 C ATOM 74 CD ARG A 17 12.755 -13.431 -5.161 1.00 72.01 C ATOM 75 NE ARG A 17 12.590 -13.612 -6.601 1.00 33.32 N ATOM 76 CZ ARG A 17 12.444 -12.607 -7.456 1.00 53.42 C ATOM 77 NH1 ARG A 17 12.443 -11.355 -7.019 1.00 13.10 N ATOM 78 NH2 ARG A 17 12.299 -12.852 -8.752 1.00 73.01 N ATOM 0 H ARG A 17 8.621 -15.373 -2.112 1.00 72.35 H new ATOM 0 HA ARG A 17 9.986 -15.105 -4.533 1.00 4.34 H new ATOM 0 HB2 ARG A 17 10.836 -13.231 -2.443 1.00 72.41 H new ATOM 0 HB3 ARG A 17 12.136 -14.311 -2.905 1.00 72.41 H new ATOM 0 HG2 ARG A 17 10.625 -13.160 -5.183 1.00 5.31 H new ATOM 0 HG3 ARG A 17 11.485 -11.985 -4.209 1.00 5.31 H new ATOM 0 HD2 ARG A 17 13.505 -12.662 -4.976 1.00 72.01 H new ATOM 0 HD3 ARG A 17 13.130 -14.355 -4.720 1.00 72.01 H new ATOM 0 HE ARG A 17 12.587 -14.563 -6.970 1.00 33.32 H new ATOM 0 HH11 ARG A 17 12.555 -11.162 -6.024 1.00 13.10 H new ATOM 0 HH12 ARG A 17 12.331 -10.585 -7.678 1.00 13.10 H new ATOM 0 HH21 ARG A 17 12.300 -13.814 -9.092 1.00 73.01 H new ATOM 0 HH22 ARG A 17 12.187 -12.079 -9.408 1.00 73.01 H new ATOM 92 N GLY A 18 11.779 -16.823 -3.623 1.00 55.42 N ATOM 93 CA GLY A 18 12.394 -18.073 -3.219 1.00 0.05 C ATOM 94 C GLY A 18 13.054 -17.981 -1.857 1.00 14.51 C ATOM 95 O GLY A 18 14.216 -17.592 -1.748 1.00 44.20 O ATOM 0 H GLY A 18 12.200 -16.384 -4.442 1.00 55.42 H new ATOM 0 HA2 GLY A 18 11.637 -18.857 -3.200 1.00 0.05 H new ATOM 0 HA3 GLY A 18 13.138 -18.365 -3.961 1.00 0.05 H new ATOM 99 N SER A 19 12.309 -18.337 -0.815 1.00 62.10 N ATOM 100 CA SER A 19 12.827 -18.287 0.547 1.00 20.32 C ATOM 101 C SER A 19 13.045 -16.845 0.993 1.00 44.41 C ATOM 102 O SER A 19 12.253 -16.292 1.757 1.00 41.14 O ATOM 103 CB SER A 19 14.139 -19.068 0.645 1.00 3.44 C ATOM 104 OG SER A 19 13.980 -20.236 1.431 1.00 23.20 O ATOM 0 H SER A 19 11.345 -18.663 -0.888 1.00 62.10 H new ATOM 0 HA SER A 19 12.090 -18.745 1.207 1.00 20.32 H new ATOM 0 HB2 SER A 19 14.478 -19.342 -0.354 1.00 3.44 H new ATOM 0 HB3 SER A 19 14.911 -18.435 1.082 1.00 3.44 H new ATOM 0 HG SER A 19 14.832 -20.718 1.477 1.00 23.20 H new ATOM 110 N HIS A 20 14.126 -16.240 0.510 1.00 3.12 N ATOM 111 CA HIS A 20 14.450 -14.861 0.858 1.00 41.23 C ATOM 112 C HIS A 20 13.415 -13.898 0.283 1.00 21.41 C ATOM 113 O HIS A 20 13.579 -13.383 -0.822 1.00 62.24 O ATOM 114 CB HIS A 20 15.843 -14.497 0.343 1.00 2.34 C ATOM 115 CG HIS A 20 16.093 -14.930 -1.068 1.00 73.43 C ATOM 116 ND1 HIS A 20 16.660 -16.145 -1.394 1.00 14.54 N ATOM 117 CD2 HIS A 20 15.847 -14.305 -2.243 1.00 44.42 C ATOM 118 CE1 HIS A 20 16.754 -16.246 -2.707 1.00 72.14 C ATOM 119 NE2 HIS A 20 16.267 -15.143 -3.247 1.00 3.25 N ATOM 0 H HIS A 20 14.792 -16.683 -0.123 1.00 3.12 H new ATOM 0 HA HIS A 20 14.438 -14.774 1.944 1.00 41.23 H new ATOM 0 HB2 HIS A 20 15.976 -13.417 0.412 1.00 2.34 H new ATOM 0 HB3 HIS A 20 16.591 -14.952 0.992 1.00 2.34 H new ATOM 0 HD2 HIS A 20 15.403 -13.329 -2.368 1.00 44.42 H new ATOM 0 HE1 HIS A 20 17.160 -17.088 -3.248 1.00 72.14 H new ATOM 0 HE2 HIS A 20 16.212 -14.946 -4.246 1.00 3.25 H new ATOM 127 N MET A 21 12.349 -13.662 1.041 1.00 44.41 N ATOM 128 CA MET A 21 11.288 -12.761 0.606 1.00 1.34 C ATOM 129 C MET A 21 11.843 -11.373 0.304 1.00 43.51 C ATOM 130 O MET A 21 13.048 -11.139 0.404 1.00 30.44 O ATOM 131 CB MET A 21 10.200 -12.665 1.678 1.00 63.31 C ATOM 132 CG MET A 21 10.742 -12.388 3.071 1.00 60.11 C ATOM 133 SD MET A 21 10.253 -13.644 4.269 1.00 51.31 S ATOM 134 CE MET A 21 11.734 -14.649 4.330 1.00 3.41 C ATOM 0 H MET A 21 12.197 -14.082 1.958 1.00 44.41 H new ATOM 0 HA MET A 21 10.854 -13.166 -0.308 1.00 1.34 H new ATOM 0 HB2 MET A 21 9.501 -11.874 1.405 1.00 63.31 H new ATOM 0 HB3 MET A 21 9.635 -13.597 1.695 1.00 63.31 H new ATOM 0 HG2 MET A 21 11.830 -12.335 3.029 1.00 60.11 H new ATOM 0 HG3 MET A 21 10.388 -11.413 3.407 1.00 60.11 H new ATOM 0 HE1 MET A 21 11.491 -15.672 4.044 1.00 3.41 H new ATOM 0 HE2 MET A 21 12.476 -14.246 3.641 1.00 3.41 H new ATOM 0 HE3 MET A 21 12.137 -14.641 5.343 1.00 3.41 H new ATOM 144 N VAL A 22 10.957 -10.454 -0.067 1.00 45.53 N ATOM 145 CA VAL A 22 11.359 -9.088 -0.384 1.00 22.24 C ATOM 146 C VAL A 22 10.267 -8.093 -0.008 1.00 2.12 C ATOM 147 O VAL A 22 9.093 -8.451 0.089 1.00 63.04 O ATOM 148 CB VAL A 22 11.688 -8.932 -1.880 1.00 74.34 C ATOM 149 CG1 VAL A 22 12.295 -7.565 -2.154 1.00 64.03 C ATOM 150 CG2 VAL A 22 12.622 -10.042 -2.339 1.00 0.33 C ATOM 0 H VAL A 22 9.956 -10.630 -0.155 1.00 45.53 H new ATOM 0 HA VAL A 22 12.255 -8.878 0.200 1.00 22.24 H new ATOM 0 HB VAL A 22 10.761 -9.011 -2.448 1.00 74.34 H new ATOM 0 HG11 VAL A 22 12.521 -7.473 -3.216 1.00 64.03 H new ATOM 0 HG12 VAL A 22 11.587 -6.788 -1.865 1.00 64.03 H new ATOM 0 HG13 VAL A 22 13.213 -7.452 -1.577 1.00 64.03 H new ATOM 0 HG21 VAL A 22 12.844 -9.916 -3.399 1.00 0.33 H new ATOM 0 HG22 VAL A 22 13.549 -9.998 -1.767 1.00 0.33 H new ATOM 0 HG23 VAL A 22 12.144 -11.009 -2.181 1.00 0.33 H new ATOM 160 N ARG A 23 10.662 -6.841 0.203 1.00 71.50 N ATOM 161 CA ARG A 23 9.717 -5.794 0.569 1.00 14.31 C ATOM 162 C ARG A 23 10.163 -4.442 0.019 1.00 23.23 C ATOM 163 O ARG A 23 11.356 -4.141 -0.022 1.00 23.23 O ATOM 164 CB ARG A 23 9.573 -5.715 2.090 1.00 23.41 C ATOM 165 CG ARG A 23 10.731 -5.009 2.775 1.00 3.34 C ATOM 166 CD ARG A 23 11.171 -5.748 4.030 1.00 43.35 C ATOM 167 NE ARG A 23 11.413 -4.837 5.145 1.00 13.23 N ATOM 168 CZ ARG A 23 11.777 -5.240 6.357 1.00 2.14 C ATOM 169 NH1 ARG A 23 11.942 -6.531 6.609 1.00 72.34 N ATOM 170 NH2 ARG A 23 11.978 -4.350 7.321 1.00 22.32 N ATOM 0 H ARG A 23 11.630 -6.528 0.127 1.00 71.50 H new ATOM 0 HA ARG A 23 8.750 -6.044 0.132 1.00 14.31 H new ATOM 0 HB2 ARG A 23 8.647 -5.194 2.332 1.00 23.41 H new ATOM 0 HB3 ARG A 23 9.486 -6.725 2.491 1.00 23.41 H new ATOM 0 HG2 ARG A 23 11.571 -4.931 2.084 1.00 3.34 H new ATOM 0 HG3 ARG A 23 10.436 -3.992 3.035 1.00 3.34 H new ATOM 0 HD2 ARG A 23 10.406 -6.471 4.312 1.00 43.35 H new ATOM 0 HD3 ARG A 23 12.080 -6.312 3.819 1.00 43.35 H new ATOM 0 HE ARG A 23 11.296 -3.837 4.984 1.00 13.23 H new ATOM 0 HH11 ARG A 23 11.789 -7.218 5.871 1.00 72.34 H new ATOM 0 HH12 ARG A 23 12.222 -6.837 7.541 1.00 72.34 H new ATOM 0 HH21 ARG A 23 11.853 -3.356 7.131 1.00 22.32 H new ATOM 0 HH22 ARG A 23 12.258 -4.660 8.252 1.00 22.32 H new ATOM 184 N ARG A 24 9.198 -3.632 -0.403 1.00 34.45 N ATOM 185 CA ARG A 24 9.491 -2.314 -0.951 1.00 64.14 C ATOM 186 C ARG A 24 9.826 -1.324 0.161 1.00 63.53 C ATOM 187 O ARG A 24 9.008 -0.478 0.519 1.00 31.34 O ATOM 188 CB ARG A 24 8.302 -1.800 -1.765 1.00 20.22 C ATOM 189 CG ARG A 24 7.601 -2.883 -2.570 1.00 4.44 C ATOM 190 CD ARG A 24 7.265 -2.404 -3.973 1.00 44.33 C ATOM 191 NE ARG A 24 6.253 -3.242 -4.610 1.00 15.44 N ATOM 192 CZ ARG A 24 4.948 -3.110 -4.394 1.00 44.11 C ATOM 193 NH1 ARG A 24 4.501 -2.179 -3.563 1.00 42.41 N ATOM 194 NH2 ARG A 24 4.089 -3.911 -5.011 1.00 14.42 N ATOM 0 H ARG A 24 8.206 -3.866 -0.376 1.00 34.45 H new ATOM 0 HA ARG A 24 10.358 -2.406 -1.605 1.00 64.14 H new ATOM 0 HB2 ARG A 24 7.582 -1.338 -1.089 1.00 20.22 H new ATOM 0 HB3 ARG A 24 8.647 -1.020 -2.444 1.00 20.22 H new ATOM 0 HG2 ARG A 24 8.239 -3.765 -2.628 1.00 4.44 H new ATOM 0 HG3 ARG A 24 6.687 -3.184 -2.058 1.00 4.44 H new ATOM 0 HD2 ARG A 24 6.908 -1.375 -3.929 1.00 44.33 H new ATOM 0 HD3 ARG A 24 8.169 -2.402 -4.582 1.00 44.33 H new ATOM 0 HE ARG A 24 6.564 -3.968 -5.256 1.00 15.44 H new ATOM 0 HH11 ARG A 24 5.159 -1.562 -3.087 1.00 42.41 H new ATOM 0 HH12 ARG A 24 3.499 -2.080 -3.399 1.00 42.41 H new ATOM 0 HH21 ARG A 24 4.430 -4.628 -5.651 1.00 14.42 H new ATOM 0 HH22 ARG A 24 3.088 -3.810 -4.845 1.00 14.42 H new ATOM 208 N ALA A 25 11.035 -1.438 0.702 1.00 14.24 N ATOM 209 CA ALA A 25 11.478 -0.553 1.772 1.00 2.42 C ATOM 210 C ALA A 25 12.269 0.627 1.216 1.00 13.03 C ATOM 211 O ALA A 25 12.298 0.852 0.006 1.00 20.33 O ATOM 212 CB ALA A 25 12.316 -1.323 2.781 1.00 22.45 C ATOM 0 H ALA A 25 11.724 -2.134 0.417 1.00 14.24 H new ATOM 0 HA ALA A 25 10.594 -0.160 2.275 1.00 2.42 H new ATOM 0 HB1 ALA A 25 12.640 -0.649 3.574 1.00 22.45 H new ATOM 0 HB2 ALA A 25 11.720 -2.129 3.210 1.00 22.45 H new ATOM 0 HB3 ALA A 25 13.190 -1.744 2.283 1.00 22.45 H new ATOM 218 N ARG A 26 12.908 1.378 2.108 1.00 74.24 N ATOM 219 CA ARG A 26 13.697 2.536 1.706 1.00 72.24 C ATOM 220 C ARG A 26 15.062 2.106 1.177 1.00 3.21 C ATOM 221 O ARG A 26 15.381 0.917 1.145 1.00 44.45 O ATOM 222 CB ARG A 26 13.873 3.494 2.885 1.00 30.01 C ATOM 223 CG ARG A 26 13.817 4.961 2.492 1.00 41.04 C ATOM 224 CD ARG A 26 12.882 5.746 3.398 1.00 32.32 C ATOM 225 NE ARG A 26 11.489 5.638 2.973 1.00 71.42 N ATOM 226 CZ ARG A 26 11.011 6.206 1.872 1.00 54.14 C ATOM 227 NH1 ARG A 26 11.809 6.918 1.089 1.00 41.43 N ATOM 228 NH2 ARG A 26 9.731 6.062 1.551 1.00 30.02 N ATOM 0 H ARG A 26 12.894 1.205 3.113 1.00 74.24 H new ATOM 0 HA ARG A 26 13.162 3.049 0.907 1.00 72.24 H new ATOM 0 HB2 ARG A 26 13.096 3.295 3.623 1.00 30.01 H new ATOM 0 HB3 ARG A 26 14.830 3.292 3.367 1.00 30.01 H new ATOM 0 HG2 ARG A 26 14.818 5.390 2.541 1.00 41.04 H new ATOM 0 HG3 ARG A 26 13.483 5.049 1.458 1.00 41.04 H new ATOM 0 HD2 ARG A 26 12.978 5.382 4.421 1.00 32.32 H new ATOM 0 HD3 ARG A 26 13.179 6.795 3.404 1.00 32.32 H new ATOM 0 HE ARG A 26 10.848 5.097 3.554 1.00 71.42 H new ATOM 0 HH11 ARG A 26 12.793 7.031 1.331 1.00 41.43 H new ATOM 0 HH12 ARG A 26 11.439 7.353 0.244 1.00 41.43 H new ATOM 0 HH21 ARG A 26 9.113 5.515 2.150 1.00 30.02 H new ATOM 0 HH22 ARG A 26 9.365 6.499 0.705 1.00 30.02 H new ATOM 242 N CYS A 27 15.864 3.082 0.763 1.00 24.54 N ATOM 243 CA CYS A 27 17.195 2.806 0.235 1.00 30.23 C ATOM 244 C CYS A 27 18.038 4.077 0.193 1.00 12.25 C ATOM 245 O CYS A 27 17.654 5.069 -0.427 1.00 61.11 O ATOM 246 CB CYS A 27 17.095 2.201 -1.166 1.00 72.24 C ATOM 247 SG CYS A 27 18.161 0.746 -1.426 1.00 54.54 S ATOM 0 H CYS A 27 15.615 4.071 0.783 1.00 24.54 H new ATOM 0 HA CYS A 27 17.681 2.091 0.899 1.00 30.23 H new ATOM 0 HB2 CYS A 27 16.060 1.918 -1.355 1.00 72.24 H new ATOM 0 HB3 CYS A 27 17.355 2.964 -1.899 1.00 72.24 H new ATOM 252 N TYR A 28 19.188 4.040 0.858 1.00 74.14 N ATOM 253 CA TYR A 28 20.084 5.189 0.899 1.00 42.05 C ATOM 254 C TYR A 28 21.522 4.769 0.607 1.00 54.22 C ATOM 255 O TYR A 28 21.933 3.641 0.877 1.00 21.32 O ATOM 256 CB TYR A 28 20.008 5.873 2.264 1.00 2.34 C ATOM 257 CG TYR A 28 20.504 5.010 3.402 1.00 4.35 C ATOM 258 CD1 TYR A 28 21.864 4.877 3.657 1.00 31.40 C ATOM 259 CD2 TYR A 28 19.614 4.328 4.222 1.00 23.14 C ATOM 260 CE1 TYR A 28 22.322 4.089 4.695 1.00 21.32 C ATOM 261 CE2 TYR A 28 20.063 3.539 5.264 1.00 44.13 C ATOM 262 CZ TYR A 28 21.418 3.422 5.496 1.00 50.40 C ATOM 263 OH TYR A 28 21.869 2.636 6.531 1.00 4.43 O ATOM 0 H TYR A 28 19.521 3.227 1.376 1.00 74.14 H new ATOM 0 HA TYR A 28 19.767 5.893 0.130 1.00 42.05 H new ATOM 0 HB2 TYR A 28 20.594 6.792 2.234 1.00 2.34 H new ATOM 0 HB3 TYR A 28 18.975 6.160 2.460 1.00 2.34 H new ATOM 0 HD1 TYR A 28 22.575 5.399 3.033 1.00 31.40 H new ATOM 0 HD2 TYR A 28 18.553 4.416 4.042 1.00 23.14 H new ATOM 0 HE1 TYR A 28 23.382 3.995 4.879 1.00 21.32 H new ATOM 0 HE2 TYR A 28 19.357 3.017 5.893 1.00 44.13 H new ATOM 0 HH TYR A 28 22.016 1.723 6.208 1.00 4.43 H new ATOM 273 N PRO A 29 22.305 5.699 0.042 1.00 44.44 N ATOM 274 CA PRO A 29 23.709 5.451 -0.299 1.00 4.03 C ATOM 275 C PRO A 29 24.591 5.319 0.938 1.00 1.14 C ATOM 276 O PRO A 29 24.701 6.249 1.738 1.00 12.21 O ATOM 277 CB PRO A 29 24.103 6.690 -1.106 1.00 43.23 C ATOM 278 CG PRO A 29 23.175 7.758 -0.639 1.00 74.55 C ATOM 279 CD PRO A 29 21.881 7.065 -0.308 1.00 44.54 C ATOM 0 HA PRO A 29 23.837 4.514 -0.841 1.00 4.03 H new ATOM 0 HB2 PRO A 29 25.143 6.964 -0.928 1.00 43.23 H new ATOM 0 HB3 PRO A 29 23.998 6.515 -2.177 1.00 43.23 H new ATOM 0 HG2 PRO A 29 23.578 8.271 0.234 1.00 74.55 H new ATOM 0 HG3 PRO A 29 23.027 8.512 -1.412 1.00 74.55 H new ATOM 0 HD2 PRO A 29 21.366 7.551 0.521 1.00 44.54 H new ATOM 0 HD3 PRO A 29 21.195 7.068 -1.155 1.00 44.54 H new ATOM 287 N THR A 30 25.219 4.157 1.091 1.00 45.43 N ATOM 288 CA THR A 30 26.091 3.904 2.231 1.00 61.42 C ATOM 289 C THR A 30 27.426 4.622 2.072 1.00 25.45 C ATOM 290 O THR A 30 27.707 5.593 2.775 1.00 71.13 O ATOM 291 CB THR A 30 26.350 2.396 2.415 1.00 2.43 C ATOM 292 OG1 THR A 30 25.303 1.640 1.798 1.00 51.12 O ATOM 293 CG2 THR A 30 26.438 2.039 3.891 1.00 1.24 C ATOM 0 H THR A 30 25.140 3.376 0.439 1.00 45.43 H new ATOM 0 HA THR A 30 25.579 4.288 3.113 1.00 61.42 H new ATOM 0 HB THR A 30 27.301 2.152 1.941 1.00 2.43 H new ATOM 0 HG1 THR A 30 25.387 0.697 2.052 1.00 51.12 H new ATOM 0 HG21 THR A 30 26.621 0.970 3.996 1.00 1.24 H new ATOM 0 HG22 THR A 30 27.255 2.594 4.352 1.00 1.24 H new ATOM 0 HG23 THR A 30 25.501 2.297 4.384 1.00 1.24 H new ATOM 301 N SER A 31 28.247 4.138 1.145 1.00 31.13 N ATOM 302 CA SER A 31 29.555 4.732 0.897 1.00 42.20 C ATOM 303 C SER A 31 29.587 5.428 -0.460 1.00 51.24 C ATOM 304 O SER A 31 28.676 5.271 -1.272 1.00 31.10 O ATOM 305 CB SER A 31 30.646 3.661 0.959 1.00 34.02 C ATOM 306 OG SER A 31 31.124 3.496 2.283 1.00 41.52 O ATOM 0 H SER A 31 28.029 3.336 0.554 1.00 31.13 H new ATOM 0 HA SER A 31 29.741 5.475 1.672 1.00 42.20 H new ATOM 0 HB2 SER A 31 30.252 2.714 0.591 1.00 34.02 H new ATOM 0 HB3 SER A 31 31.471 3.939 0.303 1.00 34.02 H new ATOM 0 HG SER A 31 31.819 2.805 2.296 1.00 41.52 H new ATOM 312 N ASN A 32 30.643 6.199 -0.699 1.00 24.53 N ATOM 313 CA ASN A 32 30.795 6.920 -1.957 1.00 70.11 C ATOM 314 C ASN A 32 30.624 5.980 -3.147 1.00 15.31 C ATOM 315 O ASN A 32 29.827 6.242 -4.047 1.00 72.25 O ATOM 316 CB ASN A 32 32.166 7.595 -2.020 1.00 4.31 C ATOM 317 CG ASN A 32 32.066 9.109 -2.017 1.00 23.53 C ATOM 318 OD1 ASN A 32 32.531 9.774 -2.942 1.00 51.41 O ATOM 319 ND2 ASN A 32 31.458 9.659 -0.972 1.00 71.24 N ATOM 0 H ASN A 32 31.406 6.340 -0.037 1.00 24.53 H new ATOM 0 HA ASN A 32 30.019 7.684 -2.005 1.00 70.11 H new ATOM 0 HB2 ASN A 32 32.767 7.272 -1.170 1.00 4.31 H new ATOM 0 HB3 ASN A 32 32.687 7.270 -2.920 1.00 4.31 H new ATOM 0 HD21 ASN A 32 31.361 10.673 -0.913 1.00 71.24 H new ATOM 0 HD22 ASN A 32 31.088 9.068 -0.228 1.00 71.24 H new ATOM 326 N ALA A 33 31.377 4.885 -3.142 1.00 54.33 N ATOM 327 CA ALA A 33 31.306 3.905 -4.219 1.00 44.41 C ATOM 328 C ALA A 33 30.426 2.723 -3.829 1.00 11.12 C ATOM 329 O ALA A 33 29.474 2.385 -4.533 1.00 60.42 O ATOM 330 CB ALA A 33 32.702 3.427 -4.589 1.00 64.21 C ATOM 0 H ALA A 33 32.043 4.654 -2.405 1.00 54.33 H new ATOM 0 HA ALA A 33 30.857 4.387 -5.087 1.00 44.41 H new ATOM 0 HB1 ALA A 33 32.635 2.696 -5.394 1.00 64.21 H new ATOM 0 HB2 ALA A 33 33.302 4.275 -4.919 1.00 64.21 H new ATOM 0 HB3 ALA A 33 33.171 2.967 -3.719 1.00 64.21 H new ATOM 336 N THR A 34 30.750 2.096 -2.702 1.00 14.52 N ATOM 337 CA THR A 34 29.989 0.951 -2.219 1.00 24.31 C ATOM 338 C THR A 34 30.344 0.625 -0.773 1.00 5.34 C ATOM 339 O THR A 34 31.481 0.821 -0.344 1.00 32.33 O ATOM 340 CB THR A 34 30.238 -0.296 -3.089 1.00 50.44 C ATOM 341 OG1 THR A 34 29.704 -1.458 -2.445 1.00 51.41 O ATOM 342 CG2 THR A 34 31.725 -0.489 -3.345 1.00 20.52 C ATOM 0 H THR A 34 31.534 2.362 -2.107 1.00 14.52 H new ATOM 0 HA THR A 34 28.935 1.224 -2.279 1.00 24.31 H new ATOM 0 HB THR A 34 29.737 -0.150 -4.046 1.00 50.44 H new ATOM 0 HG1 THR A 34 28.740 -1.512 -2.614 1.00 51.41 H new ATOM 0 HG21 THR A 34 31.876 -1.375 -3.961 1.00 20.52 H new ATOM 0 HG22 THR A 34 32.122 0.385 -3.862 1.00 20.52 H new ATOM 0 HG23 THR A 34 32.244 -0.615 -2.395 1.00 20.52 H new ATOM 350 N ASN A 35 29.365 0.127 -0.025 1.00 53.23 N ATOM 351 CA ASN A 35 29.575 -0.226 1.374 1.00 13.41 C ATOM 352 C ASN A 35 30.614 -1.335 1.505 1.00 11.14 C ATOM 353 O ASN A 35 30.844 -2.100 0.569 1.00 73.55 O ATOM 354 CB ASN A 35 28.257 -0.668 2.014 1.00 51.35 C ATOM 355 CG ASN A 35 28.425 -1.069 3.466 1.00 21.32 C ATOM 356 OD1 ASN A 35 28.361 -2.251 3.807 1.00 53.43 O ATOM 357 ND2 ASN A 35 28.642 -0.085 4.331 1.00 51.23 N ATOM 0 H ASN A 35 28.418 -0.041 -0.365 1.00 53.23 H new ATOM 0 HA ASN A 35 29.945 0.658 1.894 1.00 13.41 H new ATOM 0 HB2 ASN A 35 27.533 0.144 1.946 1.00 51.35 H new ATOM 0 HB3 ASN A 35 27.848 -1.508 1.453 1.00 51.35 H new ATOM 0 HD21 ASN A 35 28.763 -0.294 5.322 1.00 51.23 H new ATOM 0 HD22 ASN A 35 28.687 0.880 4.005 1.00 51.23 H new ATOM 364 N THR A 36 31.240 -1.416 2.675 1.00 21.44 N ATOM 365 CA THR A 36 32.255 -2.431 2.930 1.00 10.11 C ATOM 366 C THR A 36 31.885 -3.288 4.135 1.00 4.03 C ATOM 367 O THR A 36 31.383 -2.782 5.139 1.00 34.11 O ATOM 368 CB THR A 36 33.637 -1.795 3.171 1.00 10.22 C ATOM 369 OG1 THR A 36 33.514 -0.370 3.247 1.00 21.21 O ATOM 370 CG2 THR A 36 34.605 -2.167 2.059 1.00 45.23 C ATOM 0 H THR A 36 31.062 -0.791 3.461 1.00 21.44 H new ATOM 0 HA THR A 36 32.303 -3.060 2.041 1.00 10.11 H new ATOM 0 HB THR A 36 34.028 -2.176 4.114 1.00 10.22 H new ATOM 0 HG1 THR A 36 34.397 0.027 3.402 1.00 21.21 H new ATOM 0 HG21 THR A 36 35.574 -1.706 2.251 1.00 45.23 H new ATOM 0 HG22 THR A 36 34.719 -3.250 2.023 1.00 45.23 H new ATOM 0 HG23 THR A 36 34.217 -1.811 1.105 1.00 45.23 H new ATOM 378 N CYS A 37 32.138 -4.588 4.030 1.00 20.35 N ATOM 379 CA CYS A 37 31.832 -5.517 5.112 1.00 3.10 C ATOM 380 C CYS A 37 33.040 -6.393 5.435 1.00 55.34 C ATOM 381 O CYS A 37 33.455 -7.220 4.623 1.00 74.11 O ATOM 382 CB CYS A 37 30.637 -6.395 4.736 1.00 63.02 C ATOM 383 SG CYS A 37 30.202 -7.638 5.995 1.00 65.05 S ATOM 0 H CYS A 37 32.554 -5.023 3.206 1.00 20.35 H new ATOM 0 HA CYS A 37 31.581 -4.934 5.998 1.00 3.10 H new ATOM 0 HB2 CYS A 37 29.772 -5.756 4.558 1.00 63.02 H new ATOM 0 HB3 CYS A 37 30.855 -6.905 3.798 1.00 63.02 H new ATOM 388 N PHE A 38 33.599 -6.205 6.625 1.00 14.45 N ATOM 389 CA PHE A 38 34.759 -6.976 7.056 1.00 75.41 C ATOM 390 C PHE A 38 35.866 -6.925 6.007 1.00 33.12 C ATOM 391 O PHE A 38 36.570 -7.908 5.784 1.00 63.53 O ATOM 392 CB PHE A 38 34.360 -8.429 7.323 1.00 64.52 C ATOM 393 CG PHE A 38 33.706 -8.636 8.659 1.00 22.00 C ATOM 394 CD1 PHE A 38 33.214 -7.559 9.378 1.00 54.10 C ATOM 395 CD2 PHE A 38 33.584 -9.907 9.196 1.00 24.44 C ATOM 396 CE1 PHE A 38 32.611 -7.746 10.608 1.00 53.53 C ATOM 397 CE2 PHE A 38 32.982 -10.100 10.425 1.00 22.13 C ATOM 398 CZ PHE A 38 32.496 -9.018 11.132 1.00 11.14 C ATOM 0 H PHE A 38 33.267 -5.525 7.309 1.00 14.45 H new ATOM 0 HA PHE A 38 35.136 -6.534 7.978 1.00 75.41 H new ATOM 0 HB2 PHE A 38 33.679 -8.760 6.539 1.00 64.52 H new ATOM 0 HB3 PHE A 38 35.248 -9.058 7.261 1.00 64.52 H new ATOM 0 HD1 PHE A 38 33.302 -6.562 8.973 1.00 54.10 H new ATOM 0 HD2 PHE A 38 33.964 -10.757 8.648 1.00 24.44 H new ATOM 0 HE1 PHE A 38 32.230 -6.898 11.158 1.00 53.53 H new ATOM 0 HE2 PHE A 38 32.892 -11.096 10.832 1.00 22.13 H new ATOM 0 HZ PHE A 38 32.027 -9.167 12.093 1.00 11.14 H new ATOM 408 N GLY A 39 36.012 -5.770 5.366 1.00 40.44 N ATOM 409 CA GLY A 39 37.034 -5.611 4.348 1.00 51.45 C ATOM 410 C GLY A 39 36.518 -5.915 2.955 1.00 15.22 C ATOM 411 O GLY A 39 36.908 -5.265 1.985 1.00 12.14 O ATOM 0 H GLY A 39 35.441 -4.942 5.533 1.00 40.44 H new ATOM 0 HA2 GLY A 39 37.415 -4.590 4.376 1.00 51.45 H new ATOM 0 HA3 GLY A 39 37.872 -6.270 4.573 1.00 51.45 H new ATOM 415 N SER A 40 35.638 -6.907 2.855 1.00 4.34 N ATOM 416 CA SER A 40 35.072 -7.300 1.570 1.00 11.44 C ATOM 417 C SER A 40 33.936 -6.364 1.169 1.00 51.24 C ATOM 418 O SER A 40 32.870 -6.362 1.784 1.00 13.12 O ATOM 419 CB SER A 40 34.563 -8.741 1.633 1.00 54.21 C ATOM 420 OG SER A 40 35.613 -9.640 1.944 1.00 50.13 O ATOM 0 H SER A 40 35.302 -7.453 3.648 1.00 4.34 H new ATOM 0 HA SER A 40 35.858 -7.233 0.818 1.00 11.44 H new ATOM 0 HB2 SER A 40 33.778 -8.820 2.385 1.00 54.21 H new ATOM 0 HB3 SER A 40 34.117 -9.015 0.677 1.00 54.21 H new ATOM 0 HG SER A 40 35.261 -10.554 1.980 1.00 50.13 H new ATOM 426 N LYS A 41 34.172 -5.568 0.131 1.00 63.31 N ATOM 427 CA LYS A 41 33.171 -4.628 -0.356 1.00 55.54 C ATOM 428 C LYS A 41 31.923 -5.362 -0.838 1.00 3.30 C ATOM 429 O LYS A 41 32.015 -6.357 -1.558 1.00 44.10 O ATOM 430 CB LYS A 41 33.747 -3.780 -1.493 1.00 0.02 C ATOM 431 CG LYS A 41 35.043 -3.076 -1.129 1.00 51.13 C ATOM 432 CD LYS A 41 34.904 -1.566 -1.228 1.00 72.01 C ATOM 433 CE LYS A 41 34.817 -1.108 -2.676 1.00 15.11 C ATOM 434 NZ LYS A 41 36.134 -1.194 -3.365 1.00 53.12 N ATOM 0 H LYS A 41 35.049 -5.556 -0.389 1.00 63.31 H new ATOM 0 HA LYS A 41 32.891 -3.975 0.471 1.00 55.54 H new ATOM 0 HB2 LYS A 41 33.921 -4.418 -2.359 1.00 0.02 H new ATOM 0 HB3 LYS A 41 33.009 -3.035 -1.789 1.00 0.02 H new ATOM 0 HG2 LYS A 41 35.334 -3.350 -0.115 1.00 51.13 H new ATOM 0 HG3 LYS A 41 35.840 -3.413 -1.792 1.00 51.13 H new ATOM 0 HD2 LYS A 41 34.012 -1.246 -0.690 1.00 72.01 H new ATOM 0 HD3 LYS A 41 35.757 -1.089 -0.745 1.00 72.01 H new ATOM 0 HE2 LYS A 41 34.088 -1.720 -3.207 1.00 15.11 H new ATOM 0 HE3 LYS A 41 34.455 -0.080 -2.711 1.00 15.11 H new ATOM 0 HZ1 LYS A 41 36.070 -0.734 -4.295 1.00 53.12 H new ATOM 0 HZ2 LYS A 41 36.858 -0.716 -2.791 1.00 53.12 H new ATOM 0 HZ3 LYS A 41 36.396 -2.193 -3.490 1.00 53.12 H new ATOM 448 N LEU A 42 30.758 -4.865 -0.438 1.00 2.43 N ATOM 449 CA LEU A 42 29.492 -5.473 -0.830 1.00 54.30 C ATOM 450 C LEU A 42 29.160 -5.151 -2.284 1.00 24.31 C ATOM 451 O LEU A 42 29.599 -4.143 -2.838 1.00 20.11 O ATOM 452 CB LEU A 42 28.365 -4.984 0.082 1.00 74.13 C ATOM 453 CG LEU A 42 28.480 -5.370 1.557 1.00 53.22 C ATOM 454 CD1 LEU A 42 28.916 -6.820 1.697 1.00 40.11 C ATOM 455 CD2 LEU A 42 29.453 -4.446 2.275 1.00 31.42 C ATOM 0 H LEU A 42 30.664 -4.042 0.158 1.00 2.43 H new ATOM 0 HA LEU A 42 29.590 -6.554 -0.730 1.00 54.30 H new ATOM 0 HB2 LEU A 42 28.316 -3.897 0.014 1.00 74.13 H new ATOM 0 HB3 LEU A 42 27.421 -5.371 -0.302 1.00 74.13 H new ATOM 0 HG LEU A 42 27.499 -5.262 2.019 1.00 53.22 H new ATOM 0 HD11 LEU A 42 28.992 -7.077 2.754 1.00 40.11 H new ATOM 0 HD12 LEU A 42 28.182 -7.468 1.218 1.00 40.11 H new ATOM 0 HD13 LEU A 42 29.886 -6.956 1.220 1.00 40.11 H new ATOM 0 HD21 LEU A 42 29.523 -4.735 3.324 1.00 31.42 H new ATOM 0 HD22 LEU A 42 30.437 -4.522 1.811 1.00 31.42 H new ATOM 0 HD23 LEU A 42 29.098 -3.418 2.205 1.00 31.42 H new ATOM 467 N PRO A 43 28.366 -6.027 -2.918 1.00 11.35 N ATOM 468 CA PRO A 43 27.956 -5.856 -4.314 1.00 74.15 C ATOM 469 C PRO A 43 26.985 -4.694 -4.496 1.00 31.21 C ATOM 470 O PRO A 43 26.647 -4.325 -5.621 1.00 33.03 O ATOM 471 CB PRO A 43 27.269 -7.183 -4.647 1.00 63.22 C ATOM 472 CG PRO A 43 26.795 -7.704 -3.335 1.00 15.34 C ATOM 473 CD PRO A 43 27.806 -7.250 -2.319 1.00 23.12 C ATOM 0 HA PRO A 43 28.802 -5.623 -4.961 1.00 74.15 H new ATOM 0 HB2 PRO A 43 26.439 -7.036 -5.338 1.00 63.22 H new ATOM 0 HB3 PRO A 43 27.961 -7.878 -5.123 1.00 63.22 H new ATOM 0 HG2 PRO A 43 25.803 -7.319 -3.098 1.00 15.34 H new ATOM 0 HG3 PRO A 43 26.719 -8.791 -3.351 1.00 15.34 H new ATOM 0 HD2 PRO A 43 27.343 -7.049 -1.353 1.00 23.12 H new ATOM 0 HD3 PRO A 43 28.575 -8.004 -2.152 1.00 23.12 H new ATOM 481 N TYR A 44 26.541 -4.121 -3.383 1.00 33.42 N ATOM 482 CA TYR A 44 25.607 -3.002 -3.419 1.00 71.13 C ATOM 483 C TYR A 44 26.218 -1.762 -2.775 1.00 10.32 C ATOM 484 O TYR A 44 27.175 -1.856 -2.007 1.00 13.03 O ATOM 485 CB TYR A 44 24.306 -3.373 -2.706 1.00 13.22 C ATOM 486 CG TYR A 44 24.502 -4.310 -1.536 1.00 25.03 C ATOM 487 CD1 TYR A 44 24.874 -3.826 -0.288 1.00 23.45 C ATOM 488 CD2 TYR A 44 24.315 -5.680 -1.679 1.00 4.55 C ATOM 489 CE1 TYR A 44 25.056 -4.679 0.784 1.00 71.31 C ATOM 490 CE2 TYR A 44 24.493 -6.540 -0.612 1.00 43.22 C ATOM 491 CZ TYR A 44 24.864 -6.035 0.617 1.00 41.14 C ATOM 492 OH TYR A 44 25.043 -6.888 1.682 1.00 54.32 O ATOM 0 H TYR A 44 26.813 -4.413 -2.444 1.00 33.42 H new ATOM 0 HA TYR A 44 25.389 -2.777 -4.463 1.00 71.13 H new ATOM 0 HB2 TYR A 44 23.822 -2.462 -2.354 1.00 13.22 H new ATOM 0 HB3 TYR A 44 23.628 -3.837 -3.423 1.00 13.22 H new ATOM 0 HD1 TYR A 44 25.024 -2.765 -0.153 1.00 23.45 H new ATOM 0 HD2 TYR A 44 24.026 -6.079 -2.640 1.00 4.55 H new ATOM 0 HE1 TYR A 44 25.347 -4.286 1.747 1.00 71.31 H new ATOM 0 HE2 TYR A 44 24.342 -7.602 -0.740 1.00 43.22 H new ATOM 0 HH TYR A 44 24.914 -6.397 2.520 1.00 54.32 H new ATOM 502 N GLU A 45 25.657 -0.600 -3.094 1.00 14.43 N ATOM 503 CA GLU A 45 26.146 0.660 -2.546 1.00 50.22 C ATOM 504 C GLU A 45 25.043 1.387 -1.782 1.00 74.43 C ATOM 505 O GLU A 45 25.205 2.540 -1.381 1.00 60.22 O ATOM 506 CB GLU A 45 26.680 1.555 -3.666 1.00 43.32 C ATOM 507 CG GLU A 45 25.589 2.175 -4.523 1.00 2.43 C ATOM 508 CD GLU A 45 25.926 2.155 -6.001 1.00 40.41 C ATOM 509 OE1 GLU A 45 27.016 2.641 -6.368 1.00 41.15 O ATOM 510 OE2 GLU A 45 25.099 1.653 -6.791 1.00 13.34 O ATOM 0 H GLU A 45 24.864 -0.505 -3.729 1.00 14.43 H new ATOM 0 HA GLU A 45 26.956 0.434 -1.852 1.00 50.22 H new ATOM 0 HB2 GLU A 45 27.282 2.351 -3.228 1.00 43.32 H new ATOM 0 HB3 GLU A 45 27.342 0.969 -4.304 1.00 43.32 H new ATOM 0 HG2 GLU A 45 24.655 1.638 -4.360 1.00 2.43 H new ATOM 0 HG3 GLU A 45 25.424 3.205 -4.206 1.00 2.43 H new ATOM 517 N LEU A 46 23.920 0.704 -1.585 1.00 40.11 N ATOM 518 CA LEU A 46 22.788 1.283 -0.870 1.00 2.32 C ATOM 519 C LEU A 46 22.451 0.463 0.372 1.00 43.54 C ATOM 520 O LEU A 46 22.999 -0.619 0.580 1.00 30.02 O ATOM 521 CB LEU A 46 21.567 1.365 -1.788 1.00 23.02 C ATOM 522 CG LEU A 46 21.713 2.257 -3.021 1.00 2.21 C ATOM 523 CD1 LEU A 46 20.549 2.043 -3.976 1.00 30.14 C ATOM 524 CD2 LEU A 46 21.808 3.720 -2.613 1.00 1.14 C ATOM 0 H LEU A 46 23.769 -0.251 -1.910 1.00 40.11 H new ATOM 0 HA LEU A 46 23.065 2.289 -0.554 1.00 2.32 H new ATOM 0 HB2 LEU A 46 21.319 0.357 -2.121 1.00 23.02 H new ATOM 0 HB3 LEU A 46 20.721 1.724 -1.203 1.00 23.02 H new ATOM 0 HG LEU A 46 22.634 1.983 -3.536 1.00 2.21 H new ATOM 0 HD11 LEU A 46 20.670 2.686 -4.847 1.00 30.14 H new ATOM 0 HD12 LEU A 46 20.527 1.001 -4.295 1.00 30.14 H new ATOM 0 HD13 LEU A 46 19.615 2.288 -3.471 1.00 30.14 H new ATOM 0 HD21 LEU A 46 21.912 4.340 -3.503 1.00 1.14 H new ATOM 0 HD22 LEU A 46 20.905 4.007 -2.074 1.00 1.14 H new ATOM 0 HD23 LEU A 46 22.676 3.862 -1.969 1.00 1.14 H new ATOM 536 N SER A 47 21.545 0.986 1.192 1.00 42.13 N ATOM 537 CA SER A 47 21.136 0.303 2.414 1.00 40.45 C ATOM 538 C SER A 47 19.744 0.753 2.847 1.00 2.42 C ATOM 539 O SER A 47 19.294 1.843 2.494 1.00 51.13 O ATOM 540 CB SER A 47 22.143 0.571 3.534 1.00 70.31 C ATOM 541 OG SER A 47 21.501 0.614 4.797 1.00 64.14 O ATOM 0 H SER A 47 21.080 1.880 1.033 1.00 42.13 H new ATOM 0 HA SER A 47 21.106 -0.767 2.211 1.00 40.45 H new ATOM 0 HB2 SER A 47 22.905 -0.208 3.536 1.00 70.31 H new ATOM 0 HB3 SER A 47 22.654 1.516 3.350 1.00 70.31 H new ATOM 0 HG SER A 47 21.026 1.466 4.894 1.00 64.14 H new ATOM 547 N SER A 48 19.068 -0.094 3.616 1.00 72.33 N ATOM 548 CA SER A 48 17.726 0.213 4.095 1.00 15.04 C ATOM 549 C SER A 48 17.663 0.141 5.618 1.00 30.11 C ATOM 550 O SER A 48 17.651 -0.945 6.200 1.00 2.30 O ATOM 551 CB SER A 48 16.709 -0.754 3.486 1.00 62.35 C ATOM 552 OG SER A 48 15.383 -0.371 3.808 1.00 25.42 O ATOM 0 H SER A 48 19.428 -0.998 3.921 1.00 72.33 H new ATOM 0 HA SER A 48 17.481 1.229 3.785 1.00 15.04 H new ATOM 0 HB2 SER A 48 16.830 -0.780 2.403 1.00 62.35 H new ATOM 0 HB3 SER A 48 16.898 -1.763 3.852 1.00 62.35 H new ATOM 0 HG SER A 48 15.002 0.144 3.066 1.00 25.42 H new ATOM 558 N LEU A 49 17.623 1.304 6.258 1.00 41.42 N ATOM 559 CA LEU A 49 17.562 1.375 7.714 1.00 53.34 C ATOM 560 C LEU A 49 16.304 0.691 8.240 1.00 63.44 C ATOM 561 O LEU A 49 16.246 0.284 9.400 1.00 22.12 O ATOM 562 CB LEU A 49 17.593 2.834 8.175 1.00 71.44 C ATOM 563 CG LEU A 49 18.305 3.103 9.500 1.00 3.35 C ATOM 564 CD1 LEU A 49 17.491 2.559 10.664 1.00 24.01 C ATOM 565 CD2 LEU A 49 19.699 2.493 9.491 1.00 43.13 C ATOM 0 H LEU A 49 17.632 2.211 5.792 1.00 41.42 H new ATOM 0 HA LEU A 49 18.432 0.855 8.115 1.00 53.34 H new ATOM 0 HB2 LEU A 49 18.075 3.429 7.399 1.00 71.44 H new ATOM 0 HB3 LEU A 49 16.566 3.190 8.258 1.00 71.44 H new ATOM 0 HG LEU A 49 18.403 4.181 9.624 1.00 3.35 H new ATOM 0 HD11 LEU A 49 18.014 2.760 11.599 1.00 24.01 H new ATOM 0 HD12 LEU A 49 16.515 3.043 10.683 1.00 24.01 H new ATOM 0 HD13 LEU A 49 17.360 1.483 10.545 1.00 24.01 H new ATOM 0 HD21 LEU A 49 20.191 2.695 10.443 1.00 43.13 H new ATOM 0 HD22 LEU A 49 19.624 1.416 9.343 1.00 43.13 H new ATOM 0 HD23 LEU A 49 20.283 2.931 8.681 1.00 43.13 H new ATOM 577 N ASP A 50 15.301 0.565 7.378 1.00 61.00 N ATOM 578 CA ASP A 50 14.045 -0.074 7.754 1.00 3.24 C ATOM 579 C ASP A 50 14.281 -1.512 8.204 1.00 32.32 C ATOM 580 O ASP A 50 13.527 -2.052 9.015 1.00 73.00 O ATOM 581 CB ASP A 50 13.063 -0.047 6.582 1.00 24.11 C ATOM 582 CG ASP A 50 11.648 -0.388 7.005 1.00 71.13 C ATOM 583 OD1 ASP A 50 11.336 -0.241 8.205 1.00 54.24 O ATOM 584 OD2 ASP A 50 10.853 -0.803 6.136 1.00 75.14 O ATOM 0 H ASP A 50 15.333 0.897 6.414 1.00 61.00 H new ATOM 0 HA ASP A 50 13.618 0.483 8.588 1.00 3.24 H new ATOM 0 HB2 ASP A 50 13.074 0.943 6.125 1.00 24.11 H new ATOM 0 HB3 ASP A 50 13.392 -0.754 5.820 1.00 24.11 H new ATOM 589 N LEU A 51 15.331 -2.129 7.672 1.00 14.44 N ATOM 590 CA LEU A 51 15.665 -3.506 8.018 1.00 5.31 C ATOM 591 C LEU A 51 15.820 -3.666 9.527 1.00 21.21 C ATOM 592 O LEU A 51 15.647 -4.759 10.068 1.00 61.13 O ATOM 593 CB LEU A 51 16.955 -3.930 7.314 1.00 45.11 C ATOM 594 CG LEU A 51 16.997 -5.369 6.798 1.00 54.30 C ATOM 595 CD1 LEU A 51 16.974 -5.391 5.278 1.00 73.45 C ATOM 596 CD2 LEU A 51 18.229 -6.089 7.325 1.00 32.34 C ATOM 0 H LEU A 51 15.965 -1.697 7.000 1.00 14.44 H new ATOM 0 HA LEU A 51 14.848 -4.147 7.685 1.00 5.31 H new ATOM 0 HB2 LEU A 51 17.123 -3.258 6.472 1.00 45.11 H new ATOM 0 HB3 LEU A 51 17.786 -3.789 8.005 1.00 45.11 H new ATOM 0 HG LEU A 51 16.112 -5.891 7.162 1.00 54.30 H new ATOM 0 HD11 LEU A 51 17.004 -6.423 4.929 1.00 73.45 H new ATOM 0 HD12 LEU A 51 16.061 -4.914 4.921 1.00 73.45 H new ATOM 0 HD13 LEU A 51 17.840 -4.852 4.893 1.00 73.45 H new ATOM 0 HD21 LEU A 51 18.242 -7.111 6.948 1.00 32.34 H new ATOM 0 HD22 LEU A 51 19.126 -5.567 6.991 1.00 32.34 H new ATOM 0 HD23 LEU A 51 18.203 -6.105 8.415 1.00 32.34 H new ATOM 608 N THR A 52 16.145 -2.569 10.204 1.00 41.24 N ATOM 609 CA THR A 52 16.322 -2.587 11.650 1.00 11.01 C ATOM 610 C THR A 52 15.194 -1.839 12.351 1.00 0.43 C ATOM 611 O THR A 52 14.257 -1.364 11.708 1.00 23.24 O ATOM 612 CB THR A 52 17.669 -1.963 12.059 1.00 2.54 C ATOM 613 OG1 THR A 52 17.993 -0.878 11.182 1.00 21.12 O ATOM 614 CG2 THR A 52 18.780 -3.001 12.022 1.00 4.22 C ATOM 0 H THR A 52 16.291 -1.656 9.773 1.00 41.24 H new ATOM 0 HA THR A 52 16.307 -3.633 11.957 1.00 11.01 H new ATOM 0 HB THR A 52 17.576 -1.590 13.079 1.00 2.54 H new ATOM 0 HG1 THR A 52 17.174 -0.540 10.764 1.00 21.12 H new ATOM 0 HG21 THR A 52 19.722 -2.537 12.315 1.00 4.22 H new ATOM 0 HG22 THR A 52 18.545 -3.811 12.713 1.00 4.22 H new ATOM 0 HG23 THR A 52 18.871 -3.401 11.012 1.00 4.22 H new ATOM 622 N ASP A 53 15.290 -1.736 13.672 1.00 3.22 N ATOM 623 CA ASP A 53 14.278 -1.043 14.461 1.00 42.20 C ATOM 624 C ASP A 53 14.674 0.412 14.696 1.00 60.34 C ATOM 625 O ASP A 53 13.885 1.206 15.209 1.00 61.35 O ATOM 626 CB ASP A 53 14.072 -1.751 15.801 1.00 42.21 C ATOM 627 CG ASP A 53 12.628 -1.713 16.259 1.00 34.35 C ATOM 628 OD1 ASP A 53 11.758 -2.221 15.521 1.00 30.34 O ATOM 629 OD2 ASP A 53 12.367 -1.175 17.356 1.00 34.20 O ATOM 0 H ASP A 53 16.059 -2.124 14.219 1.00 3.22 H new ATOM 0 HA ASP A 53 13.342 -1.060 13.902 1.00 42.20 H new ATOM 0 HB2 ASP A 53 14.395 -2.788 15.714 1.00 42.21 H new ATOM 0 HB3 ASP A 53 14.702 -1.283 16.557 1.00 42.21 H new ATOM 634 N PHE A 54 15.901 0.754 14.318 1.00 63.11 N ATOM 635 CA PHE A 54 16.403 2.112 14.489 1.00 11.40 C ATOM 636 C PHE A 54 15.669 3.083 13.568 1.00 4.11 C ATOM 637 O PHE A 54 15.086 2.681 12.561 1.00 30.41 O ATOM 638 CB PHE A 54 17.906 2.163 14.208 1.00 22.23 C ATOM 639 CG PHE A 54 18.664 1.006 14.794 1.00 64.01 C ATOM 640 CD1 PHE A 54 18.803 0.875 16.166 1.00 34.52 C ATOM 641 CD2 PHE A 54 19.239 0.050 13.972 1.00 45.32 C ATOM 642 CE1 PHE A 54 19.499 -0.189 16.708 1.00 4.04 C ATOM 643 CE2 PHE A 54 19.937 -1.016 14.508 1.00 11.52 C ATOM 644 CZ PHE A 54 20.068 -1.135 15.878 1.00 42.30 C ATOM 0 H PHE A 54 16.566 0.109 13.891 1.00 63.11 H new ATOM 0 HA PHE A 54 16.223 2.411 15.522 1.00 11.40 H new ATOM 0 HB2 PHE A 54 18.066 2.183 13.130 1.00 22.23 H new ATOM 0 HB3 PHE A 54 18.311 3.093 14.608 1.00 22.23 H new ATOM 0 HD1 PHE A 54 18.362 1.613 16.820 1.00 34.52 H new ATOM 0 HD2 PHE A 54 19.141 0.139 12.900 1.00 45.32 H new ATOM 0 HE1 PHE A 54 19.598 -0.281 17.780 1.00 4.04 H new ATOM 0 HE2 PHE A 54 20.379 -1.755 13.856 1.00 11.52 H new ATOM 0 HZ PHE A 54 20.614 -1.966 16.299 1.00 42.30 H new ATOM 654 N HIS A 55 15.703 4.364 13.921 1.00 12.32 N ATOM 655 CA HIS A 55 15.041 5.394 13.127 1.00 25.41 C ATOM 656 C HIS A 55 16.061 6.210 12.338 1.00 71.41 C ATOM 657 O HIS A 55 15.699 7.111 11.581 1.00 0.32 O ATOM 658 CB HIS A 55 14.222 6.316 14.030 1.00 74.20 C ATOM 659 CG HIS A 55 12.949 5.697 14.521 1.00 22.10 C ATOM 660 ND1 HIS A 55 11.823 5.567 13.736 1.00 42.33 N ATOM 661 CD2 HIS A 55 12.629 5.169 15.725 1.00 31.44 C ATOM 662 CE1 HIS A 55 10.865 4.988 14.436 1.00 32.22 C ATOM 663 NE2 HIS A 55 11.328 4.735 15.647 1.00 43.10 N ATOM 0 H HIS A 55 16.182 4.714 14.751 1.00 12.32 H new ATOM 0 HA HIS A 55 14.372 4.901 12.422 1.00 25.41 H new ATOM 0 HB2 HIS A 55 14.830 6.605 14.887 1.00 74.20 H new ATOM 0 HB3 HIS A 55 13.985 7.229 13.484 1.00 74.20 H new ATOM 0 HD2 HIS A 55 13.276 5.101 16.587 1.00 31.44 H new ATOM 0 HE1 HIS A 55 9.872 4.760 14.079 1.00 32.22 H new ATOM 0 HE2 HIS A 55 10.805 4.290 16.401 1.00 43.10 H new ATOM 671 N THR A 56 17.338 5.888 12.520 1.00 70.11 N ATOM 672 CA THR A 56 18.410 6.592 11.827 1.00 74.20 C ATOM 673 C THR A 56 19.585 5.663 11.544 1.00 33.22 C ATOM 674 O THR A 56 19.529 4.470 11.841 1.00 63.01 O ATOM 675 CB THR A 56 18.909 7.799 12.644 1.00 70.34 C ATOM 676 OG1 THR A 56 19.614 7.346 13.805 1.00 44.32 O ATOM 677 CG2 THR A 56 17.747 8.686 13.064 1.00 71.04 C ATOM 0 H THR A 56 17.655 5.144 13.142 1.00 70.11 H new ATOM 0 HA THR A 56 17.996 6.947 10.883 1.00 74.20 H new ATOM 0 HB THR A 56 19.582 8.383 12.015 1.00 70.34 H new ATOM 0 HG1 THR A 56 19.650 8.067 14.468 1.00 44.32 H new ATOM 0 HG21 THR A 56 18.124 9.531 13.640 1.00 71.04 H new ATOM 0 HG22 THR A 56 17.230 9.052 12.177 1.00 71.04 H new ATOM 0 HG23 THR A 56 17.053 8.111 13.677 1.00 71.04 H new ATOM 685 N GLU A 57 20.647 6.218 10.970 1.00 42.04 N ATOM 686 CA GLU A 57 21.836 5.437 10.647 1.00 13.21 C ATOM 687 C GLU A 57 22.781 5.367 11.843 1.00 64.13 C ATOM 688 O GLU A 57 23.313 4.305 12.167 1.00 31.23 O ATOM 689 CB GLU A 57 22.561 6.044 9.444 1.00 11.12 C ATOM 690 CG GLU A 57 21.629 6.465 8.320 1.00 11.15 C ATOM 691 CD GLU A 57 22.375 7.000 7.113 1.00 13.15 C ATOM 692 OE1 GLU A 57 23.623 7.014 7.146 1.00 22.44 O ATOM 693 OE2 GLU A 57 21.711 7.405 6.137 1.00 52.24 O ATOM 0 H GLU A 57 20.709 7.205 10.719 1.00 42.04 H new ATOM 0 HA GLU A 57 21.518 4.425 10.397 1.00 13.21 H new ATOM 0 HB2 GLU A 57 23.133 6.911 9.775 1.00 11.12 H new ATOM 0 HB3 GLU A 57 23.277 5.319 9.058 1.00 11.12 H new ATOM 0 HG2 GLU A 57 21.021 5.612 8.018 1.00 11.15 H new ATOM 0 HG3 GLU A 57 20.945 7.230 8.688 1.00 11.15 H new ATOM 700 N LYS A 58 22.987 6.506 12.494 1.00 5.42 N ATOM 701 CA LYS A 58 23.868 6.577 13.654 1.00 31.43 C ATOM 702 C LYS A 58 23.462 5.552 14.709 1.00 74.15 C ATOM 703 O LYS A 58 24.313 4.958 15.369 1.00 33.14 O ATOM 704 CB LYS A 58 23.840 7.983 14.257 1.00 31.12 C ATOM 705 CG LYS A 58 22.442 8.472 14.595 1.00 41.34 C ATOM 706 CD LYS A 58 22.382 9.989 14.654 1.00 54.40 C ATOM 707 CE LYS A 58 21.516 10.468 15.810 1.00 61.14 C ATOM 708 NZ LYS A 58 21.135 11.900 15.661 1.00 23.14 N ATOM 0 H LYS A 58 22.555 7.394 12.238 1.00 5.42 H new ATOM 0 HA LYS A 58 24.882 6.351 13.323 1.00 31.43 H new ATOM 0 HB2 LYS A 58 24.448 7.994 15.162 1.00 31.12 H new ATOM 0 HB3 LYS A 58 24.300 8.679 13.556 1.00 31.12 H new ATOM 0 HG2 LYS A 58 21.737 8.108 13.847 1.00 41.34 H new ATOM 0 HG3 LYS A 58 22.132 8.057 15.554 1.00 41.34 H new ATOM 0 HD2 LYS A 58 23.390 10.390 14.762 1.00 54.40 H new ATOM 0 HD3 LYS A 58 21.984 10.375 13.716 1.00 54.40 H new ATOM 0 HE2 LYS A 58 20.615 9.857 15.867 1.00 61.14 H new ATOM 0 HE3 LYS A 58 22.054 10.331 16.748 1.00 61.14 H new ATOM 0 HZ1 LYS A 58 20.546 12.188 16.468 1.00 23.14 H new ATOM 0 HZ2 LYS A 58 21.993 12.486 15.632 1.00 23.14 H new ATOM 0 HZ3 LYS A 58 20.599 12.027 14.779 1.00 23.14 H new ATOM 722 N GLU A 59 22.156 5.350 14.859 1.00 62.55 N ATOM 723 CA GLU A 59 21.639 4.396 15.832 1.00 32.54 C ATOM 724 C GLU A 59 22.081 2.975 15.491 1.00 2.51 C ATOM 725 O GLU A 59 22.423 2.190 16.376 1.00 33.31 O ATOM 726 CB GLU A 59 20.111 4.466 15.887 1.00 43.31 C ATOM 727 CG GLU A 59 19.580 5.240 17.082 1.00 41.44 C ATOM 728 CD GLU A 59 19.074 4.333 18.186 1.00 12.32 C ATOM 729 OE1 GLU A 59 19.830 3.435 18.611 1.00 44.32 O ATOM 730 OE2 GLU A 59 17.920 4.522 18.626 1.00 3.32 O ATOM 0 H GLU A 59 21.438 5.834 14.320 1.00 62.55 H new ATOM 0 HA GLU A 59 22.044 4.659 16.809 1.00 32.54 H new ATOM 0 HB2 GLU A 59 19.744 4.930 14.972 1.00 43.31 H new ATOM 0 HB3 GLU A 59 19.710 3.453 15.914 1.00 43.31 H new ATOM 0 HG2 GLU A 59 20.370 5.880 17.476 1.00 41.44 H new ATOM 0 HG3 GLU A 59 18.772 5.895 16.756 1.00 41.44 H new ATOM 737 N LEU A 60 22.072 2.653 14.202 1.00 10.14 N ATOM 738 CA LEU A 60 22.472 1.328 13.742 1.00 34.44 C ATOM 739 C LEU A 60 23.969 1.112 13.938 1.00 32.21 C ATOM 740 O LEU A 60 24.394 0.082 14.459 1.00 65.34 O ATOM 741 CB LEU A 60 22.107 1.147 12.268 1.00 61.51 C ATOM 742 CG LEU A 60 22.281 -0.263 11.702 1.00 74.31 C ATOM 743 CD1 LEU A 60 21.138 -0.604 10.758 1.00 12.10 C ATOM 744 CD2 LEU A 60 23.619 -0.391 10.989 1.00 2.15 C ATOM 0 H LEU A 60 21.792 3.291 13.457 1.00 10.14 H new ATOM 0 HA LEU A 60 21.937 0.587 14.336 1.00 34.44 H new ATOM 0 HB2 LEU A 60 21.068 1.446 12.132 1.00 61.51 H new ATOM 0 HB3 LEU A 60 22.715 1.832 11.677 1.00 61.51 H new ATOM 0 HG LEU A 60 22.265 -0.971 12.531 1.00 74.31 H new ATOM 0 HD11 LEU A 60 21.279 -1.611 10.365 1.00 12.10 H new ATOM 0 HD12 LEU A 60 20.193 -0.554 11.298 1.00 12.10 H new ATOM 0 HD13 LEU A 60 21.122 0.108 9.933 1.00 12.10 H new ATOM 0 HD21 LEU A 60 23.725 -1.401 10.593 1.00 2.15 H new ATOM 0 HD22 LEU A 60 23.665 0.327 10.170 1.00 2.15 H new ATOM 0 HD23 LEU A 60 24.427 -0.191 11.693 1.00 2.15 H new ATOM 756 N ASN A 61 24.763 2.092 13.519 1.00 55.10 N ATOM 757 CA ASN A 61 26.213 2.010 13.650 1.00 53.02 C ATOM 758 C ASN A 61 26.634 2.112 15.113 1.00 74.33 C ATOM 759 O ASN A 61 27.703 1.636 15.496 1.00 14.52 O ATOM 760 CB ASN A 61 26.883 3.119 12.836 1.00 14.44 C ATOM 761 CG ASN A 61 27.017 2.760 11.369 1.00 23.13 C ATOM 762 OD1 ASN A 61 26.644 3.538 10.491 1.00 35.33 O ATOM 763 ND2 ASN A 61 27.553 1.576 11.097 1.00 22.34 N ATOM 0 H ASN A 61 24.427 2.952 13.086 1.00 55.10 H new ATOM 0 HA ASN A 61 26.533 1.042 13.265 1.00 53.02 H new ATOM 0 HB2 ASN A 61 26.303 4.037 12.931 1.00 14.44 H new ATOM 0 HB3 ASN A 61 27.871 3.323 13.249 1.00 14.44 H new ATOM 0 HD21 ASN A 61 27.670 1.279 10.128 1.00 22.34 H new ATOM 0 HD22 ASN A 61 27.848 0.963 11.857 1.00 22.34 H new ATOM 770 N ASP A 62 25.786 2.734 15.924 1.00 32.35 N ATOM 771 CA ASP A 62 26.068 2.897 17.346 1.00 63.41 C ATOM 772 C ASP A 62 25.814 1.597 18.103 1.00 64.31 C ATOM 773 O ASP A 62 26.626 1.178 18.929 1.00 74.21 O ATOM 774 CB ASP A 62 25.211 4.019 17.933 1.00 72.13 C ATOM 775 CG ASP A 62 25.822 5.389 17.715 1.00 63.01 C ATOM 776 OD1 ASP A 62 26.737 5.504 16.872 1.00 31.21 O ATOM 777 OD2 ASP A 62 25.386 6.347 18.387 1.00 74.43 O ATOM 0 H ASP A 62 24.898 3.134 15.622 1.00 32.35 H new ATOM 0 HA ASP A 62 27.120 3.160 17.454 1.00 63.41 H new ATOM 0 HB2 ASP A 62 24.220 3.990 17.480 1.00 72.13 H new ATOM 0 HB3 ASP A 62 25.078 3.850 19.002 1.00 72.13 H new ATOM 782 N LYS A 63 24.682 0.963 17.816 1.00 23.25 N ATOM 783 CA LYS A 63 24.320 -0.290 18.469 1.00 0.31 C ATOM 784 C LYS A 63 25.402 -1.344 18.261 1.00 23.44 C ATOM 785 O LYS A 63 25.601 -2.219 19.106 1.00 45.13 O ATOM 786 CB LYS A 63 22.983 -0.802 17.929 1.00 61.23 C ATOM 787 CG LYS A 63 22.636 -2.205 18.396 1.00 73.00 C ATOM 788 CD LYS A 63 22.662 -3.198 17.246 1.00 35.12 C ATOM 789 CE LYS A 63 24.007 -3.901 17.147 1.00 33.10 C ATOM 790 NZ LYS A 63 23.864 -5.308 16.680 1.00 42.25 N ATOM 0 H LYS A 63 23.999 1.296 17.135 1.00 23.25 H new ATOM 0 HA LYS A 63 24.224 -0.100 19.538 1.00 0.31 H new ATOM 0 HB2 LYS A 63 22.191 -0.119 18.237 1.00 61.23 H new ATOM 0 HB3 LYS A 63 23.011 -0.787 16.839 1.00 61.23 H new ATOM 0 HG2 LYS A 63 23.342 -2.519 19.165 1.00 73.00 H new ATOM 0 HG3 LYS A 63 21.647 -2.203 18.854 1.00 73.00 H new ATOM 0 HD2 LYS A 63 21.873 -3.937 17.384 1.00 35.12 H new ATOM 0 HD3 LYS A 63 22.452 -2.679 16.311 1.00 35.12 H new ATOM 0 HE2 LYS A 63 24.653 -3.354 16.460 1.00 33.10 H new ATOM 0 HE3 LYS A 63 24.495 -3.890 18.121 1.00 33.10 H new ATOM 0 HZ1 LYS A 63 24.494 -5.923 17.234 1.00 42.25 H new ATOM 0 HZ2 LYS A 63 22.879 -5.617 16.806 1.00 42.25 H new ATOM 0 HZ3 LYS A 63 24.119 -5.367 15.674 1.00 42.25 H new ATOM 804 N LEU A 64 26.100 -1.256 17.134 1.00 15.32 N ATOM 805 CA LEU A 64 27.163 -2.202 16.816 1.00 5.13 C ATOM 806 C LEU A 64 28.124 -2.356 17.991 1.00 21.11 C ATOM 807 O LEU A 64 28.595 -3.455 18.280 1.00 30.12 O ATOM 808 CB LEU A 64 27.928 -1.741 15.574 1.00 4.04 C ATOM 809 CG LEU A 64 27.648 -2.517 14.287 1.00 22.10 C ATOM 810 CD1 LEU A 64 26.893 -1.648 13.293 1.00 5.22 C ATOM 811 CD2 LEU A 64 28.947 -3.024 13.676 1.00 33.05 C ATOM 0 H LEU A 64 25.949 -0.539 16.425 1.00 15.32 H new ATOM 0 HA LEU A 64 26.706 -3.171 16.615 1.00 5.13 H new ATOM 0 HB2 LEU A 64 27.697 -0.690 15.399 1.00 4.04 H new ATOM 0 HB3 LEU A 64 28.995 -1.801 15.786 1.00 4.04 H new ATOM 0 HG LEU A 64 27.025 -3.377 14.533 1.00 22.10 H new ATOM 0 HD11 LEU A 64 26.703 -2.217 12.383 1.00 5.22 H new ATOM 0 HD12 LEU A 64 25.945 -1.335 13.730 1.00 5.22 H new ATOM 0 HD13 LEU A 64 27.490 -0.768 13.052 1.00 5.22 H new ATOM 0 HD21 LEU A 64 28.728 -3.574 12.761 1.00 33.05 H new ATOM 0 HD22 LEU A 64 29.595 -2.178 13.445 1.00 33.05 H new ATOM 0 HD23 LEU A 64 29.449 -3.683 14.384 1.00 33.05 H new ATOM 823 N ASN A 65 28.408 -1.247 18.666 1.00 44.22 N ATOM 824 CA ASN A 65 29.312 -1.259 19.811 1.00 74.12 C ATOM 825 C ASN A 65 28.863 -2.286 20.846 1.00 3.13 C ATOM 826 O ASN A 65 29.687 -2.968 21.457 1.00 41.53 O ATOM 827 CB ASN A 65 29.378 0.130 20.449 1.00 22.11 C ATOM 828 CG ASN A 65 30.431 1.012 19.806 1.00 22.31 C ATOM 829 OD1 ASN A 65 31.557 1.109 20.294 1.00 44.12 O ATOM 830 ND2 ASN A 65 30.068 1.660 18.705 1.00 21.33 N ATOM 0 H ASN A 65 28.025 -0.329 18.440 1.00 44.22 H new ATOM 0 HA ASN A 65 30.305 -1.536 19.457 1.00 74.12 H new ATOM 0 HB2 ASN A 65 28.404 0.612 20.365 1.00 22.11 H new ATOM 0 HB3 ASN A 65 29.593 0.028 21.513 1.00 22.11 H new ATOM 0 HD21 ASN A 65 30.734 2.268 18.228 1.00 21.33 H new ATOM 0 HD22 ASN A 65 29.123 1.549 18.336 1.00 21.33 H new ATOM 837 N ASP A 66 27.553 -2.391 21.038 1.00 1.03 N ATOM 838 CA ASP A 66 26.994 -3.336 21.998 1.00 3.35 C ATOM 839 C ASP A 66 27.332 -4.771 21.608 1.00 22.21 C ATOM 840 O ASP A 66 27.873 -5.532 22.411 1.00 70.55 O ATOM 841 CB ASP A 66 25.477 -3.163 22.092 1.00 25.14 C ATOM 842 CG ASP A 66 25.034 -2.673 23.457 1.00 71.32 C ATOM 843 OD1 ASP A 66 25.247 -3.404 24.447 1.00 53.31 O ATOM 844 OD2 ASP A 66 24.473 -1.560 23.535 1.00 41.15 O ATOM 0 H ASP A 66 26.858 -1.833 20.542 1.00 1.03 H new ATOM 0 HA ASP A 66 27.436 -3.130 22.973 1.00 3.35 H new ATOM 0 HB2 ASP A 66 25.147 -2.456 21.331 1.00 25.14 H new ATOM 0 HB3 ASP A 66 24.992 -4.115 21.876 1.00 25.14 H new ATOM 849 N TYR A 67 27.009 -5.134 20.372 1.00 60.21 N ATOM 850 CA TYR A 67 27.275 -6.479 19.876 1.00 30.31 C ATOM 851 C TYR A 67 28.772 -6.774 19.878 1.00 72.53 C ATOM 852 O TYR A 67 29.191 -7.916 20.072 1.00 11.31 O ATOM 853 CB TYR A 67 26.713 -6.645 18.463 1.00 34.34 C ATOM 854 CG TYR A 67 27.777 -6.844 17.408 1.00 75.44 C ATOM 855 CD1 TYR A 67 28.366 -8.088 17.214 1.00 42.44 C ATOM 856 CD2 TYR A 67 28.193 -5.790 16.605 1.00 51.40 C ATOM 857 CE1 TYR A 67 29.339 -8.274 16.251 1.00 62.22 C ATOM 858 CE2 TYR A 67 29.164 -5.967 15.639 1.00 70.33 C ATOM 859 CZ TYR A 67 29.734 -7.211 15.466 1.00 62.24 C ATOM 860 OH TYR A 67 30.703 -7.392 14.505 1.00 30.01 O ATOM 0 H TYR A 67 26.562 -4.516 19.695 1.00 60.21 H new ATOM 0 HA TYR A 67 26.782 -7.188 20.541 1.00 30.31 H new ATOM 0 HB2 TYR A 67 26.035 -7.498 18.449 1.00 34.34 H new ATOM 0 HB3 TYR A 67 26.123 -5.764 18.210 1.00 34.34 H new ATOM 0 HD1 TYR A 67 28.058 -8.923 17.826 1.00 42.44 H new ATOM 0 HD2 TYR A 67 27.749 -4.814 16.738 1.00 51.40 H new ATOM 0 HE1 TYR A 67 29.788 -9.247 16.114 1.00 62.22 H new ATOM 0 HE2 TYR A 67 29.475 -5.136 15.023 1.00 70.33 H new ATOM 0 HH TYR A 67 30.865 -6.545 14.040 1.00 30.01 H new ATOM 870 N TYR A 68 29.573 -5.737 19.660 1.00 34.31 N ATOM 871 CA TYR A 68 31.023 -5.884 19.634 1.00 1.23 C ATOM 872 C TYR A 68 31.517 -6.633 20.868 1.00 20.11 C ATOM 873 O TYR A 68 32.418 -7.466 20.782 1.00 25.44 O ATOM 874 CB TYR A 68 31.694 -4.511 19.555 1.00 70.52 C ATOM 875 CG TYR A 68 32.348 -4.234 18.220 1.00 3.34 C ATOM 876 CD1 TYR A 68 31.583 -3.971 17.091 1.00 40.13 C ATOM 877 CD2 TYR A 68 33.731 -4.235 18.089 1.00 64.03 C ATOM 878 CE1 TYR A 68 32.176 -3.717 15.869 1.00 23.31 C ATOM 879 CE2 TYR A 68 34.333 -3.981 16.872 1.00 63.04 C ATOM 880 CZ TYR A 68 33.552 -3.723 15.765 1.00 53.12 C ATOM 881 OH TYR A 68 34.147 -3.471 14.550 1.00 4.12 O ATOM 0 H TYR A 68 29.243 -4.786 19.499 1.00 34.31 H new ATOM 0 HA TYR A 68 31.288 -6.463 18.749 1.00 1.23 H new ATOM 0 HB2 TYR A 68 30.949 -3.740 19.753 1.00 70.52 H new ATOM 0 HB3 TYR A 68 32.446 -4.437 20.341 1.00 70.52 H new ATOM 0 HD1 TYR A 68 30.506 -3.965 17.170 1.00 40.13 H new ATOM 0 HD2 TYR A 68 34.346 -4.438 18.953 1.00 64.03 H new ATOM 0 HE1 TYR A 68 31.566 -3.515 15.001 1.00 23.31 H new ATOM 0 HE2 TYR A 68 35.410 -3.984 16.788 1.00 63.04 H new ATOM 0 HH TYR A 68 35.121 -3.512 14.648 1.00 4.12 H new ATOM 891 N ALA A 69 30.919 -6.330 22.015 1.00 15.13 N ATOM 892 CA ALA A 69 31.294 -6.976 23.267 1.00 44.41 C ATOM 893 C ALA A 69 31.226 -8.494 23.144 1.00 52.04 C ATOM 894 O ALA A 69 31.959 -9.216 23.820 1.00 4.13 O ATOM 895 CB ALA A 69 30.398 -6.495 24.399 1.00 61.04 C ATOM 0 H ALA A 69 30.172 -5.641 22.103 1.00 15.13 H new ATOM 0 HA ALA A 69 32.325 -6.702 23.493 1.00 44.41 H new ATOM 0 HB1 ALA A 69 30.690 -6.986 25.328 1.00 61.04 H new ATOM 0 HB2 ALA A 69 30.501 -5.416 24.511 1.00 61.04 H new ATOM 0 HB3 ALA A 69 29.360 -6.738 24.170 1.00 61.04 H new ATOM 901 N LEU A 70 30.340 -8.973 22.277 1.00 45.13 N ATOM 902 CA LEU A 70 30.175 -10.407 22.065 1.00 5.11 C ATOM 903 C LEU A 70 31.466 -11.033 21.545 1.00 13.50 C ATOM 904 O LEU A 70 31.642 -12.250 21.593 1.00 32.14 O ATOM 905 CB LEU A 70 29.035 -10.669 21.080 1.00 30.00 C ATOM 906 CG LEU A 70 28.498 -12.100 21.040 1.00 23.30 C ATOM 907 CD1 LEU A 70 27.023 -12.128 21.410 1.00 44.13 C ATOM 908 CD2 LEU A 70 28.717 -12.714 19.665 1.00 52.44 C ATOM 0 H LEU A 70 29.725 -8.389 21.710 1.00 45.13 H new ATOM 0 HA LEU A 70 29.931 -10.865 23.023 1.00 5.11 H new ATOM 0 HB2 LEU A 70 28.210 -9.999 21.324 1.00 30.00 H new ATOM 0 HB3 LEU A 70 29.377 -10.403 20.080 1.00 30.00 H new ATOM 0 HG LEU A 70 29.046 -12.693 21.772 1.00 23.30 H new ATOM 0 HD11 LEU A 70 26.659 -13.155 21.376 1.00 44.13 H new ATOM 0 HD12 LEU A 70 26.893 -11.730 22.416 1.00 44.13 H new ATOM 0 HD13 LEU A 70 26.459 -11.519 20.703 1.00 44.13 H new ATOM 0 HD21 LEU A 70 28.329 -13.732 19.655 1.00 52.44 H new ATOM 0 HD22 LEU A 70 28.196 -12.120 18.914 1.00 52.44 H new ATOM 0 HD23 LEU A 70 29.783 -12.730 19.439 1.00 52.44 H new ATOM 920 N LYS A 71 32.367 -10.192 21.049 1.00 1.53 N ATOM 921 CA LYS A 71 33.644 -10.660 20.523 1.00 34.22 C ATOM 922 C LYS A 71 34.313 -11.624 21.498 1.00 73.45 C ATOM 923 O LYS A 71 35.008 -12.554 21.087 1.00 20.33 O ATOM 924 CB LYS A 71 34.570 -9.474 20.245 1.00 23.42 C ATOM 925 CG LYS A 71 35.006 -8.736 21.499 1.00 51.10 C ATOM 926 CD LYS A 71 36.011 -7.641 21.181 1.00 73.42 C ATOM 927 CE LYS A 71 35.377 -6.261 21.267 1.00 63.22 C ATOM 928 NZ LYS A 71 34.937 -5.938 22.652 1.00 24.23 N ATOM 0 H LYS A 71 32.236 -9.182 21.000 1.00 1.53 H new ATOM 0 HA LYS A 71 33.452 -11.189 19.590 1.00 34.22 H new ATOM 0 HB2 LYS A 71 35.455 -9.830 19.717 1.00 23.42 H new ATOM 0 HB3 LYS A 71 34.062 -8.775 19.580 1.00 23.42 H new ATOM 0 HG2 LYS A 71 34.134 -8.300 21.987 1.00 51.10 H new ATOM 0 HG3 LYS A 71 35.446 -9.442 22.203 1.00 51.10 H new ATOM 0 HD2 LYS A 71 36.849 -7.702 21.876 1.00 73.42 H new ATOM 0 HD3 LYS A 71 36.415 -7.795 20.180 1.00 73.42 H new ATOM 0 HE2 LYS A 71 36.092 -5.511 20.929 1.00 63.22 H new ATOM 0 HE3 LYS A 71 34.521 -6.212 20.593 1.00 63.22 H new ATOM 0 HZ1 LYS A 71 33.953 -5.602 22.634 1.00 24.23 H new ATOM 0 HZ2 LYS A 71 35.001 -6.790 23.244 1.00 24.23 H new ATOM 0 HZ3 LYS A 71 35.549 -5.196 23.047 1.00 24.23 H new ATOM 942 N HIS A 72 34.097 -11.398 22.789 1.00 1.55 N ATOM 943 CA HIS A 72 34.678 -12.248 23.822 1.00 20.13 C ATOM 944 C HIS A 72 34.384 -13.719 23.544 1.00 54.02 C ATOM 945 O HIS A 72 35.224 -14.587 23.781 1.00 2.31 O ATOM 946 CB HIS A 72 34.136 -11.859 25.198 1.00 54.12 C ATOM 947 CG HIS A 72 35.003 -10.880 25.929 1.00 74.53 C ATOM 948 ND1 HIS A 72 35.155 -9.568 25.533 1.00 25.42 N ATOM 949 CD2 HIS A 72 35.764 -11.029 27.038 1.00 43.23 C ATOM 950 CE1 HIS A 72 35.975 -8.952 26.366 1.00 21.42 C ATOM 951 NE2 HIS A 72 36.358 -9.816 27.289 1.00 64.43 N ATOM 0 H HIS A 72 33.524 -10.633 23.145 1.00 1.55 H new ATOM 0 HA HIS A 72 35.758 -12.103 23.811 1.00 20.13 H new ATOM 0 HB2 HIS A 72 33.140 -11.432 25.080 1.00 54.12 H new ATOM 0 HB3 HIS A 72 34.027 -12.758 25.804 1.00 54.12 H new ATOM 0 HD2 HIS A 72 35.882 -11.933 27.617 1.00 43.23 H new ATOM 0 HE1 HIS A 72 36.280 -7.918 26.303 1.00 21.42 H new ATOM 0 HE2 HIS A 72 36.992 -9.615 28.062 1.00 64.43 H new ATOM 959 N VAL A 73 33.184 -13.992 23.040 1.00 64.52 N ATOM 960 CA VAL A 73 32.779 -15.358 22.729 1.00 61.12 C ATOM 961 C VAL A 73 32.930 -15.651 21.240 1.00 3.43 C ATOM 962 O VAL A 73 32.133 -15.210 20.412 1.00 44.04 O ATOM 963 CB VAL A 73 31.320 -15.619 23.147 1.00 71.44 C ATOM 964 CG1 VAL A 73 30.904 -17.035 22.777 1.00 72.00 C ATOM 965 CG2 VAL A 73 31.141 -15.374 24.637 1.00 31.32 C ATOM 0 H VAL A 73 32.476 -13.286 22.839 1.00 64.52 H new ATOM 0 HA VAL A 73 33.435 -16.019 23.294 1.00 61.12 H new ATOM 0 HB VAL A 73 30.676 -14.924 22.608 1.00 71.44 H new ATOM 0 HG11 VAL A 73 29.870 -17.201 23.080 1.00 72.00 H new ATOM 0 HG12 VAL A 73 30.993 -17.170 21.699 1.00 72.00 H new ATOM 0 HG13 VAL A 73 31.551 -17.749 23.287 1.00 72.00 H new ATOM 0 HG21 VAL A 73 30.104 -15.563 24.915 1.00 31.32 H new ATOM 0 HG22 VAL A 73 31.795 -16.043 25.197 1.00 31.32 H new ATOM 0 HG23 VAL A 73 31.396 -14.340 24.869 1.00 31.32 H new ATOM 975 N PRO A 74 33.977 -16.413 20.890 1.00 0.24 N ATOM 976 CA PRO A 74 34.257 -16.783 19.500 1.00 42.21 C ATOM 977 C PRO A 74 33.231 -17.764 18.943 1.00 25.22 C ATOM 978 O PRO A 74 32.975 -17.794 17.739 1.00 32.14 O ATOM 979 CB PRO A 74 35.638 -17.439 19.579 1.00 73.52 C ATOM 980 CG PRO A 74 35.737 -17.946 20.976 1.00 33.41 C ATOM 981 CD PRO A 74 34.967 -16.973 21.825 1.00 4.44 C ATOM 0 HA PRO A 74 34.217 -15.922 18.833 1.00 42.21 H new ATOM 0 HB2 PRO A 74 35.733 -18.249 18.856 1.00 73.52 H new ATOM 0 HB3 PRO A 74 36.430 -16.722 19.361 1.00 73.52 H new ATOM 0 HG2 PRO A 74 35.320 -18.950 21.057 1.00 33.41 H new ATOM 0 HG3 PRO A 74 36.777 -18.006 21.297 1.00 33.41 H new ATOM 0 HD2 PRO A 74 34.487 -17.468 22.669 1.00 4.44 H new ATOM 0 HD3 PRO A 74 35.614 -16.198 22.236 1.00 4.44 H new ATOM 989 N LYS A 75 32.647 -18.566 19.827 1.00 71.35 N ATOM 990 CA LYS A 75 31.647 -19.549 19.425 1.00 41.45 C ATOM 991 C LYS A 75 30.473 -18.874 18.723 1.00 14.22 C ATOM 992 O LYS A 75 29.949 -19.387 17.734 1.00 71.00 O ATOM 993 CB LYS A 75 31.148 -20.327 20.644 1.00 51.01 C ATOM 994 CG LYS A 75 32.224 -21.164 21.314 1.00 42.43 C ATOM 995 CD LYS A 75 32.611 -22.361 20.462 1.00 51.34 C ATOM 996 CE LYS A 75 34.120 -22.472 20.309 1.00 21.00 C ATOM 997 NZ LYS A 75 34.777 -22.888 21.579 1.00 32.21 N ATOM 0 H LYS A 75 32.849 -18.555 20.827 1.00 71.35 H new ATOM 0 HA LYS A 75 32.115 -20.243 18.726 1.00 41.45 H new ATOM 0 HB2 LYS A 75 30.741 -19.624 21.371 1.00 51.01 H new ATOM 0 HB3 LYS A 75 30.330 -20.979 20.338 1.00 51.01 H new ATOM 0 HG2 LYS A 75 33.104 -20.547 21.498 1.00 42.43 H new ATOM 0 HG3 LYS A 75 31.867 -21.508 22.285 1.00 42.43 H new ATOM 0 HD2 LYS A 75 32.222 -23.273 20.916 1.00 51.34 H new ATOM 0 HD3 LYS A 75 32.150 -22.273 19.478 1.00 51.34 H new ATOM 0 HE2 LYS A 75 34.354 -23.193 19.526 1.00 21.00 H new ATOM 0 HE3 LYS A 75 34.524 -21.512 19.989 1.00 21.00 H new ATOM 0 HZ1 LYS A 75 35.805 -22.952 21.433 1.00 32.21 H new ATOM 0 HZ2 LYS A 75 34.575 -22.187 22.320 1.00 32.21 H new ATOM 0 HZ3 LYS A 75 34.410 -23.816 21.872 1.00 32.21 H new ATOM 1011 N CYS A 76 30.064 -17.720 19.241 1.00 70.04 N ATOM 1012 CA CYS A 76 28.952 -16.974 18.664 1.00 2.10 C ATOM 1013 C CYS A 76 29.459 -15.850 17.766 1.00 45.54 C ATOM 1014 O CYS A 76 28.832 -15.513 16.761 1.00 2.13 O ATOM 1015 CB CYS A 76 28.069 -16.397 19.772 1.00 73.01 C ATOM 1016 SG CYS A 76 26.340 -16.969 19.718 1.00 20.20 S ATOM 0 H CYS A 76 30.486 -17.281 20.059 1.00 70.04 H new ATOM 0 HA CYS A 76 28.361 -17.661 18.058 1.00 2.10 H new ATOM 0 HB2 CYS A 76 28.498 -16.661 20.739 1.00 73.01 H new ATOM 0 HB3 CYS A 76 28.083 -15.309 19.704 1.00 73.01 H new ATOM 1021 N TRP A 77 30.598 -15.274 18.134 1.00 11.33 N ATOM 1022 CA TRP A 77 31.190 -14.187 17.362 1.00 71.32 C ATOM 1023 C TRP A 77 31.410 -14.607 15.912 1.00 14.35 C ATOM 1024 O TRP A 77 30.929 -13.952 14.988 1.00 72.42 O ATOM 1025 CB TRP A 77 32.517 -13.754 17.987 1.00 52.31 C ATOM 1026 CG TRP A 77 33.458 -13.123 17.006 1.00 53.35 C ATOM 1027 CD1 TRP A 77 34.747 -13.494 16.752 1.00 42.33 C ATOM 1028 CD2 TRP A 77 33.182 -12.009 16.149 1.00 44.10 C ATOM 1029 NE1 TRP A 77 35.290 -12.677 15.789 1.00 63.52 N ATOM 1030 CE2 TRP A 77 34.350 -11.759 15.402 1.00 24.22 C ATOM 1031 CE3 TRP A 77 32.063 -11.200 15.939 1.00 53.24 C ATOM 1032 CZ2 TRP A 77 34.428 -10.734 14.463 1.00 2.03 C ATOM 1033 CZ3 TRP A 77 32.142 -10.183 15.007 1.00 54.53 C ATOM 1034 CH2 TRP A 77 33.317 -9.957 14.278 1.00 70.21 C ATOM 0 H TRP A 77 31.130 -15.541 18.962 1.00 11.33 H new ATOM 0 HA TRP A 77 30.498 -13.345 17.376 1.00 71.32 H new ATOM 0 HB2 TRP A 77 32.317 -13.048 18.793 1.00 52.31 H new ATOM 0 HB3 TRP A 77 33.000 -14.622 18.435 1.00 52.31 H new ATOM 0 HD1 TRP A 77 35.264 -14.309 17.236 1.00 42.33 H new ATOM 0 HE1 TRP A 77 36.239 -12.744 15.422 1.00 63.52 H new ATOM 0 HE3 TRP A 77 31.152 -11.366 16.495 1.00 53.24 H new ATOM 0 HZ2 TRP A 77 35.333 -10.558 13.901 1.00 2.03 H new ATOM 0 HZ3 TRP A 77 31.283 -9.551 14.837 1.00 54.53 H new ATOM 0 HH2 TRP A 77 33.346 -9.154 13.556 1.00 70.21 H new ATOM 1045 N ALA A 78 32.138 -15.702 15.722 1.00 44.43 N ATOM 1046 CA ALA A 78 32.419 -16.209 14.384 1.00 3.14 C ATOM 1047 C ALA A 78 31.147 -16.708 13.708 1.00 31.23 C ATOM 1048 O ALA A 78 31.131 -16.963 12.504 1.00 4.44 O ATOM 1049 CB ALA A 78 33.456 -17.320 14.449 1.00 63.44 C ATOM 0 H ALA A 78 32.544 -16.255 16.477 1.00 44.43 H new ATOM 0 HA ALA A 78 32.818 -15.389 13.787 1.00 3.14 H new ATOM 0 HB1 ALA A 78 33.657 -17.690 13.443 1.00 63.44 H new ATOM 0 HB2 ALA A 78 34.377 -16.933 14.884 1.00 63.44 H new ATOM 0 HB3 ALA A 78 33.078 -18.135 15.066 1.00 63.44 H new ATOM 1055 N ALA A 79 30.082 -16.847 14.491 1.00 72.10 N ATOM 1056 CA ALA A 79 28.805 -17.315 13.967 1.00 14.10 C ATOM 1057 C ALA A 79 28.092 -16.212 13.192 1.00 12.34 C ATOM 1058 O ALA A 79 27.399 -16.479 12.210 1.00 15.53 O ATOM 1059 CB ALA A 79 27.923 -17.822 15.099 1.00 4.52 C ATOM 0 H ALA A 79 30.079 -16.642 15.490 1.00 72.10 H new ATOM 0 HA ALA A 79 29.003 -18.137 13.279 1.00 14.10 H new ATOM 0 HB1 ALA A 79 26.973 -18.168 14.693 1.00 4.52 H new ATOM 0 HB2 ALA A 79 28.422 -18.647 15.608 1.00 4.52 H new ATOM 0 HB3 ALA A 79 27.742 -17.015 15.808 1.00 4.52 H new ATOM 1065 N ILE A 80 28.266 -14.973 13.641 1.00 60.04 N ATOM 1066 CA ILE A 80 27.639 -13.830 12.989 1.00 43.04 C ATOM 1067 C ILE A 80 28.611 -13.139 12.038 1.00 54.32 C ATOM 1068 O ILE A 80 28.375 -12.010 11.608 1.00 4.31 O ATOM 1069 CB ILE A 80 27.129 -12.805 14.018 1.00 11.42 C ATOM 1070 CG1 ILE A 80 26.134 -11.844 13.364 1.00 72.13 C ATOM 1071 CG2 ILE A 80 28.295 -12.037 14.624 1.00 55.14 C ATOM 1072 CD1 ILE A 80 25.535 -10.844 14.328 1.00 23.43 C ATOM 0 H ILE A 80 28.836 -14.736 14.453 1.00 60.04 H new ATOM 0 HA ILE A 80 26.791 -14.215 12.422 1.00 43.04 H new ATOM 0 HB ILE A 80 26.617 -13.340 14.818 1.00 11.42 H new ATOM 0 HG12 ILE A 80 26.636 -11.305 12.560 1.00 72.13 H new ATOM 0 HG13 ILE A 80 25.331 -12.422 12.907 1.00 72.13 H new ATOM 0 HG21 ILE A 80 27.918 -11.316 15.350 1.00 55.14 H new ATOM 0 HG22 ILE A 80 28.970 -12.733 15.121 1.00 55.14 H new ATOM 0 HG23 ILE A 80 28.833 -11.511 13.836 1.00 55.14 H new ATOM 0 HD11 ILE A 80 24.840 -10.196 13.795 1.00 23.43 H new ATOM 0 HD12 ILE A 80 25.004 -11.374 15.118 1.00 23.43 H new ATOM 0 HD13 ILE A 80 26.330 -10.240 14.767 1.00 23.43 H new ATOM 1084 N GLN A 81 29.701 -13.825 11.713 1.00 63.13 N ATOM 1085 CA GLN A 81 30.708 -13.277 10.811 1.00 11.14 C ATOM 1086 C GLN A 81 30.120 -13.027 9.426 1.00 24.53 C ATOM 1087 O GLN A 81 30.098 -11.902 8.928 1.00 45.10 O ATOM 1088 CB GLN A 81 31.902 -14.227 10.708 1.00 22.12 C ATOM 1089 CG GLN A 81 33.211 -13.613 11.178 1.00 11.31 C ATOM 1090 CD GLN A 81 34.205 -14.652 11.657 1.00 70.21 C ATOM 1091 OE1 GLN A 81 34.417 -15.673 11.002 1.00 45.14 O ATOM 1092 NE2 GLN A 81 34.821 -14.398 12.805 1.00 11.14 N ATOM 0 H GLN A 81 29.910 -14.761 12.060 1.00 63.13 H new ATOM 0 HA GLN A 81 31.045 -12.324 11.219 1.00 11.14 H new ATOM 0 HB2 GLN A 81 31.697 -15.120 11.298 1.00 22.12 H new ATOM 0 HB3 GLN A 81 32.012 -14.548 9.672 1.00 22.12 H new ATOM 0 HG2 GLN A 81 33.653 -13.042 10.362 1.00 11.31 H new ATOM 0 HG3 GLN A 81 33.009 -12.910 11.986 1.00 11.31 H new ATOM 0 HE21 GLN A 81 34.615 -13.539 13.315 1.00 11.14 H new ATOM 0 HE22 GLN A 81 35.500 -15.062 13.177 1.00 11.14 H new ATOM 1101 N PRO A 82 29.632 -14.101 8.788 1.00 65.43 N ATOM 1102 CA PRO A 82 29.035 -14.024 7.451 1.00 25.21 C ATOM 1103 C PRO A 82 27.696 -13.296 7.456 1.00 75.41 C ATOM 1104 O PRO A 82 27.280 -12.734 6.443 1.00 52.41 O ATOM 1105 CB PRO A 82 28.845 -15.492 7.062 1.00 21.43 C ATOM 1106 CG PRO A 82 28.741 -16.217 8.360 1.00 60.44 C ATOM 1107 CD PRO A 82 29.626 -15.474 9.322 1.00 55.23 C ATOM 0 HA PRO A 82 29.661 -13.463 6.757 1.00 25.21 H new ATOM 0 HB2 PRO A 82 27.947 -15.629 6.459 1.00 21.43 H new ATOM 0 HB3 PRO A 82 29.685 -15.857 6.471 1.00 21.43 H new ATOM 0 HG2 PRO A 82 27.710 -16.237 8.714 1.00 60.44 H new ATOM 0 HG3 PRO A 82 29.062 -17.253 8.255 1.00 60.44 H new ATOM 0 HD2 PRO A 82 29.233 -15.508 10.338 1.00 55.23 H new ATOM 0 HD3 PRO A 82 30.630 -15.897 9.354 1.00 55.23 H new ATOM 1115 N PHE A 83 27.024 -13.311 8.602 1.00 34.03 N ATOM 1116 CA PHE A 83 25.730 -12.652 8.738 1.00 34.44 C ATOM 1117 C PHE A 83 25.904 -11.164 9.026 1.00 25.11 C ATOM 1118 O PHE A 83 25.025 -10.355 8.729 1.00 53.14 O ATOM 1119 CB PHE A 83 24.915 -13.307 9.856 1.00 24.22 C ATOM 1120 CG PHE A 83 23.513 -12.780 9.964 1.00 3.45 C ATOM 1121 CD1 PHE A 83 22.824 -12.369 8.835 1.00 44.24 C ATOM 1122 CD2 PHE A 83 22.884 -12.695 11.196 1.00 51.11 C ATOM 1123 CE1 PHE A 83 21.534 -11.882 8.932 1.00 65.23 C ATOM 1124 CE2 PHE A 83 21.594 -12.210 11.299 1.00 11.51 C ATOM 1125 CZ PHE A 83 20.918 -11.804 10.165 1.00 10.42 C ATOM 0 H PHE A 83 27.354 -13.772 9.450 1.00 34.03 H new ATOM 0 HA PHE A 83 25.195 -12.761 7.795 1.00 34.44 H new ATOM 0 HB2 PHE A 83 24.878 -14.383 9.685 1.00 24.22 H new ATOM 0 HB3 PHE A 83 25.427 -13.153 10.806 1.00 24.22 H new ATOM 0 HD1 PHE A 83 23.300 -12.430 7.868 1.00 44.24 H new ATOM 0 HD2 PHE A 83 23.408 -13.011 12.086 1.00 51.11 H new ATOM 0 HE1 PHE A 83 21.009 -11.563 8.044 1.00 65.23 H new ATOM 0 HE2 PHE A 83 21.115 -12.149 12.265 1.00 11.51 H new ATOM 0 HZ PHE A 83 19.909 -11.426 10.243 1.00 10.42 H new ATOM 1135 N LEU A 84 27.045 -10.810 9.607 1.00 24.22 N ATOM 1136 CA LEU A 84 27.337 -9.419 9.936 1.00 21.34 C ATOM 1137 C LEU A 84 27.016 -8.502 8.761 1.00 72.55 C ATOM 1138 O LEU A 84 26.638 -7.345 8.947 1.00 61.33 O ATOM 1139 CB LEU A 84 28.807 -9.265 10.331 1.00 30.50 C ATOM 1140 CG LEU A 84 29.078 -8.496 11.624 1.00 32.14 C ATOM 1141 CD1 LEU A 84 28.767 -7.019 11.442 1.00 43.45 C ATOM 1142 CD2 LEU A 84 28.262 -9.076 12.771 1.00 65.32 C ATOM 0 H LEU A 84 27.783 -11.467 9.860 1.00 24.22 H new ATOM 0 HA LEU A 84 26.709 -9.132 10.779 1.00 21.34 H new ATOM 0 HB2 LEU A 84 29.243 -10.260 10.425 1.00 30.50 H new ATOM 0 HB3 LEU A 84 29.330 -8.763 9.517 1.00 30.50 H new ATOM 0 HG LEU A 84 30.135 -8.597 11.868 1.00 32.14 H new ATOM 0 HD11 LEU A 84 28.966 -6.488 12.373 1.00 43.45 H new ATOM 0 HD12 LEU A 84 29.394 -6.610 10.650 1.00 43.45 H new ATOM 0 HD13 LEU A 84 27.718 -6.899 11.173 1.00 43.45 H new ATOM 0 HD21 LEU A 84 28.468 -8.516 13.683 1.00 65.32 H new ATOM 0 HD22 LEU A 84 27.200 -9.006 12.534 1.00 65.32 H new ATOM 0 HD23 LEU A 84 28.533 -10.122 12.918 1.00 65.32 H new ATOM 1154 N CYS A 85 27.166 -9.028 7.549 1.00 3.42 N ATOM 1155 CA CYS A 85 26.891 -8.258 6.342 1.00 72.10 C ATOM 1156 C CYS A 85 25.388 -8.107 6.124 1.00 30.51 C ATOM 1157 O CYS A 85 24.900 -7.018 5.825 1.00 71.22 O ATOM 1158 CB CYS A 85 27.529 -8.932 5.126 1.00 75.43 C ATOM 1159 SG CYS A 85 29.323 -9.203 5.281 1.00 4.52 S ATOM 0 H CYS A 85 27.476 -9.984 7.377 1.00 3.42 H new ATOM 0 HA CYS A 85 27.324 -7.265 6.467 1.00 72.10 H new ATOM 0 HB2 CYS A 85 27.041 -9.892 4.958 1.00 75.43 H new ATOM 0 HB3 CYS A 85 27.340 -8.320 4.244 1.00 75.43 H new ATOM 1164 N ALA A 86 24.660 -9.209 6.277 1.00 42.03 N ATOM 1165 CA ALA A 86 23.214 -9.199 6.099 1.00 35.42 C ATOM 1166 C ALA A 86 22.508 -8.730 7.367 1.00 51.01 C ATOM 1167 O ALA A 86 21.287 -8.832 7.484 1.00 73.21 O ATOM 1168 CB ALA A 86 22.722 -10.583 5.701 1.00 54.05 C ATOM 0 H ALA A 86 25.049 -10.119 6.524 1.00 42.03 H new ATOM 0 HA ALA A 86 22.976 -8.496 5.300 1.00 35.42 H new ATOM 0 HB1 ALA A 86 21.640 -10.561 5.571 1.00 54.05 H new ATOM 0 HB2 ALA A 86 23.194 -10.882 4.765 1.00 54.05 H new ATOM 0 HB3 ALA A 86 22.979 -11.299 6.481 1.00 54.05 H new ATOM 1174 N VAL A 87 23.285 -8.215 8.315 1.00 34.40 N ATOM 1175 CA VAL A 87 22.734 -7.730 9.575 1.00 52.34 C ATOM 1176 C VAL A 87 22.638 -6.208 9.582 1.00 30.21 C ATOM 1177 O VAL A 87 21.585 -5.643 9.879 1.00 61.22 O ATOM 1178 CB VAL A 87 23.587 -8.185 10.773 1.00 21.42 C ATOM 1179 CG1 VAL A 87 23.151 -7.469 12.042 1.00 31.43 C ATOM 1180 CG2 VAL A 87 23.500 -9.694 10.946 1.00 71.33 C ATOM 0 H VAL A 87 24.298 -8.123 8.234 1.00 34.40 H new ATOM 0 HA VAL A 87 21.735 -8.155 9.668 1.00 52.34 H new ATOM 0 HB VAL A 87 24.627 -7.924 10.576 1.00 21.42 H new ATOM 0 HG11 VAL A 87 23.765 -7.804 12.878 1.00 31.43 H new ATOM 0 HG12 VAL A 87 23.270 -6.393 11.912 1.00 31.43 H new ATOM 0 HG13 VAL A 87 22.105 -7.696 12.247 1.00 31.43 H new ATOM 0 HG21 VAL A 87 24.109 -9.998 11.797 1.00 71.33 H new ATOM 0 HG22 VAL A 87 22.463 -9.981 11.120 1.00 71.33 H new ATOM 0 HG23 VAL A 87 23.866 -10.185 10.044 1.00 71.33 H new ATOM 1190 N PHE A 88 23.744 -5.550 9.253 1.00 4.43 N ATOM 1191 CA PHE A 88 23.786 -4.092 9.222 1.00 31.34 C ATOM 1192 C PHE A 88 23.890 -3.581 7.788 1.00 32.44 C ATOM 1193 O PHE A 88 23.513 -2.447 7.492 1.00 72.52 O ATOM 1194 CB PHE A 88 24.968 -3.577 10.046 1.00 31.12 C ATOM 1195 CG PHE A 88 25.144 -4.293 11.355 1.00 62.44 C ATOM 1196 CD1 PHE A 88 25.828 -5.497 11.414 1.00 44.12 C ATOM 1197 CD2 PHE A 88 24.626 -3.763 12.525 1.00 25.12 C ATOM 1198 CE1 PHE A 88 25.991 -6.158 12.616 1.00 23.33 C ATOM 1199 CE2 PHE A 88 24.787 -4.420 13.731 1.00 54.12 C ATOM 1200 CZ PHE A 88 25.471 -5.619 13.776 1.00 11.44 C ATOM 0 H PHE A 88 24.624 -6.003 9.004 1.00 4.43 H new ATOM 0 HA PHE A 88 22.859 -3.718 9.656 1.00 31.34 H new ATOM 0 HB2 PHE A 88 25.881 -3.679 9.460 1.00 31.12 H new ATOM 0 HB3 PHE A 88 24.830 -2.513 10.239 1.00 31.12 H new ATOM 0 HD1 PHE A 88 26.238 -5.923 10.510 1.00 44.12 H new ATOM 0 HD2 PHE A 88 24.090 -2.826 12.495 1.00 25.12 H new ATOM 0 HE1 PHE A 88 26.525 -7.096 12.648 1.00 23.33 H new ATOM 0 HE2 PHE A 88 24.378 -3.996 14.636 1.00 54.12 H new ATOM 0 HZ PHE A 88 25.599 -6.134 14.717 1.00 11.44 H new ATOM 1210 N LYS A 89 24.405 -4.426 6.902 1.00 73.44 N ATOM 1211 CA LYS A 89 24.559 -4.063 5.498 1.00 72.21 C ATOM 1212 C LYS A 89 23.690 -4.947 4.609 1.00 61.13 C ATOM 1213 O LYS A 89 24.184 -5.785 3.853 1.00 14.05 O ATOM 1214 CB LYS A 89 26.025 -4.183 5.077 1.00 42.31 C ATOM 1215 CG LYS A 89 27.004 -3.738 6.150 1.00 62.41 C ATOM 1216 CD LYS A 89 26.804 -2.278 6.517 1.00 42.52 C ATOM 1217 CE LYS A 89 27.646 -1.885 7.721 1.00 3.01 C ATOM 1218 NZ LYS A 89 29.058 -1.603 7.342 1.00 5.51 N ATOM 0 H LYS A 89 24.723 -5.368 7.131 1.00 73.44 H new ATOM 0 HA LYS A 89 24.236 -3.029 5.378 1.00 72.21 H new ATOM 0 HB2 LYS A 89 26.235 -5.219 4.813 1.00 42.31 H new ATOM 0 HB3 LYS A 89 26.187 -3.586 4.179 1.00 42.31 H new ATOM 0 HG2 LYS A 89 26.878 -4.358 7.038 1.00 62.41 H new ATOM 0 HG3 LYS A 89 28.024 -3.889 5.798 1.00 62.41 H new ATOM 0 HD2 LYS A 89 27.067 -1.649 5.667 1.00 42.52 H new ATOM 0 HD3 LYS A 89 25.751 -2.097 6.733 1.00 42.52 H new ATOM 0 HE2 LYS A 89 27.214 -1.003 8.194 1.00 3.01 H new ATOM 0 HE3 LYS A 89 27.621 -2.687 8.459 1.00 3.01 H new ATOM 0 HZ1 LYS A 89 29.695 -1.976 8.075 1.00 5.51 H new ATOM 0 HZ2 LYS A 89 29.271 -2.060 6.432 1.00 5.51 H new ATOM 0 HZ3 LYS A 89 29.195 -0.576 7.254 1.00 5.51 H new ATOM 1232 N PRO A 90 22.365 -4.757 4.697 1.00 23.03 N ATOM 1233 CA PRO A 90 21.400 -5.527 3.906 1.00 4.52 C ATOM 1234 C PRO A 90 21.451 -5.171 2.424 1.00 1.23 C ATOM 1235 O PRO A 90 21.705 -4.023 2.059 1.00 51.22 O ATOM 1236 CB PRO A 90 20.050 -5.126 4.506 1.00 23.43 C ATOM 1237 CG PRO A 90 20.282 -3.778 5.096 1.00 44.04 C ATOM 1238 CD PRO A 90 21.707 -3.776 5.576 1.00 2.23 C ATOM 0 HA PRO A 90 21.600 -6.598 3.948 1.00 4.52 H new ATOM 0 HB2 PRO A 90 19.272 -5.096 3.744 1.00 23.43 H new ATOM 0 HB3 PRO A 90 19.726 -5.839 5.264 1.00 23.43 H new ATOM 0 HG2 PRO A 90 20.118 -2.995 4.356 1.00 44.04 H new ATOM 0 HG3 PRO A 90 19.593 -3.588 5.919 1.00 44.04 H new ATOM 0 HD2 PRO A 90 22.160 -2.789 5.486 1.00 2.23 H new ATOM 0 HD3 PRO A 90 21.778 -4.065 6.625 1.00 2.23 H new ATOM 1246 N LYS A 91 21.208 -6.162 1.574 1.00 73.41 N ATOM 1247 CA LYS A 91 21.224 -5.955 0.131 1.00 54.42 C ATOM 1248 C LYS A 91 19.958 -5.239 -0.330 1.00 33.22 C ATOM 1249 O LYS A 91 18.896 -5.851 -0.452 1.00 30.02 O ATOM 1250 CB LYS A 91 21.358 -7.294 -0.597 1.00 25.35 C ATOM 1251 CG LYS A 91 21.375 -7.166 -2.110 1.00 13.21 C ATOM 1252 CD LYS A 91 22.095 -8.335 -2.761 1.00 54.21 C ATOM 1253 CE LYS A 91 21.545 -8.624 -4.150 1.00 22.14 C ATOM 1254 NZ LYS A 91 22.129 -9.865 -4.729 1.00 71.44 N ATOM 0 H LYS A 91 20.997 -7.118 1.860 1.00 73.41 H new ATOM 0 HA LYS A 91 22.083 -5.330 -0.111 1.00 54.42 H new ATOM 0 HB2 LYS A 91 22.276 -7.784 -0.272 1.00 25.35 H new ATOM 0 HB3 LYS A 91 20.531 -7.941 -0.305 1.00 25.35 H new ATOM 0 HG2 LYS A 91 20.352 -7.114 -2.483 1.00 13.21 H new ATOM 0 HG3 LYS A 91 21.865 -6.234 -2.392 1.00 13.21 H new ATOM 0 HD2 LYS A 91 23.161 -8.115 -2.829 1.00 54.21 H new ATOM 0 HD3 LYS A 91 21.991 -9.222 -2.136 1.00 54.21 H new ATOM 0 HE2 LYS A 91 20.461 -8.722 -4.098 1.00 22.14 H new ATOM 0 HE3 LYS A 91 21.758 -7.781 -4.808 1.00 22.14 H new ATOM 0 HZ1 LYS A 91 21.730 -10.028 -5.675 1.00 71.44 H new ATOM 0 HZ2 LYS A 91 23.161 -9.762 -4.802 1.00 71.44 H new ATOM 0 HZ3 LYS A 91 21.905 -10.674 -4.115 1.00 71.44 H new ATOM 1268 N CYS A 92 20.077 -3.941 -0.586 1.00 2.21 N ATOM 1269 CA CYS A 92 18.943 -3.142 -1.034 1.00 42.24 C ATOM 1270 C CYS A 92 19.103 -2.745 -2.499 1.00 74.33 C ATOM 1271 O CYS A 92 20.008 -1.991 -2.853 1.00 63.20 O ATOM 1272 CB CYS A 92 18.801 -1.889 -0.168 1.00 41.31 C ATOM 1273 SG CYS A 92 17.368 -0.848 -0.595 1.00 60.20 S ATOM 0 H CYS A 92 20.948 -3.419 -0.491 1.00 2.21 H new ATOM 0 HA CYS A 92 18.042 -3.748 -0.935 1.00 42.24 H new ATOM 0 HB2 CYS A 92 18.720 -2.190 0.877 1.00 41.31 H new ATOM 0 HB3 CYS A 92 19.709 -1.293 -0.258 1.00 41.31 H new ATOM 1278 N GLU A 93 18.216 -3.259 -3.346 1.00 34.43 N ATOM 1279 CA GLU A 93 18.259 -2.959 -4.772 1.00 32.20 C ATOM 1280 C GLU A 93 16.877 -2.568 -5.288 1.00 11.55 C ATOM 1281 O GLU A 93 15.875 -2.715 -4.587 1.00 62.32 O ATOM 1282 CB GLU A 93 18.784 -4.165 -5.554 1.00 30.11 C ATOM 1283 CG GLU A 93 17.761 -5.276 -5.719 1.00 33.10 C ATOM 1284 CD GLU A 93 18.265 -6.409 -6.592 1.00 1.22 C ATOM 1285 OE1 GLU A 93 19.482 -6.450 -6.867 1.00 43.31 O ATOM 1286 OE2 GLU A 93 17.442 -7.255 -6.999 1.00 54.23 O ATOM 0 H GLU A 93 17.460 -3.885 -3.069 1.00 34.43 H new ATOM 0 HA GLU A 93 18.935 -2.117 -4.919 1.00 32.20 H new ATOM 0 HB2 GLU A 93 19.110 -3.834 -6.540 1.00 30.11 H new ATOM 0 HB3 GLU A 93 19.662 -4.563 -5.045 1.00 30.11 H new ATOM 0 HG2 GLU A 93 17.496 -5.669 -4.738 1.00 33.10 H new ATOM 0 HG3 GLU A 93 16.850 -4.864 -6.154 1.00 33.10 H new ATOM 1293 N LYS A 94 16.831 -2.066 -6.517 1.00 60.43 N ATOM 1294 CA LYS A 94 15.574 -1.653 -7.129 1.00 73.32 C ATOM 1295 C LYS A 94 15.116 -2.669 -8.171 1.00 31.11 C ATOM 1296 O LYS A 94 15.697 -2.768 -9.252 1.00 24.32 O ATOM 1297 CB LYS A 94 15.727 -0.276 -7.778 1.00 12.44 C ATOM 1298 CG LYS A 94 14.945 0.819 -7.072 1.00 72.13 C ATOM 1299 CD LYS A 94 14.968 2.117 -7.861 1.00 12.51 C ATOM 1300 CE LYS A 94 16.387 2.632 -8.046 1.00 61.02 C ATOM 1301 NZ LYS A 94 16.547 4.018 -7.525 1.00 61.13 N ATOM 0 H LYS A 94 17.651 -1.935 -7.110 1.00 60.43 H new ATOM 0 HA LYS A 94 14.819 -1.597 -6.345 1.00 73.32 H new ATOM 0 HB2 LYS A 94 16.783 -0.006 -7.792 1.00 12.44 H new ATOM 0 HB3 LYS A 94 15.399 -0.334 -8.816 1.00 12.44 H new ATOM 0 HG2 LYS A 94 13.913 0.497 -6.930 1.00 72.13 H new ATOM 0 HG3 LYS A 94 15.366 0.987 -6.081 1.00 72.13 H new ATOM 0 HD2 LYS A 94 14.507 1.959 -8.836 1.00 12.51 H new ATOM 0 HD3 LYS A 94 14.371 2.869 -7.344 1.00 12.51 H new ATOM 0 HE2 LYS A 94 17.084 1.969 -7.533 1.00 61.02 H new ATOM 0 HE3 LYS A 94 16.646 2.610 -9.105 1.00 61.02 H new ATOM 0 HZ1 LYS A 94 17.528 4.332 -7.670 1.00 61.13 H new ATOM 0 HZ2 LYS A 94 15.901 4.656 -8.032 1.00 61.13 H new ATOM 0 HZ3 LYS A 94 16.325 4.035 -6.509 1.00 61.13 H new ATOM 1315 N ILE A 95 14.071 -3.420 -7.839 1.00 50.13 N ATOM 1316 CA ILE A 95 13.535 -4.426 -8.748 1.00 14.42 C ATOM 1317 C ILE A 95 12.481 -3.825 -9.672 1.00 71.33 C ATOM 1318 O ILE A 95 11.451 -3.329 -9.217 1.00 24.11 O ATOM 1319 CB ILE A 95 12.913 -5.606 -7.978 1.00 2.23 C ATOM 1320 CG1 ILE A 95 13.990 -6.350 -7.185 1.00 43.34 C ATOM 1321 CG2 ILE A 95 12.206 -6.551 -8.937 1.00 62.05 C ATOM 1322 CD1 ILE A 95 14.249 -5.760 -5.817 1.00 4.32 C ATOM 0 H ILE A 95 13.579 -3.351 -6.948 1.00 50.13 H new ATOM 0 HA ILE A 95 14.372 -4.792 -9.343 1.00 14.42 H new ATOM 0 HB ILE A 95 12.177 -5.215 -7.276 1.00 2.23 H new ATOM 0 HG12 ILE A 95 13.691 -7.392 -7.072 1.00 43.34 H new ATOM 0 HG13 ILE A 95 14.919 -6.345 -7.756 1.00 43.34 H new ATOM 0 HG21 ILE A 95 11.772 -7.380 -8.377 1.00 62.05 H new ATOM 0 HG22 ILE A 95 11.416 -6.013 -9.461 1.00 62.05 H new ATOM 0 HG23 ILE A 95 12.923 -6.938 -9.661 1.00 62.05 H new ATOM 0 HD11 ILE A 95 15.023 -6.338 -5.312 1.00 4.32 H new ATOM 0 HD12 ILE A 95 14.578 -4.726 -5.923 1.00 4.32 H new ATOM 0 HD13 ILE A 95 13.332 -5.790 -5.228 1.00 4.32 H new ATOM 1334 N ASN A 96 12.745 -3.876 -10.974 1.00 4.02 N ATOM 1335 CA ASN A 96 11.819 -3.338 -11.963 1.00 60.15 C ATOM 1336 C ASN A 96 11.515 -1.870 -11.682 1.00 54.22 C ATOM 1337 O ASN A 96 10.465 -1.357 -12.069 1.00 62.41 O ATOM 1338 CB ASN A 96 10.521 -4.148 -11.970 1.00 54.42 C ATOM 1339 CG ASN A 96 9.721 -3.947 -13.243 1.00 70.20 C ATOM 1340 OD1 ASN A 96 10.037 -4.523 -14.285 1.00 14.44 O ATOM 1341 ND2 ASN A 96 8.679 -3.127 -13.164 1.00 62.52 N ATOM 0 H ASN A 96 13.593 -4.284 -11.368 1.00 4.02 H new ATOM 0 HA ASN A 96 12.290 -3.411 -12.943 1.00 60.15 H new ATOM 0 HB2 ASN A 96 10.756 -5.206 -11.855 1.00 54.42 H new ATOM 0 HB3 ASN A 96 9.912 -3.861 -11.112 1.00 54.42 H new ATOM 0 HD21 ASN A 96 8.103 -2.953 -13.988 1.00 62.52 H new ATOM 0 HD22 ASN A 96 8.454 -2.671 -12.279 1.00 62.52 H new ATOM 1348 N GLY A 97 12.441 -1.198 -11.006 1.00 4.21 N ATOM 1349 CA GLY A 97 12.254 0.205 -10.685 1.00 30.04 C ATOM 1350 C GLY A 97 11.568 0.407 -9.348 1.00 41.11 C ATOM 1351 O GLY A 97 11.042 1.484 -9.070 1.00 43.33 O ATOM 0 H GLY A 97 13.318 -1.600 -10.675 1.00 4.21 H new ATOM 0 HA2 GLY A 97 13.223 0.704 -10.672 1.00 30.04 H new ATOM 0 HA3 GLY A 97 11.662 0.678 -11.469 1.00 30.04 H new ATOM 1355 N GLU A 98 11.572 -0.632 -8.519 1.00 61.43 N ATOM 1356 CA GLU A 98 10.943 -0.564 -7.206 1.00 12.43 C ATOM 1357 C GLU A 98 11.970 -0.782 -6.098 1.00 53.04 C ATOM 1358 O GLU A 98 12.578 -1.848 -6.002 1.00 74.33 O ATOM 1359 CB GLU A 98 9.828 -1.605 -7.095 1.00 35.32 C ATOM 1360 CG GLU A 98 8.763 -1.474 -8.171 1.00 32.12 C ATOM 1361 CD GLU A 98 7.775 -2.625 -8.158 1.00 3.32 C ATOM 1362 OE1 GLU A 98 7.497 -3.156 -7.063 1.00 31.04 O ATOM 1363 OE2 GLU A 98 7.281 -2.993 -9.244 1.00 33.53 O ATOM 0 H GLU A 98 12.004 -1.531 -8.734 1.00 61.43 H new ATOM 0 HA GLU A 98 10.514 0.431 -7.089 1.00 12.43 H new ATOM 0 HB2 GLU A 98 10.266 -2.602 -7.149 1.00 35.32 H new ATOM 0 HB3 GLU A 98 9.356 -1.517 -6.116 1.00 35.32 H new ATOM 0 HG2 GLU A 98 8.225 -0.537 -8.032 1.00 32.12 H new ATOM 0 HG3 GLU A 98 9.243 -1.424 -9.148 1.00 32.12 H new ATOM 1370 N ASP A 99 12.158 0.235 -5.265 1.00 52.42 N ATOM 1371 CA ASP A 99 13.110 0.156 -4.164 1.00 24.21 C ATOM 1372 C ASP A 99 12.695 -0.918 -3.163 1.00 3.11 C ATOM 1373 O ASP A 99 11.727 -0.749 -2.423 1.00 33.00 O ATOM 1374 CB ASP A 99 13.224 1.509 -3.461 1.00 1.41 C ATOM 1375 CG ASP A 99 13.357 2.660 -4.439 1.00 1.32 C ATOM 1376 OD1 ASP A 99 14.464 2.850 -4.985 1.00 2.40 O ATOM 1377 OD2 ASP A 99 12.354 3.370 -4.659 1.00 11.43 O ATOM 0 H ASP A 99 11.663 1.125 -5.331 1.00 52.42 H new ATOM 0 HA ASP A 99 14.083 -0.113 -4.576 1.00 24.21 H new ATOM 0 HB2 ASP A 99 12.344 1.666 -2.837 1.00 1.41 H new ATOM 0 HB3 ASP A 99 14.088 1.499 -2.797 1.00 1.41 H new ATOM 1382 N MET A 100 13.434 -2.022 -3.147 1.00 65.30 N ATOM 1383 CA MET A 100 13.143 -3.124 -2.237 1.00 13.43 C ATOM 1384 C MET A 100 14.380 -3.503 -1.429 1.00 35.24 C ATOM 1385 O MET A 100 15.482 -3.030 -1.704 1.00 23.31 O ATOM 1386 CB MET A 100 12.636 -4.338 -3.017 1.00 64.11 C ATOM 1387 CG MET A 100 11.639 -3.986 -4.109 1.00 64.32 C ATOM 1388 SD MET A 100 10.203 -5.076 -4.115 1.00 54.42 S ATOM 1389 CE MET A 100 10.859 -6.497 -4.985 1.00 51.14 C ATOM 0 H MET A 100 14.239 -2.178 -3.754 1.00 65.30 H new ATOM 0 HA MET A 100 12.366 -2.796 -1.546 1.00 13.43 H new ATOM 0 HB2 MET A 100 13.486 -4.853 -3.465 1.00 64.11 H new ATOM 0 HB3 MET A 100 12.170 -5.037 -2.323 1.00 64.11 H new ATOM 0 HG2 MET A 100 11.308 -2.956 -3.975 1.00 64.32 H new ATOM 0 HG3 MET A 100 12.134 -4.038 -5.079 1.00 64.32 H new ATOM 0 HE1 MET A 100 10.411 -7.407 -4.585 1.00 51.14 H new ATOM 0 HE2 MET A 100 10.625 -6.414 -6.046 1.00 51.14 H new ATOM 0 HE3 MET A 100 11.940 -6.537 -4.854 1.00 51.14 H new ATOM 1399 N VAL A 101 14.189 -4.360 -0.430 1.00 12.50 N ATOM 1400 CA VAL A 101 15.289 -4.803 0.417 1.00 22.15 C ATOM 1401 C VAL A 101 15.322 -6.323 0.525 1.00 73.51 C ATOM 1402 O VAL A 101 14.294 -6.988 0.392 1.00 53.21 O ATOM 1403 CB VAL A 101 15.186 -4.202 1.832 1.00 42.53 C ATOM 1404 CG1 VAL A 101 14.964 -2.699 1.758 1.00 53.41 C ATOM 1405 CG2 VAL A 101 14.072 -4.876 2.617 1.00 14.11 C ATOM 0 H VAL A 101 13.283 -4.761 -0.188 1.00 12.50 H new ATOM 0 HA VAL A 101 16.209 -4.454 -0.052 1.00 22.15 H new ATOM 0 HB VAL A 101 16.126 -4.381 2.354 1.00 42.53 H new ATOM 0 HG11 VAL A 101 14.894 -2.292 2.767 1.00 53.41 H new ATOM 0 HG12 VAL A 101 15.800 -2.233 1.236 1.00 53.41 H new ATOM 0 HG13 VAL A 101 14.039 -2.494 1.219 1.00 53.41 H new ATOM 0 HG21 VAL A 101 14.014 -4.439 3.614 1.00 14.11 H new ATOM 0 HG22 VAL A 101 13.123 -4.730 2.101 1.00 14.11 H new ATOM 0 HG23 VAL A 101 14.279 -5.943 2.700 1.00 14.11 H new ATOM 1415 N TYR A 102 16.509 -6.868 0.767 1.00 73.51 N ATOM 1416 CA TYR A 102 16.676 -8.312 0.891 1.00 41.44 C ATOM 1417 C TYR A 102 16.940 -8.707 2.340 1.00 24.12 C ATOM 1418 O TYR A 102 17.648 -8.009 3.068 1.00 62.24 O ATOM 1419 CB TYR A 102 17.825 -8.791 0.002 1.00 42.21 C ATOM 1420 CG TYR A 102 17.423 -9.020 -1.437 1.00 75.23 C ATOM 1421 CD1 TYR A 102 16.665 -10.128 -1.799 1.00 41.41 C ATOM 1422 CD2 TYR A 102 17.800 -8.131 -2.435 1.00 41.54 C ATOM 1423 CE1 TYR A 102 16.295 -10.342 -3.113 1.00 4.21 C ATOM 1424 CE2 TYR A 102 17.434 -8.336 -3.751 1.00 54.14 C ATOM 1425 CZ TYR A 102 16.682 -9.443 -4.085 1.00 54.11 C ATOM 1426 OH TYR A 102 16.316 -9.652 -5.395 1.00 52.22 O ATOM 0 H TYR A 102 17.370 -6.332 0.881 1.00 73.51 H new ATOM 0 HA TYR A 102 15.751 -8.789 0.567 1.00 41.44 H new ATOM 0 HB2 TYR A 102 18.628 -8.055 0.033 1.00 42.21 H new ATOM 0 HB3 TYR A 102 18.227 -9.719 0.410 1.00 42.21 H new ATOM 0 HD1 TYR A 102 16.360 -10.833 -1.040 1.00 41.41 H new ATOM 0 HD2 TYR A 102 18.390 -7.264 -2.178 1.00 41.54 H new ATOM 0 HE1 TYR A 102 15.706 -11.208 -3.377 1.00 4.21 H new ATOM 0 HE2 TYR A 102 17.735 -7.634 -4.514 1.00 54.14 H new ATOM 0 HH TYR A 102 16.668 -8.927 -5.953 1.00 52.22 H new ATOM 1436 N LEU A 103 16.367 -9.832 2.753 1.00 1.03 N ATOM 1437 CA LEU A 103 16.540 -10.323 4.116 1.00 20.10 C ATOM 1438 C LEU A 103 17.265 -11.665 4.123 1.00 22.03 C ATOM 1439 O LEU A 103 17.290 -12.390 3.129 1.00 64.24 O ATOM 1440 CB LEU A 103 15.182 -10.461 4.806 1.00 54.13 C ATOM 1441 CG LEU A 103 14.058 -11.063 3.961 1.00 20.02 C ATOM 1442 CD1 LEU A 103 13.496 -10.025 3.002 1.00 24.10 C ATOM 1443 CD2 LEU A 103 14.558 -12.281 3.199 1.00 62.23 C ATOM 0 H LEU A 103 15.779 -10.421 2.164 1.00 1.03 H new ATOM 0 HA LEU A 103 17.146 -9.600 4.662 1.00 20.10 H new ATOM 0 HB2 LEU A 103 15.310 -11.077 5.696 1.00 54.13 H new ATOM 0 HB3 LEU A 103 14.867 -9.474 5.144 1.00 54.13 H new ATOM 0 HG LEU A 103 13.257 -11.381 4.629 1.00 20.02 H new ATOM 0 HD11 LEU A 103 12.698 -10.472 2.409 1.00 24.10 H new ATOM 0 HD12 LEU A 103 13.099 -9.183 3.569 1.00 24.10 H new ATOM 0 HD13 LEU A 103 14.288 -9.676 2.339 1.00 24.10 H new ATOM 0 HD21 LEU A 103 13.745 -12.696 2.603 1.00 62.23 H new ATOM 0 HD22 LEU A 103 15.377 -11.988 2.542 1.00 62.23 H new ATOM 0 HD23 LEU A 103 14.911 -13.032 3.905 1.00 62.23 H new ATOM 1455 N PRO A 104 17.868 -12.006 5.272 1.00 70.01 N ATOM 1456 CA PRO A 104 18.602 -13.264 5.438 1.00 44.15 C ATOM 1457 C PRO A 104 17.679 -14.477 5.448 1.00 31.20 C ATOM 1458 O PRO A 104 16.498 -14.368 5.778 1.00 1.41 O ATOM 1459 CB PRO A 104 19.285 -13.100 6.798 1.00 40.43 C ATOM 1460 CG PRO A 104 18.430 -12.128 7.536 1.00 43.14 C ATOM 1461 CD PRO A 104 17.879 -11.190 6.498 1.00 74.13 C ATOM 0 HA PRO A 104 19.296 -13.442 4.616 1.00 44.15 H new ATOM 0 HB2 PRO A 104 19.349 -14.051 7.326 1.00 40.43 H new ATOM 0 HB3 PRO A 104 20.303 -12.727 6.687 1.00 40.43 H new ATOM 0 HG2 PRO A 104 17.626 -12.639 8.066 1.00 43.14 H new ATOM 0 HG3 PRO A 104 19.010 -11.586 8.283 1.00 43.14 H new ATOM 0 HD2 PRO A 104 16.879 -10.844 6.759 1.00 74.13 H new ATOM 0 HD3 PRO A 104 18.504 -10.304 6.385 1.00 74.13 H new ATOM 1469 N SER A 105 18.225 -15.634 5.085 1.00 15.42 N ATOM 1470 CA SER A 105 17.448 -16.867 5.050 1.00 61.52 C ATOM 1471 C SER A 105 17.703 -17.706 6.299 1.00 44.05 C ATOM 1472 O SER A 105 18.527 -17.349 7.142 1.00 74.32 O ATOM 1473 CB SER A 105 17.794 -17.677 3.799 1.00 42.04 C ATOM 1474 OG SER A 105 17.510 -16.942 2.621 1.00 74.12 O ATOM 0 H SER A 105 19.202 -15.743 4.811 1.00 15.42 H new ATOM 0 HA SER A 105 16.391 -16.601 5.022 1.00 61.52 H new ATOM 0 HB2 SER A 105 18.850 -17.947 3.817 1.00 42.04 H new ATOM 0 HB3 SER A 105 17.227 -18.608 3.796 1.00 42.04 H new ATOM 0 HG SER A 105 17.741 -17.481 1.836 1.00 74.12 H new ATOM 1480 N TYR A 106 16.992 -18.822 6.410 1.00 53.05 N ATOM 1481 CA TYR A 106 17.138 -19.711 7.556 1.00 62.12 C ATOM 1482 C TYR A 106 18.602 -20.085 7.772 1.00 14.51 C ATOM 1483 O TYR A 106 19.045 -20.270 8.905 1.00 53.41 O ATOM 1484 CB TYR A 106 16.302 -20.976 7.357 1.00 74.12 C ATOM 1485 CG TYR A 106 16.892 -21.941 6.353 1.00 11.13 C ATOM 1486 CD1 TYR A 106 16.874 -21.656 4.993 1.00 30.33 C ATOM 1487 CD2 TYR A 106 17.467 -23.137 6.765 1.00 74.04 C ATOM 1488 CE1 TYR A 106 17.411 -22.535 4.073 1.00 44.05 C ATOM 1489 CE2 TYR A 106 18.008 -24.021 5.851 1.00 13.22 C ATOM 1490 CZ TYR A 106 17.978 -23.716 4.506 1.00 14.55 C ATOM 1491 OH TYR A 106 18.514 -24.594 3.593 1.00 3.03 O ATOM 0 H TYR A 106 16.308 -19.133 5.720 1.00 53.05 H new ATOM 0 HA TYR A 106 16.781 -19.183 8.441 1.00 62.12 H new ATOM 0 HB2 TYR A 106 16.193 -21.484 8.315 1.00 74.12 H new ATOM 0 HB3 TYR A 106 15.301 -20.692 7.031 1.00 74.12 H new ATOM 0 HD1 TYR A 106 16.433 -20.732 4.650 1.00 30.33 H new ATOM 0 HD2 TYR A 106 17.492 -23.380 7.817 1.00 74.04 H new ATOM 0 HE1 TYR A 106 17.387 -22.299 3.019 1.00 44.05 H new ATOM 0 HE2 TYR A 106 18.452 -24.946 6.188 1.00 13.22 H new ATOM 0 HH TYR A 106 18.873 -25.375 4.063 1.00 3.03 H new ATOM 1501 N GLU A 107 19.346 -20.192 6.676 1.00 22.51 N ATOM 1502 CA GLU A 107 20.760 -20.544 6.745 1.00 12.24 C ATOM 1503 C GLU A 107 21.550 -19.475 7.494 1.00 1.52 C ATOM 1504 O GLU A 107 22.200 -19.759 8.500 1.00 40.42 O ATOM 1505 CB GLU A 107 21.333 -20.725 5.338 1.00 34.22 C ATOM 1506 CG GLU A 107 21.260 -22.156 4.831 1.00 3.33 C ATOM 1507 CD GLU A 107 22.599 -22.668 4.337 1.00 41.23 C ATOM 1508 OE1 GLU A 107 23.195 -22.016 3.454 1.00 71.22 O ATOM 1509 OE2 GLU A 107 23.051 -23.721 4.834 1.00 41.24 O ATOM 0 H GLU A 107 18.994 -20.040 5.731 1.00 22.51 H new ATOM 0 HA GLU A 107 20.848 -21.485 7.289 1.00 12.24 H new ATOM 0 HB2 GLU A 107 20.793 -20.076 4.649 1.00 34.22 H new ATOM 0 HB3 GLU A 107 22.373 -20.399 5.334 1.00 34.22 H new ATOM 0 HG2 GLU A 107 20.900 -22.803 5.631 1.00 3.33 H new ATOM 0 HG3 GLU A 107 20.532 -22.214 4.022 1.00 3.33 H new ATOM 1516 N MET A 108 21.489 -18.244 6.995 1.00 21.25 N ATOM 1517 CA MET A 108 22.198 -17.132 7.617 1.00 3.12 C ATOM 1518 C MET A 108 21.851 -17.026 9.099 1.00 53.33 C ATOM 1519 O MET A 108 22.728 -16.827 9.940 1.00 52.11 O ATOM 1520 CB MET A 108 21.858 -15.821 6.906 1.00 10.22 C ATOM 1521 CG MET A 108 22.447 -15.717 5.509 1.00 51.42 C ATOM 1522 SD MET A 108 22.040 -14.158 4.698 1.00 62.30 S ATOM 1523 CE MET A 108 23.674 -13.467 4.454 1.00 64.01 C ATOM 0 H MET A 108 20.956 -17.992 6.162 1.00 21.25 H new ATOM 0 HA MET A 108 23.268 -17.319 7.526 1.00 3.12 H new ATOM 0 HB2 MET A 108 20.774 -15.722 6.843 1.00 10.22 H new ATOM 0 HB3 MET A 108 22.220 -14.987 7.507 1.00 10.22 H new ATOM 0 HG2 MET A 108 23.531 -15.820 5.567 1.00 51.42 H new ATOM 0 HG3 MET A 108 22.080 -16.545 4.902 1.00 51.42 H new ATOM 0 HE1 MET A 108 23.625 -12.670 3.712 1.00 64.01 H new ATOM 0 HE2 MET A 108 24.043 -13.063 5.397 1.00 64.01 H new ATOM 0 HE3 MET A 108 24.350 -14.247 4.104 1.00 64.01 H new ATOM 1533 N CYS A 109 20.566 -17.159 9.411 1.00 2.15 N ATOM 1534 CA CYS A 109 20.102 -17.077 10.791 1.00 21.21 C ATOM 1535 C CYS A 109 20.481 -18.335 11.568 1.00 44.40 C ATOM 1536 O CYS A 109 20.562 -18.317 12.796 1.00 30.13 O ATOM 1537 CB CYS A 109 18.586 -16.878 10.830 1.00 34.41 C ATOM 1538 SG CYS A 109 18.017 -15.750 12.143 1.00 62.14 S ATOM 0 H CYS A 109 19.828 -17.324 8.727 1.00 2.15 H new ATOM 0 HA CYS A 109 20.586 -16.221 11.261 1.00 21.21 H new ATOM 0 HB2 CYS A 109 18.256 -16.491 9.866 1.00 34.41 H new ATOM 0 HB3 CYS A 109 18.106 -17.847 10.966 1.00 34.41 H new ATOM 1543 N ARG A 110 20.713 -19.424 10.843 1.00 45.11 N ATOM 1544 CA ARG A 110 21.083 -20.690 11.463 1.00 24.34 C ATOM 1545 C ARG A 110 22.514 -20.639 11.993 1.00 73.14 C ATOM 1546 O ARG A 110 22.828 -21.243 13.019 1.00 41.04 O ATOM 1547 CB ARG A 110 20.940 -21.836 10.459 1.00 4.44 C ATOM 1548 CG ARG A 110 19.663 -22.641 10.632 1.00 53.43 C ATOM 1549 CD ARG A 110 19.947 -24.021 11.203 1.00 13.23 C ATOM 1550 NE ARG A 110 18.719 -24.737 11.540 1.00 3.24 N ATOM 1551 CZ ARG A 110 18.694 -26.000 11.952 1.00 44.34 C ATOM 1552 NH1 ARG A 110 19.824 -26.682 12.076 1.00 23.04 N ATOM 1553 NH2 ARG A 110 17.538 -26.582 12.240 1.00 74.34 N ATOM 0 H ARG A 110 20.651 -19.455 9.825 1.00 45.11 H new ATOM 0 HA ARG A 110 20.409 -20.865 12.302 1.00 24.34 H new ATOM 0 HB2 ARG A 110 20.968 -21.428 9.449 1.00 4.44 H new ATOM 0 HB3 ARG A 110 21.796 -22.503 10.558 1.00 4.44 H new ATOM 0 HG2 ARG A 110 18.981 -22.106 11.293 1.00 53.43 H new ATOM 0 HG3 ARG A 110 19.161 -22.741 9.669 1.00 53.43 H new ATOM 0 HD2 ARG A 110 20.519 -24.602 10.479 1.00 13.23 H new ATOM 0 HD3 ARG A 110 20.566 -23.924 12.095 1.00 13.23 H new ATOM 0 HE ARG A 110 17.832 -24.240 11.454 1.00 3.24 H new ATOM 0 HH11 ARG A 110 20.715 -26.237 11.855 1.00 23.04 H new ATOM 0 HH12 ARG A 110 19.802 -27.651 12.392 1.00 23.04 H new ATOM 0 HH21 ARG A 110 16.667 -26.060 12.145 1.00 74.34 H new ATOM 0 HH22 ARG A 110 17.520 -27.552 12.556 1.00 74.34 H new ATOM 1567 N ILE A 111 23.375 -19.915 11.286 1.00 70.44 N ATOM 1568 CA ILE A 111 24.771 -19.785 11.685 1.00 71.45 C ATOM 1569 C ILE A 111 24.889 -19.212 13.093 1.00 61.43 C ATOM 1570 O ILE A 111 25.899 -19.405 13.771 1.00 12.42 O ATOM 1571 CB ILE A 111 25.554 -18.887 10.709 1.00 12.43 C ATOM 1572 CG1 ILE A 111 25.222 -19.257 9.262 1.00 0.42 C ATOM 1573 CG2 ILE A 111 27.049 -19.006 10.963 1.00 61.31 C ATOM 1574 CD1 ILE A 111 25.362 -20.734 8.969 1.00 42.10 C ATOM 0 H ILE A 111 23.131 -19.410 10.434 1.00 70.44 H new ATOM 0 HA ILE A 111 25.199 -20.787 11.667 1.00 71.45 H new ATOM 0 HB ILE A 111 25.259 -17.851 10.875 1.00 12.43 H new ATOM 0 HG12 ILE A 111 24.201 -18.946 9.041 1.00 0.42 H new ATOM 0 HG13 ILE A 111 25.877 -18.698 8.593 1.00 0.42 H new ATOM 0 HG21 ILE A 111 27.589 -18.366 10.265 1.00 61.31 H new ATOM 0 HG22 ILE A 111 27.270 -18.697 11.985 1.00 61.31 H new ATOM 0 HG23 ILE A 111 27.361 -20.041 10.821 1.00 61.31 H new ATOM 0 HD11 ILE A 111 25.111 -20.923 7.925 1.00 42.10 H new ATOM 0 HD12 ILE A 111 26.389 -21.047 9.158 1.00 42.10 H new ATOM 0 HD13 ILE A 111 24.687 -21.298 9.613 1.00 42.10 H new ATOM 1586 N THR A 112 23.849 -18.508 13.529 1.00 60.25 N ATOM 1587 CA THR A 112 23.835 -17.907 14.856 1.00 21.43 C ATOM 1588 C THR A 112 23.194 -18.842 15.876 1.00 41.11 C ATOM 1589 O THR A 112 23.643 -18.931 17.018 1.00 23.11 O ATOM 1590 CB THR A 112 23.077 -16.566 14.858 1.00 22.42 C ATOM 1591 OG1 THR A 112 21.686 -16.790 14.603 1.00 40.43 O ATOM 1592 CG2 THR A 112 23.645 -15.622 13.810 1.00 65.13 C ATOM 0 H THR A 112 23.005 -18.340 12.981 1.00 60.25 H new ATOM 0 HA THR A 112 24.874 -17.728 15.133 1.00 21.43 H new ATOM 0 HB THR A 112 23.197 -16.107 15.839 1.00 22.42 H new ATOM 0 HG1 THR A 112 21.579 -17.229 13.733 1.00 40.43 H new ATOM 0 HG21 THR A 112 23.094 -14.682 13.830 1.00 65.13 H new ATOM 0 HG22 THR A 112 24.697 -15.431 14.024 1.00 65.13 H new ATOM 0 HG23 THR A 112 23.552 -16.076 12.823 1.00 65.13 H new ATOM 1600 N MET A 113 22.143 -19.537 15.455 1.00 35.23 N ATOM 1601 CA MET A 113 21.441 -20.467 16.333 1.00 61.12 C ATOM 1602 C MET A 113 22.291 -21.705 16.604 1.00 53.40 C ATOM 1603 O MET A 113 22.206 -22.303 17.676 1.00 72.45 O ATOM 1604 CB MET A 113 20.104 -20.878 15.712 1.00 5.21 C ATOM 1605 CG MET A 113 20.211 -22.069 14.774 1.00 34.31 C ATOM 1606 SD MET A 113 18.616 -22.560 14.091 1.00 54.52 S ATOM 1607 CE MET A 113 18.028 -20.995 13.447 1.00 14.24 C ATOM 0 H MET A 113 21.758 -19.474 14.512 1.00 35.23 H new ATOM 0 HA MET A 113 21.253 -19.962 17.280 1.00 61.12 H new ATOM 0 HB2 MET A 113 19.400 -21.116 16.509 1.00 5.21 H new ATOM 0 HB3 MET A 113 19.691 -20.031 15.165 1.00 5.21 H new ATOM 0 HG2 MET A 113 20.891 -21.824 13.958 1.00 34.31 H new ATOM 0 HG3 MET A 113 20.647 -22.911 15.311 1.00 34.31 H new ATOM 0 HE1 MET A 113 17.553 -21.155 12.479 1.00 14.24 H new ATOM 0 HE2 MET A 113 17.304 -20.566 14.140 1.00 14.24 H new ATOM 0 HE3 MET A 113 18.868 -20.311 13.330 1.00 14.24 H new ATOM 1617 N GLU A 114 23.109 -22.082 15.626 1.00 14.50 N ATOM 1618 CA GLU A 114 23.972 -23.249 15.761 1.00 41.23 C ATOM 1619 C GLU A 114 24.659 -23.263 17.123 1.00 4.21 C ATOM 1620 O GLU A 114 24.478 -24.176 17.929 1.00 54.21 O ATOM 1621 CB GLU A 114 25.022 -23.265 14.648 1.00 72.35 C ATOM 1622 CG GLU A 114 24.841 -24.403 13.657 1.00 30.53 C ATOM 1623 CD GLU A 114 26.154 -24.873 13.062 1.00 41.34 C ATOM 1624 OE1 GLU A 114 27.008 -24.015 12.757 1.00 4.41 O ATOM 1625 OE2 GLU A 114 26.327 -26.099 12.900 1.00 21.14 O ATOM 0 H GLU A 114 23.192 -21.597 14.733 1.00 14.50 H new ATOM 0 HA GLU A 114 23.350 -24.141 15.678 1.00 41.23 H new ATOM 0 HB2 GLU A 114 24.984 -22.317 14.111 1.00 72.35 H new ATOM 0 HB3 GLU A 114 26.013 -23.339 15.096 1.00 72.35 H new ATOM 0 HG2 GLU A 114 24.352 -25.240 14.156 1.00 30.53 H new ATOM 0 HG3 GLU A 114 24.178 -24.079 12.855 1.00 30.53 H new ATOM 1632 N PRO A 115 25.469 -22.227 17.388 1.00 42.25 N ATOM 1633 CA PRO A 115 26.200 -22.096 18.651 1.00 24.03 C ATOM 1634 C PRO A 115 25.276 -21.800 19.828 1.00 64.52 C ATOM 1635 O PRO A 115 24.827 -22.713 20.522 1.00 4.22 O ATOM 1636 CB PRO A 115 27.138 -20.913 18.398 1.00 63.23 C ATOM 1637 CG PRO A 115 26.461 -20.113 17.340 1.00 52.43 C ATOM 1638 CD PRO A 115 25.733 -21.103 16.473 1.00 11.14 C ATOM 0 HA PRO A 115 26.717 -23.017 18.920 1.00 24.03 H new ATOM 0 HB2 PRO A 115 27.288 -20.325 19.304 1.00 63.23 H new ATOM 0 HB3 PRO A 115 28.122 -21.250 18.071 1.00 63.23 H new ATOM 0 HG2 PRO A 115 25.768 -19.394 17.778 1.00 52.43 H new ATOM 0 HG3 PRO A 115 27.186 -19.543 16.758 1.00 52.43 H new ATOM 0 HD2 PRO A 115 24.809 -20.684 16.073 1.00 11.14 H new ATOM 0 HD3 PRO A 115 26.338 -21.412 15.621 1.00 11.14 H new ATOM 1646 N CYS A 116 24.995 -20.520 20.046 1.00 25.24 N ATOM 1647 CA CYS A 116 24.125 -20.104 21.139 1.00 53.31 C ATOM 1648 C CYS A 116 22.693 -20.576 20.903 1.00 13.44 C ATOM 1649 O CYS A 116 21.897 -19.885 20.266 1.00 5.33 O ATOM 1650 CB CYS A 116 24.153 -18.581 21.290 1.00 64.43 C ATOM 1651 SG CYS A 116 25.830 -17.876 21.397 1.00 34.33 S ATOM 0 H CYS A 116 25.357 -19.753 19.480 1.00 25.24 H new ATOM 0 HA CYS A 116 24.493 -20.560 22.058 1.00 53.31 H new ATOM 0 HB2 CYS A 116 23.635 -18.133 20.442 1.00 64.43 H new ATOM 0 HB3 CYS A 116 23.596 -18.305 22.186 1.00 64.43 H new ATOM 1656 N ARG A 117 22.372 -21.756 21.422 1.00 31.40 N ATOM 1657 CA ARG A 117 21.037 -22.321 21.268 1.00 72.33 C ATOM 1658 C ARG A 117 20.052 -21.659 22.227 1.00 50.35 C ATOM 1659 O ARG A 117 18.839 -21.710 22.019 1.00 2.23 O ATOM 1660 CB ARG A 117 21.067 -23.831 21.514 1.00 41.14 C ATOM 1661 CG ARG A 117 19.688 -24.451 21.669 1.00 51.53 C ATOM 1662 CD ARG A 117 19.762 -25.968 21.726 1.00 23.33 C ATOM 1663 NE ARG A 117 19.068 -26.593 20.604 1.00 34.31 N ATOM 1664 CZ ARG A 117 17.748 -26.568 20.450 1.00 44.40 C ATOM 1665 NH1 ARG A 117 16.985 -25.951 21.342 1.00 44.54 N ATOM 1666 NH2 ARG A 117 17.190 -27.159 19.402 1.00 70.51 N ATOM 0 H ARG A 117 23.018 -22.340 21.953 1.00 31.40 H new ATOM 0 HA ARG A 117 20.706 -22.132 20.247 1.00 72.33 H new ATOM 0 HB2 ARG A 117 21.583 -24.315 20.685 1.00 41.14 H new ATOM 0 HB3 ARG A 117 21.650 -24.033 22.413 1.00 41.14 H new ATOM 0 HG2 ARG A 117 19.219 -24.074 22.578 1.00 51.53 H new ATOM 0 HG3 ARG A 117 19.056 -24.148 20.835 1.00 51.53 H new ATOM 0 HD2 ARG A 117 20.806 -26.280 21.725 1.00 23.33 H new ATOM 0 HD3 ARG A 117 19.326 -26.317 22.662 1.00 23.33 H new ATOM 0 HE ARG A 117 19.627 -27.075 19.900 1.00 34.31 H new ATOM 0 HH11 ARG A 117 17.411 -25.494 22.148 1.00 44.54 H new ATOM 0 HH12 ARG A 117 15.972 -25.933 21.222 1.00 44.54 H new ATOM 0 HH21 ARG A 117 17.774 -27.633 18.713 1.00 70.51 H new ATOM 0 HH22 ARG A 117 16.177 -27.139 19.285 1.00 70.51 H new ATOM 1680 N ILE A 118 20.582 -21.038 23.275 1.00 32.33 N ATOM 1681 CA ILE A 118 19.750 -20.366 24.265 1.00 55.41 C ATOM 1682 C ILE A 118 18.878 -19.296 23.615 1.00 62.10 C ATOM 1683 O ILE A 118 17.863 -18.881 24.176 1.00 3.11 O ATOM 1684 CB ILE A 118 20.603 -19.715 25.370 1.00 50.15 C ATOM 1685 CG1 ILE A 118 21.487 -20.765 26.046 1.00 10.42 C ATOM 1686 CG2 ILE A 118 19.711 -19.027 26.392 1.00 31.01 C ATOM 1687 CD1 ILE A 118 20.710 -21.926 26.626 1.00 1.32 C ATOM 0 H ILE A 118 21.584 -20.986 23.460 1.00 32.33 H new ATOM 0 HA ILE A 118 19.113 -21.129 24.712 1.00 55.41 H new ATOM 0 HB ILE A 118 21.248 -18.963 24.916 1.00 50.15 H new ATOM 0 HG12 ILE A 118 22.205 -21.146 25.320 1.00 10.42 H new ATOM 0 HG13 ILE A 118 22.060 -20.288 26.841 1.00 10.42 H new ATOM 0 HG21 ILE A 118 20.329 -18.572 27.166 1.00 31.01 H new ATOM 0 HG22 ILE A 118 19.121 -18.255 25.898 1.00 31.01 H new ATOM 0 HG23 ILE A 118 19.044 -19.760 26.845 1.00 31.01 H new ATOM 0 HD11 ILE A 118 21.401 -22.631 27.089 1.00 1.32 H new ATOM 0 HD12 ILE A 118 20.011 -21.557 27.376 1.00 1.32 H new ATOM 0 HD13 ILE A 118 20.158 -22.428 25.831 1.00 1.32 H new ATOM 1699 N LEU A 119 19.280 -18.855 22.428 1.00 14.10 N ATOM 1700 CA LEU A 119 18.534 -17.834 21.699 1.00 25.41 C ATOM 1701 C LEU A 119 17.561 -18.471 20.712 1.00 24.42 C ATOM 1702 O LEU A 119 17.263 -17.901 19.663 1.00 45.15 O ATOM 1703 CB LEU A 119 19.496 -16.905 20.957 1.00 64.24 C ATOM 1704 CG LEU A 119 20.174 -15.826 21.802 1.00 23.40 C ATOM 1705 CD1 LEU A 119 19.134 -14.947 22.478 1.00 5.44 C ATOM 1706 CD2 LEU A 119 21.094 -16.459 22.836 1.00 44.10 C ATOM 0 H LEU A 119 20.117 -19.188 21.950 1.00 14.10 H new ATOM 0 HA LEU A 119 17.961 -17.252 22.421 1.00 25.41 H new ATOM 0 HB2 LEU A 119 20.271 -17.514 20.492 1.00 64.24 H new ATOM 0 HB3 LEU A 119 18.948 -16.416 20.151 1.00 64.24 H new ATOM 0 HG LEU A 119 20.776 -15.200 21.144 1.00 23.40 H new ATOM 0 HD11 LEU A 119 19.635 -14.185 23.075 1.00 5.44 H new ATOM 0 HD12 LEU A 119 18.516 -14.466 21.720 1.00 5.44 H new ATOM 0 HD13 LEU A 119 18.505 -15.559 23.124 1.00 5.44 H new ATOM 0 HD21 LEU A 119 21.568 -15.677 23.429 1.00 44.10 H new ATOM 0 HD22 LEU A 119 20.513 -17.108 23.491 1.00 44.10 H new ATOM 0 HD23 LEU A 119 21.861 -17.046 22.330 1.00 44.10 H new ATOM 1718 N TYR A 120 17.068 -19.655 21.057 1.00 71.50 N ATOM 1719 CA TYR A 120 16.128 -20.370 20.201 1.00 22.44 C ATOM 1720 C TYR A 120 15.023 -19.440 19.710 1.00 62.54 C ATOM 1721 O TYR A 120 14.511 -19.598 18.602 1.00 20.53 O ATOM 1722 CB TYR A 120 15.517 -21.553 20.956 1.00 42.54 C ATOM 1723 CG TYR A 120 15.453 -21.348 22.452 1.00 12.13 C ATOM 1724 CD1 TYR A 120 14.557 -20.445 23.012 1.00 41.33 C ATOM 1725 CD2 TYR A 120 16.288 -22.057 23.307 1.00 51.40 C ATOM 1726 CE1 TYR A 120 14.495 -20.254 24.379 1.00 41.35 C ATOM 1727 CE2 TYR A 120 16.232 -21.873 24.675 1.00 32.20 C ATOM 1728 CZ TYR A 120 15.334 -20.971 25.206 1.00 40.31 C ATOM 1729 OH TYR A 120 15.276 -20.784 26.568 1.00 20.11 O ATOM 0 H TYR A 120 17.303 -20.140 21.923 1.00 71.50 H new ATOM 0 HA TYR A 120 16.675 -20.743 19.335 1.00 22.44 H new ATOM 0 HB2 TYR A 120 14.510 -21.733 20.579 1.00 42.54 H new ATOM 0 HB3 TYR A 120 16.101 -22.449 20.745 1.00 42.54 H new ATOM 0 HD1 TYR A 120 13.898 -19.883 22.367 1.00 41.33 H new ATOM 0 HD2 TYR A 120 16.993 -22.764 22.895 1.00 51.40 H new ATOM 0 HE1 TYR A 120 13.794 -19.547 24.797 1.00 41.35 H new ATOM 0 HE2 TYR A 120 16.888 -22.433 25.325 1.00 32.20 H new ATOM 0 HH TYR A 120 15.932 -21.366 27.006 1.00 20.11 H new ATOM 1739 N ASN A 121 14.662 -18.470 20.542 1.00 13.42 N ATOM 1740 CA ASN A 121 13.618 -17.513 20.193 1.00 14.04 C ATOM 1741 C ASN A 121 13.404 -16.507 21.320 1.00 55.41 C ATOM 1742 O ASN A 121 13.075 -15.345 21.076 1.00 3.24 O ATOM 1743 CB ASN A 121 12.308 -18.244 19.891 1.00 13.44 C ATOM 1744 CG ASN A 121 12.039 -19.375 20.865 1.00 13.42 C ATOM 1745 OD1 ASN A 121 12.196 -20.548 20.529 1.00 34.50 O ATOM 1746 ND2 ASN A 121 11.631 -19.025 22.080 1.00 50.03 N ATOM 0 H ASN A 121 15.076 -18.325 21.463 1.00 13.42 H new ATOM 0 HA ASN A 121 13.938 -16.972 19.303 1.00 14.04 H new ATOM 0 HB2 ASN A 121 11.482 -17.533 19.926 1.00 13.44 H new ATOM 0 HB3 ASN A 121 12.343 -18.642 18.877 1.00 13.44 H new ATOM 0 HD21 ASN A 121 11.434 -19.742 22.778 1.00 50.03 H new ATOM 0 HD22 ASN A 121 11.515 -18.039 22.315 1.00 50.03 H new ATOM 1753 N THR A 122 13.592 -16.960 22.555 1.00 22.33 N ATOM 1754 CA THR A 122 13.420 -16.101 23.720 1.00 75.12 C ATOM 1755 C THR A 122 14.163 -14.782 23.545 1.00 53.34 C ATOM 1756 O THR A 122 15.184 -14.718 22.860 1.00 65.20 O ATOM 1757 CB THR A 122 13.916 -16.790 25.005 1.00 72.11 C ATOM 1758 OG1 THR A 122 13.788 -15.900 26.119 1.00 53.30 O ATOM 1759 CG2 THR A 122 15.367 -17.224 24.860 1.00 34.24 C ATOM 0 H THR A 122 13.864 -17.918 22.775 1.00 22.33 H new ATOM 0 HA THR A 122 12.352 -15.904 23.812 1.00 75.12 H new ATOM 0 HB THR A 122 13.304 -17.675 25.176 1.00 72.11 H new ATOM 0 HG1 THR A 122 14.104 -16.346 26.932 1.00 53.30 H new ATOM 0 HG21 THR A 122 15.696 -17.708 25.780 1.00 34.24 H new ATOM 0 HG22 THR A 122 15.456 -17.924 24.029 1.00 34.24 H new ATOM 0 HG23 THR A 122 15.990 -16.351 24.667 1.00 34.24 H new ATOM 1767 N THR A 123 13.644 -13.728 24.168 1.00 22.21 N ATOM 1768 CA THR A 123 14.259 -12.410 24.081 1.00 54.43 C ATOM 1769 C THR A 123 15.417 -12.277 25.062 1.00 3.43 C ATOM 1770 O THR A 123 15.240 -11.813 26.189 1.00 54.42 O ATOM 1771 CB THR A 123 13.234 -11.293 24.359 1.00 64.12 C ATOM 1772 OG1 THR A 123 12.425 -11.641 25.488 1.00 4.40 O ATOM 1773 CG2 THR A 123 12.347 -11.058 23.146 1.00 70.43 C ATOM 0 H THR A 123 12.799 -13.762 24.738 1.00 22.21 H new ATOM 0 HA THR A 123 14.635 -12.303 23.064 1.00 54.43 H new ATOM 0 HB THR A 123 13.780 -10.374 24.573 1.00 64.12 H new ATOM 0 HG1 THR A 123 13.002 -11.862 26.248 1.00 4.40 H new ATOM 0 HG21 THR A 123 11.632 -10.265 23.366 1.00 70.43 H new ATOM 0 HG22 THR A 123 12.963 -10.765 22.296 1.00 70.43 H new ATOM 0 HG23 THR A 123 11.809 -11.975 22.905 1.00 70.43 H new ATOM 1781 N PHE A 124 16.605 -12.686 24.628 1.00 74.11 N ATOM 1782 CA PHE A 124 17.793 -12.613 25.469 1.00 3.33 C ATOM 1783 C PHE A 124 18.825 -11.660 24.872 1.00 54.02 C ATOM 1784 O PHE A 124 19.467 -10.893 25.589 1.00 14.44 O ATOM 1785 CB PHE A 124 18.408 -14.003 25.643 1.00 34.32 C ATOM 1786 CG PHE A 124 18.379 -14.498 27.061 1.00 20.20 C ATOM 1787 CD1 PHE A 124 17.215 -14.428 27.810 1.00 64.52 C ATOM 1788 CD2 PHE A 124 19.516 -15.033 27.645 1.00 1.32 C ATOM 1789 CE1 PHE A 124 17.186 -14.883 29.115 1.00 75.43 C ATOM 1790 CE2 PHE A 124 19.492 -15.489 28.949 1.00 22.53 C ATOM 1791 CZ PHE A 124 18.326 -15.414 29.685 1.00 11.44 C ATOM 0 H PHE A 124 16.770 -13.072 23.698 1.00 74.11 H new ATOM 0 HA PHE A 124 17.493 -12.231 26.445 1.00 3.33 H new ATOM 0 HB2 PHE A 124 17.873 -14.710 25.009 1.00 34.32 H new ATOM 0 HB3 PHE A 124 19.441 -13.981 25.295 1.00 34.32 H new ATOM 0 HD1 PHE A 124 16.321 -14.013 27.369 1.00 64.52 H new ATOM 0 HD2 PHE A 124 20.431 -15.094 27.075 1.00 1.32 H new ATOM 0 HE1 PHE A 124 16.273 -14.823 29.688 1.00 75.43 H new ATOM 0 HE2 PHE A 124 20.385 -15.904 29.393 1.00 22.53 H new ATOM 0 HZ PHE A 124 18.306 -15.770 30.704 1.00 11.44 H new ATOM 1801 N PHE A 125 18.978 -11.716 23.553 1.00 4.50 N ATOM 1802 CA PHE A 125 19.932 -10.859 22.858 1.00 64.32 C ATOM 1803 C PHE A 125 19.443 -10.531 21.450 1.00 4.13 C ATOM 1804 O PHE A 125 20.065 -10.889 20.450 1.00 24.51 O ATOM 1805 CB PHE A 125 21.302 -11.537 22.789 1.00 64.33 C ATOM 1806 CG PHE A 125 21.815 -11.991 24.126 1.00 50.33 C ATOM 1807 CD1 PHE A 125 22.305 -11.074 25.042 1.00 63.13 C ATOM 1808 CD2 PHE A 125 21.807 -13.334 24.466 1.00 0.23 C ATOM 1809 CE1 PHE A 125 22.777 -11.488 26.273 1.00 4.11 C ATOM 1810 CE2 PHE A 125 22.277 -13.753 25.696 1.00 24.52 C ATOM 1811 CZ PHE A 125 22.764 -12.830 26.600 1.00 3.42 C ATOM 0 H PHE A 125 18.454 -12.345 22.944 1.00 4.50 H new ATOM 0 HA PHE A 125 20.022 -9.928 23.418 1.00 64.32 H new ATOM 0 HB2 PHE A 125 21.240 -12.397 22.122 1.00 64.33 H new ATOM 0 HB3 PHE A 125 22.020 -10.844 22.350 1.00 64.33 H new ATOM 0 HD1 PHE A 125 22.318 -10.024 24.791 1.00 63.13 H new ATOM 0 HD2 PHE A 125 21.429 -14.061 23.762 1.00 0.23 H new ATOM 0 HE1 PHE A 125 23.156 -10.763 26.979 1.00 4.11 H new ATOM 0 HE2 PHE A 125 22.263 -14.803 25.950 1.00 24.52 H new ATOM 0 HZ PHE A 125 23.134 -13.157 27.561 1.00 3.42 H new ATOM 1821 N PRO A 126 18.301 -9.832 21.369 1.00 21.53 N ATOM 1822 CA PRO A 126 17.702 -9.440 20.090 1.00 2.12 C ATOM 1823 C PRO A 126 18.520 -8.373 19.370 1.00 21.13 C ATOM 1824 O PRO A 126 18.824 -8.504 18.184 1.00 2.05 O ATOM 1825 CB PRO A 126 16.335 -8.883 20.495 1.00 70.13 C ATOM 1826 CG PRO A 126 16.513 -8.428 21.902 1.00 54.20 C ATOM 1827 CD PRO A 126 17.506 -9.372 22.520 1.00 5.23 C ATOM 0 HA PRO A 126 17.647 -10.275 19.392 1.00 2.12 H new ATOM 0 HB2 PRO A 126 16.036 -8.059 19.847 1.00 70.13 H new ATOM 0 HB3 PRO A 126 15.559 -9.645 20.421 1.00 70.13 H new ATOM 0 HG2 PRO A 126 16.877 -7.401 21.937 1.00 54.20 H new ATOM 0 HG3 PRO A 126 15.566 -8.449 22.442 1.00 54.20 H new ATOM 0 HD2 PRO A 126 18.127 -8.872 23.263 1.00 5.23 H new ATOM 0 HD3 PRO A 126 17.011 -10.202 23.024 1.00 5.23 H new ATOM 1835 N LYS A 127 18.874 -7.317 20.095 1.00 42.15 N ATOM 1836 CA LYS A 127 19.659 -6.227 19.526 1.00 32.22 C ATOM 1837 C LYS A 127 21.013 -6.730 19.035 1.00 33.03 C ATOM 1838 O LYS A 127 21.681 -6.068 18.241 1.00 2.12 O ATOM 1839 CB LYS A 127 19.860 -5.121 20.564 1.00 14.32 C ATOM 1840 CG LYS A 127 21.004 -5.390 21.526 1.00 13.43 C ATOM 1841 CD LYS A 127 20.707 -6.577 22.427 1.00 4.00 C ATOM 1842 CE LYS A 127 19.491 -6.322 23.303 1.00 13.14 C ATOM 1843 NZ LYS A 127 19.634 -5.072 24.101 1.00 74.33 N ATOM 0 H LYS A 127 18.630 -7.193 21.078 1.00 42.15 H new ATOM 0 HA LYS A 127 19.111 -5.823 18.675 1.00 32.22 H new ATOM 0 HB2 LYS A 127 20.045 -4.179 20.048 1.00 14.32 H new ATOM 0 HB3 LYS A 127 18.939 -4.997 21.134 1.00 14.32 H new ATOM 0 HG2 LYS A 127 21.918 -5.579 20.963 1.00 13.43 H new ATOM 0 HG3 LYS A 127 21.183 -4.505 22.136 1.00 13.43 H new ATOM 0 HD2 LYS A 127 20.538 -7.464 21.817 1.00 4.00 H new ATOM 0 HD3 LYS A 127 21.573 -6.783 23.056 1.00 4.00 H new ATOM 0 HE2 LYS A 127 18.601 -6.254 22.678 1.00 13.14 H new ATOM 0 HE3 LYS A 127 19.344 -7.167 23.975 1.00 13.14 H new ATOM 0 HZ1 LYS A 127 18.901 -5.045 24.838 1.00 74.33 H new ATOM 0 HZ2 LYS A 127 20.574 -5.050 24.546 1.00 74.33 H new ATOM 0 HZ3 LYS A 127 19.528 -4.247 23.476 1.00 74.33 H new ATOM 1857 N PHE A 128 21.411 -7.905 19.512 1.00 74.13 N ATOM 1858 CA PHE A 128 22.685 -8.497 19.121 1.00 53.25 C ATOM 1859 C PHE A 128 22.548 -9.266 17.810 1.00 54.12 C ATOM 1860 O PHE A 128 23.400 -9.166 16.926 1.00 20.51 O ATOM 1861 CB PHE A 128 23.197 -9.429 20.220 1.00 5.44 C ATOM 1862 CG PHE A 128 23.980 -10.599 19.698 1.00 61.23 C ATOM 1863 CD1 PHE A 128 25.094 -10.403 18.898 1.00 62.02 C ATOM 1864 CD2 PHE A 128 23.601 -11.896 20.006 1.00 42.10 C ATOM 1865 CE1 PHE A 128 25.817 -11.478 18.415 1.00 31.14 C ATOM 1866 CE2 PHE A 128 24.320 -12.975 19.527 1.00 41.31 C ATOM 1867 CZ PHE A 128 25.429 -12.766 18.730 1.00 55.43 C ATOM 0 H PHE A 128 20.870 -8.466 20.170 1.00 74.13 H new ATOM 0 HA PHE A 128 23.403 -7.690 18.975 1.00 53.25 H new ATOM 0 HB2 PHE A 128 23.824 -8.859 20.905 1.00 5.44 H new ATOM 0 HB3 PHE A 128 22.349 -9.798 20.797 1.00 5.44 H new ATOM 0 HD1 PHE A 128 25.401 -9.398 18.649 1.00 62.02 H new ATOM 0 HD2 PHE A 128 22.734 -12.066 20.627 1.00 42.10 H new ATOM 0 HE1 PHE A 128 26.684 -11.311 17.793 1.00 31.14 H new ATOM 0 HE2 PHE A 128 24.015 -13.981 19.776 1.00 41.31 H new ATOM 0 HZ PHE A 128 25.991 -13.608 18.354 1.00 55.43 H new ATOM 1877 N LEU A 129 21.470 -10.033 17.691 1.00 33.11 N ATOM 1878 CA LEU A 129 21.220 -10.821 16.489 1.00 54.42 C ATOM 1879 C LEU A 129 19.848 -10.500 15.904 1.00 71.43 C ATOM 1880 O LEU A 129 18.925 -11.312 15.978 1.00 24.23 O ATOM 1881 CB LEU A 129 21.316 -12.314 16.804 1.00 20.25 C ATOM 1882 CG LEU A 129 20.914 -12.728 18.220 1.00 33.44 C ATOM 1883 CD1 LEU A 129 19.399 -12.760 18.357 1.00 24.51 C ATOM 1884 CD2 LEU A 129 21.511 -14.083 18.570 1.00 64.42 C ATOM 0 H LEU A 129 20.755 -10.126 18.412 1.00 33.11 H new ATOM 0 HA LEU A 129 21.979 -10.563 15.751 1.00 54.42 H new ATOM 0 HB2 LEU A 129 20.688 -12.855 16.097 1.00 20.25 H new ATOM 0 HB3 LEU A 129 22.343 -12.636 16.630 1.00 20.25 H new ATOM 0 HG LEU A 129 21.307 -11.989 18.919 1.00 33.44 H new ATOM 0 HD11 LEU A 129 19.132 -13.057 19.371 1.00 24.51 H new ATOM 0 HD12 LEU A 129 18.994 -11.769 18.150 1.00 24.51 H new ATOM 0 HD13 LEU A 129 18.985 -13.477 17.648 1.00 24.51 H new ATOM 0 HD21 LEU A 129 21.214 -14.361 19.581 1.00 64.42 H new ATOM 0 HD22 LEU A 129 21.149 -14.833 17.866 1.00 64.42 H new ATOM 0 HD23 LEU A 129 22.598 -14.027 18.513 1.00 64.42 H new ATOM 1896 N ARG A 130 19.722 -9.313 15.320 1.00 72.22 N ATOM 1897 CA ARG A 130 18.463 -8.886 14.721 1.00 61.23 C ATOM 1898 C ARG A 130 18.126 -9.737 13.500 1.00 33.40 C ATOM 1899 O ARG A 130 18.443 -9.372 12.368 1.00 53.42 O ATOM 1900 CB ARG A 130 18.538 -7.411 14.322 1.00 31.12 C ATOM 1901 CG ARG A 130 18.545 -6.460 15.508 1.00 44.35 C ATOM 1902 CD ARG A 130 17.890 -5.132 15.161 1.00 71.25 C ATOM 1903 NE ARG A 130 16.946 -4.703 16.189 1.00 51.43 N ATOM 1904 CZ ARG A 130 15.727 -5.212 16.326 1.00 32.12 C ATOM 1905 NH1 ARG A 130 15.306 -6.165 15.505 1.00 4.44 N ATOM 1906 NH2 ARG A 130 14.926 -4.769 17.287 1.00 53.03 N ATOM 0 H ARG A 130 20.476 -8.630 15.249 1.00 72.22 H new ATOM 0 HA ARG A 130 17.674 -9.016 15.462 1.00 61.23 H new ATOM 0 HB2 ARG A 130 19.439 -7.248 13.731 1.00 31.12 H new ATOM 0 HB3 ARG A 130 17.689 -7.173 13.681 1.00 31.12 H new ATOM 0 HG2 ARG A 130 18.020 -6.918 16.346 1.00 44.35 H new ATOM 0 HG3 ARG A 130 19.572 -6.287 15.831 1.00 44.35 H new ATOM 0 HD2 ARG A 130 18.659 -4.370 15.035 1.00 71.25 H new ATOM 0 HD3 ARG A 130 17.371 -5.222 14.207 1.00 71.25 H new ATOM 0 HE ARG A 130 17.239 -3.972 16.838 1.00 51.43 H new ATOM 0 HH11 ARG A 130 15.919 -6.509 14.766 1.00 4.44 H new ATOM 0 HH12 ARG A 130 14.369 -6.554 15.613 1.00 4.44 H new ATOM 0 HH21 ARG A 130 15.246 -4.037 17.921 1.00 53.03 H new ATOM 0 HH22 ARG A 130 13.990 -5.160 17.392 1.00 53.03 H new ATOM 1920 N CYS A 131 17.481 -10.875 13.738 1.00 2.22 N ATOM 1921 CA CYS A 131 17.101 -11.779 12.660 1.00 62.32 C ATOM 1922 C CYS A 131 15.875 -12.602 13.046 1.00 2.42 C ATOM 1923 O CYS A 131 15.718 -12.995 14.201 1.00 62.40 O ATOM 1924 CB CYS A 131 18.265 -12.710 12.313 1.00 73.21 C ATOM 1925 SG CYS A 131 17.868 -13.956 11.044 1.00 14.31 S ATOM 0 H CYS A 131 17.211 -11.192 14.669 1.00 2.22 H new ATOM 0 HA CYS A 131 16.852 -11.177 11.786 1.00 62.32 H new ATOM 0 HB2 CYS A 131 19.106 -12.109 11.966 1.00 73.21 H new ATOM 0 HB3 CYS A 131 18.590 -13.221 13.219 1.00 73.21 H new ATOM 1930 N ASN A 132 15.009 -12.857 12.071 1.00 43.33 N ATOM 1931 CA ASN A 132 13.797 -13.632 12.308 1.00 11.22 C ATOM 1932 C ASN A 132 14.097 -15.128 12.297 1.00 12.32 C ATOM 1933 O ASN A 132 14.479 -15.686 11.269 1.00 31.04 O ATOM 1934 CB ASN A 132 12.742 -13.304 11.250 1.00 34.01 C ATOM 1935 CG ASN A 132 12.891 -11.898 10.701 1.00 73.42 C ATOM 1936 OD1 ASN A 132 12.808 -10.919 11.441 1.00 14.54 O ATOM 1937 ND2 ASN A 132 13.112 -11.794 9.396 1.00 41.24 N ATOM 0 H ASN A 132 15.124 -12.538 11.109 1.00 43.33 H new ATOM 0 HA ASN A 132 13.411 -13.364 13.292 1.00 11.22 H new ATOM 0 HB2 ASN A 132 12.817 -14.020 10.432 1.00 34.01 H new ATOM 0 HB3 ASN A 132 11.749 -13.418 11.684 1.00 34.01 H new ATOM 0 HD21 ASN A 132 13.220 -10.874 8.969 1.00 41.24 H new ATOM 0 HD22 ASN A 132 13.173 -12.634 8.821 1.00 41.24 H new ATOM 1944 N GLU A 133 13.920 -15.770 13.448 1.00 51.22 N ATOM 1945 CA GLU A 133 14.172 -17.201 13.570 1.00 51.22 C ATOM 1946 C GLU A 133 12.864 -17.987 13.556 1.00 51.35 C ATOM 1947 O GLU A 133 12.597 -18.754 12.630 1.00 54.10 O ATOM 1948 CB GLU A 133 14.944 -17.497 14.857 1.00 32.32 C ATOM 1949 CG GLU A 133 16.018 -16.470 15.173 1.00 21.21 C ATOM 1950 CD GLU A 133 17.314 -17.106 15.639 1.00 52.42 C ATOM 1951 OE1 GLU A 133 17.259 -18.219 16.202 1.00 12.12 O ATOM 1952 OE2 GLU A 133 18.382 -16.490 15.440 1.00 31.15 O ATOM 0 H GLU A 133 13.603 -15.322 14.308 1.00 51.22 H new ATOM 0 HA GLU A 133 14.772 -17.513 12.715 1.00 51.22 H new ATOM 0 HB2 GLU A 133 14.242 -17.544 15.689 1.00 32.32 H new ATOM 0 HB3 GLU A 133 15.407 -18.481 14.775 1.00 32.32 H new ATOM 0 HG2 GLU A 133 16.212 -15.868 14.286 1.00 21.21 H new ATOM 0 HG3 GLU A 133 15.652 -15.793 15.945 1.00 21.21 H new ATOM 1959 N THR A 134 12.051 -17.791 14.589 1.00 2.42 N ATOM 1960 CA THR A 134 10.772 -18.481 14.698 1.00 63.13 C ATOM 1961 C THR A 134 9.648 -17.655 14.084 1.00 14.03 C ATOM 1962 O THR A 134 8.555 -17.562 14.645 1.00 11.20 O ATOM 1963 CB THR A 134 10.424 -18.791 16.166 1.00 62.53 C ATOM 1964 OG1 THR A 134 9.175 -19.487 16.236 1.00 35.13 O ATOM 1965 CG2 THR A 134 10.345 -17.512 16.985 1.00 23.32 C ATOM 0 H THR A 134 12.256 -17.159 15.363 1.00 2.42 H new ATOM 0 HA THR A 134 10.871 -19.418 14.151 1.00 63.13 H new ATOM 0 HB THR A 134 11.213 -19.419 16.579 1.00 62.53 H new ATOM 0 HG1 THR A 134 8.485 -18.968 15.773 1.00 35.13 H new ATOM 0 HG21 THR A 134 10.098 -17.756 18.018 1.00 23.32 H new ATOM 0 HG22 THR A 134 11.307 -17.000 16.953 1.00 23.32 H new ATOM 0 HG23 THR A 134 9.574 -16.862 16.571 1.00 23.32 H new ATOM 1973 N LEU A 135 9.921 -17.057 12.930 1.00 70.11 N ATOM 1974 CA LEU A 135 8.931 -16.238 12.239 1.00 32.40 C ATOM 1975 C LEU A 135 8.634 -16.798 10.852 1.00 72.14 C ATOM 1976 O LEU A 135 7.610 -17.447 10.639 1.00 75.23 O ATOM 1977 CB LEU A 135 9.424 -14.795 12.124 1.00 0.13 C ATOM 1978 CG LEU A 135 9.595 -14.037 13.442 1.00 60.45 C ATOM 1979 CD1 LEU A 135 9.845 -12.560 13.179 1.00 32.42 C ATOM 1980 CD2 LEU A 135 8.372 -14.224 14.327 1.00 74.31 C ATOM 0 H LEU A 135 10.820 -17.124 12.453 1.00 70.11 H new ATOM 0 HA LEU A 135 8.010 -16.255 12.823 1.00 32.40 H new ATOM 0 HB2 LEU A 135 10.382 -14.800 11.604 1.00 0.13 H new ATOM 0 HB3 LEU A 135 8.724 -14.242 11.498 1.00 0.13 H new ATOM 0 HG LEU A 135 10.461 -14.444 13.964 1.00 60.45 H new ATOM 0 HD11 LEU A 135 9.964 -12.037 14.128 1.00 32.42 H new ATOM 0 HD12 LEU A 135 10.751 -12.445 12.585 1.00 32.42 H new ATOM 0 HD13 LEU A 135 8.999 -12.139 12.636 1.00 32.42 H new ATOM 0 HD21 LEU A 135 8.511 -13.678 15.260 1.00 74.31 H new ATOM 0 HD22 LEU A 135 7.489 -13.844 13.813 1.00 74.31 H new ATOM 0 HD23 LEU A 135 8.238 -15.284 14.543 1.00 74.31 H new ATOM 1992 N PHE A 136 9.537 -16.544 9.911 1.00 65.11 N ATOM 1993 CA PHE A 136 9.373 -17.024 8.544 1.00 42.34 C ATOM 1994 C PHE A 136 10.682 -16.910 7.767 1.00 74.54 C ATOM 1995 O PHE A 136 10.797 -16.152 6.803 1.00 24.54 O ATOM 1996 CB PHE A 136 8.274 -16.232 7.832 1.00 61.34 C ATOM 1997 CG PHE A 136 6.916 -16.866 7.935 1.00 23.11 C ATOM 1998 CD1 PHE A 136 6.656 -18.081 7.322 1.00 53.12 C ATOM 1999 CD2 PHE A 136 5.901 -16.247 8.646 1.00 73.40 C ATOM 2000 CE1 PHE A 136 5.407 -18.666 7.415 1.00 51.32 C ATOM 2001 CE2 PHE A 136 4.650 -16.828 8.743 1.00 51.42 C ATOM 2002 CZ PHE A 136 4.403 -18.039 8.127 1.00 22.02 C ATOM 0 H PHE A 136 10.390 -16.008 10.070 1.00 65.11 H new ATOM 0 HA PHE A 136 9.086 -18.075 8.586 1.00 42.34 H new ATOM 0 HB2 PHE A 136 8.230 -15.228 8.253 1.00 61.34 H new ATOM 0 HB3 PHE A 136 8.538 -16.125 6.780 1.00 61.34 H new ATOM 0 HD1 PHE A 136 7.438 -18.576 6.765 1.00 53.12 H new ATOM 0 HD2 PHE A 136 6.089 -15.300 9.130 1.00 73.40 H new ATOM 0 HE1 PHE A 136 5.216 -19.613 6.931 1.00 51.32 H new ATOM 0 HE2 PHE A 136 3.867 -16.335 9.300 1.00 51.42 H new ATOM 0 HZ PHE A 136 3.427 -18.495 8.202 1.00 22.02 H new ATOM 2012 N PRO A 137 11.692 -17.682 8.195 1.00 51.13 N ATOM 2013 CA PRO A 137 13.010 -17.687 7.554 1.00 5.22 C ATOM 2014 C PRO A 137 12.980 -18.325 6.170 1.00 60.13 C ATOM 2015 O PRO A 137 13.486 -17.757 5.201 1.00 22.50 O ATOM 2016 CB PRO A 137 13.866 -18.523 8.510 1.00 52.54 C ATOM 2017 CG PRO A 137 12.894 -19.405 9.214 1.00 64.40 C ATOM 2018 CD PRO A 137 11.625 -18.609 9.337 1.00 74.24 C ATOM 0 HA PRO A 137 13.388 -16.678 7.393 1.00 5.22 H new ATOM 0 HB2 PRO A 137 14.610 -19.107 7.968 1.00 52.54 H new ATOM 0 HB3 PRO A 137 14.408 -17.890 9.213 1.00 52.54 H new ATOM 0 HG2 PRO A 137 12.725 -20.325 8.654 1.00 64.40 H new ATOM 0 HG3 PRO A 137 13.270 -19.694 10.195 1.00 64.40 H new ATOM 0 HD2 PRO A 137 10.743 -19.248 9.285 1.00 74.24 H new ATOM 0 HD3 PRO A 137 11.576 -18.075 10.286 1.00 74.24 H new ATOM 2026 N THR A 138 12.383 -19.510 6.082 1.00 13.30 N ATOM 2027 CA THR A 138 12.287 -20.226 4.816 1.00 11.52 C ATOM 2028 C THR A 138 11.055 -19.791 4.031 1.00 75.41 C ATOM 2029 O THR A 138 10.997 -19.944 2.811 1.00 44.14 O ATOM 2030 CB THR A 138 12.232 -21.749 5.035 1.00 35.23 C ATOM 2031 OG1 THR A 138 12.040 -22.038 6.425 1.00 53.33 O ATOM 2032 CG2 THR A 138 13.510 -22.413 4.546 1.00 31.00 C ATOM 0 H THR A 138 11.959 -19.994 6.873 1.00 13.30 H new ATOM 0 HA THR A 138 13.183 -19.981 4.245 1.00 11.52 H new ATOM 0 HB THR A 138 11.393 -22.146 4.463 1.00 35.23 H new ATOM 0 HG1 THR A 138 12.004 -23.009 6.555 1.00 53.33 H new ATOM 0 HG21 THR A 138 13.447 -23.489 4.711 1.00 31.00 H new ATOM 0 HG22 THR A 138 13.638 -22.216 3.482 1.00 31.00 H new ATOM 0 HG23 THR A 138 14.362 -22.011 5.094 1.00 31.00 H new ATOM 2040 N LYS A 139 10.069 -19.249 4.738 1.00 41.30 N ATOM 2041 CA LYS A 139 8.837 -18.790 4.107 1.00 1.24 C ATOM 2042 C LYS A 139 8.262 -19.865 3.190 1.00 1.45 C ATOM 2043 O LYS A 139 7.053 -20.097 3.172 1.00 22.25 O ATOM 2044 CB LYS A 139 9.094 -17.509 3.311 1.00 43.24 C ATOM 2045 CG LYS A 139 9.085 -17.716 1.806 1.00 33.10 C ATOM 2046 CD LYS A 139 9.439 -16.438 1.065 1.00 64.03 C ATOM 2047 CE LYS A 139 8.228 -15.849 0.358 1.00 21.11 C ATOM 2048 NZ LYS A 139 7.153 -15.475 1.318 1.00 21.35 N ATOM 0 H LYS A 139 10.099 -19.117 5.749 1.00 41.30 H new ATOM 0 HA LYS A 139 8.111 -18.582 4.893 1.00 1.24 H new ATOM 0 HB2 LYS A 139 8.336 -16.771 3.572 1.00 43.24 H new ATOM 0 HB3 LYS A 139 10.058 -17.095 3.607 1.00 43.24 H new ATOM 0 HG2 LYS A 139 9.795 -18.500 1.541 1.00 33.10 H new ATOM 0 HG3 LYS A 139 8.100 -18.059 1.491 1.00 33.10 H new ATOM 0 HD2 LYS A 139 9.842 -15.709 1.768 1.00 64.03 H new ATOM 0 HD3 LYS A 139 10.222 -16.644 0.336 1.00 64.03 H new ATOM 0 HE2 LYS A 139 8.531 -14.969 -0.209 1.00 21.11 H new ATOM 0 HE3 LYS A 139 7.839 -16.572 -0.359 1.00 21.11 H new ATOM 0 HZ1 LYS A 139 6.374 -15.016 0.805 1.00 21.35 H new ATOM 0 HZ2 LYS A 139 6.799 -16.330 1.793 1.00 21.35 H new ATOM 0 HZ3 LYS A 139 7.535 -14.818 2.028 1.00 21.35 H new TER 2062 LYS A 139