USER MOD reduce.3.24.130724 H: found=0, std=0, add=1003, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1002 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 54 THR OG1 : rot -130:sc= 1.48 USER MOD Set 1.2: A 56 THR OG1 : rot 43:sc= 0.805 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 90:sc= -0.231 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc=-0.00176 X(o=-0.0018,f=0) USER MOD Single : A 45 THR OG1 : rot 74:sc= 1.01 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -11:sc= 0.811 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 CYS SG : rot 120:sc= -1.04 USER MOD Single : A 73 CYS SG : rot 6:sc= -0.176 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 112:sc= 0.96 USER MOD Single : A 77 ASN : amide:sc= -2.13 K(o=-2.1,f=-5.5!) USER MOD Single : A 87 GLN :FLIP amide:sc= -0.172 F(o=-0.82,f=-0.17) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -1.08 K(o=-1.1,f=-2.9!) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.142 F(o=-2.6,f=-0.14) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 MET CE :methyl 167:sc= -1.23 (180deg=-2.24) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -2.7 X(o=-2.7,f=-2.5!) USER MOD Single : A 119 MET CE :methyl -179:sc= 0 (180deg=-0.000918) USER MOD Single : A 120 LYS NZ :NH3+ -163:sc= -0.0129 (180deg=-0.128) USER MOD Single : A 122 GLN : amide:sc= 0.26 X(o=0.26,f=-0.09) USER MOD Single : A 123 THR OG1 : rot -160:sc= -0.992 USER MOD Single : A 134 CYS SG : rot 7:sc= 0.58 USER MOD Single : A 136 MET CE :methyl -169:sc=-0.00112 (180deg=-0.183) USER MOD ----------------------------------------------------------------- ATOM 68 N PRO A 6 10.998 1.107 3.245 1.00 31.51 N ATOM 69 CA PRO A 6 10.932 0.461 4.559 1.00 31.43 C ATOM 70 C PRO A 6 11.251 1.425 5.696 1.00 2.41 C ATOM 71 O PRO A 6 12.195 2.211 5.609 1.00 12.33 O ATOM 72 CB PRO A 6 11.999 -0.633 4.471 1.00 70.41 C ATOM 73 CG PRO A 6 12.962 -0.141 3.447 1.00 62.14 C ATOM 74 CD PRO A 6 12.147 0.638 2.452 1.00 72.01 C ATOM 0 HA PRO A 6 9.933 0.085 4.778 1.00 31.43 H new ATOM 0 HB2 PRO A 6 12.488 -0.787 5.433 1.00 70.41 H new ATOM 0 HB3 PRO A 6 11.563 -1.588 4.178 1.00 70.41 H new ATOM 0 HG2 PRO A 6 13.728 0.488 3.902 1.00 62.14 H new ATOM 0 HG3 PRO A 6 13.477 -0.972 2.965 1.00 62.14 H new ATOM 0 HD2 PRO A 6 12.713 1.470 2.033 1.00 72.01 H new ATOM 0 HD3 PRO A 6 11.831 0.015 1.616 1.00 72.01 H new ATOM 82 N ARG A 7 10.459 1.360 6.761 1.00 3.25 N ATOM 83 CA ARG A 7 10.658 2.229 7.915 1.00 33.03 C ATOM 84 C ARG A 7 10.006 1.636 9.161 1.00 72.11 C ATOM 85 O ARG A 7 8.781 1.567 9.260 1.00 14.03 O ATOM 86 CB ARG A 7 10.083 3.619 7.639 1.00 53.35 C ATOM 87 CG ARG A 7 10.464 4.655 8.683 1.00 5.31 C ATOM 88 CD ARG A 7 9.525 5.851 8.652 1.00 71.53 C ATOM 89 NE ARG A 7 9.128 6.270 9.993 1.00 12.01 N ATOM 90 CZ ARG A 7 9.948 6.872 10.848 1.00 73.33 C ATOM 91 NH1 ARG A 7 11.203 7.123 10.502 1.00 13.41 N ATOM 92 NH2 ARG A 7 9.512 7.223 12.051 1.00 44.42 N ATOM 0 H ARG A 7 9.674 0.715 6.849 1.00 3.25 H new ATOM 0 HA ARG A 7 11.730 2.315 8.092 1.00 33.03 H new ATOM 0 HB2 ARG A 7 10.427 3.957 6.662 1.00 53.35 H new ATOM 0 HB3 ARG A 7 8.996 3.550 7.588 1.00 53.35 H new ATOM 0 HG2 ARG A 7 10.442 4.200 9.673 1.00 5.31 H new ATOM 0 HG3 ARG A 7 11.487 4.990 8.508 1.00 5.31 H new ATOM 0 HD2 ARG A 7 10.013 6.682 8.142 1.00 71.53 H new ATOM 0 HD3 ARG A 7 8.636 5.599 8.073 1.00 71.53 H new ATOM 0 HE ARG A 7 8.169 6.091 10.290 1.00 12.01 H new ATOM 0 HH11 ARG A 7 11.541 6.854 9.578 1.00 13.41 H new ATOM 0 HH12 ARG A 7 11.831 7.585 11.160 1.00 13.41 H new ATOM 0 HH21 ARG A 7 8.547 7.031 12.320 1.00 44.42 H new ATOM 0 HH22 ARG A 7 10.142 7.685 12.707 1.00 44.42 H new ATOM 106 N VAL A 8 10.833 1.208 10.109 1.00 4.22 N ATOM 107 CA VAL A 8 10.338 0.621 11.349 1.00 40.54 C ATOM 108 C VAL A 8 9.421 1.590 12.087 1.00 1.01 C ATOM 109 O VAL A 8 9.765 2.754 12.290 1.00 25.11 O ATOM 110 CB VAL A 8 11.496 0.217 12.280 1.00 60.30 C ATOM 111 CG1 VAL A 8 12.402 1.407 12.555 1.00 54.41 C ATOM 112 CG2 VAL A 8 10.957 -0.364 13.578 1.00 33.43 C ATOM 0 H VAL A 8 11.850 1.257 10.042 1.00 4.22 H new ATOM 0 HA VAL A 8 9.775 -0.271 11.075 1.00 40.54 H new ATOM 0 HB VAL A 8 12.088 -0.551 11.782 1.00 60.30 H new ATOM 0 HG11 VAL A 8 13.214 1.101 13.215 1.00 54.41 H new ATOM 0 HG12 VAL A 8 12.816 1.774 11.616 1.00 54.41 H new ATOM 0 HG13 VAL A 8 11.826 2.200 13.032 1.00 54.41 H new ATOM 0 HG21 VAL A 8 11.789 -0.644 14.224 1.00 33.43 H new ATOM 0 HG22 VAL A 8 10.341 0.381 14.082 1.00 33.43 H new ATOM 0 HG23 VAL A 8 10.354 -1.246 13.359 1.00 33.43 H new ATOM 122 N MET A 9 8.252 1.101 12.487 1.00 20.12 N ATOM 123 CA MET A 9 7.285 1.923 13.205 1.00 4.45 C ATOM 124 C MET A 9 7.365 1.670 14.707 1.00 24.35 C ATOM 125 O MET A 9 7.414 2.608 15.503 1.00 25.11 O ATOM 126 CB MET A 9 5.869 1.639 12.703 1.00 14.21 C ATOM 127 CG MET A 9 4.785 2.323 13.521 1.00 21.55 C ATOM 128 SD MET A 9 3.664 3.305 12.507 1.00 2.10 S ATOM 129 CE MET A 9 2.090 2.914 13.266 1.00 32.11 C ATOM 0 H MET A 9 7.951 0.140 12.326 1.00 20.12 H new ATOM 0 HA MET A 9 7.526 2.969 13.017 1.00 4.45 H new ATOM 0 HB2 MET A 9 5.788 1.963 11.665 1.00 14.21 H new ATOM 0 HB3 MET A 9 5.697 0.563 12.715 1.00 14.21 H new ATOM 0 HG2 MET A 9 4.213 1.569 14.062 1.00 21.55 H new ATOM 0 HG3 MET A 9 5.250 2.966 14.268 1.00 21.55 H new ATOM 0 HE1 MET A 9 1.294 3.448 12.748 1.00 32.11 H new ATOM 0 HE2 MET A 9 1.911 1.841 13.200 1.00 32.11 H new ATOM 0 HE3 MET A 9 2.106 3.215 14.314 1.00 32.11 H new ATOM 139 N ARG A 10 7.378 0.396 15.088 1.00 13.42 N ATOM 140 CA ARG A 10 7.450 0.020 16.495 1.00 41.21 C ATOM 141 C ARG A 10 8.124 -1.339 16.660 1.00 3.43 C ATOM 142 O ARG A 10 8.075 -2.181 15.764 1.00 60.10 O ATOM 143 CB ARG A 10 6.049 -0.016 17.108 1.00 50.41 C ATOM 144 CG ARG A 10 5.301 1.303 16.995 1.00 72.52 C ATOM 145 CD ARG A 10 4.054 1.312 17.865 1.00 74.41 C ATOM 146 NE ARG A 10 2.961 0.553 17.263 1.00 73.32 N ATOM 147 CZ ARG A 10 1.760 0.427 17.818 1.00 64.12 C ATOM 148 NH1 ARG A 10 1.500 1.007 18.981 1.00 1.12 N ATOM 149 NH2 ARG A 10 0.817 -0.280 17.208 1.00 22.24 N ATOM 0 H ARG A 10 7.340 -0.392 14.442 1.00 13.42 H new ATOM 0 HA ARG A 10 8.047 0.769 17.015 1.00 41.21 H new ATOM 0 HB2 ARG A 10 5.467 -0.797 16.618 1.00 50.41 H new ATOM 0 HB3 ARG A 10 6.129 -0.290 18.160 1.00 50.41 H new ATOM 0 HG2 ARG A 10 5.958 2.121 17.290 1.00 72.52 H new ATOM 0 HG3 ARG A 10 5.022 1.477 15.956 1.00 72.52 H new ATOM 0 HD2 ARG A 10 4.291 0.893 18.843 1.00 74.41 H new ATOM 0 HD3 ARG A 10 3.734 2.341 18.029 1.00 74.41 H new ATOM 0 HE ARG A 10 3.129 0.094 16.367 1.00 73.32 H new ATOM 0 HH11 ARG A 10 2.222 1.552 19.452 1.00 1.12 H new ATOM 0 HH12 ARG A 10 0.577 0.909 19.405 1.00 1.12 H new ATOM 0 HH21 ARG A 10 1.014 -0.727 16.313 1.00 22.24 H new ATOM 0 HH22 ARG A 10 -0.104 -0.376 17.635 1.00 22.24 H new ATOM 163 N VAL A 11 8.754 -1.545 17.812 1.00 4.55 N ATOM 164 CA VAL A 11 9.438 -2.801 18.096 1.00 1.30 C ATOM 165 C VAL A 11 9.579 -3.023 19.598 1.00 40.13 C ATOM 166 O VAL A 11 9.837 -2.085 20.354 1.00 72.32 O ATOM 167 CB VAL A 11 10.836 -2.837 17.449 1.00 34.54 C ATOM 168 CG1 VAL A 11 11.666 -1.648 17.905 1.00 44.51 C ATOM 169 CG2 VAL A 11 11.539 -4.146 17.776 1.00 2.14 C ATOM 0 H VAL A 11 8.805 -0.858 18.564 1.00 4.55 H new ATOM 0 HA VAL A 11 8.828 -3.597 17.670 1.00 1.30 H new ATOM 0 HB VAL A 11 10.719 -2.774 16.367 1.00 34.54 H new ATOM 0 HG11 VAL A 11 12.650 -1.690 17.438 1.00 44.51 H new ATOM 0 HG12 VAL A 11 11.167 -0.723 17.616 1.00 44.51 H new ATOM 0 HG13 VAL A 11 11.778 -1.676 18.989 1.00 44.51 H new ATOM 0 HG21 VAL A 11 12.525 -4.155 17.312 1.00 2.14 H new ATOM 0 HG22 VAL A 11 11.646 -4.242 18.857 1.00 2.14 H new ATOM 0 HG23 VAL A 11 10.950 -4.980 17.395 1.00 2.14 H new ATOM 179 N LEU A 12 9.409 -4.269 20.024 1.00 32.41 N ATOM 180 CA LEU A 12 9.518 -4.616 21.437 1.00 75.41 C ATOM 181 C LEU A 12 9.963 -6.065 21.609 1.00 31.01 C ATOM 182 O LEU A 12 9.805 -6.886 20.705 1.00 73.23 O ATOM 183 CB LEU A 12 8.178 -4.396 22.141 1.00 13.51 C ATOM 184 CG LEU A 12 8.246 -3.762 23.531 1.00 3.00 C ATOM 185 CD1 LEU A 12 7.217 -2.650 23.662 1.00 30.24 C ATOM 186 CD2 LEU A 12 8.036 -4.816 24.609 1.00 43.25 C ATOM 0 H LEU A 12 9.195 -5.056 19.412 1.00 32.41 H new ATOM 0 HA LEU A 12 10.270 -3.968 21.888 1.00 75.41 H new ATOM 0 HB2 LEU A 12 7.556 -3.765 21.506 1.00 13.51 H new ATOM 0 HB3 LEU A 12 7.673 -5.358 22.227 1.00 13.51 H new ATOM 0 HG LEU A 12 9.237 -3.328 23.663 1.00 3.00 H new ATOM 0 HD11 LEU A 12 7.281 -2.211 24.658 1.00 30.24 H new ATOM 0 HD12 LEU A 12 7.414 -1.882 22.914 1.00 30.24 H new ATOM 0 HD13 LEU A 12 6.218 -3.059 23.509 1.00 30.24 H new ATOM 0 HD21 LEU A 12 8.088 -4.347 25.592 1.00 43.25 H new ATOM 0 HD22 LEU A 12 7.058 -5.279 24.479 1.00 43.25 H new ATOM 0 HD23 LEU A 12 8.812 -5.578 24.529 1.00 43.25 H new ATOM 198 N LEU A 13 10.518 -6.373 22.776 1.00 42.11 N ATOM 199 CA LEU A 13 10.985 -7.724 23.069 1.00 53.24 C ATOM 200 C LEU A 13 10.212 -8.325 24.238 1.00 31.30 C ATOM 201 O LEU A 13 10.111 -7.720 25.306 1.00 30.43 O ATOM 202 CB LEU A 13 12.481 -7.711 23.384 1.00 3.43 C ATOM 203 CG LEU A 13 13.404 -7.281 22.243 1.00 23.33 C ATOM 204 CD1 LEU A 13 14.703 -6.711 22.793 1.00 72.43 C ATOM 205 CD2 LEU A 13 13.685 -8.454 21.315 1.00 50.44 C ATOM 0 H LEU A 13 10.656 -5.706 23.535 1.00 42.11 H new ATOM 0 HA LEU A 13 10.812 -8.341 22.187 1.00 53.24 H new ATOM 0 HB2 LEU A 13 12.648 -7.045 24.230 1.00 3.43 H new ATOM 0 HB3 LEU A 13 12.773 -8.711 23.704 1.00 3.43 H new ATOM 0 HG LEU A 13 12.903 -6.501 21.670 1.00 23.33 H new ATOM 0 HD11 LEU A 13 15.347 -6.410 21.967 1.00 72.43 H new ATOM 0 HD12 LEU A 13 14.485 -5.844 23.417 1.00 72.43 H new ATOM 0 HD13 LEU A 13 15.209 -7.469 23.390 1.00 72.43 H new ATOM 0 HD21 LEU A 13 14.343 -8.130 20.509 1.00 50.44 H new ATOM 0 HD22 LEU A 13 14.166 -9.255 21.876 1.00 50.44 H new ATOM 0 HD23 LEU A 13 12.748 -8.818 20.894 1.00 50.44 H new ATOM 217 N LEU A 14 9.670 -9.520 24.030 1.00 73.10 N ATOM 218 CA LEU A 14 8.908 -10.206 25.068 1.00 55.41 C ATOM 219 C LEU A 14 9.772 -11.237 25.787 1.00 54.24 C ATOM 220 O LEU A 14 10.215 -11.014 26.912 1.00 5.31 O ATOM 221 CB LEU A 14 7.680 -10.887 24.461 1.00 54.52 C ATOM 222 CG LEU A 14 6.534 -9.961 24.050 1.00 35.42 C ATOM 223 CD1 LEU A 14 5.383 -10.765 23.464 1.00 11.30 C ATOM 224 CD2 LEU A 14 6.060 -9.138 25.239 1.00 24.24 C ATOM 0 H LEU A 14 9.744 -10.034 23.152 1.00 73.10 H new ATOM 0 HA LEU A 14 8.581 -9.463 25.795 1.00 55.41 H new ATOM 0 HB2 LEU A 14 7.998 -11.450 23.584 1.00 54.52 H new ATOM 0 HB3 LEU A 14 7.296 -11.609 25.182 1.00 54.52 H new ATOM 0 HG LEU A 14 6.901 -9.278 23.284 1.00 35.42 H new ATOM 0 HD11 LEU A 14 4.577 -10.090 23.177 1.00 11.30 H new ATOM 0 HD12 LEU A 14 5.730 -11.310 22.586 1.00 11.30 H new ATOM 0 HD13 LEU A 14 5.017 -11.472 24.208 1.00 11.30 H new ATOM 0 HD21 LEU A 14 5.245 -8.485 24.928 1.00 24.24 H new ATOM 0 HD22 LEU A 14 5.710 -9.805 26.027 1.00 24.24 H new ATOM 0 HD23 LEU A 14 6.885 -8.533 25.615 1.00 24.24 H new ATOM 236 N GLY A 15 10.008 -12.367 25.127 1.00 41.33 N ATOM 237 CA GLY A 15 10.820 -13.415 25.717 1.00 1.42 C ATOM 238 C GLY A 15 12.236 -12.957 26.007 1.00 60.33 C ATOM 239 O GLY A 15 13.000 -12.663 25.088 1.00 45.43 O ATOM 0 H GLY A 15 9.651 -12.575 24.194 1.00 41.33 H new ATOM 0 HA2 GLY A 15 10.354 -13.754 26.642 1.00 1.42 H new ATOM 0 HA3 GLY A 15 10.849 -14.271 25.043 1.00 1.42 H new ATOM 243 N ASP A 16 12.586 -12.896 27.287 1.00 61.14 N ATOM 244 CA ASP A 16 13.920 -12.470 27.695 1.00 32.50 C ATOM 245 C ASP A 16 14.781 -13.671 28.074 1.00 61.20 C ATOM 246 O ASP A 16 14.300 -14.804 28.120 1.00 45.44 O ATOM 247 CB ASP A 16 13.830 -11.499 28.873 1.00 21.32 C ATOM 248 CG ASP A 16 14.792 -10.335 28.738 1.00 33.14 C ATOM 249 OD1 ASP A 16 14.628 -9.537 27.792 1.00 44.41 O ATOM 250 OD2 ASP A 16 15.707 -10.222 29.580 1.00 42.11 O ATOM 0 H ASP A 16 11.965 -13.136 28.060 1.00 61.14 H new ATOM 0 HA ASP A 16 14.387 -11.963 26.851 1.00 32.50 H new ATOM 0 HB2 ASP A 16 12.812 -11.118 28.949 1.00 21.32 H new ATOM 0 HB3 ASP A 16 14.040 -12.035 29.799 1.00 21.32 H new ATOM 255 N VAL A 17 16.057 -13.416 28.344 1.00 4.12 N ATOM 256 CA VAL A 17 16.986 -14.475 28.719 1.00 22.32 C ATOM 257 C VAL A 17 17.640 -14.182 30.065 1.00 35.51 C ATOM 258 O VAL A 17 18.395 -14.999 30.590 1.00 23.35 O ATOM 259 CB VAL A 17 18.086 -14.660 27.657 1.00 52.15 C ATOM 260 CG1 VAL A 17 17.546 -15.421 26.456 1.00 74.24 C ATOM 261 CG2 VAL A 17 18.649 -13.312 27.234 1.00 43.41 C ATOM 0 H VAL A 17 16.471 -12.485 28.310 1.00 4.12 H new ATOM 0 HA VAL A 17 16.404 -15.394 28.793 1.00 22.32 H new ATOM 0 HB VAL A 17 18.895 -15.245 28.095 1.00 52.15 H new ATOM 0 HG11 VAL A 17 18.337 -15.542 25.716 1.00 74.24 H new ATOM 0 HG12 VAL A 17 17.194 -16.402 26.775 1.00 74.24 H new ATOM 0 HG13 VAL A 17 16.719 -14.865 26.015 1.00 74.24 H new ATOM 0 HG21 VAL A 17 19.425 -13.461 26.483 1.00 43.41 H new ATOM 0 HG22 VAL A 17 17.851 -12.700 26.814 1.00 43.41 H new ATOM 0 HG23 VAL A 17 19.075 -12.807 28.101 1.00 43.41 H new ATOM 271 N ALA A 18 17.342 -13.011 30.619 1.00 63.34 N ATOM 272 CA ALA A 18 17.899 -12.611 31.905 1.00 33.20 C ATOM 273 C ALA A 18 17.607 -13.655 32.978 1.00 55.31 C ATOM 274 O ALA A 18 18.344 -13.778 33.957 1.00 71.24 O ATOM 275 CB ALA A 18 17.346 -11.256 32.320 1.00 4.42 C ATOM 0 H ALA A 18 16.718 -12.323 30.197 1.00 63.34 H new ATOM 0 HA ALA A 18 18.981 -12.532 31.797 1.00 33.20 H new ATOM 0 HB1 ALA A 18 17.770 -10.969 33.282 1.00 4.42 H new ATOM 0 HB2 ALA A 18 17.610 -10.510 31.570 1.00 4.42 H new ATOM 0 HB3 ALA A 18 16.261 -11.316 32.405 1.00 4.42 H new ATOM 281 N THR A 19 16.525 -14.405 32.789 1.00 41.41 N ATOM 282 CA THR A 19 16.134 -15.436 33.741 1.00 23.32 C ATOM 283 C THR A 19 17.013 -16.674 33.602 1.00 30.22 C ATOM 284 O THR A 19 17.212 -17.418 34.564 1.00 60.15 O ATOM 285 CB THR A 19 14.660 -15.843 33.555 1.00 24.33 C ATOM 286 OG1 THR A 19 14.121 -15.212 32.388 1.00 25.42 O ATOM 287 CG2 THR A 19 13.835 -15.458 34.773 1.00 12.14 C ATOM 0 H THR A 19 15.904 -14.317 31.984 1.00 41.41 H new ATOM 0 HA THR A 19 16.263 -15.012 34.737 1.00 23.32 H new ATOM 0 HB THR A 19 14.617 -16.925 33.434 1.00 24.33 H new ATOM 0 HG1 THR A 19 13.184 -15.477 32.276 1.00 25.42 H new ATOM 0 HG21 THR A 19 12.798 -15.755 34.619 1.00 12.14 H new ATOM 0 HG22 THR A 19 14.230 -15.963 35.654 1.00 12.14 H new ATOM 0 HG23 THR A 19 13.885 -14.379 34.920 1.00 12.14 H new ATOM 295 N LEU A 20 17.537 -16.890 32.401 1.00 44.42 N ATOM 296 CA LEU A 20 18.397 -18.038 32.136 1.00 73.31 C ATOM 297 C LEU A 20 19.829 -17.761 32.582 1.00 32.51 C ATOM 298 O LEU A 20 20.247 -16.613 32.735 1.00 74.44 O ATOM 299 CB LEU A 20 18.373 -18.385 30.646 1.00 34.53 C ATOM 300 CG LEU A 20 17.204 -19.253 30.178 1.00 32.12 C ATOM 301 CD1 LEU A 20 17.258 -20.623 30.837 1.00 44.21 C ATOM 302 CD2 LEU A 20 15.878 -18.568 30.477 1.00 61.24 C ATOM 0 H LEU A 20 17.381 -16.285 31.595 1.00 44.42 H new ATOM 0 HA LEU A 20 18.016 -18.885 32.707 1.00 73.31 H new ATOM 0 HB2 LEU A 20 18.360 -17.455 30.077 1.00 34.53 H new ATOM 0 HB3 LEU A 20 19.302 -18.898 30.398 1.00 34.53 H new ATOM 0 HG LEU A 20 17.286 -19.388 29.099 1.00 32.12 H new ATOM 0 HD11 LEU A 20 16.418 -21.226 30.492 1.00 44.21 H new ATOM 0 HD12 LEU A 20 18.193 -21.117 30.573 1.00 44.21 H new ATOM 0 HD13 LEU A 20 17.202 -20.509 31.920 1.00 44.21 H new ATOM 0 HD21 LEU A 20 15.057 -19.200 30.137 1.00 61.24 H new ATOM 0 HD22 LEU A 20 15.788 -18.402 31.551 1.00 61.24 H new ATOM 0 HD23 LEU A 20 15.838 -17.611 29.958 1.00 61.24 H new ATOM 314 N PRO A 21 20.601 -18.837 32.795 1.00 61.33 N ATOM 315 CA PRO A 21 21.999 -18.736 33.224 1.00 42.15 C ATOM 316 C PRO A 21 22.903 -18.182 32.127 1.00 20.14 C ATOM 317 O PRO A 21 22.485 -18.039 30.977 1.00 24.23 O ATOM 318 CB PRO A 21 22.377 -20.183 33.547 1.00 32.54 C ATOM 319 CG PRO A 21 21.455 -21.010 32.718 1.00 2.15 C ATOM 320 CD PRO A 21 20.169 -20.236 32.632 1.00 0.34 C ATOM 0 HA PRO A 21 22.119 -18.052 34.064 1.00 42.15 H new ATOM 0 HB2 PRO A 21 23.419 -20.384 33.300 1.00 32.54 H new ATOM 0 HB3 PRO A 21 22.254 -20.397 34.609 1.00 32.54 H new ATOM 0 HG2 PRO A 21 21.872 -21.185 31.726 1.00 2.15 H new ATOM 0 HG3 PRO A 21 21.293 -21.987 33.172 1.00 2.15 H new ATOM 0 HD2 PRO A 21 19.669 -20.393 31.677 1.00 0.34 H new ATOM 0 HD3 PRO A 21 19.468 -20.534 33.412 1.00 0.34 H new ATOM 328 N LEU A 22 24.143 -17.872 32.490 1.00 72.02 N ATOM 329 CA LEU A 22 25.107 -17.334 31.536 1.00 12.12 C ATOM 330 C LEU A 22 25.337 -18.309 30.386 1.00 51.32 C ATOM 331 O LEU A 22 25.292 -17.926 29.217 1.00 73.15 O ATOM 332 CB LEU A 22 26.433 -17.032 32.237 1.00 53.12 C ATOM 333 CG LEU A 22 27.466 -16.261 31.415 1.00 52.43 C ATOM 334 CD1 LEU A 22 27.003 -14.831 31.181 1.00 13.13 C ATOM 335 CD2 LEU A 22 28.820 -16.278 32.108 1.00 22.02 C ATOM 0 H LEU A 22 24.504 -17.984 33.437 1.00 72.02 H new ATOM 0 HA LEU A 22 24.700 -16.409 31.128 1.00 12.12 H new ATOM 0 HB2 LEU A 22 26.221 -16.464 33.143 1.00 53.12 H new ATOM 0 HB3 LEU A 22 26.879 -17.976 32.550 1.00 53.12 H new ATOM 0 HG LEU A 22 27.570 -16.751 30.447 1.00 52.43 H new ATOM 0 HD11 LEU A 22 27.751 -14.298 30.594 1.00 13.13 H new ATOM 0 HD12 LEU A 22 26.056 -14.839 30.641 1.00 13.13 H new ATOM 0 HD13 LEU A 22 26.870 -14.330 32.140 1.00 13.13 H new ATOM 0 HD21 LEU A 22 29.543 -15.724 31.508 1.00 22.02 H new ATOM 0 HD22 LEU A 22 28.732 -15.814 33.090 1.00 22.02 H new ATOM 0 HD23 LEU A 22 29.157 -17.308 32.223 1.00 22.02 H new ATOM 347 N ARG A 23 25.582 -19.570 30.726 1.00 53.03 N ATOM 348 CA ARG A 23 25.818 -20.600 29.721 1.00 14.12 C ATOM 349 C ARG A 23 24.668 -20.656 28.720 1.00 72.23 C ATOM 350 O ARG A 23 24.883 -20.627 27.508 1.00 42.41 O ATOM 351 CB ARG A 23 25.993 -21.964 30.390 1.00 35.43 C ATOM 352 CG ARG A 23 27.401 -22.215 30.903 1.00 21.15 C ATOM 353 CD ARG A 23 27.477 -23.495 31.721 1.00 15.13 C ATOM 354 NE ARG A 23 27.250 -23.250 33.143 1.00 31.11 N ATOM 355 CZ ARG A 23 28.109 -22.605 33.924 1.00 45.01 C ATOM 356 NH1 ARG A 23 29.247 -22.142 33.423 1.00 35.11 N ATOM 357 NH2 ARG A 23 27.832 -22.421 35.208 1.00 21.44 N ATOM 0 H ARG A 23 25.622 -19.903 31.689 1.00 53.03 H new ATOM 0 HA ARG A 23 26.732 -20.346 29.184 1.00 14.12 H new ATOM 0 HB2 ARG A 23 25.293 -22.044 31.222 1.00 35.43 H new ATOM 0 HB3 ARG A 23 25.731 -22.745 29.677 1.00 35.43 H new ATOM 0 HG2 ARG A 23 28.090 -22.279 30.061 1.00 21.15 H new ATOM 0 HG3 ARG A 23 27.722 -21.372 31.514 1.00 21.15 H new ATOM 0 HD2 ARG A 23 26.737 -24.205 31.353 1.00 15.13 H new ATOM 0 HD3 ARG A 23 28.456 -23.955 31.584 1.00 15.13 H new ATOM 0 HE ARG A 23 26.384 -23.593 33.559 1.00 31.11 H new ATOM 0 HH11 ARG A 23 29.464 -22.281 32.436 1.00 35.11 H new ATOM 0 HH12 ARG A 23 29.905 -21.647 34.025 1.00 35.11 H new ATOM 0 HH21 ARG A 23 26.958 -22.775 35.597 1.00 21.44 H new ATOM 0 HH22 ARG A 23 28.493 -21.925 35.806 1.00 21.44 H new ATOM 371 N LYS A 24 23.445 -20.738 29.234 1.00 24.02 N ATOM 372 CA LYS A 24 22.260 -20.798 28.387 1.00 45.23 C ATOM 373 C LYS A 24 22.157 -19.556 27.507 1.00 3.12 C ATOM 374 O LYS A 24 22.117 -19.653 26.281 1.00 64.14 O ATOM 375 CB LYS A 24 21.001 -20.934 29.245 1.00 72.00 C ATOM 376 CG LYS A 24 20.745 -22.351 29.729 1.00 11.32 C ATOM 377 CD LYS A 24 20.145 -23.215 28.633 1.00 54.20 C ATOM 378 CE LYS A 24 19.881 -24.631 29.121 1.00 65.21 C ATOM 379 NZ LYS A 24 19.113 -25.427 28.124 1.00 30.44 N ATOM 0 H LYS A 24 23.249 -20.764 30.235 1.00 24.02 H new ATOM 0 HA LYS A 24 22.349 -21.672 27.742 1.00 45.23 H new ATOM 0 HB2 LYS A 24 21.087 -20.274 30.108 1.00 72.00 H new ATOM 0 HB3 LYS A 24 20.140 -20.595 28.669 1.00 72.00 H new ATOM 0 HG2 LYS A 24 21.680 -22.794 30.072 1.00 11.32 H new ATOM 0 HG3 LYS A 24 20.071 -22.328 30.585 1.00 11.32 H new ATOM 0 HD2 LYS A 24 19.213 -22.769 28.286 1.00 54.20 H new ATOM 0 HD3 LYS A 24 20.822 -23.244 27.779 1.00 54.20 H new ATOM 0 HE2 LYS A 24 20.830 -25.126 29.328 1.00 65.21 H new ATOM 0 HE3 LYS A 24 19.329 -24.594 30.060 1.00 65.21 H new ATOM 0 HZ1 LYS A 24 18.953 -26.386 28.494 1.00 30.44 H new ATOM 0 HZ2 LYS A 24 18.197 -24.968 27.945 1.00 30.44 H new ATOM 0 HZ3 LYS A 24 19.651 -25.484 27.236 1.00 30.44 H new ATOM 393 N VAL A 25 22.116 -18.389 28.142 1.00 50.52 N ATOM 394 CA VAL A 25 22.020 -17.127 27.417 1.00 63.22 C ATOM 395 C VAL A 25 23.093 -17.031 26.338 1.00 40.22 C ATOM 396 O VAL A 25 22.825 -16.594 25.218 1.00 61.14 O ATOM 397 CB VAL A 25 22.154 -15.922 28.367 1.00 74.21 C ATOM 398 CG1 VAL A 25 22.074 -14.617 27.589 1.00 32.41 C ATOM 399 CG2 VAL A 25 21.084 -15.975 29.447 1.00 53.01 C ATOM 0 H VAL A 25 22.148 -18.291 29.157 1.00 50.52 H new ATOM 0 HA VAL A 25 21.035 -17.104 26.950 1.00 63.22 H new ATOM 0 HB VAL A 25 23.130 -15.969 28.851 1.00 74.21 H new ATOM 0 HG11 VAL A 25 22.171 -13.777 28.277 1.00 32.41 H new ATOM 0 HG12 VAL A 25 22.880 -14.580 26.856 1.00 32.41 H new ATOM 0 HG13 VAL A 25 21.114 -14.557 27.076 1.00 32.41 H new ATOM 0 HG21 VAL A 25 21.193 -15.116 30.110 1.00 53.01 H new ATOM 0 HG22 VAL A 25 20.098 -15.953 28.983 1.00 53.01 H new ATOM 0 HG23 VAL A 25 21.193 -16.894 30.023 1.00 53.01 H new ATOM 409 N LEU A 26 24.309 -17.442 26.682 1.00 54.53 N ATOM 410 CA LEU A 26 25.424 -17.402 25.742 1.00 32.50 C ATOM 411 C LEU A 26 25.123 -18.242 24.505 1.00 52.04 C ATOM 412 O LEU A 26 25.020 -17.717 23.396 1.00 33.14 O ATOM 413 CB LEU A 26 26.702 -17.906 26.415 1.00 13.14 C ATOM 414 CG LEU A 26 27.699 -16.832 26.850 1.00 45.33 C ATOM 415 CD1 LEU A 26 28.303 -16.142 25.636 1.00 2.02 C ATOM 416 CD2 LEU A 26 27.027 -15.817 27.763 1.00 51.24 C ATOM 0 H LEU A 26 24.548 -17.806 27.604 1.00 54.53 H new ATOM 0 HA LEU A 26 25.568 -16.367 25.431 1.00 32.50 H new ATOM 0 HB2 LEU A 26 26.421 -18.489 27.292 1.00 13.14 H new ATOM 0 HB3 LEU A 26 27.207 -18.585 25.728 1.00 13.14 H new ATOM 0 HG LEU A 26 28.503 -17.314 27.407 1.00 45.33 H new ATOM 0 HD11 LEU A 26 29.010 -15.381 25.965 1.00 2.02 H new ATOM 0 HD12 LEU A 26 28.821 -16.877 25.020 1.00 2.02 H new ATOM 0 HD13 LEU A 26 27.511 -15.673 25.052 1.00 2.02 H new ATOM 0 HD21 LEU A 26 27.752 -15.060 28.062 1.00 51.24 H new ATOM 0 HD22 LEU A 26 26.203 -15.340 27.232 1.00 51.24 H new ATOM 0 HD23 LEU A 26 26.644 -16.323 28.649 1.00 51.24 H new ATOM 428 N ALA A 27 24.981 -19.548 24.702 1.00 21.54 N ATOM 429 CA ALA A 27 24.687 -20.460 23.604 1.00 65.14 C ATOM 430 C ALA A 27 23.440 -20.021 22.844 1.00 2.22 C ATOM 431 O ALA A 27 23.480 -19.814 21.631 1.00 2.33 O ATOM 432 CB ALA A 27 24.517 -21.879 24.126 1.00 44.10 C ATOM 0 H ALA A 27 25.065 -19.999 25.613 1.00 21.54 H new ATOM 0 HA ALA A 27 25.529 -20.438 22.912 1.00 65.14 H new ATOM 0 HB1 ALA A 27 24.298 -22.549 23.294 1.00 44.10 H new ATOM 0 HB2 ALA A 27 25.436 -22.199 24.617 1.00 44.10 H new ATOM 0 HB3 ALA A 27 23.695 -21.908 24.841 1.00 44.10 H new ATOM 438 N VAL A 28 22.332 -19.881 23.566 1.00 44.15 N ATOM 439 CA VAL A 28 21.073 -19.466 22.960 1.00 51.24 C ATOM 440 C VAL A 28 21.255 -18.204 22.124 1.00 13.41 C ATOM 441 O VAL A 28 21.194 -18.245 20.895 1.00 22.42 O ATOM 442 CB VAL A 28 19.993 -19.210 24.028 1.00 4.11 C ATOM 443 CG1 VAL A 28 18.710 -18.712 23.382 1.00 74.21 C ATOM 444 CG2 VAL A 28 19.738 -20.471 24.839 1.00 34.31 C ATOM 0 H VAL A 28 22.281 -20.049 24.571 1.00 44.15 H new ATOM 0 HA VAL A 28 20.748 -20.282 22.315 1.00 51.24 H new ATOM 0 HB VAL A 28 20.353 -18.436 24.706 1.00 4.11 H new ATOM 0 HG11 VAL A 28 17.959 -18.537 24.152 1.00 74.21 H new ATOM 0 HG12 VAL A 28 18.908 -17.782 22.850 1.00 74.21 H new ATOM 0 HG13 VAL A 28 18.342 -19.460 22.680 1.00 74.21 H new ATOM 0 HG21 VAL A 28 18.972 -20.273 25.589 1.00 34.31 H new ATOM 0 HG22 VAL A 28 19.399 -21.267 24.176 1.00 34.31 H new ATOM 0 HG23 VAL A 28 20.659 -20.778 25.334 1.00 34.31 H new ATOM 454 N VAL A 29 21.478 -17.081 22.799 1.00 3.44 N ATOM 455 CA VAL A 29 21.671 -15.805 22.120 1.00 71.34 C ATOM 456 C VAL A 29 22.704 -15.927 21.005 1.00 4.14 C ATOM 457 O VAL A 29 22.623 -15.236 19.991 1.00 42.12 O ATOM 458 CB VAL A 29 22.119 -14.707 23.103 1.00 73.34 C ATOM 459 CG1 VAL A 29 22.372 -13.401 22.365 1.00 24.32 C ATOM 460 CG2 VAL A 29 21.080 -14.518 24.198 1.00 43.30 C ATOM 0 H VAL A 29 21.530 -17.029 23.816 1.00 3.44 H new ATOM 0 HA VAL A 29 20.709 -15.526 21.691 1.00 71.34 H new ATOM 0 HB VAL A 29 23.053 -15.019 23.570 1.00 73.34 H new ATOM 0 HG11 VAL A 29 22.688 -12.637 23.075 1.00 24.32 H new ATOM 0 HG12 VAL A 29 23.154 -13.549 21.620 1.00 24.32 H new ATOM 0 HG13 VAL A 29 21.456 -13.080 21.870 1.00 24.32 H new ATOM 0 HG21 VAL A 29 21.412 -13.739 24.884 1.00 43.30 H new ATOM 0 HG22 VAL A 29 20.129 -14.227 23.751 1.00 43.30 H new ATOM 0 HG23 VAL A 29 20.953 -15.453 24.744 1.00 43.30 H new ATOM 470 N GLY A 30 23.677 -16.812 21.202 1.00 42.12 N ATOM 471 CA GLY A 30 24.713 -17.009 20.205 1.00 43.20 C ATOM 472 C GLY A 30 24.161 -17.513 18.886 1.00 10.05 C ATOM 473 O GLY A 30 24.069 -16.762 17.915 1.00 62.14 O ATOM 0 H GLY A 30 23.766 -17.396 22.034 1.00 42.12 H new ATOM 0 HA2 GLY A 30 25.237 -16.068 20.040 1.00 43.20 H new ATOM 0 HA3 GLY A 30 25.447 -17.721 20.584 1.00 43.20 H new ATOM 477 N THR A 31 23.793 -18.790 18.850 1.00 12.03 N ATOM 478 CA THR A 31 23.250 -19.395 17.641 1.00 54.23 C ATOM 479 C THR A 31 21.989 -18.670 17.182 1.00 63.21 C ATOM 480 O THR A 31 21.800 -18.428 15.990 1.00 22.13 O ATOM 481 CB THR A 31 22.922 -20.884 17.856 1.00 61.53 C ATOM 482 OG1 THR A 31 23.221 -21.262 19.204 1.00 15.14 O ATOM 483 CG2 THR A 31 23.713 -21.757 16.893 1.00 40.13 C ATOM 0 H THR A 31 23.861 -19.425 19.645 1.00 12.03 H new ATOM 0 HA THR A 31 24.017 -19.307 16.872 1.00 54.23 H new ATOM 0 HB THR A 31 21.859 -21.030 17.665 1.00 61.53 H new ATOM 0 HG1 THR A 31 22.431 -21.121 19.766 1.00 15.14 H new ATOM 0 HG21 THR A 31 23.465 -22.805 17.064 1.00 40.13 H new ATOM 0 HG22 THR A 31 23.462 -21.487 15.867 1.00 40.13 H new ATOM 0 HG23 THR A 31 24.780 -21.606 17.057 1.00 40.13 H new ATOM 491 N ALA A 32 21.130 -18.326 18.135 1.00 1.25 N ATOM 492 CA ALA A 32 19.889 -17.626 17.829 1.00 73.01 C ATOM 493 C ALA A 32 20.158 -16.352 17.036 1.00 43.05 C ATOM 494 O ALA A 32 19.669 -16.190 15.918 1.00 32.11 O ATOM 495 CB ALA A 32 19.135 -17.303 19.110 1.00 12.43 C ATOM 0 H ALA A 32 21.271 -18.521 19.126 1.00 1.25 H new ATOM 0 HA ALA A 32 19.273 -18.282 17.214 1.00 73.01 H new ATOM 0 HB1 ALA A 32 18.210 -16.780 18.866 1.00 12.43 H new ATOM 0 HB2 ALA A 32 18.901 -18.228 19.637 1.00 12.43 H new ATOM 0 HB3 ALA A 32 19.753 -16.669 19.746 1.00 12.43 H new ATOM 501 N ALA A 33 20.939 -15.450 17.621 1.00 42.11 N ATOM 502 CA ALA A 33 21.275 -14.191 16.968 1.00 54.23 C ATOM 503 C ALA A 33 22.064 -14.431 15.686 1.00 45.24 C ATOM 504 O ALA A 33 21.975 -13.653 14.736 1.00 63.52 O ATOM 505 CB ALA A 33 22.062 -13.298 17.915 1.00 15.24 C ATOM 0 H ALA A 33 21.351 -15.568 18.547 1.00 42.11 H new ATOM 0 HA ALA A 33 20.345 -13.689 16.702 1.00 54.23 H new ATOM 0 HB1 ALA A 33 22.306 -12.361 17.414 1.00 15.24 H new ATOM 0 HB2 ALA A 33 21.463 -13.090 18.801 1.00 15.24 H new ATOM 0 HB3 ALA A 33 22.982 -13.802 18.210 1.00 15.24 H new ATOM 511 N ALA A 34 22.838 -15.511 15.666 1.00 32.51 N ATOM 512 CA ALA A 34 23.642 -15.854 14.500 1.00 64.10 C ATOM 513 C ALA A 34 22.770 -16.017 13.260 1.00 61.41 C ATOM 514 O ALA A 34 23.240 -15.859 12.133 1.00 23.43 O ATOM 515 CB ALA A 34 24.435 -17.126 14.761 1.00 24.11 C ATOM 0 H ALA A 34 22.925 -16.164 16.445 1.00 32.51 H new ATOM 0 HA ALA A 34 24.339 -15.036 14.317 1.00 64.10 H new ATOM 0 HB1 ALA A 34 25.031 -17.370 13.882 1.00 24.11 H new ATOM 0 HB2 ALA A 34 25.094 -16.975 15.616 1.00 24.11 H new ATOM 0 HB3 ALA A 34 23.749 -17.946 14.973 1.00 24.11 H new ATOM 521 N SER A 35 21.498 -16.335 13.475 1.00 74.41 N ATOM 522 CA SER A 35 20.560 -16.525 12.374 1.00 45.22 C ATOM 523 C SER A 35 19.663 -15.302 12.208 1.00 63.03 C ATOM 524 O SER A 35 18.585 -15.385 11.620 1.00 12.11 O ATOM 525 CB SER A 35 19.705 -17.770 12.613 1.00 70.42 C ATOM 526 OG SER A 35 20.145 -18.853 11.810 1.00 14.44 O ATOM 0 H SER A 35 21.093 -16.467 14.402 1.00 74.41 H new ATOM 0 HA SER A 35 21.135 -16.659 11.458 1.00 45.22 H new ATOM 0 HB2 SER A 35 19.752 -18.051 13.665 1.00 70.42 H new ATOM 0 HB3 SER A 35 18.662 -17.547 12.389 1.00 70.42 H new ATOM 0 HG SER A 35 19.583 -19.637 11.982 1.00 14.44 H new ATOM 532 N SER A 36 20.117 -14.167 12.730 1.00 65.30 N ATOM 533 CA SER A 36 19.355 -12.927 12.644 1.00 63.13 C ATOM 534 C SER A 36 20.024 -11.944 11.688 1.00 5.44 C ATOM 535 O SER A 36 21.206 -11.631 11.830 1.00 21.24 O ATOM 536 CB SER A 36 19.213 -12.294 14.029 1.00 3.40 C ATOM 537 OG SER A 36 18.354 -11.168 13.989 1.00 13.33 O ATOM 0 H SER A 36 21.009 -14.081 13.217 1.00 65.30 H new ATOM 0 HA SER A 36 18.364 -13.164 12.258 1.00 63.13 H new ATOM 0 HB2 SER A 36 18.820 -13.030 14.730 1.00 3.40 H new ATOM 0 HB3 SER A 36 20.194 -11.994 14.398 1.00 3.40 H new ATOM 0 HG SER A 36 18.278 -10.782 14.887 1.00 13.33 H new ATOM 543 N GLU A 37 19.259 -11.460 10.715 1.00 11.32 N ATOM 544 CA GLU A 37 19.778 -10.512 9.736 1.00 73.34 C ATOM 545 C GLU A 37 19.482 -9.076 10.158 1.00 23.13 C ATOM 546 O GLU A 37 19.485 -8.161 9.334 1.00 70.42 O ATOM 547 CB GLU A 37 19.171 -10.785 8.358 1.00 75.31 C ATOM 548 CG GLU A 37 20.193 -11.204 7.314 1.00 14.43 C ATOM 549 CD GLU A 37 20.403 -12.705 7.273 1.00 4.31 C ATOM 550 OE1 GLU A 37 19.503 -13.418 6.782 1.00 5.41 O ATOM 551 OE2 GLU A 37 21.469 -13.166 7.732 1.00 23.21 O ATOM 0 H GLU A 37 18.278 -11.708 10.584 1.00 11.32 H new ATOM 0 HA GLU A 37 20.859 -10.641 9.682 1.00 73.34 H new ATOM 0 HB2 GLU A 37 18.418 -11.567 8.451 1.00 75.31 H new ATOM 0 HB3 GLU A 37 18.658 -9.888 8.012 1.00 75.31 H new ATOM 0 HG2 GLU A 37 19.867 -10.860 6.333 1.00 14.43 H new ATOM 0 HG3 GLU A 37 21.143 -10.713 7.524 1.00 14.43 H new ATOM 558 N HIS A 38 19.227 -8.886 11.449 1.00 50.21 N ATOM 559 CA HIS A 38 18.929 -7.561 11.982 1.00 24.21 C ATOM 560 C HIS A 38 20.184 -6.694 12.013 1.00 10.40 C ATOM 561 O HIS A 38 21.311 -7.187 11.959 1.00 12.21 O ATOM 562 CB HIS A 38 18.339 -7.675 13.388 1.00 62.10 C ATOM 563 CG HIS A 38 16.843 -7.729 13.407 1.00 55.33 C ATOM 564 ND1 HIS A 38 16.120 -8.774 12.870 1.00 1.43 N ATOM 565 CD2 HIS A 38 15.932 -6.859 13.903 1.00 33.21 C ATOM 566 CE1 HIS A 38 14.830 -8.544 13.034 1.00 14.43 C ATOM 567 NE2 HIS A 38 14.688 -7.388 13.659 1.00 63.41 N ATOM 0 H HIS A 38 19.221 -9.632 12.145 1.00 50.21 H new ATOM 0 HA HIS A 38 18.198 -7.088 11.327 1.00 24.21 H new ATOM 0 HB2 HIS A 38 18.733 -8.572 13.867 1.00 62.10 H new ATOM 0 HB3 HIS A 38 18.671 -6.824 13.983 1.00 62.10 H new ATOM 0 HD2 HIS A 38 16.144 -5.923 14.398 1.00 33.21 H new ATOM 0 HE1 HIS A 38 14.027 -9.191 12.712 1.00 14.43 H new ATOM 0 HE2 HIS A 38 13.800 -6.959 13.918 1.00 63.41 H new ATOM 575 N PRO A 39 19.987 -5.370 12.101 1.00 14.21 N ATOM 576 CA PRO A 39 21.090 -4.406 12.141 1.00 43.22 C ATOM 577 C PRO A 39 21.874 -4.475 13.447 1.00 14.13 C ATOM 578 O PRO A 39 22.910 -3.826 13.597 1.00 14.51 O ATOM 579 CB PRO A 39 20.385 -3.054 12.011 1.00 10.50 C ATOM 580 CG PRO A 39 19.009 -3.292 12.531 1.00 64.32 C ATOM 581 CD PRO A 39 18.671 -4.712 12.169 1.00 31.13 C ATOM 0 HA PRO A 39 21.825 -4.596 11.359 1.00 43.22 H new ATOM 0 HB2 PRO A 39 20.898 -2.283 12.587 1.00 10.50 H new ATOM 0 HB3 PRO A 39 20.364 -2.717 10.975 1.00 10.50 H new ATOM 0 HG2 PRO A 39 18.968 -3.144 13.610 1.00 64.32 H new ATOM 0 HG3 PRO A 39 18.298 -2.596 12.087 1.00 64.32 H new ATOM 0 HD2 PRO A 39 18.028 -5.175 12.918 1.00 31.13 H new ATOM 0 HD3 PRO A 39 18.144 -4.769 11.217 1.00 31.13 H new ATOM 589 N LEU A 40 21.373 -5.265 14.390 1.00 24.54 N ATOM 590 CA LEU A 40 22.027 -5.420 15.685 1.00 2.03 C ATOM 591 C LEU A 40 22.768 -6.751 15.766 1.00 43.32 C ATOM 592 O LEU A 40 23.383 -7.070 16.782 1.00 4.23 O ATOM 593 CB LEU A 40 20.998 -5.328 16.813 1.00 55.42 C ATOM 594 CG LEU A 40 19.999 -4.174 16.717 1.00 52.22 C ATOM 595 CD1 LEU A 40 18.847 -4.382 17.688 1.00 24.22 C ATOM 596 CD2 LEU A 40 20.691 -2.845 16.985 1.00 61.44 C ATOM 0 H LEU A 40 20.516 -5.808 14.282 1.00 24.54 H new ATOM 0 HA LEU A 40 22.752 -4.614 15.796 1.00 2.03 H new ATOM 0 HB2 LEU A 40 20.440 -6.264 16.846 1.00 55.42 H new ATOM 0 HB3 LEU A 40 21.532 -5.242 17.759 1.00 55.42 H new ATOM 0 HG LEU A 40 19.595 -4.153 15.705 1.00 52.22 H new ATOM 0 HD11 LEU A 40 18.147 -3.551 17.605 1.00 24.22 H new ATOM 0 HD12 LEU A 40 18.334 -5.314 17.450 1.00 24.22 H new ATOM 0 HD13 LEU A 40 19.233 -4.431 18.706 1.00 24.22 H new ATOM 0 HD21 LEU A 40 19.965 -2.035 16.912 1.00 61.44 H new ATOM 0 HD22 LEU A 40 21.124 -2.855 17.985 1.00 61.44 H new ATOM 0 HD23 LEU A 40 21.481 -2.691 16.249 1.00 61.44 H new ATOM 608 N GLY A 41 22.707 -7.523 14.685 1.00 34.13 N ATOM 609 CA GLY A 41 23.378 -8.809 14.654 1.00 72.44 C ATOM 610 C GLY A 41 24.839 -8.711 15.045 1.00 11.21 C ATOM 611 O GLY A 41 25.297 -9.415 15.945 1.00 11.33 O ATOM 0 H GLY A 41 22.205 -7.281 13.831 1.00 34.13 H new ATOM 0 HA2 GLY A 41 22.870 -9.497 15.330 1.00 72.44 H new ATOM 0 HA3 GLY A 41 23.301 -9.231 13.652 1.00 72.44 H new ATOM 615 N VAL A 42 25.574 -7.836 14.366 1.00 1.33 N ATOM 616 CA VAL A 42 26.992 -7.648 14.648 1.00 43.24 C ATOM 617 C VAL A 42 27.228 -7.383 16.130 1.00 22.33 C ATOM 618 O VAL A 42 28.179 -7.897 16.719 1.00 11.43 O ATOM 619 CB VAL A 42 27.577 -6.481 13.830 1.00 52.32 C ATOM 620 CG1 VAL A 42 27.662 -6.851 12.357 1.00 45.31 C ATOM 621 CG2 VAL A 42 26.742 -5.224 14.025 1.00 45.24 C ATOM 0 H VAL A 42 25.211 -7.246 13.617 1.00 1.33 H new ATOM 0 HA VAL A 42 27.496 -8.571 14.363 1.00 43.24 H new ATOM 0 HB VAL A 42 28.587 -6.279 14.188 1.00 52.32 H new ATOM 0 HG11 VAL A 42 28.077 -6.014 11.795 1.00 45.31 H new ATOM 0 HG12 VAL A 42 28.305 -7.723 12.237 1.00 45.31 H new ATOM 0 HG13 VAL A 42 26.665 -7.081 11.981 1.00 45.31 H new ATOM 0 HG21 VAL A 42 27.169 -4.409 13.440 1.00 45.24 H new ATOM 0 HG22 VAL A 42 25.720 -5.411 13.695 1.00 45.24 H new ATOM 0 HG23 VAL A 42 26.738 -4.950 15.080 1.00 45.24 H new ATOM 631 N ALA A 43 26.356 -6.579 16.728 1.00 15.14 N ATOM 632 CA ALA A 43 26.467 -6.248 18.144 1.00 40.15 C ATOM 633 C ALA A 43 26.329 -7.494 19.011 1.00 23.23 C ATOM 634 O ALA A 43 27.226 -7.824 19.788 1.00 35.32 O ATOM 635 CB ALA A 43 25.418 -5.216 18.528 1.00 15.24 C ATOM 0 H ALA A 43 25.564 -6.144 16.254 1.00 15.14 H new ATOM 0 HA ALA A 43 27.457 -5.825 18.317 1.00 40.15 H new ATOM 0 HB1 ALA A 43 25.512 -4.978 19.588 1.00 15.24 H new ATOM 0 HB2 ALA A 43 25.565 -4.311 17.938 1.00 15.24 H new ATOM 0 HB3 ALA A 43 24.424 -5.618 18.334 1.00 15.24 H new ATOM 641 N VAL A 44 25.201 -8.183 18.875 1.00 73.13 N ATOM 642 CA VAL A 44 24.946 -9.394 19.646 1.00 12.32 C ATOM 643 C VAL A 44 26.040 -10.431 19.419 1.00 52.13 C ATOM 644 O VAL A 44 26.508 -11.073 20.359 1.00 31.24 O ATOM 645 CB VAL A 44 23.583 -10.013 19.284 1.00 31.43 C ATOM 646 CG1 VAL A 44 23.349 -11.290 20.078 1.00 50.13 C ATOM 647 CG2 VAL A 44 22.462 -9.013 19.525 1.00 25.13 C ATOM 0 H VAL A 44 24.448 -7.923 18.238 1.00 73.13 H new ATOM 0 HA VAL A 44 24.937 -9.104 20.697 1.00 12.32 H new ATOM 0 HB VAL A 44 23.589 -10.268 18.224 1.00 31.43 H new ATOM 0 HG11 VAL A 44 22.381 -11.713 19.809 1.00 50.13 H new ATOM 0 HG12 VAL A 44 24.136 -12.009 19.850 1.00 50.13 H new ATOM 0 HG13 VAL A 44 23.362 -11.063 21.144 1.00 50.13 H new ATOM 0 HG21 VAL A 44 21.506 -9.468 19.264 1.00 25.13 H new ATOM 0 HG22 VAL A 44 22.451 -8.725 20.576 1.00 25.13 H new ATOM 0 HG23 VAL A 44 22.624 -8.129 18.908 1.00 25.13 H new ATOM 657 N THR A 45 26.445 -10.590 18.163 1.00 71.15 N ATOM 658 CA THR A 45 27.484 -11.550 17.810 1.00 13.42 C ATOM 659 C THR A 45 28.770 -11.275 18.580 1.00 3.42 C ATOM 660 O THR A 45 29.301 -12.155 19.258 1.00 41.13 O ATOM 661 CB THR A 45 27.786 -11.521 16.300 1.00 4.22 C ATOM 662 OG1 THR A 45 26.606 -11.848 15.558 1.00 44.33 O ATOM 663 CG2 THR A 45 28.898 -12.499 15.952 1.00 31.43 C ATOM 0 H THR A 45 26.069 -10.066 17.373 1.00 71.15 H new ATOM 0 HA THR A 45 27.107 -12.537 18.078 1.00 13.42 H new ATOM 0 HB THR A 45 28.113 -10.515 16.036 1.00 4.22 H new ATOM 0 HG1 THR A 45 25.988 -11.088 15.575 1.00 44.33 H new ATOM 0 HG21 THR A 45 29.094 -12.461 14.880 1.00 31.43 H new ATOM 0 HG22 THR A 45 29.803 -12.229 16.496 1.00 31.43 H new ATOM 0 HG23 THR A 45 28.595 -13.508 16.230 1.00 31.43 H new ATOM 671 N LYS A 46 29.268 -10.047 18.473 1.00 74.23 N ATOM 672 CA LYS A 46 30.492 -9.654 19.161 1.00 72.25 C ATOM 673 C LYS A 46 30.346 -9.822 20.670 1.00 70.45 C ATOM 674 O LYS A 46 31.287 -10.228 21.352 1.00 10.44 O ATOM 675 CB LYS A 46 30.843 -8.202 18.830 1.00 0.22 C ATOM 676 CG LYS A 46 31.708 -8.052 17.591 1.00 52.05 C ATOM 677 CD LYS A 46 33.156 -7.769 17.952 1.00 63.30 C ATOM 678 CE LYS A 46 33.952 -7.302 16.742 1.00 33.35 C ATOM 679 NZ LYS A 46 35.099 -8.206 16.451 1.00 51.25 N ATOM 0 H LYS A 46 28.842 -9.307 17.916 1.00 74.23 H new ATOM 0 HA LYS A 46 31.297 -10.303 18.817 1.00 72.25 H new ATOM 0 HB2 LYS A 46 29.921 -7.637 18.690 1.00 0.22 H new ATOM 0 HB3 LYS A 46 31.362 -7.760 19.681 1.00 0.22 H new ATOM 0 HG2 LYS A 46 31.652 -8.963 16.995 1.00 52.05 H new ATOM 0 HG3 LYS A 46 31.321 -7.242 16.972 1.00 52.05 H new ATOM 0 HD2 LYS A 46 33.196 -7.007 18.731 1.00 63.30 H new ATOM 0 HD3 LYS A 46 33.612 -8.669 18.363 1.00 63.30 H new ATOM 0 HE2 LYS A 46 33.297 -7.255 15.872 1.00 33.35 H new ATOM 0 HE3 LYS A 46 34.321 -6.292 16.918 1.00 33.35 H new ATOM 0 HZ1 LYS A 46 35.616 -7.854 15.620 1.00 51.25 H new ATOM 0 HZ2 LYS A 46 35.738 -8.231 17.271 1.00 51.25 H new ATOM 0 HZ3 LYS A 46 34.745 -9.165 16.258 1.00 51.25 H new ATOM 693 N TYR A 47 29.161 -9.510 21.183 1.00 25.32 N ATOM 694 CA TYR A 47 28.893 -9.626 22.612 1.00 63.23 C ATOM 695 C TYR A 47 29.078 -11.064 23.086 1.00 62.52 C ATOM 696 O TYR A 47 29.995 -11.364 23.852 1.00 72.42 O ATOM 697 CB TYR A 47 27.473 -9.153 22.925 1.00 1.44 C ATOM 698 CG TYR A 47 27.080 -9.334 24.374 1.00 24.02 C ATOM 699 CD1 TYR A 47 27.932 -8.942 25.399 1.00 4.34 C ATOM 700 CD2 TYR A 47 25.858 -9.898 24.718 1.00 24.50 C ATOM 701 CE1 TYR A 47 27.578 -9.106 26.725 1.00 64.04 C ATOM 702 CE2 TYR A 47 25.495 -10.065 26.040 1.00 24.24 C ATOM 703 CZ TYR A 47 26.359 -9.668 27.040 1.00 52.20 C ATOM 704 OH TYR A 47 26.001 -9.834 28.359 1.00 45.45 O ATOM 0 H TYR A 47 28.371 -9.175 20.631 1.00 25.32 H new ATOM 0 HA TYR A 47 29.605 -8.994 23.142 1.00 63.23 H new ATOM 0 HB2 TYR A 47 27.384 -8.099 22.662 1.00 1.44 H new ATOM 0 HB3 TYR A 47 26.770 -9.699 22.296 1.00 1.44 H new ATOM 0 HD1 TYR A 47 28.888 -8.501 25.155 1.00 4.34 H new ATOM 0 HD2 TYR A 47 25.180 -10.211 23.938 1.00 24.50 H new ATOM 0 HE1 TYR A 47 28.252 -8.796 27.510 1.00 64.04 H new ATOM 0 HE2 TYR A 47 24.540 -10.504 26.290 1.00 24.24 H new ATOM 0 HH TYR A 47 25.112 -10.243 28.408 1.00 45.45 H new ATOM 714 N CYS A 48 28.202 -11.950 22.624 1.00 12.44 N ATOM 715 CA CYS A 48 28.267 -13.357 23.000 1.00 32.43 C ATOM 716 C CYS A 48 29.628 -13.951 22.651 1.00 34.21 C ATOM 717 O CYS A 48 30.108 -14.866 23.320 1.00 61.41 O ATOM 718 CB CYS A 48 27.158 -14.145 22.301 1.00 63.33 C ATOM 719 SG CYS A 48 27.273 -14.137 20.496 1.00 21.33 S ATOM 0 H CYS A 48 27.439 -11.718 21.988 1.00 12.44 H new ATOM 0 HA CYS A 48 28.127 -13.426 24.079 1.00 32.43 H new ATOM 0 HB2 CYS A 48 27.184 -15.177 22.652 1.00 63.33 H new ATOM 0 HB3 CYS A 48 26.193 -13.732 22.595 1.00 63.33 H new ATOM 0 HG CYS A 48 28.157 -13.260 20.121 1.00 21.33 H new ATOM 725 N LYS A 49 30.244 -13.425 21.598 1.00 31.30 N ATOM 726 CA LYS A 49 31.550 -13.902 21.158 1.00 34.51 C ATOM 727 C LYS A 49 32.629 -13.553 22.178 1.00 34.00 C ATOM 728 O LYS A 49 33.541 -14.341 22.424 1.00 34.51 O ATOM 729 CB LYS A 49 31.904 -13.298 19.797 1.00 23.54 C ATOM 730 CG LYS A 49 33.341 -13.552 19.375 1.00 20.21 C ATOM 731 CD LYS A 49 33.441 -13.847 17.888 1.00 44.01 C ATOM 732 CE LYS A 49 33.088 -12.626 17.053 1.00 42.14 C ATOM 733 NZ LYS A 49 33.521 -12.779 15.636 1.00 73.01 N ATOM 0 H LYS A 49 29.860 -12.668 21.033 1.00 31.30 H new ATOM 0 HA LYS A 49 31.501 -14.987 21.065 1.00 34.51 H new ATOM 0 HB2 LYS A 49 31.234 -13.708 19.041 1.00 23.54 H new ATOM 0 HB3 LYS A 49 31.728 -12.223 19.829 1.00 23.54 H new ATOM 0 HG2 LYS A 49 33.951 -12.682 19.616 1.00 20.21 H new ATOM 0 HG3 LYS A 49 33.745 -14.391 19.941 1.00 20.21 H new ATOM 0 HD2 LYS A 49 34.453 -14.173 17.648 1.00 44.01 H new ATOM 0 HD3 LYS A 49 32.772 -14.669 17.633 1.00 44.01 H new ATOM 0 HE2 LYS A 49 32.011 -12.461 17.088 1.00 42.14 H new ATOM 0 HE3 LYS A 49 33.560 -11.743 17.484 1.00 42.14 H new ATOM 0 HZ1 LYS A 49 33.262 -11.926 15.100 1.00 73.01 H new ATOM 0 HZ2 LYS A 49 34.552 -12.911 15.600 1.00 73.01 H new ATOM 0 HZ3 LYS A 49 33.051 -13.607 15.217 1.00 73.01 H new ATOM 747 N GLU A 50 32.517 -12.367 22.769 1.00 73.34 N ATOM 748 CA GLU A 50 33.483 -11.915 23.762 1.00 23.44 C ATOM 749 C GLU A 50 33.170 -12.506 25.134 1.00 31.01 C ATOM 750 O GLU A 50 34.053 -12.635 25.982 1.00 54.53 O ATOM 751 CB GLU A 50 33.490 -10.387 23.842 1.00 34.43 C ATOM 752 CG GLU A 50 34.568 -9.830 24.756 1.00 21.00 C ATOM 753 CD GLU A 50 34.748 -8.332 24.600 1.00 20.53 C ATOM 754 OE1 GLU A 50 33.931 -7.706 23.894 1.00 74.30 O ATOM 755 OE2 GLU A 50 35.707 -7.787 25.186 1.00 50.24 O ATOM 0 H GLU A 50 31.767 -11.703 22.577 1.00 73.34 H new ATOM 0 HA GLU A 50 34.470 -12.259 23.454 1.00 23.44 H new ATOM 0 HB2 GLU A 50 33.629 -9.980 22.840 1.00 34.43 H new ATOM 0 HB3 GLU A 50 32.516 -10.046 24.193 1.00 34.43 H new ATOM 0 HG2 GLU A 50 34.313 -10.056 25.792 1.00 21.00 H new ATOM 0 HG3 GLU A 50 35.513 -10.330 24.544 1.00 21.00 H new ATOM 762 N GLU A 51 31.907 -12.863 25.344 1.00 55.42 N ATOM 763 CA GLU A 51 31.476 -13.438 26.613 1.00 65.12 C ATOM 764 C GLU A 51 31.833 -14.920 26.687 1.00 42.02 C ATOM 765 O GLU A 51 32.154 -15.440 27.756 1.00 24.32 O ATOM 766 CB GLU A 51 29.968 -13.256 26.796 1.00 44.41 C ATOM 767 CG GLU A 51 29.601 -12.381 27.983 1.00 71.11 C ATOM 768 CD GLU A 51 29.933 -13.031 29.312 1.00 64.32 C ATOM 769 OE1 GLU A 51 29.432 -14.146 29.568 1.00 63.43 O ATOM 770 OE2 GLU A 51 30.694 -12.426 30.095 1.00 11.15 O ATOM 0 H GLU A 51 31.164 -12.764 24.652 1.00 55.42 H new ATOM 0 HA GLU A 51 31.997 -12.915 27.415 1.00 65.12 H new ATOM 0 HB2 GLU A 51 29.551 -12.818 25.889 1.00 44.41 H new ATOM 0 HB3 GLU A 51 29.505 -14.235 26.920 1.00 44.41 H new ATOM 0 HG2 GLU A 51 30.129 -11.431 27.906 1.00 71.11 H new ATOM 0 HG3 GLU A 51 28.535 -12.157 27.949 1.00 71.11 H new ATOM 777 N LEU A 52 31.774 -15.594 25.544 1.00 70.31 N ATOM 778 CA LEU A 52 32.090 -17.017 25.478 1.00 41.03 C ATOM 779 C LEU A 52 33.556 -17.233 25.116 1.00 40.21 C ATOM 780 O LEU A 52 34.174 -18.208 25.541 1.00 72.22 O ATOM 781 CB LEU A 52 31.192 -17.712 24.452 1.00 3.25 C ATOM 782 CG LEU A 52 30.437 -18.946 24.948 1.00 2.54 C ATOM 783 CD1 LEU A 52 29.553 -19.509 23.847 1.00 62.04 C ATOM 784 CD2 LEU A 52 31.412 -20.003 25.446 1.00 72.00 C ATOM 0 H LEU A 52 31.510 -15.179 24.650 1.00 70.31 H new ATOM 0 HA LEU A 52 31.910 -17.450 26.462 1.00 41.03 H new ATOM 0 HB2 LEU A 52 30.464 -16.988 24.086 1.00 3.25 H new ATOM 0 HB3 LEU A 52 31.806 -18.004 23.600 1.00 3.25 H new ATOM 0 HG LEU A 52 29.799 -18.648 25.780 1.00 2.54 H new ATOM 0 HD11 LEU A 52 29.024 -20.387 24.218 1.00 62.04 H new ATOM 0 HD12 LEU A 52 28.831 -18.753 23.538 1.00 62.04 H new ATOM 0 HD13 LEU A 52 30.170 -19.791 22.994 1.00 62.04 H new ATOM 0 HD21 LEU A 52 30.857 -20.874 25.795 1.00 72.00 H new ATOM 0 HD22 LEU A 52 32.076 -20.297 24.633 1.00 72.00 H new ATOM 0 HD23 LEU A 52 32.002 -19.596 26.267 1.00 72.00 H new ATOM 796 N GLY A 53 34.108 -16.314 24.329 1.00 11.32 N ATOM 797 CA GLY A 53 35.498 -16.421 23.925 1.00 14.43 C ATOM 798 C GLY A 53 35.707 -17.454 22.836 1.00 21.15 C ATOM 799 O GLY A 53 36.823 -17.934 22.630 1.00 14.54 O ATOM 0 H GLY A 53 33.617 -15.498 23.964 1.00 11.32 H new ATOM 0 HA2 GLY A 53 35.846 -15.450 23.572 1.00 14.43 H new ATOM 0 HA3 GLY A 53 36.106 -16.683 24.791 1.00 14.43 H new ATOM 803 N THR A 54 34.631 -17.801 22.137 1.00 61.01 N ATOM 804 CA THR A 54 34.701 -18.786 21.065 1.00 21.44 C ATOM 805 C THR A 54 33.740 -18.438 19.934 1.00 23.04 C ATOM 806 O THR A 54 32.672 -17.873 20.168 1.00 62.44 O ATOM 807 CB THR A 54 34.377 -20.201 21.581 1.00 23.23 C ATOM 808 OG1 THR A 54 34.110 -21.075 20.479 1.00 25.50 O ATOM 809 CG2 THR A 54 33.177 -20.175 22.516 1.00 5.12 C ATOM 0 H THR A 54 33.700 -17.414 22.294 1.00 61.01 H new ATOM 0 HA THR A 54 35.723 -18.769 20.687 1.00 21.44 H new ATOM 0 HB THR A 54 35.241 -20.568 22.135 1.00 23.23 H new ATOM 0 HG1 THR A 54 33.273 -21.559 20.641 1.00 25.50 H new ATOM 0 HG21 THR A 54 32.968 -21.185 22.867 1.00 5.12 H new ATOM 0 HG22 THR A 54 33.394 -19.532 23.369 1.00 5.12 H new ATOM 0 HG23 THR A 54 32.308 -19.789 21.983 1.00 5.12 H new ATOM 817 N GLU A 55 34.127 -18.779 18.709 1.00 23.01 N ATOM 818 CA GLU A 55 33.298 -18.501 17.542 1.00 65.20 C ATOM 819 C GLU A 55 32.484 -19.730 17.148 1.00 20.11 C ATOM 820 O GLU A 55 31.910 -19.787 16.060 1.00 44.02 O ATOM 821 CB GLU A 55 34.169 -18.054 16.366 1.00 72.04 C ATOM 822 CG GLU A 55 34.425 -16.557 16.332 1.00 12.35 C ATOM 823 CD GLU A 55 35.365 -16.150 15.215 1.00 63.24 C ATOM 824 OE1 GLU A 55 35.154 -16.602 14.069 1.00 5.33 O ATOM 825 OE2 GLU A 55 36.312 -15.382 15.485 1.00 55.45 O ATOM 0 H GLU A 55 35.008 -19.248 18.499 1.00 23.01 H new ATOM 0 HA GLU A 55 32.608 -17.697 17.800 1.00 65.20 H new ATOM 0 HB2 GLU A 55 35.125 -18.576 16.413 1.00 72.04 H new ATOM 0 HB3 GLU A 55 33.688 -18.353 15.435 1.00 72.04 H new ATOM 0 HG2 GLU A 55 33.477 -16.033 16.212 1.00 12.35 H new ATOM 0 HG3 GLU A 55 34.845 -16.242 17.287 1.00 12.35 H new ATOM 832 N THR A 56 32.438 -20.714 18.041 1.00 2.33 N ATOM 833 CA THR A 56 31.697 -21.942 17.788 1.00 75.42 C ATOM 834 C THR A 56 30.193 -21.693 17.815 1.00 10.40 C ATOM 835 O THR A 56 29.552 -21.814 18.860 1.00 51.02 O ATOM 836 CB THR A 56 32.043 -23.031 18.821 1.00 63.23 C ATOM 837 OG1 THR A 56 31.905 -22.510 20.147 1.00 5.22 O ATOM 838 CG2 THR A 56 33.462 -23.540 18.615 1.00 2.12 C ATOM 0 H THR A 56 32.906 -20.683 18.947 1.00 2.33 H new ATOM 0 HA THR A 56 31.988 -22.287 16.796 1.00 75.42 H new ATOM 0 HB THR A 56 31.352 -23.863 18.685 1.00 63.23 H new ATOM 0 HG1 THR A 56 31.083 -21.979 20.206 1.00 5.22 H new ATOM 0 HG21 THR A 56 33.684 -24.308 19.356 1.00 2.12 H new ATOM 0 HG22 THR A 56 33.555 -23.963 17.615 1.00 2.12 H new ATOM 0 HG23 THR A 56 34.165 -22.714 18.727 1.00 2.12 H new ATOM 846 N LEU A 57 29.635 -21.344 16.661 1.00 1.20 N ATOM 847 CA LEU A 57 28.205 -21.077 16.552 1.00 31.43 C ATOM 848 C LEU A 57 27.709 -21.337 15.133 1.00 0.13 C ATOM 849 O LEU A 57 28.488 -21.327 14.181 1.00 11.21 O ATOM 850 CB LEU A 57 27.903 -19.633 16.954 1.00 42.51 C ATOM 851 CG LEU A 57 27.995 -19.318 18.448 1.00 73.05 C ATOM 852 CD1 LEU A 57 27.770 -17.835 18.695 1.00 14.44 C ATOM 853 CD2 LEU A 57 26.989 -20.150 19.230 1.00 23.02 C ATOM 0 H LEU A 57 30.151 -21.239 15.787 1.00 1.20 H new ATOM 0 HA LEU A 57 27.682 -21.752 17.229 1.00 31.43 H new ATOM 0 HB2 LEU A 57 28.592 -18.977 16.422 1.00 42.51 H new ATOM 0 HB3 LEU A 57 26.898 -19.384 16.612 1.00 42.51 H new ATOM 0 HG LEU A 57 28.996 -19.575 18.794 1.00 73.05 H new ATOM 0 HD11 LEU A 57 27.839 -17.629 19.763 1.00 14.44 H new ATOM 0 HD12 LEU A 57 28.528 -17.259 18.165 1.00 14.44 H new ATOM 0 HD13 LEU A 57 26.781 -17.552 18.334 1.00 14.44 H new ATOM 0 HD21 LEU A 57 27.068 -19.914 20.291 1.00 23.02 H new ATOM 0 HD22 LEU A 57 25.981 -19.924 18.882 1.00 23.02 H new ATOM 0 HD23 LEU A 57 27.196 -21.209 19.078 1.00 23.02 H new ATOM 865 N GLY A 58 26.406 -21.567 15.000 1.00 63.32 N ATOM 866 CA GLY A 58 25.828 -21.824 13.694 1.00 44.14 C ATOM 867 C GLY A 58 25.644 -23.304 13.422 1.00 41.33 C ATOM 868 O GLY A 58 25.876 -23.771 12.306 1.00 3.34 O ATOM 0 H GLY A 58 25.741 -21.580 15.773 1.00 63.32 H new ATOM 0 HA2 GLY A 58 24.863 -21.322 13.622 1.00 44.14 H new ATOM 0 HA3 GLY A 58 26.470 -21.394 12.925 1.00 44.14 H new ATOM 872 N TYR A 59 25.227 -24.044 14.443 1.00 3.31 N ATOM 873 CA TYR A 59 25.016 -25.480 14.310 1.00 21.21 C ATOM 874 C TYR A 59 23.529 -25.818 14.353 1.00 60.52 C ATOM 875 O TYR A 59 22.723 -25.057 14.888 1.00 11.15 O ATOM 876 CB TYR A 59 25.753 -26.230 15.421 1.00 62.21 C ATOM 877 CG TYR A 59 27.043 -26.874 14.964 1.00 32.01 C ATOM 878 CD1 TYR A 59 28.173 -26.108 14.711 1.00 45.54 C ATOM 879 CD2 TYR A 59 27.131 -28.249 14.787 1.00 33.51 C ATOM 880 CE1 TYR A 59 29.353 -26.692 14.292 1.00 4.45 C ATOM 881 CE2 TYR A 59 28.307 -28.842 14.371 1.00 70.34 C ATOM 882 CZ TYR A 59 29.415 -28.059 14.124 1.00 23.21 C ATOM 883 OH TYR A 59 30.589 -28.645 13.709 1.00 3.01 O ATOM 0 H TYR A 59 25.028 -23.673 15.372 1.00 3.31 H new ATOM 0 HA TYR A 59 25.414 -25.792 13.344 1.00 21.21 H new ATOM 0 HB2 TYR A 59 25.971 -25.537 16.233 1.00 62.21 H new ATOM 0 HB3 TYR A 59 25.096 -27.000 15.826 1.00 62.21 H new ATOM 0 HD1 TYR A 59 28.129 -25.037 14.844 1.00 45.54 H new ATOM 0 HD2 TYR A 59 26.265 -28.865 14.978 1.00 33.51 H new ATOM 0 HE1 TYR A 59 30.222 -26.081 14.097 1.00 4.45 H new ATOM 0 HE2 TYR A 59 28.359 -29.913 14.240 1.00 70.34 H new ATOM 0 HH TYR A 59 30.465 -29.615 13.641 1.00 3.01 H new ATOM 893 N CYS A 60 23.174 -26.966 13.785 1.00 13.24 N ATOM 894 CA CYS A 60 21.784 -27.407 13.758 1.00 54.24 C ATOM 895 C CYS A 60 20.903 -26.384 13.047 1.00 31.20 C ATOM 896 O CYS A 60 19.736 -26.203 13.397 1.00 60.13 O ATOM 897 CB CYS A 60 21.272 -27.638 15.180 1.00 13.11 C ATOM 898 SG CYS A 60 21.784 -29.215 15.902 1.00 51.41 S ATOM 0 H CYS A 60 23.829 -27.607 13.338 1.00 13.24 H new ATOM 0 HA CYS A 60 21.737 -28.346 13.206 1.00 54.24 H new ATOM 0 HB2 CYS A 60 21.624 -26.827 15.818 1.00 13.11 H new ATOM 0 HB3 CYS A 60 20.183 -27.589 15.175 1.00 13.11 H new ATOM 0 HG CYS A 60 21.304 -29.317 17.106 1.00 51.41 H new ATOM 904 N THR A 61 21.470 -25.716 12.047 1.00 13.55 N ATOM 905 CA THR A 61 20.738 -24.709 11.289 1.00 12.13 C ATOM 906 C THR A 61 19.710 -25.355 10.367 1.00 10.32 C ATOM 907 O THR A 61 19.969 -25.562 9.182 1.00 40.24 O ATOM 908 CB THR A 61 21.689 -23.837 10.448 1.00 23.21 C ATOM 909 OG1 THR A 61 20.935 -23.006 9.559 1.00 70.33 O ATOM 910 CG2 THR A 61 22.651 -24.703 9.648 1.00 2.23 C ATOM 0 H THR A 61 22.434 -25.854 11.743 1.00 13.55 H new ATOM 0 HA THR A 61 20.225 -24.078 12.015 1.00 12.13 H new ATOM 0 HB THR A 61 22.267 -23.210 11.127 1.00 23.21 H new ATOM 0 HG1 THR A 61 21.547 -22.454 9.029 1.00 70.33 H new ATOM 0 HG21 THR A 61 23.313 -24.066 9.062 1.00 2.23 H new ATOM 0 HG22 THR A 61 23.244 -25.313 10.329 1.00 2.23 H new ATOM 0 HG23 THR A 61 22.086 -25.352 8.979 1.00 2.23 H new ATOM 918 N ASP A 62 18.543 -25.670 10.918 1.00 23.25 N ATOM 919 CA ASP A 62 17.475 -26.291 10.144 1.00 32.43 C ATOM 920 C ASP A 62 16.443 -25.254 9.712 1.00 45.13 C ATOM 921 O ASP A 62 15.691 -24.731 10.534 1.00 50.00 O ATOM 922 CB ASP A 62 16.797 -27.392 10.962 1.00 63.21 C ATOM 923 CG ASP A 62 16.778 -28.723 10.236 1.00 34.24 C ATOM 924 OD1 ASP A 62 16.499 -28.732 9.019 1.00 44.33 O ATOM 925 OD2 ASP A 62 17.041 -29.756 10.886 1.00 23.40 O ATOM 0 H ASP A 62 18.313 -25.505 11.898 1.00 23.25 H new ATOM 0 HA ASP A 62 17.917 -26.732 9.251 1.00 32.43 H new ATOM 0 HB2 ASP A 62 17.317 -27.507 11.913 1.00 63.21 H new ATOM 0 HB3 ASP A 62 15.775 -27.092 11.193 1.00 63.21 H new ATOM 930 N PHE A 63 16.415 -24.960 8.416 1.00 1.21 N ATOM 931 CA PHE A 63 15.478 -23.983 7.874 1.00 34.12 C ATOM 932 C PHE A 63 14.083 -24.586 7.738 1.00 55.05 C ATOM 933 O PHE A 63 13.926 -25.805 7.680 1.00 73.24 O ATOM 934 CB PHE A 63 15.963 -23.479 6.514 1.00 41.04 C ATOM 935 CG PHE A 63 15.167 -22.320 5.985 1.00 63.01 C ATOM 936 CD1 PHE A 63 15.434 -21.028 6.410 1.00 60.34 C ATOM 937 CD2 PHE A 63 14.153 -22.522 5.063 1.00 70.10 C ATOM 938 CE1 PHE A 63 14.703 -19.960 5.925 1.00 34.32 C ATOM 939 CE2 PHE A 63 13.418 -21.458 4.575 1.00 44.23 C ATOM 940 CZ PHE A 63 13.694 -20.175 5.006 1.00 65.22 C ATOM 0 H PHE A 63 17.030 -25.384 7.722 1.00 1.21 H new ATOM 0 HA PHE A 63 15.426 -23.143 8.567 1.00 34.12 H new ATOM 0 HB2 PHE A 63 17.009 -23.183 6.597 1.00 41.04 H new ATOM 0 HB3 PHE A 63 15.919 -24.298 5.796 1.00 41.04 H new ATOM 0 HD1 PHE A 63 16.222 -20.854 7.128 1.00 60.34 H new ATOM 0 HD2 PHE A 63 13.934 -23.523 4.721 1.00 70.10 H new ATOM 0 HE1 PHE A 63 14.920 -18.958 6.264 1.00 34.32 H new ATOM 0 HE2 PHE A 63 12.629 -21.630 3.858 1.00 44.23 H new ATOM 0 HZ PHE A 63 13.122 -19.342 4.625 1.00 65.22 H new ATOM 950 N GLN A 64 13.074 -23.722 7.687 1.00 35.34 N ATOM 951 CA GLN A 64 11.692 -24.169 7.559 1.00 74.50 C ATOM 952 C GLN A 64 10.882 -23.197 6.708 1.00 73.23 C ATOM 953 O GLN A 64 10.944 -21.984 6.905 1.00 61.04 O ATOM 954 CB GLN A 64 11.050 -24.314 8.940 1.00 54.41 C ATOM 955 CG GLN A 64 9.687 -24.986 8.910 1.00 32.40 C ATOM 956 CD GLN A 64 9.651 -26.269 9.718 1.00 43.14 C ATOM 957 OE1 GLN A 64 9.943 -27.349 9.203 1.00 42.44 O ATOM 958 NE2 GLN A 64 9.293 -26.157 10.991 1.00 34.12 N ATOM 0 H GLN A 64 13.188 -22.709 7.732 1.00 35.34 H new ATOM 0 HA GLN A 64 11.696 -25.140 7.064 1.00 74.50 H new ATOM 0 HB2 GLN A 64 11.716 -24.890 9.582 1.00 54.41 H new ATOM 0 HB3 GLN A 64 10.949 -23.326 9.390 1.00 54.41 H new ATOM 0 HG2 GLN A 64 8.937 -24.296 9.297 1.00 32.40 H new ATOM 0 HG3 GLN A 64 9.416 -25.204 7.877 1.00 32.40 H new ATOM 0 HE21 GLN A 64 9.059 -25.242 11.376 1.00 34.12 H new ATOM 0 HE22 GLN A 64 9.252 -26.986 11.584 1.00 34.12 H new ATOM 967 N ALA A 65 10.122 -23.738 5.761 1.00 64.43 N ATOM 968 CA ALA A 65 9.299 -22.919 4.880 1.00 10.35 C ATOM 969 C ALA A 65 7.822 -23.043 5.238 1.00 53.14 C ATOM 970 O ALA A 65 7.329 -24.137 5.511 1.00 34.33 O ATOM 971 CB ALA A 65 9.528 -23.310 3.428 1.00 35.31 C ATOM 0 H ALA A 65 10.059 -24.741 5.585 1.00 64.43 H new ATOM 0 HA ALA A 65 9.592 -21.878 5.013 1.00 10.35 H new ATOM 0 HB1 ALA A 65 8.907 -22.690 2.782 1.00 35.31 H new ATOM 0 HB2 ALA A 65 10.577 -23.163 3.173 1.00 35.31 H new ATOM 0 HB3 ALA A 65 9.264 -24.358 3.288 1.00 35.31 H new ATOM 977 N VAL A 66 7.120 -21.914 5.234 1.00 73.11 N ATOM 978 CA VAL A 66 5.698 -21.897 5.557 1.00 1.12 C ATOM 979 C VAL A 66 4.998 -20.715 4.896 1.00 44.13 C ATOM 980 O VAL A 66 4.831 -19.649 5.489 1.00 61.20 O ATOM 981 CB VAL A 66 5.469 -21.829 7.079 1.00 43.32 C ATOM 982 CG1 VAL A 66 5.768 -23.173 7.725 1.00 60.14 C ATOM 983 CG2 VAL A 66 6.321 -20.730 7.697 1.00 63.25 C ATOM 0 H VAL A 66 7.513 -21.000 5.011 1.00 73.11 H new ATOM 0 HA VAL A 66 5.276 -22.826 5.174 1.00 1.12 H new ATOM 0 HB VAL A 66 4.421 -21.591 7.261 1.00 43.32 H new ATOM 0 HG11 VAL A 66 5.601 -23.105 8.800 1.00 60.14 H new ATOM 0 HG12 VAL A 66 5.111 -23.934 7.303 1.00 60.14 H new ATOM 0 HG13 VAL A 66 6.807 -23.445 7.536 1.00 60.14 H new ATOM 0 HG21 VAL A 66 6.147 -20.696 8.772 1.00 63.25 H new ATOM 0 HG22 VAL A 66 7.374 -20.936 7.506 1.00 63.25 H new ATOM 0 HG23 VAL A 66 6.053 -19.770 7.255 1.00 63.25 H new ATOM 993 N PRO A 67 4.578 -20.905 3.636 1.00 22.42 N ATOM 994 CA PRO A 67 3.888 -19.866 2.866 1.00 23.21 C ATOM 995 C PRO A 67 2.486 -19.587 3.396 1.00 72.23 C ATOM 996 O PRO A 67 1.723 -20.510 3.676 1.00 34.43 O ATOM 997 CB PRO A 67 3.820 -20.457 1.456 1.00 55.24 C ATOM 998 CG PRO A 67 3.875 -21.931 1.659 1.00 23.52 C ATOM 999 CD PRO A 67 4.744 -22.150 2.867 1.00 32.21 C ATOM 0 HA PRO A 67 4.406 -18.908 2.917 1.00 23.21 H new ATOM 0 HB2 PRO A 67 2.902 -20.162 0.947 1.00 55.24 H new ATOM 0 HB3 PRO A 67 4.651 -20.111 0.841 1.00 55.24 H new ATOM 0 HG2 PRO A 67 2.877 -22.341 1.816 1.00 23.52 H new ATOM 0 HG3 PRO A 67 4.290 -22.430 0.784 1.00 23.52 H new ATOM 0 HD2 PRO A 67 4.425 -23.021 3.439 1.00 32.21 H new ATOM 0 HD3 PRO A 67 5.785 -22.315 2.589 1.00 32.21 H new ATOM 1007 N GLY A 68 2.152 -18.307 3.530 1.00 44.02 N ATOM 1008 CA GLY A 68 0.842 -17.930 4.025 1.00 14.32 C ATOM 1009 C GLY A 68 0.860 -17.569 5.497 1.00 32.44 C ATOM 1010 O GLY A 68 -0.170 -17.207 6.067 1.00 1.53 O ATOM 0 H GLY A 68 2.766 -17.524 3.304 1.00 44.02 H new ATOM 0 HA2 GLY A 68 0.470 -17.081 3.451 1.00 14.32 H new ATOM 0 HA3 GLY A 68 0.146 -18.753 3.864 1.00 14.32 H new ATOM 1014 N CYS A 69 2.031 -17.671 6.115 1.00 4.20 N ATOM 1015 CA CYS A 69 2.179 -17.355 7.531 1.00 10.04 C ATOM 1016 C CYS A 69 3.513 -16.666 7.799 1.00 62.02 C ATOM 1017 O CYS A 69 3.576 -15.668 8.516 1.00 74.23 O ATOM 1018 CB CYS A 69 2.071 -18.627 8.373 1.00 74.41 C ATOM 1019 SG CYS A 69 0.535 -19.549 8.124 1.00 52.43 S ATOM 0 H CYS A 69 2.892 -17.970 5.658 1.00 4.20 H new ATOM 0 HA CYS A 69 1.376 -16.673 7.811 1.00 10.04 H new ATOM 0 HB2 CYS A 69 2.914 -19.277 8.140 1.00 74.41 H new ATOM 0 HB3 CYS A 69 2.156 -18.361 9.427 1.00 74.41 H new ATOM 0 HG CYS A 69 0.811 -20.743 7.690 1.00 52.43 H new ATOM 1025 N GLY A 70 4.580 -17.207 7.218 1.00 71.31 N ATOM 1026 CA GLY A 70 5.899 -16.633 7.407 1.00 0.20 C ATOM 1027 C GLY A 70 7.010 -17.625 7.123 1.00 15.31 C ATOM 1028 O GLY A 70 6.953 -18.365 6.141 1.00 70.22 O ATOM 0 H GLY A 70 4.554 -18.033 6.620 1.00 71.31 H new ATOM 0 HA2 GLY A 70 6.012 -15.768 6.753 1.00 0.20 H new ATOM 0 HA3 GLY A 70 5.991 -16.272 8.431 1.00 0.20 H new ATOM 1032 N ILE A 71 8.022 -17.639 7.983 1.00 2.21 N ATOM 1033 CA ILE A 71 9.151 -18.547 7.819 1.00 54.21 C ATOM 1034 C ILE A 71 9.680 -19.016 9.170 1.00 52.20 C ATOM 1035 O ILE A 71 9.626 -18.284 10.157 1.00 24.04 O ATOM 1036 CB ILE A 71 10.297 -17.884 7.033 1.00 2.42 C ATOM 1037 CG1 ILE A 71 9.794 -17.385 5.677 1.00 33.01 C ATOM 1038 CG2 ILE A 71 11.449 -18.861 6.850 1.00 35.21 C ATOM 1039 CD1 ILE A 71 9.208 -15.991 5.725 1.00 35.44 C ATOM 0 H ILE A 71 8.084 -17.032 8.801 1.00 2.21 H new ATOM 0 HA ILE A 71 8.786 -19.406 7.257 1.00 54.21 H new ATOM 0 HB ILE A 71 10.659 -17.028 7.602 1.00 2.42 H new ATOM 0 HG12 ILE A 71 10.619 -17.399 4.965 1.00 33.01 H new ATOM 0 HG13 ILE A 71 9.038 -18.075 5.303 1.00 33.01 H new ATOM 0 HG21 ILE A 71 12.251 -18.377 6.293 1.00 35.21 H new ATOM 0 HG22 ILE A 71 11.821 -19.171 7.826 1.00 35.21 H new ATOM 0 HG23 ILE A 71 11.101 -19.735 6.300 1.00 35.21 H new ATOM 0 HD11 ILE A 71 8.872 -15.703 4.729 1.00 35.44 H new ATOM 0 HD12 ILE A 71 8.362 -15.975 6.412 1.00 35.44 H new ATOM 0 HD13 ILE A 71 9.967 -15.289 6.069 1.00 35.44 H new ATOM 1051 N GLY A 72 10.193 -20.242 9.205 1.00 31.03 N ATOM 1052 CA GLY A 72 10.727 -20.788 10.440 1.00 54.43 C ATOM 1053 C GLY A 72 12.130 -21.335 10.273 1.00 61.25 C ATOM 1054 O GLY A 72 12.614 -21.490 9.150 1.00 13.04 O ATOM 0 H GLY A 72 10.249 -20.867 8.401 1.00 31.03 H new ATOM 0 HA2 GLY A 72 10.732 -20.011 11.205 1.00 54.43 H new ATOM 0 HA3 GLY A 72 10.071 -21.582 10.796 1.00 54.43 H new ATOM 1058 N CYS A 73 12.786 -21.628 11.390 1.00 41.41 N ATOM 1059 CA CYS A 73 14.144 -22.159 11.362 1.00 3.14 C ATOM 1060 C CYS A 73 14.669 -22.382 12.777 1.00 65.22 C ATOM 1061 O CYS A 73 14.248 -21.713 13.720 1.00 1.14 O ATOM 1062 CB CYS A 73 15.071 -21.207 10.605 1.00 3.24 C ATOM 1063 SG CYS A 73 14.772 -19.457 10.949 1.00 44.12 S ATOM 0 H CYS A 73 12.400 -21.507 12.326 1.00 41.41 H new ATOM 0 HA CYS A 73 14.122 -23.119 10.846 1.00 3.14 H new ATOM 0 HB2 CYS A 73 16.104 -21.445 10.859 1.00 3.24 H new ATOM 0 HB3 CYS A 73 14.957 -21.381 9.535 1.00 3.24 H new ATOM 0 HG CYS A 73 13.883 -19.346 11.891 1.00 44.12 H new ATOM 1069 N LYS A 74 15.591 -23.329 12.917 1.00 2.24 N ATOM 1070 CA LYS A 74 16.175 -23.642 14.216 1.00 31.23 C ATOM 1071 C LYS A 74 17.697 -23.685 14.133 1.00 43.14 C ATOM 1072 O LYS A 74 18.262 -24.135 13.136 1.00 71.24 O ATOM 1073 CB LYS A 74 15.644 -24.984 14.727 1.00 53.52 C ATOM 1074 CG LYS A 74 15.765 -26.110 13.716 1.00 62.42 C ATOM 1075 CD LYS A 74 14.412 -26.728 13.404 1.00 25.32 C ATOM 1076 CE LYS A 74 14.500 -28.244 13.313 1.00 33.14 C ATOM 1077 NZ LYS A 74 13.450 -28.808 12.420 1.00 13.43 N ATOM 0 H LYS A 74 15.950 -23.893 12.147 1.00 2.24 H new ATOM 0 HA LYS A 74 15.889 -22.855 14.914 1.00 31.23 H new ATOM 0 HB2 LYS A 74 16.186 -25.259 15.632 1.00 53.52 H new ATOM 0 HB3 LYS A 74 14.597 -24.868 15.006 1.00 53.52 H new ATOM 0 HG2 LYS A 74 16.212 -25.729 12.798 1.00 62.42 H new ATOM 0 HG3 LYS A 74 16.436 -26.877 14.103 1.00 62.42 H new ATOM 0 HD2 LYS A 74 13.696 -26.450 14.178 1.00 25.32 H new ATOM 0 HD3 LYS A 74 14.036 -26.327 12.463 1.00 25.32 H new ATOM 0 HE2 LYS A 74 15.484 -28.529 12.941 1.00 33.14 H new ATOM 0 HE3 LYS A 74 14.399 -28.674 14.309 1.00 33.14 H new ATOM 0 HZ1 LYS A 74 13.544 -29.843 12.385 1.00 13.43 H new ATOM 0 HZ2 LYS A 74 12.510 -28.558 12.788 1.00 13.43 H new ATOM 0 HZ3 LYS A 74 13.562 -28.417 11.463 1.00 13.43 H new ATOM 1091 N VAL A 75 18.357 -23.215 15.187 1.00 51.44 N ATOM 1092 CA VAL A 75 19.814 -23.202 15.233 1.00 1.31 C ATOM 1093 C VAL A 75 20.318 -23.145 16.671 1.00 35.10 C ATOM 1094 O VAL A 75 19.876 -22.312 17.462 1.00 14.10 O ATOM 1095 CB VAL A 75 20.390 -22.006 14.452 1.00 40.23 C ATOM 1096 CG1 VAL A 75 20.028 -20.696 15.136 1.00 73.42 C ATOM 1097 CG2 VAL A 75 21.898 -22.141 14.306 1.00 22.44 C ATOM 0 H VAL A 75 17.905 -22.838 16.020 1.00 51.44 H new ATOM 0 HA VAL A 75 20.153 -24.128 14.768 1.00 1.31 H new ATOM 0 HB VAL A 75 19.950 -22.001 13.455 1.00 40.23 H new ATOM 0 HG11 VAL A 75 20.444 -19.863 14.570 1.00 73.42 H new ATOM 0 HG12 VAL A 75 18.943 -20.598 15.183 1.00 73.42 H new ATOM 0 HG13 VAL A 75 20.437 -20.688 16.146 1.00 73.42 H new ATOM 0 HG21 VAL A 75 22.288 -21.287 13.752 1.00 22.44 H new ATOM 0 HG22 VAL A 75 22.358 -22.173 15.294 1.00 22.44 H new ATOM 0 HG23 VAL A 75 22.131 -23.060 13.768 1.00 22.44 H new ATOM 1107 N SER A 76 21.245 -24.037 17.003 1.00 65.11 N ATOM 1108 CA SER A 76 21.808 -24.091 18.347 1.00 34.23 C ATOM 1109 C SER A 76 23.167 -24.784 18.340 1.00 33.33 C ATOM 1110 O SER A 76 23.302 -25.905 17.851 1.00 53.34 O ATOM 1111 CB SER A 76 20.854 -24.824 19.293 1.00 54.14 C ATOM 1112 OG SER A 76 19.939 -25.630 18.570 1.00 20.03 O ATOM 0 H SER A 76 21.622 -24.733 16.360 1.00 65.11 H new ATOM 0 HA SER A 76 21.943 -23.068 18.699 1.00 34.23 H new ATOM 0 HB2 SER A 76 21.426 -25.446 19.982 1.00 54.14 H new ATOM 0 HB3 SER A 76 20.307 -24.100 19.897 1.00 54.14 H new ATOM 0 HG SER A 76 20.134 -26.576 18.736 1.00 20.03 H new ATOM 1118 N ASN A 77 24.171 -24.108 18.888 1.00 65.21 N ATOM 1119 CA ASN A 77 25.521 -24.658 18.945 1.00 42.42 C ATOM 1120 C ASN A 77 25.778 -25.332 20.289 1.00 11.32 C ATOM 1121 O ASN A 77 26.825 -25.944 20.499 1.00 71.30 O ATOM 1122 CB ASN A 77 26.554 -23.554 18.710 1.00 41.51 C ATOM 1123 CG ASN A 77 27.956 -24.102 18.529 1.00 21.40 C ATOM 1124 OD1 ASN A 77 28.702 -24.261 19.495 1.00 20.15 O ATOM 1125 ND2 ASN A 77 28.321 -24.395 17.286 1.00 1.21 N ATOM 0 H ASN A 77 24.076 -23.179 19.299 1.00 65.21 H new ATOM 0 HA ASN A 77 25.614 -25.408 18.159 1.00 42.42 H new ATOM 0 HB2 ASN A 77 26.274 -22.981 17.826 1.00 41.51 H new ATOM 0 HB3 ASN A 77 26.543 -22.864 19.554 1.00 41.51 H new ATOM 0 HD21 ASN A 77 29.252 -24.768 17.102 1.00 1.21 H new ATOM 0 HD22 ASN A 77 27.670 -24.247 16.515 1.00 1.21 H new ATOM 1132 N VAL A 78 24.814 -25.215 21.197 1.00 1.23 N ATOM 1133 CA VAL A 78 24.934 -25.814 22.521 1.00 22.00 C ATOM 1134 C VAL A 78 25.404 -27.261 22.429 1.00 62.45 C ATOM 1135 O VAL A 78 26.221 -27.711 23.232 1.00 74.23 O ATOM 1136 CB VAL A 78 23.596 -25.768 23.281 1.00 34.05 C ATOM 1137 CG1 VAL A 78 22.497 -26.437 22.470 1.00 71.12 C ATOM 1138 CG2 VAL A 78 23.736 -26.424 24.647 1.00 61.23 C ATOM 0 H VAL A 78 23.941 -24.711 21.040 1.00 1.23 H new ATOM 0 HA VAL A 78 25.674 -25.229 23.067 1.00 22.00 H new ATOM 0 HB VAL A 78 23.320 -24.724 23.431 1.00 34.05 H new ATOM 0 HG11 VAL A 78 21.559 -26.394 23.024 1.00 71.12 H new ATOM 0 HG12 VAL A 78 22.380 -25.919 21.518 1.00 71.12 H new ATOM 0 HG13 VAL A 78 22.763 -27.478 22.286 1.00 71.12 H new ATOM 0 HG21 VAL A 78 22.781 -26.382 25.170 1.00 61.23 H new ATOM 0 HG22 VAL A 78 24.036 -27.464 24.522 1.00 61.23 H new ATOM 0 HG23 VAL A 78 24.492 -25.896 25.229 1.00 61.23 H new ATOM 1148 N GLU A 79 24.883 -27.985 21.443 1.00 71.32 N ATOM 1149 CA GLU A 79 25.250 -29.383 21.246 1.00 54.20 C ATOM 1150 C GLU A 79 26.763 -29.537 21.131 1.00 64.03 C ATOM 1151 O GLU A 79 27.364 -30.385 21.789 1.00 32.30 O ATOM 1152 CB GLU A 79 24.572 -29.939 19.992 1.00 63.03 C ATOM 1153 CG GLU A 79 24.812 -29.100 18.748 1.00 64.44 C ATOM 1154 CD GLU A 79 25.946 -29.635 17.894 1.00 40.52 C ATOM 1155 OE1 GLU A 79 25.900 -30.827 17.526 1.00 73.20 O ATOM 1156 OE2 GLU A 79 26.879 -28.861 17.594 1.00 50.22 O ATOM 0 H GLU A 79 24.206 -27.627 20.769 1.00 71.32 H new ATOM 0 HA GLU A 79 24.910 -29.948 22.114 1.00 54.20 H new ATOM 0 HB2 GLU A 79 24.933 -30.952 19.812 1.00 63.03 H new ATOM 0 HB3 GLU A 79 23.499 -30.010 20.171 1.00 63.03 H new ATOM 0 HG2 GLU A 79 23.899 -29.068 18.154 1.00 64.44 H new ATOM 0 HG3 GLU A 79 25.037 -28.075 19.043 1.00 64.44 H new ATOM 1163 N GLY A 80 27.374 -28.710 20.288 1.00 44.22 N ATOM 1164 CA GLY A 80 28.812 -28.770 20.100 1.00 21.33 C ATOM 1165 C GLY A 80 29.576 -28.293 21.319 1.00 24.34 C ATOM 1166 O GLY A 80 30.677 -28.770 21.596 1.00 65.45 O ATOM 0 H GLY A 80 26.899 -27.999 19.732 1.00 44.22 H new ATOM 0 HA2 GLY A 80 29.103 -29.795 19.871 1.00 21.33 H new ATOM 0 HA3 GLY A 80 29.089 -28.160 19.240 1.00 21.33 H new ATOM 1170 N ILE A 81 28.993 -27.349 22.049 1.00 12.23 N ATOM 1171 CA ILE A 81 29.627 -26.807 23.245 1.00 72.22 C ATOM 1172 C ILE A 81 29.677 -27.847 24.359 1.00 0.44 C ATOM 1173 O ILE A 81 30.739 -28.386 24.673 1.00 1.23 O ATOM 1174 CB ILE A 81 28.887 -25.557 23.757 1.00 63.00 C ATOM 1175 CG1 ILE A 81 28.874 -24.469 22.681 1.00 31.21 C ATOM 1176 CG2 ILE A 81 29.539 -25.041 25.031 1.00 32.24 C ATOM 1177 CD1 ILE A 81 30.255 -24.044 22.235 1.00 41.42 C ATOM 0 H ILE A 81 28.082 -26.943 21.834 1.00 12.23 H new ATOM 0 HA ILE A 81 30.643 -26.528 22.966 1.00 72.22 H new ATOM 0 HB ILE A 81 27.856 -25.830 23.984 1.00 63.00 H new ATOM 0 HG12 ILE A 81 28.317 -24.831 21.817 1.00 31.21 H new ATOM 0 HG13 ILE A 81 28.340 -23.599 23.062 1.00 31.21 H new ATOM 0 HG21 ILE A 81 29.005 -24.157 25.381 1.00 32.24 H new ATOM 0 HG22 ILE A 81 29.502 -25.815 25.798 1.00 32.24 H new ATOM 0 HG23 ILE A 81 30.578 -24.781 24.828 1.00 32.24 H new ATOM 0 HD11 ILE A 81 30.169 -23.271 21.472 1.00 41.42 H new ATOM 0 HD12 ILE A 81 30.808 -23.652 23.088 1.00 41.42 H new ATOM 0 HD13 ILE A 81 30.785 -24.903 21.823 1.00 41.42 H new ATOM 1189 N LEU A 82 28.522 -28.125 24.953 1.00 31.15 N ATOM 1190 CA LEU A 82 28.433 -29.102 26.033 1.00 73.31 C ATOM 1191 C LEU A 82 28.860 -30.485 25.552 1.00 23.30 C ATOM 1192 O LEU A 82 29.565 -31.208 26.256 1.00 1.41 O ATOM 1193 CB LEU A 82 27.005 -29.159 26.580 1.00 42.24 C ATOM 1194 CG LEU A 82 26.822 -28.697 28.026 1.00 74.22 C ATOM 1195 CD1 LEU A 82 25.361 -28.799 28.437 1.00 0.41 C ATOM 1196 CD2 LEU A 82 27.699 -29.515 28.962 1.00 3.11 C ATOM 0 H LEU A 82 27.634 -27.688 24.705 1.00 31.15 H new ATOM 0 HA LEU A 82 29.108 -28.789 26.829 1.00 73.31 H new ATOM 0 HB2 LEU A 82 26.368 -28.548 25.941 1.00 42.24 H new ATOM 0 HB3 LEU A 82 26.647 -30.185 26.499 1.00 42.24 H new ATOM 0 HG LEU A 82 27.126 -27.653 28.095 1.00 74.22 H new ATOM 0 HD11 LEU A 82 25.249 -28.466 29.469 1.00 0.41 H new ATOM 0 HD12 LEU A 82 24.755 -28.170 27.785 1.00 0.41 H new ATOM 0 HD13 LEU A 82 25.030 -29.834 28.352 1.00 0.41 H new ATOM 0 HD21 LEU A 82 27.556 -29.172 29.987 1.00 3.11 H new ATOM 0 HD22 LEU A 82 27.425 -30.568 28.890 1.00 3.11 H new ATOM 0 HD23 LEU A 82 28.745 -29.392 28.681 1.00 3.11 H new ATOM 1208 N ALA A 83 28.430 -30.846 24.347 1.00 25.34 N ATOM 1209 CA ALA A 83 28.772 -32.141 23.771 1.00 43.55 C ATOM 1210 C ALA A 83 28.214 -33.282 24.614 1.00 41.04 C ATOM 1211 O ALA A 83 28.907 -34.262 24.885 1.00 70.11 O ATOM 1212 CB ALA A 83 30.281 -32.274 23.631 1.00 65.12 C ATOM 0 H ALA A 83 27.845 -30.260 23.751 1.00 25.34 H new ATOM 0 HA ALA A 83 28.320 -32.201 22.781 1.00 43.55 H new ATOM 0 HB1 ALA A 83 30.522 -33.246 23.200 1.00 65.12 H new ATOM 0 HB2 ALA A 83 30.657 -31.485 22.980 1.00 65.12 H new ATOM 0 HB3 ALA A 83 30.747 -32.187 24.613 1.00 65.12 H new ATOM 1218 N ALA A 84 26.958 -33.148 25.026 1.00 53.44 N ATOM 1219 CA ALA A 84 26.306 -34.169 25.837 1.00 45.41 C ATOM 1220 C ALA A 84 24.789 -34.089 25.706 1.00 43.14 C ATOM 1221 O ALA A 84 24.110 -35.111 25.607 1.00 41.03 O ATOM 1222 CB ALA A 84 26.720 -34.028 27.294 1.00 2.13 C ATOM 0 H ALA A 84 26.371 -32.342 24.811 1.00 53.44 H new ATOM 0 HA ALA A 84 26.624 -35.146 25.472 1.00 45.41 H new ATOM 0 HB1 ALA A 84 26.226 -34.796 27.889 1.00 2.13 H new ATOM 0 HB2 ALA A 84 27.801 -34.143 27.378 1.00 2.13 H new ATOM 0 HB3 ALA A 84 26.430 -33.043 27.661 1.00 2.13 H new ATOM 1228 N VAL A 85 24.263 -32.868 25.706 1.00 61.20 N ATOM 1229 CA VAL A 85 22.826 -32.655 25.587 1.00 73.35 C ATOM 1230 C VAL A 85 22.501 -31.750 24.404 1.00 53.22 C ATOM 1231 O VAL A 85 22.187 -30.570 24.561 1.00 0.33 O ATOM 1232 CB VAL A 85 22.242 -32.035 26.870 1.00 53.14 C ATOM 1233 CG1 VAL A 85 22.049 -33.100 27.938 1.00 75.30 C ATOM 1234 CG2 VAL A 85 23.140 -30.916 27.377 1.00 75.45 C ATOM 0 H VAL A 85 24.811 -32.012 25.787 1.00 61.20 H new ATOM 0 HA VAL A 85 22.373 -33.633 25.427 1.00 73.35 H new ATOM 0 HB VAL A 85 21.266 -31.609 26.636 1.00 53.14 H new ATOM 0 HG11 VAL A 85 21.636 -32.643 28.837 1.00 75.30 H new ATOM 0 HG12 VAL A 85 21.363 -33.863 27.571 1.00 75.30 H new ATOM 0 HG13 VAL A 85 23.010 -33.558 28.173 1.00 75.30 H new ATOM 0 HG21 VAL A 85 22.712 -30.489 28.284 1.00 75.45 H new ATOM 0 HG22 VAL A 85 24.130 -31.315 27.596 1.00 75.45 H new ATOM 0 HG23 VAL A 85 23.221 -30.141 26.615 1.00 75.45 H new ATOM 1244 N PRO A 86 22.576 -32.313 23.189 1.00 64.30 N ATOM 1245 CA PRO A 86 22.293 -31.575 21.955 1.00 53.12 C ATOM 1246 C PRO A 86 20.814 -31.232 21.811 1.00 11.14 C ATOM 1247 O PRO A 86 19.948 -32.076 22.037 1.00 35.23 O ATOM 1248 CB PRO A 86 22.726 -32.545 20.853 1.00 32.52 C ATOM 1249 CG PRO A 86 22.611 -33.896 21.472 1.00 51.14 C ATOM 1250 CD PRO A 86 22.944 -33.715 22.927 1.00 41.23 C ATOM 0 HA PRO A 86 22.812 -30.617 21.926 1.00 53.12 H new ATOM 0 HB2 PRO A 86 22.087 -32.456 19.974 1.00 32.52 H new ATOM 0 HB3 PRO A 86 23.747 -32.344 20.527 1.00 32.52 H new ATOM 0 HG2 PRO A 86 21.605 -34.297 21.349 1.00 51.14 H new ATOM 0 HG3 PRO A 86 23.295 -34.601 21.000 1.00 51.14 H new ATOM 0 HD2 PRO A 86 22.380 -34.403 23.557 1.00 41.23 H new ATOM 0 HD3 PRO A 86 24.001 -33.897 23.123 1.00 41.23 H new ATOM 1258 N GLN A 87 20.533 -29.989 21.434 1.00 3.44 N ATOM 1259 CA GLN A 87 19.158 -29.535 21.261 1.00 24.24 C ATOM 1260 C GLN A 87 19.038 -28.608 20.056 1.00 24.42 C ATOM 1261 O GLN A 87 20.014 -27.982 19.641 1.00 11.32 O ATOM 1262 CB GLN A 87 18.673 -28.817 22.522 1.00 23.31 C ATOM 1263 CG GLN A 87 19.340 -27.470 22.750 1.00 62.41 C ATOM 1264 CD GLN A 87 18.341 -26.337 22.870 1.00 34.11 C ATOM 1265 OE1 GLN A 87 17.410 -26.266 21.926 1.00 71.24 O flip ATOM 1266 NE2 GLN A 87 18.404 -25.534 23.802 1.00 52.43 N flip ATOM 0 H GLN A 87 21.239 -29.278 21.242 1.00 3.44 H new ATOM 0 HA GLN A 87 18.532 -30.410 21.086 1.00 24.24 H new ATOM 0 HB2 GLN A 87 17.595 -28.672 22.456 1.00 23.31 H new ATOM 0 HB3 GLN A 87 18.857 -29.455 23.387 1.00 23.31 H new ATOM 0 HG2 GLN A 87 19.942 -27.516 23.657 1.00 62.41 H new ATOM 0 HG3 GLN A 87 20.022 -27.262 21.925 1.00 62.41 H new ATOM 0 HE21 GLN A 87 19.136 -25.626 24.506 1.00 52.43 H new ATOM 0 HE22 GLN A 87 17.724 -24.777 23.870 1.00 52.43 H new ATOM 1275 N THR A 88 17.835 -28.526 19.497 1.00 41.23 N ATOM 1276 CA THR A 88 17.588 -27.677 18.338 1.00 14.01 C ATOM 1277 C THR A 88 16.666 -26.516 18.694 1.00 3.20 C ATOM 1278 O THR A 88 15.444 -26.663 18.712 1.00 21.14 O ATOM 1279 CB THR A 88 16.963 -28.476 17.179 1.00 31.52 C ATOM 1280 OG1 THR A 88 16.678 -29.814 17.604 1.00 3.01 O ATOM 1281 CG2 THR A 88 17.897 -28.508 15.979 1.00 74.24 C ATOM 0 H THR A 88 17.017 -29.037 19.828 1.00 41.23 H new ATOM 0 HA THR A 88 18.555 -27.286 18.021 1.00 14.01 H new ATOM 0 HB THR A 88 16.036 -27.983 16.885 1.00 31.52 H new ATOM 0 HG1 THR A 88 16.279 -30.315 16.862 1.00 3.01 H new ATOM 0 HG21 THR A 88 17.434 -29.078 15.173 1.00 74.24 H new ATOM 0 HG22 THR A 88 18.089 -27.490 15.640 1.00 74.24 H new ATOM 0 HG23 THR A 88 18.838 -28.979 16.263 1.00 74.24 H new ATOM 1289 N PHE A 89 17.260 -25.361 18.976 1.00 52.43 N ATOM 1290 CA PHE A 89 16.492 -24.173 19.332 1.00 75.34 C ATOM 1291 C PHE A 89 15.574 -23.755 18.186 1.00 64.31 C ATOM 1292 O PHE A 89 16.039 -23.399 17.103 1.00 11.31 O ATOM 1293 CB PHE A 89 17.431 -23.021 19.694 1.00 64.43 C ATOM 1294 CG PHE A 89 17.065 -22.329 20.975 1.00 53.20 C ATOM 1295 CD1 PHE A 89 17.370 -22.901 22.199 1.00 2.13 C ATOM 1296 CD2 PHE A 89 16.414 -21.106 20.955 1.00 11.40 C ATOM 1297 CE1 PHE A 89 17.035 -22.266 23.380 1.00 35.03 C ATOM 1298 CE2 PHE A 89 16.076 -20.466 22.133 1.00 41.14 C ATOM 1299 CZ PHE A 89 16.386 -21.047 23.347 1.00 73.33 C ATOM 0 H PHE A 89 18.270 -25.222 18.965 1.00 52.43 H new ATOM 0 HA PHE A 89 15.876 -24.416 20.198 1.00 75.34 H new ATOM 0 HB2 PHE A 89 18.448 -23.404 19.775 1.00 64.43 H new ATOM 0 HB3 PHE A 89 17.428 -22.292 18.883 1.00 64.43 H new ATOM 0 HD1 PHE A 89 17.876 -23.855 22.231 1.00 2.13 H new ATOM 0 HD2 PHE A 89 16.168 -20.648 20.009 1.00 11.40 H new ATOM 0 HE1 PHE A 89 17.280 -22.722 24.328 1.00 35.03 H new ATOM 0 HE2 PHE A 89 15.570 -19.512 22.104 1.00 41.14 H new ATOM 0 HZ PHE A 89 16.122 -20.549 24.268 1.00 73.33 H new ATOM 1309 N SER A 90 14.269 -23.803 18.433 1.00 3.11 N ATOM 1310 CA SER A 90 13.286 -23.434 17.422 1.00 52.33 C ATOM 1311 C SER A 90 13.141 -21.918 17.333 1.00 53.41 C ATOM 1312 O SER A 90 13.120 -21.224 18.350 1.00 45.44 O ATOM 1313 CB SER A 90 11.931 -24.069 17.741 1.00 23.23 C ATOM 1314 OG SER A 90 11.745 -25.268 17.010 1.00 64.54 O ATOM 0 H SER A 90 13.868 -24.094 19.325 1.00 3.11 H new ATOM 0 HA SER A 90 13.636 -23.806 16.459 1.00 52.33 H new ATOM 0 HB2 SER A 90 11.866 -24.277 18.809 1.00 23.23 H new ATOM 0 HB3 SER A 90 11.132 -23.367 17.503 1.00 23.23 H new ATOM 0 HG SER A 90 10.873 -25.655 17.233 1.00 64.54 H new ATOM 1320 N VAL A 91 13.040 -21.410 16.109 1.00 50.34 N ATOM 1321 CA VAL A 91 12.896 -19.976 15.885 1.00 34.21 C ATOM 1322 C VAL A 91 11.953 -19.694 14.720 1.00 5.23 C ATOM 1323 O VAL A 91 12.307 -19.897 13.558 1.00 71.40 O ATOM 1324 CB VAL A 91 14.257 -19.312 15.603 1.00 75.31 C ATOM 1325 CG1 VAL A 91 14.120 -17.797 15.592 1.00 73.44 C ATOM 1326 CG2 VAL A 91 15.288 -19.755 16.630 1.00 71.13 C ATOM 0 H VAL A 91 13.055 -21.970 15.257 1.00 50.34 H new ATOM 0 HA VAL A 91 12.477 -19.553 16.798 1.00 34.21 H new ATOM 0 HB VAL A 91 14.599 -19.629 14.618 1.00 75.31 H new ATOM 0 HG11 VAL A 91 15.091 -17.345 15.391 1.00 73.44 H new ATOM 0 HG12 VAL A 91 13.415 -17.501 14.815 1.00 73.44 H new ATOM 0 HG13 VAL A 91 13.755 -17.458 16.562 1.00 73.44 H new ATOM 0 HG21 VAL A 91 16.244 -19.277 16.416 1.00 71.13 H new ATOM 0 HG22 VAL A 91 14.954 -19.469 17.627 1.00 71.13 H new ATOM 0 HG23 VAL A 91 15.406 -20.838 16.584 1.00 71.13 H new ATOM 1336 N LEU A 92 10.753 -19.223 15.039 1.00 73.23 N ATOM 1337 CA LEU A 92 9.758 -18.911 14.018 1.00 31.42 C ATOM 1338 C LEU A 92 9.630 -17.404 13.825 1.00 45.24 C ATOM 1339 O LEU A 92 9.867 -16.627 14.751 1.00 74.24 O ATOM 1340 CB LEU A 92 8.401 -19.504 14.403 1.00 62.23 C ATOM 1341 CG LEU A 92 7.505 -18.621 15.271 1.00 33.13 C ATOM 1342 CD1 LEU A 92 6.510 -17.859 14.410 1.00 40.14 C ATOM 1343 CD2 LEU A 92 6.778 -19.460 16.313 1.00 42.42 C ATOM 0 H LEU A 92 10.445 -19.049 15.996 1.00 73.23 H new ATOM 0 HA LEU A 92 10.088 -19.352 13.077 1.00 31.42 H new ATOM 0 HB2 LEU A 92 7.861 -19.747 13.488 1.00 62.23 H new ATOM 0 HB3 LEU A 92 8.573 -20.442 14.931 1.00 62.23 H new ATOM 0 HG LEU A 92 8.134 -17.897 15.790 1.00 33.13 H new ATOM 0 HD11 LEU A 92 5.881 -17.236 15.046 1.00 40.14 H new ATOM 0 HD12 LEU A 92 7.049 -17.228 13.703 1.00 40.14 H new ATOM 0 HD13 LEU A 92 5.886 -18.566 13.863 1.00 40.14 H new ATOM 0 HD21 LEU A 92 6.145 -18.815 16.922 1.00 42.42 H new ATOM 0 HD22 LEU A 92 6.161 -20.207 15.813 1.00 42.42 H new ATOM 0 HD23 LEU A 92 7.507 -19.960 16.951 1.00 42.42 H new ATOM 1355 N ILE A 93 9.254 -16.997 12.617 1.00 60.41 N ATOM 1356 CA ILE A 93 9.092 -15.583 12.304 1.00 71.15 C ATOM 1357 C ILE A 93 7.863 -15.351 11.431 1.00 41.21 C ATOM 1358 O ILE A 93 7.858 -15.682 10.246 1.00 23.32 O ATOM 1359 CB ILE A 93 10.332 -15.020 11.585 1.00 61.15 C ATOM 1360 CG1 ILE A 93 11.598 -15.331 12.385 1.00 20.44 C ATOM 1361 CG2 ILE A 93 10.187 -13.520 11.374 1.00 21.25 C ATOM 1362 CD1 ILE A 93 12.876 -14.985 11.654 1.00 21.11 C ATOM 0 H ILE A 93 9.056 -17.627 11.839 1.00 60.41 H new ATOM 0 HA ILE A 93 8.965 -15.062 13.253 1.00 71.15 H new ATOM 0 HB ILE A 93 10.415 -15.498 10.609 1.00 61.15 H new ATOM 0 HG12 ILE A 93 11.567 -14.782 13.326 1.00 20.44 H new ATOM 0 HG13 ILE A 93 11.608 -16.392 12.635 1.00 20.44 H new ATOM 0 HG21 ILE A 93 11.071 -13.137 10.865 1.00 21.25 H new ATOM 0 HG22 ILE A 93 9.304 -13.322 10.766 1.00 21.25 H new ATOM 0 HG23 ILE A 93 10.082 -13.025 12.340 1.00 21.25 H new ATOM 0 HD11 ILE A 93 13.732 -15.232 12.281 1.00 21.11 H new ATOM 0 HD12 ILE A 93 12.930 -15.554 10.726 1.00 21.11 H new ATOM 0 HD13 ILE A 93 12.888 -13.919 11.427 1.00 21.11 H new ATOM 1374 N GLY A 94 6.822 -14.776 12.026 1.00 74.45 N ATOM 1375 CA GLY A 94 5.601 -14.507 11.287 1.00 24.53 C ATOM 1376 C GLY A 94 4.668 -13.573 12.031 1.00 42.42 C ATOM 1377 O GLY A 94 4.906 -13.241 13.191 1.00 2.22 O ATOM 0 H GLY A 94 6.802 -14.492 13.005 1.00 74.45 H new ATOM 0 HA2 GLY A 94 5.853 -14.070 10.321 1.00 24.53 H new ATOM 0 HA3 GLY A 94 5.086 -15.447 11.087 1.00 24.53 H new ATOM 1381 N ASN A 95 3.603 -13.145 11.360 1.00 23.30 N ATOM 1382 CA ASN A 95 2.632 -12.241 11.964 1.00 12.41 C ATOM 1383 C ASN A 95 1.489 -13.020 12.607 1.00 74.35 C ATOM 1384 O ASN A 95 1.590 -14.229 12.819 1.00 2.32 O ATOM 1385 CB ASN A 95 2.079 -11.277 10.913 1.00 50.54 C ATOM 1386 CG ASN A 95 1.139 -11.960 9.938 1.00 24.43 C ATOM 1387 OD1 ASN A 95 1.509 -12.935 9.282 1.00 12.44 O ATOM 1388 ND2 ASN A 95 -0.083 -11.451 9.839 1.00 31.44 N ATOM 0 H ASN A 95 3.391 -13.410 10.398 1.00 23.30 H new ATOM 0 HA ASN A 95 3.140 -11.669 12.741 1.00 12.41 H new ATOM 0 HB2 ASN A 95 1.552 -10.464 11.412 1.00 50.54 H new ATOM 0 HB3 ASN A 95 2.907 -10.830 10.363 1.00 50.54 H new ATOM 0 HD21 ASN A 95 -0.759 -11.869 9.200 1.00 31.44 H new ATOM 0 HD22 ASN A 95 -0.346 -10.642 10.402 1.00 31.44 H new ATOM 1395 N ARG A 96 0.401 -12.321 12.913 1.00 50.54 N ATOM 1396 CA ARG A 96 -0.761 -12.947 13.531 1.00 14.41 C ATOM 1397 C ARG A 96 -1.132 -14.238 12.809 1.00 60.45 C ATOM 1398 O ARG A 96 -1.529 -15.219 13.436 1.00 31.43 O ATOM 1399 CB ARG A 96 -1.951 -11.985 13.521 1.00 0.21 C ATOM 1400 CG ARG A 96 -2.325 -11.464 14.899 1.00 22.13 C ATOM 1401 CD ARG A 96 -2.597 -9.968 14.875 1.00 71.23 C ATOM 1402 NE ARG A 96 -3.114 -9.485 16.152 1.00 1.13 N ATOM 1403 CZ ARG A 96 -3.121 -8.204 16.505 1.00 21.30 C ATOM 1404 NH1 ARG A 96 -2.642 -7.283 15.680 1.00 22.42 N ATOM 1405 NH2 ARG A 96 -3.608 -7.843 17.685 1.00 53.50 N ATOM 0 H ARG A 96 0.300 -11.320 12.743 1.00 50.54 H new ATOM 0 HA ARG A 96 -0.506 -13.189 14.563 1.00 14.41 H new ATOM 0 HB2 ARG A 96 -1.719 -11.140 12.873 1.00 0.21 H new ATOM 0 HB3 ARG A 96 -2.813 -12.492 13.087 1.00 0.21 H new ATOM 0 HG2 ARG A 96 -3.209 -11.990 15.260 1.00 22.13 H new ATOM 0 HG3 ARG A 96 -1.519 -11.677 15.601 1.00 22.13 H new ATOM 0 HD2 ARG A 96 -1.677 -9.436 14.632 1.00 71.23 H new ATOM 0 HD3 ARG A 96 -3.314 -9.743 14.085 1.00 71.23 H new ATOM 0 HE ARG A 96 -3.490 -10.168 16.809 1.00 1.13 H new ATOM 0 HH11 ARG A 96 -2.267 -7.557 14.772 1.00 22.42 H new ATOM 0 HH12 ARG A 96 -2.649 -6.300 15.953 1.00 22.42 H new ATOM 0 HH21 ARG A 96 -3.977 -8.549 18.322 1.00 53.50 H new ATOM 0 HH22 ARG A 96 -3.613 -6.860 17.955 1.00 53.50 H new ATOM 1419 N GLU A 97 -0.999 -14.230 11.486 1.00 54.32 N ATOM 1420 CA GLU A 97 -1.322 -15.400 10.679 1.00 61.54 C ATOM 1421 C GLU A 97 -0.589 -16.636 11.195 1.00 51.43 C ATOM 1422 O GLU A 97 -1.189 -17.695 11.376 1.00 62.33 O ATOM 1423 CB GLU A 97 -0.958 -15.153 9.213 1.00 21.22 C ATOM 1424 CG GLU A 97 -1.811 -15.941 8.233 1.00 65.21 C ATOM 1425 CD GLU A 97 -2.012 -15.213 6.918 1.00 13.45 C ATOM 1426 OE1 GLU A 97 -1.280 -14.233 6.665 1.00 11.15 O ATOM 1427 OE2 GLU A 97 -2.902 -15.621 6.143 1.00 23.43 O ATOM 0 H GLU A 97 -0.670 -13.426 10.951 1.00 54.32 H new ATOM 0 HA GLU A 97 -2.395 -15.577 10.755 1.00 61.54 H new ATOM 0 HB2 GLU A 97 -1.059 -14.090 8.996 1.00 21.22 H new ATOM 0 HB3 GLU A 97 0.090 -15.411 9.059 1.00 21.22 H new ATOM 0 HG2 GLU A 97 -1.341 -16.906 8.042 1.00 65.21 H new ATOM 0 HG3 GLU A 97 -2.782 -16.144 8.684 1.00 65.21 H new ATOM 1434 N TRP A 98 0.710 -16.490 11.428 1.00 20.45 N ATOM 1435 CA TRP A 98 1.525 -17.594 11.923 1.00 64.10 C ATOM 1436 C TRP A 98 1.161 -17.938 13.363 1.00 54.21 C ATOM 1437 O TRP A 98 0.968 -19.106 13.703 1.00 15.21 O ATOM 1438 CB TRP A 98 3.010 -17.239 11.831 1.00 64.32 C ATOM 1439 CG TRP A 98 3.900 -18.438 11.692 1.00 51.41 C ATOM 1440 CD1 TRP A 98 4.593 -18.819 10.579 1.00 43.11 C ATOM 1441 CD2 TRP A 98 4.189 -19.411 12.701 1.00 64.43 C ATOM 1442 NE1 TRP A 98 5.297 -19.971 10.835 1.00 34.20 N ATOM 1443 CE2 TRP A 98 5.066 -20.354 12.130 1.00 64.52 C ATOM 1444 CE3 TRP A 98 3.795 -19.577 14.031 1.00 62.50 C ATOM 1445 CZ2 TRP A 98 5.553 -21.446 12.844 1.00 35.21 C ATOM 1446 CZ3 TRP A 98 4.278 -20.662 14.738 1.00 3.35 C ATOM 1447 CH2 TRP A 98 5.150 -21.584 14.145 1.00 71.33 C ATOM 0 H TRP A 98 1.221 -15.620 11.283 1.00 20.45 H new ATOM 0 HA TRP A 98 1.327 -18.466 11.300 1.00 64.10 H new ATOM 0 HB2 TRP A 98 3.166 -16.579 10.978 1.00 64.32 H new ATOM 0 HB3 TRP A 98 3.299 -16.682 12.722 1.00 64.32 H new ATOM 0 HD1 TRP A 98 4.589 -18.292 9.636 1.00 43.11 H new ATOM 0 HE1 TRP A 98 5.894 -20.461 10.169 1.00 34.20 H new ATOM 0 HE3 TRP A 98 3.125 -18.870 14.498 1.00 62.50 H new ATOM 0 HZ2 TRP A 98 6.224 -22.158 12.388 1.00 35.21 H new ATOM 0 HZ3 TRP A 98 3.978 -20.801 15.766 1.00 3.35 H new ATOM 0 HH2 TRP A 98 5.511 -22.420 14.725 1.00 71.33 H new ATOM 1458 N LEU A 99 1.067 -16.915 14.205 1.00 4.13 N ATOM 1459 CA LEU A 99 0.725 -17.109 15.610 1.00 71.20 C ATOM 1460 C LEU A 99 -0.563 -17.914 15.750 1.00 14.31 C ATOM 1461 O LEU A 99 -0.665 -18.799 16.600 1.00 40.41 O ATOM 1462 CB LEU A 99 0.574 -15.758 16.310 1.00 5.43 C ATOM 1463 CG LEU A 99 1.512 -15.506 17.492 1.00 52.11 C ATOM 1464 CD1 LEU A 99 1.288 -16.544 18.581 1.00 4.50 C ATOM 1465 CD2 LEU A 99 2.963 -15.516 17.033 1.00 13.41 C ATOM 0 H LEU A 99 1.223 -15.943 13.939 1.00 4.13 H new ATOM 0 HA LEU A 99 1.534 -17.667 16.082 1.00 71.20 H new ATOM 0 HB2 LEU A 99 0.731 -14.970 15.573 1.00 5.43 H new ATOM 0 HB3 LEU A 99 -0.454 -15.666 16.661 1.00 5.43 H new ATOM 0 HG LEU A 99 1.290 -14.522 17.905 1.00 52.11 H new ATOM 0 HD11 LEU A 99 1.964 -16.349 19.414 1.00 4.50 H new ATOM 0 HD12 LEU A 99 0.257 -16.489 18.930 1.00 4.50 H new ATOM 0 HD13 LEU A 99 1.483 -17.539 18.181 1.00 4.50 H new ATOM 0 HD21 LEU A 99 3.616 -15.335 17.887 1.00 13.41 H new ATOM 0 HD22 LEU A 99 3.199 -16.486 16.594 1.00 13.41 H new ATOM 0 HD23 LEU A 99 3.114 -14.734 16.288 1.00 13.41 H new ATOM 1477 N ARG A 100 -1.544 -17.601 14.910 1.00 73.35 N ATOM 1478 CA ARG A 100 -2.826 -18.296 14.939 1.00 1.21 C ATOM 1479 C ARG A 100 -2.742 -19.624 14.193 1.00 24.43 C ATOM 1480 O ARG A 100 -3.368 -20.609 14.586 1.00 3.13 O ATOM 1481 CB ARG A 100 -3.919 -17.421 14.322 1.00 4.21 C ATOM 1482 CG ARG A 100 -5.188 -18.183 13.979 1.00 60.10 C ATOM 1483 CD ARG A 100 -5.174 -18.669 12.538 1.00 50.40 C ATOM 1484 NE ARG A 100 -6.478 -18.519 11.897 1.00 21.14 N ATOM 1485 CZ ARG A 100 -6.914 -17.378 11.376 1.00 40.12 C ATOM 1486 NH1 ARG A 100 -6.154 -16.292 11.419 1.00 62.45 N ATOM 1487 NH2 ARG A 100 -8.113 -17.321 10.810 1.00 63.04 N ATOM 0 H ARG A 100 -1.476 -16.871 14.201 1.00 73.35 H new ATOM 0 HA ARG A 100 -3.077 -18.499 15.980 1.00 1.21 H new ATOM 0 HB2 ARG A 100 -4.164 -16.617 15.016 1.00 4.21 H new ATOM 0 HB3 ARG A 100 -3.531 -16.953 13.417 1.00 4.21 H new ATOM 0 HG2 ARG A 100 -5.295 -19.035 14.650 1.00 60.10 H new ATOM 0 HG3 ARG A 100 -6.054 -17.541 14.139 1.00 60.10 H new ATOM 0 HD2 ARG A 100 -4.427 -18.111 11.974 1.00 50.40 H new ATOM 0 HD3 ARG A 100 -4.876 -19.717 12.512 1.00 50.40 H new ATOM 0 HE ARG A 100 -7.087 -19.336 11.847 1.00 21.14 H new ATOM 0 HH11 ARG A 100 -5.232 -16.332 11.853 1.00 62.45 H new ATOM 0 HH12 ARG A 100 -6.492 -15.417 11.018 1.00 62.45 H new ATOM 0 HH21 ARG A 100 -8.701 -18.154 10.775 1.00 63.04 H new ATOM 0 HH22 ARG A 100 -8.447 -16.444 10.410 1.00 63.04 H new ATOM 1501 N ARG A 101 -1.964 -19.644 13.116 1.00 52.24 N ATOM 1502 CA ARG A 101 -1.800 -20.850 12.314 1.00 64.40 C ATOM 1503 C ARG A 101 -1.348 -22.022 13.181 1.00 10.22 C ATOM 1504 O ARG A 101 -1.795 -23.153 12.995 1.00 4.11 O ATOM 1505 CB ARG A 101 -0.785 -20.610 11.194 1.00 32.04 C ATOM 1506 CG ARG A 101 -0.465 -21.856 10.385 1.00 51.13 C ATOM 1507 CD ARG A 101 1.021 -22.175 10.417 1.00 44.41 C ATOM 1508 NE ARG A 101 1.272 -23.612 10.482 1.00 12.13 N ATOM 1509 CZ ARG A 101 1.180 -24.422 9.434 1.00 72.41 C ATOM 1510 NH1 ARG A 101 0.845 -23.939 8.245 1.00 25.05 N ATOM 1511 NH2 ARG A 101 1.423 -25.719 9.573 1.00 20.41 N ATOM 0 H ARG A 101 -1.437 -18.838 12.779 1.00 52.24 H new ATOM 0 HA ARG A 101 -2.766 -21.097 11.873 1.00 64.40 H new ATOM 0 HB2 ARG A 101 -1.171 -19.841 10.524 1.00 32.04 H new ATOM 0 HB3 ARG A 101 0.137 -20.222 11.627 1.00 32.04 H new ATOM 0 HG2 ARG A 101 -1.028 -22.702 10.779 1.00 51.13 H new ATOM 0 HG3 ARG A 101 -0.785 -21.713 9.353 1.00 51.13 H new ATOM 0 HD2 ARG A 101 1.499 -21.764 9.528 1.00 44.41 H new ATOM 0 HD3 ARG A 101 1.478 -21.688 11.279 1.00 44.41 H new ATOM 0 HE ARG A 101 1.532 -24.016 11.382 1.00 12.13 H new ATOM 0 HH11 ARG A 101 0.657 -22.943 8.134 1.00 25.05 H new ATOM 0 HH12 ARG A 101 0.775 -24.564 7.442 1.00 25.05 H new ATOM 0 HH21 ARG A 101 1.681 -26.095 10.486 1.00 20.41 H new ATOM 0 HH22 ARG A 101 1.352 -26.340 8.767 1.00 20.41 H new ATOM 1525 N ASN A 102 -0.459 -21.742 14.129 1.00 52.31 N ATOM 1526 CA ASN A 102 0.054 -22.772 15.024 1.00 31.33 C ATOM 1527 C ASN A 102 -0.515 -22.604 16.430 1.00 73.42 C ATOM 1528 O ASN A 102 -0.420 -23.506 17.261 1.00 3.14 O ATOM 1529 CB ASN A 102 1.582 -22.721 15.071 1.00 23.54 C ATOM 1530 CG ASN A 102 2.223 -23.601 14.015 1.00 31.33 C ATOM 1531 OD1 ASN A 102 2.715 -22.982 12.949 1.00 25.12 O flip ATOM 1532 ND2 ASN A 102 2.274 -24.823 14.157 1.00 43.02 N flip ATOM 0 H ASN A 102 -0.079 -20.810 14.297 1.00 52.31 H new ATOM 0 HA ASN A 102 -0.259 -23.742 14.638 1.00 31.33 H new ATOM 0 HB2 ASN A 102 1.913 -21.692 14.932 1.00 23.54 H new ATOM 0 HB3 ASN A 102 1.923 -23.035 16.058 1.00 23.54 H new ATOM 0 HD21 ASN A 102 1.883 -25.256 14.993 1.00 43.02 H new ATOM 0 HD22 ASN A 102 2.708 -25.402 13.438 1.00 43.02 H new ATOM 1539 N GLY A 103 -1.109 -21.443 16.687 1.00 1.33 N ATOM 1540 CA GLY A 103 -1.685 -21.177 17.992 1.00 33.55 C ATOM 1541 C GLY A 103 -3.043 -21.828 18.170 1.00 64.40 C ATOM 1542 O GLY A 103 -3.357 -22.343 19.244 1.00 14.41 O ATOM 0 H GLY A 103 -1.202 -20.682 16.015 1.00 1.33 H new ATOM 0 HA2 GLY A 103 -1.008 -21.539 18.765 1.00 33.55 H new ATOM 0 HA3 GLY A 103 -1.781 -20.100 18.131 1.00 33.55 H new ATOM 1546 N LEU A 104 -3.850 -21.806 17.115 1.00 11.34 N ATOM 1547 CA LEU A 104 -5.183 -22.397 17.160 1.00 70.15 C ATOM 1548 C LEU A 104 -5.677 -22.732 15.756 1.00 61.12 C ATOM 1549 O LEU A 104 -4.951 -22.569 14.774 1.00 1.24 O ATOM 1550 CB LEU A 104 -6.164 -21.443 17.843 1.00 5.52 C ATOM 1551 CG LEU A 104 -6.470 -21.734 19.312 1.00 34.44 C ATOM 1552 CD1 LEU A 104 -5.907 -20.638 20.203 1.00 20.34 C ATOM 1553 CD2 LEU A 104 -7.970 -21.879 19.525 1.00 32.25 C ATOM 0 H LEU A 104 -3.605 -21.386 16.219 1.00 11.34 H new ATOM 0 HA LEU A 104 -5.124 -23.321 17.736 1.00 70.15 H new ATOM 0 HB2 LEU A 104 -5.766 -20.431 17.769 1.00 5.52 H new ATOM 0 HB3 LEU A 104 -7.102 -21.459 17.287 1.00 5.52 H new ATOM 0 HG LEU A 104 -5.991 -22.675 19.583 1.00 34.44 H new ATOM 0 HD11 LEU A 104 -6.135 -20.863 21.245 1.00 20.34 H new ATOM 0 HD12 LEU A 104 -4.826 -20.582 20.072 1.00 20.34 H new ATOM 0 HD13 LEU A 104 -6.355 -19.682 19.932 1.00 20.34 H new ATOM 0 HD21 LEU A 104 -8.170 -22.086 20.576 1.00 32.25 H new ATOM 0 HD22 LEU A 104 -8.470 -20.954 19.236 1.00 32.25 H new ATOM 0 HD23 LEU A 104 -8.346 -22.701 18.916 1.00 32.25 H new ATOM 1609 N SER A 108 -11.633 -15.444 14.188 1.00 12.34 N ATOM 1610 CA SER A 108 -12.137 -14.285 13.461 1.00 41.33 C ATOM 1611 C SER A 108 -11.407 -13.015 13.889 1.00 62.34 C ATOM 1612 O SER A 108 -11.268 -12.073 13.108 1.00 24.14 O ATOM 1613 CB SER A 108 -13.641 -14.124 13.692 1.00 24.54 C ATOM 1614 OG SER A 108 -14.376 -15.078 12.946 1.00 71.40 O ATOM 0 HA SER A 108 -11.955 -14.448 12.399 1.00 41.33 H new ATOM 0 HB2 SER A 108 -13.863 -14.238 14.753 1.00 24.54 H new ATOM 0 HB3 SER A 108 -13.950 -13.118 13.407 1.00 24.54 H new ATOM 0 HG SER A 108 -15.334 -14.955 13.112 1.00 71.40 H new ATOM 1620 N ASP A 109 -10.943 -12.998 15.133 1.00 24.51 N ATOM 1621 CA ASP A 109 -10.226 -11.846 15.666 1.00 25.03 C ATOM 1622 C ASP A 109 -8.831 -11.743 15.056 1.00 73.53 C ATOM 1623 O ASP A 109 -8.400 -10.666 14.644 1.00 20.33 O ATOM 1624 CB ASP A 109 -10.123 -11.942 17.189 1.00 31.13 C ATOM 1625 CG ASP A 109 -10.617 -10.688 17.883 1.00 10.10 C ATOM 1626 OD1 ASP A 109 -11.653 -10.140 17.451 1.00 24.10 O ATOM 1627 OD2 ASP A 109 -9.968 -10.253 18.858 1.00 65.45 O ATOM 0 H ASP A 109 -11.051 -13.769 15.792 1.00 24.51 H new ATOM 0 HA ASP A 109 -10.786 -10.948 15.403 1.00 25.03 H new ATOM 0 HB2 ASP A 109 -10.702 -12.798 17.536 1.00 31.13 H new ATOM 0 HB3 ASP A 109 -9.086 -12.124 17.469 1.00 31.13 H new ATOM 1632 N VAL A 110 -8.130 -12.872 15.001 1.00 13.40 N ATOM 1633 CA VAL A 110 -6.785 -12.909 14.441 1.00 63.11 C ATOM 1634 C VAL A 110 -6.790 -12.508 12.970 1.00 33.11 C ATOM 1635 O VAL A 110 -5.965 -11.707 12.531 1.00 14.54 O ATOM 1636 CB VAL A 110 -6.159 -14.310 14.577 1.00 3.24 C ATOM 1637 CG1 VAL A 110 -4.754 -14.326 13.995 1.00 4.13 C ATOM 1638 CG2 VAL A 110 -6.146 -14.748 16.034 1.00 13.42 C ATOM 0 H VAL A 110 -8.472 -13.772 15.337 1.00 13.40 H new ATOM 0 HA VAL A 110 -6.187 -12.195 15.007 1.00 63.11 H new ATOM 0 HB VAL A 110 -6.768 -15.017 14.014 1.00 3.24 H new ATOM 0 HG11 VAL A 110 -4.328 -15.324 14.100 1.00 4.13 H new ATOM 0 HG12 VAL A 110 -4.794 -14.058 12.939 1.00 4.13 H new ATOM 0 HG13 VAL A 110 -4.131 -13.608 14.528 1.00 4.13 H new ATOM 0 HG21 VAL A 110 -5.701 -15.740 16.112 1.00 13.42 H new ATOM 0 HG22 VAL A 110 -5.561 -14.040 16.621 1.00 13.42 H new ATOM 0 HG23 VAL A 110 -7.167 -14.778 16.414 1.00 13.42 H new ATOM 1648 N SER A 111 -7.726 -13.071 12.212 1.00 13.25 N ATOM 1649 CA SER A 111 -7.838 -12.775 10.789 1.00 2.41 C ATOM 1650 C SER A 111 -8.245 -11.321 10.567 1.00 75.21 C ATOM 1651 O SER A 111 -7.680 -10.629 9.720 1.00 11.13 O ATOM 1652 CB SER A 111 -8.856 -13.708 10.131 1.00 44.15 C ATOM 1653 OG SER A 111 -9.637 -13.016 9.172 1.00 2.30 O ATOM 0 H SER A 111 -8.418 -13.735 12.560 1.00 13.25 H new ATOM 0 HA SER A 111 -6.861 -12.935 10.332 1.00 2.41 H new ATOM 0 HB2 SER A 111 -8.337 -14.538 9.651 1.00 44.15 H new ATOM 0 HB3 SER A 111 -9.506 -14.137 10.893 1.00 44.15 H new ATOM 0 HG SER A 111 -10.279 -13.635 8.765 1.00 2.30 H new ATOM 1659 N ASP A 112 -9.230 -10.866 11.333 1.00 34.14 N ATOM 1660 CA ASP A 112 -9.714 -9.495 11.222 1.00 14.14 C ATOM 1661 C ASP A 112 -8.587 -8.499 11.473 1.00 43.41 C ATOM 1662 O ASP A 112 -8.487 -7.476 10.796 1.00 51.21 O ATOM 1663 CB ASP A 112 -10.855 -9.252 12.212 1.00 72.51 C ATOM 1664 CG ASP A 112 -11.476 -7.878 12.054 1.00 32.52 C ATOM 1665 OD1 ASP A 112 -12.159 -7.650 11.034 1.00 32.22 O ATOM 1666 OD2 ASP A 112 -11.278 -7.031 12.950 1.00 34.13 O ATOM 0 H ASP A 112 -9.709 -11.427 12.038 1.00 34.14 H new ATOM 0 HA ASP A 112 -10.086 -9.349 10.208 1.00 14.14 H new ATOM 0 HB2 ASP A 112 -11.623 -10.013 12.071 1.00 72.51 H new ATOM 0 HB3 ASP A 112 -10.479 -9.363 13.229 1.00 72.51 H new ATOM 1671 N ALA A 113 -7.740 -8.804 12.451 1.00 72.43 N ATOM 1672 CA ALA A 113 -6.619 -7.937 12.790 1.00 13.41 C ATOM 1673 C ALA A 113 -5.554 -7.963 11.699 1.00 33.40 C ATOM 1674 O ALA A 113 -5.024 -6.923 11.310 1.00 14.14 O ATOM 1675 CB ALA A 113 -6.019 -8.348 14.126 1.00 12.24 C ATOM 0 H ALA A 113 -7.809 -9.646 13.023 1.00 72.43 H new ATOM 0 HA ALA A 113 -6.993 -6.916 12.871 1.00 13.41 H new ATOM 0 HB1 ALA A 113 -5.183 -7.692 14.367 1.00 12.24 H new ATOM 0 HB2 ALA A 113 -6.777 -8.270 14.905 1.00 12.24 H new ATOM 0 HB3 ALA A 113 -5.666 -9.378 14.065 1.00 12.24 H new ATOM 1681 N MET A 114 -5.245 -9.160 11.209 1.00 14.44 N ATOM 1682 CA MET A 114 -4.243 -9.321 10.162 1.00 13.23 C ATOM 1683 C MET A 114 -4.566 -8.438 8.961 1.00 62.33 C ATOM 1684 O MET A 114 -3.718 -7.681 8.488 1.00 42.33 O ATOM 1685 CB MET A 114 -4.161 -10.785 9.727 1.00 64.12 C ATOM 1686 CG MET A 114 -3.508 -11.690 10.759 1.00 33.23 C ATOM 1687 SD MET A 114 -4.127 -13.382 10.689 1.00 22.50 S ATOM 1688 CE MET A 114 -4.131 -13.668 8.921 1.00 61.31 C ATOM 0 H MET A 114 -5.674 -10.032 11.520 1.00 14.44 H new ATOM 0 HA MET A 114 -3.278 -9.015 10.566 1.00 13.23 H new ATOM 0 HB2 MET A 114 -5.167 -11.151 9.520 1.00 64.12 H new ATOM 0 HB3 MET A 114 -3.600 -10.848 8.794 1.00 64.12 H new ATOM 0 HG2 MET A 114 -2.429 -11.695 10.602 1.00 33.23 H new ATOM 0 HG3 MET A 114 -3.683 -11.284 11.755 1.00 33.23 H new ATOM 0 HE1 MET A 114 -4.265 -14.732 8.725 1.00 61.31 H new ATOM 0 HE2 MET A 114 -4.948 -13.109 8.464 1.00 61.31 H new ATOM 0 HE3 MET A 114 -3.183 -13.337 8.497 1.00 61.31 H new ATOM 1698 N THR A 115 -5.797 -8.541 8.470 1.00 51.10 N ATOM 1699 CA THR A 115 -6.231 -7.753 7.323 1.00 62.51 C ATOM 1700 C THR A 115 -6.479 -6.301 7.715 1.00 71.51 C ATOM 1701 O THR A 115 -6.348 -5.395 6.892 1.00 24.20 O ATOM 1702 CB THR A 115 -7.515 -8.331 6.698 1.00 63.31 C ATOM 1703 OG1 THR A 115 -8.062 -7.402 5.755 1.00 24.52 O ATOM 1704 CG2 THR A 115 -8.548 -8.640 7.771 1.00 4.33 C ATOM 0 H THR A 115 -6.511 -9.163 8.849 1.00 51.10 H new ATOM 0 HA THR A 115 -5.427 -7.795 6.588 1.00 62.51 H new ATOM 0 HB THR A 115 -7.258 -9.258 6.186 1.00 63.31 H new ATOM 0 HG1 THR A 115 -8.877 -7.777 5.361 1.00 24.52 H new ATOM 0 HG21 THR A 115 -9.446 -9.047 7.305 1.00 4.33 H new ATOM 0 HG22 THR A 115 -8.139 -9.370 8.470 1.00 4.33 H new ATOM 0 HG23 THR A 115 -8.800 -7.725 8.307 1.00 4.33 H new ATOM 1712 N ASP A 116 -6.838 -6.087 8.976 1.00 63.21 N ATOM 1713 CA ASP A 116 -7.103 -4.744 9.478 1.00 44.23 C ATOM 1714 C ASP A 116 -5.860 -3.867 9.365 1.00 43.40 C ATOM 1715 O ASP A 116 -5.950 -2.681 9.044 1.00 75.34 O ATOM 1716 CB ASP A 116 -7.570 -4.803 10.933 1.00 51.22 C ATOM 1717 CG ASP A 116 -7.435 -3.468 11.639 1.00 60.11 C ATOM 1718 OD1 ASP A 116 -8.040 -2.483 11.166 1.00 23.31 O ATOM 1719 OD2 ASP A 116 -6.724 -3.408 12.664 1.00 43.01 O ATOM 0 H ASP A 116 -6.952 -6.826 9.669 1.00 63.21 H new ATOM 0 HA ASP A 116 -7.893 -4.304 8.869 1.00 44.23 H new ATOM 0 HB2 ASP A 116 -8.611 -5.124 10.965 1.00 51.22 H new ATOM 0 HB3 ASP A 116 -6.989 -5.554 11.468 1.00 51.22 H new ATOM 1724 N HIS A 117 -4.699 -4.457 9.633 1.00 41.44 N ATOM 1725 CA HIS A 117 -3.437 -3.729 9.562 1.00 40.53 C ATOM 1726 C HIS A 117 -2.805 -3.870 8.180 1.00 21.33 C ATOM 1727 O HIS A 117 -2.132 -2.959 7.700 1.00 71.15 O ATOM 1728 CB HIS A 117 -2.470 -4.236 10.632 1.00 13.22 C ATOM 1729 CG HIS A 117 -1.765 -5.501 10.251 1.00 1.12 C ATOM 1730 ND1 HIS A 117 -0.689 -5.532 9.390 1.00 64.32 N ATOM 1731 CD2 HIS A 117 -1.987 -6.784 10.621 1.00 45.00 C ATOM 1732 CE1 HIS A 117 -0.280 -6.780 9.245 1.00 62.11 C ATOM 1733 NE2 HIS A 117 -1.051 -7.559 9.982 1.00 65.40 N ATOM 0 H HIS A 117 -4.606 -5.437 9.901 1.00 41.44 H new ATOM 0 HA HIS A 117 -3.644 -2.674 9.741 1.00 40.53 H new ATOM 0 HB2 HIS A 117 -1.728 -3.463 10.835 1.00 13.22 H new ATOM 0 HB3 HIS A 117 -3.020 -4.401 11.558 1.00 13.22 H new ATOM 0 HD2 HIS A 117 -2.757 -7.133 11.293 1.00 45.00 H new ATOM 0 HE1 HIS A 117 0.544 -7.107 8.629 1.00 62.11 H new ATOM 0 HE2 HIS A 117 -0.965 -8.572 10.063 1.00 65.40 H new ATOM 1741 N GLU A 118 -3.026 -5.019 7.549 1.00 62.03 N ATOM 1742 CA GLU A 118 -2.476 -5.279 6.224 1.00 62.45 C ATOM 1743 C GLU A 118 -3.050 -4.309 5.196 1.00 53.33 C ATOM 1744 O GLU A 118 -2.408 -3.999 4.192 1.00 34.24 O ATOM 1745 CB GLU A 118 -2.768 -6.720 5.800 1.00 74.24 C ATOM 1746 CG GLU A 118 -1.656 -7.695 6.149 1.00 73.15 C ATOM 1747 CD GLU A 118 -1.049 -8.351 4.923 1.00 14.43 C ATOM 1748 OE1 GLU A 118 -0.212 -7.705 4.259 1.00 3.33 O ATOM 1749 OE2 GLU A 118 -1.412 -9.508 4.628 1.00 21.42 O ATOM 0 H GLU A 118 -3.581 -5.783 7.933 1.00 62.03 H new ATOM 0 HA GLU A 118 -1.397 -5.133 6.272 1.00 62.45 H new ATOM 0 HB2 GLU A 118 -3.691 -7.050 6.276 1.00 74.24 H new ATOM 0 HB3 GLU A 118 -2.938 -6.746 4.724 1.00 74.24 H new ATOM 0 HG2 GLU A 118 -0.876 -7.169 6.699 1.00 73.15 H new ATOM 0 HG3 GLU A 118 -2.049 -8.466 6.812 1.00 73.15 H new ATOM 1756 N MET A 119 -4.264 -3.833 5.454 1.00 40.32 N ATOM 1757 CA MET A 119 -4.925 -2.897 4.552 1.00 51.21 C ATOM 1758 C MET A 119 -4.187 -1.563 4.516 1.00 3.51 C ATOM 1759 O MET A 119 -4.425 -0.733 3.638 1.00 2.44 O ATOM 1760 CB MET A 119 -6.377 -2.678 4.983 1.00 25.34 C ATOM 1761 CG MET A 119 -7.257 -2.103 3.886 1.00 61.32 C ATOM 1762 SD MET A 119 -8.656 -1.169 4.535 1.00 22.22 S ATOM 1763 CE MET A 119 -9.603 -2.475 5.314 1.00 62.14 C ATOM 0 H MET A 119 -4.810 -4.080 6.280 1.00 40.32 H new ATOM 0 HA MET A 119 -4.912 -3.327 3.550 1.00 51.21 H new ATOM 0 HB2 MET A 119 -6.797 -3.628 5.313 1.00 25.34 H new ATOM 0 HB3 MET A 119 -6.395 -2.006 5.841 1.00 25.34 H new ATOM 0 HG2 MET A 119 -6.657 -1.455 3.247 1.00 61.32 H new ATOM 0 HG3 MET A 119 -7.626 -2.915 3.259 1.00 61.32 H new ATOM 0 HE1 MET A 119 -10.512 -2.057 5.747 1.00 62.14 H new ATOM 0 HE2 MET A 119 -9.868 -3.226 4.570 1.00 62.14 H new ATOM 0 HE3 MET A 119 -9.006 -2.938 6.100 1.00 62.14 H new ATOM 1773 N LYS A 120 -3.290 -1.362 5.476 1.00 43.04 N ATOM 1774 CA LYS A 120 -2.515 -0.129 5.554 1.00 32.10 C ATOM 1775 C LYS A 120 -1.154 -0.298 4.886 1.00 32.12 C ATOM 1776 O LYS A 120 -0.401 0.663 4.738 1.00 1.24 O ATOM 1777 CB LYS A 120 -2.330 0.289 7.014 1.00 10.15 C ATOM 1778 CG LYS A 120 -3.117 1.531 7.396 1.00 34.41 C ATOM 1779 CD LYS A 120 -4.048 1.263 8.567 1.00 24.34 C ATOM 1780 CE LYS A 120 -5.488 1.097 8.108 1.00 32.44 C ATOM 1781 NZ LYS A 120 -6.076 2.385 7.650 1.00 54.52 N ATOM 0 H LYS A 120 -3.082 -2.038 6.211 1.00 43.04 H new ATOM 0 HA LYS A 120 -3.065 0.650 5.026 1.00 32.10 H new ATOM 0 HB2 LYS A 120 -2.632 -0.535 7.660 1.00 10.15 H new ATOM 0 HB3 LYS A 120 -1.271 0.469 7.200 1.00 10.15 H new ATOM 0 HG2 LYS A 120 -2.427 2.335 7.655 1.00 34.41 H new ATOM 0 HG3 LYS A 120 -3.698 1.873 6.539 1.00 34.41 H new ATOM 0 HD2 LYS A 120 -3.726 0.363 9.090 1.00 24.34 H new ATOM 0 HD3 LYS A 120 -3.985 2.086 9.279 1.00 24.34 H new ATOM 0 HE2 LYS A 120 -5.529 0.370 7.297 1.00 32.44 H new ATOM 0 HE3 LYS A 120 -6.086 0.695 8.926 1.00 32.44 H new ATOM 0 HZ1 LYS A 120 -7.112 2.303 7.621 1.00 54.52 H new ATOM 0 HZ2 LYS A 120 -5.808 3.143 8.309 1.00 54.52 H new ATOM 0 HZ3 LYS A 120 -5.720 2.611 6.699 1.00 54.52 H new ATOM 1795 N GLY A 121 -0.846 -1.527 4.483 1.00 72.11 N ATOM 1796 CA GLY A 121 0.423 -1.799 3.834 1.00 2.32 C ATOM 1797 C GLY A 121 1.545 -2.026 4.828 1.00 42.41 C ATOM 1798 O GLY A 121 2.702 -2.185 4.440 1.00 22.44 O ATOM 0 H GLY A 121 -1.453 -2.339 4.594 1.00 72.11 H new ATOM 0 HA2 GLY A 121 0.321 -2.679 3.198 1.00 2.32 H new ATOM 0 HA3 GLY A 121 0.681 -0.964 3.183 1.00 2.32 H new ATOM 1802 N GLN A 122 1.203 -2.038 6.112 1.00 33.21 N ATOM 1803 CA GLN A 122 2.191 -2.245 7.164 1.00 43.32 C ATOM 1804 C GLN A 122 2.689 -3.686 7.168 1.00 71.43 C ATOM 1805 O GLN A 122 2.223 -4.518 6.388 1.00 43.24 O ATOM 1806 CB GLN A 122 1.596 -1.895 8.529 1.00 52.44 C ATOM 1807 CG GLN A 122 1.023 -0.488 8.600 1.00 60.23 C ATOM 1808 CD GLN A 122 -0.077 -0.358 9.635 1.00 41.22 C ATOM 1809 OE1 GLN A 122 -0.041 0.530 10.487 1.00 51.41 O ATOM 1810 NE2 GLN A 122 -1.063 -1.244 9.566 1.00 31.41 N ATOM 0 H GLN A 122 0.249 -1.907 6.449 1.00 33.21 H new ATOM 0 HA GLN A 122 3.038 -1.588 6.966 1.00 43.32 H new ATOM 0 HB2 GLN A 122 0.810 -2.611 8.768 1.00 52.44 H new ATOM 0 HB3 GLN A 122 2.368 -2.003 9.291 1.00 52.44 H new ATOM 0 HG2 GLN A 122 1.823 0.215 8.835 1.00 60.23 H new ATOM 0 HG3 GLN A 122 0.631 -0.209 7.622 1.00 60.23 H new ATOM 0 HE21 GLN A 122 -1.052 -1.963 8.843 1.00 31.41 H new ATOM 0 HE22 GLN A 122 -1.831 -1.205 10.236 1.00 31.41 H new ATOM 1819 N THR A 123 3.639 -3.977 8.051 1.00 20.11 N ATOM 1820 CA THR A 123 4.201 -5.318 8.156 1.00 42.44 C ATOM 1821 C THR A 123 4.636 -5.622 9.585 1.00 53.32 C ATOM 1822 O THR A 123 5.740 -5.268 9.996 1.00 22.02 O ATOM 1823 CB THR A 123 5.408 -5.496 7.215 1.00 1.53 C ATOM 1824 OG1 THR A 123 5.583 -4.321 6.415 1.00 20.00 O ATOM 1825 CG2 THR A 123 5.218 -6.706 6.314 1.00 51.13 C ATOM 0 H THR A 123 4.036 -3.301 8.704 1.00 20.11 H new ATOM 0 HA THR A 123 3.415 -6.014 7.863 1.00 42.44 H new ATOM 0 HB THR A 123 6.297 -5.654 7.826 1.00 1.53 H new ATOM 0 HG1 THR A 123 6.119 -4.540 5.625 1.00 20.00 H new ATOM 0 HG21 THR A 123 6.083 -6.811 5.659 1.00 51.13 H new ATOM 0 HG22 THR A 123 5.115 -7.602 6.926 1.00 51.13 H new ATOM 0 HG23 THR A 123 4.320 -6.573 5.711 1.00 51.13 H new ATOM 1833 N ALA A 124 3.760 -6.280 10.337 1.00 21.02 N ATOM 1834 CA ALA A 124 4.055 -6.634 11.720 1.00 61.10 C ATOM 1835 C ALA A 124 4.473 -8.096 11.835 1.00 22.01 C ATOM 1836 O ALA A 124 3.640 -8.998 11.746 1.00 21.31 O ATOM 1837 CB ALA A 124 2.849 -6.357 12.605 1.00 54.04 C ATOM 0 H ALA A 124 2.840 -6.579 10.012 1.00 21.02 H new ATOM 0 HA ALA A 124 4.888 -6.017 12.057 1.00 61.10 H new ATOM 0 HB1 ALA A 124 3.084 -6.626 13.635 1.00 54.04 H new ATOM 0 HB2 ALA A 124 2.597 -5.298 12.555 1.00 54.04 H new ATOM 0 HB3 ALA A 124 2.001 -6.948 12.260 1.00 54.04 H new ATOM 1843 N ILE A 125 5.768 -8.323 12.033 1.00 55.54 N ATOM 1844 CA ILE A 125 6.295 -9.675 12.160 1.00 20.31 C ATOM 1845 C ILE A 125 6.738 -9.960 13.591 1.00 3.11 C ATOM 1846 O ILE A 125 7.444 -9.159 14.205 1.00 2.31 O ATOM 1847 CB ILE A 125 7.485 -9.907 11.210 1.00 31.42 C ATOM 1848 CG1 ILE A 125 7.165 -9.366 9.815 1.00 22.03 C ATOM 1849 CG2 ILE A 125 7.829 -11.388 11.144 1.00 54.03 C ATOM 1850 CD1 ILE A 125 7.621 -7.940 9.602 1.00 44.35 C ATOM 0 H ILE A 125 6.471 -7.587 12.109 1.00 55.54 H new ATOM 0 HA ILE A 125 5.487 -10.355 11.890 1.00 20.31 H new ATOM 0 HB ILE A 125 8.351 -9.370 11.598 1.00 31.42 H new ATOM 0 HG12 ILE A 125 7.637 -10.005 9.069 1.00 22.03 H new ATOM 0 HG13 ILE A 125 6.089 -9.424 9.650 1.00 22.03 H new ATOM 0 HG21 ILE A 125 8.672 -11.536 10.469 1.00 54.03 H new ATOM 0 HG22 ILE A 125 8.094 -11.745 12.139 1.00 54.03 H new ATOM 0 HG23 ILE A 125 6.967 -11.946 10.777 1.00 54.03 H new ATOM 0 HD11 ILE A 125 7.362 -7.622 8.592 1.00 44.35 H new ATOM 0 HD12 ILE A 125 7.129 -7.289 10.325 1.00 44.35 H new ATOM 0 HD13 ILE A 125 8.701 -7.880 9.735 1.00 44.35 H new ATOM 1862 N LEU A 126 6.321 -11.106 14.117 1.00 63.54 N ATOM 1863 CA LEU A 126 6.677 -11.499 15.476 1.00 72.21 C ATOM 1864 C LEU A 126 7.650 -12.673 15.467 1.00 63.45 C ATOM 1865 O LEU A 126 7.500 -13.612 14.684 1.00 32.02 O ATOM 1866 CB LEU A 126 5.420 -11.870 16.266 1.00 44.22 C ATOM 1867 CG LEU A 126 4.208 -10.960 16.065 1.00 42.34 C ATOM 1868 CD1 LEU A 126 3.044 -11.743 15.479 1.00 33.32 C ATOM 1869 CD2 LEU A 126 3.807 -10.307 17.380 1.00 61.34 C ATOM 0 H LEU A 126 5.736 -11.780 13.623 1.00 63.54 H new ATOM 0 HA LEU A 126 7.165 -10.651 15.957 1.00 72.21 H new ATOM 0 HB2 LEU A 126 5.134 -12.887 15.998 1.00 44.22 H new ATOM 0 HB3 LEU A 126 5.671 -11.878 17.327 1.00 44.22 H new ATOM 0 HG LEU A 126 4.481 -10.174 15.361 1.00 42.34 H new ATOM 0 HD11 LEU A 126 2.190 -11.079 15.343 1.00 33.32 H new ATOM 0 HD12 LEU A 126 3.335 -12.161 14.516 1.00 33.32 H new ATOM 0 HD13 LEU A 126 2.771 -12.551 16.158 1.00 33.32 H new ATOM 0 HD21 LEU A 126 2.943 -9.663 17.218 1.00 61.34 H new ATOM 0 HD22 LEU A 126 3.553 -11.079 18.107 1.00 61.34 H new ATOM 0 HD23 LEU A 126 4.638 -9.711 17.759 1.00 61.34 H new ATOM 1881 N VAL A 127 8.648 -12.615 16.343 1.00 62.32 N ATOM 1882 CA VAL A 127 9.645 -13.675 16.438 1.00 33.30 C ATOM 1883 C VAL A 127 9.465 -14.485 17.717 1.00 71.31 C ATOM 1884 O VAL A 127 9.438 -13.932 18.816 1.00 51.13 O ATOM 1885 CB VAL A 127 11.075 -13.106 16.401 1.00 3.40 C ATOM 1886 CG1 VAL A 127 12.090 -14.223 16.212 1.00 3.33 C ATOM 1887 CG2 VAL A 127 11.205 -12.064 15.300 1.00 63.32 C ATOM 0 H VAL A 127 8.788 -11.845 16.997 1.00 62.32 H new ATOM 0 HA VAL A 127 9.499 -14.325 15.575 1.00 33.30 H new ATOM 0 HB VAL A 127 11.279 -12.621 17.355 1.00 3.40 H new ATOM 0 HG11 VAL A 127 13.095 -13.801 16.188 1.00 3.33 H new ATOM 0 HG12 VAL A 127 12.012 -14.929 17.039 1.00 3.33 H new ATOM 0 HG13 VAL A 127 11.891 -14.740 15.273 1.00 3.33 H new ATOM 0 HG21 VAL A 127 12.222 -11.672 15.288 1.00 63.32 H new ATOM 0 HG22 VAL A 127 10.981 -12.523 14.337 1.00 63.32 H new ATOM 0 HG23 VAL A 127 10.505 -11.250 15.485 1.00 63.32 H new ATOM 1897 N ALA A 128 9.343 -15.800 17.566 1.00 72.12 N ATOM 1898 CA ALA A 128 9.168 -16.687 18.709 1.00 61.41 C ATOM 1899 C ALA A 128 10.277 -17.732 18.767 1.00 23.23 C ATOM 1900 O ALA A 128 10.674 -18.287 17.742 1.00 22.54 O ATOM 1901 CB ALA A 128 7.806 -17.363 18.649 1.00 23.41 C ATOM 0 H ALA A 128 9.362 -16.274 16.663 1.00 72.12 H new ATOM 0 HA ALA A 128 9.223 -16.085 19.616 1.00 61.41 H new ATOM 0 HB1 ALA A 128 7.689 -18.023 19.509 1.00 23.41 H new ATOM 0 HB2 ALA A 128 7.023 -16.605 18.664 1.00 23.41 H new ATOM 0 HB3 ALA A 128 7.729 -17.946 17.731 1.00 23.41 H new ATOM 1907 N ILE A 129 10.774 -17.995 19.972 1.00 52.44 N ATOM 1908 CA ILE A 129 11.837 -18.973 20.162 1.00 20.24 C ATOM 1909 C ILE A 129 11.385 -20.104 21.080 1.00 21.10 C ATOM 1910 O ILE A 129 10.836 -19.863 22.155 1.00 31.02 O ATOM 1911 CB ILE A 129 13.102 -18.322 20.753 1.00 72.31 C ATOM 1912 CG1 ILE A 129 12.769 -17.605 22.063 1.00 55.14 C ATOM 1913 CG2 ILE A 129 13.715 -17.353 19.753 1.00 20.41 C ATOM 1914 CD1 ILE A 129 13.414 -18.234 23.277 1.00 34.35 C ATOM 0 H ILE A 129 10.457 -17.544 20.830 1.00 52.44 H new ATOM 0 HA ILE A 129 12.073 -19.378 19.178 1.00 20.24 H new ATOM 0 HB ILE A 129 13.831 -19.105 20.965 1.00 72.31 H new ATOM 0 HG12 ILE A 129 13.088 -16.565 21.990 1.00 55.14 H new ATOM 0 HG13 ILE A 129 11.688 -17.598 22.199 1.00 55.14 H new ATOM 0 HG21 ILE A 129 14.608 -16.901 20.185 1.00 20.41 H new ATOM 0 HG22 ILE A 129 13.984 -17.890 18.844 1.00 20.41 H new ATOM 0 HG23 ILE A 129 12.993 -16.572 19.513 1.00 20.41 H new ATOM 0 HD11 ILE A 129 13.134 -17.674 24.169 1.00 34.35 H new ATOM 0 HD12 ILE A 129 13.076 -19.265 23.375 1.00 34.35 H new ATOM 0 HD13 ILE A 129 14.498 -18.217 23.163 1.00 34.35 H new ATOM 1926 N ASP A 130 11.621 -21.338 20.649 1.00 24.21 N ATOM 1927 CA ASP A 130 11.241 -22.508 21.433 1.00 5.31 C ATOM 1928 C ASP A 130 9.774 -22.434 21.843 1.00 0.54 C ATOM 1929 O ASP A 130 9.415 -22.780 22.968 1.00 1.51 O ATOM 1930 CB ASP A 130 12.126 -22.625 22.675 1.00 11.34 C ATOM 1931 CG ASP A 130 12.099 -24.016 23.277 1.00 74.24 C ATOM 1932 OD1 ASP A 130 11.406 -24.891 22.716 1.00 15.42 O ATOM 1933 OD2 ASP A 130 12.770 -24.231 24.308 1.00 52.31 O ATOM 0 H ASP A 130 12.074 -21.554 19.761 1.00 24.21 H new ATOM 0 HA ASP A 130 11.381 -23.393 20.812 1.00 5.31 H new ATOM 0 HB2 ASP A 130 13.152 -22.366 22.412 1.00 11.34 H new ATOM 0 HB3 ASP A 130 11.796 -21.903 23.422 1.00 11.34 H new ATOM 1938 N GLY A 131 8.929 -21.978 20.923 1.00 64.43 N ATOM 1939 CA GLY A 131 7.511 -21.866 21.208 1.00 1.32 C ATOM 1940 C GLY A 131 7.206 -20.763 22.202 1.00 55.41 C ATOM 1941 O GLY A 131 6.183 -20.799 22.887 1.00 62.52 O ATOM 0 H GLY A 131 9.202 -21.684 19.985 1.00 64.43 H new ATOM 0 HA2 GLY A 131 6.971 -21.675 20.281 1.00 1.32 H new ATOM 0 HA3 GLY A 131 7.146 -22.815 21.600 1.00 1.32 H new ATOM 1945 N VAL A 132 8.095 -19.778 22.283 1.00 60.01 N ATOM 1946 CA VAL A 132 7.916 -18.659 23.201 1.00 71.42 C ATOM 1947 C VAL A 132 8.275 -17.337 22.533 1.00 64.25 C ATOM 1948 O VAL A 132 9.434 -17.097 22.189 1.00 32.21 O ATOM 1949 CB VAL A 132 8.773 -18.831 24.469 1.00 62.02 C ATOM 1950 CG1 VAL A 132 8.574 -17.654 25.411 1.00 4.13 C ATOM 1951 CG2 VAL A 132 8.440 -20.143 25.163 1.00 1.12 C ATOM 0 H VAL A 132 8.947 -19.732 21.724 1.00 60.01 H new ATOM 0 HA VAL A 132 6.863 -18.646 23.482 1.00 71.42 H new ATOM 0 HB VAL A 132 9.823 -18.858 24.177 1.00 62.02 H new ATOM 0 HG11 VAL A 132 9.187 -17.793 26.301 1.00 4.13 H new ATOM 0 HG12 VAL A 132 8.867 -16.732 24.909 1.00 4.13 H new ATOM 0 HG13 VAL A 132 7.525 -17.592 25.699 1.00 4.13 H new ATOM 0 HG21 VAL A 132 9.055 -20.248 26.057 1.00 1.12 H new ATOM 0 HG22 VAL A 132 7.387 -20.149 25.444 1.00 1.12 H new ATOM 0 HG23 VAL A 132 8.639 -20.974 24.486 1.00 1.12 H new ATOM 1961 N LEU A 133 7.276 -16.481 22.351 1.00 73.50 N ATOM 1962 CA LEU A 133 7.486 -15.181 21.724 1.00 71.22 C ATOM 1963 C LEU A 133 8.677 -14.462 22.348 1.00 11.54 C ATOM 1964 O LEU A 133 8.665 -14.137 23.537 1.00 64.35 O ATOM 1965 CB LEU A 133 6.229 -14.320 21.856 1.00 75.12 C ATOM 1966 CG LEU A 133 5.676 -13.735 20.556 1.00 44.44 C ATOM 1967 CD1 LEU A 133 4.275 -14.260 20.287 1.00 54.43 C ATOM 1968 CD2 LEU A 133 5.676 -12.214 20.613 1.00 4.01 C ATOM 0 H LEU A 133 6.312 -16.664 22.629 1.00 73.50 H new ATOM 0 HA LEU A 133 7.697 -15.345 20.667 1.00 71.22 H new ATOM 0 HB2 LEU A 133 5.448 -14.922 22.321 1.00 75.12 H new ATOM 0 HB3 LEU A 133 6.446 -13.498 22.537 1.00 75.12 H new ATOM 0 HG LEU A 133 6.322 -14.048 19.736 1.00 44.44 H new ATOM 0 HD11 LEU A 133 3.898 -13.832 19.358 1.00 54.43 H new ATOM 0 HD12 LEU A 133 4.304 -15.346 20.201 1.00 54.43 H new ATOM 0 HD13 LEU A 133 3.617 -13.978 21.109 1.00 54.43 H new ATOM 0 HD21 LEU A 133 5.279 -11.815 19.679 1.00 4.01 H new ATOM 0 HD22 LEU A 133 5.054 -11.881 21.444 1.00 4.01 H new ATOM 0 HD23 LEU A 133 6.695 -11.855 20.757 1.00 4.01 H new ATOM 1980 N CYS A 134 9.701 -14.213 21.540 1.00 24.13 N ATOM 1981 CA CYS A 134 10.900 -13.530 22.013 1.00 2.13 C ATOM 1982 C CYS A 134 10.799 -12.027 21.776 1.00 53.30 C ATOM 1983 O CYS A 134 11.251 -11.227 22.594 1.00 12.20 O ATOM 1984 CB CYS A 134 12.140 -14.087 21.312 1.00 50.30 C ATOM 1985 SG CYS A 134 13.677 -13.854 22.235 1.00 21.53 S ATOM 0 H CYS A 134 9.725 -14.474 20.554 1.00 24.13 H new ATOM 0 HA CYS A 134 10.989 -13.705 23.085 1.00 2.13 H new ATOM 0 HB2 CYS A 134 11.995 -15.152 21.132 1.00 50.30 H new ATOM 0 HB3 CYS A 134 12.238 -13.610 20.337 1.00 50.30 H new ATOM 0 HG CYS A 134 13.408 -13.363 23.408 1.00 21.53 H new ATOM 1991 N GLY A 135 10.203 -11.650 20.649 1.00 52.53 N ATOM 1992 CA GLY A 135 10.054 -10.243 20.323 1.00 65.23 C ATOM 1993 C GLY A 135 9.083 -10.012 19.182 1.00 4.20 C ATOM 1994 O GLY A 135 8.642 -10.959 18.532 1.00 63.00 O ATOM 0 H GLY A 135 9.821 -12.293 19.956 1.00 52.53 H new ATOM 0 HA2 GLY A 135 9.709 -9.703 21.205 1.00 65.23 H new ATOM 0 HA3 GLY A 135 11.027 -9.830 20.057 1.00 65.23 H new ATOM 1998 N MET A 136 8.748 -8.749 18.939 1.00 3.22 N ATOM 1999 CA MET A 136 7.822 -8.396 17.869 1.00 24.51 C ATOM 2000 C MET A 136 8.241 -7.094 17.195 1.00 41.21 C ATOM 2001 O MET A 136 8.560 -6.112 17.866 1.00 51.33 O ATOM 2002 CB MET A 136 6.400 -8.266 18.418 1.00 5.14 C ATOM 2003 CG MET A 136 6.290 -7.314 19.599 1.00 70.42 C ATOM 2004 SD MET A 136 4.643 -7.306 20.332 1.00 31.13 S ATOM 2005 CE MET A 136 3.699 -6.510 19.035 1.00 14.12 C ATOM 0 H MET A 136 9.104 -7.953 19.468 1.00 3.22 H new ATOM 0 HA MET A 136 7.845 -9.193 17.125 1.00 24.51 H new ATOM 0 HB2 MET A 136 5.741 -7.921 17.621 1.00 5.14 H new ATOM 0 HB3 MET A 136 6.045 -9.251 18.721 1.00 5.14 H new ATOM 0 HG2 MET A 136 7.020 -7.596 20.358 1.00 70.42 H new ATOM 0 HG3 MET A 136 6.543 -6.305 19.273 1.00 70.42 H new ATOM 0 HE1 MET A 136 2.708 -6.255 19.410 1.00 14.12 H new ATOM 0 HE2 MET A 136 4.211 -5.602 18.717 1.00 14.12 H new ATOM 0 HE3 MET A 136 3.602 -7.188 18.187 1.00 14.12 H new ATOM 2015 N ILE A 137 8.238 -7.093 15.866 1.00 22.12 N ATOM 2016 CA ILE A 137 8.617 -5.911 15.103 1.00 40.34 C ATOM 2017 C ILE A 137 7.490 -5.472 14.173 1.00 3.15 C ATOM 2018 O ILE A 137 6.771 -6.302 13.618 1.00 21.04 O ATOM 2019 CB ILE A 137 9.887 -6.162 14.268 1.00 32.41 C ATOM 2020 CG1 ILE A 137 10.981 -6.784 15.139 1.00 53.12 C ATOM 2021 CG2 ILE A 137 10.374 -4.865 13.641 1.00 5.23 C ATOM 2022 CD1 ILE A 137 11.306 -8.214 14.770 1.00 22.55 C ATOM 0 H ILE A 137 7.977 -7.898 15.296 1.00 22.12 H new ATOM 0 HA ILE A 137 8.818 -5.121 15.826 1.00 40.34 H new ATOM 0 HB ILE A 137 9.646 -6.861 13.467 1.00 32.41 H new ATOM 0 HG12 ILE A 137 11.886 -6.182 15.057 1.00 53.12 H new ATOM 0 HG13 ILE A 137 10.668 -6.749 16.182 1.00 53.12 H new ATOM 0 HG21 ILE A 137 11.272 -5.059 13.054 1.00 5.23 H new ATOM 0 HG22 ILE A 137 9.597 -4.460 12.992 1.00 5.23 H new ATOM 0 HG23 ILE A 137 10.603 -4.145 14.426 1.00 5.23 H new ATOM 0 HD11 ILE A 137 12.089 -8.591 15.428 1.00 22.55 H new ATOM 0 HD12 ILE A 137 10.413 -8.830 14.879 1.00 22.55 H new ATOM 0 HD13 ILE A 137 11.650 -8.254 13.737 1.00 22.55 H new ATOM 2034 N ALA A 138 7.344 -4.161 14.008 1.00 71.54 N ATOM 2035 CA ALA A 138 6.307 -3.612 13.142 1.00 24.05 C ATOM 2036 C ALA A 138 6.856 -2.483 12.277 1.00 64.12 C ATOM 2037 O ALA A 138 7.385 -1.496 12.790 1.00 54.04 O ATOM 2038 CB ALA A 138 5.133 -3.119 13.974 1.00 13.31 C ATOM 0 H ALA A 138 7.930 -3.460 14.462 1.00 71.54 H new ATOM 0 HA ALA A 138 5.962 -4.406 12.480 1.00 24.05 H new ATOM 0 HB1 ALA A 138 4.366 -2.712 13.315 1.00 13.31 H new ATOM 0 HB2 ALA A 138 4.717 -3.949 14.545 1.00 13.31 H new ATOM 0 HB3 ALA A 138 5.473 -2.342 14.659 1.00 13.31 H new ATOM 2044 N ILE A 139 6.729 -2.636 10.963 1.00 12.51 N ATOM 2045 CA ILE A 139 7.212 -1.628 10.027 1.00 21.01 C ATOM 2046 C ILE A 139 6.058 -0.994 9.258 1.00 43.12 C ATOM 2047 O ILE A 139 5.109 -1.674 8.871 1.00 73.21 O ATOM 2048 CB ILE A 139 8.216 -2.227 9.024 1.00 55.11 C ATOM 2049 CG1 ILE A 139 7.682 -3.546 8.462 1.00 62.22 C ATOM 2050 CG2 ILE A 139 9.568 -2.436 9.689 1.00 71.35 C ATOM 2051 CD1 ILE A 139 8.364 -3.977 7.182 1.00 75.12 C ATOM 0 H ILE A 139 6.296 -3.448 10.523 1.00 12.51 H new ATOM 0 HA ILE A 139 7.715 -0.863 10.618 1.00 21.01 H new ATOM 0 HB ILE A 139 8.344 -1.527 8.198 1.00 55.11 H new ATOM 0 HG12 ILE A 139 7.806 -4.328 9.211 1.00 62.22 H new ATOM 0 HG13 ILE A 139 6.612 -3.447 8.279 1.00 62.22 H new ATOM 0 HG21 ILE A 139 10.267 -2.860 8.968 1.00 71.35 H new ATOM 0 HG22 ILE A 139 9.950 -1.479 10.045 1.00 71.35 H new ATOM 0 HG23 ILE A 139 9.457 -3.119 10.531 1.00 71.35 H new ATOM 0 HD11 ILE A 139 7.935 -4.919 6.841 1.00 75.12 H new ATOM 0 HD12 ILE A 139 8.218 -3.214 6.417 1.00 75.12 H new ATOM 0 HD13 ILE A 139 9.431 -4.109 7.364 1.00 75.12 H new ATOM 2063 N ALA A 140 6.149 0.314 9.038 1.00 73.30 N ATOM 2064 CA ALA A 140 5.114 1.039 8.311 1.00 4.52 C ATOM 2065 C ALA A 140 5.666 1.635 7.020 1.00 12.03 C ATOM 2066 O ALA A 140 6.543 2.499 7.049 1.00 74.22 O ATOM 2067 CB ALA A 140 4.522 2.133 9.188 1.00 34.50 C ATOM 0 H ALA A 140 6.928 0.892 9.353 1.00 73.30 H new ATOM 0 HA ALA A 140 4.327 0.333 8.047 1.00 4.52 H new ATOM 0 HB1 ALA A 140 3.750 2.667 8.633 1.00 34.50 H new ATOM 0 HB2 ALA A 140 4.084 1.687 10.081 1.00 34.50 H new ATOM 0 HB3 ALA A 140 5.307 2.830 9.479 1.00 34.50 H new ATOM 2073 N ASP A 141 5.147 1.168 5.890 1.00 22.20 N ATOM 2074 CA ASP A 141 5.588 1.655 4.588 1.00 73.21 C ATOM 2075 C ASP A 141 4.889 2.963 4.232 1.00 14.12 C ATOM 2076 O ASP A 141 3.671 2.998 4.048 1.00 61.42 O ATOM 2077 CB ASP A 141 5.315 0.606 3.508 1.00 14.34 C ATOM 2078 CG ASP A 141 6.520 0.359 2.623 1.00 24.14 C ATOM 2079 OD1 ASP A 141 7.594 0.022 3.165 1.00 72.44 O ATOM 2080 OD2 ASP A 141 6.391 0.503 1.390 1.00 51.55 O ATOM 0 H ASP A 141 4.421 0.453 5.849 1.00 22.20 H new ATOM 0 HA ASP A 141 6.661 1.840 4.641 1.00 73.21 H new ATOM 0 HB2 ASP A 141 5.018 -0.330 3.981 1.00 14.34 H new ATOM 0 HB3 ASP A 141 4.477 0.932 2.893 1.00 14.34 H new