USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1101 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 14 ASN : amide:sc= -0.57 X(o=-0.24,f=-0.0078) USER MOD Set 1.2: A 127 CYS SG : rot -53:sc= 0.325 USER MOD Set 2.1: A 105 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 113 MET CE :methyl -165:sc= -0.0673 (180deg=-0.152) USER MOD Set 3.1: A 96 LYS NZ :NH3+ -158:sc= 0.252 (180deg=0) USER MOD Set 3.2: A 119 SER OG : rot -48:sc= 0.343 USER MOD Set 4.1: A 82 SER OG : rot 40:sc= 0.801 USER MOD Set 4.2: A 84 LYS NZ :NH3+ -155:sc= 0.911 (180deg=-0.176) USER MOD Set 5.1: A 73 THR OG1 : rot 100:sc= 0.709 USER MOD Set 5.2: A 86 MET CE :methyl 178:sc= -2.58! (180deg=-2.59!) USER MOD Set 6.1: A 50 SER OG : rot 160:sc= 0 USER MOD Set 6.2: A 63 THR OG1 : rot 25:sc= -0.687 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= -0.124 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 168:sc= -0.828 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= -0.783 X(o=-0.78,f=-0.91) USER MOD Single : A 24 GLN : amide:sc= -0.33 K(o=-0.33,f=-2.2!) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 51 MET CE :methyl -110:sc= -1.28 (180deg=-2.11) USER MOD Single : A 52 TYR OH : rot 50:sc= -1.86 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -126:sc= 0 (180deg=-0.112) USER MOD Single : A 65 SER OG : rot 150:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 CYS SG : rot 66:sc= -0.403 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 100:sc= -0.95 USER MOD Single : A 75 SER OG : rot -31:sc= -1.64 USER MOD Single : A 76 CYS SG : rot 46:sc= -0.0424 USER MOD Single : A 78 ASN : amide:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -0.474 K(o=-0.47,f=-1.8) USER MOD Single : A 91 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.72) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -8.1! C(o=-8.1!,f=-5.4!) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 LYS NZ :NH3+ -134:sc= -0.99 (180deg=-4!) USER MOD Single : A 114 GLN : amide:sc= 0.0339 X(o=0.034,f=0.21) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -146:sc= 1.33 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -120:sc= -0.858 (180deg=-3.62!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 172:sc= -0.0261 (180deg=-0.389) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 150 MET CE :methyl -163:sc= -0.706 (180deg=-1.81) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.277 USER MOD Single : A 154 GLN : amide:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A 155 ASN : amide:sc= -1.24 K(o=-1.2,f=-0.64!) USER MOD ----------------------------------------------------------------- ATOM 21 N PHE A 2 0.404 2.761 -20.052 1.00 0.00 N ATOM 22 CA PHE A 2 -0.160 2.024 -18.927 1.00 0.00 C ATOM 23 C PHE A 2 -1.678 1.918 -19.051 1.00 0.00 C ATOM 24 O PHE A 2 -2.304 2.676 -19.791 1.00 0.00 O ATOM 25 CB PHE A 2 0.212 2.704 -17.606 1.00 0.00 C ATOM 26 CG PHE A 2 1.176 1.909 -16.773 1.00 0.00 C ATOM 27 CD1 PHE A 2 2.290 1.320 -17.350 1.00 0.00 C ATOM 28 CD2 PHE A 2 0.966 1.749 -15.412 1.00 0.00 C ATOM 29 CE1 PHE A 2 3.178 0.587 -16.585 1.00 0.00 C ATOM 30 CE2 PHE A 2 1.852 1.018 -14.642 1.00 0.00 C ATOM 31 CZ PHE A 2 2.958 0.436 -15.229 1.00 0.00 C ATOM 0 HA PHE A 2 0.257 1.017 -18.938 1.00 0.00 H new ATOM 0 HB2 PHE A 2 0.648 3.680 -17.819 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -0.696 2.879 -17.029 1.00 0.00 H new ATOM 0 HD1 PHE A 2 2.466 1.435 -18.409 1.00 0.00 H new ATOM 0 HD2 PHE A 2 0.101 2.200 -14.948 1.00 0.00 H new ATOM 0 HE1 PHE A 2 4.042 0.133 -17.046 1.00 0.00 H new ATOM 0 HE2 PHE A 2 1.679 0.902 -13.582 1.00 0.00 H new ATOM 0 HZ PHE A 2 3.650 -0.136 -14.629 1.00 0.00 H new ATOM 41 N GLY A 3 -2.260 0.971 -18.323 1.00 0.00 N ATOM 42 CA GLY A 3 -3.698 0.782 -18.365 1.00 0.00 C ATOM 43 C GLY A 3 -4.259 0.307 -17.039 1.00 0.00 C ATOM 44 O GLY A 3 -3.595 -0.421 -16.301 1.00 0.00 O ATOM 0 H GLY A 3 -1.762 0.331 -17.705 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -4.177 1.721 -18.643 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -3.944 0.057 -19.141 1.00 0.00 H new ATOM 48 N LYS A 4 -5.485 0.721 -16.735 1.00 0.00 N ATOM 49 CA LYS A 4 -6.135 0.333 -15.489 1.00 0.00 C ATOM 50 C LYS A 4 -6.888 -0.983 -15.655 1.00 0.00 C ATOM 51 O LYS A 4 -7.841 -1.072 -16.428 1.00 0.00 O ATOM 52 CB LYS A 4 -7.097 1.430 -15.029 1.00 0.00 C ATOM 53 CG LYS A 4 -7.603 1.236 -13.608 1.00 0.00 C ATOM 54 CD LYS A 4 -9.090 1.541 -13.498 1.00 0.00 C ATOM 55 CE LYS A 4 -9.929 0.476 -14.187 1.00 0.00 C ATOM 56 NZ LYS A 4 -11.229 0.260 -13.494 1.00 0.00 N ATOM 0 H LYS A 4 -6.048 1.325 -17.334 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.363 0.196 -14.732 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.595 2.395 -15.099 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.949 1.464 -15.708 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.417 0.210 -13.291 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.047 1.884 -12.931 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.373 1.605 -12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.297 2.514 -13.944 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.113 0.771 -15.220 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.373 -0.461 -14.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.771 -0.473 -13.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.054 -0.046 -12.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.771 1.148 -13.488 1.00 0.00 H new ATOM 70 N LEU A 5 -6.453 -2.004 -14.924 1.00 0.00 N ATOM 71 CA LEU A 5 -7.086 -3.316 -14.990 1.00 0.00 C ATOM 72 C LEU A 5 -8.419 -3.311 -14.251 1.00 0.00 C ATOM 73 O LEU A 5 -9.464 -3.602 -14.833 1.00 0.00 O ATOM 74 CB LEU A 5 -6.164 -4.382 -14.394 1.00 0.00 C ATOM 75 CG LEU A 5 -6.213 -5.743 -15.088 1.00 0.00 C ATOM 76 CD1 LEU A 5 -5.000 -6.579 -14.709 1.00 0.00 C ATOM 77 CD2 LEU A 5 -7.499 -6.475 -14.735 1.00 0.00 C ATOM 0 H LEU A 5 -5.665 -1.948 -14.279 1.00 0.00 H new ATOM 0 HA LEU A 5 -7.271 -3.551 -16.038 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -5.139 -4.012 -14.425 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -6.422 -4.518 -13.344 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.195 -5.581 -16.166 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.052 -7.544 -15.212 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.091 -6.060 -15.013 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -4.987 -6.733 -13.630 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.517 -7.442 -15.238 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -7.548 -6.626 -13.657 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.355 -5.882 -15.057 1.00 0.00 H new ATOM 89 N GLU A 6 -8.376 -2.980 -12.965 1.00 0.00 N ATOM 90 CA GLU A 6 -9.582 -2.938 -12.146 1.00 0.00 C ATOM 91 C GLU A 6 -9.265 -2.471 -10.730 1.00 0.00 C ATOM 92 O GLU A 6 -8.202 -2.774 -10.188 1.00 0.00 O ATOM 93 CB GLU A 6 -10.243 -4.317 -12.103 1.00 0.00 C ATOM 94 CG GLU A 6 -9.262 -5.453 -11.862 1.00 0.00 C ATOM 95 CD GLU A 6 -9.953 -6.790 -11.676 1.00 0.00 C ATOM 96 OE1 GLU A 6 -10.875 -6.871 -10.838 1.00 0.00 O ATOM 97 OE2 GLU A 6 -9.573 -7.756 -12.370 1.00 0.00 O ATOM 0 H GLU A 6 -7.519 -2.737 -12.467 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.271 -2.225 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -10.997 -4.325 -11.316 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -10.764 -4.491 -13.045 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -8.573 -5.518 -12.704 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.664 -5.231 -10.978 1.00 0.00 H new ATOM 104 N SER A 7 -10.194 -1.730 -10.135 1.00 0.00 N ATOM 105 CA SER A 7 -10.015 -1.219 -8.780 1.00 0.00 C ATOM 106 C SER A 7 -10.906 -1.970 -7.796 1.00 0.00 C ATOM 107 O SER A 7 -12.088 -2.193 -8.059 1.00 0.00 O ATOM 108 CB SER A 7 -10.328 0.276 -8.732 1.00 0.00 C ATOM 109 OG SER A 7 -10.520 0.716 -7.398 1.00 0.00 O ATOM 0 H SER A 7 -11.079 -1.470 -10.570 1.00 0.00 H new ATOM 0 HA SER A 7 -8.975 -1.374 -8.493 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.512 0.836 -9.189 1.00 0.00 H new ATOM 0 HB3 SER A 7 -11.223 0.482 -9.318 1.00 0.00 H new ATOM 0 HG SER A 7 -10.717 1.676 -7.395 1.00 0.00 H new ATOM 115 N LYS A 8 -10.333 -2.358 -6.662 1.00 0.00 N ATOM 116 CA LYS A 8 -11.076 -3.084 -5.639 1.00 0.00 C ATOM 117 C LYS A 8 -10.544 -2.762 -4.247 1.00 0.00 C ATOM 118 O LYS A 8 -9.462 -2.195 -4.099 1.00 0.00 O ATOM 119 CB LYS A 8 -10.997 -4.590 -5.895 1.00 0.00 C ATOM 120 CG LYS A 8 -9.593 -5.158 -5.768 1.00 0.00 C ATOM 121 CD LYS A 8 -9.619 -6.658 -5.521 1.00 0.00 C ATOM 122 CE LYS A 8 -8.556 -7.076 -4.518 1.00 0.00 C ATOM 123 NZ LYS A 8 -8.282 -8.538 -4.577 1.00 0.00 N ATOM 0 H LYS A 8 -9.356 -2.182 -6.428 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.118 -2.769 -5.689 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.652 -5.104 -5.192 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.375 -4.800 -6.895 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -9.031 -4.948 -6.678 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -9.072 -4.662 -4.949 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.603 -6.950 -5.153 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.461 -7.185 -6.462 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.636 -6.526 -4.714 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.880 -6.808 -3.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -7.552 -8.783 -3.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.154 -9.063 -4.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.948 -8.791 -5.529 1.00 0.00 H new ATOM 137 N LEU A 9 -11.313 -3.131 -3.227 1.00 0.00 N ATOM 138 CA LEU A 9 -10.920 -2.882 -1.844 1.00 0.00 C ATOM 139 C LEU A 9 -10.079 -4.032 -1.301 1.00 0.00 C ATOM 140 O LEU A 9 -10.350 -5.200 -1.580 1.00 0.00 O ATOM 141 CB LEU A 9 -12.158 -2.684 -0.967 1.00 0.00 C ATOM 142 CG LEU A 9 -12.894 -1.360 -1.175 1.00 0.00 C ATOM 143 CD1 LEU A 9 -14.309 -1.446 -0.622 1.00 0.00 C ATOM 144 CD2 LEU A 9 -12.131 -0.218 -0.521 1.00 0.00 C ATOM 0 H LEU A 9 -12.211 -3.603 -3.332 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.318 -1.973 -1.823 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.853 -3.502 -1.156 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -11.859 -2.755 0.079 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.955 -1.162 -2.245 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -14.819 -0.495 -0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -14.853 -2.238 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -14.270 -1.666 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -12.669 0.717 -0.679 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -12.039 -0.407 0.548 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -11.138 -0.144 -0.963 1.00 0.00 H new ATOM 156 N SER A 10 -9.059 -3.693 -0.521 1.00 0.00 N ATOM 157 CA SER A 10 -8.178 -4.696 0.065 1.00 0.00 C ATOM 158 C SER A 10 -7.823 -4.328 1.504 1.00 0.00 C ATOM 159 O SER A 10 -7.638 -3.155 1.826 1.00 0.00 O ATOM 160 CB SER A 10 -6.903 -4.839 -0.771 1.00 0.00 C ATOM 161 OG SER A 10 -5.876 -3.986 -0.295 1.00 0.00 O ATOM 0 H SER A 10 -8.822 -2.731 -0.280 1.00 0.00 H new ATOM 0 HA SER A 10 -8.704 -5.650 0.071 1.00 0.00 H new ATOM 0 HB2 SER A 10 -6.561 -5.874 -0.743 1.00 0.00 H new ATOM 0 HB3 SER A 10 -7.120 -4.603 -1.813 1.00 0.00 H new ATOM 0 HG SER A 10 -5.025 -4.232 -0.715 1.00 0.00 H new ATOM 167 N VAL A 11 -7.731 -5.337 2.364 1.00 0.00 N ATOM 168 CA VAL A 11 -7.400 -5.112 3.764 1.00 0.00 C ATOM 169 C VAL A 11 -5.890 -5.152 3.986 1.00 0.00 C ATOM 170 O VAL A 11 -5.279 -6.220 4.006 1.00 0.00 O ATOM 171 CB VAL A 11 -8.085 -6.147 4.679 1.00 0.00 C ATOM 172 CG1 VAL A 11 -7.648 -5.971 6.127 1.00 0.00 C ATOM 173 CG2 VAL A 11 -9.598 -6.036 4.558 1.00 0.00 C ATOM 0 H VAL A 11 -7.881 -6.315 2.116 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.770 -4.120 4.023 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.780 -7.143 4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -8.146 -6.714 6.750 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -6.568 -6.102 6.200 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.916 -4.971 6.469 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.070 -6.772 5.209 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.914 -5.035 4.853 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.895 -6.221 3.526 1.00 0.00 H new ATOM 183 N ILE A 12 -5.300 -3.973 4.152 1.00 0.00 N ATOM 184 CA ILE A 12 -3.870 -3.844 4.377 1.00 0.00 C ATOM 185 C ILE A 12 -3.544 -3.924 5.866 1.00 0.00 C ATOM 186 O ILE A 12 -3.824 -2.994 6.625 1.00 0.00 O ATOM 187 CB ILE A 12 -3.344 -2.508 3.807 1.00 0.00 C ATOM 188 CG1 ILE A 12 -3.542 -2.467 2.291 1.00 0.00 C ATOM 189 CG2 ILE A 12 -1.875 -2.310 4.158 1.00 0.00 C ATOM 190 CD1 ILE A 12 -3.606 -1.064 1.728 1.00 0.00 C ATOM 0 H ILE A 12 -5.800 -3.084 4.134 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.379 -4.670 3.862 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.912 -1.694 4.257 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.725 -3.005 1.811 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.462 -2.994 2.038 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.527 -1.363 3.746 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.758 -2.299 5.242 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.287 -3.126 3.738 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.748 -1.111 0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -4.441 -0.528 2.180 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.676 -0.540 1.949 1.00 0.00 H new ATOM 202 N ARG A 13 -2.952 -5.041 6.276 1.00 0.00 N ATOM 203 CA ARG A 13 -2.589 -5.245 7.674 1.00 0.00 C ATOM 204 C ARG A 13 -1.077 -5.365 7.832 1.00 0.00 C ATOM 205 O ARG A 13 -0.347 -5.486 6.847 1.00 0.00 O ATOM 206 CB ARG A 13 -3.271 -6.501 8.222 1.00 0.00 C ATOM 207 CG ARG A 13 -4.637 -6.236 8.831 1.00 0.00 C ATOM 208 CD ARG A 13 -5.188 -7.470 9.527 1.00 0.00 C ATOM 209 NE ARG A 13 -5.649 -8.479 8.574 1.00 0.00 N ATOM 210 CZ ARG A 13 -4.867 -9.421 8.049 1.00 0.00 C ATOM 211 NH1 ARG A 13 -3.583 -9.496 8.384 1.00 0.00 N ATOM 212 NH2 ARG A 13 -5.371 -10.295 7.189 1.00 0.00 N ATOM 0 H ARG A 13 -2.713 -5.819 5.660 1.00 0.00 H new ATOM 0 HA ARG A 13 -2.928 -4.378 8.241 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.377 -7.228 7.416 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.628 -6.953 8.977 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.565 -5.416 9.546 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.329 -5.918 8.051 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.416 -7.901 10.165 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -6.014 -7.181 10.176 1.00 0.00 H new ATOM 0 HE ARG A 13 -6.630 -8.460 8.294 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.189 -8.829 9.048 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -2.991 -10.220 7.977 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -6.356 -10.246 6.930 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -4.773 -11.017 6.786 1.00 0.00 H new ATOM 226 N ASN A 14 -0.613 -5.330 9.077 1.00 0.00 N ATOM 227 CA ASN A 14 0.812 -5.435 9.365 1.00 0.00 C ATOM 228 C ASN A 14 1.134 -6.766 10.040 1.00 0.00 C ATOM 229 O ASN A 14 0.325 -7.693 10.021 1.00 0.00 O ATOM 230 CB ASN A 14 1.260 -4.272 10.253 1.00 0.00 C ATOM 231 CG ASN A 14 2.623 -3.735 9.859 1.00 0.00 C ATOM 232 OD1 ASN A 14 3.574 -3.790 10.639 1.00 0.00 O ATOM 233 ND2 ASN A 14 2.724 -3.215 8.641 1.00 0.00 N ATOM 0 H ASN A 14 -1.204 -5.230 9.902 1.00 0.00 H new ATOM 0 HA ASN A 14 1.355 -5.389 8.421 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.525 -3.469 10.194 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.289 -4.602 11.292 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.616 -2.841 8.319 1.00 0.00 H new ATOM 0 HD22 ASN A 14 1.909 -3.190 8.028 1.00 0.00 H new ATOM 240 N LEU A 15 2.321 -6.854 10.633 1.00 0.00 N ATOM 241 CA LEU A 15 2.751 -8.073 11.309 1.00 0.00 C ATOM 242 C LEU A 15 2.023 -8.245 12.640 1.00 0.00 C ATOM 243 O LEU A 15 1.821 -9.367 13.105 1.00 0.00 O ATOM 244 CB LEU A 15 4.263 -8.045 11.541 1.00 0.00 C ATOM 245 CG LEU A 15 5.117 -8.173 10.277 1.00 0.00 C ATOM 246 CD1 LEU A 15 4.903 -9.528 9.620 1.00 0.00 C ATOM 247 CD2 LEU A 15 4.800 -7.049 9.302 1.00 0.00 C ATOM 0 H LEU A 15 3.002 -6.095 10.659 1.00 0.00 H new ATOM 0 HA LEU A 15 2.503 -8.920 10.669 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.521 -7.112 12.042 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.525 -8.855 12.222 1.00 0.00 H new ATOM 0 HG LEU A 15 6.166 -8.094 10.563 1.00 0.00 H new ATOM 0 HD11 LEU A 15 5.519 -9.599 8.723 1.00 0.00 H new ATOM 0 HD12 LEU A 15 5.183 -10.318 10.316 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.853 -9.639 9.349 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.417 -7.157 8.410 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.747 -7.095 9.023 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.009 -6.089 9.774 1.00 0.00 H new ATOM 259 N ASN A 16 1.632 -7.129 13.247 1.00 0.00 N ATOM 260 CA ASN A 16 0.926 -7.161 14.523 1.00 0.00 C ATOM 261 C ASN A 16 -0.588 -7.237 14.322 1.00 0.00 C ATOM 262 O ASN A 16 -1.356 -7.061 15.267 1.00 0.00 O ATOM 263 CB ASN A 16 1.281 -5.925 15.355 1.00 0.00 C ATOM 264 CG ASN A 16 2.263 -6.238 16.467 1.00 0.00 C ATOM 265 OD1 ASN A 16 3.468 -6.037 16.321 1.00 0.00 O ATOM 266 ND2 ASN A 16 1.749 -6.735 17.587 1.00 0.00 N ATOM 0 H ASN A 16 1.792 -6.192 12.876 1.00 0.00 H new ATOM 0 HA ASN A 16 1.242 -8.058 15.056 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.706 -5.162 14.703 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.371 -5.506 15.785 1.00 0.00 H new ATOM 0 HD21 ASN A 16 2.360 -6.966 18.370 1.00 0.00 H new ATOM 0 HD22 ASN A 16 0.743 -6.885 17.664 1.00 0.00 H new ATOM 273 N ASP A 17 -1.013 -7.500 13.086 1.00 0.00 N ATOM 274 CA ASP A 17 -2.435 -7.597 12.770 1.00 0.00 C ATOM 275 C ASP A 17 -3.112 -6.236 12.888 1.00 0.00 C ATOM 276 O ASP A 17 -4.239 -6.131 13.372 1.00 0.00 O ATOM 277 CB ASP A 17 -3.121 -8.605 13.696 1.00 0.00 C ATOM 278 CG ASP A 17 -4.404 -9.153 13.103 1.00 0.00 C ATOM 279 OD1 ASP A 17 -4.341 -9.763 12.015 1.00 0.00 O ATOM 280 OD2 ASP A 17 -5.471 -8.974 13.727 1.00 0.00 O ATOM 0 H ASP A 17 -0.393 -7.649 12.290 1.00 0.00 H new ATOM 0 HA ASP A 17 -2.529 -7.942 11.740 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -2.438 -9.429 13.902 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -3.340 -8.127 14.651 1.00 0.00 H new ATOM 285 N GLN A 18 -2.416 -5.195 12.439 1.00 0.00 N ATOM 286 CA GLN A 18 -2.949 -3.838 12.492 1.00 0.00 C ATOM 287 C GLN A 18 -3.275 -3.330 11.092 1.00 0.00 C ATOM 288 O GLN A 18 -2.447 -3.410 10.184 1.00 0.00 O ATOM 289 CB GLN A 18 -1.949 -2.901 13.170 1.00 0.00 C ATOM 290 CG GLN A 18 -0.562 -2.938 12.550 1.00 0.00 C ATOM 291 CD GLN A 18 0.429 -2.054 13.282 1.00 0.00 C ATOM 292 OE1 GLN A 18 0.045 -1.191 14.071 1.00 0.00 O ATOM 293 NE2 GLN A 18 1.714 -2.266 13.023 1.00 0.00 N ATOM 0 H GLN A 18 -1.482 -5.266 12.035 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.869 -3.856 13.076 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.331 -1.881 13.124 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -1.873 -3.166 14.225 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -0.196 -3.965 12.550 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -0.625 -2.622 11.509 1.00 0.00 H new ATOM 0 HE21 GLN A 18 1.988 -2.993 12.362 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.427 -1.702 13.486 1.00 0.00 H new ATOM 302 N VAL A 19 -4.484 -2.806 10.923 1.00 0.00 N ATOM 303 CA VAL A 19 -4.918 -2.286 9.632 1.00 0.00 C ATOM 304 C VAL A 19 -4.403 -0.868 9.406 1.00 0.00 C ATOM 305 O VAL A 19 -4.262 -0.090 10.349 1.00 0.00 O ATOM 306 CB VAL A 19 -6.453 -2.285 9.512 1.00 0.00 C ATOM 307 CG1 VAL A 19 -6.877 -1.935 8.094 1.00 0.00 C ATOM 308 CG2 VAL A 19 -7.023 -3.631 9.931 1.00 0.00 C ATOM 0 H VAL A 19 -5.181 -2.730 11.664 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.501 -2.947 8.872 1.00 0.00 H new ATOM 0 HB VAL A 19 -6.851 -1.524 10.184 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -7.965 -1.939 8.028 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -6.502 -0.945 7.836 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -6.469 -2.670 7.400 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.109 -3.611 9.839 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -6.619 -4.413 9.288 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.750 -3.835 10.966 1.00 0.00 H new ATOM 318 N LEU A 20 -4.128 -0.540 8.148 1.00 0.00 N ATOM 319 CA LEU A 20 -3.631 0.785 7.795 1.00 0.00 C ATOM 320 C LEU A 20 -4.755 1.815 7.831 1.00 0.00 C ATOM 321 O LEU A 20 -5.921 1.484 7.617 1.00 0.00 O ATOM 322 CB LEU A 20 -2.994 0.760 6.404 1.00 0.00 C ATOM 323 CG LEU A 20 -2.029 1.910 6.113 1.00 0.00 C ATOM 324 CD1 LEU A 20 -0.772 1.779 6.958 1.00 0.00 C ATOM 325 CD2 LEU A 20 -1.678 1.946 4.633 1.00 0.00 C ATOM 0 H LEU A 20 -4.241 -1.173 7.356 1.00 0.00 H new ATOM 0 HA LEU A 20 -2.877 1.069 8.529 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -2.459 -0.182 6.283 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.788 0.774 5.657 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.520 2.848 6.374 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.097 2.606 6.737 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -1.040 1.801 8.014 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.276 0.836 6.729 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.990 2.770 4.442 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.206 1.006 4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.586 2.088 4.047 1.00 0.00 H new ATOM 337 N PHE A 21 -4.398 3.067 8.102 1.00 0.00 N ATOM 338 CA PHE A 21 -5.378 4.146 8.163 1.00 0.00 C ATOM 339 C PHE A 21 -4.716 5.499 7.917 1.00 0.00 C ATOM 340 O PHE A 21 -3.496 5.630 8.009 1.00 0.00 O ATOM 341 CB PHE A 21 -6.079 4.148 9.522 1.00 0.00 C ATOM 342 CG PHE A 21 -7.399 4.865 9.515 1.00 0.00 C ATOM 343 CD1 PHE A 21 -8.494 4.321 8.863 1.00 0.00 C ATOM 344 CD2 PHE A 21 -7.544 6.083 10.160 1.00 0.00 C ATOM 345 CE1 PHE A 21 -9.709 4.979 8.854 1.00 0.00 C ATOM 346 CE2 PHE A 21 -8.757 6.745 10.154 1.00 0.00 C ATOM 347 CZ PHE A 21 -9.841 6.192 9.500 1.00 0.00 C ATOM 0 H PHE A 21 -3.438 3.359 8.283 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.117 3.977 7.380 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -6.236 3.118 9.842 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.425 4.615 10.258 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -8.397 3.372 8.356 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.700 6.520 10.673 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -10.555 4.545 8.342 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -8.857 7.694 10.660 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.790 6.708 9.494 1.00 0.00 H new ATOM 357 N ILE A 22 -5.530 6.503 7.605 1.00 0.00 N ATOM 358 CA ILE A 22 -5.029 7.845 7.350 1.00 0.00 C ATOM 359 C ILE A 22 -5.145 8.713 8.600 1.00 0.00 C ATOM 360 O ILE A 22 -5.998 8.477 9.456 1.00 0.00 O ATOM 361 CB ILE A 22 -5.794 8.506 6.180 1.00 0.00 C ATOM 362 CG1 ILE A 22 -5.284 7.967 4.843 1.00 0.00 C ATOM 363 CG2 ILE A 22 -5.664 10.021 6.226 1.00 0.00 C ATOM 364 CD1 ILE A 22 -3.840 8.323 4.559 1.00 0.00 C ATOM 0 H ILE A 22 -6.542 6.410 7.523 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.977 7.760 7.077 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.850 8.256 6.281 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.391 6.882 4.833 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.910 8.357 4.041 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.212 10.459 5.391 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.075 10.393 7.165 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -4.612 10.298 6.155 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.546 7.908 3.595 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -3.730 9.407 4.536 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.203 7.910 5.341 1.00 0.00 H new ATOM 376 N ASP A 23 -4.283 9.720 8.697 1.00 0.00 N ATOM 377 CA ASP A 23 -4.290 10.626 9.840 1.00 0.00 C ATOM 378 C ASP A 23 -4.612 12.051 9.401 1.00 0.00 C ATOM 379 O ASP A 23 -4.811 12.315 8.215 1.00 0.00 O ATOM 380 CB ASP A 23 -2.937 10.591 10.553 1.00 0.00 C ATOM 381 CG ASP A 23 -3.076 10.646 12.062 1.00 0.00 C ATOM 382 OD1 ASP A 23 -3.653 9.701 12.639 1.00 0.00 O ATOM 383 OD2 ASP A 23 -2.609 11.634 12.666 1.00 0.00 O ATOM 0 H ASP A 23 -3.571 9.929 7.998 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.065 10.295 10.532 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.405 9.682 10.273 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.330 11.431 10.216 1.00 0.00 H new ATOM 388 N GLN A 24 -4.661 12.965 10.363 1.00 0.00 N ATOM 389 CA GLN A 24 -4.957 14.363 10.074 1.00 0.00 C ATOM 390 C GLN A 24 -3.907 14.970 9.146 1.00 0.00 C ATOM 391 O GLN A 24 -4.147 15.997 8.511 1.00 0.00 O ATOM 392 CB GLN A 24 -5.035 15.168 11.372 1.00 0.00 C ATOM 393 CG GLN A 24 -6.385 15.076 12.065 1.00 0.00 C ATOM 394 CD GLN A 24 -7.086 16.417 12.165 1.00 0.00 C ATOM 395 OE1 GLN A 24 -6.734 17.368 11.467 1.00 0.00 O ATOM 396 NE2 GLN A 24 -8.084 16.499 13.038 1.00 0.00 N ATOM 0 H GLN A 24 -4.500 12.763 11.350 1.00 0.00 H new ATOM 0 HA GLN A 24 -5.922 14.403 9.569 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -4.261 14.817 12.054 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -4.818 16.214 11.155 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -7.021 14.378 11.520 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.247 14.667 13.066 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.342 15.685 13.596 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.593 17.376 13.150 1.00 0.00 H new ATOM 405 N GLY A 25 -2.745 14.329 9.071 1.00 0.00 N ATOM 406 CA GLY A 25 -1.681 14.823 8.217 1.00 0.00 C ATOM 407 C GLY A 25 -1.527 14.016 6.940 1.00 0.00 C ATOM 408 O GLY A 25 -0.504 14.106 6.263 1.00 0.00 O ATOM 0 H GLY A 25 -2.522 13.477 9.586 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.880 15.864 7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.741 14.805 8.768 1.00 0.00 H new ATOM 412 N ASN A 26 -2.545 13.225 6.610 1.00 0.00 N ATOM 413 CA ASN A 26 -2.514 12.403 5.405 1.00 0.00 C ATOM 414 C ASN A 26 -1.315 11.458 5.418 1.00 0.00 C ATOM 415 O ASN A 26 -0.618 11.308 4.415 1.00 0.00 O ATOM 416 CB ASN A 26 -2.468 13.289 4.159 1.00 0.00 C ATOM 417 CG ASN A 26 -3.835 13.820 3.776 1.00 0.00 C ATOM 418 OD1 ASN A 26 -4.750 13.865 4.599 1.00 0.00 O ATOM 419 ND2 ASN A 26 -3.982 14.224 2.520 1.00 0.00 N ATOM 0 H ASN A 26 -3.400 13.136 7.160 1.00 0.00 H new ATOM 0 HA ASN A 26 -3.424 11.803 5.382 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -1.793 14.126 4.337 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -2.056 12.719 3.326 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -4.880 14.590 2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.197 14.169 1.871 1.00 0.00 H new ATOM 426 N ARG A 27 -1.080 10.823 6.563 1.00 0.00 N ATOM 427 CA ARG A 27 0.034 9.892 6.705 1.00 0.00 C ATOM 428 C ARG A 27 -0.471 8.468 6.927 1.00 0.00 C ATOM 429 O ARG A 27 -1.458 8.255 7.630 1.00 0.00 O ATOM 430 CB ARG A 27 0.933 10.315 7.868 1.00 0.00 C ATOM 431 CG ARG A 27 1.696 11.605 7.610 1.00 0.00 C ATOM 432 CD ARG A 27 1.933 12.382 8.896 1.00 0.00 C ATOM 433 NE ARG A 27 3.355 12.588 9.157 1.00 0.00 N ATOM 434 CZ ARG A 27 4.106 13.475 8.508 1.00 0.00 C ATOM 435 NH1 ARG A 27 3.575 14.240 7.562 1.00 0.00 N ATOM 436 NH2 ARG A 27 5.392 13.599 8.806 1.00 0.00 N ATOM 0 H ARG A 27 -1.645 10.936 7.404 1.00 0.00 H new ATOM 0 HA ARG A 27 0.613 9.912 5.782 1.00 0.00 H new ATOM 0 HB2 ARG A 27 0.322 10.437 8.763 1.00 0.00 H new ATOM 0 HB3 ARG A 27 1.646 9.516 8.075 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.653 11.375 7.142 1.00 0.00 H new ATOM 0 HG3 ARG A 27 1.138 12.224 6.908 1.00 0.00 H new ATOM 0 HD2 ARG A 27 1.432 13.348 8.833 1.00 0.00 H new ATOM 0 HD3 ARG A 27 1.485 11.845 9.732 1.00 0.00 H new ATOM 0 HE ARG A 27 3.798 12.019 9.878 1.00 0.00 H new ATOM 0 HH11 ARG A 27 2.586 14.150 7.329 1.00 0.00 H new ATOM 0 HH12 ARG A 27 4.156 14.918 7.068 1.00 0.00 H new ATOM 0 HH21 ARG A 27 5.806 13.015 9.532 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.968 14.279 8.309 1.00 0.00 H new ATOM 450 N PRO A 28 0.203 7.468 6.329 1.00 0.00 N ATOM 451 CA PRO A 28 -0.186 6.062 6.467 1.00 0.00 C ATOM 452 C PRO A 28 0.190 5.488 7.829 1.00 0.00 C ATOM 453 O PRO A 28 1.331 5.082 8.049 1.00 0.00 O ATOM 454 CB PRO A 28 0.606 5.372 5.359 1.00 0.00 C ATOM 455 CG PRO A 28 1.822 6.214 5.186 1.00 0.00 C ATOM 456 CD PRO A 28 1.394 7.629 5.471 1.00 0.00 C ATOM 0 HA PRO A 28 -1.265 5.925 6.390 1.00 0.00 H new ATOM 0 HB2 PRO A 28 0.867 4.351 5.636 1.00 0.00 H new ATOM 0 HB3 PRO A 28 0.029 5.315 4.436 1.00 0.00 H new ATOM 0 HG2 PRO A 28 2.613 5.901 5.868 1.00 0.00 H new ATOM 0 HG3 PRO A 28 2.218 6.123 4.175 1.00 0.00 H new ATOM 0 HD2 PRO A 28 2.179 8.191 5.977 1.00 0.00 H new ATOM 0 HD3 PRO A 28 1.157 8.168 4.554 1.00 0.00 H new ATOM 464 N LEU A 29 -0.777 5.457 8.741 1.00 0.00 N ATOM 465 CA LEU A 29 -0.547 4.931 10.083 1.00 0.00 C ATOM 466 C LEU A 29 -1.396 3.688 10.331 1.00 0.00 C ATOM 467 O LEU A 29 -2.584 3.662 10.011 1.00 0.00 O ATOM 468 CB LEU A 29 -0.866 5.995 11.137 1.00 0.00 C ATOM 469 CG LEU A 29 -0.607 7.441 10.709 1.00 0.00 C ATOM 470 CD1 LEU A 29 -0.942 8.400 11.840 1.00 0.00 C ATOM 471 CD2 LEU A 29 0.839 7.616 10.268 1.00 0.00 C ATOM 0 H LEU A 29 -1.727 5.790 8.576 1.00 0.00 H new ATOM 0 HA LEU A 29 0.505 4.657 10.161 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.915 5.900 11.419 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.276 5.787 12.029 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.254 7.671 9.862 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.752 9.424 11.517 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.993 8.294 12.108 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.322 8.171 12.707 1.00 0.00 H new ATOM 0 HD21 LEU A 29 1.005 8.650 9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.504 7.367 11.095 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.045 6.956 9.426 1.00 0.00 H new ATOM 483 N PHE A 30 -0.780 2.658 10.905 1.00 0.00 N ATOM 484 CA PHE A 30 -1.484 1.414 11.197 1.00 0.00 C ATOM 485 C PHE A 30 -2.219 1.504 12.530 1.00 0.00 C ATOM 486 O PHE A 30 -1.917 2.362 13.360 1.00 0.00 O ATOM 487 CB PHE A 30 -0.502 0.241 11.223 1.00 0.00 C ATOM 488 CG PHE A 30 0.117 -0.056 9.887 1.00 0.00 C ATOM 489 CD1 PHE A 30 1.297 0.559 9.503 1.00 0.00 C ATOM 490 CD2 PHE A 30 -0.482 -0.951 9.016 1.00 0.00 C ATOM 491 CE1 PHE A 30 1.870 0.287 8.274 1.00 0.00 C ATOM 492 CE2 PHE A 30 0.085 -1.227 7.786 1.00 0.00 C ATOM 493 CZ PHE A 30 1.262 -0.607 7.414 1.00 0.00 C ATOM 0 H PHE A 30 0.203 2.661 11.176 1.00 0.00 H new ATOM 0 HA PHE A 30 -2.218 1.248 10.408 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.290 0.457 11.941 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.021 -0.649 11.579 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.776 1.259 10.171 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.402 -1.439 9.301 1.00 0.00 H new ATOM 0 HE1 PHE A 30 2.791 0.773 7.987 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -0.392 -1.927 7.116 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.706 -0.821 6.453 1.00 0.00 H new ATOM 503 N GLU A 31 -3.185 0.613 12.728 1.00 0.00 N ATOM 504 CA GLU A 31 -3.964 0.593 13.961 1.00 0.00 C ATOM 505 C GLU A 31 -4.637 -0.762 14.158 1.00 0.00 C ATOM 506 O GLU A 31 -4.979 -1.443 13.191 1.00 0.00 O ATOM 507 CB GLU A 31 -5.019 1.700 13.942 1.00 0.00 C ATOM 508 CG GLU A 31 -4.544 3.003 14.566 1.00 0.00 C ATOM 509 CD GLU A 31 -5.341 3.384 15.798 1.00 0.00 C ATOM 510 OE1 GLU A 31 -6.537 3.713 15.654 1.00 0.00 O ATOM 511 OE2 GLU A 31 -4.768 3.355 16.908 1.00 0.00 O ATOM 0 H GLU A 31 -3.447 -0.104 12.051 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.282 0.765 14.794 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.318 1.888 12.911 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -5.906 1.354 14.473 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.491 2.911 14.833 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.617 3.803 13.829 1.00 0.00 H new ATOM 518 N ASP A 32 -4.823 -1.146 15.417 1.00 0.00 N ATOM 519 CA ASP A 32 -5.457 -2.419 15.743 1.00 0.00 C ATOM 520 C ASP A 32 -6.971 -2.266 15.825 1.00 0.00 C ATOM 521 O ASP A 32 -7.482 -1.458 16.601 1.00 0.00 O ATOM 522 CB ASP A 32 -4.913 -2.959 17.067 1.00 0.00 C ATOM 523 CG ASP A 32 -5.087 -1.974 18.208 1.00 0.00 C ATOM 524 OD1 ASP A 32 -4.502 -0.873 18.137 1.00 0.00 O ATOM 525 OD2 ASP A 32 -5.811 -2.305 19.171 1.00 0.00 O ATOM 0 H ASP A 32 -4.544 -0.594 16.228 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.225 -3.127 14.948 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -5.423 -3.890 17.313 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -3.855 -3.195 16.953 1.00 0.00 H new ATOM 719 N ILE A 46 -11.651 0.843 4.079 1.00 0.00 N ATOM 720 CA ILE A 46 -10.204 0.932 3.979 1.00 0.00 C ATOM 721 C ILE A 46 -9.788 1.678 2.705 1.00 0.00 C ATOM 722 O ILE A 46 -10.599 2.376 2.098 1.00 0.00 O ATOM 723 CB ILE A 46 -9.578 -0.484 4.022 1.00 0.00 C ATOM 724 CG1 ILE A 46 -8.259 -0.462 4.795 1.00 0.00 C ATOM 725 CG2 ILE A 46 -9.382 -1.065 2.622 1.00 0.00 C ATOM 726 CD1 ILE A 46 -7.583 -1.808 4.861 1.00 0.00 C ATOM 0 HA ILE A 46 -9.832 1.500 4.832 1.00 0.00 H new ATOM 0 HB ILE A 46 -10.277 -1.137 4.544 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.583 0.253 4.326 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -8.446 -0.107 5.809 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.941 -2.059 2.699 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.346 -1.134 2.119 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -8.719 -0.417 2.049 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -6.653 -1.721 5.423 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -8.241 -2.522 5.356 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -7.365 -2.156 3.851 1.00 0.00 H new ATOM 738 N PHE A 47 -8.527 1.529 2.304 1.00 0.00 N ATOM 739 CA PHE A 47 -8.024 2.190 1.107 1.00 0.00 C ATOM 740 C PHE A 47 -8.480 1.455 -0.149 1.00 0.00 C ATOM 741 O PHE A 47 -8.840 0.280 -0.096 1.00 0.00 O ATOM 742 CB PHE A 47 -6.496 2.256 1.137 1.00 0.00 C ATOM 743 CG PHE A 47 -5.946 3.038 2.294 1.00 0.00 C ATOM 744 CD1 PHE A 47 -5.828 2.457 3.547 1.00 0.00 C ATOM 745 CD2 PHE A 47 -5.542 4.353 2.130 1.00 0.00 C ATOM 746 CE1 PHE A 47 -5.319 3.172 4.612 1.00 0.00 C ATOM 747 CE2 PHE A 47 -5.032 5.074 3.192 1.00 0.00 C ATOM 748 CZ PHE A 47 -4.920 4.482 4.436 1.00 0.00 C ATOM 0 H PHE A 47 -7.838 0.957 2.791 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.426 3.203 1.087 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -6.099 1.242 1.174 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -6.143 2.703 0.208 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.138 1.433 3.692 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.627 4.820 1.160 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.233 2.707 5.583 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -4.721 6.099 3.051 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.521 5.043 5.268 1.00 0.00 H new ATOM 758 N ILE A 48 -8.459 2.157 -1.275 1.00 0.00 N ATOM 759 CA ILE A 48 -8.870 1.576 -2.545 1.00 0.00 C ATOM 760 C ILE A 48 -7.654 1.180 -3.377 1.00 0.00 C ATOM 761 O ILE A 48 -6.770 1.998 -3.632 1.00 0.00 O ATOM 762 CB ILE A 48 -9.750 2.558 -3.351 1.00 0.00 C ATOM 763 CG1 ILE A 48 -11.030 2.887 -2.575 1.00 0.00 C ATOM 764 CG2 ILE A 48 -10.094 1.976 -4.715 1.00 0.00 C ATOM 765 CD1 ILE A 48 -10.784 3.602 -1.263 1.00 0.00 C ATOM 0 H ILE A 48 -8.161 3.131 -1.334 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.456 0.685 -2.321 1.00 0.00 H new ATOM 0 HB ILE A 48 -9.186 3.479 -3.502 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -11.673 3.506 -3.200 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -11.572 1.962 -2.378 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.714 2.683 -5.266 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.176 1.787 -5.272 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -10.638 1.041 -4.585 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.737 3.800 -0.773 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.167 2.976 -0.618 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.271 4.545 -1.453 1.00 0.00 H new ATOM 777 N ILE A 49 -7.615 -0.081 -3.793 1.00 0.00 N ATOM 778 CA ILE A 49 -6.507 -0.590 -4.592 1.00 0.00 C ATOM 779 C ILE A 49 -6.856 -0.605 -6.077 1.00 0.00 C ATOM 780 O ILE A 49 -7.900 -1.125 -6.473 1.00 0.00 O ATOM 781 CB ILE A 49 -6.106 -2.015 -4.158 1.00 0.00 C ATOM 782 CG1 ILE A 49 -6.077 -2.122 -2.632 1.00 0.00 C ATOM 783 CG2 ILE A 49 -4.754 -2.387 -4.748 1.00 0.00 C ATOM 784 CD1 ILE A 49 -5.007 -1.272 -1.984 1.00 0.00 C ATOM 0 H ILE A 49 -8.339 -0.770 -3.590 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.667 0.084 -4.426 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.851 -2.716 -4.535 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.050 -1.829 -2.237 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.920 -3.164 -2.352 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.484 -3.395 -4.433 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.809 -2.349 -5.836 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.998 -1.683 -4.398 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.047 -1.399 -0.902 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -4.027 -1.579 -2.350 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.175 -0.224 -2.233 1.00 0.00 H new ATOM 796 N SER A 50 -5.976 -0.035 -6.893 1.00 0.00 N ATOM 797 CA SER A 50 -6.191 0.015 -8.334 1.00 0.00 C ATOM 798 C SER A 50 -5.196 -0.882 -9.062 1.00 0.00 C ATOM 799 O SER A 50 -4.011 -0.563 -9.156 1.00 0.00 O ATOM 800 CB SER A 50 -6.065 1.453 -8.842 1.00 0.00 C ATOM 801 OG SER A 50 -6.626 2.370 -7.918 1.00 0.00 O ATOM 0 H SER A 50 -5.107 0.399 -6.581 1.00 0.00 H new ATOM 0 HA SER A 50 -7.199 -0.347 -8.538 1.00 0.00 H new ATOM 0 HB2 SER A 50 -5.015 1.694 -9.006 1.00 0.00 H new ATOM 0 HB3 SER A 50 -6.568 1.548 -9.804 1.00 0.00 H new ATOM 0 HG SER A 50 -6.265 3.266 -8.086 1.00 0.00 H new ATOM 807 N MET A 51 -5.684 -2.007 -9.575 1.00 0.00 N ATOM 808 CA MET A 51 -4.835 -2.951 -10.293 1.00 0.00 C ATOM 809 C MET A 51 -4.616 -2.503 -11.734 1.00 0.00 C ATOM 810 O MET A 51 -5.573 -2.259 -12.471 1.00 0.00 O ATOM 811 CB MET A 51 -5.457 -4.350 -10.268 1.00 0.00 C ATOM 812 CG MET A 51 -4.880 -5.254 -9.191 1.00 0.00 C ATOM 813 SD MET A 51 -5.858 -6.748 -8.941 1.00 0.00 S ATOM 814 CE MET A 51 -7.249 -6.092 -8.024 1.00 0.00 C ATOM 0 H MET A 51 -6.662 -2.287 -9.507 1.00 0.00 H new ATOM 0 HA MET A 51 -3.867 -2.982 -9.793 1.00 0.00 H new ATOM 0 HB2 MET A 51 -6.532 -4.258 -10.115 1.00 0.00 H new ATOM 0 HB3 MET A 51 -5.313 -4.820 -11.241 1.00 0.00 H new ATOM 0 HG2 MET A 51 -3.862 -5.532 -9.463 1.00 0.00 H new ATOM 0 HG3 MET A 51 -4.820 -4.702 -8.253 1.00 0.00 H new ATOM 0 HE1 MET A 51 -7.206 -6.447 -6.994 1.00 0.00 H new ATOM 0 HE2 MET A 51 -7.210 -5.003 -8.034 1.00 0.00 H new ATOM 0 HE3 MET A 51 -8.179 -6.426 -8.485 1.00 0.00 H new ATOM 824 N TYR A 52 -3.352 -2.399 -12.130 1.00 0.00 N ATOM 825 CA TYR A 52 -3.004 -1.981 -13.483 1.00 0.00 C ATOM 826 C TYR A 52 -2.790 -3.191 -14.388 1.00 0.00 C ATOM 827 O TYR A 52 -2.314 -4.235 -13.943 1.00 0.00 O ATOM 828 CB TYR A 52 -1.743 -1.118 -13.464 1.00 0.00 C ATOM 829 CG TYR A 52 -2.008 0.335 -13.141 1.00 0.00 C ATOM 830 CD1 TYR A 52 -2.173 0.757 -11.828 1.00 0.00 C ATOM 831 CD2 TYR A 52 -2.093 1.287 -14.151 1.00 0.00 C ATOM 832 CE1 TYR A 52 -2.415 2.085 -11.529 1.00 0.00 C ATOM 833 CE2 TYR A 52 -2.334 2.615 -13.860 1.00 0.00 C ATOM 834 CZ TYR A 52 -2.495 3.009 -12.549 1.00 0.00 C ATOM 835 OH TYR A 52 -2.735 4.331 -12.254 1.00 0.00 O ATOM 0 H TYR A 52 -2.550 -2.599 -11.532 1.00 0.00 H new ATOM 0 HA TYR A 52 -3.833 -1.394 -13.879 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -1.047 -1.523 -12.730 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.254 -1.182 -14.436 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -2.111 0.035 -11.027 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -1.968 0.983 -15.180 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.541 2.397 -10.503 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.396 3.342 -14.656 1.00 0.00 H new ATOM 0 HH TYR A 52 -2.116 4.628 -11.555 1.00 0.00 H new ATOM 845 N LYS A 53 -3.145 -3.043 -15.660 1.00 0.00 N ATOM 846 CA LYS A 53 -2.990 -4.124 -16.628 1.00 0.00 C ATOM 847 C LYS A 53 -1.638 -4.035 -17.329 1.00 0.00 C ATOM 848 O LYS A 53 -1.412 -3.148 -18.152 1.00 0.00 O ATOM 849 CB LYS A 53 -4.121 -4.080 -17.659 1.00 0.00 C ATOM 850 CG LYS A 53 -4.008 -5.147 -18.736 1.00 0.00 C ATOM 851 CD LYS A 53 -3.867 -6.536 -18.133 1.00 0.00 C ATOM 852 CE LYS A 53 -4.247 -7.619 -19.130 1.00 0.00 C ATOM 853 NZ LYS A 53 -5.539 -8.272 -18.777 1.00 0.00 N ATOM 0 H LYS A 53 -3.542 -2.186 -16.045 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.037 -5.071 -16.091 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -5.075 -4.196 -17.144 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -4.131 -3.098 -18.132 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.890 -5.115 -19.375 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -3.147 -4.936 -19.370 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -2.839 -6.688 -17.804 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.500 -6.616 -17.249 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.320 -7.185 -20.127 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -3.459 -8.371 -19.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -5.762 -9.004 -19.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.462 -8.709 -17.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.297 -7.560 -18.767 1.00 0.00 H new ATOM 867 N ASP A 54 -0.744 -4.960 -16.998 1.00 0.00 N ATOM 868 CA ASP A 54 0.585 -4.987 -17.595 1.00 0.00 C ATOM 869 C ASP A 54 1.137 -6.408 -17.633 1.00 0.00 C ATOM 870 O ASP A 54 0.778 -7.246 -16.804 1.00 0.00 O ATOM 871 CB ASP A 54 1.535 -4.076 -16.815 1.00 0.00 C ATOM 872 CG ASP A 54 1.770 -2.750 -17.514 1.00 0.00 C ATOM 873 OD1 ASP A 54 0.945 -2.380 -18.375 1.00 0.00 O ATOM 874 OD2 ASP A 54 2.777 -2.083 -17.199 1.00 0.00 O ATOM 0 H ASP A 54 -0.916 -5.701 -16.319 1.00 0.00 H new ATOM 0 HA ASP A 54 0.504 -4.623 -18.619 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.124 -3.892 -15.822 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.489 -4.584 -16.676 1.00 0.00 H new ATOM 945 N GLY A 59 5.010 -9.390 -10.642 1.00 0.00 N ATOM 946 CA GLY A 59 4.822 -8.181 -9.863 1.00 0.00 C ATOM 947 C GLY A 59 3.475 -7.533 -10.118 1.00 0.00 C ATOM 948 O GLY A 59 3.214 -7.042 -11.216 1.00 0.00 O ATOM 0 HA2 GLY A 59 4.914 -8.417 -8.803 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.614 -7.472 -10.101 1.00 0.00 H new ATOM 952 N MET A 60 2.618 -7.535 -9.102 1.00 0.00 N ATOM 953 CA MET A 60 1.289 -6.944 -9.226 1.00 0.00 C ATOM 954 C MET A 60 1.352 -5.426 -9.091 1.00 0.00 C ATOM 955 O MET A 60 1.568 -4.898 -8.000 1.00 0.00 O ATOM 956 CB MET A 60 0.350 -7.523 -8.166 1.00 0.00 C ATOM 957 CG MET A 60 -1.117 -7.468 -8.560 1.00 0.00 C ATOM 958 SD MET A 60 -2.141 -8.583 -7.579 1.00 0.00 S ATOM 959 CE MET A 60 -2.190 -7.708 -6.017 1.00 0.00 C ATOM 0 H MET A 60 2.818 -7.938 -8.186 1.00 0.00 H new ATOM 0 HA MET A 60 0.903 -7.186 -10.216 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.628 -8.559 -7.973 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.488 -6.977 -7.233 1.00 0.00 H new ATOM 0 HG2 MET A 60 -1.483 -6.448 -8.443 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.216 -7.724 -9.615 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.865 -8.373 -5.217 1.00 0.00 H new ATOM 0 HE2 MET A 60 -1.527 -6.844 -6.063 1.00 0.00 H new ATOM 0 HE3 MET A 60 -3.208 -7.374 -5.819 1.00 0.00 H new ATOM 969 N ALA A 61 1.159 -4.731 -10.207 1.00 0.00 N ATOM 970 CA ALA A 61 1.190 -3.273 -10.214 1.00 0.00 C ATOM 971 C ALA A 61 -0.130 -2.697 -9.716 1.00 0.00 C ATOM 972 O ALA A 61 -1.117 -2.656 -10.451 1.00 0.00 O ATOM 973 CB ALA A 61 1.498 -2.760 -11.613 1.00 0.00 C ATOM 0 H ALA A 61 0.980 -5.154 -11.118 1.00 0.00 H new ATOM 0 HA ALA A 61 1.979 -2.945 -9.537 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.518 -1.670 -11.605 1.00 0.00 H new ATOM 0 HB2 ALA A 61 2.468 -3.139 -11.934 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.728 -3.103 -12.304 1.00 0.00 H new ATOM 979 N VAL A 62 -0.143 -2.256 -8.463 1.00 0.00 N ATOM 980 CA VAL A 62 -1.345 -1.685 -7.867 1.00 0.00 C ATOM 981 C VAL A 62 -1.056 -0.333 -7.224 1.00 0.00 C ATOM 982 O VAL A 62 0.100 0.069 -7.091 1.00 0.00 O ATOM 983 CB VAL A 62 -1.949 -2.626 -6.808 1.00 0.00 C ATOM 984 CG1 VAL A 62 -2.419 -3.922 -7.449 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.939 -2.904 -5.704 1.00 0.00 C ATOM 0 H VAL A 62 0.665 -2.283 -7.841 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.063 -1.551 -8.676 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.814 -2.135 -6.363 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -2.842 -4.573 -6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.178 -3.702 -8.200 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -1.574 -4.421 -7.923 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.383 -3.571 -4.964 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.053 -3.374 -6.131 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.657 -1.967 -5.225 1.00 0.00 H new ATOM 995 N THR A 63 -2.116 0.365 -6.826 1.00 0.00 N ATOM 996 CA THR A 63 -1.979 1.673 -6.196 1.00 0.00 C ATOM 997 C THR A 63 -3.015 1.855 -5.091 1.00 0.00 C ATOM 998 O THR A 63 -4.209 1.640 -5.304 1.00 0.00 O ATOM 999 CB THR A 63 -2.128 2.784 -7.237 1.00 0.00 C ATOM 1000 OG1 THR A 63 -3.410 2.740 -7.837 1.00 0.00 O ATOM 1001 CG2 THR A 63 -1.100 2.708 -8.345 1.00 0.00 C ATOM 0 H THR A 63 -3.079 0.046 -6.929 1.00 0.00 H new ATOM 0 HA THR A 63 -0.985 1.732 -5.753 1.00 0.00 H new ATOM 0 HB THR A 63 -1.980 3.715 -6.689 1.00 0.00 H new ATOM 0 HG1 THR A 63 -4.043 2.311 -7.224 1.00 0.00 H new ATOM 0 HG21 THR A 63 -1.262 3.524 -9.049 1.00 0.00 H new ATOM 0 HG22 THR A 63 -0.100 2.789 -7.920 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.196 1.755 -8.866 1.00 0.00 H new ATOM 1009 N ILE A 64 -2.551 2.254 -3.912 1.00 0.00 N ATOM 1010 CA ILE A 64 -3.438 2.468 -2.774 1.00 0.00 C ATOM 1011 C ILE A 64 -3.817 3.939 -2.648 1.00 0.00 C ATOM 1012 O ILE A 64 -2.949 4.807 -2.550 1.00 0.00 O ATOM 1013 CB ILE A 64 -2.788 2.003 -1.456 1.00 0.00 C ATOM 1014 CG1 ILE A 64 -2.139 0.630 -1.635 1.00 0.00 C ATOM 1015 CG2 ILE A 64 -3.824 1.964 -0.341 1.00 0.00 C ATOM 1016 CD1 ILE A 64 -0.645 0.694 -1.867 1.00 0.00 C ATOM 0 H ILE A 64 -1.566 2.436 -3.719 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.335 1.875 -2.955 1.00 0.00 H new ATOM 0 HB ILE A 64 -2.011 2.716 -1.181 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.336 0.026 -0.749 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.608 0.122 -2.478 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.351 1.634 0.584 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -4.243 2.960 -0.199 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -4.621 1.270 -0.609 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -0.252 -0.316 -1.985 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.441 1.271 -2.769 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.164 1.173 -1.014 1.00 0.00 H new ATOM 1028 N SER A 65 -5.116 4.214 -2.652 1.00 0.00 N ATOM 1029 CA SER A 65 -5.606 5.582 -2.539 1.00 0.00 C ATOM 1030 C SER A 65 -6.765 5.671 -1.551 1.00 0.00 C ATOM 1031 O SER A 65 -7.618 4.786 -1.497 1.00 0.00 O ATOM 1032 CB SER A 65 -6.049 6.099 -3.910 1.00 0.00 C ATOM 1033 OG SER A 65 -6.399 5.029 -4.770 1.00 0.00 O ATOM 0 H SER A 65 -5.848 3.508 -2.732 1.00 0.00 H new ATOM 0 HA SER A 65 -4.791 6.202 -2.167 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.901 6.768 -3.792 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.245 6.683 -4.359 1.00 0.00 H new ATOM 0 HG SER A 65 -7.089 5.327 -5.399 1.00 0.00 H new ATOM 1039 N VAL A 66 -6.789 6.749 -0.773 1.00 0.00 N ATOM 1040 CA VAL A 66 -7.843 6.958 0.211 1.00 0.00 C ATOM 1041 C VAL A 66 -8.930 7.875 -0.342 1.00 0.00 C ATOM 1042 O VAL A 66 -8.643 8.814 -1.086 1.00 0.00 O ATOM 1043 CB VAL A 66 -7.283 7.561 1.515 1.00 0.00 C ATOM 1044 CG1 VAL A 66 -6.653 8.921 1.252 1.00 0.00 C ATOM 1045 CG2 VAL A 66 -8.376 7.667 2.569 1.00 0.00 C ATOM 0 H VAL A 66 -6.090 7.491 -0.806 1.00 0.00 H new ATOM 0 HA VAL A 66 -8.274 5.981 0.432 1.00 0.00 H new ATOM 0 HB VAL A 66 -6.507 6.896 1.894 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.264 9.329 2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -5.838 8.812 0.536 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.405 9.598 0.846 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -7.961 8.095 3.482 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.177 8.308 2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.774 6.675 2.782 1.00 0.00 H new ATOM 1055 N LYS A 67 -10.177 7.594 0.019 1.00 0.00 N ATOM 1056 CA LYS A 67 -11.303 8.394 -0.447 1.00 0.00 C ATOM 1057 C LYS A 67 -12.286 8.680 0.684 1.00 0.00 C ATOM 1058 O LYS A 67 -12.552 7.822 1.526 1.00 0.00 O ATOM 1059 CB LYS A 67 -12.019 7.682 -1.594 1.00 0.00 C ATOM 1060 CG LYS A 67 -11.201 7.622 -2.872 1.00 0.00 C ATOM 1061 CD LYS A 67 -12.025 7.101 -4.037 1.00 0.00 C ATOM 1062 CE LYS A 67 -11.140 6.655 -5.190 1.00 0.00 C ATOM 1063 NZ LYS A 67 -11.897 5.861 -6.197 1.00 0.00 N ATOM 0 H LYS A 67 -10.433 6.820 0.632 1.00 0.00 H new ATOM 0 HA LYS A 67 -10.911 9.346 -0.804 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -12.268 6.667 -1.283 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -12.960 8.193 -1.798 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -10.822 8.616 -3.109 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.335 6.978 -2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -12.640 6.265 -3.704 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -12.706 7.880 -4.380 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.703 7.530 -5.672 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -10.314 6.058 -4.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.258 5.576 -6.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.293 5.013 -5.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.670 6.439 -6.585 1.00 0.00 H new ATOM 1077 N CYS A 68 -12.824 9.896 0.689 1.00 0.00 N ATOM 1078 CA CYS A 68 -13.783 10.319 1.706 1.00 0.00 C ATOM 1079 C CYS A 68 -14.067 11.814 1.574 1.00 0.00 C ATOM 1080 O CYS A 68 -15.057 12.215 0.962 1.00 0.00 O ATOM 1081 CB CYS A 68 -13.260 10.000 3.112 1.00 0.00 C ATOM 1082 SG CYS A 68 -14.103 8.617 3.916 1.00 0.00 S ATOM 0 H CYS A 68 -12.610 10.611 -0.006 1.00 0.00 H new ATOM 0 HA CYS A 68 -14.711 9.769 1.553 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -12.195 9.776 3.050 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -13.363 10.887 3.737 1.00 0.00 H new ATOM 0 HG CYS A 68 -13.855 7.520 3.265 1.00 0.00 H new ATOM 1088 N GLU A 69 -13.182 12.632 2.136 1.00 0.00 N ATOM 1089 CA GLU A 69 -13.326 14.080 2.063 1.00 0.00 C ATOM 1090 C GLU A 69 -12.506 14.628 0.898 1.00 0.00 C ATOM 1091 O GLU A 69 -12.831 15.668 0.326 1.00 0.00 O ATOM 1092 CB GLU A 69 -12.881 14.728 3.377 1.00 0.00 C ATOM 1093 CG GLU A 69 -12.920 16.244 3.354 1.00 0.00 C ATOM 1094 CD GLU A 69 -12.547 16.860 4.689 1.00 0.00 C ATOM 1095 OE1 GLU A 69 -12.724 16.184 5.724 1.00 0.00 O ATOM 1096 OE2 GLU A 69 -12.079 18.017 4.698 1.00 0.00 O ATOM 0 H GLU A 69 -12.358 12.315 2.647 1.00 0.00 H new ATOM 0 HA GLU A 69 -14.376 14.320 1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -13.521 14.369 4.183 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.866 14.403 3.607 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.237 16.609 2.587 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.920 16.573 3.073 1.00 0.00 H new ATOM 1103 N LYS A 70 -11.446 13.906 0.550 1.00 0.00 N ATOM 1104 CA LYS A 70 -10.572 14.289 -0.552 1.00 0.00 C ATOM 1105 C LYS A 70 -9.790 13.079 -1.047 1.00 0.00 C ATOM 1106 O LYS A 70 -9.081 12.430 -0.277 1.00 0.00 O ATOM 1107 CB LYS A 70 -9.608 15.396 -0.122 1.00 0.00 C ATOM 1108 CG LYS A 70 -9.051 15.215 1.281 1.00 0.00 C ATOM 1109 CD LYS A 70 -9.385 16.402 2.170 1.00 0.00 C ATOM 1110 CE LYS A 70 -9.361 16.021 3.642 1.00 0.00 C ATOM 1111 NZ LYS A 70 -8.698 17.063 4.474 1.00 0.00 N ATOM 0 H LYS A 70 -11.170 13.044 1.021 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.192 14.669 -1.364 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.779 15.438 -0.829 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.123 16.355 -0.177 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.458 14.304 1.720 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.969 15.089 1.231 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.671 17.205 1.989 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.371 16.787 1.909 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.381 15.870 3.995 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.838 15.072 3.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.702 16.766 5.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.716 17.190 4.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -9.212 17.962 4.379 1.00 0.00 H new ATOM 1125 N ILE A 71 -9.930 12.774 -2.330 1.00 0.00 N ATOM 1126 CA ILE A 71 -9.243 11.633 -2.921 1.00 0.00 C ATOM 1127 C ILE A 71 -7.735 11.843 -2.944 1.00 0.00 C ATOM 1128 O ILE A 71 -7.246 12.895 -3.355 1.00 0.00 O ATOM 1129 CB ILE A 71 -9.743 11.353 -4.350 1.00 0.00 C ATOM 1130 CG1 ILE A 71 -11.263 11.197 -4.350 1.00 0.00 C ATOM 1131 CG2 ILE A 71 -9.077 10.107 -4.917 1.00 0.00 C ATOM 1132 CD1 ILE A 71 -11.854 10.992 -5.726 1.00 0.00 C ATOM 0 H ILE A 71 -10.513 13.300 -2.981 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.469 10.771 -2.294 1.00 0.00 H new ATOM 0 HB ILE A 71 -9.477 12.198 -4.985 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -11.532 10.350 -3.719 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.710 12.084 -3.901 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -9.444 9.926 -5.927 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -7.997 10.252 -4.943 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -9.313 9.250 -4.287 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -12.936 10.889 -5.646 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -11.617 11.850 -6.355 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -11.436 10.089 -6.171 1.00 0.00 H new ATOM 1144 N SER A 72 -7.004 10.827 -2.497 1.00 0.00 N ATOM 1145 CA SER A 72 -5.547 10.886 -2.461 1.00 0.00 C ATOM 1146 C SER A 72 -4.942 9.514 -2.740 1.00 0.00 C ATOM 1147 O SER A 72 -5.570 8.485 -2.485 1.00 0.00 O ATOM 1148 CB SER A 72 -5.071 11.402 -1.103 1.00 0.00 C ATOM 1149 OG SER A 72 -3.688 11.150 -0.918 1.00 0.00 O ATOM 0 H SER A 72 -7.398 9.951 -2.154 1.00 0.00 H new ATOM 0 HA SER A 72 -5.215 11.574 -3.238 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.262 12.473 -1.030 1.00 0.00 H new ATOM 0 HB3 SER A 72 -5.641 10.922 -0.308 1.00 0.00 H new ATOM 0 HG SER A 72 -3.179 11.966 -1.107 1.00 0.00 H new ATOM 1155 N THR A 73 -3.720 9.505 -3.263 1.00 0.00 N ATOM 1156 CA THR A 73 -3.033 8.259 -3.575 1.00 0.00 C ATOM 1157 C THR A 73 -1.628 8.245 -2.981 1.00 0.00 C ATOM 1158 O THR A 73 -0.923 9.253 -3.007 1.00 0.00 O ATOM 1159 CB THR A 73 -2.959 8.059 -5.090 1.00 0.00 C ATOM 1160 OG1 THR A 73 -4.220 8.297 -5.689 1.00 0.00 O ATOM 1161 CG2 THR A 73 -2.514 6.669 -5.491 1.00 0.00 C ATOM 0 H THR A 73 -3.186 10.347 -3.479 1.00 0.00 H new ATOM 0 HA THR A 73 -3.602 7.441 -3.133 1.00 0.00 H new ATOM 0 HB THR A 73 -2.214 8.774 -5.439 1.00 0.00 H new ATOM 0 HG1 THR A 73 -4.235 9.198 -6.074 1.00 0.00 H new ATOM 0 HG21 THR A 73 -2.483 6.596 -6.578 1.00 0.00 H new ATOM 0 HG22 THR A 73 -1.521 6.474 -5.086 1.00 0.00 H new ATOM 0 HG23 THR A 73 -3.217 5.934 -5.098 1.00 0.00 H new ATOM 1169 N LEU A 74 -1.228 7.095 -2.448 1.00 0.00 N ATOM 1170 CA LEU A 74 0.093 6.947 -1.848 1.00 0.00 C ATOM 1171 C LEU A 74 1.179 6.972 -2.918 1.00 0.00 C ATOM 1172 O LEU A 74 1.246 6.085 -3.769 1.00 0.00 O ATOM 1173 CB LEU A 74 0.171 5.642 -1.053 1.00 0.00 C ATOM 1174 CG LEU A 74 1.466 5.441 -0.264 1.00 0.00 C ATOM 1175 CD1 LEU A 74 1.477 6.321 0.976 1.00 0.00 C ATOM 1176 CD2 LEU A 74 1.635 3.978 0.118 1.00 0.00 C ATOM 0 H LEU A 74 -1.800 6.251 -2.419 1.00 0.00 H new ATOM 0 HA LEU A 74 0.256 7.786 -1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -0.669 5.606 -0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.050 4.807 -1.743 1.00 0.00 H new ATOM 0 HG LEU A 74 2.304 5.730 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.406 6.165 1.525 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.402 7.367 0.680 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.631 6.063 1.613 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.561 3.853 0.679 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.793 3.663 0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.672 3.368 -0.785 1.00 0.00 H new ATOM 1188 N SER A 75 2.028 7.993 -2.869 1.00 0.00 N ATOM 1189 CA SER A 75 3.111 8.134 -3.836 1.00 0.00 C ATOM 1190 C SER A 75 4.464 8.210 -3.135 1.00 0.00 C ATOM 1191 O SER A 75 4.589 8.816 -2.071 1.00 0.00 O ATOM 1192 CB SER A 75 2.898 9.382 -4.694 1.00 0.00 C ATOM 1193 OG SER A 75 3.355 10.546 -4.027 1.00 0.00 O ATOM 0 H SER A 75 1.987 8.735 -2.170 1.00 0.00 H new ATOM 0 HA SER A 75 3.105 7.254 -4.479 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.427 9.271 -5.640 1.00 0.00 H new ATOM 0 HB3 SER A 75 1.839 9.487 -4.931 1.00 0.00 H new ATOM 0 HG SER A 75 3.241 10.435 -3.060 1.00 0.00 H new ATOM 1199 N CYS A 76 5.473 7.592 -3.740 1.00 0.00 N ATOM 1200 CA CYS A 76 6.818 7.590 -3.177 1.00 0.00 C ATOM 1201 C CYS A 76 7.755 8.461 -4.006 1.00 0.00 C ATOM 1202 O CYS A 76 8.219 8.051 -5.071 1.00 0.00 O ATOM 1203 CB CYS A 76 7.359 6.162 -3.105 1.00 0.00 C ATOM 1204 SG CYS A 76 7.349 5.288 -4.688 1.00 0.00 S ATOM 0 H CYS A 76 5.384 7.086 -4.621 1.00 0.00 H new ATOM 0 HA CYS A 76 6.765 8.002 -2.169 1.00 0.00 H new ATOM 0 HB2 CYS A 76 8.380 6.190 -2.724 1.00 0.00 H new ATOM 0 HB3 CYS A 76 6.766 5.596 -2.386 1.00 0.00 H new ATOM 0 HG CYS A 76 7.831 6.062 -5.614 1.00 0.00 H new ATOM 1210 N GLU A 77 8.029 9.666 -3.514 1.00 0.00 N ATOM 1211 CA GLU A 77 8.911 10.596 -4.215 1.00 0.00 C ATOM 1212 C GLU A 77 10.267 9.944 -4.511 1.00 0.00 C ATOM 1213 O GLU A 77 10.395 9.183 -5.470 1.00 0.00 O ATOM 1214 CB GLU A 77 9.089 11.891 -3.407 1.00 0.00 C ATOM 1215 CG GLU A 77 9.076 11.690 -1.896 1.00 0.00 C ATOM 1216 CD GLU A 77 9.670 12.868 -1.148 1.00 0.00 C ATOM 1217 OE1 GLU A 77 10.493 13.594 -1.742 1.00 0.00 O ATOM 1218 OE2 GLU A 77 9.311 13.063 0.032 1.00 0.00 O ATOM 0 H GLU A 77 7.654 10.021 -2.634 1.00 0.00 H new ATOM 0 HA GLU A 77 8.447 10.853 -5.167 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.032 12.358 -3.692 1.00 0.00 H new ATOM 0 HB3 GLU A 77 8.295 12.587 -3.677 1.00 0.00 H new ATOM 0 HG2 GLU A 77 8.050 11.532 -1.563 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.634 10.787 -1.648 1.00 0.00 H new ATOM 1225 N ASN A 78 11.276 10.235 -3.691 1.00 0.00 N ATOM 1226 CA ASN A 78 12.603 9.662 -3.881 1.00 0.00 C ATOM 1227 C ASN A 78 12.800 8.455 -2.969 1.00 0.00 C ATOM 1228 O ASN A 78 12.812 7.313 -3.426 1.00 0.00 O ATOM 1229 CB ASN A 78 13.683 10.710 -3.606 1.00 0.00 C ATOM 1230 CG ASN A 78 13.558 11.920 -4.512 1.00 0.00 C ATOM 1231 OD1 ASN A 78 13.548 13.060 -4.048 1.00 0.00 O ATOM 1232 ND2 ASN A 78 13.461 11.677 -5.814 1.00 0.00 N ATOM 0 H ASN A 78 11.198 10.863 -2.891 1.00 0.00 H new ATOM 0 HA ASN A 78 12.689 9.335 -4.917 1.00 0.00 H new ATOM 0 HB2 ASN A 78 13.619 11.030 -2.566 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.666 10.259 -3.740 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.374 12.451 -6.472 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.474 10.716 -6.156 1.00 0.00 H new ATOM 1239 N LYS A 79 12.947 8.721 -1.676 1.00 0.00 N ATOM 1240 CA LYS A 79 13.135 7.663 -0.691 1.00 0.00 C ATOM 1241 C LYS A 79 12.077 7.741 0.411 1.00 0.00 C ATOM 1242 O LYS A 79 12.000 6.864 1.272 1.00 0.00 O ATOM 1243 CB LYS A 79 14.536 7.751 -0.078 1.00 0.00 C ATOM 1244 CG LYS A 79 14.758 9.000 0.761 1.00 0.00 C ATOM 1245 CD LYS A 79 14.996 10.222 -0.111 1.00 0.00 C ATOM 1246 CE LYS A 79 16.080 11.117 0.469 1.00 0.00 C ATOM 1247 NZ LYS A 79 16.772 11.907 -0.587 1.00 0.00 N ATOM 0 H LYS A 79 12.940 9.663 -1.285 1.00 0.00 H new ATOM 0 HA LYS A 79 13.027 6.706 -1.201 1.00 0.00 H new ATOM 0 HB2 LYS A 79 14.707 6.872 0.543 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.276 7.725 -0.878 1.00 0.00 H new ATOM 0 HG2 LYS A 79 13.890 9.170 1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 79 15.613 8.850 1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 79 15.282 9.905 -1.114 1.00 0.00 H new ATOM 0 HD3 LYS A 79 14.069 10.787 -0.208 1.00 0.00 H new ATOM 0 HE2 LYS A 79 15.639 11.795 1.199 1.00 0.00 H new ATOM 0 HE3 LYS A 79 16.809 10.506 1.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.503 12.504 -0.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 17.215 11.260 -1.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 16.081 12.509 -1.079 1.00 0.00 H new ATOM 1261 N ILE A 80 11.267 8.799 0.383 1.00 0.00 N ATOM 1262 CA ILE A 80 10.222 8.991 1.381 1.00 0.00 C ATOM 1263 C ILE A 80 8.843 8.738 0.780 1.00 0.00 C ATOM 1264 O ILE A 80 8.689 8.672 -0.440 1.00 0.00 O ATOM 1265 CB ILE A 80 10.252 10.420 1.968 1.00 0.00 C ATOM 1266 CG1 ILE A 80 11.688 10.940 2.077 1.00 0.00 C ATOM 1267 CG2 ILE A 80 9.575 10.445 3.330 1.00 0.00 C ATOM 1268 CD1 ILE A 80 11.788 12.448 2.003 1.00 0.00 C ATOM 0 H ILE A 80 11.317 9.535 -0.321 1.00 0.00 H new ATOM 0 HA ILE A 80 10.414 8.274 2.179 1.00 0.00 H new ATOM 0 HB ILE A 80 9.706 11.077 1.291 1.00 0.00 H new ATOM 0 HG12 ILE A 80 12.119 10.600 3.019 1.00 0.00 H new ATOM 0 HG13 ILE A 80 12.286 10.504 1.277 1.00 0.00 H new ATOM 0 HG21 ILE A 80 9.603 11.458 3.732 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.538 10.124 3.227 1.00 0.00 H new ATOM 0 HG23 ILE A 80 10.098 9.771 4.008 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.833 12.748 2.087 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.387 12.793 1.050 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.217 12.891 2.819 1.00 0.00 H new ATOM 1280 N ILE A 81 7.843 8.602 1.644 1.00 0.00 N ATOM 1281 CA ILE A 81 6.475 8.362 1.200 1.00 0.00 C ATOM 1282 C ILE A 81 5.579 9.551 1.534 1.00 0.00 C ATOM 1283 O ILE A 81 5.733 10.184 2.578 1.00 0.00 O ATOM 1284 CB ILE A 81 5.891 7.090 1.845 1.00 0.00 C ATOM 1285 CG1 ILE A 81 6.779 5.882 1.537 1.00 0.00 C ATOM 1286 CG2 ILE A 81 4.468 6.846 1.362 1.00 0.00 C ATOM 1287 CD1 ILE A 81 6.793 5.495 0.074 1.00 0.00 C ATOM 0 H ILE A 81 7.954 8.654 2.657 1.00 0.00 H new ATOM 0 HA ILE A 81 6.507 8.226 0.119 1.00 0.00 H new ATOM 0 HB ILE A 81 5.863 7.233 2.925 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.798 6.101 1.856 1.00 0.00 H new ATOM 0 HG13 ILE A 81 6.437 5.031 2.126 1.00 0.00 H new ATOM 0 HG21 ILE A 81 4.075 5.943 1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 81 3.842 7.696 1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.467 6.723 0.279 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.443 4.632 -0.068 1.00 0.00 H new ATOM 0 HD12 ILE A 81 5.782 5.244 -0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.164 6.330 -0.520 1.00 0.00 H new ATOM 1299 N SER A 82 4.641 9.850 0.640 1.00 0.00 N ATOM 1300 CA SER A 82 3.720 10.961 0.841 1.00 0.00 C ATOM 1301 C SER A 82 2.441 10.762 0.033 1.00 0.00 C ATOM 1302 O SER A 82 2.478 10.266 -1.093 1.00 0.00 O ATOM 1303 CB SER A 82 4.385 12.281 0.445 1.00 0.00 C ATOM 1304 OG SER A 82 5.264 12.101 -0.651 1.00 0.00 O ATOM 0 H SER A 82 4.500 9.337 -0.231 1.00 0.00 H new ATOM 0 HA SER A 82 3.459 10.996 1.899 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.620 13.013 0.185 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.936 12.683 1.295 1.00 0.00 H new ATOM 0 HG SER A 82 4.863 11.479 -1.293 1.00 0.00 H new ATOM 1310 N PHE A 83 1.312 11.149 0.617 1.00 0.00 N ATOM 1311 CA PHE A 83 0.023 11.012 -0.049 1.00 0.00 C ATOM 1312 C PHE A 83 -0.228 12.181 -0.996 1.00 0.00 C ATOM 1313 O PHE A 83 -0.385 13.322 -0.562 1.00 0.00 O ATOM 1314 CB PHE A 83 -1.102 10.928 0.985 1.00 0.00 C ATOM 1315 CG PHE A 83 -1.410 9.524 1.422 1.00 0.00 C ATOM 1316 CD1 PHE A 83 -2.317 8.749 0.719 1.00 0.00 C ATOM 1317 CD2 PHE A 83 -0.791 8.981 2.537 1.00 0.00 C ATOM 1318 CE1 PHE A 83 -2.602 7.457 1.120 1.00 0.00 C ATOM 1319 CE2 PHE A 83 -1.071 7.690 2.942 1.00 0.00 C ATOM 1320 CZ PHE A 83 -1.978 6.927 2.232 1.00 0.00 C ATOM 0 H PHE A 83 1.264 11.560 1.549 1.00 0.00 H new ATOM 0 HA PHE A 83 0.040 10.092 -0.633 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -0.827 11.520 1.858 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -2.003 11.376 0.567 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -2.807 9.158 -0.152 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -0.082 9.574 3.096 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -3.312 6.863 0.564 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -0.582 7.278 3.812 1.00 0.00 H new ATOM 0 HZ PHE A 83 -2.199 5.918 2.546 1.00 0.00 H new ATOM 1330 N LYS A 84 -0.264 11.888 -2.292 1.00 0.00 N ATOM 1331 CA LYS A 84 -0.495 12.916 -3.301 1.00 0.00 C ATOM 1332 C LYS A 84 -1.972 12.985 -3.678 1.00 0.00 C ATOM 1333 O LYS A 84 -2.585 11.973 -4.017 1.00 0.00 O ATOM 1334 CB LYS A 84 0.352 12.636 -4.545 1.00 0.00 C ATOM 1335 CG LYS A 84 1.646 13.433 -4.593 1.00 0.00 C ATOM 1336 CD LYS A 84 2.468 13.241 -3.328 1.00 0.00 C ATOM 1337 CE LYS A 84 3.949 13.473 -3.585 1.00 0.00 C ATOM 1338 NZ LYS A 84 4.591 14.234 -2.479 1.00 0.00 N ATOM 0 H LYS A 84 -0.136 10.948 -2.668 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.202 13.878 -2.881 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.589 11.573 -4.581 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.237 12.862 -5.434 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.232 13.125 -5.459 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.418 14.491 -4.723 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.119 13.929 -2.558 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.318 12.232 -2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.451 12.513 -3.705 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.074 14.017 -4.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.430 14.731 -2.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.916 14.927 -2.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.876 13.577 -1.725 1.00 0.00 H new ATOM 1352 N GLU A 85 -2.537 14.186 -3.617 1.00 0.00 N ATOM 1353 CA GLU A 85 -3.942 14.387 -3.952 1.00 0.00 C ATOM 1354 C GLU A 85 -4.170 14.241 -5.453 1.00 0.00 C ATOM 1355 O GLU A 85 -3.941 15.176 -6.220 1.00 0.00 O ATOM 1356 CB GLU A 85 -4.407 15.768 -3.485 1.00 0.00 C ATOM 1357 CG GLU A 85 -4.754 15.826 -2.007 1.00 0.00 C ATOM 1358 CD GLU A 85 -4.677 17.231 -1.444 1.00 0.00 C ATOM 1359 OE1 GLU A 85 -3.647 17.902 -1.664 1.00 0.00 O ATOM 1360 OE2 GLU A 85 -5.646 17.659 -0.782 1.00 0.00 O ATOM 0 H GLU A 85 -2.044 15.034 -3.339 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.525 13.622 -3.439 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.623 16.496 -3.694 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -5.280 16.064 -4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -5.760 15.434 -1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.074 15.179 -1.453 1.00 0.00 H new ATOM 1367 N MET A 86 -4.621 13.061 -5.864 1.00 0.00 N ATOM 1368 CA MET A 86 -4.879 12.792 -7.275 1.00 0.00 C ATOM 1369 C MET A 86 -5.546 11.432 -7.455 1.00 0.00 C ATOM 1370 O MET A 86 -5.097 10.431 -6.897 1.00 0.00 O ATOM 1371 CB MET A 86 -3.576 12.843 -8.072 1.00 0.00 C ATOM 1372 CG MET A 86 -2.490 11.932 -7.523 1.00 0.00 C ATOM 1373 SD MET A 86 -1.626 11.018 -8.814 1.00 0.00 S ATOM 1374 CE MET A 86 -2.853 9.782 -9.231 1.00 0.00 C ATOM 0 H MET A 86 -4.815 12.276 -5.242 1.00 0.00 H new ATOM 0 HA MET A 86 -5.555 13.561 -7.649 1.00 0.00 H new ATOM 0 HB2 MET A 86 -3.782 12.567 -9.106 1.00 0.00 H new ATOM 0 HB3 MET A 86 -3.207 13.869 -8.083 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.770 12.529 -6.963 1.00 0.00 H new ATOM 0 HG3 MET A 86 -2.934 11.227 -6.820 1.00 0.00 H new ATOM 0 HE1 MET A 86 -2.480 9.159 -10.044 1.00 0.00 H new ATOM 0 HE2 MET A 86 -3.054 9.160 -8.359 1.00 0.00 H new ATOM 0 HE3 MET A 86 -3.773 10.274 -9.545 1.00 0.00 H new ATOM 1384 N ASN A 87 -6.620 11.403 -8.237 1.00 0.00 N ATOM 1385 CA ASN A 87 -7.348 10.166 -8.490 1.00 0.00 C ATOM 1386 C ASN A 87 -6.546 9.239 -9.401 1.00 0.00 C ATOM 1387 O ASN A 87 -5.831 9.698 -10.291 1.00 0.00 O ATOM 1388 CB ASN A 87 -8.707 10.470 -9.124 1.00 0.00 C ATOM 1389 CG ASN A 87 -8.581 11.267 -10.407 1.00 0.00 C ATOM 1390 OD1 ASN A 87 -8.015 10.794 -11.392 1.00 0.00 O ATOM 1391 ND2 ASN A 87 -9.110 12.486 -10.402 1.00 0.00 N ATOM 0 H ASN A 87 -7.005 12.223 -8.706 1.00 0.00 H new ATOM 0 HA ASN A 87 -7.504 9.664 -7.535 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -9.226 9.534 -9.330 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -9.320 11.025 -8.414 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -9.056 13.069 -11.237 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -9.570 12.839 -9.563 1.00 0.00 H new ATOM 1398 N PRO A 88 -6.655 7.915 -9.191 1.00 0.00 N ATOM 1399 CA PRO A 88 -5.935 6.926 -10.000 1.00 0.00 C ATOM 1400 C PRO A 88 -6.177 7.119 -11.496 1.00 0.00 C ATOM 1401 O PRO A 88 -7.324 7.182 -11.941 1.00 0.00 O ATOM 1402 CB PRO A 88 -6.518 5.589 -9.534 1.00 0.00 C ATOM 1403 CG PRO A 88 -7.017 5.851 -8.156 1.00 0.00 C ATOM 1404 CD PRO A 88 -7.487 7.279 -8.152 1.00 0.00 C ATOM 0 HA PRO A 88 -4.855 7.002 -9.871 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -7.323 5.259 -10.190 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.761 4.805 -9.538 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -7.830 5.172 -7.899 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -6.228 5.697 -7.419 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -8.549 7.353 -8.386 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -7.342 7.747 -7.178 1.00 0.00 H new ATOM 1412 N PRO A 89 -5.101 7.216 -12.298 1.00 0.00 N ATOM 1413 CA PRO A 89 -5.215 7.403 -13.746 1.00 0.00 C ATOM 1414 C PRO A 89 -5.593 6.116 -14.470 1.00 0.00 C ATOM 1415 O PRO A 89 -5.434 5.020 -13.933 1.00 0.00 O ATOM 1416 CB PRO A 89 -3.812 7.850 -14.150 1.00 0.00 C ATOM 1417 CG PRO A 89 -2.914 7.210 -13.150 1.00 0.00 C ATOM 1418 CD PRO A 89 -3.692 7.154 -11.861 1.00 0.00 C ATOM 0 HA PRO A 89 -5.999 8.114 -14.007 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -3.570 7.530 -15.163 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -3.720 8.936 -14.129 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -2.622 6.210 -13.472 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -1.997 7.785 -13.026 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -3.485 6.238 -11.308 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -3.440 7.987 -11.205 1.00 0.00 H new ATOM 1426 N ASP A 90 -6.093 6.257 -15.693 1.00 0.00 N ATOM 1427 CA ASP A 90 -6.492 5.106 -16.493 1.00 0.00 C ATOM 1428 C ASP A 90 -5.346 4.646 -17.389 1.00 0.00 C ATOM 1429 O ASP A 90 -5.222 3.461 -17.697 1.00 0.00 O ATOM 1430 CB ASP A 90 -7.715 5.448 -17.346 1.00 0.00 C ATOM 1431 CG ASP A 90 -8.374 4.217 -17.935 1.00 0.00 C ATOM 1432 OD1 ASP A 90 -7.734 3.543 -18.770 1.00 0.00 O ATOM 1433 OD2 ASP A 90 -9.530 3.926 -17.561 1.00 0.00 O ATOM 0 H ASP A 90 -6.231 7.158 -16.152 1.00 0.00 H new ATOM 0 HA ASP A 90 -6.749 4.294 -15.813 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -8.440 5.988 -16.736 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -7.416 6.117 -18.153 1.00 0.00 H new ATOM 1438 N ASN A 91 -4.509 5.594 -17.802 1.00 0.00 N ATOM 1439 CA ASN A 91 -3.370 5.290 -18.659 1.00 0.00 C ATOM 1440 C ASN A 91 -2.230 6.273 -18.414 1.00 0.00 C ATOM 1441 O ASN A 91 -2.293 7.428 -18.835 1.00 0.00 O ATOM 1442 CB ASN A 91 -3.787 5.331 -20.130 1.00 0.00 C ATOM 1443 CG ASN A 91 -4.308 6.693 -20.546 1.00 0.00 C ATOM 1444 OD1 ASN A 91 -3.637 7.434 -21.263 1.00 0.00 O ATOM 1445 ND2 ASN A 91 -5.512 7.030 -20.095 1.00 0.00 N ATOM 0 H ASN A 91 -4.600 6.580 -17.556 1.00 0.00 H new ATOM 0 HA ASN A 91 -3.020 4.287 -18.416 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -2.934 5.065 -20.754 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -4.558 4.581 -20.307 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -5.914 7.934 -20.341 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.034 6.384 -19.503 1.00 0.00 H new ATOM 1452 N ILE A 92 -1.191 5.810 -17.727 1.00 0.00 N ATOM 1453 CA ILE A 92 -0.040 6.652 -17.425 1.00 0.00 C ATOM 1454 C ILE A 92 0.939 6.683 -18.595 1.00 0.00 C ATOM 1455 O ILE A 92 1.028 5.731 -19.369 1.00 0.00 O ATOM 1456 CB ILE A 92 0.700 6.171 -16.160 1.00 0.00 C ATOM 1457 CG1 ILE A 92 -0.303 5.826 -15.056 1.00 0.00 C ATOM 1458 CG2 ILE A 92 1.679 7.233 -15.679 1.00 0.00 C ATOM 1459 CD1 ILE A 92 0.315 5.095 -13.884 1.00 0.00 C ATOM 0 H ILE A 92 -1.123 4.857 -17.369 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.424 7.657 -17.247 1.00 0.00 H new ATOM 0 HB ILE A 92 1.264 5.272 -16.409 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -0.766 6.745 -14.697 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.099 5.212 -15.478 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.192 6.877 -14.786 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.410 7.435 -16.462 1.00 0.00 H new ATOM 0 HG23 ILE A 92 1.136 8.149 -15.445 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.454 4.883 -13.141 1.00 0.00 H new ATOM 0 HD12 ILE A 92 0.754 4.159 -14.229 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.091 5.716 -13.436 1.00 0.00 H new ATOM 1471 N LYS A 93 1.665 7.788 -18.719 1.00 0.00 N ATOM 1472 CA LYS A 93 2.634 7.954 -19.796 1.00 0.00 C ATOM 1473 C LYS A 93 3.933 7.208 -19.496 1.00 0.00 C ATOM 1474 O LYS A 93 4.605 6.724 -20.406 1.00 0.00 O ATOM 1475 CB LYS A 93 2.912 9.438 -20.021 1.00 0.00 C ATOM 1476 CG LYS A 93 3.820 10.050 -18.973 1.00 0.00 C ATOM 1477 CD LYS A 93 3.347 11.433 -18.558 1.00 0.00 C ATOM 1478 CE LYS A 93 4.466 12.233 -17.909 1.00 0.00 C ATOM 1479 NZ LYS A 93 4.041 13.625 -17.591 1.00 0.00 N ATOM 0 H LYS A 93 1.601 8.585 -18.085 1.00 0.00 H new ATOM 0 HA LYS A 93 2.210 7.527 -20.705 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.365 9.570 -21.004 1.00 0.00 H new ATOM 0 HB3 LYS A 93 1.966 9.979 -20.031 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.856 9.400 -18.099 1.00 0.00 H new ATOM 0 HG3 LYS A 93 4.835 10.115 -19.364 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.975 11.969 -19.431 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.514 11.340 -17.862 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.786 11.733 -16.995 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.327 12.260 -18.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.832 14.137 -17.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.759 14.110 -18.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.235 13.600 -16.934 1.00 0.00 H new ATOM 1493 N ASP A 94 4.281 7.122 -18.217 1.00 0.00 N ATOM 1494 CA ASP A 94 5.501 6.437 -17.804 1.00 0.00 C ATOM 1495 C ASP A 94 5.201 5.017 -17.340 1.00 0.00 C ATOM 1496 O ASP A 94 4.093 4.718 -16.894 1.00 0.00 O ATOM 1497 CB ASP A 94 6.195 7.214 -16.684 1.00 0.00 C ATOM 1498 CG ASP A 94 7.155 8.260 -17.215 1.00 0.00 C ATOM 1499 OD1 ASP A 94 7.708 8.054 -18.316 1.00 0.00 O ATOM 1500 OD2 ASP A 94 7.353 9.287 -16.531 1.00 0.00 O ATOM 0 H ASP A 94 3.737 7.517 -17.450 1.00 0.00 H new ATOM 0 HA ASP A 94 6.165 6.385 -18.667 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.443 7.698 -16.061 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.738 6.518 -16.045 1.00 0.00 H new ATOM 1505 N THR A 95 6.197 4.145 -17.448 1.00 0.00 N ATOM 1506 CA THR A 95 6.044 2.754 -17.039 1.00 0.00 C ATOM 1507 C THR A 95 6.184 2.602 -15.525 1.00 0.00 C ATOM 1508 O THR A 95 5.883 1.545 -14.970 1.00 0.00 O ATOM 1509 CB THR A 95 7.078 1.879 -17.747 1.00 0.00 C ATOM 1510 OG1 THR A 95 7.100 2.152 -19.137 1.00 0.00 O ATOM 1511 CG2 THR A 95 6.826 0.395 -17.575 1.00 0.00 C ATOM 0 H THR A 95 7.120 4.377 -17.816 1.00 0.00 H new ATOM 0 HA THR A 95 5.042 2.430 -17.322 1.00 0.00 H new ATOM 0 HB THR A 95 8.032 2.126 -17.281 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.769 1.583 -19.572 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.596 -0.168 -18.102 1.00 0.00 H new ATOM 0 HG22 THR A 95 6.853 0.142 -16.515 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.848 0.142 -17.984 1.00 0.00 H new ATOM 1519 N LYS A 96 6.645 3.660 -14.860 1.00 0.00 N ATOM 1520 CA LYS A 96 6.822 3.631 -13.413 1.00 0.00 C ATOM 1521 C LYS A 96 6.414 4.961 -12.786 1.00 0.00 C ATOM 1522 O LYS A 96 7.176 5.927 -12.805 1.00 0.00 O ATOM 1523 CB LYS A 96 8.278 3.314 -13.063 1.00 0.00 C ATOM 1524 CG LYS A 96 9.287 4.169 -13.814 1.00 0.00 C ATOM 1525 CD LYS A 96 9.651 3.556 -15.156 1.00 0.00 C ATOM 1526 CE LYS A 96 10.756 4.341 -15.845 1.00 0.00 C ATOM 1527 NZ LYS A 96 12.108 3.818 -15.500 1.00 0.00 N ATOM 0 H LYS A 96 6.901 4.544 -15.300 1.00 0.00 H new ATOM 0 HA LYS A 96 6.179 2.849 -13.010 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.423 3.453 -11.992 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.474 2.263 -13.278 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.876 5.167 -13.969 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.187 4.285 -13.210 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.972 2.524 -15.011 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.769 3.529 -15.796 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.614 4.296 -16.925 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.689 5.390 -15.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.819 4.560 -15.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.125 3.534 -14.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.325 2.995 -16.097 1.00 0.00 H new ATOM 1541 N SER A 97 5.209 5.002 -12.229 1.00 0.00 N ATOM 1542 CA SER A 97 4.703 6.213 -11.594 1.00 0.00 C ATOM 1543 C SER A 97 5.013 6.213 -10.099 1.00 0.00 C ATOM 1544 O SER A 97 5.218 5.159 -9.498 1.00 0.00 O ATOM 1545 CB SER A 97 3.194 6.340 -11.818 1.00 0.00 C ATOM 1546 OG SER A 97 2.857 7.627 -12.305 1.00 0.00 O ATOM 0 H SER A 97 4.565 4.211 -12.204 1.00 0.00 H new ATOM 0 HA SER A 97 5.202 7.069 -12.049 1.00 0.00 H new ATOM 0 HB2 SER A 97 2.863 5.581 -12.527 1.00 0.00 H new ATOM 0 HB3 SER A 97 2.667 6.152 -10.882 1.00 0.00 H new ATOM 0 HG SER A 97 1.888 7.682 -12.441 1.00 0.00 H new ATOM 1552 N ASP A 98 5.045 7.402 -9.507 1.00 0.00 N ATOM 1553 CA ASP A 98 5.331 7.540 -8.084 1.00 0.00 C ATOM 1554 C ASP A 98 4.263 6.851 -7.238 1.00 0.00 C ATOM 1555 O ASP A 98 4.500 6.514 -6.078 1.00 0.00 O ATOM 1556 CB ASP A 98 5.425 9.018 -7.703 1.00 0.00 C ATOM 1557 CG ASP A 98 4.134 9.767 -7.967 1.00 0.00 C ATOM 1558 OD1 ASP A 98 3.388 9.359 -8.883 1.00 0.00 O ATOM 1559 OD2 ASP A 98 3.868 10.762 -7.261 1.00 0.00 O ATOM 0 H ASP A 98 4.876 8.284 -9.991 1.00 0.00 H new ATOM 0 HA ASP A 98 6.288 7.057 -7.886 1.00 0.00 H new ATOM 0 HB2 ASP A 98 5.681 9.102 -6.647 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.234 9.484 -8.265 1.00 0.00 H new ATOM 1564 N ILE A 99 3.084 6.645 -7.822 1.00 0.00 N ATOM 1565 CA ILE A 99 1.985 5.999 -7.115 1.00 0.00 C ATOM 1566 C ILE A 99 1.974 4.494 -7.365 1.00 0.00 C ATOM 1567 O ILE A 99 1.561 3.716 -6.505 1.00 0.00 O ATOM 1568 CB ILE A 99 0.624 6.587 -7.535 1.00 0.00 C ATOM 1569 CG1 ILE A 99 0.477 6.559 -9.058 1.00 0.00 C ATOM 1570 CG2 ILE A 99 0.477 8.008 -7.011 1.00 0.00 C ATOM 1571 CD1 ILE A 99 -0.961 6.526 -9.526 1.00 0.00 C ATOM 0 H ILE A 99 2.868 6.916 -8.781 1.00 0.00 H new ATOM 0 HA ILE A 99 2.142 6.185 -6.053 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.167 5.975 -7.102 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.967 7.437 -9.478 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.998 5.685 -9.449 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.489 8.410 -7.316 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.541 8.003 -5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 99 1.274 8.630 -7.419 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -0.989 6.507 -10.615 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.450 5.634 -9.135 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -1.482 7.413 -9.165 1.00 0.00 H new ATOM 1583 N ILE A 100 2.431 4.092 -8.546 1.00 0.00 N ATOM 1584 CA ILE A 100 2.473 2.680 -8.908 1.00 0.00 C ATOM 1585 C ILE A 100 3.338 1.889 -7.931 1.00 0.00 C ATOM 1586 O ILE A 100 4.458 2.289 -7.612 1.00 0.00 O ATOM 1587 CB ILE A 100 3.014 2.487 -10.340 1.00 0.00 C ATOM 1588 CG1 ILE A 100 2.147 3.253 -11.342 1.00 0.00 C ATOM 1589 CG2 ILE A 100 3.067 1.008 -10.701 1.00 0.00 C ATOM 1590 CD1 ILE A 100 0.745 2.701 -11.479 1.00 0.00 C ATOM 0 H ILE A 100 2.777 4.723 -9.268 1.00 0.00 H new ATOM 0 HA ILE A 100 1.450 2.306 -8.862 1.00 0.00 H new ATOM 0 HB ILE A 100 4.028 2.884 -10.382 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.089 4.297 -11.035 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.632 3.234 -12.318 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.451 0.894 -11.715 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.723 0.487 -10.004 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.065 0.583 -10.643 1.00 0.00 H new ATOM 0 HD11 ILE A 100 0.190 3.294 -12.206 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.793 1.666 -11.816 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.241 2.745 -10.514 1.00 0.00 H new ATOM 1602 N PHE A 101 2.809 0.763 -7.460 1.00 0.00 N ATOM 1603 CA PHE A 101 3.530 -0.087 -6.519 1.00 0.00 C ATOM 1604 C PHE A 101 3.584 -1.527 -7.019 1.00 0.00 C ATOM 1605 O PHE A 101 2.634 -2.018 -7.629 1.00 0.00 O ATOM 1606 CB PHE A 101 2.863 -0.038 -5.143 1.00 0.00 C ATOM 1607 CG PHE A 101 3.239 1.172 -4.336 1.00 0.00 C ATOM 1608 CD1 PHE A 101 4.525 1.319 -3.842 1.00 0.00 C ATOM 1609 CD2 PHE A 101 2.306 2.161 -4.071 1.00 0.00 C ATOM 1610 CE1 PHE A 101 4.874 2.432 -3.099 1.00 0.00 C ATOM 1611 CE2 PHE A 101 2.648 3.275 -3.328 1.00 0.00 C ATOM 1612 CZ PHE A 101 3.933 3.410 -2.842 1.00 0.00 C ATOM 0 H PHE A 101 1.883 0.419 -7.715 1.00 0.00 H new ATOM 0 HA PHE A 101 4.550 0.288 -6.435 1.00 0.00 H new ATOM 0 HB2 PHE A 101 1.781 -0.057 -5.272 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.133 -0.935 -4.585 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.263 0.556 -4.039 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.300 2.060 -4.449 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.880 2.536 -2.721 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.911 4.039 -3.128 1.00 0.00 H new ATOM 0 HZ PHE A 101 4.202 4.280 -2.261 1.00 0.00 H new ATOM 1622 N PHE A 102 4.701 -2.198 -6.758 1.00 0.00 N ATOM 1623 CA PHE A 102 4.878 -3.582 -7.184 1.00 0.00 C ATOM 1624 C PHE A 102 4.668 -4.544 -6.019 1.00 0.00 C ATOM 1625 O PHE A 102 5.585 -4.796 -5.235 1.00 0.00 O ATOM 1626 CB PHE A 102 6.274 -3.780 -7.778 1.00 0.00 C ATOM 1627 CG PHE A 102 6.349 -3.475 -9.247 1.00 0.00 C ATOM 1628 CD1 PHE A 102 5.751 -2.336 -9.762 1.00 0.00 C ATOM 1629 CD2 PHE A 102 7.016 -4.327 -10.111 1.00 0.00 C ATOM 1630 CE1 PHE A 102 5.817 -2.052 -11.113 1.00 0.00 C ATOM 1631 CE2 PHE A 102 7.087 -4.048 -11.463 1.00 0.00 C ATOM 1632 CZ PHE A 102 6.487 -2.910 -11.965 1.00 0.00 C ATOM 0 H PHE A 102 5.497 -1.807 -6.254 1.00 0.00 H new ATOM 0 HA PHE A 102 4.131 -3.798 -7.948 1.00 0.00 H new ATOM 0 HB2 PHE A 102 6.980 -3.142 -7.246 1.00 0.00 H new ATOM 0 HB3 PHE A 102 6.588 -4.811 -7.613 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.227 -1.662 -9.100 1.00 0.00 H new ATOM 0 HD2 PHE A 102 7.486 -5.219 -9.724 1.00 0.00 H new ATOM 0 HE1 PHE A 102 5.346 -1.161 -11.502 1.00 0.00 H new ATOM 0 HE2 PHE A 102 7.611 -4.720 -12.126 1.00 0.00 H new ATOM 0 HZ PHE A 102 6.541 -2.691 -13.021 1.00 0.00 H new ATOM 1642 N GLN A 103 3.458 -5.082 -5.913 1.00 0.00 N ATOM 1643 CA GLN A 103 3.129 -6.020 -4.845 1.00 0.00 C ATOM 1644 C GLN A 103 3.591 -7.430 -5.199 1.00 0.00 C ATOM 1645 O GLN A 103 3.324 -7.924 -6.295 1.00 0.00 O ATOM 1646 CB GLN A 103 1.622 -6.015 -4.583 1.00 0.00 C ATOM 1647 CG GLN A 103 1.223 -6.763 -3.322 1.00 0.00 C ATOM 1648 CD GLN A 103 1.258 -5.882 -2.087 1.00 0.00 C ATOM 1649 OE1 GLN A 103 2.322 -5.429 -1.664 1.00 0.00 O ATOM 1650 NE2 GLN A 103 0.092 -5.637 -1.502 1.00 0.00 N ATOM 0 H GLN A 103 2.689 -4.885 -6.553 1.00 0.00 H new ATOM 0 HA GLN A 103 3.650 -5.703 -3.941 1.00 0.00 H new ATOM 0 HB2 GLN A 103 1.278 -4.983 -4.508 1.00 0.00 H new ATOM 0 HB3 GLN A 103 1.111 -6.460 -5.437 1.00 0.00 H new ATOM 0 HG2 GLN A 103 0.219 -7.168 -3.447 1.00 0.00 H new ATOM 0 HG3 GLN A 103 1.893 -7.610 -3.179 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.765 -6.033 -1.887 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.053 -5.052 -0.667 1.00 0.00 H new ATOM 1659 N ARG A 104 4.289 -8.072 -4.266 1.00 0.00 N ATOM 1660 CA ARG A 104 4.789 -9.425 -4.485 1.00 0.00 C ATOM 1661 C ARG A 104 4.460 -10.332 -3.303 1.00 0.00 C ATOM 1662 O ARG A 104 4.837 -10.049 -2.168 1.00 0.00 O ATOM 1663 CB ARG A 104 6.300 -9.400 -4.715 1.00 0.00 C ATOM 1664 CG ARG A 104 6.692 -9.533 -6.176 1.00 0.00 C ATOM 1665 CD ARG A 104 6.705 -10.987 -6.619 1.00 0.00 C ATOM 1666 NE ARG A 104 8.058 -11.460 -6.907 1.00 0.00 N ATOM 1667 CZ ARG A 104 8.410 -12.745 -6.913 1.00 0.00 C ATOM 1668 NH1 ARG A 104 7.513 -13.688 -6.651 1.00 0.00 N ATOM 1669 NH2 ARG A 104 9.663 -13.087 -7.181 1.00 0.00 N ATOM 0 H ARG A 104 4.520 -7.678 -3.354 1.00 0.00 H new ATOM 0 HA ARG A 104 4.297 -9.825 -5.371 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.704 -8.467 -4.322 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.759 -10.210 -4.148 1.00 0.00 H new ATOM 0 HG2 ARG A 104 5.993 -8.969 -6.794 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.678 -9.096 -6.330 1.00 0.00 H new ATOM 0 HD2 ARG A 104 6.262 -11.607 -5.840 1.00 0.00 H new ATOM 0 HD3 ARG A 104 6.084 -11.101 -7.508 1.00 0.00 H new ATOM 0 HE ARG A 104 8.775 -10.765 -7.116 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.548 -13.431 -6.444 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.789 -14.670 -6.657 1.00 0.00 H new ATOM 0 HH21 ARG A 104 10.356 -12.367 -7.382 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.933 -14.071 -7.186 1.00 0.00 H new ATOM 1683 N SER A 105 3.762 -11.426 -3.583 1.00 0.00 N ATOM 1684 CA SER A 105 3.385 -12.379 -2.545 1.00 0.00 C ATOM 1685 C SER A 105 4.620 -13.014 -1.914 1.00 0.00 C ATOM 1686 O SER A 105 5.632 -13.225 -2.583 1.00 0.00 O ATOM 1687 CB SER A 105 2.479 -13.466 -3.127 1.00 0.00 C ATOM 1688 OG SER A 105 1.113 -13.177 -2.881 1.00 0.00 O ATOM 0 H SER A 105 3.445 -11.676 -4.520 1.00 0.00 H new ATOM 0 HA SER A 105 2.841 -11.838 -1.770 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.649 -13.549 -4.200 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.735 -14.430 -2.688 1.00 0.00 H new ATOM 0 HG SER A 105 0.555 -13.885 -3.264 1.00 0.00 H new ATOM 1694 N VAL A 106 4.529 -13.317 -0.624 1.00 0.00 N ATOM 1695 CA VAL A 106 5.639 -13.928 0.096 1.00 0.00 C ATOM 1696 C VAL A 106 5.507 -15.451 0.119 1.00 0.00 C ATOM 1697 O VAL A 106 4.409 -15.981 0.284 1.00 0.00 O ATOM 1698 CB VAL A 106 5.721 -13.410 1.546 1.00 0.00 C ATOM 1699 CG1 VAL A 106 6.945 -13.974 2.249 1.00 0.00 C ATOM 1700 CG2 VAL A 106 5.738 -11.889 1.568 1.00 0.00 C ATOM 0 H VAL A 106 3.698 -13.149 -0.056 1.00 0.00 H new ATOM 0 HA VAL A 106 6.551 -13.652 -0.433 1.00 0.00 H new ATOM 0 HB VAL A 106 4.836 -13.750 2.084 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.984 -13.596 3.271 1.00 0.00 H new ATOM 0 HG12 VAL A 106 6.885 -15.062 2.267 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.845 -13.669 1.715 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.796 -11.541 2.599 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.604 -11.527 1.013 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.827 -11.508 1.107 1.00 0.00 H new ATOM 1761 N ASN A 111 -0.231 -15.456 3.634 1.00 0.00 N ATOM 1762 CA ASN A 111 -0.584 -14.640 2.477 1.00 0.00 C ATOM 1763 C ASN A 111 -0.056 -13.217 2.633 1.00 0.00 C ATOM 1764 O ASN A 111 -0.829 -12.262 2.711 1.00 0.00 O ATOM 1765 CB ASN A 111 -2.101 -14.620 2.285 1.00 0.00 C ATOM 1766 CG ASN A 111 -2.578 -15.702 1.336 1.00 0.00 C ATOM 1767 OD1 ASN A 111 -2.733 -15.469 0.137 1.00 0.00 O ATOM 1768 ND2 ASN A 111 -2.814 -16.896 1.869 1.00 0.00 N ATOM 0 HA ASN A 111 -0.121 -15.083 1.595 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.588 -14.748 3.252 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -2.403 -13.645 1.902 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -3.137 -17.663 1.279 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -2.672 -17.046 2.868 1.00 0.00 H new ATOM 1775 N LYS A 112 1.265 -13.083 2.679 1.00 0.00 N ATOM 1776 CA LYS A 112 1.896 -11.777 2.825 1.00 0.00 C ATOM 1777 C LYS A 112 2.289 -11.209 1.467 1.00 0.00 C ATOM 1778 O LYS A 112 2.224 -11.902 0.452 1.00 0.00 O ATOM 1779 CB LYS A 112 3.124 -11.875 3.730 1.00 0.00 C ATOM 1780 CG LYS A 112 2.871 -12.636 5.021 1.00 0.00 C ATOM 1781 CD LYS A 112 1.803 -11.960 5.867 1.00 0.00 C ATOM 1782 CE LYS A 112 2.390 -10.847 6.723 1.00 0.00 C ATOM 1783 NZ LYS A 112 2.511 -11.249 8.152 1.00 0.00 N ATOM 0 H LYS A 112 1.919 -13.863 2.617 1.00 0.00 H new ATOM 0 HA LYS A 112 1.174 -11.102 3.284 1.00 0.00 H new ATOM 0 HB2 LYS A 112 3.930 -12.363 3.182 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.467 -10.869 3.973 1.00 0.00 H new ATOM 0 HG2 LYS A 112 2.562 -13.655 4.789 1.00 0.00 H new ATOM 0 HG3 LYS A 112 3.798 -12.706 5.591 1.00 0.00 H new ATOM 0 HD2 LYS A 112 1.028 -11.551 5.218 1.00 0.00 H new ATOM 0 HD3 LYS A 112 1.324 -12.699 6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 112 3.373 -10.573 6.339 1.00 0.00 H new ATOM 0 HE3 LYS A 112 1.760 -9.961 6.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 2.151 -10.485 8.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 1.957 -12.113 8.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 3.510 -11.430 8.378 1.00 0.00 H new ATOM 1797 N MET A 113 2.691 -9.942 1.456 1.00 0.00 N ATOM 1798 CA MET A 113 3.086 -9.283 0.219 1.00 0.00 C ATOM 1799 C MET A 113 4.133 -8.205 0.477 1.00 0.00 C ATOM 1800 O MET A 113 4.216 -7.654 1.575 1.00 0.00 O ATOM 1801 CB MET A 113 1.861 -8.670 -0.459 1.00 0.00 C ATOM 1802 CG MET A 113 0.897 -9.705 -1.012 1.00 0.00 C ATOM 1803 SD MET A 113 -0.451 -10.085 0.122 1.00 0.00 S ATOM 1804 CE MET A 113 -0.896 -11.728 -0.434 1.00 0.00 C ATOM 0 H MET A 113 2.751 -9.354 2.287 1.00 0.00 H new ATOM 0 HA MET A 113 3.527 -10.032 -0.438 1.00 0.00 H new ATOM 0 HB2 MET A 113 1.335 -8.041 0.259 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.191 -8.021 -1.270 1.00 0.00 H new ATOM 0 HG2 MET A 113 0.482 -9.342 -1.952 1.00 0.00 H new ATOM 0 HG3 MET A 113 1.444 -10.620 -1.237 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.870 -11.999 -0.026 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.942 -11.744 -1.523 1.00 0.00 H new ATOM 0 HE3 MET A 113 -0.147 -12.443 -0.092 1.00 0.00 H new ATOM 1814 N GLN A 114 4.929 -7.906 -0.547 1.00 0.00 N ATOM 1815 CA GLN A 114 5.970 -6.890 -0.438 1.00 0.00 C ATOM 1816 C GLN A 114 5.742 -5.777 -1.455 1.00 0.00 C ATOM 1817 O GLN A 114 5.419 -6.039 -2.615 1.00 0.00 O ATOM 1818 CB GLN A 114 7.350 -7.518 -0.650 1.00 0.00 C ATOM 1819 CG GLN A 114 8.023 -7.960 0.639 1.00 0.00 C ATOM 1820 CD GLN A 114 9.348 -8.655 0.396 1.00 0.00 C ATOM 1821 OE1 GLN A 114 9.604 -9.734 0.933 1.00 0.00 O ATOM 1822 NE2 GLN A 114 10.200 -8.040 -0.417 1.00 0.00 N ATOM 0 H GLN A 114 4.872 -8.354 -1.462 1.00 0.00 H new ATOM 0 HA GLN A 114 5.926 -6.461 0.563 1.00 0.00 H new ATOM 0 HB2 GLN A 114 7.250 -8.379 -1.311 1.00 0.00 H new ATOM 0 HB3 GLN A 114 7.993 -6.799 -1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 114 8.184 -7.091 1.277 1.00 0.00 H new ATOM 0 HG3 GLN A 114 7.358 -8.633 1.180 1.00 0.00 H new ATOM 0 HE21 GLN A 114 9.947 -7.147 -0.840 1.00 0.00 H new ATOM 0 HE22 GLN A 114 11.107 -8.461 -0.618 1.00 0.00 H new ATOM 1831 N PHE A 115 5.910 -4.535 -1.013 1.00 0.00 N ATOM 1832 CA PHE A 115 5.720 -3.382 -1.886 1.00 0.00 C ATOM 1833 C PHE A 115 7.049 -2.915 -2.470 1.00 0.00 C ATOM 1834 O PHE A 115 7.883 -2.347 -1.765 1.00 0.00 O ATOM 1835 CB PHE A 115 5.057 -2.239 -1.115 1.00 0.00 C ATOM 1836 CG PHE A 115 3.571 -2.394 -0.972 1.00 0.00 C ATOM 1837 CD1 PHE A 115 3.038 -3.201 0.020 1.00 0.00 C ATOM 1838 CD2 PHE A 115 2.706 -1.734 -1.830 1.00 0.00 C ATOM 1839 CE1 PHE A 115 1.671 -3.346 0.155 1.00 0.00 C ATOM 1840 CE2 PHE A 115 1.337 -1.876 -1.700 1.00 0.00 C ATOM 1841 CZ PHE A 115 0.819 -2.683 -0.707 1.00 0.00 C ATOM 0 H PHE A 115 6.177 -4.301 -0.057 1.00 0.00 H new ATOM 0 HA PHE A 115 5.070 -3.682 -2.708 1.00 0.00 H new ATOM 0 HB2 PHE A 115 5.504 -2.173 -0.123 1.00 0.00 H new ATOM 0 HB3 PHE A 115 5.269 -1.298 -1.623 1.00 0.00 H new ATOM 0 HD1 PHE A 115 3.699 -3.723 0.696 1.00 0.00 H new ATOM 0 HD2 PHE A 115 3.106 -1.102 -2.609 1.00 0.00 H new ATOM 0 HE1 PHE A 115 1.269 -3.977 0.934 1.00 0.00 H new ATOM 0 HE2 PHE A 115 0.673 -1.356 -2.375 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.250 -2.796 -0.604 1.00 0.00 H new ATOM 1851 N GLU A 116 7.237 -3.160 -3.761 1.00 0.00 N ATOM 1852 CA GLU A 116 8.463 -2.767 -4.446 1.00 0.00 C ATOM 1853 C GLU A 116 8.227 -1.545 -5.327 1.00 0.00 C ATOM 1854 O GLU A 116 7.096 -1.264 -5.726 1.00 0.00 O ATOM 1855 CB GLU A 116 8.993 -3.926 -5.291 1.00 0.00 C ATOM 1856 CG GLU A 116 10.490 -3.861 -5.545 1.00 0.00 C ATOM 1857 CD GLU A 116 10.835 -3.871 -7.022 1.00 0.00 C ATOM 1858 OE1 GLU A 116 10.459 -2.910 -7.726 1.00 0.00 O ATOM 1859 OE2 GLU A 116 11.479 -4.841 -7.475 1.00 0.00 O ATOM 0 H GLU A 116 6.555 -3.630 -4.356 1.00 0.00 H new ATOM 0 HA GLU A 116 9.205 -2.509 -3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 116 8.759 -4.866 -4.791 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.471 -3.935 -6.248 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.893 -2.957 -5.088 1.00 0.00 H new ATOM 0 HG3 GLU A 116 10.974 -4.707 -5.057 1.00 0.00 H new ATOM 1866 N SER A 117 9.300 -0.822 -5.630 1.00 0.00 N ATOM 1867 CA SER A 117 9.209 0.369 -6.466 1.00 0.00 C ATOM 1868 C SER A 117 8.656 0.026 -7.845 1.00 0.00 C ATOM 1869 O SER A 117 8.796 -1.103 -8.317 1.00 0.00 O ATOM 1870 CB SER A 117 10.582 1.029 -6.603 1.00 0.00 C ATOM 1871 OG SER A 117 10.462 2.435 -6.737 1.00 0.00 O ATOM 0 H SER A 117 10.243 -1.040 -5.309 1.00 0.00 H new ATOM 0 HA SER A 117 8.525 1.068 -5.984 1.00 0.00 H new ATOM 0 HB2 SER A 117 11.190 0.795 -5.729 1.00 0.00 H new ATOM 0 HB3 SER A 117 11.100 0.621 -7.471 1.00 0.00 H new ATOM 0 HG SER A 117 11.354 2.833 -6.821 1.00 0.00 H new ATOM 1877 N SER A 118 8.026 1.005 -8.487 1.00 0.00 N ATOM 1878 CA SER A 118 7.451 0.806 -9.811 1.00 0.00 C ATOM 1879 C SER A 118 8.543 0.677 -10.868 1.00 0.00 C ATOM 1880 O SER A 118 8.436 -0.130 -11.791 1.00 0.00 O ATOM 1881 CB SER A 118 6.518 1.966 -10.164 1.00 0.00 C ATOM 1882 OG SER A 118 7.028 3.195 -9.676 1.00 0.00 O ATOM 0 H SER A 118 7.901 1.945 -8.110 1.00 0.00 H new ATOM 0 HA SER A 118 6.878 -0.121 -9.794 1.00 0.00 H new ATOM 0 HB2 SER A 118 6.396 2.023 -11.246 1.00 0.00 H new ATOM 0 HB3 SER A 118 5.530 1.784 -9.741 1.00 0.00 H new ATOM 0 HG SER A 118 6.284 3.778 -9.416 1.00 0.00 H new ATOM 1888 N SER A 119 9.593 1.479 -10.728 1.00 0.00 N ATOM 1889 CA SER A 119 10.705 1.455 -11.672 1.00 0.00 C ATOM 1890 C SER A 119 11.441 0.120 -11.613 1.00 0.00 C ATOM 1891 O SER A 119 11.403 -0.663 -12.562 1.00 0.00 O ATOM 1892 CB SER A 119 11.675 2.601 -11.380 1.00 0.00 C ATOM 1893 OG SER A 119 12.486 2.883 -12.507 1.00 0.00 O ATOM 0 H SER A 119 9.698 2.154 -9.970 1.00 0.00 H new ATOM 0 HA SER A 119 10.299 1.580 -12.676 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.115 3.493 -11.099 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.306 2.340 -10.530 1.00 0.00 H new ATOM 0 HG SER A 119 12.852 2.047 -12.864 1.00 0.00 H new ATOM 1899 N TYR A 120 12.110 -0.133 -10.494 1.00 0.00 N ATOM 1900 CA TYR A 120 12.856 -1.374 -10.312 1.00 0.00 C ATOM 1901 C TYR A 120 13.094 -1.652 -8.830 1.00 0.00 C ATOM 1902 O TYR A 120 12.641 -0.900 -7.968 1.00 0.00 O ATOM 1903 CB TYR A 120 14.195 -1.303 -11.049 1.00 0.00 C ATOM 1904 CG TYR A 120 14.060 -1.305 -12.555 1.00 0.00 C ATOM 1905 CD1 TYR A 120 13.841 -2.489 -13.250 1.00 0.00 C ATOM 1906 CD2 TYR A 120 14.152 -0.125 -13.281 1.00 0.00 C ATOM 1907 CE1 TYR A 120 13.717 -2.494 -14.627 1.00 0.00 C ATOM 1908 CE2 TYR A 120 14.029 -0.123 -14.658 1.00 0.00 C ATOM 1909 CZ TYR A 120 13.811 -1.310 -15.325 1.00 0.00 C ATOM 1910 OH TYR A 120 13.688 -1.312 -16.696 1.00 0.00 O ATOM 0 H TYR A 120 12.152 0.504 -9.699 1.00 0.00 H new ATOM 0 HA TYR A 120 12.263 -2.189 -10.728 1.00 0.00 H new ATOM 0 HB2 TYR A 120 14.722 -0.400 -10.741 1.00 0.00 H new ATOM 0 HB3 TYR A 120 14.811 -2.150 -10.747 1.00 0.00 H new ATOM 0 HD1 TYR A 120 13.767 -3.419 -12.706 1.00 0.00 H new ATOM 0 HD2 TYR A 120 14.322 0.806 -12.762 1.00 0.00 H new ATOM 0 HE1 TYR A 120 13.547 -3.422 -15.153 1.00 0.00 H new ATOM 0 HE2 TYR A 120 14.103 0.803 -15.208 1.00 0.00 H new ATOM 0 HH TYR A 120 13.778 -0.396 -17.034 1.00 0.00 H new ATOM 1920 N GLU A 121 13.808 -2.735 -8.544 1.00 0.00 N ATOM 1921 CA GLU A 121 14.107 -3.109 -7.168 1.00 0.00 C ATOM 1922 C GLU A 121 15.055 -2.102 -6.527 1.00 0.00 C ATOM 1923 O GLU A 121 15.386 -1.078 -7.126 1.00 0.00 O ATOM 1924 CB GLU A 121 14.722 -4.510 -7.122 1.00 0.00 C ATOM 1925 CG GLU A 121 16.024 -4.627 -7.896 1.00 0.00 C ATOM 1926 CD GLU A 121 16.318 -6.050 -8.331 1.00 0.00 C ATOM 1927 OE1 GLU A 121 15.403 -6.707 -8.871 1.00 0.00 O ATOM 1928 OE2 GLU A 121 17.463 -6.508 -8.131 1.00 0.00 O ATOM 0 H GLU A 121 14.190 -3.368 -9.246 1.00 0.00 H new ATOM 0 HA GLU A 121 13.174 -3.111 -6.605 1.00 0.00 H new ATOM 0 HB2 GLU A 121 14.901 -4.786 -6.083 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.005 -5.226 -7.523 1.00 0.00 H new ATOM 0 HG2 GLU A 121 15.979 -3.984 -8.775 1.00 0.00 H new ATOM 0 HG3 GLU A 121 16.844 -4.263 -7.277 1.00 0.00 H new ATOM 1935 N GLY A 122 15.489 -2.399 -5.308 1.00 0.00 N ATOM 1936 CA GLY A 122 16.396 -1.509 -4.606 1.00 0.00 C ATOM 1937 C GLY A 122 15.740 -0.820 -3.425 1.00 0.00 C ATOM 1938 O GLY A 122 16.415 -0.423 -2.476 1.00 0.00 O ATOM 0 H GLY A 122 15.229 -3.240 -4.793 1.00 0.00 H new ATOM 0 HA2 GLY A 122 17.259 -2.077 -4.257 1.00 0.00 H new ATOM 0 HA3 GLY A 122 16.769 -0.756 -5.300 1.00 0.00 H new ATOM 1942 N TYR A 123 14.419 -0.677 -3.483 1.00 0.00 N ATOM 1943 CA TYR A 123 13.671 -0.031 -2.410 1.00 0.00 C ATOM 1944 C TYR A 123 12.380 -0.788 -2.118 1.00 0.00 C ATOM 1945 O TYR A 123 11.715 -1.274 -3.032 1.00 0.00 O ATOM 1946 CB TYR A 123 13.353 1.418 -2.782 1.00 0.00 C ATOM 1947 CG TYR A 123 14.576 2.239 -3.120 1.00 0.00 C ATOM 1948 CD1 TYR A 123 15.051 2.310 -4.425 1.00 0.00 C ATOM 1949 CD2 TYR A 123 15.257 2.944 -2.135 1.00 0.00 C ATOM 1950 CE1 TYR A 123 16.168 3.060 -4.737 1.00 0.00 C ATOM 1951 CE2 TYR A 123 16.376 3.697 -2.441 1.00 0.00 C ATOM 1952 CZ TYR A 123 16.827 3.751 -3.742 1.00 0.00 C ATOM 1953 OH TYR A 123 17.940 4.499 -4.050 1.00 0.00 O ATOM 0 H TYR A 123 13.845 -1.000 -4.262 1.00 0.00 H new ATOM 0 HA TYR A 123 14.289 -0.040 -1.512 1.00 0.00 H new ATOM 0 HB2 TYR A 123 12.674 1.425 -3.635 1.00 0.00 H new ATOM 0 HB3 TYR A 123 12.827 1.890 -1.952 1.00 0.00 H new ATOM 0 HD1 TYR A 123 14.538 1.770 -5.207 1.00 0.00 H new ATOM 0 HD2 TYR A 123 14.907 2.903 -1.114 1.00 0.00 H new ATOM 0 HE1 TYR A 123 16.524 3.105 -5.756 1.00 0.00 H new ATOM 0 HE2 TYR A 123 16.894 4.240 -1.664 1.00 0.00 H new ATOM 0 HH TYR A 123 18.284 4.923 -3.237 1.00 0.00 H new ATOM 1963 N PHE A 124 12.030 -0.884 -0.839 1.00 0.00 N ATOM 1964 CA PHE A 124 10.817 -1.585 -0.433 1.00 0.00 C ATOM 1965 C PHE A 124 10.063 -0.798 0.634 1.00 0.00 C ATOM 1966 O PHE A 124 10.660 -0.286 1.583 1.00 0.00 O ATOM 1967 CB PHE A 124 11.161 -2.979 0.095 1.00 0.00 C ATOM 1968 CG PHE A 124 11.301 -4.015 -0.984 1.00 0.00 C ATOM 1969 CD1 PHE A 124 10.186 -4.491 -1.655 1.00 0.00 C ATOM 1970 CD2 PHE A 124 12.548 -4.512 -1.326 1.00 0.00 C ATOM 1971 CE1 PHE A 124 10.312 -5.446 -2.647 1.00 0.00 C ATOM 1972 CE2 PHE A 124 12.680 -5.467 -2.318 1.00 0.00 C ATOM 1973 CZ PHE A 124 11.560 -5.933 -2.979 1.00 0.00 C ATOM 0 H PHE A 124 12.567 -0.487 -0.068 1.00 0.00 H new ATOM 0 HA PHE A 124 10.175 -1.682 -1.308 1.00 0.00 H new ATOM 0 HB2 PHE A 124 12.093 -2.925 0.658 1.00 0.00 H new ATOM 0 HB3 PHE A 124 10.385 -3.296 0.792 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.207 -4.112 -1.400 1.00 0.00 H new ATOM 0 HD2 PHE A 124 13.427 -4.150 -0.813 1.00 0.00 H new ATOM 0 HE1 PHE A 124 9.435 -5.810 -3.161 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.657 -5.848 -2.575 1.00 0.00 H new ATOM 0 HZ PHE A 124 11.661 -6.678 -3.755 1.00 0.00 H new ATOM 1983 N LEU A 125 8.746 -0.710 0.478 1.00 0.00 N ATOM 1984 CA LEU A 125 7.912 0.007 1.433 1.00 0.00 C ATOM 1985 C LEU A 125 7.881 -0.729 2.769 1.00 0.00 C ATOM 1986 O LEU A 125 7.285 -1.800 2.886 1.00 0.00 O ATOM 1987 CB LEU A 125 6.491 0.166 0.884 1.00 0.00 C ATOM 1988 CG LEU A 125 6.108 1.591 0.484 1.00 0.00 C ATOM 1989 CD1 LEU A 125 4.672 1.636 -0.014 1.00 0.00 C ATOM 1990 CD2 LEU A 125 6.301 2.544 1.656 1.00 0.00 C ATOM 0 H LEU A 125 8.235 -1.126 -0.300 1.00 0.00 H new ATOM 0 HA LEU A 125 8.339 0.997 1.590 1.00 0.00 H new ATOM 0 HB2 LEU A 125 6.379 -0.482 0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 125 5.785 -0.186 1.637 1.00 0.00 H new ATOM 0 HG LEU A 125 6.762 1.910 -0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.416 2.658 -0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.567 0.984 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 125 4.002 1.298 0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.024 3.554 1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.672 2.229 2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 125 7.346 2.532 1.966 1.00 0.00 H new ATOM 2002 N ALA A 126 8.534 -0.152 3.771 1.00 0.00 N ATOM 2003 CA ALA A 126 8.589 -0.758 5.096 1.00 0.00 C ATOM 2004 C ALA A 126 7.803 0.064 6.111 1.00 0.00 C ATOM 2005 O ALA A 126 7.246 1.111 5.781 1.00 0.00 O ATOM 2006 CB ALA A 126 10.035 -0.911 5.541 1.00 0.00 C ATOM 0 H ALA A 126 9.033 0.734 3.691 1.00 0.00 H new ATOM 0 HA ALA A 126 8.130 -1.745 5.039 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.065 -1.364 6.532 1.00 0.00 H new ATOM 0 HB2 ALA A 126 10.568 -1.547 4.834 1.00 0.00 H new ATOM 0 HB3 ALA A 126 10.510 0.069 5.576 1.00 0.00 H new ATOM 2012 N CYS A 127 7.765 -0.417 7.350 1.00 0.00 N ATOM 2013 CA CYS A 127 7.049 0.271 8.416 1.00 0.00 C ATOM 2014 C CYS A 127 8.020 0.806 9.464 1.00 0.00 C ATOM 2015 O CYS A 127 9.114 0.271 9.641 1.00 0.00 O ATOM 2016 CB CYS A 127 6.038 -0.670 9.074 1.00 0.00 C ATOM 2017 SG CYS A 127 6.702 -2.303 9.478 1.00 0.00 S ATOM 0 H CYS A 127 8.223 -1.281 7.639 1.00 0.00 H new ATOM 0 HA CYS A 127 6.515 1.113 7.976 1.00 0.00 H new ATOM 0 HB2 CYS A 127 5.666 -0.205 9.987 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.184 -0.792 8.408 1.00 0.00 H new ATOM 0 HG CYS A 127 7.249 -2.823 8.420 1.00 0.00 H new ATOM 2023 N GLU A 128 7.612 1.866 10.153 1.00 0.00 N ATOM 2024 CA GLU A 128 8.446 2.476 11.181 1.00 0.00 C ATOM 2025 C GLU A 128 7.608 2.884 12.390 1.00 0.00 C ATOM 2026 O GLU A 128 6.582 3.555 12.252 1.00 0.00 O ATOM 2027 CB GLU A 128 9.179 3.694 10.616 1.00 0.00 C ATOM 2028 CG GLU A 128 10.673 3.686 10.892 1.00 0.00 C ATOM 2029 CD GLU A 128 11.330 5.018 10.584 1.00 0.00 C ATOM 2030 OE1 GLU A 128 10.831 6.053 11.073 1.00 0.00 O ATOM 2031 OE2 GLU A 128 12.345 5.025 9.856 1.00 0.00 O ATOM 0 H GLU A 128 6.709 2.320 10.018 1.00 0.00 H new ATOM 0 HA GLU A 128 9.180 1.738 11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 128 9.017 3.738 9.539 1.00 0.00 H new ATOM 0 HB3 GLU A 128 8.744 4.599 11.041 1.00 0.00 H new ATOM 0 HG2 GLU A 128 10.844 3.434 11.939 1.00 0.00 H new ATOM 0 HG3 GLU A 128 11.145 2.906 10.295 1.00 0.00 H new ATOM 2038 N LYS A 129 8.054 2.474 13.573 1.00 0.00 N ATOM 2039 CA LYS A 129 7.351 2.794 14.810 1.00 0.00 C ATOM 2040 C LYS A 129 7.710 4.196 15.289 1.00 0.00 C ATOM 2041 O LYS A 129 8.734 4.398 15.942 1.00 0.00 O ATOM 2042 CB LYS A 129 7.695 1.770 15.894 1.00 0.00 C ATOM 2043 CG LYS A 129 6.931 1.980 17.191 1.00 0.00 C ATOM 2044 CD LYS A 129 5.433 1.824 16.987 1.00 0.00 C ATOM 2045 CE LYS A 129 4.695 3.132 17.233 1.00 0.00 C ATOM 2046 NZ LYS A 129 3.346 2.908 17.825 1.00 0.00 N ATOM 0 H LYS A 129 8.900 1.919 13.701 1.00 0.00 H new ATOM 0 HA LYS A 129 6.280 2.759 14.612 1.00 0.00 H new ATOM 0 HB2 LYS A 129 7.486 0.769 15.516 1.00 0.00 H new ATOM 0 HB3 LYS A 129 8.764 1.816 16.100 1.00 0.00 H new ATOM 0 HG2 LYS A 129 7.274 1.263 17.937 1.00 0.00 H new ATOM 0 HG3 LYS A 129 7.144 2.974 17.583 1.00 0.00 H new ATOM 0 HD2 LYS A 129 5.237 1.481 15.971 1.00 0.00 H new ATOM 0 HD3 LYS A 129 5.051 1.058 17.662 1.00 0.00 H new ATOM 0 HE2 LYS A 129 5.284 3.761 17.900 1.00 0.00 H new ATOM 0 HE3 LYS A 129 4.593 3.673 16.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.620 3.297 17.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 3.186 1.888 17.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.289 3.382 18.749 1.00 0.00 H new ATOM 2060 N GLU A 130 6.861 5.163 14.960 1.00 0.00 N ATOM 2061 CA GLU A 130 7.089 6.546 15.357 1.00 0.00 C ATOM 2062 C GLU A 130 6.147 6.953 16.485 1.00 0.00 C ATOM 2063 O GLU A 130 4.950 7.145 16.271 1.00 0.00 O ATOM 2064 CB GLU A 130 6.904 7.479 14.160 1.00 0.00 C ATOM 2065 CG GLU A 130 8.183 7.721 13.375 1.00 0.00 C ATOM 2066 CD GLU A 130 8.425 9.189 13.089 1.00 0.00 C ATOM 2067 OE1 GLU A 130 8.338 10.000 14.035 1.00 0.00 O ATOM 2068 OE2 GLU A 130 8.702 9.530 11.919 1.00 0.00 O ATOM 0 H GLU A 130 6.009 5.014 14.419 1.00 0.00 H new ATOM 0 HA GLU A 130 8.114 6.629 15.718 1.00 0.00 H new ATOM 0 HB2 GLU A 130 6.152 7.056 13.493 1.00 0.00 H new ATOM 0 HB3 GLU A 130 6.517 8.435 14.512 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.029 7.320 13.934 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.135 7.175 12.433 1.00 0.00 H new ATOM 2075 N ARG A 131 6.698 7.082 17.687 1.00 0.00 N ATOM 2076 CA ARG A 131 5.912 7.467 18.852 1.00 0.00 C ATOM 2077 C ARG A 131 4.807 6.439 19.130 1.00 0.00 C ATOM 2078 O ARG A 131 5.095 5.303 19.508 1.00 0.00 O ATOM 2079 CB ARG A 131 5.326 8.868 18.653 1.00 0.00 C ATOM 2080 CG ARG A 131 6.381 9.955 18.519 1.00 0.00 C ATOM 2081 CD ARG A 131 5.787 11.248 17.986 1.00 0.00 C ATOM 2082 NE ARG A 131 5.613 12.246 19.039 1.00 0.00 N ATOM 2083 CZ ARG A 131 6.622 12.864 19.647 1.00 0.00 C ATOM 2084 NH1 ARG A 131 7.876 12.590 19.313 1.00 0.00 N ATOM 2085 NH2 ARG A 131 6.376 13.759 20.595 1.00 0.00 N ATOM 0 H ARG A 131 7.687 6.925 17.880 1.00 0.00 H new ATOM 0 HA ARG A 131 6.567 7.490 19.723 1.00 0.00 H new ATOM 0 HB2 ARG A 131 4.701 8.868 17.760 1.00 0.00 H new ATOM 0 HB3 ARG A 131 4.677 9.105 19.496 1.00 0.00 H new ATOM 0 HG2 ARG A 131 6.841 10.138 19.490 1.00 0.00 H new ATOM 0 HG3 ARG A 131 7.172 9.615 17.851 1.00 0.00 H new ATOM 0 HD2 ARG A 131 6.435 11.651 17.208 1.00 0.00 H new ATOM 0 HD3 ARG A 131 4.823 11.040 17.521 1.00 0.00 H new ATOM 0 HE ARG A 131 4.663 12.483 19.324 1.00 0.00 H new ATOM 0 HH11 ARG A 131 8.071 11.902 18.586 1.00 0.00 H new ATOM 0 HH12 ARG A 131 8.645 13.068 19.783 1.00 0.00 H new ATOM 0 HH21 ARG A 131 5.414 13.973 20.857 1.00 0.00 H new ATOM 0 HH22 ARG A 131 7.149 14.233 21.062 1.00 0.00 H new ATOM 2099 N ASP A 132 3.544 6.833 18.949 1.00 0.00 N ATOM 2100 CA ASP A 132 2.424 5.932 19.191 1.00 0.00 C ATOM 2101 C ASP A 132 1.741 5.525 17.886 1.00 0.00 C ATOM 2102 O ASP A 132 0.604 5.052 17.898 1.00 0.00 O ATOM 2103 CB ASP A 132 1.405 6.595 20.120 1.00 0.00 C ATOM 2104 CG ASP A 132 1.990 6.924 21.479 1.00 0.00 C ATOM 2105 OD1 ASP A 132 2.597 6.024 22.099 1.00 0.00 O ATOM 2106 OD2 ASP A 132 1.843 8.081 21.926 1.00 0.00 O ATOM 0 H ASP A 132 3.276 7.766 18.637 1.00 0.00 H new ATOM 0 HA ASP A 132 2.819 5.033 19.664 1.00 0.00 H new ATOM 0 HB2 ASP A 132 1.035 7.509 19.656 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.548 5.933 20.247 1.00 0.00 H new ATOM 2111 N LEU A 133 2.428 5.714 16.764 1.00 0.00 N ATOM 2112 CA LEU A 133 1.862 5.368 15.464 1.00 0.00 C ATOM 2113 C LEU A 133 2.890 4.686 14.565 1.00 0.00 C ATOM 2114 O LEU A 133 4.074 5.027 14.586 1.00 0.00 O ATOM 2115 CB LEU A 133 1.328 6.623 14.771 1.00 0.00 C ATOM 2116 CG LEU A 133 0.270 7.398 15.560 1.00 0.00 C ATOM 2117 CD1 LEU A 133 0.322 8.876 15.210 1.00 0.00 C ATOM 2118 CD2 LEU A 133 -1.116 6.831 15.291 1.00 0.00 C ATOM 0 H LEU A 133 3.371 6.102 16.728 1.00 0.00 H new ATOM 0 HA LEU A 133 1.045 4.668 15.637 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.165 7.289 14.564 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.904 6.336 13.809 1.00 0.00 H new ATOM 0 HG LEU A 133 0.484 7.290 16.623 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.437 9.412 15.780 1.00 0.00 H new ATOM 0 HD12 LEU A 133 1.307 9.273 15.454 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.133 9.004 14.144 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -1.856 7.394 15.860 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.341 6.908 14.227 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -1.146 5.784 15.593 1.00 0.00 H new ATOM 2130 N PHE A 134 2.422 3.733 13.765 1.00 0.00 N ATOM 2131 CA PHE A 134 3.286 3.010 12.839 1.00 0.00 C ATOM 2132 C PHE A 134 3.192 3.626 11.447 1.00 0.00 C ATOM 2133 O PHE A 134 2.229 3.387 10.719 1.00 0.00 O ATOM 2134 CB PHE A 134 2.888 1.533 12.780 1.00 0.00 C ATOM 2135 CG PHE A 134 3.288 0.748 13.995 1.00 0.00 C ATOM 2136 CD1 PHE A 134 2.531 0.805 15.154 1.00 0.00 C ATOM 2137 CD2 PHE A 134 4.420 -0.052 13.979 1.00 0.00 C ATOM 2138 CE1 PHE A 134 2.893 0.080 16.273 1.00 0.00 C ATOM 2139 CE2 PHE A 134 4.788 -0.779 15.095 1.00 0.00 C ATOM 2140 CZ PHE A 134 4.024 -0.713 16.244 1.00 0.00 C ATOM 0 H PHE A 134 1.445 3.443 13.740 1.00 0.00 H new ATOM 0 HA PHE A 134 4.314 3.083 13.195 1.00 0.00 H new ATOM 0 HB2 PHE A 134 1.808 1.462 12.653 1.00 0.00 H new ATOM 0 HB3 PHE A 134 3.343 1.079 11.900 1.00 0.00 H new ATOM 0 HD1 PHE A 134 1.647 1.424 15.183 1.00 0.00 H new ATOM 0 HD2 PHE A 134 5.021 -0.108 13.084 1.00 0.00 H new ATOM 0 HE1 PHE A 134 2.293 0.133 17.169 1.00 0.00 H new ATOM 0 HE2 PHE A 134 5.672 -1.398 15.069 1.00 0.00 H new ATOM 0 HZ PHE A 134 4.310 -1.280 17.118 1.00 0.00 H new ATOM 2150 N LYS A 135 4.185 4.429 11.087 1.00 0.00 N ATOM 2151 CA LYS A 135 4.195 5.089 9.786 1.00 0.00 C ATOM 2152 C LYS A 135 4.873 4.222 8.728 1.00 0.00 C ATOM 2153 O LYS A 135 5.838 3.516 9.013 1.00 0.00 O ATOM 2154 CB LYS A 135 4.900 6.442 9.885 1.00 0.00 C ATOM 2155 CG LYS A 135 4.036 7.527 10.510 1.00 0.00 C ATOM 2156 CD LYS A 135 4.811 8.345 11.531 1.00 0.00 C ATOM 2157 CE LYS A 135 4.015 8.531 12.813 1.00 0.00 C ATOM 2158 NZ LYS A 135 4.212 9.886 13.398 1.00 0.00 N ATOM 0 H LYS A 135 4.992 4.639 11.675 1.00 0.00 H new ATOM 0 HA LYS A 135 3.160 5.245 9.482 1.00 0.00 H new ATOM 0 HB2 LYS A 135 5.810 6.327 10.474 1.00 0.00 H new ATOM 0 HB3 LYS A 135 5.204 6.759 8.887 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.657 8.185 9.728 1.00 0.00 H new ATOM 0 HG3 LYS A 135 3.170 7.071 10.990 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.755 7.849 11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 135 5.056 9.319 11.108 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.956 8.375 12.608 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.315 7.775 13.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.652 9.972 14.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 5.219 10.026 13.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 3.902 10.607 12.716 1.00 0.00 H new ATOM 2172 N LEU A 136 4.358 4.287 7.503 1.00 0.00 N ATOM 2173 CA LEU A 136 4.909 3.512 6.397 1.00 0.00 C ATOM 2174 C LEU A 136 5.797 4.385 5.513 1.00 0.00 C ATOM 2175 O LEU A 136 5.386 5.457 5.071 1.00 0.00 O ATOM 2176 CB LEU A 136 3.775 2.902 5.564 1.00 0.00 C ATOM 2177 CG LEU A 136 4.206 2.230 4.256 1.00 0.00 C ATOM 2178 CD1 LEU A 136 4.385 0.733 4.457 1.00 0.00 C ATOM 2179 CD2 LEU A 136 3.189 2.502 3.157 1.00 0.00 C ATOM 0 H LEU A 136 3.559 4.869 7.252 1.00 0.00 H new ATOM 0 HA LEU A 136 5.519 2.709 6.811 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.254 2.166 6.176 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.057 3.688 5.329 1.00 0.00 H new ATOM 0 HG LEU A 136 5.164 2.653 3.952 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.691 0.274 3.517 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.150 0.556 5.213 1.00 0.00 H new ATOM 0 HD13 LEU A 136 3.442 0.295 4.785 1.00 0.00 H new ATOM 0 HD21 LEU A 136 3.511 2.017 2.235 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.218 2.107 3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.109 3.577 2.993 1.00 0.00 H new ATOM 2191 N ILE A 137 7.015 3.916 5.258 1.00 0.00 N ATOM 2192 CA ILE A 137 7.956 4.653 4.422 1.00 0.00 C ATOM 2193 C ILE A 137 8.640 3.726 3.421 1.00 0.00 C ATOM 2194 O ILE A 137 8.428 2.514 3.441 1.00 0.00 O ATOM 2195 CB ILE A 137 9.026 5.385 5.271 1.00 0.00 C ATOM 2196 CG1 ILE A 137 10.200 4.458 5.611 1.00 0.00 C ATOM 2197 CG2 ILE A 137 8.406 5.942 6.544 1.00 0.00 C ATOM 2198 CD1 ILE A 137 9.782 3.152 6.251 1.00 0.00 C ATOM 0 H ILE A 137 7.373 3.031 5.618 1.00 0.00 H new ATOM 0 HA ILE A 137 7.379 5.401 3.878 1.00 0.00 H new ATOM 0 HB ILE A 137 9.413 6.212 4.677 1.00 0.00 H new ATOM 0 HG12 ILE A 137 10.757 4.243 4.699 1.00 0.00 H new ATOM 0 HG13 ILE A 137 10.880 4.980 6.284 1.00 0.00 H new ATOM 0 HG21 ILE A 137 9.171 6.453 7.128 1.00 0.00 H new ATOM 0 HG22 ILE A 137 7.616 6.647 6.286 1.00 0.00 H new ATOM 0 HG23 ILE A 137 7.986 5.126 7.131 1.00 0.00 H new ATOM 0 HD11 ILE A 137 10.666 2.551 6.462 1.00 0.00 H new ATOM 0 HD12 ILE A 137 9.252 3.356 7.181 1.00 0.00 H new ATOM 0 HD13 ILE A 137 9.127 2.607 5.572 1.00 0.00 H new ATOM 2210 N LEU A 138 9.464 4.300 2.553 1.00 0.00 N ATOM 2211 CA LEU A 138 10.182 3.518 1.553 1.00 0.00 C ATOM 2212 C LEU A 138 11.657 3.407 1.921 1.00 0.00 C ATOM 2213 O LEU A 138 12.383 4.401 1.920 1.00 0.00 O ATOM 2214 CB LEU A 138 10.034 4.154 0.169 1.00 0.00 C ATOM 2215 CG LEU A 138 10.643 3.350 -0.980 1.00 0.00 C ATOM 2216 CD1 LEU A 138 9.746 2.179 -1.347 1.00 0.00 C ATOM 2217 CD2 LEU A 138 10.877 4.244 -2.190 1.00 0.00 C ATOM 0 H LEU A 138 9.652 5.302 2.521 1.00 0.00 H new ATOM 0 HA LEU A 138 9.751 2.517 1.527 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.974 4.303 -0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 138 10.497 5.141 0.188 1.00 0.00 H new ATOM 0 HG LEU A 138 11.605 2.955 -0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.196 1.619 -2.167 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.628 1.526 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 138 8.769 2.552 -1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.311 3.656 -2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 138 9.928 4.668 -2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 138 11.560 5.050 -1.921 1.00 0.00 H new ATOM 2229 N LYS A 139 12.094 2.194 2.242 1.00 0.00 N ATOM 2230 CA LYS A 139 13.482 1.963 2.621 1.00 0.00 C ATOM 2231 C LYS A 139 13.911 0.536 2.298 1.00 0.00 C ATOM 2232 O LYS A 139 13.126 -0.260 1.781 1.00 0.00 O ATOM 2233 CB LYS A 139 13.669 2.238 4.114 1.00 0.00 C ATOM 2234 CG LYS A 139 12.922 1.264 5.011 1.00 0.00 C ATOM 2235 CD LYS A 139 13.178 1.552 6.482 1.00 0.00 C ATOM 2236 CE LYS A 139 14.632 1.306 6.852 1.00 0.00 C ATOM 2237 NZ LYS A 139 14.876 1.511 8.307 1.00 0.00 N ATOM 0 H LYS A 139 11.509 1.359 2.247 1.00 0.00 H new ATOM 0 HA LYS A 139 14.108 2.645 2.046 1.00 0.00 H new ATOM 0 HB2 LYS A 139 14.732 2.196 4.352 1.00 0.00 H new ATOM 0 HB3 LYS A 139 13.333 3.251 4.333 1.00 0.00 H new ATOM 0 HG2 LYS A 139 11.853 1.327 4.808 1.00 0.00 H new ATOM 0 HG3 LYS A 139 13.231 0.245 4.780 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.915 2.587 6.703 1.00 0.00 H new ATOM 0 HD3 LYS A 139 12.534 0.922 7.095 1.00 0.00 H new ATOM 0 HE2 LYS A 139 14.910 0.288 6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 139 15.271 1.977 6.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 15.879 1.334 8.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 14.635 2.489 8.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 14.285 0.853 8.854 1.00 0.00 H new ATOM 2251 N LYS A 140 15.162 0.219 2.614 1.00 0.00 N ATOM 2252 CA LYS A 140 15.704 -1.112 2.369 1.00 0.00 C ATOM 2253 C LYS A 140 16.248 -1.715 3.659 1.00 0.00 C ATOM 2254 O LYS A 140 17.056 -1.095 4.352 1.00 0.00 O ATOM 2255 CB LYS A 140 16.808 -1.053 1.312 1.00 0.00 C ATOM 2256 CG LYS A 140 17.466 -2.398 1.042 1.00 0.00 C ATOM 2257 CD LYS A 140 17.302 -2.821 -0.408 1.00 0.00 C ATOM 2258 CE LYS A 140 16.090 -3.718 -0.592 1.00 0.00 C ATOM 2259 NZ LYS A 140 15.387 -3.443 -1.875 1.00 0.00 N ATOM 0 H LYS A 140 15.822 0.869 3.042 1.00 0.00 H new ATOM 0 HA LYS A 140 14.898 -1.746 2.000 1.00 0.00 H new ATOM 0 HB2 LYS A 140 16.389 -0.670 0.382 1.00 0.00 H new ATOM 0 HB3 LYS A 140 17.570 -0.343 1.634 1.00 0.00 H new ATOM 0 HG2 LYS A 140 18.527 -2.340 1.287 1.00 0.00 H new ATOM 0 HG3 LYS A 140 17.029 -3.155 1.694 1.00 0.00 H new ATOM 0 HD2 LYS A 140 17.200 -1.937 -1.037 1.00 0.00 H new ATOM 0 HD3 LYS A 140 18.198 -3.346 -0.739 1.00 0.00 H new ATOM 0 HE2 LYS A 140 16.403 -4.762 -0.566 1.00 0.00 H new ATOM 0 HE3 LYS A 140 15.400 -3.571 0.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 14.650 -4.161 -2.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 14.949 -2.501 -1.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 16.070 -3.475 -2.659 1.00 0.00 H new ATOM 2273 N GLU A 141 15.805 -2.925 3.976 1.00 0.00 N ATOM 2274 CA GLU A 141 16.244 -3.612 5.172 1.00 0.00 C ATOM 2275 C GLU A 141 17.425 -4.526 4.831 1.00 0.00 C ATOM 2276 O GLU A 141 17.703 -4.770 3.657 1.00 0.00 O ATOM 2277 CB GLU A 141 15.052 -4.388 5.757 1.00 0.00 C ATOM 2278 CG GLU A 141 15.424 -5.546 6.659 1.00 0.00 C ATOM 2279 CD GLU A 141 15.885 -5.099 8.033 1.00 0.00 C ATOM 2280 OE1 GLU A 141 15.237 -4.203 8.614 1.00 0.00 O ATOM 2281 OE2 GLU A 141 16.896 -5.642 8.525 1.00 0.00 O ATOM 0 H GLU A 141 15.136 -3.450 3.412 1.00 0.00 H new ATOM 0 HA GLU A 141 16.591 -2.905 5.926 1.00 0.00 H new ATOM 0 HB2 GLU A 141 14.427 -3.695 6.320 1.00 0.00 H new ATOM 0 HB3 GLU A 141 14.446 -4.768 4.935 1.00 0.00 H new ATOM 0 HG2 GLU A 141 14.564 -6.207 6.767 1.00 0.00 H new ATOM 0 HG3 GLU A 141 16.216 -6.128 6.187 1.00 0.00 H new ATOM 2288 N ASP A 142 18.129 -5.011 5.849 1.00 0.00 N ATOM 2289 CA ASP A 142 19.290 -5.876 5.633 1.00 0.00 C ATOM 2290 C ASP A 142 18.886 -7.322 5.331 1.00 0.00 C ATOM 2291 O ASP A 142 19.716 -8.228 5.402 1.00 0.00 O ATOM 2292 CB ASP A 142 20.201 -5.842 6.861 1.00 0.00 C ATOM 2293 CG ASP A 142 21.655 -6.093 6.509 1.00 0.00 C ATOM 2294 OD1 ASP A 142 22.220 -5.305 5.723 1.00 0.00 O ATOM 2295 OD2 ASP A 142 22.228 -7.077 7.022 1.00 0.00 O ATOM 0 H ASP A 142 17.919 -4.822 6.829 1.00 0.00 H new ATOM 0 HA ASP A 142 19.823 -5.493 4.763 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.111 -4.872 7.350 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.869 -6.593 7.578 1.00 0.00 H new ATOM 2300 N GLU A 143 17.619 -7.530 4.980 1.00 0.00 N ATOM 2301 CA GLU A 143 17.113 -8.860 4.655 1.00 0.00 C ATOM 2302 C GLU A 143 15.821 -8.750 3.856 1.00 0.00 C ATOM 2303 O GLU A 143 14.847 -8.152 4.316 1.00 0.00 O ATOM 2304 CB GLU A 143 16.857 -9.680 5.925 1.00 0.00 C ATOM 2305 CG GLU A 143 18.009 -9.669 6.914 1.00 0.00 C ATOM 2306 CD GLU A 143 17.760 -10.573 8.106 1.00 0.00 C ATOM 2307 OE1 GLU A 143 16.960 -10.191 8.985 1.00 0.00 O ATOM 2308 OE2 GLU A 143 18.366 -11.664 8.160 1.00 0.00 O ATOM 0 H GLU A 143 16.921 -6.789 4.913 1.00 0.00 H new ATOM 0 HA GLU A 143 17.871 -9.368 4.059 1.00 0.00 H new ATOM 0 HB2 GLU A 143 15.965 -9.295 6.419 1.00 0.00 H new ATOM 0 HB3 GLU A 143 16.645 -10.711 5.642 1.00 0.00 H new ATOM 0 HG2 GLU A 143 18.921 -9.984 6.408 1.00 0.00 H new ATOM 0 HG3 GLU A 143 18.174 -8.650 7.263 1.00 0.00 H new ATOM 2315 N LEU A 144 15.814 -9.325 2.662 1.00 0.00 N ATOM 2316 CA LEU A 144 14.633 -9.283 1.808 1.00 0.00 C ATOM 2317 C LEU A 144 13.532 -10.186 2.355 1.00 0.00 C ATOM 2318 O LEU A 144 12.354 -9.993 2.058 1.00 0.00 O ATOM 2319 CB LEU A 144 14.994 -9.694 0.378 1.00 0.00 C ATOM 2320 CG LEU A 144 16.076 -8.845 -0.297 1.00 0.00 C ATOM 2321 CD1 LEU A 144 15.969 -8.947 -1.811 1.00 0.00 C ATOM 2322 CD2 LEU A 144 15.982 -7.389 0.143 1.00 0.00 C ATOM 0 H LEU A 144 16.609 -9.824 2.263 1.00 0.00 H new ATOM 0 HA LEU A 144 14.260 -8.259 1.796 1.00 0.00 H new ATOM 0 HB2 LEU A 144 15.325 -10.732 0.389 1.00 0.00 H new ATOM 0 HB3 LEU A 144 14.092 -9.654 -0.232 1.00 0.00 H new ATOM 0 HG LEU A 144 17.047 -9.232 0.011 1.00 0.00 H new ATOM 0 HD11 LEU A 144 16.746 -8.337 -2.273 1.00 0.00 H new ATOM 0 HD12 LEU A 144 16.095 -9.986 -2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 144 14.990 -8.591 -2.131 1.00 0.00 H new ATOM 0 HD21 LEU A 144 16.761 -6.809 -0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 144 15.005 -6.989 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 144 16.112 -7.326 1.223 1.00 0.00 H new ATOM 2334 N GLY A 145 13.922 -11.169 3.162 1.00 0.00 N ATOM 2335 CA GLY A 145 12.952 -12.078 3.742 1.00 0.00 C ATOM 2336 C GLY A 145 12.548 -11.672 5.146 1.00 0.00 C ATOM 2337 O GLY A 145 12.048 -12.491 5.916 1.00 0.00 O ATOM 0 H GLY A 145 14.891 -11.351 3.424 1.00 0.00 H new ATOM 0 HA2 GLY A 145 12.066 -12.113 3.108 1.00 0.00 H new ATOM 0 HA3 GLY A 145 13.369 -13.085 3.763 1.00 0.00 H new ATOM 2341 N ASP A 146 12.767 -10.402 5.480 1.00 0.00 N ATOM 2342 CA ASP A 146 12.424 -9.889 6.802 1.00 0.00 C ATOM 2343 C ASP A 146 10.949 -9.505 6.873 1.00 0.00 C ATOM 2344 O ASP A 146 10.465 -8.711 6.067 1.00 0.00 O ATOM 2345 CB ASP A 146 13.291 -8.676 7.145 1.00 0.00 C ATOM 2346 CG ASP A 146 13.632 -8.608 8.621 1.00 0.00 C ATOM 2347 OD1 ASP A 146 12.757 -8.939 9.448 1.00 0.00 O ATOM 2348 OD2 ASP A 146 14.774 -8.222 8.949 1.00 0.00 O ATOM 0 H ASP A 146 13.180 -9.711 4.854 1.00 0.00 H new ATOM 0 HA ASP A 146 12.612 -10.680 7.528 1.00 0.00 H new ATOM 0 HB2 ASP A 146 14.212 -8.715 6.564 1.00 0.00 H new ATOM 0 HB3 ASP A 146 12.768 -7.765 6.853 1.00 0.00 H new ATOM 2353 N ARG A 147 10.241 -10.072 7.845 1.00 0.00 N ATOM 2354 CA ARG A 147 8.821 -9.787 8.023 1.00 0.00 C ATOM 2355 C ARG A 147 8.570 -8.290 8.164 1.00 0.00 C ATOM 2356 O ARG A 147 7.515 -7.789 7.775 1.00 0.00 O ATOM 2357 CB ARG A 147 8.286 -10.504 9.260 1.00 0.00 C ATOM 2358 CG ARG A 147 9.010 -10.127 10.539 1.00 0.00 C ATOM 2359 CD ARG A 147 8.031 -9.654 11.591 1.00 0.00 C ATOM 2360 NE ARG A 147 8.118 -8.213 11.817 1.00 0.00 N ATOM 2361 CZ ARG A 147 7.527 -7.584 12.830 1.00 0.00 C ATOM 2362 NH1 ARG A 147 6.811 -8.266 13.716 1.00 0.00 N ATOM 2363 NH2 ARG A 147 7.653 -6.271 12.960 1.00 0.00 N ATOM 0 H ARG A 147 10.627 -10.731 8.521 1.00 0.00 H new ATOM 0 HA ARG A 147 8.300 -10.147 7.136 1.00 0.00 H new ATOM 0 HB2 ARG A 147 7.226 -10.277 9.372 1.00 0.00 H new ATOM 0 HB3 ARG A 147 8.367 -11.581 9.110 1.00 0.00 H new ATOM 0 HG2 ARG A 147 9.567 -10.986 10.914 1.00 0.00 H new ATOM 0 HG3 ARG A 147 9.737 -9.341 10.333 1.00 0.00 H new ATOM 0 HD2 ARG A 147 7.017 -9.911 11.284 1.00 0.00 H new ATOM 0 HD3 ARG A 147 8.224 -10.179 12.527 1.00 0.00 H new ATOM 0 HE ARG A 147 8.664 -7.656 11.159 1.00 0.00 H new ATOM 0 HH11 ARG A 147 6.712 -9.277 13.622 1.00 0.00 H new ATOM 0 HH12 ARG A 147 6.360 -7.779 14.491 1.00 0.00 H new ATOM 0 HH21 ARG A 147 8.203 -5.742 12.283 1.00 0.00 H new ATOM 0 HH22 ARG A 147 7.200 -5.790 13.737 1.00 0.00 H new ATOM 2377 N SER A 148 9.541 -7.582 8.731 1.00 0.00 N ATOM 2378 CA SER A 148 9.419 -6.143 8.935 1.00 0.00 C ATOM 2379 C SER A 148 9.079 -5.427 7.632 1.00 0.00 C ATOM 2380 O SER A 148 8.419 -4.386 7.638 1.00 0.00 O ATOM 2381 CB SER A 148 10.716 -5.576 9.516 1.00 0.00 C ATOM 2382 OG SER A 148 10.810 -5.835 10.905 1.00 0.00 O ATOM 0 H SER A 148 10.421 -7.981 9.057 1.00 0.00 H new ATOM 0 HA SER A 148 8.606 -5.975 9.641 1.00 0.00 H new ATOM 0 HB2 SER A 148 11.571 -6.016 9.002 1.00 0.00 H new ATOM 0 HB3 SER A 148 10.757 -4.501 9.340 1.00 0.00 H new ATOM 0 HG SER A 148 11.648 -5.464 11.251 1.00 0.00 H new ATOM 2388 N ILE A 149 9.532 -5.988 6.516 1.00 0.00 N ATOM 2389 CA ILE A 149 9.275 -5.400 5.207 1.00 0.00 C ATOM 2390 C ILE A 149 8.190 -6.166 4.453 1.00 0.00 C ATOM 2391 O ILE A 149 8.051 -6.025 3.238 1.00 0.00 O ATOM 2392 CB ILE A 149 10.554 -5.369 4.350 1.00 0.00 C ATOM 2393 CG1 ILE A 149 11.203 -6.753 4.319 1.00 0.00 C ATOM 2394 CG2 ILE A 149 11.527 -4.333 4.889 1.00 0.00 C ATOM 2395 CD1 ILE A 149 12.242 -6.909 3.232 1.00 0.00 C ATOM 0 H ILE A 149 10.079 -6.849 6.492 1.00 0.00 H new ATOM 0 HA ILE A 149 8.933 -4.380 5.383 1.00 0.00 H new ATOM 0 HB ILE A 149 10.286 -5.090 3.331 1.00 0.00 H new ATOM 0 HG12 ILE A 149 11.668 -6.949 5.285 1.00 0.00 H new ATOM 0 HG13 ILE A 149 10.427 -7.506 4.180 1.00 0.00 H new ATOM 0 HG21 ILE A 149 12.426 -4.323 4.273 1.00 0.00 H new ATOM 0 HG22 ILE A 149 11.060 -3.348 4.866 1.00 0.00 H new ATOM 0 HG23 ILE A 149 11.794 -4.584 5.916 1.00 0.00 H new ATOM 0 HD11 ILE A 149 12.660 -7.915 3.270 1.00 0.00 H new ATOM 0 HD12 ILE A 149 11.778 -6.745 2.259 1.00 0.00 H new ATOM 0 HD13 ILE A 149 13.038 -6.180 3.382 1.00 0.00 H new ATOM 2407 N MET A 150 7.422 -6.972 5.180 1.00 0.00 N ATOM 2408 CA MET A 150 6.348 -7.755 4.577 1.00 0.00 C ATOM 2409 C MET A 150 5.012 -7.456 5.251 1.00 0.00 C ATOM 2410 O MET A 150 4.889 -7.546 6.472 1.00 0.00 O ATOM 2411 CB MET A 150 6.660 -9.250 4.677 1.00 0.00 C ATOM 2412 CG MET A 150 8.000 -9.631 4.069 1.00 0.00 C ATOM 2413 SD MET A 150 8.105 -11.386 3.667 1.00 0.00 S ATOM 2414 CE MET A 150 8.994 -12.008 5.093 1.00 0.00 C ATOM 0 H MET A 150 7.523 -7.100 6.187 1.00 0.00 H new ATOM 0 HA MET A 150 6.275 -7.476 3.526 1.00 0.00 H new ATOM 0 HB2 MET A 150 6.648 -9.546 5.726 1.00 0.00 H new ATOM 0 HB3 MET A 150 5.871 -9.812 4.178 1.00 0.00 H new ATOM 0 HG2 MET A 150 8.165 -9.044 3.165 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.798 -9.373 4.766 1.00 0.00 H new ATOM 0 HE1 MET A 150 9.399 -12.994 4.867 1.00 0.00 H new ATOM 0 HE2 MET A 150 9.810 -11.328 5.338 1.00 0.00 H new ATOM 0 HE3 MET A 150 8.314 -12.081 5.942 1.00 0.00 H new ATOM 2424 N PHE A 151 4.016 -7.099 4.447 1.00 0.00 N ATOM 2425 CA PHE A 151 2.690 -6.784 4.966 1.00 0.00 C ATOM 2426 C PHE A 151 1.669 -7.827 4.522 1.00 0.00 C ATOM 2427 O PHE A 151 1.997 -8.759 3.788 1.00 0.00 O ATOM 2428 CB PHE A 151 2.252 -5.396 4.496 1.00 0.00 C ATOM 2429 CG PHE A 151 3.315 -4.346 4.653 1.00 0.00 C ATOM 2430 CD1 PHE A 151 3.940 -4.151 5.874 1.00 0.00 C ATOM 2431 CD2 PHE A 151 3.688 -3.555 3.578 1.00 0.00 C ATOM 2432 CE1 PHE A 151 4.918 -3.185 6.020 1.00 0.00 C ATOM 2433 CE2 PHE A 151 4.666 -2.588 3.719 1.00 0.00 C ATOM 2434 CZ PHE A 151 5.282 -2.404 4.942 1.00 0.00 C ATOM 0 H PHE A 151 4.102 -7.021 3.434 1.00 0.00 H new ATOM 0 HA PHE A 151 2.743 -6.793 6.055 1.00 0.00 H new ATOM 0 HB2 PHE A 151 1.960 -5.452 3.447 1.00 0.00 H new ATOM 0 HB3 PHE A 151 1.368 -5.093 5.057 1.00 0.00 H new ATOM 0 HD1 PHE A 151 3.660 -4.760 6.721 1.00 0.00 H new ATOM 0 HD2 PHE A 151 3.210 -3.695 2.620 1.00 0.00 H new ATOM 0 HE1 PHE A 151 5.397 -3.042 6.977 1.00 0.00 H new ATOM 0 HE2 PHE A 151 4.948 -1.977 2.874 1.00 0.00 H new ATOM 0 HZ PHE A 151 6.047 -1.650 5.054 1.00 0.00 H new ATOM 2444 N THR A 152 0.429 -7.663 4.973 1.00 0.00 N ATOM 2445 CA THR A 152 -0.642 -8.589 4.621 1.00 0.00 C ATOM 2446 C THR A 152 -1.732 -7.876 3.829 1.00 0.00 C ATOM 2447 O THR A 152 -2.132 -6.762 4.168 1.00 0.00 O ATOM 2448 CB THR A 152 -1.240 -9.219 5.883 1.00 0.00 C ATOM 2449 OG1 THR A 152 -0.402 -8.994 7.003 1.00 0.00 O ATOM 2450 CG2 THR A 152 -1.452 -10.713 5.762 1.00 0.00 C ATOM 0 H THR A 152 0.141 -6.898 5.583 1.00 0.00 H new ATOM 0 HA THR A 152 -0.219 -9.377 3.999 1.00 0.00 H new ATOM 0 HB THR A 152 -2.210 -8.739 6.013 1.00 0.00 H new ATOM 0 HG1 THR A 152 -0.803 -9.403 7.799 1.00 0.00 H new ATOM 0 HG21 THR A 152 -1.878 -11.096 6.689 1.00 0.00 H new ATOM 0 HG22 THR A 152 -2.135 -10.918 4.937 1.00 0.00 H new ATOM 0 HG23 THR A 152 -0.496 -11.202 5.572 1.00 0.00 H new ATOM 2458 N VAL A 153 -2.208 -8.523 2.771 1.00 0.00 N ATOM 2459 CA VAL A 153 -3.250 -7.947 1.931 1.00 0.00 C ATOM 2460 C VAL A 153 -4.422 -8.909 1.771 1.00 0.00 C ATOM 2461 O VAL A 153 -4.259 -10.027 1.282 1.00 0.00 O ATOM 2462 CB VAL A 153 -2.716 -7.578 0.533 1.00 0.00 C ATOM 2463 CG1 VAL A 153 -3.713 -6.696 -0.201 1.00 0.00 C ATOM 2464 CG2 VAL A 153 -1.359 -6.890 0.633 1.00 0.00 C ATOM 0 H VAL A 153 -1.889 -9.446 2.475 1.00 0.00 H new ATOM 0 HA VAL A 153 -3.588 -7.040 2.433 1.00 0.00 H new ATOM 0 HB VAL A 153 -2.585 -8.498 -0.036 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.320 -6.445 -1.186 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.657 -7.229 -0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -3.877 -5.781 0.368 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -1.003 -6.640 -0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.456 -5.978 1.223 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -0.646 -7.559 1.114 1.00 0.00 H new ATOM 2474 N GLN A 154 -5.605 -8.466 2.185 1.00 0.00 N ATOM 2475 CA GLN A 154 -6.807 -9.285 2.087 1.00 0.00 C ATOM 2476 C GLN A 154 -7.800 -8.674 1.102 1.00 0.00 C ATOM 2477 O GLN A 154 -7.706 -7.495 0.765 1.00 0.00 O ATOM 2478 CB GLN A 154 -7.458 -9.439 3.464 1.00 0.00 C ATOM 2479 CG GLN A 154 -7.711 -10.886 3.858 1.00 0.00 C ATOM 2480 CD GLN A 154 -8.763 -11.018 4.941 1.00 0.00 C ATOM 2481 OE1 GLN A 154 -9.622 -11.898 4.884 1.00 0.00 O ATOM 2482 NE2 GLN A 154 -8.701 -10.142 5.937 1.00 0.00 N ATOM 0 H GLN A 154 -5.756 -7.543 2.592 1.00 0.00 H new ATOM 0 HA GLN A 154 -6.520 -10.270 1.720 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -6.818 -8.973 4.214 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -8.404 -8.898 3.472 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -8.027 -11.448 2.979 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -6.779 -11.333 4.205 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -7.972 -9.429 5.944 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -9.382 -10.182 6.695 1.00 0.00 H new ATOM 2491 N ASN A 155 -8.748 -9.482 0.643 1.00 0.00 N ATOM 2492 CA ASN A 155 -9.754 -9.015 -0.303 1.00 0.00 C ATOM 2493 C ASN A 155 -10.985 -8.488 0.428 1.00 0.00 C ATOM 2494 O ASN A 155 -11.487 -9.123 1.356 1.00 0.00 O ATOM 2495 CB ASN A 155 -10.155 -10.144 -1.256 1.00 0.00 C ATOM 2496 CG ASN A 155 -10.515 -11.420 -0.523 1.00 0.00 C ATOM 2497 OD1 ASN A 155 -11.335 -11.413 0.396 1.00 0.00 O ATOM 2498 ND2 ASN A 155 -9.903 -12.527 -0.926 1.00 0.00 N ATOM 0 H ASN A 155 -8.841 -10.462 0.910 1.00 0.00 H new ATOM 0 HA ASN A 155 -9.320 -8.199 -0.882 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -11.005 -9.822 -1.858 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -9.334 -10.343 -1.944 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -10.106 -13.417 -0.470 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -9.230 -12.488 -1.692 1.00 0.00 H new ATOM 2505 N GLU A 156 -11.466 -7.324 0.004 1.00 0.00 N ATOM 2506 CA GLU A 156 -12.638 -6.711 0.619 1.00 0.00 C ATOM 2507 C GLU A 156 -13.770 -6.562 -0.395 1.00 0.00 C ATOM 2508 O GLU A 156 -13.735 -5.680 -1.253 1.00 0.00 O ATOM 2509 CB GLU A 156 -12.276 -5.344 1.205 1.00 0.00 C ATOM 2510 CG GLU A 156 -12.648 -5.193 2.671 1.00 0.00 C ATOM 2511 CD GLU A 156 -12.965 -3.759 3.049 1.00 0.00 C ATOM 2512 OE1 GLU A 156 -13.426 -3.003 2.168 1.00 0.00 O ATOM 2513 OE2 GLU A 156 -12.753 -3.393 4.224 1.00 0.00 O ATOM 0 H GLU A 156 -11.062 -6.786 -0.763 1.00 0.00 H new ATOM 0 HA GLU A 156 -12.980 -7.363 1.423 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -11.204 -5.182 1.092 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -12.778 -4.567 0.629 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -13.511 -5.821 2.889 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -11.826 -5.554 3.289 1.00 0.00 H new