USER MOD reduce.3.24.130724 H: found=0, std=0, add=1400, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1398 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: B 200 GLN : amide:sc= -0.119 X(o=0.41,f=0.61) USER MOD Set 1.2: B 203 GLN : amide:sc= 0.528 X(o=0.41,f=0.61) USER MOD Set 2.1: A 81 THR OG1 : rot 180:sc= 0.144 USER MOD Set 2.2: B 184 THR OG1 : rot 89:sc= 0.146 USER MOD Set 3.1: B 150 ASN : amide:sc= 1.12 K(o=0.012,f=-4.1) USER MOD Set 3.2: B 151 HIS : no HE2:sc= -1.11 K(o=0.012,f=-5.7!) USER MOD Set 4.1: B 144 MET CE :methyl -136:sc= -0.0524 (180deg=-0.144) USER MOD Set 4.2: B 182 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: B 121 ASN : amide:sc= 0.0895 K(o=0.62,f=-7.5!) USER MOD Set 5.2: B 124 LYS NZ :NH3+ 177:sc= 0.53 (180deg=0.471) USER MOD Set 6.1: A 47 ASN : amide:sc= 1.07 K(o=-1.5,f=-3) USER MOD Set 6.2: A 48 HIS : no HE2:sc= -2.56! C(o=-1.5!,f=-3.2!) USER MOD Set 7.1: A 18 ASN : amide:sc= 0.126 K(o=0.69,f=-4!) USER MOD Set 7.2: A 21 LYS NZ :NH3+ 174:sc= 0.564 (180deg=0.532) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -170:sc= 1.45 USER MOD Single : A 10 LYS NZ :NH3+ 177:sc= 0.0536 (180deg=-0.0129) USER MOD Single : A 20 TYR OH : rot 90:sc= 1.12 USER MOD Single : A 22 TYR OH : rot 149:sc= 0.408 USER MOD Single : A 34 SER OG : rot 10:sc= 1.22 USER MOD Single : A 35 LYS NZ :NH3+ -138:sc= 0.42 (180deg=-1.67!) USER MOD Single : A 36 SER OG : rot 180:sc= 0.151 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 MET CE :methyl -161:sc= -0.0546 (180deg=-0.581) USER MOD Single : A 43 GLN : amide:sc= -0.307 X(o=-0.31,f=-0.23) USER MOD Single : A 44 LYS NZ :NH3+ 171:sc= 0.0758 (180deg=-0.158) USER MOD Single : A 49 MET CE :methyl -165:sc= -0.0417 (180deg=-0.417) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 72:sc= 1.16 USER MOD Single : A 55 ASN : amide:sc= -0.761 K(o=-0.76,f=-5.3!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc=-0.00103 X(o=-0.001,f=0) USER MOD Single : A 65 ASN : amide:sc= -0.0109 X(o=-0.011,f=-0.41) USER MOD Single : A 69 ASN : amide:sc= 0.0181 X(o=0.018,f=0) USER MOD Single : A 70 HIS : no HD1:sc= -0.29 K(o=-0.29,f=-2.3!) USER MOD Single : A 75 SER OG : rot -100:sc= 1.22 USER MOD Single : A 79 TYR OH : rot 159:sc= 0.77 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 GLN : amide:sc= -0.365 X(o=-0.37,f=-0.12) USER MOD Single : A 99 GLN : amide:sc= 0.81 K(o=0.81,f=0) USER MOD Single : B 108 TYR OH : rot 180:sc= 0 USER MOD Single : B 109 THR OG1 : rot -153:sc= 0.467 USER MOD Single : B 113 LYS NZ :NH3+ -176:sc= 1.77 (180deg=1.61) USER MOD Single : B 123 TYR OH : rot 89:sc= 0.881 USER MOD Single : B 125 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot 23:sc= 1.33 USER MOD Single : B 138 LYS NZ :NH3+ -138:sc= -0.0116 (180deg=-2.5!) USER MOD Single : B 139 SER OG : rot 180:sc= 0.147 USER MOD Single : B 140 SER OG : rot 180:sc= 0 USER MOD Single : B 146 GLN : amide:sc= -0.691 X(o=-0.69,f=-0.61) USER MOD Single : B 147 LYS NZ :NH3+ -133:sc= 1.25 (180deg=0.977) USER MOD Single : B 152 MET CE :methyl 138:sc= -0.389 (180deg=-3.19) USER MOD Single : B 154 SER OG : rot 180:sc= 0 USER MOD Single : B 156 THR OG1 : rot 180:sc= 0 USER MOD Single : B 158 ASN : amide:sc= -0.437 K(o=-0.44,f=-4.9!) USER MOD Single : B 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 167 GLN : amide:sc= -0.429 X(o=-0.43,f=-0.18) USER MOD Single : B 168 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 172 ASN : amide:sc=-0.00798 X(o=-0.008,f=0) USER MOD Single : B 173 HIS : no HD1:sc= -0.541 K(o=-0.54,f=-2.3) USER MOD Single : B 178 SER OG : rot -146:sc= 1.17 USER MOD Single : B 190 THR OG1 : rot 180:sc= 0 USER MOD Single : B 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 198 HIS : no HD1:sc= -0.118 K(o=-0.12,f=-0.67) USER MOD Single : B 202 GLN : amide:sc= 0.134 X(o=0.13,f=-0.069) USER MOD ----------------------------------------------------------------- ATOM 37 N TYR A 5 -13.755 12.132 4.842 1.00 1.27 N ATOM 38 CA TYR A 5 -12.891 11.133 4.181 1.00 1.20 C ATOM 39 C TYR A 5 -11.456 11.668 4.001 1.00 1.18 C ATOM 40 O TYR A 5 -11.179 12.439 3.077 1.00 1.48 O ATOM 41 CB TYR A 5 -13.493 10.531 2.894 1.00 1.36 C ATOM 42 CG TYR A 5 -14.474 9.389 3.117 1.00 1.38 C ATOM 43 CD1 TYR A 5 -15.550 9.512 4.021 1.00 2.34 C ATOM 44 CD2 TYR A 5 -14.284 8.172 2.433 1.00 2.06 C ATOM 45 CE1 TYR A 5 -16.423 8.427 4.242 1.00 2.41 C ATOM 46 CE2 TYR A 5 -15.146 7.084 2.656 1.00 2.10 C ATOM 47 CZ TYR A 5 -16.214 7.205 3.567 1.00 1.56 C ATOM 48 OH TYR A 5 -17.032 6.145 3.811 1.00 1.71 O ATOM 0 HA TYR A 5 -12.831 10.281 4.858 1.00 1.20 H new ATOM 0 HB2 TYR A 5 -14.000 11.323 2.343 1.00 1.36 H new ATOM 0 HB3 TYR A 5 -12.679 10.173 2.263 1.00 1.36 H new ATOM 0 HD1 TYR A 5 -15.706 10.442 4.547 1.00 2.34 H new ATOM 0 HD2 TYR A 5 -13.469 8.074 1.731 1.00 2.06 H new ATOM 0 HE1 TYR A 5 -17.251 8.531 4.927 1.00 2.41 H new ATOM 0 HE2 TYR A 5 -14.989 6.155 2.129 1.00 2.10 H new ATOM 0 HH TYR A 5 -16.751 5.382 3.263 1.00 1.71 H new ATOM 58 N THR A 6 -10.540 11.280 4.908 1.00 1.01 N ATOM 59 CA THR A 6 -9.107 11.641 4.838 1.00 0.84 C ATOM 60 C THR A 6 -8.522 11.161 3.515 1.00 0.74 C ATOM 61 O THR A 6 -8.919 10.102 3.038 1.00 0.80 O ATOM 62 CB THR A 6 -8.293 11.026 5.991 1.00 0.71 C ATOM 63 OG1 THR A 6 -8.349 9.627 5.867 1.00 1.00 O ATOM 64 CG2 THR A 6 -8.789 11.413 7.380 1.00 1.07 C ATOM 0 H THR A 6 -10.773 10.703 5.716 1.00 1.01 H new ATOM 0 HA THR A 6 -9.044 12.726 4.919 1.00 0.84 H new ATOM 0 HB THR A 6 -7.278 11.414 5.907 1.00 0.71 H new ATOM 0 HG1 THR A 6 -7.977 9.212 6.673 1.00 1.00 H new ATOM 0 HG21 THR A 6 -8.162 10.939 8.135 1.00 1.07 H new ATOM 0 HG22 THR A 6 -8.740 12.496 7.495 1.00 1.07 H new ATOM 0 HG23 THR A 6 -9.820 11.081 7.504 1.00 1.07 H new ATOM 72 N GLU A 7 -7.537 11.870 2.958 1.00 0.70 N ATOM 73 CA GLU A 7 -6.871 11.409 1.746 1.00 0.63 C ATOM 74 C GLU A 7 -6.225 10.038 1.950 1.00 0.59 C ATOM 75 O GLU A 7 -6.200 9.240 1.029 1.00 0.75 O ATOM 76 CB GLU A 7 -5.829 12.435 1.293 1.00 0.65 C ATOM 77 CG GLU A 7 -5.273 12.160 -0.110 1.00 0.78 C ATOM 78 CD GLU A 7 -6.250 12.586 -1.196 1.00 1.20 C ATOM 79 OE1 GLU A 7 -7.339 11.980 -1.282 1.00 2.04 O ATOM 80 OE2 GLU A 7 -5.918 13.548 -1.926 1.00 2.28 O ATOM 0 H GLU A 7 -7.189 12.756 3.325 1.00 0.70 H new ATOM 0 HA GLU A 7 -7.625 11.304 0.966 1.00 0.63 H new ATOM 0 HB2 GLU A 7 -6.277 13.429 1.310 1.00 0.65 H new ATOM 0 HB3 GLU A 7 -5.005 12.445 2.007 1.00 0.65 H new ATOM 0 HG2 GLU A 7 -4.331 12.693 -0.239 1.00 0.78 H new ATOM 0 HG3 GLU A 7 -5.055 11.097 -0.213 1.00 0.78 H new ATOM 87 N LEU A 8 -5.762 9.723 3.166 1.00 0.54 N ATOM 88 CA LEU A 8 -5.186 8.420 3.485 1.00 0.56 C ATOM 89 C LEU A 8 -6.222 7.297 3.294 1.00 0.55 C ATOM 90 O LEU A 8 -5.914 6.262 2.698 1.00 0.57 O ATOM 91 CB LEU A 8 -4.609 8.459 4.918 1.00 0.64 C ATOM 92 CG LEU A 8 -3.250 7.750 5.053 1.00 0.76 C ATOM 93 CD1 LEU A 8 -2.797 7.749 6.518 1.00 1.11 C ATOM 94 CD2 LEU A 8 -3.263 6.312 4.524 1.00 0.74 C ATOM 0 H LEU A 8 -5.778 10.369 3.955 1.00 0.54 H new ATOM 0 HA LEU A 8 -4.370 8.198 2.797 1.00 0.56 H new ATOM 0 HB2 LEU A 8 -4.500 9.498 5.229 1.00 0.64 H new ATOM 0 HB3 LEU A 8 -5.321 7.995 5.600 1.00 0.64 H new ATOM 0 HG LEU A 8 -2.548 8.313 4.438 1.00 0.76 H new ATOM 0 HD11 LEU A 8 -1.834 7.245 6.601 1.00 1.11 H new ATOM 0 HD12 LEU A 8 -2.700 8.776 6.870 1.00 1.11 H new ATOM 0 HD13 LEU A 8 -3.534 7.225 7.126 1.00 1.11 H new ATOM 0 HD21 LEU A 8 -2.275 5.869 4.649 1.00 0.74 H new ATOM 0 HD22 LEU A 8 -3.996 5.727 5.080 1.00 0.74 H new ATOM 0 HD23 LEU A 8 -3.528 6.316 3.467 1.00 0.74 H new ATOM 106 N GLU A 9 -7.463 7.530 3.719 1.00 0.61 N ATOM 107 CA GLU A 9 -8.549 6.580 3.516 1.00 0.67 C ATOM 108 C GLU A 9 -8.975 6.557 2.039 1.00 0.69 C ATOM 109 O GLU A 9 -8.864 5.499 1.412 1.00 0.71 O ATOM 110 CB GLU A 9 -9.680 6.884 4.510 1.00 0.76 C ATOM 111 CG GLU A 9 -10.626 5.689 4.639 1.00 0.82 C ATOM 112 CD GLU A 9 -11.898 5.873 3.826 1.00 2.01 C ATOM 113 OE1 GLU A 9 -11.769 6.037 2.596 1.00 3.37 O ATOM 114 OE2 GLU A 9 -12.978 5.880 4.452 1.00 2.51 O ATOM 0 H GLU A 9 -7.740 8.379 4.211 1.00 0.61 H new ATOM 0 HA GLU A 9 -8.222 5.562 3.729 1.00 0.67 H new ATOM 0 HB2 GLU A 9 -9.258 7.126 5.485 1.00 0.76 H new ATOM 0 HB3 GLU A 9 -10.237 7.760 4.177 1.00 0.76 H new ATOM 0 HG2 GLU A 9 -10.114 4.785 4.309 1.00 0.82 H new ATOM 0 HG3 GLU A 9 -10.885 5.544 5.688 1.00 0.82 H new ATOM 121 N LYS A 10 -9.295 7.715 1.429 1.00 0.75 N ATOM 122 CA LYS A 10 -9.531 7.854 -0.016 1.00 0.88 C ATOM 123 C LYS A 10 -8.516 7.075 -0.852 1.00 0.60 C ATOM 124 O LYS A 10 -8.850 6.420 -1.835 1.00 0.60 O ATOM 125 CB LYS A 10 -9.367 9.327 -0.425 1.00 1.35 C ATOM 126 CG LYS A 10 -10.348 10.306 0.226 1.00 2.10 C ATOM 127 CD LYS A 10 -11.420 10.777 -0.753 1.00 2.85 C ATOM 128 CE LYS A 10 -11.005 11.972 -1.644 1.00 3.91 C ATOM 129 NZ LYS A 10 -9.754 11.755 -2.415 1.00 4.90 N ATOM 0 H LYS A 10 -9.398 8.593 1.938 1.00 0.75 H new ATOM 0 HA LYS A 10 -10.535 7.472 -0.199 1.00 0.88 H new ATOM 0 HB2 LYS A 10 -8.352 9.642 -0.183 1.00 1.35 H new ATOM 0 HB3 LYS A 10 -9.473 9.399 -1.507 1.00 1.35 H new ATOM 0 HG2 LYS A 10 -10.824 9.827 1.082 1.00 2.10 H new ATOM 0 HG3 LYS A 10 -9.801 11.168 0.607 1.00 2.10 H new ATOM 0 HD2 LYS A 10 -11.697 9.942 -1.396 1.00 2.85 H new ATOM 0 HD3 LYS A 10 -12.311 11.054 -0.189 1.00 2.85 H new ATOM 0 HE2 LYS A 10 -11.814 12.189 -2.341 1.00 3.91 H new ATOM 0 HE3 LYS A 10 -10.882 12.854 -1.015 1.00 3.91 H new ATOM 0 HZ1 LYS A 10 -9.574 12.579 -3.023 1.00 4.90 H new ATOM 0 HZ2 LYS A 10 -8.958 11.629 -1.757 1.00 4.90 H new ATOM 0 HZ3 LYS A 10 -9.853 10.905 -3.005 1.00 4.90 H new ATOM 143 N ALA A 11 -7.250 7.150 -0.469 1.00 0.49 N ATOM 144 CA ALA A 11 -6.143 6.521 -1.143 1.00 0.48 C ATOM 145 C ALA A 11 -6.166 5.004 -1.019 1.00 0.42 C ATOM 146 O ALA A 11 -5.976 4.338 -2.032 1.00 0.43 O ATOM 147 CB ALA A 11 -4.909 7.144 -0.535 1.00 0.54 C ATOM 0 H ALA A 11 -6.963 7.676 0.357 1.00 0.49 H new ATOM 0 HA ALA A 11 -6.181 6.688 -2.220 1.00 0.48 H new ATOM 0 HB1 ALA A 11 -4.020 6.716 -0.997 1.00 0.54 H new ATOM 0 HB2 ALA A 11 -4.924 8.221 -0.705 1.00 0.54 H new ATOM 0 HB3 ALA A 11 -4.892 6.946 0.537 1.00 0.54 H new ATOM 153 N VAL A 12 -6.477 4.456 0.157 1.00 0.42 N ATOM 154 CA VAL A 12 -6.778 3.019 0.275 1.00 0.49 C ATOM 155 C VAL A 12 -7.932 2.651 -0.669 1.00 0.55 C ATOM 156 O VAL A 12 -7.800 1.692 -1.433 1.00 0.62 O ATOM 157 CB VAL A 12 -7.094 2.600 1.733 1.00 0.66 C ATOM 158 CG1 VAL A 12 -7.659 1.176 1.796 1.00 0.90 C ATOM 159 CG2 VAL A 12 -5.830 2.637 2.602 1.00 0.72 C ATOM 0 H VAL A 12 -6.528 4.974 1.034 1.00 0.42 H new ATOM 0 HA VAL A 12 -5.886 2.466 -0.017 1.00 0.49 H new ATOM 0 HB VAL A 12 -7.832 3.310 2.106 1.00 0.66 H new ATOM 0 HG11 VAL A 12 -7.870 0.914 2.833 1.00 0.90 H new ATOM 0 HG12 VAL A 12 -8.579 1.124 1.214 1.00 0.90 H new ATOM 0 HG13 VAL A 12 -6.930 0.477 1.386 1.00 0.90 H new ATOM 0 HG21 VAL A 12 -6.080 2.339 3.620 1.00 0.72 H new ATOM 0 HG22 VAL A 12 -5.088 1.950 2.194 1.00 0.72 H new ATOM 0 HG23 VAL A 12 -5.423 3.648 2.610 1.00 0.72 H new ATOM 169 N ILE A 13 -9.018 3.441 -0.689 1.00 0.57 N ATOM 170 CA ILE A 13 -10.115 3.236 -1.651 1.00 0.64 C ATOM 171 C ILE A 13 -9.599 3.226 -3.096 1.00 0.61 C ATOM 172 O ILE A 13 -9.844 2.254 -3.809 1.00 0.66 O ATOM 173 CB ILE A 13 -11.304 4.203 -1.396 1.00 0.69 C ATOM 174 CG1 ILE A 13 -11.935 3.864 -0.023 1.00 0.62 C ATOM 175 CG2 ILE A 13 -12.321 4.150 -2.556 1.00 0.87 C ATOM 176 CD1 ILE A 13 -13.269 4.553 0.286 1.00 0.90 C ATOM 0 H ILE A 13 -9.160 4.225 -0.052 1.00 0.57 H new ATOM 0 HA ILE A 13 -10.531 2.242 -1.487 1.00 0.64 H new ATOM 0 HB ILE A 13 -10.950 5.233 -1.362 1.00 0.69 H new ATOM 0 HG12 ILE A 13 -12.084 2.786 0.031 1.00 0.62 H new ATOM 0 HG13 ILE A 13 -11.222 4.127 0.758 1.00 0.62 H new ATOM 0 HG21 ILE A 13 -13.143 4.836 -2.351 1.00 0.87 H new ATOM 0 HG22 ILE A 13 -11.829 4.440 -3.485 1.00 0.87 H new ATOM 0 HG23 ILE A 13 -12.710 3.137 -2.652 1.00 0.87 H new ATOM 0 HD11 ILE A 13 -13.619 4.244 1.271 1.00 0.90 H new ATOM 0 HD12 ILE A 13 -13.132 5.634 0.273 1.00 0.90 H new ATOM 0 HD13 ILE A 13 -14.007 4.272 -0.466 1.00 0.90 H new ATOM 188 N VAL A 14 -8.792 4.205 -3.500 1.00 0.52 N ATOM 189 CA VAL A 14 -8.279 4.318 -4.874 1.00 0.51 C ATOM 190 C VAL A 14 -7.348 3.155 -5.247 1.00 0.50 C ATOM 191 O VAL A 14 -7.450 2.603 -6.343 1.00 0.56 O ATOM 192 CB VAL A 14 -7.576 5.676 -5.014 1.00 0.46 C ATOM 193 CG1 VAL A 14 -6.687 5.798 -6.255 1.00 0.50 C ATOM 194 CG2 VAL A 14 -8.615 6.809 -4.989 1.00 0.60 C ATOM 0 H VAL A 14 -8.470 4.950 -2.882 1.00 0.52 H new ATOM 0 HA VAL A 14 -9.113 4.259 -5.573 1.00 0.51 H new ATOM 0 HB VAL A 14 -6.904 5.758 -4.160 1.00 0.46 H new ATOM 0 HG11 VAL A 14 -6.228 6.786 -6.278 1.00 0.50 H new ATOM 0 HG12 VAL A 14 -5.907 5.037 -6.220 1.00 0.50 H new ATOM 0 HG13 VAL A 14 -7.292 5.658 -7.151 1.00 0.50 H new ATOM 0 HG21 VAL A 14 -8.109 7.769 -5.089 1.00 0.60 H new ATOM 0 HG22 VAL A 14 -9.314 6.680 -5.815 1.00 0.60 H new ATOM 0 HG23 VAL A 14 -9.160 6.782 -4.045 1.00 0.60 H new ATOM 204 N LEU A 15 -6.460 2.735 -4.338 1.00 0.48 N ATOM 205 CA LEU A 15 -5.566 1.594 -4.555 1.00 0.51 C ATOM 206 C LEU A 15 -6.361 0.297 -4.768 1.00 0.58 C ATOM 207 O LEU A 15 -6.017 -0.482 -5.655 1.00 0.66 O ATOM 208 CB LEU A 15 -4.570 1.481 -3.376 1.00 0.51 C ATOM 209 CG LEU A 15 -3.199 2.128 -3.668 1.00 0.62 C ATOM 210 CD1 LEU A 15 -3.261 3.661 -3.648 1.00 0.94 C ATOM 211 CD2 LEU A 15 -2.141 1.687 -2.650 1.00 0.61 C ATOM 0 H LEU A 15 -6.342 3.180 -3.428 1.00 0.48 H new ATOM 0 HA LEU A 15 -4.993 1.758 -5.468 1.00 0.51 H new ATOM 0 HB2 LEU A 15 -5.006 1.953 -2.495 1.00 0.51 H new ATOM 0 HB3 LEU A 15 -4.423 0.428 -3.134 1.00 0.51 H new ATOM 0 HG LEU A 15 -2.924 1.791 -4.667 1.00 0.62 H new ATOM 0 HD11 LEU A 15 -2.272 4.068 -3.859 1.00 0.94 H new ATOM 0 HD12 LEU A 15 -3.965 4.007 -4.405 1.00 0.94 H new ATOM 0 HD13 LEU A 15 -3.590 3.999 -2.666 1.00 0.94 H new ATOM 0 HD21 LEU A 15 -1.189 2.162 -2.886 1.00 0.61 H new ATOM 0 HD22 LEU A 15 -2.455 1.981 -1.649 1.00 0.61 H new ATOM 0 HD23 LEU A 15 -2.026 0.604 -2.690 1.00 0.61 H new ATOM 223 N VAL A 16 -7.428 0.091 -3.988 1.00 0.58 N ATOM 224 CA VAL A 16 -8.329 -1.075 -4.067 1.00 0.62 C ATOM 225 C VAL A 16 -9.238 -1.034 -5.310 1.00 0.71 C ATOM 226 O VAL A 16 -9.462 -2.077 -5.928 1.00 0.84 O ATOM 227 CB VAL A 16 -9.145 -1.213 -2.756 1.00 0.56 C ATOM 228 CG1 VAL A 16 -10.202 -2.326 -2.815 1.00 0.58 C ATOM 229 CG2 VAL A 16 -8.185 -1.568 -1.606 1.00 0.58 C ATOM 0 H VAL A 16 -7.701 0.750 -3.259 1.00 0.58 H new ATOM 0 HA VAL A 16 -7.710 -1.965 -4.180 1.00 0.62 H new ATOM 0 HB VAL A 16 -9.653 -0.260 -2.605 1.00 0.56 H new ATOM 0 HG11 VAL A 16 -10.738 -2.370 -1.867 1.00 0.58 H new ATOM 0 HG12 VAL A 16 -10.906 -2.117 -3.620 1.00 0.58 H new ATOM 0 HG13 VAL A 16 -9.713 -3.283 -3.000 1.00 0.58 H new ATOM 0 HG21 VAL A 16 -8.749 -1.667 -0.679 1.00 0.58 H new ATOM 0 HG22 VAL A 16 -7.683 -2.510 -1.828 1.00 0.58 H new ATOM 0 HG23 VAL A 16 -7.442 -0.778 -1.496 1.00 0.58 H new ATOM 239 N GLU A 17 -9.716 0.151 -5.707 1.00 0.70 N ATOM 240 CA GLU A 17 -10.417 0.377 -6.976 1.00 0.84 C ATOM 241 C GLU A 17 -9.544 -0.092 -8.155 1.00 0.83 C ATOM 242 O GLU A 17 -9.952 -0.986 -8.906 1.00 0.92 O ATOM 243 CB GLU A 17 -10.842 1.864 -7.038 1.00 0.89 C ATOM 244 CG GLU A 17 -11.600 2.323 -8.300 1.00 1.34 C ATOM 245 CD GLU A 17 -10.727 2.918 -9.411 1.00 2.05 C ATOM 246 OE1 GLU A 17 -9.479 2.895 -9.312 1.00 3.04 O ATOM 247 OE2 GLU A 17 -11.269 3.320 -10.464 1.00 2.88 O ATOM 0 H GLU A 17 -9.624 0.996 -5.144 1.00 0.70 H new ATOM 0 HA GLU A 17 -11.328 -0.217 -7.046 1.00 0.84 H new ATOM 0 HB2 GLU A 17 -11.469 2.074 -6.171 1.00 0.89 H new ATOM 0 HB3 GLU A 17 -9.946 2.477 -6.939 1.00 0.89 H new ATOM 0 HG2 GLU A 17 -12.145 1.471 -8.706 1.00 1.34 H new ATOM 0 HG3 GLU A 17 -12.342 3.066 -8.007 1.00 1.34 H new ATOM 254 N ASN A 18 -8.305 0.405 -8.265 1.00 0.80 N ATOM 255 CA ASN A 18 -7.404 0.069 -9.368 1.00 0.88 C ATOM 256 C ASN A 18 -6.859 -1.377 -9.323 1.00 0.81 C ATOM 257 O ASN A 18 -6.266 -1.834 -10.295 1.00 0.83 O ATOM 258 CB ASN A 18 -6.293 1.128 -9.456 1.00 1.09 C ATOM 259 CG ASN A 18 -5.733 1.226 -10.872 1.00 1.69 C ATOM 260 OD1 ASN A 18 -6.277 1.926 -11.717 1.00 2.74 O ATOM 261 ND2 ASN A 18 -4.685 0.493 -11.189 1.00 1.49 N ATOM 0 H ASN A 18 -7.901 1.053 -7.588 1.00 0.80 H new ATOM 0 HA ASN A 18 -7.987 0.090 -10.289 1.00 0.88 H new ATOM 0 HB2 ASN A 18 -6.686 2.097 -9.150 1.00 1.09 H new ATOM 0 HB3 ASN A 18 -5.491 0.876 -8.762 1.00 1.09 H new ATOM 0 HD21 ASN A 18 -4.323 0.507 -12.142 1.00 1.49 H new ATOM 0 HD22 ASN A 18 -4.236 -0.088 -10.481 1.00 1.49 H new ATOM 268 N PHE A 19 -7.070 -2.125 -8.234 1.00 0.83 N ATOM 269 CA PHE A 19 -6.825 -3.570 -8.203 1.00 0.79 C ATOM 270 C PHE A 19 -7.971 -4.367 -8.842 1.00 0.69 C ATOM 271 O PHE A 19 -7.800 -5.030 -9.870 1.00 0.70 O ATOM 272 CB PHE A 19 -6.616 -4.030 -6.757 1.00 0.95 C ATOM 273 CG PHE A 19 -6.418 -5.527 -6.672 1.00 0.89 C ATOM 274 CD1 PHE A 19 -5.296 -6.118 -7.280 1.00 1.56 C ATOM 275 CD2 PHE A 19 -7.411 -6.340 -6.096 1.00 2.48 C ATOM 276 CE1 PHE A 19 -5.138 -7.512 -7.269 1.00 1.67 C ATOM 277 CE2 PHE A 19 -7.265 -7.735 -6.112 1.00 2.40 C ATOM 278 CZ PHE A 19 -6.122 -8.321 -6.679 1.00 0.90 C ATOM 0 H PHE A 19 -7.415 -1.746 -7.352 1.00 0.83 H new ATOM 0 HA PHE A 19 -5.926 -3.762 -8.789 1.00 0.79 H new ATOM 0 HB2 PHE A 19 -5.748 -3.523 -6.335 1.00 0.95 H new ATOM 0 HB3 PHE A 19 -7.477 -3.742 -6.155 1.00 0.95 H new ATOM 0 HD1 PHE A 19 -4.553 -5.496 -7.757 1.00 1.56 H new ATOM 0 HD2 PHE A 19 -8.283 -5.892 -5.643 1.00 2.48 H new ATOM 0 HE1 PHE A 19 -4.262 -7.961 -7.713 1.00 1.67 H new ATOM 0 HE2 PHE A 19 -8.035 -8.361 -5.686 1.00 2.40 H new ATOM 0 HZ PHE A 19 -6.000 -9.394 -6.661 1.00 0.90 H new ATOM 288 N TYR A 20 -9.154 -4.320 -8.218 1.00 0.69 N ATOM 289 CA TYR A 20 -10.271 -5.181 -8.600 1.00 0.67 C ATOM 290 C TYR A 20 -10.759 -4.894 -10.034 1.00 0.69 C ATOM 291 O TYR A 20 -11.155 -5.831 -10.727 1.00 0.73 O ATOM 292 CB TYR A 20 -11.412 -5.088 -7.583 1.00 0.71 C ATOM 293 CG TYR A 20 -11.200 -5.771 -6.235 1.00 0.68 C ATOM 294 CD1 TYR A 20 -11.136 -7.179 -6.125 1.00 1.93 C ATOM 295 CD2 TYR A 20 -11.157 -4.993 -5.064 1.00 2.09 C ATOM 296 CE1 TYR A 20 -11.050 -7.794 -4.856 1.00 1.85 C ATOM 297 CE2 TYR A 20 -11.123 -5.601 -3.793 1.00 2.25 C ATOM 298 CZ TYR A 20 -11.073 -7.004 -3.685 1.00 0.88 C ATOM 299 OH TYR A 20 -11.001 -7.589 -2.456 1.00 1.05 O ATOM 0 H TYR A 20 -9.359 -3.690 -7.443 1.00 0.69 H new ATOM 0 HA TYR A 20 -9.906 -6.208 -8.594 1.00 0.67 H new ATOM 0 HB2 TYR A 20 -11.616 -4.033 -7.399 1.00 0.71 H new ATOM 0 HB3 TYR A 20 -12.307 -5.511 -8.039 1.00 0.71 H new ATOM 0 HD1 TYR A 20 -11.153 -7.788 -7.017 1.00 1.93 H new ATOM 0 HD2 TYR A 20 -11.150 -3.916 -5.140 1.00 2.09 H new ATOM 0 HE1 TYR A 20 -10.967 -8.868 -4.781 1.00 1.85 H new ATOM 0 HE2 TYR A 20 -11.135 -4.991 -2.902 1.00 2.25 H new ATOM 0 HH TYR A 20 -10.062 -7.673 -2.188 1.00 1.05 H new ATOM 309 N LYS A 21 -10.605 -3.655 -10.529 1.00 0.71 N ATOM 310 CA LYS A 21 -10.787 -3.271 -11.944 1.00 0.70 C ATOM 311 C LYS A 21 -10.109 -4.211 -12.949 1.00 0.73 C ATOM 312 O LYS A 21 -10.652 -4.469 -14.018 1.00 0.89 O ATOM 313 CB LYS A 21 -10.215 -1.850 -12.146 1.00 0.80 C ATOM 314 CG LYS A 21 -11.313 -0.784 -12.132 1.00 2.53 C ATOM 315 CD LYS A 21 -10.813 0.616 -11.770 1.00 2.65 C ATOM 316 CE LYS A 21 -9.561 1.123 -12.501 1.00 1.85 C ATOM 317 NZ LYS A 21 -9.132 2.429 -11.943 1.00 2.32 N ATOM 0 H LYS A 21 -10.342 -2.866 -9.939 1.00 0.71 H new ATOM 0 HA LYS A 21 -11.858 -3.325 -12.141 1.00 0.70 H new ATOM 0 HB2 LYS A 21 -9.491 -1.635 -11.360 1.00 0.80 H new ATOM 0 HB3 LYS A 21 -9.679 -1.806 -13.094 1.00 0.80 H new ATOM 0 HG2 LYS A 21 -11.784 -0.748 -13.114 1.00 2.53 H new ATOM 0 HG3 LYS A 21 -12.084 -1.079 -11.420 1.00 2.53 H new ATOM 0 HD2 LYS A 21 -11.622 1.322 -11.955 1.00 2.65 H new ATOM 0 HD3 LYS A 21 -10.611 0.637 -10.699 1.00 2.65 H new ATOM 0 HE2 LYS A 21 -8.755 0.396 -12.403 1.00 1.85 H new ATOM 0 HE3 LYS A 21 -9.770 1.226 -13.566 1.00 1.85 H new ATOM 0 HZ1 LYS A 21 -8.229 2.711 -12.375 1.00 2.32 H new ATOM 0 HZ2 LYS A 21 -9.854 3.148 -12.149 1.00 2.32 H new ATOM 0 HZ3 LYS A 21 -9.011 2.344 -10.914 1.00 2.32 H new ATOM 331 N TYR A 22 -8.912 -4.706 -12.631 1.00 0.74 N ATOM 332 CA TYR A 22 -8.137 -5.560 -13.537 1.00 0.95 C ATOM 333 C TYR A 22 -8.426 -7.054 -13.284 1.00 1.12 C ATOM 334 O TYR A 22 -8.327 -7.862 -14.202 1.00 1.20 O ATOM 335 CB TYR A 22 -6.648 -5.188 -13.409 1.00 1.07 C ATOM 336 CG TYR A 22 -6.291 -3.795 -13.921 1.00 1.08 C ATOM 337 CD1 TYR A 22 -6.758 -2.648 -13.251 1.00 2.14 C ATOM 338 CD2 TYR A 22 -5.475 -3.639 -15.060 1.00 1.82 C ATOM 339 CE1 TYR A 22 -6.473 -1.362 -13.738 1.00 2.33 C ATOM 340 CE2 TYR A 22 -5.145 -2.350 -15.533 1.00 1.91 C ATOM 341 CZ TYR A 22 -5.660 -1.204 -14.878 1.00 1.54 C ATOM 342 OH TYR A 22 -5.362 0.059 -15.288 1.00 1.90 O ATOM 0 H TYR A 22 -8.451 -4.527 -11.739 1.00 0.74 H new ATOM 0 HA TYR A 22 -8.437 -5.387 -14.571 1.00 0.95 H new ATOM 0 HB2 TYR A 22 -6.359 -5.260 -12.361 1.00 1.07 H new ATOM 0 HB3 TYR A 22 -6.056 -5.923 -13.954 1.00 1.07 H new ATOM 0 HD1 TYR A 22 -7.343 -2.759 -12.350 1.00 2.14 H new ATOM 0 HD2 TYR A 22 -5.100 -4.511 -15.574 1.00 1.82 H new ATOM 0 HE1 TYR A 22 -6.877 -0.494 -13.239 1.00 2.33 H new ATOM 0 HE2 TYR A 22 -4.501 -2.238 -16.393 1.00 1.91 H new ATOM 0 HH TYR A 22 -4.477 0.066 -15.709 1.00 1.90 H new ATOM 352 N VAL A 23 -8.834 -7.399 -12.062 1.00 1.35 N ATOM 353 CA VAL A 23 -9.241 -8.746 -11.628 1.00 1.61 C ATOM 354 C VAL A 23 -10.607 -9.171 -12.197 1.00 1.73 C ATOM 355 O VAL A 23 -10.698 -10.238 -12.802 1.00 3.07 O ATOM 356 CB VAL A 23 -9.271 -8.796 -10.086 1.00 1.68 C ATOM 357 CG1 VAL A 23 -9.979 -10.023 -9.503 1.00 2.23 C ATOM 358 CG2 VAL A 23 -7.850 -8.753 -9.526 1.00 2.57 C ATOM 0 H VAL A 23 -8.894 -6.716 -11.307 1.00 1.35 H new ATOM 0 HA VAL A 23 -8.507 -9.452 -12.018 1.00 1.61 H new ATOM 0 HB VAL A 23 -9.847 -7.920 -9.788 1.00 1.68 H new ATOM 0 HG11 VAL A 23 -9.952 -9.975 -8.414 1.00 2.23 H new ATOM 0 HG12 VAL A 23 -11.015 -10.039 -9.840 1.00 2.23 H new ATOM 0 HG13 VAL A 23 -9.474 -10.928 -9.839 1.00 2.23 H new ATOM 0 HG21 VAL A 23 -7.887 -8.789 -8.437 1.00 2.57 H new ATOM 0 HG22 VAL A 23 -7.286 -9.608 -9.898 1.00 2.57 H new ATOM 0 HG23 VAL A 23 -7.362 -7.831 -9.842 1.00 2.57 H new ATOM 526 N ILE A 33 -6.395 -11.408 -15.397 1.00 1.76 N ATOM 527 CA ILE A 33 -5.146 -10.737 -14.981 1.00 1.20 C ATOM 528 C ILE A 33 -4.080 -11.819 -14.708 1.00 1.30 C ATOM 529 O ILE A 33 -4.401 -13.000 -14.573 1.00 1.75 O ATOM 530 CB ILE A 33 -5.397 -9.779 -13.788 1.00 1.64 C ATOM 531 CG1 ILE A 33 -4.294 -8.696 -13.673 1.00 1.43 C ATOM 532 CG2 ILE A 33 -5.600 -10.537 -12.471 1.00 2.93 C ATOM 533 CD1 ILE A 33 -4.403 -7.790 -12.438 1.00 1.67 C ATOM 0 HA ILE A 33 -4.768 -10.094 -15.776 1.00 1.20 H new ATOM 0 HB ILE A 33 -6.332 -9.257 -13.995 1.00 1.64 H new ATOM 0 HG12 ILE A 33 -3.322 -9.189 -13.659 1.00 1.43 H new ATOM 0 HG13 ILE A 33 -4.323 -8.072 -14.567 1.00 1.43 H new ATOM 0 HG21 ILE A 33 -5.772 -9.825 -11.664 1.00 2.93 H new ATOM 0 HG22 ILE A 33 -6.461 -11.199 -12.561 1.00 2.93 H new ATOM 0 HG23 ILE A 33 -4.711 -11.127 -12.250 1.00 2.93 H new ATOM 0 HD11 ILE A 33 -3.589 -7.065 -12.445 1.00 1.67 H new ATOM 0 HD12 ILE A 33 -5.357 -7.264 -12.456 1.00 1.67 H new ATOM 0 HD13 ILE A 33 -4.340 -8.397 -11.535 1.00 1.67 H new ATOM 545 N SER A 34 -2.812 -11.438 -14.678 1.00 1.70 N ATOM 546 CA SER A 34 -1.649 -12.264 -14.343 1.00 2.11 C ATOM 547 C SER A 34 -0.446 -11.355 -14.040 1.00 1.63 C ATOM 548 O SER A 34 -0.417 -10.195 -14.454 1.00 1.31 O ATOM 549 CB SER A 34 -1.318 -13.215 -15.500 1.00 2.76 C ATOM 550 OG SER A 34 -2.266 -14.257 -15.589 1.00 3.76 O ATOM 0 H SER A 34 -2.544 -10.479 -14.901 1.00 1.70 H new ATOM 0 HA SER A 34 -1.878 -12.863 -13.462 1.00 2.11 H new ATOM 0 HB2 SER A 34 -1.296 -12.659 -16.437 1.00 2.76 H new ATOM 0 HB3 SER A 34 -0.323 -13.636 -15.355 1.00 2.76 H new ATOM 0 HG SER A 34 -3.024 -14.061 -14.999 1.00 3.76 H new ATOM 556 N LYS A 35 0.589 -11.893 -13.395 1.00 1.68 N ATOM 557 CA LYS A 35 1.853 -11.236 -13.010 1.00 1.44 C ATOM 558 C LYS A 35 2.590 -10.381 -14.084 1.00 1.34 C ATOM 559 O LYS A 35 3.464 -9.587 -13.750 1.00 1.50 O ATOM 560 CB LYS A 35 2.720 -12.316 -12.364 1.00 1.62 C ATOM 561 CG LYS A 35 3.070 -13.485 -13.295 1.00 1.81 C ATOM 562 CD LYS A 35 3.477 -14.673 -12.428 1.00 1.88 C ATOM 563 CE LYS A 35 3.939 -15.803 -13.361 1.00 2.79 C ATOM 564 NZ LYS A 35 4.082 -17.129 -12.707 1.00 2.63 N ATOM 0 H LYS A 35 0.572 -12.870 -13.103 1.00 1.68 H new ATOM 0 HA LYS A 35 1.609 -10.436 -12.311 1.00 1.44 H new ATOM 0 HB2 LYS A 35 3.644 -11.860 -12.010 1.00 1.62 H new ATOM 0 HB3 LYS A 35 2.201 -12.707 -11.489 1.00 1.62 H new ATOM 0 HG2 LYS A 35 2.215 -13.744 -13.919 1.00 1.81 H new ATOM 0 HG3 LYS A 35 3.882 -13.207 -13.967 1.00 1.81 H new ATOM 0 HD2 LYS A 35 4.278 -14.390 -11.745 1.00 1.88 H new ATOM 0 HD3 LYS A 35 2.638 -15.003 -11.815 1.00 1.88 H new ATOM 0 HE2 LYS A 35 3.227 -15.893 -14.181 1.00 2.79 H new ATOM 0 HE3 LYS A 35 4.897 -15.524 -13.800 1.00 2.79 H new ATOM 0 HZ1 LYS A 35 4.950 -17.592 -13.046 1.00 2.63 H new ATOM 0 HZ2 LYS A 35 4.137 -17.004 -11.676 1.00 2.63 H new ATOM 0 HZ3 LYS A 35 3.260 -17.722 -12.940 1.00 2.63 H new ATOM 578 N SER A 36 2.228 -10.473 -15.368 1.00 1.33 N ATOM 579 CA SER A 36 2.704 -9.539 -16.408 1.00 1.34 C ATOM 580 C SER A 36 1.977 -8.183 -16.429 1.00 1.24 C ATOM 581 O SER A 36 2.566 -7.202 -16.880 1.00 1.26 O ATOM 582 CB SER A 36 2.559 -10.155 -17.810 1.00 1.50 C ATOM 583 OG SER A 36 3.604 -11.070 -18.094 1.00 2.38 O ATOM 0 H SER A 36 1.598 -11.194 -15.721 1.00 1.33 H new ATOM 0 HA SER A 36 3.748 -9.361 -16.149 1.00 1.34 H new ATOM 0 HB2 SER A 36 1.599 -10.665 -17.885 1.00 1.50 H new ATOM 0 HB3 SER A 36 2.558 -9.361 -18.557 1.00 1.50 H new ATOM 0 HG SER A 36 3.478 -11.442 -18.992 1.00 2.38 H new ATOM 589 N SER A 37 0.713 -8.104 -16.000 1.00 1.17 N ATOM 590 CA SER A 37 -0.100 -6.888 -16.165 1.00 1.02 C ATOM 591 C SER A 37 0.272 -5.821 -15.133 1.00 0.83 C ATOM 592 O SER A 37 0.546 -4.686 -15.513 1.00 0.89 O ATOM 593 CB SER A 37 -1.597 -7.221 -16.058 1.00 1.09 C ATOM 594 OG SER A 37 -1.977 -8.238 -16.974 1.00 1.53 O ATOM 0 H SER A 37 0.227 -8.870 -15.534 1.00 1.17 H new ATOM 0 HA SER A 37 0.107 -6.488 -17.157 1.00 1.02 H new ATOM 0 HB2 SER A 37 -1.826 -7.542 -15.042 1.00 1.09 H new ATOM 0 HB3 SER A 37 -2.184 -6.322 -16.248 1.00 1.09 H new ATOM 0 HG SER A 37 -2.934 -8.425 -16.877 1.00 1.53 H new ATOM 600 N PHE A 38 0.358 -6.181 -13.843 1.00 0.88 N ATOM 601 CA PHE A 38 0.702 -5.260 -12.750 1.00 0.81 C ATOM 602 C PHE A 38 1.949 -4.436 -13.066 1.00 0.75 C ATOM 603 O PHE A 38 1.901 -3.211 -12.973 1.00 0.67 O ATOM 604 CB PHE A 38 0.897 -6.050 -11.448 1.00 1.03 C ATOM 605 CG PHE A 38 1.775 -5.375 -10.402 1.00 0.82 C ATOM 606 CD1 PHE A 38 1.329 -4.241 -9.696 1.00 2.01 C ATOM 607 CD2 PHE A 38 3.064 -5.875 -10.139 1.00 1.58 C ATOM 608 CE1 PHE A 38 2.086 -3.737 -8.628 1.00 1.91 C ATOM 609 CE2 PHE A 38 3.858 -5.323 -9.124 1.00 1.64 C ATOM 610 CZ PHE A 38 3.344 -4.285 -8.328 1.00 0.67 C ATOM 0 H PHE A 38 0.188 -7.135 -13.526 1.00 0.88 H new ATOM 0 HA PHE A 38 -0.124 -4.559 -12.631 1.00 0.81 H new ATOM 0 HB2 PHE A 38 -0.082 -6.241 -11.008 1.00 1.03 H new ATOM 0 HB3 PHE A 38 1.331 -7.019 -11.692 1.00 1.03 H new ATOM 0 HD1 PHE A 38 0.404 -3.759 -9.977 1.00 2.01 H new ATOM 0 HD2 PHE A 38 3.447 -6.696 -10.727 1.00 1.58 H new ATOM 0 HE1 PHE A 38 1.699 -2.923 -8.033 1.00 1.91 H new ATOM 0 HE2 PHE A 38 4.858 -5.693 -8.955 1.00 1.64 H new ATOM 0 HZ PHE A 38 3.913 -3.911 -7.490 1.00 0.67 H new ATOM 620 N ARG A 39 3.034 -5.096 -13.501 1.00 0.89 N ATOM 621 CA ARG A 39 4.285 -4.418 -13.852 1.00 0.97 C ATOM 622 C ARG A 39 4.113 -3.370 -14.954 1.00 0.93 C ATOM 623 O ARG A 39 4.852 -2.386 -14.942 1.00 1.04 O ATOM 624 CB ARG A 39 5.408 -5.417 -14.188 1.00 1.17 C ATOM 625 CG ARG A 39 5.071 -6.328 -15.370 1.00 1.22 C ATOM 626 CD ARG A 39 6.309 -7.041 -15.916 1.00 1.52 C ATOM 627 NE ARG A 39 5.986 -8.026 -16.963 1.00 2.07 N ATOM 628 CZ ARG A 39 6.816 -8.979 -17.379 1.00 2.96 C ATOM 629 NH1 ARG A 39 8.072 -9.040 -16.981 1.00 3.52 N ATOM 630 NH2 ARG A 39 6.388 -9.925 -18.192 1.00 3.79 N ATOM 0 H ARG A 39 3.066 -6.109 -13.618 1.00 0.89 H new ATOM 0 HA ARG A 39 4.588 -3.872 -12.958 1.00 0.97 H new ATOM 0 HB2 ARG A 39 6.321 -4.865 -14.412 1.00 1.17 H new ATOM 0 HB3 ARG A 39 5.613 -6.031 -13.311 1.00 1.17 H new ATOM 0 HG2 ARG A 39 4.334 -7.068 -15.058 1.00 1.22 H new ATOM 0 HG3 ARG A 39 4.613 -5.738 -16.164 1.00 1.22 H new ATOM 0 HD2 ARG A 39 7.000 -6.301 -16.320 1.00 1.52 H new ATOM 0 HD3 ARG A 39 6.824 -7.544 -15.097 1.00 1.52 H new ATOM 0 HE ARG A 39 5.065 -7.974 -17.398 1.00 2.07 H new ATOM 0 HH11 ARG A 39 8.436 -8.342 -16.333 1.00 3.52 H new ATOM 0 HH12 ARG A 39 8.679 -9.786 -17.321 1.00 3.52 H new ATOM 0 HH21 ARG A 39 5.417 -9.928 -18.505 1.00 3.79 H new ATOM 0 HH22 ARG A 39 7.028 -10.654 -18.508 1.00 3.79 H new ATOM 644 N GLU A 40 3.169 -3.535 -15.881 1.00 0.87 N ATOM 645 CA GLU A 40 2.954 -2.661 -17.021 1.00 0.94 C ATOM 646 C GLU A 40 1.854 -1.606 -16.789 1.00 0.83 C ATOM 647 O GLU A 40 2.073 -0.442 -17.097 1.00 0.87 O ATOM 648 CB GLU A 40 2.689 -3.598 -18.197 1.00 1.19 C ATOM 649 CG GLU A 40 2.519 -2.840 -19.508 1.00 1.16 C ATOM 650 CD GLU A 40 1.079 -2.785 -20.017 1.00 1.69 C ATOM 651 OE1 GLU A 40 0.134 -3.086 -19.246 1.00 2.88 O ATOM 652 OE2 GLU A 40 0.888 -2.290 -21.145 1.00 2.00 O ATOM 0 H GLU A 40 2.511 -4.313 -15.852 1.00 0.87 H new ATOM 0 HA GLU A 40 3.825 -2.035 -17.216 1.00 0.94 H new ATOM 0 HB2 GLU A 40 3.515 -4.303 -18.291 1.00 1.19 H new ATOM 0 HB3 GLU A 40 1.791 -4.183 -17.998 1.00 1.19 H new ATOM 0 HG2 GLU A 40 2.885 -1.822 -19.376 1.00 1.16 H new ATOM 0 HG3 GLU A 40 3.144 -3.308 -20.269 1.00 1.16 H new ATOM 659 N MET A 41 0.728 -1.940 -16.155 1.00 0.77 N ATOM 660 CA MET A 41 -0.250 -0.994 -15.564 1.00 0.81 C ATOM 661 C MET A 41 0.430 0.056 -14.672 1.00 0.75 C ATOM 662 O MET A 41 0.157 1.252 -14.767 1.00 0.82 O ATOM 663 CB MET A 41 -1.231 -1.858 -14.757 1.00 0.88 C ATOM 664 CG MET A 41 -2.192 -1.086 -13.853 1.00 1.20 C ATOM 665 SD MET A 41 -3.138 -2.183 -12.776 1.00 2.59 S ATOM 666 CE MET A 41 -1.928 -2.392 -11.462 1.00 0.80 C ATOM 0 H MET A 41 0.452 -2.914 -16.029 1.00 0.77 H new ATOM 0 HA MET A 41 -0.760 -0.426 -16.342 1.00 0.81 H new ATOM 0 HB2 MET A 41 -1.817 -2.459 -15.453 1.00 0.88 H new ATOM 0 HB3 MET A 41 -0.657 -2.551 -14.142 1.00 0.88 H new ATOM 0 HG2 MET A 41 -1.628 -0.379 -13.245 1.00 1.20 H new ATOM 0 HG3 MET A 41 -2.877 -0.502 -14.467 1.00 1.20 H new ATOM 0 HE1 MET A 41 -2.173 -3.280 -10.879 1.00 0.80 H new ATOM 0 HE2 MET A 41 -0.935 -2.506 -11.897 1.00 0.80 H new ATOM 0 HE3 MET A 41 -1.941 -1.517 -10.813 1.00 0.80 H new ATOM 676 N LEU A 42 1.400 -0.380 -13.863 1.00 0.69 N ATOM 677 CA LEU A 42 2.296 0.485 -13.090 1.00 0.72 C ATOM 678 C LEU A 42 3.055 1.526 -13.930 1.00 0.74 C ATOM 679 O LEU A 42 3.588 2.467 -13.368 1.00 0.97 O ATOM 680 CB LEU A 42 3.298 -0.411 -12.334 1.00 0.73 C ATOM 681 CG LEU A 42 2.888 -0.883 -10.935 1.00 0.74 C ATOM 682 CD1 LEU A 42 4.054 -1.732 -10.411 1.00 0.83 C ATOM 683 CD2 LEU A 42 2.664 0.309 -9.996 1.00 0.74 C ATOM 0 H LEU A 42 1.589 -1.373 -13.724 1.00 0.69 H new ATOM 0 HA LEU A 42 1.673 1.063 -12.407 1.00 0.72 H new ATOM 0 HB2 LEU A 42 3.494 -1.292 -12.945 1.00 0.73 H new ATOM 0 HB3 LEU A 42 4.239 0.132 -12.247 1.00 0.73 H new ATOM 0 HG LEU A 42 1.956 -1.446 -10.978 1.00 0.74 H new ATOM 0 HD11 LEU A 42 3.817 -2.098 -9.412 1.00 0.83 H new ATOM 0 HD12 LEU A 42 4.216 -2.578 -11.078 1.00 0.83 H new ATOM 0 HD13 LEU A 42 4.958 -1.124 -10.370 1.00 0.83 H new ATOM 0 HD21 LEU A 42 2.374 -0.054 -9.010 1.00 0.74 H new ATOM 0 HD22 LEU A 42 3.585 0.886 -9.914 1.00 0.74 H new ATOM 0 HD23 LEU A 42 1.873 0.944 -10.396 1.00 0.74 H new ATOM 695 N GLN A 43 3.192 1.349 -15.241 1.00 0.71 N ATOM 696 CA GLN A 43 3.843 2.282 -16.159 1.00 0.75 C ATOM 697 C GLN A 43 2.845 3.176 -16.916 1.00 0.79 C ATOM 698 O GLN A 43 3.273 4.145 -17.534 1.00 0.88 O ATOM 699 CB GLN A 43 4.765 1.430 -17.046 1.00 0.88 C ATOM 700 CG GLN A 43 5.303 2.068 -18.326 1.00 1.09 C ATOM 701 CD GLN A 43 6.544 1.333 -18.824 1.00 1.45 C ATOM 702 OE1 GLN A 43 7.592 1.896 -19.076 1.00 2.65 O ATOM 703 NE2 GLN A 43 6.516 0.021 -18.921 1.00 1.41 N ATOM 0 H GLN A 43 2.838 0.517 -15.714 1.00 0.71 H new ATOM 0 HA GLN A 43 4.440 3.022 -15.626 1.00 0.75 H new ATOM 0 HB2 GLN A 43 5.617 1.118 -16.442 1.00 0.88 H new ATOM 0 HB3 GLN A 43 4.223 0.526 -17.323 1.00 0.88 H new ATOM 0 HG2 GLN A 43 4.532 2.051 -19.097 1.00 1.09 H new ATOM 0 HG3 GLN A 43 5.546 3.114 -18.141 1.00 1.09 H new ATOM 0 HE21 GLN A 43 5.655 -0.487 -18.718 1.00 1.41 H new ATOM 0 HE22 GLN A 43 7.355 -0.488 -19.199 1.00 1.41 H new ATOM 712 N LYS A 44 1.539 2.890 -16.862 1.00 0.78 N ATOM 713 CA LYS A 44 0.477 3.770 -17.371 1.00 0.84 C ATOM 714 C LYS A 44 -0.153 4.627 -16.253 1.00 0.84 C ATOM 715 O LYS A 44 -0.078 5.853 -16.289 1.00 0.95 O ATOM 716 CB LYS A 44 -0.589 2.905 -18.061 1.00 0.88 C ATOM 717 CG LYS A 44 -0.231 2.437 -19.483 1.00 1.02 C ATOM 718 CD LYS A 44 0.538 1.119 -19.543 1.00 1.07 C ATOM 719 CE LYS A 44 -0.374 -0.006 -19.043 1.00 1.17 C ATOM 720 NZ LYS A 44 -1.054 -0.735 -20.131 1.00 1.61 N ATOM 0 H LYS A 44 1.183 2.025 -16.456 1.00 0.78 H new ATOM 0 HA LYS A 44 0.914 4.467 -18.086 1.00 0.84 H new ATOM 0 HB2 LYS A 44 -0.778 2.027 -17.443 1.00 0.88 H new ATOM 0 HB3 LYS A 44 -1.520 3.470 -18.105 1.00 0.88 H new ATOM 0 HG2 LYS A 44 -1.150 2.333 -20.059 1.00 1.02 H new ATOM 0 HG3 LYS A 44 0.363 3.212 -19.968 1.00 1.02 H new ATOM 0 HD2 LYS A 44 0.862 0.917 -20.564 1.00 1.07 H new ATOM 0 HD3 LYS A 44 1.437 1.178 -18.929 1.00 1.07 H new ATOM 0 HE2 LYS A 44 0.217 -0.710 -18.458 1.00 1.17 H new ATOM 0 HE3 LYS A 44 -1.124 0.415 -18.373 1.00 1.17 H new ATOM 0 HZ1 LYS A 44 -1.532 -1.573 -19.742 1.00 1.61 H new ATOM 0 HZ2 LYS A 44 -1.756 -0.113 -20.580 1.00 1.61 H new ATOM 0 HZ3 LYS A 44 -0.354 -1.034 -20.839 1.00 1.61 H new ATOM 734 N GLU A 45 -0.724 3.987 -15.234 1.00 0.86 N ATOM 735 CA GLU A 45 -1.495 4.636 -14.165 1.00 0.96 C ATOM 736 C GLU A 45 -0.603 5.344 -13.114 1.00 0.98 C ATOM 737 O GLU A 45 -1.038 6.302 -12.465 1.00 1.22 O ATOM 738 CB GLU A 45 -2.380 3.562 -13.501 1.00 1.07 C ATOM 739 CG GLU A 45 -3.621 3.130 -14.311 1.00 1.28 C ATOM 740 CD GLU A 45 -3.341 2.599 -15.726 1.00 2.42 C ATOM 741 OE1 GLU A 45 -2.956 1.413 -15.873 1.00 3.43 O ATOM 742 OE2 GLU A 45 -3.487 3.398 -16.673 1.00 3.59 O ATOM 0 H GLU A 45 -0.664 2.975 -15.122 1.00 0.86 H new ATOM 0 HA GLU A 45 -2.104 5.425 -14.606 1.00 0.96 H new ATOM 0 HB2 GLU A 45 -1.769 2.680 -13.308 1.00 1.07 H new ATOM 0 HB3 GLU A 45 -2.712 3.937 -12.533 1.00 1.07 H new ATOM 0 HG2 GLU A 45 -4.147 2.357 -13.750 1.00 1.28 H new ATOM 0 HG3 GLU A 45 -4.296 3.982 -14.390 1.00 1.28 H new ATOM 749 N LEU A 46 0.642 4.867 -12.953 1.00 0.87 N ATOM 750 CA LEU A 46 1.643 5.370 -12.004 1.00 0.89 C ATOM 751 C LEU A 46 2.900 5.911 -12.729 1.00 0.88 C ATOM 752 O LEU A 46 4.035 5.591 -12.378 1.00 1.08 O ATOM 753 CB LEU A 46 1.907 4.231 -10.995 1.00 0.97 C ATOM 754 CG LEU A 46 2.040 4.712 -9.540 1.00 0.78 C ATOM 755 CD1 LEU A 46 1.818 3.507 -8.622 1.00 0.76 C ATOM 756 CD2 LEU A 46 3.404 5.348 -9.238 1.00 1.62 C ATOM 0 H LEU A 46 0.992 4.085 -13.507 1.00 0.87 H new ATOM 0 HA LEU A 46 1.285 6.241 -11.455 1.00 0.89 H new ATOM 0 HB2 LEU A 46 1.094 3.508 -11.056 1.00 0.97 H new ATOM 0 HB3 LEU A 46 2.820 3.709 -11.281 1.00 0.97 H new ATOM 0 HG LEU A 46 1.295 5.489 -9.370 1.00 0.78 H new ATOM 0 HD11 LEU A 46 1.907 3.821 -7.582 1.00 0.76 H new ATOM 0 HD12 LEU A 46 0.823 3.097 -8.794 1.00 0.76 H new ATOM 0 HD13 LEU A 46 2.566 2.744 -8.836 1.00 0.76 H new ATOM 0 HD21 LEU A 46 3.434 5.666 -8.196 1.00 1.62 H new ATOM 0 HD22 LEU A 46 4.193 4.618 -9.418 1.00 1.62 H new ATOM 0 HD23 LEU A 46 3.554 6.212 -9.886 1.00 1.62 H new ATOM 768 N ASN A 47 2.699 6.678 -13.808 1.00 0.84 N ATOM 769 CA ASN A 47 3.772 7.111 -14.714 1.00 0.87 C ATOM 770 C ASN A 47 4.564 8.378 -14.296 1.00 0.95 C ATOM 771 O ASN A 47 5.651 8.602 -14.828 1.00 1.34 O ATOM 772 CB ASN A 47 3.207 7.288 -16.131 1.00 0.92 C ATOM 773 CG ASN A 47 2.363 8.546 -16.254 1.00 1.00 C ATOM 774 OD1 ASN A 47 2.872 9.645 -16.425 1.00 1.24 O ATOM 775 ND2 ASN A 47 1.058 8.423 -16.134 1.00 1.03 N ATOM 0 H ASN A 47 1.777 7.019 -14.080 1.00 0.84 H new ATOM 0 HA ASN A 47 4.510 6.310 -14.668 1.00 0.87 H new ATOM 0 HB2 ASN A 47 4.028 7.331 -16.846 1.00 0.92 H new ATOM 0 HB3 ASN A 47 2.603 6.419 -16.392 1.00 0.92 H new ATOM 0 HD21 ASN A 47 0.461 9.249 -16.183 1.00 1.03 H new ATOM 0 HD22 ASN A 47 0.644 7.502 -15.992 1.00 1.03 H new ATOM 782 N HIS A 48 4.073 9.226 -13.387 1.00 0.92 N ATOM 783 CA HIS A 48 4.662 10.557 -13.153 1.00 1.07 C ATOM 784 C HIS A 48 5.909 10.520 -12.245 1.00 1.12 C ATOM 785 O HIS A 48 6.794 11.365 -12.389 1.00 1.47 O ATOM 786 CB HIS A 48 3.609 11.539 -12.619 1.00 1.17 C ATOM 787 CG HIS A 48 2.203 11.368 -13.146 1.00 1.20 C ATOM 788 ND1 HIS A 48 1.734 11.634 -14.413 1.00 1.36 N ATOM 789 CD2 HIS A 48 1.121 11.001 -12.400 1.00 1.66 C ATOM 790 CE1 HIS A 48 0.399 11.478 -14.403 1.00 1.39 C ATOM 791 NE2 HIS A 48 -0.030 11.109 -13.185 1.00 1.70 N ATOM 0 H HIS A 48 3.267 9.018 -12.798 1.00 0.92 H new ATOM 0 HA HIS A 48 5.008 10.915 -14.123 1.00 1.07 H new ATOM 0 HB2 HIS A 48 3.580 11.452 -11.533 1.00 1.17 H new ATOM 0 HB3 HIS A 48 3.939 12.552 -12.848 1.00 1.17 H new ATOM 0 HD1 HIS A 48 2.300 11.902 -15.218 1.00 1.36 H new ATOM 0 HD2 HIS A 48 1.150 10.679 -11.369 1.00 1.66 H new ATOM 0 HE1 HIS A 48 -0.242 11.629 -15.259 1.00 1.39 H new ATOM 799 N MET A 49 6.026 9.512 -11.372 1.00 0.94 N ATOM 800 CA MET A 49 7.270 9.135 -10.668 1.00 1.09 C ATOM 801 C MET A 49 8.024 7.966 -11.344 1.00 1.11 C ATOM 802 O MET A 49 8.880 7.327 -10.722 1.00 1.22 O ATOM 803 CB MET A 49 6.958 8.813 -9.198 1.00 1.32 C ATOM 804 CG MET A 49 6.438 10.033 -8.432 1.00 2.55 C ATOM 805 SD MET A 49 6.159 9.712 -6.675 1.00 2.24 S ATOM 806 CE MET A 49 4.787 8.543 -6.812 1.00 1.32 C ATOM 0 H MET A 49 5.237 8.915 -11.125 1.00 0.94 H new ATOM 0 HA MET A 49 7.942 9.992 -10.720 1.00 1.09 H new ATOM 0 HB2 MET A 49 6.216 8.016 -9.153 1.00 1.32 H new ATOM 0 HB3 MET A 49 7.859 8.438 -8.712 1.00 1.32 H new ATOM 0 HG2 MET A 49 7.153 10.849 -8.536 1.00 2.55 H new ATOM 0 HG3 MET A 49 5.505 10.367 -8.885 1.00 2.55 H new ATOM 0 HE1 MET A 49 4.304 8.434 -5.841 1.00 1.32 H new ATOM 0 HE2 MET A 49 4.064 8.914 -7.538 1.00 1.32 H new ATOM 0 HE3 MET A 49 5.165 7.575 -7.140 1.00 1.32 H new ATOM 816 N LEU A 50 7.685 7.648 -12.596 1.00 1.32 N ATOM 817 CA LEU A 50 8.343 6.664 -13.440 1.00 1.57 C ATOM 818 C LEU A 50 9.458 7.320 -14.282 1.00 1.94 C ATOM 819 O LEU A 50 10.061 8.295 -13.858 1.00 2.37 O ATOM 820 CB LEU A 50 7.236 6.009 -14.284 1.00 1.92 C ATOM 821 CG LEU A 50 7.525 4.536 -14.568 1.00 2.02 C ATOM 822 CD1 LEU A 50 6.760 3.653 -13.578 1.00 2.11 C ATOM 823 CD2 LEU A 50 7.150 4.188 -16.014 1.00 2.63 C ATOM 0 H LEU A 50 6.901 8.098 -13.068 1.00 1.32 H new ATOM 0 HA LEU A 50 8.853 5.897 -12.857 1.00 1.57 H new ATOM 0 HB2 LEU A 50 6.283 6.097 -13.762 1.00 1.92 H new ATOM 0 HB3 LEU A 50 7.134 6.546 -15.227 1.00 1.92 H new ATOM 0 HG LEU A 50 8.592 4.352 -14.442 1.00 2.02 H new ATOM 0 HD11 LEU A 50 6.971 2.604 -13.787 1.00 2.11 H new ATOM 0 HD12 LEU A 50 7.073 3.891 -12.561 1.00 2.11 H new ATOM 0 HD13 LEU A 50 5.690 3.835 -13.680 1.00 2.11 H new ATOM 0 HD21 LEU A 50 7.362 3.135 -16.201 1.00 2.63 H new ATOM 0 HD22 LEU A 50 6.088 4.378 -16.170 1.00 2.63 H new ATOM 0 HD23 LEU A 50 7.733 4.803 -16.699 1.00 2.63 H new ATOM 835 N SER A 51 9.776 6.763 -15.455 1.00 3.14 N ATOM 836 CA SER A 51 10.832 7.210 -16.394 1.00 3.74 C ATOM 837 C SER A 51 12.262 6.992 -15.869 1.00 2.55 C ATOM 838 O SER A 51 13.134 6.629 -16.653 1.00 3.37 O ATOM 839 CB SER A 51 10.658 8.678 -16.818 1.00 5.31 C ATOM 840 OG SER A 51 11.497 8.960 -17.928 1.00 6.61 O ATOM 0 H SER A 51 9.281 5.942 -15.802 1.00 3.14 H new ATOM 0 HA SER A 51 10.702 6.571 -17.268 1.00 3.74 H new ATOM 0 HB2 SER A 51 9.617 8.870 -17.079 1.00 5.31 H new ATOM 0 HB3 SER A 51 10.905 9.338 -15.987 1.00 5.31 H new ATOM 0 HG SER A 51 11.382 9.896 -18.196 1.00 6.61 H new ATOM 846 N ASP A 52 12.498 7.154 -14.563 1.00 1.71 N ATOM 847 CA ASP A 52 13.759 6.895 -13.844 1.00 2.62 C ATOM 848 C ASP A 52 14.358 5.513 -14.156 1.00 2.57 C ATOM 849 O ASP A 52 15.574 5.352 -14.233 1.00 3.78 O ATOM 850 CB ASP A 52 13.453 7.040 -12.338 1.00 4.00 C ATOM 851 CG ASP A 52 14.392 6.225 -11.442 1.00 5.37 C ATOM 852 OD1 ASP A 52 15.472 6.738 -11.089 1.00 5.98 O ATOM 853 OD2 ASP A 52 14.009 5.065 -11.151 1.00 6.35 O ATOM 0 H ASP A 52 11.768 7.491 -13.935 1.00 1.71 H new ATOM 0 HA ASP A 52 14.515 7.611 -14.168 1.00 2.62 H new ATOM 0 HB2 ASP A 52 13.522 8.092 -12.061 1.00 4.00 H new ATOM 0 HB3 ASP A 52 12.425 6.728 -12.153 1.00 4.00 H new ATOM 858 N THR A 53 13.484 4.519 -14.358 1.00 2.56 N ATOM 859 CA THR A 53 13.769 3.176 -14.865 1.00 2.22 C ATOM 860 C THR A 53 14.456 2.257 -13.851 1.00 1.97 C ATOM 861 O THR A 53 14.205 1.054 -13.916 1.00 1.71 O ATOM 862 CB THR A 53 14.466 3.259 -16.228 1.00 2.45 C ATOM 863 OG1 THR A 53 13.577 3.933 -17.091 1.00 2.80 O ATOM 864 CG2 THR A 53 14.662 1.882 -16.846 1.00 2.56 C ATOM 0 H THR A 53 12.492 4.643 -14.157 1.00 2.56 H new ATOM 0 HA THR A 53 12.814 2.675 -15.026 1.00 2.22 H new ATOM 0 HB THR A 53 15.433 3.745 -16.098 1.00 2.45 H new ATOM 0 HG1 THR A 53 13.536 4.880 -16.844 1.00 2.80 H new ATOM 0 HG21 THR A 53 15.159 1.984 -17.811 1.00 2.56 H new ATOM 0 HG22 THR A 53 15.275 1.270 -16.184 1.00 2.56 H new ATOM 0 HG23 THR A 53 13.692 1.405 -16.986 1.00 2.56 H new ATOM 872 N GLY A 54 15.157 2.770 -12.835 1.00 2.22 N ATOM 873 CA GLY A 54 15.489 2.001 -11.623 1.00 2.25 C ATOM 874 C GLY A 54 14.210 1.481 -10.958 1.00 1.90 C ATOM 875 O GLY A 54 14.052 0.273 -10.759 1.00 1.74 O ATOM 0 H GLY A 54 15.511 3.727 -12.826 1.00 2.22 H new ATOM 0 HA2 GLY A 54 16.139 1.165 -11.881 1.00 2.25 H new ATOM 0 HA3 GLY A 54 16.041 2.630 -10.924 1.00 2.25 H new ATOM 879 N ASN A 55 13.248 2.390 -10.781 1.00 1.83 N ATOM 880 CA ASN A 55 11.817 2.161 -10.568 1.00 1.48 C ATOM 881 C ASN A 55 11.308 0.973 -11.414 1.00 1.08 C ATOM 882 O ASN A 55 10.945 -0.074 -10.875 1.00 1.09 O ATOM 883 CB ASN A 55 11.124 3.504 -10.912 1.00 1.34 C ATOM 884 CG ASN A 55 9.600 3.477 -10.950 1.00 2.81 C ATOM 885 OD1 ASN A 55 8.996 2.582 -11.522 1.00 4.17 O ATOM 886 ND2 ASN A 55 8.929 4.482 -10.423 1.00 3.35 N ATOM 0 H ASN A 55 13.468 3.386 -10.783 1.00 1.83 H new ATOM 0 HA ASN A 55 11.592 1.876 -9.540 1.00 1.48 H new ATOM 0 HB2 ASN A 55 11.437 4.250 -10.181 1.00 1.34 H new ATOM 0 HB3 ASN A 55 11.486 3.839 -11.884 1.00 1.34 H new ATOM 0 HD21 ASN A 55 7.912 4.509 -10.494 1.00 3.35 H new ATOM 0 HD22 ASN A 55 9.427 5.232 -9.944 1.00 3.35 H new ATOM 893 N ARG A 56 11.327 1.089 -12.750 1.00 0.97 N ATOM 894 CA ARG A 56 10.809 0.102 -13.669 1.00 0.85 C ATOM 895 C ARG A 56 11.418 -1.290 -13.517 1.00 0.75 C ATOM 896 O ARG A 56 10.683 -2.273 -13.472 1.00 0.68 O ATOM 897 CB ARG A 56 11.092 0.680 -15.068 1.00 1.32 C ATOM 898 CG ARG A 56 10.345 0.030 -16.216 1.00 1.81 C ATOM 899 CD ARG A 56 8.997 0.701 -16.447 1.00 1.41 C ATOM 900 NE ARG A 56 8.129 0.717 -15.261 1.00 2.78 N ATOM 901 CZ ARG A 56 7.307 -0.269 -14.938 1.00 4.04 C ATOM 902 NH1 ARG A 56 7.352 -1.435 -15.542 1.00 4.54 N ATOM 903 NH2 ARG A 56 6.381 -0.118 -14.021 1.00 5.81 N ATOM 0 H ARG A 56 11.719 1.904 -13.222 1.00 0.97 H new ATOM 0 HA ARG A 56 9.749 -0.063 -13.474 1.00 0.85 H new ATOM 0 HB2 ARG A 56 10.849 1.743 -15.057 1.00 1.32 H new ATOM 0 HB3 ARG A 56 12.161 0.600 -15.264 1.00 1.32 H new ATOM 0 HG2 ARG A 56 10.945 0.091 -17.124 1.00 1.81 H new ATOM 0 HG3 ARG A 56 10.195 -1.028 -16.003 1.00 1.81 H new ATOM 0 HD2 ARG A 56 9.164 1.726 -16.777 1.00 1.41 H new ATOM 0 HD3 ARG A 56 8.480 0.186 -17.257 1.00 1.41 H new ATOM 0 HE ARG A 56 8.162 1.535 -14.652 1.00 2.78 H new ATOM 0 HH11 ARG A 56 8.034 -1.600 -16.282 1.00 4.54 H new ATOM 0 HH12 ARG A 56 6.705 -2.175 -15.271 1.00 4.54 H new ATOM 0 HH21 ARG A 56 6.282 0.775 -13.538 1.00 5.81 H new ATOM 0 HH22 ARG A 56 5.760 -0.894 -13.791 1.00 5.81 H new ATOM 917 N LYS A 57 12.745 -1.397 -13.413 1.00 0.86 N ATOM 918 CA LYS A 57 13.446 -2.679 -13.240 1.00 0.85 C ATOM 919 C LYS A 57 13.122 -3.319 -11.892 1.00 0.78 C ATOM 920 O LYS A 57 13.039 -4.540 -11.794 1.00 0.79 O ATOM 921 CB LYS A 57 14.958 -2.437 -13.290 1.00 1.06 C ATOM 922 CG LYS A 57 15.482 -1.881 -14.616 1.00 1.23 C ATOM 923 CD LYS A 57 15.588 -2.878 -15.784 1.00 1.30 C ATOM 924 CE LYS A 57 16.484 -4.090 -15.487 1.00 2.39 C ATOM 925 NZ LYS A 57 16.629 -4.974 -16.673 1.00 3.02 N ATOM 0 H LYS A 57 13.371 -0.592 -13.446 1.00 0.86 H new ATOM 0 HA LYS A 57 13.121 -3.345 -14.039 1.00 0.85 H new ATOM 0 HB2 LYS A 57 15.226 -1.745 -12.492 1.00 1.06 H new ATOM 0 HB3 LYS A 57 15.468 -3.377 -13.081 1.00 1.06 H new ATOM 0 HG2 LYS A 57 14.831 -1.063 -14.924 1.00 1.23 H new ATOM 0 HG3 LYS A 57 16.470 -1.454 -14.441 1.00 1.23 H new ATOM 0 HD2 LYS A 57 14.589 -3.231 -16.040 1.00 1.30 H new ATOM 0 HD3 LYS A 57 15.976 -2.357 -16.660 1.00 1.30 H new ATOM 0 HE2 LYS A 57 17.468 -3.745 -15.168 1.00 2.39 H new ATOM 0 HE3 LYS A 57 16.062 -4.659 -14.659 1.00 2.39 H new ATOM 0 HZ1 LYS A 57 17.241 -5.780 -16.432 1.00 3.02 H new ATOM 0 HZ2 LYS A 57 15.693 -5.324 -16.962 1.00 3.02 H new ATOM 0 HZ3 LYS A 57 17.055 -4.438 -17.456 1.00 3.02 H new ATOM 939 N ALA A 58 12.962 -2.477 -10.867 1.00 0.79 N ATOM 940 CA ALA A 58 12.657 -2.912 -9.498 1.00 0.81 C ATOM 941 C ALA A 58 11.374 -3.752 -9.410 1.00 0.85 C ATOM 942 O ALA A 58 11.349 -4.688 -8.615 1.00 1.12 O ATOM 943 CB ALA A 58 12.608 -1.709 -8.545 1.00 0.84 C ATOM 0 H ALA A 58 13.041 -1.465 -10.963 1.00 0.79 H new ATOM 0 HA ALA A 58 13.469 -3.568 -9.185 1.00 0.81 H new ATOM 0 HB1 ALA A 58 12.381 -2.053 -7.536 1.00 0.84 H new ATOM 0 HB2 ALA A 58 13.574 -1.204 -8.547 1.00 0.84 H new ATOM 0 HB3 ALA A 58 11.835 -1.015 -8.875 1.00 0.84 H new ATOM 949 N ALA A 59 10.375 -3.478 -10.258 1.00 0.75 N ATOM 950 CA ALA A 59 9.149 -4.273 -10.379 1.00 0.80 C ATOM 951 C ALA A 59 9.415 -5.707 -10.865 1.00 0.94 C ATOM 952 O ALA A 59 8.860 -6.663 -10.330 1.00 0.92 O ATOM 953 CB ALA A 59 8.214 -3.549 -11.361 1.00 0.83 C ATOM 0 H ALA A 59 10.398 -2.680 -10.893 1.00 0.75 H new ATOM 0 HA ALA A 59 8.695 -4.364 -9.392 1.00 0.80 H new ATOM 0 HB1 ALA A 59 7.291 -4.118 -11.472 1.00 0.83 H new ATOM 0 HB2 ALA A 59 7.983 -2.555 -10.978 1.00 0.83 H new ATOM 0 HB3 ALA A 59 8.704 -3.460 -12.331 1.00 0.83 H new ATOM 959 N ASP A 60 10.270 -5.866 -11.878 1.00 1.11 N ATOM 960 CA ASP A 60 10.543 -7.162 -12.507 1.00 1.27 C ATOM 961 C ASP A 60 11.414 -8.087 -11.636 1.00 1.31 C ATOM 962 O ASP A 60 11.299 -9.308 -11.747 1.00 1.45 O ATOM 963 CB ASP A 60 11.146 -6.944 -13.910 1.00 1.28 C ATOM 964 CG ASP A 60 10.264 -7.556 -15.002 1.00 2.11 C ATOM 965 OD1 ASP A 60 9.110 -7.099 -15.155 1.00 2.33 O ATOM 966 OD2 ASP A 60 10.712 -8.477 -15.714 1.00 3.49 O ATOM 0 H ASP A 60 10.796 -5.094 -12.288 1.00 1.11 H new ATOM 0 HA ASP A 60 9.593 -7.686 -12.612 1.00 1.27 H new ATOM 0 HB2 ASP A 60 11.266 -5.876 -14.094 1.00 1.28 H new ATOM 0 HB3 ASP A 60 12.140 -7.388 -13.953 1.00 1.28 H new ATOM 971 N LYS A 61 12.198 -7.537 -10.692 1.00 1.24 N ATOM 972 CA LYS A 61 12.812 -8.326 -9.604 1.00 1.37 C ATOM 973 C LYS A 61 11.773 -9.121 -8.810 1.00 1.29 C ATOM 974 O LYS A 61 12.020 -10.247 -8.382 1.00 1.33 O ATOM 975 CB LYS A 61 13.529 -7.403 -8.606 1.00 1.43 C ATOM 976 CG LYS A 61 14.483 -6.431 -9.284 1.00 1.73 C ATOM 977 CD LYS A 61 15.552 -5.880 -8.331 1.00 2.00 C ATOM 978 CE LYS A 61 14.939 -5.286 -7.050 1.00 2.09 C ATOM 979 NZ LYS A 61 15.970 -4.692 -6.163 1.00 3.11 N ATOM 0 H LYS A 61 12.424 -6.543 -10.659 1.00 1.24 H new ATOM 0 HA LYS A 61 13.511 -9.011 -10.085 1.00 1.37 H new ATOM 0 HB2 LYS A 61 12.786 -6.841 -8.040 1.00 1.43 H new ATOM 0 HB3 LYS A 61 14.084 -8.010 -7.890 1.00 1.43 H new ATOM 0 HG2 LYS A 61 14.972 -6.933 -10.119 1.00 1.73 H new ATOM 0 HG3 LYS A 61 13.912 -5.601 -9.701 1.00 1.73 H new ATOM 0 HD2 LYS A 61 16.244 -6.678 -8.064 1.00 2.00 H new ATOM 0 HD3 LYS A 61 16.132 -5.113 -8.843 1.00 2.00 H new ATOM 0 HE2 LYS A 61 14.208 -4.523 -7.318 1.00 2.09 H new ATOM 0 HE3 LYS A 61 14.402 -6.066 -6.510 1.00 2.09 H new ATOM 0 HZ1 LYS A 61 15.514 -4.304 -5.313 1.00 3.11 H new ATOM 0 HZ2 LYS A 61 16.653 -5.425 -5.886 1.00 3.11 H new ATOM 0 HZ3 LYS A 61 16.466 -3.930 -6.668 1.00 3.11 H new ATOM 993 N LEU A 62 10.614 -8.497 -8.611 1.00 1.15 N ATOM 994 CA LEU A 62 9.480 -9.100 -7.911 1.00 1.04 C ATOM 995 C LEU A 62 8.783 -10.136 -8.783 1.00 1.05 C ATOM 996 O LEU A 62 8.457 -11.205 -8.289 1.00 1.08 O ATOM 997 CB LEU A 62 8.446 -8.060 -7.467 1.00 0.92 C ATOM 998 CG LEU A 62 8.968 -6.741 -6.888 1.00 0.89 C ATOM 999 CD1 LEU A 62 7.737 -5.893 -6.546 1.00 0.84 C ATOM 1000 CD2 LEU A 62 9.869 -6.969 -5.662 1.00 0.97 C ATOM 0 H LEU A 62 10.433 -7.547 -8.935 1.00 1.15 H new ATOM 0 HA LEU A 62 9.896 -9.578 -7.024 1.00 1.04 H new ATOM 0 HB2 LEU A 62 7.817 -7.824 -8.326 1.00 0.92 H new ATOM 0 HB3 LEU A 62 7.803 -8.524 -6.719 1.00 0.92 H new ATOM 0 HG LEU A 62 9.598 -6.226 -7.613 1.00 0.89 H new ATOM 0 HD11 LEU A 62 8.057 -4.939 -6.128 1.00 0.84 H new ATOM 0 HD12 LEU A 62 7.154 -5.716 -7.450 1.00 0.84 H new ATOM 0 HD13 LEU A 62 7.123 -6.421 -5.816 1.00 0.84 H new ATOM 0 HD21 LEU A 62 10.217 -6.008 -5.283 1.00 0.97 H new ATOM 0 HD22 LEU A 62 9.303 -7.482 -4.885 1.00 0.97 H new ATOM 0 HD23 LEU A 62 10.726 -7.578 -5.949 1.00 0.97 H new ATOM 1012 N ILE A 63 8.556 -9.845 -10.068 1.00 1.04 N ATOM 1013 CA ILE A 63 7.792 -10.758 -10.934 1.00 1.11 C ATOM 1014 C ILE A 63 8.468 -12.128 -11.035 1.00 1.16 C ATOM 1015 O ILE A 63 7.767 -13.128 -10.979 1.00 1.09 O ATOM 1016 CB ILE A 63 7.541 -10.138 -12.329 1.00 1.07 C ATOM 1017 CG1 ILE A 63 6.883 -8.740 -12.281 1.00 1.05 C ATOM 1018 CG2 ILE A 63 6.660 -11.083 -13.166 1.00 1.23 C ATOM 1019 CD1 ILE A 63 5.797 -8.534 -11.234 1.00 1.35 C ATOM 0 H ILE A 63 8.884 -8.997 -10.530 1.00 1.04 H new ATOM 0 HA ILE A 63 6.817 -10.912 -10.471 1.00 1.11 H new ATOM 0 HB ILE A 63 8.522 -10.009 -12.786 1.00 1.07 H new ATOM 0 HG12 ILE A 63 7.666 -8.001 -12.110 1.00 1.05 H new ATOM 0 HG13 ILE A 63 6.455 -8.531 -13.261 1.00 1.05 H new ATOM 0 HG21 ILE A 63 6.485 -10.643 -14.148 1.00 1.23 H new ATOM 0 HG22 ILE A 63 7.164 -12.042 -13.283 1.00 1.23 H new ATOM 0 HG23 ILE A 63 5.706 -11.234 -12.661 1.00 1.23 H new ATOM 0 HD11 ILE A 63 5.415 -7.515 -11.302 1.00 1.35 H new ATOM 0 HD12 ILE A 63 4.984 -9.239 -11.409 1.00 1.35 H new ATOM 0 HD13 ILE A 63 6.213 -8.700 -10.240 1.00 1.35 H new ATOM 1031 N GLN A 64 9.799 -12.185 -11.111 1.00 1.31 N ATOM 1032 CA GLN A 64 10.569 -13.444 -11.131 1.00 1.45 C ATOM 1033 C GLN A 64 10.599 -14.160 -9.771 1.00 1.51 C ATOM 1034 O GLN A 64 10.497 -15.380 -9.698 1.00 1.64 O ATOM 1035 CB GLN A 64 11.978 -13.142 -11.666 1.00 1.47 C ATOM 1036 CG GLN A 64 12.859 -12.289 -10.749 1.00 1.51 C ATOM 1037 CD GLN A 64 14.215 -11.948 -11.354 1.00 1.53 C ATOM 1038 OE1 GLN A 64 15.261 -12.164 -10.771 1.00 2.40 O ATOM 1039 NE2 GLN A 64 14.282 -11.377 -12.535 1.00 1.94 N ATOM 0 H GLN A 64 10.385 -11.352 -11.161 1.00 1.31 H new ATOM 0 HA GLN A 64 10.069 -14.149 -11.795 1.00 1.45 H new ATOM 0 HB2 GLN A 64 12.487 -14.087 -11.855 1.00 1.47 H new ATOM 0 HB3 GLN A 64 11.883 -12.634 -12.626 1.00 1.47 H new ATOM 0 HG2 GLN A 64 12.333 -11.364 -10.511 1.00 1.51 H new ATOM 0 HG3 GLN A 64 13.012 -12.820 -9.809 1.00 1.51 H new ATOM 0 HE21 GLN A 64 13.427 -11.179 -13.055 1.00 1.94 H new ATOM 0 HE22 GLN A 64 15.189 -11.131 -12.932 1.00 1.94 H new ATOM 1048 N ASN A 65 10.684 -13.392 -8.689 1.00 1.46 N ATOM 1049 CA ASN A 65 10.543 -13.869 -7.306 1.00 1.52 C ATOM 1050 C ASN A 65 9.142 -14.454 -7.021 1.00 1.53 C ATOM 1051 O ASN A 65 9.020 -15.432 -6.281 1.00 1.61 O ATOM 1052 CB ASN A 65 10.916 -12.678 -6.398 1.00 1.44 C ATOM 1053 CG ASN A 65 10.449 -12.775 -4.953 1.00 2.19 C ATOM 1054 OD1 ASN A 65 9.284 -12.585 -4.649 1.00 3.38 O ATOM 1055 ND2 ASN A 65 11.331 -13.023 -4.007 1.00 3.26 N ATOM 0 H ASN A 65 10.858 -12.389 -8.746 1.00 1.46 H new ATOM 0 HA ASN A 65 11.209 -14.709 -7.109 1.00 1.52 H new ATOM 0 HB2 ASN A 65 12.000 -12.567 -6.403 1.00 1.44 H new ATOM 0 HB3 ASN A 65 10.501 -11.769 -6.834 1.00 1.44 H new ATOM 0 HD21 ASN A 65 11.037 -13.055 -3.031 1.00 3.26 H new ATOM 0 HD22 ASN A 65 12.308 -13.183 -4.250 1.00 3.26 H new ATOM 1062 N LEU A 66 8.096 -13.888 -7.632 1.00 1.45 N ATOM 1063 CA LEU A 66 6.709 -14.329 -7.511 1.00 1.42 C ATOM 1064 C LEU A 66 6.410 -15.501 -8.450 1.00 1.51 C ATOM 1065 O LEU A 66 5.638 -16.384 -8.073 1.00 1.65 O ATOM 1066 CB LEU A 66 5.807 -13.127 -7.845 1.00 1.23 C ATOM 1067 CG LEU A 66 4.317 -13.373 -7.537 1.00 1.04 C ATOM 1068 CD1 LEU A 66 4.036 -13.180 -6.044 1.00 1.92 C ATOM 1069 CD2 LEU A 66 3.473 -12.414 -8.374 1.00 2.58 C ATOM 0 H LEU A 66 8.200 -13.080 -8.246 1.00 1.45 H new ATOM 0 HA LEU A 66 6.522 -14.682 -6.497 1.00 1.42 H new ATOM 0 HB2 LEU A 66 6.148 -12.259 -7.281 1.00 1.23 H new ATOM 0 HB3 LEU A 66 5.916 -12.883 -8.902 1.00 1.23 H new ATOM 0 HG LEU A 66 4.058 -14.400 -7.792 1.00 1.04 H new ATOM 0 HD11 LEU A 66 2.979 -13.358 -5.847 1.00 1.92 H new ATOM 0 HD12 LEU A 66 4.636 -13.883 -5.467 1.00 1.92 H new ATOM 0 HD13 LEU A 66 4.293 -12.161 -5.754 1.00 1.92 H new ATOM 0 HD21 LEU A 66 2.417 -12.580 -8.163 1.00 2.58 H new ATOM 0 HD22 LEU A 66 3.735 -11.386 -8.125 1.00 2.58 H new ATOM 0 HD23 LEU A 66 3.664 -12.590 -9.433 1.00 2.58 H new ATOM 1081 N ASP A 67 7.001 -15.493 -9.652 1.00 1.54 N ATOM 1082 CA ASP A 67 6.704 -16.376 -10.781 1.00 1.53 C ATOM 1083 C ASP A 67 6.531 -17.836 -10.368 1.00 1.62 C ATOM 1084 O ASP A 67 5.457 -18.406 -10.575 1.00 2.08 O ATOM 1085 CB ASP A 67 7.789 -16.259 -11.870 1.00 1.99 C ATOM 1086 CG ASP A 67 7.535 -17.246 -13.012 1.00 2.79 C ATOM 1087 OD1 ASP A 67 6.575 -16.988 -13.773 1.00 2.71 O ATOM 1088 OD2 ASP A 67 8.209 -18.292 -13.057 1.00 4.42 O ATOM 0 H ASP A 67 7.743 -14.829 -9.873 1.00 1.54 H new ATOM 0 HA ASP A 67 5.748 -16.042 -11.185 1.00 1.53 H new ATOM 0 HB2 ASP A 67 7.807 -15.242 -12.262 1.00 1.99 H new ATOM 0 HB3 ASP A 67 8.769 -16.449 -11.433 1.00 1.99 H new ATOM 1093 N ALA A 68 7.570 -18.376 -9.728 1.00 1.64 N ATOM 1094 CA ALA A 68 7.692 -19.757 -9.273 1.00 1.94 C ATOM 1095 C ALA A 68 6.552 -20.239 -8.350 1.00 1.93 C ATOM 1096 O ALA A 68 6.407 -21.440 -8.145 1.00 2.32 O ATOM 1097 CB ALA A 68 9.059 -19.854 -8.579 1.00 2.30 C ATOM 0 H ALA A 68 8.398 -17.825 -9.501 1.00 1.64 H new ATOM 0 HA ALA A 68 7.613 -20.422 -10.133 1.00 1.94 H new ATOM 0 HB1 ALA A 68 9.211 -20.870 -8.214 1.00 2.30 H new ATOM 0 HB2 ALA A 68 9.846 -19.602 -9.289 1.00 2.30 H new ATOM 0 HB3 ALA A 68 9.091 -19.159 -7.740 1.00 2.30 H new ATOM 1103 N ASN A 69 5.766 -19.319 -7.783 1.00 1.64 N ATOM 1104 CA ASN A 69 4.738 -19.599 -6.776 1.00 1.77 C ATOM 1105 C ASN A 69 3.301 -19.394 -7.305 1.00 1.57 C ATOM 1106 O ASN A 69 2.350 -19.532 -6.539 1.00 2.04 O ATOM 1107 CB ASN A 69 4.980 -18.683 -5.561 1.00 2.01 C ATOM 1108 CG ASN A 69 6.419 -18.680 -5.059 1.00 1.92 C ATOM 1109 OD1 ASN A 69 6.805 -19.468 -4.207 1.00 2.33 O ATOM 1110 ND2 ASN A 69 7.235 -17.760 -5.549 1.00 1.84 N ATOM 0 H ASN A 69 5.829 -18.329 -8.019 1.00 1.64 H new ATOM 0 HA ASN A 69 4.820 -20.650 -6.500 1.00 1.77 H new ATOM 0 HB2 ASN A 69 4.697 -17.664 -5.826 1.00 2.01 H new ATOM 0 HB3 ASN A 69 4.324 -18.995 -4.748 1.00 2.01 H new ATOM 0 HD21 ASN A 69 8.198 -17.703 -5.216 1.00 1.84 H new ATOM 0 HD22 ASN A 69 6.901 -17.108 -6.259 1.00 1.84 H new ATOM 1117 N HIS A 70 3.119 -18.967 -8.562 1.00 1.30 N ATOM 1118 CA HIS A 70 1.827 -18.469 -9.070 1.00 1.24 C ATOM 1119 C HIS A 70 1.506 -18.982 -10.492 1.00 1.38 C ATOM 1120 O HIS A 70 1.975 -18.429 -11.489 1.00 1.61 O ATOM 1121 CB HIS A 70 1.817 -16.923 -9.032 1.00 1.23 C ATOM 1122 CG HIS A 70 1.572 -16.325 -7.668 1.00 1.78 C ATOM 1123 ND1 HIS A 70 2.388 -16.426 -6.568 1.00 2.61 N ATOM 1124 CD2 HIS A 70 0.497 -15.567 -7.287 1.00 2.71 C ATOM 1125 CE1 HIS A 70 1.801 -15.788 -5.543 1.00 3.35 C ATOM 1126 NE2 HIS A 70 0.646 -15.242 -5.939 1.00 3.45 N ATOM 0 H HIS A 70 3.863 -18.956 -9.259 1.00 1.30 H new ATOM 0 HA HIS A 70 1.045 -18.859 -8.419 1.00 1.24 H new ATOM 0 HB2 HIS A 70 2.773 -16.558 -9.407 1.00 1.23 H new ATOM 0 HB3 HIS A 70 1.048 -16.562 -9.715 1.00 1.23 H new ATOM 0 HD2 HIS A 70 -0.325 -15.272 -7.922 1.00 2.71 H new ATOM 0 HE1 HIS A 70 2.203 -15.725 -4.543 1.00 3.35 H new ATOM 0 HE2 HIS A 70 0.001 -14.696 -5.368 1.00 3.45 H new ATOM 1134 N ASP A 71 0.643 -19.996 -10.596 1.00 1.70 N ATOM 1135 CA ASP A 71 0.323 -20.769 -11.815 1.00 2.10 C ATOM 1136 C ASP A 71 -0.622 -20.038 -12.807 1.00 2.22 C ATOM 1137 O ASP A 71 -1.472 -20.659 -13.456 1.00 3.05 O ATOM 1138 CB ASP A 71 -0.327 -22.123 -11.430 1.00 2.67 C ATOM 1139 CG ASP A 71 0.027 -22.767 -10.087 1.00 3.41 C ATOM 1140 OD1 ASP A 71 -0.240 -22.099 -9.062 1.00 3.93 O ATOM 1141 OD2 ASP A 71 0.405 -23.954 -10.102 1.00 4.66 O ATOM 0 H ASP A 71 0.114 -20.324 -9.788 1.00 1.70 H new ATOM 0 HA ASP A 71 1.276 -20.910 -12.325 1.00 2.10 H new ATOM 0 HB2 ASP A 71 -1.408 -21.986 -11.453 1.00 2.67 H new ATOM 0 HB3 ASP A 71 -0.080 -22.840 -12.213 1.00 2.67 H new ATOM 1146 N GLY A 72 -0.616 -18.702 -12.816 1.00 2.15 N ATOM 1147 CA GLY A 72 -1.815 -17.928 -13.174 1.00 2.43 C ATOM 1148 C GLY A 72 -2.846 -17.974 -12.041 1.00 2.13 C ATOM 1149 O GLY A 72 -4.052 -18.031 -12.278 1.00 2.37 O ATOM 0 H GLY A 72 0.198 -18.134 -12.582 1.00 2.15 H new ATOM 0 HA2 GLY A 72 -1.539 -16.894 -13.380 1.00 2.43 H new ATOM 0 HA3 GLY A 72 -2.253 -18.329 -14.088 1.00 2.43 H new ATOM 1153 N ARG A 73 -2.371 -18.038 -10.793 1.00 1.96 N ATOM 1154 CA ARG A 73 -3.142 -17.733 -9.580 1.00 1.83 C ATOM 1155 C ARG A 73 -2.878 -16.275 -9.186 1.00 1.61 C ATOM 1156 O ARG A 73 -1.886 -15.703 -9.633 1.00 2.09 O ATOM 1157 CB ARG A 73 -2.780 -18.687 -8.425 1.00 2.06 C ATOM 1158 CG ARG A 73 -2.857 -20.168 -8.801 1.00 2.65 C ATOM 1159 CD ARG A 73 -4.290 -20.635 -9.062 1.00 2.82 C ATOM 1160 NE ARG A 73 -4.284 -21.924 -9.777 1.00 3.75 N ATOM 1161 CZ ARG A 73 -3.978 -22.084 -11.062 1.00 4.82 C ATOM 1162 NH1 ARG A 73 -3.906 -21.067 -11.902 1.00 5.39 N ATOM 1163 NH2 ARG A 73 -3.686 -23.286 -11.513 1.00 5.91 N ATOM 0 H ARG A 73 -1.409 -18.312 -10.591 1.00 1.96 H new ATOM 0 HA ARG A 73 -4.203 -17.875 -9.786 1.00 1.83 H new ATOM 0 HB2 ARG A 73 -1.770 -18.461 -8.082 1.00 2.06 H new ATOM 0 HB3 ARG A 73 -3.451 -18.499 -7.587 1.00 2.06 H new ATOM 0 HG2 ARG A 73 -2.253 -20.345 -9.691 1.00 2.65 H new ATOM 0 HG3 ARG A 73 -2.424 -20.766 -7.999 1.00 2.65 H new ATOM 0 HD2 ARG A 73 -4.824 -20.737 -8.118 1.00 2.82 H new ATOM 0 HD3 ARG A 73 -4.822 -19.887 -9.650 1.00 2.82 H new ATOM 0 HE ARG A 73 -4.534 -22.758 -9.245 1.00 3.75 H new ATOM 0 HH11 ARG A 73 -4.088 -20.119 -11.572 1.00 5.39 H new ATOM 0 HH12 ARG A 73 -3.668 -21.230 -12.881 1.00 5.39 H new ATOM 0 HH21 ARG A 73 -3.696 -24.085 -10.879 1.00 5.91 H new ATOM 0 HH22 ARG A 73 -3.450 -23.418 -12.497 1.00 5.91 H new ATOM 1177 N ILE A 74 -3.780 -15.693 -8.399 1.00 1.38 N ATOM 1178 CA ILE A 74 -3.811 -14.280 -8.005 1.00 1.22 C ATOM 1179 C ILE A 74 -4.343 -14.203 -6.576 1.00 1.09 C ATOM 1180 O ILE A 74 -5.297 -14.919 -6.250 1.00 1.40 O ATOM 1181 CB ILE A 74 -4.724 -13.477 -8.973 1.00 1.64 C ATOM 1182 CG1 ILE A 74 -4.118 -13.332 -10.386 1.00 1.60 C ATOM 1183 CG2 ILE A 74 -5.117 -12.085 -8.434 1.00 2.23 C ATOM 1184 CD1 ILE A 74 -2.838 -12.484 -10.459 1.00 2.03 C ATOM 0 H ILE A 74 -4.553 -16.221 -7.995 1.00 1.38 H new ATOM 0 HA ILE A 74 -2.812 -13.847 -8.054 1.00 1.22 H new ATOM 0 HB ILE A 74 -5.632 -14.076 -9.044 1.00 1.64 H new ATOM 0 HG12 ILE A 74 -3.900 -14.326 -10.775 1.00 1.60 H new ATOM 0 HG13 ILE A 74 -4.867 -12.890 -11.043 1.00 1.60 H new ATOM 0 HG21 ILE A 74 -5.754 -11.580 -9.160 1.00 2.23 H new ATOM 0 HG22 ILE A 74 -5.657 -12.198 -7.494 1.00 2.23 H new ATOM 0 HG23 ILE A 74 -4.218 -11.492 -8.267 1.00 2.23 H new ATOM 0 HD11 ILE A 74 -2.489 -12.441 -11.491 1.00 2.03 H new ATOM 0 HD12 ILE A 74 -3.049 -11.475 -10.105 1.00 2.03 H new ATOM 0 HD13 ILE A 74 -2.067 -12.934 -9.833 1.00 2.03 H new ATOM 1196 N SER A 75 -3.786 -13.328 -5.751 1.00 0.94 N ATOM 1197 CA SER A 75 -4.371 -12.940 -4.471 1.00 0.88 C ATOM 1198 C SER A 75 -4.736 -11.445 -4.429 1.00 0.86 C ATOM 1199 O SER A 75 -4.450 -10.685 -5.351 1.00 1.23 O ATOM 1200 CB SER A 75 -3.436 -13.325 -3.320 1.00 0.96 C ATOM 1201 OG SER A 75 -4.171 -13.362 -2.109 1.00 1.92 O ATOM 0 H SER A 75 -2.903 -12.860 -5.953 1.00 0.94 H new ATOM 0 HA SER A 75 -5.306 -13.488 -4.352 1.00 0.88 H new ATOM 0 HB2 SER A 75 -2.984 -14.298 -3.514 1.00 0.96 H new ATOM 0 HB3 SER A 75 -2.621 -12.605 -3.242 1.00 0.96 H new ATOM 0 HG SER A 75 -4.020 -12.533 -1.609 1.00 1.92 H new ATOM 1207 N PHE A 76 -5.400 -11.022 -3.351 1.00 0.71 N ATOM 1208 CA PHE A 76 -5.764 -9.627 -3.100 1.00 0.74 C ATOM 1209 C PHE A 76 -4.569 -8.803 -2.583 1.00 0.86 C ATOM 1210 O PHE A 76 -4.299 -7.690 -3.034 1.00 1.04 O ATOM 1211 CB PHE A 76 -6.898 -9.614 -2.068 1.00 0.76 C ATOM 1212 CG PHE A 76 -7.301 -8.199 -1.738 1.00 0.90 C ATOM 1213 CD1 PHE A 76 -7.939 -7.429 -2.725 1.00 2.21 C ATOM 1214 CD2 PHE A 76 -6.897 -7.601 -0.534 1.00 1.99 C ATOM 1215 CE1 PHE A 76 -8.153 -6.060 -2.531 1.00 2.33 C ATOM 1216 CE2 PHE A 76 -7.148 -6.236 -0.328 1.00 2.11 C ATOM 1217 CZ PHE A 76 -7.770 -5.467 -1.320 1.00 1.37 C ATOM 0 H PHE A 76 -5.706 -11.655 -2.612 1.00 0.71 H new ATOM 0 HA PHE A 76 -6.082 -9.168 -4.036 1.00 0.74 H new ATOM 0 HB2 PHE A 76 -7.757 -10.161 -2.457 1.00 0.76 H new ATOM 0 HB3 PHE A 76 -6.577 -10.127 -1.161 1.00 0.76 H new ATOM 0 HD1 PHE A 76 -8.267 -7.898 -3.641 1.00 2.21 H new ATOM 0 HD2 PHE A 76 -6.398 -8.185 0.225 1.00 1.99 H new ATOM 0 HE1 PHE A 76 -8.610 -5.465 -3.308 1.00 2.33 H new ATOM 0 HE2 PHE A 76 -6.859 -5.774 0.604 1.00 2.11 H new ATOM 0 HZ PHE A 76 -7.955 -4.416 -1.152 1.00 1.37 H new ATOM 1227 N ASP A 77 -3.874 -9.371 -1.596 1.00 0.88 N ATOM 1228 CA ASP A 77 -2.721 -8.810 -0.893 1.00 1.08 C ATOM 1229 C ASP A 77 -1.434 -8.806 -1.737 1.00 1.02 C ATOM 1230 O ASP A 77 -0.566 -7.967 -1.494 1.00 1.17 O ATOM 1231 CB ASP A 77 -2.520 -9.617 0.404 1.00 1.29 C ATOM 1232 CG ASP A 77 -2.180 -11.093 0.150 1.00 1.64 C ATOM 1233 OD1 ASP A 77 -3.021 -11.783 -0.480 1.00 2.50 O ATOM 1234 OD2 ASP A 77 -1.091 -11.525 0.581 1.00 2.77 O ATOM 0 H ASP A 77 -4.119 -10.297 -1.244 1.00 0.88 H new ATOM 0 HA ASP A 77 -2.927 -7.762 -0.676 1.00 1.08 H new ATOM 0 HB2 ASP A 77 -1.720 -9.162 0.988 1.00 1.29 H new ATOM 0 HB3 ASP A 77 -3.427 -9.558 1.006 1.00 1.29 H new ATOM 1239 N GLU A 78 -1.348 -9.695 -2.736 1.00 0.88 N ATOM 1240 CA GLU A 78 -0.273 -9.798 -3.733 1.00 0.84 C ATOM 1241 C GLU A 78 0.048 -8.428 -4.341 1.00 0.73 C ATOM 1242 O GLU A 78 1.153 -7.904 -4.193 1.00 0.76 O ATOM 1243 CB GLU A 78 -0.724 -10.785 -4.820 1.00 1.02 C ATOM 1244 CG GLU A 78 0.209 -10.948 -6.037 1.00 1.84 C ATOM 1245 CD GLU A 78 -0.487 -11.682 -7.195 1.00 2.37 C ATOM 1246 OE1 GLU A 78 -1.534 -12.317 -6.949 1.00 3.27 O ATOM 1247 OE2 GLU A 78 -0.005 -11.567 -8.345 1.00 3.05 O ATOM 0 H GLU A 78 -2.069 -10.403 -2.878 1.00 0.88 H new ATOM 0 HA GLU A 78 0.639 -10.157 -3.257 1.00 0.84 H new ATOM 0 HB2 GLU A 78 -0.855 -11.764 -4.358 1.00 1.02 H new ATOM 0 HB3 GLU A 78 -1.703 -10.470 -5.181 1.00 1.02 H new ATOM 0 HG2 GLU A 78 0.540 -9.966 -6.375 1.00 1.84 H new ATOM 0 HG3 GLU A 78 1.101 -11.500 -5.740 1.00 1.84 H new ATOM 1254 N TYR A 79 -0.932 -7.806 -5.000 1.00 0.65 N ATOM 1255 CA TYR A 79 -0.765 -6.495 -5.626 1.00 0.58 C ATOM 1256 C TYR A 79 -0.261 -5.451 -4.619 1.00 0.62 C ATOM 1257 O TYR A 79 0.731 -4.766 -4.878 1.00 0.55 O ATOM 1258 CB TYR A 79 -2.114 -6.108 -6.239 1.00 0.58 C ATOM 1259 CG TYR A 79 -2.360 -4.627 -6.446 1.00 0.66 C ATOM 1260 CD1 TYR A 79 -1.898 -3.975 -7.606 1.00 1.53 C ATOM 1261 CD2 TYR A 79 -3.137 -3.925 -5.507 1.00 1.73 C ATOM 1262 CE1 TYR A 79 -2.276 -2.643 -7.860 1.00 1.62 C ATOM 1263 CE2 TYR A 79 -3.514 -2.594 -5.754 1.00 1.95 C ATOM 1264 CZ TYR A 79 -3.133 -1.967 -6.959 1.00 1.25 C ATOM 1265 OH TYR A 79 -3.656 -0.756 -7.298 1.00 1.75 O ATOM 0 H TYR A 79 -1.866 -8.200 -5.114 1.00 0.65 H new ATOM 0 HA TYR A 79 -0.004 -6.536 -6.406 1.00 0.58 H new ATOM 0 HB2 TYR A 79 -2.207 -6.608 -7.203 1.00 0.58 H new ATOM 0 HB3 TYR A 79 -2.905 -6.500 -5.599 1.00 0.58 H new ATOM 0 HD1 TYR A 79 -1.255 -4.496 -8.299 1.00 1.53 H new ATOM 0 HD2 TYR A 79 -3.445 -4.411 -4.593 1.00 1.73 H new ATOM 0 HE1 TYR A 79 -1.912 -2.137 -8.742 1.00 1.62 H new ATOM 0 HE2 TYR A 79 -4.095 -2.052 -5.022 1.00 1.95 H new ATOM 0 HH TYR A 79 -4.459 -0.585 -6.763 1.00 1.75 H new ATOM 1275 N TRP A 80 -0.906 -5.365 -3.450 1.00 0.77 N ATOM 1276 CA TRP A 80 -0.561 -4.396 -2.416 1.00 0.89 C ATOM 1277 C TRP A 80 0.874 -4.585 -1.912 1.00 0.91 C ATOM 1278 O TRP A 80 1.624 -3.607 -1.855 1.00 0.92 O ATOM 1279 CB TRP A 80 -1.579 -4.490 -1.268 1.00 1.02 C ATOM 1280 CG TRP A 80 -1.395 -3.411 -0.258 1.00 1.02 C ATOM 1281 CD1 TRP A 80 -0.426 -3.383 0.679 1.00 1.03 C ATOM 1282 CD2 TRP A 80 -2.127 -2.153 -0.123 1.00 1.02 C ATOM 1283 NE1 TRP A 80 -0.435 -2.159 1.305 1.00 1.05 N ATOM 1284 CE2 TRP A 80 -1.433 -1.339 0.820 1.00 1.04 C ATOM 1285 CE3 TRP A 80 -3.293 -1.612 -0.710 1.00 1.03 C ATOM 1286 CZ2 TRP A 80 -1.822 -0.021 1.094 1.00 1.06 C ATOM 1287 CZ3 TRP A 80 -3.741 -0.319 -0.372 1.00 1.06 C ATOM 1288 CH2 TRP A 80 -2.994 0.482 0.510 1.00 1.06 C ATOM 0 H TRP A 80 -1.686 -5.972 -3.198 1.00 0.77 H new ATOM 0 HA TRP A 80 -0.605 -3.396 -2.848 1.00 0.89 H new ATOM 0 HB2 TRP A 80 -2.588 -4.435 -1.675 1.00 1.02 H new ATOM 0 HB3 TRP A 80 -1.485 -5.460 -0.781 1.00 1.02 H new ATOM 0 HD1 TRP A 80 0.251 -4.194 0.903 1.00 1.03 H new ATOM 0 HE1 TRP A 80 0.218 -1.889 2.040 1.00 1.05 H new ATOM 0 HE3 TRP A 80 -3.849 -2.197 -1.428 1.00 1.03 H new ATOM 0 HZ2 TRP A 80 -1.227 0.600 1.747 1.00 1.06 H new ATOM 0 HZ3 TRP A 80 -4.662 0.058 -0.792 1.00 1.06 H new ATOM 0 HH2 TRP A 80 -3.323 1.485 0.738 1.00 1.06 H new ATOM 1299 N THR A 81 1.286 -5.816 -1.580 1.00 0.97 N ATOM 1300 CA THR A 81 2.632 -6.092 -1.057 1.00 1.14 C ATOM 1301 C THR A 81 3.711 -5.997 -2.132 1.00 0.94 C ATOM 1302 O THR A 81 4.842 -5.672 -1.780 1.00 0.99 O ATOM 1303 CB THR A 81 2.668 -7.412 -0.275 1.00 1.49 C ATOM 1304 OG1 THR A 81 3.787 -7.342 0.576 1.00 2.11 O ATOM 1305 CG2 THR A 81 2.783 -8.681 -1.119 1.00 1.59 C ATOM 0 H THR A 81 0.699 -6.646 -1.666 1.00 0.97 H new ATOM 0 HA THR A 81 2.871 -5.303 -0.345 1.00 1.14 H new ATOM 0 HB THR A 81 1.712 -7.502 0.241 1.00 1.49 H new ATOM 0 HG1 THR A 81 3.851 -8.167 1.100 1.00 2.11 H new ATOM 0 HG21 THR A 81 2.800 -9.553 -0.465 1.00 1.59 H new ATOM 0 HG22 THR A 81 1.928 -8.749 -1.792 1.00 1.59 H new ATOM 0 HG23 THR A 81 3.703 -8.648 -1.703 1.00 1.59 H new ATOM 1313 N LEU A 82 3.384 -6.195 -3.416 1.00 0.81 N ATOM 1314 CA LEU A 82 4.311 -5.933 -4.520 1.00 0.73 C ATOM 1315 C LEU A 82 4.580 -4.432 -4.711 1.00 0.61 C ATOM 1316 O LEU A 82 5.711 -4.083 -5.035 1.00 0.60 O ATOM 1317 CB LEU A 82 3.784 -6.535 -5.834 1.00 0.67 C ATOM 1318 CG LEU A 82 3.761 -8.073 -5.964 1.00 0.85 C ATOM 1319 CD1 LEU A 82 2.950 -8.431 -7.216 1.00 0.91 C ATOM 1320 CD2 LEU A 82 5.160 -8.675 -6.125 1.00 0.92 C ATOM 0 H LEU A 82 2.472 -6.540 -3.716 1.00 0.81 H new ATOM 0 HA LEU A 82 5.254 -6.412 -4.255 1.00 0.73 H new ATOM 0 HB2 LEU A 82 2.768 -6.171 -5.985 1.00 0.67 H new ATOM 0 HB3 LEU A 82 4.389 -6.139 -6.650 1.00 0.67 H new ATOM 0 HG LEU A 82 3.325 -8.477 -5.050 1.00 0.85 H new ATOM 0 HD11 LEU A 82 2.918 -9.514 -7.331 1.00 0.91 H new ATOM 0 HD12 LEU A 82 1.935 -8.047 -7.114 1.00 0.91 H new ATOM 0 HD13 LEU A 82 3.420 -7.986 -8.093 1.00 0.91 H new ATOM 0 HD21 LEU A 82 5.082 -9.759 -6.212 1.00 0.92 H new ATOM 0 HD22 LEU A 82 5.628 -8.272 -7.023 1.00 0.92 H new ATOM 0 HD23 LEU A 82 5.767 -8.423 -5.255 1.00 0.92 H new ATOM 1332 N ILE A 83 3.596 -3.534 -4.513 1.00 0.57 N ATOM 1333 CA ILE A 83 3.815 -2.067 -4.626 1.00 0.53 C ATOM 1334 C ILE A 83 5.062 -1.624 -3.844 1.00 0.53 C ATOM 1335 O ILE A 83 5.899 -0.914 -4.397 1.00 0.49 O ATOM 1336 CB ILE A 83 2.567 -1.254 -4.182 1.00 0.59 C ATOM 1337 CG1 ILE A 83 1.330 -1.387 -5.097 1.00 0.67 C ATOM 1338 CG2 ILE A 83 2.891 0.239 -4.044 1.00 0.59 C ATOM 1339 CD1 ILE A 83 1.439 -0.694 -6.460 1.00 0.79 C ATOM 0 H ILE A 83 2.639 -3.792 -4.274 1.00 0.57 H new ATOM 0 HA ILE A 83 3.984 -1.855 -5.682 1.00 0.53 H new ATOM 0 HB ILE A 83 2.307 -1.698 -3.221 1.00 0.59 H new ATOM 0 HG12 ILE A 83 1.134 -2.446 -5.262 1.00 0.67 H new ATOM 0 HG13 ILE A 83 0.466 -0.982 -4.571 1.00 0.67 H new ATOM 0 HG21 ILE A 83 1.996 0.778 -3.732 1.00 0.59 H new ATOM 0 HG22 ILE A 83 3.674 0.374 -3.298 1.00 0.59 H new ATOM 0 HG23 ILE A 83 3.233 0.627 -5.003 1.00 0.59 H new ATOM 0 HD11 ILE A 83 0.518 -0.849 -7.022 1.00 0.79 H new ATOM 0 HD12 ILE A 83 1.599 0.374 -6.313 1.00 0.79 H new ATOM 0 HD13 ILE A 83 2.278 -1.113 -7.015 1.00 0.79 H new ATOM 1351 N GLY A 84 5.245 -2.126 -2.615 1.00 0.65 N ATOM 1352 CA GLY A 84 6.379 -1.784 -1.744 1.00 0.71 C ATOM 1353 C GLY A 84 7.763 -2.153 -2.304 1.00 0.69 C ATOM 1354 O GLY A 84 8.772 -1.654 -1.816 1.00 0.74 O ATOM 0 H GLY A 84 4.599 -2.792 -2.191 1.00 0.65 H new ATOM 0 HA2 GLY A 84 6.357 -0.712 -1.548 1.00 0.71 H new ATOM 0 HA3 GLY A 84 6.246 -2.286 -0.786 1.00 0.71 H new ATOM 1358 N GLY A 85 7.834 -3.000 -3.339 1.00 0.65 N ATOM 1359 CA GLY A 85 9.078 -3.306 -4.052 1.00 0.69 C ATOM 1360 C GLY A 85 9.439 -2.292 -5.143 1.00 0.62 C ATOM 1361 O GLY A 85 10.606 -2.217 -5.524 1.00 0.72 O ATOM 0 H GLY A 85 7.022 -3.496 -3.707 1.00 0.65 H new ATOM 0 HA2 GLY A 85 9.895 -3.355 -3.332 1.00 0.69 H new ATOM 0 HA3 GLY A 85 8.992 -4.294 -4.504 1.00 0.69 H new ATOM 1365 N ILE A 86 8.480 -1.495 -5.637 1.00 0.56 N ATOM 1366 CA ILE A 86 8.727 -0.343 -6.539 1.00 0.64 C ATOM 1367 C ILE A 86 8.716 0.952 -5.719 1.00 0.77 C ATOM 1368 O ILE A 86 9.701 1.698 -5.717 1.00 0.75 O ATOM 1369 CB ILE A 86 7.704 -0.264 -7.706 1.00 0.64 C ATOM 1370 CG1 ILE A 86 7.504 -1.581 -8.490 1.00 0.60 C ATOM 1371 CG2 ILE A 86 8.185 0.791 -8.728 1.00 0.92 C ATOM 1372 CD1 ILE A 86 6.482 -2.554 -7.892 1.00 0.61 C ATOM 0 H ILE A 86 7.492 -1.629 -5.422 1.00 0.56 H new ATOM 0 HA ILE A 86 9.705 -0.483 -7.000 1.00 0.64 H new ATOM 0 HB ILE A 86 6.754 -0.015 -7.234 1.00 0.64 H new ATOM 0 HG12 ILE A 86 7.195 -1.336 -9.506 1.00 0.60 H new ATOM 0 HG13 ILE A 86 8.465 -2.090 -8.563 1.00 0.60 H new ATOM 0 HG21 ILE A 86 7.472 0.852 -9.550 1.00 0.92 H new ATOM 0 HG22 ILE A 86 8.260 1.763 -8.240 1.00 0.92 H new ATOM 0 HG23 ILE A 86 9.162 0.503 -9.116 1.00 0.92 H new ATOM 0 HD11 ILE A 86 6.418 -3.444 -8.518 1.00 0.61 H new ATOM 0 HD12 ILE A 86 6.795 -2.838 -6.887 1.00 0.61 H new ATOM 0 HD13 ILE A 86 5.505 -2.072 -7.845 1.00 0.61 H new ATOM 1384 N THR A 87 7.645 1.154 -4.942 1.00 0.90 N ATOM 1385 CA THR A 87 7.472 2.146 -3.873 1.00 0.88 C ATOM 1386 C THR A 87 8.287 1.697 -2.663 1.00 0.91 C ATOM 1387 O THR A 87 7.759 1.451 -1.589 1.00 1.45 O ATOM 1388 CB THR A 87 5.978 2.280 -3.533 1.00 1.00 C ATOM 1389 OG1 THR A 87 5.259 2.497 -4.725 1.00 1.12 O ATOM 1390 CG2 THR A 87 5.644 3.439 -2.592 1.00 0.96 C ATOM 0 H THR A 87 6.808 0.581 -5.054 1.00 0.90 H new ATOM 0 HA THR A 87 7.827 3.126 -4.191 1.00 0.88 H new ATOM 0 HB THR A 87 5.706 1.355 -3.026 1.00 1.00 H new ATOM 0 HG1 THR A 87 4.304 2.582 -4.520 1.00 1.12 H new ATOM 0 HG21 THR A 87 4.570 3.459 -2.406 1.00 0.96 H new ATOM 0 HG22 THR A 87 6.173 3.306 -1.648 1.00 0.96 H new ATOM 0 HG23 THR A 87 5.950 4.379 -3.050 1.00 0.96 H new ATOM 1398 N GLY A 88 9.591 1.556 -2.874 1.00 0.89 N ATOM 1399 CA GLY A 88 10.596 1.162 -1.892 1.00 0.93 C ATOM 1400 C GLY A 88 11.907 1.879 -2.197 1.00 0.99 C ATOM 1401 O GLY A 88 12.252 2.814 -1.470 1.00 1.07 O ATOM 0 H GLY A 88 10.001 1.724 -3.793 1.00 0.89 H new ATOM 0 HA2 GLY A 88 10.257 1.412 -0.887 1.00 0.93 H new ATOM 0 HA3 GLY A 88 10.744 0.082 -1.919 1.00 0.93 H new ATOM 1405 N PRO A 89 12.601 1.530 -3.304 1.00 1.12 N ATOM 1406 CA PRO A 89 13.788 2.244 -3.763 1.00 1.32 C ATOM 1407 C PRO A 89 13.519 3.731 -4.032 1.00 1.27 C ATOM 1408 O PRO A 89 14.251 4.562 -3.501 1.00 1.41 O ATOM 1409 CB PRO A 89 14.274 1.500 -5.016 1.00 1.52 C ATOM 1410 CG PRO A 89 13.050 0.719 -5.491 1.00 1.42 C ATOM 1411 CD PRO A 89 12.329 0.400 -4.185 1.00 1.18 C ATOM 0 HA PRO A 89 14.556 2.250 -2.990 1.00 1.32 H new ATOM 0 HB2 PRO A 89 14.624 2.194 -5.780 1.00 1.52 H new ATOM 0 HB3 PRO A 89 15.106 0.834 -4.786 1.00 1.52 H new ATOM 0 HG2 PRO A 89 12.428 1.310 -6.163 1.00 1.42 H new ATOM 0 HG3 PRO A 89 13.331 -0.186 -6.030 1.00 1.42 H new ATOM 0 HD2 PRO A 89 11.258 0.278 -4.348 1.00 1.18 H new ATOM 0 HD3 PRO A 89 12.694 -0.532 -3.753 1.00 1.18 H new ATOM 1419 N ILE A 90 12.484 4.085 -4.809 1.00 1.14 N ATOM 1420 CA ILE A 90 12.226 5.494 -5.180 1.00 1.19 C ATOM 1421 C ILE A 90 11.302 6.229 -4.209 1.00 1.27 C ATOM 1422 O ILE A 90 11.225 7.449 -4.253 1.00 1.35 O ATOM 1423 CB ILE A 90 11.731 5.622 -6.642 1.00 1.36 C ATOM 1424 CG1 ILE A 90 10.332 5.005 -6.905 1.00 1.43 C ATOM 1425 CG2 ILE A 90 12.789 5.029 -7.590 1.00 1.46 C ATOM 1426 CD1 ILE A 90 9.214 6.055 -6.997 1.00 1.26 C ATOM 0 H ILE A 90 11.812 3.421 -5.194 1.00 1.14 H new ATOM 0 HA ILE A 90 13.191 5.995 -5.105 1.00 1.19 H new ATOM 0 HB ILE A 90 11.602 6.687 -6.837 1.00 1.36 H new ATOM 0 HG12 ILE A 90 10.363 4.434 -7.833 1.00 1.43 H new ATOM 0 HG13 ILE A 90 10.096 4.302 -6.106 1.00 1.43 H new ATOM 0 HG21 ILE A 90 12.444 5.117 -8.620 1.00 1.46 H new ATOM 0 HG22 ILE A 90 13.727 5.572 -7.473 1.00 1.46 H new ATOM 0 HG23 ILE A 90 12.946 3.978 -7.348 1.00 1.46 H new ATOM 0 HD11 ILE A 90 8.262 5.558 -7.182 1.00 1.26 H new ATOM 0 HD12 ILE A 90 9.158 6.610 -6.060 1.00 1.26 H new ATOM 0 HD13 ILE A 90 9.428 6.744 -7.814 1.00 1.26 H new ATOM 1438 N ALA A 91 10.631 5.535 -3.291 1.00 1.30 N ATOM 1439 CA ALA A 91 9.636 6.150 -2.406 1.00 1.50 C ATOM 1440 C ALA A 91 10.237 7.174 -1.427 1.00 1.37 C ATOM 1441 O ALA A 91 9.594 8.160 -1.080 1.00 1.30 O ATOM 1442 CB ALA A 91 8.912 5.027 -1.672 1.00 1.74 C ATOM 0 H ALA A 91 10.759 4.535 -3.138 1.00 1.30 H new ATOM 0 HA ALA A 91 8.937 6.727 -3.011 1.00 1.50 H new ATOM 0 HB1 ALA A 91 8.163 5.453 -1.004 1.00 1.74 H new ATOM 0 HB2 ALA A 91 8.424 4.375 -2.396 1.00 1.74 H new ATOM 0 HB3 ALA A 91 9.631 4.450 -1.091 1.00 1.74 H new ATOM 1448 N LYS A 92 11.496 6.995 -1.020 1.00 1.39 N ATOM 1449 CA LYS A 92 12.229 8.038 -0.288 1.00 1.36 C ATOM 1450 C LYS A 92 12.280 9.393 -1.021 1.00 1.26 C ATOM 1451 O LYS A 92 12.072 10.414 -0.365 1.00 1.22 O ATOM 1452 CB LYS A 92 13.633 7.536 0.050 1.00 1.56 C ATOM 1453 CG LYS A 92 14.447 6.960 -1.127 1.00 2.37 C ATOM 1454 CD LYS A 92 15.947 7.265 -1.011 1.00 2.67 C ATOM 1455 CE LYS A 92 16.503 7.076 0.407 1.00 2.24 C ATOM 1456 NZ LYS A 92 16.654 5.645 0.742 1.00 3.63 N ATOM 0 H LYS A 92 12.030 6.141 -1.183 1.00 1.39 H new ATOM 0 HA LYS A 92 11.676 8.232 0.631 1.00 1.36 H new ATOM 0 HB2 LYS A 92 14.197 8.360 0.487 1.00 1.56 H new ATOM 0 HB3 LYS A 92 13.547 6.767 0.817 1.00 1.56 H new ATOM 0 HG2 LYS A 92 14.302 5.881 -1.171 1.00 2.37 H new ATOM 0 HG3 LYS A 92 14.067 7.371 -2.062 1.00 2.37 H new ATOM 0 HD2 LYS A 92 16.495 6.619 -1.697 1.00 2.67 H new ATOM 0 HD3 LYS A 92 16.126 8.292 -1.329 1.00 2.67 H new ATOM 0 HE2 LYS A 92 17.469 7.574 0.490 1.00 2.24 H new ATOM 0 HE3 LYS A 92 15.837 7.551 1.127 1.00 2.24 H new ATOM 0 HZ1 LYS A 92 17.032 5.552 1.707 1.00 3.63 H new ATOM 0 HZ2 LYS A 92 15.728 5.176 0.686 1.00 3.63 H new ATOM 0 HZ3 LYS A 92 17.309 5.198 0.069 1.00 3.63 H new ATOM 1470 N LEU A 93 12.418 9.396 -2.356 1.00 1.30 N ATOM 1471 CA LEU A 93 12.552 10.600 -3.181 1.00 1.26 C ATOM 1472 C LEU A 93 11.370 11.540 -2.964 1.00 1.04 C ATOM 1473 O LEU A 93 11.574 12.734 -2.821 1.00 0.98 O ATOM 1474 CB LEU A 93 12.728 10.170 -4.650 1.00 1.52 C ATOM 1475 CG LEU A 93 13.228 11.286 -5.593 1.00 1.83 C ATOM 1476 CD1 LEU A 93 13.984 10.672 -6.783 1.00 2.00 C ATOM 1477 CD2 LEU A 93 12.083 12.146 -6.151 1.00 2.02 C ATOM 0 H LEU A 93 12.440 8.536 -2.903 1.00 1.30 H new ATOM 0 HA LEU A 93 13.435 11.169 -2.889 1.00 1.26 H new ATOM 0 HB2 LEU A 93 13.431 9.338 -4.689 1.00 1.52 H new ATOM 0 HB3 LEU A 93 11.773 9.799 -5.023 1.00 1.52 H new ATOM 0 HG LEU A 93 13.882 11.923 -4.997 1.00 1.83 H new ATOM 0 HD11 LEU A 93 14.332 11.467 -7.442 1.00 2.00 H new ATOM 0 HD12 LEU A 93 14.839 10.103 -6.417 1.00 2.00 H new ATOM 0 HD13 LEU A 93 13.317 10.009 -7.335 1.00 2.00 H new ATOM 0 HD21 LEU A 93 12.492 12.914 -6.807 1.00 2.02 H new ATOM 0 HD22 LEU A 93 11.396 11.515 -6.715 1.00 2.02 H new ATOM 0 HD23 LEU A 93 11.549 12.619 -5.327 1.00 2.02 H new ATOM 1489 N ILE A 94 10.155 10.991 -2.852 1.00 1.01 N ATOM 1490 CA ILE A 94 8.930 11.717 -2.476 1.00 0.95 C ATOM 1491 C ILE A 94 9.188 12.577 -1.245 1.00 0.87 C ATOM 1492 O ILE A 94 9.114 13.792 -1.293 1.00 0.96 O ATOM 1493 CB ILE A 94 7.768 10.740 -2.201 1.00 0.99 C ATOM 1494 CG1 ILE A 94 7.536 9.833 -3.423 1.00 1.06 C ATOM 1495 CG2 ILE A 94 6.501 11.531 -1.822 1.00 1.16 C ATOM 1496 CD1 ILE A 94 6.417 8.819 -3.209 1.00 1.38 C ATOM 0 H ILE A 94 9.989 10.000 -3.025 1.00 1.01 H new ATOM 0 HA ILE A 94 8.647 12.358 -3.311 1.00 0.95 H new ATOM 0 HB ILE A 94 8.022 10.095 -1.360 1.00 0.99 H new ATOM 0 HG12 ILE A 94 7.297 10.452 -4.288 1.00 1.06 H new ATOM 0 HG13 ILE A 94 8.460 9.303 -3.656 1.00 1.06 H new ATOM 0 HG21 ILE A 94 5.683 10.837 -1.629 1.00 1.16 H new ATOM 0 HG22 ILE A 94 6.695 12.122 -0.927 1.00 1.16 H new ATOM 0 HG23 ILE A 94 6.227 12.195 -2.642 1.00 1.16 H new ATOM 0 HD11 ILE A 94 6.302 8.210 -4.105 1.00 1.38 H new ATOM 0 HD12 ILE A 94 6.664 8.177 -2.363 1.00 1.38 H new ATOM 0 HD13 ILE A 94 5.484 9.344 -3.005 1.00 1.38 H new ATOM 1508 N HIS A 95 9.518 11.958 -0.121 1.00 0.82 N ATOM 1509 CA HIS A 95 9.665 12.676 1.139 1.00 0.88 C ATOM 1510 C HIS A 95 10.946 13.528 1.194 1.00 0.99 C ATOM 1511 O HIS A 95 10.977 14.536 1.897 1.00 1.27 O ATOM 1512 CB HIS A 95 9.590 11.644 2.262 1.00 0.89 C ATOM 1513 CG HIS A 95 9.760 12.266 3.616 1.00 0.90 C ATOM 1514 ND1 HIS A 95 8.835 13.027 4.291 1.00 0.97 N ATOM 1515 CD2 HIS A 95 10.909 12.264 4.354 1.00 1.48 C ATOM 1516 CE1 HIS A 95 9.411 13.458 5.423 1.00 1.33 C ATOM 1517 NE2 HIS A 95 10.684 13.041 5.495 1.00 1.81 N ATOM 0 H HIS A 95 9.690 10.955 -0.055 1.00 0.82 H new ATOM 0 HA HIS A 95 8.860 13.402 1.249 1.00 0.88 H new ATOM 0 HB2 HIS A 95 8.629 11.131 2.218 1.00 0.89 H new ATOM 0 HB3 HIS A 95 10.362 10.889 2.111 1.00 0.89 H new ATOM 0 HD2 HIS A 95 11.827 11.754 4.102 1.00 1.48 H new ATOM 0 HE1 HIS A 95 8.918 14.058 6.173 1.00 1.33 H new ATOM 0 HE2 HIS A 95 11.355 13.249 6.235 1.00 1.81 H new ATOM 1525 N GLU A 96 11.970 13.169 0.421 1.00 0.97 N ATOM 1526 CA GLU A 96 13.135 14.014 0.203 1.00 1.24 C ATOM 1527 C GLU A 96 12.738 15.269 -0.609 1.00 1.11 C ATOM 1528 O GLU A 96 13.331 16.323 -0.387 1.00 1.30 O ATOM 1529 CB GLU A 96 14.245 13.154 -0.443 1.00 1.68 C ATOM 1530 CG GLU A 96 14.774 12.069 0.534 1.00 1.68 C ATOM 1531 CD GLU A 96 15.404 10.818 -0.104 1.00 2.48 C ATOM 1532 OE1 GLU A 96 15.233 10.603 -1.324 1.00 3.64 O ATOM 1533 OE2 GLU A 96 15.977 10.000 0.656 1.00 2.98 O ATOM 0 H GLU A 96 12.011 12.278 -0.073 1.00 0.97 H new ATOM 0 HA GLU A 96 13.536 14.399 1.141 1.00 1.24 H new ATOM 0 HB2 GLU A 96 13.857 12.676 -1.342 1.00 1.68 H new ATOM 0 HB3 GLU A 96 15.069 13.797 -0.753 1.00 1.68 H new ATOM 0 HG2 GLU A 96 15.516 12.530 1.186 1.00 1.68 H new ATOM 0 HG3 GLU A 96 13.947 11.749 1.168 1.00 1.68 H new ATOM 1540 N GLN A 97 11.696 15.207 -1.456 1.00 0.98 N ATOM 1541 CA GLN A 97 11.173 16.307 -2.271 1.00 1.10 C ATOM 1542 C GLN A 97 10.074 17.158 -1.617 1.00 1.12 C ATOM 1543 O GLN A 97 10.167 18.373 -1.749 1.00 1.32 O ATOM 1544 CB GLN A 97 10.686 15.763 -3.623 1.00 1.21 C ATOM 1545 CG GLN A 97 11.844 15.468 -4.595 1.00 1.41 C ATOM 1546 CD GLN A 97 12.703 16.681 -4.963 1.00 1.67 C ATOM 1547 OE1 GLN A 97 13.883 16.564 -5.248 1.00 2.32 O ATOM 1548 NE2 GLN A 97 12.172 17.887 -4.956 1.00 1.61 N ATOM 0 H GLN A 97 11.172 14.343 -1.595 1.00 0.98 H new ATOM 0 HA GLN A 97 12.012 16.991 -2.398 1.00 1.10 H new ATOM 0 HB2 GLN A 97 10.114 14.850 -3.458 1.00 1.21 H new ATOM 0 HB3 GLN A 97 10.009 16.486 -4.079 1.00 1.21 H new ATOM 0 HG2 GLN A 97 12.487 14.708 -4.151 1.00 1.41 H new ATOM 0 HG3 GLN A 97 11.431 15.042 -5.510 1.00 1.41 H new ATOM 0 HE21 GLN A 97 11.187 18.009 -4.721 1.00 1.61 H new ATOM 0 HE22 GLN A 97 12.746 18.698 -5.186 1.00 1.61 H new ATOM 1557 N GLU A 98 9.118 16.602 -0.849 1.00 0.99 N ATOM 1558 CA GLU A 98 8.208 17.394 0.025 1.00 1.13 C ATOM 1559 C GLU A 98 8.982 18.179 1.109 1.00 1.23 C ATOM 1560 O GLU A 98 8.426 18.862 1.974 1.00 1.58 O ATOM 1561 CB GLU A 98 7.149 16.531 0.741 1.00 1.18 C ATOM 1562 CG GLU A 98 6.408 15.500 -0.106 1.00 1.24 C ATOM 1563 CD GLU A 98 5.772 16.087 -1.365 1.00 1.35 C ATOM 1564 OE1 GLU A 98 4.763 16.815 -1.237 1.00 2.20 O ATOM 1565 OE2 GLU A 98 6.318 15.794 -2.449 1.00 2.14 O ATOM 0 H GLU A 98 8.949 15.597 -0.811 1.00 0.99 H new ATOM 0 HA GLU A 98 7.707 18.081 -0.657 1.00 1.13 H new ATOM 0 HB2 GLU A 98 7.638 16.007 1.562 1.00 1.18 H new ATOM 0 HB3 GLU A 98 6.411 17.199 1.184 1.00 1.18 H new ATOM 0 HG2 GLU A 98 7.103 14.711 -0.394 1.00 1.24 H new ATOM 0 HG3 GLU A 98 5.631 15.034 0.500 1.00 1.24 H new ATOM 1572 N GLN A 99 10.298 17.993 1.136 1.00 1.19 N ATOM 1573 CA GLN A 99 11.264 18.815 1.841 1.00 1.38 C ATOM 1574 C GLN A 99 12.168 19.589 0.874 1.00 1.50 C ATOM 1575 O GLN A 99 11.909 20.759 0.613 1.00 1.62 O ATOM 1576 CB GLN A 99 12.083 17.905 2.750 1.00 1.37 C ATOM 1577 CG GLN A 99 11.225 17.117 3.717 1.00 1.26 C ATOM 1578 CD GLN A 99 10.638 17.972 4.836 1.00 1.53 C ATOM 1579 OE1 GLN A 99 11.220 18.086 5.907 1.00 1.92 O ATOM 1580 NE2 GLN A 99 9.537 18.665 4.625 1.00 1.74 N ATOM 0 H GLN A 99 10.739 17.220 0.637 1.00 1.19 H new ATOM 0 HA GLN A 99 10.739 19.565 2.433 1.00 1.38 H new ATOM 0 HB2 GLN A 99 12.662 17.213 2.138 1.00 1.37 H new ATOM 0 HB3 GLN A 99 12.797 18.507 3.312 1.00 1.37 H new ATOM 0 HG2 GLN A 99 10.412 16.642 3.167 1.00 1.26 H new ATOM 0 HG3 GLN A 99 11.823 16.318 4.155 1.00 1.26 H new ATOM 0 HE21 GLN A 99 9.043 18.579 3.737 1.00 1.74 H new ATOM 0 HE22 GLN A 99 9.179 19.287 5.350 1.00 1.74 H new ATOM 1677 N TYR B 108 -0.820 14.425 -11.691 1.00 1.16 N ATOM 1678 CA TYR B 108 -0.710 13.350 -10.687 1.00 1.07 C ATOM 1679 C TYR B 108 -2.055 12.615 -10.547 1.00 1.09 C ATOM 1680 O TYR B 108 -3.063 13.240 -10.214 1.00 1.41 O ATOM 1681 CB TYR B 108 -0.126 13.770 -9.320 1.00 1.16 C ATOM 1682 CG TYR B 108 1.353 14.138 -9.341 1.00 1.11 C ATOM 1683 CD1 TYR B 108 1.760 15.443 -9.689 1.00 2.36 C ATOM 1684 CD2 TYR B 108 2.328 13.178 -8.995 1.00 1.89 C ATOM 1685 CE1 TYR B 108 3.125 15.790 -9.687 1.00 2.67 C ATOM 1686 CE2 TYR B 108 3.696 13.514 -9.006 1.00 1.75 C ATOM 1687 CZ TYR B 108 4.098 14.825 -9.339 1.00 1.51 C ATOM 1688 OH TYR B 108 5.415 15.170 -9.308 1.00 1.87 O ATOM 0 HA TYR B 108 0.041 12.662 -11.076 1.00 1.07 H new ATOM 0 HB2 TYR B 108 -0.693 14.623 -8.946 1.00 1.16 H new ATOM 0 HB3 TYR B 108 -0.273 12.954 -8.612 1.00 1.16 H new ATOM 0 HD1 TYR B 108 1.020 16.181 -9.959 1.00 2.36 H new ATOM 0 HD2 TYR B 108 2.023 12.179 -8.720 1.00 1.89 H new ATOM 0 HE1 TYR B 108 3.428 16.792 -9.951 1.00 2.67 H new ATOM 0 HE2 TYR B 108 4.437 12.768 -8.760 1.00 1.75 H new ATOM 0 HH TYR B 108 5.951 14.392 -9.049 1.00 1.87 H new ATOM 1698 N THR B 109 -2.101 11.295 -10.798 1.00 0.94 N ATOM 1699 CA THR B 109 -3.292 10.463 -10.521 1.00 0.90 C ATOM 1700 C THR B 109 -3.578 10.426 -9.019 1.00 0.87 C ATOM 1701 O THR B 109 -2.655 10.584 -8.223 1.00 0.96 O ATOM 1702 CB THR B 109 -3.151 9.039 -11.096 1.00 0.93 C ATOM 1703 OG1 THR B 109 -2.050 8.383 -10.511 1.00 0.93 O ATOM 1704 CG2 THR B 109 -2.970 9.025 -12.611 1.00 1.22 C ATOM 0 H THR B 109 -1.320 10.774 -11.196 1.00 0.94 H new ATOM 0 HA THR B 109 -4.141 10.924 -11.026 1.00 0.90 H new ATOM 0 HB THR B 109 -4.082 8.523 -10.860 1.00 0.93 H new ATOM 0 HG1 THR B 109 -1.708 7.703 -11.129 1.00 0.93 H new ATOM 0 HG21 THR B 109 -2.876 7.996 -12.957 1.00 1.22 H new ATOM 0 HG22 THR B 109 -3.835 9.490 -13.085 1.00 1.22 H new ATOM 0 HG23 THR B 109 -2.070 9.580 -12.875 1.00 1.22 H new ATOM 1712 N GLU B 110 -4.826 10.144 -8.618 1.00 0.86 N ATOM 1713 CA GLU B 110 -5.175 9.912 -7.214 1.00 0.87 C ATOM 1714 C GLU B 110 -4.405 8.711 -6.632 1.00 0.81 C ATOM 1715 O GLU B 110 -4.231 8.608 -5.425 1.00 1.05 O ATOM 1716 CB GLU B 110 -6.696 9.728 -7.068 1.00 0.89 C ATOM 1717 CG GLU B 110 -7.238 9.973 -5.645 1.00 1.05 C ATOM 1718 CD GLU B 110 -7.478 11.453 -5.341 1.00 1.47 C ATOM 1719 OE1 GLU B 110 -6.627 12.272 -5.748 1.00 1.50 O ATOM 1720 OE2 GLU B 110 -8.528 11.783 -4.737 1.00 2.71 O ATOM 0 H GLU B 110 -5.617 10.071 -9.257 1.00 0.86 H new ATOM 0 HA GLU B 110 -4.879 10.789 -6.639 1.00 0.87 H new ATOM 0 HB2 GLU B 110 -7.199 10.407 -7.756 1.00 0.89 H new ATOM 0 HB3 GLU B 110 -6.957 8.715 -7.373 1.00 0.89 H new ATOM 0 HG2 GLU B 110 -8.173 9.426 -5.519 1.00 1.05 H new ATOM 0 HG3 GLU B 110 -6.532 9.569 -4.919 1.00 1.05 H new ATOM 1727 N LEU B 111 -3.880 7.830 -7.497 1.00 0.61 N ATOM 1728 CA LEU B 111 -3.000 6.719 -7.149 1.00 0.54 C ATOM 1729 C LEU B 111 -1.607 7.219 -6.721 1.00 0.56 C ATOM 1730 O LEU B 111 -1.085 6.795 -5.685 1.00 0.50 O ATOM 1731 CB LEU B 111 -2.929 5.765 -8.366 1.00 0.60 C ATOM 1732 CG LEU B 111 -3.116 4.285 -7.994 1.00 0.67 C ATOM 1733 CD1 LEU B 111 -3.063 3.419 -9.261 1.00 1.01 C ATOM 1734 CD2 LEU B 111 -2.060 3.809 -6.994 1.00 0.61 C ATOM 0 H LEU B 111 -4.069 7.880 -8.498 1.00 0.61 H new ATOM 0 HA LEU B 111 -3.399 6.179 -6.290 1.00 0.54 H new ATOM 0 HB2 LEU B 111 -3.695 6.050 -9.087 1.00 0.60 H new ATOM 0 HB3 LEU B 111 -1.965 5.889 -8.859 1.00 0.60 H new ATOM 0 HG LEU B 111 -4.091 4.184 -7.517 1.00 0.67 H new ATOM 0 HD11 LEU B 111 -3.196 2.371 -8.991 1.00 1.01 H new ATOM 0 HD12 LEU B 111 -3.858 3.722 -9.942 1.00 1.01 H new ATOM 0 HD13 LEU B 111 -2.097 3.548 -9.750 1.00 1.01 H new ATOM 0 HD21 LEU B 111 -2.229 2.758 -6.759 1.00 0.61 H new ATOM 0 HD22 LEU B 111 -1.068 3.928 -7.429 1.00 0.61 H new ATOM 0 HD23 LEU B 111 -2.130 4.401 -6.081 1.00 0.61 H new ATOM 1746 N GLU B 112 -1.029 8.169 -7.462 1.00 0.72 N ATOM 1747 CA GLU B 112 0.221 8.811 -7.055 1.00 0.97 C ATOM 1748 C GLU B 112 0.008 9.765 -5.874 1.00 1.08 C ATOM 1749 O GLU B 112 0.733 9.629 -4.893 1.00 1.15 O ATOM 1750 CB GLU B 112 0.937 9.467 -8.242 1.00 1.10 C ATOM 1751 CG GLU B 112 1.518 8.365 -9.144 1.00 1.26 C ATOM 1752 CD GLU B 112 2.492 8.873 -10.201 1.00 1.72 C ATOM 1753 OE1 GLU B 112 3.362 9.695 -9.867 1.00 2.07 O ATOM 1754 OE2 GLU B 112 2.399 8.421 -11.356 1.00 2.94 O ATOM 0 H GLU B 112 -1.408 8.509 -8.346 1.00 0.72 H new ATOM 0 HA GLU B 112 0.893 8.031 -6.696 1.00 0.97 H new ATOM 0 HB2 GLU B 112 0.241 10.088 -8.806 1.00 1.10 H new ATOM 0 HB3 GLU B 112 1.733 10.122 -7.887 1.00 1.10 H new ATOM 0 HG2 GLU B 112 2.027 7.631 -8.520 1.00 1.26 H new ATOM 0 HG3 GLU B 112 0.697 7.847 -9.641 1.00 1.26 H new ATOM 1761 N LYS B 113 -1.034 10.614 -5.859 1.00 1.16 N ATOM 1762 CA LYS B 113 -1.485 11.335 -4.657 1.00 1.38 C ATOM 1763 C LYS B 113 -1.511 10.410 -3.437 1.00 1.00 C ATOM 1764 O LYS B 113 -0.953 10.732 -2.391 1.00 0.92 O ATOM 1765 CB LYS B 113 -2.909 11.874 -4.890 1.00 1.92 C ATOM 1766 CG LYS B 113 -3.016 12.935 -5.998 1.00 2.04 C ATOM 1767 CD LYS B 113 -2.960 14.351 -5.419 1.00 2.63 C ATOM 1768 CE LYS B 113 -4.344 15.002 -5.201 1.00 3.58 C ATOM 1769 NZ LYS B 113 -5.312 14.166 -4.440 1.00 4.66 N ATOM 0 H LYS B 113 -1.591 10.821 -6.688 1.00 1.16 H new ATOM 0 HA LYS B 113 -0.788 12.152 -4.469 1.00 1.38 H new ATOM 0 HB2 LYS B 113 -3.564 11.039 -5.140 1.00 1.92 H new ATOM 0 HB3 LYS B 113 -3.279 12.302 -3.958 1.00 1.92 H new ATOM 0 HG2 LYS B 113 -2.205 12.800 -6.713 1.00 2.04 H new ATOM 0 HG3 LYS B 113 -3.949 12.800 -6.545 1.00 2.04 H new ATOM 0 HD2 LYS B 113 -2.431 14.321 -4.466 1.00 2.63 H new ATOM 0 HD3 LYS B 113 -2.376 14.982 -6.088 1.00 2.63 H new ATOM 0 HE2 LYS B 113 -4.207 15.946 -4.674 1.00 3.58 H new ATOM 0 HE3 LYS B 113 -4.776 15.240 -6.173 1.00 3.58 H new ATOM 0 HZ1 LYS B 113 -6.232 14.650 -4.399 1.00 4.66 H new ATOM 0 HZ2 LYS B 113 -5.425 13.247 -4.914 1.00 4.66 H new ATOM 0 HZ3 LYS B 113 -4.957 14.016 -3.474 1.00 4.66 H new ATOM 1783 N ALA B 114 -2.099 9.226 -3.581 1.00 0.81 N ATOM 1784 CA ALA B 114 -2.182 8.238 -2.531 1.00 0.67 C ATOM 1785 C ALA B 114 -0.829 7.662 -2.126 1.00 0.51 C ATOM 1786 O ALA B 114 -0.498 7.743 -0.952 1.00 0.50 O ATOM 1787 CB ALA B 114 -3.133 7.187 -3.043 1.00 0.65 C ATOM 0 H ALA B 114 -2.538 8.929 -4.452 1.00 0.81 H new ATOM 0 HA ALA B 114 -2.544 8.689 -1.607 1.00 0.67 H new ATOM 0 HB1 ALA B 114 -3.245 6.402 -2.295 1.00 0.65 H new ATOM 0 HB2 ALA B 114 -4.104 7.640 -3.241 1.00 0.65 H new ATOM 0 HB3 ALA B 114 -2.739 6.757 -3.964 1.00 0.65 H new ATOM 1793 N VAL B 115 -0.026 7.145 -3.056 1.00 0.50 N ATOM 1794 CA VAL B 115 1.346 6.679 -2.753 1.00 0.48 C ATOM 1795 C VAL B 115 2.159 7.774 -2.039 1.00 0.52 C ATOM 1796 O VAL B 115 2.744 7.516 -0.988 1.00 0.56 O ATOM 1797 CB VAL B 115 2.060 6.195 -4.037 1.00 0.64 C ATOM 1798 CG1 VAL B 115 3.569 5.999 -3.829 1.00 0.92 C ATOM 1799 CG2 VAL B 115 1.463 4.858 -4.504 1.00 0.63 C ATOM 0 H VAL B 115 -0.295 7.034 -4.034 1.00 0.50 H new ATOM 0 HA VAL B 115 1.271 5.830 -2.073 1.00 0.48 H new ATOM 0 HB VAL B 115 1.910 6.971 -4.787 1.00 0.64 H new ATOM 0 HG11 VAL B 115 4.023 5.659 -4.760 1.00 0.92 H new ATOM 0 HG12 VAL B 115 4.021 6.945 -3.529 1.00 0.92 H new ATOM 0 HG13 VAL B 115 3.735 5.254 -3.051 1.00 0.92 H new ATOM 0 HG21 VAL B 115 1.974 4.528 -5.408 1.00 0.63 H new ATOM 0 HG22 VAL B 115 1.590 4.110 -3.722 1.00 0.63 H new ATOM 0 HG23 VAL B 115 0.401 4.987 -4.714 1.00 0.63 H new ATOM 1809 N ILE B 116 2.116 9.016 -2.544 1.00 0.53 N ATOM 1810 CA ILE B 116 2.655 10.212 -1.880 1.00 0.62 C ATOM 1811 C ILE B 116 2.095 10.348 -0.454 1.00 0.56 C ATOM 1812 O ILE B 116 2.886 10.399 0.483 1.00 0.62 O ATOM 1813 CB ILE B 116 2.432 11.474 -2.763 1.00 0.77 C ATOM 1814 CG1 ILE B 116 3.240 11.399 -4.089 1.00 0.81 C ATOM 1815 CG2 ILE B 116 2.796 12.762 -1.995 1.00 0.98 C ATOM 1816 CD1 ILE B 116 2.828 12.444 -5.135 1.00 1.38 C ATOM 0 H ILE B 116 1.694 9.222 -3.450 1.00 0.53 H new ATOM 0 HA ILE B 116 3.734 10.106 -1.767 1.00 0.62 H new ATOM 0 HB ILE B 116 1.372 11.503 -3.013 1.00 0.77 H new ATOM 0 HG12 ILE B 116 4.299 11.524 -3.864 1.00 0.81 H new ATOM 0 HG13 ILE B 116 3.121 10.404 -4.519 1.00 0.81 H new ATOM 0 HG21 ILE B 116 2.630 13.627 -2.637 1.00 0.98 H new ATOM 0 HG22 ILE B 116 2.171 12.844 -1.106 1.00 0.98 H new ATOM 0 HG23 ILE B 116 3.844 12.725 -1.699 1.00 0.98 H new ATOM 0 HD11 ILE B 116 3.439 12.324 -6.030 1.00 1.38 H new ATOM 0 HD12 ILE B 116 1.778 12.307 -5.392 1.00 1.38 H new ATOM 0 HD13 ILE B 116 2.974 13.444 -4.727 1.00 1.38 H new ATOM 1828 N VAL B 117 0.777 10.310 -0.249 1.00 0.51 N ATOM 1829 CA VAL B 117 0.150 10.532 1.070 1.00 0.50 C ATOM 1830 C VAL B 117 0.464 9.409 2.067 1.00 0.51 C ATOM 1831 O VAL B 117 0.706 9.670 3.243 1.00 0.55 O ATOM 1832 CB VAL B 117 -1.368 10.699 0.870 1.00 0.50 C ATOM 1833 CG1 VAL B 117 -2.216 10.533 2.138 1.00 0.56 C ATOM 1834 CG2 VAL B 117 -1.662 12.061 0.219 1.00 0.51 C ATOM 0 H VAL B 117 0.105 10.124 -0.993 1.00 0.51 H new ATOM 0 HA VAL B 117 0.568 11.439 1.507 1.00 0.50 H new ATOM 0 HB VAL B 117 -1.664 9.879 0.216 1.00 0.50 H new ATOM 0 HG11 VAL B 117 -3.269 10.669 1.892 1.00 0.56 H new ATOM 0 HG12 VAL B 117 -2.065 9.534 2.548 1.00 0.56 H new ATOM 0 HG13 VAL B 117 -1.917 11.277 2.876 1.00 0.56 H new ATOM 0 HG21 VAL B 117 -2.737 12.173 0.080 1.00 0.51 H new ATOM 0 HG22 VAL B 117 -1.294 12.859 0.863 1.00 0.51 H new ATOM 0 HG23 VAL B 117 -1.163 12.117 -0.749 1.00 0.51 H new ATOM 1844 N LEU B 118 0.509 8.154 1.607 1.00 0.51 N ATOM 1845 CA LEU B 118 0.891 6.998 2.417 1.00 0.55 C ATOM 1846 C LEU B 118 2.338 7.133 2.926 1.00 0.59 C ATOM 1847 O LEU B 118 2.595 6.854 4.096 1.00 0.65 O ATOM 1848 CB LEU B 118 0.663 5.705 1.594 1.00 0.57 C ATOM 1849 CG LEU B 118 -0.707 5.040 1.856 1.00 0.71 C ATOM 1850 CD1 LEU B 118 -1.877 5.809 1.225 1.00 0.99 C ATOM 1851 CD2 LEU B 118 -0.736 3.607 1.310 1.00 0.76 C ATOM 0 H LEU B 118 0.276 7.912 0.644 1.00 0.51 H new ATOM 0 HA LEU B 118 0.264 6.946 3.307 1.00 0.55 H new ATOM 0 HB2 LEU B 118 0.747 5.940 0.533 1.00 0.57 H new ATOM 0 HB3 LEU B 118 1.454 4.992 1.826 1.00 0.57 H new ATOM 0 HG LEU B 118 -0.829 5.044 2.939 1.00 0.71 H new ATOM 0 HD11 LEU B 118 -2.812 5.293 1.444 1.00 0.99 H new ATOM 0 HD12 LEU B 118 -1.914 6.817 1.637 1.00 0.99 H new ATOM 0 HD13 LEU B 118 -1.737 5.863 0.145 1.00 0.99 H new ATOM 0 HD21 LEU B 118 -1.711 3.162 1.508 1.00 0.76 H new ATOM 0 HD22 LEU B 118 -0.556 3.623 0.235 1.00 0.76 H new ATOM 0 HD23 LEU B 118 0.038 3.016 1.799 1.00 0.76 H new ATOM 1863 N VAL B 119 3.252 7.597 2.068 1.00 0.60 N ATOM 1864 CA VAL B 119 4.674 7.799 2.382 1.00 0.63 C ATOM 1865 C VAL B 119 4.908 9.044 3.253 1.00 0.71 C ATOM 1866 O VAL B 119 5.698 8.967 4.196 1.00 0.82 O ATOM 1867 CB VAL B 119 5.498 7.847 1.077 1.00 0.56 C ATOM 1868 CG1 VAL B 119 6.963 8.222 1.318 1.00 0.58 C ATOM 1869 CG2 VAL B 119 5.487 6.457 0.419 1.00 0.60 C ATOM 0 H VAL B 119 3.018 7.850 1.108 1.00 0.60 H new ATOM 0 HA VAL B 119 5.013 6.950 2.976 1.00 0.63 H new ATOM 0 HB VAL B 119 5.040 8.607 0.444 1.00 0.56 H new ATOM 0 HG11 VAL B 119 7.495 8.241 0.367 1.00 0.58 H new ATOM 0 HG12 VAL B 119 7.015 9.207 1.782 1.00 0.58 H new ATOM 0 HG13 VAL B 119 7.423 7.486 1.977 1.00 0.58 H new ATOM 0 HG21 VAL B 119 6.068 6.486 -0.503 1.00 0.60 H new ATOM 0 HG22 VAL B 119 5.925 5.728 1.101 1.00 0.60 H new ATOM 0 HG23 VAL B 119 4.460 6.170 0.192 1.00 0.60 H new ATOM 1879 N GLU B 120 4.200 10.152 2.984 1.00 0.71 N ATOM 1880 CA GLU B 120 4.158 11.347 3.839 1.00 0.86 C ATOM 1881 C GLU B 120 3.808 10.952 5.280 1.00 0.91 C ATOM 1882 O GLU B 120 4.597 11.180 6.203 1.00 1.03 O ATOM 1883 CB GLU B 120 3.166 12.363 3.227 1.00 0.84 C ATOM 1884 CG GLU B 120 3.010 13.712 3.965 1.00 1.27 C ATOM 1885 CD GLU B 120 1.929 13.787 5.053 1.00 2.04 C ATOM 1886 OE1 GLU B 120 1.183 12.805 5.271 1.00 3.08 O ATOM 1887 OE2 GLU B 120 1.877 14.807 5.776 1.00 2.88 O ATOM 0 H GLU B 120 3.627 10.243 2.145 1.00 0.71 H new ATOM 0 HA GLU B 120 5.135 11.827 3.884 1.00 0.86 H new ATOM 0 HB2 GLU B 120 3.479 12.569 2.203 1.00 0.84 H new ATOM 0 HB3 GLU B 120 2.185 11.890 3.172 1.00 0.84 H new ATOM 0 HG2 GLU B 120 3.968 13.962 4.421 1.00 1.27 H new ATOM 0 HG3 GLU B 120 2.799 14.482 3.223 1.00 1.27 H new ATOM 1894 N ASN B 121 2.672 10.275 5.476 1.00 0.91 N ATOM 1895 CA ASN B 121 2.179 9.941 6.812 1.00 1.09 C ATOM 1896 C ASN B 121 3.026 8.884 7.540 1.00 1.02 C ATOM 1897 O ASN B 121 2.901 8.731 8.751 1.00 1.11 O ATOM 1898 CB ASN B 121 0.694 9.551 6.739 1.00 1.29 C ATOM 1899 CG ASN B 121 0.042 9.689 8.110 1.00 1.89 C ATOM 1900 OD1 ASN B 121 -0.175 10.796 8.585 1.00 3.01 O ATOM 1901 ND2 ASN B 121 -0.230 8.597 8.801 1.00 1.53 N ATOM 0 H ASN B 121 2.074 9.946 4.718 1.00 0.91 H new ATOM 0 HA ASN B 121 2.277 10.837 7.425 1.00 1.09 H new ATOM 0 HB2 ASN B 121 0.179 10.187 6.018 1.00 1.29 H new ATOM 0 HB3 ASN B 121 0.598 8.525 6.385 1.00 1.29 H new ATOM 0 HD21 ASN B 121 -0.624 8.672 9.739 1.00 1.53 H new ATOM 0 HD22 ASN B 121 -0.046 7.679 8.397 1.00 1.53 H new ATOM 1908 N PHE B 122 3.899 8.160 6.833 1.00 0.92 N ATOM 1909 CA PHE B 122 4.860 7.245 7.441 1.00 0.80 C ATOM 1910 C PHE B 122 6.142 7.947 7.920 1.00 0.72 C ATOM 1911 O PHE B 122 6.441 7.925 9.119 1.00 0.73 O ATOM 1912 CB PHE B 122 5.166 6.119 6.454 1.00 0.78 C ATOM 1913 CG PHE B 122 6.172 5.144 7.017 1.00 0.70 C ATOM 1914 CD1 PHE B 122 5.868 4.410 8.180 1.00 1.84 C ATOM 1915 CD2 PHE B 122 7.452 5.053 6.446 1.00 2.02 C ATOM 1916 CE1 PHE B 122 6.835 3.573 8.756 1.00 2.00 C ATOM 1917 CE2 PHE B 122 8.415 4.216 7.026 1.00 1.94 C ATOM 1918 CZ PHE B 122 8.106 3.466 8.171 1.00 0.89 C ATOM 0 H PHE B 122 3.956 8.195 5.815 1.00 0.92 H new ATOM 0 HA PHE B 122 4.410 6.829 8.342 1.00 0.80 H new ATOM 0 HB2 PHE B 122 4.245 5.591 6.207 1.00 0.78 H new ATOM 0 HB3 PHE B 122 5.549 6.542 5.526 1.00 0.78 H new ATOM 0 HD1 PHE B 122 4.889 4.492 8.629 1.00 1.84 H new ATOM 0 HD2 PHE B 122 7.693 5.626 5.563 1.00 2.02 H new ATOM 0 HE1 PHE B 122 6.602 3.012 9.649 1.00 2.00 H new ATOM 0 HE2 PHE B 122 9.400 4.148 6.589 1.00 1.94 H new ATOM 0 HZ PHE B 122 8.846 2.807 8.602 1.00 0.89 H new ATOM 1928 N TYR B 123 6.903 8.585 7.015 1.00 0.72 N ATOM 1929 CA TYR B 123 8.200 9.181 7.377 1.00 0.75 C ATOM 1930 C TYR B 123 8.065 10.230 8.495 1.00 0.82 C ATOM 1931 O TYR B 123 8.915 10.273 9.387 1.00 0.87 O ATOM 1932 CB TYR B 123 8.923 9.771 6.156 1.00 0.77 C ATOM 1933 CG TYR B 123 9.636 8.780 5.244 1.00 0.77 C ATOM 1934 CD1 TYR B 123 10.701 7.985 5.721 1.00 1.89 C ATOM 1935 CD2 TYR B 123 9.281 8.710 3.886 1.00 2.19 C ATOM 1936 CE1 TYR B 123 11.408 7.137 4.840 1.00 1.81 C ATOM 1937 CE2 TYR B 123 9.997 7.889 2.992 1.00 2.34 C ATOM 1938 CZ TYR B 123 11.072 7.107 3.469 1.00 0.97 C ATOM 1939 OH TYR B 123 11.751 6.289 2.620 1.00 1.11 O ATOM 0 H TYR B 123 6.645 8.701 6.035 1.00 0.72 H new ATOM 0 HA TYR B 123 8.813 8.367 7.764 1.00 0.75 H new ATOM 0 HB2 TYR B 123 8.194 10.320 5.560 1.00 0.77 H new ATOM 0 HB3 TYR B 123 9.655 10.496 6.511 1.00 0.77 H new ATOM 0 HD1 TYR B 123 10.976 8.026 6.765 1.00 1.89 H new ATOM 0 HD2 TYR B 123 8.448 9.293 3.523 1.00 2.19 H new ATOM 0 HE1 TYR B 123 12.205 6.512 5.215 1.00 1.81 H new ATOM 0 HE2 TYR B 123 9.725 7.858 1.947 1.00 2.34 H new ATOM 0 HH TYR B 123 11.315 5.412 2.592 1.00 1.11 H new ATOM 1949 N LYS B 124 6.939 10.961 8.541 1.00 0.89 N ATOM 1950 CA LYS B 124 6.524 11.852 9.644 1.00 0.91 C ATOM 1951 C LYS B 124 6.783 11.282 11.050 1.00 1.00 C ATOM 1952 O LYS B 124 7.272 11.987 11.927 1.00 1.32 O ATOM 1953 CB LYS B 124 5.011 12.146 9.479 1.00 0.94 C ATOM 1954 CG LYS B 124 4.749 13.552 8.924 1.00 2.65 C ATOM 1955 CD LYS B 124 3.428 13.691 8.160 1.00 2.67 C ATOM 1956 CE LYS B 124 2.154 13.198 8.854 1.00 1.93 C ATOM 1957 NZ LYS B 124 1.001 13.300 7.926 1.00 2.26 N ATOM 0 H LYS B 124 6.262 10.949 7.778 1.00 0.89 H new ATOM 0 HA LYS B 124 7.131 12.755 9.574 1.00 0.91 H new ATOM 0 HB2 LYS B 124 4.570 11.406 8.811 1.00 0.94 H new ATOM 0 HB3 LYS B 124 4.515 12.040 10.444 1.00 0.94 H new ATOM 0 HG2 LYS B 124 4.754 14.263 9.750 1.00 2.65 H new ATOM 0 HG3 LYS B 124 5.569 13.827 8.261 1.00 2.65 H new ATOM 0 HD2 LYS B 124 3.291 14.744 7.914 1.00 2.67 H new ATOM 0 HD3 LYS B 124 3.527 13.154 7.217 1.00 2.67 H new ATOM 0 HE2 LYS B 124 2.282 12.165 9.177 1.00 1.93 H new ATOM 0 HE3 LYS B 124 1.965 13.790 9.749 1.00 1.93 H new ATOM 0 HZ1 LYS B 124 0.150 12.917 8.386 1.00 2.26 H new ATOM 0 HZ2 LYS B 124 0.841 14.298 7.679 1.00 2.26 H new ATOM 0 HZ3 LYS B 124 1.202 12.757 7.062 1.00 2.26 H new ATOM 1971 N TYR B 125 6.459 10.007 11.273 1.00 0.84 N ATOM 1972 CA TYR B 125 6.582 9.358 12.584 1.00 0.97 C ATOM 1973 C TYR B 125 7.966 8.725 12.793 1.00 1.13 C ATOM 1974 O TYR B 125 8.449 8.655 13.919 1.00 1.22 O ATOM 1975 CB TYR B 125 5.460 8.318 12.719 1.00 0.99 C ATOM 1976 CG TYR B 125 4.072 8.924 12.815 1.00 1.03 C ATOM 1977 CD1 TYR B 125 3.496 9.536 11.688 1.00 2.07 C ATOM 1978 CD2 TYR B 125 3.367 8.899 14.033 1.00 1.88 C ATOM 1979 CE1 TYR B 125 2.243 10.164 11.767 1.00 2.26 C ATOM 1980 CE2 TYR B 125 2.088 9.491 14.117 1.00 2.02 C ATOM 1981 CZ TYR B 125 1.528 10.132 12.984 1.00 1.54 C ATOM 1982 OH TYR B 125 0.295 10.709 13.045 1.00 1.88 O ATOM 0 H TYR B 125 6.101 9.389 10.545 1.00 0.84 H new ATOM 0 HA TYR B 125 6.481 10.113 13.364 1.00 0.97 H new ATOM 0 HB2 TYR B 125 5.495 7.646 11.861 1.00 0.99 H new ATOM 0 HB3 TYR B 125 5.644 7.712 13.606 1.00 0.99 H new ATOM 0 HD1 TYR B 125 4.026 9.523 10.747 1.00 2.07 H new ATOM 0 HD2 TYR B 125 3.803 8.428 14.901 1.00 1.88 H new ATOM 0 HE1 TYR B 125 1.830 10.667 10.905 1.00 2.26 H new ATOM 0 HE2 TYR B 125 1.536 9.455 15.045 1.00 2.02 H new ATOM 0 HH TYR B 125 -0.071 10.604 13.948 1.00 1.88 H new ATOM 1992 N VAL B 126 8.597 8.296 11.699 1.00 1.41 N ATOM 1993 CA VAL B 126 9.953 7.720 11.645 1.00 1.78 C ATOM 1994 C VAL B 126 11.032 8.755 11.997 1.00 1.94 C ATOM 1995 O VAL B 126 11.926 8.468 12.792 1.00 3.39 O ATOM 1996 CB VAL B 126 10.217 7.150 10.231 1.00 1.83 C ATOM 1997 CG1 VAL B 126 11.680 6.758 9.990 1.00 2.42 C ATOM 1998 CG2 VAL B 126 9.338 5.929 9.958 1.00 2.64 C ATOM 0 H VAL B 126 8.160 8.340 10.778 1.00 1.41 H new ATOM 0 HA VAL B 126 10.006 6.923 12.387 1.00 1.78 H new ATOM 0 HB VAL B 126 9.970 7.962 9.547 1.00 1.83 H new ATOM 0 HG11 VAL B 126 11.790 6.367 8.979 1.00 2.42 H new ATOM 0 HG12 VAL B 126 12.316 7.635 10.111 1.00 2.42 H new ATOM 0 HG13 VAL B 126 11.975 5.994 10.709 1.00 2.42 H new ATOM 0 HG21 VAL B 126 9.544 5.549 8.957 1.00 2.64 H new ATOM 0 HG22 VAL B 126 9.554 5.153 10.693 1.00 2.64 H new ATOM 0 HG23 VAL B 126 8.288 6.213 10.029 1.00 2.64 H new ATOM 2166 N ILE B 136 9.509 5.908 16.751 1.00 1.73 N ATOM 2167 CA ILE B 136 8.328 5.156 16.291 1.00 1.20 C ATOM 2168 C ILE B 136 8.477 3.711 16.788 1.00 1.20 C ATOM 2169 O ILE B 136 9.581 3.267 17.113 1.00 1.61 O ATOM 2170 CB ILE B 136 8.139 5.269 14.757 1.00 1.79 C ATOM 2171 CG1 ILE B 136 6.742 4.779 14.300 1.00 1.43 C ATOM 2172 CG2 ILE B 136 9.264 4.573 13.980 1.00 3.09 C ATOM 2173 CD1 ILE B 136 6.490 4.886 12.790 1.00 1.99 C ATOM 0 HA ILE B 136 7.413 5.578 16.708 1.00 1.20 H new ATOM 0 HB ILE B 136 8.197 6.331 14.520 1.00 1.79 H new ATOM 0 HG12 ILE B 136 6.619 3.739 14.603 1.00 1.43 H new ATOM 0 HG13 ILE B 136 5.980 5.356 14.824 1.00 1.43 H new ATOM 0 HG21 ILE B 136 9.087 4.680 12.910 1.00 3.09 H new ATOM 0 HG22 ILE B 136 10.220 5.029 14.237 1.00 3.09 H new ATOM 0 HG23 ILE B 136 9.285 3.515 14.240 1.00 3.09 H new ATOM 0 HD11 ILE B 136 5.489 4.521 12.561 1.00 1.99 H new ATOM 0 HD12 ILE B 136 6.576 5.927 12.480 1.00 1.99 H new ATOM 0 HD13 ILE B 136 7.226 4.286 12.255 1.00 1.99 H new ATOM 2185 N SER B 137 7.384 2.975 16.908 1.00 1.50 N ATOM 2186 CA SER B 137 7.381 1.552 17.227 1.00 1.84 C ATOM 2187 C SER B 137 6.037 0.928 16.852 1.00 1.35 C ATOM 2188 O SER B 137 5.021 1.615 16.728 1.00 1.03 O ATOM 2189 CB SER B 137 7.682 1.342 18.719 1.00 2.41 C ATOM 2190 OG SER B 137 9.067 1.447 18.972 1.00 3.53 O ATOM 0 H SER B 137 6.447 3.359 16.783 1.00 1.50 H new ATOM 0 HA SER B 137 8.161 1.059 16.647 1.00 1.84 H new ATOM 0 HB2 SER B 137 7.143 2.082 19.311 1.00 2.41 H new ATOM 0 HB3 SER B 137 7.324 0.361 19.032 1.00 2.41 H new ATOM 0 HG SER B 137 9.490 1.974 18.262 1.00 3.53 H new ATOM 2196 N LYS B 138 6.024 -0.399 16.758 1.00 1.40 N ATOM 2197 CA LYS B 138 4.900 -1.276 16.400 1.00 1.21 C ATOM 2198 C LYS B 138 3.570 -1.072 17.175 1.00 1.06 C ATOM 2199 O LYS B 138 2.528 -1.567 16.754 1.00 1.23 O ATOM 2200 CB LYS B 138 5.437 -2.709 16.414 1.00 1.48 C ATOM 2201 CG LYS B 138 6.043 -3.175 17.748 1.00 1.66 C ATOM 2202 CD LYS B 138 7.088 -4.249 17.446 1.00 1.72 C ATOM 2203 CE LYS B 138 7.632 -4.785 18.780 1.00 2.66 C ATOM 2204 NZ LYS B 138 8.779 -5.720 18.656 1.00 2.39 N ATOM 0 H LYS B 138 6.869 -0.939 16.945 1.00 1.40 H new ATOM 0 HA LYS B 138 4.557 -1.000 15.403 1.00 1.21 H new ATOM 0 HB2 LYS B 138 4.625 -3.386 16.148 1.00 1.48 H new ATOM 0 HB3 LYS B 138 6.197 -2.802 15.638 1.00 1.48 H new ATOM 0 HG2 LYS B 138 6.500 -2.336 18.272 1.00 1.66 H new ATOM 0 HG3 LYS B 138 5.266 -3.573 18.401 1.00 1.66 H new ATOM 0 HD2 LYS B 138 6.644 -5.057 16.865 1.00 1.72 H new ATOM 0 HD3 LYS B 138 7.897 -3.833 16.846 1.00 1.72 H new ATOM 0 HE2 LYS B 138 7.936 -3.940 19.398 1.00 2.66 H new ATOM 0 HE3 LYS B 138 6.824 -5.292 19.308 1.00 2.66 H new ATOM 0 HZ1 LYS B 138 8.654 -6.512 19.318 1.00 2.39 H new ATOM 0 HZ2 LYS B 138 8.825 -6.086 17.684 1.00 2.39 H new ATOM 0 HZ3 LYS B 138 9.662 -5.218 18.879 1.00 2.39 H new ATOM 2218 N SER B 139 3.542 -0.293 18.263 1.00 1.06 N ATOM 2219 CA SER B 139 2.290 0.174 18.885 1.00 1.05 C ATOM 2220 C SER B 139 1.653 1.395 18.195 1.00 1.01 C ATOM 2221 O SER B 139 0.440 1.569 18.278 1.00 1.06 O ATOM 2222 CB SER B 139 2.520 0.532 20.362 1.00 1.17 C ATOM 2223 OG SER B 139 2.628 -0.630 21.165 1.00 2.13 O ATOM 0 H SER B 139 4.383 0.033 18.739 1.00 1.06 H new ATOM 0 HA SER B 139 1.599 -0.662 18.778 1.00 1.05 H new ATOM 0 HB2 SER B 139 3.428 1.127 20.456 1.00 1.17 H new ATOM 0 HB3 SER B 139 1.696 1.149 20.721 1.00 1.17 H new ATOM 0 HG SER B 139 2.776 -0.370 22.098 1.00 2.13 H new ATOM 2229 N SER B 140 2.420 2.266 17.537 1.00 0.95 N ATOM 2230 CA SER B 140 1.906 3.558 17.050 1.00 0.84 C ATOM 2231 C SER B 140 1.061 3.400 15.785 1.00 0.74 C ATOM 2232 O SER B 140 -0.051 3.915 15.727 1.00 0.71 O ATOM 2233 CB SER B 140 3.062 4.528 16.768 1.00 0.91 C ATOM 2234 OG SER B 140 3.899 4.712 17.900 1.00 1.32 O ATOM 0 H SER B 140 3.405 2.104 17.326 1.00 0.95 H new ATOM 0 HA SER B 140 1.270 3.961 17.838 1.00 0.84 H new ATOM 0 HB2 SER B 140 3.657 4.149 15.937 1.00 0.91 H new ATOM 0 HB3 SER B 140 2.658 5.491 16.457 1.00 0.91 H new ATOM 0 HG SER B 140 4.621 5.335 17.675 1.00 1.32 H new ATOM 2240 N PHE B 141 1.536 2.629 14.801 1.00 0.90 N ATOM 2241 CA PHE B 141 0.808 2.312 13.570 1.00 0.87 C ATOM 2242 C PHE B 141 -0.609 1.782 13.846 1.00 0.69 C ATOM 2243 O PHE B 141 -1.584 2.318 13.314 1.00 0.62 O ATOM 2244 CB PHE B 141 1.641 1.293 12.783 1.00 1.09 C ATOM 2245 CG PHE B 141 0.848 0.487 11.778 1.00 0.91 C ATOM 2246 CD1 PHE B 141 0.266 1.118 10.667 1.00 2.42 C ATOM 2247 CD2 PHE B 141 0.642 -0.891 11.978 1.00 1.54 C ATOM 2248 CE1 PHE B 141 -0.363 0.354 9.681 1.00 2.36 C ATOM 2249 CE2 PHE B 141 -0.078 -1.645 11.040 1.00 1.60 C ATOM 2250 CZ PHE B 141 -0.534 -1.032 9.861 1.00 0.77 C ATOM 0 H PHE B 141 2.460 2.198 14.841 1.00 0.90 H new ATOM 0 HA PHE B 141 0.671 3.223 12.988 1.00 0.87 H new ATOM 0 HB2 PHE B 141 2.440 1.820 12.260 1.00 1.09 H new ATOM 0 HB3 PHE B 141 2.117 0.609 13.486 1.00 1.09 H new ATOM 0 HD1 PHE B 141 0.305 2.193 10.575 1.00 2.42 H new ATOM 0 HD2 PHE B 141 1.041 -1.371 12.860 1.00 1.54 H new ATOM 0 HE1 PHE B 141 -0.719 0.828 8.778 1.00 2.36 H new ATOM 0 HE2 PHE B 141 -0.281 -2.690 11.223 1.00 1.60 H new ATOM 0 HZ PHE B 141 -1.014 -1.622 9.095 1.00 0.77 H new ATOM 2260 N ARG B 142 -0.731 0.785 14.735 1.00 0.74 N ATOM 2261 CA ARG B 142 -2.025 0.201 15.115 1.00 0.75 C ATOM 2262 C ARG B 142 -2.960 1.177 15.847 1.00 0.71 C ATOM 2263 O ARG B 142 -4.121 0.835 16.059 1.00 0.96 O ATOM 2264 CB ARG B 142 -1.836 -1.077 15.948 1.00 1.02 C ATOM 2265 CG ARG B 142 -1.174 -0.777 17.298 1.00 1.02 C ATOM 2266 CD ARG B 142 -1.448 -1.872 18.321 1.00 1.32 C ATOM 2267 NE ARG B 142 -0.797 -1.588 19.608 1.00 1.79 N ATOM 2268 CZ ARG B 142 -0.625 -2.495 20.561 1.00 2.73 C ATOM 2269 NH1 ARG B 142 -1.182 -3.687 20.498 1.00 3.40 N ATOM 2270 NH2 ARG B 142 0.146 -2.219 21.590 1.00 3.53 N ATOM 0 H ARG B 142 0.065 0.361 15.211 1.00 0.74 H new ATOM 0 HA ARG B 142 -2.515 -0.048 14.174 1.00 0.75 H new ATOM 0 HB2 ARG B 142 -2.804 -1.551 16.114 1.00 1.02 H new ATOM 0 HB3 ARG B 142 -1.224 -1.788 15.392 1.00 1.02 H new ATOM 0 HG2 ARG B 142 -0.098 -0.671 17.159 1.00 1.02 H new ATOM 0 HG3 ARG B 142 -1.542 0.176 17.679 1.00 1.02 H new ATOM 0 HD2 ARG B 142 -2.523 -1.970 18.471 1.00 1.32 H new ATOM 0 HD3 ARG B 142 -1.092 -2.827 17.936 1.00 1.32 H new ATOM 0 HE ARG B 142 -0.459 -0.641 19.778 1.00 1.79 H new ATOM 0 HH11 ARG B 142 -1.766 -3.936 19.699 1.00 3.40 H new ATOM 0 HH12 ARG B 142 -1.030 -4.361 21.248 1.00 3.40 H new ATOM 0 HH21 ARG B 142 0.608 -1.312 21.652 1.00 3.53 H new ATOM 0 HH22 ARG B 142 0.282 -2.912 22.326 1.00 3.53 H new ATOM 2284 N GLU B 143 -2.491 2.343 16.302 1.00 0.65 N ATOM 2285 CA GLU B 143 -3.349 3.406 16.815 1.00 0.68 C ATOM 2286 C GLU B 143 -3.607 4.475 15.747 1.00 0.67 C ATOM 2287 O GLU B 143 -4.737 4.907 15.572 1.00 0.73 O ATOM 2288 CB GLU B 143 -2.692 4.033 18.049 1.00 0.75 C ATOM 2289 CG GLU B 143 -3.774 4.702 18.890 1.00 1.00 C ATOM 2290 CD GLU B 143 -3.142 5.548 19.980 1.00 1.47 C ATOM 2291 OE1 GLU B 143 -2.673 4.947 20.964 1.00 2.48 O ATOM 2292 OE2 GLU B 143 -3.123 6.784 19.776 1.00 1.99 O ATOM 0 H GLU B 143 -1.498 2.574 16.323 1.00 0.65 H new ATOM 0 HA GLU B 143 -4.312 2.977 17.091 1.00 0.68 H new ATOM 0 HB2 GLU B 143 -2.177 3.270 18.633 1.00 0.75 H new ATOM 0 HB3 GLU B 143 -1.941 4.764 17.748 1.00 0.75 H new ATOM 0 HG2 GLU B 143 -4.405 5.325 18.256 1.00 1.00 H new ATOM 0 HG3 GLU B 143 -4.419 3.945 19.335 1.00 1.00 H new ATOM 2299 N MET B 144 -2.580 4.888 15.009 1.00 0.64 N ATOM 2300 CA MET B 144 -2.636 5.862 13.903 1.00 0.69 C ATOM 2301 C MET B 144 -3.667 5.479 12.837 1.00 0.69 C ATOM 2302 O MET B 144 -4.460 6.311 12.412 1.00 0.77 O ATOM 2303 CB MET B 144 -1.215 5.937 13.336 1.00 0.78 C ATOM 2304 CG MET B 144 -1.027 6.907 12.172 1.00 1.15 C ATOM 2305 SD MET B 144 0.693 6.910 11.614 1.00 2.91 S ATOM 2306 CE MET B 144 0.708 5.421 10.590 1.00 1.16 C ATOM 0 H MET B 144 -1.635 4.540 15.168 1.00 0.64 H new ATOM 0 HA MET B 144 -2.967 6.837 14.261 1.00 0.69 H new ATOM 0 HB2 MET B 144 -0.536 6.223 14.139 1.00 0.78 H new ATOM 0 HB3 MET B 144 -0.919 4.940 13.008 1.00 0.78 H new ATOM 0 HG2 MET B 144 -1.682 6.625 11.347 1.00 1.15 H new ATOM 0 HG3 MET B 144 -1.317 7.912 12.479 1.00 1.15 H new ATOM 0 HE1 MET B 144 1.610 4.845 10.798 1.00 1.16 H new ATOM 0 HE2 MET B 144 -0.169 4.815 10.816 1.00 1.16 H new ATOM 0 HE3 MET B 144 0.692 5.703 9.537 1.00 1.16 H new ATOM 2316 N LEU B 145 -3.753 4.197 12.468 1.00 0.71 N ATOM 2317 CA LEU B 145 -4.810 3.714 11.574 1.00 0.89 C ATOM 2318 C LEU B 145 -6.230 3.936 12.122 1.00 0.94 C ATOM 2319 O LEU B 145 -7.158 4.120 11.345 1.00 1.33 O ATOM 2320 CB LEU B 145 -4.572 2.225 11.264 1.00 1.06 C ATOM 2321 CG LEU B 145 -3.422 1.867 10.309 1.00 1.01 C ATOM 2322 CD1 LEU B 145 -3.669 0.422 9.835 1.00 1.53 C ATOM 2323 CD2 LEU B 145 -3.349 2.802 9.095 1.00 1.51 C ATOM 0 H LEU B 145 -3.102 3.474 12.775 1.00 0.71 H new ATOM 0 HA LEU B 145 -4.753 4.304 10.659 1.00 0.89 H new ATOM 0 HB2 LEU B 145 -4.396 1.710 12.208 1.00 1.06 H new ATOM 0 HB3 LEU B 145 -5.493 1.818 10.846 1.00 1.06 H new ATOM 0 HG LEU B 145 -2.473 1.972 10.835 1.00 1.01 H new ATOM 0 HD11 LEU B 145 -2.874 0.122 9.152 1.00 1.53 H new ATOM 0 HD12 LEU B 145 -3.679 -0.247 10.696 1.00 1.53 H new ATOM 0 HD13 LEU B 145 -4.629 0.367 9.322 1.00 1.53 H new ATOM 0 HD21 LEU B 145 -2.519 2.503 8.455 1.00 1.51 H new ATOM 0 HD22 LEU B 145 -4.281 2.742 8.533 1.00 1.51 H new ATOM 0 HD23 LEU B 145 -3.195 3.827 9.434 1.00 1.51 H new ATOM 2335 N GLN B 146 -6.409 3.947 13.443 1.00 0.75 N ATOM 2336 CA GLN B 146 -7.677 4.224 14.112 1.00 0.77 C ATOM 2337 C GLN B 146 -7.986 5.727 14.209 1.00 0.79 C ATOM 2338 O GLN B 146 -9.109 6.087 14.545 1.00 0.91 O ATOM 2339 CB GLN B 146 -7.651 3.467 15.451 1.00 0.87 C ATOM 2340 CG GLN B 146 -8.711 3.889 16.466 1.00 1.21 C ATOM 2341 CD GLN B 146 -8.825 2.870 17.589 1.00 1.45 C ATOM 2342 OE1 GLN B 146 -9.672 1.992 17.619 1.00 2.61 O ATOM 2343 NE2 GLN B 146 -7.928 2.888 18.543 1.00 1.28 N ATOM 0 H GLN B 146 -5.650 3.757 14.097 1.00 0.75 H new ATOM 0 HA GLN B 146 -8.521 3.859 13.526 1.00 0.77 H new ATOM 0 HB2 GLN B 146 -7.770 2.403 15.249 1.00 0.87 H new ATOM 0 HB3 GLN B 146 -6.668 3.598 15.903 1.00 0.87 H new ATOM 0 HG2 GLN B 146 -8.456 4.865 16.880 1.00 1.21 H new ATOM 0 HG3 GLN B 146 -9.675 3.996 15.968 1.00 1.21 H new ATOM 0 HE21 GLN B 146 -7.205 3.607 18.550 1.00 1.28 H new ATOM 0 HE22 GLN B 146 -7.952 2.183 19.279 1.00 1.28 H new ATOM 2352 N LYS B 147 -7.030 6.601 13.882 1.00 0.78 N ATOM 2353 CA LYS B 147 -7.249 8.036 13.682 1.00 0.85 C ATOM 2354 C LYS B 147 -7.374 8.382 12.184 1.00 0.85 C ATOM 2355 O LYS B 147 -8.469 8.704 11.724 1.00 1.05 O ATOM 2356 CB LYS B 147 -6.127 8.823 14.384 1.00 0.91 C ATOM 2357 CG LYS B 147 -6.325 8.959 15.908 1.00 0.94 C ATOM 2358 CD LYS B 147 -5.721 7.821 16.736 1.00 0.95 C ATOM 2359 CE LYS B 147 -4.190 7.893 16.669 1.00 1.11 C ATOM 2360 NZ LYS B 147 -3.603 8.567 17.850 1.00 1.55 N ATOM 0 H LYS B 147 -6.058 6.323 13.746 1.00 0.78 H new ATOM 0 HA LYS B 147 -8.198 8.326 14.133 1.00 0.85 H new ATOM 0 HB2 LYS B 147 -5.174 8.329 14.193 1.00 0.91 H new ATOM 0 HB3 LYS B 147 -6.064 9.818 13.944 1.00 0.91 H new ATOM 0 HG2 LYS B 147 -5.885 9.901 16.235 1.00 0.94 H new ATOM 0 HG3 LYS B 147 -7.393 9.016 16.118 1.00 0.94 H new ATOM 0 HD2 LYS B 147 -6.054 7.895 17.771 1.00 0.95 H new ATOM 0 HD3 LYS B 147 -6.067 6.859 16.358 1.00 0.95 H new ATOM 0 HE2 LYS B 147 -3.785 6.884 16.591 1.00 1.11 H new ATOM 0 HE3 LYS B 147 -3.893 8.426 15.766 1.00 1.11 H new ATOM 0 HZ1 LYS B 147 -2.897 9.264 17.537 1.00 1.55 H new ATOM 0 HZ2 LYS B 147 -4.354 9.050 18.383 1.00 1.55 H new ATOM 0 HZ3 LYS B 147 -3.145 7.861 18.461 1.00 1.55 H new ATOM 2374 N GLU B 148 -6.327 8.203 11.379 1.00 0.80 N ATOM 2375 CA GLU B 148 -6.300 8.652 9.980 1.00 0.81 C ATOM 2376 C GLU B 148 -7.116 7.769 9.015 1.00 0.81 C ATOM 2377 O GLU B 148 -7.375 8.197 7.889 1.00 1.10 O ATOM 2378 CB GLU B 148 -4.839 8.753 9.499 1.00 0.91 C ATOM 2379 CG GLU B 148 -4.080 9.972 10.049 1.00 1.18 C ATOM 2380 CD GLU B 148 -4.080 10.021 11.575 1.00 1.85 C ATOM 2381 OE1 GLU B 148 -3.476 9.114 12.193 1.00 2.77 O ATOM 2382 OE2 GLU B 148 -4.789 10.891 12.122 1.00 3.19 O ATOM 0 H GLU B 148 -5.468 7.741 11.677 1.00 0.80 H new ATOM 0 HA GLU B 148 -6.781 9.630 9.963 1.00 0.81 H new ATOM 0 HB2 GLU B 148 -4.308 7.846 9.790 1.00 0.91 H new ATOM 0 HB3 GLU B 148 -4.828 8.793 8.410 1.00 0.91 H new ATOM 0 HG2 GLU B 148 -3.051 9.948 9.689 1.00 1.18 H new ATOM 0 HG3 GLU B 148 -4.533 10.884 9.659 1.00 1.18 H new ATOM 2389 N LEU B 149 -7.529 6.565 9.432 1.00 0.72 N ATOM 2390 CA LEU B 149 -8.348 5.636 8.647 1.00 0.74 C ATOM 2391 C LEU B 149 -9.648 5.222 9.376 1.00 0.77 C ATOM 2392 O LEU B 149 -10.299 4.243 9.007 1.00 1.14 O ATOM 2393 CB LEU B 149 -7.428 4.461 8.239 1.00 0.76 C ATOM 2394 CG LEU B 149 -7.323 4.340 6.710 1.00 1.07 C ATOM 2395 CD1 LEU B 149 -5.972 3.767 6.286 1.00 1.11 C ATOM 2396 CD2 LEU B 149 -8.449 3.447 6.186 1.00 1.67 C ATOM 0 H LEU B 149 -7.294 6.200 10.355 1.00 0.72 H new ATOM 0 HA LEU B 149 -8.728 6.114 7.744 1.00 0.74 H new ATOM 0 HB2 LEU B 149 -6.435 4.609 8.663 1.00 0.76 H new ATOM 0 HB3 LEU B 149 -7.816 3.531 8.654 1.00 0.76 H new ATOM 0 HG LEU B 149 -7.414 5.340 6.285 1.00 1.07 H new ATOM 0 HD11 LEU B 149 -5.932 3.695 5.199 1.00 1.11 H new ATOM 0 HD12 LEU B 149 -5.173 4.421 6.636 1.00 1.11 H new ATOM 0 HD13 LEU B 149 -5.845 2.775 6.720 1.00 1.11 H new ATOM 0 HD21 LEU B 149 -8.372 3.363 5.102 1.00 1.67 H new ATOM 0 HD22 LEU B 149 -8.366 2.457 6.634 1.00 1.67 H new ATOM 0 HD23 LEU B 149 -9.412 3.884 6.449 1.00 1.67 H new ATOM 2408 N ASN B 150 -10.056 5.996 10.394 1.00 0.71 N ATOM 2409 CA ASN B 150 -11.161 5.683 11.318 1.00 0.79 C ATOM 2410 C ASN B 150 -12.511 5.356 10.647 1.00 0.86 C ATOM 2411 O ASN B 150 -13.303 4.600 11.203 1.00 1.26 O ATOM 2412 CB ASN B 150 -11.349 6.841 12.315 1.00 0.91 C ATOM 2413 CG ASN B 150 -11.979 8.088 11.701 1.00 1.00 C ATOM 2414 OD1 ASN B 150 -13.181 8.162 11.478 1.00 1.25 O ATOM 2415 ND2 ASN B 150 -11.182 9.086 11.381 1.00 0.98 N ATOM 0 H ASN B 150 -9.611 6.889 10.605 1.00 0.71 H new ATOM 0 HA ASN B 150 -10.859 4.765 11.823 1.00 0.79 H new ATOM 0 HB2 ASN B 150 -11.973 6.499 13.141 1.00 0.91 H new ATOM 0 HB3 ASN B 150 -10.379 7.106 12.737 1.00 0.91 H new ATOM 0 HD21 ASN B 150 -11.565 9.925 10.946 1.00 0.98 H new ATOM 0 HD22 ASN B 150 -10.182 9.020 11.569 1.00 0.98 H new ATOM 2422 N HIS B 151 -12.772 5.905 9.458 1.00 0.75 N ATOM 2423 CA HIS B 151 -14.082 5.867 8.800 1.00 0.88 C ATOM 2424 C HIS B 151 -14.525 4.457 8.358 1.00 0.97 C ATOM 2425 O HIS B 151 -15.725 4.209 8.268 1.00 1.35 O ATOM 2426 CB HIS B 151 -14.053 6.787 7.571 1.00 0.88 C ATOM 2427 CG HIS B 151 -13.379 8.133 7.714 1.00 0.95 C ATOM 2428 ND1 HIS B 151 -13.556 9.078 8.702 1.00 1.14 N ATOM 2429 CD2 HIS B 151 -12.526 8.674 6.793 1.00 1.62 C ATOM 2430 CE1 HIS B 151 -12.845 10.168 8.365 1.00 1.15 C ATOM 2431 NE2 HIS B 151 -12.182 9.965 7.213 1.00 1.61 N ATOM 0 H HIS B 151 -12.064 6.399 8.914 1.00 0.75 H new ATOM 0 HA HIS B 151 -14.808 6.202 9.541 1.00 0.88 H new ATOM 0 HB2 HIS B 151 -13.559 6.249 6.762 1.00 0.88 H new ATOM 0 HB3 HIS B 151 -15.083 6.960 7.257 1.00 0.88 H new ATOM 0 HD1 HIS B 151 -14.126 8.969 9.541 1.00 1.14 H new ATOM 0 HD2 HIS B 151 -12.177 8.188 5.894 1.00 1.62 H new ATOM 0 HE1 HIS B 151 -12.811 11.081 8.941 1.00 1.15 H new ATOM 2439 N MET B 152 -13.575 3.547 8.106 1.00 0.90 N ATOM 2440 CA MET B 152 -13.837 2.119 7.844 1.00 1.15 C ATOM 2441 C MET B 152 -13.476 1.223 9.040 1.00 1.09 C ATOM 2442 O MET B 152 -13.338 0.004 8.902 1.00 1.12 O ATOM 2443 CB MET B 152 -13.068 1.667 6.596 1.00 1.40 C ATOM 2444 CG MET B 152 -13.539 2.349 5.311 1.00 2.50 C ATOM 2445 SD MET B 152 -12.853 1.534 3.850 1.00 2.15 S ATOM 2446 CE MET B 152 -11.243 2.354 3.774 1.00 1.32 C ATOM 0 H MET B 152 -12.583 3.783 8.077 1.00 0.90 H new ATOM 0 HA MET B 152 -14.909 2.013 7.677 1.00 1.15 H new ATOM 0 HB2 MET B 152 -12.007 1.871 6.739 1.00 1.40 H new ATOM 0 HB3 MET B 152 -13.173 0.588 6.485 1.00 1.40 H new ATOM 0 HG2 MET B 152 -14.628 2.330 5.264 1.00 2.50 H new ATOM 0 HG3 MET B 152 -13.239 3.397 5.321 1.00 2.50 H new ATOM 0 HE1 MET B 152 -10.472 1.621 3.538 1.00 1.32 H new ATOM 0 HE2 MET B 152 -11.262 3.122 3.001 1.00 1.32 H new ATOM 0 HE3 MET B 152 -11.023 2.814 4.737 1.00 1.32 H new ATOM 2456 N LEU B 153 -13.216 1.826 10.202 1.00 1.26 N ATOM 2457 CA LEU B 153 -12.832 1.179 11.441 1.00 1.47 C ATOM 2458 C LEU B 153 -14.050 1.032 12.369 1.00 2.02 C ATOM 2459 O LEU B 153 -15.189 1.100 11.928 1.00 2.40 O ATOM 2460 CB LEU B 153 -11.684 2.030 12.029 1.00 1.68 C ATOM 2461 CG LEU B 153 -10.620 1.183 12.738 1.00 1.72 C ATOM 2462 CD1 LEU B 153 -9.255 1.345 12.054 1.00 2.10 C ATOM 2463 CD2 LEU B 153 -10.511 1.574 14.216 1.00 2.19 C ATOM 0 H LEU B 153 -13.274 2.840 10.300 1.00 1.26 H new ATOM 0 HA LEU B 153 -12.477 0.159 11.295 1.00 1.47 H new ATOM 0 HB2 LEU B 153 -11.214 2.600 11.228 1.00 1.68 H new ATOM 0 HB3 LEU B 153 -12.097 2.751 12.734 1.00 1.68 H new ATOM 0 HG LEU B 153 -10.925 0.138 12.673 1.00 1.72 H new ATOM 0 HD11 LEU B 153 -8.514 0.736 12.572 1.00 2.10 H new ATOM 0 HD12 LEU B 153 -9.328 1.022 11.015 1.00 2.10 H new ATOM 0 HD13 LEU B 153 -8.953 2.392 12.088 1.00 2.10 H new ATOM 0 HD21 LEU B 153 -9.751 0.961 14.699 1.00 2.19 H new ATOM 0 HD22 LEU B 153 -10.234 2.625 14.295 1.00 2.19 H new ATOM 0 HD23 LEU B 153 -11.471 1.415 14.706 1.00 2.19 H new ATOM 2475 N SER B 154 -13.817 0.768 13.655 1.00 3.19 N ATOM 2476 CA SER B 154 -14.839 0.540 14.700 1.00 3.94 C ATOM 2477 C SER B 154 -15.596 -0.793 14.555 1.00 2.71 C ATOM 2478 O SER B 154 -16.069 -1.323 15.556 1.00 3.57 O ATOM 2479 CB SER B 154 -15.833 1.706 14.802 1.00 5.60 C ATOM 2480 OG SER B 154 -16.485 1.653 16.059 1.00 7.09 O ATOM 0 H SER B 154 -12.868 0.702 14.023 1.00 3.19 H new ATOM 0 HA SER B 154 -14.272 0.480 15.629 1.00 3.94 H new ATOM 0 HB2 SER B 154 -15.311 2.656 14.690 1.00 5.60 H new ATOM 0 HB3 SER B 154 -16.565 1.647 13.996 1.00 5.60 H new ATOM 0 HG SER B 154 -17.120 2.396 16.130 1.00 7.09 H new ATOM 2486 N ASP B 155 -15.651 -1.378 13.354 1.00 1.72 N ATOM 2487 CA ASP B 155 -16.274 -2.668 12.991 1.00 2.64 C ATOM 2488 C ASP B 155 -15.604 -3.912 13.630 1.00 2.90 C ATOM 2489 O ASP B 155 -15.774 -5.038 13.174 1.00 4.16 O ATOM 2490 CB ASP B 155 -16.269 -2.746 11.448 1.00 3.94 C ATOM 2491 CG ASP B 155 -17.151 -3.862 10.869 1.00 5.52 C ATOM 2492 OD1 ASP B 155 -18.274 -4.038 11.390 1.00 5.80 O ATOM 2493 OD2 ASP B 155 -16.703 -4.502 9.890 1.00 7.01 O ATOM 0 H ASP B 155 -15.229 -0.930 12.541 1.00 1.72 H new ATOM 0 HA ASP B 155 -17.286 -2.692 13.394 1.00 2.64 H new ATOM 0 HB2 ASP B 155 -16.603 -1.789 11.046 1.00 3.94 H new ATOM 0 HB3 ASP B 155 -15.245 -2.895 11.107 1.00 3.94 H new ATOM 2498 N THR B 156 -14.790 -3.711 14.678 1.00 2.34 N ATOM 2499 CA THR B 156 -14.021 -4.698 15.452 1.00 2.46 C ATOM 2500 C THR B 156 -12.973 -5.441 14.624 1.00 2.14 C ATOM 2501 O THR B 156 -11.780 -5.273 14.888 1.00 1.87 O ATOM 2502 CB THR B 156 -14.961 -5.653 16.192 1.00 3.50 C ATOM 2503 OG1 THR B 156 -15.743 -4.896 17.080 1.00 3.41 O ATOM 2504 CG2 THR B 156 -14.172 -6.632 17.051 1.00 4.19 C ATOM 0 H THR B 156 -14.640 -2.768 15.038 1.00 2.34 H new ATOM 0 HA THR B 156 -13.449 -4.141 16.194 1.00 2.46 H new ATOM 0 HB THR B 156 -15.556 -6.191 15.454 1.00 3.50 H new ATOM 0 HG1 THR B 156 -16.355 -5.489 17.564 1.00 3.41 H new ATOM 0 HG21 THR B 156 -14.861 -7.300 17.567 1.00 4.19 H new ATOM 0 HG22 THR B 156 -13.505 -7.217 16.417 1.00 4.19 H new ATOM 0 HG23 THR B 156 -13.584 -6.080 17.784 1.00 4.19 H new ATOM 2512 N GLY B 157 -13.386 -6.255 13.647 1.00 2.41 N ATOM 2513 CA GLY B 157 -12.528 -7.155 12.866 1.00 2.44 C ATOM 2514 C GLY B 157 -11.352 -6.432 12.219 1.00 2.02 C ATOM 2515 O GLY B 157 -10.223 -6.917 12.310 1.00 2.00 O ATOM 0 H GLY B 157 -14.365 -6.308 13.367 1.00 2.41 H new ATOM 0 HA2 GLY B 157 -12.151 -7.945 13.515 1.00 2.44 H new ATOM 0 HA3 GLY B 157 -13.124 -7.637 12.091 1.00 2.44 H new ATOM 2519 N ASN B 158 -11.604 -5.225 11.695 1.00 1.77 N ATOM 2520 CA ASN B 158 -10.599 -4.263 11.240 1.00 1.47 C ATOM 2521 C ASN B 158 -9.416 -4.138 12.232 1.00 1.13 C ATOM 2522 O ASN B 158 -8.307 -4.583 11.924 1.00 1.18 O ATOM 2523 CB ASN B 158 -11.325 -2.924 10.992 1.00 1.39 C ATOM 2524 CG ASN B 158 -10.402 -1.807 10.513 1.00 2.87 C ATOM 2525 OD1 ASN B 158 -9.353 -1.570 11.088 1.00 4.16 O ATOM 2526 ND2 ASN B 158 -10.770 -1.058 9.496 1.00 3.41 N ATOM 0 H ASN B 158 -12.556 -4.880 11.573 1.00 1.77 H new ATOM 0 HA ASN B 158 -10.138 -4.604 10.313 1.00 1.47 H new ATOM 0 HB2 ASN B 158 -12.110 -3.078 10.251 1.00 1.39 H new ATOM 0 HB3 ASN B 158 -11.814 -2.609 11.914 1.00 1.39 H new ATOM 0 HD21 ASN B 158 -10.179 -0.284 9.192 1.00 3.41 H new ATOM 0 HD22 ASN B 158 -11.646 -1.251 9.011 1.00 3.41 H new ATOM 2533 N ARG B 159 -9.635 -3.595 13.443 1.00 0.99 N ATOM 2534 CA ARG B 159 -8.549 -3.322 14.382 1.00 0.85 C ATOM 2535 C ARG B 159 -7.997 -4.600 15.031 1.00 0.77 C ATOM 2536 O ARG B 159 -6.806 -4.674 15.315 1.00 0.75 O ATOM 2537 CB ARG B 159 -8.961 -2.248 15.385 1.00 0.99 C ATOM 2538 CG ARG B 159 -7.698 -1.825 16.145 1.00 1.67 C ATOM 2539 CD ARG B 159 -7.727 -0.361 16.562 1.00 1.35 C ATOM 2540 NE ARG B 159 -6.494 0.023 17.267 1.00 2.60 N ATOM 2541 CZ ARG B 159 -6.272 0.166 18.569 1.00 3.75 C ATOM 2542 NH1 ARG B 159 -7.221 0.004 19.469 1.00 4.14 N ATOM 2543 NH2 ARG B 159 -5.062 0.488 18.968 1.00 5.04 N ATOM 0 H ARG B 159 -10.560 -3.338 13.789 1.00 0.99 H new ATOM 0 HA ARG B 159 -7.708 -2.917 13.820 1.00 0.85 H new ATOM 0 HB2 ARG B 159 -9.405 -1.394 14.873 1.00 0.99 H new ATOM 0 HB3 ARG B 159 -9.713 -2.633 16.074 1.00 0.99 H new ATOM 0 HG2 ARG B 159 -7.586 -2.449 17.032 1.00 1.67 H new ATOM 0 HG3 ARG B 159 -6.825 -2.003 15.518 1.00 1.67 H new ATOM 0 HD2 ARG B 159 -7.854 0.267 15.680 1.00 1.35 H new ATOM 0 HD3 ARG B 159 -8.587 -0.182 17.207 1.00 1.35 H new ATOM 0 HE ARG B 159 -5.690 0.207 16.667 1.00 2.60 H new ATOM 0 HH11 ARG B 159 -8.167 -0.240 19.175 1.00 4.14 H new ATOM 0 HH12 ARG B 159 -7.010 0.123 20.460 1.00 4.14 H new ATOM 0 HH21 ARG B 159 -4.318 0.622 18.283 1.00 5.04 H new ATOM 0 HH22 ARG B 159 -4.867 0.603 19.962 1.00 5.04 H new ATOM 2557 N LYS B 160 -8.805 -5.650 15.209 1.00 0.89 N ATOM 2558 CA LYS B 160 -8.287 -6.955 15.652 1.00 0.94 C ATOM 2559 C LYS B 160 -7.279 -7.542 14.661 1.00 0.83 C ATOM 2560 O LYS B 160 -6.263 -8.086 15.080 1.00 0.81 O ATOM 2561 CB LYS B 160 -9.443 -7.945 15.807 1.00 1.18 C ATOM 2562 CG LYS B 160 -10.458 -7.584 16.891 1.00 1.37 C ATOM 2563 CD LYS B 160 -9.985 -7.755 18.347 1.00 1.38 C ATOM 2564 CE LYS B 160 -9.579 -9.195 18.697 1.00 2.46 C ATOM 2565 NZ LYS B 160 -9.185 -9.326 20.124 1.00 3.14 N ATOM 0 H LYS B 160 -9.813 -5.626 15.055 1.00 0.89 H new ATOM 0 HA LYS B 160 -7.782 -6.793 16.604 1.00 0.94 H new ATOM 0 HB2 LYS B 160 -9.965 -8.024 14.853 1.00 1.18 H new ATOM 0 HB3 LYS B 160 -9.032 -8.930 16.028 1.00 1.18 H new ATOM 0 HG2 LYS B 160 -10.758 -6.546 16.748 1.00 1.37 H new ATOM 0 HG3 LYS B 160 -11.348 -8.196 16.745 1.00 1.37 H new ATOM 0 HD2 LYS B 160 -9.137 -7.094 18.525 1.00 1.38 H new ATOM 0 HD3 LYS B 160 -10.783 -7.438 19.019 1.00 1.38 H new ATOM 0 HE2 LYS B 160 -10.410 -9.868 18.486 1.00 2.46 H new ATOM 0 HE3 LYS B 160 -8.749 -9.503 18.061 1.00 2.46 H new ATOM 0 HZ1 LYS B 160 -8.918 -10.312 20.321 1.00 3.14 H new ATOM 0 HZ2 LYS B 160 -8.376 -8.702 20.319 1.00 3.14 H new ATOM 0 HZ3 LYS B 160 -9.985 -9.056 20.731 1.00 3.14 H new ATOM 2579 N ALA B 161 -7.572 -7.442 13.361 1.00 0.85 N ATOM 2580 CA ALA B 161 -6.701 -7.941 12.286 1.00 0.86 C ATOM 2581 C ALA B 161 -5.292 -7.325 12.301 1.00 0.94 C ATOM 2582 O ALA B 161 -4.333 -8.064 12.083 1.00 1.23 O ATOM 2583 CB ALA B 161 -7.388 -7.744 10.929 1.00 0.87 C ATOM 0 H ALA B 161 -8.429 -7.008 13.019 1.00 0.85 H new ATOM 0 HA ALA B 161 -6.549 -9.006 12.463 1.00 0.86 H new ATOM 0 HB1 ALA B 161 -6.739 -8.115 10.136 1.00 0.87 H new ATOM 0 HB2 ALA B 161 -8.329 -8.293 10.915 1.00 0.87 H new ATOM 0 HB3 ALA B 161 -7.584 -6.684 10.771 1.00 0.87 H new ATOM 2589 N ALA B 162 -5.185 -6.030 12.628 1.00 0.86 N ATOM 2590 CA ALA B 162 -3.919 -5.319 12.831 1.00 0.87 C ATOM 2591 C ALA B 162 -3.048 -5.952 13.928 1.00 0.96 C ATOM 2592 O ALA B 162 -1.851 -6.157 13.736 1.00 0.93 O ATOM 2593 CB ALA B 162 -4.240 -3.860 13.198 1.00 0.88 C ATOM 0 H ALA B 162 -6.001 -5.433 12.762 1.00 0.86 H new ATOM 0 HA ALA B 162 -3.345 -5.378 11.906 1.00 0.87 H new ATOM 0 HB1 ALA B 162 -3.311 -3.311 13.354 1.00 0.88 H new ATOM 0 HB2 ALA B 162 -4.804 -3.397 12.388 1.00 0.88 H new ATOM 0 HB3 ALA B 162 -4.833 -3.837 14.112 1.00 0.88 H new ATOM 2599 N ASP B 163 -3.631 -6.266 15.087 1.00 1.08 N ATOM 2600 CA ASP B 163 -2.869 -6.754 16.244 1.00 1.17 C ATOM 2601 C ASP B 163 -2.373 -8.205 16.068 1.00 1.20 C ATOM 2602 O ASP B 163 -1.332 -8.560 16.619 1.00 1.28 O ATOM 2603 CB ASP B 163 -3.698 -6.565 17.533 1.00 1.16 C ATOM 2604 CG ASP B 163 -2.963 -5.691 18.557 1.00 1.97 C ATOM 2605 OD1 ASP B 163 -2.742 -4.496 18.266 1.00 2.21 O ATOM 2606 OD2 ASP B 163 -2.615 -6.175 19.655 1.00 3.40 O ATOM 0 H ASP B 163 -4.635 -6.191 15.252 1.00 1.08 H new ATOM 0 HA ASP B 163 -1.962 -6.155 16.327 1.00 1.17 H new ATOM 0 HB2 ASP B 163 -4.656 -6.108 17.286 1.00 1.16 H new ATOM 0 HB3 ASP B 163 -3.913 -7.539 17.973 1.00 1.16 H new ATOM 2611 N LYS B 164 -3.029 -9.009 15.212 1.00 1.17 N ATOM 2612 CA LYS B 164 -2.466 -10.278 14.709 1.00 1.25 C ATOM 2613 C LYS B 164 -1.093 -10.082 14.066 1.00 1.18 C ATOM 2614 O LYS B 164 -0.219 -10.943 14.147 1.00 1.26 O ATOM 2615 CB LYS B 164 -3.363 -10.891 13.621 1.00 1.30 C ATOM 2616 CG LYS B 164 -4.828 -10.963 14.016 1.00 1.67 C ATOM 2617 CD LYS B 164 -5.619 -11.957 13.154 1.00 1.99 C ATOM 2618 CE LYS B 164 -5.443 -11.661 11.652 1.00 2.02 C ATOM 2619 NZ LYS B 164 -6.259 -12.563 10.804 1.00 3.02 N ATOM 0 H LYS B 164 -3.960 -8.800 14.850 1.00 1.17 H new ATOM 0 HA LYS B 164 -2.392 -10.929 15.580 1.00 1.25 H new ATOM 0 HB2 LYS B 164 -3.269 -10.302 12.709 1.00 1.30 H new ATOM 0 HB3 LYS B 164 -3.007 -11.895 13.390 1.00 1.30 H new ATOM 0 HG2 LYS B 164 -4.905 -11.254 15.064 1.00 1.67 H new ATOM 0 HG3 LYS B 164 -5.275 -9.973 13.926 1.00 1.67 H new ATOM 0 HD2 LYS B 164 -5.286 -12.972 13.368 1.00 1.99 H new ATOM 0 HD3 LYS B 164 -6.676 -11.907 13.415 1.00 1.99 H new ATOM 0 HE2 LYS B 164 -5.722 -10.626 11.452 1.00 2.02 H new ATOM 0 HE3 LYS B 164 -4.392 -11.765 11.384 1.00 2.02 H new ATOM 0 HZ1 LYS B 164 -6.109 -12.328 9.802 1.00 3.02 H new ATOM 0 HZ2 LYS B 164 -5.976 -13.549 10.974 1.00 3.02 H new ATOM 0 HZ3 LYS B 164 -7.265 -12.446 11.040 1.00 3.02 H new ATOM 2633 N LEU B 165 -0.937 -8.952 13.380 1.00 1.04 N ATOM 2634 CA LEU B 165 0.325 -8.558 12.754 1.00 0.91 C ATOM 2635 C LEU B 165 1.328 -8.101 13.805 1.00 0.88 C ATOM 2636 O LEU B 165 2.467 -8.536 13.757 1.00 0.90 O ATOM 2637 CB LEU B 165 0.163 -7.446 11.712 1.00 0.81 C ATOM 2638 CG LEU B 165 -1.085 -7.464 10.820 1.00 0.75 C ATOM 2639 CD1 LEU B 165 -0.989 -6.243 9.903 1.00 0.69 C ATOM 2640 CD2 LEU B 165 -1.225 -8.764 10.014 1.00 0.85 C ATOM 0 H LEU B 165 -1.689 -8.277 13.241 1.00 1.04 H new ATOM 0 HA LEU B 165 0.689 -9.447 12.239 1.00 0.91 H new ATOM 0 HB2 LEU B 165 0.182 -6.492 12.238 1.00 0.81 H new ATOM 0 HB3 LEU B 165 1.037 -7.469 11.062 1.00 0.81 H new ATOM 0 HG LEU B 165 -1.981 -7.422 11.439 1.00 0.75 H new ATOM 0 HD11 LEU B 165 -1.858 -6.212 9.246 1.00 0.69 H new ATOM 0 HD12 LEU B 165 -0.958 -5.336 10.507 1.00 0.69 H new ATOM 0 HD13 LEU B 165 -0.082 -6.310 9.302 1.00 0.69 H new ATOM 0 HD21 LEU B 165 -2.126 -8.718 9.402 1.00 0.85 H new ATOM 0 HD22 LEU B 165 -0.355 -8.888 9.369 1.00 0.85 H new ATOM 0 HD23 LEU B 165 -1.294 -9.610 10.698 1.00 0.85 H new ATOM 2652 N ILE B 166 0.919 -7.259 14.759 1.00 0.87 N ATOM 2653 CA ILE B 166 1.844 -6.686 15.752 1.00 0.89 C ATOM 2654 C ILE B 166 2.524 -7.770 16.596 1.00 0.90 C ATOM 2655 O ILE B 166 3.733 -7.696 16.793 1.00 0.85 O ATOM 2656 CB ILE B 166 1.125 -5.634 16.631 1.00 0.89 C ATOM 2657 CG1 ILE B 166 0.412 -4.511 15.833 1.00 0.94 C ATOM 2658 CG2 ILE B 166 2.148 -5.005 17.591 1.00 0.99 C ATOM 2659 CD1 ILE B 166 1.136 -4.002 14.595 1.00 1.26 C ATOM 0 H ILE B 166 -0.049 -6.956 14.868 1.00 0.87 H new ATOM 0 HA ILE B 166 2.639 -6.176 15.208 1.00 0.89 H new ATOM 0 HB ILE B 166 0.339 -6.166 17.168 1.00 0.89 H new ATOM 0 HG12 ILE B 166 -0.569 -4.876 15.530 1.00 0.94 H new ATOM 0 HG13 ILE B 166 0.245 -3.668 16.503 1.00 0.94 H new ATOM 0 HG21 ILE B 166 1.652 -4.262 18.215 1.00 0.99 H new ATOM 0 HG22 ILE B 166 2.579 -5.781 18.223 1.00 0.99 H new ATOM 0 HG23 ILE B 166 2.940 -4.525 17.016 1.00 0.99 H new ATOM 0 HD11 ILE B 166 0.542 -3.220 14.122 1.00 1.26 H new ATOM 0 HD12 ILE B 166 2.106 -3.597 14.882 1.00 1.26 H new ATOM 0 HD13 ILE B 166 1.279 -4.824 13.894 1.00 1.26 H new ATOM 2671 N GLN B 167 1.781 -8.784 17.038 1.00 0.99 N ATOM 2672 CA GLN B 167 2.302 -9.925 17.813 1.00 1.06 C ATOM 2673 C GLN B 167 3.218 -10.848 16.992 1.00 1.09 C ATOM 2674 O GLN B 167 4.218 -11.351 17.487 1.00 1.18 O ATOM 2675 CB GLN B 167 1.100 -10.677 18.416 1.00 1.14 C ATOM 2676 CG GLN B 167 0.254 -11.444 17.389 1.00 1.25 C ATOM 2677 CD GLN B 167 -1.087 -11.992 17.882 1.00 1.38 C ATOM 2678 OE1 GLN B 167 -1.726 -12.802 17.229 1.00 1.94 O ATOM 2679 NE2 GLN B 167 -1.618 -11.565 19.007 1.00 1.98 N ATOM 0 H GLN B 167 0.777 -8.843 16.867 1.00 0.99 H new ATOM 0 HA GLN B 167 2.944 -9.550 18.610 1.00 1.06 H new ATOM 0 HB2 GLN B 167 1.465 -11.379 19.166 1.00 1.14 H new ATOM 0 HB3 GLN B 167 0.461 -9.961 18.934 1.00 1.14 H new ATOM 0 HG2 GLN B 167 0.062 -10.784 16.543 1.00 1.25 H new ATOM 0 HG3 GLN B 167 0.846 -12.279 17.014 1.00 1.25 H new ATOM 0 HE21 GLN B 167 -1.117 -10.888 19.583 1.00 1.98 H new ATOM 0 HE22 GLN B 167 -2.531 -11.911 19.304 1.00 1.98 H new ATOM 2688 N ASN B 168 2.889 -11.032 15.717 1.00 1.07 N ATOM 2689 CA ASN B 168 3.688 -11.776 14.741 1.00 1.13 C ATOM 2690 C ASN B 168 4.983 -11.019 14.372 1.00 1.13 C ATOM 2691 O ASN B 168 6.052 -11.612 14.235 1.00 1.14 O ATOM 2692 CB ASN B 168 2.737 -12.010 13.553 1.00 1.11 C ATOM 2693 CG ASN B 168 3.285 -12.797 12.376 1.00 1.87 C ATOM 2694 OD1 ASN B 168 4.405 -13.272 12.347 1.00 2.51 O ATOM 2695 ND2 ASN B 168 2.478 -12.940 11.343 1.00 2.84 N ATOM 0 H ASN B 168 2.029 -10.655 15.318 1.00 1.07 H new ATOM 0 HA ASN B 168 4.053 -12.727 15.128 1.00 1.13 H new ATOM 0 HB2 ASN B 168 1.852 -12.528 13.924 1.00 1.11 H new ATOM 0 HB3 ASN B 168 2.407 -11.038 13.186 1.00 1.11 H new ATOM 0 HD21 ASN B 168 2.792 -13.450 10.517 1.00 2.84 H new ATOM 0 HD22 ASN B 168 1.540 -12.541 11.370 1.00 2.84 H new ATOM 2702 N LEU B 169 4.914 -9.688 14.269 1.00 1.15 N ATOM 2703 CA LEU B 169 6.047 -8.820 13.962 1.00 1.16 C ATOM 2704 C LEU B 169 6.984 -8.673 15.165 1.00 1.22 C ATOM 2705 O LEU B 169 8.190 -8.521 14.962 1.00 1.34 O ATOM 2706 CB LEU B 169 5.477 -7.455 13.540 1.00 1.08 C ATOM 2707 CG LEU B 169 6.523 -6.510 12.923 1.00 1.08 C ATOM 2708 CD1 LEU B 169 6.722 -6.814 11.434 1.00 1.80 C ATOM 2709 CD2 LEU B 169 6.068 -5.070 13.128 1.00 2.58 C ATOM 0 H LEU B 169 4.043 -9.174 14.401 1.00 1.15 H new ATOM 0 HA LEU B 169 6.643 -9.253 13.159 1.00 1.16 H new ATOM 0 HB2 LEU B 169 4.674 -7.614 12.820 1.00 1.08 H new ATOM 0 HB3 LEU B 169 5.033 -6.972 14.411 1.00 1.08 H new ATOM 0 HG LEU B 169 7.483 -6.660 13.416 1.00 1.08 H new ATOM 0 HD11 LEU B 169 7.466 -6.133 11.020 1.00 1.80 H new ATOM 0 HD12 LEU B 169 7.065 -7.842 11.315 1.00 1.80 H new ATOM 0 HD13 LEU B 169 5.777 -6.683 10.907 1.00 1.80 H new ATOM 0 HD21 LEU B 169 6.802 -4.391 12.694 1.00 2.58 H new ATOM 0 HD22 LEU B 169 5.104 -4.920 12.642 1.00 2.58 H new ATOM 0 HD23 LEU B 169 5.972 -4.867 14.195 1.00 2.58 H new ATOM 2721 N ASP B 170 6.432 -8.705 16.384 1.00 1.26 N ATOM 2722 CA ASP B 170 7.123 -8.439 17.642 1.00 1.33 C ATOM 2723 C ASP B 170 8.464 -9.164 17.746 1.00 1.53 C ATOM 2724 O ASP B 170 9.499 -8.510 17.895 1.00 2.03 O ATOM 2725 CB ASP B 170 6.225 -8.784 18.845 1.00 1.74 C ATOM 2726 CG ASP B 170 6.909 -8.439 20.174 1.00 2.54 C ATOM 2727 OD1 ASP B 170 7.235 -7.241 20.348 1.00 2.67 O ATOM 2728 OD2 ASP B 170 7.132 -9.358 20.984 1.00 4.03 O ATOM 0 H ASP B 170 5.446 -8.928 16.522 1.00 1.26 H new ATOM 0 HA ASP B 170 7.340 -7.371 17.657 1.00 1.33 H new ATOM 0 HB2 ASP B 170 5.284 -8.239 18.766 1.00 1.74 H new ATOM 0 HB3 ASP B 170 5.981 -9.846 18.825 1.00 1.74 H new ATOM 2733 N ALA B 171 8.426 -10.485 17.563 1.00 1.58 N ATOM 2734 CA ALA B 171 9.561 -11.404 17.643 1.00 1.94 C ATOM 2735 C ALA B 171 10.698 -11.158 16.625 1.00 1.93 C ATOM 2736 O ALA B 171 11.706 -11.858 16.682 1.00 2.27 O ATOM 2737 CB ALA B 171 8.987 -12.819 17.501 1.00 2.25 C ATOM 0 H ALA B 171 7.555 -10.968 17.343 1.00 1.58 H new ATOM 0 HA ALA B 171 10.054 -11.243 18.602 1.00 1.94 H new ATOM 0 HB1 ALA B 171 9.796 -13.547 17.554 1.00 2.25 H new ATOM 0 HB2 ALA B 171 8.277 -13.006 18.307 1.00 2.25 H new ATOM 0 HB3 ALA B 171 8.479 -12.911 16.541 1.00 2.25 H new ATOM 2743 N ASN B 172 10.541 -10.214 15.690 1.00 1.64 N ATOM 2744 CA ASN B 172 11.505 -9.937 14.616 1.00 1.79 C ATOM 2745 C ASN B 172 12.034 -8.486 14.625 1.00 1.60 C ATOM 2746 O ASN B 172 12.826 -8.123 13.758 1.00 2.04 O ATOM 2747 CB ASN B 172 10.841 -10.227 13.255 1.00 1.97 C ATOM 2748 CG ASN B 172 10.157 -11.584 13.158 1.00 1.84 C ATOM 2749 OD1 ASN B 172 10.742 -12.577 12.752 1.00 2.27 O ATOM 2750 ND2 ASN B 172 8.875 -11.629 13.476 1.00 1.74 N ATOM 0 H ASN B 172 9.722 -9.607 15.657 1.00 1.64 H new ATOM 0 HA ASN B 172 12.364 -10.587 14.785 1.00 1.79 H new ATOM 0 HB2 ASN B 172 10.105 -9.449 13.052 1.00 1.97 H new ATOM 0 HB3 ASN B 172 11.599 -10.161 12.475 1.00 1.97 H new ATOM 0 HD21 ASN B 172 8.357 -12.503 13.384 1.00 1.74 H new ATOM 0 HD22 ASN B 172 8.403 -10.790 13.813 1.00 1.74 H new ATOM 2757 N HIS B 173 11.556 -7.618 15.527 1.00 1.29 N ATOM 2758 CA HIS B 173 11.794 -6.163 15.460 1.00 1.25 C ATOM 2759 C HIS B 173 12.136 -5.568 16.846 1.00 1.27 C ATOM 2760 O HIS B 173 11.260 -5.101 17.582 1.00 1.46 O ATOM 2761 CB HIS B 173 10.575 -5.469 14.814 1.00 1.28 C ATOM 2762 CG HIS B 173 10.443 -5.693 13.325 1.00 1.85 C ATOM 2763 ND1 HIS B 173 10.013 -6.845 12.713 1.00 2.76 N ATOM 2764 CD2 HIS B 173 10.714 -4.797 12.325 1.00 2.72 C ATOM 2765 CE1 HIS B 173 10.067 -6.667 11.384 1.00 3.61 C ATOM 2766 NE2 HIS B 173 10.472 -5.424 11.097 1.00 3.60 N ATOM 0 H HIS B 173 10.991 -7.902 16.327 1.00 1.29 H new ATOM 0 HA HIS B 173 12.667 -5.981 14.834 1.00 1.25 H new ATOM 0 HB2 HIS B 173 9.669 -5.825 15.304 1.00 1.28 H new ATOM 0 HB3 HIS B 173 10.640 -4.398 15.003 1.00 1.28 H new ATOM 0 HD2 HIS B 173 11.056 -3.781 12.461 1.00 2.72 H new ATOM 0 HE1 HIS B 173 9.819 -7.420 10.650 1.00 3.61 H new ATOM 0 HE2 HIS B 173 10.582 -5.015 10.169 1.00 3.60 H new ATOM 2774 N ASP B 174 13.427 -5.545 17.183 1.00 1.55 N ATOM 2775 CA ASP B 174 14.030 -5.289 18.510 1.00 1.87 C ATOM 2776 C ASP B 174 14.004 -3.804 18.954 1.00 1.95 C ATOM 2777 O ASP B 174 14.952 -3.303 19.570 1.00 2.80 O ATOM 2778 CB ASP B 174 15.498 -5.783 18.500 1.00 2.45 C ATOM 2779 CG ASP B 174 15.797 -7.032 17.666 1.00 3.54 C ATOM 2780 OD1 ASP B 174 15.653 -6.913 16.425 1.00 4.35 O ATOM 2781 OD2 ASP B 174 16.251 -8.030 18.261 1.00 4.75 O ATOM 0 H ASP B 174 14.146 -5.719 16.481 1.00 1.55 H new ATOM 0 HA ASP B 174 13.419 -5.833 19.230 1.00 1.87 H new ATOM 0 HB2 ASP B 174 16.128 -4.971 18.135 1.00 2.45 H new ATOM 0 HB3 ASP B 174 15.797 -5.981 19.529 1.00 2.45 H new ATOM 2786 N GLY B 175 13.011 -3.033 18.504 1.00 1.88 N ATOM 2787 CA GLY B 175 13.200 -1.591 18.292 1.00 2.16 C ATOM 2788 C GLY B 175 14.037 -1.337 17.032 1.00 2.08 C ATOM 2789 O GLY B 175 14.847 -0.411 16.978 1.00 2.57 O ATOM 0 H GLY B 175 12.077 -3.376 18.281 1.00 1.88 H new ATOM 0 HA2 GLY B 175 12.231 -1.102 18.196 1.00 2.16 H new ATOM 0 HA3 GLY B 175 13.695 -1.152 19.159 1.00 2.16 H new ATOM 2793 N ARG B 176 13.897 -2.217 16.038 1.00 1.89 N ATOM 2794 CA ARG B 176 14.261 -2.003 14.632 1.00 1.88 C ATOM 2795 C ARG B 176 12.963 -1.742 13.857 1.00 1.75 C ATOM 2796 O ARG B 176 11.908 -2.207 14.282 1.00 2.20 O ATOM 2797 CB ARG B 176 15.004 -3.223 14.053 1.00 2.12 C ATOM 2798 CG ARG B 176 16.136 -3.759 14.935 1.00 2.70 C ATOM 2799 CD ARG B 176 17.306 -2.780 15.064 1.00 2.93 C ATOM 2800 NE ARG B 176 18.228 -3.235 16.125 1.00 3.80 N ATOM 2801 CZ ARG B 176 17.981 -3.152 17.430 1.00 4.78 C ATOM 2802 NH1 ARG B 176 17.072 -2.330 17.909 1.00 5.26 N ATOM 2803 NH2 ARG B 176 18.617 -3.934 18.276 1.00 5.91 N ATOM 0 H ARG B 176 13.507 -3.146 16.198 1.00 1.89 H new ATOM 0 HA ARG B 176 14.939 -1.154 14.547 1.00 1.88 H new ATOM 0 HB2 ARG B 176 14.284 -4.023 13.883 1.00 2.12 H new ATOM 0 HB3 ARG B 176 15.416 -2.953 13.081 1.00 2.12 H new ATOM 0 HG2 ARG B 176 15.743 -3.980 15.927 1.00 2.70 H new ATOM 0 HG3 ARG B 176 16.499 -4.699 14.519 1.00 2.70 H new ATOM 0 HD2 ARG B 176 17.837 -2.708 14.115 1.00 2.93 H new ATOM 0 HD3 ARG B 176 16.933 -1.783 15.297 1.00 2.93 H new ATOM 0 HE ARG B 176 19.118 -3.642 15.837 1.00 3.80 H new ATOM 0 HH11 ARG B 176 16.537 -1.736 17.275 1.00 5.26 H new ATOM 0 HH12 ARG B 176 16.903 -2.286 18.914 1.00 5.26 H new ATOM 0 HH21 ARG B 176 19.302 -4.607 17.932 1.00 5.91 H new ATOM 0 HH22 ARG B 176 18.425 -3.867 19.276 1.00 5.91 H new ATOM 2817 N ILE B 177 13.053 -0.978 12.772 1.00 1.50 N ATOM 2818 CA ILE B 177 11.947 -0.455 11.957 1.00 1.29 C ATOM 2819 C ILE B 177 12.431 -0.457 10.505 1.00 1.14 C ATOM 2820 O ILE B 177 13.591 -0.103 10.258 1.00 1.38 O ATOM 2821 CB ILE B 177 11.585 0.997 12.382 1.00 1.67 C ATOM 2822 CG1 ILE B 177 11.242 1.172 13.882 1.00 1.87 C ATOM 2823 CG2 ILE B 177 10.446 1.576 11.519 1.00 1.89 C ATOM 2824 CD1 ILE B 177 9.959 0.474 14.354 1.00 2.24 C ATOM 0 H ILE B 177 13.960 -0.685 12.409 1.00 1.50 H new ATOM 0 HA ILE B 177 11.056 -1.069 12.086 1.00 1.29 H new ATOM 0 HB ILE B 177 12.503 1.559 12.211 1.00 1.67 H new ATOM 0 HG12 ILE B 177 12.077 0.797 14.474 1.00 1.87 H new ATOM 0 HG13 ILE B 177 11.154 2.237 14.094 1.00 1.87 H new ATOM 0 HG21 ILE B 177 10.222 2.591 11.846 1.00 1.89 H new ATOM 0 HG22 ILE B 177 10.753 1.591 10.473 1.00 1.89 H new ATOM 0 HG23 ILE B 177 9.556 0.955 11.627 1.00 1.89 H new ATOM 0 HD11 ILE B 177 9.814 0.661 15.418 1.00 2.24 H new ATOM 0 HD12 ILE B 177 9.107 0.864 13.797 1.00 2.24 H new ATOM 0 HD13 ILE B 177 10.044 -0.599 14.182 1.00 2.24 H new ATOM 2836 N SER B 178 11.569 -0.808 9.555 1.00 0.99 N ATOM 2837 CA SER B 178 11.854 -0.666 8.120 1.00 0.91 C ATOM 2838 C SER B 178 10.852 0.259 7.408 1.00 0.85 C ATOM 2839 O SER B 178 9.855 0.692 7.978 1.00 1.19 O ATOM 2840 CB SER B 178 11.932 -2.031 7.423 1.00 1.01 C ATOM 2841 OG SER B 178 12.634 -1.890 6.194 1.00 1.97 O ATOM 0 H SER B 178 10.649 -1.201 9.753 1.00 0.99 H new ATOM 0 HA SER B 178 12.833 -0.192 8.047 1.00 0.91 H new ATOM 0 HB2 SER B 178 12.439 -2.752 8.065 1.00 1.01 H new ATOM 0 HB3 SER B 178 10.929 -2.417 7.240 1.00 1.01 H new ATOM 0 HG SER B 178 12.264 -2.511 5.533 1.00 1.97 H new ATOM 2847 N PHE B 179 11.133 0.591 6.145 1.00 0.75 N ATOM 2848 CA PHE B 179 10.273 1.423 5.307 1.00 0.75 C ATOM 2849 C PHE B 179 9.069 0.642 4.747 1.00 0.87 C ATOM 2850 O PHE B 179 7.928 1.101 4.767 1.00 1.06 O ATOM 2851 CB PHE B 179 11.131 1.987 4.172 1.00 0.78 C ATOM 2852 CG PHE B 179 10.296 2.825 3.238 1.00 0.92 C ATOM 2853 CD1 PHE B 179 9.823 4.075 3.673 1.00 2.30 C ATOM 2854 CD2 PHE B 179 9.853 2.293 2.015 1.00 1.92 C ATOM 2855 CE1 PHE B 179 8.896 4.787 2.902 1.00 2.43 C ATOM 2856 CE2 PHE B 179 8.946 3.024 1.233 1.00 2.04 C ATOM 2857 CZ PHE B 179 8.470 4.267 1.673 1.00 1.40 C ATOM 0 H PHE B 179 11.981 0.282 5.670 1.00 0.75 H new ATOM 0 HA PHE B 179 9.855 2.228 5.911 1.00 0.75 H new ATOM 0 HB2 PHE B 179 11.939 2.590 4.586 1.00 0.78 H new ATOM 0 HB3 PHE B 179 11.594 1.170 3.619 1.00 0.78 H new ATOM 0 HD1 PHE B 179 10.176 4.488 4.606 1.00 2.30 H new ATOM 0 HD2 PHE B 179 10.208 1.330 1.680 1.00 1.92 H new ATOM 0 HE1 PHE B 179 8.511 5.733 3.253 1.00 2.43 H new ATOM 0 HE2 PHE B 179 8.612 2.626 0.286 1.00 2.04 H new ATOM 0 HZ PHE B 179 7.774 4.824 1.064 1.00 1.40 H new ATOM 2867 N ASP B 180 9.355 -0.551 4.229 1.00 0.86 N ATOM 2868 CA ASP B 180 8.406 -1.490 3.634 1.00 1.04 C ATOM 2869 C ASP B 180 7.481 -2.154 4.668 1.00 1.02 C ATOM 2870 O ASP B 180 6.371 -2.548 4.306 1.00 1.16 O ATOM 2871 CB ASP B 180 9.211 -2.543 2.853 1.00 1.18 C ATOM 2872 CG ASP B 180 10.200 -3.327 3.732 1.00 1.64 C ATOM 2873 OD1 ASP B 180 11.134 -2.679 4.271 1.00 2.60 O ATOM 2874 OD2 ASP B 180 10.025 -4.554 3.862 1.00 2.78 O ATOM 0 H ASP B 180 10.310 -0.909 4.212 1.00 0.86 H new ATOM 0 HA ASP B 180 7.741 -0.939 2.969 1.00 1.04 H new ATOM 0 HB2 ASP B 180 8.520 -3.243 2.382 1.00 1.18 H new ATOM 0 HB3 ASP B 180 9.760 -2.049 2.051 1.00 1.18 H new ATOM 2879 N GLU B 181 7.920 -2.210 5.934 1.00 0.91 N ATOM 2880 CA GLU B 181 7.187 -2.710 7.104 1.00 0.86 C ATOM 2881 C GLU B 181 5.777 -2.108 7.170 1.00 0.75 C ATOM 2882 O GLU B 181 4.777 -2.818 7.073 1.00 0.76 O ATOM 2883 CB GLU B 181 7.992 -2.374 8.369 1.00 1.01 C ATOM 2884 CG GLU B 181 7.349 -2.800 9.703 1.00 1.82 C ATOM 2885 CD GLU B 181 8.014 -2.132 10.912 1.00 2.36 C ATOM 2886 OE1 GLU B 181 9.229 -1.827 10.826 1.00 3.18 O ATOM 2887 OE2 GLU B 181 7.303 -1.892 11.917 1.00 3.11 O ATOM 0 H GLU B 181 8.855 -1.887 6.183 1.00 0.91 H new ATOM 0 HA GLU B 181 7.069 -3.791 7.025 1.00 0.86 H new ATOM 0 HB2 GLU B 181 8.971 -2.847 8.291 1.00 1.01 H new ATOM 0 HB3 GLU B 181 8.160 -1.297 8.395 1.00 1.01 H new ATOM 0 HG2 GLU B 181 6.289 -2.547 9.689 1.00 1.82 H new ATOM 0 HG3 GLU B 181 7.417 -3.883 9.807 1.00 1.82 H new ATOM 2894 N TYR B 182 5.678 -0.781 7.270 1.00 0.71 N ATOM 2895 CA TYR B 182 4.384 -0.104 7.355 1.00 0.62 C ATOM 2896 C TYR B 182 3.492 -0.438 6.153 1.00 0.66 C ATOM 2897 O TYR B 182 2.322 -0.782 6.328 1.00 0.61 O ATOM 2898 CB TYR B 182 4.637 1.398 7.477 1.00 0.65 C ATOM 2899 CG TYR B 182 3.438 2.287 7.209 1.00 0.71 C ATOM 2900 CD1 TYR B 182 2.451 2.470 8.197 1.00 1.82 C ATOM 2901 CD2 TYR B 182 3.338 2.966 5.979 1.00 1.67 C ATOM 2902 CE1 TYR B 182 1.394 3.372 7.976 1.00 1.95 C ATOM 2903 CE2 TYR B 182 2.288 3.877 5.759 1.00 1.72 C ATOM 2904 CZ TYR B 182 1.334 4.109 6.774 1.00 1.08 C ATOM 2905 OH TYR B 182 0.390 5.075 6.618 1.00 1.38 O ATOM 0 H TYR B 182 6.481 -0.153 7.294 1.00 0.71 H new ATOM 0 HA TYR B 182 3.843 -0.453 8.235 1.00 0.62 H new ATOM 0 HB2 TYR B 182 5.004 1.606 8.482 1.00 0.65 H new ATOM 0 HB3 TYR B 182 5.432 1.672 6.784 1.00 0.65 H new ATOM 0 HD1 TYR B 182 2.505 1.918 9.124 1.00 1.82 H new ATOM 0 HD2 TYR B 182 4.068 2.787 5.204 1.00 1.67 H new ATOM 0 HE1 TYR B 182 0.628 3.500 8.727 1.00 1.95 H new ATOM 0 HE2 TYR B 182 2.212 4.398 4.816 1.00 1.72 H new ATOM 0 HH TYR B 182 0.487 5.487 5.734 1.00 1.38 H new ATOM 2915 N TRP B 183 4.048 -0.382 4.939 1.00 0.78 N ATOM 2916 CA TRP B 183 3.314 -0.648 3.708 1.00 0.86 C ATOM 2917 C TRP B 183 2.765 -2.082 3.652 1.00 0.89 C ATOM 2918 O TRP B 183 1.586 -2.258 3.331 1.00 0.91 O ATOM 2919 CB TRP B 183 4.224 -0.338 2.510 1.00 0.96 C ATOM 2920 CG TRP B 183 3.487 -0.373 1.219 1.00 0.99 C ATOM 2921 CD1 TRP B 183 3.125 -1.495 0.568 1.00 1.01 C ATOM 2922 CD2 TRP B 183 2.915 0.739 0.466 1.00 1.00 C ATOM 2923 NE1 TRP B 183 2.294 -1.165 -0.475 1.00 1.03 N ATOM 2924 CE2 TRP B 183 2.081 0.195 -0.553 1.00 1.03 C ATOM 2925 CE3 TRP B 183 2.992 2.147 0.556 1.00 1.01 C ATOM 2926 CZ2 TRP B 183 1.290 1.003 -1.379 1.00 1.06 C ATOM 2927 CZ3 TRP B 183 2.258 2.969 -0.322 1.00 1.06 C ATOM 2928 CH2 TRP B 183 1.391 2.397 -1.270 1.00 1.06 C ATOM 0 H TRP B 183 5.029 -0.148 4.787 1.00 0.78 H new ATOM 0 HA TRP B 183 2.440 0.002 3.675 1.00 0.86 H new ATOM 0 HB2 TRP B 183 4.674 0.646 2.643 1.00 0.96 H new ATOM 0 HB3 TRP B 183 5.040 -1.060 2.480 1.00 0.96 H new ATOM 0 HD1 TRP B 183 3.438 -2.496 0.825 1.00 1.01 H new ATOM 0 HE1 TRP B 183 1.884 -1.845 -1.115 1.00 1.03 H new ATOM 0 HE3 TRP B 183 3.622 2.599 1.308 1.00 1.01 H new ATOM 0 HZ2 TRP B 183 0.611 0.558 -2.091 1.00 1.06 H new ATOM 0 HZ3 TRP B 183 2.362 4.043 -0.267 1.00 1.06 H new ATOM 0 HH2 TRP B 183 0.802 3.032 -1.915 1.00 1.06 H new ATOM 2939 N THR B 184 3.574 -3.097 3.988 1.00 0.91 N ATOM 2940 CA THR B 184 3.138 -4.502 4.018 1.00 1.00 C ATOM 2941 C THR B 184 2.149 -4.753 5.159 1.00 0.89 C ATOM 2942 O THR B 184 1.143 -5.421 4.937 1.00 1.04 O ATOM 2943 CB THR B 184 4.350 -5.450 3.995 1.00 1.20 C ATOM 2944 OG1 THR B 184 3.911 -6.745 3.683 1.00 1.76 O ATOM 2945 CG2 THR B 184 5.119 -5.580 5.307 1.00 1.50 C ATOM 0 H THR B 184 4.552 -2.967 4.247 1.00 0.91 H new ATOM 0 HA THR B 184 2.578 -4.726 3.110 1.00 1.00 H new ATOM 0 HB THR B 184 5.023 -5.008 3.260 1.00 1.20 H new ATOM 0 HG1 THR B 184 3.911 -6.865 2.710 1.00 1.76 H new ATOM 0 HG21 THR B 184 5.951 -6.272 5.174 1.00 1.50 H new ATOM 0 HG22 THR B 184 5.503 -4.603 5.602 1.00 1.50 H new ATOM 0 HG23 THR B 184 4.453 -5.957 6.083 1.00 1.50 H new ATOM 2953 N LEU B 185 2.316 -4.118 6.328 1.00 0.72 N ATOM 2954 CA LEU B 185 1.341 -4.211 7.424 1.00 0.62 C ATOM 2955 C LEU B 185 -0.048 -3.675 7.048 1.00 0.55 C ATOM 2956 O LEU B 185 -1.034 -4.265 7.483 1.00 0.53 O ATOM 2957 CB LEU B 185 1.847 -3.471 8.672 1.00 0.57 C ATOM 2958 CG LEU B 185 3.018 -4.104 9.452 1.00 0.65 C ATOM 2959 CD1 LEU B 185 3.444 -3.115 10.543 1.00 0.68 C ATOM 2960 CD2 LEU B 185 2.624 -5.421 10.134 1.00 0.69 C ATOM 0 H LEU B 185 3.123 -3.531 6.539 1.00 0.72 H new ATOM 0 HA LEU B 185 1.236 -5.275 7.636 1.00 0.62 H new ATOM 0 HB2 LEU B 185 2.148 -2.468 8.369 1.00 0.57 H new ATOM 0 HB3 LEU B 185 1.008 -3.358 9.359 1.00 0.57 H new ATOM 0 HG LEU B 185 3.820 -4.318 8.745 1.00 0.65 H new ATOM 0 HD11 LEU B 185 4.272 -3.536 11.113 1.00 0.68 H new ATOM 0 HD12 LEU B 185 3.759 -2.179 10.082 1.00 0.68 H new ATOM 0 HD13 LEU B 185 2.604 -2.926 11.211 1.00 0.68 H new ATOM 0 HD21 LEU B 185 3.483 -5.825 10.669 1.00 0.69 H new ATOM 0 HD22 LEU B 185 1.812 -5.238 10.838 1.00 0.69 H new ATOM 0 HD23 LEU B 185 2.296 -6.137 9.380 1.00 0.69 H new ATOM 2972 N ILE B 186 -0.161 -2.595 6.254 1.00 0.56 N ATOM 2973 CA ILE B 186 -1.473 -2.080 5.788 1.00 0.54 C ATOM 2974 C ILE B 186 -2.326 -3.213 5.202 1.00 0.52 C ATOM 2975 O ILE B 186 -3.489 -3.344 5.578 1.00 0.49 O ATOM 2976 CB ILE B 186 -1.321 -0.924 4.762 1.00 0.60 C ATOM 2977 CG1 ILE B 186 -0.703 0.374 5.327 1.00 0.69 C ATOM 2978 CG2 ILE B 186 -2.671 -0.573 4.117 1.00 0.59 C ATOM 2979 CD1 ILE B 186 -1.627 1.227 6.200 1.00 0.91 C ATOM 0 H ILE B 186 0.638 -2.057 5.918 1.00 0.56 H new ATOM 0 HA ILE B 186 -1.983 -1.672 6.661 1.00 0.54 H new ATOM 0 HB ILE B 186 -0.621 -1.318 4.025 1.00 0.60 H new ATOM 0 HG12 ILE B 186 0.177 0.110 5.913 1.00 0.69 H new ATOM 0 HG13 ILE B 186 -0.359 0.984 4.492 1.00 0.69 H new ATOM 0 HG21 ILE B 186 -2.533 0.239 3.403 1.00 0.59 H new ATOM 0 HG22 ILE B 186 -3.065 -1.448 3.599 1.00 0.59 H new ATOM 0 HG23 ILE B 186 -3.374 -0.262 4.890 1.00 0.59 H new ATOM 0 HD11 ILE B 186 -1.090 2.112 6.542 1.00 0.91 H new ATOM 0 HD12 ILE B 186 -2.497 1.532 5.619 1.00 0.91 H new ATOM 0 HD13 ILE B 186 -1.953 0.645 7.062 1.00 0.91 H new ATOM 2991 N GLY B 187 -1.733 -4.078 4.367 1.00 0.58 N ATOM 2992 CA GLY B 187 -2.419 -5.185 3.687 1.00 0.63 C ATOM 2993 C GLY B 187 -2.968 -6.266 4.623 1.00 0.58 C ATOM 2994 O GLY B 187 -3.782 -7.079 4.194 1.00 0.62 O ATOM 0 H GLY B 187 -0.740 -4.026 4.141 1.00 0.58 H new ATOM 0 HA2 GLY B 187 -3.243 -4.779 3.100 1.00 0.63 H new ATOM 0 HA3 GLY B 187 -1.726 -5.648 2.985 1.00 0.63 H new ATOM 2998 N GLY B 188 -2.568 -6.274 5.900 1.00 0.60 N ATOM 2999 CA GLY B 188 -3.180 -7.125 6.924 1.00 0.66 C ATOM 3000 C GLY B 188 -4.453 -6.537 7.540 1.00 0.67 C ATOM 3001 O GLY B 188 -5.255 -7.297 8.083 1.00 0.79 O ATOM 0 H GLY B 188 -1.810 -5.689 6.252 1.00 0.60 H new ATOM 0 HA2 GLY B 188 -3.415 -8.094 6.484 1.00 0.66 H new ATOM 0 HA3 GLY B 188 -2.453 -7.303 7.717 1.00 0.66 H new ATOM 3005 N ILE B 189 -4.678 -5.218 7.454 1.00 0.64 N ATOM 3006 CA ILE B 189 -5.950 -4.559 7.837 1.00 0.73 C ATOM 3007 C ILE B 189 -6.806 -4.376 6.585 1.00 0.79 C ATOM 3008 O ILE B 189 -7.923 -4.893 6.501 1.00 0.73 O ATOM 3009 CB ILE B 189 -5.730 -3.190 8.538 1.00 0.74 C ATOM 3010 CG1 ILE B 189 -4.871 -3.272 9.816 1.00 0.68 C ATOM 3011 CG2 ILE B 189 -7.094 -2.597 8.949 1.00 1.09 C ATOM 3012 CD1 ILE B 189 -3.363 -3.217 9.569 1.00 0.61 C ATOM 0 H ILE B 189 -3.975 -4.563 7.112 1.00 0.64 H new ATOM 0 HA ILE B 189 -6.456 -5.200 8.559 1.00 0.73 H new ATOM 0 HB ILE B 189 -5.202 -2.571 7.813 1.00 0.74 H new ATOM 0 HG12 ILE B 189 -5.148 -2.452 10.479 1.00 0.68 H new ATOM 0 HG13 ILE B 189 -5.108 -4.199 10.339 1.00 0.68 H new ATOM 0 HG21 ILE B 189 -6.940 -1.637 9.441 1.00 1.09 H new ATOM 0 HG22 ILE B 189 -7.711 -2.455 8.062 1.00 1.09 H new ATOM 0 HG23 ILE B 189 -7.596 -3.280 9.635 1.00 1.09 H new ATOM 0 HD11 ILE B 189 -2.836 -3.281 10.521 1.00 0.61 H new ATOM 0 HD12 ILE B 189 -3.068 -4.052 8.934 1.00 0.61 H new ATOM 0 HD13 ILE B 189 -3.109 -2.279 9.076 1.00 0.61 H new ATOM 3024 N THR B 190 -6.224 -3.709 5.585 1.00 0.93 N ATOM 3025 CA THR B 190 -6.679 -3.554 4.205 1.00 0.86 C ATOM 3026 C THR B 190 -6.474 -4.879 3.474 1.00 0.88 C ATOM 3027 O THR B 190 -5.759 -4.968 2.491 1.00 1.48 O ATOM 3028 CB THR B 190 -5.910 -2.392 3.557 1.00 0.99 C ATOM 3029 OG1 THR B 190 -6.019 -1.256 4.391 1.00 1.15 O ATOM 3030 CG2 THR B 190 -6.430 -1.994 2.176 1.00 0.93 C ATOM 0 H THR B 190 -5.342 -3.220 5.737 1.00 0.93 H new ATOM 0 HA THR B 190 -7.740 -3.310 4.156 1.00 0.86 H new ATOM 0 HB THR B 190 -4.883 -2.737 3.436 1.00 0.99 H new ATOM 0 HG1 THR B 190 -5.531 -0.507 3.989 1.00 1.15 H new ATOM 0 HG21 THR B 190 -5.835 -1.168 1.787 1.00 0.93 H new ATOM 0 HG22 THR B 190 -6.355 -2.845 1.500 1.00 0.93 H new ATOM 0 HG23 THR B 190 -7.472 -1.685 2.255 1.00 0.93 H new ATOM 3038 N GLY B 191 -7.114 -5.920 3.994 1.00 0.87 N ATOM 3039 CA GLY B 191 -7.162 -7.276 3.457 1.00 0.91 C ATOM 3040 C GLY B 191 -8.557 -7.843 3.701 1.00 0.97 C ATOM 3041 O GLY B 191 -9.351 -7.894 2.760 1.00 1.05 O ATOM 0 H GLY B 191 -7.648 -5.834 4.859 1.00 0.87 H new ATOM 0 HA2 GLY B 191 -6.937 -7.269 2.391 1.00 0.91 H new ATOM 0 HA3 GLY B 191 -6.409 -7.901 3.938 1.00 0.91 H new ATOM 3045 N PRO B 192 -8.906 -8.178 4.963 1.00 1.08 N ATOM 3046 CA PRO B 192 -10.247 -8.626 5.330 1.00 1.26 C ATOM 3047 C PRO B 192 -11.339 -7.596 5.003 1.00 1.23 C ATOM 3048 O PRO B 192 -12.310 -7.955 4.343 1.00 1.33 O ATOM 3049 CB PRO B 192 -10.183 -8.959 6.827 1.00 1.44 C ATOM 3050 CG PRO B 192 -8.972 -8.180 7.339 1.00 1.38 C ATOM 3051 CD PRO B 192 -8.036 -8.193 6.134 1.00 1.15 C ATOM 0 HA PRO B 192 -10.533 -9.499 4.743 1.00 1.26 H new ATOM 0 HB2 PRO B 192 -11.096 -8.657 7.341 1.00 1.44 H new ATOM 0 HB3 PRO B 192 -10.065 -10.030 6.991 1.00 1.44 H new ATOM 0 HG2 PRO B 192 -9.238 -7.165 7.635 1.00 1.38 H new ATOM 0 HG3 PRO B 192 -8.520 -8.658 8.209 1.00 1.38 H new ATOM 0 HD2 PRO B 192 -7.374 -7.327 6.142 1.00 1.15 H new ATOM 0 HD3 PRO B 192 -7.401 -9.079 6.140 1.00 1.15 H new ATOM 3059 N ILE B 193 -11.199 -6.329 5.422 1.00 1.17 N ATOM 3060 CA ILE B 193 -12.261 -5.309 5.237 1.00 1.28 C ATOM 3061 C ILE B 193 -12.177 -4.592 3.884 1.00 1.37 C ATOM 3062 O ILE B 193 -13.104 -3.895 3.479 1.00 1.49 O ATOM 3063 CB ILE B 193 -12.297 -4.316 6.428 1.00 1.46 C ATOM 3064 CG1 ILE B 193 -11.062 -3.382 6.526 1.00 1.45 C ATOM 3065 CG2 ILE B 193 -12.492 -5.094 7.744 1.00 1.58 C ATOM 3066 CD1 ILE B 193 -11.308 -1.983 5.943 1.00 1.14 C ATOM 0 H ILE B 193 -10.364 -5.979 5.892 1.00 1.17 H new ATOM 0 HA ILE B 193 -13.211 -5.844 5.224 1.00 1.28 H new ATOM 0 HB ILE B 193 -13.143 -3.653 6.246 1.00 1.46 H new ATOM 0 HG12 ILE B 193 -10.771 -3.286 7.572 1.00 1.45 H new ATOM 0 HG13 ILE B 193 -10.224 -3.843 6.003 1.00 1.45 H new ATOM 0 HG21 ILE B 193 -12.517 -4.395 8.580 1.00 1.58 H new ATOM 0 HG22 ILE B 193 -13.431 -5.646 7.705 1.00 1.58 H new ATOM 0 HG23 ILE B 193 -11.666 -5.792 7.880 1.00 1.58 H new ATOM 0 HD11 ILE B 193 -10.404 -1.382 6.044 1.00 1.14 H new ATOM 0 HD12 ILE B 193 -11.570 -2.069 4.888 1.00 1.14 H new ATOM 0 HD13 ILE B 193 -12.125 -1.503 6.482 1.00 1.14 H new ATOM 3078 N ALA B 194 -11.086 -4.780 3.143 1.00 1.34 N ATOM 3079 CA ALA B 194 -10.822 -4.052 1.904 1.00 1.54 C ATOM 3080 C ALA B 194 -11.788 -4.421 0.774 1.00 1.45 C ATOM 3081 O ALA B 194 -12.126 -3.581 -0.053 1.00 1.39 O ATOM 3082 CB ALA B 194 -9.380 -4.328 1.492 1.00 1.71 C ATOM 0 H ALA B 194 -10.355 -5.448 3.388 1.00 1.34 H new ATOM 0 HA ALA B 194 -10.977 -2.989 2.089 1.00 1.54 H new ATOM 0 HB1 ALA B 194 -9.157 -3.795 0.568 1.00 1.71 H new ATOM 0 HB2 ALA B 194 -8.706 -3.989 2.278 1.00 1.71 H new ATOM 0 HB3 ALA B 194 -9.245 -5.398 1.335 1.00 1.71 H new ATOM 3088 N LYS B 195 -12.279 -5.662 0.740 1.00 1.47 N ATOM 3089 CA LYS B 195 -13.328 -6.029 -0.217 1.00 1.42 C ATOM 3090 C LYS B 195 -14.585 -5.146 -0.102 1.00 1.31 C ATOM 3091 O LYS B 195 -15.099 -4.739 -1.145 1.00 1.31 O ATOM 3092 CB LYS B 195 -13.683 -7.514 -0.136 1.00 1.57 C ATOM 3093 CG LYS B 195 -13.987 -8.085 1.264 1.00 2.35 C ATOM 3094 CD LYS B 195 -15.081 -9.166 1.244 1.00 2.72 C ATOM 3095 CE LYS B 195 -15.031 -10.107 0.029 1.00 2.23 C ATOM 3096 NZ LYS B 195 -13.981 -11.133 0.145 1.00 3.39 N ATOM 0 H LYS B 195 -11.974 -6.419 1.352 1.00 1.47 H new ATOM 0 HA LYS B 195 -12.907 -5.842 -1.205 1.00 1.42 H new ATOM 0 HB2 LYS B 195 -14.552 -7.690 -0.770 1.00 1.57 H new ATOM 0 HB3 LYS B 195 -12.857 -8.084 -0.562 1.00 1.57 H new ATOM 0 HG2 LYS B 195 -13.074 -8.506 1.685 1.00 2.35 H new ATOM 0 HG3 LYS B 195 -14.297 -7.274 1.923 1.00 2.35 H new ATOM 0 HD2 LYS B 195 -15.000 -9.763 2.152 1.00 2.72 H new ATOM 0 HD3 LYS B 195 -16.055 -8.678 1.269 1.00 2.72 H new ATOM 0 HE2 LYS B 195 -15.999 -10.595 -0.087 1.00 2.23 H new ATOM 0 HE3 LYS B 195 -14.861 -9.519 -0.873 1.00 2.23 H new ATOM 0 HZ1 LYS B 195 -13.993 -11.739 -0.700 1.00 3.39 H new ATOM 0 HZ2 LYS B 195 -13.053 -10.672 0.228 1.00 3.39 H new ATOM 0 HZ3 LYS B 195 -14.155 -11.714 0.990 1.00 3.39 H new ATOM 3110 N LEU B 196 -14.973 -4.741 1.118 1.00 1.33 N ATOM 3111 CA LEU B 196 -16.173 -3.945 1.381 1.00 1.29 C ATOM 3112 C LEU B 196 -16.152 -2.653 0.567 1.00 1.05 C ATOM 3113 O LEU B 196 -17.159 -2.298 -0.018 1.00 0.98 O ATOM 3114 CB LEU B 196 -16.266 -3.693 2.897 1.00 1.58 C ATOM 3115 CG LEU B 196 -17.634 -3.164 3.382 1.00 2.04 C ATOM 3116 CD1 LEU B 196 -17.834 -3.533 4.860 1.00 2.21 C ATOM 3117 CD2 LEU B 196 -17.769 -1.637 3.255 1.00 2.41 C ATOM 0 H LEU B 196 -14.448 -4.965 1.963 1.00 1.33 H new ATOM 0 HA LEU B 196 -17.067 -4.484 1.067 1.00 1.29 H new ATOM 0 HB2 LEU B 196 -16.046 -4.624 3.420 1.00 1.58 H new ATOM 0 HB3 LEU B 196 -15.494 -2.977 3.180 1.00 1.58 H new ATOM 0 HG LEU B 196 -18.387 -3.627 2.744 1.00 2.04 H new ATOM 0 HD11 LEU B 196 -18.799 -3.159 5.201 1.00 2.21 H new ATOM 0 HD12 LEU B 196 -17.805 -4.617 4.972 1.00 2.21 H new ATOM 0 HD13 LEU B 196 -17.040 -3.085 5.458 1.00 2.21 H new ATOM 0 HD21 LEU B 196 -18.751 -1.328 3.612 1.00 2.41 H new ATOM 0 HD22 LEU B 196 -16.997 -1.153 3.853 1.00 2.41 H new ATOM 0 HD23 LEU B 196 -17.654 -1.347 2.210 1.00 2.41 H new ATOM 3129 N ILE B 197 -14.987 -2.006 0.449 1.00 1.02 N ATOM 3130 CA ILE B 197 -14.755 -0.853 -0.441 1.00 0.96 C ATOM 3131 C ILE B 197 -15.279 -1.136 -1.844 1.00 0.86 C ATOM 3132 O ILE B 197 -16.166 -0.457 -2.329 1.00 0.97 O ATOM 3133 CB ILE B 197 -13.255 -0.522 -0.520 1.00 0.97 C ATOM 3134 CG1 ILE B 197 -12.729 -0.153 0.876 1.00 1.14 C ATOM 3135 CG2 ILE B 197 -13.000 0.604 -1.536 1.00 1.10 C ATOM 3136 CD1 ILE B 197 -11.207 -0.099 0.907 1.00 1.25 C ATOM 0 H ILE B 197 -14.158 -2.272 0.980 1.00 1.02 H new ATOM 0 HA ILE B 197 -15.292 -0.001 -0.024 1.00 0.96 H new ATOM 0 HB ILE B 197 -12.712 -1.401 -0.867 1.00 0.97 H new ATOM 0 HG12 ILE B 197 -13.134 0.814 1.174 1.00 1.14 H new ATOM 0 HG13 ILE B 197 -13.082 -0.884 1.603 1.00 1.14 H new ATOM 0 HG21 ILE B 197 -11.933 0.823 -1.576 1.00 1.10 H new ATOM 0 HG22 ILE B 197 -13.344 0.290 -2.521 1.00 1.10 H new ATOM 0 HG23 ILE B 197 -13.542 1.499 -1.231 1.00 1.10 H new ATOM 0 HD11 ILE B 197 -10.873 0.165 1.910 1.00 1.25 H new ATOM 0 HD12 ILE B 197 -10.803 -1.074 0.634 1.00 1.25 H new ATOM 0 HD13 ILE B 197 -10.855 0.651 0.198 1.00 1.25 H new ATOM 3148 N HIS B 198 -14.733 -2.149 -2.511 1.00 0.79 N ATOM 3149 CA HIS B 198 -15.092 -2.462 -3.891 1.00 0.85 C ATOM 3150 C HIS B 198 -16.544 -2.915 -4.008 1.00 0.94 C ATOM 3151 O HIS B 198 -17.204 -2.576 -4.986 1.00 1.18 O ATOM 3152 CB HIS B 198 -14.145 -3.550 -4.405 1.00 0.91 C ATOM 3153 CG HIS B 198 -14.420 -3.978 -5.825 1.00 0.99 C ATOM 3154 ND1 HIS B 198 -14.471 -3.159 -6.930 1.00 1.09 N ATOM 3155 CD2 HIS B 198 -14.675 -5.253 -6.258 1.00 1.50 C ATOM 3156 CE1 HIS B 198 -14.750 -3.925 -7.998 1.00 1.40 C ATOM 3157 NE2 HIS B 198 -14.866 -5.215 -7.643 1.00 1.81 N ATOM 0 H HIS B 198 -14.032 -2.774 -2.112 1.00 0.79 H new ATOM 0 HA HIS B 198 -14.993 -1.561 -4.496 1.00 0.85 H new ATOM 0 HB2 HIS B 198 -13.119 -3.187 -4.337 1.00 0.91 H new ATOM 0 HB3 HIS B 198 -14.219 -4.420 -3.753 1.00 0.91 H new ATOM 0 HD2 HIS B 198 -14.721 -6.135 -5.637 1.00 1.50 H new ATOM 0 HE1 HIS B 198 -14.865 -3.554 -9.006 1.00 1.40 H new ATOM 0 HE2 HIS B 198 -15.055 -6.006 -8.258 1.00 1.81 H new ATOM 3165 N GLU B 199 -17.042 -3.631 -3.000 1.00 0.92 N ATOM 3166 CA GLU B 199 -18.427 -4.070 -2.941 1.00 1.13 C ATOM 3167 C GLU B 199 -19.374 -2.868 -2.743 1.00 1.03 C ATOM 3168 O GLU B 199 -20.532 -2.959 -3.136 1.00 1.28 O ATOM 3169 CB GLU B 199 -18.536 -5.151 -1.848 1.00 1.53 C ATOM 3170 CG GLU B 199 -17.782 -6.436 -2.278 1.00 1.59 C ATOM 3171 CD GLU B 199 -17.244 -7.319 -1.146 1.00 2.43 C ATOM 3172 OE1 GLU B 199 -17.165 -6.851 0.012 1.00 3.55 O ATOM 3173 OE2 GLU B 199 -16.798 -8.447 -1.465 1.00 3.01 O ATOM 0 H GLU B 199 -16.486 -3.923 -2.196 1.00 0.92 H new ATOM 0 HA GLU B 199 -18.744 -4.518 -3.883 1.00 1.13 H new ATOM 0 HB2 GLU B 199 -18.121 -4.774 -0.913 1.00 1.53 H new ATOM 0 HB3 GLU B 199 -19.584 -5.383 -1.661 1.00 1.53 H new ATOM 0 HG2 GLU B 199 -18.453 -7.037 -2.891 1.00 1.59 H new ATOM 0 HG3 GLU B 199 -16.945 -6.145 -2.912 1.00 1.59 H new ATOM 3180 N GLN B 200 -18.887 -1.726 -2.231 1.00 0.92 N ATOM 3181 CA GLN B 200 -19.613 -0.462 -2.100 1.00 1.08 C ATOM 3182 C GLN B 200 -19.459 0.494 -3.291 1.00 1.13 C ATOM 3183 O GLN B 200 -20.477 1.046 -3.694 1.00 1.39 O ATOM 3184 CB GLN B 200 -19.184 0.229 -0.796 1.00 1.21 C ATOM 3185 CG GLN B 200 -19.840 -0.395 0.448 1.00 1.42 C ATOM 3186 CD GLN B 200 -21.369 -0.305 0.487 1.00 1.74 C ATOM 3187 OE1 GLN B 200 -22.047 -1.148 1.051 1.00 2.28 O ATOM 3188 NE2 GLN B 200 -21.980 0.695 -0.116 1.00 1.92 N ATOM 0 H GLN B 200 -17.931 -1.661 -1.882 1.00 0.92 H new ATOM 0 HA GLN B 200 -20.673 -0.715 -2.079 1.00 1.08 H new ATOM 0 HB2 GLN B 200 -18.100 0.171 -0.698 1.00 1.21 H new ATOM 0 HB3 GLN B 200 -19.443 1.286 -0.847 1.00 1.21 H new ATOM 0 HG2 GLN B 200 -19.551 -1.444 0.505 1.00 1.42 H new ATOM 0 HG3 GLN B 200 -19.439 0.094 1.336 1.00 1.42 H new ATOM 0 HE21 GLN B 200 -21.435 1.412 -0.594 1.00 1.92 H new ATOM 0 HE22 GLN B 200 -22.998 0.752 -0.104 1.00 1.92 H new ATOM 3197 N GLU B 201 -18.283 0.631 -3.927 1.00 0.98 N ATOM 3198 CA GLU B 201 -18.160 1.270 -5.267 1.00 1.21 C ATOM 3199 C GLU B 201 -18.982 0.530 -6.344 1.00 1.33 C ATOM 3200 O GLU B 201 -19.055 0.909 -7.517 1.00 1.70 O ATOM 3201 CB GLU B 201 -16.703 1.358 -5.753 1.00 1.31 C ATOM 3202 CG GLU B 201 -15.684 1.890 -4.745 1.00 1.37 C ATOM 3203 CD GLU B 201 -16.125 3.152 -4.004 1.00 1.40 C ATOM 3204 OE1 GLU B 201 -16.190 4.224 -4.649 1.00 2.40 O ATOM 3205 OE2 GLU B 201 -16.398 3.019 -2.791 1.00 2.00 O ATOM 0 H GLU B 201 -17.396 0.309 -3.540 1.00 0.98 H new ATOM 0 HA GLU B 201 -18.553 2.278 -5.132 1.00 1.21 H new ATOM 0 HB2 GLU B 201 -16.386 0.363 -6.067 1.00 1.31 H new ATOM 0 HB3 GLU B 201 -16.675 1.995 -6.637 1.00 1.31 H new ATOM 0 HG2 GLU B 201 -15.474 1.109 -4.014 1.00 1.37 H new ATOM 0 HG3 GLU B 201 -14.750 2.098 -5.267 1.00 1.37 H new ATOM 3212 N GLN B 202 -19.549 -0.612 -5.972 1.00 1.25 N ATOM 3213 CA GLN B 202 -20.630 -1.281 -6.670 1.00 1.41 C ATOM 3214 C GLN B 202 -21.970 -1.110 -5.954 1.00 1.43 C ATOM 3215 O GLN B 202 -22.726 -0.207 -6.297 1.00 1.53 O ATOM 3216 CB GLN B 202 -20.257 -2.754 -6.794 1.00 1.49 C ATOM 3217 CG GLN B 202 -18.994 -2.956 -7.598 1.00 1.43 C ATOM 3218 CD GLN B 202 -19.185 -2.561 -9.058 1.00 1.67 C ATOM 3219 OE1 GLN B 202 -19.703 -3.326 -9.857 1.00 2.19 O ATOM 3220 NE2 GLN B 202 -18.870 -1.341 -9.451 1.00 1.82 N ATOM 0 H GLN B 202 -19.251 -1.116 -5.137 1.00 1.25 H new ATOM 0 HA GLN B 202 -20.759 -0.835 -7.656 1.00 1.41 H new ATOM 0 HB2 GLN B 202 -20.124 -3.179 -5.799 1.00 1.49 H new ATOM 0 HB3 GLN B 202 -21.077 -3.296 -7.265 1.00 1.49 H new ATOM 0 HG2 GLN B 202 -18.188 -2.365 -7.164 1.00 1.43 H new ATOM 0 HG3 GLN B 202 -18.689 -4.001 -7.541 1.00 1.43 H new ATOM 0 HE21 GLN B 202 -18.437 -0.690 -8.796 1.00 1.82 H new ATOM 0 HE22 GLN B 202 -19.060 -1.049 -10.410 1.00 1.82 H new ATOM 3229 N GLN B 203 -22.311 -2.080 -5.094 1.00 1.54 N ATOM 3230 CA GLN B 203 -23.594 -2.265 -4.376 1.00 1.74 C ATOM 3231 C GLN B 203 -24.842 -2.102 -5.271 1.00 2.49 C ATOM 3232 O GLN B 203 -25.931 -1.752 -4.818 1.00 2.56 O ATOM 3233 CB GLN B 203 -23.642 -1.462 -3.063 1.00 1.63 C ATOM 3234 CG GLN B 203 -23.801 0.061 -3.213 1.00 2.31 C ATOM 3235 CD GLN B 203 -24.941 0.597 -2.355 1.00 3.18 C ATOM 3236 OE1 GLN B 203 -24.741 1.122 -1.267 1.00 3.90 O ATOM 3237 NE2 GLN B 203 -26.177 0.417 -2.786 1.00 3.98 N ATOM 0 H GLN B 203 -21.648 -2.818 -4.859 1.00 1.54 H new ATOM 0 HA GLN B 203 -23.631 -3.314 -4.081 1.00 1.74 H new ATOM 0 HB2 GLN B 203 -24.469 -1.837 -2.460 1.00 1.63 H new ATOM 0 HB3 GLN B 203 -22.727 -1.659 -2.505 1.00 1.63 H new ATOM 0 HG2 GLN B 203 -22.871 0.553 -2.930 1.00 2.31 H new ATOM 0 HG3 GLN B 203 -23.987 0.306 -4.259 1.00 2.31 H new ATOM 0 HE21 GLN B 203 -26.342 -0.020 -3.692 1.00 3.98 H new ATOM 0 HE22 GLN B 203 -26.966 0.716 -2.212 1.00 3.98 H new