USER MOD reduce.3.24.130724 H: found=0, std=0, add=1328, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1330 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 ASN : amide:sc= -2.38 X(o=-5.7,f=-5.9) USER MOD Set 1.2: A 165 ASN : amide:sc= -3.27! C(o=-5.7!,f=-6.1!) USER MOD Set 2.1: A 105 SER OG : rot -10:sc= 1.14 USER MOD Set 2.2: A 124 GLN : amide:sc= 0.983 K(o=3.7,f=2.6) USER MOD Set 2.3: A 126 THR OG1 : rot -41:sc= 1.56 USER MOD Set 3.1: A 125 LYS NZ :NH3+ -119:sc= 0.595 (180deg=-0.038) USER MOD Set 3.2: A 127 SER OG : rot -134:sc= 0.285 USER MOD Set 4.1: A 86 SER OG : rot -138:sc= 0.424 USER MOD Set 4.2: A 87 SER OG : rot 180:sc= 0 USER MOD Set 4.3: A 91 GLN : amide:sc= -2.68! C(o=-2.3!,f=-8.6!) USER MOD Set 5.1: A 59 GLN : amide:sc= -0.0508 X(o=1.1,f=1.1) USER MOD Set 5.2: A 65 ASN : amide:sc= 1.1 K(o=1.1,f=-0.71) USER MOD Set 6.1: A 52 TYR OH : rot 34:sc= 1 USER MOD Set 6.2: A 54 THR OG1 : rot 166:sc= 0.0491 USER MOD Set 6.3: A 134 LYS NZ :NH3+ -134:sc= -0.072 (180deg=-0.497) USER MOD Set 6.4: A 138 TYR OH : rot 171:sc= 1.31 USER MOD Set 7.1: A 51 MET CE :methyl 168:sc= -1.12 (180deg=-1.52!) USER MOD Set 7.2: A 169 SER OG : rot 144:sc= 0.626 USER MOD Single : A 15 SER OG : rot 80:sc= 0.211 USER MOD Single : A 19 GLN : amide:sc= -3.3! C(o=-3.3!,f=-4.1!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0736 USER MOD Single : A 28 GLN : amide:sc= -0.0874 K(o=-0.087,f=-2.5!) USER MOD Single : A 42 GLN : amide:sc= -1.07 K(o=-1.1,f=-2.3) USER MOD Single : A 43 LYS NZ :NH3+ -112:sc= 1.25 (180deg=0.454) USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 47 SER OG : rot -160:sc= 0.00331 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0432 USER MOD Single : A 53 SER OG : rot -90:sc= 0.0154 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.776 X(o=-0.78,f=-0.75) USER MOD Single : A 63 SER OG : rot 37:sc= 0.0709 USER MOD Single : A 64 TYR OH : rot 180:sc= -1.72! USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -84:sc= 0.958 USER MOD Single : A 78 TYR OH : rot 39:sc= 1.3 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -28:sc= -1.54! USER MOD Single : A 96 ASN : amide:sc= -0.0195 K(o=-0.019,f=-0.99) USER MOD Single : A 98 HIS : no HD1:sc= -0.14 X(o=-0.14,f=-0.063) USER MOD Single : A 99 SER OG : rot -42:sc= 0.00748 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 GLN :FLIP amide:sc= -1.61 F(o=-3.7!,f=-1.6) USER MOD Single : A 104 GLN :FLIP amide:sc= -0.449 F(o=-2.1,f=-0.45) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.365 USER MOD Single : A 109 GLN : amide:sc= -5.6! C(o=-5.6!,f=-16!) USER MOD Single : A 113 THR OG1 : rot 163:sc= 0.0417 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 GLN :FLIP amide:sc= 0 F(o=-0.95,f=0) USER MOD Single : A 120 MET CE :methyl 162:sc= -0.187 (180deg=-0.874) USER MOD Single : A 129 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.13) USER MOD Single : A 130 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0735) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -138:sc= -0.167 USER MOD Single : A 141 THR OG1 : rot 180:sc= -0.0369 USER MOD Single : A 142 LYS NZ :NH3+ 155:sc= -0.103 (180deg=-0.767) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ -148:sc= 1.24 (180deg=-1.42) USER MOD Single : A 154 SER OG : rot 74:sc= 1.23 USER MOD Single : A 157 LYS NZ :NH3+ -159:sc= 1.11 (180deg=0.591) USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ -167:sc= -2.3! (180deg=-3.01!) USER MOD Single : A 164 ASN :FLIP amide:sc= 0.824 F(o=-0.24,f=0.82) USER MOD Single : A 172 THR OG1 : rot 130:sc= -1.95! USER MOD Single : A 174 GLN : amide:sc= -3.73! C(o=-3.7!,f=-7.4!) USER MOD ----------------------------------------------------------------- ATOM 88 N LEU A 7 -16.698 8.138 -0.858 1.00 0.58 N ATOM 89 CA LEU A 7 -15.622 7.753 0.032 1.00 0.51 C ATOM 90 C LEU A 7 -16.155 7.264 1.374 1.00 0.45 C ATOM 91 O LEU A 7 -17.105 7.815 1.931 1.00 0.49 O ATOM 92 CB LEU A 7 -14.665 8.936 0.226 1.00 0.52 C ATOM 93 CG LEU A 7 -15.316 10.222 0.743 1.00 0.80 C ATOM 94 CD1 LEU A 7 -15.173 10.329 2.252 1.00 1.73 C ATOM 95 CD2 LEU A 7 -14.720 11.433 0.047 1.00 1.08 C ATOM 0 HA LEU A 7 -15.080 6.924 -0.422 1.00 0.51 H new ATOM 0 HB2 LEU A 7 -13.881 8.639 0.923 1.00 0.52 H new ATOM 0 HB3 LEU A 7 -14.180 9.150 -0.726 1.00 0.52 H new ATOM 0 HG LEU A 7 -16.381 10.189 0.513 1.00 0.80 H new ATOM 0 HD11 LEU A 7 -15.643 11.250 2.598 1.00 1.73 H new ATOM 0 HD12 LEU A 7 -15.658 9.475 2.725 1.00 1.73 H new ATOM 0 HD13 LEU A 7 -14.116 10.339 2.518 1.00 1.73 H new ATOM 0 HD21 LEU A 7 -15.193 12.339 0.425 1.00 1.08 H new ATOM 0 HD22 LEU A 7 -13.648 11.474 0.242 1.00 1.08 H new ATOM 0 HD23 LEU A 7 -14.890 11.356 -1.027 1.00 1.08 H new ATOM 107 N ILE A 8 -15.545 6.199 1.856 1.00 0.43 N ATOM 108 CA ILE A 8 -15.714 5.754 3.220 1.00 0.40 C ATOM 109 C ILE A 8 -14.927 6.703 4.107 1.00 0.40 C ATOM 110 O ILE A 8 -14.204 7.540 3.590 1.00 0.62 O ATOM 111 CB ILE A 8 -15.233 4.267 3.338 1.00 0.41 C ATOM 112 CG1 ILE A 8 -16.440 3.337 3.468 1.00 0.48 C ATOM 113 CG2 ILE A 8 -14.219 4.014 4.466 1.00 0.67 C ATOM 114 CD1 ILE A 8 -16.105 1.880 3.231 1.00 0.47 C ATOM 0 H ILE A 8 -14.914 5.616 1.306 1.00 0.43 H new ATOM 0 HA ILE A 8 -16.757 5.772 3.535 1.00 0.40 H new ATOM 0 HB ILE A 8 -14.692 4.049 2.417 1.00 0.41 H new ATOM 0 HG12 ILE A 8 -16.868 3.446 4.465 1.00 0.48 H new ATOM 0 HG13 ILE A 8 -17.206 3.646 2.757 1.00 0.48 H new ATOM 0 HG21 ILE A 8 -13.941 2.960 4.475 1.00 0.67 H new ATOM 0 HG22 ILE A 8 -13.330 4.623 4.300 1.00 0.67 H new ATOM 0 HG23 ILE A 8 -14.666 4.280 5.424 1.00 0.67 H new ATOM 0 HD11 ILE A 8 -17.007 1.277 3.339 1.00 0.47 H new ATOM 0 HD12 ILE A 8 -15.705 1.758 2.224 1.00 0.47 H new ATOM 0 HD13 ILE A 8 -15.362 1.555 3.959 1.00 0.47 H new ATOM 126 N PRO A 9 -15.161 6.657 5.416 1.00 0.31 N ATOM 127 CA PRO A 9 -14.344 7.313 6.441 1.00 0.28 C ATOM 128 C PRO A 9 -12.869 7.524 6.040 1.00 0.32 C ATOM 129 O PRO A 9 -12.000 6.754 6.444 1.00 0.38 O ATOM 130 CB PRO A 9 -14.438 6.265 7.539 1.00 0.31 C ATOM 131 CG PRO A 9 -15.828 5.718 7.439 1.00 0.35 C ATOM 132 CD PRO A 9 -16.292 5.954 6.024 1.00 0.35 C ATOM 0 HA PRO A 9 -14.683 8.321 6.680 1.00 0.28 H new ATOM 0 HB2 PRO A 9 -13.695 5.480 7.399 1.00 0.31 H new ATOM 0 HB3 PRO A 9 -14.257 6.705 8.520 1.00 0.31 H new ATOM 0 HG2 PRO A 9 -15.842 4.655 7.678 1.00 0.35 H new ATOM 0 HG3 PRO A 9 -16.490 6.213 8.150 1.00 0.35 H new ATOM 0 HD2 PRO A 9 -16.508 5.018 5.509 1.00 0.35 H new ATOM 0 HD3 PRO A 9 -17.202 6.553 5.993 1.00 0.35 H new ATOM 140 N ALA A 10 -12.605 8.569 5.252 1.00 0.36 N ATOM 141 CA ALA A 10 -11.273 8.856 4.722 1.00 0.44 C ATOM 142 C ALA A 10 -10.405 9.600 5.735 1.00 0.42 C ATOM 143 O ALA A 10 -10.613 10.787 5.990 1.00 0.53 O ATOM 144 CB ALA A 10 -11.390 9.679 3.437 1.00 0.62 C ATOM 0 H ALA A 10 -13.314 9.243 4.963 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.790 7.902 4.508 1.00 0.44 H new ATOM 0 HB1 ALA A 10 -10.394 9.889 3.048 1.00 0.62 H new ATOM 0 HB2 ALA A 10 -11.958 9.117 2.696 1.00 0.62 H new ATOM 0 HB3 ALA A 10 -11.901 10.617 3.651 1.00 0.62 H new ATOM 150 N PRO A 11 -9.421 8.912 6.326 1.00 0.35 N ATOM 151 CA PRO A 11 -8.499 9.484 7.291 1.00 0.35 C ATOM 152 C PRO A 11 -7.181 9.936 6.651 1.00 0.39 C ATOM 153 O PRO A 11 -6.541 9.181 5.920 1.00 0.45 O ATOM 154 CB PRO A 11 -8.254 8.308 8.248 1.00 0.35 C ATOM 155 CG PRO A 11 -8.752 7.080 7.539 1.00 0.41 C ATOM 156 CD PRO A 11 -9.132 7.497 6.145 1.00 0.38 C ATOM 0 HA PRO A 11 -8.897 10.380 7.767 1.00 0.35 H new ATOM 0 HB2 PRO A 11 -7.195 8.216 8.489 1.00 0.35 H new ATOM 0 HB3 PRO A 11 -8.783 8.455 9.189 1.00 0.35 H new ATOM 0 HG2 PRO A 11 -7.981 6.310 7.514 1.00 0.41 H new ATOM 0 HG3 PRO A 11 -9.609 6.655 8.061 1.00 0.41 H new ATOM 0 HD2 PRO A 11 -8.322 7.333 5.434 1.00 0.38 H new ATOM 0 HD3 PRO A 11 -9.997 6.947 5.775 1.00 0.38 H new ATOM 164 N PRO A 12 -6.772 11.184 6.907 1.00 0.42 N ATOM 165 CA PRO A 12 -5.483 11.715 6.461 1.00 0.46 C ATOM 166 C PRO A 12 -4.309 11.096 7.214 1.00 0.44 C ATOM 167 O PRO A 12 -4.512 10.399 8.213 1.00 0.41 O ATOM 168 CB PRO A 12 -5.560 13.221 6.755 1.00 0.50 C ATOM 169 CG PRO A 12 -6.992 13.486 7.090 1.00 0.55 C ATOM 170 CD PRO A 12 -7.543 12.198 7.636 1.00 0.48 C ATOM 0 HA PRO A 12 -5.311 11.490 5.408 1.00 0.46 H new ATOM 0 HB2 PRO A 12 -4.906 13.494 7.583 1.00 0.50 H new ATOM 0 HB3 PRO A 12 -5.243 13.807 5.892 1.00 0.50 H new ATOM 0 HG2 PRO A 12 -7.078 14.288 7.824 1.00 0.55 H new ATOM 0 HG3 PRO A 12 -7.546 13.802 6.206 1.00 0.55 H new ATOM 0 HD2 PRO A 12 -7.398 12.120 8.714 1.00 0.48 H new ATOM 0 HD3 PRO A 12 -8.613 12.104 7.451 1.00 0.48 H new ATOM 178 N LEU A 13 -3.098 11.355 6.726 1.00 0.50 N ATOM 179 CA LEU A 13 -1.853 10.871 7.339 1.00 0.51 C ATOM 180 C LEU A 13 -1.915 10.981 8.858 1.00 0.49 C ATOM 181 O LEU A 13 -1.578 10.047 9.577 1.00 0.48 O ATOM 182 CB LEU A 13 -0.719 11.763 6.806 1.00 0.61 C ATOM 183 CG LEU A 13 0.729 11.563 7.334 1.00 0.60 C ATOM 184 CD1 LEU A 13 0.925 10.295 8.146 1.00 0.50 C ATOM 185 CD2 LEU A 13 1.700 11.554 6.165 1.00 0.74 C ATOM 0 H LEU A 13 -2.947 11.912 5.885 1.00 0.50 H new ATOM 0 HA LEU A 13 -1.692 9.822 7.090 1.00 0.51 H new ATOM 0 HB2 LEU A 13 -0.691 11.642 5.723 1.00 0.61 H new ATOM 0 HB3 LEU A 13 -0.998 12.798 7.004 1.00 0.61 H new ATOM 0 HG LEU A 13 0.921 12.398 8.007 1.00 0.60 H new ATOM 0 HD11 LEU A 13 1.962 10.231 8.477 1.00 0.50 H new ATOM 0 HD12 LEU A 13 0.267 10.314 9.015 1.00 0.50 H new ATOM 0 HD13 LEU A 13 0.687 9.428 7.530 1.00 0.50 H new ATOM 0 HD21 LEU A 13 2.715 11.414 6.536 1.00 0.74 H new ATOM 0 HD22 LEU A 13 1.446 10.739 5.487 1.00 0.74 H new ATOM 0 HD23 LEU A 13 1.637 12.503 5.632 1.00 0.74 H new ATOM 197 N ILE A 14 -2.415 12.092 9.334 1.00 0.52 N ATOM 198 CA ILE A 14 -2.344 12.418 10.745 1.00 0.56 C ATOM 199 C ILE A 14 -3.184 11.458 11.616 1.00 0.54 C ATOM 200 O ILE A 14 -3.204 11.571 12.842 1.00 0.61 O ATOM 201 CB ILE A 14 -2.764 13.892 10.957 1.00 0.66 C ATOM 202 CG1 ILE A 14 -4.261 14.038 11.282 1.00 0.79 C ATOM 203 CG2 ILE A 14 -2.418 14.695 9.700 1.00 0.65 C ATOM 204 CD1 ILE A 14 -5.190 13.655 10.151 1.00 1.05 C ATOM 0 H ILE A 14 -2.882 12.796 8.763 1.00 0.52 H new ATOM 0 HA ILE A 14 -1.311 12.291 11.070 1.00 0.56 H new ATOM 0 HB ILE A 14 -2.216 14.276 11.817 1.00 0.66 H new ATOM 0 HG12 ILE A 14 -4.493 13.421 12.150 1.00 0.79 H new ATOM 0 HG13 ILE A 14 -4.459 15.072 11.564 1.00 0.79 H new ATOM 0 HG21 ILE A 14 -2.711 15.735 9.841 1.00 0.65 H new ATOM 0 HG22 ILE A 14 -1.345 14.642 9.518 1.00 0.65 H new ATOM 0 HG23 ILE A 14 -2.952 14.280 8.845 1.00 0.65 H new ATOM 0 HD11 ILE A 14 -6.224 13.789 10.468 1.00 1.05 H new ATOM 0 HD12 ILE A 14 -4.991 14.288 9.286 1.00 1.05 H new ATOM 0 HD13 ILE A 14 -5.025 12.612 9.882 1.00 1.05 H new ATOM 216 N SER A 15 -3.860 10.506 10.972 1.00 0.46 N ATOM 217 CA SER A 15 -4.642 9.496 11.675 1.00 0.46 C ATOM 218 C SER A 15 -3.834 8.211 11.856 1.00 0.46 C ATOM 219 O SER A 15 -4.178 7.357 12.675 1.00 0.51 O ATOM 220 CB SER A 15 -5.917 9.183 10.892 1.00 0.42 C ATOM 221 OG SER A 15 -6.542 10.374 10.442 1.00 0.92 O ATOM 0 H SER A 15 -3.879 10.416 9.956 1.00 0.46 H new ATOM 0 HA SER A 15 -4.901 9.891 12.657 1.00 0.46 H new ATOM 0 HB2 SER A 15 -5.677 8.549 10.038 1.00 0.42 H new ATOM 0 HB3 SER A 15 -6.607 8.622 11.522 1.00 0.42 H new ATOM 0 HG SER A 15 -6.085 10.700 9.639 1.00 0.92 H new ATOM 227 N VAL A 16 -2.760 8.077 11.089 1.00 0.43 N ATOM 228 CA VAL A 16 -1.942 6.874 11.120 1.00 0.43 C ATOM 229 C VAL A 16 -0.595 7.165 11.782 1.00 0.45 C ATOM 230 O VAL A 16 0.000 8.221 11.557 1.00 0.50 O ATOM 231 CB VAL A 16 -1.722 6.301 9.689 1.00 0.45 C ATOM 232 CG1 VAL A 16 -0.939 7.261 8.811 1.00 0.54 C ATOM 233 CG2 VAL A 16 -1.021 4.951 9.737 1.00 0.45 C ATOM 0 H VAL A 16 -2.435 8.790 10.436 1.00 0.43 H new ATOM 0 HA VAL A 16 -2.474 6.124 11.706 1.00 0.43 H new ATOM 0 HB VAL A 16 -2.710 6.167 9.248 1.00 0.45 H new ATOM 0 HG11 VAL A 16 -0.807 6.824 7.821 1.00 0.54 H new ATOM 0 HG12 VAL A 16 -1.484 8.201 8.723 1.00 0.54 H new ATOM 0 HG13 VAL A 16 0.037 7.449 9.258 1.00 0.54 H new ATOM 0 HG21 VAL A 16 -0.882 4.577 8.723 1.00 0.45 H new ATOM 0 HG22 VAL A 16 -0.050 5.062 10.219 1.00 0.45 H new ATOM 0 HG23 VAL A 16 -1.629 4.245 10.304 1.00 0.45 H new ATOM 243 N PRO A 17 -0.128 6.257 12.657 1.00 0.46 N ATOM 244 CA PRO A 17 1.210 6.343 13.245 1.00 0.50 C ATOM 245 C PRO A 17 2.285 6.345 12.166 1.00 0.43 C ATOM 246 O PRO A 17 2.075 5.824 11.072 1.00 0.48 O ATOM 247 CB PRO A 17 1.315 5.081 14.108 1.00 0.59 C ATOM 248 CG PRO A 17 -0.093 4.676 14.369 1.00 0.53 C ATOM 249 CD PRO A 17 -0.871 5.089 13.153 1.00 0.50 C ATOM 0 HA PRO A 17 1.355 7.261 13.815 1.00 0.50 H new ATOM 0 HB2 PRO A 17 1.863 4.293 13.591 1.00 0.59 H new ATOM 0 HB3 PRO A 17 1.847 5.282 15.038 1.00 0.59 H new ATOM 0 HG2 PRO A 17 -0.166 3.601 14.533 1.00 0.53 H new ATOM 0 HG3 PRO A 17 -0.480 5.162 15.264 1.00 0.53 H new ATOM 0 HD2 PRO A 17 -0.910 4.292 12.410 1.00 0.50 H new ATOM 0 HD3 PRO A 17 -1.901 5.344 13.402 1.00 0.50 H new ATOM 257 N LEU A 18 3.433 6.921 12.476 1.00 0.42 N ATOM 258 CA LEU A 18 4.495 7.072 11.498 1.00 0.38 C ATOM 259 C LEU A 18 5.804 6.502 12.032 1.00 0.33 C ATOM 260 O LEU A 18 5.984 6.382 13.245 1.00 0.35 O ATOM 261 CB LEU A 18 4.671 8.553 11.143 1.00 0.46 C ATOM 262 CG LEU A 18 5.663 8.837 10.013 1.00 0.63 C ATOM 263 CD1 LEU A 18 5.233 8.116 8.749 1.00 1.15 C ATOM 264 CD2 LEU A 18 5.779 10.333 9.761 1.00 1.07 C ATOM 0 H LEU A 18 3.654 7.293 13.400 1.00 0.42 H new ATOM 0 HA LEU A 18 4.221 6.519 10.600 1.00 0.38 H new ATOM 0 HB2 LEU A 18 3.700 8.961 10.864 1.00 0.46 H new ATOM 0 HB3 LEU A 18 4.997 9.088 12.035 1.00 0.46 H new ATOM 0 HG LEU A 18 6.644 8.467 10.311 1.00 0.63 H new ATOM 0 HD11 LEU A 18 5.945 8.325 7.951 1.00 1.15 H new ATOM 0 HD12 LEU A 18 5.201 7.043 8.935 1.00 1.15 H new ATOM 0 HD13 LEU A 18 4.243 8.462 8.451 1.00 1.15 H new ATOM 0 HD21 LEU A 18 6.489 10.512 8.954 1.00 1.07 H new ATOM 0 HD22 LEU A 18 4.804 10.732 9.481 1.00 1.07 H new ATOM 0 HD23 LEU A 18 6.127 10.829 10.667 1.00 1.07 H new ATOM 276 N GLN A 19 6.687 6.099 11.121 1.00 0.36 N ATOM 277 CA GLN A 19 8.040 5.694 11.481 1.00 0.47 C ATOM 278 C GLN A 19 9.023 6.829 11.198 1.00 0.62 C ATOM 279 O GLN A 19 9.609 6.897 10.117 1.00 0.68 O ATOM 280 CB GLN A 19 8.455 4.424 10.718 1.00 0.49 C ATOM 281 CG GLN A 19 7.624 3.212 11.078 1.00 1.04 C ATOM 282 CD GLN A 19 7.877 2.726 12.490 1.00 2.08 C ATOM 283 OE1 GLN A 19 8.732 1.875 12.717 1.00 2.68 O ATOM 284 NE2 GLN A 19 7.134 3.259 13.446 1.00 2.93 N ATOM 0 H GLN A 19 6.486 6.045 10.122 1.00 0.36 H new ATOM 0 HA GLN A 19 8.058 5.470 12.548 1.00 0.47 H new ATOM 0 HB2 GLN A 19 8.371 4.608 9.647 1.00 0.49 H new ATOM 0 HB3 GLN A 19 9.504 4.211 10.924 1.00 0.49 H new ATOM 0 HG2 GLN A 19 6.567 3.455 10.966 1.00 1.04 H new ATOM 0 HG3 GLN A 19 7.842 2.406 10.377 1.00 1.04 H new ATOM 0 HE21 GLN A 19 6.434 3.964 13.215 1.00 2.93 H new ATOM 0 HE22 GLN A 19 7.261 2.965 14.414 1.00 2.93 H new ATOM 293 N PRO A 20 9.204 7.748 12.164 1.00 0.92 N ATOM 294 CA PRO A 20 10.083 8.901 12.020 1.00 1.20 C ATOM 295 C PRO A 20 11.522 8.554 12.378 1.00 1.19 C ATOM 296 O PRO A 20 11.772 7.633 13.161 1.00 1.36 O ATOM 297 CB PRO A 20 9.512 9.919 13.022 1.00 1.58 C ATOM 298 CG PRO A 20 8.411 9.212 13.758 1.00 1.65 C ATOM 299 CD PRO A 20 8.583 7.746 13.485 1.00 1.15 C ATOM 0 HA PRO A 20 10.114 9.273 10.996 1.00 1.20 H new ATOM 0 HB2 PRO A 20 10.284 10.261 13.712 1.00 1.58 H new ATOM 0 HB3 PRO A 20 9.132 10.801 12.507 1.00 1.58 H new ATOM 0 HG2 PRO A 20 8.467 9.416 14.827 1.00 1.65 H new ATOM 0 HG3 PRO A 20 7.434 9.557 13.418 1.00 1.65 H new ATOM 0 HD2 PRO A 20 9.215 7.265 14.231 1.00 1.15 H new ATOM 0 HD3 PRO A 20 7.630 7.217 13.486 1.00 1.15 H new ATOM 307 N GLY A 21 12.463 9.291 11.812 1.00 1.32 N ATOM 308 CA GLY A 21 13.861 8.998 12.042 1.00 1.38 C ATOM 309 C GLY A 21 14.352 7.887 11.140 1.00 1.06 C ATOM 310 O GLY A 21 15.531 7.526 11.160 1.00 1.29 O ATOM 0 H GLY A 21 12.285 10.086 11.198 1.00 1.32 H new ATOM 0 HA2 GLY A 21 14.455 9.896 11.871 1.00 1.38 H new ATOM 0 HA3 GLY A 21 14.007 8.713 13.084 1.00 1.38 H new ATOM 314 N PHE A 22 13.438 7.348 10.346 1.00 0.69 N ATOM 315 CA PHE A 22 13.758 6.280 9.415 1.00 0.51 C ATOM 316 C PHE A 22 14.494 6.862 8.213 1.00 0.51 C ATOM 317 O PHE A 22 14.531 8.081 8.033 1.00 0.68 O ATOM 318 CB PHE A 22 12.480 5.549 8.984 1.00 0.71 C ATOM 319 CG PHE A 22 12.688 4.082 8.716 1.00 1.19 C ATOM 320 CD1 PHE A 22 13.636 3.367 9.429 1.00 2.08 C ATOM 321 CD2 PHE A 22 11.945 3.421 7.753 1.00 0.91 C ATOM 322 CE1 PHE A 22 13.836 2.021 9.191 1.00 2.66 C ATOM 323 CE2 PHE A 22 12.145 2.074 7.509 1.00 1.43 C ATOM 324 CZ PHE A 22 13.090 1.375 8.230 1.00 2.32 C ATOM 0 H PHE A 22 12.460 7.638 10.330 1.00 0.69 H new ATOM 0 HA PHE A 22 14.407 5.552 9.902 1.00 0.51 H new ATOM 0 HB2 PHE A 22 11.725 5.665 9.762 1.00 0.71 H new ATOM 0 HB3 PHE A 22 12.086 6.022 8.085 1.00 0.71 H new ATOM 0 HD1 PHE A 22 14.227 3.869 10.181 1.00 2.08 H new ATOM 0 HD2 PHE A 22 11.202 3.962 7.186 1.00 0.91 H new ATOM 0 HE1 PHE A 22 14.576 1.476 9.758 1.00 2.66 H new ATOM 0 HE2 PHE A 22 11.561 1.570 6.754 1.00 1.43 H new ATOM 0 HZ PHE A 22 13.245 0.323 8.042 1.00 2.32 H new ATOM 334 N TRP A 23 15.071 6.002 7.389 1.00 0.48 N ATOM 335 CA TRP A 23 15.988 6.460 6.358 1.00 0.57 C ATOM 336 C TRP A 23 15.690 5.812 5.008 1.00 0.50 C ATOM 337 O TRP A 23 15.158 4.700 4.961 1.00 0.51 O ATOM 338 CB TRP A 23 17.427 6.163 6.802 1.00 0.78 C ATOM 339 CG TRP A 23 18.488 6.703 5.892 1.00 1.35 C ATOM 340 CD1 TRP A 23 19.351 5.978 5.122 1.00 2.36 C ATOM 341 CD2 TRP A 23 18.806 8.081 5.663 1.00 2.01 C ATOM 342 NE1 TRP A 23 20.182 6.819 4.426 1.00 3.05 N ATOM 343 CE2 TRP A 23 19.869 8.114 4.741 1.00 2.82 C ATOM 344 CE3 TRP A 23 18.296 9.289 6.144 1.00 2.70 C ATOM 345 CZ2 TRP A 23 20.428 9.306 4.294 1.00 3.70 C ATOM 346 CZ3 TRP A 23 18.853 10.472 5.697 1.00 3.72 C ATOM 347 CH2 TRP A 23 19.911 10.473 4.781 1.00 4.03 C ATOM 0 H TRP A 23 14.923 4.993 7.413 1.00 0.48 H new ATOM 0 HA TRP A 23 15.860 7.534 6.226 1.00 0.57 H new ATOM 0 HB2 TRP A 23 17.578 6.577 7.799 1.00 0.78 H new ATOM 0 HB3 TRP A 23 17.552 5.083 6.883 1.00 0.78 H new ATOM 0 HD1 TRP A 23 19.376 4.900 5.068 1.00 2.36 H new ATOM 0 HE1 TRP A 23 20.914 6.527 3.779 1.00 3.05 H new ATOM 0 HE3 TRP A 23 17.481 9.298 6.853 1.00 2.70 H new ATOM 0 HZ2 TRP A 23 21.243 9.309 3.586 1.00 3.70 H new ATOM 0 HZ3 TRP A 23 18.465 11.412 6.061 1.00 3.72 H new ATOM 0 HH2 TRP A 23 20.327 11.414 4.453 1.00 4.03 H new ATOM 358 N THR A 24 16.034 6.512 3.930 1.00 0.50 N ATOM 359 CA THR A 24 15.844 6.027 2.561 1.00 0.47 C ATOM 360 C THR A 24 16.302 4.581 2.398 1.00 0.46 C ATOM 361 O THR A 24 15.532 3.702 2.001 1.00 0.48 O ATOM 362 CB THR A 24 16.652 6.902 1.600 1.00 0.50 C ATOM 363 OG1 THR A 24 17.747 7.500 2.304 1.00 0.58 O ATOM 364 CG2 THR A 24 15.783 7.973 0.983 1.00 0.53 C ATOM 0 H THR A 24 16.456 7.439 3.980 1.00 0.50 H new ATOM 0 HA THR A 24 14.778 6.077 2.339 1.00 0.47 H new ATOM 0 HB THR A 24 17.035 6.275 0.795 1.00 0.50 H new ATOM 0 HG1 THR A 24 18.265 8.059 1.688 1.00 0.58 H new ATOM 0 HG21 THR A 24 16.381 8.581 0.304 1.00 0.53 H new ATOM 0 HG22 THR A 24 14.968 7.506 0.429 1.00 0.53 H new ATOM 0 HG23 THR A 24 15.372 8.606 1.770 1.00 0.53 H new ATOM 372 N GLU A 25 17.558 4.359 2.752 1.00 0.53 N ATOM 373 CA GLU A 25 18.217 3.068 2.606 1.00 0.60 C ATOM 374 C GLU A 25 17.469 1.955 3.344 1.00 0.60 C ATOM 375 O GLU A 25 17.372 0.831 2.859 1.00 0.63 O ATOM 376 CB GLU A 25 19.628 3.186 3.174 1.00 0.71 C ATOM 377 CG GLU A 25 20.410 1.889 3.220 1.00 1.31 C ATOM 378 CD GLU A 25 21.549 1.962 4.216 1.00 1.63 C ATOM 379 OE1 GLU A 25 22.576 2.601 3.908 1.00 1.94 O ATOM 380 OE2 GLU A 25 21.414 1.397 5.323 1.00 1.88 O ATOM 0 H GLU A 25 18.158 5.079 3.154 1.00 0.53 H new ATOM 0 HA GLU A 25 18.235 2.806 1.548 1.00 0.60 H new ATOM 0 HB2 GLU A 25 20.185 3.908 2.576 1.00 0.71 H new ATOM 0 HB3 GLU A 25 19.564 3.590 4.184 1.00 0.71 H new ATOM 0 HG2 GLU A 25 19.743 1.070 3.488 1.00 1.31 H new ATOM 0 HG3 GLU A 25 20.806 1.666 2.229 1.00 1.31 H new ATOM 387 N ARG A 26 16.941 2.282 4.514 1.00 0.64 N ATOM 388 CA ARG A 26 16.350 1.277 5.389 1.00 0.76 C ATOM 389 C ARG A 26 14.962 0.876 4.903 1.00 0.71 C ATOM 390 O ARG A 26 14.505 -0.239 5.148 1.00 0.87 O ATOM 391 CB ARG A 26 16.276 1.808 6.819 1.00 0.96 C ATOM 392 CG ARG A 26 17.592 2.379 7.318 1.00 1.62 C ATOM 393 CD ARG A 26 17.460 2.935 8.726 1.00 2.07 C ATOM 394 NE ARG A 26 18.565 3.832 9.061 1.00 2.61 N ATOM 395 CZ ARG A 26 18.501 4.771 10.006 1.00 3.42 C ATOM 396 NH1 ARG A 26 17.434 4.859 10.791 1.00 3.88 N ATOM 397 NH2 ARG A 26 19.512 5.609 10.187 1.00 4.18 N ATOM 0 H ARG A 26 16.909 3.233 4.880 1.00 0.64 H new ATOM 0 HA ARG A 26 16.984 0.391 5.369 1.00 0.76 H new ATOM 0 HB2 ARG A 26 15.509 2.581 6.873 1.00 0.96 H new ATOM 0 HB3 ARG A 26 15.963 1.002 7.483 1.00 0.96 H new ATOM 0 HG2 ARG A 26 18.356 1.602 7.303 1.00 1.62 H new ATOM 0 HG3 ARG A 26 17.926 3.168 6.644 1.00 1.62 H new ATOM 0 HD2 ARG A 26 16.516 3.471 8.818 1.00 2.07 H new ATOM 0 HD3 ARG A 26 17.430 2.112 9.440 1.00 2.07 H new ATOM 0 HE ARG A 26 19.437 3.734 8.541 1.00 2.61 H new ATOM 0 HH11 ARG A 26 16.659 4.207 10.673 1.00 3.88 H new ATOM 0 HH12 ARG A 26 17.390 5.579 11.512 1.00 3.88 H new ATOM 0 HH21 ARG A 26 20.345 5.538 9.602 1.00 4.18 H new ATOM 0 HH22 ARG A 26 19.457 6.325 10.911 1.00 4.18 H new ATOM 411 N PHE A 27 14.304 1.786 4.203 1.00 0.59 N ATOM 412 CA PHE A 27 12.984 1.516 3.650 1.00 0.61 C ATOM 413 C PHE A 27 13.129 1.150 2.168 1.00 0.51 C ATOM 414 O PHE A 27 12.257 1.424 1.350 1.00 0.72 O ATOM 415 CB PHE A 27 12.073 2.746 3.842 1.00 0.71 C ATOM 416 CG PHE A 27 10.590 2.442 3.888 1.00 1.11 C ATOM 417 CD1 PHE A 27 9.851 2.371 2.717 1.00 1.74 C ATOM 418 CD2 PHE A 27 9.931 2.242 5.100 1.00 0.95 C ATOM 419 CE1 PHE A 27 8.497 2.104 2.748 1.00 2.21 C ATOM 420 CE2 PHE A 27 8.576 1.976 5.131 1.00 1.39 C ATOM 421 CZ PHE A 27 7.859 1.906 3.956 1.00 2.03 C ATOM 0 H PHE A 27 14.662 2.720 4.003 1.00 0.59 H new ATOM 0 HA PHE A 27 12.522 0.678 4.171 1.00 0.61 H new ATOM 0 HB2 PHE A 27 12.355 3.247 4.768 1.00 0.71 H new ATOM 0 HB3 PHE A 27 12.260 3.448 3.030 1.00 0.71 H new ATOM 0 HD1 PHE A 27 10.341 2.527 1.767 1.00 1.74 H new ATOM 0 HD2 PHE A 27 10.486 2.296 6.025 1.00 0.95 H new ATOM 0 HE1 PHE A 27 7.936 2.050 1.826 1.00 2.21 H new ATOM 0 HE2 PHE A 27 8.078 1.823 6.077 1.00 1.39 H new ATOM 0 HZ PHE A 27 6.800 1.697 3.980 1.00 2.03 H new ATOM 431 N GLN A 28 14.267 0.545 1.834 1.00 0.40 N ATOM 432 CA GLN A 28 14.539 0.094 0.473 1.00 0.31 C ATOM 433 C GLN A 28 14.363 -1.423 0.375 1.00 0.30 C ATOM 434 O GLN A 28 14.475 -2.138 1.375 1.00 0.37 O ATOM 435 CB GLN A 28 15.971 0.502 0.071 1.00 0.28 C ATOM 436 CG GLN A 28 16.362 0.165 -1.368 1.00 0.45 C ATOM 437 CD GLN A 28 17.232 -1.080 -1.480 1.00 0.77 C ATOM 438 OE1 GLN A 28 17.160 -1.985 -0.652 1.00 1.73 O ATOM 439 NE2 GLN A 28 18.059 -1.138 -2.514 1.00 1.23 N ATOM 0 H GLN A 28 15.021 0.355 2.494 1.00 0.40 H new ATOM 0 HA GLN A 28 13.833 0.564 -0.211 1.00 0.31 H new ATOM 0 HB2 GLN A 28 16.081 1.576 0.219 1.00 0.28 H new ATOM 0 HB3 GLN A 28 16.674 0.014 0.746 1.00 0.28 H new ATOM 0 HG2 GLN A 28 15.457 0.022 -1.959 1.00 0.45 H new ATOM 0 HG3 GLN A 28 16.895 1.012 -1.800 1.00 0.45 H new ATOM 0 HE21 GLN A 28 18.094 -0.369 -3.183 1.00 1.23 H new ATOM 0 HE22 GLN A 28 18.661 -1.952 -2.641 1.00 1.23 H new ATOM 448 N GLY A 29 14.064 -1.902 -0.823 1.00 0.29 N ATOM 449 CA GLY A 29 14.015 -3.329 -1.066 1.00 0.32 C ATOM 450 C GLY A 29 12.620 -3.866 -1.269 1.00 0.30 C ATOM 451 O GLY A 29 11.700 -3.133 -1.631 1.00 0.28 O ATOM 0 H GLY A 29 13.853 -1.324 -1.636 1.00 0.29 H new ATOM 0 HA2 GLY A 29 14.614 -3.559 -1.947 1.00 0.32 H new ATOM 0 HA3 GLY A 29 14.475 -3.847 -0.224 1.00 0.32 H new ATOM 455 N ARG A 30 12.476 -5.159 -1.029 1.00 0.35 N ATOM 456 CA ARG A 30 11.259 -5.880 -1.360 1.00 0.36 C ATOM 457 C ARG A 30 10.303 -5.971 -0.185 1.00 0.39 C ATOM 458 O ARG A 30 10.687 -6.377 0.910 1.00 0.51 O ATOM 459 CB ARG A 30 11.606 -7.289 -1.824 1.00 0.46 C ATOM 460 CG ARG A 30 12.150 -7.331 -3.231 1.00 0.51 C ATOM 461 CD ARG A 30 12.673 -8.699 -3.586 1.00 0.66 C ATOM 462 NE ARG A 30 13.962 -8.976 -2.959 1.00 1.20 N ATOM 463 CZ ARG A 30 15.017 -9.419 -3.634 1.00 1.70 C ATOM 464 NH1 ARG A 30 14.935 -9.574 -4.949 1.00 1.65 N ATOM 465 NH2 ARG A 30 16.158 -9.679 -3.008 1.00 2.57 N ATOM 0 H ARG A 30 13.199 -5.737 -0.600 1.00 0.35 H new ATOM 0 HA ARG A 30 10.763 -5.323 -2.155 1.00 0.36 H new ATOM 0 HB2 ARG A 30 12.341 -7.719 -1.143 1.00 0.46 H new ATOM 0 HB3 ARG A 30 10.715 -7.914 -1.766 1.00 0.46 H new ATOM 0 HG2 ARG A 30 11.366 -7.048 -3.933 1.00 0.51 H new ATOM 0 HG3 ARG A 30 12.950 -6.598 -3.334 1.00 0.51 H new ATOM 0 HD2 ARG A 30 11.950 -9.454 -3.276 1.00 0.66 H new ATOM 0 HD3 ARG A 30 12.773 -8.778 -4.669 1.00 0.66 H new ATOM 0 HE ARG A 30 14.057 -8.822 -1.955 1.00 1.20 H new ATOM 0 HH11 ARG A 30 14.066 -9.353 -5.435 1.00 1.65 H new ATOM 0 HH12 ARG A 30 15.741 -9.914 -5.474 1.00 1.65 H new ATOM 0 HH21 ARG A 30 16.230 -9.539 -2.000 1.00 2.57 H new ATOM 0 HH22 ARG A 30 16.963 -10.019 -3.535 1.00 2.57 H new ATOM 479 N TRP A 31 9.061 -5.592 -0.421 1.00 0.34 N ATOM 480 CA TRP A 31 8.009 -5.798 0.553 1.00 0.42 C ATOM 481 C TRP A 31 6.836 -6.523 -0.085 1.00 0.34 C ATOM 482 O TRP A 31 6.281 -6.078 -1.095 1.00 0.34 O ATOM 483 CB TRP A 31 7.567 -4.473 1.167 1.00 0.55 C ATOM 484 CG TRP A 31 8.535 -3.958 2.186 1.00 0.85 C ATOM 485 CD1 TRP A 31 9.581 -3.107 1.975 1.00 1.94 C ATOM 486 CD2 TRP A 31 8.556 -4.282 3.577 1.00 0.74 C ATOM 487 NE1 TRP A 31 10.242 -2.872 3.155 1.00 1.91 N ATOM 488 CE2 TRP A 31 9.634 -3.585 4.152 1.00 0.91 C ATOM 489 CE3 TRP A 31 7.764 -5.092 4.394 1.00 1.79 C ATOM 490 CZ2 TRP A 31 9.937 -3.673 5.505 1.00 0.90 C ATOM 491 CZ3 TRP A 31 8.067 -5.180 5.737 1.00 2.36 C ATOM 492 CH2 TRP A 31 9.144 -4.474 6.282 1.00 1.70 C ATOM 0 H TRP A 31 8.757 -5.138 -1.282 1.00 0.34 H new ATOM 0 HA TRP A 31 8.400 -6.420 1.358 1.00 0.42 H new ATOM 0 HB2 TRP A 31 7.449 -3.732 0.376 1.00 0.55 H new ATOM 0 HB3 TRP A 31 6.590 -4.601 1.632 1.00 0.55 H new ATOM 0 HD1 TRP A 31 9.849 -2.681 1.020 1.00 1.94 H new ATOM 0 HE1 TRP A 31 11.054 -2.265 3.270 1.00 1.91 H new ATOM 0 HE3 TRP A 31 6.929 -5.640 3.982 1.00 1.79 H new ATOM 0 HZ2 TRP A 31 10.768 -3.129 5.929 1.00 0.90 H new ATOM 0 HZ3 TRP A 31 7.462 -5.804 6.378 1.00 2.36 H new ATOM 0 HH2 TRP A 31 9.355 -4.562 7.338 1.00 1.70 H new ATOM 503 N PHE A 32 6.486 -7.658 0.498 1.00 0.31 N ATOM 504 CA PHE A 32 5.398 -8.476 -0.005 1.00 0.30 C ATOM 505 C PHE A 32 4.107 -8.169 0.727 1.00 0.29 C ATOM 506 O PHE A 32 4.076 -8.122 1.955 1.00 0.33 O ATOM 507 CB PHE A 32 5.730 -9.962 0.138 1.00 0.38 C ATOM 508 CG PHE A 32 6.629 -10.480 -0.941 1.00 0.63 C ATOM 509 CD1 PHE A 32 6.095 -10.885 -2.150 1.00 0.68 C ATOM 510 CD2 PHE A 32 7.997 -10.567 -0.752 1.00 1.10 C ATOM 511 CE1 PHE A 32 6.902 -11.371 -3.153 1.00 1.17 C ATOM 512 CE2 PHE A 32 8.816 -11.052 -1.753 1.00 1.62 C ATOM 513 CZ PHE A 32 8.267 -11.453 -2.957 1.00 1.64 C ATOM 0 H PHE A 32 6.945 -8.035 1.327 1.00 0.31 H new ATOM 0 HA PHE A 32 5.266 -8.241 -1.061 1.00 0.30 H new ATOM 0 HB2 PHE A 32 6.203 -10.129 1.106 1.00 0.38 H new ATOM 0 HB3 PHE A 32 4.803 -10.535 0.134 1.00 0.38 H new ATOM 0 HD1 PHE A 32 5.029 -10.819 -2.310 1.00 0.68 H new ATOM 0 HD2 PHE A 32 8.428 -10.253 0.187 1.00 1.10 H new ATOM 0 HE1 PHE A 32 6.470 -11.687 -4.091 1.00 1.17 H new ATOM 0 HE2 PHE A 32 9.882 -11.118 -1.596 1.00 1.62 H new ATOM 0 HZ PHE A 32 8.904 -11.830 -3.743 1.00 1.64 H new ATOM 523 N VAL A 33 3.048 -7.951 -0.032 1.00 0.28 N ATOM 524 CA VAL A 33 1.740 -7.701 0.546 1.00 0.30 C ATOM 525 C VAL A 33 1.123 -9.012 1.042 1.00 0.31 C ATOM 526 O VAL A 33 0.978 -9.977 0.289 1.00 0.52 O ATOM 527 CB VAL A 33 0.800 -7.026 -0.478 1.00 0.34 C ATOM 528 CG1 VAL A 33 0.651 -7.896 -1.683 1.00 0.74 C ATOM 529 CG2 VAL A 33 -0.556 -6.693 0.130 1.00 0.74 C ATOM 0 H VAL A 33 3.068 -7.942 -1.052 1.00 0.28 H new ATOM 0 HA VAL A 33 1.866 -7.023 1.390 1.00 0.30 H new ATOM 0 HB VAL A 33 1.251 -6.081 -0.779 1.00 0.34 H new ATOM 0 HG11 VAL A 33 -0.013 -7.414 -2.400 1.00 0.74 H new ATOM 0 HG12 VAL A 33 1.627 -8.053 -2.141 1.00 0.74 H new ATOM 0 HG13 VAL A 33 0.230 -8.857 -1.388 1.00 0.74 H new ATOM 0 HG21 VAL A 33 -1.186 -6.220 -0.623 1.00 0.74 H new ATOM 0 HG22 VAL A 33 -1.033 -7.609 0.479 1.00 0.74 H new ATOM 0 HG23 VAL A 33 -0.421 -6.012 0.970 1.00 0.74 H new ATOM 539 N VAL A 34 0.794 -9.055 2.315 1.00 0.20 N ATOM 540 CA VAL A 34 0.150 -10.225 2.890 1.00 0.25 C ATOM 541 C VAL A 34 -1.248 -9.844 3.391 1.00 0.28 C ATOM 542 O VAL A 34 -2.008 -10.683 3.877 1.00 0.47 O ATOM 543 CB VAL A 34 0.989 -10.823 4.046 1.00 0.30 C ATOM 544 CG1 VAL A 34 0.525 -12.229 4.387 1.00 0.40 C ATOM 545 CG2 VAL A 34 2.472 -10.826 3.698 1.00 0.29 C ATOM 0 H VAL A 34 0.960 -8.295 2.975 1.00 0.20 H new ATOM 0 HA VAL A 34 0.067 -10.987 2.115 1.00 0.25 H new ATOM 0 HB VAL A 34 0.842 -10.191 4.922 1.00 0.30 H new ATOM 0 HG11 VAL A 34 1.131 -12.625 5.202 1.00 0.40 H new ATOM 0 HG12 VAL A 34 -0.521 -12.203 4.693 1.00 0.40 H new ATOM 0 HG13 VAL A 34 0.631 -12.870 3.512 1.00 0.40 H new ATOM 0 HG21 VAL A 34 3.039 -11.251 4.526 1.00 0.29 H new ATOM 0 HG22 VAL A 34 2.634 -11.425 2.802 1.00 0.29 H new ATOM 0 HG23 VAL A 34 2.805 -9.804 3.516 1.00 0.29 H new ATOM 555 N GLY A 35 -1.582 -8.564 3.254 1.00 0.19 N ATOM 556 CA GLY A 35 -2.894 -8.092 3.654 1.00 0.19 C ATOM 557 C GLY A 35 -3.269 -6.776 3.005 1.00 0.17 C ATOM 558 O GLY A 35 -2.393 -5.980 2.652 1.00 0.18 O ATOM 0 H GLY A 35 -0.966 -7.846 2.873 1.00 0.19 H new ATOM 0 HA2 GLY A 35 -3.640 -8.844 3.396 1.00 0.19 H new ATOM 0 HA3 GLY A 35 -2.919 -7.977 4.738 1.00 0.19 H new ATOM 562 N LEU A 36 -4.567 -6.534 2.861 1.00 0.17 N ATOM 563 CA LEU A 36 -5.051 -5.301 2.262 1.00 0.18 C ATOM 564 C LEU A 36 -6.415 -4.925 2.825 1.00 0.16 C ATOM 565 O LEU A 36 -7.289 -5.769 2.967 1.00 0.18 O ATOM 566 CB LEU A 36 -5.156 -5.443 0.750 1.00 0.20 C ATOM 567 CG LEU A 36 -5.099 -4.123 -0.008 1.00 0.24 C ATOM 568 CD1 LEU A 36 -3.689 -3.561 0.050 1.00 0.31 C ATOM 569 CD2 LEU A 36 -5.551 -4.303 -1.442 1.00 0.30 C ATOM 0 H LEU A 36 -5.302 -7.178 3.152 1.00 0.17 H new ATOM 0 HA LEU A 36 -4.335 -4.514 2.502 1.00 0.18 H new ATOM 0 HB2 LEU A 36 -4.348 -6.085 0.400 1.00 0.20 H new ATOM 0 HB3 LEU A 36 -6.091 -5.948 0.508 1.00 0.20 H new ATOM 0 HG LEU A 36 -5.780 -3.415 0.465 1.00 0.24 H new ATOM 0 HD11 LEU A 36 -3.651 -2.617 -0.493 1.00 0.31 H new ATOM 0 HD12 LEU A 36 -3.407 -3.393 1.089 1.00 0.31 H new ATOM 0 HD13 LEU A 36 -2.996 -4.269 -0.405 1.00 0.31 H new ATOM 0 HD21 LEU A 36 -5.501 -3.346 -1.962 1.00 0.30 H new ATOM 0 HD22 LEU A 36 -4.901 -5.022 -1.941 1.00 0.30 H new ATOM 0 HD23 LEU A 36 -6.577 -4.671 -1.457 1.00 0.30 H new ATOM 581 N ALA A 37 -6.601 -3.656 3.122 1.00 0.17 N ATOM 582 CA ALA A 37 -7.848 -3.187 3.711 1.00 0.18 C ATOM 583 C ALA A 37 -8.141 -1.775 3.245 1.00 0.24 C ATOM 584 O ALA A 37 -7.295 -0.905 3.366 1.00 0.43 O ATOM 585 CB ALA A 37 -7.740 -3.234 5.226 1.00 0.25 C ATOM 0 H ALA A 37 -5.906 -2.926 2.967 1.00 0.17 H new ATOM 0 HA ALA A 37 -8.667 -3.833 3.393 1.00 0.18 H new ATOM 0 HB1 ALA A 37 -8.672 -2.883 5.668 1.00 0.25 H new ATOM 0 HB2 ALA A 37 -7.550 -4.259 5.546 1.00 0.25 H new ATOM 0 HB3 ALA A 37 -6.920 -2.594 5.552 1.00 0.25 H new ATOM 591 N GLY A 38 -9.329 -1.540 2.716 1.00 0.22 N ATOM 592 CA GLY A 38 -9.631 -0.236 2.174 1.00 0.26 C ATOM 593 C GLY A 38 -10.918 -0.206 1.396 1.00 0.25 C ATOM 594 O GLY A 38 -11.353 -1.216 0.861 1.00 0.26 O ATOM 0 H GLY A 38 -10.084 -2.223 2.652 1.00 0.22 H new ATOM 0 HA2 GLY A 38 -9.689 0.486 2.989 1.00 0.26 H new ATOM 0 HA3 GLY A 38 -8.814 0.080 1.526 1.00 0.26 H new ATOM 598 N ASN A 39 -11.530 0.962 1.322 1.00 0.26 N ATOM 599 CA ASN A 39 -12.790 1.108 0.616 1.00 0.27 C ATOM 600 C ASN A 39 -12.563 0.935 -0.888 1.00 0.32 C ATOM 601 O ASN A 39 -13.456 0.522 -1.627 1.00 0.40 O ATOM 602 CB ASN A 39 -13.419 2.468 0.940 1.00 0.31 C ATOM 603 CG ASN A 39 -14.669 2.777 0.129 1.00 1.08 C ATOM 604 OD1 ASN A 39 -14.907 3.928 -0.231 1.00 1.94 O ATOM 605 ND2 ASN A 39 -15.498 1.771 -0.124 1.00 1.73 N ATOM 0 H ASN A 39 -11.176 1.822 1.741 1.00 0.26 H new ATOM 0 HA ASN A 39 -13.485 0.335 0.943 1.00 0.27 H new ATOM 0 HB2 ASN A 39 -13.669 2.499 2.001 1.00 0.31 H new ATOM 0 HB3 ASN A 39 -12.681 3.250 0.764 1.00 0.31 H new ATOM 0 HD21 ASN A 39 -16.366 1.941 -0.633 1.00 1.73 H new ATOM 0 HD22 ASN A 39 -15.267 0.829 0.190 1.00 1.73 H new ATOM 612 N ALA A 40 -11.338 1.218 -1.324 1.00 0.34 N ATOM 613 CA ALA A 40 -10.954 1.019 -2.718 1.00 0.41 C ATOM 614 C ALA A 40 -10.426 -0.401 -2.934 1.00 0.39 C ATOM 615 O ALA A 40 -10.080 -0.787 -4.049 1.00 0.45 O ATOM 616 CB ALA A 40 -9.917 2.054 -3.133 1.00 0.46 C ATOM 0 H ALA A 40 -10.594 1.586 -0.731 1.00 0.34 H new ATOM 0 HA ALA A 40 -11.837 1.148 -3.344 1.00 0.41 H new ATOM 0 HB1 ALA A 40 -9.640 1.894 -4.175 1.00 0.46 H new ATOM 0 HB2 ALA A 40 -10.335 3.054 -3.018 1.00 0.46 H new ATOM 0 HB3 ALA A 40 -9.033 1.956 -2.503 1.00 0.46 H new ATOM 622 N VAL A 41 -10.358 -1.165 -1.850 1.00 0.34 N ATOM 623 CA VAL A 41 -9.994 -2.580 -1.915 1.00 0.33 C ATOM 624 C VAL A 41 -11.106 -3.380 -2.592 1.00 0.42 C ATOM 625 O VAL A 41 -12.286 -3.204 -2.279 1.00 0.46 O ATOM 626 CB VAL A 41 -9.721 -3.158 -0.494 1.00 0.28 C ATOM 627 CG1 VAL A 41 -9.925 -4.674 -0.437 1.00 0.32 C ATOM 628 CG2 VAL A 41 -8.309 -2.803 -0.044 1.00 0.30 C ATOM 0 H VAL A 41 -10.551 -0.827 -0.907 1.00 0.34 H new ATOM 0 HA VAL A 41 -9.079 -2.663 -2.501 1.00 0.33 H new ATOM 0 HB VAL A 41 -10.444 -2.706 0.184 1.00 0.28 H new ATOM 0 HG11 VAL A 41 -9.723 -5.031 0.573 1.00 0.32 H new ATOM 0 HG12 VAL A 41 -10.953 -4.913 -0.707 1.00 0.32 H new ATOM 0 HG13 VAL A 41 -9.244 -5.159 -1.136 1.00 0.32 H new ATOM 0 HG21 VAL A 41 -8.130 -3.212 0.950 1.00 0.30 H new ATOM 0 HG22 VAL A 41 -7.587 -3.223 -0.745 1.00 0.30 H new ATOM 0 HG23 VAL A 41 -8.198 -1.719 -0.015 1.00 0.30 H new ATOM 638 N GLN A 42 -10.731 -4.241 -3.534 1.00 0.55 N ATOM 639 CA GLN A 42 -11.693 -5.120 -4.184 1.00 0.69 C ATOM 640 C GLN A 42 -12.056 -6.265 -3.243 1.00 0.60 C ATOM 641 O GLN A 42 -11.523 -7.374 -3.337 1.00 0.70 O ATOM 642 CB GLN A 42 -11.130 -5.664 -5.500 1.00 0.93 C ATOM 643 CG GLN A 42 -12.151 -6.438 -6.322 1.00 1.49 C ATOM 644 CD GLN A 42 -11.569 -7.005 -7.603 1.00 1.84 C ATOM 645 OE1 GLN A 42 -10.382 -7.323 -7.676 1.00 2.44 O ATOM 646 NE2 GLN A 42 -12.403 -7.146 -8.617 1.00 2.35 N ATOM 0 H GLN A 42 -9.771 -4.347 -3.862 1.00 0.55 H new ATOM 0 HA GLN A 42 -12.592 -4.549 -4.416 1.00 0.69 H new ATOM 0 HB2 GLN A 42 -10.751 -4.833 -6.095 1.00 0.93 H new ATOM 0 HB3 GLN A 42 -10.282 -6.314 -5.283 1.00 0.93 H new ATOM 0 HG2 GLN A 42 -12.553 -7.253 -5.720 1.00 1.49 H new ATOM 0 HG3 GLN A 42 -12.986 -5.781 -6.567 1.00 1.49 H new ATOM 0 HE21 GLN A 42 -13.380 -6.870 -8.516 1.00 2.35 H new ATOM 0 HE22 GLN A 42 -12.070 -7.531 -9.501 1.00 2.35 H new ATOM 655 N LYS A 43 -12.949 -5.968 -2.321 1.00 0.50 N ATOM 656 CA LYS A 43 -13.387 -6.925 -1.323 1.00 0.48 C ATOM 657 C LYS A 43 -14.778 -7.433 -1.704 1.00 0.59 C ATOM 658 O LYS A 43 -15.777 -6.754 -1.476 1.00 0.69 O ATOM 659 CB LYS A 43 -13.408 -6.237 0.051 1.00 0.43 C ATOM 660 CG LYS A 43 -13.241 -7.157 1.253 1.00 0.57 C ATOM 661 CD LYS A 43 -14.077 -8.417 1.185 1.00 0.55 C ATOM 662 CE LYS A 43 -13.452 -9.488 2.054 1.00 0.52 C ATOM 663 NZ LYS A 43 -13.635 -9.224 3.510 1.00 0.97 N ATOM 0 H LYS A 43 -13.393 -5.053 -2.242 1.00 0.50 H new ATOM 0 HA LYS A 43 -12.706 -7.775 -1.276 1.00 0.48 H new ATOM 0 HB2 LYS A 43 -12.614 -5.490 0.075 1.00 0.43 H new ATOM 0 HB3 LYS A 43 -14.352 -5.702 0.155 1.00 0.43 H new ATOM 0 HG2 LYS A 43 -12.191 -7.435 1.342 1.00 0.57 H new ATOM 0 HG3 LYS A 43 -13.503 -6.608 2.157 1.00 0.57 H new ATOM 0 HD2 LYS A 43 -15.093 -8.210 1.520 1.00 0.55 H new ATOM 0 HD3 LYS A 43 -14.146 -8.765 0.154 1.00 0.55 H new ATOM 0 HE2 LYS A 43 -13.891 -10.454 1.806 1.00 0.52 H new ATOM 0 HE3 LYS A 43 -12.387 -9.555 1.832 1.00 0.52 H new ATOM 0 HZ1 LYS A 43 -12.714 -9.005 3.941 1.00 0.97 H new ATOM 0 HZ2 LYS A 43 -14.279 -8.417 3.638 1.00 0.97 H new ATOM 0 HZ3 LYS A 43 -14.040 -10.066 3.967 1.00 0.97 H new ATOM 677 N GLU A 44 -14.841 -8.611 -2.312 1.00 0.68 N ATOM 678 CA GLU A 44 -16.124 -9.167 -2.723 1.00 0.80 C ATOM 679 C GLU A 44 -16.807 -9.900 -1.577 1.00 0.76 C ATOM 680 O GLU A 44 -17.927 -9.565 -1.193 1.00 0.88 O ATOM 681 CB GLU A 44 -15.980 -10.091 -3.944 1.00 0.94 C ATOM 682 CG GLU A 44 -14.572 -10.605 -4.204 1.00 0.95 C ATOM 683 CD GLU A 44 -14.255 -11.857 -3.422 1.00 1.59 C ATOM 684 OE1 GLU A 44 -13.887 -11.747 -2.235 1.00 2.22 O ATOM 685 OE2 GLU A 44 -14.366 -12.953 -3.994 1.00 2.00 O ATOM 0 H GLU A 44 -14.032 -9.193 -2.529 1.00 0.68 H new ATOM 0 HA GLU A 44 -16.754 -8.326 -3.012 1.00 0.80 H new ATOM 0 HB2 GLU A 44 -16.643 -10.946 -3.813 1.00 0.94 H new ATOM 0 HB3 GLU A 44 -16.323 -9.554 -4.828 1.00 0.94 H new ATOM 0 HG2 GLU A 44 -14.454 -10.807 -5.269 1.00 0.95 H new ATOM 0 HG3 GLU A 44 -13.853 -9.828 -3.945 1.00 0.95 H new ATOM 692 N ARG A 45 -16.131 -10.892 -1.040 1.00 0.70 N ATOM 693 CA ARG A 45 -16.671 -11.687 0.048 1.00 0.79 C ATOM 694 C ARG A 45 -15.537 -12.270 0.870 1.00 0.79 C ATOM 695 O ARG A 45 -15.665 -12.485 2.074 1.00 0.90 O ATOM 696 CB ARG A 45 -17.555 -12.801 -0.516 1.00 0.94 C ATOM 697 CG ARG A 45 -18.255 -13.635 0.541 1.00 1.54 C ATOM 698 CD ARG A 45 -19.297 -14.540 -0.092 1.00 1.86 C ATOM 699 NE ARG A 45 -20.282 -13.772 -0.850 1.00 2.25 N ATOM 700 CZ ARG A 45 -21.367 -14.290 -1.412 1.00 2.90 C ATOM 701 NH1 ARG A 45 -21.596 -15.598 -1.360 1.00 3.09 N ATOM 702 NH2 ARG A 45 -22.212 -13.497 -2.053 1.00 3.78 N ATOM 0 H ARG A 45 -15.197 -11.171 -1.341 1.00 0.70 H new ATOM 0 HA ARG A 45 -17.278 -11.054 0.694 1.00 0.79 H new ATOM 0 HB2 ARG A 45 -18.306 -12.358 -1.169 1.00 0.94 H new ATOM 0 HB3 ARG A 45 -16.943 -13.458 -1.134 1.00 0.94 H new ATOM 0 HG2 ARG A 45 -17.523 -14.236 1.080 1.00 1.54 H new ATOM 0 HG3 ARG A 45 -18.730 -12.981 1.272 1.00 1.54 H new ATOM 0 HD2 ARG A 45 -18.807 -15.256 -0.751 1.00 1.86 H new ATOM 0 HD3 ARG A 45 -19.801 -15.115 0.685 1.00 1.86 H new ATOM 0 HE ARG A 45 -20.125 -12.770 -0.954 1.00 2.25 H new ATOM 0 HH11 ARG A 45 -20.935 -16.213 -0.885 1.00 3.09 H new ATOM 0 HH12 ARG A 45 -22.433 -15.987 -1.795 1.00 3.09 H new ATOM 0 HH21 ARG A 45 -22.027 -12.496 -2.112 1.00 3.78 H new ATOM 0 HH22 ARG A 45 -23.048 -13.888 -2.488 1.00 3.78 H new ATOM 716 N GLN A 46 -14.415 -12.501 0.210 1.00 0.80 N ATOM 717 CA GLN A 46 -13.251 -13.081 0.866 1.00 0.94 C ATOM 718 C GLN A 46 -11.977 -12.317 0.507 1.00 0.86 C ATOM 719 O GLN A 46 -11.265 -11.842 1.393 1.00 0.94 O ATOM 720 CB GLN A 46 -13.116 -14.565 0.501 1.00 1.13 C ATOM 721 CG GLN A 46 -13.196 -14.847 -0.992 1.00 1.36 C ATOM 722 CD GLN A 46 -13.095 -16.323 -1.315 1.00 1.85 C ATOM 723 OE1 GLN A 46 -13.482 -17.174 -0.513 1.00 2.42 O ATOM 724 NE2 GLN A 46 -12.585 -16.637 -2.494 1.00 2.45 N ATOM 0 H GLN A 46 -14.283 -12.296 -0.781 1.00 0.80 H new ATOM 0 HA GLN A 46 -13.394 -13.000 1.944 1.00 0.94 H new ATOM 0 HB2 GLN A 46 -12.164 -14.936 0.879 1.00 1.13 H new ATOM 0 HB3 GLN A 46 -13.901 -15.126 1.008 1.00 1.13 H new ATOM 0 HG2 GLN A 46 -14.137 -14.458 -1.381 1.00 1.36 H new ATOM 0 HG3 GLN A 46 -12.395 -14.312 -1.502 1.00 1.36 H new ATOM 0 HE21 GLN A 46 -12.276 -15.901 -3.129 1.00 2.45 H new ATOM 0 HE22 GLN A 46 -12.500 -17.616 -2.769 1.00 2.45 H new ATOM 733 N SER A 47 -11.730 -12.165 -0.790 1.00 0.79 N ATOM 734 CA SER A 47 -10.522 -11.533 -1.297 1.00 0.80 C ATOM 735 C SER A 47 -10.428 -11.742 -2.803 1.00 0.82 C ATOM 736 O SER A 47 -10.133 -12.843 -3.267 1.00 0.93 O ATOM 737 CB SER A 47 -9.268 -12.112 -0.632 1.00 0.93 C ATOM 738 OG SER A 47 -8.121 -11.355 -0.973 1.00 1.58 O ATOM 0 H SER A 47 -12.368 -12.479 -1.521 1.00 0.79 H new ATOM 0 HA SER A 47 -10.577 -10.469 -1.066 1.00 0.80 H new ATOM 0 HB2 SER A 47 -9.396 -12.119 0.450 1.00 0.93 H new ATOM 0 HB3 SER A 47 -9.131 -13.148 -0.944 1.00 0.93 H new ATOM 0 HG SER A 47 -7.316 -11.893 -0.820 1.00 1.58 H new ATOM 744 N ARG A 48 -10.725 -10.704 -3.569 1.00 0.81 N ATOM 745 CA ARG A 48 -10.490 -10.748 -5.005 1.00 0.90 C ATOM 746 C ARG A 48 -9.114 -10.178 -5.296 1.00 0.92 C ATOM 747 O ARG A 48 -8.565 -10.354 -6.383 1.00 1.64 O ATOM 748 CB ARG A 48 -11.553 -9.965 -5.773 1.00 0.95 C ATOM 749 CG ARG A 48 -12.216 -10.769 -6.884 1.00 1.22 C ATOM 750 CD ARG A 48 -11.196 -11.393 -7.826 1.00 1.72 C ATOM 751 NE ARG A 48 -11.840 -12.183 -8.873 1.00 2.25 N ATOM 752 CZ ARG A 48 -11.410 -13.379 -9.283 1.00 2.93 C ATOM 753 NH1 ARG A 48 -10.292 -13.900 -8.782 1.00 3.36 N ATOM 754 NH2 ARG A 48 -12.086 -14.043 -10.211 1.00 3.61 N ATOM 0 H ARG A 48 -11.125 -9.830 -3.227 1.00 0.81 H new ATOM 0 HA ARG A 48 -10.546 -11.785 -5.335 1.00 0.90 H new ATOM 0 HB2 ARG A 48 -12.318 -9.626 -5.075 1.00 0.95 H new ATOM 0 HB3 ARG A 48 -11.096 -9.074 -6.203 1.00 0.95 H new ATOM 0 HG2 ARG A 48 -12.831 -11.554 -6.445 1.00 1.22 H new ATOM 0 HG3 ARG A 48 -12.884 -10.121 -7.451 1.00 1.22 H new ATOM 0 HD2 ARG A 48 -10.593 -10.607 -8.282 1.00 1.72 H new ATOM 0 HD3 ARG A 48 -10.516 -12.028 -7.258 1.00 1.72 H new ATOM 0 HE ARG A 48 -12.671 -11.796 -9.319 1.00 2.25 H new ATOM 0 HH11 ARG A 48 -9.759 -13.385 -8.081 1.00 3.36 H new ATOM 0 HH12 ARG A 48 -9.969 -14.814 -9.099 1.00 3.36 H new ATOM 0 HH21 ARG A 48 -12.933 -13.640 -10.611 1.00 3.61 H new ATOM 0 HH22 ARG A 48 -11.758 -14.957 -10.525 1.00 3.61 H new ATOM 768 N PHE A 49 -8.566 -9.489 -4.307 1.00 0.49 N ATOM 769 CA PHE A 49 -7.220 -8.961 -4.400 1.00 0.42 C ATOM 770 C PHE A 49 -6.219 -10.102 -4.382 1.00 0.59 C ATOM 771 O PHE A 49 -6.478 -11.176 -3.847 1.00 1.46 O ATOM 772 CB PHE A 49 -6.938 -8.002 -3.244 1.00 0.35 C ATOM 773 CG PHE A 49 -5.554 -7.414 -3.239 1.00 0.32 C ATOM 774 CD1 PHE A 49 -5.097 -6.645 -4.299 1.00 0.40 C ATOM 775 CD2 PHE A 49 -4.706 -7.649 -2.170 1.00 0.27 C ATOM 776 CE1 PHE A 49 -3.818 -6.119 -4.287 1.00 0.42 C ATOM 777 CE2 PHE A 49 -3.425 -7.127 -2.154 1.00 0.30 C ATOM 778 CZ PHE A 49 -2.981 -6.361 -3.214 1.00 0.37 C ATOM 0 H PHE A 49 -9.039 -9.283 -3.427 1.00 0.49 H new ATOM 0 HA PHE A 49 -7.124 -8.411 -5.336 1.00 0.42 H new ATOM 0 HB2 PHE A 49 -7.663 -7.189 -3.279 1.00 0.35 H new ATOM 0 HB3 PHE A 49 -7.097 -8.531 -2.304 1.00 0.35 H new ATOM 0 HD1 PHE A 49 -5.746 -6.455 -5.141 1.00 0.40 H new ATOM 0 HD2 PHE A 49 -5.049 -8.247 -1.339 1.00 0.27 H new ATOM 0 HE1 PHE A 49 -3.473 -5.519 -5.116 1.00 0.42 H new ATOM 0 HE2 PHE A 49 -2.773 -7.318 -1.314 1.00 0.30 H new ATOM 0 HZ PHE A 49 -1.982 -5.952 -3.205 1.00 0.37 H new ATOM 788 N THR A 50 -5.076 -9.843 -4.948 1.00 0.46 N ATOM 789 CA THR A 50 -4.047 -10.848 -5.126 1.00 0.42 C ATOM 790 C THR A 50 -2.692 -10.171 -4.936 1.00 0.47 C ATOM 791 O THR A 50 -2.469 -9.076 -5.454 1.00 0.84 O ATOM 792 CB THR A 50 -4.156 -11.494 -6.528 1.00 0.42 C ATOM 793 OG1 THR A 50 -5.536 -11.572 -6.920 1.00 0.89 O ATOM 794 CG2 THR A 50 -3.571 -12.902 -6.539 1.00 0.82 C ATOM 0 H THR A 50 -4.821 -8.922 -5.305 1.00 0.46 H new ATOM 0 HA THR A 50 -4.166 -11.647 -4.394 1.00 0.42 H new ATOM 0 HB THR A 50 -3.593 -10.871 -7.224 1.00 0.42 H new ATOM 0 HG1 THR A 50 -5.601 -11.980 -7.809 1.00 0.89 H new ATOM 0 HG21 THR A 50 -3.664 -13.327 -7.539 1.00 0.82 H new ATOM 0 HG22 THR A 50 -2.519 -12.861 -6.258 1.00 0.82 H new ATOM 0 HG23 THR A 50 -4.112 -13.526 -5.828 1.00 0.82 H new ATOM 802 N MET A 51 -1.817 -10.803 -4.162 1.00 0.25 N ATOM 803 CA MET A 51 -0.592 -10.150 -3.681 1.00 0.24 C ATOM 804 C MET A 51 0.331 -9.667 -4.798 1.00 0.26 C ATOM 805 O MET A 51 0.465 -10.295 -5.844 1.00 0.29 O ATOM 806 CB MET A 51 0.195 -11.064 -2.732 1.00 0.25 C ATOM 807 CG MET A 51 0.699 -12.345 -3.357 1.00 0.31 C ATOM 808 SD MET A 51 1.536 -13.409 -2.162 1.00 0.50 S ATOM 809 CE MET A 51 0.386 -13.393 -0.781 1.00 1.00 C ATOM 0 H MET A 51 -1.928 -11.768 -3.851 1.00 0.25 H new ATOM 0 HA MET A 51 -0.938 -9.267 -3.144 1.00 0.24 H new ATOM 0 HB2 MET A 51 1.047 -10.509 -2.339 1.00 0.25 H new ATOM 0 HB3 MET A 51 -0.441 -11.316 -1.883 1.00 0.25 H new ATOM 0 HG2 MET A 51 -0.139 -12.886 -3.797 1.00 0.31 H new ATOM 0 HG3 MET A 51 1.385 -12.105 -4.169 1.00 0.31 H new ATOM 0 HE1 MET A 51 0.665 -14.167 -0.066 1.00 1.00 H new ATOM 0 HE2 MET A 51 0.418 -12.419 -0.292 1.00 1.00 H new ATOM 0 HE3 MET A 51 -0.623 -13.583 -1.146 1.00 1.00 H new ATOM 819 N TYR A 52 0.969 -8.533 -4.542 1.00 0.28 N ATOM 820 CA TYR A 52 1.980 -7.989 -5.426 1.00 0.32 C ATOM 821 C TYR A 52 3.281 -7.766 -4.654 1.00 0.30 C ATOM 822 O TYR A 52 3.316 -7.896 -3.428 1.00 0.30 O ATOM 823 CB TYR A 52 1.493 -6.670 -6.068 1.00 0.42 C ATOM 824 CG TYR A 52 1.037 -5.577 -5.099 1.00 0.48 C ATOM 825 CD1 TYR A 52 1.474 -5.532 -3.780 1.00 0.49 C ATOM 826 CD2 TYR A 52 0.174 -4.574 -5.527 1.00 0.61 C ATOM 827 CE1 TYR A 52 1.065 -4.531 -2.920 1.00 0.61 C ATOM 828 CE2 TYR A 52 -0.243 -3.570 -4.669 1.00 0.72 C ATOM 829 CZ TYR A 52 0.207 -3.554 -3.366 1.00 0.71 C ATOM 830 OH TYR A 52 -0.195 -2.554 -2.506 1.00 0.85 O ATOM 0 H TYR A 52 0.796 -7.966 -3.712 1.00 0.28 H new ATOM 0 HA TYR A 52 2.166 -8.704 -6.228 1.00 0.32 H new ATOM 0 HB2 TYR A 52 2.299 -6.269 -6.682 1.00 0.42 H new ATOM 0 HB3 TYR A 52 0.666 -6.900 -6.739 1.00 0.42 H new ATOM 0 HD1 TYR A 52 2.147 -6.296 -3.420 1.00 0.49 H new ATOM 0 HD2 TYR A 52 -0.178 -4.578 -6.548 1.00 0.61 H new ATOM 0 HE1 TYR A 52 1.419 -4.516 -1.900 1.00 0.61 H new ATOM 0 HE2 TYR A 52 -0.918 -2.803 -5.019 1.00 0.72 H new ATOM 0 HH TYR A 52 0.538 -2.335 -1.894 1.00 0.85 H new ATOM 840 N SER A 53 4.341 -7.436 -5.366 1.00 0.33 N ATOM 841 CA SER A 53 5.591 -7.065 -4.727 1.00 0.33 C ATOM 842 C SER A 53 5.880 -5.605 -4.998 1.00 0.37 C ATOM 843 O SER A 53 5.970 -5.198 -6.156 1.00 0.52 O ATOM 844 CB SER A 53 6.761 -7.909 -5.239 1.00 0.40 C ATOM 845 OG SER A 53 6.472 -9.286 -5.167 1.00 0.93 O ATOM 0 H SER A 53 4.363 -7.417 -6.386 1.00 0.33 H new ATOM 0 HA SER A 53 5.485 -7.243 -3.657 1.00 0.33 H new ATOM 0 HB2 SER A 53 6.984 -7.636 -6.270 1.00 0.40 H new ATOM 0 HB3 SER A 53 7.653 -7.692 -4.651 1.00 0.40 H new ATOM 0 HG SER A 53 6.753 -9.634 -4.295 1.00 0.93 H new ATOM 851 N THR A 54 5.989 -4.821 -3.941 1.00 0.31 N ATOM 852 CA THR A 54 6.413 -3.438 -4.070 1.00 0.33 C ATOM 853 C THR A 54 7.889 -3.350 -3.718 1.00 0.29 C ATOM 854 O THR A 54 8.269 -3.452 -2.552 1.00 0.27 O ATOM 855 CB THR A 54 5.598 -2.513 -3.152 1.00 0.37 C ATOM 856 OG1 THR A 54 4.239 -2.970 -3.100 1.00 0.43 O ATOM 857 CG2 THR A 54 5.622 -1.084 -3.674 1.00 0.43 C ATOM 0 H THR A 54 5.790 -5.117 -2.985 1.00 0.31 H new ATOM 0 HA THR A 54 6.246 -3.111 -5.096 1.00 0.33 H new ATOM 0 HB THR A 54 6.040 -2.534 -2.156 1.00 0.37 H new ATOM 0 HG1 THR A 54 3.775 -2.531 -2.357 1.00 0.43 H new ATOM 0 HG21 THR A 54 5.040 -0.445 -3.011 1.00 0.43 H new ATOM 0 HG22 THR A 54 6.651 -0.727 -3.711 1.00 0.43 H new ATOM 0 HG23 THR A 54 5.192 -1.055 -4.675 1.00 0.43 H new ATOM 865 N ILE A 55 8.720 -3.198 -4.736 1.00 0.30 N ATOM 866 CA ILE A 55 10.159 -3.170 -4.534 1.00 0.28 C ATOM 867 C ILE A 55 10.653 -1.743 -4.620 1.00 0.24 C ATOM 868 O ILE A 55 10.726 -1.180 -5.708 1.00 0.26 O ATOM 869 CB ILE A 55 10.928 -4.005 -5.583 1.00 0.34 C ATOM 870 CG1 ILE A 55 10.116 -5.224 -6.056 1.00 0.50 C ATOM 871 CG2 ILE A 55 12.283 -4.435 -5.021 1.00 0.32 C ATOM 872 CD1 ILE A 55 9.707 -6.179 -4.957 1.00 0.72 C ATOM 0 H ILE A 55 8.425 -3.093 -5.707 1.00 0.30 H new ATOM 0 HA ILE A 55 10.346 -3.602 -3.551 1.00 0.28 H new ATOM 0 HB ILE A 55 11.092 -3.375 -6.457 1.00 0.34 H new ATOM 0 HG12 ILE A 55 9.218 -4.870 -6.563 1.00 0.50 H new ATOM 0 HG13 ILE A 55 10.704 -5.771 -6.793 1.00 0.50 H new ATOM 0 HG21 ILE A 55 12.817 -5.023 -5.768 1.00 0.32 H new ATOM 0 HG22 ILE A 55 12.869 -3.551 -4.768 1.00 0.32 H new ATOM 0 HG23 ILE A 55 12.131 -5.038 -4.126 1.00 0.32 H new ATOM 0 HD11 ILE A 55 9.140 -7.005 -5.385 1.00 0.72 H new ATOM 0 HD12 ILE A 55 10.597 -6.568 -4.463 1.00 0.72 H new ATOM 0 HD13 ILE A 55 9.089 -5.653 -4.230 1.00 0.72 H new ATOM 884 N TYR A 56 10.977 -1.157 -3.485 1.00 0.25 N ATOM 885 CA TYR A 56 11.426 0.223 -3.456 1.00 0.27 C ATOM 886 C TYR A 56 12.920 0.281 -3.742 1.00 0.30 C ATOM 887 O TYR A 56 13.733 -0.077 -2.895 1.00 0.36 O ATOM 888 CB TYR A 56 11.148 0.870 -2.101 1.00 0.32 C ATOM 889 CG TYR A 56 9.879 0.406 -1.403 1.00 0.39 C ATOM 890 CD1 TYR A 56 8.640 0.371 -2.045 1.00 0.32 C ATOM 891 CD2 TYR A 56 9.926 0.026 -0.071 1.00 0.79 C ATOM 892 CE1 TYR A 56 7.504 -0.030 -1.371 1.00 0.43 C ATOM 893 CE2 TYR A 56 8.791 -0.380 0.600 1.00 1.01 C ATOM 894 CZ TYR A 56 7.584 -0.406 -0.054 1.00 0.79 C ATOM 895 OH TYR A 56 6.451 -0.808 0.612 1.00 1.02 O ATOM 0 H TYR A 56 10.939 -1.612 -2.573 1.00 0.25 H new ATOM 0 HA TYR A 56 10.875 0.772 -4.220 1.00 0.27 H new ATOM 0 HB2 TYR A 56 11.996 0.675 -1.444 1.00 0.32 H new ATOM 0 HB3 TYR A 56 11.093 1.950 -2.238 1.00 0.32 H new ATOM 0 HD1 TYR A 56 8.569 0.662 -3.083 1.00 0.32 H new ATOM 0 HD2 TYR A 56 10.870 0.048 0.452 1.00 0.79 H new ATOM 0 HE1 TYR A 56 6.552 -0.048 -1.881 1.00 0.43 H new ATOM 0 HE2 TYR A 56 8.852 -0.677 1.637 1.00 1.01 H new ATOM 0 HH TYR A 56 6.680 -1.042 1.536 1.00 1.02 H new ATOM 905 N GLU A 57 13.276 0.710 -4.938 1.00 0.33 N ATOM 906 CA GLU A 57 14.676 0.771 -5.336 1.00 0.41 C ATOM 907 C GLU A 57 15.214 2.192 -5.178 1.00 0.36 C ATOM 908 O GLU A 57 14.961 3.058 -6.011 1.00 0.42 O ATOM 909 CB GLU A 57 14.820 0.294 -6.784 1.00 0.52 C ATOM 910 CG GLU A 57 16.251 0.232 -7.284 1.00 1.13 C ATOM 911 CD GLU A 57 16.333 -0.285 -8.702 1.00 1.56 C ATOM 912 OE1 GLU A 57 16.327 -1.519 -8.890 1.00 1.84 O ATOM 913 OE2 GLU A 57 16.411 0.543 -9.634 1.00 2.33 O ATOM 0 H GLU A 57 12.618 1.022 -5.653 1.00 0.33 H new ATOM 0 HA GLU A 57 15.261 0.116 -4.690 1.00 0.41 H new ATOM 0 HB2 GLU A 57 14.373 -0.696 -6.874 1.00 0.52 H new ATOM 0 HB3 GLU A 57 14.250 0.960 -7.432 1.00 0.52 H new ATOM 0 HG2 GLU A 57 16.696 1.226 -7.234 1.00 1.13 H new ATOM 0 HG3 GLU A 57 16.837 -0.413 -6.629 1.00 1.13 H new ATOM 920 N LEU A 58 15.960 2.417 -4.106 1.00 0.41 N ATOM 921 CA LEU A 58 16.493 3.740 -3.794 1.00 0.42 C ATOM 922 C LEU A 58 17.509 4.191 -4.842 1.00 0.43 C ATOM 923 O LEU A 58 18.466 3.475 -5.147 1.00 0.60 O ATOM 924 CB LEU A 58 17.117 3.729 -2.393 1.00 0.62 C ATOM 925 CG LEU A 58 17.950 4.959 -2.012 1.00 0.58 C ATOM 926 CD1 LEU A 58 17.168 6.252 -2.201 1.00 1.24 C ATOM 927 CD2 LEU A 58 18.422 4.830 -0.575 1.00 1.24 C ATOM 0 H LEU A 58 16.213 1.695 -3.431 1.00 0.41 H new ATOM 0 HA LEU A 58 15.673 4.457 -3.810 1.00 0.42 H new ATOM 0 HB2 LEU A 58 16.316 3.618 -1.662 1.00 0.62 H new ATOM 0 HB3 LEU A 58 17.751 2.846 -2.307 1.00 0.62 H new ATOM 0 HG LEU A 58 18.813 5.003 -2.676 1.00 0.58 H new ATOM 0 HD11 LEU A 58 17.793 7.100 -1.920 1.00 1.24 H new ATOM 0 HD12 LEU A 58 16.873 6.349 -3.246 1.00 1.24 H new ATOM 0 HD13 LEU A 58 16.278 6.234 -1.572 1.00 1.24 H new ATOM 0 HD21 LEU A 58 19.014 5.705 -0.306 1.00 1.24 H new ATOM 0 HD22 LEU A 58 17.559 4.759 0.087 1.00 1.24 H new ATOM 0 HD23 LEU A 58 19.033 3.933 -0.472 1.00 1.24 H new ATOM 939 N GLN A 59 17.279 5.376 -5.390 1.00 0.37 N ATOM 940 CA GLN A 59 18.145 5.941 -6.408 1.00 0.48 C ATOM 941 C GLN A 59 18.952 7.114 -5.862 1.00 0.57 C ATOM 942 O GLN A 59 18.877 7.432 -4.674 1.00 0.58 O ATOM 943 CB GLN A 59 17.314 6.397 -7.607 1.00 0.53 C ATOM 944 CG GLN A 59 16.700 5.245 -8.386 1.00 1.13 C ATOM 945 CD GLN A 59 17.712 4.545 -9.269 1.00 1.75 C ATOM 946 OE1 GLN A 59 18.420 3.636 -8.831 1.00 2.50 O ATOM 947 NE2 GLN A 59 17.769 4.943 -10.530 1.00 2.33 N ATOM 0 H GLN A 59 16.488 5.969 -5.140 1.00 0.37 H new ATOM 0 HA GLN A 59 18.844 5.166 -6.723 1.00 0.48 H new ATOM 0 HB2 GLN A 59 16.519 7.056 -7.259 1.00 0.53 H new ATOM 0 HB3 GLN A 59 17.945 6.983 -8.275 1.00 0.53 H new ATOM 0 HG2 GLN A 59 16.270 4.526 -7.689 1.00 1.13 H new ATOM 0 HG3 GLN A 59 15.882 5.620 -9.001 1.00 1.13 H new ATOM 0 HE21 GLN A 59 17.166 5.699 -10.854 1.00 2.33 H new ATOM 0 HE22 GLN A 59 18.416 4.493 -11.178 1.00 2.33 H new ATOM 956 N GLU A 60 19.707 7.755 -6.741 1.00 0.69 N ATOM 957 CA GLU A 60 20.526 8.911 -6.386 1.00 0.82 C ATOM 958 C GLU A 60 19.704 10.048 -5.765 1.00 0.75 C ATOM 959 O GLU A 60 20.217 10.830 -4.968 1.00 0.89 O ATOM 960 CB GLU A 60 21.241 9.422 -7.637 1.00 1.05 C ATOM 961 CG GLU A 60 20.306 9.598 -8.825 1.00 1.11 C ATOM 962 CD GLU A 60 21.005 10.128 -10.056 1.00 1.47 C ATOM 963 OE1 GLU A 60 21.818 9.388 -10.645 1.00 1.73 O ATOM 964 OE2 GLU A 60 20.761 11.291 -10.433 1.00 1.79 O ATOM 0 H GLU A 60 19.771 7.490 -7.724 1.00 0.69 H new ATOM 0 HA GLU A 60 21.246 8.586 -5.635 1.00 0.82 H new ATOM 0 HB2 GLU A 60 21.718 10.376 -7.412 1.00 1.05 H new ATOM 0 HB3 GLU A 60 22.034 8.725 -7.906 1.00 1.05 H new ATOM 0 HG2 GLU A 60 19.844 8.639 -9.061 1.00 1.11 H new ATOM 0 HG3 GLU A 60 19.502 10.280 -8.549 1.00 1.11 H new ATOM 971 N ASP A 61 18.427 10.121 -6.117 1.00 0.64 N ATOM 972 CA ASP A 61 17.587 11.255 -5.731 1.00 0.70 C ATOM 973 C ASP A 61 16.584 10.851 -4.650 1.00 0.54 C ATOM 974 O ASP A 61 15.535 11.477 -4.503 1.00 0.50 O ATOM 975 CB ASP A 61 16.854 11.777 -6.975 1.00 0.92 C ATOM 976 CG ASP A 61 16.152 13.105 -6.760 1.00 1.18 C ATOM 977 OD1 ASP A 61 16.848 14.127 -6.605 1.00 1.41 O ATOM 978 OD2 ASP A 61 14.900 13.136 -6.775 1.00 1.26 O ATOM 0 H ASP A 61 17.947 9.410 -6.669 1.00 0.64 H new ATOM 0 HA ASP A 61 18.217 12.043 -5.318 1.00 0.70 H new ATOM 0 HB2 ASP A 61 17.570 11.883 -7.790 1.00 0.92 H new ATOM 0 HB3 ASP A 61 16.120 11.036 -7.291 1.00 0.92 H new ATOM 983 N ASN A 62 16.918 9.793 -3.896 1.00 0.52 N ATOM 984 CA ASN A 62 16.008 9.179 -2.909 1.00 0.46 C ATOM 985 C ASN A 62 14.610 8.977 -3.471 1.00 0.36 C ATOM 986 O ASN A 62 13.625 8.924 -2.736 1.00 0.41 O ATOM 987 CB ASN A 62 15.950 9.914 -1.553 1.00 0.57 C ATOM 988 CG ASN A 62 16.092 11.425 -1.620 1.00 0.70 C ATOM 989 OD1 ASN A 62 17.201 11.960 -1.550 1.00 1.36 O ATOM 990 ND2 ASN A 62 14.972 12.123 -1.734 1.00 1.35 N ATOM 0 H ASN A 62 17.828 9.336 -3.951 1.00 0.52 H new ATOM 0 HA ASN A 62 16.446 8.202 -2.704 1.00 0.46 H new ATOM 0 HB2 ASN A 62 15.001 9.677 -1.072 1.00 0.57 H new ATOM 0 HB3 ASN A 62 16.739 9.521 -0.913 1.00 0.57 H new ATOM 0 HD21 ASN A 62 15.007 13.142 -1.767 1.00 1.35 H new ATOM 0 HD22 ASN A 62 14.074 11.642 -1.789 1.00 1.35 H new ATOM 997 N SER A 63 14.540 8.868 -4.782 1.00 0.34 N ATOM 998 CA SER A 63 13.342 8.445 -5.454 1.00 0.30 C ATOM 999 C SER A 63 13.471 6.960 -5.715 1.00 0.29 C ATOM 1000 O SER A 63 14.463 6.510 -6.289 1.00 0.31 O ATOM 1001 CB SER A 63 13.166 9.222 -6.759 1.00 0.35 C ATOM 1002 OG SER A 63 14.359 9.207 -7.531 1.00 0.96 O ATOM 0 H SER A 63 15.319 9.073 -5.408 1.00 0.34 H new ATOM 0 HA SER A 63 12.461 8.641 -4.842 1.00 0.30 H new ATOM 0 HB2 SER A 63 12.350 8.787 -7.337 1.00 0.35 H new ATOM 0 HB3 SER A 63 12.886 10.252 -6.537 1.00 0.35 H new ATOM 0 HG SER A 63 14.800 8.337 -7.435 1.00 0.96 H new ATOM 1008 N TYR A 64 12.508 6.191 -5.272 1.00 0.28 N ATOM 1009 CA TYR A 64 12.608 4.759 -5.398 1.00 0.28 C ATOM 1010 C TYR A 64 12.009 4.308 -6.718 1.00 0.29 C ATOM 1011 O TYR A 64 10.910 4.728 -7.081 1.00 0.30 O ATOM 1012 CB TYR A 64 11.857 4.072 -4.251 1.00 0.28 C ATOM 1013 CG TYR A 64 12.224 4.546 -2.853 1.00 0.31 C ATOM 1014 CD1 TYR A 64 13.509 4.978 -2.536 1.00 0.31 C ATOM 1015 CD2 TYR A 64 11.272 4.542 -1.843 1.00 0.39 C ATOM 1016 CE1 TYR A 64 13.829 5.393 -1.249 1.00 0.36 C ATOM 1017 CE2 TYR A 64 11.580 4.955 -0.564 1.00 0.45 C ATOM 1018 CZ TYR A 64 12.855 5.378 -0.271 1.00 0.42 C ATOM 1019 OH TYR A 64 13.159 5.784 1.006 1.00 0.49 O ATOM 0 H TYR A 64 11.655 6.528 -4.826 1.00 0.28 H new ATOM 0 HA TYR A 64 13.662 4.484 -5.360 1.00 0.28 H new ATOM 0 HB2 TYR A 64 10.788 4.223 -4.398 1.00 0.28 H new ATOM 0 HB3 TYR A 64 12.039 2.999 -4.312 1.00 0.28 H new ATOM 0 HD1 TYR A 64 14.269 4.991 -3.303 1.00 0.31 H new ATOM 0 HD2 TYR A 64 10.269 4.208 -2.064 1.00 0.39 H new ATOM 0 HE1 TYR A 64 14.830 5.724 -1.016 1.00 0.36 H new ATOM 0 HE2 TYR A 64 10.822 4.946 0.205 1.00 0.45 H new ATOM 0 HH TYR A 64 12.361 5.713 1.571 1.00 0.49 H new ATOM 1029 N ASN A 65 12.730 3.452 -7.433 1.00 0.32 N ATOM 1030 CA ASN A 65 12.144 2.737 -8.549 1.00 0.36 C ATOM 1031 C ASN A 65 11.344 1.612 -7.959 1.00 0.32 C ATOM 1032 O ASN A 65 11.897 0.592 -7.557 1.00 0.37 O ATOM 1033 CB ASN A 65 13.192 2.154 -9.504 1.00 0.48 C ATOM 1034 CG ASN A 65 14.004 3.199 -10.242 1.00 1.24 C ATOM 1035 OD1 ASN A 65 13.531 4.305 -10.509 1.00 2.02 O ATOM 1036 ND2 ASN A 65 15.236 2.853 -10.587 1.00 1.96 N ATOM 0 H ASN A 65 13.712 3.241 -7.258 1.00 0.32 H new ATOM 0 HA ASN A 65 11.540 3.429 -9.136 1.00 0.36 H new ATOM 0 HB2 ASN A 65 13.870 1.516 -8.937 1.00 0.48 H new ATOM 0 HB3 ASN A 65 12.690 1.518 -10.233 1.00 0.48 H new ATOM 0 HD21 ASN A 65 15.828 3.512 -11.092 1.00 1.96 H new ATOM 0 HD22 ASN A 65 15.592 1.927 -10.348 1.00 1.96 H new ATOM 1043 N VAL A 66 10.059 1.800 -7.877 1.00 0.31 N ATOM 1044 CA VAL A 66 9.224 0.868 -7.176 1.00 0.29 C ATOM 1045 C VAL A 66 8.502 -0.050 -8.126 1.00 0.31 C ATOM 1046 O VAL A 66 7.619 0.358 -8.881 1.00 0.37 O ATOM 1047 CB VAL A 66 8.248 1.596 -6.240 1.00 0.37 C ATOM 1048 CG1 VAL A 66 7.002 0.763 -5.950 1.00 0.67 C ATOM 1049 CG2 VAL A 66 8.977 1.935 -4.953 1.00 0.65 C ATOM 0 H VAL A 66 9.565 2.592 -8.288 1.00 0.31 H new ATOM 0 HA VAL A 66 9.870 0.245 -6.557 1.00 0.29 H new ATOM 0 HB VAL A 66 7.905 2.507 -6.730 1.00 0.37 H new ATOM 0 HG11 VAL A 66 6.341 1.317 -5.284 1.00 0.67 H new ATOM 0 HG12 VAL A 66 6.482 0.550 -6.884 1.00 0.67 H new ATOM 0 HG13 VAL A 66 7.293 -0.174 -5.475 1.00 0.67 H new ATOM 0 HG21 VAL A 66 8.298 2.453 -4.276 1.00 0.65 H new ATOM 0 HG22 VAL A 66 9.329 1.017 -4.482 1.00 0.65 H new ATOM 0 HG23 VAL A 66 9.828 2.578 -5.176 1.00 0.65 H new ATOM 1059 N THR A 67 8.905 -1.295 -8.083 1.00 0.34 N ATOM 1060 CA THR A 67 8.286 -2.315 -8.882 1.00 0.39 C ATOM 1061 C THR A 67 6.938 -2.663 -8.274 1.00 0.47 C ATOM 1062 O THR A 67 6.846 -2.901 -7.074 1.00 0.71 O ATOM 1063 CB THR A 67 9.167 -3.580 -8.945 1.00 0.48 C ATOM 1064 OG1 THR A 67 10.364 -3.320 -9.690 1.00 0.58 O ATOM 1065 CG2 THR A 67 8.419 -4.750 -9.570 1.00 0.74 C ATOM 0 H THR A 67 9.669 -1.626 -7.494 1.00 0.34 H new ATOM 0 HA THR A 67 8.159 -1.940 -9.897 1.00 0.39 H new ATOM 0 HB THR A 67 9.429 -3.848 -7.921 1.00 0.48 H new ATOM 0 HG1 THR A 67 10.913 -4.131 -9.720 1.00 0.58 H new ATOM 0 HG21 THR A 67 9.069 -5.624 -9.598 1.00 0.74 H new ATOM 0 HG22 THR A 67 7.534 -4.975 -8.975 1.00 0.74 H new ATOM 0 HG23 THR A 67 8.118 -4.489 -10.584 1.00 0.74 H new ATOM 1073 N SER A 68 5.893 -2.611 -9.077 1.00 0.44 N ATOM 1074 CA SER A 68 4.595 -3.103 -8.667 1.00 0.52 C ATOM 1075 C SER A 68 4.149 -4.180 -9.645 1.00 0.53 C ATOM 1076 O SER A 68 3.555 -3.891 -10.680 1.00 0.65 O ATOM 1077 CB SER A 68 3.579 -1.959 -8.624 1.00 0.60 C ATOM 1078 OG SER A 68 4.063 -0.883 -7.833 1.00 1.14 O ATOM 0 H SER A 68 5.920 -2.230 -10.023 1.00 0.44 H new ATOM 0 HA SER A 68 4.662 -3.527 -7.665 1.00 0.52 H new ATOM 0 HB2 SER A 68 3.376 -1.609 -9.636 1.00 0.60 H new ATOM 0 HB3 SER A 68 2.635 -2.320 -8.216 1.00 0.60 H new ATOM 0 HG SER A 68 3.866 -1.057 -6.889 1.00 1.14 H new ATOM 1084 N ILE A 69 4.475 -5.420 -9.329 1.00 0.53 N ATOM 1085 CA ILE A 69 4.147 -6.533 -10.205 1.00 0.53 C ATOM 1086 C ILE A 69 2.696 -6.936 -10.067 1.00 0.60 C ATOM 1087 O ILE A 69 2.183 -7.112 -8.966 1.00 0.74 O ATOM 1088 CB ILE A 69 5.056 -7.760 -9.951 1.00 0.54 C ATOM 1089 CG1 ILE A 69 4.412 -9.042 -10.491 1.00 0.66 C ATOM 1090 CG2 ILE A 69 5.379 -7.907 -8.475 1.00 0.57 C ATOM 1091 CD1 ILE A 69 5.111 -9.609 -11.699 1.00 0.78 C ATOM 0 H ILE A 69 4.966 -5.683 -8.474 1.00 0.53 H new ATOM 0 HA ILE A 69 4.321 -6.185 -11.223 1.00 0.53 H new ATOM 0 HB ILE A 69 5.990 -7.595 -10.487 1.00 0.54 H new ATOM 0 HG12 ILE A 69 4.403 -9.794 -9.702 1.00 0.66 H new ATOM 0 HG13 ILE A 69 3.373 -8.836 -10.747 1.00 0.66 H new ATOM 0 HG21 ILE A 69 6.019 -8.777 -8.327 1.00 0.57 H new ATOM 0 HG22 ILE A 69 5.895 -7.013 -8.125 1.00 0.57 H new ATOM 0 HG23 ILE A 69 4.455 -8.036 -7.911 1.00 0.57 H new ATOM 0 HD11 ILE A 69 4.599 -10.515 -12.024 1.00 0.78 H new ATOM 0 HD12 ILE A 69 5.097 -8.875 -12.505 1.00 0.78 H new ATOM 0 HD13 ILE A 69 6.143 -9.848 -11.443 1.00 0.78 H new ATOM 1103 N LEU A 70 2.051 -7.069 -11.206 1.00 0.56 N ATOM 1104 CA LEU A 70 0.670 -7.486 -11.269 1.00 0.64 C ATOM 1105 C LEU A 70 0.442 -8.234 -12.563 1.00 0.64 C ATOM 1106 O LEU A 70 1.202 -8.086 -13.523 1.00 0.67 O ATOM 1107 CB LEU A 70 -0.281 -6.279 -11.167 1.00 0.74 C ATOM 1108 CG LEU A 70 0.379 -4.885 -11.132 1.00 0.66 C ATOM 1109 CD1 LEU A 70 0.930 -4.489 -12.496 1.00 0.96 C ATOM 1110 CD2 LEU A 70 -0.611 -3.840 -10.644 1.00 1.18 C ATOM 0 H LEU A 70 2.473 -6.890 -12.117 1.00 0.56 H new ATOM 0 HA LEU A 70 0.457 -8.141 -10.424 1.00 0.64 H new ATOM 0 HB2 LEU A 70 -0.966 -6.311 -12.014 1.00 0.74 H new ATOM 0 HB3 LEU A 70 -0.883 -6.394 -10.266 1.00 0.74 H new ATOM 0 HG LEU A 70 1.216 -4.936 -10.436 1.00 0.66 H new ATOM 0 HD11 LEU A 70 1.387 -3.502 -12.431 1.00 0.96 H new ATOM 0 HD12 LEU A 70 1.679 -5.216 -12.811 1.00 0.96 H new ATOM 0 HD13 LEU A 70 0.119 -4.466 -13.224 1.00 0.96 H new ATOM 0 HD21 LEU A 70 -0.129 -2.863 -10.625 1.00 1.18 H new ATOM 0 HD22 LEU A 70 -1.468 -3.809 -11.316 1.00 1.18 H new ATOM 0 HD23 LEU A 70 -0.947 -4.098 -9.640 1.00 1.18 H new ATOM 1122 N VAL A 71 -0.586 -9.052 -12.583 1.00 0.70 N ATOM 1123 CA VAL A 71 -0.867 -9.872 -13.739 1.00 0.74 C ATOM 1124 C VAL A 71 -1.747 -9.095 -14.707 1.00 0.83 C ATOM 1125 O VAL A 71 -2.953 -8.956 -14.502 1.00 0.99 O ATOM 1126 CB VAL A 71 -1.541 -11.194 -13.323 1.00 0.82 C ATOM 1127 CG1 VAL A 71 -1.595 -12.164 -14.491 1.00 0.88 C ATOM 1128 CG2 VAL A 71 -0.808 -11.809 -12.133 1.00 0.84 C ATOM 0 H VAL A 71 -1.242 -9.167 -11.811 1.00 0.70 H new ATOM 0 HA VAL A 71 0.071 -10.124 -14.234 1.00 0.74 H new ATOM 0 HB VAL A 71 -2.566 -10.981 -13.021 1.00 0.82 H new ATOM 0 HG11 VAL A 71 -2.075 -13.090 -14.173 1.00 0.88 H new ATOM 0 HG12 VAL A 71 -2.166 -11.720 -15.306 1.00 0.88 H new ATOM 0 HG13 VAL A 71 -0.582 -12.379 -14.833 1.00 0.88 H new ATOM 0 HG21 VAL A 71 -1.294 -12.742 -11.849 1.00 0.84 H new ATOM 0 HG22 VAL A 71 0.228 -12.008 -12.407 1.00 0.84 H new ATOM 0 HG23 VAL A 71 -0.834 -11.116 -11.292 1.00 0.84 H new ATOM 1186 N GLY A 75 -0.548 -12.447 -18.718 1.00 0.97 N ATOM 1187 CA GLY A 75 0.803 -12.752 -18.290 1.00 0.88 C ATOM 1188 C GLY A 75 1.225 -11.915 -17.104 1.00 0.81 C ATOM 1189 O GLY A 75 0.400 -11.250 -16.482 1.00 0.81 O ATOM 0 HA2 GLY A 75 0.871 -13.808 -18.030 1.00 0.88 H new ATOM 0 HA3 GLY A 75 1.492 -12.582 -19.117 1.00 0.88 H new ATOM 1193 N CYS A 76 2.514 -11.894 -16.822 1.00 0.79 N ATOM 1194 CA CYS A 76 3.027 -11.193 -15.658 1.00 0.73 C ATOM 1195 C CYS A 76 3.821 -9.976 -16.120 1.00 0.75 C ATOM 1196 O CYS A 76 4.507 -10.033 -17.144 1.00 0.92 O ATOM 1197 CB CYS A 76 3.953 -12.113 -14.846 1.00 0.78 C ATOM 1198 SG CYS A 76 5.513 -12.551 -15.702 1.00 1.26 S ATOM 0 H CYS A 76 3.228 -12.356 -17.385 1.00 0.79 H new ATOM 0 HA CYS A 76 2.190 -10.885 -15.031 1.00 0.73 H new ATOM 0 HB2 CYS A 76 4.194 -11.625 -13.901 1.00 0.78 H new ATOM 0 HB3 CYS A 76 3.415 -13.029 -14.603 1.00 0.78 H new ATOM 1203 N ARG A 77 3.714 -8.869 -15.400 1.00 0.65 N ATOM 1204 CA ARG A 77 4.500 -7.696 -15.737 1.00 0.67 C ATOM 1205 C ARG A 77 4.759 -6.830 -14.513 1.00 0.57 C ATOM 1206 O ARG A 77 3.905 -6.695 -13.634 1.00 0.56 O ATOM 1207 CB ARG A 77 3.812 -6.868 -16.826 1.00 0.79 C ATOM 1208 CG ARG A 77 4.730 -5.815 -17.421 1.00 1.22 C ATOM 1209 CD ARG A 77 5.918 -6.459 -18.115 1.00 1.46 C ATOM 1210 NE ARG A 77 7.075 -5.569 -18.183 1.00 2.14 N ATOM 1211 CZ ARG A 77 8.325 -5.998 -18.358 1.00 2.81 C ATOM 1212 NH1 ARG A 77 8.557 -7.287 -18.596 1.00 3.04 N ATOM 1213 NH2 ARG A 77 9.336 -5.137 -18.337 1.00 3.68 N ATOM 0 H ARG A 77 3.101 -8.760 -14.592 1.00 0.65 H new ATOM 0 HA ARG A 77 5.459 -8.049 -16.117 1.00 0.67 H new ATOM 0 HB2 ARG A 77 3.464 -7.532 -17.618 1.00 0.79 H new ATOM 0 HB3 ARG A 77 2.931 -6.383 -16.407 1.00 0.79 H new ATOM 0 HG2 ARG A 77 4.175 -5.204 -18.133 1.00 1.22 H new ATOM 0 HG3 ARG A 77 5.082 -5.147 -16.634 1.00 1.22 H new ATOM 0 HD2 ARG A 77 6.195 -7.370 -17.584 1.00 1.46 H new ATOM 0 HD3 ARG A 77 5.630 -6.753 -19.124 1.00 1.46 H new ATOM 0 HE ARG A 77 6.918 -4.565 -18.092 1.00 2.14 H new ATOM 0 HH11 ARG A 77 7.779 -7.945 -18.644 1.00 3.04 H new ATOM 0 HH12 ARG A 77 9.513 -7.617 -18.730 1.00 3.04 H new ATOM 0 HH21 ARG A 77 9.157 -4.144 -18.187 1.00 3.68 H new ATOM 0 HH22 ARG A 77 10.291 -5.469 -18.471 1.00 3.68 H new ATOM 1227 N TYR A 78 5.951 -6.255 -14.463 1.00 0.56 N ATOM 1228 CA TYR A 78 6.321 -5.338 -13.401 1.00 0.48 C ATOM 1229 C TYR A 78 5.943 -3.916 -13.789 1.00 0.47 C ATOM 1230 O TYR A 78 6.546 -3.327 -14.686 1.00 0.53 O ATOM 1231 CB TYR A 78 7.827 -5.423 -13.123 1.00 0.47 C ATOM 1232 CG TYR A 78 8.288 -6.804 -12.716 1.00 0.53 C ATOM 1233 CD1 TYR A 78 7.909 -7.358 -11.498 1.00 0.47 C ATOM 1234 CD2 TYR A 78 9.097 -7.559 -13.554 1.00 0.70 C ATOM 1235 CE1 TYR A 78 8.324 -8.620 -11.130 1.00 0.54 C ATOM 1236 CE2 TYR A 78 9.516 -8.823 -13.191 1.00 0.79 C ATOM 1237 CZ TYR A 78 9.127 -9.349 -11.978 1.00 0.70 C ATOM 1238 OH TYR A 78 9.539 -10.607 -11.612 1.00 0.80 O ATOM 0 H TYR A 78 6.684 -6.411 -15.155 1.00 0.56 H new ATOM 0 HA TYR A 78 5.783 -5.616 -12.495 1.00 0.48 H new ATOM 0 HB2 TYR A 78 8.371 -5.115 -14.016 1.00 0.47 H new ATOM 0 HB3 TYR A 78 8.083 -4.716 -12.334 1.00 0.47 H new ATOM 0 HD1 TYR A 78 7.279 -6.790 -10.829 1.00 0.47 H new ATOM 0 HD2 TYR A 78 9.404 -7.151 -14.506 1.00 0.70 H new ATOM 0 HE1 TYR A 78 8.020 -9.035 -10.180 1.00 0.54 H new ATOM 0 HE2 TYR A 78 10.146 -9.397 -13.854 1.00 0.79 H new ATOM 0 HH TYR A 78 8.808 -11.070 -11.152 1.00 0.80 H new ATOM 1248 N TRP A 79 4.919 -3.384 -13.143 1.00 0.47 N ATOM 1249 CA TRP A 79 4.531 -1.999 -13.341 1.00 0.51 C ATOM 1250 C TRP A 79 5.316 -1.140 -12.364 1.00 0.46 C ATOM 1251 O TRP A 79 5.041 -1.123 -11.169 1.00 0.45 O ATOM 1252 CB TRP A 79 3.013 -1.843 -13.156 1.00 0.61 C ATOM 1253 CG TRP A 79 2.542 -0.421 -13.056 1.00 0.72 C ATOM 1254 CD1 TRP A 79 1.873 0.147 -12.009 1.00 1.33 C ATOM 1255 CD2 TRP A 79 2.707 0.613 -14.035 1.00 1.44 C ATOM 1256 NE1 TRP A 79 1.603 1.466 -12.282 1.00 1.23 N ATOM 1257 CE2 TRP A 79 2.108 1.777 -13.517 1.00 1.32 C ATOM 1258 CE3 TRP A 79 3.301 0.669 -15.300 1.00 2.64 C ATOM 1259 CZ2 TRP A 79 2.086 2.980 -14.220 1.00 2.09 C ATOM 1260 CZ3 TRP A 79 3.280 1.863 -15.994 1.00 3.53 C ATOM 1261 CH2 TRP A 79 2.676 3.005 -15.453 1.00 3.20 C ATOM 0 H TRP A 79 4.340 -3.893 -12.475 1.00 0.47 H new ATOM 0 HA TRP A 79 4.761 -1.675 -14.356 1.00 0.51 H new ATOM 0 HB2 TRP A 79 2.506 -2.322 -13.994 1.00 0.61 H new ATOM 0 HB3 TRP A 79 2.713 -2.376 -12.254 1.00 0.61 H new ATOM 0 HD1 TRP A 79 1.597 -0.366 -11.100 1.00 1.33 H new ATOM 0 HE1 TRP A 79 1.107 2.109 -11.665 1.00 1.23 H new ATOM 0 HE3 TRP A 79 3.768 -0.206 -15.727 1.00 2.64 H new ATOM 0 HZ2 TRP A 79 1.619 3.861 -13.805 1.00 2.09 H new ATOM 0 HZ3 TRP A 79 3.737 1.917 -16.971 1.00 3.53 H new ATOM 0 HH2 TRP A 79 2.676 3.924 -16.021 1.00 3.20 H new ATOM 1272 N ILE A 80 6.307 -0.438 -12.876 1.00 0.46 N ATOM 1273 CA ILE A 80 7.303 0.183 -12.027 1.00 0.42 C ATOM 1274 C ILE A 80 7.127 1.693 -11.967 1.00 0.42 C ATOM 1275 O ILE A 80 7.082 2.379 -12.991 1.00 0.49 O ATOM 1276 CB ILE A 80 8.714 -0.219 -12.507 1.00 0.43 C ATOM 1277 CG1 ILE A 80 8.794 -1.750 -12.498 1.00 0.48 C ATOM 1278 CG2 ILE A 80 9.800 0.394 -11.625 1.00 0.40 C ATOM 1279 CD1 ILE A 80 9.995 -2.332 -13.205 1.00 0.55 C ATOM 0 H ILE A 80 6.444 -0.284 -13.875 1.00 0.46 H new ATOM 0 HA ILE A 80 7.171 -0.178 -11.007 1.00 0.42 H new ATOM 0 HB ILE A 80 8.884 0.161 -13.515 1.00 0.43 H new ATOM 0 HG12 ILE A 80 8.800 -2.092 -11.463 1.00 0.48 H new ATOM 0 HG13 ILE A 80 7.891 -2.148 -12.960 1.00 0.48 H new ATOM 0 HG21 ILE A 80 10.781 0.090 -11.991 1.00 0.40 H new ATOM 0 HG22 ILE A 80 9.722 1.481 -11.654 1.00 0.40 H new ATOM 0 HG23 ILE A 80 9.673 0.049 -10.599 1.00 0.40 H new ATOM 0 HD11 ILE A 80 9.961 -3.420 -13.144 1.00 0.55 H new ATOM 0 HD12 ILE A 80 9.984 -2.027 -14.251 1.00 0.55 H new ATOM 0 HD13 ILE A 80 10.907 -1.970 -12.731 1.00 0.55 H new ATOM 1291 N ARG A 81 7.009 2.182 -10.742 1.00 0.41 N ATOM 1292 CA ARG A 81 6.736 3.580 -10.462 1.00 0.44 C ATOM 1293 C ARG A 81 7.868 4.192 -9.656 1.00 0.35 C ATOM 1294 O ARG A 81 8.919 3.583 -9.482 1.00 0.42 O ATOM 1295 CB ARG A 81 5.425 3.706 -9.687 1.00 0.57 C ATOM 1296 CG ARG A 81 4.195 3.594 -10.563 1.00 1.21 C ATOM 1297 CD ARG A 81 2.925 3.510 -9.736 1.00 1.97 C ATOM 1298 NE ARG A 81 2.867 2.279 -8.948 1.00 2.78 N ATOM 1299 CZ ARG A 81 1.799 1.883 -8.254 1.00 3.79 C ATOM 1300 NH1 ARG A 81 0.699 2.628 -8.237 1.00 4.16 N ATOM 1301 NH2 ARG A 81 1.835 0.739 -7.579 1.00 4.76 N ATOM 0 H ARG A 81 7.102 1.609 -9.903 1.00 0.41 H new ATOM 0 HA ARG A 81 6.651 4.115 -11.408 1.00 0.44 H new ATOM 0 HB2 ARG A 81 5.388 2.931 -8.921 1.00 0.57 H new ATOM 0 HB3 ARG A 81 5.408 4.666 -9.170 1.00 0.57 H new ATOM 0 HG2 ARG A 81 4.141 4.457 -11.227 1.00 1.21 H new ATOM 0 HG3 ARG A 81 4.277 2.710 -11.195 1.00 1.21 H new ATOM 0 HD2 ARG A 81 2.868 4.371 -9.069 1.00 1.97 H new ATOM 0 HD3 ARG A 81 2.059 3.560 -10.395 1.00 1.97 H new ATOM 0 HE ARG A 81 3.696 1.685 -8.928 1.00 2.78 H new ATOM 0 HH11 ARG A 81 0.669 3.506 -8.756 1.00 4.16 H new ATOM 0 HH12 ARG A 81 -0.116 2.322 -7.705 1.00 4.16 H new ATOM 0 HH21 ARG A 81 2.678 0.165 -7.592 1.00 4.76 H new ATOM 0 HH22 ARG A 81 1.019 0.434 -7.048 1.00 4.76 H new ATOM 1315 N THR A 82 7.652 5.402 -9.176 1.00 0.41 N ATOM 1316 CA THR A 82 8.645 6.086 -8.370 1.00 0.35 C ATOM 1317 C THR A 82 8.036 6.526 -7.043 1.00 0.32 C ATOM 1318 O THR A 82 6.966 7.117 -7.021 1.00 0.36 O ATOM 1319 CB THR A 82 9.210 7.309 -9.123 1.00 0.38 C ATOM 1320 OG1 THR A 82 9.724 6.893 -10.397 1.00 0.45 O ATOM 1321 CG2 THR A 82 10.318 7.999 -8.329 1.00 0.36 C ATOM 0 H THR A 82 6.795 5.933 -9.331 1.00 0.41 H new ATOM 0 HA THR A 82 9.462 5.392 -8.173 1.00 0.35 H new ATOM 0 HB THR A 82 8.398 8.023 -9.259 1.00 0.38 H new ATOM 0 HG1 THR A 82 10.081 7.670 -10.875 1.00 0.45 H new ATOM 0 HG21 THR A 82 10.690 8.855 -8.892 1.00 0.36 H new ATOM 0 HG22 THR A 82 9.922 8.339 -7.372 1.00 0.36 H new ATOM 0 HG23 THR A 82 11.133 7.296 -8.156 1.00 0.36 H new ATOM 1329 N PHE A 83 8.698 6.204 -5.942 1.00 0.27 N ATOM 1330 CA PHE A 83 8.279 6.692 -4.630 1.00 0.26 C ATOM 1331 C PHE A 83 9.307 7.665 -4.092 1.00 0.26 C ATOM 1332 O PHE A 83 10.503 7.405 -4.129 1.00 0.36 O ATOM 1333 CB PHE A 83 8.092 5.548 -3.624 1.00 0.26 C ATOM 1334 CG PHE A 83 6.742 4.880 -3.655 1.00 0.29 C ATOM 1335 CD1 PHE A 83 5.575 5.597 -3.451 1.00 0.37 C ATOM 1336 CD2 PHE A 83 6.653 3.524 -3.872 1.00 0.33 C ATOM 1337 CE1 PHE A 83 4.346 4.961 -3.473 1.00 0.44 C ATOM 1338 CE2 PHE A 83 5.438 2.876 -3.896 1.00 0.38 C ATOM 1339 CZ PHE A 83 4.276 3.596 -3.694 1.00 0.42 C ATOM 0 H PHE A 83 9.526 5.609 -5.927 1.00 0.27 H new ATOM 0 HA PHE A 83 7.318 7.190 -4.759 1.00 0.26 H new ATOM 0 HB2 PHE A 83 8.857 4.794 -3.810 1.00 0.26 H new ATOM 0 HB3 PHE A 83 8.264 5.937 -2.620 1.00 0.26 H new ATOM 0 HD1 PHE A 83 5.624 6.661 -3.273 1.00 0.37 H new ATOM 0 HD2 PHE A 83 7.557 2.954 -4.027 1.00 0.33 H new ATOM 0 HE1 PHE A 83 3.441 5.530 -3.318 1.00 0.44 H new ATOM 0 HE2 PHE A 83 5.394 1.811 -4.072 1.00 0.38 H new ATOM 0 HZ PHE A 83 3.318 3.097 -3.708 1.00 0.42 H new ATOM 1349 N VAL A 84 8.829 8.780 -3.596 1.00 0.24 N ATOM 1350 CA VAL A 84 9.686 9.825 -3.079 1.00 0.24 C ATOM 1351 C VAL A 84 9.148 10.316 -1.744 1.00 0.24 C ATOM 1352 O VAL A 84 7.936 10.476 -1.576 1.00 0.27 O ATOM 1353 CB VAL A 84 9.777 11.016 -4.062 1.00 0.27 C ATOM 1354 CG1 VAL A 84 10.586 10.655 -5.297 1.00 0.30 C ATOM 1355 CG2 VAL A 84 8.390 11.474 -4.469 1.00 0.29 C ATOM 0 H VAL A 84 7.833 8.991 -3.538 1.00 0.24 H new ATOM 0 HA VAL A 84 10.685 9.408 -2.950 1.00 0.24 H new ATOM 0 HB VAL A 84 10.287 11.831 -3.547 1.00 0.27 H new ATOM 0 HG11 VAL A 84 10.630 11.514 -5.967 1.00 0.30 H new ATOM 0 HG12 VAL A 84 11.596 10.373 -5.001 1.00 0.30 H new ATOM 0 HG13 VAL A 84 10.112 9.818 -5.811 1.00 0.30 H new ATOM 0 HG21 VAL A 84 8.472 12.312 -5.161 1.00 0.29 H new ATOM 0 HG22 VAL A 84 7.864 10.653 -4.955 1.00 0.29 H new ATOM 0 HG23 VAL A 84 7.836 11.787 -3.584 1.00 0.29 H new ATOM 1365 N PRO A 85 10.034 10.525 -0.765 1.00 0.35 N ATOM 1366 CA PRO A 85 9.656 11.098 0.526 1.00 0.34 C ATOM 1367 C PRO A 85 8.998 12.460 0.344 1.00 0.38 C ATOM 1368 O PRO A 85 9.444 13.269 -0.472 1.00 0.52 O ATOM 1369 CB PRO A 85 10.991 11.246 1.264 1.00 0.49 C ATOM 1370 CG PRO A 85 11.906 10.274 0.602 1.00 0.78 C ATOM 1371 CD PRO A 85 11.473 10.215 -0.834 1.00 0.56 C ATOM 0 HA PRO A 85 8.936 10.480 1.063 1.00 0.34 H new ATOM 0 HB2 PRO A 85 11.374 12.264 1.188 1.00 0.49 H new ATOM 0 HB3 PRO A 85 10.882 11.025 2.326 1.00 0.49 H new ATOM 0 HG2 PRO A 85 12.944 10.596 0.684 1.00 0.78 H new ATOM 0 HG3 PRO A 85 11.839 9.292 1.071 1.00 0.78 H new ATOM 0 HD2 PRO A 85 12.012 10.938 -1.447 1.00 0.56 H new ATOM 0 HD3 PRO A 85 11.653 9.232 -1.269 1.00 0.56 H new ATOM 1379 N SER A 86 7.922 12.691 1.081 1.00 0.34 N ATOM 1380 CA SER A 86 7.217 13.960 1.032 1.00 0.46 C ATOM 1381 C SER A 86 8.049 15.050 1.727 1.00 0.58 C ATOM 1382 O SER A 86 9.270 15.102 1.583 1.00 0.93 O ATOM 1383 CB SER A 86 5.845 13.813 1.690 1.00 0.53 C ATOM 1384 OG SER A 86 5.060 14.987 1.527 1.00 1.27 O ATOM 0 H SER A 86 7.517 12.010 1.724 1.00 0.34 H new ATOM 0 HA SER A 86 7.071 14.256 -0.007 1.00 0.46 H new ATOM 0 HB2 SER A 86 5.322 12.961 1.256 1.00 0.53 H new ATOM 0 HB3 SER A 86 5.970 13.603 2.752 1.00 0.53 H new ATOM 0 HG SER A 86 4.593 15.187 2.365 1.00 1.27 H new ATOM 1390 N SER A 87 7.394 15.906 2.490 1.00 0.75 N ATOM 1391 CA SER A 87 8.083 16.985 3.173 1.00 0.90 C ATOM 1392 C SER A 87 8.798 16.448 4.412 1.00 0.79 C ATOM 1393 O SER A 87 9.606 17.136 5.032 1.00 0.89 O ATOM 1394 CB SER A 87 7.080 18.069 3.556 1.00 1.12 C ATOM 1395 OG SER A 87 6.221 18.372 2.465 1.00 1.70 O ATOM 0 H SER A 87 6.387 15.875 2.652 1.00 0.75 H new ATOM 0 HA SER A 87 8.830 17.418 2.508 1.00 0.90 H new ATOM 0 HB2 SER A 87 6.488 17.738 4.409 1.00 1.12 H new ATOM 0 HB3 SER A 87 7.611 18.969 3.867 1.00 1.12 H new ATOM 0 HG SER A 87 5.585 19.068 2.733 1.00 1.70 H new ATOM 1401 N ARG A 88 8.496 15.203 4.757 1.00 0.64 N ATOM 1402 CA ARG A 88 9.113 14.546 5.897 1.00 0.58 C ATOM 1403 C ARG A 88 9.242 13.048 5.631 1.00 0.49 C ATOM 1404 O ARG A 88 8.340 12.436 5.046 1.00 0.46 O ATOM 1405 CB ARG A 88 8.295 14.775 7.178 1.00 0.66 C ATOM 1406 CG ARG A 88 6.908 14.139 7.167 1.00 0.75 C ATOM 1407 CD ARG A 88 5.903 14.954 6.377 1.00 1.11 C ATOM 1408 NE ARG A 88 5.893 16.355 6.780 1.00 1.51 N ATOM 1409 CZ ARG A 88 5.152 17.288 6.191 1.00 1.84 C ATOM 1410 NH1 ARG A 88 4.300 16.952 5.231 1.00 1.95 N ATOM 1411 NH2 ARG A 88 5.261 18.554 6.565 1.00 2.59 N ATOM 0 H ARG A 88 7.821 14.625 4.257 1.00 0.64 H new ATOM 0 HA ARG A 88 10.104 14.978 6.039 1.00 0.58 H new ATOM 0 HB2 ARG A 88 8.855 14.381 8.026 1.00 0.66 H new ATOM 0 HB3 ARG A 88 8.187 15.848 7.338 1.00 0.66 H new ATOM 0 HG2 ARG A 88 6.974 13.138 6.741 1.00 0.75 H new ATOM 0 HG3 ARG A 88 6.555 14.027 8.192 1.00 0.75 H new ATOM 0 HD2 ARG A 88 6.136 14.885 5.315 1.00 1.11 H new ATOM 0 HD3 ARG A 88 4.908 14.531 6.513 1.00 1.11 H new ATOM 0 HE ARG A 88 6.489 16.635 7.559 1.00 1.51 H new ATOM 0 HH11 ARG A 88 4.213 15.977 4.944 1.00 1.95 H new ATOM 0 HH12 ARG A 88 3.732 17.669 4.780 1.00 1.95 H new ATOM 0 HH21 ARG A 88 5.914 18.813 7.305 1.00 2.59 H new ATOM 0 HH22 ARG A 88 4.692 19.270 6.113 1.00 2.59 H new ATOM 1425 N PRO A 89 10.377 12.450 6.029 1.00 0.49 N ATOM 1426 CA PRO A 89 10.589 11.003 5.930 1.00 0.48 C ATOM 1427 C PRO A 89 9.486 10.228 6.640 1.00 0.48 C ATOM 1428 O PRO A 89 9.092 10.567 7.757 1.00 0.62 O ATOM 1429 CB PRO A 89 11.935 10.783 6.623 1.00 0.58 C ATOM 1430 CG PRO A 89 12.631 12.096 6.522 1.00 0.70 C ATOM 1431 CD PRO A 89 11.550 13.138 6.599 1.00 0.56 C ATOM 0 HA PRO A 89 10.577 10.653 4.898 1.00 0.48 H new ATOM 0 HB2 PRO A 89 11.801 10.485 7.663 1.00 0.58 H new ATOM 0 HB3 PRO A 89 12.507 9.993 6.136 1.00 0.58 H new ATOM 0 HG2 PRO A 89 13.352 12.220 7.330 1.00 0.70 H new ATOM 0 HG3 PRO A 89 13.184 12.175 5.586 1.00 0.70 H new ATOM 0 HD2 PRO A 89 11.370 13.457 7.626 1.00 0.56 H new ATOM 0 HD3 PRO A 89 11.810 14.030 6.029 1.00 0.56 H new ATOM 1439 N GLY A 90 8.981 9.203 5.979 1.00 0.41 N ATOM 1440 CA GLY A 90 7.864 8.459 6.508 1.00 0.42 C ATOM 1441 C GLY A 90 6.639 8.631 5.640 1.00 0.38 C ATOM 1442 O GLY A 90 5.988 7.657 5.278 1.00 0.43 O ATOM 0 H GLY A 90 9.328 8.871 5.079 1.00 0.41 H new ATOM 0 HA2 GLY A 90 8.124 7.402 6.571 1.00 0.42 H new ATOM 0 HA3 GLY A 90 7.646 8.795 7.522 1.00 0.42 H new ATOM 1446 N GLN A 91 6.351 9.878 5.284 1.00 0.33 N ATOM 1447 CA GLN A 91 5.240 10.184 4.390 1.00 0.31 C ATOM 1448 C GLN A 91 5.715 9.997 2.964 1.00 0.26 C ATOM 1449 O GLN A 91 6.638 10.690 2.524 1.00 0.30 O ATOM 1450 CB GLN A 91 4.759 11.624 4.583 1.00 0.39 C ATOM 1451 CG GLN A 91 3.678 12.024 3.590 1.00 0.61 C ATOM 1452 CD GLN A 91 3.160 13.433 3.794 1.00 0.61 C ATOM 1453 OE1 GLN A 91 3.879 14.319 4.261 1.00 1.11 O ATOM 1454 NE2 GLN A 91 1.906 13.646 3.448 1.00 1.03 N ATOM 0 H GLN A 91 6.873 10.695 5.602 1.00 0.33 H new ATOM 0 HA GLN A 91 4.406 9.518 4.612 1.00 0.31 H new ATOM 0 HB2 GLN A 91 4.376 11.741 5.597 1.00 0.39 H new ATOM 0 HB3 GLN A 91 5.607 12.302 4.482 1.00 0.39 H new ATOM 0 HG2 GLN A 91 4.074 11.934 2.578 1.00 0.61 H new ATOM 0 HG3 GLN A 91 2.846 11.325 3.670 1.00 0.61 H new ATOM 0 HE21 GLN A 91 1.346 12.884 3.065 1.00 1.03 H new ATOM 0 HE22 GLN A 91 1.496 14.573 3.563 1.00 1.03 H new ATOM 1463 N PHE A 92 5.125 9.071 2.236 1.00 0.24 N ATOM 1464 CA PHE A 92 5.638 8.779 0.910 1.00 0.24 C ATOM 1465 C PHE A 92 4.697 9.236 -0.185 1.00 0.26 C ATOM 1466 O PHE A 92 3.493 9.001 -0.141 1.00 0.35 O ATOM 1467 CB PHE A 92 5.977 7.300 0.757 1.00 0.31 C ATOM 1468 CG PHE A 92 7.195 6.902 1.540 1.00 0.33 C ATOM 1469 CD1 PHE A 92 8.401 7.554 1.333 1.00 0.32 C ATOM 1470 CD2 PHE A 92 7.143 5.879 2.470 1.00 0.42 C ATOM 1471 CE1 PHE A 92 9.530 7.195 2.038 1.00 0.40 C ATOM 1472 CE2 PHE A 92 8.270 5.517 3.183 1.00 0.50 C ATOM 1473 CZ PHE A 92 9.465 6.174 2.966 1.00 0.48 C ATOM 0 H PHE A 92 4.316 8.522 2.526 1.00 0.24 H new ATOM 0 HA PHE A 92 6.559 9.351 0.800 1.00 0.24 H new ATOM 0 HB2 PHE A 92 5.127 6.701 1.084 1.00 0.31 H new ATOM 0 HB3 PHE A 92 6.138 7.075 -0.297 1.00 0.31 H new ATOM 0 HD1 PHE A 92 8.457 8.354 0.610 1.00 0.32 H new ATOM 0 HD2 PHE A 92 6.212 5.358 2.640 1.00 0.42 H new ATOM 0 HE1 PHE A 92 10.463 7.711 1.865 1.00 0.40 H new ATOM 0 HE2 PHE A 92 8.216 4.720 3.910 1.00 0.50 H new ATOM 0 HZ PHE A 92 10.347 5.890 3.521 1.00 0.48 H new ATOM 1483 N THR A 93 5.280 9.910 -1.156 1.00 0.23 N ATOM 1484 CA THR A 93 4.571 10.376 -2.327 1.00 0.27 C ATOM 1485 C THR A 93 5.144 9.666 -3.551 1.00 0.26 C ATOM 1486 O THR A 93 6.100 8.901 -3.427 1.00 0.25 O ATOM 1487 CB THR A 93 4.706 11.913 -2.492 1.00 0.35 C ATOM 1488 OG1 THR A 93 6.081 12.275 -2.660 1.00 1.29 O ATOM 1489 CG2 THR A 93 4.159 12.653 -1.280 1.00 0.92 C ATOM 0 H THR A 93 6.271 10.151 -1.152 1.00 0.23 H new ATOM 0 HA THR A 93 3.510 10.150 -2.218 1.00 0.27 H new ATOM 0 HB THR A 93 4.130 12.195 -3.373 1.00 0.35 H new ATOM 0 HG1 THR A 93 6.650 11.617 -2.209 1.00 1.29 H new ATOM 0 HG21 THR A 93 4.269 13.727 -1.429 1.00 0.92 H new ATOM 0 HG22 THR A 93 3.104 12.411 -1.152 1.00 0.92 H new ATOM 0 HG23 THR A 93 4.711 12.352 -0.390 1.00 0.92 H new ATOM 1497 N LEU A 94 4.580 9.908 -4.720 1.00 0.34 N ATOM 1498 CA LEU A 94 5.106 9.303 -5.942 1.00 0.37 C ATOM 1499 C LEU A 94 6.048 10.274 -6.620 1.00 0.34 C ATOM 1500 O LEU A 94 5.784 11.475 -6.683 1.00 0.39 O ATOM 1501 CB LEU A 94 3.986 8.950 -6.935 1.00 0.54 C ATOM 1502 CG LEU A 94 3.137 7.718 -6.622 1.00 0.50 C ATOM 1503 CD1 LEU A 94 3.946 6.443 -6.797 1.00 0.88 C ATOM 1504 CD2 LEU A 94 2.577 7.805 -5.222 1.00 0.75 C ATOM 0 H LEU A 94 3.768 10.510 -4.855 1.00 0.34 H new ATOM 0 HA LEU A 94 5.623 8.387 -5.656 1.00 0.37 H new ATOM 0 HB2 LEU A 94 3.319 9.809 -7.011 1.00 0.54 H new ATOM 0 HB3 LEU A 94 4.437 8.808 -7.917 1.00 0.54 H new ATOM 0 HG LEU A 94 2.305 7.689 -7.326 1.00 0.50 H new ATOM 0 HD11 LEU A 94 3.320 5.581 -6.568 1.00 0.88 H new ATOM 0 HD12 LEU A 94 4.298 6.374 -7.826 1.00 0.88 H new ATOM 0 HD13 LEU A 94 4.802 6.459 -6.122 1.00 0.88 H new ATOM 0 HD21 LEU A 94 1.975 6.920 -5.015 1.00 0.75 H new ATOM 0 HD22 LEU A 94 3.396 7.862 -4.505 1.00 0.75 H new ATOM 0 HD23 LEU A 94 1.955 8.696 -5.134 1.00 0.75 H new ATOM 1516 N GLY A 95 7.148 9.719 -7.124 1.00 0.32 N ATOM 1517 CA GLY A 95 8.170 10.491 -7.801 1.00 0.34 C ATOM 1518 C GLY A 95 7.584 11.379 -8.874 1.00 0.46 C ATOM 1519 O GLY A 95 8.070 12.479 -9.124 1.00 0.88 O ATOM 0 H GLY A 95 7.350 8.721 -7.071 1.00 0.32 H new ATOM 0 HA2 GLY A 95 8.704 11.103 -7.074 1.00 0.34 H new ATOM 0 HA3 GLY A 95 8.900 9.816 -8.247 1.00 0.34 H new ATOM 1523 N ASN A 96 6.526 10.884 -9.501 1.00 0.57 N ATOM 1524 CA ASN A 96 5.778 11.646 -10.482 1.00 0.71 C ATOM 1525 C ASN A 96 4.287 11.644 -10.149 1.00 0.61 C ATOM 1526 O ASN A 96 3.451 11.645 -11.048 1.00 0.66 O ATOM 1527 CB ASN A 96 5.997 11.086 -11.895 1.00 0.98 C ATOM 1528 CG ASN A 96 7.363 11.424 -12.459 1.00 1.89 C ATOM 1529 OD1 ASN A 96 7.931 12.476 -12.165 1.00 2.72 O ATOM 1530 ND2 ASN A 96 7.905 10.531 -13.271 1.00 2.42 N ATOM 0 H ASN A 96 6.165 9.943 -9.342 1.00 0.57 H new ATOM 0 HA ASN A 96 6.144 12.672 -10.452 1.00 0.71 H new ATOM 0 HB2 ASN A 96 5.876 10.003 -11.874 1.00 0.98 H new ATOM 0 HB3 ASN A 96 5.228 11.479 -12.559 1.00 0.98 H new ATOM 0 HD21 ASN A 96 8.825 10.703 -13.677 1.00 2.42 H new ATOM 0 HD22 ASN A 96 7.403 9.671 -13.491 1.00 2.42 H new ATOM 1537 N ILE A 97 3.951 11.662 -8.852 1.00 0.55 N ATOM 1538 CA ILE A 97 2.543 11.697 -8.421 1.00 0.57 C ATOM 1539 C ILE A 97 1.860 12.923 -9.002 1.00 0.74 C ATOM 1540 O ILE A 97 0.669 12.923 -9.307 1.00 0.88 O ATOM 1541 CB ILE A 97 2.390 11.742 -6.876 1.00 0.54 C ATOM 1542 CG1 ILE A 97 0.911 11.681 -6.488 1.00 0.68 C ATOM 1543 CG2 ILE A 97 3.046 12.998 -6.297 1.00 0.60 C ATOM 1544 CD1 ILE A 97 0.262 10.355 -6.820 1.00 1.20 C ATOM 0 H ILE A 97 4.626 11.653 -8.088 1.00 0.55 H new ATOM 0 HA ILE A 97 2.082 10.778 -8.783 1.00 0.57 H new ATOM 0 HB ILE A 97 2.898 10.873 -6.457 1.00 0.54 H new ATOM 0 HG12 ILE A 97 0.815 11.868 -5.418 1.00 0.68 H new ATOM 0 HG13 ILE A 97 0.374 12.479 -7.001 1.00 0.68 H new ATOM 0 HG21 ILE A 97 2.925 13.005 -5.214 1.00 0.60 H new ATOM 0 HG22 ILE A 97 4.108 13.000 -6.543 1.00 0.60 H new ATOM 0 HG23 ILE A 97 2.573 13.884 -6.721 1.00 0.60 H new ATOM 0 HD11 ILE A 97 -0.786 10.377 -6.520 1.00 1.20 H new ATOM 0 HD12 ILE A 97 0.328 10.176 -7.893 1.00 1.20 H new ATOM 0 HD13 ILE A 97 0.775 9.555 -6.286 1.00 1.20 H new ATOM 1556 N HIS A 98 2.655 13.954 -9.185 1.00 0.85 N ATOM 1557 CA HIS A 98 2.170 15.238 -9.632 1.00 1.12 C ATOM 1558 C HIS A 98 1.979 15.252 -11.147 1.00 1.14 C ATOM 1559 O HIS A 98 1.672 16.284 -11.736 1.00 1.38 O ATOM 1560 CB HIS A 98 3.139 16.323 -9.157 1.00 1.38 C ATOM 1561 CG HIS A 98 4.542 16.203 -9.691 1.00 2.01 C ATOM 1562 ND1 HIS A 98 5.604 15.800 -8.909 1.00 2.88 N ATOM 1563 CD2 HIS A 98 5.060 16.439 -10.924 1.00 2.69 C ATOM 1564 CE1 HIS A 98 6.708 15.792 -9.629 1.00 3.63 C ATOM 1565 NE2 HIS A 98 6.408 16.177 -10.856 1.00 3.56 N ATOM 0 H HIS A 98 3.662 13.923 -9.026 1.00 0.85 H new ATOM 0 HA HIS A 98 1.189 15.437 -9.200 1.00 1.12 H new ATOM 0 HB2 HIS A 98 2.740 17.296 -9.443 1.00 1.38 H new ATOM 0 HB3 HIS A 98 3.178 16.302 -8.068 1.00 1.38 H new ATOM 0 HD2 HIS A 98 4.515 16.771 -11.795 1.00 2.69 H new ATOM 0 HE1 HIS A 98 7.691 15.517 -9.276 1.00 3.63 H new ATOM 0 HE2 HIS A 98 7.069 16.266 -11.628 1.00 3.56 H new ATOM 1574 N SER A 99 2.172 14.098 -11.771 1.00 0.99 N ATOM 1575 CA SER A 99 1.932 13.953 -13.192 1.00 1.16 C ATOM 1576 C SER A 99 0.605 13.224 -13.415 1.00 1.22 C ATOM 1577 O SER A 99 0.208 12.948 -14.548 1.00 1.30 O ATOM 1578 CB SER A 99 3.087 13.190 -13.851 1.00 1.24 C ATOM 1579 OG SER A 99 3.148 13.448 -15.245 1.00 1.79 O ATOM 0 H SER A 99 2.496 13.248 -11.309 1.00 0.99 H new ATOM 0 HA SER A 99 1.873 14.940 -13.650 1.00 1.16 H new ATOM 0 HB2 SER A 99 4.029 13.478 -13.384 1.00 1.24 H new ATOM 0 HB3 SER A 99 2.962 12.120 -13.682 1.00 1.24 H new ATOM 0 HG SER A 99 2.242 13.447 -15.618 1.00 1.79 H new ATOM 1585 N TYR A 100 -0.075 12.914 -12.314 1.00 1.23 N ATOM 1586 CA TYR A 100 -1.385 12.276 -12.365 1.00 1.30 C ATOM 1587 C TYR A 100 -2.479 13.342 -12.413 1.00 1.17 C ATOM 1588 O TYR A 100 -2.416 14.357 -11.716 1.00 1.30 O ATOM 1589 CB TYR A 100 -1.587 11.361 -11.160 1.00 1.63 C ATOM 1590 CG TYR A 100 -0.710 10.123 -11.146 1.00 2.74 C ATOM 1591 CD1 TYR A 100 0.662 10.210 -10.956 1.00 2.85 C ATOM 1592 CD2 TYR A 100 -1.266 8.859 -11.304 1.00 3.75 C ATOM 1593 CE1 TYR A 100 1.455 9.079 -10.926 1.00 3.91 C ATOM 1594 CE2 TYR A 100 -0.480 7.722 -11.277 1.00 4.83 C ATOM 1595 CZ TYR A 100 0.881 7.839 -11.088 1.00 4.89 C ATOM 1596 OH TYR A 100 1.670 6.710 -11.050 1.00 5.98 O ATOM 0 H TYR A 100 0.264 13.097 -11.369 1.00 1.23 H new ATOM 0 HA TYR A 100 -1.442 11.667 -13.267 1.00 1.30 H new ATOM 0 HB2 TYR A 100 -1.398 11.933 -10.252 1.00 1.63 H new ATOM 0 HB3 TYR A 100 -2.631 11.050 -11.129 1.00 1.63 H new ATOM 0 HD1 TYR A 100 1.119 11.180 -10.829 1.00 2.85 H new ATOM 0 HD2 TYR A 100 -2.332 8.763 -11.451 1.00 3.75 H new ATOM 0 HE1 TYR A 100 2.521 9.168 -10.776 1.00 3.91 H new ATOM 0 HE2 TYR A 100 -0.929 6.748 -11.403 1.00 4.83 H new ATOM 0 HH TYR A 100 1.111 5.916 -11.180 1.00 5.98 H new ATOM 1606 N PRO A 101 -3.494 13.103 -13.261 1.00 1.09 N ATOM 1607 CA PRO A 101 -4.523 14.100 -13.609 1.00 1.04 C ATOM 1608 C PRO A 101 -5.489 14.455 -12.479 1.00 0.89 C ATOM 1609 O PRO A 101 -5.747 15.630 -12.227 1.00 0.94 O ATOM 1610 CB PRO A 101 -5.289 13.429 -14.753 1.00 1.19 C ATOM 1611 CG PRO A 101 -5.081 11.968 -14.547 1.00 1.28 C ATOM 1612 CD PRO A 101 -3.702 11.829 -13.974 1.00 1.21 C ATOM 0 HA PRO A 101 -4.054 15.053 -13.856 1.00 1.04 H new ATOM 0 HB2 PRO A 101 -6.348 13.686 -14.724 1.00 1.19 H new ATOM 0 HB3 PRO A 101 -4.910 13.749 -15.724 1.00 1.19 H new ATOM 0 HG2 PRO A 101 -5.829 11.558 -13.869 1.00 1.28 H new ATOM 0 HG3 PRO A 101 -5.171 11.424 -15.487 1.00 1.28 H new ATOM 0 HD2 PRO A 101 -3.632 10.976 -13.299 1.00 1.21 H new ATOM 0 HD3 PRO A 101 -2.956 11.680 -14.755 1.00 1.21 H new ATOM 1620 N GLN A 102 -6.039 13.448 -11.813 1.00 0.82 N ATOM 1621 CA GLN A 102 -7.116 13.687 -10.858 1.00 0.74 C ATOM 1622 C GLN A 102 -6.644 13.531 -9.420 1.00 0.63 C ATOM 1623 O GLN A 102 -7.423 13.719 -8.487 1.00 0.59 O ATOM 1624 CB GLN A 102 -8.269 12.721 -11.114 1.00 0.83 C ATOM 1625 CG GLN A 102 -8.006 11.316 -10.605 1.00 0.98 C ATOM 1626 CD GLN A 102 -9.111 10.346 -10.968 1.00 1.30 C ATOM 1627 OE1 GLN A 102 -10.328 10.849 -11.096 1.00 1.95 O flip ATOM 1628 NE2 GLN A 102 -8.871 9.155 -11.140 1.00 1.73 N flip ATOM 0 H GLN A 102 -5.763 12.471 -11.913 1.00 0.82 H new ATOM 0 HA GLN A 102 -7.450 14.715 -10.998 1.00 0.74 H new ATOM 0 HB2 GLN A 102 -9.170 13.109 -10.638 1.00 0.83 H new ATOM 0 HB3 GLN A 102 -8.467 12.680 -12.185 1.00 0.83 H new ATOM 0 HG2 GLN A 102 -7.063 10.956 -11.016 1.00 0.98 H new ATOM 0 HG3 GLN A 102 -7.893 11.342 -9.521 1.00 0.98 H new ATOM 0 HE21 GLN A 102 -7.919 8.806 -11.032 1.00 1.73 H new ATOM 0 HE22 GLN A 102 -9.624 8.514 -11.391 1.00 1.73 H new ATOM 1637 N ILE A 103 -5.387 13.161 -9.242 1.00 0.60 N ATOM 1638 CA ILE A 103 -4.859 12.931 -7.915 1.00 0.51 C ATOM 1639 C ILE A 103 -4.678 14.248 -7.174 1.00 0.52 C ATOM 1640 O ILE A 103 -3.920 15.125 -7.590 1.00 0.65 O ATOM 1641 CB ILE A 103 -3.534 12.128 -7.933 1.00 0.54 C ATOM 1642 CG1 ILE A 103 -3.812 10.656 -8.267 1.00 0.63 C ATOM 1643 CG2 ILE A 103 -2.814 12.235 -6.590 1.00 0.43 C ATOM 1644 CD1 ILE A 103 -4.290 10.411 -9.684 1.00 1.10 C ATOM 0 H ILE A 103 -4.718 13.015 -9.998 1.00 0.60 H new ATOM 0 HA ILE A 103 -5.591 12.323 -7.384 1.00 0.51 H new ATOM 0 HB ILE A 103 -2.888 12.552 -8.702 1.00 0.54 H new ATOM 0 HG12 ILE A 103 -2.901 10.081 -8.100 1.00 0.63 H new ATOM 0 HG13 ILE A 103 -4.562 10.275 -7.573 1.00 0.63 H new ATOM 0 HG21 ILE A 103 -1.887 11.663 -6.628 1.00 0.43 H new ATOM 0 HG22 ILE A 103 -2.587 13.280 -6.381 1.00 0.43 H new ATOM 0 HG23 ILE A 103 -3.454 11.838 -5.802 1.00 0.43 H new ATOM 0 HD11 ILE A 103 -4.461 9.345 -9.831 1.00 1.10 H new ATOM 0 HD12 ILE A 103 -5.219 10.955 -9.854 1.00 1.10 H new ATOM 0 HD13 ILE A 103 -3.534 10.757 -10.388 1.00 1.10 H new ATOM 1656 N GLN A 104 -5.408 14.353 -6.081 1.00 0.45 N ATOM 1657 CA GLN A 104 -5.441 15.542 -5.250 1.00 0.48 C ATOM 1658 C GLN A 104 -4.225 15.555 -4.339 1.00 0.50 C ATOM 1659 O GLN A 104 -3.560 16.576 -4.178 1.00 0.63 O ATOM 1660 CB GLN A 104 -6.729 15.512 -4.431 1.00 0.46 C ATOM 1661 CG GLN A 104 -7.906 14.985 -5.236 1.00 0.43 C ATOM 1662 CD GLN A 104 -8.535 16.051 -6.109 1.00 0.52 C ATOM 1663 OE1 GLN A 104 -9.456 16.812 -5.545 1.00 1.40 O flip ATOM 1664 NE2 GLN A 104 -8.177 16.210 -7.273 1.00 0.98 N flip ATOM 0 H GLN A 104 -6.006 13.601 -5.739 1.00 0.45 H new ATOM 0 HA GLN A 104 -5.419 16.444 -5.862 1.00 0.48 H new ATOM 0 HB2 GLN A 104 -6.584 14.887 -3.550 1.00 0.46 H new ATOM 0 HB3 GLN A 104 -6.955 16.517 -4.075 1.00 0.46 H new ATOM 0 HG2 GLN A 104 -7.572 14.157 -5.862 1.00 0.43 H new ATOM 0 HG3 GLN A 104 -8.658 14.587 -4.555 1.00 0.43 H new ATOM 0 HE21 GLN A 104 -7.463 15.602 -7.674 1.00 0.98 H new ATOM 0 HE22 GLN A 104 -8.594 16.950 -7.838 1.00 0.98 H new ATOM 1673 N SER A 105 -3.952 14.396 -3.755 1.00 0.40 N ATOM 1674 CA SER A 105 -2.773 14.184 -2.937 1.00 0.41 C ATOM 1675 C SER A 105 -2.550 12.687 -2.786 1.00 0.36 C ATOM 1676 O SER A 105 -3.491 11.903 -2.959 1.00 0.39 O ATOM 1677 CB SER A 105 -2.930 14.845 -1.564 1.00 0.48 C ATOM 1678 OG SER A 105 -4.051 14.333 -0.857 1.00 1.13 O ATOM 0 H SER A 105 -4.549 13.573 -3.838 1.00 0.40 H new ATOM 0 HA SER A 105 -1.910 14.640 -3.422 1.00 0.41 H new ATOM 0 HB2 SER A 105 -2.026 14.684 -0.977 1.00 0.48 H new ATOM 0 HB3 SER A 105 -3.040 15.922 -1.690 1.00 0.48 H new ATOM 0 HG SER A 105 -4.585 13.769 -1.455 1.00 1.13 H new ATOM 1684 N TYR A 106 -1.326 12.285 -2.495 1.00 0.35 N ATOM 1685 CA TYR A 106 -1.030 10.879 -2.297 1.00 0.34 C ATOM 1686 C TYR A 106 0.042 10.719 -1.230 1.00 0.36 C ATOM 1687 O TYR A 106 1.201 11.071 -1.449 1.00 0.40 O ATOM 1688 CB TYR A 106 -0.588 10.227 -3.617 1.00 0.37 C ATOM 1689 CG TYR A 106 -0.609 8.718 -3.582 1.00 0.38 C ATOM 1690 CD1 TYR A 106 0.448 8.008 -3.043 1.00 0.41 C ATOM 1691 CD2 TYR A 106 -1.686 8.005 -4.082 1.00 0.39 C ATOM 1692 CE1 TYR A 106 0.435 6.625 -3.004 1.00 0.45 C ATOM 1693 CE2 TYR A 106 -1.709 6.622 -4.050 1.00 0.43 C ATOM 1694 CZ TYR A 106 -0.646 5.936 -3.510 1.00 0.46 C ATOM 1695 OH TYR A 106 -0.664 4.558 -3.482 1.00 0.52 O ATOM 0 H TYR A 106 -0.526 12.909 -2.391 1.00 0.35 H new ATOM 0 HA TYR A 106 -1.935 10.374 -1.960 1.00 0.34 H new ATOM 0 HB2 TYR A 106 -1.240 10.573 -4.419 1.00 0.37 H new ATOM 0 HB3 TYR A 106 0.421 10.563 -3.859 1.00 0.37 H new ATOM 0 HD1 TYR A 106 1.298 8.542 -2.646 1.00 0.41 H new ATOM 0 HD2 TYR A 106 -2.524 8.539 -4.505 1.00 0.39 H new ATOM 0 HE1 TYR A 106 1.269 6.087 -2.578 1.00 0.45 H new ATOM 0 HE2 TYR A 106 -2.557 6.084 -4.447 1.00 0.43 H new ATOM 0 HH TYR A 106 -1.500 4.234 -3.878 1.00 0.52 H new ATOM 1705 N ASP A 107 -0.357 10.198 -0.079 1.00 0.34 N ATOM 1706 CA ASP A 107 0.564 9.962 1.022 1.00 0.36 C ATOM 1707 C ASP A 107 0.435 8.533 1.525 1.00 0.38 C ATOM 1708 O ASP A 107 -0.646 8.075 1.880 1.00 0.46 O ATOM 1709 CB ASP A 107 0.350 10.966 2.178 1.00 0.48 C ATOM 1710 CG ASP A 107 -1.098 11.092 2.636 1.00 1.27 C ATOM 1711 OD1 ASP A 107 -1.511 10.315 3.527 1.00 2.25 O ATOM 1712 OD2 ASP A 107 -1.833 11.938 2.090 1.00 1.31 O ATOM 0 H ASP A 107 -1.321 9.929 0.117 1.00 0.34 H new ATOM 0 HA ASP A 107 1.575 10.113 0.642 1.00 0.36 H new ATOM 0 HB2 ASP A 107 0.963 10.662 3.027 1.00 0.48 H new ATOM 0 HB3 ASP A 107 0.706 11.947 1.863 1.00 0.48 H new ATOM 1717 N VAL A 108 1.542 7.816 1.501 1.00 0.38 N ATOM 1718 CA VAL A 108 1.601 6.466 2.037 1.00 0.44 C ATOM 1719 C VAL A 108 2.691 6.390 3.087 1.00 0.47 C ATOM 1720 O VAL A 108 3.866 6.627 2.816 1.00 0.58 O ATOM 1721 CB VAL A 108 1.814 5.401 0.929 1.00 0.48 C ATOM 1722 CG1 VAL A 108 2.206 6.077 -0.357 1.00 0.68 C ATOM 1723 CG2 VAL A 108 2.852 4.355 1.317 1.00 0.70 C ATOM 0 H VAL A 108 2.424 8.150 1.111 1.00 0.38 H new ATOM 0 HA VAL A 108 0.639 6.240 2.497 1.00 0.44 H new ATOM 0 HB VAL A 108 0.870 4.874 0.795 1.00 0.48 H new ATOM 0 HG11 VAL A 108 2.355 5.326 -1.132 1.00 0.68 H new ATOM 0 HG12 VAL A 108 1.416 6.763 -0.663 1.00 0.68 H new ATOM 0 HG13 VAL A 108 3.132 6.633 -0.208 1.00 0.68 H new ATOM 0 HG21 VAL A 108 2.962 3.634 0.507 1.00 0.70 H new ATOM 0 HG22 VAL A 108 3.809 4.843 1.501 1.00 0.70 H new ATOM 0 HG23 VAL A 108 2.528 3.839 2.221 1.00 0.70 H new ATOM 1733 N GLN A 109 2.279 6.132 4.300 1.00 0.44 N ATOM 1734 CA GLN A 109 3.188 6.101 5.415 1.00 0.50 C ATOM 1735 C GLN A 109 2.913 4.893 6.290 1.00 0.30 C ATOM 1736 O GLN A 109 1.765 4.470 6.447 1.00 0.29 O ATOM 1737 CB GLN A 109 3.058 7.396 6.214 1.00 0.85 C ATOM 1738 CG GLN A 109 1.630 7.898 6.363 1.00 0.92 C ATOM 1739 CD GLN A 109 1.059 8.506 5.099 1.00 2.08 C ATOM 1740 OE1 GLN A 109 1.791 9.074 4.288 1.00 2.86 O ATOM 1741 NE2 GLN A 109 -0.246 8.391 4.928 1.00 2.81 N ATOM 0 H GLN A 109 1.307 5.938 4.543 1.00 0.44 H new ATOM 0 HA GLN A 109 4.210 6.018 5.045 1.00 0.50 H new ATOM 0 HB2 GLN A 109 3.482 7.241 7.206 1.00 0.85 H new ATOM 0 HB3 GLN A 109 3.654 8.169 5.730 1.00 0.85 H new ATOM 0 HG2 GLN A 109 0.995 7.069 6.675 1.00 0.92 H new ATOM 0 HG3 GLN A 109 1.598 8.642 7.159 1.00 0.92 H new ATOM 0 HE21 GLN A 109 -0.812 7.911 5.628 1.00 2.81 H new ATOM 0 HE22 GLN A 109 -0.688 8.782 4.096 1.00 2.81 H new ATOM 1750 N VAL A 110 3.974 4.321 6.835 1.00 0.33 N ATOM 1751 CA VAL A 110 3.864 3.142 7.651 1.00 0.27 C ATOM 1752 C VAL A 110 3.576 3.503 9.098 1.00 0.30 C ATOM 1753 O VAL A 110 4.151 4.449 9.637 1.00 0.41 O ATOM 1754 CB VAL A 110 5.170 2.333 7.638 1.00 0.37 C ATOM 1755 CG1 VAL A 110 5.302 1.507 6.378 1.00 0.76 C ATOM 1756 CG2 VAL A 110 6.375 3.241 7.812 1.00 0.77 C ATOM 0 H VAL A 110 4.927 4.665 6.720 1.00 0.33 H new ATOM 0 HA VAL A 110 3.047 2.553 7.233 1.00 0.27 H new ATOM 0 HB VAL A 110 5.134 1.645 8.483 1.00 0.37 H new ATOM 0 HG11 VAL A 110 6.238 0.949 6.405 1.00 0.76 H new ATOM 0 HG12 VAL A 110 4.466 0.811 6.310 1.00 0.76 H new ATOM 0 HG13 VAL A 110 5.297 2.165 5.509 1.00 0.76 H new ATOM 0 HG21 VAL A 110 7.286 2.643 7.799 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.405 3.966 6.998 1.00 0.77 H new ATOM 0 HG23 VAL A 110 6.300 3.767 8.764 1.00 0.77 H new ATOM 1766 N ALA A 111 2.706 2.727 9.721 1.00 0.29 N ATOM 1767 CA ALA A 111 2.478 2.826 11.150 1.00 0.36 C ATOM 1768 C ALA A 111 3.657 2.211 11.889 1.00 0.37 C ATOM 1769 O ALA A 111 4.015 2.638 12.986 1.00 0.44 O ATOM 1770 CB ALA A 111 1.181 2.130 11.534 1.00 0.42 C ATOM 0 H ALA A 111 2.142 2.016 9.254 1.00 0.29 H new ATOM 0 HA ALA A 111 2.388 3.876 11.429 1.00 0.36 H new ATOM 0 HB1 ALA A 111 1.027 2.215 12.610 1.00 0.42 H new ATOM 0 HB2 ALA A 111 0.348 2.598 11.010 1.00 0.42 H new ATOM 0 HB3 ALA A 111 1.237 1.077 11.258 1.00 0.42 H new ATOM 1776 N ASP A 112 4.262 1.208 11.258 1.00 0.35 N ATOM 1777 CA ASP A 112 5.449 0.548 11.789 1.00 0.46 C ATOM 1778 C ASP A 112 6.117 -0.278 10.703 1.00 0.37 C ATOM 1779 O ASP A 112 5.452 -0.954 9.923 1.00 0.35 O ATOM 1780 CB ASP A 112 5.129 -0.319 13.013 1.00 0.67 C ATOM 1781 CG ASP A 112 3.907 -1.191 12.828 1.00 1.36 C ATOM 1782 OD1 ASP A 112 4.042 -2.274 12.217 1.00 1.88 O ATOM 1783 OD2 ASP A 112 2.812 -0.795 13.261 1.00 2.20 O ATOM 0 H ASP A 112 3.943 0.831 10.366 1.00 0.35 H new ATOM 0 HA ASP A 112 6.138 1.324 12.121 1.00 0.46 H new ATOM 0 HB2 ASP A 112 5.988 -0.952 13.235 1.00 0.67 H new ATOM 0 HB3 ASP A 112 4.978 0.327 13.877 1.00 0.67 H new ATOM 1788 N THR A 113 7.430 -0.149 10.618 1.00 0.37 N ATOM 1789 CA THR A 113 8.217 -0.849 9.620 1.00 0.36 C ATOM 1790 C THR A 113 9.492 -1.411 10.265 1.00 0.44 C ATOM 1791 O THR A 113 10.088 -0.762 11.131 1.00 0.55 O ATOM 1792 CB THR A 113 8.552 0.104 8.443 1.00 0.37 C ATOM 1793 OG1 THR A 113 9.359 -0.566 7.463 1.00 0.44 O ATOM 1794 CG2 THR A 113 9.273 1.358 8.946 1.00 0.51 C ATOM 0 H THR A 113 7.980 0.444 11.240 1.00 0.37 H new ATOM 0 HA THR A 113 7.641 -1.684 9.221 1.00 0.36 H new ATOM 0 HB THR A 113 7.613 0.405 7.978 1.00 0.37 H new ATOM 0 HG1 THR A 113 9.329 -0.068 6.619 1.00 0.44 H new ATOM 0 HG21 THR A 113 9.498 2.011 8.103 1.00 0.51 H new ATOM 0 HG22 THR A 113 8.634 1.886 9.654 1.00 0.51 H new ATOM 0 HG23 THR A 113 10.201 1.071 9.440 1.00 0.51 H new ATOM 1802 N ASP A 114 9.894 -2.617 9.870 1.00 0.43 N ATOM 1803 CA ASP A 114 11.098 -3.251 10.420 1.00 0.57 C ATOM 1804 C ASP A 114 11.884 -3.948 9.310 1.00 0.64 C ATOM 1805 O ASP A 114 11.411 -4.013 8.182 1.00 0.61 O ATOM 1806 CB ASP A 114 10.714 -4.246 11.528 1.00 0.60 C ATOM 1807 CG ASP A 114 11.909 -4.951 12.150 1.00 1.24 C ATOM 1808 OD1 ASP A 114 12.588 -4.344 13.010 1.00 1.17 O ATOM 1809 OD2 ASP A 114 12.171 -6.116 11.788 1.00 2.10 O ATOM 0 H ASP A 114 9.406 -3.178 9.171 1.00 0.43 H new ATOM 0 HA ASP A 114 11.735 -2.482 10.856 1.00 0.57 H new ATOM 0 HB2 ASP A 114 10.168 -3.716 12.308 1.00 0.60 H new ATOM 0 HB3 ASP A 114 10.036 -4.993 11.116 1.00 0.60 H new ATOM 1814 N TYR A 115 13.077 -4.456 9.609 1.00 0.84 N ATOM 1815 CA TYR A 115 13.890 -5.105 8.590 1.00 0.99 C ATOM 1816 C TYR A 115 13.319 -6.478 8.216 1.00 0.90 C ATOM 1817 O TYR A 115 13.140 -6.772 7.038 1.00 1.07 O ATOM 1818 CB TYR A 115 15.365 -5.219 9.034 1.00 1.25 C ATOM 1819 CG TYR A 115 15.626 -6.159 10.197 1.00 1.46 C ATOM 1820 CD1 TYR A 115 15.376 -5.770 11.507 1.00 1.77 C ATOM 1821 CD2 TYR A 115 16.140 -7.433 9.980 1.00 1.67 C ATOM 1822 CE1 TYR A 115 15.624 -6.626 12.566 1.00 2.16 C ATOM 1823 CE2 TYR A 115 16.389 -8.294 11.031 1.00 2.05 C ATOM 1824 CZ TYR A 115 16.130 -7.887 12.323 1.00 2.26 C ATOM 1825 OH TYR A 115 16.377 -8.747 13.372 1.00 2.75 O ATOM 0 H TYR A 115 13.497 -4.431 10.538 1.00 0.84 H new ATOM 0 HA TYR A 115 13.861 -4.478 7.699 1.00 0.99 H new ATOM 0 HB2 TYR A 115 15.958 -5.550 8.182 1.00 1.25 H new ATOM 0 HB3 TYR A 115 15.723 -4.226 9.305 1.00 1.25 H new ATOM 0 HD1 TYR A 115 14.982 -4.784 11.702 1.00 1.77 H new ATOM 0 HD2 TYR A 115 16.348 -7.755 8.970 1.00 1.67 H new ATOM 0 HE1 TYR A 115 15.422 -6.309 13.578 1.00 2.16 H new ATOM 0 HE2 TYR A 115 16.785 -9.281 10.842 1.00 2.05 H new ATOM 0 HH TYR A 115 16.730 -9.593 13.025 1.00 2.75 H new ATOM 1835 N ASP A 116 13.000 -7.300 9.218 1.00 0.77 N ATOM 1836 CA ASP A 116 12.531 -8.667 8.965 1.00 0.74 C ATOM 1837 C ASP A 116 11.082 -8.818 9.398 1.00 0.64 C ATOM 1838 O ASP A 116 10.316 -9.594 8.817 1.00 0.66 O ATOM 1839 CB ASP A 116 13.409 -9.690 9.696 1.00 0.82 C ATOM 1840 CG ASP A 116 13.185 -11.107 9.201 1.00 1.03 C ATOM 1841 OD1 ASP A 116 13.799 -11.501 8.187 1.00 1.46 O ATOM 1842 OD2 ASP A 116 12.378 -11.835 9.823 1.00 1.40 O ATOM 0 H ASP A 116 13.057 -7.047 10.205 1.00 0.77 H new ATOM 0 HA ASP A 116 12.601 -8.857 7.894 1.00 0.74 H new ATOM 0 HB2 ASP A 116 14.458 -9.424 9.564 1.00 0.82 H new ATOM 0 HB3 ASP A 116 13.201 -9.645 10.765 1.00 0.82 H new ATOM 1847 N GLN A 117 10.720 -8.068 10.429 1.00 0.59 N ATOM 1848 CA GLN A 117 9.340 -7.947 10.870 1.00 0.50 C ATOM 1849 C GLN A 117 8.501 -7.292 9.783 1.00 0.37 C ATOM 1850 O GLN A 117 9.007 -6.930 8.720 1.00 0.39 O ATOM 1851 CB GLN A 117 9.229 -7.164 12.179 1.00 0.56 C ATOM 1852 CG GLN A 117 9.835 -7.882 13.373 1.00 1.22 C ATOM 1853 CD GLN A 117 9.717 -7.090 14.661 1.00 1.68 C ATOM 1854 OE1 GLN A 117 8.671 -6.283 14.777 1.00 2.16 O flip ATOM 1855 NE2 GLN A 117 10.561 -7.204 15.549 1.00 2.51 N flip ATOM 0 H GLN A 117 11.380 -7.524 10.985 1.00 0.59 H new ATOM 0 HA GLN A 117 8.960 -8.951 11.059 1.00 0.50 H new ATOM 0 HB2 GLN A 117 9.722 -6.199 12.058 1.00 0.56 H new ATOM 0 HB3 GLN A 117 8.178 -6.962 12.383 1.00 0.56 H new ATOM 0 HG2 GLN A 117 9.342 -8.846 13.499 1.00 1.22 H new ATOM 0 HG3 GLN A 117 10.887 -8.085 13.173 1.00 1.22 H new ATOM 0 HE21 GLN A 117 11.352 -7.835 15.423 1.00 2.51 H new ATOM 0 HE22 GLN A 117 10.470 -6.667 16.411 1.00 2.51 H new ATOM 1864 N PHE A 118 7.226 -7.128 10.048 1.00 0.30 N ATOM 1865 CA PHE A 118 6.293 -6.724 9.022 1.00 0.25 C ATOM 1866 C PHE A 118 6.078 -5.225 9.091 1.00 0.26 C ATOM 1867 O PHE A 118 6.585 -4.555 9.992 1.00 0.40 O ATOM 1868 CB PHE A 118 4.949 -7.413 9.242 1.00 0.31 C ATOM 1869 CG PHE A 118 4.173 -6.884 10.421 1.00 0.30 C ATOM 1870 CD1 PHE A 118 4.756 -6.749 11.674 1.00 0.36 C ATOM 1871 CD2 PHE A 118 2.862 -6.499 10.256 1.00 0.32 C ATOM 1872 CE1 PHE A 118 4.036 -6.243 12.738 1.00 0.41 C ATOM 1873 CE2 PHE A 118 2.133 -5.987 11.315 1.00 0.38 C ATOM 1874 CZ PHE A 118 2.721 -5.860 12.558 1.00 0.42 C ATOM 0 H PHE A 118 6.810 -7.269 10.969 1.00 0.30 H new ATOM 0 HA PHE A 118 6.700 -7.002 8.050 1.00 0.25 H new ATOM 0 HB2 PHE A 118 4.344 -7.301 8.342 1.00 0.31 H new ATOM 0 HB3 PHE A 118 5.118 -8.481 9.381 1.00 0.31 H new ATOM 0 HD1 PHE A 118 5.785 -7.043 11.818 1.00 0.36 H new ATOM 0 HD2 PHE A 118 2.396 -6.598 9.287 1.00 0.32 H new ATOM 0 HE1 PHE A 118 4.500 -6.147 13.709 1.00 0.41 H new ATOM 0 HE2 PHE A 118 1.106 -5.687 11.170 1.00 0.38 H new ATOM 0 HZ PHE A 118 2.154 -5.462 13.387 1.00 0.42 H new ATOM 1884 N ALA A 119 5.338 -4.711 8.138 1.00 0.23 N ATOM 1885 CA ALA A 119 5.103 -3.284 8.059 1.00 0.23 C ATOM 1886 C ALA A 119 3.653 -2.995 7.728 1.00 0.21 C ATOM 1887 O ALA A 119 3.072 -3.602 6.825 1.00 0.28 O ATOM 1888 CB ALA A 119 6.033 -2.638 7.042 1.00 0.25 C ATOM 0 H ALA A 119 4.887 -5.258 7.405 1.00 0.23 H new ATOM 0 HA ALA A 119 5.319 -2.850 9.035 1.00 0.23 H new ATOM 0 HB1 ALA A 119 5.838 -1.566 7.000 1.00 0.25 H new ATOM 0 HB2 ALA A 119 7.069 -2.807 7.337 1.00 0.25 H new ATOM 0 HB3 ALA A 119 5.859 -3.077 6.060 1.00 0.25 H new ATOM 1894 N MET A 120 3.076 -2.069 8.463 1.00 0.19 N ATOM 1895 CA MET A 120 1.680 -1.709 8.288 1.00 0.21 C ATOM 1896 C MET A 120 1.577 -0.327 7.674 1.00 0.22 C ATOM 1897 O MET A 120 1.853 0.669 8.331 1.00 0.25 O ATOM 1898 CB MET A 120 0.969 -1.755 9.633 1.00 0.27 C ATOM 1899 CG MET A 120 0.148 -3.022 9.848 1.00 0.48 C ATOM 1900 SD MET A 120 -0.393 -3.213 11.557 1.00 0.63 S ATOM 1901 CE MET A 120 -0.894 -1.536 11.932 1.00 1.47 C ATOM 0 H MET A 120 3.555 -1.545 9.195 1.00 0.19 H new ATOM 0 HA MET A 120 1.201 -2.421 7.615 1.00 0.21 H new ATOM 0 HB2 MET A 120 1.709 -1.673 10.429 1.00 0.27 H new ATOM 0 HB3 MET A 120 0.313 -0.889 9.717 1.00 0.27 H new ATOM 0 HG2 MET A 120 -0.724 -3.001 9.195 1.00 0.48 H new ATOM 0 HG3 MET A 120 0.742 -3.889 9.559 1.00 0.48 H new ATOM 0 HE1 MET A 120 -1.537 -1.537 12.812 1.00 1.47 H new ATOM 0 HE2 MET A 120 -0.011 -0.928 12.128 1.00 1.47 H new ATOM 0 HE3 MET A 120 -1.439 -1.121 11.084 1.00 1.47 H new ATOM 1911 N VAL A 121 1.181 -0.261 6.416 1.00 0.25 N ATOM 1912 CA VAL A 121 1.228 0.997 5.690 1.00 0.26 C ATOM 1913 C VAL A 121 -0.162 1.495 5.329 1.00 0.29 C ATOM 1914 O VAL A 121 -1.005 0.723 4.883 1.00 0.39 O ATOM 1915 CB VAL A 121 2.018 0.876 4.377 1.00 0.28 C ATOM 1916 CG1 VAL A 121 2.649 2.209 4.045 1.00 0.34 C ATOM 1917 CG2 VAL A 121 3.064 -0.224 4.440 1.00 0.28 C ATOM 0 H VAL A 121 0.827 -1.053 5.880 1.00 0.25 H new ATOM 0 HA VAL A 121 1.720 1.699 6.363 1.00 0.26 H new ATOM 0 HB VAL A 121 1.324 0.599 3.584 1.00 0.28 H new ATOM 0 HG11 VAL A 121 3.210 2.124 3.114 1.00 0.34 H new ATOM 0 HG12 VAL A 121 1.870 2.962 3.932 1.00 0.34 H new ATOM 0 HG13 VAL A 121 3.324 2.503 4.849 1.00 0.34 H new ATOM 0 HG21 VAL A 121 3.598 -0.273 3.491 1.00 0.28 H new ATOM 0 HG22 VAL A 121 3.770 -0.009 5.242 1.00 0.28 H new ATOM 0 HG23 VAL A 121 2.576 -1.180 4.632 1.00 0.28 H new ATOM 1927 N PHE A 122 -0.388 2.788 5.497 1.00 0.25 N ATOM 1928 CA PHE A 122 -1.615 3.412 5.032 1.00 0.27 C ATOM 1929 C PHE A 122 -1.308 4.213 3.758 1.00 0.27 C ATOM 1930 O PHE A 122 -0.556 5.185 3.789 1.00 0.26 O ATOM 1931 CB PHE A 122 -2.224 4.300 6.147 1.00 0.29 C ATOM 1932 CG PHE A 122 -3.541 4.974 5.811 1.00 0.37 C ATOM 1933 CD1 PHE A 122 -3.961 5.140 4.500 1.00 0.87 C ATOM 1934 CD2 PHE A 122 -4.361 5.452 6.824 1.00 0.33 C ATOM 1935 CE1 PHE A 122 -5.156 5.757 4.205 1.00 0.99 C ATOM 1936 CE2 PHE A 122 -5.557 6.073 6.531 1.00 0.38 C ATOM 1937 CZ PHE A 122 -5.955 6.225 5.222 1.00 0.63 C ATOM 0 H PHE A 122 0.264 3.426 5.953 1.00 0.25 H new ATOM 0 HA PHE A 122 -2.359 2.652 4.792 1.00 0.27 H new ATOM 0 HB2 PHE A 122 -2.369 3.686 7.036 1.00 0.29 H new ATOM 0 HB3 PHE A 122 -1.499 5.071 6.407 1.00 0.29 H new ATOM 0 HD1 PHE A 122 -3.339 4.778 3.695 1.00 0.87 H new ATOM 0 HD2 PHE A 122 -4.059 5.336 7.854 1.00 0.33 H new ATOM 0 HE1 PHE A 122 -5.465 5.873 3.177 1.00 0.99 H new ATOM 0 HE2 PHE A 122 -6.183 6.441 7.331 1.00 0.38 H new ATOM 0 HZ PHE A 122 -6.892 6.711 4.994 1.00 0.63 H new ATOM 1947 N PHE A 123 -1.877 3.761 2.643 1.00 0.34 N ATOM 1948 CA PHE A 123 -1.745 4.430 1.345 1.00 0.34 C ATOM 1949 C PHE A 123 -2.975 5.308 1.099 1.00 0.35 C ATOM 1950 O PHE A 123 -4.104 4.809 1.070 1.00 0.38 O ATOM 1951 CB PHE A 123 -1.648 3.392 0.219 1.00 0.37 C ATOM 1952 CG PHE A 123 -0.343 2.643 0.133 1.00 0.37 C ATOM 1953 CD1 PHE A 123 0.150 1.906 1.203 1.00 0.32 C ATOM 1954 CD2 PHE A 123 0.379 2.653 -1.049 1.00 0.45 C ATOM 1955 CE1 PHE A 123 1.332 1.203 1.088 1.00 0.33 C ATOM 1956 CE2 PHE A 123 1.565 1.954 -1.165 1.00 0.47 C ATOM 1957 CZ PHE A 123 2.041 1.228 -0.095 1.00 0.41 C ATOM 0 H PHE A 123 -2.447 2.915 2.611 1.00 0.34 H new ATOM 0 HA PHE A 123 -0.841 5.039 1.355 1.00 0.34 H new ATOM 0 HB2 PHE A 123 -2.454 2.669 0.346 1.00 0.37 H new ATOM 0 HB3 PHE A 123 -1.820 3.897 -0.732 1.00 0.37 H new ATOM 0 HD1 PHE A 123 -0.397 1.883 2.134 1.00 0.32 H new ATOM 0 HD2 PHE A 123 0.009 3.216 -1.893 1.00 0.45 H new ATOM 0 HE1 PHE A 123 1.703 0.632 1.926 1.00 0.33 H new ATOM 0 HE2 PHE A 123 2.118 1.977 -2.092 1.00 0.47 H new ATOM 0 HZ PHE A 123 2.967 0.680 -0.182 1.00 0.41 H new ATOM 1967 N GLN A 124 -2.758 6.600 0.923 1.00 0.36 N ATOM 1968 CA GLN A 124 -3.852 7.553 0.753 1.00 0.39 C ATOM 1969 C GLN A 124 -3.801 8.167 -0.644 1.00 0.34 C ATOM 1970 O GLN A 124 -2.812 8.800 -1.010 1.00 0.33 O ATOM 1971 CB GLN A 124 -3.728 8.637 1.836 1.00 0.45 C ATOM 1972 CG GLN A 124 -4.937 9.553 2.026 1.00 0.67 C ATOM 1973 CD GLN A 124 -5.106 10.597 0.933 1.00 0.82 C ATOM 1974 OE1 GLN A 124 -5.903 10.429 0.009 1.00 1.54 O ATOM 1975 NE2 GLN A 124 -4.324 11.660 1.006 1.00 1.57 N ATOM 0 H GLN A 124 -1.829 7.020 0.893 1.00 0.36 H new ATOM 0 HA GLN A 124 -4.812 7.047 0.858 1.00 0.39 H new ATOM 0 HB2 GLN A 124 -3.519 8.147 2.787 1.00 0.45 H new ATOM 0 HB3 GLN A 124 -2.864 9.258 1.600 1.00 0.45 H new ATOM 0 HG2 GLN A 124 -5.838 8.942 2.071 1.00 0.67 H new ATOM 0 HG3 GLN A 124 -4.847 10.060 2.987 1.00 0.67 H new ATOM 0 HE21 GLN A 124 -3.676 11.764 1.787 1.00 1.57 H new ATOM 0 HE22 GLN A 124 -4.368 12.376 0.281 1.00 1.57 H new ATOM 1984 N LYS A 125 -4.854 7.967 -1.432 1.00 0.37 N ATOM 1985 CA LYS A 125 -4.933 8.572 -2.751 1.00 0.38 C ATOM 1986 C LYS A 125 -6.214 9.377 -2.897 1.00 0.35 C ATOM 1987 O LYS A 125 -7.318 8.850 -2.804 1.00 0.41 O ATOM 1988 CB LYS A 125 -4.836 7.520 -3.872 1.00 0.53 C ATOM 1989 CG LYS A 125 -5.975 6.511 -3.919 1.00 0.98 C ATOM 1990 CD LYS A 125 -5.816 5.536 -5.079 1.00 1.06 C ATOM 1991 CE LYS A 125 -5.881 6.241 -6.429 1.00 1.36 C ATOM 1992 NZ LYS A 125 -7.236 6.785 -6.721 1.00 1.55 N ATOM 0 H LYS A 125 -5.658 7.393 -1.179 1.00 0.37 H new ATOM 0 HA LYS A 125 -4.079 9.242 -2.850 1.00 0.38 H new ATOM 0 HB2 LYS A 125 -4.792 8.038 -4.830 1.00 0.53 H new ATOM 0 HB3 LYS A 125 -3.897 6.978 -3.759 1.00 0.53 H new ATOM 0 HG2 LYS A 125 -6.010 5.958 -2.981 1.00 0.98 H new ATOM 0 HG3 LYS A 125 -6.924 7.038 -4.014 1.00 0.98 H new ATOM 0 HD2 LYS A 125 -4.863 5.015 -4.987 1.00 1.06 H new ATOM 0 HD3 LYS A 125 -6.599 4.779 -5.027 1.00 1.06 H new ATOM 0 HE2 LYS A 125 -5.155 7.054 -6.447 1.00 1.36 H new ATOM 0 HE3 LYS A 125 -5.596 5.542 -7.215 1.00 1.36 H new ATOM 0 HZ1 LYS A 125 -7.611 6.338 -7.582 1.00 1.55 H new ATOM 0 HZ2 LYS A 125 -7.870 6.584 -5.922 1.00 1.55 H new ATOM 0 HZ3 LYS A 125 -7.174 7.813 -6.864 1.00 1.55 H new ATOM 2006 N THR A 126 -6.069 10.657 -3.136 1.00 0.31 N ATOM 2007 CA THR A 126 -7.219 11.500 -3.365 1.00 0.31 C ATOM 2008 C THR A 126 -7.382 11.682 -4.856 1.00 0.34 C ATOM 2009 O THR A 126 -6.396 11.885 -5.559 1.00 0.39 O ATOM 2010 CB THR A 126 -7.031 12.874 -2.720 1.00 0.35 C ATOM 2011 OG1 THR A 126 -6.095 12.775 -1.639 1.00 0.42 O ATOM 2012 CG2 THR A 126 -8.349 13.417 -2.199 1.00 0.47 C ATOM 0 H THR A 126 -5.170 11.138 -3.177 1.00 0.31 H new ATOM 0 HA THR A 126 -8.098 11.029 -2.925 1.00 0.31 H new ATOM 0 HB THR A 126 -6.651 13.558 -3.479 1.00 0.35 H new ATOM 0 HG1 THR A 126 -6.263 11.952 -1.135 1.00 0.42 H new ATOM 0 HG21 THR A 126 -8.186 14.395 -1.746 1.00 0.47 H new ATOM 0 HG22 THR A 126 -9.055 13.513 -3.024 1.00 0.47 H new ATOM 0 HG23 THR A 126 -8.754 12.734 -1.452 1.00 0.47 H new ATOM 2020 N SER A 127 -8.597 11.589 -5.354 1.00 0.37 N ATOM 2021 CA SER A 127 -8.813 11.666 -6.780 1.00 0.45 C ATOM 2022 C SER A 127 -10.221 12.148 -7.081 1.00 0.51 C ATOM 2023 O SER A 127 -11.188 11.645 -6.509 1.00 0.52 O ATOM 2024 CB SER A 127 -8.582 10.292 -7.420 1.00 0.54 C ATOM 2025 OG SER A 127 -7.304 9.775 -7.085 1.00 0.87 O ATOM 0 H SER A 127 -9.442 11.461 -4.797 1.00 0.37 H new ATOM 0 HA SER A 127 -8.105 12.380 -7.200 1.00 0.45 H new ATOM 0 HB2 SER A 127 -9.355 9.599 -7.088 1.00 0.54 H new ATOM 0 HB3 SER A 127 -8.671 10.374 -8.503 1.00 0.54 H new ATOM 0 HG SER A 127 -6.872 9.422 -7.891 1.00 0.87 H new ATOM 2031 N GLU A 128 -10.321 13.145 -7.954 1.00 0.63 N ATOM 2032 CA GLU A 128 -11.611 13.656 -8.409 1.00 0.74 C ATOM 2033 C GLU A 128 -12.398 14.243 -7.238 1.00 0.66 C ATOM 2034 O GLU A 128 -13.625 14.183 -7.201 1.00 0.71 O ATOM 2035 CB GLU A 128 -12.415 12.534 -9.074 1.00 0.89 C ATOM 2036 CG GLU A 128 -13.511 13.031 -9.991 1.00 1.26 C ATOM 2037 CD GLU A 128 -12.960 13.591 -11.283 1.00 1.59 C ATOM 2038 OE1 GLU A 128 -12.635 14.793 -11.327 1.00 1.98 O ATOM 2039 OE2 GLU A 128 -12.862 12.833 -12.270 1.00 2.13 O ATOM 0 H GLU A 128 -9.517 13.619 -8.364 1.00 0.63 H new ATOM 0 HA GLU A 128 -11.434 14.447 -9.138 1.00 0.74 H new ATOM 0 HB2 GLU A 128 -11.735 11.901 -9.645 1.00 0.89 H new ATOM 0 HB3 GLU A 128 -12.858 11.908 -8.299 1.00 0.89 H new ATOM 0 HG2 GLU A 128 -14.196 12.213 -10.214 1.00 1.26 H new ATOM 0 HG3 GLU A 128 -14.090 13.801 -9.480 1.00 1.26 H new ATOM 2046 N ASN A 129 -11.656 14.775 -6.270 1.00 0.64 N ATOM 2047 CA ASN A 129 -12.224 15.384 -5.064 1.00 0.70 C ATOM 2048 C ASN A 129 -12.741 14.320 -4.088 1.00 0.59 C ATOM 2049 O ASN A 129 -13.141 14.631 -2.968 1.00 0.71 O ATOM 2050 CB ASN A 129 -13.312 16.412 -5.423 1.00 0.91 C ATOM 2051 CG ASN A 129 -13.820 17.198 -4.225 1.00 1.28 C ATOM 2052 OD1 ASN A 129 -13.181 18.151 -3.776 1.00 1.64 O ATOM 2053 ND2 ASN A 129 -14.992 16.839 -3.727 1.00 2.21 N ATOM 0 H ASN A 129 -10.637 14.797 -6.298 1.00 0.64 H new ATOM 0 HA ASN A 129 -11.425 15.921 -4.553 1.00 0.70 H new ATOM 0 HB2 ASN A 129 -12.914 17.107 -6.162 1.00 0.91 H new ATOM 0 HB3 ASN A 129 -14.150 15.895 -5.890 1.00 0.91 H new ATOM 0 HD21 ASN A 129 -15.394 17.357 -2.946 1.00 2.21 H new ATOM 0 HD22 ASN A 129 -15.493 16.044 -4.124 1.00 2.21 H new ATOM 2060 N LYS A 130 -12.695 13.057 -4.499 1.00 0.45 N ATOM 2061 CA LYS A 130 -13.000 11.959 -3.591 1.00 0.49 C ATOM 2062 C LYS A 130 -11.696 11.366 -3.092 1.00 0.42 C ATOM 2063 O LYS A 130 -10.647 11.579 -3.697 1.00 0.45 O ATOM 2064 CB LYS A 130 -13.840 10.860 -4.265 1.00 0.64 C ATOM 2065 CG LYS A 130 -15.277 11.260 -4.576 1.00 1.02 C ATOM 2066 CD LYS A 130 -15.381 12.030 -5.881 1.00 1.36 C ATOM 2067 CE LYS A 130 -15.019 11.164 -7.077 1.00 2.08 C ATOM 2068 NZ LYS A 130 -16.032 10.106 -7.328 1.00 2.80 N ATOM 0 H LYS A 130 -12.451 12.770 -5.447 1.00 0.45 H new ATOM 0 HA LYS A 130 -13.590 12.356 -2.765 1.00 0.49 H new ATOM 0 HB2 LYS A 130 -13.350 10.565 -5.193 1.00 0.64 H new ATOM 0 HB3 LYS A 130 -13.853 9.983 -3.618 1.00 0.64 H new ATOM 0 HG2 LYS A 130 -15.899 10.366 -4.631 1.00 1.02 H new ATOM 0 HG3 LYS A 130 -15.668 11.871 -3.762 1.00 1.02 H new ATOM 0 HD2 LYS A 130 -16.396 12.408 -6.000 1.00 1.36 H new ATOM 0 HD3 LYS A 130 -14.720 12.896 -5.846 1.00 1.36 H new ATOM 0 HE2 LYS A 130 -14.924 11.792 -7.963 1.00 2.08 H new ATOM 0 HE3 LYS A 130 -14.047 10.701 -6.908 1.00 2.08 H new ATOM 0 HZ1 LYS A 130 -15.839 9.650 -8.243 1.00 2.80 H new ATOM 0 HZ2 LYS A 130 -15.986 9.395 -6.570 1.00 2.80 H new ATOM 0 HZ3 LYS A 130 -16.981 10.531 -7.347 1.00 2.80 H new ATOM 2082 N GLN A 131 -11.744 10.644 -1.993 1.00 0.43 N ATOM 2083 CA GLN A 131 -10.549 10.000 -1.481 1.00 0.44 C ATOM 2084 C GLN A 131 -10.680 8.489 -1.560 1.00 0.48 C ATOM 2085 O GLN A 131 -11.757 7.939 -1.334 1.00 0.59 O ATOM 2086 CB GLN A 131 -10.272 10.402 -0.034 1.00 0.55 C ATOM 2087 CG GLN A 131 -9.763 11.822 0.107 1.00 0.56 C ATOM 2088 CD GLN A 131 -9.590 12.249 1.551 1.00 0.77 C ATOM 2089 OE1 GLN A 131 -10.503 12.796 2.166 1.00 1.11 O ATOM 2090 NE2 GLN A 131 -8.413 12.000 2.103 1.00 1.57 N ATOM 0 H GLN A 131 -12.587 10.488 -1.440 1.00 0.43 H new ATOM 0 HA GLN A 131 -9.716 10.329 -2.102 1.00 0.44 H new ATOM 0 HB2 GLN A 131 -11.187 10.292 0.548 1.00 0.55 H new ATOM 0 HB3 GLN A 131 -9.539 9.717 0.392 1.00 0.55 H new ATOM 0 HG2 GLN A 131 -8.808 11.912 -0.410 1.00 0.56 H new ATOM 0 HG3 GLN A 131 -10.458 12.502 -0.386 1.00 0.56 H new ATOM 0 HE21 GLN A 131 -7.681 11.544 1.559 1.00 1.57 H new ATOM 0 HE22 GLN A 131 -8.238 12.264 3.073 1.00 1.57 H new ATOM 2099 N TYR A 132 -9.587 7.831 -1.887 1.00 0.45 N ATOM 2100 CA TYR A 132 -9.506 6.385 -1.824 1.00 0.50 C ATOM 2101 C TYR A 132 -8.285 6.039 -1.000 1.00 0.44 C ATOM 2102 O TYR A 132 -7.212 6.600 -1.188 1.00 0.51 O ATOM 2103 CB TYR A 132 -9.439 5.745 -3.213 1.00 0.57 C ATOM 2104 CG TYR A 132 -10.523 6.236 -4.150 1.00 0.68 C ATOM 2105 CD1 TYR A 132 -10.331 7.362 -4.944 1.00 0.68 C ATOM 2106 CD2 TYR A 132 -11.747 5.583 -4.225 1.00 0.87 C ATOM 2107 CE1 TYR A 132 -11.329 7.823 -5.783 1.00 0.81 C ATOM 2108 CE2 TYR A 132 -12.747 6.035 -5.065 1.00 1.01 C ATOM 2109 CZ TYR A 132 -12.535 7.155 -5.839 1.00 0.96 C ATOM 2110 OH TYR A 132 -13.537 7.611 -6.669 1.00 1.12 O ATOM 0 H TYR A 132 -8.729 8.283 -2.204 1.00 0.45 H new ATOM 0 HA TYR A 132 -10.409 5.986 -1.362 1.00 0.50 H new ATOM 0 HB2 TYR A 132 -8.464 5.953 -3.655 1.00 0.57 H new ATOM 0 HB3 TYR A 132 -9.519 4.663 -3.111 1.00 0.57 H new ATOM 0 HD1 TYR A 132 -9.387 7.885 -4.905 1.00 0.68 H new ATOM 0 HD2 TYR A 132 -11.920 4.708 -3.617 1.00 0.87 H new ATOM 0 HE1 TYR A 132 -11.165 8.701 -6.391 1.00 0.81 H new ATOM 0 HE2 TYR A 132 -13.691 5.512 -5.115 1.00 1.01 H new ATOM 0 HH TYR A 132 -14.319 7.026 -6.589 1.00 1.12 H new ATOM 2120 N PHE A 133 -8.455 5.139 -0.075 1.00 0.40 N ATOM 2121 CA PHE A 133 -7.500 4.976 1.001 1.00 0.30 C ATOM 2122 C PHE A 133 -7.530 3.551 1.503 1.00 0.25 C ATOM 2123 O PHE A 133 -8.594 2.921 1.551 1.00 0.30 O ATOM 2124 CB PHE A 133 -7.840 5.966 2.126 1.00 0.45 C ATOM 2125 CG PHE A 133 -9.306 5.984 2.454 1.00 0.82 C ATOM 2126 CD1 PHE A 133 -10.210 6.591 1.595 1.00 1.20 C ATOM 2127 CD2 PHE A 133 -9.787 5.363 3.590 1.00 1.31 C ATOM 2128 CE1 PHE A 133 -11.553 6.579 1.865 1.00 1.74 C ATOM 2129 CE2 PHE A 133 -11.131 5.346 3.859 1.00 1.82 C ATOM 2130 CZ PHE A 133 -12.011 5.952 2.996 1.00 1.95 C ATOM 0 H PHE A 133 -9.249 4.500 -0.038 1.00 0.40 H new ATOM 0 HA PHE A 133 -6.492 5.184 0.642 1.00 0.30 H new ATOM 0 HB2 PHE A 133 -7.274 5.703 3.020 1.00 0.45 H new ATOM 0 HB3 PHE A 133 -7.525 6.967 1.832 1.00 0.45 H new ATOM 0 HD1 PHE A 133 -9.850 7.080 0.701 1.00 1.20 H new ATOM 0 HD2 PHE A 133 -9.098 4.887 4.272 1.00 1.31 H new ATOM 0 HE1 PHE A 133 -12.247 7.060 1.192 1.00 1.74 H new ATOM 0 HE2 PHE A 133 -11.498 4.856 4.749 1.00 1.82 H new ATOM 0 HZ PHE A 133 -13.070 5.935 3.209 1.00 1.95 H new ATOM 2140 N LYS A 134 -6.369 3.030 1.843 1.00 0.21 N ATOM 2141 CA LYS A 134 -6.273 1.656 2.275 1.00 0.24 C ATOM 2142 C LYS A 134 -5.080 1.460 3.205 1.00 0.17 C ATOM 2143 O LYS A 134 -4.107 2.211 3.155 1.00 0.20 O ATOM 2144 CB LYS A 134 -6.143 0.750 1.045 1.00 0.38 C ATOM 2145 CG LYS A 134 -4.775 0.817 0.395 1.00 0.53 C ATOM 2146 CD LYS A 134 -3.981 -0.438 0.687 1.00 0.76 C ATOM 2147 CE LYS A 134 -2.568 -0.384 0.121 1.00 0.61 C ATOM 2148 NZ LYS A 134 -2.540 -0.408 -1.370 1.00 1.30 N ATOM 0 H LYS A 134 -5.484 3.537 1.828 1.00 0.21 H new ATOM 0 HA LYS A 134 -7.175 1.394 2.829 1.00 0.24 H new ATOM 0 HB2 LYS A 134 -6.349 -0.280 1.337 1.00 0.38 H new ATOM 0 HB3 LYS A 134 -6.900 1.031 0.313 1.00 0.38 H new ATOM 0 HG2 LYS A 134 -4.885 0.941 -0.682 1.00 0.53 H new ATOM 0 HG3 LYS A 134 -4.234 1.689 0.763 1.00 0.53 H new ATOM 0 HD2 LYS A 134 -3.931 -0.589 1.765 1.00 0.76 H new ATOM 0 HD3 LYS A 134 -4.503 -1.299 0.269 1.00 0.76 H new ATOM 0 HE2 LYS A 134 -2.075 0.521 0.474 1.00 0.61 H new ATOM 0 HE3 LYS A 134 -1.996 -1.229 0.504 1.00 0.61 H new ATOM 0 HZ1 LYS A 134 -1.822 -1.087 -1.693 1.00 1.30 H new ATOM 0 HZ2 LYS A 134 -3.473 -0.693 -1.730 1.00 1.30 H new ATOM 0 HZ3 LYS A 134 -2.306 0.540 -1.728 1.00 1.30 H new ATOM 2162 N VAL A 135 -5.163 0.442 4.029 1.00 0.16 N ATOM 2163 CA VAL A 135 -4.052 0.026 4.857 1.00 0.17 C ATOM 2164 C VAL A 135 -3.593 -1.348 4.365 1.00 0.20 C ATOM 2165 O VAL A 135 -4.408 -2.246 4.151 1.00 0.30 O ATOM 2166 CB VAL A 135 -4.417 -0.009 6.374 1.00 0.24 C ATOM 2167 CG1 VAL A 135 -5.290 -1.204 6.740 1.00 0.39 C ATOM 2168 CG2 VAL A 135 -3.159 0.013 7.231 1.00 0.78 C ATOM 0 H VAL A 135 -6.004 -0.123 4.145 1.00 0.16 H new ATOM 0 HA VAL A 135 -3.245 0.754 4.767 1.00 0.17 H new ATOM 0 HB VAL A 135 -5.002 0.888 6.577 1.00 0.24 H new ATOM 0 HG11 VAL A 135 -5.513 -1.178 7.807 1.00 0.39 H new ATOM 0 HG12 VAL A 135 -6.220 -1.162 6.173 1.00 0.39 H new ATOM 0 HG13 VAL A 135 -4.761 -2.127 6.502 1.00 0.39 H new ATOM 0 HG21 VAL A 135 -3.436 -0.012 8.285 1.00 0.78 H new ATOM 0 HG22 VAL A 135 -2.544 -0.856 6.997 1.00 0.78 H new ATOM 0 HG23 VAL A 135 -2.595 0.923 7.026 1.00 0.78 H new ATOM 2178 N THR A 136 -2.310 -1.494 4.114 1.00 0.20 N ATOM 2179 CA THR A 136 -1.796 -2.734 3.569 1.00 0.22 C ATOM 2180 C THR A 136 -0.850 -3.409 4.553 1.00 0.24 C ATOM 2181 O THR A 136 -0.117 -2.742 5.290 1.00 0.47 O ATOM 2182 CB THR A 136 -1.075 -2.504 2.224 1.00 0.43 C ATOM 2183 OG1 THR A 136 -0.556 -3.735 1.705 1.00 1.41 O ATOM 2184 CG2 THR A 136 0.049 -1.492 2.365 1.00 0.65 C ATOM 0 H THR A 136 -1.606 -0.774 4.277 1.00 0.20 H new ATOM 0 HA THR A 136 -2.650 -3.388 3.393 1.00 0.22 H new ATOM 0 HB THR A 136 -1.812 -2.108 1.525 1.00 0.43 H new ATOM 0 HG1 THR A 136 0.339 -3.583 1.335 1.00 1.41 H new ATOM 0 HG21 THR A 136 0.536 -1.353 1.400 1.00 0.65 H new ATOM 0 HG22 THR A 136 -0.359 -0.540 2.706 1.00 0.65 H new ATOM 0 HG23 THR A 136 0.777 -1.856 3.090 1.00 0.65 H new ATOM 2192 N LEU A 137 -0.889 -4.730 4.570 1.00 0.18 N ATOM 2193 CA LEU A 137 0.006 -5.514 5.392 1.00 0.21 C ATOM 2194 C LEU A 137 1.172 -5.991 4.535 1.00 0.17 C ATOM 2195 O LEU A 137 0.984 -6.787 3.617 1.00 0.25 O ATOM 2196 CB LEU A 137 -0.766 -6.701 5.990 1.00 0.33 C ATOM 2197 CG LEU A 137 -0.063 -7.497 7.096 1.00 0.34 C ATOM 2198 CD1 LEU A 137 1.057 -8.359 6.539 1.00 0.97 C ATOM 2199 CD2 LEU A 137 0.461 -6.561 8.171 1.00 0.68 C ATOM 0 H LEU A 137 -1.541 -5.285 4.015 1.00 0.18 H new ATOM 0 HA LEU A 137 0.399 -4.913 6.212 1.00 0.21 H new ATOM 0 HB2 LEU A 137 -1.709 -6.327 6.388 1.00 0.33 H new ATOM 0 HB3 LEU A 137 -1.012 -7.389 5.181 1.00 0.33 H new ATOM 0 HG LEU A 137 -0.798 -8.166 7.544 1.00 0.34 H new ATOM 0 HD11 LEU A 137 1.532 -8.908 7.352 1.00 0.97 H new ATOM 0 HD12 LEU A 137 0.648 -9.064 5.815 1.00 0.97 H new ATOM 0 HD13 LEU A 137 1.796 -7.724 6.050 1.00 0.97 H new ATOM 0 HD21 LEU A 137 0.957 -7.142 8.949 1.00 0.68 H new ATOM 0 HD22 LEU A 137 1.172 -5.862 7.730 1.00 0.68 H new ATOM 0 HD23 LEU A 137 -0.370 -6.006 8.607 1.00 0.68 H new ATOM 2211 N TYR A 138 2.363 -5.483 4.817 1.00 0.18 N ATOM 2212 CA TYR A 138 3.559 -5.904 4.102 1.00 0.26 C ATOM 2213 C TYR A 138 4.461 -6.732 5.001 1.00 0.20 C ATOM 2214 O TYR A 138 4.480 -6.553 6.217 1.00 0.25 O ATOM 2215 CB TYR A 138 4.350 -4.706 3.576 1.00 0.44 C ATOM 2216 CG TYR A 138 3.738 -4.016 2.379 1.00 0.59 C ATOM 2217 CD1 TYR A 138 3.175 -4.740 1.338 1.00 1.36 C ATOM 2218 CD2 TYR A 138 3.732 -2.636 2.293 1.00 0.54 C ATOM 2219 CE1 TYR A 138 2.625 -4.101 0.242 1.00 2.04 C ATOM 2220 CE2 TYR A 138 3.186 -1.989 1.204 1.00 1.18 C ATOM 2221 CZ TYR A 138 2.631 -2.725 0.179 1.00 1.94 C ATOM 2222 OH TYR A 138 2.081 -2.082 -0.909 1.00 2.64 O ATOM 0 H TYR A 138 2.527 -4.778 5.536 1.00 0.18 H new ATOM 0 HA TYR A 138 3.228 -6.507 3.257 1.00 0.26 H new ATOM 0 HB2 TYR A 138 4.458 -3.979 4.381 1.00 0.44 H new ATOM 0 HB3 TYR A 138 5.353 -5.039 3.311 1.00 0.44 H new ATOM 0 HD1 TYR A 138 3.166 -5.819 1.384 1.00 1.36 H new ATOM 0 HD2 TYR A 138 4.163 -2.054 3.094 1.00 0.54 H new ATOM 0 HE1 TYR A 138 2.192 -4.679 -0.562 1.00 2.04 H new ATOM 0 HE2 TYR A 138 3.193 -0.910 1.155 1.00 1.18 H new ATOM 0 HH TYR A 138 2.041 -1.119 -0.734 1.00 2.64 H new ATOM 2232 N GLY A 139 5.202 -7.635 4.390 1.00 0.28 N ATOM 2233 CA GLY A 139 6.174 -8.424 5.109 1.00 0.29 C ATOM 2234 C GLY A 139 7.431 -8.621 4.287 1.00 0.33 C ATOM 2235 O GLY A 139 7.390 -8.491 3.061 1.00 0.45 O ATOM 0 H GLY A 139 5.147 -7.839 3.392 1.00 0.28 H new ATOM 0 HA2 GLY A 139 6.424 -7.931 6.049 1.00 0.29 H new ATOM 0 HA3 GLY A 139 5.745 -9.394 5.362 1.00 0.29 H new ATOM 2239 N ARG A 140 8.542 -8.928 4.947 1.00 0.37 N ATOM 2240 CA ARG A 140 9.827 -9.098 4.262 1.00 0.49 C ATOM 2241 C ARG A 140 9.793 -10.310 3.330 1.00 0.38 C ATOM 2242 O ARG A 140 10.554 -10.397 2.368 1.00 0.51 O ATOM 2243 CB ARG A 140 10.950 -9.278 5.287 1.00 0.78 C ATOM 2244 CG ARG A 140 12.346 -9.044 4.725 1.00 1.61 C ATOM 2245 CD ARG A 140 13.418 -9.457 5.719 1.00 1.91 C ATOM 2246 NE ARG A 140 14.695 -8.790 5.462 1.00 2.46 N ATOM 2247 CZ ARG A 140 15.783 -8.943 6.215 1.00 3.13 C ATOM 2248 NH1 ARG A 140 15.784 -9.808 7.224 1.00 3.38 N ATOM 2249 NH2 ARG A 140 16.873 -8.235 5.950 1.00 3.99 N ATOM 0 H ARG A 140 8.583 -9.065 5.957 1.00 0.37 H new ATOM 0 HA ARG A 140 10.013 -8.203 3.668 1.00 0.49 H new ATOM 0 HB2 ARG A 140 10.784 -8.591 6.117 1.00 0.78 H new ATOM 0 HB3 ARG A 140 10.898 -10.288 5.694 1.00 0.78 H new ATOM 0 HG2 ARG A 140 12.467 -9.609 3.801 1.00 1.61 H new ATOM 0 HG3 ARG A 140 12.467 -7.990 4.473 1.00 1.61 H new ATOM 0 HD2 ARG A 140 13.084 -9.222 6.730 1.00 1.91 H new ATOM 0 HD3 ARG A 140 13.558 -10.537 5.672 1.00 1.91 H new ATOM 0 HE ARG A 140 14.756 -8.169 4.655 1.00 2.46 H new ATOM 0 HH11 ARG A 140 14.949 -10.358 7.425 1.00 3.38 H new ATOM 0 HH12 ARG A 140 16.620 -9.921 7.798 1.00 3.38 H new ATOM 0 HH21 ARG A 140 16.876 -7.576 5.172 1.00 3.99 H new ATOM 0 HH22 ARG A 140 17.708 -8.350 6.525 1.00 3.99 H new ATOM 2263 N THR A 141 8.901 -11.239 3.627 1.00 0.40 N ATOM 2264 CA THR A 141 8.797 -12.475 2.878 1.00 0.58 C ATOM 2265 C THR A 141 7.369 -13.005 2.993 1.00 0.64 C ATOM 2266 O THR A 141 6.548 -12.424 3.708 1.00 1.14 O ATOM 2267 CB THR A 141 9.816 -13.514 3.412 1.00 0.85 C ATOM 2268 OG1 THR A 141 9.865 -14.670 2.564 1.00 1.13 O ATOM 2269 CG2 THR A 141 9.471 -13.942 4.835 1.00 0.94 C ATOM 0 H THR A 141 8.231 -11.157 4.392 1.00 0.40 H new ATOM 0 HA THR A 141 9.027 -12.291 1.829 1.00 0.58 H new ATOM 0 HB THR A 141 10.795 -13.034 3.415 1.00 0.85 H new ATOM 0 HG1 THR A 141 10.516 -15.310 2.921 1.00 1.13 H new ATOM 0 HG21 THR A 141 10.203 -14.671 5.183 1.00 0.94 H new ATOM 0 HG22 THR A 141 9.486 -13.071 5.491 1.00 0.94 H new ATOM 0 HG23 THR A 141 8.477 -14.390 4.849 1.00 0.94 H new ATOM 2277 N LYS A 142 7.080 -14.103 2.302 1.00 0.79 N ATOM 2278 CA LYS A 142 5.740 -14.687 2.299 1.00 0.87 C ATOM 2279 C LYS A 142 5.473 -15.461 3.595 1.00 0.84 C ATOM 2280 O LYS A 142 4.851 -16.525 3.568 1.00 1.09 O ATOM 2281 CB LYS A 142 5.582 -15.642 1.111 1.00 1.02 C ATOM 2282 CG LYS A 142 5.846 -15.026 -0.256 1.00 1.17 C ATOM 2283 CD LYS A 142 4.748 -14.063 -0.682 1.00 0.84 C ATOM 2284 CE LYS A 142 4.738 -13.876 -2.194 1.00 0.85 C ATOM 2285 NZ LYS A 142 4.430 -15.148 -2.895 1.00 1.57 N ATOM 0 H LYS A 142 7.759 -14.610 1.734 1.00 0.79 H new ATOM 0 HA LYS A 142 5.023 -13.870 2.218 1.00 0.87 H new ATOM 0 HB2 LYS A 142 6.260 -16.484 1.249 1.00 1.02 H new ATOM 0 HB3 LYS A 142 4.569 -16.044 1.121 1.00 1.02 H new ATOM 0 HG2 LYS A 142 6.800 -14.499 -0.235 1.00 1.17 H new ATOM 0 HG3 LYS A 142 5.937 -15.820 -0.997 1.00 1.17 H new ATOM 0 HD2 LYS A 142 3.780 -14.442 -0.353 1.00 0.84 H new ATOM 0 HD3 LYS A 142 4.896 -13.099 -0.194 1.00 0.84 H new ATOM 0 HE2 LYS A 142 3.999 -13.122 -2.464 1.00 0.85 H new ATOM 0 HE3 LYS A 142 5.708 -13.503 -2.523 1.00 0.85 H new ATOM 0 HZ1 LYS A 142 4.020 -14.940 -3.828 1.00 1.57 H new ATOM 0 HZ2 LYS A 142 5.304 -15.698 -3.016 1.00 1.57 H new ATOM 0 HZ3 LYS A 142 3.750 -15.698 -2.333 1.00 1.57 H new ATOM 2299 N GLY A 143 5.936 -14.932 4.722 1.00 0.67 N ATOM 2300 CA GLY A 143 5.797 -15.634 5.979 1.00 0.70 C ATOM 2301 C GLY A 143 5.611 -14.702 7.158 1.00 0.62 C ATOM 2302 O GLY A 143 6.576 -14.347 7.838 1.00 0.74 O ATOM 0 H GLY A 143 6.405 -14.029 4.785 1.00 0.67 H new ATOM 0 HA2 GLY A 143 4.944 -16.310 5.919 1.00 0.70 H new ATOM 0 HA3 GLY A 143 6.681 -16.250 6.145 1.00 0.70 H new ATOM 2306 N LEU A 144 4.370 -14.298 7.391 1.00 0.52 N ATOM 2307 CA LEU A 144 4.025 -13.457 8.532 1.00 0.46 C ATOM 2308 C LEU A 144 2.883 -14.095 9.313 1.00 0.48 C ATOM 2309 O LEU A 144 1.918 -14.575 8.717 1.00 0.53 O ATOM 2310 CB LEU A 144 3.609 -12.056 8.070 1.00 0.43 C ATOM 2311 CG LEU A 144 4.704 -11.222 7.406 1.00 0.40 C ATOM 2312 CD1 LEU A 144 4.182 -9.827 7.109 1.00 0.56 C ATOM 2313 CD2 LEU A 144 5.942 -11.150 8.289 1.00 0.56 C ATOM 0 H LEU A 144 3.576 -14.542 6.798 1.00 0.52 H new ATOM 0 HA LEU A 144 4.903 -13.366 9.171 1.00 0.46 H new ATOM 0 HB2 LEU A 144 2.780 -12.156 7.370 1.00 0.43 H new ATOM 0 HB3 LEU A 144 3.233 -11.506 8.933 1.00 0.43 H new ATOM 0 HG LEU A 144 4.987 -11.702 6.469 1.00 0.40 H new ATOM 0 HD11 LEU A 144 4.967 -9.238 6.636 1.00 0.56 H new ATOM 0 HD12 LEU A 144 3.325 -9.894 6.439 1.00 0.56 H new ATOM 0 HD13 LEU A 144 3.878 -9.346 8.039 1.00 0.56 H new ATOM 0 HD21 LEU A 144 6.707 -10.551 7.795 1.00 0.56 H new ATOM 0 HD22 LEU A 144 5.682 -10.691 9.243 1.00 0.56 H new ATOM 0 HD23 LEU A 144 6.324 -12.156 8.462 1.00 0.56 H new ATOM 2325 N SER A 145 2.998 -14.100 10.636 1.00 0.51 N ATOM 2326 CA SER A 145 1.991 -14.700 11.494 1.00 0.56 C ATOM 2327 C SER A 145 0.666 -13.962 11.362 1.00 0.50 C ATOM 2328 O SER A 145 0.629 -12.747 11.171 1.00 0.49 O ATOM 2329 CB SER A 145 2.477 -14.670 12.943 1.00 0.65 C ATOM 2330 OG SER A 145 3.797 -15.180 13.037 1.00 1.43 O ATOM 0 H SER A 145 3.786 -13.691 11.138 1.00 0.51 H new ATOM 0 HA SER A 145 1.832 -15.734 11.189 1.00 0.56 H new ATOM 0 HB2 SER A 145 2.448 -13.648 13.321 1.00 0.65 H new ATOM 0 HB3 SER A 145 1.808 -15.260 13.569 1.00 0.65 H new ATOM 0 HG SER A 145 4.093 -15.152 13.971 1.00 1.43 H new ATOM 2336 N ASP A 146 -0.421 -14.720 11.454 1.00 0.53 N ATOM 2337 CA ASP A 146 -1.766 -14.183 11.279 1.00 0.51 C ATOM 2338 C ASP A 146 -2.064 -13.098 12.303 1.00 0.48 C ATOM 2339 O ASP A 146 -2.912 -12.235 12.077 1.00 0.46 O ATOM 2340 CB ASP A 146 -2.804 -15.300 11.382 1.00 0.62 C ATOM 2341 CG ASP A 146 -4.215 -14.795 11.164 1.00 1.15 C ATOM 2342 OD1 ASP A 146 -4.488 -14.253 10.073 1.00 1.24 O ATOM 2343 OD2 ASP A 146 -5.057 -14.955 12.073 1.00 2.08 O ATOM 0 H ASP A 146 -0.395 -15.720 11.651 1.00 0.53 H new ATOM 0 HA ASP A 146 -1.820 -13.738 10.286 1.00 0.51 H new ATOM 0 HB2 ASP A 146 -2.579 -16.071 10.646 1.00 0.62 H new ATOM 0 HB3 ASP A 146 -2.735 -15.767 12.364 1.00 0.62 H new ATOM 2348 N GLU A 147 -1.354 -13.146 13.421 1.00 0.51 N ATOM 2349 CA GLU A 147 -1.504 -12.156 14.476 1.00 0.53 C ATOM 2350 C GLU A 147 -1.273 -10.748 13.929 1.00 0.45 C ATOM 2351 O GLU A 147 -2.075 -9.841 14.159 1.00 0.46 O ATOM 2352 CB GLU A 147 -0.515 -12.449 15.607 1.00 0.62 C ATOM 2353 CG GLU A 147 -0.668 -11.537 16.813 1.00 0.72 C ATOM 2354 CD GLU A 147 -1.931 -11.820 17.604 1.00 1.25 C ATOM 2355 OE1 GLU A 147 -1.918 -12.757 18.427 1.00 1.48 O ATOM 2356 OE2 GLU A 147 -2.937 -11.104 17.415 1.00 1.99 O ATOM 0 H GLU A 147 -0.662 -13.868 13.621 1.00 0.51 H new ATOM 0 HA GLU A 147 -2.521 -12.212 14.865 1.00 0.53 H new ATOM 0 HB2 GLU A 147 -0.642 -13.483 15.928 1.00 0.62 H new ATOM 0 HB3 GLU A 147 0.500 -12.357 15.221 1.00 0.62 H new ATOM 0 HG2 GLU A 147 0.198 -11.655 17.465 1.00 0.72 H new ATOM 0 HG3 GLU A 147 -0.678 -10.499 16.480 1.00 0.72 H new ATOM 2363 N LEU A 148 -0.184 -10.574 13.181 1.00 0.41 N ATOM 2364 CA LEU A 148 0.147 -9.270 12.626 1.00 0.37 C ATOM 2365 C LEU A 148 -0.837 -8.872 11.525 1.00 0.31 C ATOM 2366 O LEU A 148 -1.088 -7.685 11.306 1.00 0.29 O ATOM 2367 CB LEU A 148 1.617 -9.214 12.149 1.00 0.37 C ATOM 2368 CG LEU A 148 2.059 -10.208 11.062 1.00 0.35 C ATOM 2369 CD1 LEU A 148 1.611 -9.767 9.681 1.00 0.33 C ATOM 2370 CD2 LEU A 148 3.571 -10.362 11.076 1.00 0.38 C ATOM 0 H LEU A 148 0.477 -11.315 12.949 1.00 0.41 H new ATOM 0 HA LEU A 148 0.049 -8.532 13.422 1.00 0.37 H new ATOM 0 HB2 LEU A 148 1.811 -8.207 11.780 1.00 0.37 H new ATOM 0 HB3 LEU A 148 2.257 -9.363 13.019 1.00 0.37 H new ATOM 0 HG LEU A 148 1.587 -11.165 11.284 1.00 0.35 H new ATOM 0 HD11 LEU A 148 1.943 -10.495 8.941 1.00 0.33 H new ATOM 0 HD12 LEU A 148 0.524 -9.695 9.657 1.00 0.33 H new ATOM 0 HD13 LEU A 148 2.044 -8.794 9.451 1.00 0.33 H new ATOM 0 HD21 LEU A 148 3.872 -11.068 10.302 1.00 0.38 H new ATOM 0 HD22 LEU A 148 4.037 -9.395 10.886 1.00 0.38 H new ATOM 0 HD23 LEU A 148 3.890 -10.733 12.050 1.00 0.38 H new ATOM 2382 N LYS A 149 -1.406 -9.857 10.838 1.00 0.31 N ATOM 2383 CA LYS A 149 -2.394 -9.566 9.805 1.00 0.29 C ATOM 2384 C LYS A 149 -3.677 -9.054 10.448 1.00 0.29 C ATOM 2385 O LYS A 149 -4.220 -8.032 10.050 1.00 0.28 O ATOM 2386 CB LYS A 149 -2.722 -10.799 8.957 1.00 0.35 C ATOM 2387 CG LYS A 149 -1.512 -11.535 8.415 1.00 0.78 C ATOM 2388 CD LYS A 149 -1.790 -12.134 7.042 1.00 0.80 C ATOM 2389 CE LYS A 149 -3.066 -12.973 7.003 1.00 0.83 C ATOM 2390 NZ LYS A 149 -2.970 -14.209 7.825 1.00 1.22 N ATOM 0 H LYS A 149 -1.205 -10.848 10.974 1.00 0.31 H new ATOM 0 HA LYS A 149 -1.964 -8.808 9.151 1.00 0.29 H new ATOM 0 HB2 LYS A 149 -3.312 -11.491 9.559 1.00 0.35 H new ATOM 0 HB3 LYS A 149 -3.348 -10.491 8.120 1.00 0.35 H new ATOM 0 HG2 LYS A 149 -0.667 -10.849 8.349 1.00 0.78 H new ATOM 0 HG3 LYS A 149 -1.227 -12.327 9.107 1.00 0.78 H new ATOM 0 HD2 LYS A 149 -1.868 -11.330 6.310 1.00 0.80 H new ATOM 0 HD3 LYS A 149 -0.945 -12.755 6.745 1.00 0.80 H new ATOM 0 HE2 LYS A 149 -3.902 -12.371 7.358 1.00 0.83 H new ATOM 0 HE3 LYS A 149 -3.285 -13.245 5.970 1.00 0.83 H new ATOM 0 HZ1 LYS A 149 -3.541 -14.961 7.389 1.00 1.22 H new ATOM 0 HZ2 LYS A 149 -1.977 -14.514 7.878 1.00 1.22 H new ATOM 0 HZ3 LYS A 149 -3.325 -14.017 8.784 1.00 1.22 H new ATOM 2404 N GLU A 150 -4.151 -9.764 11.457 1.00 0.33 N ATOM 2405 CA GLU A 150 -5.349 -9.356 12.174 1.00 0.35 C ATOM 2406 C GLU A 150 -5.152 -7.962 12.765 1.00 0.34 C ATOM 2407 O GLU A 150 -6.091 -7.167 12.859 1.00 0.35 O ATOM 2408 CB GLU A 150 -5.679 -10.365 13.273 1.00 0.42 C ATOM 2409 CG GLU A 150 -6.994 -10.089 13.978 1.00 1.02 C ATOM 2410 CD GLU A 150 -7.279 -11.089 15.073 1.00 1.39 C ATOM 2411 OE1 GLU A 150 -7.820 -12.171 14.764 1.00 1.83 O ATOM 2412 OE2 GLU A 150 -6.964 -10.795 16.245 1.00 2.00 O ATOM 0 H GLU A 150 -3.726 -10.626 11.799 1.00 0.33 H new ATOM 0 HA GLU A 150 -6.186 -9.324 11.477 1.00 0.35 H new ATOM 0 HB2 GLU A 150 -5.712 -11.364 12.839 1.00 0.42 H new ATOM 0 HB3 GLU A 150 -4.875 -10.364 14.009 1.00 0.42 H new ATOM 0 HG2 GLU A 150 -6.972 -9.085 14.403 1.00 1.02 H new ATOM 0 HG3 GLU A 150 -7.805 -10.110 13.250 1.00 1.02 H new ATOM 2419 N ARG A 151 -3.922 -7.680 13.168 1.00 0.33 N ATOM 2420 CA ARG A 151 -3.547 -6.359 13.642 1.00 0.35 C ATOM 2421 C ARG A 151 -3.863 -5.301 12.579 1.00 0.30 C ATOM 2422 O ARG A 151 -4.435 -4.256 12.890 1.00 0.32 O ATOM 2423 CB ARG A 151 -2.056 -6.336 13.987 1.00 0.41 C ATOM 2424 CG ARG A 151 -1.603 -5.090 14.730 1.00 1.21 C ATOM 2425 CD ARG A 151 -0.094 -5.083 14.902 1.00 1.20 C ATOM 2426 NE ARG A 151 0.373 -3.983 15.742 1.00 1.71 N ATOM 2427 CZ ARG A 151 1.159 -2.998 15.308 1.00 1.97 C ATOM 2428 NH1 ARG A 151 1.486 -2.923 14.025 1.00 1.74 N ATOM 2429 NH2 ARG A 151 1.604 -2.083 16.158 1.00 2.88 N ATOM 0 H ARG A 151 -3.160 -8.358 13.175 1.00 0.33 H new ATOM 0 HA ARG A 151 -4.122 -6.129 14.539 1.00 0.35 H new ATOM 0 HB2 ARG A 151 -1.822 -7.211 14.593 1.00 0.41 H new ATOM 0 HB3 ARG A 151 -1.481 -6.424 13.065 1.00 0.41 H new ATOM 0 HG2 ARG A 151 -1.915 -4.201 14.182 1.00 1.21 H new ATOM 0 HG3 ARG A 151 -2.085 -5.048 15.707 1.00 1.21 H new ATOM 0 HD2 ARG A 151 0.222 -6.029 15.341 1.00 1.20 H new ATOM 0 HD3 ARG A 151 0.379 -5.013 13.922 1.00 1.20 H new ATOM 0 HE ARG A 151 0.080 -3.968 16.719 1.00 1.71 H new ATOM 0 HH11 ARG A 151 1.136 -3.620 13.368 1.00 1.74 H new ATOM 0 HH12 ARG A 151 2.088 -2.168 13.695 1.00 1.74 H new ATOM 0 HH21 ARG A 151 1.345 -2.133 17.143 1.00 2.88 H new ATOM 0 HH22 ARG A 151 2.206 -1.329 15.827 1.00 2.88 H new ATOM 2443 N PHE A 152 -3.517 -5.586 11.318 1.00 0.28 N ATOM 2444 CA PHE A 152 -3.761 -4.629 10.239 1.00 0.27 C ATOM 2445 C PHE A 152 -5.261 -4.475 9.973 1.00 0.23 C ATOM 2446 O PHE A 152 -5.735 -3.365 9.766 1.00 0.24 O ATOM 2447 CB PHE A 152 -2.999 -5.010 8.940 1.00 0.30 C ATOM 2448 CG PHE A 152 -3.840 -5.641 7.849 1.00 0.25 C ATOM 2449 CD1 PHE A 152 -4.766 -4.891 7.136 1.00 0.21 C ATOM 2450 CD2 PHE A 152 -3.709 -6.985 7.545 1.00 0.28 C ATOM 2451 CE1 PHE A 152 -5.543 -5.468 6.157 1.00 0.19 C ATOM 2452 CE2 PHE A 152 -4.481 -7.568 6.560 1.00 0.26 C ATOM 2453 CZ PHE A 152 -5.402 -6.809 5.868 1.00 0.21 C ATOM 0 H PHE A 152 -3.075 -6.457 11.025 1.00 0.28 H new ATOM 0 HA PHE A 152 -3.372 -3.665 10.567 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -2.530 -4.112 8.539 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -2.196 -5.700 9.200 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -4.878 -3.839 7.353 1.00 0.21 H new ATOM 0 HD2 PHE A 152 -2.993 -7.586 8.086 1.00 0.28 H new ATOM 0 HE1 PHE A 152 -6.262 -4.871 5.616 1.00 0.19 H new ATOM 0 HE2 PHE A 152 -4.364 -8.617 6.331 1.00 0.26 H new ATOM 0 HZ PHE A 152 -6.011 -7.264 5.101 1.00 0.21 H new ATOM 2463 N VAL A 153 -6.009 -5.583 9.976 1.00 0.22 N ATOM 2464 CA VAL A 153 -7.442 -5.522 9.677 1.00 0.22 C ATOM 2465 C VAL A 153 -8.156 -4.712 10.757 1.00 0.25 C ATOM 2466 O VAL A 153 -9.100 -3.976 10.477 1.00 0.28 O ATOM 2467 CB VAL A 153 -8.094 -6.934 9.543 1.00 0.23 C ATOM 2468 CG1 VAL A 153 -7.220 -7.868 8.725 1.00 0.23 C ATOM 2469 CG2 VAL A 153 -8.395 -7.561 10.893 1.00 0.28 C ATOM 0 H VAL A 153 -5.653 -6.517 10.178 1.00 0.22 H new ATOM 0 HA VAL A 153 -7.551 -5.034 8.708 1.00 0.22 H new ATOM 0 HB VAL A 153 -9.041 -6.787 9.024 1.00 0.23 H new ATOM 0 HG11 VAL A 153 -7.701 -8.843 8.650 1.00 0.23 H new ATOM 0 HG12 VAL A 153 -7.080 -7.454 7.726 1.00 0.23 H new ATOM 0 HG13 VAL A 153 -6.251 -7.978 9.211 1.00 0.23 H new ATOM 0 HG21 VAL A 153 -8.847 -8.542 10.746 1.00 0.28 H new ATOM 0 HG22 VAL A 153 -7.469 -7.669 11.458 1.00 0.28 H new ATOM 0 HG23 VAL A 153 -9.085 -6.922 11.445 1.00 0.28 H new ATOM 2479 N SER A 154 -7.679 -4.838 11.991 1.00 0.28 N ATOM 2480 CA SER A 154 -8.210 -4.059 13.094 1.00 0.33 C ATOM 2481 C SER A 154 -7.834 -2.593 12.904 1.00 0.32 C ATOM 2482 O SER A 154 -8.654 -1.697 13.102 1.00 0.35 O ATOM 2483 CB SER A 154 -7.668 -4.595 14.422 1.00 0.38 C ATOM 2484 OG SER A 154 -7.905 -5.993 14.537 1.00 1.05 O ATOM 0 H SER A 154 -6.925 -5.474 12.248 1.00 0.28 H new ATOM 0 HA SER A 154 -9.297 -4.142 13.114 1.00 0.33 H new ATOM 0 HB2 SER A 154 -6.598 -4.396 14.490 1.00 0.38 H new ATOM 0 HB3 SER A 154 -8.143 -4.072 15.252 1.00 0.38 H new ATOM 0 HG SER A 154 -7.295 -6.478 13.943 1.00 1.05 H new ATOM 2490 N PHE A 155 -6.599 -2.364 12.475 1.00 0.29 N ATOM 2491 CA PHE A 155 -6.127 -1.021 12.180 1.00 0.29 C ATOM 2492 C PHE A 155 -6.933 -0.416 11.034 1.00 0.28 C ATOM 2493 O PHE A 155 -7.184 0.790 11.008 1.00 0.30 O ATOM 2494 CB PHE A 155 -4.638 -1.043 11.828 1.00 0.29 C ATOM 2495 CG PHE A 155 -4.042 0.327 11.690 1.00 0.31 C ATOM 2496 CD1 PHE A 155 -3.834 1.112 12.811 1.00 0.41 C ATOM 2497 CD2 PHE A 155 -3.704 0.837 10.445 1.00 0.26 C ATOM 2498 CE1 PHE A 155 -3.296 2.377 12.696 1.00 0.45 C ATOM 2499 CE2 PHE A 155 -3.170 2.102 10.324 1.00 0.30 C ATOM 2500 CZ PHE A 155 -2.965 2.873 11.453 1.00 0.39 C ATOM 0 H PHE A 155 -5.905 -3.096 12.324 1.00 0.29 H new ATOM 0 HA PHE A 155 -6.264 -0.403 13.067 1.00 0.29 H new ATOM 0 HB2 PHE A 155 -4.097 -1.591 12.599 1.00 0.29 H new ATOM 0 HB3 PHE A 155 -4.500 -1.588 10.894 1.00 0.29 H new ATOM 0 HD1 PHE A 155 -4.096 0.730 13.787 1.00 0.41 H new ATOM 0 HD2 PHE A 155 -3.861 0.237 9.561 1.00 0.26 H new ATOM 0 HE1 PHE A 155 -3.134 2.978 13.579 1.00 0.45 H new ATOM 0 HE2 PHE A 155 -2.912 2.490 9.350 1.00 0.30 H new ATOM 0 HZ PHE A 155 -2.546 3.864 11.361 1.00 0.39 H new ATOM 2510 N ALA A 156 -7.348 -1.266 10.095 1.00 0.25 N ATOM 2511 CA ALA A 156 -8.205 -0.843 8.995 1.00 0.25 C ATOM 2512 C ALA A 156 -9.476 -0.213 9.543 1.00 0.28 C ATOM 2513 O ALA A 156 -9.914 0.850 9.095 1.00 0.28 O ATOM 2514 CB ALA A 156 -8.569 -2.025 8.102 1.00 0.25 C ATOM 0 H ALA A 156 -7.101 -2.256 10.077 1.00 0.25 H new ATOM 0 HA ALA A 156 -7.659 -0.112 8.400 1.00 0.25 H new ATOM 0 HB1 ALA A 156 -9.209 -1.683 7.289 1.00 0.25 H new ATOM 0 HB2 ALA A 156 -7.660 -2.463 7.689 1.00 0.25 H new ATOM 0 HB3 ALA A 156 -9.098 -2.775 8.689 1.00 0.25 H new ATOM 2520 N LYS A 157 -10.048 -0.876 10.537 1.00 0.33 N ATOM 2521 CA LYS A 157 -11.270 -0.414 11.173 1.00 0.39 C ATOM 2522 C LYS A 157 -10.991 0.741 12.127 1.00 0.41 C ATOM 2523 O LYS A 157 -11.884 1.525 12.438 1.00 0.44 O ATOM 2524 CB LYS A 157 -11.940 -1.574 11.903 1.00 0.50 C ATOM 2525 CG LYS A 157 -12.398 -2.669 10.956 1.00 0.78 C ATOM 2526 CD LYS A 157 -11.982 -4.045 11.434 1.00 0.70 C ATOM 2527 CE LYS A 157 -12.286 -5.096 10.379 1.00 0.55 C ATOM 2528 NZ LYS A 157 -11.948 -6.469 10.839 1.00 0.75 N ATOM 0 H LYS A 157 -9.679 -1.745 10.923 1.00 0.33 H new ATOM 0 HA LYS A 157 -11.946 -0.044 10.402 1.00 0.39 H new ATOM 0 HB2 LYS A 157 -11.243 -1.993 12.629 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -12.797 -1.200 12.463 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -13.483 -2.632 10.857 1.00 0.78 H new ATOM 0 HG3 LYS A 157 -11.982 -2.488 9.965 1.00 0.78 H new ATOM 0 HD2 LYS A 157 -10.916 -4.049 11.662 1.00 0.70 H new ATOM 0 HD3 LYS A 157 -12.506 -4.288 12.358 1.00 0.70 H new ATOM 0 HE2 LYS A 157 -13.344 -5.052 10.119 1.00 0.55 H new ATOM 0 HE3 LYS A 157 -11.725 -4.870 9.472 1.00 0.55 H new ATOM 0 HZ1 LYS A 157 -11.827 -7.091 10.015 1.00 0.75 H new ATOM 0 HZ2 LYS A 157 -11.064 -6.444 11.386 1.00 0.75 H new ATOM 0 HZ3 LYS A 157 -12.716 -6.833 11.438 1.00 0.75 H new ATOM 2542 N SER A 158 -9.747 0.849 12.578 1.00 0.48 N ATOM 2543 CA SER A 158 -9.337 1.961 13.422 1.00 0.58 C ATOM 2544 C SER A 158 -9.342 3.254 12.607 1.00 0.49 C ATOM 2545 O SER A 158 -9.649 4.328 13.128 1.00 0.55 O ATOM 2546 CB SER A 158 -7.951 1.699 14.022 1.00 0.81 C ATOM 2547 OG SER A 158 -7.657 2.620 15.063 1.00 1.39 O ATOM 0 H SER A 158 -9.006 0.179 12.372 1.00 0.48 H new ATOM 0 HA SER A 158 -10.044 2.063 14.246 1.00 0.58 H new ATOM 0 HB2 SER A 158 -7.907 0.682 14.410 1.00 0.81 H new ATOM 0 HB3 SER A 158 -7.194 1.775 13.241 1.00 0.81 H new ATOM 0 HG SER A 158 -6.768 2.428 15.428 1.00 1.39 H new ATOM 2553 N LEU A 159 -9.007 3.142 11.320 1.00 0.43 N ATOM 2554 CA LEU A 159 -9.123 4.272 10.406 1.00 0.46 C ATOM 2555 C LEU A 159 -10.593 4.631 10.194 1.00 0.38 C ATOM 2556 O LEU A 159 -10.931 5.788 9.952 1.00 0.55 O ATOM 2557 CB LEU A 159 -8.468 3.973 9.046 1.00 0.61 C ATOM 2558 CG LEU A 159 -6.981 4.344 8.895 1.00 0.30 C ATOM 2559 CD1 LEU A 159 -6.621 5.559 9.742 1.00 0.34 C ATOM 2560 CD2 LEU A 159 -6.072 3.167 9.215 1.00 0.76 C ATOM 0 H LEU A 159 -8.656 2.285 10.893 1.00 0.43 H new ATOM 0 HA LEU A 159 -8.599 5.114 10.859 1.00 0.46 H new ATOM 0 HB2 LEU A 159 -8.574 2.907 8.845 1.00 0.61 H new ATOM 0 HB3 LEU A 159 -9.030 4.500 8.275 1.00 0.61 H new ATOM 0 HG LEU A 159 -6.821 4.607 7.849 1.00 0.30 H new ATOM 0 HD11 LEU A 159 -5.564 5.793 9.612 1.00 0.34 H new ATOM 0 HD12 LEU A 159 -7.223 6.412 9.429 1.00 0.34 H new ATOM 0 HD13 LEU A 159 -6.818 5.342 10.792 1.00 0.34 H new ATOM 0 HD21 LEU A 159 -5.031 3.468 9.097 1.00 0.76 H new ATOM 0 HD22 LEU A 159 -6.242 2.845 10.242 1.00 0.76 H new ATOM 0 HD23 LEU A 159 -6.290 2.343 8.535 1.00 0.76 H new ATOM 2572 N GLY A 160 -11.463 3.631 10.305 1.00 0.31 N ATOM 2573 CA GLY A 160 -12.887 3.851 10.112 1.00 0.41 C ATOM 2574 C GLY A 160 -13.474 2.917 9.073 1.00 0.35 C ATOM 2575 O GLY A 160 -14.678 2.936 8.799 1.00 0.42 O ATOM 0 H GLY A 160 -11.207 2.669 10.526 1.00 0.31 H new ATOM 0 HA2 GLY A 160 -13.407 3.710 11.060 1.00 0.41 H new ATOM 0 HA3 GLY A 160 -13.055 4.884 9.807 1.00 0.41 H new ATOM 2579 N LEU A 161 -12.627 2.087 8.494 1.00 0.38 N ATOM 2580 CA LEU A 161 -13.052 1.184 7.443 1.00 0.35 C ATOM 2581 C LEU A 161 -13.649 -0.096 8.017 1.00 0.37 C ATOM 2582 O LEU A 161 -13.593 -0.339 9.216 1.00 0.58 O ATOM 2583 CB LEU A 161 -11.879 0.874 6.523 1.00 0.32 C ATOM 2584 CG LEU A 161 -12.003 1.461 5.119 1.00 0.33 C ATOM 2585 CD1 LEU A 161 -10.635 1.861 4.586 1.00 0.39 C ATOM 2586 CD2 LEU A 161 -12.663 0.443 4.200 1.00 0.35 C ATOM 0 H LEU A 161 -11.638 2.020 8.735 1.00 0.38 H new ATOM 0 HA LEU A 161 -13.835 1.673 6.864 1.00 0.35 H new ATOM 0 HB2 LEU A 161 -10.965 1.251 6.981 1.00 0.32 H new ATOM 0 HB3 LEU A 161 -11.773 -0.208 6.443 1.00 0.32 H new ATOM 0 HG LEU A 161 -12.623 2.357 5.158 1.00 0.33 H new ATOM 0 HD11 LEU A 161 -10.742 2.277 3.584 1.00 0.39 H new ATOM 0 HD12 LEU A 161 -10.192 2.609 5.244 1.00 0.39 H new ATOM 0 HD13 LEU A 161 -9.989 0.984 4.547 1.00 0.39 H new ATOM 0 HD21 LEU A 161 -12.752 0.862 3.198 1.00 0.35 H new ATOM 0 HD22 LEU A 161 -12.056 -0.461 4.163 1.00 0.35 H new ATOM 0 HD23 LEU A 161 -13.655 0.199 4.580 1.00 0.35 H new ATOM 2598 N LYS A 162 -14.249 -0.892 7.147 1.00 0.40 N ATOM 2599 CA LYS A 162 -14.960 -2.094 7.556 1.00 0.42 C ATOM 2600 C LYS A 162 -14.358 -3.326 6.899 1.00 0.36 C ATOM 2601 O LYS A 162 -13.827 -3.252 5.794 1.00 0.35 O ATOM 2602 CB LYS A 162 -16.435 -1.948 7.181 1.00 0.52 C ATOM 2603 CG LYS A 162 -16.638 -1.442 5.763 1.00 0.86 C ATOM 2604 CD LYS A 162 -17.367 -0.097 5.701 1.00 0.93 C ATOM 2605 CE LYS A 162 -16.631 1.043 6.408 1.00 0.77 C ATOM 2606 NZ LYS A 162 -16.762 1.001 7.894 1.00 1.46 N ATOM 0 H LYS A 162 -14.258 -0.725 6.141 1.00 0.40 H new ATOM 0 HA LYS A 162 -14.870 -2.219 8.635 1.00 0.42 H new ATOM 0 HB2 LYS A 162 -16.930 -2.913 7.291 1.00 0.52 H new ATOM 0 HB3 LYS A 162 -16.916 -1.262 7.878 1.00 0.52 H new ATOM 0 HG2 LYS A 162 -15.667 -1.345 5.276 1.00 0.86 H new ATOM 0 HG3 LYS A 162 -17.205 -2.182 5.198 1.00 0.86 H new ATOM 0 HD2 LYS A 162 -17.518 0.175 4.656 1.00 0.93 H new ATOM 0 HD3 LYS A 162 -18.355 -0.210 6.147 1.00 0.93 H new ATOM 0 HE2 LYS A 162 -15.575 1.003 6.142 1.00 0.77 H new ATOM 0 HE3 LYS A 162 -17.016 1.995 6.043 1.00 0.77 H new ATOM 0 HZ1 LYS A 162 -16.437 1.903 8.297 1.00 1.46 H new ATOM 0 HZ2 LYS A 162 -17.758 0.846 8.150 1.00 1.46 H new ATOM 0 HZ3 LYS A 162 -16.182 0.225 8.272 1.00 1.46 H new ATOM 2620 N ASP A 163 -14.437 -4.448 7.614 1.00 0.40 N ATOM 2621 CA ASP A 163 -13.912 -5.740 7.164 1.00 0.41 C ATOM 2622 C ASP A 163 -14.458 -6.133 5.794 1.00 0.39 C ATOM 2623 O ASP A 163 -13.820 -6.884 5.053 1.00 0.42 O ATOM 2624 CB ASP A 163 -14.271 -6.822 8.184 1.00 0.52 C ATOM 2625 CG ASP A 163 -13.427 -8.072 8.041 1.00 0.81 C ATOM 2626 OD1 ASP A 163 -13.733 -8.891 7.145 1.00 1.81 O ATOM 2627 OD2 ASP A 163 -12.450 -8.231 8.800 1.00 0.91 O ATOM 0 H ASP A 163 -14.873 -4.487 8.535 1.00 0.40 H new ATOM 0 HA ASP A 163 -12.830 -5.645 7.077 1.00 0.41 H new ATOM 0 HB2 ASP A 163 -14.149 -6.421 9.190 1.00 0.52 H new ATOM 0 HB3 ASP A 163 -15.323 -7.085 8.072 1.00 0.52 H new ATOM 2632 N ASN A 164 -15.635 -5.617 5.453 1.00 0.39 N ATOM 2633 CA ASN A 164 -16.248 -5.900 4.152 1.00 0.43 C ATOM 2634 C ASN A 164 -15.467 -5.191 3.042 1.00 0.38 C ATOM 2635 O ASN A 164 -15.743 -5.355 1.861 1.00 0.47 O ATOM 2636 CB ASN A 164 -17.719 -5.463 4.138 1.00 0.52 C ATOM 2637 CG ASN A 164 -18.553 -6.194 3.088 1.00 1.34 C ATOM 2638 OD1 ASN A 164 -19.844 -6.330 3.346 1.00 2.34 O flip ATOM 2639 ND2 ASN A 164 -18.052 -6.632 2.058 1.00 1.68 N flip ATOM 0 H ASN A 164 -16.184 -5.003 6.054 1.00 0.39 H new ATOM 0 HA ASN A 164 -16.213 -6.975 3.976 1.00 0.43 H new ATOM 0 HB2 ASN A 164 -18.153 -5.637 5.123 1.00 0.52 H new ATOM 0 HB3 ASN A 164 -17.771 -4.390 3.952 1.00 0.52 H new ATOM 0 HD21 ASN A 164 -17.054 -6.513 1.886 1.00 1.68 H new ATOM 0 HD22 ASN A 164 -18.633 -7.116 1.374 1.00 1.68 H new ATOM 2646 N ASN A 165 -14.490 -4.390 3.439 1.00 0.32 N ATOM 2647 CA ASN A 165 -13.564 -3.778 2.502 1.00 0.31 C ATOM 2648 C ASN A 165 -12.128 -4.152 2.862 1.00 0.26 C ATOM 2649 O ASN A 165 -11.190 -3.434 2.546 1.00 0.27 O ATOM 2650 CB ASN A 165 -13.740 -2.256 2.485 1.00 0.35 C ATOM 2651 CG ASN A 165 -14.737 -1.783 1.438 1.00 0.53 C ATOM 2652 OD1 ASN A 165 -15.392 -0.757 1.611 1.00 1.40 O ATOM 2653 ND2 ASN A 165 -14.852 -2.515 0.340 1.00 0.61 N ATOM 0 H ASN A 165 -14.318 -4.148 4.415 1.00 0.32 H new ATOM 0 HA ASN A 165 -13.780 -4.154 1.502 1.00 0.31 H new ATOM 0 HB2 ASN A 165 -14.070 -1.923 3.469 1.00 0.35 H new ATOM 0 HB3 ASN A 165 -12.774 -1.787 2.297 1.00 0.35 H new ATOM 0 HD21 ASN A 165 -15.500 -2.233 -0.395 1.00 0.61 H new ATOM 0 HD22 ASN A 165 -14.293 -3.361 0.230 1.00 0.61 H new ATOM 2660 N ILE A 166 -11.968 -5.287 3.530 1.00 0.25 N ATOM 2661 CA ILE A 166 -10.648 -5.774 3.925 1.00 0.22 C ATOM 2662 C ILE A 166 -10.431 -7.193 3.407 1.00 0.24 C ATOM 2663 O ILE A 166 -11.222 -8.086 3.692 1.00 0.33 O ATOM 2664 CB ILE A 166 -10.495 -5.770 5.466 1.00 0.23 C ATOM 2665 CG1 ILE A 166 -10.834 -4.388 6.022 1.00 0.25 C ATOM 2666 CG2 ILE A 166 -9.088 -6.194 5.886 1.00 0.24 C ATOM 2667 CD1 ILE A 166 -10.761 -4.302 7.527 1.00 0.26 C ATOM 0 H ILE A 166 -12.739 -5.892 3.812 1.00 0.25 H new ATOM 0 HA ILE A 166 -9.903 -5.106 3.492 1.00 0.22 H new ATOM 0 HB ILE A 166 -11.193 -6.497 5.881 1.00 0.23 H new ATOM 0 HG12 ILE A 166 -10.150 -3.656 5.592 1.00 0.25 H new ATOM 0 HG13 ILE A 166 -11.839 -4.114 5.700 1.00 0.25 H new ATOM 0 HG21 ILE A 166 -9.013 -6.181 6.973 1.00 0.24 H new ATOM 0 HG22 ILE A 166 -8.887 -7.201 5.521 1.00 0.24 H new ATOM 0 HG23 ILE A 166 -8.358 -5.503 5.464 1.00 0.24 H new ATOM 0 HD11 ILE A 166 -11.015 -3.291 7.846 1.00 0.26 H new ATOM 0 HD12 ILE A 166 -11.465 -5.009 7.966 1.00 0.26 H new ATOM 0 HD13 ILE A 166 -9.751 -4.544 7.857 1.00 0.26 H new ATOM 2679 N VAL A 167 -9.364 -7.394 2.650 1.00 0.25 N ATOM 2680 CA VAL A 167 -9.068 -8.695 2.068 1.00 0.26 C ATOM 2681 C VAL A 167 -7.678 -9.171 2.478 1.00 0.26 C ATOM 2682 O VAL A 167 -6.908 -8.441 3.103 1.00 0.31 O ATOM 2683 CB VAL A 167 -9.142 -8.671 0.519 1.00 0.28 C ATOM 2684 CG1 VAL A 167 -10.547 -8.366 0.026 1.00 0.57 C ATOM 2685 CG2 VAL A 167 -8.130 -7.691 -0.065 1.00 0.72 C ATOM 0 H VAL A 167 -8.684 -6.668 2.423 1.00 0.25 H new ATOM 0 HA VAL A 167 -9.826 -9.381 2.447 1.00 0.26 H new ATOM 0 HB VAL A 167 -8.885 -9.670 0.167 1.00 0.28 H new ATOM 0 HG11 VAL A 167 -10.556 -8.358 -1.064 1.00 0.57 H new ATOM 0 HG12 VAL A 167 -11.234 -9.130 0.389 1.00 0.57 H new ATOM 0 HG13 VAL A 167 -10.860 -7.390 0.398 1.00 0.57 H new ATOM 0 HG21 VAL A 167 -8.205 -7.696 -1.152 1.00 0.72 H new ATOM 0 HG22 VAL A 167 -8.337 -6.688 0.309 1.00 0.72 H new ATOM 0 HG23 VAL A 167 -7.124 -7.988 0.231 1.00 0.72 H new ATOM 2695 N PHE A 168 -7.362 -10.398 2.113 1.00 0.26 N ATOM 2696 CA PHE A 168 -6.051 -10.962 2.367 1.00 0.28 C ATOM 2697 C PHE A 168 -5.452 -11.391 1.041 1.00 0.30 C ATOM 2698 O PHE A 168 -6.015 -12.244 0.352 1.00 0.42 O ATOM 2699 CB PHE A 168 -6.139 -12.151 3.332 1.00 0.33 C ATOM 2700 CG PHE A 168 -6.788 -11.817 4.647 1.00 0.34 C ATOM 2701 CD1 PHE A 168 -6.110 -11.078 5.606 1.00 0.33 C ATOM 2702 CD2 PHE A 168 -8.077 -12.243 4.923 1.00 0.41 C ATOM 2703 CE1 PHE A 168 -6.707 -10.773 6.816 1.00 0.35 C ATOM 2704 CE2 PHE A 168 -8.679 -11.941 6.130 1.00 0.45 C ATOM 2705 CZ PHE A 168 -7.995 -11.206 7.077 1.00 0.40 C ATOM 0 H PHE A 168 -8.004 -11.030 1.634 1.00 0.26 H new ATOM 0 HA PHE A 168 -5.415 -10.212 2.838 1.00 0.28 H new ATOM 0 HB2 PHE A 168 -6.700 -12.954 2.854 1.00 0.33 H new ATOM 0 HB3 PHE A 168 -5.135 -12.531 3.519 1.00 0.33 H new ATOM 0 HD1 PHE A 168 -5.105 -10.737 5.405 1.00 0.33 H new ATOM 0 HD2 PHE A 168 -8.618 -12.818 4.186 1.00 0.41 H new ATOM 0 HE1 PHE A 168 -6.169 -10.198 7.555 1.00 0.35 H new ATOM 0 HE2 PHE A 168 -9.684 -12.280 6.332 1.00 0.45 H new ATOM 0 HZ PHE A 168 -8.464 -10.969 8.020 1.00 0.40 H new ATOM 2715 N SER A 169 -4.332 -10.784 0.682 1.00 0.48 N ATOM 2716 CA SER A 169 -3.760 -10.941 -0.645 1.00 0.63 C ATOM 2717 C SER A 169 -3.526 -12.404 -1.011 1.00 0.50 C ATOM 2718 O SER A 169 -2.749 -13.108 -0.369 1.00 0.66 O ATOM 2719 CB SER A 169 -2.467 -10.145 -0.738 1.00 1.01 C ATOM 2720 OG SER A 169 -1.743 -10.223 0.471 1.00 1.75 O ATOM 0 H SER A 169 -3.797 -10.172 1.298 1.00 0.48 H new ATOM 0 HA SER A 169 -4.479 -10.555 -1.367 1.00 0.63 H new ATOM 0 HB2 SER A 169 -1.858 -10.527 -1.557 1.00 1.01 H new ATOM 0 HB3 SER A 169 -2.692 -9.103 -0.966 1.00 1.01 H new ATOM 0 HG SER A 169 -0.783 -10.253 0.276 1.00 1.75 H new ATOM 2726 N VAL A 170 -4.232 -12.841 -2.044 1.00 0.46 N ATOM 2727 CA VAL A 170 -4.095 -14.187 -2.581 1.00 0.41 C ATOM 2728 C VAL A 170 -2.686 -14.411 -3.110 1.00 0.41 C ATOM 2729 O VAL A 170 -2.119 -13.529 -3.752 1.00 0.43 O ATOM 2730 CB VAL A 170 -5.117 -14.397 -3.721 1.00 0.47 C ATOM 2731 CG1 VAL A 170 -4.950 -15.746 -4.399 1.00 0.55 C ATOM 2732 CG2 VAL A 170 -6.524 -14.226 -3.190 1.00 0.57 C ATOM 0 H VAL A 170 -4.919 -12.269 -2.535 1.00 0.46 H new ATOM 0 HA VAL A 170 -4.285 -14.903 -1.781 1.00 0.41 H new ATOM 0 HB VAL A 170 -4.929 -13.640 -4.482 1.00 0.47 H new ATOM 0 HG11 VAL A 170 -5.690 -15.848 -5.193 1.00 0.55 H new ATOM 0 HG12 VAL A 170 -3.949 -15.818 -4.824 1.00 0.55 H new ATOM 0 HG13 VAL A 170 -5.091 -16.541 -3.667 1.00 0.55 H new ATOM 0 HG21 VAL A 170 -7.239 -14.375 -3.999 1.00 0.57 H new ATOM 0 HG22 VAL A 170 -6.708 -14.958 -2.404 1.00 0.57 H new ATOM 0 HG23 VAL A 170 -6.640 -13.221 -2.784 1.00 0.57 H new ATOM 2742 N PRO A 171 -2.095 -15.578 -2.816 1.00 0.47 N ATOM 2743 CA PRO A 171 -0.790 -15.949 -3.353 1.00 0.54 C ATOM 2744 C PRO A 171 -0.835 -16.039 -4.874 1.00 0.54 C ATOM 2745 O PRO A 171 -1.292 -17.034 -5.440 1.00 0.62 O ATOM 2746 CB PRO A 171 -0.497 -17.316 -2.726 1.00 0.66 C ATOM 2747 CG PRO A 171 -1.814 -17.826 -2.246 1.00 0.83 C ATOM 2748 CD PRO A 171 -2.655 -16.619 -1.938 1.00 0.57 C ATOM 0 HA PRO A 171 -0.018 -15.215 -3.121 1.00 0.54 H new ATOM 0 HB2 PRO A 171 -0.055 -17.995 -3.455 1.00 0.66 H new ATOM 0 HB3 PRO A 171 0.212 -17.226 -1.903 1.00 0.66 H new ATOM 0 HG2 PRO A 171 -2.290 -18.446 -3.006 1.00 0.83 H new ATOM 0 HG3 PRO A 171 -1.689 -18.448 -1.359 1.00 0.83 H new ATOM 0 HD2 PRO A 171 -3.709 -16.799 -2.150 1.00 0.57 H new ATOM 0 HD3 PRO A 171 -2.585 -16.338 -0.887 1.00 0.57 H new ATOM 2756 N THR A 172 -0.385 -14.978 -5.524 1.00 0.65 N ATOM 2757 CA THR A 172 -0.473 -14.861 -6.968 1.00 0.78 C ATOM 2758 C THR A 172 0.425 -15.863 -7.667 1.00 0.73 C ATOM 2759 O THR A 172 1.583 -16.051 -7.288 1.00 0.72 O ATOM 2760 CB THR A 172 -0.063 -13.456 -7.420 1.00 1.07 C ATOM 2761 OG1 THR A 172 -0.630 -12.489 -6.534 1.00 1.78 O ATOM 2762 CG2 THR A 172 -0.525 -13.183 -8.843 1.00 0.81 C ATOM 0 H THR A 172 0.050 -14.177 -5.066 1.00 0.65 H new ATOM 0 HA THR A 172 -1.511 -15.059 -7.237 1.00 0.78 H new ATOM 0 HB THR A 172 1.025 -13.388 -7.397 1.00 1.07 H new ATOM 0 HG1 THR A 172 0.067 -11.865 -6.242 1.00 1.78 H new ATOM 0 HG21 THR A 172 -0.221 -12.179 -9.138 1.00 0.81 H new ATOM 0 HG22 THR A 172 -0.075 -13.911 -9.518 1.00 0.81 H new ATOM 0 HG23 THR A 172 -1.611 -13.263 -8.895 1.00 0.81 H new ATOM 2770 N ASP A 173 -0.105 -16.495 -8.693 1.00 0.75 N ATOM 2771 CA ASP A 173 0.691 -17.387 -9.507 1.00 0.80 C ATOM 2772 C ASP A 173 1.153 -16.655 -10.756 1.00 0.77 C ATOM 2773 O ASP A 173 0.499 -16.687 -11.798 1.00 0.86 O ATOM 2774 CB ASP A 173 -0.098 -18.637 -9.885 1.00 0.99 C ATOM 2775 CG ASP A 173 0.736 -19.620 -10.684 1.00 1.34 C ATOM 2776 OD1 ASP A 173 1.809 -20.032 -10.196 1.00 1.94 O ATOM 2777 OD2 ASP A 173 0.324 -19.979 -11.809 1.00 1.55 O ATOM 0 H ASP A 173 -1.079 -16.408 -8.982 1.00 0.75 H new ATOM 0 HA ASP A 173 1.560 -17.705 -8.930 1.00 0.80 H new ATOM 0 HB2 ASP A 173 -0.461 -19.123 -8.980 1.00 0.99 H new ATOM 0 HB3 ASP A 173 -0.974 -18.350 -10.466 1.00 0.99 H new ATOM 2782 N GLN A 174 2.277 -15.976 -10.609 1.00 0.78 N ATOM 2783 CA GLN A 174 2.935 -15.264 -11.692 1.00 0.94 C ATOM 2784 C GLN A 174 4.360 -14.943 -11.275 1.00 0.89 C ATOM 2785 O GLN A 174 4.801 -15.341 -10.197 1.00 1.21 O ATOM 2786 CB GLN A 174 2.206 -13.959 -12.080 1.00 1.17 C ATOM 2787 CG GLN A 174 1.219 -14.114 -13.228 1.00 1.69 C ATOM 2788 CD GLN A 174 1.749 -14.980 -14.359 1.00 2.98 C ATOM 2789 OE1 GLN A 174 2.951 -15.029 -14.613 1.00 3.60 O ATOM 2790 NE2 GLN A 174 0.853 -15.667 -15.044 1.00 3.76 N ATOM 0 H GLN A 174 2.767 -15.902 -9.718 1.00 0.78 H new ATOM 0 HA GLN A 174 2.920 -15.911 -12.569 1.00 0.94 H new ATOM 0 HB2 GLN A 174 1.674 -13.580 -11.207 1.00 1.17 H new ATOM 0 HB3 GLN A 174 2.948 -13.209 -12.352 1.00 1.17 H new ATOM 0 HG2 GLN A 174 0.295 -14.549 -12.848 1.00 1.69 H new ATOM 0 HG3 GLN A 174 0.969 -13.128 -13.620 1.00 1.69 H new ATOM 0 HE21 GLN A 174 -0.136 -15.599 -14.802 1.00 3.76 H new ATOM 0 HE22 GLN A 174 1.150 -16.265 -15.815 1.00 3.76 H new ATOM 2799 N CYS A 175 5.063 -14.214 -12.122 1.00 0.79 N ATOM 2800 CA CYS A 175 6.455 -13.847 -11.881 1.00 0.85 C ATOM 2801 C CYS A 175 6.565 -12.740 -10.826 1.00 1.02 C ATOM 2802 O CYS A 175 7.185 -11.709 -11.069 1.00 2.06 O ATOM 2803 CB CYS A 175 7.059 -13.367 -13.199 1.00 0.90 C ATOM 2804 SG CYS A 175 6.276 -14.124 -14.662 1.00 1.07 S ATOM 0 H CYS A 175 4.688 -13.856 -13.000 1.00 0.79 H new ATOM 0 HA CYS A 175 6.994 -14.716 -11.504 1.00 0.85 H new ATOM 0 HB2 CYS A 175 6.963 -12.283 -13.263 1.00 0.90 H new ATOM 0 HB3 CYS A 175 8.125 -13.593 -13.207 1.00 0.90 H new ATOM 2809 N ILE A 176 5.980 -12.964 -9.656 1.00 0.60 N ATOM 2810 CA ILE A 176 5.896 -11.935 -8.621 1.00 0.56 C ATOM 2811 C ILE A 176 7.240 -11.739 -7.916 1.00 0.80 C ATOM 2812 O ILE A 176 7.524 -10.660 -7.391 1.00 1.52 O ATOM 2813 CB ILE A 176 4.788 -12.276 -7.583 1.00 0.51 C ATOM 2814 CG1 ILE A 176 4.666 -11.165 -6.531 1.00 0.46 C ATOM 2815 CG2 ILE A 176 5.067 -13.619 -6.919 1.00 0.81 C ATOM 2816 CD1 ILE A 176 3.516 -11.340 -5.551 1.00 0.65 C ATOM 0 H ILE A 176 5.554 -13.854 -9.397 1.00 0.60 H new ATOM 0 HA ILE A 176 5.633 -11.000 -9.115 1.00 0.56 H new ATOM 0 HB ILE A 176 3.838 -12.348 -8.112 1.00 0.51 H new ATOM 0 HG12 ILE A 176 5.599 -11.111 -5.970 1.00 0.46 H new ATOM 0 HG13 ILE A 176 4.547 -10.210 -7.043 1.00 0.46 H new ATOM 0 HG21 ILE A 176 4.280 -13.838 -6.197 1.00 0.81 H new ATOM 0 HG22 ILE A 176 5.092 -14.402 -7.677 1.00 0.81 H new ATOM 0 HG23 ILE A 176 6.029 -13.579 -6.407 1.00 0.81 H new ATOM 0 HD11 ILE A 176 3.509 -10.509 -4.846 1.00 0.65 H new ATOM 0 HD12 ILE A 176 2.573 -11.361 -6.097 1.00 0.65 H new ATOM 0 HD13 ILE A 176 3.641 -12.276 -5.007 1.00 0.65 H new