USER MOD reduce.3.24.130724 H: found=0, std=0, add=1460, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 1464 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 158 MET CE :methyl -135:sc= -0.0917 (180deg=-1.76) USER MOD Set 1.2: A 166 LYS NZ :NH3+ 173:sc= 0.996 (180deg=0.315) USER MOD Set 2.1: A 18 ASN : amide:sc= -2.8! C(o=-3!,f=-5!) USER MOD Set 2.2: A 156 SER OG : rot 109:sc= -0.2 USER MOD Set 3.1: A 129 SER OG : rot -8:sc= 0.721 USER MOD Set 3.2: A 148 ASN : amide:sc= -1.26 K(o=-3.8,f=-7.1!) USER MOD Set 3.3: A 151 CYS SG : rot -51:sc= -3.28! USER MOD Set 4.1: A 10 THR OG1 : rot 40:sc= 0.962 USER MOD Set 4.2: A 130 LYS NZ :NH3+ -154:sc= 0.64 (180deg=-1.01) USER MOD Set 5.1: A 123 ASN : amide:sc= -0.0217 K(o=-2.9,f=-3.8) USER MOD Set 5.2: A 124 MET CE :methyl 178:sc= -2.86 (180deg=-2.87) USER MOD Set 6.1: A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 120 TYR OH : rot 180:sc= -0.028 USER MOD Set 7.1: A 8 GLN : amide:sc= -3.25! C(o=-4.8!,f=-5.8!) USER MOD Set 7.2: A 116 TYR OH : rot 60:sc= -1.54! USER MOD Set 8.1: A 94 CYS SG : rot -100:sc= 1.25 USER MOD Set 8.2: A 96 THR OG1 : rot 121:sc= 1.84 USER MOD Set 9.1: A 82 ASN : amide:sc= -0.191 X(o=-2,f=-1.8) USER MOD Set 9.2: A 95 HIS : no HD1:sc= -1.85 K(o=-2,f=-8.9!) USER MOD Set10.1: A 76 LYS NZ :NH3+ -156:sc= 0.918 (180deg=-1.7!) USER MOD Set10.2: A 77 SER OG : rot -29:sc= 0.642 USER MOD Set10.3: A 190 SER OG : rot 180:sc= 0 USER MOD Set10.4: A 194 ASN : amide:sc= 2.28 K(o=3.8,f=-13!) USER MOD Set11.1: A 62 SER OG : rot -20:sc= -0.487 USER MOD Set11.2: A 125 ASN : amide:sc= 0.843 K(o=0.36,f=-1.9!) USER MOD Set12.1: A 46 ASN :FLIP amide:sc= 1.1 F(o=-1.3,f=1.2) USER MOD Set12.2: A 48 TYR OH : rot -82:sc= 0.0957 USER MOD Set13.1: A 4 LYS NZ :NH3+ -124:sc= 0.482 (180deg=-1.59!) USER MOD Set13.2: A 91 THR OG1 : rot -62:sc= 1.33 USER MOD Single : A 9 GLN : amide:sc= -0.385 X(o=-0.38,f=-0.63) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 23:sc= 0.301 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0334) USER MOD Single : A 28 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0354) USER MOD Single : A 29 THR OG1 : rot 33:sc= 0.358 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -168:sc= -0.0195 (180deg=-0.188) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 36 SER OG : rot -150:sc= 0.855 USER MOD Single : A 37 SER OG : rot 29:sc= 0.053 USER MOD Single : A 38 LYS NZ :NH3+ -167:sc= -0.0302 (180deg=-0.222) USER MOD Single : A 57 SER OG : rot 180:sc= -0.314 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot -79:sc= 0.068 USER MOD Single : A 67 GLN : amide:sc= -1.27! C(o=-1.3!,f=-7.2!) USER MOD Single : A 68 THR OG1 : rot -25:sc= -0.787! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN :FLIP amide:sc= -0.0984 F(o=-1.2,f=-0.098) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl -111:sc= -0.508 (180deg=-2.01!) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 89 SER OG : rot -20:sc= 0.197 USER MOD Single : A 98 THR OG1 : rot -120:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 1.21 K(o=1.2,f=-0.065) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 78:sc= -1.38! USER MOD Single : A 131 SER OG : rot 120:sc= -0.1 USER MOD Single : A 137 TYR OH : rot 46:sc= 0.15 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 HIS : no HE2:sc= 0.855 K(o=0.85,f=-2.9!) USER MOD Single : A 155 CYS SG : rot 50:sc= -5.76! USER MOD Single : A 161 ASN :FLIP amide:sc= 0 F(o=-0.57,f=0) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 76:sc= 0.846 USER MOD Single : A 169 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 172 GLN : amide:sc= -0.344 K(o=-0.34,f=-1.4) USER MOD Single : A 173 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0 USER MOD Single : A 188 MET CE :methyl -145:sc= -1.49 (180deg=-1.76!) USER MOD Single : A 191 ASN : amide:sc=-0.00808 X(o=-0.0081,f=-0.039) USER MOD Single : A 198 ASN : amide:sc= -4.94! C(o=-4.9!,f=-7.6!) USER MOD Single : A 200 LYS NZ :NH3+ -163:sc= -0.0975 (180deg=-0.548) USER MOD Single : A 204 LYS NZ :NH3+ 173:sc= 0.774 (180deg=0.743) USER MOD ----------------------------------------------------------------- ATOM 20 N ASP A 2 -8.766 -4.959 -19.426 1.00 0.84 N ATOM 21 CA ASP A 2 -9.600 -3.909 -18.873 1.00 0.67 C ATOM 22 C ASP A 2 -8.937 -3.351 -17.640 1.00 0.52 C ATOM 23 O ASP A 2 -8.972 -2.153 -17.388 1.00 0.53 O ATOM 24 CB ASP A 2 -10.986 -4.447 -18.517 1.00 0.98 C ATOM 25 CG ASP A 2 -11.763 -4.913 -19.730 1.00 1.50 C ATOM 26 OD1 ASP A 2 -11.415 -5.971 -20.296 1.00 2.25 O ATOM 27 OD2 ASP A 2 -12.721 -4.220 -20.132 1.00 1.72 O ATOM 0 HA ASP A 2 -9.721 -3.123 -19.619 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -10.880 -5.277 -17.818 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.552 -3.669 -18.005 1.00 0.98 H new ATOM 32 N PHE A 3 -8.274 -4.235 -16.906 1.00 0.43 N ATOM 33 CA PHE A 3 -7.597 -3.864 -15.684 1.00 0.34 C ATOM 34 C PHE A 3 -6.428 -2.970 -16.019 1.00 0.37 C ATOM 35 O PHE A 3 -6.113 -2.025 -15.306 1.00 0.40 O ATOM 36 CB PHE A 3 -7.114 -5.109 -14.953 1.00 0.30 C ATOM 37 CG PHE A 3 -8.220 -5.988 -14.440 1.00 0.29 C ATOM 38 CD1 PHE A 3 -8.917 -5.645 -13.296 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.544 -7.169 -15.086 1.00 0.30 C ATOM 40 CE1 PHE A 3 -9.910 -6.457 -12.803 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.542 -7.986 -14.600 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.223 -7.630 -13.456 1.00 0.29 C ATOM 0 H PHE A 3 -8.194 -5.223 -17.145 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.288 -3.329 -15.033 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.485 -5.691 -15.626 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.488 -4.805 -14.114 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.677 -4.726 -12.783 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.009 -7.453 -15.980 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.444 -6.177 -11.907 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -9.790 -8.903 -15.114 1.00 0.31 H new ATOM 0 HZ PHE A 3 -11.003 -8.271 -13.071 1.00 0.29 H new ATOM 52 N LYS A 4 -5.838 -3.253 -17.160 1.00 0.40 N ATOM 53 CA LYS A 4 -4.713 -2.524 -17.653 1.00 0.47 C ATOM 54 C LYS A 4 -5.179 -1.219 -18.273 1.00 0.54 C ATOM 55 O LYS A 4 -4.394 -0.447 -18.795 1.00 0.95 O ATOM 56 CB LYS A 4 -3.984 -3.360 -18.694 1.00 0.54 C ATOM 57 CG LYS A 4 -2.478 -3.230 -18.625 1.00 0.68 C ATOM 58 CD LYS A 4 -1.785 -4.138 -19.621 1.00 0.83 C ATOM 59 CE LYS A 4 -0.275 -3.984 -19.553 1.00 1.10 C ATOM 60 NZ LYS A 4 0.250 -4.291 -18.199 1.00 1.51 N ATOM 0 H LYS A 4 -6.139 -4.010 -17.774 1.00 0.40 H new ATOM 0 HA LYS A 4 -4.035 -2.303 -16.829 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -4.257 -4.407 -18.564 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.321 -3.064 -19.687 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.194 -2.196 -18.818 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.139 -3.471 -17.617 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -2.056 -5.175 -19.421 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -2.131 -3.907 -20.628 1.00 0.83 H new ATOM 0 HE2 LYS A 4 0.191 -4.646 -20.282 1.00 1.10 H new ATOM 0 HE3 LYS A 4 -0.001 -2.965 -19.827 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 0.793 -3.478 -17.845 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 -0.543 -4.485 -17.555 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 0.869 -5.126 -18.248 1.00 1.51 H new ATOM 74 N ALA A 5 -6.475 -1.008 -18.271 1.00 0.45 N ATOM 75 CA ALA A 5 -7.020 0.260 -18.683 1.00 0.47 C ATOM 76 C ALA A 5 -7.201 1.169 -17.480 1.00 0.42 C ATOM 77 O ALA A 5 -6.814 2.334 -17.497 1.00 0.42 O ATOM 78 CB ALA A 5 -8.325 0.051 -19.429 1.00 0.54 C ATOM 0 H ALA A 5 -7.170 -1.699 -17.988 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.322 0.747 -19.364 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.728 1.016 -19.735 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -8.145 -0.564 -20.311 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -9.041 -0.450 -18.777 1.00 0.54 H new ATOM 84 N ILE A 6 -7.725 0.598 -16.408 1.00 0.42 N ATOM 85 CA ILE A 6 -8.100 1.387 -15.241 1.00 0.43 C ATOM 86 C ILE A 6 -6.894 1.635 -14.368 1.00 0.37 C ATOM 87 O ILE A 6 -6.733 2.697 -13.780 1.00 0.38 O ATOM 88 CB ILE A 6 -9.211 0.729 -14.390 1.00 0.53 C ATOM 89 CG1 ILE A 6 -8.872 -0.732 -14.039 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.556 0.842 -15.092 1.00 1.07 C ATOM 91 CD1 ILE A 6 -9.804 -1.766 -14.640 1.00 0.65 C ATOM 0 H ILE A 6 -7.901 -0.403 -16.319 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.496 2.327 -15.625 1.00 0.43 H new ATOM 0 HB ILE A 6 -9.277 1.270 -13.446 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -7.856 -0.944 -14.371 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -8.882 -0.842 -12.955 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -11.327 0.374 -14.479 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -10.801 1.893 -15.242 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.506 0.340 -16.058 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -9.485 -2.763 -14.337 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -10.820 -1.588 -14.289 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -9.778 -1.691 -15.727 1.00 0.65 H new ATOM 103 N ALA A 7 -6.058 0.626 -14.296 1.00 0.33 N ATOM 104 CA ALA A 7 -4.890 0.636 -13.453 1.00 0.31 C ATOM 105 C ALA A 7 -3.752 1.390 -14.093 1.00 0.30 C ATOM 106 O ALA A 7 -3.024 2.115 -13.437 1.00 0.32 O ATOM 107 CB ALA A 7 -4.473 -0.774 -13.226 1.00 0.34 C ATOM 0 H ALA A 7 -6.173 -0.236 -14.829 1.00 0.33 H new ATOM 0 HA ALA A 7 -5.135 1.134 -12.515 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.589 -0.794 -12.589 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.282 -1.319 -12.740 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.242 -1.244 -14.182 1.00 0.34 H new ATOM 113 N GLN A 8 -3.599 1.184 -15.379 1.00 0.31 N ATOM 114 CA GLN A 8 -2.565 1.845 -16.149 1.00 0.34 C ATOM 115 C GLN A 8 -2.822 3.329 -16.197 1.00 0.35 C ATOM 116 O GLN A 8 -1.896 4.135 -16.283 1.00 0.39 O ATOM 117 CB GLN A 8 -2.518 1.282 -17.554 1.00 0.38 C ATOM 118 CG GLN A 8 -1.753 -0.005 -17.656 1.00 0.96 C ATOM 119 CD GLN A 8 -1.063 -0.155 -19.000 1.00 1.04 C ATOM 120 OE1 GLN A 8 -1.643 -0.658 -19.960 1.00 1.59 O ATOM 121 NE2 GLN A 8 0.182 0.285 -19.080 1.00 1.50 N ATOM 0 H GLN A 8 -4.187 0.553 -15.924 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.604 1.668 -15.667 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -3.537 1.119 -17.906 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.065 2.019 -18.218 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -1.009 -0.048 -16.860 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.433 -0.843 -17.502 1.00 0.96 H new ATOM 0 HE21 GLN A 8 0.631 0.697 -18.262 1.00 1.50 H new ATOM 0 HE22 GLN A 8 0.693 0.213 -19.960 1.00 1.50 H new ATOM 130 N GLN A 9 -4.088 3.681 -16.130 1.00 0.36 N ATOM 131 CA GLN A 9 -4.455 5.085 -16.058 1.00 0.40 C ATOM 132 C GLN A 9 -4.347 5.556 -14.620 1.00 0.38 C ATOM 133 O GLN A 9 -3.968 6.693 -14.353 1.00 0.45 O ATOM 134 CB GLN A 9 -5.865 5.331 -16.597 1.00 0.48 C ATOM 135 CG GLN A 9 -5.973 5.178 -18.107 1.00 0.74 C ATOM 136 CD GLN A 9 -5.013 6.080 -18.858 1.00 1.65 C ATOM 137 OE1 GLN A 9 -3.885 5.689 -19.169 1.00 2.47 O ATOM 138 NE2 GLN A 9 -5.444 7.296 -19.144 1.00 2.31 N ATOM 0 H GLN A 9 -4.872 3.029 -16.124 1.00 0.36 H new ATOM 0 HA GLN A 9 -3.768 5.653 -16.685 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.555 4.635 -16.119 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.182 6.336 -16.318 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -5.777 4.140 -18.378 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -6.993 5.401 -18.418 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -6.384 7.582 -18.870 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -4.837 7.949 -19.639 1.00 2.31 H new ATOM 147 N THR A 10 -4.647 4.648 -13.704 1.00 0.34 N ATOM 148 CA THR A 10 -4.606 4.937 -12.284 1.00 0.34 C ATOM 149 C THR A 10 -3.170 5.100 -11.789 1.00 0.30 C ATOM 150 O THR A 10 -2.915 5.902 -10.888 1.00 0.30 O ATOM 151 CB THR A 10 -5.354 3.843 -11.487 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.403 4.440 -10.729 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.436 3.047 -10.566 1.00 0.34 C ATOM 0 H THR A 10 -4.925 3.692 -13.926 1.00 0.34 H new ATOM 0 HA THR A 10 -5.114 5.887 -12.118 1.00 0.34 H new ATOM 0 HB THR A 10 -5.762 3.138 -12.211 1.00 0.37 H new ATOM 0 HG1 THR A 10 -6.839 5.135 -11.265 1.00 0.48 H new ATOM 0 HG21 THR A 10 -5.018 2.295 -10.034 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.663 2.556 -11.158 1.00 0.34 H new ATOM 0 HG23 THR A 10 -3.969 3.720 -9.847 1.00 0.34 H new ATOM 161 N ALA A 11 -2.247 4.324 -12.360 1.00 0.29 N ATOM 162 CA ALA A 11 -0.821 4.507 -12.087 1.00 0.28 C ATOM 163 C ALA A 11 -0.419 5.980 -12.103 1.00 0.30 C ATOM 164 O ALA A 11 0.027 6.523 -11.097 1.00 0.31 O ATOM 165 CB ALA A 11 0.004 3.749 -13.105 1.00 0.31 C ATOM 0 H ALA A 11 -2.460 3.567 -13.010 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.630 4.117 -11.087 1.00 0.28 H new ATOM 0 HB1 ALA A 11 1.064 3.891 -12.893 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.237 2.687 -13.051 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.220 4.122 -14.105 1.00 0.31 H new ATOM 171 N GLN A 12 -0.593 6.626 -13.243 1.00 0.35 N ATOM 172 CA GLN A 12 -0.194 8.018 -13.393 1.00 0.40 C ATOM 173 C GLN A 12 -1.160 8.963 -12.681 1.00 0.40 C ATOM 174 O GLN A 12 -0.876 10.151 -12.541 1.00 0.45 O ATOM 175 CB GLN A 12 -0.094 8.383 -14.867 1.00 0.48 C ATOM 176 CG GLN A 12 -1.411 8.254 -15.599 1.00 0.98 C ATOM 177 CD GLN A 12 -1.273 8.521 -17.081 1.00 0.97 C ATOM 178 OE1 GLN A 12 -0.225 8.265 -17.675 1.00 1.30 O ATOM 179 NE2 GLN A 12 -2.325 9.037 -17.689 1.00 1.64 N ATOM 0 H GLN A 12 -1.007 6.211 -14.078 1.00 0.35 H new ATOM 0 HA GLN A 12 0.785 8.132 -12.928 1.00 0.40 H new ATOM 0 HB2 GLN A 12 0.267 9.407 -14.958 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.645 7.741 -15.345 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -1.811 7.251 -15.449 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.131 8.952 -15.172 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -3.174 9.234 -17.160 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -2.289 9.239 -18.688 1.00 1.64 H new ATOM 188 N GLU A 13 -2.305 8.447 -12.242 1.00 0.38 N ATOM 189 CA GLU A 13 -3.211 9.238 -11.412 1.00 0.39 C ATOM 190 C GLU A 13 -2.601 9.407 -10.036 1.00 0.37 C ATOM 191 O GLU A 13 -2.373 10.521 -9.567 1.00 0.42 O ATOM 192 CB GLU A 13 -4.581 8.575 -11.247 1.00 0.43 C ATOM 193 CG GLU A 13 -5.423 8.521 -12.504 1.00 1.10 C ATOM 194 CD GLU A 13 -6.808 7.975 -12.229 1.00 1.65 C ATOM 195 OE1 GLU A 13 -6.922 6.812 -11.786 1.00 2.54 O ATOM 196 OE2 GLU A 13 -7.794 8.706 -12.448 1.00 1.64 O ATOM 0 H GLU A 13 -2.625 7.499 -12.443 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.353 10.197 -11.910 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -4.434 7.558 -10.883 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.137 9.112 -10.478 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -5.504 9.521 -12.930 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -4.927 7.897 -13.247 1.00 1.10 H new ATOM 203 N VAL A 14 -2.294 8.277 -9.420 1.00 0.34 N ATOM 204 CA VAL A 14 -1.798 8.247 -8.060 1.00 0.33 C ATOM 205 C VAL A 14 -0.408 8.856 -8.008 1.00 0.33 C ATOM 206 O VAL A 14 -0.039 9.610 -7.098 1.00 0.36 O ATOM 207 CB VAL A 14 -1.769 6.795 -7.542 1.00 0.32 C ATOM 208 CG1 VAL A 14 -0.747 5.946 -8.260 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.535 6.755 -6.063 1.00 0.49 C ATOM 0 H VAL A 14 -2.383 7.357 -9.851 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.462 8.830 -7.422 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.750 6.370 -7.754 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.768 4.933 -7.857 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -0.980 5.918 -9.324 1.00 0.53 H new ATOM 0 HG13 VAL A 14 0.246 6.373 -8.117 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.519 5.719 -5.725 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.579 7.226 -5.833 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.336 7.291 -5.553 1.00 0.49 H new ATOM 219 N LEU A 15 0.337 8.557 -9.038 1.00 0.32 N ATOM 220 CA LEU A 15 1.662 9.048 -9.186 1.00 0.33 C ATOM 221 C LEU A 15 1.612 10.486 -9.611 1.00 0.39 C ATOM 222 O LEU A 15 2.567 11.239 -9.445 1.00 0.43 O ATOM 223 CB LEU A 15 2.345 8.171 -10.192 1.00 0.34 C ATOM 224 CG LEU A 15 3.567 8.746 -10.850 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.613 7.666 -10.955 1.00 0.56 C ATOM 226 CD2 LEU A 15 3.232 9.289 -12.231 1.00 0.60 C ATOM 0 H LEU A 15 0.028 7.957 -9.803 1.00 0.32 H new ATOM 0 HA LEU A 15 2.223 9.017 -8.252 1.00 0.33 H new ATOM 0 HB2 LEU A 15 2.626 7.240 -9.700 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.625 7.916 -10.969 1.00 0.34 H new ATOM 0 HG LEU A 15 3.945 9.573 -10.249 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.506 8.070 -11.431 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.865 7.305 -9.958 1.00 0.56 H new ATOM 0 HD13 LEU A 15 4.225 6.841 -11.552 1.00 0.56 H new ATOM 0 HD21 LEU A 15 4.132 9.700 -12.688 1.00 0.60 H new ATOM 0 HD22 LEU A 15 2.844 8.484 -12.854 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.480 10.073 -12.141 1.00 0.60 H new ATOM 238 N GLY A 16 0.458 10.856 -10.123 1.00 0.43 N ATOM 239 CA GLY A 16 0.194 12.243 -10.423 1.00 0.50 C ATOM 240 C GLY A 16 0.248 13.064 -9.160 1.00 0.50 C ATOM 241 O GLY A 16 0.617 14.236 -9.173 1.00 0.57 O ATOM 0 H GLY A 16 -0.308 10.218 -10.339 1.00 0.43 H new ATOM 0 HA2 GLY A 16 0.927 12.614 -11.139 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -0.786 12.342 -10.889 1.00 0.50 H new ATOM 245 N TYR A 17 -0.061 12.410 -8.049 1.00 0.45 N ATOM 246 CA TYR A 17 -0.049 13.070 -6.753 1.00 0.48 C ATOM 247 C TYR A 17 1.344 13.033 -6.165 1.00 0.50 C ATOM 248 O TYR A 17 1.649 13.764 -5.223 1.00 0.64 O ATOM 249 CB TYR A 17 -1.030 12.425 -5.781 1.00 0.49 C ATOM 250 CG TYR A 17 -2.484 12.680 -6.113 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.069 12.113 -7.232 1.00 1.41 C ATOM 252 CD2 TYR A 17 -3.270 13.486 -5.300 1.00 1.59 C ATOM 253 CE1 TYR A 17 -4.396 12.337 -7.538 1.00 2.13 C ATOM 254 CE2 TYR A 17 -4.601 13.716 -5.598 1.00 2.29 C ATOM 255 CZ TYR A 17 -5.157 13.138 -6.718 1.00 2.49 C ATOM 256 OH TYR A 17 -6.482 13.356 -7.020 1.00 3.27 O ATOM 0 H TYR A 17 -0.323 11.425 -8.020 1.00 0.45 H new ATOM 0 HA TYR A 17 -0.358 14.104 -6.908 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -0.855 11.349 -5.765 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -0.827 12.796 -4.776 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -2.476 11.483 -7.878 1.00 1.41 H new ATOM 0 HD2 TYR A 17 -2.835 13.940 -4.422 1.00 1.59 H new ATOM 0 HE1 TYR A 17 -4.835 11.886 -8.416 1.00 2.13 H new ATOM 0 HE2 TYR A 17 -5.201 14.345 -4.957 1.00 2.29 H new ATOM 0 HH TYR A 17 -6.880 13.942 -6.343 1.00 3.27 H new ATOM 266 N ASN A 18 2.204 12.176 -6.704 1.00 0.43 N ATOM 267 CA ASN A 18 3.595 12.201 -6.288 1.00 0.51 C ATOM 268 C ASN A 18 4.372 13.234 -7.113 1.00 0.62 C ATOM 269 O ASN A 18 5.552 13.491 -6.874 1.00 0.77 O ATOM 270 CB ASN A 18 4.214 10.812 -6.416 1.00 0.60 C ATOM 271 CG ASN A 18 5.674 10.779 -5.988 1.00 1.20 C ATOM 272 OD1 ASN A 18 6.076 11.464 -5.049 1.00 2.03 O ATOM 273 ND2 ASN A 18 6.483 10.003 -6.694 1.00 1.65 N ATOM 0 H ASN A 18 1.970 11.476 -7.409 1.00 0.43 H new ATOM 0 HA ASN A 18 3.648 12.494 -5.239 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.645 10.108 -5.809 1.00 0.60 H new ATOM 0 HB3 ASN A 18 4.135 10.477 -7.450 1.00 0.60 H new ATOM 0 HD21 ASN A 18 7.476 9.960 -6.465 1.00 1.65 H new ATOM 0 HD22 ASN A 18 6.113 9.449 -7.466 1.00 1.65 H new ATOM 280 N ARG A 19 3.697 13.850 -8.074 1.00 0.61 N ATOM 281 CA ARG A 19 4.346 14.823 -8.947 1.00 0.80 C ATOM 282 C ARG A 19 3.939 16.242 -8.597 1.00 0.90 C ATOM 283 O ARG A 19 4.642 17.199 -8.926 1.00 1.10 O ATOM 284 CB ARG A 19 4.000 14.515 -10.394 1.00 0.83 C ATOM 285 CG ARG A 19 4.503 13.158 -10.819 1.00 1.26 C ATOM 286 CD ARG A 19 3.753 12.631 -12.024 1.00 1.01 C ATOM 287 NE ARG A 19 3.762 13.564 -13.146 1.00 1.65 N ATOM 288 CZ ARG A 19 3.470 13.219 -14.397 1.00 1.85 C ATOM 289 NH1 ARG A 19 3.213 11.954 -14.700 1.00 1.70 N ATOM 290 NH2 ARG A 19 3.454 14.138 -15.352 1.00 2.72 N ATOM 0 H ARG A 19 2.708 13.696 -8.269 1.00 0.61 H new ATOM 0 HA ARG A 19 5.424 14.747 -8.805 1.00 0.80 H new ATOM 0 HB2 ARG A 19 2.919 14.558 -10.525 1.00 0.83 H new ATOM 0 HB3 ARG A 19 4.430 15.280 -11.040 1.00 0.83 H new ATOM 0 HG2 ARG A 19 5.566 13.221 -11.052 1.00 1.26 H new ATOM 0 HG3 ARG A 19 4.399 12.457 -9.991 1.00 1.26 H new ATOM 0 HD2 ARG A 19 4.197 11.687 -12.339 1.00 1.01 H new ATOM 0 HD3 ARG A 19 2.722 12.420 -11.741 1.00 1.01 H new ATOM 0 HE ARG A 19 4.006 14.537 -12.960 1.00 1.65 H new ATOM 0 HH11 ARG A 19 3.239 11.240 -13.972 1.00 1.70 H new ATOM 0 HH12 ARG A 19 2.990 11.695 -15.661 1.00 1.70 H new ATOM 0 HH21 ARG A 19 3.666 15.110 -15.128 1.00 2.72 H new ATOM 0 HH22 ARG A 19 3.230 13.873 -16.311 1.00 2.72 H new ATOM 304 N ASP A 20 2.809 16.377 -7.933 1.00 0.87 N ATOM 305 CA ASP A 20 2.375 17.680 -7.444 1.00 1.08 C ATOM 306 C ASP A 20 1.628 17.547 -6.132 1.00 0.94 C ATOM 307 O ASP A 20 1.041 16.506 -5.841 1.00 1.32 O ATOM 308 CB ASP A 20 1.512 18.422 -8.463 1.00 1.59 C ATOM 309 CG ASP A 20 0.164 17.771 -8.711 1.00 1.74 C ATOM 310 OD1 ASP A 20 -0.767 17.982 -7.906 1.00 2.16 O ATOM 311 OD2 ASP A 20 0.037 17.018 -9.699 1.00 1.91 O ATOM 0 H ASP A 20 2.174 15.608 -7.718 1.00 0.87 H new ATOM 0 HA ASP A 20 3.278 18.269 -7.282 1.00 1.08 H new ATOM 0 HB2 ASP A 20 1.354 19.443 -8.117 1.00 1.59 H new ATOM 0 HB3 ASP A 20 2.054 18.486 -9.407 1.00 1.59 H new ATOM 316 N THR A 21 1.654 18.611 -5.346 1.00 0.91 N ATOM 317 CA THR A 21 1.124 18.579 -3.995 1.00 1.05 C ATOM 318 C THR A 21 0.285 19.814 -3.703 1.00 1.13 C ATOM 319 O THR A 21 0.733 20.937 -3.945 1.00 1.46 O ATOM 320 CB THR A 21 2.281 18.502 -2.986 1.00 1.45 C ATOM 321 OG1 THR A 21 3.095 19.682 -3.070 1.00 1.82 O ATOM 322 CG2 THR A 21 3.133 17.286 -3.280 1.00 1.70 C ATOM 0 H THR A 21 2.040 19.513 -5.624 1.00 0.91 H new ATOM 0 HA THR A 21 0.488 17.699 -3.903 1.00 1.05 H new ATOM 0 HB THR A 21 1.864 18.426 -1.982 1.00 1.45 H new ATOM 0 HG1 THR A 21 2.572 20.413 -3.459 1.00 1.82 H new ATOM 0 HG21 THR A 21 3.952 17.234 -2.563 1.00 1.70 H new ATOM 0 HG22 THR A 21 2.523 16.386 -3.200 1.00 1.70 H new ATOM 0 HG23 THR A 21 3.538 17.361 -4.289 1.00 1.70 H new ATOM 330 N SER A 22 -0.922 19.608 -3.186 1.00 1.05 N ATOM 331 CA SER A 22 -1.814 20.720 -2.870 1.00 1.30 C ATOM 332 C SER A 22 -3.085 20.245 -2.174 1.00 1.31 C ATOM 333 O SER A 22 -3.467 19.080 -2.289 1.00 2.15 O ATOM 334 CB SER A 22 -2.184 21.470 -4.151 1.00 1.67 C ATOM 335 OG SER A 22 -2.694 20.579 -5.133 1.00 2.19 O ATOM 0 H SER A 22 -1.305 18.686 -2.977 1.00 1.05 H new ATOM 0 HA SER A 22 -1.284 21.385 -2.188 1.00 1.30 H new ATOM 0 HB2 SER A 22 -2.928 22.235 -3.927 1.00 1.67 H new ATOM 0 HB3 SER A 22 -1.306 21.984 -4.542 1.00 1.67 H new ATOM 0 HG SER A 22 -2.925 21.081 -5.942 1.00 2.19 H new ATOM 341 N GLY A 23 -3.718 21.153 -1.438 1.00 0.96 N ATOM 342 CA GLY A 23 -5.037 20.897 -0.889 1.00 1.10 C ATOM 343 C GLY A 23 -5.019 20.088 0.391 1.00 0.89 C ATOM 344 O GLY A 23 -6.074 19.746 0.927 1.00 1.01 O ATOM 0 H GLY A 23 -3.336 22.071 -1.210 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -5.533 21.849 -0.699 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -5.634 20.370 -1.633 1.00 1.10 H new ATOM 348 N TRP A 24 -3.839 19.779 0.892 1.00 0.79 N ATOM 349 CA TRP A 24 -3.730 18.942 2.075 1.00 0.66 C ATOM 350 C TRP A 24 -3.010 19.665 3.204 1.00 0.67 C ATOM 351 O TRP A 24 -2.938 20.896 3.224 1.00 0.83 O ATOM 352 CB TRP A 24 -3.050 17.615 1.725 1.00 0.71 C ATOM 353 CG TRP A 24 -1.636 17.718 1.264 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.721 18.665 1.602 1.00 1.34 C ATOM 355 CD2 TRP A 24 -0.968 16.804 0.404 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.476 18.396 1.010 1.00 1.41 N ATOM 357 CE2 TRP A 24 0.353 17.257 0.265 1.00 0.99 C ATOM 358 CE3 TRP A 24 -1.360 15.643 -0.261 1.00 1.36 C ATOM 359 CZ2 TRP A 24 1.284 16.589 -0.510 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -0.433 14.981 -1.031 1.00 1.67 C ATOM 361 CH2 TRP A 24 0.876 15.455 -1.147 1.00 1.37 C ATOM 0 H TRP A 24 -2.949 20.091 0.504 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.735 18.722 2.434 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.081 16.969 2.602 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.632 17.123 0.946 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.915 19.509 2.247 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.325 18.953 1.107 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -2.370 15.272 -0.173 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 2.296 16.952 -0.607 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -0.721 14.081 -1.554 1.00 1.67 H new ATOM 0 HH2 TRP A 24 1.582 14.910 -1.756 1.00 1.37 H new ATOM 372 N LYS A 25 -2.473 18.888 4.128 1.00 0.60 N ATOM 373 CA LYS A 25 -1.860 19.399 5.320 1.00 0.70 C ATOM 374 C LYS A 25 -1.212 18.251 6.064 1.00 0.61 C ATOM 375 O LYS A 25 -1.894 17.291 6.417 1.00 0.59 O ATOM 376 CB LYS A 25 -2.914 20.025 6.218 1.00 0.89 C ATOM 377 CG LYS A 25 -2.317 20.958 7.239 1.00 1.29 C ATOM 378 CD LYS A 25 -2.711 22.407 6.987 1.00 1.62 C ATOM 379 CE LYS A 25 -2.170 22.925 5.663 1.00 2.23 C ATOM 380 NZ LYS A 25 -0.690 23.069 5.679 1.00 2.95 N ATOM 0 H LYS A 25 -2.455 17.870 4.061 1.00 0.60 H new ATOM 0 HA LYS A 25 -1.118 20.151 5.051 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -3.631 20.572 5.606 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -3.467 19.237 6.729 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -2.644 20.662 8.236 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.231 20.869 7.220 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -3.798 22.493 6.993 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -2.338 23.030 7.799 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -2.458 22.243 4.863 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -2.625 23.890 5.439 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -0.377 23.534 4.803 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -0.406 23.644 6.497 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -0.250 22.129 5.748 1.00 2.95 H new ATOM 394 N VAL A 26 0.091 18.313 6.268 1.00 0.63 N ATOM 395 CA VAL A 26 0.759 17.307 7.073 1.00 0.58 C ATOM 396 C VAL A 26 0.135 17.192 8.435 1.00 0.66 C ATOM 397 O VAL A 26 0.043 18.157 9.196 1.00 0.80 O ATOM 398 CB VAL A 26 2.254 17.546 7.226 1.00 0.64 C ATOM 399 CG1 VAL A 26 2.972 16.930 6.067 1.00 1.22 C ATOM 400 CG2 VAL A 26 2.555 19.011 7.305 1.00 1.56 C ATOM 0 H VAL A 26 0.701 19.039 5.893 1.00 0.63 H new ATOM 0 HA VAL A 26 0.630 16.373 6.527 1.00 0.58 H new ATOM 0 HB VAL A 26 2.594 17.085 8.153 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.044 17.098 6.172 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.774 15.858 6.044 1.00 1.22 H new ATOM 0 HG13 VAL A 26 2.622 17.384 5.140 1.00 1.22 H new ATOM 0 HG21 VAL A 26 3.630 19.156 7.414 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.213 19.502 6.394 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.042 19.442 8.164 1.00 1.56 H new ATOM 410 N VAL A 27 -0.311 16.000 8.714 1.00 0.62 N ATOM 411 CA VAL A 27 -0.952 15.706 9.961 1.00 0.73 C ATOM 412 C VAL A 27 -0.047 14.833 10.818 1.00 0.76 C ATOM 413 O VAL A 27 -0.131 14.850 12.047 1.00 0.90 O ATOM 414 CB VAL A 27 -2.309 15.002 9.725 1.00 0.75 C ATOM 415 CG1 VAL A 27 -2.113 13.713 8.939 1.00 1.21 C ATOM 416 CG2 VAL A 27 -3.026 14.727 11.040 1.00 1.22 C ATOM 0 H VAL A 27 -0.239 15.204 8.080 1.00 0.62 H new ATOM 0 HA VAL A 27 -1.140 16.643 10.484 1.00 0.73 H new ATOM 0 HB VAL A 27 -2.937 15.673 9.139 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -3.078 13.232 8.783 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.661 13.941 7.974 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.459 13.042 9.497 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -3.976 14.232 10.840 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.406 14.084 11.665 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.210 15.668 11.558 1.00 1.22 H new ATOM 426 N LYS A 28 0.842 14.086 10.174 1.00 0.65 N ATOM 427 CA LYS A 28 1.640 13.125 10.908 1.00 0.68 C ATOM 428 C LYS A 28 3.064 13.028 10.382 1.00 0.58 C ATOM 429 O LYS A 28 3.289 12.733 9.212 1.00 0.55 O ATOM 430 CB LYS A 28 0.978 11.747 10.864 1.00 0.77 C ATOM 431 CG LYS A 28 1.202 10.938 12.126 1.00 0.87 C ATOM 432 CD LYS A 28 0.504 11.593 13.305 1.00 1.45 C ATOM 433 CE LYS A 28 0.943 10.988 14.630 1.00 2.02 C ATOM 434 NZ LYS A 28 0.667 9.529 14.698 1.00 2.41 N ATOM 0 H LYS A 28 1.023 14.127 9.171 1.00 0.65 H new ATOM 0 HA LYS A 28 1.696 13.477 11.938 1.00 0.68 H new ATOM 0 HB2 LYS A 28 -0.093 11.870 10.704 1.00 0.77 H new ATOM 0 HB3 LYS A 28 1.366 11.192 10.010 1.00 0.77 H new ATOM 0 HG2 LYS A 28 0.824 9.925 11.988 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.270 10.855 12.328 1.00 0.87 H new ATOM 0 HD2 LYS A 28 0.717 12.662 13.305 1.00 1.45 H new ATOM 0 HD3 LYS A 28 -0.575 11.483 13.195 1.00 1.45 H new ATOM 0 HE2 LYS A 28 2.010 11.162 14.771 1.00 2.02 H new ATOM 0 HE3 LYS A 28 0.427 11.492 15.447 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 0.903 9.175 15.647 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -0.340 9.357 14.505 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 1.245 9.033 13.990 1.00 2.41 H new ATOM 448 N THR A 29 4.019 13.282 11.256 1.00 0.61 N ATOM 449 CA THR A 29 5.422 13.076 10.949 1.00 0.59 C ATOM 450 C THR A 29 6.102 12.385 12.128 1.00 0.72 C ATOM 451 O THR A 29 6.080 12.889 13.250 1.00 0.88 O ATOM 452 CB THR A 29 6.146 14.407 10.650 1.00 0.75 C ATOM 453 OG1 THR A 29 5.960 15.333 11.732 1.00 1.38 O ATOM 454 CG2 THR A 29 5.652 15.034 9.355 1.00 0.82 C ATOM 0 H THR A 29 3.845 13.636 12.197 1.00 0.61 H new ATOM 0 HA THR A 29 5.482 12.453 10.056 1.00 0.59 H new ATOM 0 HB THR A 29 7.207 14.183 10.540 1.00 0.75 H new ATOM 0 HG1 THR A 29 5.904 14.841 12.578 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.184 15.969 9.177 1.00 0.82 H new ATOM 0 HG22 THR A 29 5.835 14.350 8.527 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.583 15.234 9.432 1.00 0.82 H new ATOM 462 N SER A 30 6.689 11.223 11.879 1.00 0.80 N ATOM 463 CA SER A 30 7.330 10.463 12.941 1.00 1.04 C ATOM 464 C SER A 30 8.764 10.947 13.152 1.00 1.45 C ATOM 465 O SER A 30 9.031 11.708 14.082 1.00 2.37 O ATOM 466 CB SER A 30 7.298 8.961 12.628 1.00 1.24 C ATOM 467 OG SER A 30 7.822 8.188 13.698 1.00 1.93 O ATOM 0 H SER A 30 6.734 10.789 10.957 1.00 0.80 H new ATOM 0 HA SER A 30 6.776 10.625 13.866 1.00 1.04 H new ATOM 0 HB2 SER A 30 6.272 8.654 12.426 1.00 1.24 H new ATOM 0 HB3 SER A 30 7.873 8.766 11.723 1.00 1.24 H new ATOM 0 HG SER A 30 7.784 7.237 13.464 1.00 1.93 H new ATOM 473 N LYS A 31 9.677 10.516 12.290 1.00 1.32 N ATOM 474 CA LYS A 31 11.063 10.965 12.357 1.00 1.71 C ATOM 475 C LYS A 31 11.779 10.636 11.046 1.00 1.47 C ATOM 476 O LYS A 31 13.008 10.620 10.971 1.00 2.02 O ATOM 477 CB LYS A 31 11.769 10.297 13.549 1.00 2.29 C ATOM 478 CG LYS A 31 13.113 10.914 13.909 1.00 2.73 C ATOM 479 CD LYS A 31 13.751 10.215 15.102 1.00 3.59 C ATOM 480 CE LYS A 31 12.977 10.459 16.391 1.00 4.18 C ATOM 481 NZ LYS A 31 13.006 11.889 16.801 1.00 4.55 N ATOM 0 H LYS A 31 9.483 9.856 11.537 1.00 1.32 H new ATOM 0 HA LYS A 31 11.089 12.045 12.501 1.00 1.71 H new ATOM 0 HB2 LYS A 31 11.114 10.349 14.419 1.00 2.29 H new ATOM 0 HB3 LYS A 31 11.916 9.241 13.323 1.00 2.29 H new ATOM 0 HG2 LYS A 31 13.783 10.854 13.051 1.00 2.73 H new ATOM 0 HG3 LYS A 31 12.979 11.972 14.136 1.00 2.73 H new ATOM 0 HD2 LYS A 31 13.803 9.144 14.908 1.00 3.59 H new ATOM 0 HD3 LYS A 31 14.775 10.567 15.223 1.00 3.59 H new ATOM 0 HE2 LYS A 31 11.943 10.142 16.257 1.00 4.18 H new ATOM 0 HE3 LYS A 31 13.398 9.846 17.188 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 12.648 11.979 17.773 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 13.983 12.243 16.757 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 12.407 12.446 16.159 1.00 4.55 H new ATOM 495 N LYS A 32 10.991 10.408 10.002 1.00 0.87 N ATOM 496 CA LYS A 32 11.521 9.990 8.709 1.00 0.69 C ATOM 497 C LYS A 32 10.407 9.959 7.662 1.00 0.51 C ATOM 498 O LYS A 32 10.635 9.590 6.512 1.00 0.59 O ATOM 499 CB LYS A 32 12.145 8.592 8.829 1.00 0.80 C ATOM 500 CG LYS A 32 13.161 8.256 7.745 1.00 1.00 C ATOM 501 CD LYS A 32 14.432 9.078 7.901 1.00 0.93 C ATOM 502 CE LYS A 32 15.537 8.589 6.977 1.00 1.14 C ATOM 503 NZ LYS A 32 16.818 9.306 7.219 1.00 1.42 N ATOM 0 H LYS A 32 9.976 10.506 10.026 1.00 0.87 H new ATOM 0 HA LYS A 32 12.282 10.705 8.398 1.00 0.69 H new ATOM 0 HB2 LYS A 32 12.630 8.507 9.802 1.00 0.80 H new ATOM 0 HB3 LYS A 32 11.348 7.849 8.804 1.00 0.80 H new ATOM 0 HG2 LYS A 32 13.405 7.195 7.789 1.00 1.00 H new ATOM 0 HG3 LYS A 32 12.724 8.442 6.764 1.00 1.00 H new ATOM 0 HD2 LYS A 32 14.216 10.125 7.688 1.00 0.93 H new ATOM 0 HD3 LYS A 32 14.773 9.027 8.935 1.00 0.93 H new ATOM 0 HE2 LYS A 32 15.686 7.519 7.123 1.00 1.14 H new ATOM 0 HE3 LYS A 32 15.232 8.729 5.940 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 17.546 8.945 6.570 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 16.682 10.324 7.055 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 17.122 9.151 8.201 1.00 1.42 H new ATOM 517 N ILE A 33 9.203 10.362 8.064 1.00 0.37 N ATOM 518 CA ILE A 33 8.019 10.218 7.219 1.00 0.33 C ATOM 519 C ILE A 33 7.119 11.430 7.340 1.00 0.36 C ATOM 520 O ILE A 33 7.290 12.253 8.235 1.00 0.46 O ATOM 521 CB ILE A 33 7.207 8.956 7.577 1.00 0.41 C ATOM 522 CG1 ILE A 33 6.797 8.994 9.049 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.003 7.695 7.276 1.00 0.76 C ATOM 524 CD1 ILE A 33 5.978 7.801 9.481 1.00 0.75 C ATOM 0 H ILE A 33 9.022 10.792 8.971 1.00 0.37 H new ATOM 0 HA ILE A 33 8.377 10.125 6.194 1.00 0.33 H new ATOM 0 HB ILE A 33 6.307 8.940 6.963 1.00 0.41 H new ATOM 0 HG12 ILE A 33 7.694 9.051 9.666 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.225 9.903 9.235 1.00 0.58 H new ATOM 0 HG21 ILE A 33 7.409 6.819 7.537 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.248 7.664 6.214 1.00 0.76 H new ATOM 0 HG23 ILE A 33 8.923 7.697 7.861 1.00 0.76 H new ATOM 0 HD11 ILE A 33 5.724 7.897 10.537 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.063 7.755 8.890 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.555 6.889 9.328 1.00 0.75 H new ATOM 536 N THR A 34 6.159 11.534 6.443 1.00 0.33 N ATOM 537 CA THR A 34 5.348 12.733 6.342 1.00 0.36 C ATOM 538 C THR A 34 3.963 12.418 5.768 1.00 0.36 C ATOM 539 O THR A 34 3.817 12.174 4.574 1.00 0.39 O ATOM 540 CB THR A 34 6.077 13.760 5.444 1.00 0.39 C ATOM 541 OG1 THR A 34 7.425 13.948 5.900 1.00 0.58 O ATOM 542 CG2 THR A 34 5.375 15.096 5.445 1.00 0.56 C ATOM 0 H THR A 34 5.921 10.803 5.773 1.00 0.33 H new ATOM 0 HA THR A 34 5.206 13.148 7.340 1.00 0.36 H new ATOM 0 HB THR A 34 6.074 13.362 4.429 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.878 14.599 5.324 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.916 15.792 4.803 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.358 14.973 5.071 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.343 15.489 6.461 1.00 0.56 H new ATOM 550 N VAL A 35 2.957 12.409 6.636 1.00 0.39 N ATOM 551 CA VAL A 35 1.587 12.123 6.233 1.00 0.40 C ATOM 552 C VAL A 35 0.792 13.419 6.124 1.00 0.40 C ATOM 553 O VAL A 35 0.672 14.162 7.095 1.00 0.44 O ATOM 554 CB VAL A 35 0.874 11.190 7.238 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.430 10.671 6.665 1.00 0.82 C ATOM 556 CG2 VAL A 35 1.769 10.035 7.652 1.00 0.86 C ATOM 0 H VAL A 35 3.068 12.599 7.632 1.00 0.39 H new ATOM 0 HA VAL A 35 1.635 11.622 5.266 1.00 0.40 H new ATOM 0 HB VAL A 35 0.650 11.778 8.128 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.912 10.017 7.392 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -1.088 11.510 6.440 1.00 0.82 H new ATOM 0 HG13 VAL A 35 -0.229 10.112 5.751 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.237 9.398 8.359 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.041 9.452 6.772 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.672 10.425 8.122 1.00 0.86 H new ATOM 566 N SER A 36 0.263 13.680 4.944 1.00 0.42 N ATOM 567 CA SER A 36 -0.516 14.878 4.684 1.00 0.42 C ATOM 568 C SER A 36 -1.970 14.512 4.411 1.00 0.43 C ATOM 569 O SER A 36 -2.260 13.650 3.585 1.00 0.47 O ATOM 570 CB SER A 36 0.095 15.631 3.502 1.00 0.45 C ATOM 571 OG SER A 36 1.505 15.730 3.626 1.00 1.10 O ATOM 0 H SER A 36 0.361 13.066 4.135 1.00 0.42 H new ATOM 0 HA SER A 36 -0.496 15.526 5.560 1.00 0.42 H new ATOM 0 HB2 SER A 36 -0.155 15.118 2.573 1.00 0.45 H new ATOM 0 HB3 SER A 36 -0.338 16.630 3.442 1.00 0.45 H new ATOM 0 HG SER A 36 1.815 16.551 3.191 1.00 1.10 H new ATOM 577 N SER A 37 -2.869 15.167 5.125 1.00 0.45 N ATOM 578 CA SER A 37 -4.284 14.873 5.042 1.00 0.48 C ATOM 579 C SER A 37 -4.973 15.852 4.106 1.00 0.53 C ATOM 580 O SER A 37 -4.808 17.063 4.227 1.00 0.59 O ATOM 581 CB SER A 37 -4.910 14.926 6.437 1.00 0.59 C ATOM 582 OG SER A 37 -4.576 16.132 7.106 1.00 1.27 O ATOM 0 H SER A 37 -2.636 15.916 5.777 1.00 0.45 H new ATOM 0 HA SER A 37 -4.415 13.868 4.640 1.00 0.48 H new ATOM 0 HB2 SER A 37 -5.994 14.841 6.355 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.567 14.074 7.025 1.00 0.59 H new ATOM 0 HG SER A 37 -4.430 16.842 6.447 1.00 1.27 H new ATOM 588 N LYS A 38 -5.745 15.314 3.186 1.00 0.59 N ATOM 589 CA LYS A 38 -6.366 16.110 2.137 1.00 0.76 C ATOM 590 C LYS A 38 -7.896 15.993 2.182 1.00 0.90 C ATOM 591 O LYS A 38 -8.546 16.652 2.991 1.00 1.69 O ATOM 592 CB LYS A 38 -5.811 15.668 0.773 1.00 0.99 C ATOM 593 CG LYS A 38 -6.092 16.625 -0.375 1.00 1.06 C ATOM 594 CD LYS A 38 -5.403 16.159 -1.650 1.00 1.11 C ATOM 595 CE LYS A 38 -5.784 17.010 -2.851 1.00 1.44 C ATOM 596 NZ LYS A 38 -7.227 16.898 -3.184 1.00 1.91 N ATOM 0 H LYS A 38 -5.962 14.318 3.140 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.125 17.161 2.296 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -4.733 15.537 0.861 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -6.231 14.693 0.525 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -7.167 16.694 -0.542 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -5.745 17.625 -0.114 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -4.322 16.193 -1.511 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -5.667 15.119 -1.845 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -5.540 18.053 -2.647 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -5.190 16.706 -3.713 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -7.399 17.309 -4.124 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -7.506 15.896 -3.188 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -7.788 17.410 -2.474 1.00 1.91 H new ATOM 722 N ASN A 46 -11.401 12.078 4.904 1.00 1.06 N ATOM 723 CA ASN A 46 -10.286 12.743 4.264 1.00 0.90 C ATOM 724 C ASN A 46 -9.221 11.746 3.830 1.00 0.81 C ATOM 725 O ASN A 46 -9.117 10.645 4.369 1.00 0.95 O ATOM 726 CB ASN A 46 -9.702 13.807 5.197 1.00 0.91 C ATOM 727 CG ASN A 46 -9.200 13.252 6.522 1.00 1.32 C ATOM 728 OD1 ASN A 46 -8.208 13.909 7.096 1.00 2.05 O flip ATOM 729 ND2 ASN A 46 -9.715 12.258 7.038 1.00 1.87 N flip ATOM 0 HA ASN A 46 -10.651 13.236 3.363 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -8.879 14.310 4.689 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -10.464 14.561 5.395 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -10.480 11.776 6.565 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -9.377 11.917 7.938 1.00 1.87 H new ATOM 736 N LEU A 47 -8.455 12.146 2.828 1.00 0.70 N ATOM 737 CA LEU A 47 -7.432 11.304 2.229 1.00 0.62 C ATOM 738 C LEU A 47 -6.095 11.575 2.897 1.00 0.54 C ATOM 739 O LEU A 47 -5.866 12.674 3.395 1.00 0.58 O ATOM 740 CB LEU A 47 -7.363 11.602 0.723 1.00 0.66 C ATOM 741 CG LEU A 47 -6.425 10.731 -0.117 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.907 10.701 -1.551 1.00 0.77 C ATOM 743 CD2 LEU A 47 -5.000 11.262 -0.077 1.00 0.87 C ATOM 0 H LEU A 47 -8.526 13.071 2.404 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.677 10.251 2.371 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -8.369 11.509 0.313 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -7.062 12.642 0.597 1.00 0.66 H new ATOM 0 HG LEU A 47 -6.431 9.724 0.301 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -6.238 10.080 -2.147 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -7.915 10.287 -1.588 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -6.916 11.714 -1.953 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.357 10.623 -0.682 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.979 12.278 -0.472 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.642 11.266 0.953 1.00 0.87 H new ATOM 755 N TYR A 48 -5.219 10.586 2.910 1.00 0.48 N ATOM 756 CA TYR A 48 -3.923 10.742 3.543 1.00 0.45 C ATOM 757 C TYR A 48 -2.803 10.349 2.585 1.00 0.46 C ATOM 758 O TYR A 48 -2.890 9.330 1.904 1.00 0.54 O ATOM 759 CB TYR A 48 -3.848 9.895 4.812 1.00 0.48 C ATOM 760 CG TYR A 48 -4.741 10.369 5.940 1.00 0.53 C ATOM 761 CD1 TYR A 48 -6.096 10.065 5.949 1.00 0.63 C ATOM 762 CD2 TYR A 48 -4.232 11.125 6.989 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.918 10.500 6.972 1.00 0.76 C ATOM 764 CE2 TYR A 48 -5.049 11.561 8.015 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.370 11.233 8.022 1.00 0.82 C ATOM 766 OH TYR A 48 -7.210 11.674 9.020 1.00 0.99 O ATOM 0 H TYR A 48 -5.381 9.670 2.491 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.798 11.791 3.810 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -4.113 8.867 4.563 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.816 9.882 5.164 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.514 9.479 5.144 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -3.182 11.376 7.003 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -7.974 10.274 6.957 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.639 12.163 8.812 1.00 0.78 H new ATOM 0 HH TYR A 48 -7.659 12.496 8.730 1.00 0.99 H new ATOM 776 N ARG A 49 -1.773 11.181 2.522 1.00 0.45 N ATOM 777 CA ARG A 49 -0.585 10.896 1.716 1.00 0.48 C ATOM 778 C ARG A 49 0.627 10.814 2.632 1.00 0.40 C ATOM 779 O ARG A 49 0.893 11.745 3.373 1.00 0.48 O ATOM 780 CB ARG A 49 -0.388 12.005 0.660 1.00 0.59 C ATOM 781 CG ARG A 49 0.746 11.790 -0.364 1.00 0.71 C ATOM 782 CD ARG A 49 2.143 11.896 0.240 1.00 1.32 C ATOM 783 NE ARG A 49 2.321 13.100 1.054 1.00 1.69 N ATOM 784 CZ ARG A 49 3.260 14.021 0.833 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.024 13.955 -0.251 1.00 2.54 N ATOM 786 NH2 ARG A 49 3.410 15.031 1.678 1.00 2.92 N ATOM 0 H ARG A 49 -1.733 12.068 3.023 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.710 9.945 1.197 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -1.323 12.124 0.113 1.00 0.59 H new ATOM 0 HB3 ARG A 49 -0.202 12.944 1.182 1.00 0.59 H new ATOM 0 HG2 ARG A 49 0.630 10.807 -0.820 1.00 0.71 H new ATOM 0 HG3 ARG A 49 0.648 12.526 -1.162 1.00 0.71 H new ATOM 0 HD2 ARG A 49 2.336 11.016 0.854 1.00 1.32 H new ATOM 0 HD3 ARG A 49 2.881 11.893 -0.562 1.00 1.32 H new ATOM 0 HE ARG A 49 1.687 13.243 1.840 1.00 1.69 H new ATOM 0 HH11 ARG A 49 3.895 13.197 -0.921 1.00 2.54 H new ATOM 0 HH12 ARG A 49 4.740 14.663 -0.414 1.00 2.54 H new ATOM 0 HH21 ARG A 49 2.807 15.104 2.498 1.00 2.92 H new ATOM 0 HH22 ARG A 49 4.128 15.735 1.509 1.00 2.92 H new ATOM 800 N VAL A 50 1.374 9.729 2.562 1.00 0.37 N ATOM 801 CA VAL A 50 2.545 9.572 3.399 1.00 0.42 C ATOM 802 C VAL A 50 3.796 9.542 2.532 1.00 0.46 C ATOM 803 O VAL A 50 3.753 9.119 1.378 1.00 0.62 O ATOM 804 CB VAL A 50 2.455 8.312 4.283 1.00 0.63 C ATOM 805 CG1 VAL A 50 2.426 7.042 3.446 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.593 8.275 5.290 1.00 1.33 C ATOM 0 H VAL A 50 1.190 8.945 1.935 1.00 0.37 H new ATOM 0 HA VAL A 50 2.598 10.427 4.073 1.00 0.42 H new ATOM 0 HB VAL A 50 1.515 8.362 4.833 1.00 0.63 H new ATOM 0 HG11 VAL A 50 2.362 6.175 4.103 1.00 1.29 H new ATOM 0 HG12 VAL A 50 1.559 7.061 2.785 1.00 1.29 H new ATOM 0 HG13 VAL A 50 3.336 6.979 2.849 1.00 1.29 H new ATOM 0 HG21 VAL A 50 3.508 7.377 5.902 1.00 1.33 H new ATOM 0 HG22 VAL A 50 4.546 8.265 4.762 1.00 1.33 H new ATOM 0 HG23 VAL A 50 3.542 9.156 5.929 1.00 1.33 H new ATOM 816 N GLU A 51 4.894 10.007 3.088 1.00 0.37 N ATOM 817 CA GLU A 51 6.102 10.228 2.325 1.00 0.37 C ATOM 818 C GLU A 51 7.321 10.170 3.235 1.00 0.38 C ATOM 819 O GLU A 51 7.525 11.052 4.068 1.00 0.56 O ATOM 820 CB GLU A 51 6.008 11.592 1.641 1.00 0.40 C ATOM 821 CG GLU A 51 7.279 12.023 0.945 1.00 0.47 C ATOM 822 CD GLU A 51 7.165 13.399 0.334 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.952 14.370 1.088 1.00 1.02 O ATOM 824 OE2 GLU A 51 7.264 13.513 -0.903 1.00 1.07 O ATOM 0 H GLU A 51 4.974 10.241 4.077 1.00 0.37 H new ATOM 0 HA GLU A 51 6.209 9.448 1.571 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.198 11.566 0.912 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.742 12.342 2.386 1.00 0.40 H new ATOM 0 HG2 GLU A 51 8.102 12.013 1.660 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.525 11.302 0.165 1.00 0.47 H new ATOM 831 N GLY A 52 8.114 9.125 3.088 1.00 0.27 N ATOM 832 CA GLY A 52 9.308 8.992 3.884 1.00 0.29 C ATOM 833 C GLY A 52 10.469 8.483 3.070 1.00 0.25 C ATOM 834 O GLY A 52 10.277 7.914 1.997 1.00 0.29 O ATOM 0 H GLY A 52 7.950 8.364 2.429 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.565 9.958 4.319 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.118 8.310 4.713 1.00 0.29 H new ATOM 838 N ILE A 53 11.675 8.690 3.555 1.00 0.24 N ATOM 839 CA ILE A 53 12.844 8.218 2.846 1.00 0.23 C ATOM 840 C ILE A 53 13.366 6.936 3.463 1.00 0.23 C ATOM 841 O ILE A 53 13.811 6.919 4.612 1.00 0.30 O ATOM 842 CB ILE A 53 13.970 9.259 2.830 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.453 10.587 2.272 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.130 8.734 1.992 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.405 11.742 2.475 1.00 0.58 C ATOM 0 H ILE A 53 11.870 9.178 4.429 1.00 0.24 H new ATOM 0 HA ILE A 53 12.531 8.034 1.818 1.00 0.23 H new ATOM 0 HB ILE A 53 14.320 9.434 3.847 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.258 10.472 1.206 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.501 10.825 2.747 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.932 9.472 1.979 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.499 7.804 2.424 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.789 8.550 0.973 1.00 0.27 H new ATOM 0 HD11 ILE A 53 13.971 12.649 2.054 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.582 11.885 3.541 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.350 11.527 1.976 1.00 0.58 H new ATOM 857 N ILE A 54 13.299 5.865 2.697 1.00 0.24 N ATOM 858 CA ILE A 54 13.846 4.597 3.124 1.00 0.26 C ATOM 859 C ILE A 54 15.268 4.450 2.586 1.00 0.29 C ATOM 860 O ILE A 54 15.482 4.414 1.375 1.00 0.31 O ATOM 861 CB ILE A 54 12.954 3.418 2.679 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.530 3.648 3.197 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.514 2.097 3.195 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.564 2.533 2.893 1.00 0.35 C ATOM 0 H ILE A 54 12.869 5.850 1.772 1.00 0.24 H new ATOM 0 HA ILE A 54 13.875 4.577 4.213 1.00 0.26 H new ATOM 0 HB ILE A 54 12.936 3.365 1.590 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.569 3.793 4.277 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.145 4.572 2.765 1.00 0.32 H new ATOM 0 HG21 ILE A 54 12.872 1.278 2.871 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.519 1.948 2.799 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.553 2.119 4.284 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.583 2.782 3.297 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.490 2.400 1.814 1.00 0.35 H new ATOM 0 HD13 ILE A 54 10.920 1.609 3.348 1.00 0.35 H new ATOM 876 N PRO A 55 16.253 4.455 3.504 1.00 0.36 N ATOM 877 CA PRO A 55 17.685 4.318 3.193 1.00 0.44 C ATOM 878 C PRO A 55 18.021 2.994 2.520 1.00 0.47 C ATOM 879 O PRO A 55 18.647 2.112 3.112 1.00 0.62 O ATOM 880 CB PRO A 55 18.367 4.404 4.565 1.00 0.54 C ATOM 881 CG PRO A 55 17.371 5.071 5.445 1.00 0.53 C ATOM 882 CD PRO A 55 16.028 4.641 4.936 1.00 0.42 C ATOM 0 HA PRO A 55 18.012 5.083 2.489 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.626 3.414 4.940 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.293 4.977 4.511 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.508 4.776 6.485 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.476 6.155 5.404 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.693 3.720 5.413 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.265 5.395 5.128 1.00 0.42 H new ATOM 890 N GLU A 56 17.580 2.872 1.291 1.00 0.43 N ATOM 891 CA GLU A 56 17.852 1.715 0.471 1.00 0.49 C ATOM 892 C GLU A 56 17.766 2.125 -0.985 1.00 0.46 C ATOM 893 O GLU A 56 17.713 3.317 -1.299 1.00 0.60 O ATOM 894 CB GLU A 56 16.824 0.620 0.740 1.00 0.66 C ATOM 895 CG GLU A 56 17.417 -0.764 0.959 1.00 0.77 C ATOM 896 CD GLU A 56 18.588 -1.081 0.051 1.00 1.18 C ATOM 897 OE1 GLU A 56 18.364 -1.368 -1.141 1.00 1.68 O ATOM 898 OE2 GLU A 56 19.740 -1.047 0.527 1.00 1.38 O ATOM 0 H GLU A 56 17.015 3.582 0.826 1.00 0.43 H new ATOM 0 HA GLU A 56 18.845 1.332 0.705 1.00 0.49 H new ATOM 0 HB2 GLU A 56 16.241 0.895 1.619 1.00 0.66 H new ATOM 0 HB3 GLU A 56 16.131 0.576 -0.100 1.00 0.66 H new ATOM 0 HG2 GLU A 56 17.741 -0.850 1.996 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.638 -1.511 0.805 1.00 0.77 H new ATOM 905 N SER A 57 17.741 1.142 -1.858 1.00 0.45 N ATOM 906 CA SER A 57 17.543 1.363 -3.248 1.00 0.45 C ATOM 907 C SER A 57 16.100 1.034 -3.587 1.00 0.43 C ATOM 908 O SER A 57 15.491 0.142 -2.986 1.00 0.43 O ATOM 909 CB SER A 57 18.524 0.493 -4.051 1.00 0.53 C ATOM 910 OG SER A 57 18.408 0.706 -5.449 1.00 1.18 O ATOM 0 H SER A 57 17.860 0.161 -1.606 1.00 0.45 H new ATOM 0 HA SER A 57 17.735 2.404 -3.506 1.00 0.45 H new ATOM 0 HB2 SER A 57 19.544 0.712 -3.735 1.00 0.53 H new ATOM 0 HB3 SER A 57 18.341 -0.558 -3.829 1.00 0.53 H new ATOM 0 HG SER A 57 19.050 0.135 -5.921 1.00 1.18 H new ATOM 916 N PRO A 58 15.540 1.764 -4.553 1.00 0.44 N ATOM 917 CA PRO A 58 14.164 1.583 -5.004 1.00 0.43 C ATOM 918 C PRO A 58 13.971 0.187 -5.572 1.00 0.46 C ATOM 919 O PRO A 58 12.850 -0.274 -5.775 1.00 0.46 O ATOM 920 CB PRO A 58 13.983 2.663 -6.084 1.00 0.44 C ATOM 921 CG PRO A 58 15.100 3.630 -5.857 1.00 0.49 C ATOM 922 CD PRO A 58 16.226 2.833 -5.277 1.00 0.52 C ATOM 0 HA PRO A 58 13.433 1.680 -4.201 1.00 0.43 H new ATOM 0 HB2 PRO A 58 14.031 2.233 -7.084 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.013 3.152 -5.994 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.400 4.106 -6.791 1.00 0.49 H new ATOM 0 HG3 PRO A 58 14.795 4.426 -5.177 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.881 2.438 -6.053 1.00 0.52 H new ATOM 0 HD3 PRO A 58 16.846 3.436 -4.613 1.00 0.52 H new ATOM 930 N ALA A 59 15.094 -0.481 -5.796 1.00 0.50 N ATOM 931 CA ALA A 59 15.107 -1.849 -6.263 1.00 0.54 C ATOM 932 C ALA A 59 14.721 -2.810 -5.161 1.00 0.50 C ATOM 933 O ALA A 59 13.927 -3.719 -5.381 1.00 0.51 O ATOM 934 CB ALA A 59 16.480 -2.206 -6.792 1.00 0.64 C ATOM 0 H ALA A 59 16.022 -0.082 -5.657 1.00 0.50 H new ATOM 0 HA ALA A 59 14.374 -1.935 -7.065 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.478 -3.239 -7.141 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.735 -1.544 -7.619 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.217 -2.093 -5.997 1.00 0.64 H new ATOM 940 N LYS A 60 15.276 -2.610 -3.974 1.00 0.49 N ATOM 941 CA LYS A 60 14.965 -3.476 -2.856 1.00 0.49 C ATOM 942 C LYS A 60 13.554 -3.186 -2.411 1.00 0.42 C ATOM 943 O LYS A 60 12.836 -4.054 -1.922 1.00 0.43 O ATOM 944 CB LYS A 60 15.913 -3.243 -1.691 1.00 0.58 C ATOM 945 CG LYS A 60 15.809 -4.319 -0.628 1.00 0.65 C ATOM 946 CD LYS A 60 16.849 -5.398 -0.835 1.00 1.35 C ATOM 947 CE LYS A 60 18.236 -4.863 -0.551 1.00 2.45 C ATOM 948 NZ LYS A 60 19.270 -5.931 -0.599 1.00 3.30 N ATOM 0 H LYS A 60 15.937 -1.862 -3.766 1.00 0.49 H new ATOM 0 HA LYS A 60 15.072 -4.513 -3.174 1.00 0.49 H new ATOM 0 HB2 LYS A 60 16.937 -3.203 -2.063 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.699 -2.273 -1.242 1.00 0.58 H new ATOM 0 HG2 LYS A 60 15.936 -3.873 0.358 1.00 0.65 H new ATOM 0 HG3 LYS A 60 14.813 -4.761 -0.651 1.00 0.65 H new ATOM 0 HD2 LYS A 60 16.639 -6.244 -0.180 1.00 1.35 H new ATOM 0 HD3 LYS A 60 16.799 -5.767 -1.859 1.00 1.35 H new ATOM 0 HE2 LYS A 60 18.481 -4.089 -1.278 1.00 2.45 H new ATOM 0 HE3 LYS A 60 18.248 -4.392 0.432 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 20.204 -5.519 -0.399 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 19.052 -6.657 0.113 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 19.278 -6.364 -1.545 1.00 3.30 H new ATOM 962 N LEU A 61 13.178 -1.936 -2.577 1.00 0.37 N ATOM 963 CA LEU A 61 11.832 -1.498 -2.294 1.00 0.35 C ATOM 964 C LEU A 61 10.835 -2.218 -3.201 1.00 0.38 C ATOM 965 O LEU A 61 9.879 -2.836 -2.724 1.00 0.41 O ATOM 966 CB LEU A 61 11.751 0.017 -2.441 1.00 0.34 C ATOM 967 CG LEU A 61 12.501 0.801 -1.348 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.356 2.291 -1.563 1.00 0.34 C ATOM 969 CD2 LEU A 61 11.959 0.435 0.018 1.00 0.30 C ATOM 0 H LEU A 61 13.797 -1.198 -2.911 1.00 0.37 H new ATOM 0 HA LEU A 61 11.569 -1.752 -1.267 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.154 0.298 -3.414 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.703 0.316 -2.431 1.00 0.34 H new ATOM 0 HG LEU A 61 13.557 0.538 -1.404 1.00 0.31 H new ATOM 0 HD11 LEU A 61 12.893 2.826 -0.780 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.769 2.560 -2.535 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.301 2.562 -1.529 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.496 0.994 0.784 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.898 0.680 0.066 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.093 -0.633 0.188 1.00 0.30 H new ATOM 981 N SER A 62 11.081 -2.187 -4.503 1.00 0.41 N ATOM 982 CA SER A 62 10.271 -2.952 -5.443 1.00 0.46 C ATOM 983 C SER A 62 10.436 -4.452 -5.199 1.00 0.46 C ATOM 984 O SER A 62 9.641 -5.263 -5.672 1.00 0.50 O ATOM 985 CB SER A 62 10.663 -2.613 -6.880 1.00 0.53 C ATOM 986 OG SER A 62 10.499 -1.231 -7.134 1.00 1.29 O ATOM 0 H SER A 62 11.830 -1.644 -4.932 1.00 0.41 H new ATOM 0 HA SER A 62 9.225 -2.686 -5.288 1.00 0.46 H new ATOM 0 HB2 SER A 62 11.700 -2.899 -7.056 1.00 0.53 H new ATOM 0 HB3 SER A 62 10.052 -3.190 -7.574 1.00 0.53 H new ATOM 0 HG SER A 62 9.886 -0.847 -6.473 1.00 1.29 H new ATOM 992 N ASP A 63 11.467 -4.809 -4.447 1.00 0.44 N ATOM 993 CA ASP A 63 11.768 -6.213 -4.180 1.00 0.48 C ATOM 994 C ASP A 63 10.960 -6.752 -3.001 1.00 0.49 C ATOM 995 O ASP A 63 10.284 -7.776 -3.117 1.00 0.60 O ATOM 996 CB ASP A 63 13.264 -6.394 -3.912 1.00 0.53 C ATOM 997 CG ASP A 63 13.645 -7.833 -3.641 1.00 0.87 C ATOM 998 OD1 ASP A 63 13.524 -8.669 -4.558 1.00 1.10 O ATOM 999 OD2 ASP A 63 14.073 -8.138 -2.510 1.00 1.32 O ATOM 0 H ASP A 63 12.110 -4.149 -4.010 1.00 0.44 H new ATOM 0 HA ASP A 63 11.487 -6.782 -5.066 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.828 -6.030 -4.771 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.552 -5.781 -3.058 1.00 0.53 H new ATOM 1004 N PHE A 64 11.015 -6.054 -1.870 1.00 0.44 N ATOM 1005 CA PHE A 64 10.413 -6.555 -0.638 1.00 0.48 C ATOM 1006 C PHE A 64 8.884 -6.546 -0.710 1.00 0.51 C ATOM 1007 O PHE A 64 8.238 -7.491 -0.251 1.00 0.61 O ATOM 1008 CB PHE A 64 10.883 -5.740 0.586 1.00 0.51 C ATOM 1009 CG PHE A 64 10.120 -4.465 0.774 1.00 0.46 C ATOM 1010 CD1 PHE A 64 10.404 -3.364 0.010 1.00 0.50 C ATOM 1011 CD2 PHE A 64 9.083 -4.397 1.679 1.00 0.59 C ATOM 1012 CE1 PHE A 64 9.660 -2.210 0.134 1.00 0.50 C ATOM 1013 CE2 PHE A 64 8.342 -3.248 1.817 1.00 0.59 C ATOM 1014 CZ PHE A 64 8.629 -2.155 1.035 1.00 0.47 C ATOM 0 H PHE A 64 11.468 -5.144 -1.781 1.00 0.44 H new ATOM 0 HA PHE A 64 10.745 -7.587 -0.523 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.782 -6.352 1.482 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.942 -5.509 0.476 1.00 0.51 H new ATOM 0 HD1 PHE A 64 11.220 -3.400 -0.697 1.00 0.50 H new ATOM 0 HD2 PHE A 64 8.850 -5.258 2.288 1.00 0.59 H new ATOM 0 HE1 PHE A 64 9.889 -1.350 -0.478 1.00 0.50 H new ATOM 0 HE2 PHE A 64 7.538 -3.204 2.537 1.00 0.59 H new ATOM 0 HZ PHE A 64 8.042 -1.253 1.130 1.00 0.47 H new ATOM 1024 N LEU A 65 8.300 -5.492 -1.286 1.00 0.49 N ATOM 1025 CA LEU A 65 6.857 -5.311 -1.199 1.00 0.58 C ATOM 1026 C LEU A 65 6.111 -6.180 -2.200 1.00 0.64 C ATOM 1027 O LEU A 65 4.963 -6.527 -1.955 1.00 0.81 O ATOM 1028 CB LEU A 65 6.465 -3.845 -1.430 1.00 0.66 C ATOM 1029 CG LEU A 65 6.025 -3.498 -2.862 1.00 0.78 C ATOM 1030 CD1 LEU A 65 5.306 -2.169 -2.894 1.00 1.25 C ATOM 1031 CD2 LEU A 65 7.207 -3.458 -3.813 1.00 1.50 C ATOM 0 H LEU A 65 8.795 -4.768 -1.806 1.00 0.49 H new ATOM 0 HA LEU A 65 6.573 -5.612 -0.191 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.654 -3.592 -0.747 1.00 0.66 H new ATOM 0 HB3 LEU A 65 7.313 -3.214 -1.166 1.00 0.66 H new ATOM 0 HG LEU A 65 5.344 -4.284 -3.189 1.00 0.78 H new ATOM 0 HD11 LEU A 65 5.004 -1.943 -3.917 1.00 1.25 H new ATOM 0 HD12 LEU A 65 4.423 -2.218 -2.257 1.00 1.25 H new ATOM 0 HD13 LEU A 65 5.972 -1.386 -2.532 1.00 1.25 H new ATOM 0 HD21 LEU A 65 6.859 -3.210 -4.816 1.00 1.50 H new ATOM 0 HD22 LEU A 65 7.918 -2.703 -3.478 1.00 1.50 H new ATOM 0 HD23 LEU A 65 7.694 -4.433 -3.829 1.00 1.50 H new ATOM 1043 N TYR A 66 6.838 -6.595 -3.250 1.00 0.58 N ATOM 1044 CA TYR A 66 6.278 -6.998 -4.558 1.00 0.64 C ATOM 1045 C TYR A 66 4.746 -7.034 -4.573 1.00 0.72 C ATOM 1046 O TYR A 66 4.129 -6.170 -5.190 1.00 0.89 O ATOM 1047 CB TYR A 66 6.862 -8.338 -5.015 1.00 0.73 C ATOM 1048 CG TYR A 66 6.659 -8.636 -6.491 1.00 0.88 C ATOM 1049 CD1 TYR A 66 6.445 -7.605 -7.396 1.00 0.82 C ATOM 1050 CD2 TYR A 66 6.671 -9.942 -6.979 1.00 1.27 C ATOM 1051 CE1 TYR A 66 6.250 -7.863 -8.740 1.00 1.01 C ATOM 1052 CE2 TYR A 66 6.479 -10.204 -8.322 1.00 1.47 C ATOM 1053 CZ TYR A 66 6.307 -9.202 -9.195 1.00 1.29 C ATOM 1054 OH TYR A 66 6.078 -9.419 -10.537 1.00 1.52 O ATOM 0 H TYR A 66 7.855 -6.663 -3.216 1.00 0.58 H new ATOM 0 HA TYR A 66 6.574 -6.226 -5.269 1.00 0.64 H new ATOM 0 HB2 TYR A 66 7.930 -8.349 -4.797 1.00 0.73 H new ATOM 0 HB3 TYR A 66 6.409 -9.138 -4.429 1.00 0.73 H new ATOM 0 HD1 TYR A 66 6.431 -6.584 -7.044 1.00 0.82 H new ATOM 0 HD2 TYR A 66 6.833 -10.763 -6.296 1.00 1.27 H new ATOM 0 HE1 TYR A 66 6.057 -7.056 -9.431 1.00 1.01 H new ATOM 0 HE2 TYR A 66 6.467 -11.226 -8.671 1.00 1.47 H new ATOM 0 HH TYR A 66 5.115 -9.387 -10.714 1.00 1.52 H new ATOM 1064 N GLN A 67 4.152 -8.029 -3.895 1.00 0.89 N ATOM 1065 CA GLN A 67 2.712 -8.029 -3.614 1.00 1.13 C ATOM 1066 C GLN A 67 2.269 -9.316 -2.918 1.00 1.10 C ATOM 1067 O GLN A 67 1.424 -9.287 -2.021 1.00 1.76 O ATOM 1068 CB GLN A 67 1.875 -7.833 -4.885 1.00 1.54 C ATOM 1069 CG GLN A 67 0.477 -7.295 -4.603 1.00 2.13 C ATOM 1070 CD GLN A 67 0.492 -5.891 -4.009 1.00 2.94 C ATOM 1071 OE1 GLN A 67 1.441 -5.492 -3.336 1.00 3.50 O ATOM 1072 NE2 GLN A 67 -0.580 -5.145 -4.214 1.00 3.60 N ATOM 0 H GLN A 67 4.649 -8.843 -3.532 1.00 0.89 H new ATOM 0 HA GLN A 67 2.539 -7.185 -2.947 1.00 1.13 H new ATOM 0 HB2 GLN A 67 2.395 -7.146 -5.553 1.00 1.54 H new ATOM 0 HB3 GLN A 67 1.793 -8.785 -5.409 1.00 1.54 H new ATOM 0 HG2 GLN A 67 -0.097 -7.286 -5.529 1.00 2.13 H new ATOM 0 HG3 GLN A 67 -0.035 -7.969 -3.917 1.00 2.13 H new ATOM 0 HE21 GLN A 67 -1.351 -5.504 -4.777 1.00 3.60 H new ATOM 0 HE22 GLN A 67 -0.636 -4.210 -3.809 1.00 3.60 H new ATOM 1081 N THR A 68 2.849 -10.440 -3.310 1.00 0.83 N ATOM 1082 CA THR A 68 2.328 -11.738 -2.894 1.00 0.93 C ATOM 1083 C THR A 68 3.435 -12.777 -2.708 1.00 1.09 C ATOM 1084 O THR A 68 3.154 -13.965 -2.557 1.00 1.39 O ATOM 1085 CB THR A 68 1.341 -12.249 -3.971 1.00 1.18 C ATOM 1086 OG1 THR A 68 0.702 -13.451 -3.550 1.00 1.48 O ATOM 1087 CG2 THR A 68 2.076 -12.502 -5.282 1.00 1.29 C ATOM 0 H THR A 68 3.673 -10.483 -3.910 1.00 0.83 H new ATOM 0 HA THR A 68 1.832 -11.604 -1.933 1.00 0.93 H new ATOM 0 HB THR A 68 0.582 -11.481 -4.119 1.00 1.18 H new ATOM 0 HG1 THR A 68 1.273 -13.916 -2.903 1.00 1.48 H new ATOM 0 HG21 THR A 68 1.370 -12.861 -6.031 1.00 1.29 H new ATOM 0 HG22 THR A 68 2.532 -11.575 -5.628 1.00 1.29 H new ATOM 0 HG23 THR A 68 2.852 -13.252 -5.125 1.00 1.29 H new ATOM 1095 N GLY A 69 4.684 -12.342 -2.696 1.00 1.06 N ATOM 1096 CA GLY A 69 5.766 -13.305 -2.706 1.00 1.39 C ATOM 1097 C GLY A 69 6.664 -13.230 -1.491 1.00 1.17 C ATOM 1098 O GLY A 69 7.550 -14.066 -1.320 1.00 1.46 O ATOM 0 H GLY A 69 4.966 -11.362 -2.680 1.00 1.06 H new ATOM 0 HA2 GLY A 69 5.346 -14.308 -2.774 1.00 1.39 H new ATOM 0 HA3 GLY A 69 6.369 -13.151 -3.601 1.00 1.39 H new ATOM 1102 N ASP A 70 6.426 -12.246 -0.638 1.00 0.84 N ATOM 1103 CA ASP A 70 7.257 -12.048 0.548 1.00 0.83 C ATOM 1104 C ASP A 70 6.625 -10.997 1.453 1.00 0.65 C ATOM 1105 O ASP A 70 6.706 -11.072 2.665 1.00 0.61 O ATOM 1106 CB ASP A 70 8.667 -11.612 0.133 1.00 1.12 C ATOM 1107 CG ASP A 70 9.748 -12.209 1.012 1.00 1.45 C ATOM 1108 OD1 ASP A 70 10.186 -13.346 0.736 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.182 -11.540 1.965 1.00 1.68 O ATOM 0 H ASP A 70 5.668 -11.572 -0.741 1.00 0.84 H new ATOM 0 HA ASP A 70 7.328 -12.988 1.095 1.00 0.83 H new ATOM 0 HB2 ASP A 70 8.843 -11.905 -0.902 1.00 1.12 H new ATOM 0 HB3 ASP A 70 8.733 -10.525 0.172 1.00 1.12 H new ATOM 1114 N ARG A 71 5.949 -10.058 0.821 1.00 0.60 N ATOM 1115 CA ARG A 71 5.255 -8.943 1.455 1.00 0.51 C ATOM 1116 C ARG A 71 4.535 -9.393 2.717 1.00 0.43 C ATOM 1117 O ARG A 71 4.692 -8.811 3.788 1.00 0.49 O ATOM 1118 CB ARG A 71 4.243 -8.436 0.428 1.00 0.59 C ATOM 1119 CG ARG A 71 3.423 -7.227 0.810 1.00 0.83 C ATOM 1120 CD ARG A 71 2.016 -7.420 0.265 1.00 0.87 C ATOM 1121 NE ARG A 71 1.189 -6.215 0.299 1.00 1.77 N ATOM 1122 CZ ARG A 71 0.022 -6.115 -0.351 1.00 2.46 C ATOM 1123 NH1 ARG A 71 -0.425 -7.134 -1.080 1.00 2.69 N ATOM 1124 NH2 ARG A 71 -0.691 -4.995 -0.283 1.00 3.38 N ATOM 0 H ARG A 71 5.862 -10.047 -0.195 1.00 0.60 H new ATOM 0 HA ARG A 71 5.959 -8.165 1.751 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.781 -8.203 -0.491 1.00 0.59 H new ATOM 0 HB3 ARG A 71 3.557 -9.251 0.198 1.00 0.59 H new ATOM 0 HG2 ARG A 71 3.399 -7.110 1.893 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.869 -6.320 0.401 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.082 -7.772 -0.764 1.00 0.87 H new ATOM 0 HD3 ARG A 71 1.521 -8.203 0.839 1.00 0.87 H new ATOM 0 HE ARG A 71 1.515 -5.415 0.842 1.00 1.77 H new ATOM 0 HH11 ARG A 71 0.121 -7.993 -1.145 1.00 2.69 H new ATOM 0 HH12 ARG A 71 -1.314 -7.056 -1.574 1.00 2.69 H new ATOM 0 HH21 ARG A 71 -0.350 -4.206 0.266 1.00 3.38 H new ATOM 0 HH22 ARG A 71 -1.579 -4.925 -0.780 1.00 3.38 H new ATOM 1138 N ILE A 72 3.772 -10.462 2.569 1.00 0.44 N ATOM 1139 CA ILE A 72 2.947 -10.985 3.647 1.00 0.44 C ATOM 1140 C ILE A 72 3.697 -12.026 4.458 1.00 0.54 C ATOM 1141 O ILE A 72 3.210 -12.496 5.482 1.00 0.64 O ATOM 1142 CB ILE A 72 1.658 -11.643 3.109 1.00 0.45 C ATOM 1143 CG1 ILE A 72 1.971 -12.924 2.332 1.00 0.62 C ATOM 1144 CG2 ILE A 72 0.898 -10.679 2.230 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.541 -12.715 0.941 1.00 0.71 C ATOM 0 H ILE A 72 3.706 -10.992 1.700 1.00 0.44 H new ATOM 0 HA ILE A 72 2.691 -10.133 4.276 1.00 0.44 H new ATOM 0 HB ILE A 72 1.038 -11.906 3.966 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.678 -13.517 2.911 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.056 -13.511 2.248 1.00 0.62 H new ATOM 0 HG21 ILE A 72 -0.007 -11.160 1.860 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.629 -9.795 2.808 1.00 0.47 H new ATOM 0 HG23 ILE A 72 1.523 -10.385 1.387 1.00 0.47 H new ATOM 0 HD11 ILE A 72 2.728 -13.683 0.475 1.00 0.71 H new ATOM 0 HD12 ILE A 72 1.829 -12.153 0.337 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.476 -12.159 1.011 1.00 0.71 H new ATOM 1157 N THR A 73 4.874 -12.402 3.991 1.00 0.59 N ATOM 1158 CA THR A 73 5.599 -13.478 4.615 1.00 0.72 C ATOM 1159 C THR A 73 6.410 -12.955 5.794 1.00 0.74 C ATOM 1160 O THR A 73 6.579 -13.653 6.793 1.00 0.88 O ATOM 1161 CB THR A 73 6.525 -14.218 3.616 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.683 -15.589 4.010 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.902 -13.565 3.535 1.00 0.80 C ATOM 0 H THR A 73 5.340 -11.978 3.188 1.00 0.59 H new ATOM 0 HA THR A 73 4.863 -14.199 4.972 1.00 0.72 H new ATOM 0 HB THR A 73 6.055 -14.161 2.634 1.00 0.81 H new ATOM 0 HG1 THR A 73 7.268 -16.047 3.372 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.523 -14.112 2.825 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.796 -12.532 3.204 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.372 -13.585 4.518 1.00 0.80 H new ATOM 1171 N TRP A 74 6.921 -11.729 5.676 1.00 0.64 N ATOM 1172 CA TRP A 74 7.615 -11.115 6.803 1.00 0.66 C ATOM 1173 C TRP A 74 6.620 -10.304 7.627 1.00 0.63 C ATOM 1174 O TRP A 74 6.647 -10.374 8.849 1.00 0.75 O ATOM 1175 CB TRP A 74 8.824 -10.277 6.342 1.00 0.66 C ATOM 1176 CG TRP A 74 8.583 -9.465 5.107 1.00 0.59 C ATOM 1177 CD1 TRP A 74 8.867 -9.819 3.822 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.034 -8.156 5.042 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.489 -8.822 2.962 1.00 0.65 N ATOM 1180 CE2 TRP A 74 7.980 -7.789 3.686 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.573 -7.266 6.000 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.479 -6.571 3.266 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 7.086 -6.054 5.588 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.036 -5.711 4.224 1.00 0.61 C ATOM 0 H TRP A 74 6.869 -11.156 4.834 1.00 0.64 H new ATOM 0 HA TRP A 74 8.027 -11.899 7.439 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.115 -9.607 7.151 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.666 -10.945 6.163 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.324 -10.751 3.525 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.575 -8.850 1.946 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.597 -7.523 7.049 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.440 -6.312 2.218 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.733 -5.347 6.325 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.640 -4.750 3.932 1.00 0.61 H new ATOM 1195 N ASP A 75 5.740 -9.566 6.931 1.00 0.55 N ATOM 1196 CA ASP A 75 4.466 -9.067 7.486 1.00 0.58 C ATOM 1197 C ASP A 75 4.570 -8.201 8.755 1.00 0.58 C ATOM 1198 O ASP A 75 5.385 -8.422 9.641 1.00 0.73 O ATOM 1199 CB ASP A 75 3.548 -10.273 7.738 1.00 0.83 C ATOM 1200 CG ASP A 75 2.447 -10.010 8.747 1.00 1.44 C ATOM 1201 OD1 ASP A 75 1.765 -8.977 8.634 1.00 1.44 O ATOM 1202 OD2 ASP A 75 2.273 -10.840 9.664 1.00 2.19 O ATOM 0 H ASP A 75 5.892 -9.295 5.959 1.00 0.55 H new ATOM 0 HA ASP A 75 4.060 -8.384 6.740 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.096 -10.576 6.794 1.00 0.83 H new ATOM 0 HB3 ASP A 75 4.153 -11.111 8.086 1.00 0.83 H new ATOM 1207 N LYS A 76 3.724 -7.177 8.822 1.00 0.58 N ATOM 1208 CA LYS A 76 3.466 -6.499 10.081 1.00 0.65 C ATOM 1209 C LYS A 76 1.981 -6.152 10.253 1.00 0.62 C ATOM 1210 O LYS A 76 1.486 -6.064 11.375 1.00 0.75 O ATOM 1211 CB LYS A 76 4.325 -5.258 10.202 1.00 0.88 C ATOM 1212 CG LYS A 76 4.368 -4.412 8.948 1.00 0.78 C ATOM 1213 CD LYS A 76 3.204 -3.461 8.889 1.00 1.63 C ATOM 1214 CE LYS A 76 3.335 -2.395 9.956 1.00 1.97 C ATOM 1215 NZ LYS A 76 2.486 -2.673 11.145 1.00 3.19 N ATOM 0 H LYS A 76 3.211 -6.803 8.024 1.00 0.58 H new ATOM 0 HA LYS A 76 3.731 -7.188 10.883 1.00 0.65 H new ATOM 0 HB2 LYS A 76 3.951 -4.649 11.025 1.00 0.88 H new ATOM 0 HB3 LYS A 76 5.341 -5.556 10.461 1.00 0.88 H new ATOM 0 HG2 LYS A 76 5.301 -3.850 8.918 1.00 0.78 H new ATOM 0 HG3 LYS A 76 4.357 -5.058 8.070 1.00 0.78 H new ATOM 0 HD2 LYS A 76 3.157 -2.995 7.905 1.00 1.63 H new ATOM 0 HD3 LYS A 76 2.272 -4.009 9.027 1.00 1.63 H new ATOM 0 HE2 LYS A 76 4.377 -2.322 10.267 1.00 1.97 H new ATOM 0 HE3 LYS A 76 3.060 -1.428 9.535 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 2.283 -1.783 11.643 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 1.593 -3.110 10.839 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 2.987 -3.321 11.785 1.00 3.19 H new ATOM 1229 N SER A 77 1.286 -5.935 9.144 1.00 0.61 N ATOM 1230 CA SER A 77 -0.146 -5.667 9.165 1.00 0.72 C ATOM 1231 C SER A 77 -0.802 -6.467 8.057 1.00 0.61 C ATOM 1232 O SER A 77 -1.896 -6.154 7.583 1.00 0.65 O ATOM 1233 CB SER A 77 -0.432 -4.172 8.986 1.00 0.91 C ATOM 1234 OG SER A 77 0.142 -3.410 10.035 1.00 1.58 O ATOM 0 H SER A 77 1.696 -5.940 8.210 1.00 0.61 H new ATOM 0 HA SER A 77 -0.554 -5.963 10.132 1.00 0.72 H new ATOM 0 HB2 SER A 77 -0.034 -3.835 8.029 1.00 0.91 H new ATOM 0 HB3 SER A 77 -1.509 -4.006 8.960 1.00 0.91 H new ATOM 0 HG SER A 77 0.185 -3.954 10.849 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.106 -7.510 7.659 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.555 -8.394 6.593 1.00 0.50 C ATOM 1242 C LEU A 78 -0.945 -9.747 7.164 1.00 0.53 C ATOM 1243 O LEU A 78 -0.990 -9.920 8.379 1.00 0.71 O ATOM 1244 CB LEU A 78 0.546 -8.560 5.542 1.00 0.45 C ATOM 1245 CG LEU A 78 0.718 -7.371 4.597 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.888 -7.585 3.660 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.567 -7.132 3.816 1.00 0.51 C ATOM 0 H LEU A 78 0.792 -7.774 8.064 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.428 -7.950 6.115 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.492 -8.739 6.053 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.331 -9.449 4.949 1.00 0.45 H new ATOM 0 HG LEU A 78 0.932 -6.485 5.194 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.987 -6.724 2.999 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.803 -7.704 4.241 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.718 -8.482 3.064 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.433 -6.283 3.146 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -0.808 -8.020 3.232 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.381 -6.922 4.510 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.253 -10.693 6.287 1.00 0.46 N ATOM 1260 CA GLN A 79 -1.662 -12.022 6.716 1.00 0.50 C ATOM 1261 C GLN A 79 -1.502 -13.053 5.605 1.00 0.48 C ATOM 1262 O GLN A 79 -0.672 -13.953 5.702 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.117 -12.010 7.194 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.281 -11.911 8.697 1.00 0.55 C ATOM 1265 CD GLN A 79 -2.743 -13.122 9.447 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -2.838 -14.297 8.839 1.00 1.66 O flip ATOM 1267 NE2 GLN A 79 -2.268 -13.004 10.577 1.00 1.73 N flip ATOM 0 H GLN A 79 -1.227 -10.564 5.275 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.008 -12.306 7.541 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -3.633 -11.170 6.728 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.609 -12.919 6.846 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -2.769 -11.017 9.052 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.338 -11.788 8.932 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -2.211 -12.084 11.013 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -1.931 -13.827 11.077 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.285 -12.916 4.539 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.412 -13.985 3.554 1.00 0.43 C ATOM 1278 C VAL A 80 -2.542 -13.421 2.145 1.00 0.39 C ATOM 1279 O VAL A 80 -3.293 -12.478 1.908 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.643 -14.883 3.839 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.691 -16.059 2.874 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.657 -15.378 5.282 1.00 0.74 C ATOM 0 H VAL A 80 -2.837 -12.083 4.336 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.505 -14.584 3.630 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.533 -14.272 3.688 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -4.563 -16.675 3.094 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.757 -15.688 1.851 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -2.787 -16.658 2.985 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.535 -16.004 5.443 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -2.756 -15.960 5.476 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.691 -14.524 5.959 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.783 -13.991 1.230 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.851 -13.655 -0.176 1.00 0.46 C ATOM 1294 C TYR A 81 -2.666 -14.698 -0.944 1.00 0.51 C ATOM 1295 O TYR A 81 -2.631 -15.886 -0.616 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.424 -13.640 -0.715 1.00 0.74 C ATOM 1297 CG TYR A 81 0.252 -15.014 -0.685 1.00 1.91 C ATOM 1298 CD1 TYR A 81 0.698 -15.576 0.509 1.00 3.05 C ATOM 1299 CD2 TYR A 81 0.438 -15.747 -1.851 1.00 2.02 C ATOM 1300 CE1 TYR A 81 1.301 -16.818 0.536 1.00 4.21 C ATOM 1301 CE2 TYR A 81 1.043 -16.991 -1.830 1.00 3.15 C ATOM 1302 CZ TYR A 81 1.472 -17.521 -0.634 1.00 4.24 C ATOM 1303 OH TYR A 81 2.072 -18.760 -0.607 1.00 5.40 O ATOM 0 H TYR A 81 -1.093 -14.710 1.447 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.333 -12.686 -0.301 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.435 -13.271 -1.741 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.170 -12.938 -0.130 1.00 0.74 H new ATOM 0 HD1 TYR A 81 0.570 -15.030 1.432 1.00 3.05 H new ATOM 0 HD2 TYR A 81 0.103 -15.337 -2.793 1.00 2.02 H new ATOM 0 HE1 TYR A 81 1.637 -17.236 1.473 1.00 4.21 H new ATOM 0 HE2 TYR A 81 1.178 -17.544 -2.748 1.00 3.15 H new ATOM 0 HH TYR A 81 2.115 -19.122 -1.516 1.00 5.40 H new ATOM 1313 N ASN A 82 -3.395 -14.247 -1.952 1.00 0.42 N ATOM 1314 CA ASN A 82 -4.063 -15.137 -2.899 1.00 0.46 C ATOM 1315 C ASN A 82 -4.171 -14.432 -4.241 1.00 0.44 C ATOM 1316 O ASN A 82 -5.004 -13.544 -4.416 1.00 0.45 O ATOM 1317 CB ASN A 82 -5.469 -15.554 -2.431 1.00 0.50 C ATOM 1318 CG ASN A 82 -5.479 -16.491 -1.240 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -5.532 -16.049 -0.091 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -5.452 -17.788 -1.502 1.00 1.40 N ATOM 0 H ASN A 82 -3.543 -13.255 -2.140 1.00 0.42 H new ATOM 0 HA ASN A 82 -3.466 -16.045 -2.977 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -6.035 -14.658 -2.178 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.987 -16.035 -3.261 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -5.475 -18.463 -0.738 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -5.408 -18.112 -2.468 1.00 1.40 H new ATOM 1327 N MET A 83 -3.309 -14.800 -5.172 1.00 0.47 N ATOM 1328 CA MET A 83 -3.319 -14.197 -6.494 1.00 0.48 C ATOM 1329 C MET A 83 -4.592 -14.596 -7.229 1.00 0.47 C ATOM 1330 O MET A 83 -4.749 -15.741 -7.657 1.00 0.57 O ATOM 1331 CB MET A 83 -2.070 -14.618 -7.271 1.00 0.58 C ATOM 1332 CG MET A 83 -1.275 -13.444 -7.827 1.00 0.63 C ATOM 1333 SD MET A 83 -1.193 -12.062 -6.672 1.00 1.66 S ATOM 1334 CE MET A 83 -0.128 -10.932 -7.560 1.00 2.05 C ATOM 0 H MET A 83 -2.593 -15.514 -5.038 1.00 0.47 H new ATOM 0 HA MET A 83 -3.305 -13.111 -6.402 1.00 0.48 H new ATOM 0 HB2 MET A 83 -1.426 -15.205 -6.617 1.00 0.58 H new ATOM 0 HB3 MET A 83 -2.366 -15.268 -8.094 1.00 0.58 H new ATOM 0 HG2 MET A 83 -0.264 -13.774 -8.067 1.00 0.63 H new ATOM 0 HG3 MET A 83 -1.730 -13.109 -8.759 1.00 0.63 H new ATOM 0 HE1 MET A 83 0.830 -10.855 -7.046 1.00 2.05 H new ATOM 0 HE2 MET A 83 0.032 -11.302 -8.573 1.00 2.05 H new ATOM 0 HE3 MET A 83 -0.596 -9.949 -7.603 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.497 -13.640 -7.366 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.842 -13.921 -7.861 1.00 0.39 C ATOM 1346 C VAL A 84 -6.870 -13.934 -9.377 1.00 0.42 C ATOM 1347 O VAL A 84 -7.269 -14.919 -9.991 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.884 -12.901 -7.340 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.657 -13.452 -6.156 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -7.228 -11.593 -6.947 1.00 0.42 C ATOM 0 H VAL A 84 -5.327 -12.660 -7.142 1.00 0.38 H new ATOM 0 HA VAL A 84 -7.111 -14.907 -7.481 1.00 0.39 H new ATOM 0 HB VAL A 84 -8.579 -12.716 -8.159 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.379 -12.710 -5.816 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -9.182 -14.359 -6.455 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -7.966 -13.683 -5.346 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -7.987 -10.899 -6.586 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.498 -11.775 -6.158 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.726 -11.163 -7.814 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.444 -12.834 -9.974 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.392 -12.719 -11.421 1.00 0.31 C ATOM 1362 C HIS A 85 -5.228 -11.833 -11.837 1.00 0.32 C ATOM 1363 O HIS A 85 -5.203 -10.641 -11.544 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.710 -12.163 -11.974 1.00 0.37 C ATOM 1365 CG HIS A 85 -8.676 -13.223 -12.421 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -9.588 -13.827 -11.578 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -8.873 -13.780 -13.639 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -10.300 -14.705 -12.260 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -9.886 -14.695 -13.510 1.00 1.96 N ATOM 0 H HIS A 85 -6.127 -12.003 -9.475 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.243 -13.715 -11.838 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.186 -11.552 -11.207 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.491 -11.506 -12.816 1.00 0.37 H new ATOM 0 HD2 HIS A 85 -8.332 -13.547 -14.544 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -11.088 -15.326 -11.861 1.00 1.75 H new ATOM 0 HE2 HIS A 85 -10.259 -15.275 -14.262 1.00 1.96 H new ATOM 1378 N ARG A 86 -4.250 -12.436 -12.488 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.109 -11.702 -13.012 1.00 0.36 C ATOM 1380 C ARG A 86 -3.369 -11.383 -14.469 1.00 0.38 C ATOM 1381 O ARG A 86 -3.577 -12.276 -15.292 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.827 -12.520 -12.860 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.725 -13.256 -11.530 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.306 -13.744 -11.277 1.00 0.69 C ATOM 1385 NE ARG A 86 0.185 -14.613 -12.346 1.00 1.15 N ATOM 1386 CZ ARG A 86 1.466 -14.951 -12.500 1.00 1.68 C ATOM 1387 NH1 ARG A 86 2.385 -14.476 -11.670 1.00 1.98 N ATOM 1388 NH2 ARG A 86 1.826 -15.760 -13.487 1.00 2.44 N ATOM 0 H ARG A 86 -4.222 -13.440 -12.668 1.00 0.34 H new ATOM 0 HA ARG A 86 -2.978 -10.777 -12.451 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -1.771 -13.245 -13.672 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -0.968 -11.857 -12.965 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -2.034 -12.594 -10.721 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.410 -14.104 -11.528 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.358 -12.885 -11.177 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.274 -14.284 -10.331 1.00 0.69 H new ATOM 0 HE ARG A 86 -0.492 -14.982 -13.013 1.00 1.15 H new ATOM 0 HH11 ARG A 86 2.113 -13.851 -10.912 1.00 1.98 H new ATOM 0 HH12 ARG A 86 3.364 -14.736 -11.790 1.00 1.98 H new ATOM 0 HH21 ARG A 86 1.123 -16.125 -14.130 1.00 2.44 H new ATOM 0 HH22 ARG A 86 2.806 -16.018 -13.604 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.367 -10.097 -14.767 1.00 0.35 N ATOM 1403 CA ILE A 87 -3.834 -9.601 -16.048 1.00 0.36 C ATOM 1404 C ILE A 87 -2.833 -9.931 -17.135 1.00 0.39 C ATOM 1405 O ILE A 87 -3.179 -10.515 -18.158 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.061 -8.074 -16.023 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.385 -7.570 -14.612 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.177 -7.699 -16.974 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.559 -8.249 -13.944 1.00 0.27 C ATOM 0 H ILE A 87 -3.043 -9.369 -14.130 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.786 -10.090 -16.254 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.134 -7.597 -16.342 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.504 -7.701 -13.984 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -4.584 -6.499 -14.662 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -5.329 -6.620 -16.949 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -4.911 -8.004 -17.986 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.096 -8.202 -16.673 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.709 -7.824 -12.951 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.457 -8.096 -14.543 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.359 -9.317 -13.855 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.592 -9.542 -16.906 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.515 -9.862 -17.832 1.00 0.56 C ATOM 1423 C ASP A 88 0.768 -10.235 -17.091 1.00 0.67 C ATOM 1424 O ASP A 88 0.928 -11.372 -16.652 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.269 -8.707 -18.815 1.00 0.65 C ATOM 1426 CG ASP A 88 -0.233 -7.352 -18.140 1.00 1.16 C ATOM 1427 OD1 ASP A 88 0.852 -6.934 -17.702 1.00 1.86 O ATOM 1428 OD2 ASP A 88 -1.296 -6.696 -18.037 1.00 1.35 O ATOM 0 H ASP A 88 -1.303 -9.005 -16.089 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.827 -10.733 -18.408 1.00 0.56 H new ATOM 0 HB2 ASP A 88 0.675 -8.874 -19.333 1.00 0.65 H new ATOM 0 HB3 ASP A 88 -1.053 -8.709 -19.572 1.00 0.65 H new ATOM 1433 N SER A 89 1.666 -9.280 -16.936 1.00 0.65 N ATOM 1434 CA SER A 89 2.937 -9.533 -16.289 1.00 0.70 C ATOM 1435 C SER A 89 3.308 -8.393 -15.346 1.00 0.53 C ATOM 1436 O SER A 89 4.228 -8.529 -14.539 1.00 0.59 O ATOM 1437 CB SER A 89 4.033 -9.724 -17.345 1.00 0.94 C ATOM 1438 OG SER A 89 5.280 -10.043 -16.749 1.00 1.44 O ATOM 0 H SER A 89 1.537 -8.319 -17.251 1.00 0.65 H new ATOM 0 HA SER A 89 2.845 -10.444 -15.698 1.00 0.70 H new ATOM 0 HB2 SER A 89 3.743 -10.519 -18.032 1.00 0.94 H new ATOM 0 HB3 SER A 89 4.133 -8.813 -17.936 1.00 0.94 H new ATOM 0 HG SER A 89 5.275 -9.762 -15.810 1.00 1.44 H new ATOM 1444 N ASP A 90 2.597 -7.267 -15.438 1.00 0.47 N ATOM 1445 CA ASP A 90 2.915 -6.118 -14.606 1.00 0.48 C ATOM 1446 C ASP A 90 1.655 -5.595 -13.956 1.00 0.39 C ATOM 1447 O ASP A 90 1.654 -4.537 -13.330 1.00 0.41 O ATOM 1448 CB ASP A 90 3.559 -4.999 -15.435 1.00 0.73 C ATOM 1449 CG ASP A 90 4.867 -5.408 -16.082 1.00 1.21 C ATOM 1450 OD1 ASP A 90 5.871 -5.565 -15.353 1.00 1.70 O ATOM 1451 OD2 ASP A 90 4.897 -5.597 -17.315 1.00 1.87 O ATOM 0 H ASP A 90 1.810 -7.132 -16.072 1.00 0.47 H new ATOM 0 HA ASP A 90 3.624 -6.437 -13.842 1.00 0.48 H new ATOM 0 HB2 ASP A 90 2.861 -4.684 -16.211 1.00 0.73 H new ATOM 0 HB3 ASP A 90 3.734 -4.136 -14.793 1.00 0.73 H new ATOM 1456 N THR A 91 0.575 -6.341 -14.101 1.00 0.35 N ATOM 1457 CA THR A 91 -0.707 -5.886 -13.665 1.00 0.32 C ATOM 1458 C THR A 91 -1.419 -7.063 -13.030 1.00 0.28 C ATOM 1459 O THR A 91 -1.622 -8.096 -13.671 1.00 0.30 O ATOM 1460 CB THR A 91 -1.494 -5.323 -14.865 1.00 0.36 C ATOM 1461 OG1 THR A 91 -0.636 -4.457 -15.623 1.00 0.46 O ATOM 1462 CG2 THR A 91 -2.702 -4.535 -14.415 1.00 0.35 C ATOM 0 H THR A 91 0.574 -7.270 -14.522 1.00 0.35 H new ATOM 0 HA THR A 91 -0.616 -5.083 -12.934 1.00 0.32 H new ATOM 0 HB THR A 91 -1.835 -6.162 -15.471 1.00 0.36 H new ATOM 0 HG1 THR A 91 -0.352 -3.705 -15.062 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.233 -4.153 -15.287 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.365 -5.182 -13.841 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.381 -3.700 -13.792 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.729 -6.938 -11.758 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.245 -8.055 -10.997 1.00 0.25 C ATOM 1472 C PHE A 92 -3.454 -7.646 -10.197 1.00 0.22 C ATOM 1473 O PHE A 92 -3.831 -6.483 -10.167 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.204 -8.567 -10.003 1.00 0.30 C ATOM 1475 CG PHE A 92 0.149 -8.832 -10.581 1.00 0.32 C ATOM 1476 CD1 PHE A 92 1.096 -7.824 -10.635 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.480 -10.089 -11.047 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.351 -8.064 -11.148 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.732 -10.339 -11.564 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.674 -9.326 -11.615 1.00 0.41 C ATOM 0 H PHE A 92 -1.632 -6.072 -11.228 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.503 -8.832 -11.716 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.102 -7.838 -9.200 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.576 -9.487 -9.553 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.848 -6.838 -10.271 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.250 -10.884 -11.006 1.00 0.39 H new ATOM 0 HE1 PHE A 92 3.081 -7.269 -11.186 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.979 -11.325 -11.929 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.657 -9.520 -12.018 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.048 -8.626 -9.556 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.017 -8.391 -8.516 1.00 0.23 C ATOM 1492 C ILE A 93 -4.667 -9.307 -7.360 1.00 0.28 C ATOM 1493 O ILE A 93 -4.542 -10.520 -7.550 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.457 -8.676 -8.977 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.736 -8.020 -10.320 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.446 -8.171 -7.946 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.096 -8.360 -10.861 1.00 0.41 C ATOM 0 H ILE A 93 -3.870 -9.613 -9.744 1.00 0.23 H new ATOM 0 HA ILE A 93 -4.981 -7.340 -8.230 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.570 -9.755 -9.087 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.651 -6.938 -10.216 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -5.976 -8.332 -11.037 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.461 -8.378 -8.284 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.270 -8.674 -6.995 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.319 -7.096 -7.816 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.240 -7.864 -11.821 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.175 -9.439 -10.994 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -8.861 -8.024 -10.161 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.457 -8.743 -6.191 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.038 -9.536 -5.055 1.00 0.48 C ATOM 1511 C CYS A 94 -5.119 -9.595 -3.986 1.00 0.39 C ATOM 1512 O CYS A 94 -5.594 -8.569 -3.497 1.00 0.47 O ATOM 1513 CB CYS A 94 -2.742 -8.979 -4.466 1.00 0.74 C ATOM 1514 SG CYS A 94 -2.066 -9.957 -3.103 1.00 2.01 S ATOM 0 H CYS A 94 -4.568 -7.747 -6.002 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.861 -10.552 -5.408 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -1.995 -8.914 -5.257 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.923 -7.963 -4.115 1.00 0.74 H new ATOM 0 HG CYS A 94 -2.378 -9.398 -1.971 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.535 -10.810 -3.661 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.370 -11.047 -2.500 1.00 0.36 C ATOM 1522 C HIS A 95 -5.494 -11.038 -1.254 1.00 0.39 C ATOM 1523 O HIS A 95 -4.964 -12.064 -0.824 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.133 -12.369 -2.635 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.835 -12.801 -1.382 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -7.303 -13.705 -0.490 1.00 1.20 N ATOM 1527 CD2 HIS A 95 -9.027 -12.438 -0.870 1.00 1.23 C ATOM 1528 CE1 HIS A 95 -8.138 -13.874 0.511 1.00 0.99 C ATOM 1529 NE2 HIS A 95 -9.196 -13.114 0.311 1.00 0.95 N ATOM 0 H HIS A 95 -5.304 -11.650 -4.191 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.115 -10.256 -2.419 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.867 -12.273 -3.435 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.435 -13.150 -2.935 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -9.724 -11.740 -1.310 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -7.983 -14.527 1.357 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -10.004 -13.041 0.930 1.00 0.95 H new ATOM 1538 N THR A 96 -5.335 -9.859 -0.711 1.00 0.35 N ATOM 1539 CA THR A 96 -4.482 -9.622 0.422 1.00 0.38 C ATOM 1540 C THR A 96 -5.282 -9.608 1.721 1.00 0.36 C ATOM 1541 O THR A 96 -6.109 -8.726 1.935 1.00 0.41 O ATOM 1542 CB THR A 96 -3.782 -8.262 0.255 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.195 -8.161 -1.051 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.708 -8.081 1.310 1.00 0.47 C ATOM 0 H THR A 96 -5.805 -9.020 -1.052 1.00 0.35 H new ATOM 0 HA THR A 96 -3.749 -10.427 0.472 1.00 0.38 H new ATOM 0 HB THR A 96 -4.530 -7.478 0.374 1.00 0.43 H new ATOM 0 HG1 THR A 96 -3.580 -7.394 -1.524 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.225 -7.113 1.175 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.160 -8.126 2.301 1.00 0.47 H new ATOM 0 HG23 THR A 96 -1.966 -8.874 1.214 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.045 -10.575 2.594 1.00 0.38 N ATOM 1553 CA ILE A 97 -5.661 -10.539 3.909 1.00 0.40 C ATOM 1554 C ILE A 97 -4.919 -9.533 4.773 1.00 0.41 C ATOM 1555 O ILE A 97 -3.698 -9.601 4.930 1.00 0.42 O ATOM 1556 CB ILE A 97 -5.690 -11.914 4.609 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.483 -12.924 3.779 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.310 -11.781 5.997 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -7.955 -12.595 3.678 1.00 1.03 C ATOM 0 H ILE A 97 -4.442 -11.379 2.420 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.701 -10.244 3.773 1.00 0.40 H new ATOM 0 HB ILE A 97 -4.666 -12.273 4.707 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -6.059 -12.971 2.776 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.369 -13.914 4.220 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.326 -12.756 6.483 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -5.719 -11.087 6.595 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.329 -11.404 5.906 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.457 -13.352 3.076 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.393 -12.576 4.676 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.078 -11.619 3.210 1.00 1.03 H new ATOM 1571 N THR A 98 -5.671 -8.594 5.303 1.00 0.49 N ATOM 1572 CA THR A 98 -5.125 -7.440 5.976 1.00 0.56 C ATOM 1573 C THR A 98 -5.405 -7.481 7.478 1.00 0.63 C ATOM 1574 O THR A 98 -6.528 -7.739 7.905 1.00 0.77 O ATOM 1575 CB THR A 98 -5.754 -6.169 5.382 1.00 0.71 C ATOM 1576 OG1 THR A 98 -5.693 -6.217 3.949 1.00 1.38 O ATOM 1577 CG2 THR A 98 -5.050 -4.921 5.873 1.00 0.86 C ATOM 0 H THR A 98 -6.691 -8.612 5.278 1.00 0.49 H new ATOM 0 HA THR A 98 -4.045 -7.440 5.831 1.00 0.56 H new ATOM 0 HB THR A 98 -6.793 -6.128 5.709 1.00 0.71 H new ATOM 0 HG1 THR A 98 -5.175 -5.454 3.618 1.00 1.38 H new ATOM 0 HG21 THR A 98 -5.520 -4.041 5.434 1.00 0.86 H new ATOM 0 HG22 THR A 98 -5.122 -4.866 6.959 1.00 0.86 H new ATOM 0 HG23 THR A 98 -4.001 -4.956 5.580 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.391 -7.217 8.276 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.575 -7.065 9.708 1.00 0.72 C ATOM 1587 C GLN A 99 -4.882 -5.606 10.035 1.00 0.99 C ATOM 1588 O GLN A 99 -3.986 -4.831 10.371 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.336 -7.518 10.483 1.00 0.61 C ATOM 1590 CG GLN A 99 -3.307 -9.004 10.771 1.00 0.80 C ATOM 1591 CD GLN A 99 -2.160 -9.396 11.681 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -2.296 -9.392 12.905 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -1.025 -9.743 11.096 1.00 1.82 N ATOM 0 H GLN A 99 -3.428 -7.103 7.958 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.411 -7.696 10.010 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.445 -7.250 9.915 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.289 -6.973 11.426 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -4.250 -9.300 11.231 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -3.225 -9.551 9.832 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -0.952 -9.733 10.079 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -0.223 -10.020 11.662 1.00 1.82 H new ATOM 1677 N ILE A 106 -11.281 -2.452 14.799 1.00 1.05 N ATOM 1678 CA ILE A 106 -11.355 -3.070 13.490 1.00 0.96 C ATOM 1679 C ILE A 106 -10.942 -4.534 13.584 1.00 0.94 C ATOM 1680 O ILE A 106 -10.065 -4.886 14.375 1.00 1.12 O ATOM 1681 CB ILE A 106 -10.433 -2.337 12.492 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -10.621 -0.826 12.614 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -10.719 -2.787 11.066 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -9.526 -0.024 11.957 1.00 0.94 C ATOM 0 HA ILE A 106 -12.383 -3.004 13.134 1.00 0.96 H new ATOM 0 HB ILE A 106 -9.399 -2.586 12.731 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -11.577 -0.551 12.170 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -10.671 -0.559 13.670 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -10.059 -2.259 10.378 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -10.547 -3.860 10.982 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -11.756 -2.565 10.816 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -9.727 1.040 12.085 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -8.569 -0.270 12.417 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -9.489 -0.261 10.894 1.00 0.94 H new ATOM 1696 N SER A 107 -11.588 -5.378 12.797 1.00 0.84 N ATOM 1697 CA SER A 107 -11.297 -6.801 12.790 1.00 0.86 C ATOM 1698 C SER A 107 -10.387 -7.140 11.607 1.00 0.79 C ATOM 1699 O SER A 107 -10.161 -6.284 10.748 1.00 0.77 O ATOM 1700 CB SER A 107 -12.611 -7.577 12.693 1.00 0.97 C ATOM 1701 OG SER A 107 -13.527 -7.143 13.684 1.00 1.35 O ATOM 0 H SER A 107 -12.324 -5.098 12.149 1.00 0.84 H new ATOM 0 HA SER A 107 -10.782 -7.078 13.710 1.00 0.86 H new ATOM 0 HB2 SER A 107 -13.047 -7.440 11.703 1.00 0.97 H new ATOM 0 HB3 SER A 107 -12.418 -8.643 12.812 1.00 0.97 H new ATOM 0 HG SER A 107 -14.361 -7.651 13.603 1.00 1.35 H new ATOM 1707 N PRO A 108 -9.827 -8.369 11.556 1.00 0.82 N ATOM 1708 CA PRO A 108 -9.083 -8.840 10.385 1.00 0.82 C ATOM 1709 C PRO A 108 -9.842 -8.544 9.097 1.00 0.73 C ATOM 1710 O PRO A 108 -11.024 -8.874 8.970 1.00 0.81 O ATOM 1711 CB PRO A 108 -8.974 -10.344 10.620 1.00 0.91 C ATOM 1712 CG PRO A 108 -8.970 -10.486 12.102 1.00 1.07 C ATOM 1713 CD PRO A 108 -9.853 -9.384 12.631 1.00 0.92 C ATOM 0 HA PRO A 108 -8.114 -8.353 10.273 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -9.812 -10.878 10.172 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -8.064 -10.750 10.179 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -9.347 -11.464 12.401 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -7.959 -10.399 12.499 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -10.866 -9.739 12.822 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -9.473 -8.982 13.570 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.173 -7.913 8.151 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.847 -7.406 6.979 1.00 0.56 C ATOM 1723 C ARG A 109 -9.328 -8.107 5.735 1.00 0.52 C ATOM 1724 O ARG A 109 -8.266 -8.723 5.753 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.627 -5.895 6.867 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.576 -5.220 5.908 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.040 -3.906 5.401 1.00 0.88 C ATOM 1728 NE ARG A 109 -8.926 -4.098 4.470 1.00 1.89 N ATOM 1729 CZ ARG A 109 -7.916 -3.243 4.320 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -7.839 -2.159 5.082 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -6.966 -3.488 3.427 1.00 3.45 N ATOM 0 H ARG A 109 -8.168 -7.741 8.174 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.915 -7.602 7.069 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -9.738 -5.445 7.854 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.603 -5.707 6.545 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -10.767 -5.882 5.063 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -11.532 -5.053 6.404 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -10.838 -3.355 4.904 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -9.710 -3.298 6.243 1.00 0.88 H new ATOM 0 HE ARG A 109 -8.923 -4.943 3.898 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -8.555 -1.978 5.786 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -7.064 -1.507 4.964 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -7.009 -4.331 2.855 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -6.193 -2.833 3.312 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.080 -8.014 4.663 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.692 -8.604 3.400 1.00 0.47 C ATOM 1747 C ASP A 110 -9.400 -7.479 2.417 1.00 0.44 C ATOM 1748 O ASP A 110 -9.783 -6.332 2.659 1.00 0.64 O ATOM 1749 CB ASP A 110 -10.825 -9.497 2.898 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.373 -10.548 1.905 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -9.871 -10.176 0.826 1.00 1.32 O ATOM 1752 OD2 ASP A 110 -10.471 -11.749 2.211 1.00 1.37 O ATOM 0 H ASP A 110 -10.977 -7.528 4.640 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.798 -9.218 3.511 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -11.292 -9.991 3.750 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.589 -8.874 2.433 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.698 -7.773 1.344 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.387 -6.756 0.356 1.00 0.43 C ATOM 1759 C PHE A 111 -8.267 -7.360 -1.042 1.00 0.41 C ATOM 1760 O PHE A 111 -7.672 -8.419 -1.226 1.00 0.54 O ATOM 1761 CB PHE A 111 -7.083 -6.055 0.756 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.775 -4.787 0.006 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.786 -4.001 -0.523 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.462 -4.373 -0.147 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -7.493 -2.830 -1.191 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.163 -3.203 -0.816 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.180 -2.431 -1.339 1.00 2.41 C ATOM 0 H PHE A 111 -8.333 -8.701 1.132 1.00 0.39 H new ATOM 0 HA PHE A 111 -9.199 -6.030 0.326 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -7.125 -5.826 1.821 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.257 -6.752 0.612 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.815 -4.309 -0.411 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.662 -4.973 0.262 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.290 -2.226 -1.598 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -4.135 -2.893 -0.930 1.00 2.30 H new ATOM 0 HZ PHE A 111 -5.949 -1.516 -1.864 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.860 -6.678 -2.015 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.705 -7.027 -3.421 1.00 0.33 C ATOM 1779 C ILE A 112 -8.159 -5.826 -4.153 1.00 0.35 C ATOM 1780 O ILE A 112 -8.910 -4.966 -4.622 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.011 -7.465 -4.132 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.597 -8.718 -3.492 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -9.722 -7.724 -5.596 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.706 -9.934 -3.589 1.00 0.42 C ATOM 0 H ILE A 112 -9.460 -5.870 -1.852 1.00 0.34 H new ATOM 0 HA ILE A 112 -8.035 -7.886 -3.445 1.00 0.33 H new ATOM 0 HB ILE A 112 -10.743 -6.663 -4.033 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.802 -8.514 -2.441 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.553 -8.942 -3.966 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -10.639 -8.032 -6.099 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.343 -6.813 -6.059 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -8.976 -8.514 -5.685 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.195 -10.782 -3.110 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.520 -10.166 -4.638 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.759 -9.732 -3.089 1.00 0.42 H new ATOM 1796 N ASP A 113 -6.857 -5.749 -4.209 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.200 -4.663 -4.890 1.00 0.42 C ATOM 1798 C ASP A 113 -5.846 -5.058 -6.313 1.00 0.33 C ATOM 1799 O ASP A 113 -5.058 -5.973 -6.531 1.00 0.35 O ATOM 1800 CB ASP A 113 -4.939 -4.232 -4.121 1.00 0.58 C ATOM 1801 CG ASP A 113 -4.029 -5.393 -3.737 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -3.155 -5.768 -4.555 1.00 1.86 O ATOM 1803 OD2 ASP A 113 -4.194 -5.945 -2.634 1.00 1.32 O ATOM 0 H ASP A 113 -6.225 -6.430 -3.788 1.00 0.36 H new ATOM 0 HA ASP A 113 -6.887 -3.818 -4.931 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -4.375 -3.527 -4.731 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -5.239 -3.702 -3.217 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.478 -4.423 -7.293 1.00 0.28 N ATOM 1809 CA LEU A 114 -5.932 -4.470 -8.631 1.00 0.23 C ATOM 1810 C LEU A 114 -4.761 -3.535 -8.699 1.00 0.22 C ATOM 1811 O LEU A 114 -4.884 -2.335 -8.476 1.00 0.24 O ATOM 1812 CB LEU A 114 -6.929 -4.104 -9.705 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.284 -3.696 -11.032 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -5.838 -4.922 -11.815 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.231 -2.830 -11.843 1.00 0.26 C ATOM 0 H LEU A 114 -7.340 -3.888 -7.188 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.637 -5.501 -8.825 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.590 -4.953 -9.879 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.551 -3.284 -9.346 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.395 -3.103 -10.817 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.383 -4.608 -12.754 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.110 -5.483 -11.229 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.701 -5.554 -12.024 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.754 -2.550 -12.782 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.145 -3.387 -12.051 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.475 -1.930 -11.278 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.641 -4.086 -9.030 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.398 -3.409 -8.852 1.00 0.23 C ATOM 1829 C VAL A 115 -1.584 -3.386 -10.117 1.00 0.23 C ATOM 1830 O VAL A 115 -1.347 -4.419 -10.749 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.632 -4.084 -7.712 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.077 -5.538 -7.596 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.124 -3.962 -7.891 1.00 0.26 C ATOM 0 H VAL A 115 -3.561 -5.020 -9.432 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.595 -2.368 -8.597 1.00 0.23 H new ATOM 0 HB VAL A 115 -1.866 -3.571 -6.779 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.533 -6.021 -6.785 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.146 -5.576 -7.389 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -1.870 -6.058 -8.532 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.382 -4.454 -7.060 1.00 0.26 H new ATOM 0 HG22 VAL A 115 0.171 -4.436 -8.827 1.00 0.26 H new ATOM 0 HG23 VAL A 115 0.156 -2.909 -7.913 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.183 -2.197 -10.502 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.294 -2.060 -11.626 1.00 0.25 C ATOM 1845 C TYR A 116 1.088 -1.628 -11.160 1.00 0.26 C ATOM 1846 O TYR A 116 1.269 -0.516 -10.658 1.00 0.28 O ATOM 1847 CB TYR A 116 -0.859 -1.080 -12.658 1.00 0.31 C ATOM 1848 CG TYR A 116 0.041 -0.844 -13.854 1.00 0.83 C ATOM 1849 CD1 TYR A 116 0.779 -1.882 -14.396 1.00 1.31 C ATOM 1850 CD2 TYR A 116 0.159 0.413 -14.433 1.00 1.10 C ATOM 1851 CE1 TYR A 116 1.603 -1.681 -15.482 1.00 1.87 C ATOM 1852 CE2 TYR A 116 0.980 0.623 -15.521 1.00 1.65 C ATOM 1853 CZ TYR A 116 1.685 -0.393 -16.048 1.00 1.99 C ATOM 1854 OH TYR A 116 2.525 -0.227 -17.123 1.00 2.57 O ATOM 0 H TYR A 116 -1.456 -1.321 -10.057 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.203 -3.032 -12.111 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -1.820 -1.456 -13.010 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.050 -0.125 -12.168 1.00 0.31 H new ATOM 0 HD1 TYR A 116 0.708 -2.867 -13.960 1.00 1.31 H new ATOM 0 HD2 TYR A 116 -0.402 1.240 -14.024 1.00 1.10 H new ATOM 0 HE1 TYR A 116 2.177 -2.498 -15.893 1.00 1.87 H new ATOM 0 HE2 TYR A 116 1.057 1.610 -15.952 1.00 1.65 H new ATOM 0 HH TYR A 116 2.241 -0.815 -17.854 1.00 2.57 H new ATOM 1864 N ILE A 117 2.053 -2.518 -11.323 1.00 0.30 N ATOM 1865 CA ILE A 117 3.420 -2.251 -10.917 1.00 0.33 C ATOM 1866 C ILE A 117 4.227 -1.772 -12.114 1.00 0.38 C ATOM 1867 O ILE A 117 4.439 -2.518 -13.070 1.00 0.46 O ATOM 1868 CB ILE A 117 4.083 -3.511 -10.311 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.290 -3.998 -9.091 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.530 -3.222 -9.925 1.00 0.52 C ATOM 1871 CD1 ILE A 117 3.717 -5.358 -8.589 1.00 0.89 C ATOM 0 H ILE A 117 1.911 -3.439 -11.738 1.00 0.30 H new ATOM 0 HA ILE A 117 3.401 -1.476 -10.151 1.00 0.33 H new ATOM 0 HB ILE A 117 4.079 -4.299 -11.064 1.00 0.42 H new ATOM 0 HG12 ILE A 117 3.400 -3.273 -8.285 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.231 -4.032 -9.347 1.00 0.45 H new ATOM 0 HG21 ILE A 117 5.980 -4.120 -9.501 1.00 0.52 H new ATOM 0 HG22 ILE A 117 6.089 -2.920 -10.810 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.557 -2.420 -9.188 1.00 0.52 H new ATOM 0 HD11 ILE A 117 3.111 -5.634 -7.726 1.00 0.89 H new ATOM 0 HD12 ILE A 117 3.581 -6.097 -9.379 1.00 0.89 H new ATOM 0 HD13 ILE A 117 4.767 -5.326 -8.300 1.00 0.89 H new ATOM 1883 N LYS A 118 4.656 -0.524 -12.069 1.00 0.42 N ATOM 1884 CA LYS A 118 5.424 0.054 -13.157 1.00 0.52 C ATOM 1885 C LYS A 118 6.569 0.878 -12.614 1.00 0.39 C ATOM 1886 O LYS A 118 6.430 1.569 -11.607 1.00 0.34 O ATOM 1887 CB LYS A 118 4.531 0.914 -14.065 1.00 0.70 C ATOM 1888 CG LYS A 118 5.308 1.636 -15.157 1.00 0.93 C ATOM 1889 CD LYS A 118 4.403 2.226 -16.227 1.00 0.94 C ATOM 1890 CE LYS A 118 3.467 3.291 -15.678 1.00 0.72 C ATOM 1891 NZ LYS A 118 2.738 3.991 -16.768 1.00 1.20 N ATOM 0 H LYS A 118 4.485 0.110 -11.289 1.00 0.42 H new ATOM 0 HA LYS A 118 5.831 -0.762 -13.755 1.00 0.52 H new ATOM 0 HB2 LYS A 118 3.773 0.280 -14.525 1.00 0.70 H new ATOM 0 HB3 LYS A 118 4.004 1.649 -13.456 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.902 2.433 -14.709 1.00 0.93 H new ATOM 0 HG3 LYS A 118 6.007 0.940 -15.621 1.00 0.93 H new ATOM 0 HD2 LYS A 118 5.016 2.659 -17.018 1.00 0.94 H new ATOM 0 HD3 LYS A 118 3.814 1.428 -16.680 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.751 2.831 -14.997 1.00 0.72 H new ATOM 0 HE3 LYS A 118 4.039 4.015 -15.098 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 2.109 4.711 -16.358 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 3.421 4.450 -17.404 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 2.173 3.303 -17.306 1.00 1.20 H new ATOM 1905 N ARG A 119 7.704 0.795 -13.280 1.00 0.52 N ATOM 1906 CA ARG A 119 8.847 1.577 -12.893 1.00 0.52 C ATOM 1907 C ARG A 119 9.146 2.583 -13.980 1.00 0.49 C ATOM 1908 O ARG A 119 9.434 2.238 -15.125 1.00 0.58 O ATOM 1909 CB ARG A 119 10.064 0.684 -12.568 1.00 0.79 C ATOM 1910 CG ARG A 119 10.599 -0.138 -13.735 1.00 1.00 C ATOM 1911 CD ARG A 119 11.674 0.610 -14.514 1.00 1.25 C ATOM 1912 NE ARG A 119 12.918 0.744 -13.759 1.00 1.68 N ATOM 1913 CZ ARG A 119 14.115 0.879 -14.324 1.00 2.18 C ATOM 1914 NH1 ARG A 119 14.230 0.862 -15.647 1.00 2.57 N ATOM 1915 NH2 ARG A 119 15.195 1.027 -13.568 1.00 2.80 N ATOM 0 H ARG A 119 7.853 0.193 -14.090 1.00 0.52 H new ATOM 0 HA ARG A 119 8.621 2.116 -11.973 1.00 0.52 H new ATOM 0 HB2 ARG A 119 10.868 1.317 -12.192 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.790 0.004 -11.762 1.00 0.79 H new ATOM 0 HG2 ARG A 119 11.009 -1.076 -13.360 1.00 1.00 H new ATOM 0 HG3 ARG A 119 9.778 -0.394 -14.405 1.00 1.00 H new ATOM 0 HD2 ARG A 119 11.874 0.085 -15.448 1.00 1.25 H new ATOM 0 HD3 ARG A 119 11.304 1.601 -14.778 1.00 1.25 H new ATOM 0 HE ARG A 119 12.866 0.733 -12.740 1.00 1.68 H new ATOM 0 HH11 ARG A 119 13.401 0.746 -16.230 1.00 2.57 H new ATOM 0 HH12 ARG A 119 15.147 0.965 -16.081 1.00 2.57 H new ATOM 0 HH21 ARG A 119 15.109 1.037 -12.552 1.00 2.80 H new ATOM 0 HH22 ARG A 119 16.112 1.130 -14.003 1.00 2.80 H new ATOM 1929 N TYR A 120 8.967 3.827 -13.634 1.00 0.43 N ATOM 1930 CA TYR A 120 9.435 4.909 -14.459 1.00 0.46 C ATOM 1931 C TYR A 120 10.950 4.889 -14.401 1.00 0.50 C ATOM 1932 O TYR A 120 11.517 5.119 -13.338 1.00 0.48 O ATOM 1933 CB TYR A 120 8.879 6.249 -13.959 1.00 0.46 C ATOM 1934 CG TYR A 120 7.383 6.411 -14.152 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.482 5.504 -13.608 1.00 0.58 C ATOM 1936 CD2 TYR A 120 6.875 7.472 -14.891 1.00 0.76 C ATOM 1937 CE1 TYR A 120 5.121 5.650 -13.791 1.00 0.66 C ATOM 1938 CE2 TYR A 120 5.513 7.624 -15.079 1.00 0.83 C ATOM 1939 CZ TYR A 120 4.642 6.710 -14.528 1.00 0.70 C ATOM 1940 OH TYR A 120 3.287 6.854 -14.721 1.00 0.81 O ATOM 0 H TYR A 120 8.496 4.120 -12.778 1.00 0.43 H new ATOM 0 HA TYR A 120 9.093 4.790 -15.487 1.00 0.46 H new ATOM 0 HB2 TYR A 120 9.111 6.353 -12.899 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.391 7.059 -14.479 1.00 0.46 H new ATOM 0 HD1 TYR A 120 6.853 4.669 -13.031 1.00 0.58 H new ATOM 0 HD2 TYR A 120 7.555 8.190 -15.326 1.00 0.76 H new ATOM 0 HE1 TYR A 120 4.436 4.936 -13.358 1.00 0.66 H new ATOM 0 HE2 TYR A 120 5.134 8.455 -15.655 1.00 0.83 H new ATOM 0 HH TYR A 120 3.117 7.653 -15.262 1.00 0.81 H new ATOM 1950 N GLU A 121 11.564 4.526 -15.527 1.00 0.61 N ATOM 1951 CA GLU A 121 13.017 4.347 -15.660 1.00 0.73 C ATOM 1952 C GLU A 121 13.821 5.343 -14.834 1.00 0.70 C ATOM 1953 O GLU A 121 14.105 6.462 -15.274 1.00 0.79 O ATOM 1954 CB GLU A 121 13.431 4.454 -17.126 1.00 0.96 C ATOM 1955 CG GLU A 121 12.801 3.403 -18.023 1.00 1.06 C ATOM 1956 CD GLU A 121 13.247 3.538 -19.462 1.00 1.69 C ATOM 1957 OE1 GLU A 121 14.297 2.963 -19.821 1.00 2.28 O ATOM 1958 OE2 GLU A 121 12.555 4.221 -20.242 1.00 2.27 O ATOM 0 H GLU A 121 11.058 4.343 -16.393 1.00 0.61 H new ATOM 0 HA GLU A 121 13.240 3.352 -15.275 1.00 0.73 H new ATOM 0 HB2 GLU A 121 13.162 5.443 -17.498 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.516 4.372 -17.194 1.00 0.96 H new ATOM 0 HG2 GLU A 121 13.062 2.411 -17.655 1.00 1.06 H new ATOM 0 HG3 GLU A 121 11.715 3.487 -17.971 1.00 1.06 H new ATOM 1965 N GLY A 122 14.184 4.903 -13.639 1.00 0.67 N ATOM 1966 CA GLY A 122 14.953 5.716 -12.720 1.00 0.71 C ATOM 1967 C GLY A 122 14.235 6.988 -12.363 1.00 0.66 C ATOM 1968 O GLY A 122 14.787 8.085 -12.458 1.00 0.76 O ATOM 0 H GLY A 122 13.953 3.975 -13.283 1.00 0.67 H new ATOM 0 HA2 GLY A 122 15.155 5.146 -11.813 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.917 5.956 -13.167 1.00 0.71 H new ATOM 1972 N ASN A 123 12.993 6.831 -11.963 1.00 0.57 N ATOM 1973 CA ASN A 123 12.141 7.953 -11.655 1.00 0.54 C ATOM 1974 C ASN A 123 11.141 7.568 -10.573 1.00 0.45 C ATOM 1975 O ASN A 123 11.068 8.218 -9.534 1.00 0.45 O ATOM 1976 CB ASN A 123 11.422 8.402 -12.926 1.00 0.60 C ATOM 1977 CG ASN A 123 10.641 9.690 -12.752 1.00 1.01 C ATOM 1978 OD1 ASN A 123 10.963 10.520 -11.900 1.00 1.65 O ATOM 1979 ND2 ASN A 123 9.629 9.882 -13.585 1.00 1.61 N ATOM 0 H ASN A 123 12.547 5.922 -11.843 1.00 0.57 H new ATOM 0 HA ASN A 123 12.743 8.780 -11.279 1.00 0.54 H new ATOM 0 HB2 ASN A 123 12.155 8.535 -13.722 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.742 7.614 -13.248 1.00 0.60 H new ATOM 0 HD21 ASN A 123 9.084 10.743 -13.535 1.00 1.61 H new ATOM 0 HD22 ASN A 123 9.395 9.169 -14.276 1.00 1.61 H new ATOM 1986 N MET A 124 10.409 6.475 -10.792 1.00 0.39 N ATOM 1987 CA MET A 124 9.372 6.047 -9.844 1.00 0.34 C ATOM 1988 C MET A 124 9.041 4.569 -10.001 1.00 0.33 C ATOM 1989 O MET A 124 8.582 4.135 -11.053 1.00 0.40 O ATOM 1990 CB MET A 124 8.075 6.862 -9.999 1.00 0.34 C ATOM 1991 CG MET A 124 7.972 8.079 -9.086 1.00 0.56 C ATOM 1992 SD MET A 124 8.482 9.624 -9.874 1.00 1.09 S ATOM 1993 CE MET A 124 7.278 9.771 -11.190 1.00 1.12 C ATOM 0 H MET A 124 10.511 5.873 -11.609 1.00 0.39 H new ATOM 0 HA MET A 124 9.786 6.222 -8.851 1.00 0.34 H new ATOM 0 HB2 MET A 124 7.992 7.194 -11.034 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.226 6.207 -9.805 1.00 0.34 H new ATOM 0 HG2 MET A 124 6.942 8.179 -8.743 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.587 7.912 -8.202 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.449 10.698 -11.738 1.00 1.12 H new ATOM 0 HE2 MET A 124 7.377 8.924 -11.870 1.00 1.12 H new ATOM 0 HE3 MET A 124 6.274 9.780 -10.765 1.00 1.12 H new ATOM 2003 N ASN A 125 9.249 3.814 -8.936 1.00 0.34 N ATOM 2004 CA ASN A 125 8.918 2.401 -8.907 1.00 0.37 C ATOM 2005 C ASN A 125 7.616 2.235 -8.149 1.00 0.32 C ATOM 2006 O ASN A 125 7.609 1.989 -6.943 1.00 0.37 O ATOM 2007 CB ASN A 125 10.029 1.590 -8.232 1.00 0.50 C ATOM 2008 CG ASN A 125 11.297 1.501 -9.059 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.635 2.412 -9.815 1.00 1.58 O ATOM 2010 ND2 ASN A 125 12.011 0.396 -8.919 1.00 1.62 N ATOM 0 H ASN A 125 9.652 4.164 -8.067 1.00 0.34 H new ATOM 0 HA ASN A 125 8.814 2.030 -9.927 1.00 0.37 H new ATOM 0 HB2 ASN A 125 10.264 2.041 -7.268 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.663 0.583 -8.032 1.00 0.50 H new ATOM 0 HD21 ASN A 125 12.875 0.277 -9.448 1.00 1.62 H new ATOM 0 HD22 ASN A 125 11.697 -0.337 -8.282 1.00 1.62 H new ATOM 2017 N ILE A 126 6.517 2.405 -8.854 1.00 0.26 N ATOM 2018 CA ILE A 126 5.214 2.479 -8.222 1.00 0.23 C ATOM 2019 C ILE A 126 4.426 1.181 -8.335 1.00 0.27 C ATOM 2020 O ILE A 126 4.446 0.512 -9.371 1.00 0.30 O ATOM 2021 CB ILE A 126 4.367 3.627 -8.828 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.873 3.386 -8.574 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.651 3.785 -10.313 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.952 4.392 -9.227 1.00 0.26 C ATOM 0 H ILE A 126 6.499 2.495 -9.870 1.00 0.26 H new ATOM 0 HA ILE A 126 5.408 2.670 -7.166 1.00 0.23 H new ATOM 0 HB ILE A 126 4.649 4.558 -8.335 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.613 2.390 -8.932 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.695 3.395 -7.499 1.00 0.24 H new ATOM 0 HG21 ILE A 126 4.045 4.597 -10.715 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.707 4.014 -10.459 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.406 2.858 -10.831 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.917 4.143 -8.993 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.179 5.390 -8.852 1.00 0.26 H new ATOM 0 HD13 ILE A 126 2.096 4.369 -10.307 1.00 0.26 H new ATOM 2036 N ILE A 127 3.732 0.834 -7.258 1.00 0.30 N ATOM 2037 CA ILE A 127 2.675 -0.148 -7.339 1.00 0.34 C ATOM 2038 C ILE A 127 1.328 0.565 -7.167 1.00 0.38 C ATOM 2039 O ILE A 127 1.034 1.160 -6.129 1.00 0.45 O ATOM 2040 CB ILE A 127 2.821 -1.313 -6.318 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.486 -0.870 -4.892 1.00 0.42 C ATOM 2042 CG2 ILE A 127 4.237 -1.876 -6.363 1.00 0.50 C ATOM 2043 CD1 ILE A 127 2.103 -2.012 -3.975 1.00 0.59 C ATOM 0 H ILE A 127 3.886 1.219 -6.326 1.00 0.30 H new ATOM 0 HA ILE A 127 2.738 -0.619 -8.320 1.00 0.34 H new ATOM 0 HB ILE A 127 2.108 -2.087 -6.603 1.00 0.41 H new ATOM 0 HG12 ILE A 127 3.346 -0.350 -4.471 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.666 -0.153 -4.927 1.00 0.42 H new ATOM 0 HG21 ILE A 127 4.328 -2.691 -5.644 1.00 0.50 H new ATOM 0 HG22 ILE A 127 4.448 -2.250 -7.365 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.949 -1.090 -6.112 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.879 -1.622 -2.982 1.00 0.59 H new ATOM 0 HD12 ILE A 127 1.223 -2.519 -4.372 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.930 -2.719 -3.909 1.00 0.59 H new ATOM 2055 N SER A 128 0.558 0.591 -8.231 1.00 0.39 N ATOM 2056 CA SER A 128 -0.777 1.152 -8.192 1.00 0.50 C ATOM 2057 C SER A 128 -1.724 0.130 -7.593 1.00 0.55 C ATOM 2058 O SER A 128 -1.445 -1.059 -7.637 1.00 1.00 O ATOM 2059 CB SER A 128 -1.224 1.516 -9.605 1.00 0.68 C ATOM 2060 OG SER A 128 -0.183 2.173 -10.304 1.00 1.18 O ATOM 0 H SER A 128 0.835 0.227 -9.143 1.00 0.39 H new ATOM 0 HA SER A 128 -0.782 2.054 -7.580 1.00 0.50 H new ATOM 0 HB2 SER A 128 -1.518 0.615 -10.143 1.00 0.68 H new ATOM 0 HB3 SER A 128 -2.102 2.160 -9.560 1.00 0.68 H new ATOM 0 HG SER A 128 0.472 1.512 -10.613 1.00 1.18 H new ATOM 2066 N SER A 129 -2.821 0.583 -7.028 1.00 0.30 N ATOM 2067 CA SER A 129 -3.794 -0.328 -6.445 1.00 0.31 C ATOM 2068 C SER A 129 -5.214 0.231 -6.524 1.00 0.31 C ATOM 2069 O SER A 129 -5.472 1.382 -6.185 1.00 0.43 O ATOM 2070 CB SER A 129 -3.425 -0.636 -4.993 1.00 0.40 C ATOM 2071 OG SER A 129 -3.405 0.545 -4.206 1.00 1.24 O ATOM 0 H SER A 129 -3.065 1.571 -6.957 1.00 0.30 H new ATOM 0 HA SER A 129 -3.772 -1.251 -7.025 1.00 0.31 H new ATOM 0 HB2 SER A 129 -4.142 -1.342 -4.575 1.00 0.40 H new ATOM 0 HB3 SER A 129 -2.447 -1.116 -4.958 1.00 0.40 H new ATOM 0 HG SER A 129 -3.503 1.327 -4.788 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.134 -0.591 -6.986 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.530 -0.233 -7.030 1.00 0.32 C ATOM 2079 C LYS A 130 -8.312 -1.381 -6.460 1.00 0.37 C ATOM 2080 O LYS A 130 -8.197 -2.498 -6.954 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.006 -0.005 -8.464 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.100 0.862 -9.315 1.00 0.90 C ATOM 2083 CD LYS A 130 -7.677 1.012 -10.711 1.00 0.80 C ATOM 2084 CE LYS A 130 -8.926 1.877 -10.701 1.00 1.42 C ATOM 2085 NZ LYS A 130 -8.713 3.180 -11.382 1.00 2.26 N ATOM 0 H LYS A 130 -5.931 -1.526 -7.341 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.675 0.689 -6.466 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.117 -0.974 -8.951 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -8.995 0.452 -8.433 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -6.985 1.843 -8.854 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.106 0.418 -9.370 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -6.930 1.455 -11.370 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -7.916 0.029 -11.116 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -9.740 1.342 -11.190 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -9.235 2.054 -9.671 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -9.374 3.885 -10.997 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -7.736 3.499 -11.224 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -8.880 3.070 -12.402 1.00 2.26 H new ATOM 2099 N SER A 131 -9.091 -1.144 -5.436 1.00 0.41 N ATOM 2100 CA SER A 131 -9.917 -2.198 -4.931 1.00 0.44 C ATOM 2101 C SER A 131 -10.991 -2.434 -5.951 1.00 0.41 C ATOM 2102 O SER A 131 -11.920 -1.635 -6.090 1.00 0.47 O ATOM 2103 CB SER A 131 -10.518 -1.852 -3.575 1.00 0.56 C ATOM 2104 OG SER A 131 -11.155 -2.977 -2.995 1.00 1.39 O ATOM 0 H SER A 131 -9.168 -0.251 -4.948 1.00 0.41 H new ATOM 0 HA SER A 131 -9.322 -3.097 -4.772 1.00 0.44 H new ATOM 0 HB2 SER A 131 -9.735 -1.491 -2.909 1.00 0.56 H new ATOM 0 HB3 SER A 131 -11.238 -1.042 -3.689 1.00 0.56 H new ATOM 0 HG SER A 131 -10.730 -3.188 -2.138 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.861 -3.509 -6.689 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.773 -3.737 -7.761 1.00 0.36 C ATOM 2112 C VAL A 132 -12.781 -4.771 -7.365 1.00 0.37 C ATOM 2113 O VAL A 132 -12.519 -5.650 -6.544 1.00 0.46 O ATOM 2114 CB VAL A 132 -11.117 -4.187 -9.072 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.414 -3.040 -9.759 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.167 -5.322 -8.830 1.00 1.05 C ATOM 0 H VAL A 132 -10.143 -4.223 -6.564 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.236 -2.769 -7.951 1.00 0.36 H new ATOM 0 HB VAL A 132 -11.909 -4.536 -9.735 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -9.960 -3.394 -10.685 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -11.135 -2.254 -9.985 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -9.639 -2.643 -9.103 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -9.714 -5.625 -9.774 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -9.387 -5.003 -8.139 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -10.709 -6.165 -8.401 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.924 -4.663 -7.972 1.00 0.39 N ATOM 2127 CA ASP A 133 -15.075 -5.404 -7.561 1.00 0.43 C ATOM 2128 C ASP A 133 -15.382 -6.483 -8.577 1.00 0.43 C ATOM 2129 O ASP A 133 -16.481 -6.604 -9.122 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.187 -4.399 -7.352 1.00 0.54 C ATOM 2131 CG ASP A 133 -16.736 -3.802 -8.636 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -15.944 -3.263 -9.441 1.00 2.17 O ATOM 2133 OD2 ASP A 133 -17.966 -3.860 -8.844 1.00 1.39 O ATOM 0 H ASP A 133 -14.084 -4.052 -8.773 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.924 -5.940 -6.624 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -17.001 -4.882 -6.812 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -15.818 -3.593 -6.718 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.360 -7.282 -8.794 1.00 0.35 N ATOM 2139 CA PHE A 134 -14.369 -8.334 -9.795 1.00 0.40 C ATOM 2140 C PHE A 134 -14.860 -9.654 -9.140 1.00 0.46 C ATOM 2141 O PHE A 134 -15.131 -9.659 -7.941 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.938 -8.448 -10.357 1.00 0.39 C ATOM 2143 CG PHE A 134 -12.060 -9.300 -9.504 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.910 -9.018 -8.162 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -11.434 -10.415 -10.026 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -11.166 -9.827 -7.356 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -10.669 -11.224 -9.218 1.00 0.53 C ATOM 2148 CZ PHE A 134 -10.547 -10.923 -7.878 1.00 0.45 C ATOM 0 H PHE A 134 -13.485 -7.221 -8.274 1.00 0.35 H new ATOM 0 HA PHE A 134 -15.050 -8.114 -10.617 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.978 -8.865 -11.363 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.503 -7.452 -10.441 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.389 -8.144 -7.744 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -11.546 -10.653 -11.074 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -11.067 -9.600 -6.305 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -10.168 -12.088 -9.630 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.956 -11.561 -7.237 1.00 0.45 H new ATOM 2158 N PRO A 135 -14.983 -10.775 -9.901 1.00 0.61 N ATOM 2159 CA PRO A 135 -15.513 -12.072 -9.413 1.00 0.75 C ATOM 2160 C PRO A 135 -15.250 -12.436 -7.932 1.00 0.92 C ATOM 2161 O PRO A 135 -16.198 -12.726 -7.200 1.00 1.13 O ATOM 2162 CB PRO A 135 -14.802 -13.053 -10.330 1.00 1.28 C ATOM 2163 CG PRO A 135 -14.768 -12.355 -11.644 1.00 1.19 C ATOM 2164 CD PRO A 135 -14.653 -10.880 -11.342 1.00 0.76 C ATOM 0 HA PRO A 135 -16.603 -12.065 -9.440 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -13.798 -13.279 -9.972 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -15.338 -14.000 -10.394 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -13.923 -12.696 -12.243 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -15.671 -12.564 -12.218 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -13.649 -10.509 -11.548 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -15.341 -10.294 -11.951 1.00 0.76 H new ATOM 2172 N GLU A 136 -13.988 -12.461 -7.497 1.00 1.10 N ATOM 2173 CA GLU A 136 -13.646 -12.915 -6.149 1.00 1.59 C ATOM 2174 C GLU A 136 -14.018 -11.886 -5.074 1.00 1.68 C ATOM 2175 O GLU A 136 -14.324 -12.240 -3.937 1.00 2.17 O ATOM 2176 CB GLU A 136 -12.156 -13.190 -6.098 1.00 1.78 C ATOM 2177 CG GLU A 136 -11.664 -13.688 -4.762 1.00 2.38 C ATOM 2178 CD GLU A 136 -12.119 -15.097 -4.447 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -11.561 -16.056 -5.022 1.00 3.50 O ATOM 2180 OE2 GLU A 136 -13.049 -15.255 -3.632 1.00 3.30 O ATOM 0 H GLU A 136 -13.187 -12.172 -8.059 1.00 1.10 H new ATOM 0 HA GLU A 136 -14.218 -13.818 -5.938 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.908 -13.927 -6.862 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -11.620 -12.275 -6.352 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -10.575 -13.653 -4.747 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -12.015 -13.016 -3.979 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.988 -10.620 -5.462 1.00 1.38 N ATOM 2188 CA TYR A 137 -14.179 -9.485 -4.550 1.00 1.79 C ATOM 2189 C TYR A 137 -15.368 -9.598 -3.559 1.00 1.42 C ATOM 2190 O TYR A 137 -15.205 -9.192 -2.413 1.00 1.58 O ATOM 2191 CB TYR A 137 -14.265 -8.195 -5.366 1.00 2.49 C ATOM 2192 CG TYR A 137 -14.900 -7.021 -4.642 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -14.130 -6.147 -3.879 1.00 4.47 C ATOM 2194 CD2 TYR A 137 -16.269 -6.792 -4.712 1.00 3.49 C ATOM 2195 CE1 TYR A 137 -14.705 -5.082 -3.213 1.00 5.35 C ATOM 2196 CE2 TYR A 137 -16.850 -5.727 -4.050 1.00 4.37 C ATOM 2197 CZ TYR A 137 -16.064 -4.860 -3.328 1.00 5.22 C ATOM 2198 OH TYR A 137 -16.641 -3.817 -2.635 1.00 6.12 O ATOM 0 H TYR A 137 -13.829 -10.341 -6.430 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.305 -9.483 -3.898 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -13.259 -7.911 -5.676 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -14.834 -8.394 -6.274 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -13.064 -6.305 -3.807 1.00 4.47 H new ATOM 0 HD2 TYR A 137 -16.889 -7.458 -5.294 1.00 3.49 H new ATOM 0 HE1 TYR A 137 -14.097 -4.427 -2.607 1.00 5.35 H new ATOM 0 HE2 TYR A 137 -17.918 -5.576 -4.100 1.00 4.37 H new ATOM 0 HH TYR A 137 -16.091 -3.012 -2.738 1.00 6.12 H new ATOM 2208 N PRO A 138 -16.574 -10.079 -3.960 1.00 1.33 N ATOM 2209 CA PRO A 138 -17.699 -10.271 -3.020 1.00 1.10 C ATOM 2210 C PRO A 138 -17.269 -10.891 -1.681 1.00 0.99 C ATOM 2211 O PRO A 138 -16.934 -12.073 -1.616 1.00 0.99 O ATOM 2212 CB PRO A 138 -18.611 -11.226 -3.783 1.00 0.97 C ATOM 2213 CG PRO A 138 -18.403 -10.871 -5.214 1.00 1.56 C ATOM 2214 CD PRO A 138 -16.964 -10.432 -5.340 1.00 1.77 C ATOM 0 HA PRO A 138 -18.164 -9.325 -2.742 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -18.349 -12.266 -3.589 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -19.653 -11.100 -3.490 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -18.606 -11.725 -5.859 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -19.080 -10.073 -5.519 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -16.337 -11.229 -5.740 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -16.864 -9.580 -6.013 1.00 1.77 H new ATOM 2222 N PRO A 139 -17.248 -10.089 -0.598 1.00 0.96 N ATOM 2223 CA PRO A 139 -16.755 -10.512 0.710 1.00 0.91 C ATOM 2224 C PRO A 139 -17.863 -10.971 1.660 1.00 1.00 C ATOM 2225 O PRO A 139 -18.966 -11.319 1.230 1.00 1.25 O ATOM 2226 CB PRO A 139 -16.117 -9.223 1.220 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.941 -8.116 0.634 1.00 0.89 C ATOM 2228 CD PRO A 139 -17.685 -8.686 -0.557 1.00 1.06 C ATOM 0 HA PRO A 139 -16.090 -11.374 0.649 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -16.124 -9.185 2.309 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -15.076 -9.148 0.905 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.641 -7.726 1.373 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.305 -7.285 0.328 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -18.765 -8.606 -0.431 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -17.431 -8.160 -1.477 1.00 1.06 H new ATOM 2236 N SER A 140 -17.556 -10.960 2.955 1.00 0.90 N ATOM 2237 CA SER A 140 -18.483 -11.382 3.989 1.00 1.01 C ATOM 2238 C SER A 140 -18.279 -10.494 5.210 1.00 1.01 C ATOM 2239 O SER A 140 -17.690 -9.423 5.092 1.00 1.13 O ATOM 2240 CB SER A 140 -18.249 -12.854 4.346 1.00 1.09 C ATOM 2241 OG SER A 140 -18.349 -13.683 3.199 1.00 1.60 O ATOM 0 H SER A 140 -16.651 -10.655 3.313 1.00 0.90 H new ATOM 0 HA SER A 140 -19.508 -11.286 3.632 1.00 1.01 H new ATOM 0 HB2 SER A 140 -17.263 -12.969 4.796 1.00 1.09 H new ATOM 0 HB3 SER A 140 -18.979 -13.170 5.091 1.00 1.09 H new ATOM 0 HG SER A 140 -18.194 -14.616 3.455 1.00 1.60 H new ATOM 2247 N SER A 141 -18.740 -10.915 6.373 1.00 1.07 N ATOM 2248 CA SER A 141 -18.584 -10.093 7.559 1.00 1.19 C ATOM 2249 C SER A 141 -17.198 -10.283 8.176 1.00 1.07 C ATOM 2250 O SER A 141 -16.509 -9.310 8.490 1.00 1.22 O ATOM 2251 CB SER A 141 -19.670 -10.423 8.581 1.00 1.47 C ATOM 2252 OG SER A 141 -20.959 -10.377 7.988 1.00 1.97 O ATOM 0 H SER A 141 -19.217 -11.804 6.522 1.00 1.07 H new ATOM 0 HA SER A 141 -18.685 -9.048 7.265 1.00 1.19 H new ATOM 0 HB2 SER A 141 -19.493 -11.415 8.998 1.00 1.47 H new ATOM 0 HB3 SER A 141 -19.622 -9.716 9.409 1.00 1.47 H new ATOM 0 HG SER A 141 -21.637 -10.593 8.662 1.00 1.97 H new ATOM 2258 N ASN A 142 -16.786 -11.538 8.324 1.00 0.97 N ATOM 2259 CA ASN A 142 -15.491 -11.867 8.922 1.00 0.95 C ATOM 2260 C ASN A 142 -14.342 -11.373 8.056 1.00 0.86 C ATOM 2261 O ASN A 142 -13.229 -11.166 8.540 1.00 1.07 O ATOM 2262 CB ASN A 142 -15.363 -13.376 9.133 1.00 1.01 C ATOM 2263 CG ASN A 142 -16.161 -13.868 10.322 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -17.176 -13.280 10.698 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -15.711 -14.957 10.920 1.00 1.73 N ATOM 0 H ASN A 142 -17.332 -12.350 8.037 1.00 0.97 H new ATOM 0 HA ASN A 142 -15.439 -11.364 9.888 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -15.699 -13.894 8.235 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -14.313 -13.631 9.274 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -16.209 -15.340 11.724 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -14.866 -15.415 10.578 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.618 -11.194 6.777 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.638 -10.670 5.846 1.00 0.67 C ATOM 2274 C TYR A 143 -14.265 -9.572 5.026 1.00 0.61 C ATOM 2275 O TYR A 143 -15.096 -9.842 4.156 1.00 0.67 O ATOM 2276 CB TYR A 143 -13.126 -11.779 4.922 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.436 -12.905 5.655 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.125 -12.773 6.093 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -13.092 -14.105 5.894 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -10.487 -13.807 6.748 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -12.462 -15.142 6.553 1.00 1.09 C ATOM 2282 CZ TYR A 143 -11.174 -14.960 7.030 1.00 1.09 C ATOM 2283 OH TYR A 143 -10.526 -16.022 7.620 1.00 1.23 O ATOM 0 H TYR A 143 -15.523 -11.407 6.357 1.00 0.71 H new ATOM 0 HA TYR A 143 -12.794 -10.272 6.409 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.964 -12.185 4.356 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.433 -11.348 4.200 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.597 -11.847 5.919 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -14.111 -14.229 5.559 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.451 -13.708 7.037 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -12.968 -16.085 6.695 1.00 1.09 H new ATOM 0 HH TYR A 143 -11.158 -16.759 7.752 1.00 1.23 H new ATOM 2293 N ILE A 144 -13.874 -8.335 5.286 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.399 -7.237 4.518 1.00 0.53 C ATOM 2295 C ILE A 144 -13.350 -6.778 3.536 1.00 0.46 C ATOM 2296 O ILE A 144 -12.261 -6.374 3.921 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.888 -6.046 5.391 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.806 -4.732 4.602 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -14.112 -5.945 6.693 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -15.764 -4.668 3.428 1.00 0.82 C ATOM 0 H ILE A 144 -13.206 -8.076 6.012 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.282 -7.600 3.992 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.930 -6.232 5.650 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -15.013 -3.900 5.275 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -13.788 -4.600 4.237 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -14.484 -5.101 7.274 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -14.240 -6.864 7.265 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -13.054 -5.798 6.476 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -15.650 -3.712 2.917 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -15.543 -5.479 2.734 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -16.788 -4.768 3.788 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.667 -6.915 2.268 1.00 0.43 N ATOM 2313 CA ARG A 145 -12.833 -6.371 1.215 1.00 0.41 C ATOM 2314 C ARG A 145 -12.711 -4.860 1.385 1.00 0.45 C ATOM 2315 O ARG A 145 -13.613 -4.112 1.010 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.427 -6.701 -0.156 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.487 -7.494 -1.042 1.00 0.81 C ATOM 2318 CD ARG A 145 -12.222 -8.882 -0.472 1.00 2.08 C ATOM 2319 NE ARG A 145 -13.297 -9.825 -0.778 1.00 2.70 N ATOM 2320 CZ ARG A 145 -13.185 -11.150 -0.671 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -12.051 -11.693 -0.267 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -14.208 -11.935 -0.978 1.00 4.42 N ATOM 0 H ARG A 145 -14.501 -7.401 1.938 1.00 0.43 H new ATOM 0 HA ARG A 145 -11.842 -6.819 1.280 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.349 -7.266 -0.018 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -13.695 -5.773 -0.661 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -12.916 -7.585 -2.040 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -11.545 -6.957 -1.148 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -11.283 -9.263 -0.873 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -12.101 -8.811 0.609 1.00 2.08 H new ATOM 0 HE ARG A 145 -14.190 -9.445 -1.093 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -11.255 -11.099 -0.035 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -11.971 -12.707 -0.187 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -15.086 -11.527 -1.298 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -14.117 -12.947 -0.894 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.604 -4.429 1.980 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.372 -3.017 2.199 1.00 0.79 C ATOM 2338 C GLY A 146 -11.359 -2.262 0.898 1.00 0.57 C ATOM 2339 O GLY A 146 -10.467 -2.456 0.075 1.00 0.62 O ATOM 0 H GLY A 146 -10.859 -5.039 2.316 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -12.149 -2.614 2.849 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.421 -2.877 2.714 1.00 0.79 H new ATOM 2343 N TYR A 147 -12.333 -1.390 0.711 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.536 -0.792 -0.594 1.00 0.56 C ATOM 2345 C TYR A 147 -11.643 0.416 -0.787 1.00 0.54 C ATOM 2346 O TYR A 147 -12.011 1.549 -0.488 1.00 0.67 O ATOM 2347 CB TYR A 147 -14.002 -0.429 -0.823 1.00 0.86 C ATOM 2348 CG TYR A 147 -14.296 -0.111 -2.269 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.446 -1.121 -3.210 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -14.447 1.206 -2.688 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -14.738 -0.829 -4.527 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -14.735 1.506 -4.005 1.00 3.13 C ATOM 2353 CZ TYR A 147 -14.790 0.464 -4.943 1.00 3.51 C ATOM 2354 OH TYR A 147 -15.174 0.778 -6.233 1.00 4.44 O ATOM 0 H TYR A 147 -12.985 -1.085 1.433 1.00 0.58 H new ATOM 0 HA TYR A 147 -12.260 -1.538 -1.340 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -14.633 -1.257 -0.500 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -14.262 0.430 -0.205 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.332 -2.151 -2.907 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -14.337 2.007 -1.972 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -14.925 -1.629 -5.228 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -14.915 2.527 -4.308 1.00 3.13 H new ATOM 0 HH TYR A 147 -15.154 1.750 -6.353 1.00 4.44 H new ATOM 2364 N ASN A 148 -10.454 0.146 -1.283 1.00 0.46 N ATOM 2365 CA ASN A 148 -9.482 1.179 -1.563 1.00 0.47 C ATOM 2366 C ASN A 148 -9.727 1.795 -2.935 1.00 0.45 C ATOM 2367 O ASN A 148 -9.765 1.095 -3.944 1.00 0.58 O ATOM 2368 CB ASN A 148 -8.069 0.606 -1.502 1.00 0.49 C ATOM 2369 CG ASN A 148 -7.027 1.696 -1.475 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -7.276 2.779 -0.950 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -5.858 1.426 -2.037 1.00 1.62 N ATOM 0 H ASN A 148 -10.135 -0.797 -1.503 1.00 0.46 H new ATOM 0 HA ASN A 148 -9.587 1.957 -0.807 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.967 -0.017 -0.614 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -7.900 -0.038 -2.365 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -5.121 2.131 -2.045 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -5.695 0.513 -2.461 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.898 3.105 -2.962 1.00 0.43 N ATOM 2379 CA HIS A 149 -10.066 3.831 -4.214 1.00 0.45 C ATOM 2380 C HIS A 149 -8.732 3.941 -4.930 1.00 0.40 C ATOM 2381 O HIS A 149 -7.702 3.715 -4.306 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.657 5.215 -3.949 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.124 5.185 -3.644 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -12.625 5.252 -2.363 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -13.201 5.081 -4.459 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -13.943 5.186 -2.402 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -14.318 5.082 -3.661 1.00 2.32 N ATOM 0 H HIS A 149 -9.925 3.692 -2.128 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.758 3.284 -4.854 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.129 5.674 -3.113 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.487 5.848 -4.820 1.00 0.60 H new ATOM 0 HD1 HIS A 149 -12.065 5.339 -1.515 1.00 1.67 H new ATOM 0 HD2 HIS A 149 -13.184 5.010 -5.537 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -14.602 5.213 -1.547 1.00 2.14 H new ATOM 2396 N PRO A 150 -8.751 4.235 -6.254 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.547 4.338 -7.107 1.00 0.32 C ATOM 2398 C PRO A 150 -6.424 5.187 -6.522 1.00 0.36 C ATOM 2399 O PRO A 150 -6.201 6.330 -6.932 1.00 0.47 O ATOM 2400 CB PRO A 150 -8.053 5.012 -8.383 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.460 5.425 -8.099 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.957 4.474 -7.054 1.00 0.46 C ATOM 0 HA PRO A 150 -7.111 3.348 -7.241 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.437 5.874 -8.640 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -8.011 4.327 -9.230 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.502 6.455 -7.744 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -10.073 5.373 -8.999 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.761 4.907 -6.459 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -10.344 3.554 -7.492 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.733 4.618 -5.573 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.534 5.202 -5.023 1.00 0.48 C ATOM 2412 C CYS A 151 -3.441 4.146 -5.036 1.00 0.43 C ATOM 2413 O CYS A 151 -3.632 3.071 -5.593 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.797 5.727 -3.616 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.518 4.515 -2.498 1.00 1.58 S ATOM 0 H CYS A 151 -5.987 3.724 -5.152 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.213 6.053 -5.624 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.858 6.082 -3.192 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.464 6.587 -3.680 1.00 0.84 H new ATOM 0 HG CYS A 151 -6.557 3.971 -3.059 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.293 4.434 -4.467 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.209 3.501 -4.598 1.00 0.39 C ATOM 2423 C GLY A 152 -0.059 3.790 -3.679 1.00 0.36 C ATOM 2424 O GLY A 152 -0.227 4.358 -2.599 1.00 0.43 O ATOM 0 H GLY A 152 -2.093 5.277 -3.928 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.579 2.495 -4.399 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.853 3.512 -5.628 1.00 0.39 H new ATOM 2428 N PHE A 153 1.115 3.472 -4.168 1.00 0.32 N ATOM 2429 CA PHE A 153 2.289 3.320 -3.336 1.00 0.31 C ATOM 2430 C PHE A 153 3.504 3.427 -4.229 1.00 0.30 C ATOM 2431 O PHE A 153 3.916 2.452 -4.858 1.00 0.38 O ATOM 2432 CB PHE A 153 2.235 1.949 -2.640 1.00 0.36 C ATOM 2433 CG PHE A 153 3.337 1.674 -1.651 1.00 0.38 C ATOM 2434 CD1 PHE A 153 4.581 1.232 -2.077 1.00 0.49 C ATOM 2435 CD2 PHE A 153 3.116 1.821 -0.294 1.00 0.54 C ATOM 2436 CE1 PHE A 153 5.581 0.949 -1.166 1.00 0.55 C ATOM 2437 CE2 PHE A 153 4.112 1.543 0.622 1.00 0.60 C ATOM 2438 CZ PHE A 153 5.345 1.104 0.185 1.00 0.52 C ATOM 0 H PHE A 153 1.286 3.310 -5.160 1.00 0.32 H new ATOM 0 HA PHE A 153 2.335 4.091 -2.567 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.279 1.862 -2.124 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.257 1.173 -3.405 1.00 0.36 H new ATOM 0 HD1 PHE A 153 4.770 1.108 -3.133 1.00 0.49 H new ATOM 0 HD2 PHE A 153 2.151 2.158 0.055 1.00 0.54 H new ATOM 0 HE1 PHE A 153 6.546 0.607 -1.511 1.00 0.55 H new ATOM 0 HE2 PHE A 153 3.926 1.669 1.678 1.00 0.60 H new ATOM 0 HZ PHE A 153 6.124 0.882 0.899 1.00 0.52 H new ATOM 2448 N VAL A 154 4.052 4.616 -4.326 1.00 0.25 N ATOM 2449 CA VAL A 154 5.121 4.843 -5.259 1.00 0.25 C ATOM 2450 C VAL A 154 6.456 4.957 -4.550 1.00 0.24 C ATOM 2451 O VAL A 154 6.549 5.389 -3.401 1.00 0.31 O ATOM 2452 CB VAL A 154 4.903 6.097 -6.132 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.498 6.167 -6.687 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.235 7.365 -5.380 1.00 0.26 C ATOM 0 H VAL A 154 3.777 5.430 -3.776 1.00 0.25 H new ATOM 0 HA VAL A 154 5.126 3.973 -5.916 1.00 0.25 H new ATOM 0 HB VAL A 154 5.590 6.009 -6.974 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.391 7.066 -7.295 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.306 5.288 -7.302 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.783 6.198 -5.865 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.069 8.226 -6.027 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.596 7.444 -4.500 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.279 7.341 -5.069 1.00 0.26 H new ATOM 2464 N CYS A 155 7.483 4.538 -5.240 1.00 0.21 N ATOM 2465 CA CYS A 155 8.830 4.700 -4.765 1.00 0.23 C ATOM 2466 C CYS A 155 9.580 5.589 -5.734 1.00 0.27 C ATOM 2467 O CYS A 155 9.424 5.461 -6.939 1.00 0.42 O ATOM 2468 CB CYS A 155 9.508 3.345 -4.645 1.00 0.27 C ATOM 2469 SG CYS A 155 11.286 3.436 -4.368 1.00 1.55 S ATOM 0 H CYS A 155 7.409 4.075 -6.146 1.00 0.21 H new ATOM 0 HA CYS A 155 8.825 5.162 -3.778 1.00 0.23 H new ATOM 0 HB2 CYS A 155 9.051 2.793 -3.824 1.00 0.27 H new ATOM 0 HB3 CYS A 155 9.321 2.775 -5.555 1.00 0.27 H new ATOM 0 HG CYS A 155 11.531 4.256 -3.389 1.00 1.55 H new ATOM 2475 N SER A 156 10.365 6.504 -5.221 1.00 0.25 N ATOM 2476 CA SER A 156 11.070 7.435 -6.084 1.00 0.29 C ATOM 2477 C SER A 156 12.552 7.485 -5.739 1.00 0.30 C ATOM 2478 O SER A 156 12.924 7.846 -4.627 1.00 0.29 O ATOM 2479 CB SER A 156 10.443 8.825 -5.973 1.00 0.32 C ATOM 2480 OG SER A 156 9.033 8.758 -6.123 1.00 1.06 O ATOM 0 H SER A 156 10.534 6.628 -4.223 1.00 0.25 H new ATOM 0 HA SER A 156 10.980 7.088 -7.114 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.689 9.263 -5.006 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.863 9.480 -6.736 1.00 0.32 H new ATOM 0 HG SER A 156 8.604 8.931 -5.259 1.00 1.06 H new ATOM 2486 N PRO A 157 13.414 7.078 -6.681 1.00 0.36 N ATOM 2487 CA PRO A 157 14.864 7.210 -6.530 1.00 0.39 C ATOM 2488 C PRO A 157 15.254 8.628 -6.110 1.00 0.40 C ATOM 2489 O PRO A 157 14.923 9.596 -6.796 1.00 0.49 O ATOM 2490 CB PRO A 157 15.395 6.905 -7.931 1.00 0.51 C ATOM 2491 CG PRO A 157 14.358 6.043 -8.567 1.00 0.56 C ATOM 2492 CD PRO A 157 13.039 6.426 -7.950 1.00 0.45 C ATOM 0 HA PRO A 157 15.265 6.551 -5.760 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.548 7.821 -8.501 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.357 6.394 -7.884 1.00 0.51 H new ATOM 0 HG2 PRO A 157 14.339 6.193 -9.646 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.573 4.988 -8.396 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.478 7.102 -8.595 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.410 5.553 -7.779 1.00 0.45 H new ATOM 2500 N MET A 158 15.944 8.748 -4.980 1.00 0.37 N ATOM 2501 CA MET A 158 16.290 10.059 -4.442 1.00 0.43 C ATOM 2502 C MET A 158 17.496 10.655 -5.130 1.00 0.48 C ATOM 2503 O MET A 158 17.946 10.161 -6.162 1.00 0.49 O ATOM 2504 CB MET A 158 16.593 9.987 -2.952 1.00 0.43 C ATOM 2505 CG MET A 158 15.468 10.490 -2.077 1.00 0.50 C ATOM 2506 SD MET A 158 15.004 12.187 -2.473 1.00 0.95 S ATOM 2507 CE MET A 158 13.797 12.522 -1.194 1.00 1.16 C ATOM 0 H MET A 158 16.273 7.960 -4.423 1.00 0.37 H new ATOM 0 HA MET A 158 15.420 10.691 -4.619 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.815 8.954 -2.685 1.00 0.43 H new ATOM 0 HB3 MET A 158 17.491 10.569 -2.744 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.600 9.841 -2.195 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.770 10.432 -1.031 1.00 0.50 H new ATOM 0 HE1 MET A 158 12.929 13.014 -1.633 1.00 1.16 H new ATOM 0 HE2 MET A 158 13.487 11.585 -0.732 1.00 1.16 H new ATOM 0 HE3 MET A 158 14.239 13.171 -0.438 1.00 1.16 H new ATOM 2517 N GLU A 159 18.032 11.707 -4.533 1.00 0.57 N ATOM 2518 CA GLU A 159 19.238 12.329 -5.035 1.00 0.62 C ATOM 2519 C GLU A 159 20.415 11.374 -4.850 1.00 0.54 C ATOM 2520 O GLU A 159 21.388 11.401 -5.602 1.00 0.59 O ATOM 2521 CB GLU A 159 19.501 13.643 -4.298 1.00 0.76 C ATOM 2522 CG GLU A 159 18.287 14.559 -4.214 1.00 1.38 C ATOM 2523 CD GLU A 159 17.915 15.189 -5.540 1.00 1.87 C ATOM 2524 OE1 GLU A 159 17.323 14.496 -6.393 1.00 2.09 O ATOM 2525 OE2 GLU A 159 18.191 16.394 -5.723 1.00 2.63 O ATOM 0 H GLU A 159 17.646 12.147 -3.697 1.00 0.57 H new ATOM 0 HA GLU A 159 19.116 12.548 -6.096 1.00 0.62 H new ATOM 0 HB2 GLU A 159 19.845 13.419 -3.288 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.310 14.174 -4.800 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.437 13.989 -3.840 1.00 1.38 H new ATOM 0 HG3 GLU A 159 18.486 15.348 -3.489 1.00 1.38 H new ATOM 2532 N GLU A 160 20.287 10.503 -3.855 1.00 0.52 N ATOM 2533 CA GLU A 160 21.313 9.518 -3.541 1.00 0.55 C ATOM 2534 C GLU A 160 20.957 8.183 -4.172 1.00 0.58 C ATOM 2535 O GLU A 160 21.529 7.159 -3.826 1.00 0.76 O ATOM 2536 CB GLU A 160 21.451 9.356 -2.027 1.00 0.63 C ATOM 2537 CG GLU A 160 21.904 10.614 -1.308 1.00 0.77 C ATOM 2538 CD GLU A 160 23.323 11.001 -1.660 1.00 1.32 C ATOM 2539 OE1 GLU A 160 24.260 10.331 -1.186 1.00 1.61 O ATOM 2540 OE2 GLU A 160 23.508 11.979 -2.408 1.00 2.05 O ATOM 0 H GLU A 160 19.470 10.461 -3.245 1.00 0.52 H new ATOM 0 HA GLU A 160 22.265 9.864 -3.944 1.00 0.55 H new ATOM 0 HB2 GLU A 160 20.491 9.042 -1.617 1.00 0.63 H new ATOM 0 HB3 GLU A 160 22.163 8.556 -1.821 1.00 0.63 H new ATOM 0 HG2 GLU A 160 21.233 11.435 -1.561 1.00 0.77 H new ATOM 0 HG3 GLU A 160 21.829 10.461 -0.231 1.00 0.77 H new ATOM 2547 N ASN A 161 19.990 8.248 -5.086 1.00 0.51 N ATOM 2548 CA ASN A 161 19.418 7.105 -5.813 1.00 0.65 C ATOM 2549 C ASN A 161 19.518 5.743 -5.084 1.00 0.53 C ATOM 2550 O ASN A 161 18.588 5.397 -4.360 1.00 0.53 O ATOM 2551 CB ASN A 161 19.939 7.042 -7.261 1.00 0.92 C ATOM 2552 CG ASN A 161 19.384 8.140 -8.148 1.00 1.07 C ATOM 2553 OD1 ASN A 161 18.333 7.825 -8.891 1.00 1.93 O flip ATOM 2554 ND2 ASN A 161 19.914 9.250 -8.192 1.00 1.62 N flip ATOM 0 H ASN A 161 19.562 9.134 -5.355 1.00 0.51 H new ATOM 0 HA ASN A 161 18.346 7.299 -5.847 1.00 0.65 H new ATOM 0 HB2 ASN A 161 21.027 7.108 -7.251 1.00 0.92 H new ATOM 0 HB3 ASN A 161 19.682 6.074 -7.690 1.00 0.92 H new ATOM 0 HD21 ASN A 161 20.722 9.453 -7.604 1.00 1.62 H new ATOM 0 HD22 ASN A 161 19.545 9.967 -8.817 1.00 1.62 H new ATOM 2561 N PRO A 162 20.602 4.927 -5.238 1.00 0.55 N ATOM 2562 CA PRO A 162 20.636 3.590 -4.638 1.00 0.57 C ATOM 2563 C PRO A 162 20.852 3.607 -3.125 1.00 0.55 C ATOM 2564 O PRO A 162 20.730 2.579 -2.460 1.00 0.63 O ATOM 2565 CB PRO A 162 21.826 2.922 -5.325 1.00 0.71 C ATOM 2566 CG PRO A 162 22.742 4.048 -5.627 1.00 0.73 C ATOM 2567 CD PRO A 162 21.846 5.193 -5.997 1.00 0.67 C ATOM 0 HA PRO A 162 19.685 3.075 -4.777 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.299 2.185 -4.676 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.522 2.400 -6.232 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.361 4.295 -4.764 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.419 3.797 -6.444 1.00 0.73 H new ATOM 0 HD2 PRO A 162 22.286 6.151 -5.721 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.661 5.225 -7.071 1.00 0.67 H new ATOM 2575 N ALA A 163 21.191 4.769 -2.589 1.00 0.53 N ATOM 2576 CA ALA A 163 21.480 4.891 -1.169 1.00 0.59 C ATOM 2577 C ALA A 163 20.261 5.365 -0.388 1.00 0.53 C ATOM 2578 O ALA A 163 20.058 4.964 0.759 1.00 0.58 O ATOM 2579 CB ALA A 163 22.658 5.825 -0.947 1.00 0.68 C ATOM 0 H ALA A 163 21.273 5.639 -3.115 1.00 0.53 H new ATOM 0 HA ALA A 163 21.743 3.901 -0.796 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.862 5.906 0.121 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.537 5.429 -1.455 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.421 6.811 -1.347 1.00 0.68 H new ATOM 2585 N TYR A 164 19.451 6.221 -0.999 1.00 0.45 N ATOM 2586 CA TYR A 164 18.244 6.705 -0.344 1.00 0.40 C ATOM 2587 C TYR A 164 17.089 6.702 -1.321 1.00 0.32 C ATOM 2588 O TYR A 164 17.238 7.125 -2.467 1.00 0.38 O ATOM 2589 CB TYR A 164 18.447 8.112 0.230 1.00 0.46 C ATOM 2590 CG TYR A 164 19.351 8.153 1.442 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.851 7.932 2.718 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.708 8.416 1.309 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.674 7.972 3.825 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.539 8.458 2.410 1.00 0.78 C ATOM 2595 CZ TYR A 164 21.009 8.220 3.673 1.00 0.79 C ATOM 2596 OH TYR A 164 21.841 8.279 4.768 1.00 0.93 O ATOM 0 H TYR A 164 19.606 6.591 -1.937 1.00 0.45 H new ATOM 0 HA TYR A 164 18.017 6.035 0.485 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.865 8.754 -0.545 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.476 8.528 0.498 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.799 7.725 2.847 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.120 8.591 0.326 1.00 0.67 H new ATOM 0 HE1 TYR A 164 19.263 7.807 4.810 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.591 8.674 2.292 1.00 0.78 H new ATOM 0 HH TYR A 164 22.757 8.463 4.473 1.00 0.93 H new ATOM 2606 N SER A 165 15.941 6.222 -0.877 1.00 0.26 N ATOM 2607 CA SER A 165 14.793 6.127 -1.749 1.00 0.24 C ATOM 2608 C SER A 165 13.582 6.821 -1.156 1.00 0.23 C ATOM 2609 O SER A 165 13.356 6.792 0.052 1.00 0.26 O ATOM 2610 CB SER A 165 14.475 4.670 -2.019 1.00 0.30 C ATOM 2611 OG SER A 165 15.561 4.031 -2.648 1.00 1.41 O ATOM 0 H SER A 165 15.783 5.895 0.076 1.00 0.26 H new ATOM 0 HA SER A 165 15.038 6.629 -2.685 1.00 0.24 H new ATOM 0 HB2 SER A 165 14.242 4.164 -1.082 1.00 0.30 H new ATOM 0 HB3 SER A 165 13.589 4.597 -2.650 1.00 0.30 H new ATOM 0 HG SER A 165 16.261 3.848 -1.987 1.00 1.41 H new ATOM 2617 N LYS A 166 12.804 7.437 -2.022 1.00 0.24 N ATOM 2618 CA LYS A 166 11.616 8.144 -1.610 1.00 0.26 C ATOM 2619 C LYS A 166 10.400 7.228 -1.655 1.00 0.28 C ATOM 2620 O LYS A 166 9.921 6.847 -2.714 1.00 0.43 O ATOM 2621 CB LYS A 166 11.422 9.389 -2.489 1.00 0.36 C ATOM 2622 CG LYS A 166 9.996 9.919 -2.537 1.00 0.32 C ATOM 2623 CD LYS A 166 9.453 10.224 -1.158 1.00 0.37 C ATOM 2624 CE LYS A 166 10.163 11.404 -0.520 1.00 0.47 C ATOM 2625 NZ LYS A 166 9.892 12.677 -1.243 1.00 0.74 N ATOM 0 H LYS A 166 12.979 7.460 -3.027 1.00 0.24 H new ATOM 0 HA LYS A 166 11.734 8.471 -0.577 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.077 10.180 -2.124 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.742 9.154 -3.504 1.00 0.36 H new ATOM 0 HG2 LYS A 166 9.966 10.823 -3.145 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.354 9.186 -3.024 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.386 10.436 -1.226 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.564 9.346 -0.522 1.00 0.37 H new ATOM 0 HE2 LYS A 166 9.843 11.501 0.517 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.237 11.217 -0.506 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 10.297 13.472 -0.709 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 10.325 12.638 -2.188 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 8.865 12.811 -1.338 1.00 0.74 H new ATOM 2639 N LEU A 167 9.933 6.863 -0.487 1.00 0.20 N ATOM 2640 CA LEU A 167 8.728 6.080 -0.340 1.00 0.21 C ATOM 2641 C LEU A 167 7.540 7.015 -0.145 1.00 0.20 C ATOM 2642 O LEU A 167 7.398 7.631 0.911 1.00 0.24 O ATOM 2643 CB LEU A 167 8.877 5.159 0.871 1.00 0.23 C ATOM 2644 CG LEU A 167 8.037 3.882 0.859 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.553 4.193 0.816 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.442 3.001 -0.316 1.00 0.25 C ATOM 0 H LEU A 167 10.381 7.102 0.397 1.00 0.20 H new ATOM 0 HA LEU A 167 8.562 5.477 -1.233 1.00 0.21 H new ATOM 0 HB2 LEU A 167 9.926 4.877 0.959 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.623 5.727 1.766 1.00 0.23 H new ATOM 0 HG LEU A 167 8.228 3.341 1.786 1.00 0.24 H new ATOM 0 HD11 LEU A 167 5.986 3.262 0.808 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.278 4.778 1.694 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.327 4.763 -0.085 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.838 2.094 -0.316 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.283 3.543 -1.249 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.495 2.735 -0.226 1.00 0.25 H new ATOM 2658 N VAL A 168 6.699 7.133 -1.155 1.00 0.19 N ATOM 2659 CA VAL A 168 5.530 8.005 -1.058 1.00 0.20 C ATOM 2660 C VAL A 168 4.256 7.298 -1.520 1.00 0.23 C ATOM 2661 O VAL A 168 4.196 6.708 -2.593 1.00 0.28 O ATOM 2662 CB VAL A 168 5.764 9.345 -1.805 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.627 9.140 -3.030 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.456 10.025 -2.189 1.00 0.26 C ATOM 0 H VAL A 168 6.796 6.645 -2.045 1.00 0.19 H new ATOM 0 HA VAL A 168 5.385 8.247 -0.005 1.00 0.20 H new ATOM 0 HB VAL A 168 6.287 10.004 -1.112 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.775 10.095 -3.535 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.593 8.734 -2.731 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.135 8.443 -3.709 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.670 10.959 -2.709 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.883 9.368 -2.843 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.878 10.235 -1.289 1.00 0.26 H new ATOM 2674 N MET A 169 3.241 7.372 -0.680 1.00 0.29 N ATOM 2675 CA MET A 169 2.005 6.636 -0.857 1.00 0.32 C ATOM 2676 C MET A 169 0.841 7.522 -0.454 1.00 0.34 C ATOM 2677 O MET A 169 0.999 8.399 0.383 1.00 0.45 O ATOM 2678 CB MET A 169 2.037 5.378 0.027 1.00 0.35 C ATOM 2679 CG MET A 169 0.673 4.745 0.273 1.00 0.40 C ATOM 2680 SD MET A 169 0.734 3.409 1.481 1.00 0.74 S ATOM 2681 CE MET A 169 -0.993 2.935 1.541 1.00 1.24 C ATOM 0 H MET A 169 3.253 7.954 0.157 1.00 0.29 H new ATOM 0 HA MET A 169 1.890 6.340 -1.900 1.00 0.32 H new ATOM 0 HB2 MET A 169 2.688 4.638 -0.439 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.483 5.635 0.988 1.00 0.35 H new ATOM 0 HG2 MET A 169 -0.021 5.511 0.619 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.280 4.361 -0.668 1.00 0.40 H new ATOM 0 HE1 MET A 169 -1.121 2.115 2.248 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.593 3.787 1.861 1.00 1.24 H new ATOM 0 HE3 MET A 169 -1.317 2.615 0.551 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.317 7.312 -1.043 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.510 7.987 -0.575 1.00 0.42 C ATOM 2693 C PHE A 170 -2.684 7.061 -0.727 1.00 0.37 C ATOM 2694 O PHE A 170 -2.677 6.178 -1.592 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.751 9.341 -1.272 1.00 0.69 C ATOM 2696 CG PHE A 170 -2.499 9.310 -2.579 1.00 1.26 C ATOM 2697 CD1 PHE A 170 -3.855 9.065 -2.597 1.00 2.02 C ATOM 2698 CD2 PHE A 170 -1.837 9.475 -3.789 1.00 1.74 C ATOM 2699 CE1 PHE A 170 -4.542 8.996 -3.790 1.00 3.07 C ATOM 2700 CE2 PHE A 170 -2.520 9.403 -4.986 1.00 2.73 C ATOM 2701 CZ PHE A 170 -3.878 9.338 -4.989 1.00 3.37 C ATOM 0 H PHE A 170 -0.458 6.687 -1.837 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.373 8.232 0.478 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.298 9.985 -0.583 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -0.783 9.810 -1.446 1.00 0.69 H new ATOM 0 HD1 PHE A 170 -4.385 8.926 -1.666 1.00 2.02 H new ATOM 0 HD2 PHE A 170 -0.773 9.662 -3.793 1.00 1.74 H new ATOM 0 HE1 PHE A 170 -5.576 8.684 -3.808 1.00 3.07 H new ATOM 0 HE2 PHE A 170 -1.976 9.398 -5.919 1.00 2.73 H new ATOM 0 HZ PHE A 170 -4.438 9.544 -5.890 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.675 7.254 0.117 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.783 6.337 0.178 1.00 0.50 C ATOM 2713 C VAL A 171 -6.121 7.072 0.311 1.00 0.49 C ATOM 2714 O VAL A 171 -6.293 7.946 1.168 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.577 5.338 1.341 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.615 6.037 2.692 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -5.591 4.217 1.276 1.00 1.40 C ATOM 0 H VAL A 171 -3.732 8.037 0.768 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.818 5.782 -0.760 1.00 0.50 H new ATOM 0 HB VAL A 171 -3.584 4.902 1.229 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.467 5.304 3.485 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -3.824 6.785 2.737 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.582 6.523 2.823 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -5.425 3.528 2.104 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -6.597 4.632 1.345 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -5.483 3.683 0.332 1.00 1.40 H new ATOM 2727 N GLN A 172 -7.049 6.731 -0.579 1.00 0.57 N ATOM 2728 CA GLN A 172 -8.416 7.242 -0.518 1.00 0.65 C ATOM 2729 C GLN A 172 -9.359 6.072 -0.289 1.00 0.65 C ATOM 2730 O GLN A 172 -10.362 5.895 -0.983 1.00 0.95 O ATOM 2731 CB GLN A 172 -8.787 7.982 -1.808 1.00 0.80 C ATOM 2732 CG GLN A 172 -10.100 8.748 -1.709 1.00 1.01 C ATOM 2733 CD GLN A 172 -10.311 9.721 -2.851 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -9.924 10.882 -2.766 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -10.927 9.259 -3.923 1.00 2.15 N ATOM 0 H GLN A 172 -6.877 6.096 -1.359 1.00 0.57 H new ATOM 0 HA GLN A 172 -8.498 7.955 0.302 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -7.987 8.678 -2.062 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -8.855 7.263 -2.624 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -10.927 8.038 -1.688 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -10.124 9.294 -0.766 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -11.234 8.287 -3.956 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -11.096 9.874 -4.719 1.00 2.15 H new ATOM 2744 N THR A 173 -9.014 5.264 0.683 1.00 0.59 N ATOM 2745 CA THR A 173 -9.743 4.032 0.937 1.00 0.66 C ATOM 2746 C THR A 173 -11.082 4.317 1.599 1.00 0.75 C ATOM 2747 O THR A 173 -11.271 5.347 2.248 1.00 1.01 O ATOM 2748 CB THR A 173 -8.939 3.040 1.811 1.00 0.93 C ATOM 2749 OG1 THR A 173 -9.403 1.702 1.585 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.077 3.360 3.290 1.00 1.12 C ATOM 0 H THR A 173 -8.232 5.432 1.316 1.00 0.59 H new ATOM 0 HA THR A 173 -9.908 3.568 -0.035 1.00 0.66 H new ATOM 0 HB THR A 173 -7.890 3.131 1.529 1.00 0.93 H new ATOM 0 HG1 THR A 173 -8.889 1.079 2.140 1.00 1.65 H new ATOM 0 HG21 THR A 173 -8.499 2.643 3.873 1.00 1.12 H new ATOM 0 HG22 THR A 173 -8.705 4.367 3.481 1.00 1.12 H new ATOM 0 HG23 THR A 173 -10.126 3.301 3.579 1.00 1.12 H new ATOM 2758 N GLU A 174 -12.024 3.420 1.371 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.302 3.481 2.034 1.00 0.87 C ATOM 2760 C GLU A 174 -13.291 2.583 3.257 1.00 0.99 C ATOM 2761 O GLU A 174 -13.942 2.893 4.252 1.00 1.32 O ATOM 2762 CB GLU A 174 -14.409 3.074 1.066 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.717 2.739 1.748 1.00 1.10 C ATOM 2764 CD GLU A 174 -16.870 2.658 0.775 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -16.856 1.758 -0.087 1.00 2.30 O ATOM 2766 OE2 GLU A 174 -17.795 3.487 0.867 1.00 2.45 O ATOM 0 H GLU A 174 -11.921 2.637 0.725 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.493 4.503 2.361 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -14.576 3.885 0.357 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -14.077 2.210 0.490 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -15.618 1.787 2.270 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.934 3.495 2.502 1.00 1.10 H new ATOM 2898 N ILE A 183 -13.085 6.021 13.546 1.00 1.04 N ATOM 2899 CA ILE A 183 -12.224 4.845 13.578 1.00 0.90 C ATOM 2900 C ILE A 183 -11.162 4.975 12.513 1.00 0.79 C ATOM 2901 O ILE A 183 -9.978 4.759 12.735 1.00 0.69 O ATOM 2902 CB ILE A 183 -13.025 3.562 13.312 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -14.234 3.478 14.242 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -12.139 2.336 13.466 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -13.887 3.538 15.716 1.00 1.12 C ATOM 0 HA ILE A 183 -11.774 4.782 14.569 1.00 0.90 H new ATOM 0 HB ILE A 183 -13.389 3.592 12.285 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -14.917 4.295 14.007 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -14.768 2.549 14.043 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -12.725 1.437 13.274 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -11.315 2.391 12.755 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -11.741 2.300 14.480 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -14.800 3.472 16.308 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -13.230 2.706 15.969 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -13.381 4.479 15.933 1.00 1.12 H new ATOM 2917 N ILE A 184 -11.649 5.337 11.359 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.873 5.548 10.169 1.00 0.83 C ATOM 2919 C ILE A 184 -9.847 6.651 10.372 1.00 0.81 C ATOM 2920 O ILE A 184 -8.718 6.572 9.885 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.819 5.903 9.011 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.479 4.650 8.451 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -11.106 6.673 7.902 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.864 4.417 8.997 1.00 1.13 C ATOM 0 H ILE A 184 -12.646 5.501 11.216 1.00 0.87 H new ATOM 0 HA ILE A 184 -10.330 4.633 9.933 1.00 0.83 H new ATOM 0 HB ILE A 184 -12.591 6.557 9.416 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.532 4.729 7.365 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.855 3.786 8.678 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -11.814 6.902 7.105 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.701 7.601 8.306 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.293 6.066 7.502 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.280 3.509 8.559 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.814 4.308 10.080 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.501 5.265 8.747 1.00 1.13 H new ATOM 2936 N GLU A 185 -10.232 7.654 11.142 1.00 0.91 N ATOM 2937 CA GLU A 185 -9.347 8.774 11.409 1.00 0.99 C ATOM 2938 C GLU A 185 -8.215 8.311 12.302 1.00 0.91 C ATOM 2939 O GLU A 185 -7.199 8.983 12.438 1.00 0.99 O ATOM 2940 CB GLU A 185 -10.086 9.952 12.045 1.00 1.17 C ATOM 2941 CG GLU A 185 -10.710 9.640 13.393 1.00 1.58 C ATOM 2942 CD GLU A 185 -11.372 10.850 14.017 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -11.911 11.690 13.269 1.00 2.89 O ATOM 2944 OE2 GLU A 185 -11.346 10.975 15.259 1.00 2.46 O ATOM 0 H GLU A 185 -11.146 7.716 11.591 1.00 0.91 H new ATOM 0 HA GLU A 185 -8.948 9.129 10.459 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -9.390 10.782 12.163 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -10.868 10.286 11.364 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -11.448 8.847 13.274 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -9.942 9.262 14.067 1.00 1.58 H new ATOM 2951 N LYS A 186 -8.420 7.165 12.937 1.00 0.82 N ATOM 2952 CA LYS A 186 -7.372 6.522 13.691 1.00 0.79 C ATOM 2953 C LYS A 186 -6.635 5.538 12.805 1.00 0.70 C ATOM 2954 O LYS A 186 -5.411 5.419 12.878 1.00 0.86 O ATOM 2955 CB LYS A 186 -7.937 5.771 14.889 1.00 0.80 C ATOM 2956 CG LYS A 186 -8.866 6.593 15.755 1.00 1.27 C ATOM 2957 CD LYS A 186 -9.283 5.814 16.991 1.00 1.28 C ATOM 2958 CE LYS A 186 -10.043 4.550 16.627 1.00 0.96 C ATOM 2959 NZ LYS A 186 -10.336 3.718 17.827 1.00 1.09 N ATOM 0 H LYS A 186 -9.309 6.666 12.940 1.00 0.82 H new ATOM 0 HA LYS A 186 -6.693 7.296 14.047 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -8.474 4.892 14.532 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -7.110 5.412 15.502 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -8.370 7.517 16.052 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -9.750 6.875 15.182 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -8.399 5.553 17.572 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -9.907 6.444 17.625 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -10.977 4.817 16.132 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -9.460 3.967 15.914 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -10.855 2.864 17.539 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -9.444 3.443 18.285 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -10.914 4.265 18.496 1.00 1.09 H new ATOM 2973 N THR A 187 -7.382 4.822 11.961 1.00 0.59 N ATOM 2974 CA THR A 187 -6.784 3.709 11.236 1.00 0.54 C ATOM 2975 C THR A 187 -5.857 4.173 10.109 1.00 0.50 C ATOM 2976 O THR A 187 -4.820 3.553 9.881 1.00 0.53 O ATOM 2977 CB THR A 187 -7.845 2.721 10.696 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.213 1.494 10.309 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.592 3.288 9.503 1.00 0.60 C ATOM 0 H THR A 187 -8.370 4.988 11.769 1.00 0.59 H new ATOM 0 HA THR A 187 -6.174 3.177 11.966 1.00 0.54 H new ATOM 0 HB THR A 187 -8.563 2.544 11.497 1.00 0.58 H new ATOM 0 HG1 THR A 187 -7.889 0.871 9.969 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.327 2.562 9.155 1.00 0.60 H new ATOM 0 HG22 THR A 187 -9.100 4.207 9.795 1.00 0.60 H new ATOM 0 HG23 THR A 187 -7.886 3.503 8.700 1.00 0.60 H new ATOM 2987 N MET A 188 -6.197 5.261 9.419 1.00 0.52 N ATOM 2988 CA MET A 188 -5.392 5.691 8.278 1.00 0.53 C ATOM 2989 C MET A 188 -4.032 6.240 8.700 1.00 0.54 C ATOM 2990 O MET A 188 -3.016 5.729 8.243 1.00 0.54 O ATOM 2991 CB MET A 188 -6.105 6.720 7.396 1.00 0.62 C ATOM 2992 CG MET A 188 -7.518 6.329 6.983 1.00 0.80 C ATOM 2993 SD MET A 188 -7.670 4.592 6.526 1.00 1.06 S ATOM 2994 CE MET A 188 -6.367 4.449 5.316 1.00 0.83 C ATOM 0 H MET A 188 -7.005 5.849 9.624 1.00 0.52 H new ATOM 0 HA MET A 188 -5.238 4.787 7.688 1.00 0.53 H new ATOM 0 HB2 MET A 188 -6.146 7.670 7.929 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.510 6.884 6.498 1.00 0.62 H new ATOM 0 HG2 MET A 188 -8.202 6.543 7.804 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.828 6.948 6.141 1.00 0.80 H new ATOM 0 HE1 MET A 188 -6.671 3.752 4.535 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.171 5.426 4.875 1.00 0.83 H new ATOM 0 HE3 MET A 188 -5.462 4.081 5.798 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.965 7.276 9.573 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.685 7.891 9.966 1.00 0.71 C ATOM 3006 C PRO A 189 -1.722 6.884 10.580 1.00 0.74 C ATOM 3007 O PRO A 189 -0.520 7.125 10.656 1.00 0.91 O ATOM 3008 CB PRO A 189 -3.076 8.948 11.002 1.00 0.84 C ATOM 3009 CG PRO A 189 -4.442 8.566 11.444 1.00 0.83 C ATOM 3010 CD PRO A 189 -5.095 7.931 10.251 1.00 0.63 C ATOM 0 HA PRO A 189 -2.163 8.303 9.102 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.378 8.957 11.839 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -3.067 9.948 10.568 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.402 7.872 12.283 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -5.003 9.439 11.779 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -5.862 7.214 10.543 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.577 8.671 9.612 1.00 0.63 H new ATOM 3018 N SER A 190 -2.257 5.762 11.023 1.00 0.66 N ATOM 3019 CA SER A 190 -1.435 4.681 11.515 1.00 0.76 C ATOM 3020 C SER A 190 -1.009 3.805 10.344 1.00 0.72 C ATOM 3021 O SER A 190 0.139 3.387 10.248 1.00 0.90 O ATOM 3022 CB SER A 190 -2.209 3.856 12.550 1.00 0.84 C ATOM 3023 OG SER A 190 -1.401 2.835 13.105 1.00 1.50 O ATOM 0 H SER A 190 -3.260 5.578 11.051 1.00 0.66 H new ATOM 0 HA SER A 190 -0.548 5.088 12.000 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.568 4.510 13.344 1.00 0.84 H new ATOM 0 HB3 SER A 190 -3.087 3.413 12.081 1.00 0.84 H new ATOM 0 HG SER A 190 -1.921 2.327 13.762 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.930 3.615 9.416 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.758 2.678 8.313 1.00 0.61 C ATOM 3031 C ASN A 191 -0.680 3.142 7.346 1.00 0.51 C ATOM 3032 O ASN A 191 0.145 2.346 6.915 1.00 0.52 O ATOM 3033 CB ASN A 191 -3.086 2.485 7.573 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.961 1.579 6.363 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -2.754 2.042 5.243 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -3.094 0.279 6.579 1.00 1.46 N ATOM 0 H ASN A 191 -2.823 4.107 9.404 1.00 0.57 H new ATOM 0 HA ASN A 191 -1.438 1.724 8.733 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.821 2.066 8.260 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -3.464 3.457 7.255 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -3.025 -0.377 5.801 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -3.265 -0.066 7.523 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.669 4.431 7.025 1.00 0.45 N ATOM 3044 CA LEU A 192 0.283 4.968 6.067 1.00 0.42 C ATOM 3045 C LEU A 192 1.706 4.787 6.557 1.00 0.36 C ATOM 3046 O LEU A 192 2.580 4.309 5.835 1.00 0.35 O ATOM 3047 CB LEU A 192 0.028 6.447 5.858 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.382 6.812 5.419 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -2.012 7.743 6.423 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.345 7.464 4.053 1.00 1.09 C ATOM 0 H LEU A 192 -1.310 5.122 7.416 1.00 0.45 H new ATOM 0 HA LEU A 192 0.155 4.427 5.129 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.247 6.971 6.788 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.730 6.817 5.111 1.00 0.48 H new ATOM 0 HG LEU A 192 -1.981 5.904 5.360 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -3.021 7.998 6.099 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -2.056 7.253 7.396 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -1.415 8.652 6.501 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.358 7.722 3.746 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.738 8.368 4.098 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -0.912 6.772 3.331 1.00 1.09 H new ATOM 3062 N VAL A 193 1.923 5.176 7.798 1.00 0.36 N ATOM 3063 CA VAL A 193 3.247 5.111 8.397 1.00 0.36 C ATOM 3064 C VAL A 193 3.657 3.662 8.573 1.00 0.39 C ATOM 3065 O VAL A 193 4.826 3.306 8.467 1.00 0.42 O ATOM 3066 CB VAL A 193 3.292 5.829 9.764 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.403 7.056 9.739 1.00 0.68 C ATOM 3068 CG2 VAL A 193 2.894 4.918 10.918 1.00 0.59 C ATOM 0 H VAL A 193 1.198 5.542 8.415 1.00 0.36 H new ATOM 0 HA VAL A 193 3.941 5.618 7.727 1.00 0.36 H new ATOM 0 HB VAL A 193 4.326 6.128 9.934 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.443 7.554 10.708 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.749 7.741 8.965 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.377 6.757 9.526 1.00 0.68 H new ATOM 0 HG21 VAL A 193 2.943 5.474 11.854 1.00 0.59 H new ATOM 0 HG22 VAL A 193 1.877 4.558 10.763 1.00 0.59 H new ATOM 0 HG23 VAL A 193 3.577 4.069 10.964 1.00 0.59 H new ATOM 3078 N ASN A 194 2.661 2.839 8.826 1.00 0.43 N ATOM 3079 CA ASN A 194 2.863 1.427 9.051 1.00 0.48 C ATOM 3080 C ASN A 194 3.113 0.698 7.740 1.00 0.45 C ATOM 3081 O ASN A 194 3.819 -0.309 7.715 1.00 0.49 O ATOM 3082 CB ASN A 194 1.663 0.846 9.797 1.00 0.58 C ATOM 3083 CG ASN A 194 1.868 0.825 11.307 1.00 1.28 C ATOM 3084 OD1 ASN A 194 2.453 -0.107 11.856 1.00 1.80 O ATOM 3085 ND2 ASN A 194 1.373 1.841 11.994 1.00 2.07 N ATOM 0 H ASN A 194 1.686 3.134 8.881 1.00 0.43 H new ATOM 0 HA ASN A 194 3.750 1.289 9.669 1.00 0.48 H new ATOM 0 HB2 ASN A 194 0.775 1.433 9.562 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.477 -0.169 9.445 1.00 0.58 H new ATOM 0 HD21 ASN A 194 1.471 1.867 13.009 1.00 2.07 H new ATOM 0 HD22 ASN A 194 0.893 2.599 11.509 1.00 2.07 H new ATOM 3092 N PHE A 195 2.553 1.218 6.653 1.00 0.44 N ATOM 3093 CA PHE A 195 2.876 0.723 5.323 1.00 0.44 C ATOM 3094 C PHE A 195 4.328 1.040 5.003 1.00 0.36 C ATOM 3095 O PHE A 195 5.024 0.285 4.320 1.00 0.36 O ATOM 3096 CB PHE A 195 1.949 1.326 4.268 1.00 0.47 C ATOM 3097 CG PHE A 195 0.994 0.327 3.681 1.00 0.73 C ATOM 3098 CD1 PHE A 195 -0.238 0.095 4.269 1.00 1.06 C ATOM 3099 CD2 PHE A 195 1.332 -0.383 2.540 1.00 1.51 C ATOM 3100 CE1 PHE A 195 -1.116 -0.827 3.730 1.00 1.43 C ATOM 3101 CE2 PHE A 195 0.460 -1.306 1.997 1.00 2.00 C ATOM 3102 CZ PHE A 195 -0.767 -1.528 2.592 1.00 1.76 C ATOM 0 H PHE A 195 1.875 1.980 6.668 1.00 0.44 H new ATOM 0 HA PHE A 195 2.731 -0.357 5.308 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.382 2.142 4.716 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.551 1.757 3.468 1.00 0.47 H new ATOM 0 HD1 PHE A 195 -0.516 0.640 5.159 1.00 1.06 H new ATOM 0 HD2 PHE A 195 2.289 -0.212 2.070 1.00 1.51 H new ATOM 0 HE1 PHE A 195 -2.074 -0.999 4.198 1.00 1.43 H new ATOM 0 HE2 PHE A 195 0.737 -1.854 1.108 1.00 2.00 H new ATOM 0 HZ PHE A 195 -1.452 -2.248 2.168 1.00 1.76 H new ATOM 3112 N ILE A 196 4.795 2.156 5.518 1.00 0.31 N ATOM 3113 CA ILE A 196 6.183 2.497 5.393 1.00 0.27 C ATOM 3114 C ILE A 196 7.028 1.671 6.343 1.00 0.28 C ATOM 3115 O ILE A 196 8.185 1.395 6.070 1.00 0.28 O ATOM 3116 CB ILE A 196 6.395 3.992 5.641 1.00 0.25 C ATOM 3117 CG1 ILE A 196 5.850 4.773 4.453 1.00 0.25 C ATOM 3118 CG2 ILE A 196 7.859 4.307 5.894 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.112 6.247 4.535 1.00 0.26 C ATOM 0 H ILE A 196 4.230 2.837 6.025 1.00 0.31 H new ATOM 0 HA ILE A 196 6.499 2.271 4.375 1.00 0.27 H new ATOM 0 HB ILE A 196 5.854 4.289 6.539 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.295 4.383 3.537 1.00 0.25 H new ATOM 0 HG13 ILE A 196 4.775 4.607 4.381 1.00 0.25 H new ATOM 0 HG21 ILE A 196 7.976 5.377 6.067 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.203 3.758 6.771 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.450 4.012 5.027 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.696 6.740 3.656 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.644 6.650 5.433 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.187 6.424 4.576 1.00 0.26 H new ATOM 3131 N LEU A 197 6.443 1.256 7.442 1.00 0.33 N ATOM 3132 CA LEU A 197 7.158 0.455 8.416 1.00 0.37 C ATOM 3133 C LEU A 197 7.408 -0.931 7.905 1.00 0.36 C ATOM 3134 O LEU A 197 8.496 -1.475 8.087 1.00 0.38 O ATOM 3135 CB LEU A 197 6.405 0.381 9.728 1.00 0.50 C ATOM 3136 CG LEU A 197 6.440 1.651 10.546 1.00 0.52 C ATOM 3137 CD1 LEU A 197 5.635 1.458 11.811 1.00 1.00 C ATOM 3138 CD2 LEU A 197 7.884 2.017 10.849 1.00 1.03 C ATOM 0 H LEU A 197 5.474 1.458 7.687 1.00 0.33 H new ATOM 0 HA LEU A 197 8.116 0.945 8.587 1.00 0.37 H new ATOM 0 HB2 LEU A 197 5.366 0.126 9.521 1.00 0.50 H new ATOM 0 HB3 LEU A 197 6.820 -0.431 10.325 1.00 0.50 H new ATOM 0 HG LEU A 197 5.994 2.473 9.987 1.00 0.52 H new ATOM 0 HD11 LEU A 197 5.660 2.374 12.401 1.00 1.00 H new ATOM 0 HD12 LEU A 197 4.603 1.221 11.553 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.061 0.640 12.392 1.00 1.00 H new ATOM 0 HD21 LEU A 197 7.911 2.933 11.439 1.00 1.03 H new ATOM 0 HD22 LEU A 197 8.354 1.210 11.411 1.00 1.03 H new ATOM 0 HD23 LEU A 197 8.424 2.171 9.915 1.00 1.03 H new ATOM 3150 N ASN A 198 6.409 -1.515 7.270 1.00 0.38 N ATOM 3151 CA ASN A 198 6.644 -2.768 6.589 1.00 0.43 C ATOM 3152 C ASN A 198 7.716 -2.562 5.533 1.00 0.31 C ATOM 3153 O ASN A 198 8.418 -3.489 5.167 1.00 0.32 O ATOM 3154 CB ASN A 198 5.376 -3.400 5.974 1.00 0.65 C ATOM 3155 CG ASN A 198 4.653 -2.553 4.960 1.00 1.05 C ATOM 3156 OD1 ASN A 198 3.632 -1.960 5.271 1.00 1.90 O ATOM 3157 ND2 ASN A 198 5.158 -2.516 3.736 1.00 1.61 N ATOM 0 H ASN A 198 5.457 -1.154 7.213 1.00 0.38 H new ATOM 0 HA ASN A 198 6.979 -3.484 7.340 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.654 -4.342 5.502 1.00 0.65 H new ATOM 0 HB3 ASN A 198 4.683 -3.640 6.781 1.00 0.65 H new ATOM 0 HD21 ASN A 198 4.691 -1.976 3.008 1.00 1.61 H new ATOM 0 HD22 ASN A 198 6.014 -3.028 3.522 1.00 1.61 H new ATOM 3164 N ALA A 199 7.889 -1.336 5.071 1.00 0.29 N ATOM 3165 CA ALA A 199 8.931 -1.068 4.123 1.00 0.25 C ATOM 3166 C ALA A 199 10.270 -0.901 4.815 1.00 0.23 C ATOM 3167 O ALA A 199 11.267 -1.473 4.386 1.00 0.26 O ATOM 3168 CB ALA A 199 8.574 0.146 3.327 1.00 0.26 C ATOM 0 H ALA A 199 7.326 -0.528 5.338 1.00 0.29 H new ATOM 0 HA ALA A 199 9.026 -1.918 3.447 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.364 0.353 2.605 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.636 -0.028 2.799 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.461 0.999 3.996 1.00 0.26 H new ATOM 3174 N LYS A 200 10.282 -0.123 5.893 1.00 0.26 N ATOM 3175 CA LYS A 200 11.491 0.072 6.681 1.00 0.29 C ATOM 3176 C LYS A 200 12.049 -1.269 7.129 1.00 0.31 C ATOM 3177 O LYS A 200 13.249 -1.505 7.065 1.00 0.36 O ATOM 3178 CB LYS A 200 11.195 0.910 7.927 1.00 0.34 C ATOM 3179 CG LYS A 200 10.519 2.248 7.652 1.00 0.57 C ATOM 3180 CD LYS A 200 11.343 3.149 6.741 1.00 0.54 C ATOM 3181 CE LYS A 200 12.576 3.702 7.436 1.00 0.64 C ATOM 3182 NZ LYS A 200 12.242 4.416 8.699 1.00 0.97 N ATOM 0 H LYS A 200 9.467 0.382 6.240 1.00 0.26 H new ATOM 0 HA LYS A 200 12.216 0.590 6.054 1.00 0.29 H new ATOM 0 HB2 LYS A 200 10.560 0.329 8.596 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.131 1.093 8.455 1.00 0.34 H new ATOM 0 HG2 LYS A 200 9.545 2.071 7.196 1.00 0.57 H new ATOM 0 HG3 LYS A 200 10.340 2.761 8.597 1.00 0.57 H new ATOM 0 HD2 LYS A 200 11.648 2.587 5.858 1.00 0.54 H new ATOM 0 HD3 LYS A 200 10.723 3.976 6.394 1.00 0.54 H new ATOM 0 HE2 LYS A 200 13.264 2.885 7.654 1.00 0.64 H new ATOM 0 HE3 LYS A 200 13.095 4.384 6.762 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 13.045 5.012 8.984 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 11.404 5.014 8.549 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 12.043 3.722 9.448 1.00 0.97 H new ATOM 3196 N ASP A 201 11.160 -2.140 7.579 1.00 0.30 N ATOM 3197 CA ASP A 201 11.569 -3.419 8.155 1.00 0.33 C ATOM 3198 C ASP A 201 11.616 -4.526 7.111 1.00 0.31 C ATOM 3199 O ASP A 201 12.460 -5.412 7.188 1.00 0.36 O ATOM 3200 CB ASP A 201 10.660 -3.811 9.322 1.00 0.40 C ATOM 3201 CG ASP A 201 10.812 -2.879 10.513 1.00 1.10 C ATOM 3202 OD1 ASP A 201 11.961 -2.517 10.852 1.00 1.18 O ATOM 3203 OD2 ASP A 201 9.783 -2.504 11.125 1.00 1.94 O ATOM 0 H ASP A 201 10.151 -1.989 7.558 1.00 0.30 H new ATOM 0 HA ASP A 201 12.582 -3.289 8.536 1.00 0.33 H new ATOM 0 HB2 ASP A 201 9.622 -3.804 8.989 1.00 0.40 H new ATOM 0 HB3 ASP A 201 10.889 -4.831 9.631 1.00 0.40 H new ATOM 3208 N GLY A 202 10.723 -4.472 6.134 1.00 0.31 N ATOM 3209 CA GLY A 202 10.745 -5.448 5.045 1.00 0.37 C ATOM 3210 C GLY A 202 11.981 -5.293 4.192 1.00 0.37 C ATOM 3211 O GLY A 202 12.470 -6.252 3.600 1.00 0.47 O ATOM 0 H GLY A 202 9.982 -3.774 6.069 1.00 0.31 H new ATOM 0 HA2 GLY A 202 10.710 -6.456 5.457 1.00 0.37 H new ATOM 0 HA3 GLY A 202 9.856 -5.325 4.426 1.00 0.37 H new ATOM 3215 N ILE A 203 12.485 -4.070 4.130 1.00 0.30 N ATOM 3216 CA ILE A 203 13.702 -3.779 3.407 1.00 0.37 C ATOM 3217 C ILE A 203 14.889 -4.361 4.159 1.00 0.47 C ATOM 3218 O ILE A 203 15.901 -4.720 3.565 1.00 0.61 O ATOM 3219 CB ILE A 203 13.896 -2.258 3.219 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.582 -1.962 1.914 1.00 0.41 C ATOM 3221 CG2 ILE A 203 14.719 -1.652 4.318 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.702 -2.152 0.726 1.00 0.52 C ATOM 0 H ILE A 203 12.060 -3.258 4.579 1.00 0.30 H new ATOM 0 HA ILE A 203 13.630 -4.233 2.418 1.00 0.37 H new ATOM 0 HB ILE A 203 12.897 -1.822 3.235 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.945 -0.934 1.928 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.455 -2.607 1.817 1.00 0.41 H new ATOM 0 HG21 ILE A 203 14.828 -0.582 4.143 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.224 -1.814 5.275 1.00 0.38 H new ATOM 0 HG23 ILE A 203 15.704 -2.119 4.335 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.261 -1.921 -0.181 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.360 -3.186 0.688 1.00 0.52 H new ATOM 0 HD13 ILE A 203 12.841 -1.488 0.801 1.00 0.52 H new ATOM 3234 N LYS A 204 14.748 -4.457 5.475 1.00 0.47 N ATOM 3235 CA LYS A 204 15.754 -5.091 6.302 1.00 0.63 C ATOM 3236 C LYS A 204 15.576 -6.580 6.185 1.00 0.64 C ATOM 3237 O LYS A 204 16.523 -7.326 6.099 1.00 0.78 O ATOM 3238 CB LYS A 204 15.615 -4.709 7.756 1.00 0.74 C ATOM 3239 CG LYS A 204 15.470 -3.233 8.017 1.00 1.21 C ATOM 3240 CD LYS A 204 15.258 -3.019 9.491 1.00 1.55 C ATOM 3241 CE LYS A 204 15.122 -1.558 9.857 1.00 2.41 C ATOM 3242 NZ LYS A 204 14.630 -1.395 11.249 1.00 3.37 N ATOM 0 H LYS A 204 13.942 -4.101 5.989 1.00 0.47 H new ATOM 0 HA LYS A 204 16.737 -4.766 5.961 1.00 0.63 H new ATOM 0 HB2 LYS A 204 14.747 -5.222 8.169 1.00 0.74 H new ATOM 0 HB3 LYS A 204 16.488 -5.074 8.297 1.00 0.74 H new ATOM 0 HG2 LYS A 204 16.361 -2.702 7.683 1.00 1.21 H new ATOM 0 HG3 LYS A 204 14.629 -2.831 7.453 1.00 1.21 H new ATOM 0 HD2 LYS A 204 14.361 -3.553 9.806 1.00 1.55 H new ATOM 0 HD3 LYS A 204 16.095 -3.450 10.040 1.00 1.55 H new ATOM 0 HE2 LYS A 204 16.087 -1.062 9.749 1.00 2.41 H new ATOM 0 HE3 LYS A 204 14.434 -1.070 9.166 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 14.659 -0.389 11.512 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 13.652 -1.742 11.314 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 15.234 -1.940 11.897 1.00 3.37 H new ATOM 3256 N ALA A 205 14.333 -7.000 6.182 1.00 0.57 N ATOM 3257 CA ALA A 205 14.001 -8.384 5.914 1.00 0.69 C ATOM 3258 C ALA A 205 14.582 -8.806 4.569 1.00 0.87 C ATOM 3259 O ALA A 205 14.870 -9.977 4.341 1.00 1.02 O ATOM 3260 CB ALA A 205 12.496 -8.572 5.935 1.00 0.68 C ATOM 0 H ALA A 205 13.528 -6.400 6.363 1.00 0.57 H new ATOM 0 HA ALA A 205 14.435 -9.014 6.690 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.257 -9.616 5.732 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.108 -8.295 6.915 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.040 -7.941 5.172 1.00 0.68 H new