USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1216 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 141 THR OG1 : rot -22:sc= 0.924 USER MOD Set 1.2: A 145 HIS : no HE2:sc= -0.77 K(o=0.15,f=-1.6!) USER MOD Set 2.1: A 56 LYS NZ :NH3+ -172:sc= 0.6 (180deg=-0.24) USER MOD Set 2.2: A 117 ASN : amide:sc= -0.277 K(o=1.2,f=-0.63) USER MOD Set 2.3: A 121 ASN : amide:sc= 0.909 K(o=1.2,f=0.14) USER MOD Set 3.1: A 78 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Set 3.2: A 104 ASN :FLIP amide:sc= 0 F(o=-0.99,f=0) USER MOD Set 4.1: A 102 LYS NZ :NH3+ 162:sc= 0.524 (180deg=0.19) USER MOD Set 4.2: A 103 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 46 SER OG : rot 180:sc= 0.0297 USER MOD Set 5.2: A 50 ASN : amide:sc= 0.0176 X(o=0.047,f=-0.19) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.0108 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0655) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0256) USER MOD Single : A 17 LYS NZ :NH3+ -130:sc= -0.371 (180deg=-2.14!) USER MOD Single : A 18 THR OG1 : rot 88:sc= 0.0333 USER MOD Single : A 21 SER OG : rot 74:sc= 0.761 USER MOD Single : A 24 TYR OH : rot -59:sc= 0.988 USER MOD Single : A 26 GLN : amide:sc= -0.358 K(o=-0.36,f=-8.2!) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN :FLIP amide:sc= -0.0454 F(o=-1.4!,f=-0.045) USER MOD Single : A 39 ASN : amide:sc= -1.39! X(o=-1.4!,f=-1.7) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -134:sc= 1.07 (180deg=-0.0868) USER MOD Single : A 54 THR OG1 : rot -82:sc= 0.276 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.122 USER MOD Single : A 65 SER OG : rot -170:sc= 0 USER MOD Single : A 66 ASN : amide:sc=-0.00911 X(o=-0.0091,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.585 USER MOD Single : A 70 LYS NZ :NH3+ -169:sc= -0.0154 (180deg=-0.158) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 62:sc= 0.974 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -148:sc= -0.193 (180deg=-1.81!) USER MOD Single : A 86 THR OG1 : rot 84:sc= 0.37 USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0817) USER MOD Single : A 88 HIS : no HD1:sc= -0.0378 K(o=-0.038,f=-0.87) USER MOD Single : A 97 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.022) USER MOD Single : A 105 GLN :FLIP amide:sc= -0.228 F(o=-2.2!,f=-0.23) USER MOD Single : A 109 THR OG1 : rot -75:sc= 0.429 USER MOD Single : A 110 GLN : amide:sc= -0.0346 X(o=-0.035,f=0) USER MOD Single : A 122 SER OG : rot 160:sc= -0.641 USER MOD Single : A 123 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 125 TYR OH : rot 30:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -1.08 K(o=-1.1,f=-8.1!) USER MOD Single : A 133 THR OG1 : rot 109:sc= 0.367 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 HIS : no HD1:sc=-0.00506 X(o=-0.0051,f=-0.0021) USER MOD Single : A 146 HIS : no HE2:sc= -0.277 K(o=-0.28,f=-1.3) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.390 7.840 -3.730 1.00 1.32 N ATOM 2 CA MET A 1 18.462 8.229 -4.839 1.00 23.40 C ATOM 3 C MET A 1 18.414 7.124 -5.919 1.00 3.11 C ATOM 4 O MET A 1 19.451 6.552 -6.258 1.00 3.43 O ATOM 5 CB MET A 1 18.916 9.584 -5.458 1.00 52.25 C ATOM 6 CG MET A 1 18.037 10.120 -6.601 1.00 2.04 C ATOM 7 SD MET A 1 18.673 11.670 -7.283 1.00 71.12 S ATOM 8 CE MET A 1 17.484 12.028 -8.580 1.00 13.52 C ATOM 0 H1 MET A 1 19.970 8.660 -3.459 1.00 1.32 H new ATOM 0 H2 MET A 1 18.836 7.521 -2.909 1.00 1.32 H new ATOM 0 H3 MET A 1 20.009 7.068 -4.050 1.00 1.32 H new ATOM 0 HA MET A 1 17.457 8.348 -4.433 1.00 23.40 H new ATOM 0 HB2 MET A 1 18.947 10.332 -4.666 1.00 52.25 H new ATOM 0 HB3 MET A 1 19.934 9.470 -5.829 1.00 52.25 H new ATOM 0 HG2 MET A 1 17.979 9.373 -7.393 1.00 2.04 H new ATOM 0 HG3 MET A 1 17.022 10.276 -6.234 1.00 2.04 H new ATOM 0 HE1 MET A 1 17.759 12.957 -9.079 1.00 13.52 H new ATOM 0 HE2 MET A 1 17.480 11.214 -9.305 1.00 13.52 H new ATOM 0 HE3 MET A 1 16.490 12.131 -8.144 1.00 13.52 H new ATOM 20 N LYS A 2 17.208 6.831 -6.458 1.00 30.44 N ATOM 21 CA LYS A 2 17.036 5.811 -7.526 1.00 22.21 C ATOM 22 C LYS A 2 15.698 6.008 -8.283 1.00 31.33 C ATOM 23 O LYS A 2 15.659 5.897 -9.516 1.00 5.15 O ATOM 24 CB LYS A 2 17.105 4.363 -6.943 1.00 21.30 C ATOM 25 CG LYS A 2 17.359 3.261 -8.000 1.00 61.52 C ATOM 26 CD LYS A 2 18.757 3.400 -8.658 1.00 23.11 C ATOM 27 CE LYS A 2 19.037 2.318 -9.717 1.00 63.34 C ATOM 28 NZ LYS A 2 18.961 0.941 -9.155 1.00 60.01 N ATOM 0 H LYS A 2 16.339 7.284 -6.174 1.00 30.44 H new ATOM 0 HA LYS A 2 17.857 5.944 -8.230 1.00 22.21 H new ATOM 0 HB2 LYS A 2 17.897 4.322 -6.196 1.00 21.30 H new ATOM 0 HB3 LYS A 2 16.169 4.147 -6.428 1.00 21.30 H new ATOM 0 HG2 LYS A 2 17.275 2.281 -7.530 1.00 61.52 H new ATOM 0 HG3 LYS A 2 16.589 3.312 -8.770 1.00 61.52 H new ATOM 0 HD2 LYS A 2 18.837 4.383 -9.122 1.00 23.11 H new ATOM 0 HD3 LYS A 2 19.523 3.349 -7.884 1.00 23.11 H new ATOM 0 HE2 LYS A 2 18.319 2.416 -10.531 1.00 63.34 H new ATOM 0 HE3 LYS A 2 20.027 2.479 -10.144 1.00 63.34 H new ATOM 0 HZ1 LYS A 2 19.256 0.254 -9.878 1.00 60.01 H new ATOM 0 HZ2 LYS A 2 19.591 0.867 -8.331 1.00 60.01 H new ATOM 0 HZ3 LYS A 2 17.984 0.739 -8.863 1.00 60.01 H new ATOM 42 N VAL A 3 14.619 6.330 -7.519 1.00 43.12 N ATOM 43 CA VAL A 3 13.216 6.400 -8.020 1.00 14.03 C ATOM 44 C VAL A 3 12.818 5.138 -8.842 1.00 21.51 C ATOM 45 O VAL A 3 12.969 5.099 -10.067 1.00 0.04 O ATOM 46 CB VAL A 3 12.932 7.726 -8.837 1.00 52.12 C ATOM 47 CG1 VAL A 3 11.445 7.821 -9.296 1.00 4.14 C ATOM 48 CG2 VAL A 3 13.340 8.979 -8.017 1.00 21.05 C ATOM 0 H VAL A 3 14.699 6.551 -6.526 1.00 43.12 H new ATOM 0 HA VAL A 3 12.582 6.424 -7.133 1.00 14.03 H new ATOM 0 HB VAL A 3 13.546 7.689 -9.737 1.00 52.12 H new ATOM 0 HG11 VAL A 3 11.294 8.746 -9.853 1.00 4.14 H new ATOM 0 HG12 VAL A 3 11.206 6.970 -9.934 1.00 4.14 H new ATOM 0 HG13 VAL A 3 10.793 7.813 -8.422 1.00 4.14 H new ATOM 0 HG21 VAL A 3 13.135 9.877 -8.599 1.00 21.05 H new ATOM 0 HG22 VAL A 3 12.768 9.009 -7.090 1.00 21.05 H new ATOM 0 HG23 VAL A 3 14.404 8.931 -7.785 1.00 21.05 H new ATOM 58 N PHE A 4 12.358 4.094 -8.138 1.00 13.34 N ATOM 59 CA PHE A 4 11.913 2.832 -8.767 1.00 3.41 C ATOM 60 C PHE A 4 10.571 3.051 -9.508 1.00 43.43 C ATOM 61 O PHE A 4 9.655 3.665 -8.954 1.00 45.34 O ATOM 62 CB PHE A 4 11.766 1.724 -7.690 1.00 20.00 C ATOM 63 CG PHE A 4 13.064 1.404 -6.940 1.00 15.44 C ATOM 64 CD1 PHE A 4 13.968 0.457 -7.436 1.00 75.31 C ATOM 65 CD2 PHE A 4 13.382 2.046 -5.740 1.00 45.22 C ATOM 66 CE1 PHE A 4 15.143 0.172 -6.760 1.00 42.43 C ATOM 67 CE2 PHE A 4 14.558 1.758 -5.066 1.00 12.43 C ATOM 68 CZ PHE A 4 15.435 0.819 -5.574 1.00 72.31 C ATOM 0 H PHE A 4 12.282 4.095 -7.121 1.00 13.34 H new ATOM 0 HA PHE A 4 12.661 2.514 -9.493 1.00 3.41 H new ATOM 0 HB2 PHE A 4 11.009 2.031 -6.969 1.00 20.00 H new ATOM 0 HB3 PHE A 4 11.401 0.815 -8.167 1.00 20.00 H new ATOM 0 HD1 PHE A 4 13.746 -0.059 -8.359 1.00 75.31 H new ATOM 0 HD2 PHE A 4 12.701 2.778 -5.332 1.00 45.22 H new ATOM 0 HE1 PHE A 4 15.832 -0.557 -7.160 1.00 42.43 H new ATOM 0 HE2 PHE A 4 14.789 2.268 -4.143 1.00 12.43 H new ATOM 0 HZ PHE A 4 16.348 0.591 -5.045 1.00 72.31 H new ATOM 78 N LYS A 5 10.474 2.567 -10.762 1.00 63.22 N ATOM 79 CA LYS A 5 9.250 2.715 -11.581 1.00 42.11 C ATOM 80 C LYS A 5 9.106 1.577 -12.620 1.00 10.54 C ATOM 81 O LYS A 5 10.083 0.903 -12.971 1.00 1.33 O ATOM 82 CB LYS A 5 9.231 4.092 -12.304 1.00 62.50 C ATOM 83 CG LYS A 5 10.401 4.322 -13.289 1.00 61.52 C ATOM 84 CD LYS A 5 10.180 5.545 -14.208 1.00 15.12 C ATOM 85 CE LYS A 5 10.031 6.873 -13.442 1.00 63.54 C ATOM 86 NZ LYS A 5 9.824 8.015 -14.362 1.00 52.42 N ATOM 0 H LYS A 5 11.229 2.069 -11.233 1.00 63.22 H new ATOM 0 HA LYS A 5 8.403 2.656 -10.897 1.00 42.11 H new ATOM 0 HB2 LYS A 5 8.292 4.188 -12.848 1.00 62.50 H new ATOM 0 HB3 LYS A 5 9.246 4.882 -11.553 1.00 62.50 H new ATOM 0 HG2 LYS A 5 11.323 4.460 -12.724 1.00 61.52 H new ATOM 0 HG3 LYS A 5 10.533 3.431 -13.903 1.00 61.52 H new ATOM 0 HD2 LYS A 5 11.019 5.626 -14.899 1.00 15.12 H new ATOM 0 HD3 LYS A 5 9.286 5.380 -14.810 1.00 15.12 H new ATOM 0 HE2 LYS A 5 9.189 6.803 -12.753 1.00 63.54 H new ATOM 0 HE3 LYS A 5 10.922 7.048 -12.840 1.00 63.54 H new ATOM 0 HZ1 LYS A 5 9.728 8.892 -13.811 1.00 52.42 H new ATOM 0 HZ2 LYS A 5 10.639 8.097 -15.003 1.00 52.42 H new ATOM 0 HZ3 LYS A 5 8.960 7.860 -14.919 1.00 52.42 H new ATOM 100 N ARG A 6 7.869 1.381 -13.104 1.00 43.42 N ATOM 101 CA ARG A 6 7.559 0.462 -14.210 1.00 11.43 C ATOM 102 C ARG A 6 7.542 1.268 -15.529 1.00 2.23 C ATOM 103 O ARG A 6 6.574 1.982 -15.824 1.00 13.41 O ATOM 104 CB ARG A 6 6.186 -0.241 -13.954 1.00 4.24 C ATOM 105 CG ARG A 6 5.609 -1.048 -15.145 1.00 14.41 C ATOM 106 CD ARG A 6 6.484 -2.234 -15.586 1.00 35.22 C ATOM 107 NE ARG A 6 5.943 -2.882 -16.804 1.00 3.25 N ATOM 108 CZ ARG A 6 5.690 -4.170 -16.949 1.00 53.05 C ATOM 109 NH1 ARG A 6 5.867 -5.002 -15.977 1.00 71.32 N ATOM 110 NH2 ARG A 6 5.256 -4.621 -18.075 1.00 34.40 N ATOM 0 H ARG A 6 7.048 1.861 -12.735 1.00 43.42 H new ATOM 0 HA ARG A 6 8.318 -0.317 -14.280 1.00 11.43 H new ATOM 0 HB2 ARG A 6 6.297 -0.914 -13.103 1.00 4.24 H new ATOM 0 HB3 ARG A 6 5.458 0.518 -13.667 1.00 4.24 H new ATOM 0 HG2 ARG A 6 4.622 -1.421 -14.872 1.00 14.41 H new ATOM 0 HG3 ARG A 6 5.473 -0.376 -15.993 1.00 14.41 H new ATOM 0 HD2 ARG A 6 7.500 -1.887 -15.777 1.00 35.22 H new ATOM 0 HD3 ARG A 6 6.543 -2.964 -14.779 1.00 35.22 H new ATOM 0 HE ARG A 6 5.748 -2.278 -17.603 1.00 3.25 H new ATOM 0 HH11 ARG A 6 6.208 -4.668 -15.076 1.00 71.32 H new ATOM 0 HH12 ARG A 6 5.665 -5.993 -16.111 1.00 71.32 H new ATOM 0 HH21 ARG A 6 5.107 -3.983 -18.857 1.00 34.40 H new ATOM 0 HH22 ARG A 6 5.061 -5.616 -18.185 1.00 34.40 H new ATOM 124 N VAL A 7 8.647 1.188 -16.288 1.00 72.51 N ATOM 125 CA VAL A 7 8.748 1.812 -17.625 1.00 65.31 C ATOM 126 C VAL A 7 8.011 0.932 -18.667 1.00 64.43 C ATOM 127 O VAL A 7 8.030 -0.300 -18.563 1.00 34.02 O ATOM 128 CB VAL A 7 10.257 2.029 -18.046 1.00 5.20 C ATOM 129 CG1 VAL A 7 10.398 2.647 -19.465 1.00 11.41 C ATOM 130 CG2 VAL A 7 11.010 2.882 -16.988 1.00 21.02 C ATOM 0 H VAL A 7 9.491 0.694 -15.999 1.00 72.51 H new ATOM 0 HA VAL A 7 8.275 2.793 -17.586 1.00 65.31 H new ATOM 0 HB VAL A 7 10.719 1.042 -18.088 1.00 5.20 H new ATOM 0 HG11 VAL A 7 11.454 2.774 -19.703 1.00 11.41 H new ATOM 0 HG12 VAL A 7 9.938 1.984 -20.198 1.00 11.41 H new ATOM 0 HG13 VAL A 7 9.901 3.617 -19.491 1.00 11.41 H new ATOM 0 HG21 VAL A 7 12.046 3.017 -17.300 1.00 21.02 H new ATOM 0 HG22 VAL A 7 10.529 3.856 -16.896 1.00 21.02 H new ATOM 0 HG23 VAL A 7 10.985 2.372 -16.025 1.00 21.02 H new ATOM 140 N ALA A 8 7.320 1.585 -19.625 1.00 44.11 N ATOM 141 CA ALA A 8 6.632 0.901 -20.740 1.00 54.51 C ATOM 142 C ALA A 8 7.603 0.000 -21.553 1.00 12.21 C ATOM 143 O ALA A 8 8.288 0.472 -22.468 1.00 30.31 O ATOM 144 CB ALA A 8 5.935 1.932 -21.647 1.00 64.01 C ATOM 0 H ALA A 8 7.223 2.600 -19.647 1.00 44.11 H new ATOM 0 HA ALA A 8 5.874 0.244 -20.315 1.00 54.51 H new ATOM 0 HB1 ALA A 8 5.432 1.416 -22.465 1.00 64.01 H new ATOM 0 HB2 ALA A 8 5.202 2.492 -21.066 1.00 64.01 H new ATOM 0 HB3 ALA A 8 6.677 2.619 -22.054 1.00 64.01 H new ATOM 150 N GLY A 9 7.673 -1.296 -21.176 1.00 70.41 N ATOM 151 CA GLY A 9 8.597 -2.257 -21.809 1.00 72.33 C ATOM 152 C GLY A 9 9.494 -3.021 -20.823 1.00 3.13 C ATOM 153 O GLY A 9 10.338 -3.812 -21.257 1.00 23.45 O ATOM 0 H GLY A 9 7.099 -1.699 -20.435 1.00 70.41 H new ATOM 0 HA2 GLY A 9 8.015 -2.977 -22.384 1.00 72.33 H new ATOM 0 HA3 GLY A 9 9.230 -1.721 -22.517 1.00 72.33 H new ATOM 157 N ILE A 10 9.343 -2.793 -19.496 1.00 12.30 N ATOM 158 CA ILE A 10 10.058 -3.602 -18.474 1.00 73.44 C ATOM 159 C ILE A 10 9.327 -4.952 -18.262 1.00 21.32 C ATOM 160 O ILE A 10 8.493 -5.117 -17.372 1.00 2.41 O ATOM 161 CB ILE A 10 10.275 -2.835 -17.103 1.00 64.05 C ATOM 162 CG1 ILE A 10 11.176 -1.573 -17.313 1.00 22.44 C ATOM 163 CG2 ILE A 10 10.888 -3.764 -16.014 1.00 63.20 C ATOM 164 CD1 ILE A 10 11.565 -0.830 -16.034 1.00 5.33 C ATOM 0 H ILE A 10 8.741 -2.066 -19.110 1.00 12.30 H new ATOM 0 HA ILE A 10 11.059 -3.794 -18.859 1.00 73.44 H new ATOM 0 HB ILE A 10 9.295 -2.513 -16.751 1.00 64.05 H new ATOM 0 HG12 ILE A 10 12.087 -1.878 -17.828 1.00 22.44 H new ATOM 0 HG13 ILE A 10 10.654 -0.880 -17.972 1.00 22.44 H new ATOM 0 HG21 ILE A 10 11.022 -3.202 -15.090 1.00 63.20 H new ATOM 0 HG22 ILE A 10 10.218 -4.605 -15.834 1.00 63.20 H new ATOM 0 HG23 ILE A 10 11.854 -4.136 -16.355 1.00 63.20 H new ATOM 0 HD11 ILE A 10 12.188 0.028 -16.287 1.00 5.33 H new ATOM 0 HD12 ILE A 10 10.665 -0.487 -15.525 1.00 5.33 H new ATOM 0 HD13 ILE A 10 12.120 -1.501 -15.378 1.00 5.33 H new ATOM 176 N LYS A 11 9.617 -5.897 -19.157 1.00 54.54 N ATOM 177 CA LYS A 11 9.136 -7.295 -19.068 1.00 44.44 C ATOM 178 C LYS A 11 10.304 -8.236 -18.667 1.00 61.21 C ATOM 179 O LYS A 11 10.197 -9.465 -18.735 1.00 31.04 O ATOM 180 CB LYS A 11 8.475 -7.690 -20.420 1.00 63.32 C ATOM 181 CG LYS A 11 7.257 -6.799 -20.782 1.00 72.33 C ATOM 182 CD LYS A 11 6.578 -7.192 -22.114 1.00 13.45 C ATOM 183 CE LYS A 11 5.326 -6.341 -22.408 1.00 55.20 C ATOM 184 NZ LYS A 11 4.642 -6.757 -23.658 1.00 34.55 N ATOM 0 H LYS A 11 10.198 -5.721 -19.977 1.00 54.54 H new ATOM 0 HA LYS A 11 8.379 -7.392 -18.290 1.00 44.44 H new ATOM 0 HB2 LYS A 11 9.218 -7.621 -21.215 1.00 63.32 H new ATOM 0 HB3 LYS A 11 8.155 -8.731 -20.371 1.00 63.32 H new ATOM 0 HG2 LYS A 11 6.523 -6.857 -19.978 1.00 72.33 H new ATOM 0 HG3 LYS A 11 7.582 -5.760 -20.842 1.00 72.33 H new ATOM 0 HD2 LYS A 11 7.292 -7.078 -22.930 1.00 13.45 H new ATOM 0 HD3 LYS A 11 6.299 -8.245 -22.080 1.00 13.45 H new ATOM 0 HE2 LYS A 11 4.631 -6.421 -21.572 1.00 55.20 H new ATOM 0 HE3 LYS A 11 5.612 -5.292 -22.485 1.00 55.20 H new ATOM 0 HZ1 LYS A 11 3.807 -6.157 -23.813 1.00 34.55 H new ATOM 0 HZ2 LYS A 11 5.295 -6.656 -24.461 1.00 34.55 H new ATOM 0 HZ3 LYS A 11 4.344 -7.750 -23.577 1.00 34.55 H new ATOM 198 N ASP A 12 11.412 -7.616 -18.213 1.00 50.44 N ATOM 199 CA ASP A 12 12.580 -8.303 -17.661 1.00 72.10 C ATOM 200 C ASP A 12 12.328 -8.606 -16.163 1.00 1.21 C ATOM 201 O ASP A 12 12.177 -7.680 -15.361 1.00 30.33 O ATOM 202 CB ASP A 12 13.827 -7.403 -17.851 1.00 73.14 C ATOM 203 CG ASP A 12 15.116 -8.052 -17.334 1.00 72.24 C ATOM 204 OD1 ASP A 12 15.779 -8.780 -18.105 1.00 72.24 O ATOM 205 OD2 ASP A 12 15.459 -7.858 -16.151 1.00 30.04 O ATOM 0 H ASP A 12 11.514 -6.601 -18.224 1.00 50.44 H new ATOM 0 HA ASP A 12 12.753 -9.247 -18.177 1.00 72.10 H new ATOM 0 HB2 ASP A 12 13.943 -7.170 -18.910 1.00 73.14 H new ATOM 0 HB3 ASP A 12 13.669 -6.458 -17.332 1.00 73.14 H new ATOM 210 N LYS A 13 12.278 -9.899 -15.797 1.00 75.12 N ATOM 211 CA LYS A 13 11.918 -10.340 -14.427 1.00 52.32 C ATOM 212 C LYS A 13 12.982 -10.001 -13.360 1.00 70.04 C ATOM 213 O LYS A 13 12.642 -9.891 -12.180 1.00 70.44 O ATOM 214 CB LYS A 13 11.574 -11.855 -14.419 1.00 71.11 C ATOM 215 CG LYS A 13 10.323 -12.218 -15.250 1.00 11.23 C ATOM 216 CD LYS A 13 9.054 -11.444 -14.801 1.00 14.25 C ATOM 217 CE LYS A 13 8.606 -11.776 -13.365 1.00 65.22 C ATOM 218 NZ LYS A 13 8.163 -13.186 -13.249 1.00 12.14 N ATOM 0 H LYS A 13 12.484 -10.668 -16.435 1.00 75.12 H new ATOM 0 HA LYS A 13 11.034 -9.769 -14.144 1.00 52.32 H new ATOM 0 HB2 LYS A 13 12.428 -12.413 -14.803 1.00 71.11 H new ATOM 0 HB3 LYS A 13 11.420 -12.177 -13.389 1.00 71.11 H new ATOM 0 HG2 LYS A 13 10.518 -12.007 -16.302 1.00 11.23 H new ATOM 0 HG3 LYS A 13 10.137 -13.289 -15.169 1.00 11.23 H new ATOM 0 HD2 LYS A 13 9.246 -10.374 -14.875 1.00 14.25 H new ATOM 0 HD3 LYS A 13 8.239 -11.669 -15.488 1.00 14.25 H new ATOM 0 HE2 LYS A 13 9.429 -11.594 -12.674 1.00 65.22 H new ATOM 0 HE3 LYS A 13 7.792 -11.112 -13.073 1.00 65.22 H new ATOM 0 HZ1 LYS A 13 7.804 -13.359 -12.288 1.00 12.14 H new ATOM 0 HZ2 LYS A 13 7.407 -13.370 -13.939 1.00 12.14 H new ATOM 0 HZ3 LYS A 13 8.966 -13.819 -13.438 1.00 12.14 H new ATOM 232 N ALA A 14 14.255 -9.831 -13.770 1.00 44.03 N ATOM 233 CA ALA A 14 15.340 -9.379 -12.856 1.00 22.52 C ATOM 234 C ALA A 14 15.120 -7.908 -12.414 1.00 63.35 C ATOM 235 O ALA A 14 15.485 -7.514 -11.296 1.00 34.25 O ATOM 236 CB ALA A 14 16.710 -9.553 -13.526 1.00 14.04 C ATOM 0 H ALA A 14 14.564 -9.998 -14.728 1.00 44.03 H new ATOM 0 HA ALA A 14 15.314 -10.000 -11.961 1.00 22.52 H new ATOM 0 HB1 ALA A 14 17.493 -9.218 -12.846 1.00 14.04 H new ATOM 0 HB2 ALA A 14 16.865 -10.604 -13.769 1.00 14.04 H new ATOM 0 HB3 ALA A 14 16.746 -8.960 -14.440 1.00 14.04 H new ATOM 242 N ALA A 15 14.505 -7.118 -13.309 1.00 44.23 N ATOM 243 CA ALA A 15 14.093 -5.727 -13.020 1.00 54.05 C ATOM 244 C ALA A 15 12.805 -5.705 -12.155 1.00 52.23 C ATOM 245 O ALA A 15 12.742 -5.021 -11.124 1.00 72.30 O ATOM 246 CB ALA A 15 13.876 -4.958 -14.334 1.00 22.34 C ATOM 0 H ALA A 15 14.277 -7.422 -14.256 1.00 44.23 H new ATOM 0 HA ALA A 15 14.887 -5.238 -12.456 1.00 54.05 H new ATOM 0 HB1 ALA A 15 13.573 -3.935 -14.111 1.00 22.34 H new ATOM 0 HB2 ALA A 15 14.804 -4.945 -14.906 1.00 22.34 H new ATOM 0 HB3 ALA A 15 13.097 -5.448 -14.918 1.00 22.34 H new ATOM 252 N ILE A 16 11.787 -6.471 -12.608 1.00 51.33 N ATOM 253 CA ILE A 16 10.465 -6.588 -11.943 1.00 31.15 C ATOM 254 C ILE A 16 10.564 -7.033 -10.464 1.00 34.12 C ATOM 255 O ILE A 16 9.908 -6.442 -9.607 1.00 52.54 O ATOM 256 CB ILE A 16 9.518 -7.566 -12.753 1.00 44.41 C ATOM 257 CG1 ILE A 16 9.142 -6.943 -14.135 1.00 12.43 C ATOM 258 CG2 ILE A 16 8.237 -7.955 -11.964 1.00 61.13 C ATOM 259 CD1 ILE A 16 8.350 -5.642 -14.038 1.00 14.52 C ATOM 0 H ILE A 16 11.859 -7.033 -13.456 1.00 51.33 H new ATOM 0 HA ILE A 16 10.033 -5.587 -11.939 1.00 31.15 H new ATOM 0 HB ILE A 16 10.079 -8.486 -12.914 1.00 44.41 H new ATOM 0 HG12 ILE A 16 10.056 -6.758 -14.699 1.00 12.43 H new ATOM 0 HG13 ILE A 16 8.559 -7.669 -14.702 1.00 12.43 H new ATOM 0 HG21 ILE A 16 7.627 -8.626 -12.569 1.00 61.13 H new ATOM 0 HG22 ILE A 16 8.518 -8.456 -11.038 1.00 61.13 H new ATOM 0 HG23 ILE A 16 7.666 -7.056 -11.731 1.00 61.13 H new ATOM 0 HD11 ILE A 16 8.129 -5.275 -15.040 1.00 14.52 H new ATOM 0 HD12 ILE A 16 7.417 -5.823 -13.504 1.00 14.52 H new ATOM 0 HD13 ILE A 16 8.937 -4.898 -13.500 1.00 14.52 H new ATOM 271 N LYS A 17 11.388 -8.058 -10.170 1.00 74.41 N ATOM 272 CA LYS A 17 11.518 -8.593 -8.787 1.00 2.11 C ATOM 273 C LYS A 17 12.048 -7.524 -7.799 1.00 43.41 C ATOM 274 O LYS A 17 11.576 -7.451 -6.661 1.00 44.25 O ATOM 275 CB LYS A 17 12.399 -9.873 -8.739 1.00 72.43 C ATOM 276 CG LYS A 17 13.863 -9.686 -9.200 1.00 11.20 C ATOM 277 CD LYS A 17 14.729 -10.975 -9.098 1.00 64.42 C ATOM 278 CE LYS A 17 14.241 -12.142 -9.994 1.00 2.14 C ATOM 279 NZ LYS A 17 13.092 -12.891 -9.408 1.00 50.34 N ATOM 0 H LYS A 17 11.971 -8.533 -10.859 1.00 74.41 H new ATOM 0 HA LYS A 17 10.513 -8.870 -8.468 1.00 2.11 H new ATOM 0 HB2 LYS A 17 12.403 -10.253 -7.717 1.00 72.43 H new ATOM 0 HB3 LYS A 17 11.934 -10.637 -9.362 1.00 72.43 H new ATOM 0 HG2 LYS A 17 13.866 -9.340 -10.233 1.00 11.20 H new ATOM 0 HG3 LYS A 17 14.325 -8.902 -8.600 1.00 11.20 H new ATOM 0 HD2 LYS A 17 15.757 -10.731 -9.367 1.00 64.42 H new ATOM 0 HD3 LYS A 17 14.742 -11.309 -8.061 1.00 64.42 H new ATOM 0 HE2 LYS A 17 13.951 -11.747 -10.968 1.00 2.14 H new ATOM 0 HE3 LYS A 17 15.068 -12.832 -10.163 1.00 2.14 H new ATOM 0 HZ1 LYS A 17 13.295 -13.911 -9.429 1.00 50.34 H new ATOM 0 HZ2 LYS A 17 12.945 -12.587 -8.424 1.00 50.34 H new ATOM 0 HZ3 LYS A 17 12.233 -12.698 -9.962 1.00 50.34 H new ATOM 293 N THR A 18 13.019 -6.693 -8.241 1.00 53.41 N ATOM 294 CA THR A 18 13.528 -5.541 -7.456 1.00 75.53 C ATOM 295 C THR A 18 12.428 -4.487 -7.192 1.00 24.54 C ATOM 296 O THR A 18 12.341 -3.935 -6.093 1.00 32.00 O ATOM 297 CB THR A 18 14.720 -4.854 -8.210 1.00 61.31 C ATOM 298 OG1 THR A 18 15.732 -5.833 -8.510 1.00 20.20 O ATOM 299 CG2 THR A 18 15.350 -3.694 -7.403 1.00 41.35 C ATOM 0 H THR A 18 13.472 -6.800 -9.149 1.00 53.41 H new ATOM 0 HA THR A 18 13.865 -5.934 -6.497 1.00 75.53 H new ATOM 0 HB THR A 18 14.315 -4.428 -9.128 1.00 61.31 H new ATOM 0 HG1 THR A 18 15.531 -6.258 -9.370 1.00 20.20 H new ATOM 0 HG21 THR A 18 16.169 -3.257 -7.974 1.00 41.35 H new ATOM 0 HG22 THR A 18 14.594 -2.932 -7.211 1.00 41.35 H new ATOM 0 HG23 THR A 18 15.731 -4.075 -6.455 1.00 41.35 H new ATOM 307 N LEU A 19 11.601 -4.220 -8.223 1.00 74.40 N ATOM 308 CA LEU A 19 10.476 -3.258 -8.138 1.00 73.03 C ATOM 309 C LEU A 19 9.439 -3.705 -7.076 1.00 11.31 C ATOM 310 O LEU A 19 8.965 -2.903 -6.271 1.00 14.05 O ATOM 311 CB LEU A 19 9.774 -3.134 -9.517 1.00 55.10 C ATOM 312 CG LEU A 19 8.712 -1.996 -9.626 1.00 62.10 C ATOM 313 CD1 LEU A 19 9.382 -0.612 -9.693 1.00 0.44 C ATOM 314 CD2 LEU A 19 7.749 -2.223 -10.804 1.00 42.03 C ATOM 0 H LEU A 19 11.691 -4.663 -9.138 1.00 74.40 H new ATOM 0 HA LEU A 19 10.885 -2.291 -7.844 1.00 73.03 H new ATOM 0 HB2 LEU A 19 10.535 -2.972 -10.280 1.00 55.10 H new ATOM 0 HB3 LEU A 19 9.290 -4.083 -9.746 1.00 55.10 H new ATOM 0 HG LEU A 19 8.110 -2.023 -8.718 1.00 62.10 H new ATOM 0 HD11 LEU A 19 8.616 0.160 -9.768 1.00 0.44 H new ATOM 0 HD12 LEU A 19 9.973 -0.450 -8.792 1.00 0.44 H new ATOM 0 HD13 LEU A 19 10.032 -0.564 -10.567 1.00 0.44 H new ATOM 0 HD21 LEU A 19 7.026 -1.409 -10.845 1.00 42.03 H new ATOM 0 HD22 LEU A 19 8.314 -2.253 -11.735 1.00 42.03 H new ATOM 0 HD23 LEU A 19 7.224 -3.168 -10.668 1.00 42.03 H new ATOM 326 N ILE A 20 9.119 -5.010 -7.114 1.00 61.20 N ATOM 327 CA ILE A 20 8.205 -5.681 -6.162 1.00 52.11 C ATOM 328 C ILE A 20 8.770 -5.636 -4.717 1.00 3.43 C ATOM 329 O ILE A 20 8.028 -5.378 -3.762 1.00 43.33 O ATOM 330 CB ILE A 20 7.958 -7.174 -6.631 1.00 64.12 C ATOM 331 CG1 ILE A 20 7.215 -7.191 -8.002 1.00 72.44 C ATOM 332 CG2 ILE A 20 7.189 -8.015 -5.583 1.00 61.31 C ATOM 333 CD1 ILE A 20 6.957 -8.566 -8.588 1.00 65.41 C ATOM 0 H ILE A 20 9.494 -5.644 -7.820 1.00 61.20 H new ATOM 0 HA ILE A 20 7.253 -5.150 -6.153 1.00 52.11 H new ATOM 0 HB ILE A 20 8.937 -7.639 -6.743 1.00 64.12 H new ATOM 0 HG12 ILE A 20 6.259 -6.680 -7.884 1.00 72.44 H new ATOM 0 HG13 ILE A 20 7.799 -6.613 -8.719 1.00 72.44 H new ATOM 0 HG21 ILE A 20 7.050 -9.028 -5.961 1.00 61.31 H new ATOM 0 HG22 ILE A 20 7.759 -8.049 -4.654 1.00 61.31 H new ATOM 0 HG23 ILE A 20 6.216 -7.561 -5.395 1.00 61.31 H new ATOM 0 HD11 ILE A 20 6.436 -8.464 -9.540 1.00 65.41 H new ATOM 0 HD12 ILE A 20 7.906 -9.078 -8.747 1.00 65.41 H new ATOM 0 HD13 ILE A 20 6.343 -9.146 -7.899 1.00 65.41 H new ATOM 345 N SER A 21 10.095 -5.860 -4.587 1.00 32.31 N ATOM 346 CA SER A 21 10.807 -5.821 -3.283 1.00 44.23 C ATOM 347 C SER A 21 10.740 -4.413 -2.649 1.00 4.31 C ATOM 348 O SER A 21 10.333 -4.273 -1.496 1.00 54.25 O ATOM 349 CB SER A 21 12.286 -6.264 -3.443 1.00 14.55 C ATOM 350 OG SER A 21 12.387 -7.608 -3.894 1.00 14.33 O ATOM 0 H SER A 21 10.703 -6.073 -5.378 1.00 32.31 H new ATOM 0 HA SER A 21 10.304 -6.522 -2.616 1.00 44.23 H new ATOM 0 HB2 SER A 21 12.789 -5.604 -4.150 1.00 14.55 H new ATOM 0 HB3 SER A 21 12.802 -6.161 -2.488 1.00 14.55 H new ATOM 0 HG SER A 21 12.141 -7.654 -4.842 1.00 14.33 H new ATOM 356 N ALA A 22 11.143 -3.372 -3.415 1.00 64.34 N ATOM 357 CA ALA A 22 11.068 -1.953 -2.983 1.00 52.31 C ATOM 358 C ALA A 22 9.622 -1.507 -2.660 1.00 42.24 C ATOM 359 O ALA A 22 9.402 -0.742 -1.710 1.00 72.45 O ATOM 360 CB ALA A 22 11.687 -1.043 -4.065 1.00 3.35 C ATOM 0 H ALA A 22 11.530 -3.491 -4.351 1.00 64.34 H new ATOM 0 HA ALA A 22 11.638 -1.861 -2.058 1.00 52.31 H new ATOM 0 HB1 ALA A 22 11.629 -0.003 -3.743 1.00 3.35 H new ATOM 0 HB2 ALA A 22 12.731 -1.318 -4.218 1.00 3.35 H new ATOM 0 HB3 ALA A 22 11.139 -1.164 -4.999 1.00 3.35 H new ATOM 366 N ALA A 23 8.649 -1.985 -3.469 1.00 13.15 N ATOM 367 CA ALA A 23 7.207 -1.770 -3.214 1.00 42.21 C ATOM 368 C ALA A 23 6.804 -2.257 -1.791 1.00 10.44 C ATOM 369 O ALA A 23 6.071 -1.571 -1.073 1.00 23.34 O ATOM 370 CB ALA A 23 6.364 -2.478 -4.287 1.00 33.25 C ATOM 0 H ALA A 23 8.840 -2.527 -4.312 1.00 13.15 H new ATOM 0 HA ALA A 23 7.012 -0.699 -3.265 1.00 42.21 H new ATOM 0 HB1 ALA A 23 5.306 -2.311 -4.087 1.00 33.25 H new ATOM 0 HB2 ALA A 23 6.615 -2.078 -5.269 1.00 33.25 H new ATOM 0 HB3 ALA A 23 6.573 -3.548 -4.267 1.00 33.25 H new ATOM 376 N TYR A 24 7.323 -3.440 -1.397 1.00 14.41 N ATOM 377 CA TYR A 24 7.128 -4.002 -0.039 1.00 22.11 C ATOM 378 C TYR A 24 7.823 -3.150 1.044 1.00 3.04 C ATOM 379 O TYR A 24 7.235 -2.874 2.092 1.00 21.03 O ATOM 380 CB TYR A 24 7.670 -5.449 0.049 1.00 43.30 C ATOM 381 CG TYR A 24 6.934 -6.492 -0.803 1.00 0.03 C ATOM 382 CD1 TYR A 24 5.544 -6.503 -0.897 1.00 11.14 C ATOM 383 CD2 TYR A 24 7.633 -7.498 -1.475 1.00 44.24 C ATOM 384 CE1 TYR A 24 4.882 -7.471 -1.624 1.00 64.03 C ATOM 385 CE2 TYR A 24 6.973 -8.461 -2.203 1.00 51.24 C ATOM 386 CZ TYR A 24 5.599 -8.444 -2.279 1.00 35.30 C ATOM 387 OH TYR A 24 4.943 -9.412 -3.009 1.00 4.45 O ATOM 0 H TYR A 24 7.887 -4.032 -2.007 1.00 14.41 H new ATOM 0 HA TYR A 24 6.053 -3.998 0.142 1.00 22.11 H new ATOM 0 HB2 TYR A 24 8.719 -5.442 -0.246 1.00 43.30 H new ATOM 0 HB3 TYR A 24 7.634 -5.768 1.091 1.00 43.30 H new ATOM 0 HD1 TYR A 24 4.973 -5.739 -0.391 1.00 11.14 H new ATOM 0 HD2 TYR A 24 8.711 -7.520 -1.422 1.00 44.24 H new ATOM 0 HE1 TYR A 24 3.803 -7.464 -1.678 1.00 64.03 H new ATOM 0 HE2 TYR A 24 7.533 -9.230 -2.715 1.00 51.24 H new ATOM 0 HH TYR A 24 4.332 -9.906 -2.423 1.00 4.45 H new ATOM 397 N ARG A 25 9.074 -2.715 0.772 1.00 54.22 N ATOM 398 CA ARG A 25 9.912 -1.972 1.751 1.00 52.52 C ATOM 399 C ARG A 25 9.352 -0.553 2.050 1.00 43.15 C ATOM 400 O ARG A 25 9.819 0.121 2.970 1.00 42.22 O ATOM 401 CB ARG A 25 11.375 -1.897 1.234 1.00 11.12 C ATOM 402 CG ARG A 25 12.031 -3.283 1.033 1.00 34.24 C ATOM 403 CD ARG A 25 13.408 -3.228 0.339 1.00 55.44 C ATOM 404 NE ARG A 25 14.468 -2.651 1.197 1.00 32.15 N ATOM 405 CZ ARG A 25 15.653 -3.203 1.427 1.00 2.34 C ATOM 406 NH1 ARG A 25 15.952 -4.378 0.958 1.00 41.21 N ATOM 407 NH2 ARG A 25 16.526 -2.576 2.147 1.00 33.00 N ATOM 0 H ARG A 25 9.533 -2.866 -0.126 1.00 54.22 H new ATOM 0 HA ARG A 25 9.891 -2.517 2.695 1.00 52.52 H new ATOM 0 HB2 ARG A 25 11.390 -1.356 0.288 1.00 11.12 H new ATOM 0 HB3 ARG A 25 11.972 -1.320 1.940 1.00 11.12 H new ATOM 0 HG2 ARG A 25 12.143 -3.765 2.004 1.00 34.24 H new ATOM 0 HG3 ARG A 25 11.362 -3.909 0.442 1.00 34.24 H new ATOM 0 HD2 ARG A 25 13.698 -4.235 0.041 1.00 55.44 H new ATOM 0 HD3 ARG A 25 13.325 -2.637 -0.573 1.00 55.44 H new ATOM 0 HE ARG A 25 14.272 -1.757 1.648 1.00 32.15 H new ATOM 0 HH11 ARG A 25 15.270 -4.894 0.402 1.00 41.21 H new ATOM 0 HH12 ARG A 25 16.868 -4.784 1.146 1.00 41.21 H new ATOM 0 HH21 ARG A 25 16.303 -1.660 2.536 1.00 33.00 H new ATOM 0 HH22 ARG A 25 17.437 -2.998 2.325 1.00 33.00 H new ATOM 421 N GLN A 26 8.401 -0.084 1.229 1.00 60.20 N ATOM 422 CA GLN A 26 7.638 1.150 1.511 1.00 31.53 C ATOM 423 C GLN A 26 6.362 0.849 2.327 1.00 14.44 C ATOM 424 O GLN A 26 6.242 1.280 3.474 1.00 43.32 O ATOM 425 CB GLN A 26 7.315 1.904 0.188 1.00 71.14 C ATOM 426 CG GLN A 26 8.534 2.611 -0.439 1.00 3.40 C ATOM 427 CD GLN A 26 9.127 3.675 0.494 1.00 1.35 C ATOM 428 OE1 GLN A 26 8.737 4.835 0.461 1.00 5.40 O ATOM 429 NE2 GLN A 26 10.033 3.280 1.375 1.00 34.03 N ATOM 0 H GLN A 26 8.137 -0.542 0.357 1.00 60.20 H new ATOM 0 HA GLN A 26 8.258 1.803 2.125 1.00 31.53 H new ATOM 0 HB2 GLN A 26 6.907 1.195 -0.533 1.00 71.14 H new ATOM 0 HB3 GLN A 26 6.538 2.643 0.382 1.00 71.14 H new ATOM 0 HG2 GLN A 26 9.299 1.872 -0.677 1.00 3.40 H new ATOM 0 HG3 GLN A 26 8.238 3.078 -1.379 1.00 3.40 H new ATOM 0 HE21 GLN A 26 10.344 2.309 1.386 1.00 34.03 H new ATOM 0 HE22 GLN A 26 10.419 3.947 2.043 1.00 34.03 H new ATOM 438 N ILE A 27 5.433 0.071 1.744 1.00 21.42 N ATOM 439 CA ILE A 27 4.105 -0.195 2.362 1.00 51.53 C ATOM 440 C ILE A 27 4.264 -0.998 3.683 1.00 1.01 C ATOM 441 O ILE A 27 3.873 -0.531 4.760 1.00 64.21 O ATOM 442 CB ILE A 27 3.108 -0.921 1.354 1.00 2.52 C ATOM 443 CG1 ILE A 27 2.635 0.041 0.203 1.00 41.54 C ATOM 444 CG2 ILE A 27 1.874 -1.509 2.093 1.00 24.35 C ATOM 445 CD1 ILE A 27 3.714 0.546 -0.734 1.00 21.14 C ATOM 0 H ILE A 27 5.570 -0.389 0.844 1.00 21.42 H new ATOM 0 HA ILE A 27 3.657 0.769 2.602 1.00 51.53 H new ATOM 0 HB ILE A 27 3.667 -1.742 0.905 1.00 2.52 H new ATOM 0 HG12 ILE A 27 1.882 -0.479 -0.390 1.00 41.54 H new ATOM 0 HG13 ILE A 27 2.145 0.902 0.657 1.00 41.54 H new ATOM 0 HG21 ILE A 27 1.217 -1.996 1.373 1.00 24.35 H new ATOM 0 HG22 ILE A 27 2.206 -2.238 2.832 1.00 24.35 H new ATOM 0 HG23 ILE A 27 1.333 -0.706 2.593 1.00 24.35 H new ATOM 0 HD11 ILE A 27 3.268 1.199 -1.484 1.00 21.14 H new ATOM 0 HD12 ILE A 27 4.459 1.102 -0.165 1.00 21.14 H new ATOM 0 HD13 ILE A 27 4.192 -0.300 -1.228 1.00 21.14 H new ATOM 457 N PHE A 28 4.891 -2.174 3.586 1.00 64.13 N ATOM 458 CA PHE A 28 5.102 -3.080 4.738 1.00 74.42 C ATOM 459 C PHE A 28 6.348 -2.686 5.575 1.00 65.31 C ATOM 460 O PHE A 28 6.503 -3.177 6.693 1.00 22.32 O ATOM 461 CB PHE A 28 5.269 -4.545 4.253 1.00 75.01 C ATOM 462 CG PHE A 28 4.091 -5.095 3.462 1.00 23.43 C ATOM 463 CD1 PHE A 28 3.033 -5.733 4.103 1.00 70.34 C ATOM 464 CD2 PHE A 28 4.049 -4.986 2.078 1.00 75.24 C ATOM 465 CE1 PHE A 28 1.975 -6.244 3.380 1.00 50.41 C ATOM 466 CE2 PHE A 28 2.992 -5.501 1.361 1.00 2.31 C ATOM 467 CZ PHE A 28 1.955 -6.127 2.011 1.00 31.41 C ATOM 0 H PHE A 28 5.270 -2.532 2.709 1.00 64.13 H new ATOM 0 HA PHE A 28 4.219 -2.990 5.371 1.00 74.42 H new ATOM 0 HB2 PHE A 28 6.164 -4.608 3.635 1.00 75.01 H new ATOM 0 HB3 PHE A 28 5.435 -5.183 5.121 1.00 75.01 H new ATOM 0 HD1 PHE A 28 3.040 -5.829 5.179 1.00 70.34 H new ATOM 0 HD2 PHE A 28 4.856 -4.491 1.557 1.00 75.24 H new ATOM 0 HE1 PHE A 28 1.161 -6.737 3.891 1.00 50.41 H new ATOM 0 HE2 PHE A 28 2.978 -5.413 0.285 1.00 2.31 H new ATOM 0 HZ PHE A 28 1.126 -6.526 1.446 1.00 31.41 H new ATOM 477 N GLU A 29 7.213 -1.787 5.027 1.00 11.04 N ATOM 478 CA GLU A 29 8.584 -1.467 5.553 1.00 12.53 C ATOM 479 C GLU A 29 9.587 -2.650 5.471 1.00 30.51 C ATOM 480 O GLU A 29 10.702 -2.498 4.947 1.00 55.11 O ATOM 481 CB GLU A 29 8.544 -0.861 6.990 1.00 41.04 C ATOM 482 CG GLU A 29 7.959 0.566 7.076 1.00 72.44 C ATOM 483 CD GLU A 29 8.810 1.628 6.355 1.00 31.14 C ATOM 484 OE1 GLU A 29 9.970 1.849 6.766 1.00 4.23 O ATOM 485 OE2 GLU A 29 8.318 2.274 5.410 1.00 43.42 O ATOM 0 H GLU A 29 6.978 -1.251 4.191 1.00 11.04 H new ATOM 0 HA GLU A 29 8.965 -0.702 4.877 1.00 12.53 H new ATOM 0 HB2 GLU A 29 7.956 -1.519 7.630 1.00 41.04 H new ATOM 0 HB3 GLU A 29 9.557 -0.848 7.392 1.00 41.04 H new ATOM 0 HG2 GLU A 29 6.956 0.565 6.648 1.00 72.44 H new ATOM 0 HG3 GLU A 29 7.858 0.845 8.125 1.00 72.44 H new ATOM 492 N ARG A 30 9.198 -3.798 6.024 1.00 40.43 N ATOM 493 CA ARG A 30 9.971 -5.057 5.957 1.00 64.01 C ATOM 494 C ARG A 30 10.259 -5.516 4.502 1.00 5.43 C ATOM 495 O ARG A 30 9.355 -5.584 3.653 1.00 12.14 O ATOM 496 CB ARG A 30 9.214 -6.180 6.724 1.00 11.30 C ATOM 497 CG ARG A 30 7.722 -6.321 6.336 1.00 71.32 C ATOM 498 CD ARG A 30 7.069 -7.603 6.878 1.00 64.34 C ATOM 499 NE ARG A 30 7.193 -7.734 8.343 1.00 55.35 N ATOM 500 CZ ARG A 30 6.920 -8.821 9.034 1.00 14.23 C ATOM 501 NH1 ARG A 30 6.506 -9.903 8.464 1.00 52.50 N ATOM 502 NH2 ARG A 30 7.082 -8.816 10.303 1.00 11.35 N ATOM 0 H ARG A 30 8.324 -3.891 6.542 1.00 40.43 H new ATOM 0 HA ARG A 30 10.936 -4.863 6.425 1.00 64.01 H new ATOM 0 HB2 ARG A 30 9.716 -7.130 6.542 1.00 11.30 H new ATOM 0 HB3 ARG A 30 9.282 -5.983 7.794 1.00 11.30 H new ATOM 0 HG2 ARG A 30 7.174 -5.457 6.710 1.00 71.32 H new ATOM 0 HG3 ARG A 30 7.634 -6.308 5.250 1.00 71.32 H new ATOM 0 HD2 ARG A 30 6.014 -7.611 6.605 1.00 64.34 H new ATOM 0 HD3 ARG A 30 7.528 -8.469 6.400 1.00 64.34 H new ATOM 0 HE ARG A 30 7.516 -6.917 8.861 1.00 55.35 H new ATOM 0 HH11 ARG A 30 6.382 -9.931 7.452 1.00 52.50 H new ATOM 0 HH12 ARG A 30 6.303 -10.730 9.026 1.00 52.50 H new ATOM 0 HH21 ARG A 30 7.420 -7.975 10.771 1.00 11.35 H new ATOM 0 HH22 ARG A 30 6.873 -9.653 10.847 1.00 11.35 H new ATOM 516 N ASP A 31 11.545 -5.797 4.237 1.00 23.10 N ATOM 517 CA ASP A 31 11.981 -6.475 3.010 1.00 75.14 C ATOM 518 C ASP A 31 11.459 -7.932 3.011 1.00 53.11 C ATOM 519 O ASP A 31 11.774 -8.713 3.925 1.00 62.41 O ATOM 520 CB ASP A 31 13.530 -6.427 2.894 1.00 50.21 C ATOM 521 CG ASP A 31 14.073 -7.070 1.602 1.00 63.22 C ATOM 522 OD1 ASP A 31 13.704 -6.607 0.499 1.00 34.34 O ATOM 523 OD2 ASP A 31 14.890 -8.014 1.679 1.00 0.21 O ATOM 0 H ASP A 31 12.310 -5.560 4.869 1.00 23.10 H new ATOM 0 HA ASP A 31 11.568 -5.963 2.141 1.00 75.14 H new ATOM 0 HB2 ASP A 31 13.857 -5.388 2.938 1.00 50.21 H new ATOM 0 HB3 ASP A 31 13.966 -6.935 3.754 1.00 50.21 H new ATOM 528 N ILE A 32 10.654 -8.288 1.998 1.00 42.13 N ATOM 529 CA ILE A 32 10.021 -9.619 1.906 1.00 63.04 C ATOM 530 C ILE A 32 10.920 -10.557 1.074 1.00 71.04 C ATOM 531 O ILE A 32 11.298 -10.215 -0.054 1.00 3.11 O ATOM 532 CB ILE A 32 8.587 -9.532 1.248 1.00 14.35 C ATOM 533 CG1 ILE A 32 7.641 -8.595 2.071 1.00 70.20 C ATOM 534 CG2 ILE A 32 7.944 -10.935 1.058 1.00 4.30 C ATOM 535 CD1 ILE A 32 7.112 -9.179 3.367 1.00 74.44 C ATOM 0 H ILE A 32 10.423 -7.668 1.222 1.00 42.13 H new ATOM 0 HA ILE A 32 9.904 -10.013 2.916 1.00 63.04 H new ATOM 0 HB ILE A 32 8.720 -9.098 0.257 1.00 14.35 H new ATOM 0 HG12 ILE A 32 8.179 -7.675 2.300 1.00 70.20 H new ATOM 0 HG13 ILE A 32 6.793 -8.321 1.443 1.00 70.20 H new ATOM 0 HG21 ILE A 32 6.960 -10.825 0.603 1.00 4.30 H new ATOM 0 HG22 ILE A 32 8.578 -11.541 0.411 1.00 4.30 H new ATOM 0 HG23 ILE A 32 7.843 -11.423 2.027 1.00 4.30 H new ATOM 0 HD11 ILE A 32 6.468 -8.450 3.859 1.00 74.44 H new ATOM 0 HD12 ILE A 32 6.540 -10.082 3.153 1.00 74.44 H new ATOM 0 HD13 ILE A 32 7.947 -9.426 4.023 1.00 74.44 H new ATOM 547 N ALA A 33 11.251 -11.728 1.648 1.00 24.52 N ATOM 548 CA ALA A 33 12.034 -12.770 0.954 1.00 42.24 C ATOM 549 C ALA A 33 11.244 -13.297 -0.277 1.00 62.45 C ATOM 550 O ALA A 33 10.046 -13.555 -0.150 1.00 44.23 O ATOM 551 CB ALA A 33 12.370 -13.908 1.920 1.00 22.52 C ATOM 0 H ALA A 33 10.986 -11.979 2.600 1.00 24.52 H new ATOM 0 HA ALA A 33 12.970 -12.339 0.600 1.00 42.24 H new ATOM 0 HB1 ALA A 33 12.947 -14.670 1.397 1.00 22.52 H new ATOM 0 HB2 ALA A 33 12.955 -13.518 2.753 1.00 22.52 H new ATOM 0 HB3 ALA A 33 11.448 -14.348 2.299 1.00 22.52 H new ATOM 557 N PRO A 34 11.901 -13.468 -1.478 1.00 24.31 N ATOM 558 CA PRO A 34 11.196 -13.733 -2.774 1.00 73.12 C ATOM 559 C PRO A 34 10.242 -14.957 -2.739 1.00 72.24 C ATOM 560 O PRO A 34 9.184 -14.924 -3.363 1.00 24.14 O ATOM 561 CB PRO A 34 12.359 -13.945 -3.795 1.00 74.13 C ATOM 562 CG PRO A 34 13.561 -14.234 -2.946 1.00 53.33 C ATOM 563 CD PRO A 34 13.373 -13.424 -1.684 1.00 2.34 C ATOM 0 HA PRO A 34 10.533 -12.907 -3.032 1.00 73.12 H new ATOM 0 HB2 PRO A 34 12.145 -14.771 -4.473 1.00 74.13 H new ATOM 0 HB3 PRO A 34 12.512 -13.059 -4.411 1.00 74.13 H new ATOM 0 HG2 PRO A 34 13.635 -15.298 -2.721 1.00 53.33 H new ATOM 0 HG3 PRO A 34 14.480 -13.952 -3.459 1.00 53.33 H new ATOM 0 HD2 PRO A 34 13.912 -13.857 -0.842 1.00 2.34 H new ATOM 0 HD3 PRO A 34 13.734 -12.402 -1.802 1.00 2.34 H new ATOM 571 N TYR A 35 10.615 -16.015 -1.982 1.00 50.10 N ATOM 572 CA TYR A 35 9.769 -17.226 -1.832 1.00 21.52 C ATOM 573 C TYR A 35 8.495 -16.928 -0.998 1.00 23.52 C ATOM 574 O TYR A 35 7.408 -17.416 -1.330 1.00 73.03 O ATOM 575 CB TYR A 35 10.573 -18.419 -1.236 1.00 71.43 C ATOM 576 CG TYR A 35 11.154 -18.213 0.180 1.00 5.13 C ATOM 577 CD1 TYR A 35 12.362 -17.537 0.378 1.00 22.32 C ATOM 578 CD2 TYR A 35 10.504 -18.719 1.316 1.00 12.42 C ATOM 579 CE1 TYR A 35 12.888 -17.371 1.645 1.00 42.11 C ATOM 580 CE2 TYR A 35 11.031 -18.548 2.581 1.00 32.32 C ATOM 581 CZ TYR A 35 12.221 -17.876 2.740 1.00 75.11 C ATOM 582 OH TYR A 35 12.745 -17.702 4.003 1.00 42.21 O ATOM 0 H TYR A 35 11.494 -16.056 -1.466 1.00 50.10 H new ATOM 0 HA TYR A 35 9.446 -17.520 -2.831 1.00 21.52 H new ATOM 0 HB2 TYR A 35 9.923 -19.293 -1.215 1.00 71.43 H new ATOM 0 HB3 TYR A 35 11.395 -18.650 -1.913 1.00 71.43 H new ATOM 0 HD1 TYR A 35 12.893 -17.138 -0.474 1.00 22.32 H new ATOM 0 HD2 TYR A 35 9.573 -19.253 1.199 1.00 12.42 H new ATOM 0 HE1 TYR A 35 13.822 -16.845 1.777 1.00 42.11 H new ATOM 0 HE2 TYR A 35 10.511 -18.940 3.442 1.00 32.32 H new ATOM 0 HH TYR A 35 12.152 -18.117 4.663 1.00 42.21 H new ATOM 592 N ILE A 36 8.643 -16.094 0.062 1.00 71.10 N ATOM 593 CA ILE A 36 7.505 -15.620 0.904 1.00 14.13 C ATOM 594 C ILE A 36 6.524 -14.776 0.054 1.00 10.03 C ATOM 595 O ILE A 36 5.296 -14.921 0.160 1.00 20.42 O ATOM 596 CB ILE A 36 8.005 -14.776 2.146 1.00 42.13 C ATOM 597 CG1 ILE A 36 8.955 -15.636 3.039 1.00 2.22 C ATOM 598 CG2 ILE A 36 6.823 -14.211 2.981 1.00 42.01 C ATOM 599 CD1 ILE A 36 9.563 -14.917 4.237 1.00 0.41 C ATOM 0 H ILE A 36 9.548 -15.730 0.360 1.00 71.10 H new ATOM 0 HA ILE A 36 6.990 -16.502 1.284 1.00 14.13 H new ATOM 0 HB ILE A 36 8.561 -13.921 1.761 1.00 42.13 H new ATOM 0 HG12 ILE A 36 8.399 -16.501 3.401 1.00 2.22 H new ATOM 0 HG13 ILE A 36 9.765 -16.015 2.416 1.00 2.22 H new ATOM 0 HG21 ILE A 36 7.213 -13.639 3.823 1.00 42.01 H new ATOM 0 HG22 ILE A 36 6.212 -13.562 2.354 1.00 42.01 H new ATOM 0 HG23 ILE A 36 6.214 -15.035 3.353 1.00 42.01 H new ATOM 0 HD11 ILE A 36 10.205 -15.605 4.787 1.00 0.41 H new ATOM 0 HD12 ILE A 36 10.153 -14.069 3.891 1.00 0.41 H new ATOM 0 HD13 ILE A 36 8.767 -14.562 4.891 1.00 0.41 H new ATOM 611 N ALA A 37 7.104 -13.921 -0.803 1.00 2.24 N ATOM 612 CA ALA A 37 6.351 -13.075 -1.738 1.00 21.34 C ATOM 613 C ALA A 37 5.517 -13.917 -2.733 1.00 24.54 C ATOM 614 O ALA A 37 4.327 -13.726 -2.851 1.00 5.24 O ATOM 615 CB ALA A 37 7.309 -12.142 -2.499 1.00 41.31 C ATOM 0 H ALA A 37 8.115 -13.798 -0.866 1.00 2.24 H new ATOM 0 HA ALA A 37 5.654 -12.475 -1.153 1.00 21.34 H new ATOM 0 HB1 ALA A 37 6.739 -11.520 -3.189 1.00 41.31 H new ATOM 0 HB2 ALA A 37 7.838 -11.506 -1.789 1.00 41.31 H new ATOM 0 HB3 ALA A 37 8.030 -12.738 -3.059 1.00 41.31 H new ATOM 621 N GLN A 38 6.160 -14.864 -3.430 1.00 42.13 N ATOM 622 CA GLN A 38 5.515 -15.620 -4.536 1.00 13.42 C ATOM 623 C GLN A 38 4.587 -16.779 -4.083 1.00 3.23 C ATOM 624 O GLN A 38 3.891 -17.348 -4.924 1.00 62.04 O ATOM 625 CB GLN A 38 6.574 -16.117 -5.545 1.00 51.43 C ATOM 626 CG GLN A 38 7.614 -17.111 -4.995 1.00 32.45 C ATOM 627 CD GLN A 38 8.845 -17.267 -5.901 1.00 15.02 C ATOM 628 OE1 GLN A 38 9.233 -16.203 -6.600 1.00 70.21 O flip ATOM 629 NE2 GLN A 38 9.468 -18.324 -5.959 1.00 1.35 N flip ATOM 0 H GLN A 38 7.128 -15.132 -3.254 1.00 42.13 H new ATOM 0 HA GLN A 38 4.851 -14.907 -5.023 1.00 13.42 H new ATOM 0 HB2 GLN A 38 6.058 -16.587 -6.382 1.00 51.43 H new ATOM 0 HB3 GLN A 38 7.103 -15.251 -5.943 1.00 51.43 H new ATOM 0 HG2 GLN A 38 7.937 -16.779 -4.009 1.00 32.45 H new ATOM 0 HG3 GLN A 38 7.142 -18.085 -4.864 1.00 32.45 H new ATOM 0 HE21 GLN A 38 9.157 -19.130 -5.417 1.00 1.35 H new ATOM 0 HE22 GLN A 38 10.297 -18.396 -6.550 1.00 1.35 H new ATOM 638 N ASN A 39 4.595 -17.184 -2.790 1.00 11.33 N ATOM 639 CA ASN A 39 3.582 -18.168 -2.302 1.00 64.42 C ATOM 640 C ASN A 39 2.237 -17.458 -1.970 1.00 1.42 C ATOM 641 O ASN A 39 1.164 -17.928 -2.368 1.00 20.13 O ATOM 642 CB ASN A 39 4.092 -19.060 -1.123 1.00 50.12 C ATOM 643 CG ASN A 39 4.131 -18.385 0.244 1.00 33.33 C ATOM 644 OD1 ASN A 39 3.141 -18.360 0.959 1.00 33.40 O ATOM 645 ND2 ASN A 39 5.271 -17.885 0.648 1.00 43.34 N ATOM 0 H ASN A 39 5.260 -16.864 -2.086 1.00 11.33 H new ATOM 0 HA ASN A 39 3.403 -18.864 -3.121 1.00 64.42 H new ATOM 0 HB2 ASN A 39 3.454 -19.941 -1.055 1.00 50.12 H new ATOM 0 HB3 ASN A 39 5.095 -19.411 -1.364 1.00 50.12 H new ATOM 0 HD21 ASN A 39 5.344 -17.465 1.575 1.00 43.34 H new ATOM 0 HD22 ASN A 39 6.087 -17.915 0.036 1.00 43.34 H new ATOM 652 N GLU A 40 2.319 -16.304 -1.261 1.00 2.43 N ATOM 653 CA GLU A 40 1.135 -15.510 -0.831 1.00 53.40 C ATOM 654 C GLU A 40 0.613 -14.600 -1.972 1.00 74.14 C ATOM 655 O GLU A 40 -0.587 -14.543 -2.250 1.00 12.25 O ATOM 656 CB GLU A 40 1.498 -14.640 0.408 1.00 34.34 C ATOM 657 CG GLU A 40 1.905 -15.448 1.658 1.00 60.15 C ATOM 658 CD GLU A 40 2.172 -14.568 2.889 1.00 42.24 C ATOM 659 OE1 GLU A 40 1.194 -14.100 3.516 1.00 52.52 O ATOM 660 OE2 GLU A 40 3.347 -14.335 3.235 1.00 63.53 O ATOM 0 H GLU A 40 3.207 -15.896 -0.970 1.00 2.43 H new ATOM 0 HA GLU A 40 0.343 -16.212 -0.569 1.00 53.40 H new ATOM 0 HB2 GLU A 40 2.316 -13.972 0.140 1.00 34.34 H new ATOM 0 HB3 GLU A 40 0.643 -14.012 0.659 1.00 34.34 H new ATOM 0 HG2 GLU A 40 1.115 -16.161 1.894 1.00 60.15 H new ATOM 0 HG3 GLU A 40 2.801 -16.027 1.432 1.00 60.15 H new ATOM 667 N PHE A 41 1.549 -13.906 -2.629 1.00 64.44 N ATOM 668 CA PHE A 41 1.272 -12.937 -3.718 1.00 1.01 C ATOM 669 C PHE A 41 1.668 -13.560 -5.091 1.00 54.11 C ATOM 670 O PHE A 41 2.274 -12.893 -5.922 1.00 44.33 O ATOM 671 CB PHE A 41 2.084 -11.611 -3.484 1.00 62.41 C ATOM 672 CG PHE A 41 1.922 -10.958 -2.105 1.00 12.11 C ATOM 673 CD1 PHE A 41 0.766 -10.249 -1.780 1.00 55.52 C ATOM 674 CD2 PHE A 41 2.926 -11.054 -1.126 1.00 64.31 C ATOM 675 CE1 PHE A 41 0.621 -9.651 -0.536 1.00 45.13 C ATOM 676 CE2 PHE A 41 2.774 -10.457 0.114 1.00 21.40 C ATOM 677 CZ PHE A 41 1.619 -9.760 0.409 1.00 21.40 C ATOM 0 H PHE A 41 2.543 -13.998 -2.421 1.00 64.44 H new ATOM 0 HA PHE A 41 0.207 -12.704 -3.720 1.00 1.01 H new ATOM 0 HB2 PHE A 41 3.141 -11.823 -3.642 1.00 62.41 H new ATOM 0 HB3 PHE A 41 1.787 -10.888 -4.244 1.00 62.41 H new ATOM 0 HD1 PHE A 41 -0.028 -10.164 -2.507 1.00 55.52 H new ATOM 0 HD2 PHE A 41 3.830 -11.602 -1.344 1.00 64.31 H new ATOM 0 HE1 PHE A 41 -0.278 -9.098 -0.307 1.00 45.13 H new ATOM 0 HE2 PHE A 41 3.559 -10.537 0.851 1.00 21.40 H new ATOM 0 HZ PHE A 41 1.498 -9.301 1.379 1.00 21.40 H new ATOM 687 N SER A 42 1.302 -14.841 -5.324 1.00 42.30 N ATOM 688 CA SER A 42 1.697 -15.595 -6.560 1.00 41.40 C ATOM 689 C SER A 42 1.140 -14.958 -7.855 1.00 1.10 C ATOM 690 O SER A 42 1.890 -14.674 -8.803 1.00 41.02 O ATOM 691 CB SER A 42 1.199 -17.056 -6.468 1.00 60.42 C ATOM 692 OG SER A 42 1.573 -17.817 -7.611 1.00 35.11 O ATOM 0 H SER A 42 0.732 -15.385 -4.677 1.00 42.30 H new ATOM 0 HA SER A 42 2.785 -15.560 -6.613 1.00 41.40 H new ATOM 0 HB2 SER A 42 1.607 -17.523 -5.572 1.00 60.42 H new ATOM 0 HB3 SER A 42 0.114 -17.064 -6.366 1.00 60.42 H new ATOM 0 HG SER A 42 1.242 -18.735 -7.516 1.00 35.11 H new ATOM 698 N GLY A 43 -0.181 -14.712 -7.860 1.00 53.42 N ATOM 699 CA GLY A 43 -0.861 -14.073 -8.992 1.00 13.55 C ATOM 700 C GLY A 43 -0.532 -12.586 -9.110 1.00 45.44 C ATOM 701 O GLY A 43 -0.506 -12.041 -10.206 1.00 61.01 O ATOM 0 H GLY A 43 -0.800 -14.949 -7.085 1.00 53.42 H new ATOM 0 HA2 GLY A 43 -0.577 -14.579 -9.915 1.00 13.55 H new ATOM 0 HA3 GLY A 43 -1.938 -14.195 -8.880 1.00 13.55 H new ATOM 705 N TRP A 44 -0.274 -11.950 -7.952 1.00 75.33 N ATOM 706 CA TRP A 44 -0.006 -10.498 -7.839 1.00 22.33 C ATOM 707 C TRP A 44 1.401 -10.127 -8.395 1.00 52.42 C ATOM 708 O TRP A 44 1.560 -9.117 -9.098 1.00 21.14 O ATOM 709 CB TRP A 44 -0.162 -10.082 -6.341 1.00 11.10 C ATOM 710 CG TRP A 44 -0.462 -8.618 -6.106 1.00 22.12 C ATOM 711 CD1 TRP A 44 0.260 -7.723 -5.365 1.00 14.02 C ATOM 712 CD2 TRP A 44 -1.601 -7.892 -6.604 1.00 75.03 C ATOM 713 NE1 TRP A 44 -0.340 -6.489 -5.398 1.00 45.00 N ATOM 714 CE2 TRP A 44 -1.489 -6.575 -6.144 1.00 23.25 C ATOM 715 CE3 TRP A 44 -2.706 -8.235 -7.395 1.00 41.32 C ATOM 716 CZ2 TRP A 44 -2.432 -5.602 -6.457 1.00 44.12 C ATOM 717 CZ3 TRP A 44 -3.642 -7.265 -7.700 1.00 24.44 C ATOM 718 CH2 TRP A 44 -3.501 -5.961 -7.227 1.00 11.02 C ATOM 0 H TRP A 44 -0.245 -12.434 -7.055 1.00 75.33 H new ATOM 0 HA TRP A 44 -0.725 -9.948 -8.446 1.00 22.33 H new ATOM 0 HB2 TRP A 44 -0.961 -10.676 -5.897 1.00 11.10 H new ATOM 0 HB3 TRP A 44 0.756 -10.337 -5.812 1.00 11.10 H new ATOM 0 HD1 TRP A 44 1.170 -7.954 -4.831 1.00 14.02 H new ATOM 0 HE1 TRP A 44 0.010 -5.646 -4.943 1.00 45.00 H new ATOM 0 HE3 TRP A 44 -2.824 -9.244 -7.761 1.00 41.32 H new ATOM 0 HZ2 TRP A 44 -2.322 -4.589 -6.100 1.00 44.12 H new ATOM 0 HZ3 TRP A 44 -4.494 -7.520 -8.313 1.00 24.44 H new ATOM 0 HH2 TRP A 44 -4.250 -5.223 -7.474 1.00 11.02 H new ATOM 729 N GLU A 45 2.404 -10.971 -8.069 1.00 45.53 N ATOM 730 CA GLU A 45 3.788 -10.880 -8.606 1.00 22.51 C ATOM 731 C GLU A 45 3.791 -11.038 -10.147 1.00 14.22 C ATOM 732 O GLU A 45 4.371 -10.216 -10.877 1.00 64.02 O ATOM 733 CB GLU A 45 4.684 -11.993 -7.963 1.00 14.44 C ATOM 734 CG GLU A 45 6.139 -12.056 -8.487 1.00 51.13 C ATOM 735 CD GLU A 45 6.956 -13.234 -7.920 1.00 53.05 C ATOM 736 OE1 GLU A 45 6.870 -14.351 -8.482 1.00 62.34 O ATOM 737 OE2 GLU A 45 7.697 -13.050 -6.926 1.00 15.31 O ATOM 0 H GLU A 45 2.278 -11.746 -7.418 1.00 45.53 H new ATOM 0 HA GLU A 45 4.189 -9.898 -8.355 1.00 22.51 H new ATOM 0 HB2 GLU A 45 4.710 -11.837 -6.885 1.00 14.44 H new ATOM 0 HB3 GLU A 45 4.212 -12.960 -8.134 1.00 14.44 H new ATOM 0 HG2 GLU A 45 6.120 -12.129 -9.574 1.00 51.13 H new ATOM 0 HG3 GLU A 45 6.645 -11.123 -8.239 1.00 51.13 H new ATOM 744 N SER A 46 3.116 -12.110 -10.612 1.00 51.13 N ATOM 745 CA SER A 46 2.965 -12.425 -12.054 1.00 62.03 C ATOM 746 C SER A 46 2.252 -11.282 -12.821 1.00 20.45 C ATOM 747 O SER A 46 2.696 -10.870 -13.892 1.00 52.51 O ATOM 748 CB SER A 46 2.179 -13.748 -12.235 1.00 2.14 C ATOM 749 OG SER A 46 2.012 -14.074 -13.612 1.00 10.13 O ATOM 0 H SER A 46 2.658 -12.785 -9.999 1.00 51.13 H new ATOM 0 HA SER A 46 3.966 -12.536 -12.471 1.00 62.03 H new ATOM 0 HB2 SER A 46 2.706 -14.557 -11.730 1.00 2.14 H new ATOM 0 HB3 SER A 46 1.202 -13.659 -11.760 1.00 2.14 H new ATOM 0 HG SER A 46 1.514 -14.914 -13.691 1.00 10.13 H new ATOM 755 N LYS A 47 1.178 -10.752 -12.213 1.00 43.24 N ATOM 756 CA LYS A 47 0.311 -9.707 -12.795 1.00 54.22 C ATOM 757 C LYS A 47 1.093 -8.409 -13.143 1.00 54.44 C ATOM 758 O LYS A 47 0.938 -7.854 -14.241 1.00 21.44 O ATOM 759 CB LYS A 47 -0.819 -9.405 -11.783 1.00 3.43 C ATOM 760 CG LYS A 47 -1.875 -8.400 -12.253 1.00 44.14 C ATOM 761 CD LYS A 47 -2.961 -8.124 -11.186 1.00 32.34 C ATOM 762 CE LYS A 47 -3.851 -9.341 -10.902 1.00 10.34 C ATOM 763 NZ LYS A 47 -4.633 -9.736 -12.096 1.00 42.41 N ATOM 0 H LYS A 47 0.879 -11.043 -11.282 1.00 43.24 H new ATOM 0 HA LYS A 47 -0.099 -10.075 -13.736 1.00 54.22 H new ATOM 0 HB2 LYS A 47 -1.319 -10.341 -11.534 1.00 3.43 H new ATOM 0 HB3 LYS A 47 -0.369 -9.029 -10.864 1.00 3.43 H new ATOM 0 HG2 LYS A 47 -1.385 -7.463 -12.516 1.00 44.14 H new ATOM 0 HG3 LYS A 47 -2.350 -8.777 -13.159 1.00 44.14 H new ATOM 0 HD2 LYS A 47 -2.480 -7.810 -10.260 1.00 32.34 H new ATOM 0 HD3 LYS A 47 -3.585 -7.295 -11.518 1.00 32.34 H new ATOM 0 HE2 LYS A 47 -3.232 -10.178 -10.579 1.00 10.34 H new ATOM 0 HE3 LYS A 47 -4.530 -9.112 -10.081 1.00 10.34 H new ATOM 0 HZ1 LYS A 47 -5.621 -9.909 -11.822 1.00 42.41 H new ATOM 0 HZ2 LYS A 47 -4.598 -8.973 -12.802 1.00 42.41 H new ATOM 0 HZ3 LYS A 47 -4.230 -10.604 -12.503 1.00 42.41 H new ATOM 777 N LEU A 48 1.936 -7.944 -12.196 1.00 52.33 N ATOM 778 CA LEU A 48 2.782 -6.740 -12.394 1.00 25.13 C ATOM 779 C LEU A 48 3.823 -6.963 -13.521 1.00 61.54 C ATOM 780 O LEU A 48 3.994 -6.105 -14.389 1.00 75.32 O ATOM 781 CB LEU A 48 3.500 -6.342 -11.075 1.00 54.14 C ATOM 782 CG LEU A 48 4.334 -5.013 -11.125 1.00 72.51 C ATOM 783 CD1 LEU A 48 3.443 -3.784 -11.432 1.00 51.32 C ATOM 784 CD2 LEU A 48 5.144 -4.810 -9.825 1.00 23.43 C ATOM 0 H LEU A 48 2.051 -8.384 -11.283 1.00 52.33 H new ATOM 0 HA LEU A 48 2.124 -5.924 -12.692 1.00 25.13 H new ATOM 0 HB2 LEU A 48 2.750 -6.249 -10.289 1.00 54.14 H new ATOM 0 HB3 LEU A 48 4.165 -7.156 -10.786 1.00 54.14 H new ATOM 0 HG LEU A 48 5.043 -5.108 -11.947 1.00 72.51 H new ATOM 0 HD11 LEU A 48 4.059 -2.885 -11.458 1.00 51.32 H new ATOM 0 HD12 LEU A 48 2.958 -3.919 -12.399 1.00 51.32 H new ATOM 0 HD13 LEU A 48 2.684 -3.682 -10.656 1.00 51.32 H new ATOM 0 HD21 LEU A 48 5.711 -3.881 -9.891 1.00 23.43 H new ATOM 0 HD22 LEU A 48 4.463 -4.760 -8.976 1.00 23.43 H new ATOM 0 HD23 LEU A 48 5.831 -5.645 -9.690 1.00 23.43 H new ATOM 796 N GLY A 49 4.481 -8.143 -13.505 1.00 35.45 N ATOM 797 CA GLY A 49 5.507 -8.498 -14.506 1.00 34.12 C ATOM 798 C GLY A 49 4.976 -8.557 -15.946 1.00 62.32 C ATOM 799 O GLY A 49 5.629 -8.082 -16.889 1.00 53.31 O ATOM 0 H GLY A 49 4.318 -8.868 -12.806 1.00 35.45 H new ATOM 0 HA2 GLY A 49 6.316 -7.769 -14.457 1.00 34.12 H new ATOM 0 HA3 GLY A 49 5.934 -9.467 -14.247 1.00 34.12 H new ATOM 803 N ASN A 50 3.755 -9.106 -16.096 1.00 40.33 N ATOM 804 CA ASN A 50 3.065 -9.261 -17.405 1.00 14.25 C ATOM 805 C ASN A 50 2.388 -7.948 -17.892 1.00 73.22 C ATOM 806 O ASN A 50 1.706 -7.951 -18.925 1.00 11.32 O ATOM 807 CB ASN A 50 2.016 -10.403 -17.299 1.00 10.15 C ATOM 808 CG ASN A 50 2.620 -11.748 -16.881 1.00 30.14 C ATOM 809 OD1 ASN A 50 3.759 -12.066 -17.209 1.00 11.24 O ATOM 810 ND2 ASN A 50 1.870 -12.538 -16.133 1.00 60.34 N ATOM 0 H ASN A 50 3.210 -9.459 -15.310 1.00 40.33 H new ATOM 0 HA ASN A 50 3.822 -9.511 -18.148 1.00 14.25 H new ATOM 0 HB2 ASN A 50 1.250 -10.117 -16.578 1.00 10.15 H new ATOM 0 HB3 ASN A 50 1.519 -10.520 -18.262 1.00 10.15 H new ATOM 0 HD21 ASN A 50 2.235 -13.436 -15.814 1.00 60.34 H new ATOM 0 HD22 ASN A 50 0.926 -12.250 -15.874 1.00 60.34 H new ATOM 817 N GLY A 51 2.619 -6.834 -17.163 1.00 72.23 N ATOM 818 CA GLY A 51 2.017 -5.526 -17.481 1.00 23.32 C ATOM 819 C GLY A 51 0.479 -5.517 -17.501 1.00 61.30 C ATOM 820 O GLY A 51 -0.135 -4.782 -18.282 1.00 34.21 O ATOM 0 H GLY A 51 3.225 -6.819 -16.343 1.00 72.23 H new ATOM 0 HA2 GLY A 51 2.362 -4.795 -16.750 1.00 23.32 H new ATOM 0 HA3 GLY A 51 2.382 -5.200 -18.455 1.00 23.32 H new ATOM 824 N GLU A 52 -0.142 -6.348 -16.647 1.00 74.42 N ATOM 825 CA GLU A 52 -1.621 -6.410 -16.503 1.00 11.34 C ATOM 826 C GLU A 52 -2.109 -5.222 -15.618 1.00 40.51 C ATOM 827 O GLU A 52 -3.235 -4.736 -15.761 1.00 62.31 O ATOM 828 CB GLU A 52 -2.013 -7.804 -15.908 1.00 42.21 C ATOM 829 CG GLU A 52 -3.435 -8.340 -16.242 1.00 22.10 C ATOM 830 CD GLU A 52 -4.586 -7.661 -15.478 1.00 63.13 C ATOM 831 OE1 GLU A 52 -4.702 -7.878 -14.257 1.00 74.32 O ATOM 832 OE2 GLU A 52 -5.375 -6.908 -16.091 1.00 43.34 O ATOM 0 H GLU A 52 0.357 -6.996 -16.037 1.00 74.42 H new ATOM 0 HA GLU A 52 -2.112 -6.311 -17.471 1.00 11.34 H new ATOM 0 HB2 GLU A 52 -1.285 -8.537 -16.255 1.00 42.21 H new ATOM 0 HB3 GLU A 52 -1.918 -7.748 -14.824 1.00 42.21 H new ATOM 0 HG2 GLU A 52 -3.609 -8.220 -17.311 1.00 22.10 H new ATOM 0 HG3 GLU A 52 -3.462 -9.409 -16.032 1.00 22.10 H new ATOM 839 N ILE A 53 -1.205 -4.744 -14.735 1.00 74.22 N ATOM 840 CA ILE A 53 -1.432 -3.562 -13.860 1.00 22.23 C ATOM 841 C ILE A 53 -0.200 -2.630 -13.868 1.00 70.12 C ATOM 842 O ILE A 53 0.869 -2.984 -14.390 1.00 71.24 O ATOM 843 CB ILE A 53 -1.756 -3.963 -12.366 1.00 74.10 C ATOM 844 CG1 ILE A 53 -0.598 -4.825 -11.753 1.00 14.30 C ATOM 845 CG2 ILE A 53 -3.131 -4.672 -12.257 1.00 44.20 C ATOM 846 CD1 ILE A 53 -0.755 -5.161 -10.279 1.00 20.13 C ATOM 0 H ILE A 53 -0.287 -5.169 -14.605 1.00 74.22 H new ATOM 0 HA ILE A 53 -2.299 -3.044 -14.270 1.00 22.23 H new ATOM 0 HB ILE A 53 -1.825 -3.048 -11.778 1.00 74.10 H new ATOM 0 HG12 ILE A 53 -0.522 -5.755 -12.316 1.00 14.30 H new ATOM 0 HG13 ILE A 53 0.343 -4.292 -11.890 1.00 14.30 H new ATOM 0 HG21 ILE A 53 -3.324 -4.935 -11.217 1.00 44.20 H new ATOM 0 HG22 ILE A 53 -3.914 -4.003 -12.613 1.00 44.20 H new ATOM 0 HG23 ILE A 53 -3.123 -5.577 -12.864 1.00 44.20 H new ATOM 0 HD11 ILE A 53 0.095 -5.759 -9.950 1.00 20.13 H new ATOM 0 HD12 ILE A 53 -0.798 -4.240 -9.698 1.00 20.13 H new ATOM 0 HD13 ILE A 53 -1.675 -5.726 -10.131 1.00 20.13 H new ATOM 858 N THR A 54 -0.368 -1.434 -13.280 1.00 2.32 N ATOM 859 CA THR A 54 0.745 -0.500 -13.002 1.00 15.33 C ATOM 860 C THR A 54 1.233 -0.692 -11.550 1.00 22.40 C ATOM 861 O THR A 54 0.729 -1.572 -10.827 1.00 23.33 O ATOM 862 CB THR A 54 0.313 0.993 -13.197 1.00 71.10 C ATOM 863 OG1 THR A 54 -0.663 1.363 -12.202 1.00 55.23 O ATOM 864 CG2 THR A 54 -0.257 1.253 -14.602 1.00 11.31 C ATOM 0 H THR A 54 -1.279 -1.084 -12.982 1.00 2.32 H new ATOM 0 HA THR A 54 1.545 -0.722 -13.708 1.00 15.33 H new ATOM 0 HB THR A 54 1.208 1.605 -13.082 1.00 71.10 H new ATOM 0 HG1 THR A 54 -1.552 1.069 -12.491 1.00 55.23 H new ATOM 0 HG21 THR A 54 -0.543 2.301 -14.690 1.00 11.31 H new ATOM 0 HG22 THR A 54 0.500 1.019 -15.351 1.00 11.31 H new ATOM 0 HG23 THR A 54 -1.132 0.624 -14.762 1.00 11.31 H new ATOM 872 N VAL A 55 2.199 0.137 -11.119 1.00 1.25 N ATOM 873 CA VAL A 55 2.691 0.115 -9.729 1.00 22.04 C ATOM 874 C VAL A 55 1.582 0.561 -8.742 1.00 41.12 C ATOM 875 O VAL A 55 1.382 -0.093 -7.739 1.00 72.22 O ATOM 876 CB VAL A 55 3.981 0.993 -9.550 1.00 73.31 C ATOM 877 CG1 VAL A 55 4.424 1.084 -8.066 1.00 53.03 C ATOM 878 CG2 VAL A 55 5.130 0.455 -10.435 1.00 61.31 C ATOM 0 H VAL A 55 2.655 0.830 -11.712 1.00 1.25 H new ATOM 0 HA VAL A 55 2.963 -0.915 -9.500 1.00 22.04 H new ATOM 0 HB VAL A 55 3.734 2.004 -9.873 1.00 73.31 H new ATOM 0 HG11 VAL A 55 5.320 1.701 -7.991 1.00 53.03 H new ATOM 0 HG12 VAL A 55 3.625 1.531 -7.474 1.00 53.03 H new ATOM 0 HG13 VAL A 55 4.639 0.084 -7.689 1.00 53.03 H new ATOM 0 HG21 VAL A 55 6.016 1.075 -10.298 1.00 61.31 H new ATOM 0 HG22 VAL A 55 5.359 -0.572 -10.150 1.00 61.31 H new ATOM 0 HG23 VAL A 55 4.826 0.482 -11.482 1.00 61.31 H new ATOM 888 N LYS A 56 0.864 1.661 -9.058 1.00 23.24 N ATOM 889 CA LYS A 56 -0.286 2.177 -8.251 1.00 4.42 C ATOM 890 C LYS A 56 -1.313 1.079 -7.847 1.00 72.23 C ATOM 891 O LYS A 56 -1.658 0.946 -6.665 1.00 14.53 O ATOM 892 CB LYS A 56 -1.001 3.302 -9.045 1.00 45.44 C ATOM 893 CG LYS A 56 -2.325 3.805 -8.427 1.00 35.50 C ATOM 894 CD LYS A 56 -2.974 4.948 -9.235 1.00 0.15 C ATOM 895 CE LYS A 56 -4.398 5.273 -8.748 1.00 23.32 C ATOM 896 NZ LYS A 56 -5.334 4.139 -8.978 1.00 40.35 N ATOM 0 H LYS A 56 1.060 2.226 -9.884 1.00 23.24 H new ATOM 0 HA LYS A 56 0.129 2.560 -7.319 1.00 4.42 H new ATOM 0 HB2 LYS A 56 -0.319 4.147 -9.140 1.00 45.44 H new ATOM 0 HB3 LYS A 56 -1.204 2.941 -10.053 1.00 45.44 H new ATOM 0 HG2 LYS A 56 -3.026 2.973 -8.358 1.00 35.50 H new ATOM 0 HG3 LYS A 56 -2.137 4.148 -7.410 1.00 35.50 H new ATOM 0 HD2 LYS A 56 -2.354 5.841 -9.159 1.00 0.15 H new ATOM 0 HD3 LYS A 56 -3.007 4.672 -10.289 1.00 0.15 H new ATOM 0 HE2 LYS A 56 -4.372 5.513 -7.685 1.00 23.32 H new ATOM 0 HE3 LYS A 56 -4.766 6.159 -9.266 1.00 23.32 H new ATOM 0 HZ1 LYS A 56 -6.306 4.442 -8.764 1.00 40.35 H new ATOM 0 HZ2 LYS A 56 -5.276 3.837 -9.972 1.00 40.35 H new ATOM 0 HZ3 LYS A 56 -5.075 3.344 -8.359 1.00 40.35 H new ATOM 910 N GLU A 57 -1.800 0.316 -8.844 1.00 60.42 N ATOM 911 CA GLU A 57 -2.738 -0.813 -8.606 1.00 43.25 C ATOM 912 C GLU A 57 -2.089 -1.926 -7.738 1.00 25.13 C ATOM 913 O GLU A 57 -2.763 -2.522 -6.890 1.00 15.04 O ATOM 914 CB GLU A 57 -3.269 -1.399 -9.945 1.00 4.10 C ATOM 915 CG GLU A 57 -4.441 -0.615 -10.586 1.00 10.34 C ATOM 916 CD GLU A 57 -4.069 0.791 -11.093 1.00 10.45 C ATOM 917 OE1 GLU A 57 -3.524 0.898 -12.212 1.00 42.11 O ATOM 918 OE2 GLU A 57 -4.338 1.791 -10.387 1.00 61.43 O ATOM 0 H GLU A 57 -1.563 0.456 -9.826 1.00 60.42 H new ATOM 0 HA GLU A 57 -3.586 -0.412 -8.051 1.00 43.25 H new ATOM 0 HB2 GLU A 57 -2.446 -1.439 -10.658 1.00 4.10 H new ATOM 0 HB3 GLU A 57 -3.591 -2.426 -9.772 1.00 4.10 H new ATOM 0 HG2 GLU A 57 -4.836 -1.195 -11.420 1.00 10.34 H new ATOM 0 HG3 GLU A 57 -5.243 -0.523 -9.854 1.00 10.34 H new ATOM 925 N PHE A 58 -0.781 -2.173 -7.959 1.00 71.42 N ATOM 926 CA PHE A 58 0.029 -3.113 -7.142 1.00 21.55 C ATOM 927 C PHE A 58 0.087 -2.656 -5.651 1.00 24.35 C ATOM 928 O PHE A 58 -0.097 -3.469 -4.739 1.00 3.14 O ATOM 929 CB PHE A 58 1.457 -3.241 -7.750 1.00 41.33 C ATOM 930 CG PHE A 58 2.317 -4.365 -7.164 1.00 64.31 C ATOM 931 CD1 PHE A 58 2.205 -5.671 -7.644 1.00 50.14 C ATOM 932 CD2 PHE A 58 3.252 -4.118 -6.154 1.00 13.24 C ATOM 933 CE1 PHE A 58 2.984 -6.689 -7.124 1.00 23.03 C ATOM 934 CE2 PHE A 58 4.029 -5.140 -5.636 1.00 21.45 C ATOM 935 CZ PHE A 58 3.897 -6.422 -6.126 1.00 52.13 C ATOM 0 H PHE A 58 -0.252 -1.728 -8.709 1.00 71.42 H new ATOM 0 HA PHE A 58 -0.446 -4.094 -7.160 1.00 21.55 H new ATOM 0 HB2 PHE A 58 1.364 -3.399 -8.825 1.00 41.33 H new ATOM 0 HB3 PHE A 58 1.980 -2.295 -7.611 1.00 41.33 H new ATOM 0 HD1 PHE A 58 1.500 -5.890 -8.433 1.00 50.14 H new ATOM 0 HD2 PHE A 58 3.370 -3.115 -5.772 1.00 13.24 H new ATOM 0 HE1 PHE A 58 2.877 -7.695 -7.501 1.00 23.03 H new ATOM 0 HE2 PHE A 58 4.738 -4.933 -4.848 1.00 21.45 H new ATOM 0 HZ PHE A 58 4.509 -7.218 -5.728 1.00 52.13 H new ATOM 945 N ILE A 59 0.288 -1.336 -5.442 1.00 13.43 N ATOM 946 CA ILE A 59 0.401 -0.695 -4.104 1.00 43.41 C ATOM 947 C ILE A 59 -0.929 -0.805 -3.314 1.00 62.24 C ATOM 948 O ILE A 59 -0.927 -1.103 -2.110 1.00 13.34 O ATOM 949 CB ILE A 59 0.833 0.827 -4.246 1.00 34.33 C ATOM 950 CG1 ILE A 59 2.222 0.970 -4.955 1.00 25.13 C ATOM 951 CG2 ILE A 59 0.841 1.570 -2.891 1.00 64.32 C ATOM 952 CD1 ILE A 59 3.353 0.154 -4.355 1.00 55.43 C ATOM 0 H ILE A 59 0.378 -0.670 -6.210 1.00 13.43 H new ATOM 0 HA ILE A 59 1.172 -1.227 -3.546 1.00 43.41 H new ATOM 0 HB ILE A 59 0.076 1.298 -4.873 1.00 34.33 H new ATOM 0 HG12 ILE A 59 2.107 0.684 -6.001 1.00 25.13 H new ATOM 0 HG13 ILE A 59 2.510 2.021 -4.942 1.00 25.13 H new ATOM 0 HG21 ILE A 59 1.143 2.606 -3.046 1.00 64.32 H new ATOM 0 HG22 ILE A 59 -0.158 1.545 -2.456 1.00 64.32 H new ATOM 0 HG23 ILE A 59 1.544 1.084 -2.214 1.00 64.32 H new ATOM 0 HD11 ILE A 59 4.268 0.328 -4.922 1.00 55.43 H new ATOM 0 HD12 ILE A 59 3.507 0.453 -3.318 1.00 55.43 H new ATOM 0 HD13 ILE A 59 3.098 -0.905 -4.393 1.00 55.43 H new ATOM 964 N GLU A 60 -2.053 -0.547 -4.012 1.00 60.03 N ATOM 965 CA GLU A 60 -3.417 -0.753 -3.474 1.00 72.13 C ATOM 966 C GLU A 60 -3.607 -2.179 -2.901 1.00 34.21 C ATOM 967 O GLU A 60 -4.096 -2.346 -1.782 1.00 21.21 O ATOM 968 CB GLU A 60 -4.470 -0.457 -4.574 1.00 43.24 C ATOM 969 CG GLU A 60 -5.935 -0.532 -4.096 1.00 45.11 C ATOM 970 CD GLU A 60 -6.936 -0.016 -5.141 1.00 55.25 C ATOM 971 OE1 GLU A 60 -7.274 -0.771 -6.085 1.00 35.11 O ATOM 972 OE2 GLU A 60 -7.383 1.146 -5.036 1.00 2.41 O ATOM 0 H GLU A 60 -2.043 -0.189 -4.967 1.00 60.03 H new ATOM 0 HA GLU A 60 -3.558 -0.057 -2.647 1.00 72.13 H new ATOM 0 HB2 GLU A 60 -4.284 0.538 -4.979 1.00 43.24 H new ATOM 0 HB3 GLU A 60 -4.331 -1.165 -5.391 1.00 43.24 H new ATOM 0 HG2 GLU A 60 -6.178 -1.565 -3.848 1.00 45.11 H new ATOM 0 HG3 GLU A 60 -6.043 0.049 -3.180 1.00 45.11 H new ATOM 979 N GLY A 61 -3.144 -3.191 -3.657 1.00 64.32 N ATOM 980 CA GLY A 61 -3.220 -4.592 -3.214 1.00 14.22 C ATOM 981 C GLY A 61 -2.408 -4.872 -1.943 1.00 75.21 C ATOM 982 O GLY A 61 -2.839 -5.639 -1.075 1.00 63.23 O ATOM 0 H GLY A 61 -2.715 -3.064 -4.574 1.00 64.32 H new ATOM 0 HA2 GLY A 61 -4.263 -4.853 -3.035 1.00 14.22 H new ATOM 0 HA3 GLY A 61 -2.862 -5.239 -4.015 1.00 14.22 H new ATOM 986 N LEU A 62 -1.240 -4.209 -1.833 1.00 22.12 N ATOM 987 CA LEU A 62 -0.343 -4.328 -0.661 1.00 73.54 C ATOM 988 C LEU A 62 -1.011 -3.775 0.627 1.00 34.02 C ATOM 989 O LEU A 62 -0.913 -4.381 1.698 1.00 32.22 O ATOM 990 CB LEU A 62 0.998 -3.590 -0.926 1.00 21.01 C ATOM 991 CG LEU A 62 1.789 -4.016 -2.206 1.00 35.12 C ATOM 992 CD1 LEU A 62 3.166 -3.318 -2.268 1.00 24.24 C ATOM 993 CD2 LEU A 62 1.913 -5.555 -2.322 1.00 2.01 C ATOM 0 H LEU A 62 -0.890 -3.576 -2.552 1.00 22.12 H new ATOM 0 HA LEU A 62 -0.142 -5.388 -0.507 1.00 73.54 H new ATOM 0 HB2 LEU A 62 0.792 -2.522 -0.992 1.00 21.01 H new ATOM 0 HB3 LEU A 62 1.645 -3.737 -0.061 1.00 21.01 H new ATOM 0 HG LEU A 62 1.216 -3.684 -3.072 1.00 35.12 H new ATOM 0 HD11 LEU A 62 3.693 -3.633 -3.168 1.00 24.24 H new ATOM 0 HD12 LEU A 62 3.025 -2.237 -2.289 1.00 24.24 H new ATOM 0 HD13 LEU A 62 3.752 -3.590 -1.390 1.00 24.24 H new ATOM 0 HD21 LEU A 62 2.469 -5.808 -3.225 1.00 2.01 H new ATOM 0 HD22 LEU A 62 2.439 -5.944 -1.450 1.00 2.01 H new ATOM 0 HD23 LEU A 62 0.918 -5.997 -2.373 1.00 2.01 H new ATOM 1005 N GLY A 63 -1.664 -2.604 0.502 1.00 53.22 N ATOM 1006 CA GLY A 63 -2.427 -1.995 1.604 1.00 34.33 C ATOM 1007 C GLY A 63 -3.597 -2.842 2.148 1.00 62.12 C ATOM 1008 O GLY A 63 -3.892 -2.797 3.345 1.00 74.34 O ATOM 0 H GLY A 63 -1.677 -2.058 -0.360 1.00 53.22 H new ATOM 0 HA2 GLY A 63 -1.741 -1.784 2.425 1.00 34.33 H new ATOM 0 HA3 GLY A 63 -2.822 -1.037 1.264 1.00 34.33 H new ATOM 1012 N TYR A 64 -4.277 -3.599 1.262 1.00 41.35 N ATOM 1013 CA TYR A 64 -5.400 -4.498 1.661 1.00 13.03 C ATOM 1014 C TYR A 64 -4.892 -5.784 2.376 1.00 52.44 C ATOM 1015 O TYR A 64 -5.658 -6.427 3.112 1.00 75.54 O ATOM 1016 CB TYR A 64 -6.267 -4.892 0.426 1.00 45.14 C ATOM 1017 CG TYR A 64 -7.170 -3.778 -0.159 1.00 35.40 C ATOM 1018 CD1 TYR A 64 -6.700 -2.482 -0.349 1.00 1.44 C ATOM 1019 CD2 TYR A 64 -8.491 -4.042 -0.555 1.00 3.40 C ATOM 1020 CE1 TYR A 64 -7.495 -1.496 -0.899 1.00 13.34 C ATOM 1021 CE2 TYR A 64 -9.286 -3.056 -1.114 1.00 13.42 C ATOM 1022 CZ TYR A 64 -8.780 -1.785 -1.285 1.00 51.41 C ATOM 1023 OH TYR A 64 -9.561 -0.799 -1.849 1.00 51.24 O ATOM 0 H TYR A 64 -4.074 -3.611 0.263 1.00 41.35 H new ATOM 0 HA TYR A 64 -6.014 -3.938 2.366 1.00 13.03 H new ATOM 0 HB2 TYR A 64 -5.601 -5.242 -0.362 1.00 45.14 H new ATOM 0 HB3 TYR A 64 -6.900 -5.734 0.706 1.00 45.14 H new ATOM 0 HD1 TYR A 64 -5.688 -2.241 -0.059 1.00 1.44 H new ATOM 0 HD2 TYR A 64 -8.895 -5.034 -0.421 1.00 3.40 H new ATOM 0 HE1 TYR A 64 -7.105 -0.497 -1.026 1.00 13.34 H new ATOM 0 HE2 TYR A 64 -10.298 -3.282 -1.415 1.00 13.42 H new ATOM 0 HH TYR A 64 -10.443 -1.165 -2.067 1.00 51.24 H new ATOM 1033 N SER A 65 -3.615 -6.159 2.123 1.00 72.52 N ATOM 1034 CA SER A 65 -2.978 -7.370 2.718 1.00 15.10 C ATOM 1035 C SER A 65 -3.021 -7.393 4.268 1.00 54.43 C ATOM 1036 O SER A 65 -2.692 -6.403 4.930 1.00 34.32 O ATOM 1037 CB SER A 65 -1.512 -7.507 2.246 1.00 61.43 C ATOM 1038 OG SER A 65 -0.874 -8.635 2.837 1.00 54.14 O ATOM 0 H SER A 65 -2.995 -5.636 1.504 1.00 72.52 H new ATOM 0 HA SER A 65 -3.568 -8.216 2.365 1.00 15.10 H new ATOM 0 HB2 SER A 65 -1.486 -7.601 1.160 1.00 61.43 H new ATOM 0 HB3 SER A 65 -0.961 -6.602 2.501 1.00 61.43 H new ATOM 0 HG SER A 65 0.087 -8.605 2.646 1.00 54.14 H new ATOM 1044 N ASN A 66 -3.394 -8.568 4.820 1.00 65.12 N ATOM 1045 CA ASN A 66 -3.503 -8.808 6.281 1.00 21.40 C ATOM 1046 C ASN A 66 -2.143 -8.604 7.011 1.00 23.41 C ATOM 1047 O ASN A 66 -2.122 -8.289 8.201 1.00 32.14 O ATOM 1048 CB ASN A 66 -4.054 -10.245 6.516 1.00 41.44 C ATOM 1049 CG ASN A 66 -4.121 -10.663 7.990 1.00 11.01 C ATOM 1050 OD1 ASN A 66 -5.116 -10.447 8.672 1.00 21.02 O ATOM 1051 ND2 ASN A 66 -3.060 -11.280 8.486 1.00 73.20 N ATOM 0 H ASN A 66 -3.631 -9.387 4.260 1.00 65.12 H new ATOM 0 HA ASN A 66 -4.191 -8.076 6.704 1.00 21.40 H new ATOM 0 HB2 ASN A 66 -5.053 -10.313 6.086 1.00 41.44 H new ATOM 0 HB3 ASN A 66 -3.426 -10.955 5.978 1.00 41.44 H new ATOM 0 HD21 ASN A 66 -3.058 -11.588 9.458 1.00 73.20 H new ATOM 0 HD22 ASN A 66 -2.245 -11.447 7.896 1.00 73.20 H new ATOM 1058 N LEU A 67 -1.020 -8.789 6.287 1.00 23.43 N ATOM 1059 CA LEU A 67 0.341 -8.562 6.835 1.00 2.04 C ATOM 1060 C LEU A 67 0.562 -7.066 7.179 1.00 14.53 C ATOM 1061 O LEU A 67 1.155 -6.737 8.208 1.00 21.31 O ATOM 1062 CB LEU A 67 1.413 -9.046 5.828 1.00 1.24 C ATOM 1063 CG LEU A 67 2.900 -8.935 6.302 1.00 35.52 C ATOM 1064 CD1 LEU A 67 3.168 -9.806 7.551 1.00 72.14 C ATOM 1065 CD2 LEU A 67 3.874 -9.271 5.148 1.00 50.30 C ATOM 0 H LEU A 67 -1.026 -9.097 5.315 1.00 23.43 H new ATOM 0 HA LEU A 67 0.435 -9.138 7.756 1.00 2.04 H new ATOM 0 HB2 LEU A 67 1.208 -10.088 5.582 1.00 1.24 H new ATOM 0 HB3 LEU A 67 1.302 -8.474 4.907 1.00 1.24 H new ATOM 0 HG LEU A 67 3.079 -7.900 6.595 1.00 35.52 H new ATOM 0 HD11 LEU A 67 4.211 -9.702 7.850 1.00 72.14 H new ATOM 0 HD12 LEU A 67 2.523 -9.480 8.367 1.00 72.14 H new ATOM 0 HD13 LEU A 67 2.959 -10.850 7.318 1.00 72.14 H new ATOM 0 HD21 LEU A 67 4.901 -9.187 5.503 1.00 50.30 H new ATOM 0 HD22 LEU A 67 3.692 -10.289 4.803 1.00 50.30 H new ATOM 0 HD23 LEU A 67 3.716 -8.575 4.324 1.00 50.30 H new ATOM 1077 N TYR A 68 0.049 -6.167 6.313 1.00 14.41 N ATOM 1078 CA TYR A 68 0.107 -4.703 6.542 1.00 33.03 C ATOM 1079 C TYR A 68 -0.818 -4.299 7.718 1.00 53.31 C ATOM 1080 O TYR A 68 -0.479 -3.431 8.530 1.00 22.44 O ATOM 1081 CB TYR A 68 -0.284 -3.938 5.251 1.00 3.11 C ATOM 1082 CG TYR A 68 -0.262 -2.408 5.400 1.00 63.42 C ATOM 1083 CD1 TYR A 68 0.931 -1.735 5.675 1.00 53.00 C ATOM 1084 CD2 TYR A 68 -1.427 -1.643 5.284 1.00 51.12 C ATOM 1085 CE1 TYR A 68 0.959 -0.364 5.826 1.00 74.34 C ATOM 1086 CE2 TYR A 68 -1.397 -0.271 5.432 1.00 44.03 C ATOM 1087 CZ TYR A 68 -0.202 0.361 5.703 1.00 24.03 C ATOM 1088 OH TYR A 68 -0.167 1.725 5.853 1.00 60.23 O ATOM 0 H TYR A 68 -0.413 -6.429 5.443 1.00 14.41 H new ATOM 0 HA TYR A 68 1.130 -4.434 6.805 1.00 33.03 H new ATOM 0 HB2 TYR A 68 0.398 -4.225 4.450 1.00 3.11 H new ATOM 0 HB3 TYR A 68 -1.283 -4.249 4.945 1.00 3.11 H new ATOM 0 HD1 TYR A 68 1.848 -2.298 5.771 1.00 53.00 H new ATOM 0 HD2 TYR A 68 -2.366 -2.134 5.075 1.00 51.12 H new ATOM 0 HE1 TYR A 68 1.891 0.138 6.040 1.00 74.34 H new ATOM 0 HE2 TYR A 68 -2.306 0.305 5.336 1.00 44.03 H new ATOM 0 HH TYR A 68 -1.069 2.090 5.735 1.00 60.23 H new ATOM 1098 N LEU A 69 -1.993 -4.944 7.781 1.00 25.45 N ATOM 1099 CA LEU A 69 -2.949 -4.789 8.902 1.00 71.11 C ATOM 1100 C LEU A 69 -2.371 -5.316 10.239 1.00 63.54 C ATOM 1101 O LEU A 69 -2.702 -4.808 11.313 1.00 14.33 O ATOM 1102 CB LEU A 69 -4.302 -5.497 8.567 1.00 2.22 C ATOM 1103 CG LEU A 69 -5.325 -4.665 7.728 1.00 74.14 C ATOM 1104 CD1 LEU A 69 -5.760 -3.412 8.503 1.00 53.11 C ATOM 1105 CD2 LEU A 69 -4.774 -4.292 6.335 1.00 21.41 C ATOM 0 H LEU A 69 -2.313 -5.589 7.059 1.00 25.45 H new ATOM 0 HA LEU A 69 -3.131 -3.722 9.030 1.00 71.11 H new ATOM 0 HB2 LEU A 69 -4.083 -6.417 8.026 1.00 2.22 H new ATOM 0 HB3 LEU A 69 -4.780 -5.784 9.504 1.00 2.22 H new ATOM 0 HG LEU A 69 -6.199 -5.295 7.561 1.00 74.14 H new ATOM 0 HD11 LEU A 69 -6.472 -2.843 7.905 1.00 53.11 H new ATOM 0 HD12 LEU A 69 -6.229 -3.709 9.441 1.00 53.11 H new ATOM 0 HD13 LEU A 69 -4.888 -2.793 8.713 1.00 53.11 H new ATOM 0 HD21 LEU A 69 -5.521 -3.715 5.791 1.00 21.41 H new ATOM 0 HD22 LEU A 69 -3.868 -3.697 6.450 1.00 21.41 H new ATOM 0 HD23 LEU A 69 -4.543 -5.201 5.780 1.00 21.41 H new ATOM 1117 N LYS A 70 -1.512 -6.338 10.160 1.00 75.51 N ATOM 1118 CA LYS A 70 -0.865 -6.931 11.342 1.00 22.44 C ATOM 1119 C LYS A 70 0.260 -6.022 11.880 1.00 12.34 C ATOM 1120 O LYS A 70 0.327 -5.757 13.080 1.00 3.44 O ATOM 1121 CB LYS A 70 -0.312 -8.339 11.000 1.00 24.31 C ATOM 1122 CG LYS A 70 0.414 -9.046 12.174 1.00 21.23 C ATOM 1123 CD LYS A 70 0.782 -10.514 11.865 1.00 5.32 C ATOM 1124 CE LYS A 70 -0.463 -11.399 11.661 1.00 31.52 C ATOM 1125 NZ LYS A 70 -1.333 -11.428 12.868 1.00 30.54 N ATOM 0 H LYS A 70 -1.244 -6.778 9.280 1.00 75.51 H new ATOM 0 HA LYS A 70 -1.616 -7.029 12.126 1.00 22.44 H new ATOM 0 HB2 LYS A 70 -1.137 -8.969 10.667 1.00 24.31 H new ATOM 0 HB3 LYS A 70 0.379 -8.250 10.162 1.00 24.31 H new ATOM 0 HG2 LYS A 70 1.322 -8.494 12.417 1.00 21.23 H new ATOM 0 HG3 LYS A 70 -0.223 -9.016 13.058 1.00 21.23 H new ATOM 0 HD2 LYS A 70 1.401 -10.550 10.969 1.00 5.32 H new ATOM 0 HD3 LYS A 70 1.381 -10.916 12.682 1.00 5.32 H new ATOM 0 HE2 LYS A 70 -1.036 -11.028 10.811 1.00 31.52 H new ATOM 0 HE3 LYS A 70 -0.150 -12.414 11.416 1.00 31.52 H new ATOM 0 HZ1 LYS A 70 -2.052 -12.172 12.760 1.00 30.54 H new ATOM 0 HZ2 LYS A 70 -0.754 -11.626 13.709 1.00 30.54 H new ATOM 0 HZ3 LYS A 70 -1.802 -10.507 12.980 1.00 30.54 H new ATOM 1139 N GLU A 71 1.115 -5.522 10.972 1.00 22.45 N ATOM 1140 CA GLU A 71 2.332 -4.765 11.345 1.00 3.33 C ATOM 1141 C GLU A 71 2.043 -3.269 11.640 1.00 41.14 C ATOM 1142 O GLU A 71 2.533 -2.726 12.631 1.00 74.42 O ATOM 1143 CB GLU A 71 3.403 -4.903 10.228 1.00 63.15 C ATOM 1144 CG GLU A 71 3.881 -6.352 9.967 1.00 25.23 C ATOM 1145 CD GLU A 71 4.438 -7.053 11.225 1.00 12.11 C ATOM 1146 OE1 GLU A 71 5.534 -6.668 11.693 1.00 22.30 O ATOM 1147 OE2 GLU A 71 3.792 -7.991 11.750 1.00 41.11 O ATOM 0 H GLU A 71 0.988 -5.627 9.965 1.00 22.45 H new ATOM 0 HA GLU A 71 2.710 -5.197 12.272 1.00 3.33 H new ATOM 0 HB2 GLU A 71 2.997 -4.496 9.302 1.00 63.15 H new ATOM 0 HB3 GLU A 71 4.266 -4.292 10.493 1.00 63.15 H new ATOM 0 HG2 GLU A 71 3.048 -6.936 9.574 1.00 25.23 H new ATOM 0 HG3 GLU A 71 4.652 -6.339 9.197 1.00 25.23 H new ATOM 1154 N PHE A 72 1.261 -2.607 10.761 1.00 34.25 N ATOM 1155 CA PHE A 72 0.980 -1.141 10.856 1.00 54.43 C ATOM 1156 C PHE A 72 -0.531 -0.827 10.973 1.00 64.32 C ATOM 1157 O PHE A 72 -1.054 0.055 10.280 1.00 43.15 O ATOM 1158 CB PHE A 72 1.633 -0.409 9.647 1.00 53.54 C ATOM 1159 CG PHE A 72 3.158 -0.462 9.682 1.00 31.41 C ATOM 1160 CD1 PHE A 72 3.868 0.383 10.529 1.00 51.12 C ATOM 1161 CD2 PHE A 72 3.877 -1.365 8.904 1.00 64.24 C ATOM 1162 CE1 PHE A 72 5.244 0.333 10.597 1.00 52.52 C ATOM 1163 CE2 PHE A 72 5.253 -1.411 8.973 1.00 33.23 C ATOM 1164 CZ PHE A 72 5.937 -0.565 9.820 1.00 34.01 C ATOM 0 H PHE A 72 0.806 -3.060 9.969 1.00 34.25 H new ATOM 0 HA PHE A 72 1.426 -0.770 11.779 1.00 54.43 H new ATOM 0 HB2 PHE A 72 1.279 -0.860 8.720 1.00 53.54 H new ATOM 0 HB3 PHE A 72 1.309 0.632 9.639 1.00 53.54 H new ATOM 0 HD1 PHE A 72 3.332 1.091 11.144 1.00 51.12 H new ATOM 0 HD2 PHE A 72 3.352 -2.036 8.240 1.00 64.24 H new ATOM 0 HE1 PHE A 72 5.777 0.998 11.260 1.00 52.52 H new ATOM 0 HE2 PHE A 72 5.798 -2.114 8.360 1.00 33.23 H new ATOM 0 HZ PHE A 72 7.015 -0.608 9.873 1.00 34.01 H new ATOM 1174 N TYR A 73 -1.213 -1.535 11.892 1.00 70.33 N ATOM 1175 CA TYR A 73 -2.619 -1.236 12.260 1.00 75.13 C ATOM 1176 C TYR A 73 -2.968 -1.840 13.642 1.00 33.15 C ATOM 1177 O TYR A 73 -3.540 -1.162 14.501 1.00 23.12 O ATOM 1178 CB TYR A 73 -3.596 -1.746 11.167 1.00 2.23 C ATOM 1179 CG TYR A 73 -5.078 -1.398 11.402 1.00 41.12 C ATOM 1180 CD1 TYR A 73 -5.586 -0.153 11.031 1.00 32.32 C ATOM 1181 CD2 TYR A 73 -5.965 -2.311 11.990 1.00 14.15 C ATOM 1182 CE1 TYR A 73 -6.907 0.174 11.238 1.00 31.25 C ATOM 1183 CE2 TYR A 73 -7.295 -1.986 12.195 1.00 34.22 C ATOM 1184 CZ TYR A 73 -7.761 -0.741 11.818 1.00 22.13 C ATOM 1185 OH TYR A 73 -9.084 -0.406 12.026 1.00 2.15 O ATOM 0 H TYR A 73 -0.814 -2.325 12.399 1.00 70.33 H new ATOM 0 HA TYR A 73 -2.728 -0.154 12.330 1.00 75.13 H new ATOM 0 HB2 TYR A 73 -3.290 -1.333 10.206 1.00 2.23 H new ATOM 0 HB3 TYR A 73 -3.500 -2.829 11.093 1.00 2.23 H new ATOM 0 HD1 TYR A 73 -4.929 0.570 10.571 1.00 32.32 H new ATOM 0 HD2 TYR A 73 -5.604 -3.284 12.288 1.00 14.15 H new ATOM 0 HE1 TYR A 73 -7.275 1.147 10.946 1.00 31.25 H new ATOM 0 HE2 TYR A 73 -7.965 -2.702 12.647 1.00 34.22 H new ATOM 0 HH TYR A 73 -9.551 -1.160 12.442 1.00 2.15 H new ATOM 1195 N THR A 74 -2.625 -3.129 13.834 1.00 62.13 N ATOM 1196 CA THR A 74 -2.906 -3.861 15.100 1.00 11.52 C ATOM 1197 C THR A 74 -2.099 -3.293 16.325 1.00 31.31 C ATOM 1198 O THR A 74 -2.703 -3.063 17.384 1.00 32.00 O ATOM 1199 CB THR A 74 -2.661 -5.411 14.957 1.00 33.25 C ATOM 1200 OG1 THR A 74 -3.375 -5.924 13.816 1.00 51.10 O ATOM 1201 CG2 THR A 74 -3.105 -6.194 16.211 1.00 30.33 C ATOM 0 H THR A 74 -2.150 -3.693 13.129 1.00 62.13 H new ATOM 0 HA THR A 74 -3.965 -3.699 15.300 1.00 11.52 H new ATOM 0 HB THR A 74 -1.587 -5.549 14.830 1.00 33.25 H new ATOM 0 HG1 THR A 74 -3.044 -5.492 13.001 1.00 51.10 H new ATOM 0 HG21 THR A 74 -2.915 -7.257 16.062 1.00 30.33 H new ATOM 0 HG22 THR A 74 -2.544 -5.843 17.077 1.00 30.33 H new ATOM 0 HG23 THR A 74 -4.170 -6.036 16.381 1.00 30.33 H new ATOM 1209 N PRO A 75 -0.732 -3.032 16.231 1.00 65.52 N ATOM 1210 CA PRO A 75 0.055 -2.468 17.357 1.00 3.13 C ATOM 1211 C PRO A 75 0.097 -0.915 17.357 1.00 53.11 C ATOM 1212 O PRO A 75 0.874 -0.316 18.108 1.00 62.21 O ATOM 1213 CB PRO A 75 1.477 -3.073 17.131 1.00 75.02 C ATOM 1214 CG PRO A 75 1.485 -3.624 15.718 1.00 44.01 C ATOM 1215 CD PRO A 75 0.162 -3.242 15.073 1.00 3.43 C ATOM 0 HA PRO A 75 -0.382 -2.717 18.324 1.00 3.13 H new ATOM 0 HB2 PRO A 75 2.248 -2.312 17.256 1.00 75.02 H new ATOM 0 HB3 PRO A 75 1.685 -3.860 17.856 1.00 75.02 H new ATOM 0 HG2 PRO A 75 2.321 -3.214 15.151 1.00 44.01 H new ATOM 0 HG3 PRO A 75 1.608 -4.707 15.729 1.00 44.01 H new ATOM 0 HD2 PRO A 75 0.255 -2.340 14.468 1.00 3.43 H new ATOM 0 HD3 PRO A 75 -0.208 -4.030 14.417 1.00 3.43 H new ATOM 1223 N TYR A 76 -0.738 -0.266 16.519 1.00 53.01 N ATOM 1224 CA TYR A 76 -0.714 1.209 16.334 1.00 22.13 C ATOM 1225 C TYR A 76 -2.140 1.819 16.370 1.00 42.15 C ATOM 1226 O TYR A 76 -3.079 1.223 15.840 1.00 61.45 O ATOM 1227 CB TYR A 76 -0.014 1.563 14.991 1.00 24.11 C ATOM 1228 CG TYR A 76 1.488 1.246 14.978 1.00 65.42 C ATOM 1229 CD1 TYR A 76 2.376 1.994 15.753 1.00 24.34 C ATOM 1230 CD2 TYR A 76 2.017 0.200 14.221 1.00 11.42 C ATOM 1231 CE1 TYR A 76 3.724 1.720 15.768 1.00 62.14 C ATOM 1232 CE2 TYR A 76 3.370 -0.083 14.241 1.00 43.12 C ATOM 1233 CZ TYR A 76 4.217 0.681 15.014 1.00 34.04 C ATOM 1234 OH TYR A 76 5.563 0.400 15.051 1.00 72.12 O ATOM 0 H TYR A 76 -1.443 -0.740 15.954 1.00 53.01 H new ATOM 0 HA TYR A 76 -0.152 1.639 17.163 1.00 22.13 H new ATOM 0 HB2 TYR A 76 -0.499 1.016 14.183 1.00 24.11 H new ATOM 0 HB3 TYR A 76 -0.155 2.624 14.787 1.00 24.11 H new ATOM 0 HD1 TYR A 76 1.996 2.806 16.355 1.00 24.34 H new ATOM 0 HD2 TYR A 76 1.358 -0.399 13.609 1.00 11.42 H new ATOM 0 HE1 TYR A 76 4.392 2.318 16.369 1.00 62.14 H new ATOM 0 HE2 TYR A 76 3.762 -0.900 13.653 1.00 43.12 H new ATOM 0 HH TYR A 76 5.754 -0.362 14.466 1.00 72.12 H new ATOM 1244 N PRO A 77 -2.323 3.031 16.999 1.00 14.41 N ATOM 1245 CA PRO A 77 -3.616 3.775 16.946 1.00 15.03 C ATOM 1246 C PRO A 77 -3.892 4.326 15.527 1.00 63.03 C ATOM 1247 O PRO A 77 -2.950 4.492 14.745 1.00 75.43 O ATOM 1248 CB PRO A 77 -3.405 4.916 17.977 1.00 44.21 C ATOM 1249 CG PRO A 77 -1.920 5.139 17.998 1.00 4.13 C ATOM 1250 CD PRO A 77 -1.302 3.766 17.807 1.00 12.32 C ATOM 0 HA PRO A 77 -4.481 3.152 17.174 1.00 15.03 H new ATOM 0 HB2 PRO A 77 -3.937 5.820 17.682 1.00 44.21 H new ATOM 0 HB3 PRO A 77 -3.777 4.634 18.962 1.00 44.21 H new ATOM 0 HG2 PRO A 77 -1.614 5.821 17.205 1.00 4.13 H new ATOM 0 HG3 PRO A 77 -1.603 5.584 18.941 1.00 4.13 H new ATOM 0 HD2 PRO A 77 -0.346 3.825 17.287 1.00 12.32 H new ATOM 0 HD3 PRO A 77 -1.116 3.274 18.761 1.00 12.32 H new ATOM 1258 N ASN A 78 -5.178 4.613 15.208 1.00 50.51 N ATOM 1259 CA ASN A 78 -5.591 5.121 13.870 1.00 74.45 C ATOM 1260 C ASN A 78 -4.763 6.348 13.419 1.00 74.41 C ATOM 1261 O ASN A 78 -4.349 6.410 12.270 1.00 42.22 O ATOM 1262 CB ASN A 78 -7.101 5.466 13.851 1.00 74.52 C ATOM 1263 CG ASN A 78 -8.007 4.257 14.081 1.00 33.43 C ATOM 1264 OD1 ASN A 78 -7.667 3.126 13.744 1.00 41.42 O ATOM 1265 ND2 ASN A 78 -9.170 4.490 14.652 1.00 11.33 N ATOM 0 H ASN A 78 -5.953 4.501 15.861 1.00 50.51 H new ATOM 0 HA ASN A 78 -5.397 4.316 13.161 1.00 74.45 H new ATOM 0 HB2 ASN A 78 -7.304 6.213 14.618 1.00 74.52 H new ATOM 0 HB3 ASN A 78 -7.350 5.919 12.891 1.00 74.52 H new ATOM 0 HD21 ASN A 78 -9.816 3.720 14.825 1.00 11.33 H new ATOM 0 HD22 ASN A 78 -9.425 5.440 14.921 1.00 11.33 H new ATOM 1272 N THR A 79 -4.500 7.292 14.354 1.00 5.44 N ATOM 1273 CA THR A 79 -3.657 8.496 14.095 1.00 42.13 C ATOM 1274 C THR A 79 -2.261 8.105 13.530 1.00 1.20 C ATOM 1275 O THR A 79 -1.770 8.711 12.567 1.00 5.23 O ATOM 1276 CB THR A 79 -3.445 9.357 15.395 1.00 11.35 C ATOM 1277 OG1 THR A 79 -4.695 9.589 16.058 1.00 31.01 O ATOM 1278 CG2 THR A 79 -2.793 10.721 15.084 1.00 53.12 C ATOM 0 H THR A 79 -4.862 7.246 15.307 1.00 5.44 H new ATOM 0 HA THR A 79 -4.198 9.088 13.357 1.00 42.13 H new ATOM 0 HB THR A 79 -2.777 8.787 16.041 1.00 11.35 H new ATOM 0 HG1 THR A 79 -4.543 10.124 16.865 1.00 31.01 H new ATOM 0 HG21 THR A 79 -2.665 11.283 16.009 1.00 53.12 H new ATOM 0 HG22 THR A 79 -1.820 10.562 14.619 1.00 53.12 H new ATOM 0 HG23 THR A 79 -3.433 11.283 14.404 1.00 53.12 H new ATOM 1286 N LYS A 80 -1.655 7.051 14.122 1.00 24.23 N ATOM 1287 CA LYS A 80 -0.339 6.530 13.691 1.00 43.44 C ATOM 1288 C LYS A 80 -0.437 5.724 12.365 1.00 23.34 C ATOM 1289 O LYS A 80 0.492 5.745 11.556 1.00 32.11 O ATOM 1290 CB LYS A 80 0.305 5.676 14.813 1.00 70.32 C ATOM 1291 CG LYS A 80 1.719 5.133 14.484 1.00 10.23 C ATOM 1292 CD LYS A 80 2.826 6.218 14.331 1.00 4.41 C ATOM 1293 CE LYS A 80 3.298 6.849 15.654 1.00 42.45 C ATOM 1294 NZ LYS A 80 2.282 7.726 16.292 1.00 24.44 N ATOM 0 H LYS A 80 -2.061 6.541 14.906 1.00 24.23 H new ATOM 0 HA LYS A 80 0.304 7.389 13.497 1.00 43.44 H new ATOM 0 HB2 LYS A 80 0.364 6.278 15.720 1.00 70.32 H new ATOM 0 HB3 LYS A 80 -0.351 4.833 15.031 1.00 70.32 H new ATOM 0 HG2 LYS A 80 2.017 4.441 15.271 1.00 10.23 H new ATOM 0 HG3 LYS A 80 1.664 4.559 13.559 1.00 10.23 H new ATOM 0 HD2 LYS A 80 3.685 5.772 13.830 1.00 4.41 H new ATOM 0 HD3 LYS A 80 2.453 7.009 13.680 1.00 4.41 H new ATOM 0 HE2 LYS A 80 3.568 6.054 16.350 1.00 42.45 H new ATOM 0 HE3 LYS A 80 4.201 7.430 15.468 1.00 42.45 H new ATOM 0 HZ1 LYS A 80 2.760 8.496 16.803 1.00 24.44 H new ATOM 0 HZ2 LYS A 80 1.662 8.128 15.560 1.00 24.44 H new ATOM 0 HZ3 LYS A 80 1.712 7.168 16.960 1.00 24.44 H new ATOM 1308 N VAL A 81 -1.568 5.025 12.148 1.00 75.52 N ATOM 1309 CA VAL A 81 -1.843 4.299 10.875 1.00 44.21 C ATOM 1310 C VAL A 81 -1.979 5.294 9.686 1.00 3.11 C ATOM 1311 O VAL A 81 -1.624 4.982 8.548 1.00 51.40 O ATOM 1312 CB VAL A 81 -3.148 3.420 10.988 1.00 61.41 C ATOM 1313 CG1 VAL A 81 -3.452 2.654 9.667 1.00 4.12 C ATOM 1314 CG2 VAL A 81 -3.051 2.444 12.188 1.00 74.00 C ATOM 0 H VAL A 81 -2.315 4.943 12.837 1.00 75.52 H new ATOM 0 HA VAL A 81 -0.996 3.639 10.688 1.00 44.21 H new ATOM 0 HB VAL A 81 -3.983 4.099 11.163 1.00 61.41 H new ATOM 0 HG11 VAL A 81 -4.359 2.062 9.790 1.00 4.12 H new ATOM 0 HG12 VAL A 81 -3.593 3.369 8.856 1.00 4.12 H new ATOM 0 HG13 VAL A 81 -2.618 1.994 9.429 1.00 4.12 H new ATOM 0 HG21 VAL A 81 -3.962 1.848 12.247 1.00 74.00 H new ATOM 0 HG22 VAL A 81 -2.194 1.785 12.052 1.00 74.00 H new ATOM 0 HG23 VAL A 81 -2.929 3.012 13.110 1.00 74.00 H new ATOM 1324 N ILE A 82 -2.491 6.501 9.984 1.00 23.10 N ATOM 1325 CA ILE A 82 -2.644 7.595 9.001 1.00 15.31 C ATOM 1326 C ILE A 82 -1.276 8.226 8.657 1.00 42.32 C ATOM 1327 O ILE A 82 -0.936 8.363 7.483 1.00 1.14 O ATOM 1328 CB ILE A 82 -3.634 8.692 9.546 1.00 2.42 C ATOM 1329 CG1 ILE A 82 -5.046 8.069 9.787 1.00 25.40 C ATOM 1330 CG2 ILE A 82 -3.726 9.929 8.601 1.00 3.13 C ATOM 1331 CD1 ILE A 82 -5.990 8.934 10.596 1.00 64.44 C ATOM 0 H ILE A 82 -2.813 6.749 10.919 1.00 23.10 H new ATOM 0 HA ILE A 82 -3.061 7.172 8.087 1.00 15.31 H new ATOM 0 HB ILE A 82 -3.236 9.051 10.495 1.00 2.42 H new ATOM 0 HG12 ILE A 82 -5.505 7.859 8.821 1.00 25.40 H new ATOM 0 HG13 ILE A 82 -4.924 7.113 10.296 1.00 25.40 H new ATOM 0 HG21 ILE A 82 -4.421 10.657 9.021 1.00 3.13 H new ATOM 0 HG22 ILE A 82 -2.741 10.384 8.501 1.00 3.13 H new ATOM 0 HG23 ILE A 82 -4.081 9.612 7.620 1.00 3.13 H new ATOM 0 HD11 ILE A 82 -6.944 8.421 10.712 1.00 64.44 H new ATOM 0 HD12 ILE A 82 -5.558 9.124 11.579 1.00 64.44 H new ATOM 0 HD13 ILE A 82 -6.148 9.881 10.080 1.00 64.44 H new ATOM 1343 N GLU A 83 -0.486 8.584 9.690 1.00 43.43 N ATOM 1344 CA GLU A 83 0.801 9.300 9.492 1.00 24.24 C ATOM 1345 C GLU A 83 1.882 8.372 8.870 1.00 64.04 C ATOM 1346 O GLU A 83 2.703 8.827 8.074 1.00 64.22 O ATOM 1347 CB GLU A 83 1.301 9.931 10.825 1.00 32.34 C ATOM 1348 CG GLU A 83 1.731 8.922 11.898 1.00 24.44 C ATOM 1349 CD GLU A 83 2.124 9.571 13.235 1.00 2.04 C ATOM 1350 OE1 GLU A 83 3.280 10.030 13.363 1.00 52.55 O ATOM 1351 OE2 GLU A 83 1.291 9.596 14.172 1.00 34.21 O ATOM 0 H GLU A 83 -0.711 8.392 10.666 1.00 43.43 H new ATOM 0 HA GLU A 83 0.620 10.109 8.784 1.00 24.24 H new ATOM 0 HB2 GLU A 83 2.144 10.587 10.606 1.00 32.34 H new ATOM 0 HB3 GLU A 83 0.508 10.557 11.233 1.00 32.34 H new ATOM 0 HG2 GLU A 83 0.916 8.220 12.071 1.00 24.44 H new ATOM 0 HG3 GLU A 83 2.575 8.344 11.523 1.00 24.44 H new ATOM 1358 N LEU A 84 1.873 7.073 9.248 1.00 21.13 N ATOM 1359 CA LEU A 84 2.746 6.043 8.640 1.00 33.42 C ATOM 1360 C LEU A 84 2.199 5.594 7.270 1.00 25.35 C ATOM 1361 O LEU A 84 2.960 5.503 6.313 1.00 71.31 O ATOM 1362 CB LEU A 84 2.906 4.806 9.584 1.00 44.25 C ATOM 1363 CG LEU A 84 3.764 5.023 10.872 1.00 12.13 C ATOM 1364 CD1 LEU A 84 3.801 3.745 11.741 1.00 3.31 C ATOM 1365 CD2 LEU A 84 5.193 5.506 10.534 1.00 42.05 C ATOM 0 H LEU A 84 1.263 6.711 9.980 1.00 21.13 H new ATOM 0 HA LEU A 84 3.728 6.493 8.494 1.00 33.42 H new ATOM 0 HB2 LEU A 84 1.912 4.476 9.887 1.00 44.25 H new ATOM 0 HB3 LEU A 84 3.351 3.993 9.010 1.00 44.25 H new ATOM 0 HG LEU A 84 3.282 5.811 11.452 1.00 12.13 H new ATOM 0 HD11 LEU A 84 4.405 3.927 12.630 1.00 3.31 H new ATOM 0 HD12 LEU A 84 2.787 3.479 12.040 1.00 3.31 H new ATOM 0 HD13 LEU A 84 4.237 2.927 11.167 1.00 3.31 H new ATOM 0 HD21 LEU A 84 5.758 5.645 11.456 1.00 42.05 H new ATOM 0 HD22 LEU A 84 5.691 4.762 9.912 1.00 42.05 H new ATOM 0 HD23 LEU A 84 5.139 6.452 9.995 1.00 42.05 H new ATOM 1377 N GLY A 85 0.875 5.354 7.188 1.00 75.43 N ATOM 1378 CA GLY A 85 0.240 4.801 5.977 1.00 54.13 C ATOM 1379 C GLY A 85 0.309 5.731 4.772 1.00 12.11 C ATOM 1380 O GLY A 85 0.722 5.321 3.689 1.00 11.22 O ATOM 0 H GLY A 85 0.223 5.536 7.951 1.00 75.43 H new ATOM 0 HA2 GLY A 85 0.721 3.856 5.724 1.00 54.13 H new ATOM 0 HA3 GLY A 85 -0.805 4.579 6.194 1.00 54.13 H new ATOM 1384 N THR A 86 -0.086 6.995 4.982 1.00 71.10 N ATOM 1385 CA THR A 86 0.090 8.075 3.979 1.00 53.11 C ATOM 1386 C THR A 86 1.574 8.198 3.566 1.00 31.45 C ATOM 1387 O THR A 86 1.872 8.313 2.406 1.00 73.25 O ATOM 1388 CB THR A 86 -0.416 9.459 4.512 1.00 10.43 C ATOM 1389 OG1 THR A 86 -1.808 9.359 4.859 1.00 72.35 O ATOM 1390 CG2 THR A 86 -0.224 10.615 3.501 1.00 4.33 C ATOM 0 H THR A 86 -0.535 7.304 5.844 1.00 71.10 H new ATOM 0 HA THR A 86 -0.511 7.802 3.112 1.00 53.11 H new ATOM 0 HB THR A 86 0.190 9.698 5.386 1.00 10.43 H new ATOM 0 HG1 THR A 86 -1.894 9.003 5.768 1.00 72.35 H new ATOM 0 HG21 THR A 86 -0.596 11.543 3.935 1.00 4.33 H new ATOM 0 HG22 THR A 86 0.835 10.722 3.268 1.00 4.33 H new ATOM 0 HG23 THR A 86 -0.776 10.395 2.587 1.00 4.33 H new ATOM 1398 N LYS A 87 2.494 8.078 4.533 1.00 74.31 N ATOM 1399 CA LYS A 87 3.958 8.185 4.280 1.00 24.41 C ATOM 1400 C LYS A 87 4.498 6.935 3.502 1.00 11.22 C ATOM 1401 O LYS A 87 5.539 7.013 2.838 1.00 23.13 O ATOM 1402 CB LYS A 87 4.694 8.411 5.637 1.00 21.02 C ATOM 1403 CG LYS A 87 6.241 8.631 5.573 1.00 24.44 C ATOM 1404 CD LYS A 87 7.068 7.337 5.818 1.00 32.42 C ATOM 1405 CE LYS A 87 6.823 6.743 7.218 1.00 42.52 C ATOM 1406 NZ LYS A 87 7.190 7.695 8.306 1.00 4.23 N ATOM 0 H LYS A 87 2.258 7.905 5.510 1.00 74.31 H new ATOM 0 HA LYS A 87 4.155 9.042 3.636 1.00 24.41 H new ATOM 0 HB2 LYS A 87 4.248 9.277 6.125 1.00 21.02 H new ATOM 0 HB3 LYS A 87 4.500 7.550 6.276 1.00 21.02 H new ATOM 0 HG2 LYS A 87 6.501 9.038 4.596 1.00 24.44 H new ATOM 0 HG3 LYS A 87 6.524 9.378 6.315 1.00 24.44 H new ATOM 0 HD2 LYS A 87 6.811 6.596 5.061 1.00 32.42 H new ATOM 0 HD3 LYS A 87 8.129 7.559 5.700 1.00 32.42 H new ATOM 0 HE2 LYS A 87 5.772 6.469 7.316 1.00 42.52 H new ATOM 0 HE3 LYS A 87 7.403 5.827 7.329 1.00 42.52 H new ATOM 0 HZ1 LYS A 87 7.122 7.214 9.226 1.00 4.23 H new ATOM 0 HZ2 LYS A 87 8.164 8.029 8.161 1.00 4.23 H new ATOM 0 HZ3 LYS A 87 6.540 8.507 8.291 1.00 4.23 H new ATOM 1420 N HIS A 88 3.762 5.797 3.569 1.00 54.01 N ATOM 1421 CA HIS A 88 4.111 4.532 2.854 1.00 4.31 C ATOM 1422 C HIS A 88 3.537 4.491 1.411 1.00 30.24 C ATOM 1423 O HIS A 88 3.851 3.578 0.647 1.00 11.23 O ATOM 1424 CB HIS A 88 3.558 3.306 3.640 1.00 1.31 C ATOM 1425 CG HIS A 88 4.192 3.057 4.981 1.00 71.01 C ATOM 1426 ND1 HIS A 88 3.668 2.174 5.901 1.00 60.51 N ATOM 1427 CD2 HIS A 88 5.328 3.540 5.541 1.00 13.54 C ATOM 1428 CE1 HIS A 88 4.444 2.132 6.961 1.00 5.20 C ATOM 1429 NE2 HIS A 88 5.458 2.948 6.772 1.00 31.14 N ATOM 0 H HIS A 88 2.907 5.725 4.120 1.00 54.01 H new ATOM 0 HA HIS A 88 5.199 4.494 2.793 1.00 4.31 H new ATOM 0 HB2 HIS A 88 2.486 3.442 3.784 1.00 1.31 H new ATOM 0 HB3 HIS A 88 3.686 2.415 3.026 1.00 1.31 H new ATOM 0 HD2 HIS A 88 6.005 4.257 5.100 1.00 13.54 H new ATOM 0 HE1 HIS A 88 4.277 1.528 7.841 1.00 5.20 H new ATOM 0 HE2 HIS A 88 6.217 3.114 7.433 1.00 31.14 H new ATOM 1438 N PHE A 89 2.682 5.470 1.063 1.00 74.11 N ATOM 1439 CA PHE A 89 1.950 5.525 -0.229 1.00 42.11 C ATOM 1440 C PHE A 89 2.289 6.856 -0.940 1.00 53.41 C ATOM 1441 O PHE A 89 2.841 6.883 -2.039 1.00 2.42 O ATOM 1442 CB PHE A 89 0.409 5.423 0.016 1.00 73.34 C ATOM 1443 CG PHE A 89 -0.131 4.024 0.330 1.00 25.23 C ATOM 1444 CD1 PHE A 89 0.306 3.301 1.440 1.00 2.35 C ATOM 1445 CD2 PHE A 89 -1.084 3.431 -0.492 1.00 13.44 C ATOM 1446 CE1 PHE A 89 -0.186 2.042 1.715 1.00 2.24 C ATOM 1447 CE2 PHE A 89 -1.574 2.175 -0.219 1.00 74.45 C ATOM 1448 CZ PHE A 89 -1.126 1.477 0.883 1.00 62.20 C ATOM 0 H PHE A 89 2.473 6.259 1.675 1.00 74.11 H new ATOM 0 HA PHE A 89 2.253 4.686 -0.856 1.00 42.11 H new ATOM 0 HB2 PHE A 89 0.148 6.085 0.842 1.00 73.34 H new ATOM 0 HB3 PHE A 89 -0.105 5.799 -0.869 1.00 73.34 H new ATOM 0 HD1 PHE A 89 1.044 3.736 2.097 1.00 2.35 H new ATOM 0 HD2 PHE A 89 -1.445 3.965 -1.358 1.00 13.44 H new ATOM 0 HE1 PHE A 89 0.165 1.501 2.581 1.00 2.24 H new ATOM 0 HE2 PHE A 89 -2.313 1.733 -0.871 1.00 74.45 H new ATOM 0 HZ PHE A 89 -1.512 0.490 1.093 1.00 62.20 H new ATOM 1458 N LEU A 90 1.930 7.956 -0.278 1.00 62.22 N ATOM 1459 CA LEU A 90 2.214 9.326 -0.726 1.00 21.02 C ATOM 1460 C LEU A 90 3.271 9.915 0.234 1.00 32.44 C ATOM 1461 O LEU A 90 2.901 10.530 1.231 1.00 4.22 O ATOM 1462 CB LEU A 90 0.901 10.210 -0.740 1.00 55.10 C ATOM 1463 CG LEU A 90 -0.461 9.439 -0.932 1.00 53.22 C ATOM 1464 CD1 LEU A 90 -0.950 8.784 0.374 1.00 62.31 C ATOM 1465 CD2 LEU A 90 -1.562 10.330 -1.515 1.00 62.44 C ATOM 0 H LEU A 90 1.422 7.922 0.606 1.00 62.22 H new ATOM 0 HA LEU A 90 2.591 9.318 -1.749 1.00 21.02 H new ATOM 0 HB2 LEU A 90 0.851 10.763 0.198 1.00 55.10 H new ATOM 0 HB3 LEU A 90 0.993 10.946 -1.539 1.00 55.10 H new ATOM 0 HG LEU A 90 -0.250 8.649 -1.653 1.00 53.22 H new ATOM 0 HD11 LEU A 90 -1.891 8.265 0.191 1.00 62.31 H new ATOM 0 HD12 LEU A 90 -0.204 8.070 0.724 1.00 62.31 H new ATOM 0 HD13 LEU A 90 -1.101 9.552 1.132 1.00 62.31 H new ATOM 0 HD21 LEU A 90 -2.478 9.750 -1.627 1.00 62.44 H new ATOM 0 HD22 LEU A 90 -1.744 11.170 -0.844 1.00 62.44 H new ATOM 0 HD23 LEU A 90 -1.249 10.705 -2.489 1.00 62.44 H new ATOM 1477 N GLY A 91 4.569 9.639 -0.040 1.00 51.51 N ATOM 1478 CA GLY A 91 5.692 9.999 0.865 1.00 2.40 C ATOM 1479 C GLY A 91 5.758 11.487 1.256 1.00 2.10 C ATOM 1480 O GLY A 91 6.560 12.254 0.709 1.00 51.43 O ATOM 0 H GLY A 91 4.868 9.162 -0.891 1.00 51.51 H new ATOM 0 HA2 GLY A 91 5.612 9.403 1.774 1.00 2.40 H new ATOM 0 HA3 GLY A 91 6.630 9.723 0.384 1.00 2.40 H new ATOM 1484 N ARG A 92 4.897 11.878 2.223 1.00 41.34 N ATOM 1485 CA ARG A 92 4.715 13.279 2.663 1.00 2.43 C ATOM 1486 C ARG A 92 4.602 13.369 4.211 1.00 74.05 C ATOM 1487 O ARG A 92 4.156 12.426 4.876 1.00 74.40 O ATOM 1488 CB ARG A 92 3.423 13.904 2.049 1.00 14.41 C ATOM 1489 CG ARG A 92 3.264 13.783 0.510 1.00 23.34 C ATOM 1490 CD ARG A 92 2.075 14.614 -0.036 1.00 52.13 C ATOM 1491 NE ARG A 92 0.805 14.380 0.708 1.00 40.32 N ATOM 1492 CZ ARG A 92 0.275 15.196 1.613 1.00 41.42 C ATOM 1493 NH1 ARG A 92 0.889 16.271 1.980 1.00 22.00 N ATOM 1494 NH2 ARG A 92 -0.858 14.902 2.173 1.00 52.42 N ATOM 0 H ARG A 92 4.302 11.220 2.726 1.00 41.34 H new ATOM 0 HA ARG A 92 5.591 13.829 2.319 1.00 2.43 H new ATOM 0 HB2 ARG A 92 2.559 13.435 2.520 1.00 14.41 H new ATOM 0 HB3 ARG A 92 3.395 14.961 2.314 1.00 14.41 H new ATOM 0 HG2 ARG A 92 4.184 14.112 0.027 1.00 23.34 H new ATOM 0 HG3 ARG A 92 3.122 12.735 0.245 1.00 23.34 H new ATOM 0 HD2 ARG A 92 2.327 15.673 0.013 1.00 52.13 H new ATOM 0 HD3 ARG A 92 1.923 14.371 -1.088 1.00 52.13 H new ATOM 0 HE ARG A 92 0.298 13.518 0.505 1.00 40.32 H new ATOM 0 HH11 ARG A 92 1.795 16.505 1.574 1.00 22.00 H new ATOM 0 HH12 ARG A 92 0.468 16.886 2.676 1.00 22.00 H new ATOM 0 HH21 ARG A 92 -1.345 14.042 1.919 1.00 52.42 H new ATOM 0 HH22 ARG A 92 -1.262 15.531 2.867 1.00 52.42 H new ATOM 1508 N ALA A 93 5.024 14.520 4.754 1.00 62.21 N ATOM 1509 CA ALA A 93 4.767 14.895 6.163 1.00 13.31 C ATOM 1510 C ALA A 93 3.262 15.250 6.375 1.00 2.43 C ATOM 1511 O ALA A 93 2.694 16.000 5.564 1.00 52.14 O ATOM 1512 CB ALA A 93 5.672 16.072 6.573 1.00 31.23 C ATOM 0 H ALA A 93 5.553 15.220 4.234 1.00 62.21 H new ATOM 0 HA ALA A 93 5.002 14.041 6.799 1.00 13.31 H new ATOM 0 HB1 ALA A 93 5.474 16.339 7.611 1.00 31.23 H new ATOM 0 HB2 ALA A 93 6.717 15.782 6.466 1.00 31.23 H new ATOM 0 HB3 ALA A 93 5.466 16.930 5.932 1.00 31.23 H new ATOM 1518 N PRO A 94 2.588 14.690 7.448 1.00 52.31 N ATOM 1519 CA PRO A 94 1.163 15.011 7.783 1.00 64.20 C ATOM 1520 C PRO A 94 0.868 16.535 7.878 1.00 65.20 C ATOM 1521 O PRO A 94 1.634 17.292 8.486 1.00 70.02 O ATOM 1522 CB PRO A 94 0.952 14.310 9.151 1.00 33.30 C ATOM 1523 CG PRO A 94 1.914 13.164 9.123 1.00 13.12 C ATOM 1524 CD PRO A 94 3.139 13.671 8.389 1.00 24.24 C ATOM 0 HA PRO A 94 0.484 14.670 7.002 1.00 64.20 H new ATOM 0 HB2 PRO A 94 1.159 14.985 9.981 1.00 33.30 H new ATOM 0 HB3 PRO A 94 -0.075 13.966 9.269 1.00 33.30 H new ATOM 0 HG2 PRO A 94 2.169 12.842 10.133 1.00 13.12 H new ATOM 0 HG3 PRO A 94 1.482 12.303 8.614 1.00 13.12 H new ATOM 0 HD2 PRO A 94 3.864 14.109 9.075 1.00 24.24 H new ATOM 0 HD3 PRO A 94 3.648 12.868 7.857 1.00 24.24 H new ATOM 1532 N ILE A 95 -0.262 16.955 7.284 1.00 34.13 N ATOM 1533 CA ILE A 95 -0.605 18.381 7.099 1.00 50.03 C ATOM 1534 C ILE A 95 -1.248 19.013 8.363 1.00 60.25 C ATOM 1535 O ILE A 95 -0.633 19.843 9.037 1.00 14.12 O ATOM 1536 CB ILE A 95 -1.565 18.552 5.850 1.00 53.44 C ATOM 1537 CG1 ILE A 95 -0.882 18.003 4.553 1.00 75.43 C ATOM 1538 CG2 ILE A 95 -2.014 20.029 5.663 1.00 71.24 C ATOM 1539 CD1 ILE A 95 0.410 18.712 4.157 1.00 75.24 C ATOM 0 H ILE A 95 -0.967 16.316 6.917 1.00 34.13 H new ATOM 0 HA ILE A 95 0.329 18.914 6.920 1.00 50.03 H new ATOM 0 HB ILE A 95 -2.464 17.966 6.042 1.00 53.44 H new ATOM 0 HG12 ILE A 95 -0.669 16.943 4.693 1.00 75.43 H new ATOM 0 HG13 ILE A 95 -1.589 18.080 3.727 1.00 75.43 H new ATOM 0 HG21 ILE A 95 -2.671 20.103 4.796 1.00 71.24 H new ATOM 0 HG22 ILE A 95 -2.548 20.362 6.553 1.00 71.24 H new ATOM 0 HG23 ILE A 95 -1.138 20.659 5.509 1.00 71.24 H new ATOM 0 HD11 ILE A 95 0.808 18.262 3.248 1.00 75.24 H new ATOM 0 HD12 ILE A 95 0.206 19.768 3.980 1.00 75.24 H new ATOM 0 HD13 ILE A 95 1.140 18.613 4.960 1.00 75.24 H new ATOM 1551 N ASP A 96 -2.474 18.596 8.688 1.00 23.22 N ATOM 1552 CA ASP A 96 -3.343 19.291 9.662 1.00 54.42 C ATOM 1553 C ASP A 96 -4.220 18.249 10.389 1.00 54.04 C ATOM 1554 O ASP A 96 -4.439 17.153 9.850 1.00 72.12 O ATOM 1555 CB ASP A 96 -4.204 20.324 8.877 1.00 42.13 C ATOM 1556 CG ASP A 96 -5.150 21.148 9.751 1.00 41.04 C ATOM 1557 OD1 ASP A 96 -4.695 22.135 10.363 1.00 30.21 O ATOM 1558 OD2 ASP A 96 -6.345 20.808 9.836 1.00 52.10 O ATOM 0 H ASP A 96 -2.901 17.762 8.285 1.00 23.22 H new ATOM 0 HA ASP A 96 -2.760 19.817 10.418 1.00 54.42 H new ATOM 0 HB2 ASP A 96 -3.539 21.002 8.342 1.00 42.13 H new ATOM 0 HB3 ASP A 96 -4.790 19.795 8.126 1.00 42.13 H new ATOM 1563 N GLN A 97 -4.716 18.564 11.606 1.00 34.43 N ATOM 1564 CA GLN A 97 -5.576 17.647 12.386 1.00 3.15 C ATOM 1565 C GLN A 97 -6.866 17.244 11.634 1.00 23.10 C ATOM 1566 O GLN A 97 -7.261 16.092 11.699 1.00 34.03 O ATOM 1567 CB GLN A 97 -5.929 18.285 13.755 1.00 31.54 C ATOM 1568 CG GLN A 97 -6.776 17.404 14.710 1.00 74.31 C ATOM 1569 CD GLN A 97 -6.093 16.086 15.105 1.00 75.22 C ATOM 1570 OE1 GLN A 97 -5.357 16.021 16.082 1.00 42.12 O ATOM 1571 NE2 GLN A 97 -6.339 15.025 14.352 1.00 51.11 N ATOM 0 H GLN A 97 -4.534 19.453 12.072 1.00 34.43 H new ATOM 0 HA GLN A 97 -5.005 16.731 12.541 1.00 3.15 H new ATOM 0 HB2 GLN A 97 -5.001 18.549 14.262 1.00 31.54 H new ATOM 0 HB3 GLN A 97 -6.469 19.214 13.573 1.00 31.54 H new ATOM 0 HG2 GLN A 97 -6.998 17.973 15.613 1.00 74.31 H new ATOM 0 HG3 GLN A 97 -7.730 17.180 14.232 1.00 74.31 H new ATOM 0 HE21 GLN A 97 -6.956 15.105 13.544 1.00 51.11 H new ATOM 0 HE22 GLN A 97 -5.912 14.127 14.580 1.00 51.11 H new ATOM 1580 N ALA A 98 -7.508 18.189 10.927 1.00 13.13 N ATOM 1581 CA ALA A 98 -8.748 17.906 10.142 1.00 43.53 C ATOM 1582 C ALA A 98 -8.506 16.862 9.015 1.00 12.40 C ATOM 1583 O ALA A 98 -9.404 16.089 8.670 1.00 12.03 O ATOM 1584 CB ALA A 98 -9.327 19.203 9.557 1.00 31.54 C ATOM 0 H ALA A 98 -7.198 19.159 10.875 1.00 13.13 H new ATOM 0 HA ALA A 98 -9.472 17.475 10.833 1.00 43.53 H new ATOM 0 HB1 ALA A 98 -10.229 18.975 8.989 1.00 31.54 H new ATOM 0 HB2 ALA A 98 -9.572 19.890 10.367 1.00 31.54 H new ATOM 0 HB3 ALA A 98 -8.591 19.666 8.899 1.00 31.54 H new ATOM 1590 N GLU A 99 -7.276 16.859 8.461 1.00 73.24 N ATOM 1591 CA GLU A 99 -6.824 15.851 7.465 1.00 75.33 C ATOM 1592 C GLU A 99 -6.749 14.435 8.103 1.00 23.22 C ATOM 1593 O GLU A 99 -7.140 13.435 7.488 1.00 72.13 O ATOM 1594 CB GLU A 99 -5.441 16.281 6.874 1.00 12.03 C ATOM 1595 CG GLU A 99 -4.850 15.349 5.773 1.00 55.23 C ATOM 1596 CD GLU A 99 -5.611 15.322 4.422 1.00 60.02 C ATOM 1597 OE1 GLU A 99 -6.560 16.119 4.205 1.00 1.24 O ATOM 1598 OE2 GLU A 99 -5.245 14.495 3.554 1.00 75.15 O ATOM 0 H GLU A 99 -6.564 17.553 8.688 1.00 73.24 H new ATOM 0 HA GLU A 99 -7.550 15.803 6.654 1.00 75.33 H new ATOM 0 HB2 GLU A 99 -5.542 17.283 6.458 1.00 12.03 H new ATOM 0 HB3 GLU A 99 -4.723 16.346 7.691 1.00 12.03 H new ATOM 0 HG2 GLU A 99 -3.821 15.654 5.581 1.00 55.23 H new ATOM 0 HG3 GLU A 99 -4.813 14.333 6.167 1.00 55.23 H new ATOM 1605 N ILE A 100 -6.258 14.381 9.358 1.00 73.21 N ATOM 1606 CA ILE A 100 -6.203 13.139 10.162 1.00 54.01 C ATOM 1607 C ILE A 100 -7.633 12.646 10.523 1.00 15.32 C ATOM 1608 O ILE A 100 -7.951 11.484 10.322 1.00 50.42 O ATOM 1609 CB ILE A 100 -5.349 13.355 11.472 1.00 53.53 C ATOM 1610 CG1 ILE A 100 -3.884 13.781 11.109 1.00 70.35 C ATOM 1611 CG2 ILE A 100 -5.363 12.104 12.392 1.00 33.02 C ATOM 1612 CD1 ILE A 100 -2.971 14.040 12.307 1.00 42.35 C ATOM 0 H ILE A 100 -5.888 15.197 9.845 1.00 73.21 H new ATOM 0 HA ILE A 100 -5.719 12.372 9.558 1.00 54.01 H new ATOM 0 HB ILE A 100 -5.812 14.164 12.037 1.00 53.53 H new ATOM 0 HG12 ILE A 100 -3.437 13.001 10.493 1.00 70.35 H new ATOM 0 HG13 ILE A 100 -3.925 14.684 10.500 1.00 70.35 H new ATOM 0 HG21 ILE A 100 -4.762 12.299 13.281 1.00 33.02 H new ATOM 0 HG22 ILE A 100 -6.388 11.882 12.688 1.00 33.02 H new ATOM 0 HG23 ILE A 100 -4.948 11.252 11.854 1.00 33.02 H new ATOM 0 HD11 ILE A 100 -1.981 14.328 11.954 1.00 42.35 H new ATOM 0 HD12 ILE A 100 -3.388 14.843 12.915 1.00 42.35 H new ATOM 0 HD13 ILE A 100 -2.892 13.134 12.907 1.00 42.35 H new ATOM 1624 N ARG A 101 -8.471 13.557 11.066 1.00 25.44 N ATOM 1625 CA ARG A 101 -9.895 13.293 11.413 1.00 65.35 C ATOM 1626 C ARG A 101 -10.686 12.691 10.232 1.00 51.12 C ATOM 1627 O ARG A 101 -11.498 11.780 10.419 1.00 3.12 O ATOM 1628 CB ARG A 101 -10.586 14.609 11.874 1.00 4.24 C ATOM 1629 CG ARG A 101 -9.991 15.251 13.144 1.00 72.04 C ATOM 1630 CD ARG A 101 -10.148 14.357 14.383 1.00 32.21 C ATOM 1631 NE ARG A 101 -11.564 14.136 14.738 1.00 52.23 N ATOM 1632 CZ ARG A 101 -12.018 13.160 15.494 1.00 1.04 C ATOM 1633 NH1 ARG A 101 -11.232 12.233 15.948 1.00 13.32 N ATOM 1634 NH2 ARG A 101 -13.276 13.108 15.780 1.00 70.13 N ATOM 0 H ARG A 101 -8.178 14.510 11.280 1.00 25.44 H new ATOM 0 HA ARG A 101 -9.895 12.563 12.222 1.00 65.35 H new ATOM 0 HB2 ARG A 101 -10.533 15.333 11.061 1.00 4.24 H new ATOM 0 HB3 ARG A 101 -11.642 14.404 12.050 1.00 4.24 H new ATOM 0 HG2 ARG A 101 -8.933 15.458 12.981 1.00 72.04 H new ATOM 0 HG3 ARG A 101 -10.479 16.208 13.326 1.00 72.04 H new ATOM 0 HD2 ARG A 101 -9.668 13.396 14.198 1.00 32.21 H new ATOM 0 HD3 ARG A 101 -9.631 14.815 15.227 1.00 32.21 H new ATOM 0 HE ARG A 101 -12.247 14.795 14.366 1.00 52.23 H new ATOM 0 HH11 ARG A 101 -10.238 12.251 15.720 1.00 13.32 H new ATOM 0 HH12 ARG A 101 -11.608 11.487 16.533 1.00 13.32 H new ATOM 0 HH21 ARG A 101 -13.911 13.821 15.420 1.00 70.13 H new ATOM 0 HH22 ARG A 101 -13.635 12.354 16.366 1.00 70.13 H new ATOM 1648 N LYS A 102 -10.421 13.225 9.026 1.00 62.34 N ATOM 1649 CA LYS A 102 -11.015 12.738 7.764 1.00 30.22 C ATOM 1650 C LYS A 102 -10.726 11.229 7.554 1.00 71.53 C ATOM 1651 O LYS A 102 -11.649 10.433 7.383 1.00 5.31 O ATOM 1652 CB LYS A 102 -10.439 13.555 6.579 1.00 32.44 C ATOM 1653 CG LYS A 102 -11.011 13.190 5.184 1.00 51.32 C ATOM 1654 CD LYS A 102 -10.219 13.839 4.026 1.00 44.51 C ATOM 1655 CE LYS A 102 -8.767 13.335 3.967 1.00 21.14 C ATOM 1656 NZ LYS A 102 -8.018 13.880 2.810 1.00 35.40 N ATOM 0 H LYS A 102 -9.785 14.012 8.897 1.00 62.34 H new ATOM 0 HA LYS A 102 -12.096 12.869 7.815 1.00 30.22 H new ATOM 0 HB2 LYS A 102 -10.624 14.613 6.764 1.00 32.44 H new ATOM 0 HB3 LYS A 102 -9.358 13.420 6.557 1.00 32.44 H new ATOM 0 HG2 LYS A 102 -11.000 12.107 5.064 1.00 51.32 H new ATOM 0 HG3 LYS A 102 -12.053 13.507 5.129 1.00 51.32 H new ATOM 0 HD2 LYS A 102 -10.716 13.623 3.081 1.00 44.51 H new ATOM 0 HD3 LYS A 102 -10.222 14.922 4.147 1.00 44.51 H new ATOM 0 HE2 LYS A 102 -8.254 13.610 4.889 1.00 21.14 H new ATOM 0 HE3 LYS A 102 -8.767 12.246 3.914 1.00 21.14 H new ATOM 0 HZ1 LYS A 102 -6.997 13.768 2.974 1.00 35.40 H new ATOM 0 HZ2 LYS A 102 -8.289 13.365 1.948 1.00 35.40 H new ATOM 0 HZ3 LYS A 102 -8.242 14.889 2.696 1.00 35.40 H new ATOM 1670 N TYR A 103 -9.433 10.847 7.639 1.00 64.04 N ATOM 1671 CA TYR A 103 -8.993 9.452 7.415 1.00 1.25 C ATOM 1672 C TYR A 103 -9.399 8.518 8.579 1.00 74.22 C ATOM 1673 O TYR A 103 -9.769 7.376 8.336 1.00 42.15 O ATOM 1674 CB TYR A 103 -7.463 9.381 7.176 1.00 12.15 C ATOM 1675 CG TYR A 103 -7.002 9.915 5.810 1.00 50.44 C ATOM 1676 CD1 TYR A 103 -7.520 9.385 4.621 1.00 74.45 C ATOM 1677 CD2 TYR A 103 -6.054 10.933 5.704 1.00 74.02 C ATOM 1678 CE1 TYR A 103 -7.110 9.853 3.387 1.00 33.02 C ATOM 1679 CE2 TYR A 103 -5.641 11.401 4.475 1.00 22.12 C ATOM 1680 CZ TYR A 103 -6.170 10.862 3.318 1.00 63.33 C ATOM 1681 OH TYR A 103 -5.762 11.340 2.090 1.00 61.43 O ATOM 0 H TYR A 103 -8.672 11.489 7.862 1.00 64.04 H new ATOM 0 HA TYR A 103 -9.504 9.102 6.518 1.00 1.25 H new ATOM 0 HB2 TYR A 103 -6.960 9.946 7.961 1.00 12.15 H new ATOM 0 HB3 TYR A 103 -7.141 8.344 7.273 1.00 12.15 H new ATOM 0 HD1 TYR A 103 -8.255 8.595 4.670 1.00 74.45 H new ATOM 0 HD2 TYR A 103 -5.636 11.363 6.602 1.00 74.02 H new ATOM 0 HE1 TYR A 103 -7.522 9.432 2.482 1.00 33.02 H new ATOM 0 HE2 TYR A 103 -4.904 12.189 4.416 1.00 22.12 H new ATOM 0 HH TYR A 103 -5.098 12.049 2.219 1.00 61.43 H new ATOM 1691 N ASN A 104 -9.357 9.012 9.831 1.00 53.22 N ATOM 1692 CA ASN A 104 -9.717 8.231 11.045 1.00 32.11 C ATOM 1693 C ASN A 104 -11.210 7.835 11.035 1.00 31.15 C ATOM 1694 O ASN A 104 -11.576 6.708 11.409 1.00 51.23 O ATOM 1695 CB ASN A 104 -9.350 9.078 12.311 1.00 21.10 C ATOM 1696 CG ASN A 104 -10.153 8.732 13.574 1.00 65.34 C ATOM 1697 OD1 ASN A 104 -9.711 7.746 14.327 1.00 13.41 O flip ATOM 1698 ND2 ASN A 104 -11.176 9.347 13.860 1.00 4.34 N flip ATOM 0 H ASN A 104 -9.071 9.969 10.037 1.00 53.22 H new ATOM 0 HA ASN A 104 -9.152 7.299 11.062 1.00 32.11 H new ATOM 0 HB2 ASN A 104 -8.289 8.945 12.524 1.00 21.10 H new ATOM 0 HB3 ASN A 104 -9.499 10.133 12.081 1.00 21.10 H new ATOM 0 HD21 ASN A 104 -11.498 10.107 13.261 1.00 4.34 H new ATOM 0 HD22 ASN A 104 -11.704 9.098 14.697 1.00 4.34 H new ATOM 1705 N GLN A 105 -12.055 8.783 10.605 1.00 70.33 N ATOM 1706 CA GLN A 105 -13.505 8.562 10.487 1.00 33.22 C ATOM 1707 C GLN A 105 -13.822 7.540 9.366 1.00 1.01 C ATOM 1708 O GLN A 105 -14.811 6.815 9.458 1.00 20.35 O ATOM 1709 CB GLN A 105 -14.253 9.908 10.258 1.00 3.14 C ATOM 1710 CG GLN A 105 -15.793 9.824 10.375 1.00 24.11 C ATOM 1711 CD GLN A 105 -16.271 9.308 11.738 1.00 34.31 C ATOM 1712 OE1 GLN A 105 -16.468 8.004 11.859 1.00 54.30 O flip ATOM 1713 NE2 GLN A 105 -16.455 10.073 12.675 1.00 13.51 N flip ATOM 0 H GLN A 105 -11.756 9.719 10.331 1.00 70.33 H new ATOM 0 HA GLN A 105 -13.862 8.140 11.426 1.00 33.22 H new ATOM 0 HB2 GLN A 105 -13.887 10.638 10.980 1.00 3.14 H new ATOM 0 HB3 GLN A 105 -13.998 10.285 9.267 1.00 3.14 H new ATOM 0 HG2 GLN A 105 -16.218 10.812 10.199 1.00 24.11 H new ATOM 0 HG3 GLN A 105 -16.175 9.169 9.592 1.00 24.11 H new ATOM 0 HE21 GLN A 105 -16.296 11.073 12.555 1.00 13.51 H new ATOM 0 HE22 GLN A 105 -16.767 9.710 13.576 1.00 13.51 H new ATOM 1722 N ILE A 106 -12.947 7.473 8.328 1.00 42.34 N ATOM 1723 CA ILE A 106 -13.053 6.459 7.242 1.00 53.54 C ATOM 1724 C ILE A 106 -12.877 5.030 7.814 1.00 31.14 C ATOM 1725 O ILE A 106 -13.588 4.115 7.404 1.00 40.43 O ATOM 1726 CB ILE A 106 -12.013 6.708 6.075 1.00 13.51 C ATOM 1727 CG1 ILE A 106 -12.299 8.060 5.350 1.00 51.43 C ATOM 1728 CG2 ILE A 106 -11.994 5.535 5.057 1.00 61.30 C ATOM 1729 CD1 ILE A 106 -11.289 8.435 4.267 1.00 13.42 C ATOM 0 H ILE A 106 -12.158 8.110 8.220 1.00 42.34 H new ATOM 0 HA ILE A 106 -14.051 6.559 6.814 1.00 53.54 H new ATOM 0 HB ILE A 106 -11.025 6.763 6.532 1.00 13.51 H new ATOM 0 HG12 ILE A 106 -13.291 8.012 4.900 1.00 51.43 H new ATOM 0 HG13 ILE A 106 -12.325 8.856 6.094 1.00 51.43 H new ATOM 0 HG21 ILE A 106 -11.267 5.746 4.273 1.00 61.30 H new ATOM 0 HG22 ILE A 106 -11.718 4.613 5.569 1.00 61.30 H new ATOM 0 HG23 ILE A 106 -12.983 5.422 4.614 1.00 61.30 H new ATOM 0 HD11 ILE A 106 -11.571 9.389 3.821 1.00 13.42 H new ATOM 0 HD12 ILE A 106 -10.296 8.521 4.709 1.00 13.42 H new ATOM 0 HD13 ILE A 106 -11.278 7.663 3.497 1.00 13.42 H new ATOM 1741 N LEU A 107 -11.951 4.858 8.779 1.00 41.21 N ATOM 1742 CA LEU A 107 -11.738 3.558 9.470 1.00 24.31 C ATOM 1743 C LEU A 107 -13.002 3.118 10.266 1.00 11.31 C ATOM 1744 O LEU A 107 -13.365 1.932 10.269 1.00 1.11 O ATOM 1745 CB LEU A 107 -10.490 3.620 10.421 1.00 51.20 C ATOM 1746 CG LEU A 107 -9.081 3.395 9.775 1.00 72.43 C ATOM 1747 CD1 LEU A 107 -9.026 2.065 9.008 1.00 70.41 C ATOM 1748 CD2 LEU A 107 -8.656 4.578 8.895 1.00 22.24 C ATOM 0 H LEU A 107 -11.334 5.603 9.102 1.00 41.21 H new ATOM 0 HA LEU A 107 -11.549 2.812 8.698 1.00 24.31 H new ATOM 0 HB2 LEU A 107 -10.486 4.595 10.908 1.00 51.20 H new ATOM 0 HB3 LEU A 107 -10.625 2.873 11.204 1.00 51.20 H new ATOM 0 HG LEU A 107 -8.358 3.335 10.589 1.00 72.43 H new ATOM 0 HD11 LEU A 107 -8.036 1.938 8.571 1.00 70.41 H new ATOM 0 HD12 LEU A 107 -9.229 1.242 9.693 1.00 70.41 H new ATOM 0 HD13 LEU A 107 -9.774 2.071 8.215 1.00 70.41 H new ATOM 0 HD21 LEU A 107 -7.673 4.379 8.468 1.00 22.24 H new ATOM 0 HD22 LEU A 107 -9.381 4.713 8.092 1.00 22.24 H new ATOM 0 HD23 LEU A 107 -8.612 5.484 9.500 1.00 22.24 H new ATOM 1760 N ALA A 108 -13.665 4.089 10.921 1.00 45.51 N ATOM 1761 CA ALA A 108 -14.855 3.826 11.772 1.00 31.53 C ATOM 1762 C ALA A 108 -16.145 3.590 10.942 1.00 22.32 C ATOM 1763 O ALA A 108 -17.003 2.791 11.328 1.00 54.23 O ATOM 1764 CB ALA A 108 -15.055 4.992 12.750 1.00 42.24 C ATOM 0 H ALA A 108 -13.399 5.073 10.880 1.00 45.51 H new ATOM 0 HA ALA A 108 -14.666 2.905 12.324 1.00 31.53 H new ATOM 0 HB1 ALA A 108 -15.928 4.798 13.374 1.00 42.24 H new ATOM 0 HB2 ALA A 108 -14.173 5.092 13.382 1.00 42.24 H new ATOM 0 HB3 ALA A 108 -15.207 5.915 12.190 1.00 42.24 H new ATOM 1770 N THR A 109 -16.295 4.333 9.833 1.00 3.21 N ATOM 1771 CA THR A 109 -17.468 4.213 8.924 1.00 53.45 C ATOM 1772 C THR A 109 -17.338 3.018 7.941 1.00 12.14 C ATOM 1773 O THR A 109 -18.165 2.096 7.951 1.00 54.14 O ATOM 1774 CB THR A 109 -17.699 5.537 8.107 1.00 54.12 C ATOM 1775 OG1 THR A 109 -16.514 5.871 7.352 1.00 33.25 O ATOM 1776 CG2 THR A 109 -18.079 6.720 9.022 1.00 71.33 C ATOM 0 H THR A 109 -15.616 5.033 9.534 1.00 3.21 H new ATOM 0 HA THR A 109 -18.329 4.032 9.568 1.00 53.45 H new ATOM 0 HB THR A 109 -18.531 5.357 7.427 1.00 54.12 H new ATOM 0 HG1 THR A 109 -15.832 6.233 7.956 1.00 33.25 H new ATOM 0 HG21 THR A 109 -18.229 7.614 8.417 1.00 71.33 H new ATOM 0 HG22 THR A 109 -18.999 6.485 9.557 1.00 71.33 H new ATOM 0 HG23 THR A 109 -17.277 6.898 9.739 1.00 71.33 H new ATOM 1784 N GLN A 110 -16.283 3.045 7.112 1.00 33.12 N ATOM 1785 CA GLN A 110 -16.113 2.129 5.951 1.00 15.33 C ATOM 1786 C GLN A 110 -15.099 0.990 6.228 1.00 23.12 C ATOM 1787 O GLN A 110 -15.278 -0.133 5.747 1.00 23.44 O ATOM 1788 CB GLN A 110 -15.657 2.960 4.727 1.00 2.21 C ATOM 1789 CG GLN A 110 -16.605 4.118 4.361 1.00 45.52 C ATOM 1790 CD GLN A 110 -16.113 4.950 3.177 1.00 54.55 C ATOM 1791 OE1 GLN A 110 -16.437 4.670 2.024 1.00 71.24 O ATOM 1792 NE2 GLN A 110 -15.310 5.963 3.447 1.00 72.34 N ATOM 0 H GLN A 110 -15.513 3.705 7.221 1.00 33.12 H new ATOM 0 HA GLN A 110 -17.073 1.649 5.758 1.00 15.33 H new ATOM 0 HB2 GLN A 110 -14.666 3.366 4.927 1.00 2.21 H new ATOM 0 HB3 GLN A 110 -15.562 2.297 3.867 1.00 2.21 H new ATOM 0 HG2 GLN A 110 -17.589 3.713 4.127 1.00 45.52 H new ATOM 0 HG3 GLN A 110 -16.725 4.768 5.228 1.00 45.52 H new ATOM 0 HE21 GLN A 110 -15.059 6.171 4.413 1.00 72.34 H new ATOM 0 HE22 GLN A 110 -14.941 6.537 2.689 1.00 72.34 H new ATOM 1801 N GLY A 111 -14.032 1.297 6.981 1.00 53.11 N ATOM 1802 CA GLY A 111 -12.959 0.331 7.279 1.00 2.31 C ATOM 1803 C GLY A 111 -11.615 0.703 6.645 1.00 23.23 C ATOM 1804 O GLY A 111 -11.409 1.853 6.236 1.00 63.21 O ATOM 0 H GLY A 111 -13.887 2.216 7.399 1.00 53.11 H new ATOM 0 HA2 GLY A 111 -12.835 0.258 8.359 1.00 2.31 H new ATOM 0 HA3 GLY A 111 -13.259 -0.655 6.925 1.00 2.31 H new ATOM 1808 N ILE A 112 -10.700 -0.285 6.548 1.00 40.32 N ATOM 1809 CA ILE A 112 -9.316 -0.065 6.047 1.00 75.44 C ATOM 1810 C ILE A 112 -9.276 -0.004 4.500 1.00 5.53 C ATOM 1811 O ILE A 112 -8.433 0.688 3.925 1.00 4.20 O ATOM 1812 CB ILE A 112 -8.324 -1.179 6.569 1.00 12.42 C ATOM 1813 CG1 ILE A 112 -6.833 -0.855 6.182 1.00 40.11 C ATOM 1814 CG2 ILE A 112 -8.741 -2.585 6.067 1.00 55.14 C ATOM 1815 CD1 ILE A 112 -6.232 0.344 6.898 1.00 14.53 C ATOM 0 H ILE A 112 -10.892 -1.252 6.811 1.00 40.32 H new ATOM 0 HA ILE A 112 -8.989 0.898 6.440 1.00 75.44 H new ATOM 0 HB ILE A 112 -8.385 -1.183 7.657 1.00 12.42 H new ATOM 0 HG12 ILE A 112 -6.220 -1.731 6.393 1.00 40.11 H new ATOM 0 HG13 ILE A 112 -6.781 -0.681 5.107 1.00 40.11 H new ATOM 0 HG21 ILE A 112 -8.039 -3.329 6.443 1.00 55.14 H new ATOM 0 HG22 ILE A 112 -9.743 -2.817 6.427 1.00 55.14 H new ATOM 0 HG23 ILE A 112 -8.735 -2.599 4.977 1.00 55.14 H new ATOM 0 HD11 ILE A 112 -5.204 0.488 6.566 1.00 14.53 H new ATOM 0 HD12 ILE A 112 -6.816 1.235 6.668 1.00 14.53 H new ATOM 0 HD13 ILE A 112 -6.245 0.169 7.974 1.00 14.53 H new ATOM 1827 N ARG A 113 -10.220 -0.714 3.846 1.00 40.31 N ATOM 1828 CA ARG A 113 -10.268 -0.842 2.367 1.00 12.15 C ATOM 1829 C ARG A 113 -10.409 0.547 1.712 1.00 22.02 C ATOM 1830 O ARG A 113 -9.654 0.900 0.811 1.00 20.22 O ATOM 1831 CB ARG A 113 -11.447 -1.750 1.900 1.00 74.40 C ATOM 1832 CG ARG A 113 -11.464 -3.209 2.439 1.00 53.02 C ATOM 1833 CD ARG A 113 -11.998 -3.329 3.882 1.00 31.44 C ATOM 1834 NE ARG A 113 -13.301 -2.647 4.053 1.00 24.23 N ATOM 1835 CZ ARG A 113 -14.488 -3.183 3.851 1.00 72.02 C ATOM 1836 NH1 ARG A 113 -14.624 -4.401 3.425 1.00 21.44 N ATOM 1837 NH2 ARG A 113 -15.544 -2.480 4.069 1.00 21.04 N ATOM 0 H ARG A 113 -10.970 -1.215 4.323 1.00 40.31 H new ATOM 0 HA ARG A 113 -9.333 -1.307 2.055 1.00 12.15 H new ATOM 0 HB2 ARG A 113 -12.381 -1.270 2.190 1.00 74.40 H new ATOM 0 HB3 ARG A 113 -11.434 -1.790 0.811 1.00 74.40 H new ATOM 0 HG2 ARG A 113 -12.079 -3.823 1.781 1.00 53.02 H new ATOM 0 HG3 ARG A 113 -10.453 -3.614 2.400 1.00 53.02 H new ATOM 0 HD2 ARG A 113 -12.104 -4.382 4.142 1.00 31.44 H new ATOM 0 HD3 ARG A 113 -11.272 -2.901 4.573 1.00 31.44 H new ATOM 0 HE ARG A 113 -13.278 -1.673 4.355 1.00 24.23 H new ATOM 0 HH11 ARG A 113 -13.799 -4.971 3.237 1.00 21.44 H new ATOM 0 HH12 ARG A 113 -15.556 -4.789 3.278 1.00 21.44 H new ATOM 0 HH21 ARG A 113 -15.458 -1.517 4.395 1.00 21.04 H new ATOM 0 HH22 ARG A 113 -16.467 -2.886 3.916 1.00 21.04 H new ATOM 1851 N ALA A 114 -11.383 1.324 2.223 1.00 42.40 N ATOM 1852 CA ALA A 114 -11.660 2.703 1.760 1.00 33.31 C ATOM 1853 C ALA A 114 -10.530 3.697 2.129 1.00 74.30 C ATOM 1854 O ALA A 114 -10.297 4.654 1.391 1.00 51.34 O ATOM 1855 CB ALA A 114 -12.999 3.193 2.313 1.00 3.15 C ATOM 0 H ALA A 114 -12.004 1.015 2.971 1.00 42.40 H new ATOM 0 HA ALA A 114 -11.709 2.666 0.672 1.00 33.31 H new ATOM 0 HB1 ALA A 114 -13.188 4.208 1.963 1.00 3.15 H new ATOM 0 HB2 ALA A 114 -13.797 2.536 1.968 1.00 3.15 H new ATOM 0 HB3 ALA A 114 -12.968 3.185 3.403 1.00 3.15 H new ATOM 1861 N PHE A 115 -9.865 3.486 3.290 1.00 50.05 N ATOM 1862 CA PHE A 115 -8.672 4.277 3.703 1.00 61.21 C ATOM 1863 C PHE A 115 -7.526 4.155 2.663 1.00 25.03 C ATOM 1864 O PHE A 115 -7.004 5.163 2.177 1.00 5.44 O ATOM 1865 CB PHE A 115 -8.197 3.809 5.112 1.00 14.14 C ATOM 1866 CG PHE A 115 -6.860 4.403 5.592 1.00 4.05 C ATOM 1867 CD1 PHE A 115 -6.765 5.729 6.016 1.00 71.21 C ATOM 1868 CD2 PHE A 115 -5.697 3.626 5.618 1.00 73.11 C ATOM 1869 CE1 PHE A 115 -5.554 6.251 6.448 1.00 31.13 C ATOM 1870 CE2 PHE A 115 -4.493 4.147 6.051 1.00 65.45 C ATOM 1871 CZ PHE A 115 -4.421 5.461 6.465 1.00 73.52 C ATOM 0 H PHE A 115 -10.134 2.770 3.964 1.00 50.05 H new ATOM 0 HA PHE A 115 -8.952 5.329 3.753 1.00 61.21 H new ATOM 0 HB2 PHE A 115 -8.969 4.062 5.839 1.00 14.14 H new ATOM 0 HB3 PHE A 115 -8.110 2.723 5.105 1.00 14.14 H new ATOM 0 HD1 PHE A 115 -7.644 6.356 6.008 1.00 71.21 H new ATOM 0 HD2 PHE A 115 -5.741 2.597 5.293 1.00 73.11 H new ATOM 0 HE1 PHE A 115 -5.497 7.280 6.772 1.00 31.13 H new ATOM 0 HE2 PHE A 115 -3.609 3.526 6.065 1.00 65.45 H new ATOM 0 HZ PHE A 115 -3.480 5.871 6.802 1.00 73.52 H new ATOM 1881 N ILE A 116 -7.173 2.903 2.324 1.00 72.34 N ATOM 1882 CA ILE A 116 -6.120 2.587 1.331 1.00 15.24 C ATOM 1883 C ILE A 116 -6.531 3.076 -0.076 1.00 12.11 C ATOM 1884 O ILE A 116 -5.745 3.717 -0.771 1.00 33.24 O ATOM 1885 CB ILE A 116 -5.823 1.038 1.308 1.00 23.31 C ATOM 1886 CG1 ILE A 116 -5.351 0.539 2.714 1.00 3.31 C ATOM 1887 CG2 ILE A 116 -4.796 0.658 0.206 1.00 62.05 C ATOM 1888 CD1 ILE A 116 -4.078 1.190 3.235 1.00 2.45 C ATOM 0 H ILE A 116 -7.609 2.075 2.730 1.00 72.34 H new ATOM 0 HA ILE A 116 -5.210 3.109 1.625 1.00 15.24 H new ATOM 0 HB ILE A 116 -6.757 0.533 1.062 1.00 23.31 H new ATOM 0 HG12 ILE A 116 -6.151 0.715 3.433 1.00 3.31 H new ATOM 0 HG13 ILE A 116 -5.197 -0.539 2.667 1.00 3.31 H new ATOM 0 HG21 ILE A 116 -4.622 -0.418 0.227 1.00 62.05 H new ATOM 0 HG22 ILE A 116 -5.188 0.943 -0.770 1.00 62.05 H new ATOM 0 HG23 ILE A 116 -3.857 1.181 0.387 1.00 62.05 H new ATOM 0 HD11 ILE A 116 -3.833 0.778 4.214 1.00 2.45 H new ATOM 0 HD12 ILE A 116 -3.259 0.992 2.543 1.00 2.45 H new ATOM 0 HD13 ILE A 116 -4.229 2.266 3.321 1.00 2.45 H new ATOM 1900 N ASN A 117 -7.792 2.790 -0.449 1.00 51.23 N ATOM 1901 CA ASN A 117 -8.396 3.213 -1.735 1.00 52.23 C ATOM 1902 C ASN A 117 -8.360 4.759 -1.897 1.00 72.12 C ATOM 1903 O ASN A 117 -8.153 5.271 -2.999 1.00 31.22 O ATOM 1904 CB ASN A 117 -9.859 2.689 -1.816 1.00 14.42 C ATOM 1905 CG ASN A 117 -10.537 2.901 -3.173 1.00 71.33 C ATOM 1906 OD1 ASN A 117 -9.898 2.887 -4.212 1.00 55.12 O ATOM 1907 ND2 ASN A 117 -11.840 3.088 -3.171 1.00 64.44 N ATOM 0 H ASN A 117 -8.431 2.253 0.138 1.00 51.23 H new ATOM 0 HA ASN A 117 -7.812 2.786 -2.550 1.00 52.23 H new ATOM 0 HB2 ASN A 117 -9.863 1.624 -1.585 1.00 14.42 H new ATOM 0 HB3 ASN A 117 -10.452 3.184 -1.047 1.00 14.42 H new ATOM 0 HD21 ASN A 117 -12.337 3.225 -4.051 1.00 64.44 H new ATOM 0 HD22 ASN A 117 -12.353 3.096 -2.289 1.00 64.44 H new ATOM 1914 N ALA A 118 -8.538 5.486 -0.774 1.00 54.43 N ATOM 1915 CA ALA A 118 -8.464 6.964 -0.747 1.00 73.12 C ATOM 1916 C ALA A 118 -7.023 7.463 -1.025 1.00 52.14 C ATOM 1917 O ALA A 118 -6.829 8.359 -1.844 1.00 71.23 O ATOM 1918 CB ALA A 118 -8.972 7.507 0.601 1.00 63.30 C ATOM 0 H ALA A 118 -8.736 5.069 0.135 1.00 54.43 H new ATOM 0 HA ALA A 118 -9.108 7.343 -1.541 1.00 73.12 H new ATOM 0 HB1 ALA A 118 -8.910 8.595 0.602 1.00 63.30 H new ATOM 0 HB2 ALA A 118 -10.008 7.203 0.749 1.00 63.30 H new ATOM 0 HB3 ALA A 118 -8.358 7.108 1.409 1.00 63.30 H new ATOM 1924 N LEU A 119 -6.033 6.872 -0.320 1.00 53.53 N ATOM 1925 CA LEU A 119 -4.586 7.185 -0.506 1.00 34.41 C ATOM 1926 C LEU A 119 -4.104 6.935 -1.964 1.00 62.50 C ATOM 1927 O LEU A 119 -3.405 7.760 -2.556 1.00 50.11 O ATOM 1928 CB LEU A 119 -3.724 6.340 0.481 1.00 24.04 C ATOM 1929 CG LEU A 119 -4.029 6.513 2.006 1.00 21.51 C ATOM 1930 CD1 LEU A 119 -3.098 5.626 2.861 1.00 25.34 C ATOM 1931 CD2 LEU A 119 -3.959 7.997 2.440 1.00 5.23 C ATOM 0 H LEU A 119 -6.207 6.165 0.394 1.00 53.53 H new ATOM 0 HA LEU A 119 -4.461 8.247 -0.297 1.00 34.41 H new ATOM 0 HB2 LEU A 119 -3.849 5.288 0.226 1.00 24.04 H new ATOM 0 HB3 LEU A 119 -2.675 6.586 0.314 1.00 24.04 H new ATOM 0 HG LEU A 119 -5.053 6.180 2.177 1.00 21.51 H new ATOM 0 HD11 LEU A 119 -3.331 5.765 3.917 1.00 25.34 H new ATOM 0 HD12 LEU A 119 -3.244 4.580 2.592 1.00 25.34 H new ATOM 0 HD13 LEU A 119 -2.060 5.906 2.679 1.00 25.34 H new ATOM 0 HD21 LEU A 119 -4.177 8.075 3.505 1.00 5.23 H new ATOM 0 HD22 LEU A 119 -2.960 8.387 2.244 1.00 5.23 H new ATOM 0 HD23 LEU A 119 -4.691 8.576 1.877 1.00 5.23 H new ATOM 1943 N VAL A 120 -4.514 5.790 -2.524 1.00 71.44 N ATOM 1944 CA VAL A 120 -4.128 5.346 -3.884 1.00 64.33 C ATOM 1945 C VAL A 120 -4.747 6.243 -4.983 1.00 33.02 C ATOM 1946 O VAL A 120 -4.041 6.768 -5.846 1.00 22.32 O ATOM 1947 CB VAL A 120 -4.554 3.841 -4.087 1.00 11.25 C ATOM 1948 CG1 VAL A 120 -4.378 3.362 -5.545 1.00 15.11 C ATOM 1949 CG2 VAL A 120 -3.762 2.931 -3.129 1.00 40.12 C ATOM 0 H VAL A 120 -5.131 5.133 -2.046 1.00 71.44 H new ATOM 0 HA VAL A 120 -3.045 5.433 -3.976 1.00 64.33 H new ATOM 0 HB VAL A 120 -5.618 3.778 -3.858 1.00 11.25 H new ATOM 0 HG11 VAL A 120 -4.687 2.320 -5.625 1.00 15.11 H new ATOM 0 HG12 VAL A 120 -4.992 3.974 -6.206 1.00 15.11 H new ATOM 0 HG13 VAL A 120 -3.331 3.454 -5.834 1.00 15.11 H new ATOM 0 HG21 VAL A 120 -4.065 1.895 -3.278 1.00 40.12 H new ATOM 0 HG22 VAL A 120 -2.696 3.030 -3.331 1.00 40.12 H new ATOM 0 HG23 VAL A 120 -3.965 3.223 -2.099 1.00 40.12 H new ATOM 1959 N ASN A 121 -6.070 6.435 -4.923 1.00 40.35 N ATOM 1960 CA ASN A 121 -6.836 7.163 -5.966 1.00 22.12 C ATOM 1961 C ASN A 121 -7.008 8.668 -5.623 1.00 60.24 C ATOM 1962 O ASN A 121 -7.926 9.326 -6.128 1.00 43.33 O ATOM 1963 CB ASN A 121 -8.205 6.460 -6.169 1.00 31.11 C ATOM 1964 CG ASN A 121 -8.042 5.018 -6.662 1.00 31.41 C ATOM 1965 OD1 ASN A 121 -8.010 4.756 -7.855 1.00 51.14 O ATOM 1966 ND2 ASN A 121 -7.901 4.079 -5.751 1.00 34.22 N ATOM 0 H ASN A 121 -6.648 6.094 -4.155 1.00 40.35 H new ATOM 0 HA ASN A 121 -6.274 7.133 -6.900 1.00 22.12 H new ATOM 0 HB2 ASN A 121 -8.756 6.462 -5.229 1.00 31.11 H new ATOM 0 HB3 ASN A 121 -8.799 7.024 -6.888 1.00 31.11 H new ATOM 0 HD21 ASN A 121 -7.762 3.109 -6.035 1.00 34.22 H new ATOM 0 HD22 ASN A 121 -7.931 4.321 -4.761 1.00 34.22 H new ATOM 1973 N SER A 122 -6.091 9.210 -4.790 1.00 4.51 N ATOM 1974 CA SER A 122 -6.080 10.634 -4.404 1.00 3.50 C ATOM 1975 C SER A 122 -5.459 11.533 -5.498 1.00 52.24 C ATOM 1976 O SER A 122 -4.650 11.068 -6.312 1.00 14.12 O ATOM 1977 CB SER A 122 -5.288 10.808 -3.090 1.00 72.11 C ATOM 1978 OG SER A 122 -5.419 12.118 -2.579 1.00 41.20 O ATOM 0 H SER A 122 -5.337 8.668 -4.367 1.00 4.51 H new ATOM 0 HA SER A 122 -7.116 10.944 -4.269 1.00 3.50 H new ATOM 0 HB2 SER A 122 -5.644 10.090 -2.351 1.00 72.11 H new ATOM 0 HB3 SER A 122 -4.235 10.588 -3.266 1.00 72.11 H new ATOM 0 HG SER A 122 -5.195 12.121 -1.625 1.00 41.20 H new ATOM 1984 N GLN A 123 -5.852 12.824 -5.491 1.00 41.11 N ATOM 1985 CA GLN A 123 -5.280 13.865 -6.385 1.00 65.24 C ATOM 1986 C GLN A 123 -3.758 14.019 -6.152 1.00 20.33 C ATOM 1987 O GLN A 123 -2.968 13.940 -7.086 1.00 42.22 O ATOM 1988 CB GLN A 123 -5.967 15.233 -6.129 1.00 1.31 C ATOM 1989 CG GLN A 123 -7.504 15.242 -6.274 1.00 65.51 C ATOM 1990 CD GLN A 123 -8.167 16.562 -5.841 1.00 32.42 C ATOM 1991 OE1 GLN A 123 -7.619 17.231 -4.834 1.00 32.14 O flip ATOM 1992 NE2 GLN A 123 -9.186 16.967 -6.390 1.00 32.35 N flip ATOM 0 H GLN A 123 -6.576 13.179 -4.866 1.00 41.11 H new ATOM 0 HA GLN A 123 -5.455 13.550 -7.414 1.00 65.24 H new ATOM 0 HB2 GLN A 123 -5.712 15.565 -5.122 1.00 1.31 H new ATOM 0 HB3 GLN A 123 -5.550 15.965 -6.821 1.00 1.31 H new ATOM 0 HG2 GLN A 123 -7.762 15.042 -7.314 1.00 65.51 H new ATOM 0 HG3 GLN A 123 -7.919 14.427 -5.681 1.00 65.51 H new ATOM 0 HE21 GLN A 123 -9.593 16.440 -7.162 1.00 32.35 H new ATOM 0 HE22 GLN A 123 -9.626 17.831 -6.074 1.00 32.35 H new ATOM 2001 N GLU A 124 -3.376 14.222 -4.881 1.00 60.14 N ATOM 2002 CA GLU A 124 -1.962 14.391 -4.459 1.00 45.32 C ATOM 2003 C GLU A 124 -1.071 13.174 -4.850 1.00 63.14 C ATOM 2004 O GLU A 124 0.127 13.341 -5.105 1.00 73.14 O ATOM 2005 CB GLU A 124 -1.893 14.676 -2.929 1.00 43.31 C ATOM 2006 CG GLU A 124 -2.654 13.650 -2.071 1.00 54.24 C ATOM 2007 CD GLU A 124 -2.601 13.926 -0.562 1.00 35.22 C ATOM 2008 OE1 GLU A 124 -3.253 14.891 -0.109 1.00 72.13 O ATOM 2009 OE2 GLU A 124 -1.924 13.174 0.173 1.00 21.44 O ATOM 0 H GLU A 124 -4.038 14.275 -4.107 1.00 60.14 H new ATOM 0 HA GLU A 124 -1.558 15.248 -4.997 1.00 45.32 H new ATOM 0 HB2 GLU A 124 -0.848 14.692 -2.619 1.00 43.31 H new ATOM 0 HB3 GLU A 124 -2.298 15.669 -2.735 1.00 43.31 H new ATOM 0 HG2 GLU A 124 -3.697 13.630 -2.389 1.00 54.24 H new ATOM 0 HG3 GLU A 124 -2.244 12.658 -2.262 1.00 54.24 H new ATOM 2016 N TYR A 125 -1.661 11.952 -4.893 1.00 62.40 N ATOM 2017 CA TYR A 125 -0.939 10.741 -5.354 1.00 4.12 C ATOM 2018 C TYR A 125 -0.702 10.782 -6.881 1.00 62.24 C ATOM 2019 O TYR A 125 0.434 10.659 -7.338 1.00 52.12 O ATOM 2020 CB TYR A 125 -1.697 9.430 -4.992 1.00 75.01 C ATOM 2021 CG TYR A 125 -0.877 8.134 -5.241 1.00 45.32 C ATOM 2022 CD1 TYR A 125 -0.013 7.626 -4.263 1.00 34.42 C ATOM 2023 CD2 TYR A 125 -0.955 7.430 -6.452 1.00 34.24 C ATOM 2024 CE1 TYR A 125 0.727 6.476 -4.482 1.00 65.11 C ATOM 2025 CE2 TYR A 125 -0.215 6.282 -6.670 1.00 40.53 C ATOM 2026 CZ TYR A 125 0.624 5.809 -5.686 1.00 31.30 C ATOM 2027 OH TYR A 125 1.360 4.657 -5.902 1.00 75.45 O ATOM 0 H TYR A 125 -2.628 11.781 -4.616 1.00 62.40 H new ATOM 0 HA TYR A 125 0.019 10.740 -4.835 1.00 4.12 H new ATOM 0 HB2 TYR A 125 -1.986 9.468 -3.942 1.00 75.01 H new ATOM 0 HB3 TYR A 125 -2.617 9.382 -5.574 1.00 75.01 H new ATOM 0 HD1 TYR A 125 0.078 8.142 -3.318 1.00 34.42 H new ATOM 0 HD2 TYR A 125 -1.608 7.793 -7.232 1.00 34.24 H new ATOM 0 HE1 TYR A 125 1.384 6.101 -3.711 1.00 65.11 H new ATOM 0 HE2 TYR A 125 -0.295 5.757 -7.611 1.00 40.53 H new ATOM 0 HH TYR A 125 1.502 4.195 -5.050 1.00 75.45 H new ATOM 2037 N ASN A 126 -1.788 10.967 -7.659 1.00 31.31 N ATOM 2038 CA ASN A 126 -1.744 10.814 -9.132 1.00 75.22 C ATOM 2039 C ASN A 126 -0.933 11.927 -9.829 1.00 10.43 C ATOM 2040 O ASN A 126 -0.303 11.682 -10.859 1.00 61.02 O ATOM 2041 CB ASN A 126 -3.174 10.707 -9.736 1.00 43.13 C ATOM 2042 CG ASN A 126 -4.069 11.948 -9.590 1.00 73.22 C ATOM 2043 OD1 ASN A 126 -3.630 13.080 -9.547 1.00 53.42 O ATOM 2044 ND2 ASN A 126 -5.350 11.740 -9.582 1.00 11.33 N ATOM 0 H ASN A 126 -2.706 11.222 -7.295 1.00 31.31 H new ATOM 0 HA ASN A 126 -1.220 9.878 -9.323 1.00 75.22 H new ATOM 0 HB2 ASN A 126 -3.081 10.475 -10.797 1.00 43.13 H new ATOM 0 HB3 ASN A 126 -3.681 9.863 -9.268 1.00 43.13 H new ATOM 0 HD21 ASN A 126 -5.995 12.529 -9.539 1.00 11.33 H new ATOM 0 HD22 ASN A 126 -5.712 10.787 -9.618 1.00 11.33 H new ATOM 2051 N GLU A 127 -0.979 13.152 -9.288 1.00 21.35 N ATOM 2052 CA GLU A 127 -0.280 14.294 -9.902 1.00 44.21 C ATOM 2053 C GLU A 127 1.258 14.220 -9.669 1.00 21.21 C ATOM 2054 O GLU A 127 2.042 14.463 -10.591 1.00 60.45 O ATOM 2055 CB GLU A 127 -0.874 15.648 -9.403 1.00 44.02 C ATOM 2056 CG GLU A 127 -0.658 15.958 -7.906 1.00 22.22 C ATOM 2057 CD GLU A 127 -1.318 17.274 -7.448 1.00 61.13 C ATOM 2058 OE1 GLU A 127 -0.853 18.353 -7.877 1.00 32.21 O ATOM 2059 OE2 GLU A 127 -2.301 17.239 -6.675 1.00 63.10 O ATOM 0 H GLU A 127 -1.488 13.379 -8.434 1.00 21.35 H new ATOM 0 HA GLU A 127 -0.441 14.239 -10.979 1.00 44.21 H new ATOM 0 HB2 GLU A 127 -0.436 16.455 -9.990 1.00 44.02 H new ATOM 0 HB3 GLU A 127 -1.945 15.651 -9.606 1.00 44.02 H new ATOM 0 HG2 GLU A 127 -1.056 15.135 -7.312 1.00 22.22 H new ATOM 0 HG3 GLU A 127 0.412 16.008 -7.704 1.00 22.22 H new ATOM 2066 N VAL A 128 1.675 13.857 -8.434 1.00 63.13 N ATOM 2067 CA VAL A 128 3.106 13.787 -8.045 1.00 75.22 C ATOM 2068 C VAL A 128 3.753 12.431 -8.456 1.00 45.33 C ATOM 2069 O VAL A 128 4.783 12.401 -9.142 1.00 74.31 O ATOM 2070 CB VAL A 128 3.281 14.019 -6.491 1.00 34.34 C ATOM 2071 CG1 VAL A 128 4.774 13.966 -6.067 1.00 11.10 C ATOM 2072 CG2 VAL A 128 2.624 15.351 -6.040 1.00 10.54 C ATOM 0 H VAL A 128 1.034 13.605 -7.681 1.00 63.13 H new ATOM 0 HA VAL A 128 3.621 14.583 -8.583 1.00 75.22 H new ATOM 0 HB VAL A 128 2.766 13.202 -5.985 1.00 34.34 H new ATOM 0 HG11 VAL A 128 4.853 14.130 -4.992 1.00 11.10 H new ATOM 0 HG12 VAL A 128 5.189 12.989 -6.317 1.00 11.10 H new ATOM 0 HG13 VAL A 128 5.330 14.742 -6.594 1.00 11.10 H new ATOM 0 HG21 VAL A 128 2.762 15.480 -4.967 1.00 10.54 H new ATOM 0 HG22 VAL A 128 3.089 16.183 -6.568 1.00 10.54 H new ATOM 0 HG23 VAL A 128 1.558 15.327 -6.268 1.00 10.54 H new ATOM 2082 N PHE A 129 3.137 11.322 -8.012 1.00 35.24 N ATOM 2083 CA PHE A 129 3.645 9.936 -8.232 1.00 54.53 C ATOM 2084 C PHE A 129 3.115 9.361 -9.568 1.00 11.31 C ATOM 2085 O PHE A 129 3.883 8.838 -10.383 1.00 23.35 O ATOM 2086 CB PHE A 129 3.224 9.014 -7.041 1.00 41.32 C ATOM 2087 CG PHE A 129 3.671 9.534 -5.672 1.00 30.42 C ATOM 2088 CD1 PHE A 129 2.943 10.523 -5.005 1.00 24.13 C ATOM 2089 CD2 PHE A 129 4.829 9.057 -5.063 1.00 62.14 C ATOM 2090 CE1 PHE A 129 3.365 11.019 -3.788 1.00 43.44 C ATOM 2091 CE2 PHE A 129 5.243 9.551 -3.843 1.00 61.33 C ATOM 2092 CZ PHE A 129 4.515 10.532 -3.209 1.00 63.34 C ATOM 0 H PHE A 129 2.264 11.351 -7.485 1.00 35.24 H new ATOM 0 HA PHE A 129 4.733 9.973 -8.285 1.00 54.53 H new ATOM 0 HB2 PHE A 129 2.139 8.906 -7.042 1.00 41.32 H new ATOM 0 HB3 PHE A 129 3.643 8.020 -7.197 1.00 41.32 H new ATOM 0 HD1 PHE A 129 2.036 10.905 -5.449 1.00 24.13 H new ATOM 0 HD2 PHE A 129 5.411 8.290 -5.552 1.00 62.14 H new ATOM 0 HE1 PHE A 129 2.793 11.789 -3.290 1.00 43.44 H new ATOM 0 HE2 PHE A 129 6.142 9.166 -3.384 1.00 61.33 H new ATOM 0 HZ PHE A 129 4.846 10.920 -2.257 1.00 63.34 H new ATOM 2102 N GLY A 130 1.793 9.474 -9.780 1.00 22.41 N ATOM 2103 CA GLY A 130 1.140 8.957 -10.992 1.00 13.13 C ATOM 2104 C GLY A 130 0.602 7.543 -10.808 1.00 71.42 C ATOM 2105 O GLY A 130 -0.283 7.312 -9.973 1.00 70.53 O ATOM 0 H GLY A 130 1.154 9.921 -9.123 1.00 22.41 H new ATOM 0 HA2 GLY A 130 0.321 9.620 -11.271 1.00 13.13 H new ATOM 0 HA3 GLY A 130 1.853 8.967 -11.817 1.00 13.13 H new ATOM 2109 N GLU A 131 1.122 6.608 -11.615 1.00 33.45 N ATOM 2110 CA GLU A 131 0.778 5.173 -11.541 1.00 51.42 C ATOM 2111 C GLU A 131 2.015 4.278 -11.780 1.00 14.11 C ATOM 2112 O GLU A 131 2.039 3.120 -11.367 1.00 1.25 O ATOM 2113 CB GLU A 131 -0.352 4.810 -12.555 1.00 72.54 C ATOM 2114 CG GLU A 131 -0.041 5.092 -14.053 1.00 74.22 C ATOM 2115 CD GLU A 131 -0.211 6.570 -14.451 1.00 52.25 C ATOM 2116 OE1 GLU A 131 -1.351 6.977 -14.753 1.00 12.44 O ATOM 2117 OE2 GLU A 131 0.781 7.333 -14.444 1.00 32.41 O ATOM 0 H GLU A 131 1.800 6.824 -12.346 1.00 33.45 H new ATOM 0 HA GLU A 131 0.412 4.984 -10.532 1.00 51.42 H new ATOM 0 HB2 GLU A 131 -0.584 3.751 -12.446 1.00 72.54 H new ATOM 0 HB3 GLU A 131 -1.250 5.363 -12.281 1.00 72.54 H new ATOM 0 HG2 GLU A 131 0.982 4.782 -14.268 1.00 74.22 H new ATOM 0 HG3 GLU A 131 -0.696 4.480 -14.673 1.00 74.22 H new ATOM 2124 N ASP A 132 3.037 4.816 -12.462 1.00 21.23 N ATOM 2125 CA ASP A 132 4.269 4.064 -12.789 1.00 32.23 C ATOM 2126 C ASP A 132 5.293 4.076 -11.636 1.00 12.50 C ATOM 2127 O ASP A 132 6.124 3.185 -11.550 1.00 33.53 O ATOM 2128 CB ASP A 132 4.912 4.645 -14.070 1.00 45.30 C ATOM 2129 CG ASP A 132 3.914 4.693 -15.233 1.00 62.00 C ATOM 2130 OD1 ASP A 132 3.564 3.624 -15.760 1.00 13.35 O ATOM 2131 OD2 ASP A 132 3.472 5.793 -15.616 1.00 3.12 O ATOM 0 H ASP A 132 3.039 5.777 -12.803 1.00 21.23 H new ATOM 0 HA ASP A 132 3.981 3.026 -12.952 1.00 32.23 H new ATOM 0 HB2 ASP A 132 5.284 5.650 -13.867 1.00 45.30 H new ATOM 0 HB3 ASP A 132 5.772 4.038 -14.353 1.00 45.30 H new ATOM 2136 N THR A 133 5.222 5.078 -10.746 1.00 24.52 N ATOM 2137 CA THR A 133 6.266 5.307 -9.721 1.00 72.11 C ATOM 2138 C THR A 133 5.929 4.615 -8.373 1.00 2.20 C ATOM 2139 O THR A 133 4.779 4.640 -7.925 1.00 14.41 O ATOM 2140 CB THR A 133 6.470 6.838 -9.477 1.00 64.31 C ATOM 2141 OG1 THR A 133 6.549 7.529 -10.739 1.00 3.11 O ATOM 2142 CG2 THR A 133 7.746 7.117 -8.671 1.00 61.33 C ATOM 0 H THR A 133 4.453 5.747 -10.711 1.00 24.52 H new ATOM 0 HA THR A 133 7.186 4.867 -10.107 1.00 72.11 H new ATOM 0 HB THR A 133 5.615 7.197 -8.904 1.00 64.31 H new ATOM 0 HG1 THR A 133 5.739 8.064 -10.870 1.00 3.11 H new ATOM 0 HG21 THR A 133 7.854 8.191 -8.521 1.00 61.33 H new ATOM 0 HG22 THR A 133 7.681 6.620 -7.703 1.00 61.33 H new ATOM 0 HG23 THR A 133 8.611 6.738 -9.216 1.00 61.33 H new ATOM 2150 N VAL A 134 6.954 3.997 -7.746 1.00 15.50 N ATOM 2151 CA VAL A 134 6.887 3.494 -6.356 1.00 11.24 C ATOM 2152 C VAL A 134 6.948 4.693 -5.360 1.00 11.23 C ATOM 2153 O VAL A 134 7.738 5.621 -5.585 1.00 51.20 O ATOM 2154 CB VAL A 134 8.069 2.477 -6.060 1.00 43.13 C ATOM 2155 CG1 VAL A 134 8.124 2.029 -4.572 1.00 72.34 C ATOM 2156 CG2 VAL A 134 7.977 1.243 -6.987 1.00 73.10 C ATOM 0 H VAL A 134 7.856 3.832 -8.193 1.00 15.50 H new ATOM 0 HA VAL A 134 5.944 2.962 -6.226 1.00 11.24 H new ATOM 0 HB VAL A 134 8.995 3.014 -6.266 1.00 43.13 H new ATOM 0 HG11 VAL A 134 8.952 1.335 -4.431 1.00 72.34 H new ATOM 0 HG12 VAL A 134 8.270 2.901 -3.935 1.00 72.34 H new ATOM 0 HG13 VAL A 134 7.189 1.537 -4.305 1.00 72.34 H new ATOM 0 HG21 VAL A 134 8.797 0.560 -6.766 1.00 73.10 H new ATOM 0 HG22 VAL A 134 7.027 0.734 -6.823 1.00 73.10 H new ATOM 0 HG23 VAL A 134 8.042 1.563 -8.027 1.00 73.10 H new ATOM 2166 N PRO A 135 6.083 4.701 -4.281 1.00 3.54 N ATOM 2167 CA PRO A 135 6.116 5.703 -3.177 1.00 53.30 C ATOM 2168 C PRO A 135 7.536 6.214 -2.775 1.00 62.34 C ATOM 2169 O PRO A 135 8.367 5.454 -2.270 1.00 42.21 O ATOM 2170 CB PRO A 135 5.476 4.907 -2.019 1.00 54.13 C ATOM 2171 CG PRO A 135 4.431 4.061 -2.687 1.00 34.33 C ATOM 2172 CD PRO A 135 4.956 3.740 -4.075 1.00 23.33 C ATOM 0 HA PRO A 135 5.610 6.625 -3.463 1.00 53.30 H new ATOM 0 HB2 PRO A 135 6.214 4.294 -1.502 1.00 54.13 H new ATOM 0 HB3 PRO A 135 5.035 5.571 -1.275 1.00 54.13 H new ATOM 0 HG2 PRO A 135 4.251 3.148 -2.120 1.00 34.33 H new ATOM 0 HG3 PRO A 135 3.481 4.592 -2.745 1.00 34.33 H new ATOM 0 HD2 PRO A 135 5.298 2.707 -4.141 1.00 23.33 H new ATOM 0 HD3 PRO A 135 4.182 3.868 -4.832 1.00 23.33 H new ATOM 2180 N TYR A 136 7.816 7.497 -3.060 1.00 73.42 N ATOM 2181 CA TYR A 136 9.073 8.162 -2.663 1.00 75.02 C ATOM 2182 C TYR A 136 8.789 9.379 -1.754 1.00 61.04 C ATOM 2183 O TYR A 136 7.757 10.048 -1.887 1.00 71.34 O ATOM 2184 CB TYR A 136 9.894 8.592 -3.922 1.00 41.10 C ATOM 2185 CG TYR A 136 9.242 9.667 -4.830 1.00 62.40 C ATOM 2186 CD1 TYR A 136 8.408 9.316 -5.896 1.00 44.12 C ATOM 2187 CD2 TYR A 136 9.479 11.036 -4.628 1.00 10.22 C ATOM 2188 CE1 TYR A 136 7.837 10.278 -6.717 1.00 24.42 C ATOM 2189 CE2 TYR A 136 8.906 11.998 -5.445 1.00 23.32 C ATOM 2190 CZ TYR A 136 8.087 11.615 -6.488 1.00 14.30 C ATOM 2191 OH TYR A 136 7.524 12.572 -7.312 1.00 35.14 O ATOM 0 H TYR A 136 7.177 8.105 -3.573 1.00 73.42 H new ATOM 0 HA TYR A 136 9.669 7.447 -2.095 1.00 75.02 H new ATOM 0 HB2 TYR A 136 10.862 8.966 -3.588 1.00 41.10 H new ATOM 0 HB3 TYR A 136 10.086 7.705 -4.525 1.00 41.10 H new ATOM 0 HD1 TYR A 136 8.204 8.272 -6.085 1.00 44.12 H new ATOM 0 HD2 TYR A 136 10.122 11.346 -3.818 1.00 10.22 H new ATOM 0 HE1 TYR A 136 7.197 9.980 -7.535 1.00 24.42 H new ATOM 0 HE2 TYR A 136 9.100 13.045 -5.266 1.00 23.32 H new ATOM 0 HH TYR A 136 7.799 13.464 -7.013 1.00 35.14 H new ATOM 2201 N ARG A 137 9.710 9.639 -0.817 1.00 71.15 N ATOM 2202 CA ARG A 137 9.727 10.899 -0.052 1.00 74.32 C ATOM 2203 C ARG A 137 10.260 12.041 -0.949 1.00 70.05 C ATOM 2204 O ARG A 137 11.349 11.935 -1.532 1.00 31.25 O ATOM 2205 CB ARG A 137 10.563 10.790 1.276 1.00 41.41 C ATOM 2206 CG ARG A 137 12.095 10.499 1.141 1.00 55.13 C ATOM 2207 CD ARG A 137 12.425 9.051 0.706 1.00 4.11 C ATOM 2208 NE ARG A 137 11.812 8.062 1.617 1.00 61.23 N ATOM 2209 CZ ARG A 137 11.000 7.080 1.269 1.00 53.51 C ATOM 2210 NH1 ARG A 137 10.774 6.786 0.021 1.00 54.00 N ATOM 2211 NH2 ARG A 137 10.446 6.373 2.188 1.00 71.30 N ATOM 0 H ARG A 137 10.458 8.992 -0.567 1.00 71.15 H new ATOM 0 HA ARG A 137 8.703 11.119 0.250 1.00 74.32 H new ATOM 0 HB2 ARG A 137 10.445 11.724 1.826 1.00 41.41 H new ATOM 0 HB3 ARG A 137 10.123 10.002 1.887 1.00 41.41 H new ATOM 0 HG2 ARG A 137 12.523 11.192 0.417 1.00 55.13 H new ATOM 0 HG3 ARG A 137 12.578 10.699 2.097 1.00 55.13 H new ATOM 0 HD2 ARG A 137 12.066 8.884 -0.310 1.00 4.11 H new ATOM 0 HD3 ARG A 137 13.506 8.912 0.689 1.00 4.11 H new ATOM 0 HE ARG A 137 12.037 8.146 2.608 1.00 61.23 H new ATOM 0 HH11 ARG A 137 11.229 7.320 -0.719 1.00 54.00 H new ATOM 0 HH12 ARG A 137 10.142 6.022 -0.216 1.00 54.00 H new ATOM 0 HH21 ARG A 137 10.636 6.574 3.170 1.00 71.30 H new ATOM 0 HH22 ARG A 137 9.816 5.611 1.936 1.00 71.30 H new ATOM 2225 N ARG A 138 9.474 13.122 -1.092 1.00 34.20 N ATOM 2226 CA ARG A 138 9.887 14.318 -1.867 1.00 33.22 C ATOM 2227 C ARG A 138 10.695 15.287 -0.954 1.00 55.12 C ATOM 2228 O ARG A 138 10.396 16.483 -0.824 1.00 11.32 O ATOM 2229 CB ARG A 138 8.636 14.995 -2.502 1.00 4.14 C ATOM 2230 CG ARG A 138 8.984 16.108 -3.515 1.00 32.34 C ATOM 2231 CD ARG A 138 7.759 16.719 -4.220 1.00 34.31 C ATOM 2232 NE ARG A 138 8.165 17.713 -5.232 1.00 4.51 N ATOM 2233 CZ ARG A 138 7.352 18.424 -5.979 1.00 51.34 C ATOM 2234 NH1 ARG A 138 6.067 18.352 -5.841 1.00 12.35 N ATOM 2235 NH2 ARG A 138 7.847 19.229 -6.853 1.00 44.13 N ATOM 0 H ARG A 138 8.544 13.197 -0.681 1.00 34.20 H new ATOM 0 HA ARG A 138 10.544 14.025 -2.686 1.00 33.22 H new ATOM 0 HB2 ARG A 138 8.036 14.235 -3.002 1.00 4.14 H new ATOM 0 HB3 ARG A 138 8.019 15.417 -1.709 1.00 4.14 H new ATOM 0 HG2 ARG A 138 9.525 16.900 -2.997 1.00 32.34 H new ATOM 0 HG3 ARG A 138 9.659 15.701 -4.268 1.00 32.34 H new ATOM 0 HD2 ARG A 138 7.178 15.929 -4.696 1.00 34.31 H new ATOM 0 HD3 ARG A 138 7.110 17.191 -3.483 1.00 34.31 H new ATOM 0 HE ARG A 138 9.166 17.861 -5.363 1.00 4.51 H new ATOM 0 HH11 ARG A 138 5.663 17.732 -5.139 1.00 12.35 H new ATOM 0 HH12 ARG A 138 5.458 18.915 -6.434 1.00 12.35 H new ATOM 0 HH21 ARG A 138 8.858 19.308 -6.958 1.00 44.13 H new ATOM 0 HH22 ARG A 138 7.228 19.788 -7.440 1.00 44.13 H new ATOM 2249 N PHE A 139 11.735 14.731 -0.304 1.00 51.24 N ATOM 2250 CA PHE A 139 12.551 15.430 0.710 1.00 2.45 C ATOM 2251 C PHE A 139 14.032 14.971 0.604 1.00 44.43 C ATOM 2252 O PHE A 139 14.289 13.776 0.412 1.00 63.54 O ATOM 2253 CB PHE A 139 12.010 15.134 2.145 1.00 73.32 C ATOM 2254 CG PHE A 139 10.540 15.519 2.367 1.00 43.20 C ATOM 2255 CD1 PHE A 139 10.166 16.855 2.527 1.00 0.11 C ATOM 2256 CD2 PHE A 139 9.534 14.548 2.405 1.00 63.23 C ATOM 2257 CE1 PHE A 139 8.838 17.203 2.719 1.00 61.02 C ATOM 2258 CE2 PHE A 139 8.208 14.898 2.596 1.00 45.14 C ATOM 2259 CZ PHE A 139 7.861 16.226 2.754 1.00 34.31 C ATOM 0 H PHE A 139 12.037 13.771 -0.470 1.00 51.24 H new ATOM 0 HA PHE A 139 12.490 16.503 0.526 1.00 2.45 H new ATOM 0 HB2 PHE A 139 12.128 14.070 2.351 1.00 73.32 H new ATOM 0 HB3 PHE A 139 12.625 15.669 2.868 1.00 73.32 H new ATOM 0 HD1 PHE A 139 10.921 17.627 2.501 1.00 0.11 H new ATOM 0 HD2 PHE A 139 9.796 13.507 2.283 1.00 63.23 H new ATOM 0 HE1 PHE A 139 8.566 18.241 2.842 1.00 61.02 H new ATOM 0 HE2 PHE A 139 7.446 14.134 2.621 1.00 45.14 H new ATOM 0 HZ PHE A 139 6.827 16.500 2.905 1.00 34.31 H new ATOM 2269 N PRO A 140 15.032 15.901 0.766 1.00 24.05 N ATOM 2270 CA PRO A 140 16.483 15.551 0.693 1.00 11.15 C ATOM 2271 C PRO A 140 17.054 14.934 2.008 1.00 1.25 C ATOM 2272 O PRO A 140 18.275 14.920 2.210 1.00 73.41 O ATOM 2273 CB PRO A 140 17.126 16.924 0.382 1.00 75.25 C ATOM 2274 CG PRO A 140 16.255 17.908 1.110 1.00 63.55 C ATOM 2275 CD PRO A 140 14.839 17.363 1.015 1.00 65.41 C ATOM 0 HA PRO A 140 16.686 14.775 -0.045 1.00 11.15 H new ATOM 0 HB2 PRO A 140 18.158 16.970 0.731 1.00 75.25 H new ATOM 0 HB3 PRO A 140 17.143 17.123 -0.690 1.00 75.25 H new ATOM 0 HG2 PRO A 140 16.565 18.009 2.150 1.00 63.55 H new ATOM 0 HG3 PRO A 140 16.323 18.898 0.659 1.00 63.55 H new ATOM 0 HD2 PRO A 140 14.280 17.541 1.933 1.00 65.41 H new ATOM 0 HD3 PRO A 140 14.282 17.836 0.206 1.00 65.41 H new ATOM 2283 N THR A 141 16.146 14.429 2.886 1.00 73.54 N ATOM 2284 CA THR A 141 16.474 13.740 4.177 1.00 11.01 C ATOM 2285 C THR A 141 17.356 14.598 5.132 1.00 42.03 C ATOM 2286 O THR A 141 18.018 14.053 6.023 1.00 74.54 O ATOM 2287 CB THR A 141 17.133 12.314 3.954 1.00 13.51 C ATOM 2288 OG1 THR A 141 18.470 12.420 3.407 1.00 31.13 O ATOM 2289 CG2 THR A 141 16.274 11.430 3.025 1.00 34.25 C ATOM 0 H THR A 141 15.142 14.488 2.718 1.00 73.54 H new ATOM 0 HA THR A 141 15.511 13.599 4.667 1.00 11.01 H new ATOM 0 HB THR A 141 17.190 11.846 4.937 1.00 13.51 H new ATOM 0 HG1 THR A 141 18.574 13.288 2.964 1.00 31.13 H new ATOM 0 HG21 THR A 141 16.757 10.461 2.896 1.00 34.25 H new ATOM 0 HG22 THR A 141 15.288 11.288 3.468 1.00 34.25 H new ATOM 0 HG23 THR A 141 16.169 11.916 2.055 1.00 34.25 H new ATOM 2297 N LEU A 142 17.298 15.944 4.970 1.00 63.43 N ATOM 2298 CA LEU A 142 18.172 16.908 5.695 1.00 22.12 C ATOM 2299 C LEU A 142 19.678 16.593 5.457 1.00 72.12 C ATOM 2300 O LEU A 142 20.459 16.483 6.409 1.00 14.02 O ATOM 2301 CB LEU A 142 17.821 16.960 7.220 1.00 74.32 C ATOM 2302 CG LEU A 142 16.375 17.428 7.585 1.00 22.41 C ATOM 2303 CD1 LEU A 142 16.156 17.435 9.115 1.00 72.43 C ATOM 2304 CD2 LEU A 142 16.058 18.811 6.971 1.00 64.32 C ATOM 0 H LEU A 142 16.643 16.395 4.332 1.00 63.43 H new ATOM 0 HA LEU A 142 17.982 17.901 5.288 1.00 22.12 H new ATOM 0 HB2 LEU A 142 17.975 15.966 7.640 1.00 74.32 H new ATOM 0 HB3 LEU A 142 18.530 17.626 7.711 1.00 74.32 H new ATOM 0 HG LEU A 142 15.680 16.708 7.153 1.00 22.41 H new ATOM 0 HD11 LEU A 142 15.141 17.765 9.336 1.00 72.43 H new ATOM 0 HD12 LEU A 142 16.304 16.429 9.508 1.00 72.43 H new ATOM 0 HD13 LEU A 142 16.868 18.116 9.581 1.00 72.43 H new ATOM 0 HD21 LEU A 142 15.045 19.107 7.244 1.00 64.32 H new ATOM 0 HD22 LEU A 142 16.766 19.548 7.350 1.00 64.32 H new ATOM 0 HD23 LEU A 142 16.139 18.754 5.886 1.00 64.32 H new ATOM 2316 N GLU A 143 20.034 16.407 4.161 1.00 24.24 N ATOM 2317 CA GLU A 143 21.416 16.098 3.658 1.00 23.33 C ATOM 2318 C GLU A 143 22.042 14.811 4.289 1.00 45.11 C ATOM 2319 O GLU A 143 23.245 14.565 4.131 1.00 4.33 O ATOM 2320 CB GLU A 143 22.387 17.344 3.791 1.00 41.30 C ATOM 2321 CG GLU A 143 23.105 17.518 5.159 1.00 74.30 C ATOM 2322 CD GLU A 143 23.962 18.791 5.271 1.00 41.10 C ATOM 2323 OE1 GLU A 143 24.918 18.948 4.484 1.00 74.43 O ATOM 2324 OE2 GLU A 143 23.677 19.646 6.140 1.00 74.33 O ATOM 0 H GLU A 143 19.352 16.468 3.405 1.00 24.24 H new ATOM 0 HA GLU A 143 21.296 15.880 2.597 1.00 23.33 H new ATOM 0 HB2 GLU A 143 23.147 17.269 3.013 1.00 41.30 H new ATOM 0 HB3 GLU A 143 21.812 18.248 3.589 1.00 41.30 H new ATOM 0 HG2 GLU A 143 22.355 17.529 5.950 1.00 74.30 H new ATOM 0 HG3 GLU A 143 23.741 16.650 5.335 1.00 74.30 H new ATOM 2331 N HIS A 144 21.205 13.958 4.936 1.00 21.55 N ATOM 2332 CA HIS A 144 21.688 12.782 5.712 1.00 2.03 C ATOM 2333 C HIS A 144 22.463 11.775 4.812 1.00 43.50 C ATOM 2334 O HIS A 144 23.515 11.266 5.205 1.00 4.32 O ATOM 2335 CB HIS A 144 20.500 12.084 6.432 1.00 62.41 C ATOM 2336 CG HIS A 144 20.899 11.149 7.559 1.00 1.51 C ATOM 2337 ND1 HIS A 144 20.544 11.363 8.874 1.00 41.10 N ATOM 2338 CD2 HIS A 144 21.618 9.996 7.563 1.00 23.45 C ATOM 2339 CE1 HIS A 144 21.022 10.393 9.628 1.00 53.43 C ATOM 2340 NE2 HIS A 144 21.676 9.553 8.859 1.00 14.43 N ATOM 0 H HIS A 144 20.190 14.062 4.936 1.00 21.55 H new ATOM 0 HA HIS A 144 22.388 13.145 6.465 1.00 2.03 H new ATOM 0 HB2 HIS A 144 19.836 12.850 6.832 1.00 62.41 H new ATOM 0 HB3 HIS A 144 19.928 11.519 5.696 1.00 62.41 H new ATOM 0 HD2 HIS A 144 22.062 9.517 6.703 1.00 23.45 H new ATOM 0 HE1 HIS A 144 20.897 10.304 10.697 1.00 53.43 H new ATOM 0 HE2 HIS A 144 22.151 8.707 9.175 1.00 14.43 H new ATOM 2349 N HIS A 145 21.937 11.504 3.599 1.00 52.14 N ATOM 2350 CA HIS A 145 22.629 10.656 2.596 1.00 40.01 C ATOM 2351 C HIS A 145 22.519 11.277 1.174 1.00 35.14 C ATOM 2352 O HIS A 145 21.460 11.255 0.536 1.00 75.53 O ATOM 2353 CB HIS A 145 22.108 9.185 2.647 1.00 63.02 C ATOM 2354 CG HIS A 145 20.655 8.981 2.280 1.00 24.25 C ATOM 2355 ND1 HIS A 145 20.258 8.378 1.106 1.00 50.24 N ATOM 2356 CD2 HIS A 145 19.506 9.288 2.936 1.00 50.00 C ATOM 2357 CE1 HIS A 145 18.946 8.328 1.053 1.00 70.44 C ATOM 2358 NE2 HIS A 145 18.460 8.867 2.148 1.00 71.32 N ATOM 0 H HIS A 145 21.033 11.860 3.287 1.00 52.14 H new ATOM 0 HA HIS A 145 23.689 10.622 2.847 1.00 40.01 H new ATOM 0 HB2 HIS A 145 22.719 8.581 1.976 1.00 63.02 H new ATOM 0 HB3 HIS A 145 22.265 8.800 3.655 1.00 63.02 H new ATOM 0 HD1 HIS A 145 20.888 8.024 0.386 1.00 50.24 H new ATOM 0 HD2 HIS A 145 19.428 9.773 3.898 1.00 50.00 H new ATOM 0 HE1 HIS A 145 18.364 7.913 0.244 1.00 70.44 H new ATOM 2367 N HIS A 146 23.625 11.891 0.716 1.00 12.14 N ATOM 2368 CA HIS A 146 23.767 12.444 -0.652 1.00 41.34 C ATOM 2369 C HIS A 146 24.896 11.684 -1.392 1.00 23.13 C ATOM 2370 O HIS A 146 26.061 11.762 -0.984 1.00 14.32 O ATOM 2371 CB HIS A 146 24.038 13.983 -0.598 1.00 55.32 C ATOM 2372 CG HIS A 146 25.119 14.420 0.379 1.00 55.34 C ATOM 2373 ND1 HIS A 146 26.471 14.244 0.156 1.00 73.43 N ATOM 2374 CD2 HIS A 146 25.034 15.028 1.591 1.00 11.31 C ATOM 2375 CE1 HIS A 146 27.156 14.713 1.177 1.00 3.13 C ATOM 2376 NE2 HIS A 146 26.313 15.195 2.061 1.00 51.50 N ATOM 0 H HIS A 146 24.458 12.021 1.290 1.00 12.14 H new ATOM 0 HA HIS A 146 22.838 12.305 -1.205 1.00 41.34 H new ATOM 0 HB2 HIS A 146 24.316 14.321 -1.596 1.00 55.32 H new ATOM 0 HB3 HIS A 146 23.109 14.490 -0.337 1.00 55.32 H new ATOM 0 HD1 HIS A 146 26.877 13.815 -0.675 1.00 73.43 H new ATOM 0 HD2 HIS A 146 24.125 15.326 2.093 1.00 11.31 H new ATOM 0 HE1 HIS A 146 28.232 14.703 1.272 1.00 3.13 H new ATOM 2385 N HIS A 147 24.512 10.893 -2.427 1.00 12.24 N ATOM 2386 CA HIS A 147 25.414 10.000 -3.223 1.00 71.55 C ATOM 2387 C HIS A 147 25.819 8.710 -2.434 1.00 70.33 C ATOM 2388 O HIS A 147 25.909 7.622 -3.018 1.00 12.44 O ATOM 2389 CB HIS A 147 26.654 10.769 -3.763 1.00 52.43 C ATOM 2390 CG HIS A 147 27.567 9.968 -4.662 1.00 54.24 C ATOM 2391 ND1 HIS A 147 28.896 9.750 -4.378 1.00 32.02 N ATOM 2392 CD2 HIS A 147 27.342 9.369 -5.859 1.00 32.15 C ATOM 2393 CE1 HIS A 147 29.449 9.062 -5.353 1.00 62.11 C ATOM 2394 NE2 HIS A 147 28.531 8.817 -6.261 1.00 21.45 N ATOM 0 H HIS A 147 23.543 10.853 -2.744 1.00 12.24 H new ATOM 0 HA HIS A 147 24.843 9.665 -4.089 1.00 71.55 H new ATOM 0 HB2 HIS A 147 26.308 11.645 -4.311 1.00 52.43 H new ATOM 0 HB3 HIS A 147 27.234 11.133 -2.915 1.00 52.43 H new ATOM 0 HD2 HIS A 147 26.404 9.334 -6.393 1.00 32.15 H new ATOM 0 HE1 HIS A 147 30.482 8.751 -5.400 1.00 62.11 H new ATOM 0 HE2 HIS A 147 28.679 8.299 -7.127 1.00 21.45 H new ATOM 2403 N HIS A 148 26.086 8.859 -1.120 1.00 21.43 N ATOM 2404 CA HIS A 148 26.275 7.736 -0.178 1.00 13.04 C ATOM 2405 C HIS A 148 24.964 6.910 -0.062 1.00 23.42 C ATOM 2406 O HIS A 148 24.002 7.344 0.582 1.00 63.30 O ATOM 2407 CB HIS A 148 26.710 8.296 1.207 1.00 54.01 C ATOM 2408 CG HIS A 148 27.128 7.258 2.221 1.00 14.20 C ATOM 2409 ND1 HIS A 148 28.441 6.903 2.430 1.00 44.45 N ATOM 2410 CD2 HIS A 148 26.406 6.540 3.120 1.00 51.34 C ATOM 2411 CE1 HIS A 148 28.511 6.018 3.400 1.00 13.41 C ATOM 2412 NE2 HIS A 148 27.293 5.780 3.842 1.00 15.01 N ATOM 0 H HIS A 148 26.178 9.774 -0.678 1.00 21.43 H new ATOM 0 HA HIS A 148 27.056 7.072 -0.548 1.00 13.04 H new ATOM 0 HB2 HIS A 148 27.539 8.987 1.057 1.00 54.01 H new ATOM 0 HB3 HIS A 148 25.884 8.874 1.622 1.00 54.01 H new ATOM 0 HD2 HIS A 148 25.333 6.563 3.244 1.00 51.34 H new ATOM 0 HE1 HIS A 148 29.416 5.562 3.772 1.00 13.41 H new ATOM 0 HE2 HIS A 148 27.049 5.138 4.596 1.00 15.01 H new ATOM 2421 N HIS A 149 24.934 5.734 -0.716 1.00 11.14 N ATOM 2422 CA HIS A 149 23.728 4.878 -0.775 1.00 24.45 C ATOM 2423 C HIS A 149 23.495 4.131 0.562 1.00 1.43 C ATOM 2424 O HIS A 149 22.403 3.620 0.828 1.00 23.25 O ATOM 2425 CB HIS A 149 23.818 3.889 -1.973 1.00 60.34 C ATOM 2426 CG HIS A 149 24.962 2.902 -1.911 1.00 63.04 C ATOM 2427 ND1 HIS A 149 26.218 3.174 -2.406 1.00 74.42 N ATOM 2428 CD2 HIS A 149 25.037 1.643 -1.403 1.00 0.02 C ATOM 2429 CE1 HIS A 149 27.007 2.136 -2.211 1.00 65.22 C ATOM 2430 NE2 HIS A 149 26.317 1.197 -1.605 1.00 1.13 N ATOM 0 H HIS A 149 25.736 5.350 -1.215 1.00 11.14 H new ATOM 0 HA HIS A 149 22.864 5.523 -0.934 1.00 24.45 H new ATOM 0 HB2 HIS A 149 22.883 3.333 -2.035 1.00 60.34 H new ATOM 0 HB3 HIS A 149 23.907 4.466 -2.893 1.00 60.34 H new ATOM 0 HD2 HIS A 149 24.236 1.096 -0.928 1.00 0.02 H new ATOM 0 HE1 HIS A 149 28.045 2.069 -2.501 1.00 65.22 H new ATOM 0 HE2 HIS A 149 26.676 0.283 -1.329 1.00 1.13 H new TER 2439 HIS A 149