USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1203 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 140 LYS NZ :NH3+ -149:sc= 0.583 (180deg=0) USER MOD Set 1.2: A 141 SER OG : rot -154:sc= -0.212 USER MOD Set 2.1: A 128 GLN : amide:sc= -2.14! K(o=-2.1!,f=-0.26) USER MOD Set 2.2: A 130 GLN : amide:sc= 0.0702 K(o=-2.1,f=-0.26) USER MOD Set 3.1: A 69 TYR OH : rot -74:sc= 1.21 USER MOD Set 3.2: A 113 SER OG : rot -84:sc= 1.33 USER MOD Set 4.1: A 1 MET N :NH3+ 171:sc= -0.0781 (180deg=-0.221) USER MOD Set 4.2: A 112 SER OG : rot 82:sc= 1.28 USER MOD Set 5.1: A 77 THR OG1 : rot 84:sc= 0.107 USER MOD Set 5.2: A 88 THR OG1 : rot 180:sc= 0.106 USER MOD Set 6.1: A 67 CYS SG : rot 114:sc= 0.158 USER MOD Set 6.2: A 98 CYS SG : rot -37:sc= 1.51 USER MOD Set 7.1: A 15 TYR OH : rot 150:sc= -0.499 USER MOD Set 7.2: A 19 HIS : no HD1:sc= -0.632! C(o=-0.064!,f=-7.2!) USER MOD Set 7.3: A 125 SER OG : rot -108:sc= 1.07 USER MOD Single : A 1 MET CE :methyl -154:sc= -0.162 (180deg=-0.776) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0.00518 USER MOD Single : A 11 CYS SG : rot -56:sc= 0.682 USER MOD Single : A 12 LYS NZ :NH3+ 145:sc= 1.18 (180deg=-0.288!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 20 ASN : amide:sc= -0.0599 X(o=-0.06,f=-0.3) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS : no HD1:sc= -1.84! X(o=-1.8!,f=-2.3) USER MOD Single : A 23 GLN : amide:sc= -1.19 K(o=-1.2,f=-4.8!) USER MOD Single : A 24 HIS : no HE2:sc= 1.12 K(o=1.1,f=-4.4!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 130:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 174:sc= 2.32 (180deg=2.29) USER MOD Single : A 33 LYS NZ :NH3+ -156:sc= 1.22 (180deg=1.21) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 29:sc= 0.85 USER MOD Single : A 42 LYS NZ :NH3+ 151:sc= 1.29 (180deg=0.937) USER MOD Single : A 46 LYS NZ :NH3+ -143:sc= 2.24 (180deg=-0.138) USER MOD Single : A 47 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl 165:sc= -0.0916 (180deg=-0.519) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 149:sc= 1.22 (180deg=0.214) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 1.09 K(o=1.1,f=-0.99) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 THR OG1 : rot 50:sc= 0.0174 USER MOD Single : A 87 SER OG : rot 130:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 1.08 K(o=1.1,f=-0.034) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -0.653 K(o=-0.65,f=-1.3) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 MET CE :methyl 139:sc= -0.0773 (180deg=-0.45) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -139:sc= 0.627 (180deg=-0.118) USER MOD Single : A 120 SER OG : rot 101:sc= 1.26 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 97:sc= 0.00809 USER MOD Single : A 143 LYS NZ :NH3+ -165:sc= 1.17 (180deg=0.796) USER MOD Single : A 144 SER OG : rot 131:sc= 0.779 USER MOD Single : A 147 MET CE :methyl -138:sc= -0.417 (180deg=-1.36) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 1.21 K(o=1.2,f=-0.46) USER MOD Single : A 150 GLN : amide:sc= -2.57! C(o=-2.6!,f=-6.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.093 -1.797 1.862 1.00 51.31 N ATOM 2 CA MET A 1 2.034 -2.788 0.762 1.00 62.24 C ATOM 3 C MET A 1 1.605 -4.152 1.308 1.00 62.20 C ATOM 4 O MET A 1 1.725 -5.175 0.633 1.00 11.22 O ATOM 5 CB MET A 1 3.411 -2.884 0.094 1.00 41.23 C ATOM 6 CG MET A 1 3.403 -3.608 -1.242 1.00 61.22 C ATOM 7 SD MET A 1 5.039 -3.684 -1.998 1.00 35.31 S ATOM 8 CE MET A 1 5.382 -1.945 -2.258 1.00 32.45 C ATOM 0 H1 MET A 1 2.529 -0.919 1.515 1.00 51.31 H new ATOM 0 H2 MET A 1 1.130 -1.596 2.200 1.00 51.31 H new ATOM 0 H3 MET A 1 2.662 -2.180 2.644 1.00 51.31 H new ATOM 0 HA MET A 1 1.300 -2.470 0.021 1.00 62.24 H new ATOM 0 HB2 MET A 1 3.803 -1.877 -0.053 1.00 41.23 H new ATOM 0 HB3 MET A 1 4.096 -3.397 0.769 1.00 41.23 H new ATOM 0 HG2 MET A 1 3.025 -4.620 -1.100 1.00 61.22 H new ATOM 0 HG3 MET A 1 2.716 -3.103 -1.921 1.00 61.22 H new ATOM 0 HE1 MET A 1 6.081 -1.832 -3.087 1.00 32.45 H new ATOM 0 HE2 MET A 1 4.455 -1.422 -2.491 1.00 32.45 H new ATOM 0 HE3 MET A 1 5.820 -1.521 -1.354 1.00 32.45 H new ATOM 20 N ALA A 2 1.072 -4.157 2.526 1.00 12.23 N ATOM 21 CA ALA A 2 0.735 -5.396 3.207 1.00 11.41 C ATOM 22 C ALA A 2 -0.742 -5.735 3.054 1.00 64.24 C ATOM 23 O ALA A 2 -1.565 -5.358 3.889 1.00 54.14 O ATOM 24 CB ALA A 2 1.098 -5.296 4.678 1.00 32.33 C ATOM 0 H ALA A 2 0.865 -3.313 3.060 1.00 12.23 H new ATOM 0 HA ALA A 2 1.310 -6.199 2.746 1.00 11.41 H new ATOM 0 HB1 ALA A 2 0.842 -6.229 5.180 1.00 32.33 H new ATOM 0 HB2 ALA A 2 2.168 -5.112 4.777 1.00 32.33 H new ATOM 0 HB3 ALA A 2 0.545 -4.475 5.134 1.00 32.33 H new ATOM 30 N SER A 3 -1.070 -6.432 1.974 1.00 43.23 N ATOM 31 CA SER A 3 -2.431 -6.879 1.725 1.00 2.21 C ATOM 32 C SER A 3 -2.467 -7.769 0.488 1.00 51.22 C ATOM 33 O SER A 3 -1.616 -7.647 -0.400 1.00 1.34 O ATOM 34 CB SER A 3 -3.368 -5.679 1.537 1.00 44.52 C ATOM 35 OG SER A 3 -4.720 -6.089 1.434 1.00 0.55 O ATOM 0 H SER A 3 -0.403 -6.701 1.251 1.00 43.23 H new ATOM 0 HA SER A 3 -2.772 -7.451 2.588 1.00 2.21 H new ATOM 0 HB2 SER A 3 -3.257 -4.994 2.378 1.00 44.52 H new ATOM 0 HB3 SER A 3 -3.083 -5.131 0.639 1.00 44.52 H new ATOM 0 HG SER A 3 -5.292 -5.302 1.317 1.00 0.55 H new ATOM 41 N GLY A 4 -3.442 -8.666 0.438 1.00 41.23 N ATOM 42 CA GLY A 4 -3.599 -9.535 -0.708 1.00 2.24 C ATOM 43 C GLY A 4 -4.607 -8.985 -1.695 1.00 14.43 C ATOM 44 O GLY A 4 -5.546 -9.681 -2.088 1.00 10.22 O ATOM 0 H GLY A 4 -4.131 -8.807 1.177 1.00 41.23 H new ATOM 0 HA2 GLY A 4 -2.636 -9.661 -1.203 1.00 2.24 H new ATOM 0 HA3 GLY A 4 -3.918 -10.523 -0.375 1.00 2.24 H new ATOM 48 N VAL A 5 -4.413 -7.731 -2.086 1.00 53.41 N ATOM 49 CA VAL A 5 -5.301 -7.067 -3.031 1.00 42.02 C ATOM 50 C VAL A 5 -5.293 -7.788 -4.371 1.00 31.42 C ATOM 51 O VAL A 5 -4.298 -7.770 -5.099 1.00 23.32 O ATOM 52 CB VAL A 5 -4.906 -5.591 -3.259 1.00 63.41 C ATOM 53 CG1 VAL A 5 -5.943 -4.882 -4.121 1.00 10.11 C ATOM 54 CG2 VAL A 5 -4.722 -4.867 -1.934 1.00 35.52 C ATOM 0 H VAL A 5 -3.641 -7.150 -1.759 1.00 53.41 H new ATOM 0 HA VAL A 5 -6.300 -7.097 -2.596 1.00 42.02 H new ATOM 0 HB VAL A 5 -3.953 -5.575 -3.788 1.00 63.41 H new ATOM 0 HG11 VAL A 5 -5.645 -3.844 -4.269 1.00 10.11 H new ATOM 0 HG12 VAL A 5 -6.015 -5.380 -5.088 1.00 10.11 H new ATOM 0 HG13 VAL A 5 -6.913 -4.914 -3.624 1.00 10.11 H new ATOM 0 HG21 VAL A 5 -4.444 -3.830 -2.122 1.00 35.52 H new ATOM 0 HG22 VAL A 5 -5.655 -4.897 -1.371 1.00 35.52 H new ATOM 0 HG23 VAL A 5 -3.935 -5.355 -1.359 1.00 35.52 H new ATOM 64 N LYS A 6 -6.399 -8.434 -4.679 1.00 11.44 N ATOM 65 CA LYS A 6 -6.547 -9.138 -5.937 1.00 51.24 C ATOM 66 C LYS A 6 -7.087 -8.197 -7.002 1.00 24.21 C ATOM 67 O LYS A 6 -7.715 -7.187 -6.688 1.00 35.43 O ATOM 68 CB LYS A 6 -7.492 -10.331 -5.775 1.00 70.44 C ATOM 69 CG LYS A 6 -8.804 -9.964 -5.104 1.00 0.10 C ATOM 70 CD LYS A 6 -9.851 -11.051 -5.261 1.00 74.34 C ATOM 71 CE LYS A 6 -10.301 -11.182 -6.708 1.00 1.34 C ATOM 72 NZ LYS A 6 -11.543 -11.983 -6.825 1.00 12.24 N ATOM 0 H LYS A 6 -7.215 -8.486 -4.070 1.00 11.44 H new ATOM 0 HA LYS A 6 -5.567 -9.504 -6.245 1.00 51.24 H new ATOM 0 HB2 LYS A 6 -7.699 -10.759 -6.756 1.00 70.44 H new ATOM 0 HB3 LYS A 6 -6.995 -11.104 -5.189 1.00 70.44 H new ATOM 0 HG2 LYS A 6 -8.629 -9.781 -4.044 1.00 0.10 H new ATOM 0 HG3 LYS A 6 -9.181 -9.034 -5.531 1.00 0.10 H new ATOM 0 HD2 LYS A 6 -9.445 -12.002 -4.917 1.00 74.34 H new ATOM 0 HD3 LYS A 6 -10.710 -10.825 -4.630 1.00 74.34 H new ATOM 0 HE2 LYS A 6 -10.466 -10.190 -7.129 1.00 1.34 H new ATOM 0 HE3 LYS A 6 -9.510 -11.649 -7.294 1.00 1.34 H new ATOM 0 HZ1 LYS A 6 -11.819 -12.051 -7.825 1.00 12.24 H new ATOM 0 HZ2 LYS A 6 -11.378 -12.937 -6.446 1.00 12.24 H new ATOM 0 HZ3 LYS A 6 -12.304 -11.524 -6.286 1.00 12.24 H new ATOM 86 N VAL A 7 -6.815 -8.503 -8.254 1.00 63.13 N ATOM 87 CA VAL A 7 -7.423 -7.774 -9.347 1.00 53.21 C ATOM 88 C VAL A 7 -8.620 -8.550 -9.869 1.00 3.11 C ATOM 89 O VAL A 7 -8.608 -9.783 -9.892 1.00 43.11 O ATOM 90 CB VAL A 7 -6.428 -7.504 -10.497 1.00 50.42 C ATOM 91 CG1 VAL A 7 -5.294 -6.609 -10.021 1.00 44.25 C ATOM 92 CG2 VAL A 7 -5.878 -8.806 -11.063 1.00 13.32 C ATOM 0 H VAL A 7 -6.180 -9.248 -8.539 1.00 63.13 H new ATOM 0 HA VAL A 7 -7.742 -6.805 -8.962 1.00 53.21 H new ATOM 0 HB VAL A 7 -6.966 -6.991 -11.294 1.00 50.42 H new ATOM 0 HG11 VAL A 7 -4.602 -6.429 -10.844 1.00 44.25 H new ATOM 0 HG12 VAL A 7 -5.701 -5.659 -9.675 1.00 44.25 H new ATOM 0 HG13 VAL A 7 -4.765 -7.097 -9.202 1.00 44.25 H new ATOM 0 HG21 VAL A 7 -5.180 -8.586 -11.871 1.00 13.32 H new ATOM 0 HG22 VAL A 7 -5.360 -9.355 -10.276 1.00 13.32 H new ATOM 0 HG23 VAL A 7 -6.699 -9.411 -11.448 1.00 13.32 H new ATOM 102 N ASP A 8 -9.663 -7.838 -10.252 1.00 1.40 N ATOM 103 CA ASP A 8 -10.856 -8.479 -10.777 1.00 64.24 C ATOM 104 C ASP A 8 -10.712 -8.617 -12.289 1.00 71.11 C ATOM 105 O ASP A 8 -10.555 -7.615 -12.984 1.00 1.04 O ATOM 106 CB ASP A 8 -12.099 -7.661 -10.411 1.00 3.14 C ATOM 107 CG ASP A 8 -13.362 -8.502 -10.320 1.00 44.25 C ATOM 108 OD1 ASP A 8 -13.257 -9.744 -10.269 1.00 33.23 O ATOM 109 OD2 ASP A 8 -14.466 -7.918 -10.259 1.00 11.53 O ATOM 0 H ASP A 8 -9.710 -6.820 -10.210 1.00 1.40 H new ATOM 0 HA ASP A 8 -10.973 -9.470 -10.339 1.00 64.24 H new ATOM 0 HB2 ASP A 8 -11.931 -7.164 -9.455 1.00 3.14 H new ATOM 0 HB3 ASP A 8 -12.244 -6.879 -11.156 1.00 3.14 H new ATOM 114 N PRO A 9 -10.743 -9.863 -12.807 1.00 62.01 N ATOM 115 CA PRO A 9 -10.461 -10.183 -14.223 1.00 11.22 C ATOM 116 C PRO A 9 -11.117 -9.241 -15.235 1.00 11.30 C ATOM 117 O PRO A 9 -10.589 -9.040 -16.329 1.00 44.25 O ATOM 118 CB PRO A 9 -11.025 -11.592 -14.371 1.00 23.32 C ATOM 119 CG PRO A 9 -10.856 -12.199 -13.025 1.00 52.31 C ATOM 120 CD PRO A 9 -11.051 -11.083 -12.035 1.00 53.55 C ATOM 0 HA PRO A 9 -9.397 -10.084 -14.437 1.00 11.22 H new ATOM 0 HB2 PRO A 9 -12.073 -11.571 -14.669 1.00 23.32 H new ATOM 0 HB3 PRO A 9 -10.488 -12.157 -15.133 1.00 23.32 H new ATOM 0 HG2 PRO A 9 -11.583 -12.995 -12.863 1.00 52.31 H new ATOM 0 HG3 PRO A 9 -9.867 -12.644 -12.920 1.00 52.31 H new ATOM 0 HD2 PRO A 9 -12.070 -11.065 -11.650 1.00 53.55 H new ATOM 0 HD3 PRO A 9 -10.388 -11.190 -11.177 1.00 53.55 H new ATOM 128 N SER A 10 -12.249 -8.658 -14.860 1.00 12.13 N ATOM 129 CA SER A 10 -12.974 -7.736 -15.725 1.00 65.43 C ATOM 130 C SER A 10 -12.100 -6.550 -16.155 1.00 64.20 C ATOM 131 O SER A 10 -12.318 -5.964 -17.216 1.00 70.04 O ATOM 132 CB SER A 10 -14.217 -7.230 -14.996 1.00 42.55 C ATOM 133 OG SER A 10 -14.936 -8.306 -14.416 1.00 52.30 O ATOM 0 H SER A 10 -12.688 -8.810 -13.952 1.00 12.13 H new ATOM 0 HA SER A 10 -13.263 -8.274 -16.628 1.00 65.43 H new ATOM 0 HB2 SER A 10 -13.926 -6.522 -14.220 1.00 42.55 H new ATOM 0 HB3 SER A 10 -14.859 -6.692 -15.694 1.00 42.55 H new ATOM 0 HG SER A 10 -15.727 -7.959 -13.953 1.00 52.30 H new ATOM 139 N CYS A 11 -11.108 -6.201 -15.337 1.00 63.13 N ATOM 140 CA CYS A 11 -10.218 -5.094 -15.661 1.00 24.30 C ATOM 141 C CYS A 11 -9.164 -5.526 -16.676 1.00 53.50 C ATOM 142 O CYS A 11 -8.902 -4.824 -17.652 1.00 0.33 O ATOM 143 CB CYS A 11 -9.548 -4.545 -14.396 1.00 2.15 C ATOM 144 SG CYS A 11 -8.487 -5.727 -13.527 1.00 41.20 S ATOM 0 H CYS A 11 -10.904 -6.666 -14.453 1.00 63.13 H new ATOM 0 HA CYS A 11 -10.818 -4.299 -16.105 1.00 24.30 H new ATOM 0 HB2 CYS A 11 -8.952 -3.673 -14.666 1.00 2.15 H new ATOM 0 HB3 CYS A 11 -10.323 -4.201 -13.711 1.00 2.15 H new ATOM 0 HG CYS A 11 -9.173 -6.792 -13.235 1.00 41.20 H new ATOM 150 N LYS A 12 -8.587 -6.700 -16.451 1.00 51.23 N ATOM 151 CA LYS A 12 -7.543 -7.230 -17.317 1.00 52.30 C ATOM 152 C LYS A 12 -8.101 -7.542 -18.701 1.00 64.45 C ATOM 153 O LYS A 12 -7.456 -7.276 -19.714 1.00 42.44 O ATOM 154 CB LYS A 12 -6.930 -8.482 -16.678 1.00 30.42 C ATOM 155 CG LYS A 12 -5.866 -9.168 -17.520 1.00 31.32 C ATOM 156 CD LYS A 12 -4.772 -8.205 -17.952 1.00 14.42 C ATOM 157 CE LYS A 12 -3.580 -8.944 -18.540 1.00 54.34 C ATOM 158 NZ LYS A 12 -3.981 -9.870 -19.632 1.00 4.25 N ATOM 0 H LYS A 12 -8.828 -7.308 -15.668 1.00 51.23 H new ATOM 0 HA LYS A 12 -6.762 -6.479 -17.435 1.00 52.30 H new ATOM 0 HB2 LYS A 12 -6.493 -8.207 -15.718 1.00 30.42 H new ATOM 0 HB3 LYS A 12 -7.727 -9.196 -16.472 1.00 30.42 H new ATOM 0 HG2 LYS A 12 -5.425 -9.986 -16.950 1.00 31.32 H new ATOM 0 HG3 LYS A 12 -6.330 -9.608 -18.402 1.00 31.32 H new ATOM 0 HD2 LYS A 12 -5.170 -7.508 -18.690 1.00 14.42 H new ATOM 0 HD3 LYS A 12 -4.448 -7.613 -17.096 1.00 14.42 H new ATOM 0 HE2 LYS A 12 -2.859 -8.222 -18.924 1.00 54.34 H new ATOM 0 HE3 LYS A 12 -3.079 -9.507 -17.753 1.00 54.34 H new ATOM 0 HZ1 LYS A 12 -3.237 -9.892 -20.359 1.00 4.25 H new ATOM 0 HZ2 LYS A 12 -4.115 -10.826 -19.245 1.00 4.25 H new ATOM 0 HZ3 LYS A 12 -4.871 -9.540 -20.057 1.00 4.25 H new ATOM 172 N ASN A 13 -9.317 -8.076 -18.729 1.00 52.52 N ATOM 173 CA ASN A 13 -9.993 -8.417 -19.980 1.00 54.41 C ATOM 174 C ASN A 13 -10.080 -7.205 -20.909 1.00 24.24 C ATOM 175 O ASN A 13 -9.912 -7.322 -22.124 1.00 31.33 O ATOM 176 CB ASN A 13 -11.397 -8.945 -19.675 1.00 14.23 C ATOM 177 CG ASN A 13 -12.174 -9.339 -20.917 1.00 70.32 C ATOM 178 OD1 ASN A 13 -11.609 -9.796 -21.909 1.00 13.32 O ATOM 179 ND2 ASN A 13 -13.483 -9.164 -20.866 1.00 11.10 N ATOM 0 H ASN A 13 -9.861 -8.285 -17.892 1.00 52.52 H new ATOM 0 HA ASN A 13 -9.413 -9.188 -20.487 1.00 54.41 H new ATOM 0 HB2 ASN A 13 -11.317 -9.809 -19.016 1.00 14.23 H new ATOM 0 HB3 ASN A 13 -11.955 -8.181 -19.133 1.00 14.23 H new ATOM 0 HD21 ASN A 13 -14.062 -9.411 -21.668 1.00 11.10 H new ATOM 0 HD22 ASN A 13 -13.914 -8.782 -20.024 1.00 11.10 H new ATOM 186 N ALA A 14 -10.330 -6.039 -20.329 1.00 34.35 N ATOM 187 CA ALA A 14 -10.463 -4.812 -21.105 1.00 31.50 C ATOM 188 C ALA A 14 -9.102 -4.170 -21.355 1.00 43.32 C ATOM 189 O ALA A 14 -8.891 -3.503 -22.371 1.00 22.41 O ATOM 190 CB ALA A 14 -11.391 -3.833 -20.399 1.00 22.42 C ATOM 0 H ALA A 14 -10.445 -5.916 -19.323 1.00 34.35 H new ATOM 0 HA ALA A 14 -10.897 -5.070 -22.071 1.00 31.50 H new ATOM 0 HB1 ALA A 14 -11.479 -2.923 -20.992 1.00 22.42 H new ATOM 0 HB2 ALA A 14 -12.376 -4.286 -20.281 1.00 22.42 H new ATOM 0 HB3 ALA A 14 -10.984 -3.589 -19.418 1.00 22.42 H new ATOM 196 N TYR A 15 -8.183 -4.386 -20.422 1.00 62.20 N ATOM 197 CA TYR A 15 -6.853 -3.793 -20.481 1.00 43.20 C ATOM 198 C TYR A 15 -6.082 -4.260 -21.715 1.00 3.35 C ATOM 199 O TYR A 15 -5.370 -3.476 -22.344 1.00 54.53 O ATOM 200 CB TYR A 15 -6.074 -4.137 -19.206 1.00 4.02 C ATOM 201 CG TYR A 15 -4.631 -3.688 -19.231 1.00 32.42 C ATOM 202 CD1 TYR A 15 -4.288 -2.364 -18.991 1.00 23.11 C ATOM 203 CD2 TYR A 15 -3.613 -4.590 -19.509 1.00 64.02 C ATOM 204 CE1 TYR A 15 -2.969 -1.952 -19.030 1.00 40.45 C ATOM 205 CE2 TYR A 15 -2.295 -4.188 -19.545 1.00 4.21 C ATOM 206 CZ TYR A 15 -1.976 -2.869 -19.307 1.00 42.45 C ATOM 207 OH TYR A 15 -0.662 -2.467 -19.356 1.00 2.20 O ATOM 0 H TYR A 15 -8.338 -4.976 -19.605 1.00 62.20 H new ATOM 0 HA TYR A 15 -6.968 -2.712 -20.556 1.00 43.20 H new ATOM 0 HB2 TYR A 15 -6.573 -3.678 -18.352 1.00 4.02 H new ATOM 0 HB3 TYR A 15 -6.106 -5.216 -19.052 1.00 4.02 H new ATOM 0 HD1 TYR A 15 -5.063 -1.645 -18.771 1.00 23.11 H new ATOM 0 HD2 TYR A 15 -3.858 -5.624 -19.700 1.00 64.02 H new ATOM 0 HE1 TYR A 15 -2.717 -0.918 -18.845 1.00 40.45 H new ATOM 0 HE2 TYR A 15 -1.515 -4.904 -19.759 1.00 4.21 H new ATOM 0 HH TYR A 15 -0.082 -3.212 -19.092 1.00 2.20 H new ATOM 217 N ASP A 16 -6.231 -5.530 -22.069 1.00 12.31 N ATOM 218 CA ASP A 16 -5.505 -6.091 -23.208 1.00 44.22 C ATOM 219 C ASP A 16 -5.849 -5.373 -24.504 1.00 1.15 C ATOM 220 O ASP A 16 -5.017 -5.281 -25.409 1.00 25.52 O ATOM 221 CB ASP A 16 -5.782 -7.584 -23.360 1.00 55.22 C ATOM 222 CG ASP A 16 -5.045 -8.409 -22.332 1.00 70.32 C ATOM 223 OD1 ASP A 16 -3.808 -8.534 -22.439 1.00 73.20 O ATOM 224 OD2 ASP A 16 -5.693 -8.929 -21.408 1.00 4.25 O ATOM 0 H ASP A 16 -6.843 -6.190 -21.589 1.00 12.31 H new ATOM 0 HA ASP A 16 -4.444 -5.947 -23.005 1.00 44.22 H new ATOM 0 HB2 ASP A 16 -6.853 -7.764 -23.268 1.00 55.22 H new ATOM 0 HB3 ASP A 16 -5.489 -7.906 -24.359 1.00 55.22 H new ATOM 229 N LEU A 17 -7.067 -4.850 -24.583 1.00 70.11 N ATOM 230 CA LEU A 17 -7.530 -4.168 -25.782 1.00 13.23 C ATOM 231 C LEU A 17 -6.715 -2.908 -26.050 1.00 65.51 C ATOM 232 O LEU A 17 -6.446 -2.570 -27.196 1.00 74.12 O ATOM 233 CB LEU A 17 -9.014 -3.819 -25.660 1.00 1.01 C ATOM 234 CG LEU A 17 -9.950 -5.016 -25.475 1.00 51.04 C ATOM 235 CD1 LEU A 17 -11.395 -4.551 -25.404 1.00 21.23 C ATOM 236 CD2 LEU A 17 -9.764 -6.021 -26.602 1.00 64.33 C ATOM 0 H LEU A 17 -7.752 -4.886 -23.828 1.00 70.11 H new ATOM 0 HA LEU A 17 -7.394 -4.846 -26.624 1.00 13.23 H new ATOM 0 HB2 LEU A 17 -9.144 -3.142 -24.815 1.00 1.01 H new ATOM 0 HB3 LEU A 17 -9.318 -3.275 -26.554 1.00 1.01 H new ATOM 0 HG LEU A 17 -9.700 -5.509 -24.536 1.00 51.04 H new ATOM 0 HD11 LEU A 17 -12.049 -5.413 -25.272 1.00 21.23 H new ATOM 0 HD12 LEU A 17 -11.517 -3.871 -24.561 1.00 21.23 H new ATOM 0 HD13 LEU A 17 -11.657 -4.035 -26.328 1.00 21.23 H new ATOM 0 HD21 LEU A 17 -10.438 -6.864 -26.452 1.00 64.33 H new ATOM 0 HD22 LEU A 17 -9.987 -5.543 -27.556 1.00 64.33 H new ATOM 0 HD23 LEU A 17 -8.734 -6.376 -26.606 1.00 64.33 H new ATOM 248 N LEU A 18 -6.345 -2.195 -24.998 1.00 24.11 N ATOM 249 CA LEU A 18 -5.497 -1.019 -25.155 1.00 33.14 C ATOM 250 C LEU A 18 -4.017 -1.401 -25.175 1.00 43.04 C ATOM 251 O LEU A 18 -3.239 -0.822 -25.920 1.00 51.13 O ATOM 252 CB LEU A 18 -5.794 0.021 -24.061 1.00 74.35 C ATOM 253 CG LEU A 18 -5.640 -0.445 -22.609 1.00 45.11 C ATOM 254 CD1 LEU A 18 -4.227 -0.195 -22.096 1.00 54.50 C ATOM 255 CD2 LEU A 18 -6.659 0.253 -21.725 1.00 73.22 C ATOM 0 H LEU A 18 -6.613 -2.404 -24.036 1.00 24.11 H new ATOM 0 HA LEU A 18 -5.728 -0.564 -26.118 1.00 33.14 H new ATOM 0 HB2 LEU A 18 -5.135 0.876 -24.216 1.00 74.35 H new ATOM 0 HB3 LEU A 18 -6.815 0.377 -24.198 1.00 74.35 H new ATOM 0 HG LEU A 18 -5.821 -1.519 -22.576 1.00 45.11 H new ATOM 0 HD11 LEU A 18 -4.149 -0.536 -21.064 1.00 54.50 H new ATOM 0 HD12 LEU A 18 -3.514 -0.741 -22.713 1.00 54.50 H new ATOM 0 HD13 LEU A 18 -4.006 0.871 -22.144 1.00 54.50 H new ATOM 0 HD21 LEU A 18 -6.540 -0.086 -20.696 1.00 73.22 H new ATOM 0 HD22 LEU A 18 -6.504 1.331 -21.772 1.00 73.22 H new ATOM 0 HD23 LEU A 18 -7.665 0.015 -22.072 1.00 73.22 H new ATOM 267 N HIS A 19 -3.667 -2.428 -24.395 1.00 11.13 N ATOM 268 CA HIS A 19 -2.269 -2.771 -24.097 1.00 54.32 C ATOM 269 C HIS A 19 -1.377 -2.847 -25.343 1.00 41.12 C ATOM 270 O HIS A 19 -0.265 -2.324 -25.339 1.00 30.01 O ATOM 271 CB HIS A 19 -2.211 -4.100 -23.335 1.00 20.43 C ATOM 272 CG HIS A 19 -0.869 -4.392 -22.722 1.00 44.44 C ATOM 273 ND1 HIS A 19 -0.441 -5.668 -22.413 1.00 24.11 N ATOM 274 CD2 HIS A 19 0.133 -3.561 -22.342 1.00 73.40 C ATOM 275 CE1 HIS A 19 0.760 -5.605 -21.864 1.00 23.03 C ATOM 276 NE2 HIS A 19 1.129 -4.341 -21.815 1.00 21.40 N ATOM 0 H HIS A 19 -4.345 -3.047 -23.951 1.00 11.13 H new ATOM 0 HA HIS A 19 -1.876 -1.961 -23.483 1.00 54.32 H new ATOM 0 HB2 HIS A 19 -2.965 -4.089 -22.548 1.00 20.43 H new ATOM 0 HB3 HIS A 19 -2.473 -4.910 -24.016 1.00 20.43 H new ATOM 0 HD2 HIS A 19 0.144 -2.485 -22.437 1.00 73.40 H new ATOM 0 HE1 HIS A 19 1.340 -6.446 -21.515 1.00 23.03 H new ATOM 0 HE2 HIS A 19 2.015 -3.998 -21.444 1.00 21.40 H new ATOM 285 N ASN A 20 -1.838 -3.519 -26.387 1.00 40.23 N ATOM 286 CA ASN A 20 -1.047 -3.625 -27.613 1.00 32.44 C ATOM 287 C ASN A 20 -1.963 -3.719 -28.828 1.00 60.33 C ATOM 288 O ASN A 20 -1.557 -4.126 -29.914 1.00 65.31 O ATOM 289 CB ASN A 20 -0.116 -4.842 -27.537 1.00 75.40 C ATOM 290 CG ASN A 20 1.037 -4.774 -28.527 1.00 61.21 C ATOM 291 OD1 ASN A 20 0.956 -5.286 -29.645 1.00 21.11 O ATOM 292 ND2 ASN A 20 2.125 -4.142 -28.117 1.00 24.32 N ATOM 0 H ASN A 20 -2.740 -3.994 -26.416 1.00 40.23 H new ATOM 0 HA ASN A 20 -0.435 -2.729 -27.717 1.00 32.44 H new ATOM 0 HB2 ASN A 20 0.285 -4.923 -26.527 1.00 75.40 H new ATOM 0 HB3 ASN A 20 -0.695 -5.747 -27.724 1.00 75.40 H new ATOM 0 HD21 ASN A 20 2.934 -4.066 -28.734 1.00 24.32 H new ATOM 0 HD22 ASN A 20 2.155 -3.731 -27.184 1.00 24.32 H new ATOM 299 N LYS A 21 -3.206 -3.320 -28.636 1.00 3.34 N ATOM 300 CA LYS A 21 -4.192 -3.356 -29.704 1.00 41.32 C ATOM 301 C LYS A 21 -4.734 -1.950 -29.953 1.00 52.31 C ATOM 302 O LYS A 21 -5.223 -1.643 -31.040 1.00 42.42 O ATOM 303 CB LYS A 21 -5.324 -4.314 -29.325 1.00 2.13 C ATOM 304 CG LYS A 21 -6.354 -4.546 -30.418 1.00 54.24 C ATOM 305 CD LYS A 21 -5.987 -5.712 -31.324 1.00 11.21 C ATOM 306 CE LYS A 21 -4.877 -5.364 -32.303 1.00 61.23 C ATOM 307 NZ LYS A 21 -4.536 -6.521 -33.171 1.00 71.14 N ATOM 0 H LYS A 21 -3.560 -2.966 -27.747 1.00 3.34 H new ATOM 0 HA LYS A 21 -3.726 -3.714 -30.622 1.00 41.32 H new ATOM 0 HB2 LYS A 21 -4.890 -5.274 -29.044 1.00 2.13 H new ATOM 0 HB3 LYS A 21 -5.832 -3.923 -28.443 1.00 2.13 H new ATOM 0 HG2 LYS A 21 -7.326 -4.735 -29.963 1.00 54.24 H new ATOM 0 HG3 LYS A 21 -6.453 -3.641 -31.017 1.00 54.24 H new ATOM 0 HD2 LYS A 21 -5.675 -6.559 -30.712 1.00 11.21 H new ATOM 0 HD3 LYS A 21 -6.870 -6.028 -31.879 1.00 11.21 H new ATOM 0 HE2 LYS A 21 -5.187 -4.522 -32.922 1.00 61.23 H new ATOM 0 HE3 LYS A 21 -3.991 -5.047 -31.753 1.00 61.23 H new ATOM 0 HZ1 LYS A 21 -3.776 -6.251 -33.827 1.00 71.14 H new ATOM 0 HZ2 LYS A 21 -4.218 -7.316 -32.581 1.00 71.14 H new ATOM 0 HZ3 LYS A 21 -5.376 -6.807 -33.713 1.00 71.14 H new ATOM 321 N HIS A 22 -4.632 -1.108 -28.923 1.00 4.22 N ATOM 322 CA HIS A 22 -5.066 0.290 -28.975 1.00 40.03 C ATOM 323 C HIS A 22 -6.551 0.402 -29.335 1.00 63.24 C ATOM 324 O HIS A 22 -6.981 1.389 -29.923 1.00 74.40 O ATOM 325 CB HIS A 22 -4.213 1.090 -29.972 1.00 20.23 C ATOM 326 CG HIS A 22 -4.189 2.570 -29.703 1.00 34.52 C ATOM 327 ND1 HIS A 22 -5.031 3.467 -30.322 1.00 51.52 N ATOM 328 CD2 HIS A 22 -3.403 3.306 -28.884 1.00 2.24 C ATOM 329 CE1 HIS A 22 -4.755 4.688 -29.902 1.00 75.23 C ATOM 330 NE2 HIS A 22 -3.768 4.623 -29.028 1.00 53.34 N ATOM 0 H HIS A 22 -4.242 -1.380 -28.020 1.00 4.22 H new ATOM 0 HA HIS A 22 -4.928 0.713 -27.980 1.00 40.03 H new ATOM 0 HB2 HIS A 22 -3.192 0.710 -29.948 1.00 20.23 H new ATOM 0 HB3 HIS A 22 -4.593 0.920 -30.979 1.00 20.23 H new ATOM 0 HD2 HIS A 22 -2.628 2.927 -28.234 1.00 2.24 H new ATOM 0 HE1 HIS A 22 -5.254 5.591 -30.221 1.00 75.23 H new ATOM 0 HE2 HIS A 22 -3.348 5.415 -28.542 1.00 53.34 H new ATOM 339 N GLN A 23 -7.339 -0.603 -28.958 1.00 60.54 N ATOM 340 CA GLN A 23 -8.779 -0.561 -29.193 1.00 71.33 C ATOM 341 C GLN A 23 -9.444 0.425 -28.241 1.00 53.30 C ATOM 342 O GLN A 23 -10.572 0.855 -28.465 1.00 21.13 O ATOM 343 CB GLN A 23 -9.403 -1.952 -29.065 1.00 11.41 C ATOM 344 CG GLN A 23 -9.213 -2.800 -30.312 1.00 65.51 C ATOM 345 CD GLN A 23 -10.033 -4.074 -30.294 1.00 23.31 C ATOM 346 OE1 GLN A 23 -9.578 -5.115 -29.823 1.00 72.53 O ATOM 347 NE2 GLN A 23 -11.243 -4.002 -30.823 1.00 22.41 N ATOM 0 H GLN A 23 -7.008 -1.448 -28.493 1.00 60.54 H new ATOM 0 HA GLN A 23 -8.946 -0.219 -30.215 1.00 71.33 H new ATOM 0 HB2 GLN A 23 -8.962 -2.466 -28.211 1.00 11.41 H new ATOM 0 HB3 GLN A 23 -10.469 -1.850 -28.860 1.00 11.41 H new ATOM 0 HG2 GLN A 23 -9.485 -2.212 -31.189 1.00 65.51 H new ATOM 0 HG3 GLN A 23 -8.158 -3.055 -30.414 1.00 65.51 H new ATOM 0 HE21 GLN A 23 -11.582 -3.118 -31.203 1.00 22.41 H new ATOM 0 HE22 GLN A 23 -11.837 -4.830 -30.851 1.00 22.41 H new ATOM 356 N HIS A 24 -8.731 0.768 -27.180 1.00 25.11 N ATOM 357 CA HIS A 24 -9.115 1.855 -26.289 1.00 54.13 C ATOM 358 C HIS A 24 -7.851 2.621 -25.934 1.00 62.32 C ATOM 359 O HIS A 24 -6.758 2.171 -26.271 1.00 2.24 O ATOM 360 CB HIS A 24 -9.799 1.343 -25.013 1.00 53.32 C ATOM 361 CG HIS A 24 -11.061 0.563 -25.247 1.00 41.12 C ATOM 362 ND1 HIS A 24 -12.111 1.018 -26.020 1.00 45.32 N ATOM 363 CD2 HIS A 24 -11.437 -0.656 -24.790 1.00 10.35 C ATOM 364 CE1 HIS A 24 -13.072 0.114 -26.027 1.00 51.44 C ATOM 365 NE2 HIS A 24 -12.688 -0.909 -25.290 1.00 23.35 N ATOM 0 H HIS A 24 -7.866 0.299 -26.910 1.00 25.11 H new ATOM 0 HA HIS A 24 -9.838 2.496 -26.793 1.00 54.13 H new ATOM 0 HB2 HIS A 24 -9.095 0.714 -24.467 1.00 53.32 H new ATOM 0 HB3 HIS A 24 -10.028 2.195 -24.373 1.00 53.32 H new ATOM 0 HD1 HIS A 24 -12.139 1.913 -26.509 1.00 45.32 H new ATOM 0 HD2 HIS A 24 -10.859 -1.307 -24.151 1.00 10.35 H new ATOM 0 HE1 HIS A 24 -14.014 0.198 -26.548 1.00 51.44 H new ATOM 374 N SER A 25 -7.976 3.764 -25.280 1.00 44.23 N ATOM 375 CA SER A 25 -6.795 4.546 -24.942 1.00 1.23 C ATOM 376 C SER A 25 -6.575 4.591 -23.433 1.00 54.14 C ATOM 377 O SER A 25 -5.636 3.982 -22.921 1.00 33.30 O ATOM 378 CB SER A 25 -6.912 5.961 -25.513 1.00 73.14 C ATOM 379 OG SER A 25 -5.724 6.704 -25.296 1.00 65.22 O ATOM 0 H SER A 25 -8.863 4.166 -24.977 1.00 44.23 H new ATOM 0 HA SER A 25 -5.928 4.060 -25.390 1.00 1.23 H new ATOM 0 HB2 SER A 25 -7.120 5.908 -26.582 1.00 73.14 H new ATOM 0 HB3 SER A 25 -7.754 6.474 -25.049 1.00 73.14 H new ATOM 0 HG SER A 25 -5.827 7.603 -25.673 1.00 65.22 H new ATOM 385 N TYR A 26 -7.450 5.289 -22.719 1.00 13.10 N ATOM 386 CA TYR A 26 -7.299 5.439 -21.280 1.00 53.22 C ATOM 387 C TYR A 26 -8.389 4.680 -20.542 1.00 51.01 C ATOM 388 O TYR A 26 -9.516 4.571 -21.022 1.00 75.34 O ATOM 389 CB TYR A 26 -7.324 6.922 -20.879 1.00 44.25 C ATOM 390 CG TYR A 26 -8.657 7.617 -21.097 1.00 35.24 C ATOM 391 CD1 TYR A 26 -8.971 8.204 -22.318 1.00 33.23 C ATOM 392 CD2 TYR A 26 -9.595 7.697 -20.072 1.00 13.32 C ATOM 393 CE1 TYR A 26 -10.183 8.845 -22.511 1.00 12.21 C ATOM 394 CE2 TYR A 26 -10.806 8.337 -20.259 1.00 15.51 C ATOM 395 CZ TYR A 26 -11.095 8.910 -21.478 1.00 33.30 C ATOM 396 OH TYR A 26 -12.303 9.544 -21.666 1.00 22.13 O ATOM 0 H TYR A 26 -8.267 5.757 -23.112 1.00 13.10 H new ATOM 0 HA TYR A 26 -6.332 5.020 -21.000 1.00 53.22 H new ATOM 0 HB2 TYR A 26 -7.055 7.004 -19.826 1.00 44.25 H new ATOM 0 HB3 TYR A 26 -6.557 7.450 -21.446 1.00 44.25 H new ATOM 0 HD1 TYR A 26 -8.258 8.159 -23.128 1.00 33.23 H new ATOM 0 HD2 TYR A 26 -9.373 7.251 -19.114 1.00 13.32 H new ATOM 0 HE1 TYR A 26 -10.414 9.292 -23.467 1.00 12.21 H new ATOM 0 HE2 TYR A 26 -11.523 8.388 -19.453 1.00 15.51 H new ATOM 0 HH TYR A 26 -13.030 8.959 -21.367 1.00 22.13 H new ATOM 406 N ILE A 27 -8.043 4.141 -19.388 1.00 23.31 N ATOM 407 CA ILE A 27 -9.009 3.453 -18.550 1.00 23.32 C ATOM 408 C ILE A 27 -8.733 3.736 -17.071 1.00 21.14 C ATOM 409 O ILE A 27 -7.584 3.699 -16.621 1.00 31.55 O ATOM 410 CB ILE A 27 -9.000 1.933 -18.836 1.00 65.34 C ATOM 411 CG1 ILE A 27 -10.066 1.209 -18.012 1.00 74.14 C ATOM 412 CG2 ILE A 27 -7.628 1.344 -18.570 1.00 53.21 C ATOM 413 CD1 ILE A 27 -10.198 -0.259 -18.362 1.00 55.11 C ATOM 0 H ILE A 27 -7.097 4.166 -19.008 1.00 23.31 H new ATOM 0 HA ILE A 27 -10.003 3.831 -18.788 1.00 23.32 H new ATOM 0 HB ILE A 27 -9.237 1.791 -19.890 1.00 65.34 H new ATOM 0 HG12 ILE A 27 -9.823 1.303 -16.954 1.00 74.14 H new ATOM 0 HG13 ILE A 27 -11.028 1.699 -18.163 1.00 74.14 H new ATOM 0 HG21 ILE A 27 -7.645 0.274 -18.778 1.00 53.21 H new ATOM 0 HG22 ILE A 27 -6.893 1.827 -19.214 1.00 53.21 H new ATOM 0 HG23 ILE A 27 -7.358 1.507 -17.527 1.00 53.21 H new ATOM 0 HD11 ILE A 27 -10.971 -0.713 -17.741 1.00 55.11 H new ATOM 0 HD12 ILE A 27 -10.471 -0.359 -19.413 1.00 55.11 H new ATOM 0 HD13 ILE A 27 -9.248 -0.762 -18.184 1.00 55.11 H new ATOM 425 N ILE A 28 -9.784 4.048 -16.328 1.00 75.12 N ATOM 426 CA ILE A 28 -9.658 4.374 -14.921 1.00 14.11 C ATOM 427 C ILE A 28 -9.962 3.151 -14.061 1.00 70.15 C ATOM 428 O ILE A 28 -10.982 2.485 -14.251 1.00 61.40 O ATOM 429 CB ILE A 28 -10.610 5.525 -14.533 1.00 44.41 C ATOM 430 CG1 ILE A 28 -10.344 6.748 -15.415 1.00 73.13 C ATOM 431 CG2 ILE A 28 -10.454 5.880 -13.060 1.00 4.43 C ATOM 432 CD1 ILE A 28 -11.309 7.892 -15.178 1.00 34.15 C ATOM 0 H ILE A 28 -10.740 4.082 -16.682 1.00 75.12 H new ATOM 0 HA ILE A 28 -8.631 4.693 -14.744 1.00 14.11 H new ATOM 0 HB ILE A 28 -11.637 5.196 -14.694 1.00 44.41 H new ATOM 0 HG12 ILE A 28 -9.328 7.099 -15.237 1.00 73.13 H new ATOM 0 HG13 ILE A 28 -10.399 6.449 -16.462 1.00 73.13 H new ATOM 0 HG21 ILE A 28 -11.134 6.694 -12.808 1.00 4.43 H new ATOM 0 HG22 ILE A 28 -10.688 5.008 -12.449 1.00 4.43 H new ATOM 0 HG23 ILE A 28 -9.428 6.192 -12.868 1.00 4.43 H new ATOM 0 HD11 ILE A 28 -11.058 8.722 -15.838 1.00 34.15 H new ATOM 0 HD12 ILE A 28 -12.326 7.559 -15.384 1.00 34.15 H new ATOM 0 HD13 ILE A 28 -11.238 8.219 -14.141 1.00 34.15 H new ATOM 444 N PHE A 29 -9.071 2.860 -13.128 1.00 24.02 N ATOM 445 CA PHE A 29 -9.249 1.744 -12.214 1.00 31.01 C ATOM 446 C PHE A 29 -9.425 2.253 -10.793 1.00 0.13 C ATOM 447 O PHE A 29 -8.925 3.319 -10.439 1.00 23.40 O ATOM 448 CB PHE A 29 -8.042 0.805 -12.256 1.00 71.05 C ATOM 449 CG PHE A 29 -7.789 0.171 -13.594 1.00 34.52 C ATOM 450 CD1 PHE A 29 -8.634 -0.812 -14.081 1.00 54.11 C ATOM 451 CD2 PHE A 29 -6.692 0.546 -14.354 1.00 70.35 C ATOM 452 CE1 PHE A 29 -8.390 -1.409 -15.303 1.00 70.30 C ATOM 453 CE2 PHE A 29 -6.446 -0.047 -15.578 1.00 21.24 C ATOM 454 CZ PHE A 29 -7.295 -1.026 -16.052 1.00 53.34 C ATOM 0 H PHE A 29 -8.210 3.387 -12.983 1.00 24.02 H new ATOM 0 HA PHE A 29 -10.139 1.197 -12.526 1.00 31.01 H new ATOM 0 HB2 PHE A 29 -7.154 1.363 -11.959 1.00 71.05 H new ATOM 0 HB3 PHE A 29 -8.185 0.017 -11.517 1.00 71.05 H new ATOM 0 HD1 PHE A 29 -9.492 -1.115 -13.500 1.00 54.11 H new ATOM 0 HD2 PHE A 29 -6.023 1.309 -13.986 1.00 70.35 H new ATOM 0 HE1 PHE A 29 -9.056 -2.175 -15.672 1.00 70.30 H new ATOM 0 HE2 PHE A 29 -5.590 0.256 -16.163 1.00 21.24 H new ATOM 0 HZ PHE A 29 -7.103 -1.492 -17.007 1.00 53.34 H new ATOM 464 N LYS A 30 -10.134 1.493 -9.986 1.00 12.44 N ATOM 465 CA LYS A 30 -10.257 1.797 -8.573 1.00 60.21 C ATOM 466 C LYS A 30 -10.242 0.515 -7.761 1.00 0.12 C ATOM 467 O LYS A 30 -10.547 -0.562 -8.283 1.00 30.25 O ATOM 468 CB LYS A 30 -11.521 2.631 -8.281 1.00 42.43 C ATOM 469 CG LYS A 30 -12.786 2.193 -9.019 1.00 53.42 C ATOM 470 CD LYS A 30 -13.276 0.823 -8.582 1.00 63.15 C ATOM 471 CE LYS A 30 -14.629 0.490 -9.192 1.00 45.44 C ATOM 472 NZ LYS A 30 -15.735 1.263 -8.563 1.00 5.11 N ATOM 0 H LYS A 30 -10.636 0.657 -10.284 1.00 12.44 H new ATOM 0 HA LYS A 30 -9.401 2.404 -8.278 1.00 60.21 H new ATOM 0 HB2 LYS A 30 -11.717 2.598 -7.209 1.00 42.43 H new ATOM 0 HB3 LYS A 30 -11.315 3.671 -8.535 1.00 42.43 H new ATOM 0 HG2 LYS A 30 -13.573 2.927 -8.849 1.00 53.42 H new ATOM 0 HG3 LYS A 30 -12.590 2.179 -10.091 1.00 53.42 H new ATOM 0 HD2 LYS A 30 -12.548 0.066 -8.874 1.00 63.15 H new ATOM 0 HD3 LYS A 30 -13.349 0.792 -7.495 1.00 63.15 H new ATOM 0 HE2 LYS A 30 -14.605 0.699 -10.262 1.00 45.44 H new ATOM 0 HE3 LYS A 30 -14.824 -0.577 -9.080 1.00 45.44 H new ATOM 0 HZ1 LYS A 30 -16.621 1.081 -9.076 1.00 5.11 H new ATOM 0 HZ2 LYS A 30 -15.843 0.970 -7.571 1.00 5.11 H new ATOM 0 HZ3 LYS A 30 -15.515 2.279 -8.602 1.00 5.11 H new ATOM 486 N ILE A 31 -9.858 0.622 -6.501 1.00 12.10 N ATOM 487 CA ILE A 31 -9.890 -0.521 -5.614 1.00 64.33 C ATOM 488 C ILE A 31 -11.280 -0.652 -5.001 1.00 52.30 C ATOM 489 O ILE A 31 -11.664 0.086 -4.092 1.00 12.44 O ATOM 490 CB ILE A 31 -8.790 -0.453 -4.525 1.00 34.50 C ATOM 491 CG1 ILE A 31 -8.920 -1.638 -3.558 1.00 11.50 C ATOM 492 CG2 ILE A 31 -8.830 0.878 -3.778 1.00 75.34 C ATOM 493 CD1 ILE A 31 -7.765 -1.760 -2.587 1.00 3.12 C ATOM 0 H ILE A 31 -9.523 1.485 -6.073 1.00 12.10 H new ATOM 0 HA ILE A 31 -9.676 -1.414 -6.201 1.00 64.33 H new ATOM 0 HB ILE A 31 -7.820 -0.519 -5.017 1.00 34.50 H new ATOM 0 HG12 ILE A 31 -9.848 -1.536 -2.995 1.00 11.50 H new ATOM 0 HG13 ILE A 31 -8.997 -2.560 -4.135 1.00 11.50 H new ATOM 0 HG21 ILE A 31 -8.046 0.894 -3.021 1.00 75.34 H new ATOM 0 HG22 ILE A 31 -8.672 1.695 -4.482 1.00 75.34 H new ATOM 0 HG23 ILE A 31 -9.801 0.996 -3.297 1.00 75.34 H new ATOM 0 HD11 ILE A 31 -7.926 -2.619 -1.936 1.00 3.12 H new ATOM 0 HD12 ILE A 31 -6.836 -1.894 -3.141 1.00 3.12 H new ATOM 0 HD13 ILE A 31 -7.700 -0.855 -1.984 1.00 3.12 H new ATOM 505 N ASP A 32 -12.039 -1.576 -5.552 1.00 60.44 N ATOM 506 CA ASP A 32 -13.421 -1.783 -5.163 1.00 34.12 C ATOM 507 C ASP A 32 -13.534 -3.144 -4.494 1.00 0.12 C ATOM 508 O ASP A 32 -12.529 -3.668 -3.999 1.00 33.23 O ATOM 509 CB ASP A 32 -14.308 -1.722 -6.414 1.00 62.44 C ATOM 510 CG ASP A 32 -15.748 -1.352 -6.118 1.00 13.23 C ATOM 511 OD1 ASP A 32 -16.543 -2.255 -5.777 1.00 72.34 O ATOM 512 OD2 ASP A 32 -16.095 -0.160 -6.254 1.00 52.20 O ATOM 0 H ASP A 32 -11.715 -2.207 -6.285 1.00 60.44 H new ATOM 0 HA ASP A 32 -13.747 -1.011 -4.466 1.00 34.12 H new ATOM 0 HB2 ASP A 32 -13.890 -0.995 -7.110 1.00 62.44 H new ATOM 0 HB3 ASP A 32 -14.286 -2.691 -6.913 1.00 62.44 H new ATOM 517 N LYS A 33 -14.744 -3.701 -4.475 1.00 24.52 N ATOM 518 CA LYS A 33 -14.972 -5.071 -4.028 1.00 52.31 C ATOM 519 C LYS A 33 -14.902 -5.181 -2.506 1.00 1.22 C ATOM 520 O LYS A 33 -13.973 -4.682 -1.875 1.00 3.40 O ATOM 521 CB LYS A 33 -13.940 -6.003 -4.676 1.00 2.31 C ATOM 522 CG LYS A 33 -14.243 -7.483 -4.542 1.00 45.14 C ATOM 523 CD LYS A 33 -15.321 -7.923 -5.524 1.00 72.32 C ATOM 524 CE LYS A 33 -14.904 -7.629 -6.960 1.00 12.22 C ATOM 525 NZ LYS A 33 -15.866 -8.166 -7.959 1.00 54.34 N ATOM 0 H LYS A 33 -15.591 -3.215 -4.769 1.00 24.52 H new ATOM 0 HA LYS A 33 -15.975 -5.368 -4.335 1.00 52.31 H new ATOM 0 HB2 LYS A 33 -13.864 -5.757 -5.735 1.00 2.31 H new ATOM 0 HB3 LYS A 33 -12.964 -5.805 -4.232 1.00 2.31 H new ATOM 0 HG2 LYS A 33 -13.334 -8.059 -4.716 1.00 45.14 H new ATOM 0 HG3 LYS A 33 -14.567 -7.698 -3.524 1.00 45.14 H new ATOM 0 HD2 LYS A 33 -15.510 -8.990 -5.408 1.00 72.32 H new ATOM 0 HD3 LYS A 33 -16.255 -7.407 -5.300 1.00 72.32 H new ATOM 0 HE2 LYS A 33 -14.812 -6.551 -7.094 1.00 12.22 H new ATOM 0 HE3 LYS A 33 -13.919 -8.058 -7.143 1.00 12.22 H new ATOM 0 HZ1 LYS A 33 -15.379 -8.312 -8.866 1.00 54.34 H new ATOM 0 HZ2 LYS A 33 -16.247 -9.073 -7.621 1.00 54.34 H new ATOM 0 HZ3 LYS A 33 -16.645 -7.490 -8.089 1.00 54.34 H new ATOM 539 N ASN A 34 -15.882 -5.859 -1.921 1.00 53.03 N ATOM 540 CA ASN A 34 -15.877 -6.114 -0.479 1.00 43.30 C ATOM 541 C ASN A 34 -14.860 -7.198 -0.139 1.00 24.05 C ATOM 542 O ASN A 34 -14.715 -7.601 1.015 1.00 74.44 O ATOM 543 CB ASN A 34 -17.265 -6.530 0.013 1.00 14.23 C ATOM 544 CG ASN A 34 -18.249 -5.376 0.055 1.00 20.41 C ATOM 545 OD1 ASN A 34 -18.345 -4.663 1.055 1.00 10.32 O ATOM 546 ND2 ASN A 34 -18.999 -5.193 -1.022 1.00 4.20 N ATOM 0 H ASN A 34 -16.687 -6.242 -2.416 1.00 53.03 H new ATOM 0 HA ASN A 34 -15.598 -5.188 0.025 1.00 43.30 H new ATOM 0 HB2 ASN A 34 -17.657 -7.311 -0.639 1.00 14.23 H new ATOM 0 HB3 ASN A 34 -17.177 -6.962 1.010 1.00 14.23 H new ATOM 0 HD21 ASN A 34 -19.686 -4.440 -1.043 1.00 4.20 H new ATOM 0 HD22 ASN A 34 -18.889 -5.805 -1.830 1.00 4.20 H new ATOM 553 N ASP A 35 -14.170 -7.667 -1.167 1.00 13.40 N ATOM 554 CA ASP A 35 -13.120 -8.664 -1.026 1.00 5.22 C ATOM 555 C ASP A 35 -11.804 -8.065 -1.524 1.00 62.00 C ATOM 556 O ASP A 35 -10.849 -8.777 -1.826 1.00 34.25 O ATOM 557 CB ASP A 35 -13.498 -9.917 -1.827 1.00 71.15 C ATOM 558 CG ASP A 35 -12.563 -11.090 -1.602 1.00 35.33 C ATOM 559 OD1 ASP A 35 -12.616 -11.701 -0.517 1.00 44.24 O ATOM 560 OD2 ASP A 35 -11.790 -11.427 -2.524 1.00 1.30 O ATOM 0 H ASP A 35 -14.324 -7.365 -2.129 1.00 13.40 H new ATOM 0 HA ASP A 35 -13.001 -8.952 0.019 1.00 5.22 H new ATOM 0 HB2 ASP A 35 -14.512 -10.216 -1.560 1.00 71.15 H new ATOM 0 HB3 ASP A 35 -13.507 -9.670 -2.889 1.00 71.15 H new ATOM 565 N THR A 36 -11.784 -6.730 -1.581 1.00 51.33 N ATOM 566 CA THR A 36 -10.640 -5.945 -2.059 1.00 54.24 C ATOM 567 C THR A 36 -10.139 -6.396 -3.430 1.00 33.21 C ATOM 568 O THR A 36 -9.287 -7.279 -3.538 1.00 23.40 O ATOM 569 CB THR A 36 -9.462 -5.926 -1.058 1.00 43.32 C ATOM 570 OG1 THR A 36 -9.205 -7.235 -0.529 1.00 10.44 O ATOM 571 CG2 THR A 36 -9.736 -4.953 0.078 1.00 65.20 C ATOM 0 H THR A 36 -12.575 -6.154 -1.292 1.00 51.33 H new ATOM 0 HA THR A 36 -11.025 -4.930 -2.153 1.00 54.24 H new ATOM 0 HB THR A 36 -8.577 -5.596 -1.601 1.00 43.32 H new ATOM 0 HG1 THR A 36 -9.460 -7.911 -1.191 1.00 10.44 H new ATOM 0 HG21 THR A 36 -8.894 -4.956 0.770 1.00 65.20 H new ATOM 0 HG22 THR A 36 -9.870 -3.950 -0.327 1.00 65.20 H new ATOM 0 HG23 THR A 36 -10.641 -5.255 0.606 1.00 65.20 H new ATOM 579 N ALA A 37 -10.666 -5.777 -4.477 1.00 53.30 N ATOM 580 CA ALA A 37 -10.263 -6.104 -5.835 1.00 33.30 C ATOM 581 C ALA A 37 -10.281 -4.870 -6.723 1.00 32.20 C ATOM 582 O ALA A 37 -11.245 -4.102 -6.723 1.00 5.04 O ATOM 583 CB ALA A 37 -11.153 -7.191 -6.420 1.00 33.44 C ATOM 0 H ALA A 37 -11.374 -5.046 -4.411 1.00 53.30 H new ATOM 0 HA ALA A 37 -9.241 -6.481 -5.795 1.00 33.30 H new ATOM 0 HB1 ALA A 37 -10.831 -7.417 -7.436 1.00 33.44 H new ATOM 0 HB2 ALA A 37 -11.080 -8.090 -5.808 1.00 33.44 H new ATOM 0 HB3 ALA A 37 -12.187 -6.846 -6.436 1.00 33.44 H new ATOM 589 N ILE A 38 -9.207 -4.682 -7.468 1.00 35.14 N ATOM 590 CA ILE A 38 -9.104 -3.570 -8.400 1.00 15.13 C ATOM 591 C ILE A 38 -9.887 -3.883 -9.670 1.00 51.22 C ATOM 592 O ILE A 38 -9.699 -4.939 -10.280 1.00 63.13 O ATOM 593 CB ILE A 38 -7.629 -3.270 -8.756 1.00 12.21 C ATOM 594 CG1 ILE A 38 -6.827 -2.990 -7.481 1.00 4.01 C ATOM 595 CG2 ILE A 38 -7.539 -2.088 -9.714 1.00 45.24 C ATOM 596 CD1 ILE A 38 -5.341 -2.809 -7.715 1.00 44.25 C ATOM 0 H ILE A 38 -8.387 -5.289 -7.446 1.00 35.14 H new ATOM 0 HA ILE A 38 -9.524 -2.687 -7.919 1.00 15.13 H new ATOM 0 HB ILE A 38 -7.205 -4.143 -9.252 1.00 12.21 H new ATOM 0 HG12 ILE A 38 -7.222 -2.092 -7.006 1.00 4.01 H new ATOM 0 HG13 ILE A 38 -6.977 -3.813 -6.782 1.00 4.01 H new ATOM 0 HG21 ILE A 38 -6.494 -1.892 -9.953 1.00 45.24 H new ATOM 0 HG22 ILE A 38 -8.083 -2.319 -10.630 1.00 45.24 H new ATOM 0 HG23 ILE A 38 -7.976 -1.206 -9.246 1.00 45.24 H new ATOM 0 HD11 ILE A 38 -4.844 -2.615 -6.765 1.00 44.25 H new ATOM 0 HD12 ILE A 38 -4.930 -3.715 -8.161 1.00 44.25 H new ATOM 0 HD13 ILE A 38 -5.179 -1.967 -8.388 1.00 44.25 H new ATOM 608 N VAL A 39 -10.774 -2.977 -10.058 1.00 2.41 N ATOM 609 CA VAL A 39 -11.620 -3.194 -11.221 1.00 13.41 C ATOM 610 C VAL A 39 -11.869 -1.875 -11.962 1.00 2.53 C ATOM 611 O VAL A 39 -11.626 -0.793 -11.419 1.00 35.32 O ATOM 612 CB VAL A 39 -12.964 -3.855 -10.810 1.00 53.54 C ATOM 613 CG1 VAL A 39 -13.841 -2.888 -10.029 1.00 65.21 C ATOM 614 CG2 VAL A 39 -13.704 -4.416 -12.019 1.00 64.03 C ATOM 0 H VAL A 39 -10.926 -2.086 -9.585 1.00 2.41 H new ATOM 0 HA VAL A 39 -11.101 -3.873 -11.897 1.00 13.41 H new ATOM 0 HB VAL A 39 -12.727 -4.692 -10.153 1.00 53.54 H new ATOM 0 HG11 VAL A 39 -14.774 -3.382 -9.757 1.00 65.21 H new ATOM 0 HG12 VAL A 39 -13.320 -2.573 -9.125 1.00 65.21 H new ATOM 0 HG13 VAL A 39 -14.059 -2.016 -10.645 1.00 65.21 H new ATOM 0 HG21 VAL A 39 -14.640 -4.871 -11.694 1.00 64.03 H new ATOM 0 HG22 VAL A 39 -13.917 -3.610 -12.721 1.00 64.03 H new ATOM 0 HG23 VAL A 39 -13.085 -5.169 -12.507 1.00 64.03 H new ATOM 624 N VAL A 40 -12.336 -1.981 -13.203 1.00 61.45 N ATOM 625 CA VAL A 40 -12.579 -0.825 -14.060 1.00 42.12 C ATOM 626 C VAL A 40 -13.640 0.100 -13.472 1.00 74.44 C ATOM 627 O VAL A 40 -14.674 -0.355 -12.981 1.00 54.01 O ATOM 628 CB VAL A 40 -13.048 -1.275 -15.463 1.00 52.12 C ATOM 629 CG1 VAL A 40 -13.249 -0.084 -16.389 1.00 73.12 C ATOM 630 CG2 VAL A 40 -12.069 -2.267 -16.067 1.00 65.40 C ATOM 0 H VAL A 40 -12.557 -2.874 -13.644 1.00 61.45 H new ATOM 0 HA VAL A 40 -11.635 -0.284 -14.134 1.00 42.12 H new ATOM 0 HB VAL A 40 -14.011 -1.772 -15.346 1.00 52.12 H new ATOM 0 HG11 VAL A 40 -13.579 -0.435 -17.367 1.00 73.12 H new ATOM 0 HG12 VAL A 40 -14.004 0.580 -15.969 1.00 73.12 H new ATOM 0 HG13 VAL A 40 -12.309 0.457 -16.496 1.00 73.12 H new ATOM 0 HG21 VAL A 40 -12.420 -2.569 -17.054 1.00 65.40 H new ATOM 0 HG22 VAL A 40 -11.088 -1.801 -16.158 1.00 65.40 H new ATOM 0 HG23 VAL A 40 -11.996 -3.144 -15.424 1.00 65.40 H new ATOM 640 N GLU A 41 -13.373 1.395 -13.516 1.00 44.43 N ATOM 641 CA GLU A 41 -14.365 2.389 -13.144 1.00 51.02 C ATOM 642 C GLU A 41 -14.897 3.073 -14.400 1.00 52.33 C ATOM 643 O GLU A 41 -16.107 3.216 -14.582 1.00 74.15 O ATOM 644 CB GLU A 41 -13.766 3.427 -12.190 1.00 52.52 C ATOM 645 CG GLU A 41 -14.795 4.385 -11.604 1.00 5.33 C ATOM 646 CD GLU A 41 -15.793 3.689 -10.699 1.00 21.52 C ATOM 647 OE1 GLU A 41 -16.692 2.994 -11.217 1.00 14.42 O ATOM 648 OE2 GLU A 41 -15.681 3.823 -9.463 1.00 62.43 O ATOM 0 H GLU A 41 -12.475 1.783 -13.806 1.00 44.43 H new ATOM 0 HA GLU A 41 -15.185 1.890 -12.628 1.00 51.02 H new ATOM 0 HB2 GLU A 41 -13.259 2.909 -11.376 1.00 52.52 H new ATOM 0 HB3 GLU A 41 -13.009 4.002 -12.722 1.00 52.52 H new ATOM 0 HG2 GLU A 41 -14.281 5.164 -11.040 1.00 5.33 H new ATOM 0 HG3 GLU A 41 -15.329 4.879 -12.416 1.00 5.33 H new ATOM 655 N LYS A 42 -13.983 3.467 -15.281 1.00 21.35 N ATOM 656 CA LYS A 42 -14.356 4.152 -16.510 1.00 4.42 C ATOM 657 C LYS A 42 -13.356 3.836 -17.613 1.00 3.30 C ATOM 658 O LYS A 42 -12.154 3.910 -17.396 1.00 43.40 O ATOM 659 CB LYS A 42 -14.408 5.665 -16.279 1.00 2.01 C ATOM 660 CG LYS A 42 -15.416 6.371 -17.164 1.00 44.44 C ATOM 661 CD LYS A 42 -16.794 5.758 -16.996 1.00 62.34 C ATOM 662 CE LYS A 42 -17.862 6.538 -17.743 1.00 70.11 C ATOM 663 NZ LYS A 42 -17.539 6.688 -19.185 1.00 44.21 N ATOM 0 H LYS A 42 -12.980 3.323 -15.165 1.00 21.35 H new ATOM 0 HA LYS A 42 -15.343 3.804 -16.814 1.00 4.42 H new ATOM 0 HB2 LYS A 42 -14.653 5.858 -15.235 1.00 2.01 H new ATOM 0 HB3 LYS A 42 -13.419 6.087 -16.458 1.00 2.01 H new ATOM 0 HG2 LYS A 42 -15.450 7.431 -16.912 1.00 44.44 H new ATOM 0 HG3 LYS A 42 -15.105 6.301 -18.206 1.00 44.44 H new ATOM 0 HD2 LYS A 42 -16.779 4.729 -17.356 1.00 62.34 H new ATOM 0 HD3 LYS A 42 -17.047 5.721 -15.936 1.00 62.34 H new ATOM 0 HE2 LYS A 42 -18.821 6.031 -17.638 1.00 70.11 H new ATOM 0 HE3 LYS A 42 -17.972 7.524 -17.292 1.00 70.11 H new ATOM 0 HZ1 LYS A 42 -18.420 6.758 -19.733 1.00 44.21 H new ATOM 0 HZ2 LYS A 42 -16.974 7.550 -19.326 1.00 44.21 H new ATOM 0 HZ3 LYS A 42 -16.996 5.861 -19.507 1.00 44.21 H new ATOM 677 N VAL A 43 -13.846 3.482 -18.786 1.00 31.20 N ATOM 678 CA VAL A 43 -12.972 3.176 -19.909 1.00 34.04 C ATOM 679 C VAL A 43 -13.205 4.158 -21.059 1.00 24.24 C ATOM 680 O VAL A 43 -14.331 4.334 -21.532 1.00 42.31 O ATOM 681 CB VAL A 43 -13.155 1.714 -20.393 1.00 71.43 C ATOM 682 CG1 VAL A 43 -14.600 1.435 -20.783 1.00 32.30 C ATOM 683 CG2 VAL A 43 -12.211 1.404 -21.547 1.00 24.02 C ATOM 0 H VAL A 43 -14.842 3.399 -18.989 1.00 31.20 H new ATOM 0 HA VAL A 43 -11.944 3.283 -19.564 1.00 34.04 H new ATOM 0 HB VAL A 43 -12.905 1.055 -19.561 1.00 71.43 H new ATOM 0 HG11 VAL A 43 -14.694 0.402 -21.118 1.00 32.30 H new ATOM 0 HG12 VAL A 43 -15.247 1.597 -19.921 1.00 32.30 H new ATOM 0 HG13 VAL A 43 -14.895 2.106 -21.590 1.00 32.30 H new ATOM 0 HG21 VAL A 43 -12.357 0.373 -21.870 1.00 24.02 H new ATOM 0 HG22 VAL A 43 -12.419 2.078 -22.378 1.00 24.02 H new ATOM 0 HG23 VAL A 43 -11.180 1.539 -21.220 1.00 24.02 H new ATOM 693 N GLY A 44 -12.137 4.811 -21.487 1.00 74.11 N ATOM 694 CA GLY A 44 -12.235 5.776 -22.557 1.00 13.10 C ATOM 695 C GLY A 44 -11.906 5.163 -23.897 1.00 41.14 C ATOM 696 O GLY A 44 -11.272 4.106 -23.967 1.00 3.13 O ATOM 0 H GLY A 44 -11.198 4.688 -21.108 1.00 74.11 H new ATOM 0 HA2 GLY A 44 -13.244 6.188 -22.584 1.00 13.10 H new ATOM 0 HA3 GLY A 44 -11.557 6.606 -22.361 1.00 13.10 H new ATOM 700 N GLU A 45 -12.328 5.820 -24.960 1.00 31.42 N ATOM 701 CA GLU A 45 -12.138 5.292 -26.297 1.00 71.01 C ATOM 702 C GLU A 45 -10.737 5.581 -26.819 1.00 64.35 C ATOM 703 O GLU A 45 -10.031 6.439 -26.297 1.00 4.24 O ATOM 704 CB GLU A 45 -13.190 5.857 -27.253 1.00 61.22 C ATOM 705 CG GLU A 45 -14.103 4.785 -27.821 1.00 20.32 C ATOM 706 CD GLU A 45 -13.326 3.707 -28.545 1.00 64.11 C ATOM 707 OE1 GLU A 45 -12.658 2.893 -27.870 1.00 5.51 O ATOM 708 OE2 GLU A 45 -13.357 3.678 -29.788 1.00 21.25 O ATOM 0 H GLU A 45 -12.805 6.721 -24.924 1.00 31.42 H new ATOM 0 HA GLU A 45 -12.257 4.210 -26.243 1.00 71.01 H new ATOM 0 HB2 GLU A 45 -13.791 6.599 -26.727 1.00 61.22 H new ATOM 0 HB3 GLU A 45 -12.690 6.374 -28.072 1.00 61.22 H new ATOM 0 HG2 GLU A 45 -14.681 4.336 -27.014 1.00 20.32 H new ATOM 0 HG3 GLU A 45 -14.816 5.242 -28.508 1.00 20.32 H new ATOM 715 N LYS A 46 -10.351 4.850 -27.855 1.00 74.34 N ATOM 716 CA LYS A 46 -9.038 5.000 -28.475 1.00 43.40 C ATOM 717 C LYS A 46 -8.892 6.355 -29.154 1.00 73.22 C ATOM 718 O LYS A 46 -7.792 6.890 -29.262 1.00 32.04 O ATOM 719 CB LYS A 46 -8.819 3.881 -29.489 1.00 55.41 C ATOM 720 CG LYS A 46 -10.028 3.623 -30.373 1.00 12.40 C ATOM 721 CD LYS A 46 -9.823 2.410 -31.261 1.00 11.43 C ATOM 722 CE LYS A 46 -11.145 1.886 -31.796 1.00 62.13 C ATOM 723 NZ LYS A 46 -12.090 1.549 -30.697 1.00 4.33 N ATOM 0 H LYS A 46 -10.936 4.137 -28.290 1.00 74.34 H new ATOM 0 HA LYS A 46 -8.283 4.938 -27.691 1.00 43.40 H new ATOM 0 HB2 LYS A 46 -7.965 4.133 -30.118 1.00 55.41 H new ATOM 0 HB3 LYS A 46 -8.564 2.964 -28.958 1.00 55.41 H new ATOM 0 HG2 LYS A 46 -10.910 3.473 -29.750 1.00 12.40 H new ATOM 0 HG3 LYS A 46 -10.220 4.499 -30.992 1.00 12.40 H new ATOM 0 HD2 LYS A 46 -9.170 2.673 -32.093 1.00 11.43 H new ATOM 0 HD3 LYS A 46 -9.320 1.625 -30.697 1.00 11.43 H new ATOM 0 HE2 LYS A 46 -11.596 2.635 -32.447 1.00 62.13 H new ATOM 0 HE3 LYS A 46 -10.965 1.000 -32.406 1.00 62.13 H new ATOM 0 HZ1 LYS A 46 -12.633 0.700 -30.954 1.00 4.33 H new ATOM 0 HZ2 LYS A 46 -11.556 1.367 -29.823 1.00 4.33 H new ATOM 0 HZ3 LYS A 46 -12.743 2.344 -30.544 1.00 4.33 H new ATOM 737 N ASN A 47 -10.007 6.902 -29.612 1.00 41.44 N ATOM 738 CA ASN A 47 -10.002 8.201 -30.268 1.00 14.02 C ATOM 739 C ASN A 47 -10.495 9.290 -29.326 1.00 15.34 C ATOM 740 O ASN A 47 -10.780 10.409 -29.755 1.00 11.41 O ATOM 741 CB ASN A 47 -10.854 8.172 -31.539 1.00 73.45 C ATOM 742 CG ASN A 47 -10.109 7.583 -32.723 1.00 14.10 C ATOM 743 OD1 ASN A 47 -10.133 6.374 -32.953 1.00 71.32 O ATOM 744 ND2 ASN A 47 -9.443 8.436 -33.486 1.00 31.23 N ATOM 0 H ASN A 47 -10.927 6.467 -29.542 1.00 41.44 H new ATOM 0 HA ASN A 47 -8.973 8.429 -30.546 1.00 14.02 H new ATOM 0 HB2 ASN A 47 -11.756 7.589 -31.355 1.00 73.45 H new ATOM 0 HB3 ASN A 47 -11.173 9.185 -31.782 1.00 73.45 H new ATOM 0 HD21 ASN A 47 -8.926 8.098 -34.297 1.00 31.23 H new ATOM 0 HD22 ASN A 47 -9.447 9.431 -33.262 1.00 31.23 H new ATOM 751 N ALA A 48 -10.578 8.963 -28.041 1.00 51.15 N ATOM 752 CA ALA A 48 -10.988 9.930 -27.034 1.00 32.20 C ATOM 753 C ALA A 48 -9.760 10.529 -26.361 1.00 14.03 C ATOM 754 O ALA A 48 -9.109 9.878 -25.545 1.00 52.20 O ATOM 755 CB ALA A 48 -11.905 9.281 -26.007 1.00 63.12 C ATOM 0 H ALA A 48 -10.366 8.035 -27.674 1.00 51.15 H new ATOM 0 HA ALA A 48 -11.545 10.730 -27.521 1.00 32.20 H new ATOM 0 HB1 ALA A 48 -12.200 10.021 -25.263 1.00 63.12 H new ATOM 0 HB2 ALA A 48 -12.794 8.894 -26.506 1.00 63.12 H new ATOM 0 HB3 ALA A 48 -11.379 8.462 -25.516 1.00 63.12 H new ATOM 761 N PRO A 49 -9.416 11.774 -26.717 1.00 54.53 N ATOM 762 CA PRO A 49 -8.215 12.443 -26.225 1.00 51.05 C ATOM 763 C PRO A 49 -8.371 12.950 -24.792 1.00 2.51 C ATOM 764 O PRO A 49 -9.394 12.717 -24.142 1.00 72.23 O ATOM 765 CB PRO A 49 -8.024 13.615 -27.201 1.00 50.34 C ATOM 766 CG PRO A 49 -9.063 13.438 -28.263 1.00 3.53 C ATOM 767 CD PRO A 49 -10.160 12.634 -27.637 1.00 44.14 C ATOM 0 HA PRO A 49 -7.362 11.765 -26.189 1.00 51.05 H new ATOM 0 HB2 PRO A 49 -8.145 14.571 -26.692 1.00 50.34 H new ATOM 0 HB3 PRO A 49 -7.022 13.607 -27.630 1.00 50.34 H new ATOM 0 HG2 PRO A 49 -9.435 14.402 -28.610 1.00 3.53 H new ATOM 0 HG3 PRO A 49 -8.650 12.925 -29.131 1.00 3.53 H new ATOM 0 HD2 PRO A 49 -10.881 13.263 -27.115 1.00 44.14 H new ATOM 0 HD3 PRO A 49 -10.716 12.057 -28.376 1.00 44.14 H new ATOM 775 N TYR A 50 -7.361 13.672 -24.312 1.00 52.31 N ATOM 776 CA TYR A 50 -7.303 14.065 -22.909 1.00 12.33 C ATOM 777 C TYR A 50 -8.383 15.080 -22.539 1.00 63.54 C ATOM 778 O TYR A 50 -8.715 15.220 -21.367 1.00 54.13 O ATOM 779 CB TYR A 50 -5.905 14.583 -22.530 1.00 4.13 C ATOM 780 CG TYR A 50 -5.443 15.827 -23.262 1.00 34.32 C ATOM 781 CD1 TYR A 50 -4.846 15.744 -24.514 1.00 21.41 C ATOM 782 CD2 TYR A 50 -5.571 17.083 -22.681 1.00 31.04 C ATOM 783 CE1 TYR A 50 -4.390 16.876 -25.166 1.00 63.23 C ATOM 784 CE2 TYR A 50 -5.125 18.219 -23.328 1.00 45.32 C ATOM 785 CZ TYR A 50 -4.534 18.112 -24.568 1.00 22.40 C ATOM 786 OH TYR A 50 -4.068 19.243 -25.204 1.00 34.44 O ATOM 0 H TYR A 50 -6.574 13.996 -24.874 1.00 52.31 H new ATOM 0 HA TYR A 50 -7.502 13.165 -22.327 1.00 12.33 H new ATOM 0 HB2 TYR A 50 -5.892 14.788 -21.460 1.00 4.13 H new ATOM 0 HB3 TYR A 50 -5.182 13.788 -22.711 1.00 4.13 H new ATOM 0 HD1 TYR A 50 -4.736 14.779 -24.986 1.00 21.41 H new ATOM 0 HD2 TYR A 50 -6.027 17.172 -21.706 1.00 31.04 H new ATOM 0 HE1 TYR A 50 -3.924 16.793 -26.137 1.00 63.23 H new ATOM 0 HE2 TYR A 50 -5.239 19.187 -22.864 1.00 45.32 H new ATOM 0 HH TYR A 50 -4.250 20.029 -24.648 1.00 34.44 H new ATOM 796 N ALA A 51 -8.930 15.778 -23.530 1.00 2.14 N ATOM 797 CA ALA A 51 -10.020 16.723 -23.288 1.00 32.34 C ATOM 798 C ALA A 51 -11.178 16.052 -22.552 1.00 1.42 C ATOM 799 O ALA A 51 -11.659 16.551 -21.535 1.00 53.23 O ATOM 800 CB ALA A 51 -10.508 17.317 -24.599 1.00 42.42 C ATOM 0 H ALA A 51 -8.639 15.709 -24.505 1.00 2.14 H new ATOM 0 HA ALA A 51 -9.634 17.524 -22.658 1.00 32.34 H new ATOM 0 HB1 ALA A 51 -11.319 18.018 -24.401 1.00 42.42 H new ATOM 0 HB2 ALA A 51 -9.687 17.841 -25.089 1.00 42.42 H new ATOM 0 HB3 ALA A 51 -10.868 16.519 -25.248 1.00 42.42 H new ATOM 806 N GLU A 52 -11.607 14.902 -23.057 1.00 40.14 N ATOM 807 CA GLU A 52 -12.705 14.169 -22.445 1.00 3.04 C ATOM 808 C GLU A 52 -12.210 13.331 -21.271 1.00 22.03 C ATOM 809 O GLU A 52 -12.985 12.963 -20.389 1.00 53.42 O ATOM 810 CB GLU A 52 -13.410 13.302 -23.486 1.00 24.30 C ATOM 811 CG GLU A 52 -14.166 14.126 -24.516 1.00 3.35 C ATOM 812 CD GLU A 52 -14.830 13.287 -25.583 1.00 74.01 C ATOM 813 OE1 GLU A 52 -15.825 12.597 -25.272 1.00 61.34 O ATOM 814 OE2 GLU A 52 -14.365 13.322 -26.742 1.00 72.51 O ATOM 0 H GLU A 52 -11.212 14.459 -23.886 1.00 40.14 H new ATOM 0 HA GLU A 52 -13.427 14.887 -22.056 1.00 3.04 H new ATOM 0 HB2 GLU A 52 -12.674 12.679 -23.994 1.00 24.30 H new ATOM 0 HB3 GLU A 52 -14.105 12.629 -22.983 1.00 24.30 H new ATOM 0 HG2 GLU A 52 -14.924 14.722 -24.008 1.00 3.35 H new ATOM 0 HG3 GLU A 52 -13.476 14.824 -24.990 1.00 3.35 H new ATOM 821 N PHE A 53 -10.914 13.036 -21.262 1.00 20.15 N ATOM 822 CA PHE A 53 -10.285 12.406 -20.107 1.00 65.10 C ATOM 823 C PHE A 53 -10.403 13.325 -18.895 1.00 44.11 C ATOM 824 O PHE A 53 -10.665 12.868 -17.782 1.00 35.35 O ATOM 825 CB PHE A 53 -8.811 12.089 -20.401 1.00 24.30 C ATOM 826 CG PHE A 53 -8.023 11.655 -19.194 1.00 42.33 C ATOM 827 CD1 PHE A 53 -8.208 10.399 -18.640 1.00 21.23 C ATOM 828 CD2 PHE A 53 -7.097 12.508 -18.612 1.00 14.41 C ATOM 829 CE1 PHE A 53 -7.486 10.000 -17.531 1.00 51.22 C ATOM 830 CE2 PHE A 53 -6.373 12.115 -17.503 1.00 20.30 C ATOM 831 CZ PHE A 53 -6.567 10.860 -16.962 1.00 34.33 C ATOM 0 H PHE A 53 -10.280 13.223 -22.039 1.00 20.15 H new ATOM 0 HA PHE A 53 -10.796 11.467 -19.893 1.00 65.10 H new ATOM 0 HB2 PHE A 53 -8.763 11.303 -21.155 1.00 24.30 H new ATOM 0 HB3 PHE A 53 -8.339 12.973 -20.831 1.00 24.30 H new ATOM 0 HD1 PHE A 53 -8.926 9.723 -19.080 1.00 21.23 H new ATOM 0 HD2 PHE A 53 -6.940 13.491 -19.031 1.00 14.41 H new ATOM 0 HE1 PHE A 53 -7.640 9.017 -17.110 1.00 51.22 H new ATOM 0 HE2 PHE A 53 -5.655 12.789 -17.059 1.00 20.30 H new ATOM 0 HZ PHE A 53 -6.001 10.551 -16.095 1.00 34.33 H new ATOM 841 N VAL A 54 -10.221 14.624 -19.127 1.00 54.03 N ATOM 842 CA VAL A 54 -10.398 15.620 -18.080 1.00 12.43 C ATOM 843 C VAL A 54 -11.819 15.558 -17.537 1.00 12.44 C ATOM 844 O VAL A 54 -12.015 15.498 -16.331 1.00 65.12 O ATOM 845 CB VAL A 54 -10.097 17.054 -18.581 1.00 22.24 C ATOM 846 CG1 VAL A 54 -10.410 18.084 -17.504 1.00 30.21 C ATOM 847 CG2 VAL A 54 -8.645 17.174 -19.020 1.00 43.51 C ATOM 0 H VAL A 54 -9.951 15.008 -20.032 1.00 54.03 H new ATOM 0 HA VAL A 54 -9.686 15.388 -17.288 1.00 12.43 H new ATOM 0 HB VAL A 54 -10.738 17.252 -19.440 1.00 22.24 H new ATOM 0 HG11 VAL A 54 -10.190 19.083 -17.881 1.00 30.21 H new ATOM 0 HG12 VAL A 54 -11.465 18.021 -17.236 1.00 30.21 H new ATOM 0 HG13 VAL A 54 -9.800 17.886 -16.623 1.00 30.21 H new ATOM 0 HG21 VAL A 54 -8.453 18.189 -19.369 1.00 43.51 H new ATOM 0 HG22 VAL A 54 -7.991 16.950 -18.178 1.00 43.51 H new ATOM 0 HG23 VAL A 54 -8.450 16.470 -19.829 1.00 43.51 H new ATOM 857 N GLU A 55 -12.798 15.540 -18.439 1.00 73.42 N ATOM 858 CA GLU A 55 -14.208 15.445 -18.057 1.00 32.13 C ATOM 859 C GLU A 55 -14.460 14.273 -17.115 1.00 32.23 C ATOM 860 O GLU A 55 -15.118 14.423 -16.086 1.00 21.54 O ATOM 861 CB GLU A 55 -15.086 15.301 -19.302 1.00 52.31 C ATOM 862 CG GLU A 55 -15.478 16.626 -19.930 1.00 41.31 C ATOM 863 CD GLU A 55 -16.395 17.433 -19.034 1.00 10.35 C ATOM 864 OE1 GLU A 55 -17.563 17.020 -18.851 1.00 51.20 O ATOM 865 OE2 GLU A 55 -15.955 18.468 -18.499 1.00 61.22 O ATOM 0 H GLU A 55 -12.641 15.590 -19.446 1.00 73.42 H new ATOM 0 HA GLU A 55 -14.466 16.364 -17.531 1.00 32.13 H new ATOM 0 HB2 GLU A 55 -14.556 14.701 -20.042 1.00 52.31 H new ATOM 0 HB3 GLU A 55 -15.990 14.753 -19.036 1.00 52.31 H new ATOM 0 HG2 GLU A 55 -14.580 17.205 -20.144 1.00 41.31 H new ATOM 0 HG3 GLU A 55 -15.973 16.442 -20.883 1.00 41.31 H new ATOM 872 N GLU A 56 -13.925 13.113 -17.467 1.00 15.03 N ATOM 873 CA GLU A 56 -14.103 11.911 -16.665 1.00 42.34 C ATOM 874 C GLU A 56 -13.358 12.025 -15.333 1.00 23.01 C ATOM 875 O GLU A 56 -13.781 11.467 -14.322 1.00 55.14 O ATOM 876 CB GLU A 56 -13.607 10.684 -17.438 1.00 13.10 C ATOM 877 CG GLU A 56 -14.279 10.493 -18.794 1.00 45.53 C ATOM 878 CD GLU A 56 -15.707 9.990 -18.695 1.00 23.35 C ATOM 879 OE1 GLU A 56 -16.588 10.743 -18.229 1.00 25.24 O ATOM 880 OE2 GLU A 56 -15.961 8.840 -19.105 1.00 45.21 O ATOM 0 H GLU A 56 -13.362 12.978 -18.307 1.00 15.03 H new ATOM 0 HA GLU A 56 -15.166 11.798 -16.454 1.00 42.34 H new ATOM 0 HB2 GLU A 56 -12.531 10.771 -17.586 1.00 13.10 H new ATOM 0 HB3 GLU A 56 -13.774 9.793 -16.832 1.00 13.10 H new ATOM 0 HG2 GLU A 56 -14.272 11.442 -19.331 1.00 45.53 H new ATOM 0 HG3 GLU A 56 -13.694 9.788 -19.385 1.00 45.53 H new ATOM 887 N MET A 57 -12.256 12.762 -15.338 1.00 42.33 N ATOM 888 CA MET A 57 -11.389 12.861 -14.168 1.00 70.05 C ATOM 889 C MET A 57 -11.829 13.959 -13.192 1.00 4.30 C ATOM 890 O MET A 57 -11.931 13.716 -11.992 1.00 33.01 O ATOM 891 CB MET A 57 -9.942 13.100 -14.611 1.00 2.03 C ATOM 892 CG MET A 57 -8.947 13.199 -13.465 1.00 31.13 C ATOM 893 SD MET A 57 -8.912 11.717 -12.437 1.00 63.15 S ATOM 894 CE MET A 57 -8.446 10.471 -13.640 1.00 31.53 C ATOM 0 H MET A 57 -11.939 13.303 -16.142 1.00 42.33 H new ATOM 0 HA MET A 57 -11.464 11.914 -13.633 1.00 70.05 H new ATOM 0 HB2 MET A 57 -9.638 12.289 -15.272 1.00 2.03 H new ATOM 0 HB3 MET A 57 -9.900 14.020 -15.194 1.00 2.03 H new ATOM 0 HG2 MET A 57 -7.951 13.378 -13.870 1.00 31.13 H new ATOM 0 HG3 MET A 57 -9.199 14.059 -12.845 1.00 31.13 H new ATOM 0 HE1 MET A 57 -8.126 9.567 -13.122 1.00 31.53 H new ATOM 0 HE2 MET A 57 -9.301 10.242 -14.276 1.00 31.53 H new ATOM 0 HE3 MET A 57 -7.627 10.846 -14.254 1.00 31.53 H new ATOM 904 N LYS A 58 -12.091 15.158 -13.706 1.00 1.25 N ATOM 905 CA LYS A 58 -12.331 16.330 -12.855 1.00 51.44 C ATOM 906 C LYS A 58 -13.581 16.176 -11.987 1.00 13.22 C ATOM 907 O LYS A 58 -13.674 16.773 -10.915 1.00 12.31 O ATOM 908 CB LYS A 58 -12.397 17.620 -13.696 1.00 13.32 C ATOM 909 CG LYS A 58 -13.432 17.614 -14.818 1.00 13.21 C ATOM 910 CD LYS A 58 -14.824 17.976 -14.327 1.00 51.34 C ATOM 911 CE LYS A 58 -15.839 17.921 -15.455 1.00 73.04 C ATOM 912 NZ LYS A 58 -17.189 18.344 -15.008 1.00 22.53 N ATOM 0 H LYS A 58 -12.143 15.348 -14.707 1.00 1.25 H new ATOM 0 HA LYS A 58 -11.482 16.406 -12.175 1.00 51.44 H new ATOM 0 HB2 LYS A 58 -12.611 18.457 -13.031 1.00 13.32 H new ATOM 0 HB3 LYS A 58 -11.414 17.801 -14.131 1.00 13.32 H new ATOM 0 HG2 LYS A 58 -13.128 18.319 -15.592 1.00 13.21 H new ATOM 0 HG3 LYS A 58 -13.458 16.627 -15.279 1.00 13.21 H new ATOM 0 HD2 LYS A 58 -15.122 17.291 -13.533 1.00 51.34 H new ATOM 0 HD3 LYS A 58 -14.811 18.977 -13.895 1.00 51.34 H new ATOM 0 HE2 LYS A 58 -15.509 18.564 -16.271 1.00 73.04 H new ATOM 0 HE3 LYS A 58 -15.889 16.906 -15.849 1.00 73.04 H new ATOM 0 HZ1 LYS A 58 -17.852 18.292 -15.808 1.00 22.53 H new ATOM 0 HZ2 LYS A 58 -17.515 17.715 -14.246 1.00 22.53 H new ATOM 0 HZ3 LYS A 58 -17.148 19.322 -14.656 1.00 22.53 H new ATOM 926 N LYS A 59 -14.532 15.367 -12.437 1.00 31.52 N ATOM 927 CA LYS A 59 -15.738 15.110 -11.654 1.00 65.35 C ATOM 928 C LYS A 59 -15.422 14.218 -10.458 1.00 45.14 C ATOM 929 O LYS A 59 -16.181 14.156 -9.493 1.00 13.34 O ATOM 930 CB LYS A 59 -16.838 14.494 -12.522 1.00 72.14 C ATOM 931 CG LYS A 59 -16.420 13.245 -13.276 1.00 14.10 C ATOM 932 CD LYS A 59 -17.537 12.763 -14.187 1.00 5.23 C ATOM 933 CE LYS A 59 -17.066 11.654 -15.105 1.00 33.43 C ATOM 934 NZ LYS A 59 -18.116 11.249 -16.073 1.00 42.12 N ATOM 0 H LYS A 59 -14.494 14.880 -13.333 1.00 31.52 H new ATOM 0 HA LYS A 59 -16.108 16.064 -11.279 1.00 65.35 H new ATOM 0 HB2 LYS A 59 -17.691 14.252 -11.888 1.00 72.14 H new ATOM 0 HB3 LYS A 59 -17.177 15.240 -13.240 1.00 72.14 H new ATOM 0 HG2 LYS A 59 -15.528 13.453 -13.867 1.00 14.10 H new ATOM 0 HG3 LYS A 59 -16.157 12.459 -12.568 1.00 14.10 H new ATOM 0 HD2 LYS A 59 -18.372 12.407 -13.583 1.00 5.23 H new ATOM 0 HD3 LYS A 59 -17.907 13.597 -14.783 1.00 5.23 H new ATOM 0 HE2 LYS A 59 -16.181 11.985 -15.648 1.00 33.43 H new ATOM 0 HE3 LYS A 59 -16.770 10.791 -14.509 1.00 33.43 H new ATOM 0 HZ1 LYS A 59 -17.669 10.927 -16.955 1.00 42.12 H new ATOM 0 HZ2 LYS A 59 -18.681 10.475 -15.669 1.00 42.12 H new ATOM 0 HZ3 LYS A 59 -18.734 12.061 -16.274 1.00 42.12 H new ATOM 948 N LEU A 60 -14.312 13.503 -10.546 1.00 55.54 N ATOM 949 CA LEU A 60 -13.826 12.700 -9.435 1.00 52.24 C ATOM 950 C LEU A 60 -12.978 13.554 -8.494 1.00 75.24 C ATOM 951 O LEU A 60 -13.112 13.470 -7.276 1.00 40.35 O ATOM 952 CB LEU A 60 -12.999 11.519 -9.953 1.00 41.12 C ATOM 953 CG LEU A 60 -13.735 10.572 -10.903 1.00 34.52 C ATOM 954 CD1 LEU A 60 -12.801 9.485 -11.404 1.00 10.11 C ATOM 955 CD2 LEU A 60 -14.943 9.959 -10.217 1.00 41.20 C ATOM 0 H LEU A 60 -13.727 13.462 -11.381 1.00 55.54 H new ATOM 0 HA LEU A 60 -14.686 12.316 -8.886 1.00 52.24 H new ATOM 0 HB2 LEU A 60 -12.119 11.909 -10.465 1.00 41.12 H new ATOM 0 HB3 LEU A 60 -12.642 10.944 -9.098 1.00 41.12 H new ATOM 0 HG LEU A 60 -14.082 11.150 -11.760 1.00 34.52 H new ATOM 0 HD11 LEU A 60 -13.343 8.822 -12.078 1.00 10.11 H new ATOM 0 HD12 LEU A 60 -11.966 9.940 -11.936 1.00 10.11 H new ATOM 0 HD13 LEU A 60 -12.423 8.912 -10.558 1.00 10.11 H new ATOM 0 HD21 LEU A 60 -15.453 9.289 -10.909 1.00 41.20 H new ATOM 0 HD22 LEU A 60 -14.618 9.398 -9.341 1.00 41.20 H new ATOM 0 HD23 LEU A 60 -15.626 10.750 -9.908 1.00 41.20 H new ATOM 967 N VAL A 61 -12.126 14.397 -9.081 1.00 53.12 N ATOM 968 CA VAL A 61 -11.150 15.190 -8.323 1.00 3.13 C ATOM 969 C VAL A 61 -11.826 16.237 -7.430 1.00 32.42 C ATOM 970 O VAL A 61 -11.230 16.728 -6.470 1.00 15.14 O ATOM 971 CB VAL A 61 -10.153 15.907 -9.265 1.00 20.43 C ATOM 972 CG1 VAL A 61 -9.009 16.529 -8.479 1.00 54.52 C ATOM 973 CG2 VAL A 61 -9.615 14.953 -10.318 1.00 45.32 C ATOM 0 H VAL A 61 -12.091 14.550 -10.089 1.00 53.12 H new ATOM 0 HA VAL A 61 -10.612 14.484 -7.691 1.00 3.13 H new ATOM 0 HB VAL A 61 -10.694 16.706 -9.771 1.00 20.43 H new ATOM 0 HG11 VAL A 61 -8.324 17.026 -9.166 1.00 54.52 H new ATOM 0 HG12 VAL A 61 -9.407 17.258 -7.773 1.00 54.52 H new ATOM 0 HG13 VAL A 61 -8.476 15.750 -7.935 1.00 54.52 H new ATOM 0 HG21 VAL A 61 -8.917 15.483 -10.966 1.00 45.32 H new ATOM 0 HG22 VAL A 61 -9.100 14.125 -9.830 1.00 45.32 H new ATOM 0 HG23 VAL A 61 -10.441 14.566 -10.914 1.00 45.32 H new ATOM 983 N GLU A 62 -13.068 16.582 -7.744 1.00 61.23 N ATOM 984 CA GLU A 62 -13.796 17.583 -6.970 1.00 5.45 C ATOM 985 C GLU A 62 -14.034 17.117 -5.530 1.00 21.22 C ATOM 986 O GLU A 62 -14.411 17.915 -4.665 1.00 52.51 O ATOM 987 CB GLU A 62 -15.124 17.935 -7.643 1.00 13.20 C ATOM 988 CG GLU A 62 -16.052 16.749 -7.839 1.00 65.20 C ATOM 989 CD GLU A 62 -17.402 17.155 -8.389 1.00 70.42 C ATOM 990 OE1 GLU A 62 -17.528 17.334 -9.622 1.00 62.22 O ATOM 991 OE2 GLU A 62 -18.351 17.294 -7.590 1.00 34.23 O ATOM 0 H GLU A 62 -13.592 16.187 -8.525 1.00 61.23 H new ATOM 0 HA GLU A 62 -13.177 18.479 -6.934 1.00 5.45 H new ATOM 0 HB2 GLU A 62 -15.635 18.688 -7.043 1.00 13.20 H new ATOM 0 HB3 GLU A 62 -14.919 18.387 -8.614 1.00 13.20 H new ATOM 0 HG2 GLU A 62 -15.586 16.035 -8.519 1.00 65.20 H new ATOM 0 HG3 GLU A 62 -16.190 16.238 -6.886 1.00 65.20 H new ATOM 998 N ASP A 63 -13.832 15.826 -5.272 1.00 45.55 N ATOM 999 CA ASP A 63 -14.016 15.286 -3.931 1.00 22.31 C ATOM 1000 C ASP A 63 -12.834 15.664 -3.039 1.00 63.15 C ATOM 1001 O ASP A 63 -12.991 15.850 -1.829 1.00 2.33 O ATOM 1002 CB ASP A 63 -14.185 13.764 -3.985 1.00 42.21 C ATOM 1003 CG ASP A 63 -14.529 13.160 -2.634 1.00 45.45 C ATOM 1004 OD1 ASP A 63 -15.570 13.536 -2.053 1.00 70.51 O ATOM 1005 OD2 ASP A 63 -13.781 12.281 -2.161 1.00 64.25 O ATOM 0 H ASP A 63 -13.543 15.141 -5.970 1.00 45.55 H new ATOM 0 HA ASP A 63 -14.922 15.717 -3.504 1.00 22.31 H new ATOM 0 HB2 ASP A 63 -14.970 13.516 -4.699 1.00 42.21 H new ATOM 0 HB3 ASP A 63 -13.264 13.314 -4.355 1.00 42.21 H new ATOM 1010 N GLY A 64 -11.658 15.790 -3.646 1.00 64.31 N ATOM 1011 CA GLY A 64 -10.486 16.279 -2.938 1.00 3.05 C ATOM 1012 C GLY A 64 -9.766 15.199 -2.153 1.00 53.10 C ATOM 1013 O GLY A 64 -8.555 15.271 -1.945 1.00 73.32 O ATOM 0 H GLY A 64 -11.494 15.560 -4.626 1.00 64.31 H new ATOM 0 HA2 GLY A 64 -9.794 16.719 -3.656 1.00 3.05 H new ATOM 0 HA3 GLY A 64 -10.787 17.074 -2.256 1.00 3.05 H new ATOM 1017 N LYS A 65 -10.515 14.214 -1.692 1.00 11.13 N ATOM 1018 CA LYS A 65 -9.967 13.146 -0.873 1.00 51.22 C ATOM 1019 C LYS A 65 -10.132 11.793 -1.561 1.00 11.11 C ATOM 1020 O LYS A 65 -10.048 10.742 -0.922 1.00 50.21 O ATOM 1021 CB LYS A 65 -10.654 13.160 0.499 1.00 51.32 C ATOM 1022 CG LYS A 65 -12.169 13.289 0.417 1.00 25.13 C ATOM 1023 CD LYS A 65 -12.776 13.706 1.747 1.00 72.42 C ATOM 1024 CE LYS A 65 -14.269 13.959 1.612 1.00 53.31 C ATOM 1025 NZ LYS A 65 -14.853 14.540 2.850 1.00 33.31 N ATOM 0 H LYS A 65 -11.515 14.131 -1.873 1.00 11.13 H new ATOM 0 HA LYS A 65 -8.898 13.309 -0.735 1.00 51.22 H new ATOM 0 HB2 LYS A 65 -10.403 12.243 1.032 1.00 51.32 H new ATOM 0 HB3 LYS A 65 -10.258 13.988 1.087 1.00 51.32 H new ATOM 0 HG2 LYS A 65 -12.430 14.022 -0.347 1.00 25.13 H new ATOM 0 HG3 LYS A 65 -12.598 12.337 0.105 1.00 25.13 H new ATOM 0 HD2 LYS A 65 -12.602 12.928 2.490 1.00 72.42 H new ATOM 0 HD3 LYS A 65 -12.282 14.608 2.109 1.00 72.42 H new ATOM 0 HE2 LYS A 65 -14.447 14.635 0.776 1.00 53.31 H new ATOM 0 HE3 LYS A 65 -14.775 13.022 1.378 1.00 53.31 H new ATOM 0 HZ1 LYS A 65 -15.872 14.696 2.713 1.00 33.31 H new ATOM 0 HZ2 LYS A 65 -14.707 13.884 3.644 1.00 33.31 H new ATOM 0 HZ3 LYS A 65 -14.389 15.447 3.060 1.00 33.31 H new ATOM 1039 N GLU A 66 -10.346 11.824 -2.869 1.00 54.00 N ATOM 1040 CA GLU A 66 -10.583 10.606 -3.630 1.00 11.20 C ATOM 1041 C GLU A 66 -9.267 9.928 -4.014 1.00 62.51 C ATOM 1042 O GLU A 66 -8.184 10.485 -3.833 1.00 71.54 O ATOM 1043 CB GLU A 66 -11.416 10.905 -4.886 1.00 33.03 C ATOM 1044 CG GLU A 66 -10.648 11.546 -6.037 1.00 32.41 C ATOM 1045 CD GLU A 66 -9.984 12.856 -5.668 1.00 34.34 C ATOM 1046 OE1 GLU A 66 -10.688 13.763 -5.189 1.00 11.23 O ATOM 1047 OE2 GLU A 66 -8.753 12.972 -5.857 1.00 35.43 O ATOM 0 H GLU A 66 -10.360 12.679 -3.425 1.00 54.00 H new ATOM 0 HA GLU A 66 -11.144 9.921 -2.994 1.00 11.20 H new ATOM 0 HB2 GLU A 66 -11.858 9.974 -5.239 1.00 33.03 H new ATOM 0 HB3 GLU A 66 -12.239 11.563 -4.608 1.00 33.03 H new ATOM 0 HG2 GLU A 66 -9.887 10.849 -6.388 1.00 32.41 H new ATOM 0 HG3 GLU A 66 -11.332 11.716 -6.869 1.00 32.41 H new ATOM 1054 N CYS A 67 -9.369 8.717 -4.539 1.00 43.13 N ATOM 1055 CA CYS A 67 -8.203 7.972 -4.976 1.00 24.22 C ATOM 1056 C CYS A 67 -8.590 7.059 -6.127 1.00 74.14 C ATOM 1057 O CYS A 67 -9.603 6.363 -6.057 1.00 54.32 O ATOM 1058 CB CYS A 67 -7.623 7.158 -3.816 1.00 10.42 C ATOM 1059 SG CYS A 67 -6.070 6.319 -4.199 1.00 33.43 S ATOM 0 H CYS A 67 -10.254 8.228 -4.673 1.00 43.13 H new ATOM 0 HA CYS A 67 -7.437 8.670 -5.315 1.00 24.22 H new ATOM 0 HB2 CYS A 67 -7.464 7.822 -2.966 1.00 10.42 H new ATOM 0 HB3 CYS A 67 -8.357 6.414 -3.507 1.00 10.42 H new ATOM 0 HG CYS A 67 -5.112 6.832 -3.485 1.00 33.43 H new ATOM 1065 N ARG A 68 -7.799 7.078 -7.191 1.00 62.32 N ATOM 1066 CA ARG A 68 -8.102 6.299 -8.386 1.00 5.02 C ATOM 1067 C ARG A 68 -6.861 6.102 -9.244 1.00 15.14 C ATOM 1068 O ARG A 68 -5.956 6.937 -9.253 1.00 22.31 O ATOM 1069 CB ARG A 68 -9.238 6.935 -9.215 1.00 34.24 C ATOM 1070 CG ARG A 68 -9.342 8.454 -9.128 1.00 44.32 C ATOM 1071 CD ARG A 68 -8.108 9.159 -9.668 1.00 75.51 C ATOM 1072 NE ARG A 68 -8.246 10.614 -9.594 1.00 2.15 N ATOM 1073 CZ ARG A 68 -8.093 11.323 -8.473 1.00 21.11 C ATOM 1074 NH1 ARG A 68 -7.701 10.733 -7.351 1.00 53.03 N ATOM 1075 NH2 ARG A 68 -8.303 12.630 -8.475 1.00 35.05 N ATOM 0 H ARG A 68 -6.940 7.625 -7.252 1.00 62.32 H new ATOM 0 HA ARG A 68 -8.446 5.321 -8.049 1.00 5.02 H new ATOM 0 HB2 ARG A 68 -9.101 6.657 -10.260 1.00 34.24 H new ATOM 0 HB3 ARG A 68 -10.186 6.504 -8.892 1.00 34.24 H new ATOM 0 HG2 ARG A 68 -10.218 8.786 -9.685 1.00 44.32 H new ATOM 0 HG3 ARG A 68 -9.496 8.745 -8.089 1.00 44.32 H new ATOM 0 HD2 ARG A 68 -7.232 8.846 -9.100 1.00 75.51 H new ATOM 0 HD3 ARG A 68 -7.941 8.861 -10.703 1.00 75.51 H new ATOM 0 HE ARG A 68 -8.473 11.117 -10.452 1.00 2.15 H new ATOM 0 HH11 ARG A 68 -7.514 9.730 -7.340 1.00 53.03 H new ATOM 0 HH12 ARG A 68 -7.587 11.282 -6.499 1.00 53.03 H new ATOM 0 HH21 ARG A 68 -8.583 13.100 -9.336 1.00 35.05 H new ATOM 0 HH22 ARG A 68 -8.185 13.167 -7.616 1.00 35.05 H new ATOM 1089 N TYR A 69 -6.821 4.984 -9.942 1.00 15.23 N ATOM 1090 CA TYR A 69 -5.693 4.643 -10.786 1.00 33.32 C ATOM 1091 C TYR A 69 -6.064 4.863 -12.246 1.00 52.15 C ATOM 1092 O TYR A 69 -7.236 4.771 -12.605 1.00 51.40 O ATOM 1093 CB TYR A 69 -5.307 3.179 -10.578 1.00 13.23 C ATOM 1094 CG TYR A 69 -5.235 2.750 -9.129 1.00 33.14 C ATOM 1095 CD1 TYR A 69 -4.182 3.144 -8.313 1.00 74.24 C ATOM 1096 CD2 TYR A 69 -6.225 1.943 -8.580 1.00 21.12 C ATOM 1097 CE1 TYR A 69 -4.118 2.746 -6.991 1.00 24.50 C ATOM 1098 CE2 TYR A 69 -6.167 1.541 -7.261 1.00 74.54 C ATOM 1099 CZ TYR A 69 -5.112 1.945 -6.471 1.00 1.31 C ATOM 1100 OH TYR A 69 -5.052 1.545 -5.156 1.00 21.25 O ATOM 0 H TYR A 69 -7.567 4.288 -9.940 1.00 15.23 H new ATOM 0 HA TYR A 69 -4.848 5.278 -10.522 1.00 33.32 H new ATOM 0 HB2 TYR A 69 -6.030 2.549 -11.095 1.00 13.23 H new ATOM 0 HB3 TYR A 69 -4.338 3.002 -11.045 1.00 13.23 H new ATOM 0 HD1 TYR A 69 -3.401 3.771 -8.718 1.00 74.24 H new ATOM 0 HD2 TYR A 69 -7.053 1.625 -9.196 1.00 21.12 H new ATOM 0 HE1 TYR A 69 -3.293 3.061 -6.369 1.00 24.50 H new ATOM 0 HE2 TYR A 69 -6.944 0.913 -6.850 1.00 74.54 H new ATOM 0 HH TYR A 69 -4.368 0.851 -5.056 1.00 21.25 H new ATOM 1110 N ALA A 70 -5.086 5.154 -13.085 1.00 40.53 N ATOM 1111 CA ALA A 70 -5.347 5.330 -14.506 1.00 20.54 C ATOM 1112 C ALA A 70 -4.262 4.681 -15.350 1.00 40.50 C ATOM 1113 O ALA A 70 -3.073 4.833 -15.075 1.00 12.21 O ATOM 1114 CB ALA A 70 -5.473 6.807 -14.849 1.00 45.21 C ATOM 0 H ALA A 70 -4.110 5.273 -12.812 1.00 40.53 H new ATOM 0 HA ALA A 70 -6.292 4.837 -14.734 1.00 20.54 H new ATOM 0 HB1 ALA A 70 -5.668 6.917 -15.916 1.00 45.21 H new ATOM 0 HB2 ALA A 70 -6.296 7.243 -14.283 1.00 45.21 H new ATOM 0 HB3 ALA A 70 -4.546 7.320 -14.595 1.00 45.21 H new ATOM 1120 N ALA A 71 -4.683 3.950 -16.367 1.00 50.22 N ATOM 1121 CA ALA A 71 -3.762 3.342 -17.311 1.00 2.22 C ATOM 1122 C ALA A 71 -4.121 3.778 -18.722 1.00 53.50 C ATOM 1123 O ALA A 71 -5.296 3.788 -19.092 1.00 42.22 O ATOM 1124 CB ALA A 71 -3.795 1.824 -17.193 1.00 31.32 C ATOM 0 H ALA A 71 -5.667 3.762 -16.561 1.00 50.22 H new ATOM 0 HA ALA A 71 -2.749 3.673 -17.083 1.00 2.22 H new ATOM 0 HB1 ALA A 71 -3.098 1.388 -17.909 1.00 31.32 H new ATOM 0 HB2 ALA A 71 -3.508 1.531 -16.183 1.00 31.32 H new ATOM 0 HB3 ALA A 71 -4.802 1.465 -17.403 1.00 31.32 H new ATOM 1130 N VAL A 72 -3.123 4.158 -19.501 1.00 41.33 N ATOM 1131 CA VAL A 72 -3.368 4.646 -20.848 1.00 42.11 C ATOM 1132 C VAL A 72 -2.265 4.213 -21.811 1.00 1.12 C ATOM 1133 O VAL A 72 -1.075 4.354 -21.516 1.00 41.43 O ATOM 1134 CB VAL A 72 -3.510 6.191 -20.868 1.00 0.52 C ATOM 1135 CG1 VAL A 72 -2.310 6.867 -20.213 1.00 52.40 C ATOM 1136 CG2 VAL A 72 -3.702 6.708 -22.289 1.00 5.43 C ATOM 0 H VAL A 72 -2.141 4.139 -19.227 1.00 41.33 H new ATOM 0 HA VAL A 72 -4.307 4.204 -21.181 1.00 42.11 H new ATOM 0 HB VAL A 72 -4.399 6.443 -20.289 1.00 0.52 H new ATOM 0 HG11 VAL A 72 -2.440 7.949 -20.243 1.00 52.40 H new ATOM 0 HG12 VAL A 72 -2.229 6.540 -19.176 1.00 52.40 H new ATOM 0 HG13 VAL A 72 -1.401 6.596 -20.751 1.00 52.40 H new ATOM 0 HG21 VAL A 72 -3.799 7.794 -22.271 1.00 5.43 H new ATOM 0 HG22 VAL A 72 -2.841 6.430 -22.897 1.00 5.43 H new ATOM 0 HG23 VAL A 72 -4.604 6.270 -22.717 1.00 5.43 H new ATOM 1146 N ASP A 73 -2.675 3.664 -22.948 1.00 34.43 N ATOM 1147 CA ASP A 73 -1.747 3.350 -24.025 1.00 12.54 C ATOM 1148 C ASP A 73 -1.739 4.491 -25.022 1.00 33.42 C ATOM 1149 O ASP A 73 -2.752 4.783 -25.664 1.00 53.42 O ATOM 1150 CB ASP A 73 -2.125 2.045 -24.727 1.00 52.42 C ATOM 1151 CG ASP A 73 -1.214 1.738 -25.905 1.00 60.33 C ATOM 1152 OD1 ASP A 73 0.000 1.533 -25.686 1.00 43.30 O ATOM 1153 OD2 ASP A 73 -1.708 1.690 -27.050 1.00 12.15 O ATOM 0 H ASP A 73 -3.647 3.427 -23.147 1.00 34.43 H new ATOM 0 HA ASP A 73 -0.753 3.220 -23.598 1.00 12.54 H new ATOM 0 HB2 ASP A 73 -2.079 1.224 -24.012 1.00 52.42 H new ATOM 0 HB3 ASP A 73 -3.156 2.108 -25.075 1.00 52.42 H new ATOM 1158 N VAL A 74 -0.610 5.158 -25.125 1.00 13.40 N ATOM 1159 CA VAL A 74 -0.496 6.310 -25.994 1.00 50.41 C ATOM 1160 C VAL A 74 0.732 6.194 -26.884 1.00 73.32 C ATOM 1161 O VAL A 74 1.834 5.893 -26.416 1.00 60.42 O ATOM 1162 CB VAL A 74 -0.447 7.628 -25.180 1.00 44.20 C ATOM 1163 CG1 VAL A 74 0.695 7.610 -24.176 1.00 35.45 C ATOM 1164 CG2 VAL A 74 -0.335 8.833 -26.104 1.00 74.33 C ATOM 0 H VAL A 74 0.243 4.923 -24.618 1.00 13.40 H new ATOM 0 HA VAL A 74 -1.384 6.335 -26.625 1.00 50.41 H new ATOM 0 HB VAL A 74 -1.381 7.711 -24.624 1.00 44.20 H new ATOM 0 HG11 VAL A 74 0.705 8.547 -23.619 1.00 35.45 H new ATOM 0 HG12 VAL A 74 0.558 6.779 -23.484 1.00 35.45 H new ATOM 0 HG13 VAL A 74 1.641 7.491 -24.704 1.00 35.45 H new ATOM 0 HG21 VAL A 74 -0.302 9.746 -25.509 1.00 74.33 H new ATOM 0 HG22 VAL A 74 0.576 8.753 -26.697 1.00 74.33 H new ATOM 0 HG23 VAL A 74 -1.199 8.864 -26.768 1.00 74.33 H new ATOM 1174 N GLU A 75 0.529 6.399 -28.172 1.00 24.03 N ATOM 1175 CA GLU A 75 1.624 6.409 -29.117 1.00 4.40 C ATOM 1176 C GLU A 75 2.219 7.806 -29.206 1.00 34.44 C ATOM 1177 O GLU A 75 1.622 8.725 -29.770 1.00 24.34 O ATOM 1178 CB GLU A 75 1.181 5.921 -30.507 1.00 22.52 C ATOM 1179 CG GLU A 75 -0.042 6.632 -31.072 1.00 31.31 C ATOM 1180 CD GLU A 75 -1.344 6.053 -30.565 1.00 13.42 C ATOM 1181 OE1 GLU A 75 -1.794 6.444 -29.468 1.00 23.41 O ATOM 1182 OE2 GLU A 75 -1.921 5.198 -31.267 1.00 51.50 O ATOM 0 H GLU A 75 -0.389 6.561 -28.587 1.00 24.03 H new ATOM 0 HA GLU A 75 2.385 5.717 -28.757 1.00 4.40 H new ATOM 0 HB2 GLU A 75 2.011 6.047 -31.203 1.00 22.52 H new ATOM 0 HB3 GLU A 75 0.970 4.853 -30.452 1.00 22.52 H new ATOM 0 HG2 GLU A 75 0.006 7.689 -30.812 1.00 31.31 H new ATOM 0 HG3 GLU A 75 -0.022 6.570 -32.160 1.00 31.31 H new ATOM 1189 N VAL A 76 3.392 7.967 -28.632 1.00 34.05 N ATOM 1190 CA VAL A 76 4.072 9.244 -28.658 1.00 24.02 C ATOM 1191 C VAL A 76 4.975 9.323 -29.878 1.00 32.43 C ATOM 1192 O VAL A 76 5.923 8.545 -30.016 1.00 32.20 O ATOM 1193 CB VAL A 76 4.899 9.475 -27.377 1.00 55.23 C ATOM 1194 CG1 VAL A 76 5.617 10.819 -27.428 1.00 1.13 C ATOM 1195 CG2 VAL A 76 4.005 9.392 -26.146 1.00 24.43 C ATOM 0 H VAL A 76 3.895 7.228 -28.141 1.00 34.05 H new ATOM 0 HA VAL A 76 3.314 10.025 -28.711 1.00 24.02 H new ATOM 0 HB VAL A 76 5.654 8.691 -27.312 1.00 55.23 H new ATOM 0 HG11 VAL A 76 6.193 10.959 -26.513 1.00 1.13 H new ATOM 0 HG12 VAL A 76 6.288 10.841 -28.287 1.00 1.13 H new ATOM 0 HG13 VAL A 76 4.884 11.620 -27.520 1.00 1.13 H new ATOM 0 HG21 VAL A 76 4.603 9.557 -25.250 1.00 24.43 H new ATOM 0 HG22 VAL A 76 3.228 10.154 -26.209 1.00 24.43 H new ATOM 0 HG23 VAL A 76 3.543 8.406 -26.097 1.00 24.43 H new ATOM 1205 N THR A 77 4.657 10.237 -30.780 1.00 34.51 N ATOM 1206 CA THR A 77 5.459 10.427 -31.970 1.00 1.14 C ATOM 1207 C THR A 77 6.599 11.408 -31.691 1.00 41.14 C ATOM 1208 O THR A 77 6.383 12.566 -31.320 1.00 21.24 O ATOM 1209 CB THR A 77 4.604 10.886 -33.178 1.00 4.10 C ATOM 1210 OG1 THR A 77 5.424 11.027 -34.342 1.00 73.14 O ATOM 1211 CG2 THR A 77 3.870 12.192 -32.896 1.00 71.42 C ATOM 0 H THR A 77 3.850 10.856 -30.708 1.00 34.51 H new ATOM 0 HA THR A 77 5.890 9.463 -32.239 1.00 1.14 H new ATOM 0 HB THR A 77 3.853 10.116 -33.354 1.00 4.10 H new ATOM 0 HG1 THR A 77 5.523 10.156 -34.780 1.00 73.14 H new ATOM 0 HG21 THR A 77 3.283 12.476 -33.770 1.00 71.42 H new ATOM 0 HG22 THR A 77 3.207 12.059 -32.041 1.00 71.42 H new ATOM 0 HG23 THR A 77 4.594 12.976 -32.675 1.00 71.42 H new ATOM 1219 N VAL A 78 7.813 10.905 -31.826 1.00 21.32 N ATOM 1220 CA VAL A 78 9.025 11.671 -31.566 1.00 15.22 C ATOM 1221 C VAL A 78 10.008 11.500 -32.710 1.00 1.31 C ATOM 1222 O VAL A 78 9.678 10.902 -33.724 1.00 35.35 O ATOM 1223 CB VAL A 78 9.717 11.224 -30.260 1.00 71.32 C ATOM 1224 CG1 VAL A 78 9.364 12.160 -29.115 1.00 2.01 C ATOM 1225 CG2 VAL A 78 9.343 9.789 -29.904 1.00 72.52 C ATOM 0 H VAL A 78 7.990 9.945 -32.122 1.00 21.32 H new ATOM 0 HA VAL A 78 8.728 12.715 -31.469 1.00 15.22 H new ATOM 0 HB VAL A 78 10.794 11.266 -30.424 1.00 71.32 H new ATOM 0 HG11 VAL A 78 9.862 11.826 -28.205 1.00 2.01 H new ATOM 0 HG12 VAL A 78 9.691 13.171 -29.358 1.00 2.01 H new ATOM 0 HG13 VAL A 78 8.285 12.155 -28.960 1.00 2.01 H new ATOM 0 HG21 VAL A 78 9.845 9.501 -28.980 1.00 72.52 H new ATOM 0 HG22 VAL A 78 8.264 9.717 -29.769 1.00 72.52 H new ATOM 0 HG23 VAL A 78 9.653 9.122 -30.708 1.00 72.52 H new ATOM 1235 N GLN A 79 11.203 12.040 -32.562 1.00 52.42 N ATOM 1236 CA GLN A 79 12.262 11.787 -33.523 1.00 64.22 C ATOM 1237 C GLN A 79 13.370 10.985 -32.854 1.00 5.52 C ATOM 1238 O GLN A 79 14.125 11.510 -32.037 1.00 65.25 O ATOM 1239 CB GLN A 79 12.808 13.101 -34.079 1.00 51.32 C ATOM 1240 CG GLN A 79 13.921 12.919 -35.097 1.00 52.31 C ATOM 1241 CD GLN A 79 14.569 14.231 -35.489 1.00 43.44 C ATOM 1242 OE1 GLN A 79 14.638 15.165 -34.690 1.00 30.21 O ATOM 1243 NE2 GLN A 79 15.037 14.315 -36.722 1.00 63.14 N ATOM 0 H GLN A 79 11.465 12.653 -31.790 1.00 52.42 H new ATOM 0 HA GLN A 79 11.859 11.213 -34.357 1.00 64.22 H new ATOM 0 HB2 GLN A 79 11.992 13.656 -34.542 1.00 51.32 H new ATOM 0 HB3 GLN A 79 13.179 13.708 -33.253 1.00 51.32 H new ATOM 0 HG2 GLN A 79 14.679 12.252 -34.687 1.00 52.31 H new ATOM 0 HG3 GLN A 79 13.519 12.436 -35.987 1.00 52.31 H new ATOM 0 HE21 GLN A 79 14.960 13.517 -37.352 1.00 63.14 H new ATOM 0 HE22 GLN A 79 15.476 15.178 -37.043 1.00 63.14 H new ATOM 1252 N ARG A 80 13.448 9.705 -33.195 1.00 51.43 N ATOM 1253 CA ARG A 80 14.411 8.795 -32.582 1.00 75.03 C ATOM 1254 C ARG A 80 15.033 7.918 -33.663 1.00 60.04 C ATOM 1255 O ARG A 80 14.846 8.173 -34.852 1.00 73.51 O ATOM 1256 CB ARG A 80 13.727 7.904 -31.531 1.00 22.04 C ATOM 1257 CG ARG A 80 12.902 8.659 -30.492 1.00 2.33 C ATOM 1258 CD ARG A 80 13.746 9.620 -29.670 1.00 63.20 C ATOM 1259 NE ARG A 80 14.736 8.931 -28.847 1.00 43.15 N ATOM 1260 CZ ARG A 80 15.779 9.536 -28.286 1.00 44.12 C ATOM 1261 NH1 ARG A 80 15.985 10.831 -28.490 1.00 52.30 N ATOM 1262 NH2 ARG A 80 16.616 8.846 -27.521 1.00 15.42 N ATOM 0 H ARG A 80 12.851 9.270 -33.898 1.00 51.43 H new ATOM 0 HA ARG A 80 15.183 9.384 -32.088 1.00 75.03 H new ATOM 0 HB2 ARG A 80 13.078 7.194 -32.044 1.00 22.04 H new ATOM 0 HB3 ARG A 80 14.491 7.322 -31.015 1.00 22.04 H new ATOM 0 HG2 ARG A 80 12.110 9.214 -30.994 1.00 2.33 H new ATOM 0 HG3 ARG A 80 12.418 7.944 -29.827 1.00 2.33 H new ATOM 0 HD2 ARG A 80 14.254 10.315 -30.338 1.00 63.20 H new ATOM 0 HD3 ARG A 80 13.094 10.213 -29.028 1.00 63.20 H new ATOM 0 HE ARG A 80 14.621 7.929 -28.694 1.00 43.15 H new ATOM 0 HH11 ARG A 80 15.343 11.363 -29.077 1.00 52.30 H new ATOM 0 HH12 ARG A 80 16.785 11.294 -28.059 1.00 52.30 H new ATOM 0 HH21 ARG A 80 16.460 7.851 -27.363 1.00 15.42 H new ATOM 0 HH22 ARG A 80 17.416 9.311 -27.091 1.00 15.42 H new ATOM 1276 N GLN A 81 15.761 6.884 -33.255 1.00 51.12 N ATOM 1277 CA GLN A 81 16.343 5.942 -34.205 1.00 72.11 C ATOM 1278 C GLN A 81 15.262 5.151 -34.934 1.00 11.24 C ATOM 1279 O GLN A 81 14.110 5.093 -34.496 1.00 52.34 O ATOM 1280 CB GLN A 81 17.308 4.982 -33.515 1.00 14.14 C ATOM 1281 CG GLN A 81 18.557 5.655 -32.980 1.00 51.35 C ATOM 1282 CD GLN A 81 19.657 4.659 -32.696 1.00 0.54 C ATOM 1283 OE1 GLN A 81 19.751 4.112 -31.599 1.00 13.23 O ATOM 1284 NE2 GLN A 81 20.495 4.417 -33.690 1.00 45.32 N ATOM 0 H GLN A 81 15.962 6.677 -32.277 1.00 51.12 H new ATOM 0 HA GLN A 81 16.899 6.529 -34.936 1.00 72.11 H new ATOM 0 HB2 GLN A 81 16.790 4.489 -32.692 1.00 14.14 H new ATOM 0 HB3 GLN A 81 17.599 4.204 -34.220 1.00 14.14 H new ATOM 0 HG2 GLN A 81 18.911 6.390 -33.703 1.00 51.35 H new ATOM 0 HG3 GLN A 81 18.314 6.197 -32.066 1.00 51.35 H new ATOM 0 HE21 GLN A 81 20.378 4.895 -34.584 1.00 45.32 H new ATOM 0 HE22 GLN A 81 21.258 3.752 -33.563 1.00 45.32 H new ATOM 1293 N GLY A 82 15.639 4.555 -36.057 1.00 34.44 N ATOM 1294 CA GLY A 82 14.689 3.833 -36.880 1.00 32.21 C ATOM 1295 C GLY A 82 14.161 4.712 -37.987 1.00 73.54 C ATOM 1296 O GLY A 82 14.139 4.324 -39.155 1.00 52.30 O ATOM 0 H GLY A 82 16.594 4.559 -36.415 1.00 34.44 H new ATOM 0 HA2 GLY A 82 15.167 2.951 -37.307 1.00 32.21 H new ATOM 0 HA3 GLY A 82 13.862 3.480 -36.264 1.00 32.21 H new ATOM 1300 N ALA A 83 13.737 5.901 -37.607 1.00 15.31 N ATOM 1301 CA ALA A 83 13.324 6.919 -38.552 1.00 11.52 C ATOM 1302 C ALA A 83 13.659 8.287 -37.987 1.00 14.43 C ATOM 1303 O ALA A 83 13.003 8.756 -37.054 1.00 5.42 O ATOM 1304 CB ALA A 83 11.839 6.808 -38.852 1.00 21.20 C ATOM 0 H ALA A 83 13.669 6.189 -36.631 1.00 15.31 H new ATOM 0 HA ALA A 83 13.860 6.776 -39.491 1.00 11.52 H new ATOM 0 HB1 ALA A 83 11.553 7.582 -39.564 1.00 21.20 H new ATOM 0 HB2 ALA A 83 11.626 5.827 -39.278 1.00 21.20 H new ATOM 0 HB3 ALA A 83 11.271 6.934 -37.930 1.00 21.20 H new ATOM 1310 N GLU A 84 14.682 8.917 -38.554 1.00 63.40 N ATOM 1311 CA GLU A 84 15.194 10.196 -38.057 1.00 23.04 C ATOM 1312 C GLU A 84 14.256 11.361 -38.387 1.00 62.24 C ATOM 1313 O GLU A 84 14.695 12.451 -38.754 1.00 12.33 O ATOM 1314 CB GLU A 84 16.588 10.444 -38.639 1.00 63.31 C ATOM 1315 CG GLU A 84 16.642 10.361 -40.156 1.00 73.14 C ATOM 1316 CD GLU A 84 18.058 10.290 -40.679 1.00 53.05 C ATOM 1317 OE1 GLU A 84 18.671 11.349 -40.909 1.00 42.51 O ATOM 1318 OE2 GLU A 84 18.570 9.165 -40.855 1.00 71.43 O ATOM 0 H GLU A 84 15.181 8.560 -39.369 1.00 63.40 H new ATOM 0 HA GLU A 84 15.254 10.139 -36.970 1.00 23.04 H new ATOM 0 HB2 GLU A 84 16.932 11.430 -38.326 1.00 63.31 H new ATOM 0 HB3 GLU A 84 17.282 9.716 -38.219 1.00 63.31 H new ATOM 0 HG2 GLU A 84 16.090 9.482 -40.489 1.00 73.14 H new ATOM 0 HG3 GLU A 84 16.143 11.231 -40.583 1.00 73.14 H new ATOM 1325 N GLY A 85 12.969 11.131 -38.206 1.00 42.24 N ATOM 1326 CA GLY A 85 11.978 12.148 -38.450 1.00 12.43 C ATOM 1327 C GLY A 85 10.721 11.872 -37.661 1.00 55.14 C ATOM 1328 O GLY A 85 10.238 12.732 -36.925 1.00 32.12 O ATOM 0 H GLY A 85 12.589 10.239 -37.888 1.00 42.24 H new ATOM 0 HA2 GLY A 85 12.378 13.124 -38.176 1.00 12.43 H new ATOM 0 HA3 GLY A 85 11.744 12.186 -39.514 1.00 12.43 H new ATOM 1332 N THR A 86 10.207 10.657 -37.801 1.00 74.43 N ATOM 1333 CA THR A 86 9.001 10.249 -37.104 1.00 1.13 C ATOM 1334 C THR A 86 9.148 8.859 -36.488 1.00 54.01 C ATOM 1335 O THR A 86 9.106 7.846 -37.184 1.00 13.44 O ATOM 1336 CB THR A 86 7.789 10.271 -38.053 1.00 21.42 C ATOM 1337 OG1 THR A 86 8.163 9.740 -39.333 1.00 3.53 O ATOM 1338 CG2 THR A 86 7.259 11.687 -38.214 1.00 23.51 C ATOM 0 H THR A 86 10.612 9.934 -38.396 1.00 74.43 H new ATOM 0 HA THR A 86 8.838 10.964 -36.297 1.00 1.13 H new ATOM 0 HB THR A 86 7.000 9.654 -37.623 1.00 21.42 H new ATOM 0 HG1 THR A 86 8.623 8.883 -39.210 1.00 3.53 H new ATOM 0 HG21 THR A 86 6.403 11.681 -38.888 1.00 23.51 H new ATOM 0 HG22 THR A 86 6.952 12.073 -37.242 1.00 23.51 H new ATOM 0 HG23 THR A 86 8.041 12.324 -38.627 1.00 23.51 H new ATOM 1346 N SER A 87 9.342 8.830 -35.182 1.00 43.22 N ATOM 1347 CA SER A 87 9.420 7.591 -34.436 1.00 32.42 C ATOM 1348 C SER A 87 8.260 7.539 -33.448 1.00 64.33 C ATOM 1349 O SER A 87 8.258 8.241 -32.439 1.00 22.15 O ATOM 1350 CB SER A 87 10.766 7.499 -33.706 1.00 24.03 C ATOM 1351 OG SER A 87 11.013 6.189 -33.220 1.00 5.44 O ATOM 0 H SER A 87 9.450 9.667 -34.609 1.00 43.22 H new ATOM 0 HA SER A 87 9.350 6.741 -35.115 1.00 32.42 H new ATOM 0 HB2 SER A 87 11.568 7.793 -34.383 1.00 24.03 H new ATOM 0 HB3 SER A 87 10.777 8.203 -32.874 1.00 24.03 H new ATOM 0 HG SER A 87 11.908 5.901 -33.496 1.00 5.44 H new ATOM 1357 N THR A 88 7.262 6.730 -33.758 1.00 21.22 N ATOM 1358 CA THR A 88 6.051 6.678 -32.956 1.00 64.12 C ATOM 1359 C THR A 88 5.953 5.358 -32.196 1.00 50.22 C ATOM 1360 O THR A 88 5.769 4.297 -32.794 1.00 25.41 O ATOM 1361 CB THR A 88 4.802 6.857 -33.843 1.00 71.13 C ATOM 1362 OG1 THR A 88 4.969 8.004 -34.693 1.00 22.20 O ATOM 1363 CG2 THR A 88 3.551 7.034 -32.994 1.00 21.40 C ATOM 0 H THR A 88 7.266 6.100 -34.560 1.00 21.22 H new ATOM 0 HA THR A 88 6.098 7.495 -32.236 1.00 64.12 H new ATOM 0 HB THR A 88 4.685 5.960 -34.451 1.00 71.13 H new ATOM 0 HG1 THR A 88 4.174 8.113 -35.256 1.00 22.20 H new ATOM 0 HG21 THR A 88 2.685 7.158 -33.644 1.00 21.40 H new ATOM 0 HG22 THR A 88 3.410 6.154 -32.366 1.00 21.40 H new ATOM 0 HG23 THR A 88 3.661 7.916 -32.364 1.00 21.40 H new ATOM 1371 N LEU A 89 6.092 5.429 -30.880 1.00 5.31 N ATOM 1372 CA LEU A 89 6.005 4.245 -30.032 1.00 72.25 C ATOM 1373 C LEU A 89 4.831 4.374 -29.074 1.00 23.34 C ATOM 1374 O LEU A 89 4.710 5.379 -28.371 1.00 5.51 O ATOM 1375 CB LEU A 89 7.298 4.039 -29.223 1.00 2.34 C ATOM 1376 CG LEU A 89 8.557 3.680 -30.025 1.00 5.21 C ATOM 1377 CD1 LEU A 89 9.127 4.899 -30.736 1.00 62.43 C ATOM 1378 CD2 LEU A 89 9.603 3.062 -29.110 1.00 1.02 C ATOM 0 H LEU A 89 6.266 6.297 -30.373 1.00 5.31 H new ATOM 0 HA LEU A 89 5.860 3.382 -30.682 1.00 72.25 H new ATOM 0 HB2 LEU A 89 7.499 4.952 -28.663 1.00 2.34 H new ATOM 0 HB3 LEU A 89 7.122 3.249 -28.493 1.00 2.34 H new ATOM 0 HG LEU A 89 8.276 2.952 -30.786 1.00 5.21 H new ATOM 0 HD11 LEU A 89 10.018 4.611 -31.295 1.00 62.43 H new ATOM 0 HD12 LEU A 89 8.382 5.301 -31.423 1.00 62.43 H new ATOM 0 HD13 LEU A 89 9.390 5.659 -30.001 1.00 62.43 H new ATOM 0 HD21 LEU A 89 10.491 2.812 -29.690 1.00 1.02 H new ATOM 0 HD22 LEU A 89 9.869 3.774 -28.328 1.00 1.02 H new ATOM 0 HD23 LEU A 89 9.200 2.157 -28.655 1.00 1.02 H new ATOM 1390 N ASN A 90 3.957 3.376 -29.054 1.00 21.43 N ATOM 1391 CA ASN A 90 2.851 3.375 -28.108 1.00 43.21 C ATOM 1392 C ASN A 90 3.295 2.718 -26.810 1.00 2.01 C ATOM 1393 O ASN A 90 3.937 1.662 -26.818 1.00 12.34 O ATOM 1394 CB ASN A 90 1.599 2.688 -28.683 1.00 70.32 C ATOM 1395 CG ASN A 90 1.733 1.182 -28.846 1.00 44.53 C ATOM 1396 OD1 ASN A 90 2.233 0.699 -29.866 1.00 15.11 O ATOM 1397 ND2 ASN A 90 1.243 0.431 -27.870 1.00 62.01 N ATOM 0 H ASN A 90 3.992 2.567 -29.674 1.00 21.43 H new ATOM 0 HA ASN A 90 2.570 4.409 -27.908 1.00 43.21 H new ATOM 0 HB2 ASN A 90 0.751 2.897 -28.030 1.00 70.32 H new ATOM 0 HB3 ASN A 90 1.370 3.128 -29.654 1.00 70.32 H new ATOM 0 HD21 ASN A 90 1.271 -0.586 -27.946 1.00 62.01 H new ATOM 0 HD22 ASN A 90 0.838 0.870 -27.043 1.00 62.01 H new ATOM 1404 N LYS A 91 3.002 3.377 -25.703 1.00 11.14 N ATOM 1405 CA LYS A 91 3.423 2.912 -24.395 1.00 75.44 C ATOM 1406 C LYS A 91 2.293 3.054 -23.385 1.00 73.13 C ATOM 1407 O LYS A 91 1.538 4.028 -23.418 1.00 43.20 O ATOM 1408 CB LYS A 91 4.652 3.693 -23.931 1.00 42.00 C ATOM 1409 CG LYS A 91 5.938 3.284 -24.630 1.00 11.30 C ATOM 1410 CD LYS A 91 6.354 1.874 -24.241 1.00 21.20 C ATOM 1411 CE LYS A 91 7.646 1.465 -24.926 1.00 42.21 C ATOM 1412 NZ LYS A 91 8.142 0.147 -24.444 1.00 1.43 N ATOM 0 H LYS A 91 2.468 4.246 -25.686 1.00 11.14 H new ATOM 0 HA LYS A 91 3.684 1.856 -24.470 1.00 75.44 H new ATOM 0 HB2 LYS A 91 4.480 4.756 -24.099 1.00 42.00 H new ATOM 0 HB3 LYS A 91 4.774 3.556 -22.857 1.00 42.00 H new ATOM 0 HG2 LYS A 91 5.801 3.340 -25.710 1.00 11.30 H new ATOM 0 HG3 LYS A 91 6.733 3.984 -24.373 1.00 11.30 H new ATOM 0 HD2 LYS A 91 6.480 1.816 -23.160 1.00 21.20 H new ATOM 0 HD3 LYS A 91 5.562 1.174 -24.507 1.00 21.20 H new ATOM 0 HE2 LYS A 91 7.486 1.420 -26.003 1.00 42.21 H new ATOM 0 HE3 LYS A 91 8.407 2.225 -24.748 1.00 42.21 H new ATOM 0 HZ1 LYS A 91 9.025 -0.093 -24.938 1.00 1.43 H new ATOM 0 HZ2 LYS A 91 8.320 0.196 -23.420 1.00 1.43 H new ATOM 0 HZ3 LYS A 91 7.428 -0.584 -24.637 1.00 1.43 H new ATOM 1426 N VAL A 92 2.190 2.087 -22.482 1.00 40.11 N ATOM 1427 CA VAL A 92 1.112 2.070 -21.500 1.00 5.03 C ATOM 1428 C VAL A 92 1.629 2.501 -20.136 1.00 3.13 C ATOM 1429 O VAL A 92 2.249 1.711 -19.421 1.00 50.21 O ATOM 1430 CB VAL A 92 0.471 0.671 -21.365 1.00 50.52 C ATOM 1431 CG1 VAL A 92 -0.763 0.729 -20.473 1.00 50.54 C ATOM 1432 CG2 VAL A 92 0.128 0.100 -22.731 1.00 15.05 C ATOM 0 H VAL A 92 2.840 1.304 -22.409 1.00 40.11 H new ATOM 0 HA VAL A 92 0.353 2.768 -21.855 1.00 5.03 H new ATOM 0 HB VAL A 92 1.197 0.007 -20.896 1.00 50.52 H new ATOM 0 HG11 VAL A 92 -1.200 -0.266 -20.391 1.00 50.54 H new ATOM 0 HG12 VAL A 92 -0.479 1.084 -19.482 1.00 50.54 H new ATOM 0 HG13 VAL A 92 -1.494 1.411 -20.907 1.00 50.54 H new ATOM 0 HG21 VAL A 92 -0.322 -0.885 -22.611 1.00 15.05 H new ATOM 0 HG22 VAL A 92 -0.576 0.762 -23.235 1.00 15.05 H new ATOM 0 HG23 VAL A 92 1.036 0.014 -23.328 1.00 15.05 H new ATOM 1442 N ILE A 93 1.385 3.752 -19.784 1.00 40.44 N ATOM 1443 CA ILE A 93 1.826 4.276 -18.500 1.00 40.14 C ATOM 1444 C ILE A 93 0.704 4.169 -17.474 1.00 32.41 C ATOM 1445 O ILE A 93 -0.475 4.289 -17.813 1.00 5.21 O ATOM 1446 CB ILE A 93 2.311 5.746 -18.605 1.00 21.03 C ATOM 1447 CG1 ILE A 93 2.681 6.298 -17.221 1.00 54.24 C ATOM 1448 CG2 ILE A 93 1.252 6.619 -19.265 1.00 61.42 C ATOM 1449 CD1 ILE A 93 3.192 7.723 -17.245 1.00 60.23 C ATOM 0 H ILE A 93 0.885 4.423 -20.367 1.00 40.44 H new ATOM 0 HA ILE A 93 2.674 3.672 -18.177 1.00 40.14 H new ATOM 0 HB ILE A 93 3.204 5.763 -19.229 1.00 21.03 H new ATOM 0 HG12 ILE A 93 1.805 6.248 -16.575 1.00 54.24 H new ATOM 0 HG13 ILE A 93 3.442 5.657 -16.777 1.00 54.24 H new ATOM 0 HG21 ILE A 93 1.614 7.645 -19.328 1.00 61.42 H new ATOM 0 HG22 ILE A 93 1.045 6.245 -20.268 1.00 61.42 H new ATOM 0 HG23 ILE A 93 0.338 6.593 -18.672 1.00 61.42 H new ATOM 0 HD11 ILE A 93 3.432 8.041 -16.230 1.00 60.23 H new ATOM 0 HD12 ILE A 93 4.088 7.778 -17.864 1.00 60.23 H new ATOM 0 HD13 ILE A 93 2.425 8.378 -17.658 1.00 60.23 H new ATOM 1461 N PHE A 94 1.080 3.918 -16.230 1.00 73.55 N ATOM 1462 CA PHE A 94 0.123 3.802 -15.149 1.00 60.33 C ATOM 1463 C PHE A 94 0.297 4.964 -14.181 1.00 51.25 C ATOM 1464 O PHE A 94 1.340 5.095 -13.538 1.00 71.32 O ATOM 1465 CB PHE A 94 0.313 2.470 -14.426 1.00 3.20 C ATOM 1466 CG PHE A 94 -0.830 2.104 -13.524 1.00 3.54 C ATOM 1467 CD1 PHE A 94 -2.030 1.662 -14.056 1.00 24.43 C ATOM 1468 CD2 PHE A 94 -0.706 2.197 -12.148 1.00 31.33 C ATOM 1469 CE1 PHE A 94 -3.084 1.317 -13.233 1.00 22.41 C ATOM 1470 CE2 PHE A 94 -1.756 1.853 -11.322 1.00 21.13 C ATOM 1471 CZ PHE A 94 -2.945 1.413 -11.865 1.00 41.22 C ATOM 0 H PHE A 94 2.051 3.790 -15.946 1.00 73.55 H new ATOM 0 HA PHE A 94 -0.887 3.834 -15.557 1.00 60.33 H new ATOM 0 HB2 PHE A 94 0.447 1.681 -15.166 1.00 3.20 H new ATOM 0 HB3 PHE A 94 1.229 2.514 -13.837 1.00 3.20 H new ATOM 0 HD1 PHE A 94 -2.143 1.586 -15.127 1.00 24.43 H new ATOM 0 HD2 PHE A 94 0.222 2.542 -11.717 1.00 31.33 H new ATOM 0 HE1 PHE A 94 -4.014 0.973 -13.660 1.00 22.41 H new ATOM 0 HE2 PHE A 94 -1.647 1.928 -10.250 1.00 21.13 H new ATOM 0 HZ PHE A 94 -3.767 1.144 -11.218 1.00 41.22 H new ATOM 1481 N VAL A 95 -0.715 5.812 -14.092 1.00 24.23 N ATOM 1482 CA VAL A 95 -0.642 6.995 -13.251 1.00 15.41 C ATOM 1483 C VAL A 95 -1.567 6.864 -12.046 1.00 33.42 C ATOM 1484 O VAL A 95 -2.791 6.904 -12.178 1.00 25.51 O ATOM 1485 CB VAL A 95 -0.998 8.277 -14.033 1.00 62.04 C ATOM 1486 CG1 VAL A 95 -0.684 9.513 -13.207 1.00 13.02 C ATOM 1487 CG2 VAL A 95 -0.265 8.316 -15.365 1.00 52.14 C ATOM 0 H VAL A 95 -1.597 5.703 -14.592 1.00 24.23 H new ATOM 0 HA VAL A 95 0.390 7.075 -12.908 1.00 15.41 H new ATOM 0 HB VAL A 95 -2.069 8.267 -14.236 1.00 62.04 H new ATOM 0 HG11 VAL A 95 -0.942 10.406 -13.776 1.00 13.02 H new ATOM 0 HG12 VAL A 95 -1.264 9.491 -12.284 1.00 13.02 H new ATOM 0 HG13 VAL A 95 0.379 9.530 -12.967 1.00 13.02 H new ATOM 0 HG21 VAL A 95 -0.530 9.228 -15.900 1.00 52.14 H new ATOM 0 HG22 VAL A 95 0.811 8.299 -15.189 1.00 52.14 H new ATOM 0 HG23 VAL A 95 -0.549 7.449 -15.962 1.00 52.14 H new ATOM 1497 N GLN A 96 -0.976 6.672 -10.877 1.00 2.15 N ATOM 1498 CA GLN A 96 -1.737 6.561 -9.639 1.00 65.45 C ATOM 1499 C GLN A 96 -2.028 7.947 -9.063 1.00 24.22 C ATOM 1500 O GLN A 96 -1.116 8.652 -8.630 1.00 4.54 O ATOM 1501 CB GLN A 96 -0.976 5.695 -8.627 1.00 40.43 C ATOM 1502 CG GLN A 96 -0.710 4.281 -9.129 1.00 3.44 C ATOM 1503 CD GLN A 96 0.042 3.414 -8.135 1.00 53.42 C ATOM 1504 OE1 GLN A 96 0.790 2.518 -8.520 1.00 11.53 O ATOM 1505 NE2 GLN A 96 -0.156 3.663 -6.850 1.00 1.30 N ATOM 0 H GLN A 96 0.034 6.589 -10.758 1.00 2.15 H new ATOM 0 HA GLN A 96 -2.691 6.079 -9.854 1.00 65.45 H new ATOM 0 HB2 GLN A 96 -0.026 6.174 -8.390 1.00 40.43 H new ATOM 0 HB3 GLN A 96 -1.547 5.643 -7.700 1.00 40.43 H new ATOM 0 HG2 GLN A 96 -1.661 3.804 -9.368 1.00 3.44 H new ATOM 0 HG3 GLN A 96 -0.139 4.335 -10.056 1.00 3.44 H new ATOM 0 HE21 GLN A 96 -0.784 4.415 -6.567 1.00 1.30 H new ATOM 0 HE22 GLN A 96 0.320 3.103 -6.143 1.00 1.30 H new ATOM 1514 N TYR A 97 -3.296 8.341 -9.071 1.00 13.11 N ATOM 1515 CA TYR A 97 -3.696 9.642 -8.549 1.00 51.22 C ATOM 1516 C TYR A 97 -4.172 9.505 -7.110 1.00 62.25 C ATOM 1517 O TYR A 97 -5.173 8.827 -6.843 1.00 42.34 O ATOM 1518 CB TYR A 97 -4.822 10.247 -9.388 1.00 21.34 C ATOM 1519 CG TYR A 97 -4.508 10.400 -10.856 1.00 50.34 C ATOM 1520 CD1 TYR A 97 -3.733 11.455 -11.313 1.00 11.31 C ATOM 1521 CD2 TYR A 97 -5.006 9.500 -11.787 1.00 11.54 C ATOM 1522 CE1 TYR A 97 -3.459 11.605 -12.658 1.00 61.32 C ATOM 1523 CE2 TYR A 97 -4.738 9.646 -13.132 1.00 34.21 C ATOM 1524 CZ TYR A 97 -3.965 10.700 -13.563 1.00 60.21 C ATOM 1525 OH TYR A 97 -3.699 10.852 -14.902 1.00 35.44 O ATOM 0 H TYR A 97 -4.065 7.778 -9.433 1.00 13.11 H new ATOM 0 HA TYR A 97 -2.828 10.300 -8.592 1.00 51.22 H new ATOM 0 HB2 TYR A 97 -5.709 9.622 -9.284 1.00 21.34 H new ATOM 0 HB3 TYR A 97 -5.073 11.227 -8.981 1.00 21.34 H new ATOM 0 HD1 TYR A 97 -3.338 12.170 -10.607 1.00 11.31 H new ATOM 0 HD2 TYR A 97 -5.613 8.672 -11.453 1.00 11.54 H new ATOM 0 HE1 TYR A 97 -2.850 12.429 -12.999 1.00 61.32 H new ATOM 0 HE2 TYR A 97 -5.133 8.936 -13.844 1.00 34.21 H new ATOM 0 HH TYR A 97 -4.129 10.129 -15.405 1.00 35.44 H new ATOM 1535 N CYS A 98 -3.464 10.142 -6.191 1.00 22.14 N ATOM 1536 CA CYS A 98 -3.829 10.095 -4.785 1.00 44.30 C ATOM 1537 C CYS A 98 -3.115 11.188 -4.000 1.00 62.22 C ATOM 1538 O CYS A 98 -1.894 11.147 -3.835 1.00 70.51 O ATOM 1539 CB CYS A 98 -3.487 8.728 -4.186 1.00 74.31 C ATOM 1540 SG CYS A 98 -3.954 8.548 -2.446 1.00 43.53 S ATOM 0 H CYS A 98 -2.633 10.698 -6.394 1.00 22.14 H new ATOM 0 HA CYS A 98 -4.905 10.258 -4.716 1.00 44.30 H new ATOM 0 HB2 CYS A 98 -3.986 7.953 -4.767 1.00 74.31 H new ATOM 0 HB3 CYS A 98 -2.415 8.558 -4.283 1.00 74.31 H new ATOM 0 HG CYS A 98 -3.745 9.669 -1.822 1.00 43.53 H new ATOM 1546 N PRO A 99 -3.869 12.182 -3.507 1.00 53.10 N ATOM 1547 CA PRO A 99 -3.318 13.228 -2.649 1.00 32.51 C ATOM 1548 C PRO A 99 -2.950 12.685 -1.270 1.00 11.33 C ATOM 1549 O PRO A 99 -3.362 11.584 -0.895 1.00 32.32 O ATOM 1550 CB PRO A 99 -4.451 14.251 -2.548 1.00 21.43 C ATOM 1551 CG PRO A 99 -5.698 13.487 -2.833 1.00 72.10 C ATOM 1552 CD PRO A 99 -5.309 12.367 -3.761 1.00 32.25 C ATOM 0 HA PRO A 99 -2.397 13.651 -3.050 1.00 32.51 H new ATOM 0 HB2 PRO A 99 -4.485 14.704 -1.557 1.00 21.43 H new ATOM 0 HB3 PRO A 99 -4.314 15.061 -3.264 1.00 21.43 H new ATOM 0 HG2 PRO A 99 -6.132 13.096 -1.913 1.00 72.10 H new ATOM 0 HG3 PRO A 99 -6.450 14.129 -3.293 1.00 72.10 H new ATOM 0 HD2 PRO A 99 -5.872 11.458 -3.549 1.00 32.25 H new ATOM 0 HD3 PRO A 99 -5.501 12.626 -4.802 1.00 32.25 H new ATOM 1560 N ASP A 100 -2.187 13.463 -0.517 1.00 20.02 N ATOM 1561 CA ASP A 100 -1.688 13.024 0.781 1.00 4.33 C ATOM 1562 C ASP A 100 -2.792 13.066 1.831 1.00 1.44 C ATOM 1563 O ASP A 100 -2.793 12.283 2.779 1.00 0.10 O ATOM 1564 CB ASP A 100 -0.515 13.905 1.222 1.00 62.53 C ATOM 1565 CG ASP A 100 0.058 13.492 2.566 1.00 13.33 C ATOM 1566 OD1 ASP A 100 0.945 12.613 2.595 1.00 11.01 O ATOM 1567 OD2 ASP A 100 -0.364 14.056 3.599 1.00 33.33 O ATOM 0 H ASP A 100 -1.898 14.405 -0.782 1.00 20.02 H new ATOM 0 HA ASP A 100 -1.345 11.994 0.682 1.00 4.33 H new ATOM 0 HB2 ASP A 100 0.271 13.860 0.468 1.00 62.53 H new ATOM 0 HB3 ASP A 100 -0.846 14.942 1.276 1.00 62.53 H new ATOM 1572 N ASN A 101 -3.745 13.970 1.637 1.00 73.51 N ATOM 1573 CA ASN A 101 -4.821 14.178 2.605 1.00 43.23 C ATOM 1574 C ASN A 101 -5.958 13.172 2.422 1.00 50.32 C ATOM 1575 O ASN A 101 -7.027 13.313 3.017 1.00 60.13 O ATOM 1576 CB ASN A 101 -5.365 15.605 2.494 1.00 31.34 C ATOM 1577 CG ASN A 101 -4.342 16.656 2.884 1.00 11.34 C ATOM 1578 OD1 ASN A 101 -3.573 17.133 2.047 1.00 61.10 O ATOM 1579 ND2 ASN A 101 -4.326 17.027 4.154 1.00 53.43 N ATOM 0 H ASN A 101 -3.796 14.573 0.816 1.00 73.51 H new ATOM 0 HA ASN A 101 -4.399 14.025 3.598 1.00 43.23 H new ATOM 0 HB2 ASN A 101 -5.693 15.786 1.470 1.00 31.34 H new ATOM 0 HB3 ASN A 101 -6.243 15.705 3.132 1.00 31.34 H new ATOM 0 HD21 ASN A 101 -3.660 17.732 4.471 1.00 53.43 H new ATOM 0 HD22 ASN A 101 -4.979 16.608 4.816 1.00 53.43 H new ATOM 1586 N ALA A 102 -5.719 12.155 1.604 1.00 10.43 N ATOM 1587 CA ALA A 102 -6.701 11.101 1.388 1.00 11.43 C ATOM 1588 C ALA A 102 -6.861 10.258 2.653 1.00 5.20 C ATOM 1589 O ALA A 102 -5.898 10.071 3.399 1.00 62.31 O ATOM 1590 CB ALA A 102 -6.286 10.228 0.211 1.00 74.02 C ATOM 0 H ALA A 102 -4.852 12.038 1.079 1.00 10.43 H new ATOM 0 HA ALA A 102 -7.662 11.559 1.156 1.00 11.43 H new ATOM 0 HB1 ALA A 102 -7.028 9.444 0.060 1.00 74.02 H new ATOM 0 HB2 ALA A 102 -6.216 10.839 -0.689 1.00 74.02 H new ATOM 0 HB3 ALA A 102 -5.317 9.775 0.418 1.00 74.02 H new ATOM 1596 N PRO A 103 -8.082 9.754 2.914 1.00 4.24 N ATOM 1597 CA PRO A 103 -8.373 8.941 4.100 1.00 71.01 C ATOM 1598 C PRO A 103 -7.376 7.800 4.281 1.00 5.43 C ATOM 1599 O PRO A 103 -7.092 7.060 3.340 1.00 60.20 O ATOM 1600 CB PRO A 103 -9.773 8.393 3.823 1.00 12.12 C ATOM 1601 CG PRO A 103 -10.396 9.400 2.922 1.00 32.53 C ATOM 1602 CD PRO A 103 -9.278 9.946 2.073 1.00 71.01 C ATOM 0 HA PRO A 103 -8.305 9.523 5.019 1.00 71.01 H new ATOM 0 HB2 PRO A 103 -9.729 7.412 3.351 1.00 12.12 H new ATOM 0 HB3 PRO A 103 -10.344 8.278 4.745 1.00 12.12 H new ATOM 0 HG2 PRO A 103 -11.169 8.944 2.303 1.00 32.53 H new ATOM 0 HG3 PRO A 103 -10.874 10.194 3.496 1.00 32.53 H new ATOM 0 HD2 PRO A 103 -9.194 9.411 1.127 1.00 71.01 H new ATOM 0 HD3 PRO A 103 -9.434 10.997 1.831 1.00 71.01 H new ATOM 1610 N VAL A 104 -6.867 7.662 5.503 1.00 62.11 N ATOM 1611 CA VAL A 104 -5.811 6.697 5.820 1.00 74.51 C ATOM 1612 C VAL A 104 -6.170 5.273 5.392 1.00 74.45 C ATOM 1613 O VAL A 104 -5.310 4.523 4.939 1.00 11.30 O ATOM 1614 CB VAL A 104 -5.491 6.709 7.330 1.00 55.22 C ATOM 1615 CG1 VAL A 104 -4.392 5.712 7.670 1.00 32.42 C ATOM 1616 CG2 VAL A 104 -5.095 8.109 7.770 1.00 70.14 C ATOM 0 H VAL A 104 -7.174 8.215 6.303 1.00 62.11 H new ATOM 0 HA VAL A 104 -4.933 7.008 5.254 1.00 74.51 H new ATOM 0 HB VAL A 104 -6.390 6.410 7.870 1.00 55.22 H new ATOM 0 HG11 VAL A 104 -4.190 5.745 8.741 1.00 32.42 H new ATOM 0 HG12 VAL A 104 -4.713 4.708 7.392 1.00 32.42 H new ATOM 0 HG13 VAL A 104 -3.486 5.969 7.122 1.00 32.42 H new ATOM 0 HG21 VAL A 104 -4.872 8.106 8.837 1.00 70.14 H new ATOM 0 HG22 VAL A 104 -4.213 8.429 7.215 1.00 70.14 H new ATOM 0 HG23 VAL A 104 -5.916 8.798 7.574 1.00 70.14 H new ATOM 1626 N ARG A 105 -7.438 4.910 5.521 1.00 0.50 N ATOM 1627 CA ARG A 105 -7.881 3.565 5.166 1.00 72.22 C ATOM 1628 C ARG A 105 -7.665 3.318 3.675 1.00 13.33 C ATOM 1629 O ARG A 105 -7.117 2.292 3.275 1.00 42.33 O ATOM 1630 CB ARG A 105 -9.357 3.351 5.529 1.00 34.14 C ATOM 1631 CG ARG A 105 -9.691 3.684 6.975 1.00 53.41 C ATOM 1632 CD ARG A 105 -10.010 5.161 7.149 1.00 52.40 C ATOM 1633 NE ARG A 105 -9.964 5.579 8.548 1.00 55.21 N ATOM 1634 CZ ARG A 105 -10.830 6.422 9.102 1.00 35.55 C ATOM 1635 NH1 ARG A 105 -11.889 6.834 8.416 1.00 73.22 N ATOM 1636 NH2 ARG A 105 -10.655 6.825 10.353 1.00 20.11 N ATOM 0 H ARG A 105 -8.177 5.523 5.867 1.00 0.50 H new ATOM 0 HA ARG A 105 -7.287 2.852 5.738 1.00 72.22 H new ATOM 0 HB2 ARG A 105 -9.975 3.964 4.873 1.00 34.14 H new ATOM 0 HB3 ARG A 105 -9.621 2.311 5.335 1.00 34.14 H new ATOM 0 HG2 ARG A 105 -10.543 3.086 7.299 1.00 53.41 H new ATOM 0 HG3 ARG A 105 -8.851 3.415 7.615 1.00 53.41 H new ATOM 0 HD2 ARG A 105 -9.300 5.754 6.572 1.00 52.40 H new ATOM 0 HD3 ARG A 105 -11.001 5.366 6.744 1.00 52.40 H new ATOM 0 HE ARG A 105 -9.222 5.201 9.136 1.00 55.21 H new ATOM 0 HH11 ARG A 105 -12.039 6.504 7.463 1.00 73.22 H new ATOM 0 HH12 ARG A 105 -12.553 7.481 8.842 1.00 73.22 H new ATOM 0 HH21 ARG A 105 -9.856 6.488 10.890 1.00 20.11 H new ATOM 0 HH22 ARG A 105 -11.319 7.472 10.778 1.00 20.11 H new ATOM 1650 N ARG A 106 -8.074 4.283 2.864 1.00 32.53 N ATOM 1651 CA ARG A 106 -7.902 4.202 1.421 1.00 61.12 C ATOM 1652 C ARG A 106 -6.432 4.403 1.056 1.00 11.12 C ATOM 1653 O ARG A 106 -5.935 3.840 0.082 1.00 2.15 O ATOM 1654 CB ARG A 106 -8.773 5.262 0.744 1.00 24.01 C ATOM 1655 CG ARG A 106 -8.893 5.101 -0.760 1.00 30.33 C ATOM 1656 CD ARG A 106 -9.863 6.117 -1.340 1.00 44.04 C ATOM 1657 NE ARG A 106 -11.198 5.999 -0.751 1.00 54.02 N ATOM 1658 CZ ARG A 106 -12.007 7.035 -0.524 1.00 22.23 C ATOM 1659 NH1 ARG A 106 -11.594 8.269 -0.776 1.00 33.24 N ATOM 1660 NH2 ARG A 106 -13.223 6.837 -0.025 1.00 72.42 N ATOM 0 H ARG A 106 -8.531 5.137 3.184 1.00 32.53 H new ATOM 0 HA ARG A 106 -8.210 3.216 1.074 1.00 61.12 H new ATOM 0 HB2 ARG A 106 -9.771 5.230 1.182 1.00 24.01 H new ATOM 0 HB3 ARG A 106 -8.361 6.247 0.961 1.00 24.01 H new ATOM 0 HG2 ARG A 106 -7.913 5.223 -1.222 1.00 30.33 H new ATOM 0 HG3 ARG A 106 -9.233 4.092 -0.996 1.00 30.33 H new ATOM 0 HD2 ARG A 106 -9.479 7.123 -1.170 1.00 44.04 H new ATOM 0 HD3 ARG A 106 -9.929 5.980 -2.419 1.00 44.04 H new ATOM 0 HE ARG A 106 -11.530 5.068 -0.499 1.00 54.02 H new ATOM 0 HH11 ARG A 106 -10.656 8.428 -1.144 1.00 33.24 H new ATOM 0 HH12 ARG A 106 -12.214 9.060 -0.602 1.00 33.24 H new ATOM 0 HH21 ARG A 106 -13.540 5.891 0.186 1.00 72.42 H new ATOM 0 HH22 ARG A 106 -13.839 7.631 0.147 1.00 72.42 H new ATOM 1674 N ARG A 107 -5.750 5.208 1.862 1.00 74.24 N ATOM 1675 CA ARG A 107 -4.322 5.460 1.705 1.00 73.55 C ATOM 1676 C ARG A 107 -3.537 4.163 1.899 1.00 65.11 C ATOM 1677 O ARG A 107 -2.590 3.876 1.165 1.00 2.11 O ATOM 1678 CB ARG A 107 -3.877 6.505 2.736 1.00 24.22 C ATOM 1679 CG ARG A 107 -2.472 7.049 2.533 1.00 11.03 C ATOM 1680 CD ARG A 107 -2.382 7.927 1.296 1.00 21.51 C ATOM 1681 NE ARG A 107 -1.210 8.799 1.336 1.00 11.51 N ATOM 1682 CZ ARG A 107 -0.742 9.482 0.293 1.00 2.22 C ATOM 1683 NH1 ARG A 107 -1.311 9.372 -0.902 1.00 63.35 N ATOM 1684 NH2 ARG A 107 0.298 10.285 0.452 1.00 63.23 N ATOM 0 H ARG A 107 -6.173 5.706 2.645 1.00 74.24 H new ATOM 0 HA ARG A 107 -4.128 5.837 0.701 1.00 73.55 H new ATOM 0 HB2 ARG A 107 -4.580 7.338 2.714 1.00 24.22 H new ATOM 0 HB3 ARG A 107 -3.939 6.062 3.730 1.00 24.22 H new ATOM 0 HG2 ARG A 107 -2.174 7.624 3.410 1.00 11.03 H new ATOM 0 HG3 ARG A 107 -1.770 6.220 2.442 1.00 11.03 H new ATOM 0 HD2 ARG A 107 -2.338 7.299 0.406 1.00 21.51 H new ATOM 0 HD3 ARG A 107 -3.284 8.533 1.214 1.00 21.51 H new ATOM 0 HE ARG A 107 -0.716 8.891 2.224 1.00 11.51 H new ATOM 0 HH11 ARG A 107 -2.116 8.759 -1.029 1.00 63.35 H new ATOM 0 HH12 ARG A 107 -0.943 9.901 -1.693 1.00 63.35 H new ATOM 0 HH21 ARG A 107 0.735 10.377 1.369 1.00 63.23 H new ATOM 0 HH22 ARG A 107 0.662 10.811 -0.342 1.00 63.23 H new ATOM 1698 N MET A 108 -3.949 3.385 2.894 1.00 72.23 N ATOM 1699 CA MET A 108 -3.328 2.099 3.187 1.00 60.02 C ATOM 1700 C MET A 108 -3.546 1.123 2.036 1.00 63.42 C ATOM 1701 O MET A 108 -2.637 0.385 1.652 1.00 34.11 O ATOM 1702 CB MET A 108 -3.897 1.524 4.488 1.00 2.03 C ATOM 1703 CG MET A 108 -3.363 0.143 4.837 1.00 35.24 C ATOM 1704 SD MET A 108 -1.571 0.118 5.052 1.00 42.34 S ATOM 1705 CE MET A 108 -1.381 1.214 6.459 1.00 40.21 C ATOM 0 H MET A 108 -4.719 3.627 3.517 1.00 72.23 H new ATOM 0 HA MET A 108 -2.256 2.251 3.309 1.00 60.02 H new ATOM 0 HB2 MET A 108 -3.670 2.208 5.306 1.00 2.03 H new ATOM 0 HB3 MET A 108 -4.983 1.473 4.407 1.00 2.03 H new ATOM 0 HG2 MET A 108 -3.839 -0.204 5.754 1.00 35.24 H new ATOM 0 HG3 MET A 108 -3.639 -0.558 4.049 1.00 35.24 H new ATOM 0 HE1 MET A 108 -0.632 0.808 7.138 1.00 40.21 H new ATOM 0 HE2 MET A 108 -1.062 2.198 6.114 1.00 40.21 H new ATOM 0 HE3 MET A 108 -2.333 1.304 6.981 1.00 40.21 H new ATOM 1715 N LEU A 109 -4.757 1.125 1.489 1.00 24.44 N ATOM 1716 CA LEU A 109 -5.078 0.295 0.333 1.00 14.01 C ATOM 1717 C LEU A 109 -4.208 0.687 -0.856 1.00 50.04 C ATOM 1718 O LEU A 109 -3.633 -0.169 -1.529 1.00 20.22 O ATOM 1719 CB LEU A 109 -6.557 0.438 -0.029 1.00 71.11 C ATOM 1720 CG LEU A 109 -7.540 -0.013 1.052 1.00 0.03 C ATOM 1721 CD1 LEU A 109 -8.974 0.228 0.602 1.00 22.11 C ATOM 1722 CD2 LEU A 109 -7.326 -1.481 1.387 1.00 54.23 C ATOM 0 H LEU A 109 -5.534 1.693 1.828 1.00 24.44 H new ATOM 0 HA LEU A 109 -4.878 -0.746 0.587 1.00 14.01 H new ATOM 0 HB2 LEU A 109 -6.757 1.483 -0.266 1.00 71.11 H new ATOM 0 HB3 LEU A 109 -6.750 -0.137 -0.935 1.00 71.11 H new ATOM 0 HG LEU A 109 -7.358 0.575 1.951 1.00 0.03 H new ATOM 0 HD11 LEU A 109 -9.660 -0.099 1.383 1.00 22.11 H new ATOM 0 HD12 LEU A 109 -9.122 1.291 0.411 1.00 22.11 H new ATOM 0 HD13 LEU A 109 -9.169 -0.335 -0.311 1.00 22.11 H new ATOM 0 HD21 LEU A 109 -8.034 -1.785 2.158 1.00 54.23 H new ATOM 0 HD22 LEU A 109 -7.482 -2.085 0.493 1.00 54.23 H new ATOM 0 HD23 LEU A 109 -6.309 -1.627 1.751 1.00 54.23 H new ATOM 1734 N TYR A 110 -4.105 1.993 -1.077 1.00 53.42 N ATOM 1735 CA TYR A 110 -3.267 2.561 -2.131 1.00 71.04 C ATOM 1736 C TYR A 110 -1.824 2.061 -2.032 1.00 73.33 C ATOM 1737 O TYR A 110 -1.200 1.727 -3.037 1.00 24.31 O ATOM 1738 CB TYR A 110 -3.316 4.095 -2.032 1.00 14.13 C ATOM 1739 CG TYR A 110 -2.166 4.819 -2.702 1.00 35.25 C ATOM 1740 CD1 TYR A 110 -2.172 5.074 -4.068 1.00 33.04 C ATOM 1741 CD2 TYR A 110 -1.072 5.252 -1.959 1.00 52.23 C ATOM 1742 CE1 TYR A 110 -1.119 5.736 -4.673 1.00 71.33 C ATOM 1743 CE2 TYR A 110 -0.018 5.913 -2.558 1.00 11.13 C ATOM 1744 CZ TYR A 110 -0.045 6.152 -3.913 1.00 3.23 C ATOM 1745 OH TYR A 110 1.006 6.807 -4.510 1.00 25.51 O ATOM 0 H TYR A 110 -4.603 2.693 -0.527 1.00 53.42 H new ATOM 0 HA TYR A 110 -3.651 2.240 -3.099 1.00 71.04 H new ATOM 0 HB2 TYR A 110 -4.250 4.442 -2.473 1.00 14.13 H new ATOM 0 HB3 TYR A 110 -3.337 4.375 -0.979 1.00 14.13 H new ATOM 0 HD1 TYR A 110 -3.011 4.751 -4.666 1.00 33.04 H new ATOM 0 HD2 TYR A 110 -1.047 5.068 -0.895 1.00 52.23 H new ATOM 0 HE1 TYR A 110 -1.137 5.927 -5.736 1.00 71.33 H new ATOM 0 HE2 TYR A 110 0.824 6.241 -1.966 1.00 11.13 H new ATOM 0 HH TYR A 110 1.678 7.031 -3.833 1.00 25.51 H new ATOM 1755 N ALA A 111 -1.305 2.004 -0.814 1.00 5.21 N ATOM 1756 CA ALA A 111 0.077 1.598 -0.589 1.00 23.13 C ATOM 1757 C ALA A 111 0.244 0.083 -0.681 1.00 2.13 C ATOM 1758 O ALA A 111 1.354 -0.415 -0.862 1.00 34.02 O ATOM 1759 CB ALA A 111 0.560 2.100 0.763 1.00 24.33 C ATOM 0 H ALA A 111 -1.820 2.234 0.036 1.00 5.21 H new ATOM 0 HA ALA A 111 0.685 2.045 -1.376 1.00 23.13 H new ATOM 0 HB1 ALA A 111 1.593 1.790 0.918 1.00 24.33 H new ATOM 0 HB2 ALA A 111 0.500 3.188 0.790 1.00 24.33 H new ATOM 0 HB3 ALA A 111 -0.066 1.682 1.551 1.00 24.33 H new ATOM 1765 N SER A 112 -0.851 -0.648 -0.538 1.00 15.02 N ATOM 1766 CA SER A 112 -0.804 -2.102 -0.562 1.00 13.22 C ATOM 1767 C SER A 112 -0.955 -2.659 -1.976 1.00 15.34 C ATOM 1768 O SER A 112 -0.342 -3.670 -2.319 1.00 12.42 O ATOM 1769 CB SER A 112 -1.885 -2.666 0.355 1.00 65.23 C ATOM 1770 OG SER A 112 -1.704 -2.194 1.679 1.00 32.22 O ATOM 0 H SER A 112 -1.784 -0.258 -0.404 1.00 15.02 H new ATOM 0 HA SER A 112 0.177 -2.412 -0.202 1.00 13.22 H new ATOM 0 HB2 SER A 112 -2.870 -2.375 -0.011 1.00 65.23 H new ATOM 0 HB3 SER A 112 -1.850 -3.755 0.342 1.00 65.23 H new ATOM 0 HG SER A 112 -2.090 -1.297 1.762 1.00 32.22 H new ATOM 1776 N SER A 113 -1.744 -1.985 -2.798 1.00 32.53 N ATOM 1777 CA SER A 113 -2.064 -2.477 -4.132 1.00 72.12 C ATOM 1778 C SER A 113 -0.900 -2.292 -5.107 1.00 60.00 C ATOM 1779 O SER A 113 -0.911 -2.863 -6.197 1.00 1.43 O ATOM 1780 CB SER A 113 -3.302 -1.749 -4.654 1.00 12.01 C ATOM 1781 OG SER A 113 -3.161 -0.349 -4.495 1.00 35.01 O ATOM 0 H SER A 113 -2.177 -1.091 -2.565 1.00 32.53 H new ATOM 0 HA SER A 113 -2.259 -3.547 -4.059 1.00 72.12 H new ATOM 0 HB2 SER A 113 -3.454 -1.987 -5.707 1.00 12.01 H new ATOM 0 HB3 SER A 113 -4.186 -2.094 -4.118 1.00 12.01 H new ATOM 0 HG SER A 113 -3.430 -0.094 -3.588 1.00 35.01 H new ATOM 1787 N VAL A 114 0.107 -1.521 -4.689 1.00 62.41 N ATOM 1788 CA VAL A 114 1.212 -1.106 -5.563 1.00 14.12 C ATOM 1789 C VAL A 114 1.783 -2.253 -6.402 1.00 71.22 C ATOM 1790 O VAL A 114 1.682 -2.242 -7.628 1.00 3.23 O ATOM 1791 CB VAL A 114 2.364 -0.469 -4.756 1.00 3.25 C ATOM 1792 CG1 VAL A 114 3.477 0.014 -5.681 1.00 21.25 C ATOM 1793 CG2 VAL A 114 1.846 0.675 -3.897 1.00 40.40 C ATOM 0 H VAL A 114 0.181 -1.166 -3.736 1.00 62.41 H new ATOM 0 HA VAL A 114 0.777 -0.371 -6.240 1.00 14.12 H new ATOM 0 HB VAL A 114 2.780 -1.233 -4.099 1.00 3.25 H new ATOM 0 HG11 VAL A 114 4.276 0.458 -5.088 1.00 21.25 H new ATOM 0 HG12 VAL A 114 3.872 -0.830 -6.247 1.00 21.25 H new ATOM 0 HG13 VAL A 114 3.080 0.759 -6.370 1.00 21.25 H new ATOM 0 HG21 VAL A 114 2.672 1.111 -3.336 1.00 40.40 H new ATOM 0 HG22 VAL A 114 1.399 1.437 -4.536 1.00 40.40 H new ATOM 0 HG23 VAL A 114 1.095 0.298 -3.203 1.00 40.40 H new ATOM 1803 N ARG A 115 2.371 -3.247 -5.749 1.00 53.02 N ATOM 1804 CA ARG A 115 3.035 -4.324 -6.478 1.00 55.41 C ATOM 1805 C ARG A 115 2.025 -5.249 -7.150 1.00 22.25 C ATOM 1806 O ARG A 115 2.352 -5.948 -8.108 1.00 54.10 O ATOM 1807 CB ARG A 115 4.005 -5.103 -5.569 1.00 2.55 C ATOM 1808 CG ARG A 115 3.402 -5.676 -4.290 1.00 21.35 C ATOM 1809 CD ARG A 115 2.649 -6.976 -4.533 1.00 2.52 C ATOM 1810 NE ARG A 115 2.314 -7.661 -3.282 1.00 72.41 N ATOM 1811 CZ ARG A 115 1.088 -7.716 -2.769 1.00 23.33 C ATOM 1812 NH1 ARG A 115 0.093 -7.084 -3.368 1.00 71.21 N ATOM 1813 NH2 ARG A 115 0.858 -8.401 -1.655 1.00 73.14 N ATOM 0 H ARG A 115 2.403 -3.332 -4.733 1.00 53.02 H new ATOM 0 HA ARG A 115 3.629 -3.867 -7.269 1.00 55.41 H new ATOM 0 HB2 ARG A 115 4.433 -5.923 -6.145 1.00 2.55 H new ATOM 0 HB3 ARG A 115 4.827 -4.442 -5.296 1.00 2.55 H new ATOM 0 HG2 ARG A 115 4.196 -5.850 -3.564 1.00 21.35 H new ATOM 0 HG3 ARG A 115 2.724 -4.944 -3.852 1.00 21.35 H new ATOM 0 HD2 ARG A 115 1.734 -6.766 -5.087 1.00 2.52 H new ATOM 0 HD3 ARG A 115 3.255 -7.635 -5.155 1.00 2.52 H new ATOM 0 HE ARG A 115 3.067 -8.124 -2.773 1.00 72.41 H new ATOM 0 HH11 ARG A 115 0.266 -6.555 -4.223 1.00 71.21 H new ATOM 0 HH12 ARG A 115 -0.847 -7.126 -2.975 1.00 71.21 H new ATOM 0 HH21 ARG A 115 1.623 -8.888 -1.189 1.00 73.14 H new ATOM 0 HH22 ARG A 115 -0.084 -8.440 -1.266 1.00 73.14 H new ATOM 1827 N ALA A 116 0.793 -5.223 -6.667 1.00 64.33 N ATOM 1828 CA ALA A 116 -0.239 -6.112 -7.173 1.00 21.12 C ATOM 1829 C ALA A 116 -0.757 -5.641 -8.525 1.00 5.34 C ATOM 1830 O ALA A 116 -0.848 -6.425 -9.470 1.00 52.25 O ATOM 1831 CB ALA A 116 -1.383 -6.215 -6.178 1.00 51.15 C ATOM 0 H ALA A 116 0.484 -4.595 -5.925 1.00 64.33 H new ATOM 0 HA ALA A 116 0.204 -7.099 -7.306 1.00 21.12 H new ATOM 0 HB1 ALA A 116 -2.148 -6.884 -6.571 1.00 51.15 H new ATOM 0 HB2 ALA A 116 -1.009 -6.607 -5.233 1.00 51.15 H new ATOM 0 HB3 ALA A 116 -1.814 -5.227 -6.016 1.00 51.15 H new ATOM 1837 N LEU A 117 -1.077 -4.356 -8.620 1.00 34.25 N ATOM 1838 CA LEU A 117 -1.695 -3.816 -9.824 1.00 22.24 C ATOM 1839 C LEU A 117 -0.761 -3.876 -11.030 1.00 62.33 C ATOM 1840 O LEU A 117 -1.210 -4.104 -12.152 1.00 52.51 O ATOM 1841 CB LEU A 117 -2.211 -2.386 -9.580 1.00 35.43 C ATOM 1842 CG LEU A 117 -1.247 -1.414 -8.883 1.00 55.51 C ATOM 1843 CD1 LEU A 117 -0.243 -0.831 -9.865 1.00 1.03 C ATOM 1844 CD2 LEU A 117 -2.023 -0.301 -8.198 1.00 53.21 C ATOM 0 H LEU A 117 -0.919 -3.671 -7.881 1.00 34.25 H new ATOM 0 HA LEU A 117 -2.550 -4.449 -10.062 1.00 22.24 H new ATOM 0 HB2 LEU A 117 -2.491 -1.956 -10.542 1.00 35.43 H new ATOM 0 HB3 LEU A 117 -3.121 -2.450 -8.983 1.00 35.43 H new ATOM 0 HG LEU A 117 -0.693 -1.974 -8.130 1.00 55.51 H new ATOM 0 HD11 LEU A 117 0.424 -0.147 -9.340 1.00 1.03 H new ATOM 0 HD12 LEU A 117 0.340 -1.637 -10.311 1.00 1.03 H new ATOM 0 HD13 LEU A 117 -0.773 -0.290 -10.649 1.00 1.03 H new ATOM 0 HD21 LEU A 117 -1.327 0.380 -7.708 1.00 53.21 H new ATOM 0 HD22 LEU A 117 -2.605 0.246 -8.939 1.00 53.21 H new ATOM 0 HD23 LEU A 117 -2.694 -0.730 -7.454 1.00 53.21 H new ATOM 1856 N LYS A 118 0.537 -3.704 -10.804 1.00 11.25 N ATOM 1857 CA LYS A 118 1.491 -3.712 -11.906 1.00 2.21 C ATOM 1858 C LYS A 118 1.650 -5.106 -12.499 1.00 21.13 C ATOM 1859 O LYS A 118 1.498 -5.293 -13.708 1.00 14.51 O ATOM 1860 CB LYS A 118 2.861 -3.191 -11.468 1.00 70.50 C ATOM 1861 CG LYS A 118 2.894 -1.704 -11.151 1.00 50.11 C ATOM 1862 CD LYS A 118 4.219 -1.091 -11.572 1.00 61.04 C ATOM 1863 CE LYS A 118 4.360 -1.094 -13.087 1.00 24.22 C ATOM 1864 NZ LYS A 118 5.765 -0.883 -13.527 1.00 23.14 N ATOM 0 H LYS A 118 0.948 -3.559 -9.882 1.00 11.25 H new ATOM 0 HA LYS A 118 1.087 -3.047 -12.669 1.00 2.21 H new ATOM 0 HB2 LYS A 118 3.183 -3.746 -10.586 1.00 70.50 H new ATOM 0 HB3 LYS A 118 3.584 -3.398 -12.256 1.00 70.50 H new ATOM 0 HG2 LYS A 118 2.076 -1.200 -11.665 1.00 50.11 H new ATOM 0 HG3 LYS A 118 2.741 -1.552 -10.083 1.00 50.11 H new ATOM 0 HD2 LYS A 118 4.287 -0.069 -11.198 1.00 61.04 H new ATOM 0 HD3 LYS A 118 5.041 -1.649 -11.125 1.00 61.04 H new ATOM 0 HE2 LYS A 118 3.998 -2.044 -13.481 1.00 24.22 H new ATOM 0 HE3 LYS A 118 3.729 -0.312 -13.509 1.00 24.22 H new ATOM 0 HZ1 LYS A 118 5.780 -0.243 -14.347 1.00 23.14 H new ATOM 0 HZ2 LYS A 118 6.313 -0.462 -12.750 1.00 23.14 H new ATOM 0 HZ3 LYS A 118 6.186 -1.796 -13.793 1.00 23.14 H new ATOM 1878 N ALA A 119 1.944 -6.078 -11.644 1.00 23.21 N ATOM 1879 CA ALA A 119 2.244 -7.434 -12.094 1.00 71.03 C ATOM 1880 C ALA A 119 1.020 -8.122 -12.686 1.00 2.33 C ATOM 1881 O ALA A 119 1.119 -8.830 -13.689 1.00 23.03 O ATOM 1882 CB ALA A 119 2.802 -8.252 -10.939 1.00 13.03 C ATOM 0 H ALA A 119 1.981 -5.953 -10.632 1.00 23.21 H new ATOM 0 HA ALA A 119 2.991 -7.364 -12.884 1.00 71.03 H new ATOM 0 HB1 ALA A 119 3.023 -9.263 -11.282 1.00 13.03 H new ATOM 0 HB2 ALA A 119 3.716 -7.785 -10.571 1.00 13.03 H new ATOM 0 HB3 ALA A 119 2.067 -8.295 -10.135 1.00 13.03 H new ATOM 1888 N SER A 120 -0.132 -7.896 -12.074 1.00 52.50 N ATOM 1889 CA SER A 120 -1.353 -8.580 -12.473 1.00 13.21 C ATOM 1890 C SER A 120 -1.866 -8.102 -13.829 1.00 2.33 C ATOM 1891 O SER A 120 -2.549 -8.846 -14.534 1.00 71.34 O ATOM 1892 CB SER A 120 -2.427 -8.377 -11.412 1.00 2.31 C ATOM 1893 OG SER A 120 -1.951 -8.755 -10.132 1.00 63.24 O ATOM 0 H SER A 120 -0.248 -7.244 -11.298 1.00 52.50 H new ATOM 0 HA SER A 120 -1.119 -9.640 -12.568 1.00 13.21 H new ATOM 0 HB2 SER A 120 -2.735 -7.331 -11.396 1.00 2.31 H new ATOM 0 HB3 SER A 120 -3.309 -8.965 -11.665 1.00 2.31 H new ATOM 0 HG SER A 120 -1.698 -7.954 -9.628 1.00 63.24 H new ATOM 1899 N LEU A 121 -1.545 -6.867 -14.198 1.00 60.54 N ATOM 1900 CA LEU A 121 -2.031 -6.314 -15.458 1.00 32.24 C ATOM 1901 C LEU A 121 -0.958 -6.353 -16.538 1.00 42.31 C ATOM 1902 O LEU A 121 -1.268 -6.457 -17.723 1.00 2.41 O ATOM 1903 CB LEU A 121 -2.531 -4.876 -15.277 1.00 52.10 C ATOM 1904 CG LEU A 121 -3.959 -4.727 -14.734 1.00 24.34 C ATOM 1905 CD1 LEU A 121 -4.062 -5.232 -13.303 1.00 0.24 C ATOM 1906 CD2 LEU A 121 -4.406 -3.276 -14.816 1.00 13.33 C ATOM 0 H LEU A 121 -0.958 -6.236 -13.652 1.00 60.54 H new ATOM 0 HA LEU A 121 -2.865 -6.939 -15.777 1.00 32.24 H new ATOM 0 HB2 LEU A 121 -1.850 -4.357 -14.602 1.00 52.10 H new ATOM 0 HB3 LEU A 121 -2.474 -4.368 -16.240 1.00 52.10 H new ATOM 0 HG LEU A 121 -4.618 -5.336 -15.352 1.00 24.34 H new ATOM 0 HD11 LEU A 121 -5.086 -5.113 -12.948 1.00 0.24 H new ATOM 0 HD12 LEU A 121 -3.787 -6.286 -13.268 1.00 0.24 H new ATOM 0 HD13 LEU A 121 -3.388 -4.660 -12.666 1.00 0.24 H new ATOM 0 HD21 LEU A 121 -5.420 -3.185 -14.428 1.00 13.33 H new ATOM 0 HD22 LEU A 121 -3.734 -2.654 -14.224 1.00 13.33 H new ATOM 0 HD23 LEU A 121 -4.385 -2.947 -15.855 1.00 13.33 H new ATOM 1918 N GLY A 122 0.297 -6.277 -16.127 1.00 3.25 N ATOM 1919 CA GLY A 122 1.380 -6.212 -17.085 1.00 73.42 C ATOM 1920 C GLY A 122 1.728 -4.779 -17.418 1.00 14.25 C ATOM 1921 O GLY A 122 1.898 -4.417 -18.581 1.00 11.34 O ATOM 0 H GLY A 122 0.586 -6.259 -15.149 1.00 3.25 H new ATOM 0 HA2 GLY A 122 2.257 -6.718 -16.682 1.00 73.42 H new ATOM 0 HA3 GLY A 122 1.097 -6.741 -17.995 1.00 73.42 H new ATOM 1925 N LEU A 123 1.843 -3.963 -16.380 1.00 0.24 N ATOM 1926 CA LEU A 123 2.098 -2.537 -16.536 1.00 12.44 C ATOM 1927 C LEU A 123 3.592 -2.253 -16.627 1.00 62.12 C ATOM 1928 O LEU A 123 4.036 -1.129 -16.391 1.00 21.22 O ATOM 1929 CB LEU A 123 1.490 -1.778 -15.358 1.00 63.52 C ATOM 1930 CG LEU A 123 -0.032 -1.860 -15.254 1.00 64.53 C ATOM 1931 CD1 LEU A 123 -0.493 -1.418 -13.878 1.00 21.22 C ATOM 1932 CD2 LEU A 123 -0.688 -1.007 -16.328 1.00 55.34 C ATOM 0 H LEU A 123 1.763 -4.268 -15.410 1.00 0.24 H new ATOM 0 HA LEU A 123 1.636 -2.202 -17.464 1.00 12.44 H new ATOM 0 HB2 LEU A 123 1.924 -2.162 -14.435 1.00 63.52 H new ATOM 0 HB3 LEU A 123 1.778 -0.729 -15.433 1.00 63.52 H new ATOM 0 HG LEU A 123 -0.331 -2.897 -15.406 1.00 64.53 H new ATOM 0 HD11 LEU A 123 -1.580 -1.482 -13.820 1.00 21.22 H new ATOM 0 HD12 LEU A 123 -0.050 -2.065 -13.121 1.00 21.22 H new ATOM 0 HD13 LEU A 123 -0.181 -0.388 -13.703 1.00 21.22 H new ATOM 0 HD21 LEU A 123 -1.772 -1.078 -16.238 1.00 55.34 H new ATOM 0 HD22 LEU A 123 -0.381 0.032 -16.205 1.00 55.34 H new ATOM 0 HD23 LEU A 123 -0.382 -1.362 -17.312 1.00 55.34 H new ATOM 1944 N GLU A 124 4.358 -3.273 -16.983 1.00 72.40 N ATOM 1945 CA GLU A 124 5.801 -3.142 -17.125 1.00 53.04 C ATOM 1946 C GLU A 124 6.155 -2.493 -18.459 1.00 0.40 C ATOM 1947 O GLU A 124 7.317 -2.185 -18.720 1.00 70.43 O ATOM 1948 CB GLU A 124 6.480 -4.505 -16.993 1.00 64.35 C ATOM 1949 CG GLU A 124 6.244 -5.169 -15.645 1.00 64.50 C ATOM 1950 CD GLU A 124 6.582 -4.258 -14.481 1.00 1.25 C ATOM 1951 OE1 GLU A 124 7.780 -4.100 -14.166 1.00 31.11 O ATOM 1952 OE2 GLU A 124 5.651 -3.683 -13.883 1.00 71.21 O ATOM 0 H GLU A 124 4.001 -4.208 -17.180 1.00 72.40 H new ATOM 0 HA GLU A 124 6.166 -2.498 -16.325 1.00 53.04 H new ATOM 0 HB2 GLU A 124 6.115 -5.162 -17.782 1.00 64.35 H new ATOM 0 HB3 GLU A 124 7.552 -4.385 -17.148 1.00 64.35 H new ATOM 0 HG2 GLU A 124 5.200 -5.474 -15.572 1.00 64.50 H new ATOM 0 HG3 GLU A 124 6.846 -6.075 -15.580 1.00 64.50 H new ATOM 1959 N SER A 125 5.141 -2.304 -19.304 1.00 34.23 N ATOM 1960 CA SER A 125 5.315 -1.640 -20.590 1.00 33.21 C ATOM 1961 C SER A 125 5.874 -0.225 -20.405 1.00 44.34 C ATOM 1962 O SER A 125 6.553 0.310 -21.285 1.00 63.14 O ATOM 1963 CB SER A 125 3.976 -1.584 -21.322 1.00 22.33 C ATOM 1964 OG SER A 125 3.384 -2.872 -21.393 1.00 20.21 O ATOM 0 H SER A 125 4.185 -2.605 -19.116 1.00 34.23 H new ATOM 0 HA SER A 125 6.030 -2.211 -21.183 1.00 33.21 H new ATOM 0 HB2 SER A 125 3.304 -0.898 -20.807 1.00 22.33 H new ATOM 0 HB3 SER A 125 4.123 -1.191 -22.328 1.00 22.33 H new ATOM 0 HG SER A 125 3.434 -3.205 -22.313 1.00 20.21 H new ATOM 1970 N LEU A 126 5.575 0.372 -19.256 1.00 22.21 N ATOM 1971 CA LEU A 126 6.109 1.676 -18.903 1.00 4.31 C ATOM 1972 C LEU A 126 6.343 1.765 -17.403 1.00 44.25 C ATOM 1973 O LEU A 126 6.312 0.759 -16.691 1.00 23.42 O ATOM 1974 CB LEU A 126 5.173 2.803 -19.350 1.00 40.43 C ATOM 1975 CG LEU A 126 5.677 3.636 -20.528 1.00 44.11 C ATOM 1976 CD1 LEU A 126 4.761 4.822 -20.774 1.00 13.13 C ATOM 1977 CD2 LEU A 126 7.099 4.109 -20.280 1.00 42.15 C ATOM 0 H LEU A 126 4.960 -0.033 -18.550 1.00 22.21 H new ATOM 0 HA LEU A 126 7.059 1.795 -19.423 1.00 4.31 H new ATOM 0 HB2 LEU A 126 4.210 2.369 -19.618 1.00 40.43 H new ATOM 0 HB3 LEU A 126 4.999 3.467 -18.503 1.00 40.43 H new ATOM 0 HG LEU A 126 5.673 3.006 -21.417 1.00 44.11 H new ATOM 0 HD11 LEU A 126 5.136 5.403 -21.616 1.00 13.13 H new ATOM 0 HD12 LEU A 126 3.756 4.465 -20.998 1.00 13.13 H new ATOM 0 HD13 LEU A 126 4.732 5.450 -19.884 1.00 13.13 H new ATOM 0 HD21 LEU A 126 7.439 4.700 -21.130 1.00 42.15 H new ATOM 0 HD22 LEU A 126 7.127 4.721 -19.378 1.00 42.15 H new ATOM 0 HD23 LEU A 126 7.753 3.246 -20.153 1.00 42.15 H new ATOM 1989 N PHE A 127 6.563 2.977 -16.934 1.00 43.34 N ATOM 1990 CA PHE A 127 6.882 3.208 -15.540 1.00 3.13 C ATOM 1991 C PHE A 127 5.664 3.761 -14.812 1.00 33.10 C ATOM 1992 O PHE A 127 4.838 4.450 -15.411 1.00 32.32 O ATOM 1993 CB PHE A 127 8.051 4.190 -15.436 1.00 30.23 C ATOM 1994 CG PHE A 127 8.782 4.126 -14.126 1.00 43.22 C ATOM 1995 CD1 PHE A 127 9.638 3.071 -13.851 1.00 21.23 C ATOM 1996 CD2 PHE A 127 8.618 5.118 -13.171 1.00 34.42 C ATOM 1997 CE1 PHE A 127 10.315 3.006 -12.649 1.00 12.21 C ATOM 1998 CE2 PHE A 127 9.292 5.058 -11.967 1.00 4.44 C ATOM 1999 CZ PHE A 127 10.142 4.000 -11.706 1.00 30.40 C ATOM 0 H PHE A 127 6.526 3.823 -17.503 1.00 43.34 H new ATOM 0 HA PHE A 127 7.168 2.264 -15.075 1.00 3.13 H new ATOM 0 HB2 PHE A 127 8.755 3.990 -16.244 1.00 30.23 H new ATOM 0 HB3 PHE A 127 7.677 5.203 -15.583 1.00 30.23 H new ATOM 0 HD1 PHE A 127 9.777 2.291 -14.585 1.00 21.23 H new ATOM 0 HD2 PHE A 127 7.956 5.947 -13.371 1.00 34.42 H new ATOM 0 HE1 PHE A 127 10.979 2.179 -12.447 1.00 12.21 H new ATOM 0 HE2 PHE A 127 9.155 5.836 -11.231 1.00 4.44 H new ATOM 0 HZ PHE A 127 10.670 3.951 -10.765 1.00 30.40 H new ATOM 2009 N GLN A 128 5.543 3.442 -13.533 1.00 62.50 N ATOM 2010 CA GLN A 128 4.456 3.968 -12.720 1.00 34.32 C ATOM 2011 C GLN A 128 4.771 5.385 -12.264 1.00 53.11 C ATOM 2012 O GLN A 128 5.809 5.638 -11.652 1.00 21.53 O ATOM 2013 CB GLN A 128 4.193 3.055 -11.514 1.00 13.51 C ATOM 2014 CG GLN A 128 3.146 3.588 -10.540 1.00 52.41 C ATOM 2015 CD GLN A 128 3.745 4.408 -9.404 1.00 4.14 C ATOM 2016 OE1 GLN A 128 3.121 5.340 -8.895 1.00 21.31 O ATOM 2017 NE2 GLN A 128 4.956 4.061 -8.991 1.00 61.45 N ATOM 0 H GLN A 128 6.183 2.822 -13.035 1.00 62.50 H new ATOM 0 HA GLN A 128 3.552 3.997 -13.329 1.00 34.32 H new ATOM 0 HB2 GLN A 128 3.872 2.078 -11.876 1.00 13.51 H new ATOM 0 HB3 GLN A 128 5.129 2.904 -10.976 1.00 13.51 H new ATOM 0 HG2 GLN A 128 2.431 4.204 -11.086 1.00 52.41 H new ATOM 0 HG3 GLN A 128 2.590 2.750 -10.120 1.00 52.41 H new ATOM 0 HE21 GLN A 128 5.443 3.283 -9.436 1.00 61.45 H new ATOM 0 HE22 GLN A 128 5.400 4.572 -8.228 1.00 61.45 H new ATOM 2026 N VAL A 129 3.873 6.301 -12.578 1.00 25.14 N ATOM 2027 CA VAL A 129 4.016 7.686 -12.175 1.00 52.12 C ATOM 2028 C VAL A 129 2.802 8.089 -11.351 1.00 43.12 C ATOM 2029 O VAL A 129 1.674 7.752 -11.698 1.00 62.40 O ATOM 2030 CB VAL A 129 4.161 8.627 -13.397 1.00 21.21 C ATOM 2031 CG1 VAL A 129 4.305 10.078 -12.958 1.00 24.41 C ATOM 2032 CG2 VAL A 129 5.351 8.214 -14.257 1.00 33.31 C ATOM 0 H VAL A 129 3.029 6.106 -13.117 1.00 25.14 H new ATOM 0 HA VAL A 129 4.925 7.780 -11.580 1.00 52.12 H new ATOM 0 HB VAL A 129 3.253 8.540 -13.994 1.00 21.21 H new ATOM 0 HG11 VAL A 129 4.405 10.716 -13.836 1.00 24.41 H new ATOM 0 HG12 VAL A 129 3.423 10.376 -12.392 1.00 24.41 H new ATOM 0 HG13 VAL A 129 5.191 10.182 -12.331 1.00 24.41 H new ATOM 0 HG21 VAL A 129 5.435 8.888 -15.110 1.00 33.31 H new ATOM 0 HG22 VAL A 129 6.264 8.265 -13.663 1.00 33.31 H new ATOM 0 HG23 VAL A 129 5.206 7.194 -14.613 1.00 33.31 H new ATOM 2042 N GLN A 130 3.028 8.785 -10.254 1.00 63.23 N ATOM 2043 CA GLN A 130 1.940 9.161 -9.368 1.00 74.31 C ATOM 2044 C GLN A 130 1.788 10.672 -9.288 1.00 2.30 C ATOM 2045 O GLN A 130 2.750 11.421 -9.470 1.00 14.32 O ATOM 2046 CB GLN A 130 2.153 8.562 -7.976 1.00 2.21 C ATOM 2047 CG GLN A 130 3.579 8.674 -7.473 1.00 72.24 C ATOM 2048 CD GLN A 130 3.772 7.979 -6.143 1.00 45.13 C ATOM 2049 OE1 GLN A 130 3.655 8.593 -5.084 1.00 2.30 O ATOM 2050 NE2 GLN A 130 4.047 6.685 -6.188 1.00 61.42 N ATOM 0 H GLN A 130 3.950 9.101 -9.954 1.00 63.23 H new ATOM 0 HA GLN A 130 1.015 8.758 -9.781 1.00 74.31 H new ATOM 0 HB2 GLN A 130 1.489 9.061 -7.270 1.00 2.21 H new ATOM 0 HB3 GLN A 130 1.866 7.511 -7.995 1.00 2.21 H new ATOM 0 HG2 GLN A 130 4.257 8.242 -8.209 1.00 72.24 H new ATOM 0 HG3 GLN A 130 3.846 9.726 -7.373 1.00 72.24 H new ATOM 0 HE21 GLN A 130 4.136 6.213 -7.088 1.00 61.42 H new ATOM 0 HE22 GLN A 130 4.170 6.159 -5.323 1.00 61.42 H new ATOM 2059 N ALA A 131 0.565 11.104 -9.028 1.00 63.43 N ATOM 2060 CA ALA A 131 0.245 12.516 -8.931 1.00 32.44 C ATOM 2061 C ALA A 131 -0.710 12.751 -7.771 1.00 12.54 C ATOM 2062 O ALA A 131 -1.477 11.857 -7.402 1.00 14.13 O ATOM 2063 CB ALA A 131 -0.361 13.016 -10.235 1.00 21.32 C ATOM 0 H ALA A 131 -0.232 10.485 -8.879 1.00 63.43 H new ATOM 0 HA ALA A 131 1.163 13.075 -8.748 1.00 32.44 H new ATOM 0 HB1 ALA A 131 -0.595 14.077 -10.144 1.00 21.32 H new ATOM 0 HB2 ALA A 131 0.351 12.870 -11.047 1.00 21.32 H new ATOM 0 HB3 ALA A 131 -1.274 12.460 -10.449 1.00 21.32 H new ATOM 2069 N SER A 132 -0.658 13.941 -7.195 1.00 43.42 N ATOM 2070 CA SER A 132 -1.496 14.265 -6.048 1.00 60.11 C ATOM 2071 C SER A 132 -2.883 14.740 -6.484 1.00 42.30 C ATOM 2072 O SER A 132 -3.842 13.968 -6.475 1.00 10.34 O ATOM 2073 CB SER A 132 -0.824 15.330 -5.179 1.00 34.14 C ATOM 2074 OG SER A 132 0.471 14.915 -4.775 1.00 54.30 O ATOM 0 H SER A 132 -0.047 14.698 -7.501 1.00 43.42 H new ATOM 0 HA SER A 132 -1.621 13.354 -5.462 1.00 60.11 H new ATOM 0 HB2 SER A 132 -0.753 16.265 -5.734 1.00 34.14 H new ATOM 0 HB3 SER A 132 -1.437 15.527 -4.300 1.00 34.14 H new ATOM 0 HG SER A 132 0.881 15.613 -4.222 1.00 54.30 H new ATOM 2080 N GLU A 133 -2.988 16.007 -6.872 1.00 25.43 N ATOM 2081 CA GLU A 133 -4.279 16.585 -7.214 1.00 21.44 C ATOM 2082 C GLU A 133 -4.306 17.124 -8.647 1.00 64.12 C ATOM 2083 O GLU A 133 -3.393 16.869 -9.435 1.00 50.11 O ATOM 2084 CB GLU A 133 -4.673 17.664 -6.191 1.00 4.12 C ATOM 2085 CG GLU A 133 -3.531 18.564 -5.741 1.00 20.10 C ATOM 2086 CD GLU A 133 -3.094 19.545 -6.805 1.00 71.40 C ATOM 2087 OE1 GLU A 133 -3.672 20.649 -6.875 1.00 60.21 O ATOM 2088 OE2 GLU A 133 -2.175 19.219 -7.574 1.00 50.31 O ATOM 0 H GLU A 133 -2.199 16.648 -6.957 1.00 25.43 H new ATOM 0 HA GLU A 133 -5.023 15.789 -7.171 1.00 21.44 H new ATOM 0 HB2 GLU A 133 -5.458 18.285 -6.623 1.00 4.12 H new ATOM 0 HB3 GLU A 133 -5.099 17.176 -5.315 1.00 4.12 H new ATOM 0 HG2 GLU A 133 -3.839 19.115 -4.852 1.00 20.10 H new ATOM 0 HG3 GLU A 133 -2.680 17.946 -5.454 1.00 20.10 H new ATOM 2095 N MET A 134 -5.360 17.872 -8.966 1.00 42.11 N ATOM 2096 CA MET A 134 -5.643 18.302 -10.338 1.00 54.23 C ATOM 2097 C MET A 134 -4.520 19.143 -10.952 1.00 0.14 C ATOM 2098 O MET A 134 -4.320 19.114 -12.164 1.00 53.41 O ATOM 2099 CB MET A 134 -6.963 19.080 -10.386 1.00 11.32 C ATOM 2100 CG MET A 134 -6.968 20.340 -9.534 1.00 31.21 C ATOM 2101 SD MET A 134 -8.577 21.147 -9.503 1.00 34.24 S ATOM 2102 CE MET A 134 -8.231 22.540 -8.434 1.00 43.32 C ATOM 0 H MET A 134 -6.043 18.198 -8.282 1.00 42.11 H new ATOM 0 HA MET A 134 -5.721 17.395 -10.937 1.00 54.23 H new ATOM 0 HB2 MET A 134 -7.176 19.352 -11.420 1.00 11.32 H new ATOM 0 HB3 MET A 134 -7.771 18.427 -10.056 1.00 11.32 H new ATOM 0 HG2 MET A 134 -6.673 20.087 -8.516 1.00 31.21 H new ATOM 0 HG3 MET A 134 -6.223 21.037 -9.918 1.00 31.21 H new ATOM 0 HE1 MET A 134 -9.133 23.140 -8.315 1.00 43.32 H new ATOM 0 HE2 MET A 134 -7.905 22.178 -7.459 1.00 43.32 H new ATOM 0 HE3 MET A 134 -7.444 23.151 -8.876 1.00 43.32 H new ATOM 2112 N SER A 135 -3.791 19.884 -10.132 1.00 43.32 N ATOM 2113 CA SER A 135 -2.740 20.752 -10.644 1.00 23.35 C ATOM 2114 C SER A 135 -1.443 19.975 -10.859 1.00 45.31 C ATOM 2115 O SER A 135 -0.595 20.365 -11.663 1.00 32.10 O ATOM 2116 CB SER A 135 -2.505 21.909 -9.677 1.00 42.20 C ATOM 2117 OG SER A 135 -3.718 22.584 -9.391 1.00 62.13 O ATOM 0 H SER A 135 -3.905 19.903 -9.119 1.00 43.32 H new ATOM 0 HA SER A 135 -3.061 21.148 -11.608 1.00 23.35 H new ATOM 0 HB2 SER A 135 -2.067 21.532 -8.753 1.00 42.20 H new ATOM 0 HB3 SER A 135 -1.788 22.608 -10.108 1.00 42.20 H new ATOM 0 HG SER A 135 -4.091 22.244 -8.551 1.00 62.13 H new ATOM 2123 N ASP A 136 -1.298 18.878 -10.131 1.00 64.43 N ATOM 2124 CA ASP A 136 -0.088 18.070 -10.186 1.00 43.41 C ATOM 2125 C ASP A 136 -0.137 17.079 -11.341 1.00 74.50 C ATOM 2126 O ASP A 136 0.890 16.751 -11.930 1.00 65.44 O ATOM 2127 CB ASP A 136 0.105 17.326 -8.864 1.00 11.43 C ATOM 2128 CG ASP A 136 1.407 16.558 -8.814 1.00 65.11 C ATOM 2129 OD1 ASP A 136 2.472 17.172 -9.039 1.00 64.05 O ATOM 2130 OD2 ASP A 136 1.374 15.345 -8.544 1.00 44.41 O ATOM 0 H ASP A 136 -2.009 18.525 -9.491 1.00 64.43 H new ATOM 0 HA ASP A 136 0.757 18.738 -10.351 1.00 43.41 H new ATOM 0 HB2 ASP A 136 0.077 18.041 -8.042 1.00 11.43 H new ATOM 0 HB3 ASP A 136 -0.726 16.636 -8.715 1.00 11.43 H new ATOM 2135 N LEU A 137 -1.340 16.632 -11.683 1.00 4.11 N ATOM 2136 CA LEU A 137 -1.514 15.631 -12.734 1.00 73.04 C ATOM 2137 C LEU A 137 -1.427 16.251 -14.127 1.00 40.23 C ATOM 2138 O LEU A 137 -1.658 15.576 -15.131 1.00 2.24 O ATOM 2139 CB LEU A 137 -2.848 14.884 -12.549 1.00 4.05 C ATOM 2140 CG LEU A 137 -4.110 15.752 -12.425 1.00 45.10 C ATOM 2141 CD1 LEU A 137 -4.572 16.268 -13.782 1.00 63.15 C ATOM 2142 CD2 LEU A 137 -5.227 14.966 -11.753 1.00 51.52 C ATOM 0 H LEU A 137 -2.209 16.945 -11.250 1.00 4.11 H new ATOM 0 HA LEU A 137 -0.697 14.914 -12.648 1.00 73.04 H new ATOM 0 HB2 LEU A 137 -2.981 14.209 -13.394 1.00 4.05 H new ATOM 0 HB3 LEU A 137 -2.771 14.265 -11.655 1.00 4.05 H new ATOM 0 HG LEU A 137 -3.859 16.615 -11.809 1.00 45.10 H new ATOM 0 HD11 LEU A 137 -5.467 16.878 -13.654 1.00 63.15 H new ATOM 0 HD12 LEU A 137 -3.783 16.872 -14.230 1.00 63.15 H new ATOM 0 HD13 LEU A 137 -4.798 15.424 -14.434 1.00 63.15 H new ATOM 0 HD21 LEU A 137 -6.115 15.593 -11.672 1.00 51.52 H new ATOM 0 HD22 LEU A 137 -5.460 14.083 -12.348 1.00 51.52 H new ATOM 0 HD23 LEU A 137 -4.907 14.659 -10.757 1.00 51.52 H new ATOM 2154 N ASP A 138 -1.083 17.531 -14.179 1.00 34.25 N ATOM 2155 CA ASP A 138 -0.948 18.239 -15.445 1.00 15.52 C ATOM 2156 C ASP A 138 0.186 17.635 -16.272 1.00 34.41 C ATOM 2157 O ASP A 138 1.220 17.224 -15.732 1.00 40.22 O ATOM 2158 CB ASP A 138 -0.694 19.731 -15.207 1.00 32.23 C ATOM 2159 CG ASP A 138 -0.799 20.558 -16.478 1.00 1.41 C ATOM 2160 OD1 ASP A 138 0.093 20.449 -17.347 1.00 73.25 O ATOM 2161 OD2 ASP A 138 -1.776 21.326 -16.611 1.00 24.41 O ATOM 0 H ASP A 138 -0.892 18.102 -13.356 1.00 34.25 H new ATOM 0 HA ASP A 138 -1.881 18.133 -15.998 1.00 15.52 H new ATOM 0 HB2 ASP A 138 -1.411 20.105 -14.476 1.00 32.23 H new ATOM 0 HB3 ASP A 138 0.298 19.861 -14.775 1.00 32.23 H new ATOM 2166 N GLU A 139 -0.020 17.590 -17.583 1.00 61.40 N ATOM 2167 CA GLU A 139 0.924 16.981 -18.516 1.00 4.33 C ATOM 2168 C GLU A 139 2.320 17.602 -18.416 1.00 33.24 C ATOM 2169 O GLU A 139 3.302 16.978 -18.821 1.00 64.33 O ATOM 2170 CB GLU A 139 0.399 17.088 -19.948 1.00 44.04 C ATOM 2171 CG GLU A 139 0.274 18.512 -20.460 1.00 31.00 C ATOM 2172 CD GLU A 139 -0.198 18.568 -21.897 1.00 0.30 C ATOM 2173 OE1 GLU A 139 0.262 17.736 -22.707 1.00 22.42 O ATOM 2174 OE2 GLU A 139 -1.015 19.456 -22.220 1.00 64.41 O ATOM 0 H GLU A 139 -0.850 17.976 -18.032 1.00 61.40 H new ATOM 0 HA GLU A 139 1.016 15.930 -18.242 1.00 4.33 H new ATOM 0 HB2 GLU A 139 1.064 16.533 -20.609 1.00 44.04 H new ATOM 0 HB3 GLU A 139 -0.578 16.607 -20.002 1.00 44.04 H new ATOM 0 HG2 GLU A 139 -0.424 19.062 -19.829 1.00 31.00 H new ATOM 0 HG3 GLU A 139 1.239 19.011 -20.378 1.00 31.00 H new ATOM 2181 N LYS A 140 2.392 18.833 -17.893 1.00 54.54 N ATOM 2182 CA LYS A 140 3.656 19.568 -17.751 1.00 24.25 C ATOM 2183 C LYS A 140 4.799 18.695 -17.215 1.00 42.14 C ATOM 2184 O LYS A 140 5.951 18.864 -17.618 1.00 32.21 O ATOM 2185 CB LYS A 140 3.458 20.819 -16.871 1.00 13.42 C ATOM 2186 CG LYS A 140 2.695 20.586 -15.566 1.00 35.03 C ATOM 2187 CD LYS A 140 3.595 20.084 -14.450 1.00 12.51 C ATOM 2188 CE LYS A 140 2.817 19.807 -13.170 1.00 24.10 C ATOM 2189 NZ LYS A 140 3.710 19.356 -12.065 1.00 5.01 N ATOM 0 H LYS A 140 1.577 19.347 -17.557 1.00 54.54 H new ATOM 0 HA LYS A 140 3.953 19.882 -18.752 1.00 24.25 H new ATOM 0 HB2 LYS A 140 4.437 21.233 -16.631 1.00 13.42 H new ATOM 0 HB3 LYS A 140 2.927 21.572 -17.453 1.00 13.42 H new ATOM 0 HG2 LYS A 140 2.220 21.516 -15.255 1.00 35.03 H new ATOM 0 HG3 LYS A 140 1.898 19.863 -15.739 1.00 35.03 H new ATOM 0 HD2 LYS A 140 4.098 19.173 -14.773 1.00 12.51 H new ATOM 0 HD3 LYS A 140 4.371 20.823 -14.250 1.00 12.51 H new ATOM 0 HE2 LYS A 140 2.288 20.709 -12.864 1.00 24.10 H new ATOM 0 HE3 LYS A 140 2.062 19.044 -13.361 1.00 24.10 H new ATOM 0 HZ1 LYS A 140 3.189 18.708 -11.440 1.00 5.01 H new ATOM 0 HZ2 LYS A 140 4.535 18.864 -12.464 1.00 5.01 H new ATOM 0 HZ3 LYS A 140 4.030 20.181 -11.519 1.00 5.01 H new ATOM 2203 N SER A 141 4.487 17.762 -16.323 1.00 42.11 N ATOM 2204 CA SER A 141 5.489 16.827 -15.831 1.00 43.45 C ATOM 2205 C SER A 141 5.242 15.432 -16.390 1.00 71.31 C ATOM 2206 O SER A 141 6.145 14.812 -16.947 1.00 55.12 O ATOM 2207 CB SER A 141 5.489 16.780 -14.302 1.00 64.22 C ATOM 2208 OG SER A 141 5.794 18.050 -13.751 1.00 40.34 O ATOM 0 H SER A 141 3.555 17.634 -15.929 1.00 42.11 H new ATOM 0 HA SER A 141 6.465 17.176 -16.169 1.00 43.45 H new ATOM 0 HB2 SER A 141 4.513 16.451 -13.945 1.00 64.22 H new ATOM 0 HB3 SER A 141 6.218 16.047 -13.958 1.00 64.22 H new ATOM 0 HG SER A 141 6.188 17.934 -12.861 1.00 40.34 H new ATOM 2214 N VAL A 142 4.003 14.962 -16.261 1.00 13.24 N ATOM 2215 CA VAL A 142 3.644 13.597 -16.636 1.00 61.23 C ATOM 2216 C VAL A 142 4.005 13.295 -18.091 1.00 43.45 C ATOM 2217 O VAL A 142 4.788 12.385 -18.367 1.00 2.31 O ATOM 2218 CB VAL A 142 2.136 13.343 -16.424 1.00 44.24 C ATOM 2219 CG1 VAL A 142 1.786 11.887 -16.700 1.00 22.42 C ATOM 2220 CG2 VAL A 142 1.718 13.740 -15.015 1.00 12.12 C ATOM 0 H VAL A 142 3.225 15.512 -15.896 1.00 13.24 H new ATOM 0 HA VAL A 142 4.218 12.933 -15.990 1.00 61.23 H new ATOM 0 HB VAL A 142 1.585 13.962 -17.132 1.00 44.24 H new ATOM 0 HG11 VAL A 142 0.718 11.734 -16.544 1.00 22.42 H new ATOM 0 HG12 VAL A 142 2.041 11.641 -17.731 1.00 22.42 H new ATOM 0 HG13 VAL A 142 2.348 11.243 -16.023 1.00 22.42 H new ATOM 0 HG21 VAL A 142 0.652 13.553 -14.886 1.00 12.12 H new ATOM 0 HG22 VAL A 142 2.280 13.152 -14.289 1.00 12.12 H new ATOM 0 HG23 VAL A 142 1.922 14.799 -14.860 1.00 12.12 H new ATOM 2230 N LYS A 143 3.456 14.085 -19.006 1.00 51.53 N ATOM 2231 CA LYS A 143 3.634 13.860 -20.439 1.00 73.41 C ATOM 2232 C LYS A 143 5.102 14.013 -20.829 1.00 74.20 C ATOM 2233 O LYS A 143 5.640 13.214 -21.596 1.00 52.44 O ATOM 2234 CB LYS A 143 2.743 14.840 -21.225 1.00 64.31 C ATOM 2235 CG LYS A 143 2.797 14.701 -22.746 1.00 43.34 C ATOM 2236 CD LYS A 143 3.941 15.504 -23.352 1.00 2.22 C ATOM 2237 CE LYS A 143 3.805 16.996 -23.069 1.00 34.14 C ATOM 2238 NZ LYS A 143 2.641 17.605 -23.772 1.00 30.23 N ATOM 0 H LYS A 143 2.878 14.895 -18.780 1.00 51.53 H new ATOM 0 HA LYS A 143 3.335 12.841 -20.685 1.00 73.41 H new ATOM 0 HB2 LYS A 143 1.711 14.705 -20.901 1.00 64.31 H new ATOM 0 HB3 LYS A 143 3.030 15.858 -20.960 1.00 64.31 H new ATOM 0 HG2 LYS A 143 2.912 13.650 -23.010 1.00 43.34 H new ATOM 0 HG3 LYS A 143 1.852 15.036 -23.174 1.00 43.34 H new ATOM 0 HD2 LYS A 143 4.889 15.144 -22.951 1.00 2.22 H new ATOM 0 HD3 LYS A 143 3.968 15.340 -24.429 1.00 2.22 H new ATOM 0 HE2 LYS A 143 3.699 17.151 -21.995 1.00 34.14 H new ATOM 0 HE3 LYS A 143 4.718 17.506 -23.376 1.00 34.14 H new ATOM 0 HZ1 LYS A 143 2.732 18.641 -23.761 1.00 30.23 H new ATOM 0 HZ2 LYS A 143 2.616 17.270 -24.756 1.00 30.23 H new ATOM 0 HZ3 LYS A 143 1.761 17.329 -23.290 1.00 30.23 H new ATOM 2252 N SER A 144 5.746 15.033 -20.282 1.00 23.43 N ATOM 2253 CA SER A 144 7.133 15.325 -20.605 1.00 44.40 C ATOM 2254 C SER A 144 8.061 14.198 -20.147 1.00 32.03 C ATOM 2255 O SER A 144 8.994 13.819 -20.861 1.00 44.05 O ATOM 2256 CB SER A 144 7.542 16.640 -19.944 1.00 61.23 C ATOM 2257 OG SER A 144 6.562 17.642 -20.164 1.00 4.14 O ATOM 0 H SER A 144 5.327 15.675 -19.609 1.00 23.43 H new ATOM 0 HA SER A 144 7.224 15.412 -21.688 1.00 44.40 H new ATOM 0 HB2 SER A 144 7.678 16.487 -18.873 1.00 61.23 H new ATOM 0 HB3 SER A 144 8.501 16.970 -20.343 1.00 61.23 H new ATOM 0 HG SER A 144 6.336 18.071 -19.312 1.00 4.14 H new ATOM 2263 N ASP A 145 7.784 13.651 -18.970 1.00 42.00 N ATOM 2264 CA ASP A 145 8.669 12.668 -18.359 1.00 2.24 C ATOM 2265 C ASP A 145 8.454 11.274 -18.950 1.00 33.52 C ATOM 2266 O ASP A 145 9.420 10.573 -19.261 1.00 1.34 O ATOM 2267 CB ASP A 145 8.463 12.646 -16.842 1.00 75.33 C ATOM 2268 CG ASP A 145 9.587 11.941 -16.110 1.00 20.13 C ATOM 2269 OD1 ASP A 145 10.720 12.474 -16.100 1.00 41.11 O ATOM 2270 OD2 ASP A 145 9.345 10.865 -15.528 1.00 63.03 O ATOM 0 H ASP A 145 6.954 13.871 -18.420 1.00 42.00 H new ATOM 0 HA ASP A 145 9.697 12.961 -18.574 1.00 2.24 H new ATOM 0 HB2 ASP A 145 8.382 13.669 -16.476 1.00 75.33 H new ATOM 0 HB3 ASP A 145 7.519 12.150 -16.615 1.00 75.33 H new ATOM 2275 N LEU A 146 7.190 10.883 -19.137 1.00 43.13 N ATOM 2276 CA LEU A 146 6.873 9.542 -19.640 1.00 53.21 C ATOM 2277 C LEU A 146 7.452 9.337 -21.036 1.00 44.40 C ATOM 2278 O LEU A 146 7.817 8.222 -21.408 1.00 61.12 O ATOM 2279 CB LEU A 146 5.349 9.281 -19.631 1.00 72.30 C ATOM 2280 CG LEU A 146 4.483 10.106 -20.604 1.00 72.35 C ATOM 2281 CD1 LEU A 146 4.464 9.487 -21.997 1.00 64.10 C ATOM 2282 CD2 LEU A 146 3.062 10.229 -20.075 1.00 60.43 C ATOM 0 H LEU A 146 6.376 11.469 -18.950 1.00 43.13 H new ATOM 0 HA LEU A 146 7.335 8.818 -18.969 1.00 53.21 H new ATOM 0 HB2 LEU A 146 5.187 8.225 -19.848 1.00 72.30 H new ATOM 0 HB3 LEU A 146 4.983 9.459 -18.620 1.00 72.30 H new ATOM 0 HG LEU A 146 4.927 11.099 -20.679 1.00 72.35 H new ATOM 0 HD11 LEU A 146 3.844 10.094 -22.657 1.00 64.10 H new ATOM 0 HD12 LEU A 146 5.480 9.445 -22.390 1.00 64.10 H new ATOM 0 HD13 LEU A 146 4.054 8.478 -21.941 1.00 64.10 H new ATOM 0 HD21 LEU A 146 2.463 10.814 -20.773 1.00 60.43 H new ATOM 0 HD22 LEU A 146 2.627 9.236 -19.968 1.00 60.43 H new ATOM 0 HD23 LEU A 146 3.077 10.726 -19.105 1.00 60.43 H new ATOM 2294 N MET A 147 7.551 10.429 -21.788 1.00 1.41 N ATOM 2295 CA MET A 147 8.076 10.398 -23.147 1.00 1.43 C ATOM 2296 C MET A 147 9.509 9.873 -23.171 1.00 45.15 C ATOM 2297 O MET A 147 9.905 9.150 -24.083 1.00 1.10 O ATOM 2298 CB MET A 147 8.019 11.802 -23.748 1.00 12.40 C ATOM 2299 CG MET A 147 8.533 11.889 -25.173 1.00 43.35 C ATOM 2300 SD MET A 147 8.463 13.572 -25.815 1.00 70.31 S ATOM 2301 CE MET A 147 6.706 13.905 -25.679 1.00 43.43 C ATOM 0 H MET A 147 7.270 11.357 -21.473 1.00 1.41 H new ATOM 0 HA MET A 147 7.462 9.722 -23.741 1.00 1.43 H new ATOM 0 HB2 MET A 147 6.988 12.154 -23.723 1.00 12.40 H new ATOM 0 HB3 MET A 147 8.602 12.477 -23.121 1.00 12.40 H new ATOM 0 HG2 MET A 147 9.561 11.529 -25.210 1.00 43.35 H new ATOM 0 HG3 MET A 147 7.943 11.232 -25.812 1.00 43.35 H new ATOM 0 HE1 MET A 147 6.364 14.425 -26.574 1.00 43.43 H new ATOM 0 HE2 MET A 147 6.164 12.965 -25.576 1.00 43.43 H new ATOM 0 HE3 MET A 147 6.520 14.528 -24.804 1.00 43.43 H new ATOM 2311 N SER A 148 10.277 10.231 -22.154 1.00 31.23 N ATOM 2312 CA SER A 148 11.655 9.786 -22.054 1.00 11.52 C ATOM 2313 C SER A 148 11.706 8.365 -21.503 1.00 62.45 C ATOM 2314 O SER A 148 12.443 7.517 -21.999 1.00 63.13 O ATOM 2315 CB SER A 148 12.453 10.744 -21.157 1.00 62.10 C ATOM 2316 OG SER A 148 13.816 10.352 -21.049 1.00 11.34 O ATOM 0 H SER A 148 9.968 10.828 -21.387 1.00 31.23 H new ATOM 0 HA SER A 148 12.104 9.788 -23.047 1.00 11.52 H new ATOM 0 HB2 SER A 148 12.396 11.754 -21.562 1.00 62.10 H new ATOM 0 HB3 SER A 148 12.003 10.773 -20.165 1.00 62.10 H new ATOM 0 HG SER A 148 14.294 10.984 -20.473 1.00 11.34 H new ATOM 2322 N ASN A 149 10.874 8.095 -20.507 1.00 42.04 N ATOM 2323 CA ASN A 149 10.914 6.819 -19.794 1.00 60.34 C ATOM 2324 C ASN A 149 10.410 5.662 -20.654 1.00 61.42 C ATOM 2325 O ASN A 149 10.466 4.507 -20.229 1.00 53.24 O ATOM 2326 CB ASN A 149 10.074 6.888 -18.520 1.00 3.10 C ATOM 2327 CG ASN A 149 10.501 7.991 -17.570 1.00 43.03 C ATOM 2328 OD1 ASN A 149 11.677 8.349 -17.494 1.00 14.15 O ATOM 2329 ND2 ASN A 149 9.539 8.535 -16.840 1.00 23.23 N ATOM 0 H ASN A 149 10.160 8.742 -20.171 1.00 42.04 H new ATOM 0 HA ASN A 149 11.959 6.635 -19.544 1.00 60.34 H new ATOM 0 HB2 ASN A 149 9.029 7.038 -18.791 1.00 3.10 H new ATOM 0 HB3 ASN A 149 10.135 5.931 -18.003 1.00 3.10 H new ATOM 0 HD21 ASN A 149 9.759 9.282 -16.182 1.00 23.23 H new ATOM 0 HD22 ASN A 149 8.578 8.207 -16.936 1.00 23.23 H new ATOM 2336 N GLN A 150 9.923 5.974 -21.855 1.00 12.42 N ATOM 2337 CA GLN A 150 9.367 4.968 -22.761 1.00 14.54 C ATOM 2338 C GLN A 150 10.331 3.805 -22.990 1.00 33.13 C ATOM 2339 O GLN A 150 9.908 2.653 -23.082 1.00 20.40 O ATOM 2340 CB GLN A 150 8.978 5.609 -24.094 1.00 13.53 C ATOM 2341 CG GLN A 150 7.663 6.374 -24.030 1.00 52.10 C ATOM 2342 CD GLN A 150 7.434 7.274 -25.229 1.00 11.45 C ATOM 2343 OE1 GLN A 150 6.814 8.326 -25.116 1.00 30.52 O ATOM 2344 NE2 GLN A 150 7.924 6.863 -26.388 1.00 34.04 N ATOM 0 H GLN A 150 9.902 6.924 -22.226 1.00 12.42 H new ATOM 0 HA GLN A 150 8.474 4.561 -22.286 1.00 14.54 H new ATOM 0 HB2 GLN A 150 9.771 6.288 -24.409 1.00 13.53 H new ATOM 0 HB3 GLN A 150 8.903 4.832 -24.855 1.00 13.53 H new ATOM 0 HG2 GLN A 150 6.840 5.663 -23.956 1.00 52.10 H new ATOM 0 HG3 GLN A 150 7.646 6.978 -23.123 1.00 52.10 H new ATOM 0 HE21 GLN A 150 8.434 5.982 -26.442 1.00 34.04 H new ATOM 0 HE22 GLN A 150 7.791 7.428 -27.227 1.00 34.04 H new ATOM 2353 N ARG A 151 11.620 4.101 -23.081 1.00 23.30 N ATOM 2354 CA ARG A 151 12.624 3.051 -23.203 1.00 42.54 C ATOM 2355 C ARG A 151 13.956 3.502 -22.610 1.00 64.43 C ATOM 2356 O ARG A 151 14.973 2.825 -22.753 1.00 32.12 O ATOM 2357 CB ARG A 151 12.804 2.635 -24.669 1.00 24.30 C ATOM 2358 CG ARG A 151 13.377 3.723 -25.561 1.00 51.20 C ATOM 2359 CD ARG A 151 13.528 3.236 -26.994 1.00 5.41 C ATOM 2360 NE ARG A 151 14.314 2.003 -27.079 1.00 73.22 N ATOM 2361 CZ ARG A 151 15.279 1.788 -27.974 1.00 30.21 C ATOM 2362 NH1 ARG A 151 15.583 2.718 -28.868 1.00 71.12 N ATOM 2363 NH2 ARG A 151 15.935 0.636 -27.973 1.00 71.35 N ATOM 0 H ARG A 151 11.994 5.050 -23.073 1.00 23.30 H new ATOM 0 HA ARG A 151 12.274 2.185 -22.641 1.00 42.54 H new ATOM 0 HB2 ARG A 151 13.459 1.765 -24.710 1.00 24.30 H new ATOM 0 HB3 ARG A 151 11.838 2.325 -25.068 1.00 24.30 H new ATOM 0 HG2 ARG A 151 12.726 4.597 -25.538 1.00 51.20 H new ATOM 0 HG3 ARG A 151 14.347 4.038 -25.177 1.00 51.20 H new ATOM 0 HD2 ARG A 151 12.541 3.066 -27.424 1.00 5.41 H new ATOM 0 HD3 ARG A 151 14.007 4.012 -27.591 1.00 5.41 H new ATOM 0 HE ARG A 151 14.110 1.260 -26.410 1.00 73.22 H new ATOM 0 HH11 ARG A 151 15.078 3.604 -28.874 1.00 71.12 H new ATOM 0 HH12 ARG A 151 16.322 2.548 -29.550 1.00 71.12 H new ATOM 0 HH21 ARG A 151 15.701 -0.083 -27.289 1.00 71.35 H new ATOM 0 HH22 ARG A 151 16.673 0.469 -28.656 1.00 71.35 H new ATOM 2377 N ILE A 152 13.941 4.640 -21.935 1.00 52.35 N ATOM 2378 CA ILE A 152 15.144 5.188 -21.336 1.00 54.31 C ATOM 2379 C ILE A 152 15.109 4.994 -19.824 1.00 21.45 C ATOM 2380 O ILE A 152 15.766 4.062 -19.330 1.00 53.24 O ATOM 2381 CB ILE A 152 15.288 6.690 -21.669 1.00 25.03 C ATOM 2382 CG1 ILE A 152 15.385 6.894 -23.182 1.00 75.25 C ATOM 2383 CG2 ILE A 152 16.499 7.286 -20.972 1.00 25.34 C ATOM 2384 CD1 ILE A 152 15.218 8.336 -23.610 1.00 10.22 C ATOM 2385 OXT ILE A 152 14.413 5.773 -19.137 1.00 0.00 O ATOM 0 H ILE A 152 13.104 5.204 -21.789 1.00 52.35 H new ATOM 0 HA ILE A 152 16.003 4.659 -21.748 1.00 54.31 H new ATOM 0 HB ILE A 152 14.400 7.207 -21.305 1.00 25.03 H new ATOM 0 HG12 ILE A 152 16.353 6.531 -23.528 1.00 75.25 H new ATOM 0 HG13 ILE A 152 14.623 6.288 -23.672 1.00 75.25 H new ATOM 0 HG21 ILE A 152 16.579 8.344 -21.222 1.00 25.34 H new ATOM 0 HG22 ILE A 152 16.389 7.176 -19.893 1.00 25.34 H new ATOM 0 HG23 ILE A 152 17.400 6.767 -21.300 1.00 25.34 H new ATOM 0 HD11 ILE A 152 15.298 8.405 -24.695 1.00 10.22 H new ATOM 0 HD12 ILE A 152 14.239 8.698 -23.295 1.00 10.22 H new ATOM 0 HD13 ILE A 152 15.996 8.945 -23.149 1.00 10.22 H new TER 2397 ILE A 152