USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=47 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+ -170:sc= 1.02 (180deg=0.107) USER MOD Set 1.2: A 141 SER OG : rot -146:sc= 0.0579 USER MOD Set 2.1: A 96 GLN : amide:sc= 0.56 K(o=0.89,f=0.18) USER MOD Set 2.2: A 98 CYS SG : rot 43:sc= 0.33 USER MOD Set 3.1: A 1 MET N :NH3+ -170:sc= 1.18 (180deg=-0.123) USER MOD Set 3.2: A 112 SER OG : rot 89:sc= 1.73 USER MOD Single : A 1 MET CE :methyl 161:sc= -0.123 (180deg=-0.657) USER MOD Single : A 3 SER OG : rot 120:sc= 0.134 USER MOD Single : A 6 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0474) USER MOD Single : A 10 SER OG : rot 94:sc= 1.25 USER MOD Single : A 11 CYS SG : rot -14:sc= 0.399 USER MOD Single : A 12 LYS NZ :NH3+ -166:sc= 0.805 (180deg=0.417) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 15 TYR OH : rot -173:sc= -2.37! USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS : no HD1:sc= 0.101 K(o=0.1,f=-3.7!) USER MOD Single : A 23 GLN : amide:sc= 0.375 X(o=0.37,f=-0.053) USER MOD Single : A 24 HIS : no HE2:sc= 0.086 X(o=0.086,f=-0.41) USER MOD Single : A 25 SER OG : rot 180:sc= -0.308 USER MOD Single : A 26 TYR OH : rot 159:sc= -0.0635 USER MOD Single : A 30 LYS NZ :NH3+ -176:sc= 0.965 (180deg=0.792) USER MOD Single : A 33 LYS NZ :NH3+ 162:sc= -0.233 (180deg=-0.708) USER MOD Single : A 34 ASN : amide:sc=-0.00378 X(o=-0.0038,f=-0.0038) USER MOD Single : A 36 THR OG1 : rot 13:sc= 0.867 USER MOD Single : A 42 LYS NZ :NH3+ -169:sc= 2.42 (180deg=2.22) USER MOD Single : A 46 LYS NZ :NH3+ -171:sc= 0.558 (180deg=0.437) USER MOD Single : A 47 ASN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 50 TYR OH : rot 180:sc=-0.00764 USER MOD Single : A 57 MET CE :methyl 180:sc= -0.0574 (180deg=-0.0574) USER MOD Single : A 58 LYS NZ :NH3+ 156:sc= -0.189 (180deg=-1.36!) USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= 0.995 (180deg=0.614) USER MOD Single : A 65 LYS NZ :NH3+ 160:sc= -0.0599 (180deg=-0.34) USER MOD Single : A 67 CYS SG : rot 180:sc= -0.0575 USER MOD Single : A 69 TYR OH : rot 180:sc= -0.296 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.557 USER MOD Single : A 79 GLN : amide:sc= 0.741 K(o=0.74,f=-0.81) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 THR OG1 : rot 40:sc= 0.23 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 36:sc= 0.467 USER MOD Single : A 90 ASN : amide:sc= -2.22! C(o=-2.2!,f=-4.7!) USER MOD Single : A 91 LYS NZ :NH3+ 159:sc= -0.0304 (180deg=-0.333) USER MOD Single : A 97 TYR OH : rot 170:sc= 0.378 USER MOD Single : A 101 ASN : amide:sc= -0.0841 X(o=-0.084,f=-0.36) USER MOD Single : A 108 MET CE :methyl -161:sc= -0.124 (180deg=-0.594) USER MOD Single : A 110 TYR OH : rot -86:sc= 0.455 USER MOD Single : A 113 SER OG : rot -2:sc= 0.51 USER MOD Single : A 118 LYS NZ :NH3+ 166:sc= -1.02! (180deg=-2.15!) USER MOD Single : A 120 SER OG : rot -110:sc= -0.0957 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-2.2) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 SER OG : rot -52:sc= 0.941 USER MOD Single : A 134 MET CE :methyl -133:sc= -0.128 (180deg=-0.59) USER MOD Single : A 135 SER OG : rot 114:sc= 1.31 USER MOD Single : A 143 LYS NZ :NH3+ -145:sc= 1.24 (180deg=0.419) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 147 MET CE :methyl -140:sc= -0.254 (180deg=-1.06) USER MOD Single : A 148 SER OG : rot 180:sc= -0.0397 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 150 GLN :FLIP amide:sc= -4.24 F(o=-5.3!,f=-4.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.482 -0.141 1.029 1.00 32.41 N ATOM 2 CA MET A 1 1.246 -0.874 -0.009 1.00 72.41 C ATOM 3 C MET A 1 1.433 -2.325 0.410 1.00 72.03 C ATOM 4 O MET A 1 2.234 -2.627 1.295 1.00 32.14 O ATOM 5 CB MET A 1 2.608 -0.216 -0.241 1.00 32.21 C ATOM 6 CG MET A 1 2.515 1.179 -0.839 1.00 51.41 C ATOM 7 SD MET A 1 4.129 1.946 -1.082 1.00 61.14 S ATOM 8 CE MET A 1 4.884 0.799 -2.232 1.00 74.23 C ATOM 0 H1 MET A 1 0.212 0.795 0.665 1.00 32.41 H new ATOM 0 H2 MET A 1 -0.375 -0.678 1.273 1.00 32.41 H new ATOM 0 H3 MET A 1 1.072 -0.026 1.878 1.00 32.41 H new ATOM 0 HA MET A 1 0.683 -0.841 -0.942 1.00 72.41 H new ATOM 0 HB2 MET A 1 3.142 -0.161 0.708 1.00 32.21 H new ATOM 0 HB3 MET A 1 3.199 -0.848 -0.904 1.00 32.21 H new ATOM 0 HG2 MET A 1 1.996 1.125 -1.796 1.00 51.41 H new ATOM 0 HG3 MET A 1 1.913 1.810 -0.185 1.00 51.41 H new ATOM 0 HE1 MET A 1 5.721 1.285 -2.734 1.00 74.23 H new ATOM 0 HE2 MET A 1 5.244 -0.076 -1.690 1.00 74.23 H new ATOM 0 HE3 MET A 1 4.147 0.489 -2.973 1.00 74.23 H new ATOM 20 N ALA A 2 0.688 -3.220 -0.226 1.00 43.33 N ATOM 21 CA ALA A 2 0.697 -4.629 0.137 1.00 4.24 C ATOM 22 C ALA A 2 0.177 -5.474 -1.019 1.00 74.32 C ATOM 23 O ALA A 2 0.248 -5.059 -2.175 1.00 73.44 O ATOM 24 CB ALA A 2 -0.145 -4.852 1.389 1.00 40.14 C ATOM 0 H ALA A 2 0.066 -2.991 -1.001 1.00 43.33 H new ATOM 0 HA ALA A 2 1.722 -4.934 0.350 1.00 4.24 H new ATOM 0 HB1 ALA A 2 -0.132 -5.910 1.653 1.00 40.14 H new ATOM 0 HB2 ALA A 2 0.266 -4.268 2.212 1.00 40.14 H new ATOM 0 HB3 ALA A 2 -1.171 -4.538 1.198 1.00 40.14 H new ATOM 30 N SER A 3 -0.333 -6.655 -0.703 1.00 11.34 N ATOM 31 CA SER A 3 -0.885 -7.551 -1.708 1.00 25.32 C ATOM 32 C SER A 3 -2.181 -8.176 -1.196 1.00 11.11 C ATOM 33 O SER A 3 -2.478 -9.341 -1.458 1.00 71.40 O ATOM 34 CB SER A 3 0.136 -8.637 -2.055 1.00 45.13 C ATOM 35 OG SER A 3 1.346 -8.061 -2.522 1.00 63.45 O ATOM 0 H SER A 3 -0.376 -7.017 0.250 1.00 11.34 H new ATOM 0 HA SER A 3 -1.109 -6.983 -2.611 1.00 25.32 H new ATOM 0 HB2 SER A 3 0.335 -9.249 -1.176 1.00 45.13 H new ATOM 0 HB3 SER A 3 -0.275 -9.299 -2.818 1.00 45.13 H new ATOM 0 HG SER A 3 2.083 -8.326 -1.933 1.00 63.45 H new ATOM 41 N GLY A 4 -2.959 -7.380 -0.471 1.00 45.13 N ATOM 42 CA GLY A 4 -4.218 -7.858 0.071 1.00 32.33 C ATOM 43 C GLY A 4 -5.390 -7.530 -0.833 1.00 44.04 C ATOM 44 O GLY A 4 -6.548 -7.663 -0.440 1.00 34.13 O ATOM 0 H GLY A 4 -2.740 -6.409 -0.248 1.00 45.13 H new ATOM 0 HA2 GLY A 4 -4.163 -8.937 0.216 1.00 32.33 H new ATOM 0 HA3 GLY A 4 -4.382 -7.413 1.052 1.00 32.33 H new ATOM 48 N VAL A 5 -5.081 -7.089 -2.043 1.00 2.32 N ATOM 49 CA VAL A 5 -6.094 -6.757 -3.032 1.00 75.32 C ATOM 50 C VAL A 5 -5.836 -7.553 -4.301 1.00 12.14 C ATOM 51 O VAL A 5 -4.695 -7.645 -4.754 1.00 40.21 O ATOM 52 CB VAL A 5 -6.093 -5.250 -3.367 1.00 5.02 C ATOM 53 CG1 VAL A 5 -7.211 -4.917 -4.343 1.00 75.24 C ATOM 54 CG2 VAL A 5 -6.221 -4.419 -2.098 1.00 70.41 C ATOM 0 H VAL A 5 -4.123 -6.952 -2.366 1.00 2.32 H new ATOM 0 HA VAL A 5 -7.069 -7.009 -2.614 1.00 75.32 H new ATOM 0 HB VAL A 5 -5.143 -5.005 -3.841 1.00 5.02 H new ATOM 0 HG11 VAL A 5 -7.193 -3.850 -4.566 1.00 75.24 H new ATOM 0 HG12 VAL A 5 -7.071 -5.483 -5.264 1.00 75.24 H new ATOM 0 HG13 VAL A 5 -8.171 -5.179 -3.899 1.00 75.24 H new ATOM 0 HG21 VAL A 5 -6.218 -3.360 -2.355 1.00 70.41 H new ATOM 0 HG22 VAL A 5 -7.154 -4.668 -1.593 1.00 70.41 H new ATOM 0 HG23 VAL A 5 -5.382 -4.634 -1.436 1.00 70.41 H new ATOM 64 N LYS A 6 -6.881 -8.139 -4.864 1.00 43.41 N ATOM 65 CA LYS A 6 -6.725 -8.979 -6.040 1.00 22.15 C ATOM 66 C LYS A 6 -7.090 -8.234 -7.310 1.00 14.50 C ATOM 67 O LYS A 6 -7.874 -7.284 -7.293 1.00 13.45 O ATOM 68 CB LYS A 6 -7.560 -10.257 -5.917 1.00 33.40 C ATOM 69 CG LYS A 6 -6.838 -11.377 -5.184 1.00 2.14 C ATOM 70 CD LYS A 6 -6.519 -10.999 -3.749 1.00 64.41 C ATOM 71 CE LYS A 6 -5.438 -11.888 -3.162 1.00 0.01 C ATOM 72 NZ LYS A 6 -5.802 -13.329 -3.209 1.00 73.21 N ATOM 0 H LYS A 6 -7.840 -8.049 -4.528 1.00 43.41 H new ATOM 0 HA LYS A 6 -5.672 -9.255 -6.101 1.00 22.15 H new ATOM 0 HB2 LYS A 6 -8.488 -10.028 -5.393 1.00 33.40 H new ATOM 0 HB3 LYS A 6 -7.834 -10.602 -6.914 1.00 33.40 H new ATOM 0 HG2 LYS A 6 -7.456 -12.275 -5.194 1.00 2.14 H new ATOM 0 HG3 LYS A 6 -5.914 -11.619 -5.710 1.00 2.14 H new ATOM 0 HD2 LYS A 6 -6.196 -9.959 -3.710 1.00 64.41 H new ATOM 0 HD3 LYS A 6 -7.422 -11.075 -3.143 1.00 64.41 H new ATOM 0 HE2 LYS A 6 -4.508 -11.733 -3.708 1.00 0.01 H new ATOM 0 HE3 LYS A 6 -5.253 -11.596 -2.128 1.00 0.01 H new ATOM 0 HZ1 LYS A 6 -5.109 -13.880 -2.664 1.00 73.21 H new ATOM 0 HZ2 LYS A 6 -6.749 -13.461 -2.799 1.00 73.21 H new ATOM 0 HZ3 LYS A 6 -5.804 -13.655 -4.197 1.00 73.21 H new ATOM 86 N VAL A 7 -6.497 -8.670 -8.407 1.00 33.20 N ATOM 87 CA VAL A 7 -6.779 -8.097 -9.713 1.00 34.45 C ATOM 88 C VAL A 7 -8.006 -8.761 -10.328 1.00 51.31 C ATOM 89 O VAL A 7 -8.223 -9.960 -10.154 1.00 71.35 O ATOM 90 CB VAL A 7 -5.569 -8.239 -10.664 1.00 10.25 C ATOM 91 CG1 VAL A 7 -4.399 -7.408 -10.162 1.00 50.33 C ATOM 92 CG2 VAL A 7 -5.157 -9.697 -10.812 1.00 43.14 C ATOM 0 H VAL A 7 -5.811 -9.425 -8.420 1.00 33.20 H new ATOM 0 HA VAL A 7 -6.977 -7.034 -9.574 1.00 34.45 H new ATOM 0 HB VAL A 7 -5.867 -7.870 -11.645 1.00 10.25 H new ATOM 0 HG11 VAL A 7 -3.555 -7.519 -10.843 1.00 50.33 H new ATOM 0 HG12 VAL A 7 -4.691 -6.359 -10.115 1.00 50.33 H new ATOM 0 HG13 VAL A 7 -4.110 -7.749 -9.168 1.00 50.33 H new ATOM 0 HG21 VAL A 7 -4.304 -9.767 -11.486 1.00 43.14 H new ATOM 0 HG22 VAL A 7 -4.883 -10.098 -9.836 1.00 43.14 H new ATOM 0 HG23 VAL A 7 -5.989 -10.271 -11.219 1.00 43.14 H new ATOM 102 N ASP A 8 -8.816 -7.981 -11.027 1.00 24.10 N ATOM 103 CA ASP A 8 -10.039 -8.503 -11.624 1.00 73.22 C ATOM 104 C ASP A 8 -9.810 -8.838 -13.096 1.00 24.51 C ATOM 105 O ASP A 8 -9.199 -8.061 -13.830 1.00 70.14 O ATOM 106 CB ASP A 8 -11.183 -7.493 -11.482 1.00 32.12 C ATOM 107 CG ASP A 8 -12.515 -8.058 -11.927 1.00 11.04 C ATOM 108 OD1 ASP A 8 -12.804 -8.025 -13.138 1.00 52.31 O ATOM 109 OD2 ASP A 8 -13.274 -8.549 -11.067 1.00 63.01 O ATOM 0 H ASP A 8 -8.651 -6.989 -11.195 1.00 24.10 H new ATOM 0 HA ASP A 8 -10.316 -9.415 -11.096 1.00 73.22 H new ATOM 0 HB2 ASP A 8 -11.256 -7.176 -10.442 1.00 32.12 H new ATOM 0 HB3 ASP A 8 -10.954 -6.605 -12.071 1.00 32.12 H new ATOM 114 N PRO A 9 -10.289 -10.007 -13.544 1.00 31.30 N ATOM 115 CA PRO A 9 -10.087 -10.470 -14.921 1.00 54.22 C ATOM 116 C PRO A 9 -10.704 -9.543 -15.970 1.00 70.14 C ATOM 117 O PRO A 9 -10.219 -9.476 -17.100 1.00 22.05 O ATOM 118 CB PRO A 9 -10.777 -11.839 -14.951 1.00 50.34 C ATOM 119 CG PRO A 9 -11.712 -11.830 -13.790 1.00 3.22 C ATOM 120 CD PRO A 9 -11.058 -10.977 -12.745 1.00 70.44 C ATOM 0 HA PRO A 9 -9.026 -10.501 -15.171 1.00 54.22 H new ATOM 0 HB2 PRO A 9 -11.314 -11.989 -15.888 1.00 50.34 H new ATOM 0 HB3 PRO A 9 -10.051 -12.648 -14.866 1.00 50.34 H new ATOM 0 HG2 PRO A 9 -12.683 -11.425 -14.073 1.00 3.22 H new ATOM 0 HG3 PRO A 9 -11.884 -12.840 -13.419 1.00 3.22 H new ATOM 0 HD2 PRO A 9 -11.793 -10.484 -12.109 1.00 70.44 H new ATOM 0 HD3 PRO A 9 -10.413 -11.563 -12.091 1.00 70.44 H new ATOM 128 N SER A 10 -11.752 -8.814 -15.596 1.00 33.43 N ATOM 129 CA SER A 10 -12.475 -7.981 -16.550 1.00 61.25 C ATOM 130 C SER A 10 -11.670 -6.736 -16.908 1.00 31.52 C ATOM 131 O SER A 10 -11.628 -6.326 -18.069 1.00 24.24 O ATOM 132 CB SER A 10 -13.831 -7.575 -15.976 1.00 10.54 C ATOM 133 OG SER A 10 -14.348 -8.598 -15.141 1.00 62.51 O ATOM 0 H SER A 10 -12.117 -8.784 -14.644 1.00 33.43 H new ATOM 0 HA SER A 10 -12.630 -8.564 -17.458 1.00 61.25 H new ATOM 0 HB2 SER A 10 -13.729 -6.651 -15.407 1.00 10.54 H new ATOM 0 HB3 SER A 10 -14.530 -7.374 -16.788 1.00 10.54 H new ATOM 0 HG SER A 10 -14.099 -8.418 -14.210 1.00 62.51 H new ATOM 139 N CYS A 11 -11.020 -6.140 -15.915 1.00 31.23 N ATOM 140 CA CYS A 11 -10.241 -4.936 -16.148 1.00 51.02 C ATOM 141 C CYS A 11 -8.929 -5.291 -16.833 1.00 53.25 C ATOM 142 O CYS A 11 -8.399 -4.518 -17.629 1.00 12.23 O ATOM 143 CB CYS A 11 -9.989 -4.187 -14.836 1.00 72.13 C ATOM 144 SG CYS A 11 -9.112 -5.140 -13.578 1.00 72.52 S ATOM 0 H CYS A 11 -11.018 -6.469 -14.950 1.00 31.23 H new ATOM 0 HA CYS A 11 -10.808 -4.274 -16.803 1.00 51.02 H new ATOM 0 HB2 CYS A 11 -9.417 -3.285 -15.053 1.00 72.13 H new ATOM 0 HB3 CYS A 11 -10.947 -3.866 -14.427 1.00 72.13 H new ATOM 0 HG CYS A 11 -9.118 -6.398 -13.905 1.00 72.52 H new ATOM 150 N LYS A 12 -8.428 -6.483 -16.534 1.00 62.11 N ATOM 151 CA LYS A 12 -7.222 -6.985 -17.168 1.00 33.50 C ATOM 152 C LYS A 12 -7.485 -7.314 -18.634 1.00 24.30 C ATOM 153 O LYS A 12 -6.707 -6.935 -19.504 1.00 22.11 O ATOM 154 CB LYS A 12 -6.700 -8.214 -16.417 1.00 52.33 C ATOM 155 CG LYS A 12 -5.492 -8.880 -17.063 1.00 75.23 C ATOM 156 CD LYS A 12 -4.421 -7.873 -17.462 1.00 23.11 C ATOM 157 CE LYS A 12 -3.109 -8.567 -17.799 1.00 31.42 C ATOM 158 NZ LYS A 12 -3.264 -9.550 -18.906 1.00 53.12 N ATOM 0 H LYS A 12 -8.842 -7.120 -15.853 1.00 62.11 H new ATOM 0 HA LYS A 12 -6.458 -6.209 -17.128 1.00 33.50 H new ATOM 0 HB2 LYS A 12 -6.437 -7.919 -15.401 1.00 52.33 H new ATOM 0 HB3 LYS A 12 -7.504 -8.946 -16.339 1.00 52.33 H new ATOM 0 HG2 LYS A 12 -5.066 -9.605 -16.370 1.00 75.23 H new ATOM 0 HG3 LYS A 12 -5.814 -9.434 -17.945 1.00 75.23 H new ATOM 0 HD2 LYS A 12 -4.762 -7.298 -18.323 1.00 23.11 H new ATOM 0 HD3 LYS A 12 -4.262 -7.166 -16.648 1.00 23.11 H new ATOM 0 HE2 LYS A 12 -2.366 -7.820 -18.079 1.00 31.42 H new ATOM 0 HE3 LYS A 12 -2.731 -9.076 -16.913 1.00 31.42 H new ATOM 0 HZ1 LYS A 12 -2.424 -10.162 -18.946 1.00 53.12 H new ATOM 0 HZ2 LYS A 12 -4.109 -10.132 -18.738 1.00 53.12 H new ATOM 0 HZ3 LYS A 12 -3.367 -9.043 -19.808 1.00 53.12 H new ATOM 172 N ASN A 13 -8.593 -7.992 -18.906 1.00 63.10 N ATOM 173 CA ASN A 13 -8.945 -8.347 -20.278 1.00 12.21 C ATOM 174 C ASN A 13 -9.201 -7.087 -21.101 1.00 5.01 C ATOM 175 O ASN A 13 -8.843 -7.012 -22.278 1.00 41.32 O ATOM 176 CB ASN A 13 -10.177 -9.256 -20.305 1.00 61.03 C ATOM 177 CG ASN A 13 -10.489 -9.769 -21.698 1.00 42.40 C ATOM 178 OD1 ASN A 13 -11.259 -9.160 -22.445 1.00 53.31 O ATOM 179 ND2 ASN A 13 -9.889 -10.891 -22.063 1.00 10.55 N ATOM 0 H ASN A 13 -9.260 -8.306 -18.201 1.00 63.10 H new ATOM 0 HA ASN A 13 -8.108 -8.891 -20.716 1.00 12.21 H new ATOM 0 HB2 ASN A 13 -10.015 -10.102 -19.637 1.00 61.03 H new ATOM 0 HB3 ASN A 13 -11.038 -8.708 -19.922 1.00 61.03 H new ATOM 0 HD21 ASN A 13 -10.057 -11.281 -22.991 1.00 10.55 H new ATOM 0 HD22 ASN A 13 -9.259 -11.366 -21.417 1.00 10.55 H new ATOM 186 N ALA A 14 -9.794 -6.082 -20.461 1.00 52.12 N ATOM 187 CA ALA A 14 -10.048 -4.804 -21.113 1.00 55.04 C ATOM 188 C ALA A 14 -8.735 -4.074 -21.365 1.00 73.50 C ATOM 189 O ALA A 14 -8.620 -3.270 -22.299 1.00 33.31 O ATOM 190 CB ALA A 14 -10.986 -3.947 -20.274 1.00 70.32 C ATOM 0 H ALA A 14 -10.107 -6.130 -19.491 1.00 52.12 H new ATOM 0 HA ALA A 14 -10.531 -4.994 -22.071 1.00 55.04 H new ATOM 0 HB1 ALA A 14 -11.162 -2.998 -20.780 1.00 70.32 H new ATOM 0 HB2 ALA A 14 -11.934 -4.468 -20.141 1.00 70.32 H new ATOM 0 HB3 ALA A 14 -10.535 -3.761 -19.299 1.00 70.32 H new ATOM 196 N TYR A 15 -7.749 -4.364 -20.525 1.00 45.31 N ATOM 197 CA TYR A 15 -6.418 -3.813 -20.687 1.00 64.44 C ATOM 198 C TYR A 15 -5.682 -4.540 -21.806 1.00 62.33 C ATOM 199 O TYR A 15 -4.998 -3.915 -22.612 1.00 21.11 O ATOM 200 CB TYR A 15 -5.622 -3.908 -19.384 1.00 63.34 C ATOM 201 CG TYR A 15 -4.270 -3.238 -19.472 1.00 51.02 C ATOM 202 CD1 TYR A 15 -4.142 -1.866 -19.289 1.00 62.14 C ATOM 203 CD2 TYR A 15 -3.127 -3.972 -19.761 1.00 31.02 C ATOM 204 CE1 TYR A 15 -2.913 -1.247 -19.387 1.00 73.42 C ATOM 205 CE2 TYR A 15 -1.896 -3.359 -19.865 1.00 4.54 C ATOM 206 CZ TYR A 15 -1.795 -1.998 -19.679 1.00 43.13 C ATOM 207 OH TYR A 15 -0.572 -1.386 -19.794 1.00 12.20 O ATOM 0 H TYR A 15 -7.852 -4.983 -19.721 1.00 45.31 H new ATOM 0 HA TYR A 15 -6.516 -2.760 -20.950 1.00 64.44 H new ATOM 0 HB2 TYR A 15 -6.197 -3.451 -18.579 1.00 63.34 H new ATOM 0 HB3 TYR A 15 -5.486 -4.957 -19.123 1.00 63.34 H new ATOM 0 HD1 TYR A 15 -5.018 -1.275 -19.067 1.00 62.14 H new ATOM 0 HD2 TYR A 15 -3.203 -5.039 -19.907 1.00 31.02 H new ATOM 0 HE1 TYR A 15 -2.828 -0.181 -19.236 1.00 73.42 H new ATOM 0 HE2 TYR A 15 -1.016 -3.943 -20.091 1.00 4.54 H new ATOM 0 HH TYR A 15 0.089 -2.034 -20.117 1.00 12.20 H new ATOM 217 N ASP A 16 -5.830 -5.863 -21.857 1.00 65.21 N ATOM 218 CA ASP A 16 -5.220 -6.667 -22.917 1.00 24.51 C ATOM 219 C ASP A 16 -5.648 -6.149 -24.281 1.00 41.10 C ATOM 220 O ASP A 16 -4.854 -6.108 -25.223 1.00 43.33 O ATOM 221 CB ASP A 16 -5.605 -8.145 -22.790 1.00 23.21 C ATOM 222 CG ASP A 16 -5.019 -8.810 -21.561 1.00 15.23 C ATOM 223 OD1 ASP A 16 -3.804 -8.655 -21.315 1.00 25.22 O ATOM 224 OD2 ASP A 16 -5.769 -9.492 -20.833 1.00 72.11 O ATOM 0 H ASP A 16 -6.367 -6.402 -21.177 1.00 65.21 H new ATOM 0 HA ASP A 16 -4.138 -6.582 -22.815 1.00 24.51 H new ATOM 0 HB2 ASP A 16 -6.691 -8.230 -22.758 1.00 23.21 H new ATOM 0 HB3 ASP A 16 -5.270 -8.679 -23.679 1.00 23.21 H new ATOM 229 N LEU A 17 -6.906 -5.731 -24.370 1.00 4.52 N ATOM 230 CA LEU A 17 -7.442 -5.150 -25.591 1.00 73.32 C ATOM 231 C LEU A 17 -6.599 -3.963 -26.052 1.00 42.42 C ATOM 232 O LEU A 17 -6.307 -3.831 -27.237 1.00 74.54 O ATOM 233 CB LEU A 17 -8.894 -4.712 -25.383 1.00 5.03 C ATOM 234 CG LEU A 17 -9.878 -5.844 -25.077 1.00 72.34 C ATOM 235 CD1 LEU A 17 -11.272 -5.289 -24.836 1.00 20.43 C ATOM 236 CD2 LEU A 17 -9.901 -6.858 -26.213 1.00 74.53 C ATOM 0 H LEU A 17 -7.577 -5.785 -23.603 1.00 4.52 H new ATOM 0 HA LEU A 17 -7.410 -5.915 -26.367 1.00 73.32 H new ATOM 0 HB2 LEU A 17 -8.926 -3.993 -24.565 1.00 5.03 H new ATOM 0 HB3 LEU A 17 -9.232 -4.191 -26.279 1.00 5.03 H new ATOM 0 HG LEU A 17 -9.545 -6.349 -24.171 1.00 72.34 H new ATOM 0 HD11 LEU A 17 -11.958 -6.108 -24.620 1.00 20.43 H new ATOM 0 HD12 LEU A 17 -11.249 -4.603 -23.990 1.00 20.43 H new ATOM 0 HD13 LEU A 17 -11.611 -4.757 -25.725 1.00 20.43 H new ATOM 0 HD21 LEU A 17 -10.607 -7.654 -25.976 1.00 74.53 H new ATOM 0 HD22 LEU A 17 -10.208 -6.364 -27.135 1.00 74.53 H new ATOM 0 HD23 LEU A 17 -8.905 -7.282 -26.342 1.00 74.53 H new ATOM 248 N LEU A 18 -6.212 -3.099 -25.119 1.00 61.03 N ATOM 249 CA LEU A 18 -5.419 -1.922 -25.459 1.00 73.01 C ATOM 250 C LEU A 18 -3.926 -2.247 -25.520 1.00 53.51 C ATOM 251 O LEU A 18 -3.170 -1.587 -26.225 1.00 52.52 O ATOM 252 CB LEU A 18 -5.696 -0.770 -24.479 1.00 0.45 C ATOM 253 CG LEU A 18 -5.280 -0.981 -23.020 1.00 41.03 C ATOM 254 CD1 LEU A 18 -3.834 -0.560 -22.796 1.00 12.35 C ATOM 255 CD2 LEU A 18 -6.210 -0.213 -22.095 1.00 73.42 C ATOM 0 H LEU A 18 -6.433 -3.190 -24.127 1.00 61.03 H new ATOM 0 HA LEU A 18 -5.722 -1.598 -26.455 1.00 73.01 H new ATOM 0 HB2 LEU A 18 -5.188 0.120 -24.850 1.00 0.45 H new ATOM 0 HB3 LEU A 18 -6.765 -0.558 -24.499 1.00 0.45 H new ATOM 0 HG LEU A 18 -5.357 -2.044 -22.792 1.00 41.03 H new ATOM 0 HD11 LEU A 18 -3.566 -0.721 -21.752 1.00 12.35 H new ATOM 0 HD12 LEU A 18 -3.179 -1.153 -23.434 1.00 12.35 H new ATOM 0 HD13 LEU A 18 -3.720 0.496 -23.041 1.00 12.35 H new ATOM 0 HD21 LEU A 18 -5.905 -0.370 -21.060 1.00 73.42 H new ATOM 0 HD22 LEU A 18 -6.161 0.850 -22.330 1.00 73.42 H new ATOM 0 HD23 LEU A 18 -7.232 -0.568 -22.230 1.00 73.42 H new ATOM 267 N HIS A 19 -3.512 -3.267 -24.788 1.00 21.22 N ATOM 268 CA HIS A 19 -2.104 -3.628 -24.710 1.00 73.41 C ATOM 269 C HIS A 19 -1.659 -4.387 -25.959 1.00 50.21 C ATOM 270 O HIS A 19 -0.544 -4.203 -26.441 1.00 4.45 O ATOM 271 CB HIS A 19 -1.853 -4.471 -23.455 1.00 70.53 C ATOM 272 CG HIS A 19 -0.406 -4.746 -23.181 1.00 64.32 C ATOM 273 ND1 HIS A 19 0.069 -5.996 -22.851 1.00 13.45 N ATOM 274 CD2 HIS A 19 0.669 -3.921 -23.168 1.00 50.42 C ATOM 275 CE1 HIS A 19 1.371 -5.931 -22.652 1.00 3.23 C ATOM 276 NE2 HIS A 19 1.758 -4.684 -22.836 1.00 1.51 N ATOM 0 H HIS A 19 -4.131 -3.862 -24.238 1.00 21.22 H new ATOM 0 HA HIS A 19 -1.517 -2.712 -24.650 1.00 73.41 H new ATOM 0 HB2 HIS A 19 -2.284 -3.959 -22.594 1.00 70.53 H new ATOM 0 HB3 HIS A 19 -2.379 -5.420 -23.557 1.00 70.53 H new ATOM 0 HD2 HIS A 19 0.668 -2.862 -23.379 1.00 50.42 H new ATOM 0 HE1 HIS A 19 2.011 -6.758 -22.384 1.00 3.23 H new ATOM 0 HE2 HIS A 19 2.715 -4.342 -22.746 1.00 1.51 H new ATOM 285 N ASN A 20 -2.527 -5.247 -26.472 1.00 12.24 N ATOM 286 CA ASN A 20 -2.200 -6.048 -27.649 1.00 12.41 C ATOM 287 C ASN A 20 -2.721 -5.405 -28.930 1.00 51.52 C ATOM 288 O ASN A 20 -1.950 -5.112 -29.844 1.00 61.20 O ATOM 289 CB ASN A 20 -2.764 -7.465 -27.508 1.00 5.42 C ATOM 290 CG ASN A 20 -1.855 -8.385 -26.713 1.00 32.03 C ATOM 291 OD1 ASN A 20 -1.079 -7.942 -25.860 1.00 13.54 O ATOM 292 ND2 ASN A 20 -1.952 -9.676 -26.981 1.00 22.41 N ATOM 0 H ASN A 20 -3.461 -5.410 -26.095 1.00 12.24 H new ATOM 0 HA ASN A 20 -1.113 -6.100 -27.716 1.00 12.41 H new ATOM 0 HB2 ASN A 20 -3.738 -7.416 -27.022 1.00 5.42 H new ATOM 0 HB3 ASN A 20 -2.923 -7.888 -28.500 1.00 5.42 H new ATOM 0 HD21 ASN A 20 -1.373 -10.347 -26.475 1.00 22.41 H new ATOM 0 HD22 ASN A 20 -2.606 -10.001 -27.693 1.00 22.41 H new ATOM 299 N LYS A 21 -4.028 -5.180 -28.992 1.00 41.32 N ATOM 300 CA LYS A 21 -4.662 -4.639 -30.197 1.00 73.53 C ATOM 301 C LYS A 21 -4.634 -3.116 -30.173 1.00 11.45 C ATOM 302 O LYS A 21 -4.703 -2.457 -31.211 1.00 24.15 O ATOM 303 CB LYS A 21 -6.118 -5.107 -30.281 1.00 42.51 C ATOM 304 CG LYS A 21 -6.320 -6.562 -29.900 1.00 15.24 C ATOM 305 CD LYS A 21 -5.721 -7.508 -30.923 1.00 60.55 C ATOM 306 CE LYS A 21 -5.790 -8.938 -30.427 1.00 24.01 C ATOM 307 NZ LYS A 21 -5.582 -9.925 -31.518 1.00 34.10 N ATOM 0 H LYS A 21 -4.673 -5.363 -28.223 1.00 41.32 H new ATOM 0 HA LYS A 21 -4.109 -4.999 -31.065 1.00 73.53 H new ATOM 0 HB2 LYS A 21 -6.728 -4.483 -29.628 1.00 42.51 H new ATOM 0 HB3 LYS A 21 -6.480 -4.954 -31.298 1.00 42.51 H new ATOM 0 HG2 LYS A 21 -5.867 -6.748 -28.926 1.00 15.24 H new ATOM 0 HG3 LYS A 21 -7.386 -6.765 -29.799 1.00 15.24 H new ATOM 0 HD2 LYS A 21 -6.257 -7.418 -31.868 1.00 60.55 H new ATOM 0 HD3 LYS A 21 -4.684 -7.234 -31.117 1.00 60.55 H new ATOM 0 HE2 LYS A 21 -5.035 -9.089 -29.655 1.00 24.01 H new ATOM 0 HE3 LYS A 21 -6.761 -9.113 -29.963 1.00 24.01 H new ATOM 0 HZ1 LYS A 21 -5.638 -10.888 -31.130 1.00 34.10 H new ATOM 0 HZ2 LYS A 21 -6.317 -9.801 -32.243 1.00 34.10 H new ATOM 0 HZ3 LYS A 21 -4.645 -9.778 -31.945 1.00 34.10 H new ATOM 321 N HIS A 22 -4.533 -2.583 -28.964 1.00 62.00 N ATOM 322 CA HIS A 22 -4.641 -1.148 -28.703 1.00 15.41 C ATOM 323 C HIS A 22 -6.042 -0.664 -29.057 1.00 23.45 C ATOM 324 O HIS A 22 -6.226 0.400 -29.646 1.00 42.21 O ATOM 325 CB HIS A 22 -3.574 -0.335 -29.444 1.00 2.15 C ATOM 326 CG HIS A 22 -3.318 0.992 -28.793 1.00 51.21 C ATOM 327 ND1 HIS A 22 -3.706 2.197 -29.334 1.00 61.22 N ATOM 328 CD2 HIS A 22 -2.727 1.289 -27.613 1.00 32.02 C ATOM 329 CE1 HIS A 22 -3.364 3.175 -28.514 1.00 2.42 C ATOM 330 NE2 HIS A 22 -2.770 2.651 -27.462 1.00 43.04 N ATOM 0 H HIS A 22 -4.372 -3.139 -28.124 1.00 62.00 H new ATOM 0 HA HIS A 22 -4.463 -0.990 -27.639 1.00 15.41 H new ATOM 0 HB2 HIS A 22 -2.646 -0.905 -29.480 1.00 2.15 H new ATOM 0 HB3 HIS A 22 -3.891 -0.177 -30.475 1.00 2.15 H new ATOM 0 HD2 HIS A 22 -2.299 0.582 -26.917 1.00 32.02 H new ATOM 0 HE1 HIS A 22 -3.542 4.227 -28.679 1.00 2.42 H new ATOM 0 HE2 HIS A 22 -2.403 3.172 -26.666 1.00 43.04 H new ATOM 339 N GLN A 23 -7.024 -1.470 -28.673 1.00 34.25 N ATOM 340 CA GLN A 23 -8.432 -1.148 -28.872 1.00 22.15 C ATOM 341 C GLN A 23 -8.833 0.043 -28.002 1.00 31.14 C ATOM 342 O GLN A 23 -9.837 0.705 -28.249 1.00 14.43 O ATOM 343 CB GLN A 23 -9.284 -2.375 -28.527 1.00 12.34 C ATOM 344 CG GLN A 23 -10.779 -2.198 -28.750 1.00 71.01 C ATOM 345 CD GLN A 23 -11.126 -1.860 -30.186 1.00 2.25 C ATOM 346 OE1 GLN A 23 -11.313 -2.749 -31.014 1.00 30.24 O ATOM 347 NE2 GLN A 23 -11.229 -0.577 -30.487 1.00 71.53 N ATOM 0 H GLN A 23 -6.866 -2.367 -28.214 1.00 34.25 H new ATOM 0 HA GLN A 23 -8.597 -0.877 -29.915 1.00 22.15 H new ATOM 0 HB2 GLN A 23 -8.939 -3.219 -29.125 1.00 12.34 H new ATOM 0 HB3 GLN A 23 -9.115 -2.635 -27.482 1.00 12.34 H new ATOM 0 HG2 GLN A 23 -11.295 -3.114 -28.463 1.00 71.01 H new ATOM 0 HG3 GLN A 23 -11.147 -1.407 -28.097 1.00 71.01 H new ATOM 0 HE21 GLN A 23 -11.066 0.130 -29.770 1.00 71.53 H new ATOM 0 HE22 GLN A 23 -11.472 -0.294 -31.436 1.00 71.53 H new ATOM 356 N HIS A 24 -8.035 0.303 -26.979 1.00 72.13 N ATOM 357 CA HIS A 24 -8.270 1.424 -26.078 1.00 21.22 C ATOM 358 C HIS A 24 -6.989 2.231 -25.932 1.00 45.00 C ATOM 359 O HIS A 24 -5.907 1.739 -26.254 1.00 72.35 O ATOM 360 CB HIS A 24 -8.724 0.935 -24.696 1.00 14.10 C ATOM 361 CG HIS A 24 -9.977 0.115 -24.711 1.00 72.22 C ATOM 362 ND1 HIS A 24 -10.091 -1.105 -24.070 1.00 60.34 N ATOM 363 CD2 HIS A 24 -11.183 0.349 -25.281 1.00 52.34 C ATOM 364 CE1 HIS A 24 -11.311 -1.578 -24.245 1.00 73.13 C ATOM 365 NE2 HIS A 24 -11.991 -0.717 -24.976 1.00 53.42 N ATOM 0 H HIS A 24 -7.211 -0.252 -26.749 1.00 72.13 H new ATOM 0 HA HIS A 24 -9.060 2.046 -26.500 1.00 21.22 H new ATOM 0 HB2 HIS A 24 -7.923 0.344 -24.252 1.00 14.10 H new ATOM 0 HB3 HIS A 24 -8.878 1.800 -24.051 1.00 14.10 H new ATOM 0 HD1 HIS A 24 -9.349 -1.567 -23.544 1.00 60.34 H new ATOM 0 HD2 HIS A 24 -11.458 1.214 -25.867 1.00 52.34 H new ATOM 0 HE1 HIS A 24 -11.688 -2.512 -23.855 1.00 73.13 H new ATOM 374 N SER A 25 -7.111 3.461 -25.462 1.00 34.41 N ATOM 375 CA SER A 25 -5.941 4.279 -25.188 1.00 74.01 C ATOM 376 C SER A 25 -5.651 4.299 -23.689 1.00 40.41 C ATOM 377 O SER A 25 -4.564 3.933 -23.251 1.00 63.43 O ATOM 378 CB SER A 25 -6.146 5.702 -25.711 1.00 43.41 C ATOM 379 OG SER A 25 -6.466 5.692 -27.091 1.00 13.13 O ATOM 0 H SER A 25 -8.003 3.914 -25.263 1.00 34.41 H new ATOM 0 HA SER A 25 -5.085 3.844 -25.704 1.00 74.01 H new ATOM 0 HB2 SER A 25 -6.946 6.188 -25.152 1.00 43.41 H new ATOM 0 HB3 SER A 25 -5.241 6.288 -25.548 1.00 43.41 H new ATOM 0 HG SER A 25 -6.594 6.612 -27.404 1.00 13.13 H new ATOM 385 N TYR A 26 -6.634 4.706 -22.901 1.00 31.44 N ATOM 386 CA TYR A 26 -6.463 4.768 -21.459 1.00 44.42 C ATOM 387 C TYR A 26 -7.626 4.101 -20.743 1.00 23.31 C ATOM 388 O TYR A 26 -8.730 4.003 -21.282 1.00 13.21 O ATOM 389 CB TYR A 26 -6.308 6.220 -20.985 1.00 64.12 C ATOM 390 CG TYR A 26 -7.421 7.153 -21.416 1.00 42.24 C ATOM 391 CD1 TYR A 26 -8.658 7.132 -20.786 1.00 23.43 C ATOM 392 CD2 TYR A 26 -7.223 8.068 -22.442 1.00 74.11 C ATOM 393 CE1 TYR A 26 -9.667 7.994 -21.166 1.00 52.54 C ATOM 394 CE2 TYR A 26 -8.228 8.932 -22.830 1.00 45.13 C ATOM 395 CZ TYR A 26 -9.448 8.891 -22.189 1.00 73.22 C ATOM 396 OH TYR A 26 -10.449 9.756 -22.563 1.00 45.35 O ATOM 0 H TYR A 26 -7.553 4.997 -23.234 1.00 31.44 H new ATOM 0 HA TYR A 26 -5.550 4.226 -21.211 1.00 44.42 H new ATOM 0 HB2 TYR A 26 -6.248 6.227 -19.897 1.00 64.12 H new ATOM 0 HB3 TYR A 26 -5.361 6.610 -21.359 1.00 64.12 H new ATOM 0 HD1 TYR A 26 -8.834 6.429 -19.985 1.00 23.43 H new ATOM 0 HD2 TYR A 26 -6.268 8.104 -22.944 1.00 74.11 H new ATOM 0 HE1 TYR A 26 -10.623 7.966 -20.664 1.00 52.54 H new ATOM 0 HE2 TYR A 26 -8.059 9.636 -23.631 1.00 45.13 H new ATOM 0 HH TYR A 26 -10.060 10.525 -23.029 1.00 45.35 H new ATOM 406 N ILE A 27 -7.362 3.613 -19.544 1.00 24.44 N ATOM 407 CA ILE A 27 -8.394 3.034 -18.706 1.00 41.44 C ATOM 408 C ILE A 27 -8.139 3.371 -17.235 1.00 23.25 C ATOM 409 O ILE A 27 -6.998 3.348 -16.767 1.00 72.23 O ATOM 410 CB ILE A 27 -8.489 1.503 -18.909 1.00 23.41 C ATOM 411 CG1 ILE A 27 -9.568 0.895 -18.004 1.00 13.42 C ATOM 412 CG2 ILE A 27 -7.142 0.845 -18.659 1.00 54.05 C ATOM 413 CD1 ILE A 27 -9.801 -0.580 -18.247 1.00 24.20 C ATOM 0 H ILE A 27 -6.431 3.607 -19.127 1.00 24.44 H new ATOM 0 HA ILE A 27 -9.350 3.467 -19.001 1.00 41.44 H new ATOM 0 HB ILE A 27 -8.774 1.316 -19.944 1.00 23.41 H new ATOM 0 HG12 ILE A 27 -9.282 1.043 -16.962 1.00 13.42 H new ATOM 0 HG13 ILE A 27 -10.504 1.432 -18.157 1.00 13.42 H new ATOM 0 HG21 ILE A 27 -7.230 -0.231 -18.807 1.00 54.05 H new ATOM 0 HG22 ILE A 27 -6.406 1.248 -19.354 1.00 54.05 H new ATOM 0 HG23 ILE A 27 -6.823 1.046 -17.636 1.00 54.05 H new ATOM 0 HD11 ILE A 27 -10.577 -0.942 -17.572 1.00 24.20 H new ATOM 0 HD12 ILE A 27 -10.117 -0.733 -19.279 1.00 24.20 H new ATOM 0 HD13 ILE A 27 -8.877 -1.129 -18.066 1.00 24.20 H new ATOM 425 N ILE A 28 -9.198 3.715 -16.525 1.00 74.42 N ATOM 426 CA ILE A 28 -9.102 4.074 -15.121 1.00 22.12 C ATOM 427 C ILE A 28 -9.632 2.940 -14.250 1.00 30.22 C ATOM 428 O ILE A 28 -10.694 2.382 -14.526 1.00 62.31 O ATOM 429 CB ILE A 28 -9.897 5.367 -14.830 1.00 62.01 C ATOM 430 CG1 ILE A 28 -9.402 6.503 -15.730 1.00 62.20 C ATOM 431 CG2 ILE A 28 -9.778 5.756 -13.363 1.00 73.52 C ATOM 432 CD1 ILE A 28 -10.179 7.794 -15.573 1.00 21.01 C ATOM 0 H ILE A 28 -10.145 3.754 -16.903 1.00 74.42 H new ATOM 0 HA ILE A 28 -8.052 4.248 -14.886 1.00 22.12 H new ATOM 0 HB ILE A 28 -10.949 5.182 -15.046 1.00 62.01 H new ATOM 0 HG12 ILE A 28 -8.351 6.694 -15.512 1.00 62.20 H new ATOM 0 HG13 ILE A 28 -9.459 6.181 -16.770 1.00 62.20 H new ATOM 0 HG21 ILE A 28 -10.345 6.669 -13.181 1.00 73.52 H new ATOM 0 HG22 ILE A 28 -10.173 4.953 -12.741 1.00 73.52 H new ATOM 0 HG23 ILE A 28 -8.730 5.925 -13.115 1.00 73.52 H new ATOM 0 HD11 ILE A 28 -9.769 8.549 -16.243 1.00 21.01 H new ATOM 0 HD12 ILE A 28 -11.226 7.621 -15.820 1.00 21.01 H new ATOM 0 HD13 ILE A 28 -10.102 8.142 -14.543 1.00 21.01 H new ATOM 444 N PHE A 29 -8.886 2.604 -13.209 1.00 44.24 N ATOM 445 CA PHE A 29 -9.250 1.516 -12.315 1.00 3.33 C ATOM 446 C PHE A 29 -9.600 2.050 -10.930 1.00 15.14 C ATOM 447 O PHE A 29 -9.136 3.122 -10.529 1.00 5.50 O ATOM 448 CB PHE A 29 -8.092 0.525 -12.176 1.00 14.33 C ATOM 449 CG PHE A 29 -7.577 -0.027 -13.476 1.00 5.20 C ATOM 450 CD1 PHE A 29 -8.249 -1.049 -14.126 1.00 3.53 C ATOM 451 CD2 PHE A 29 -6.409 0.466 -14.036 1.00 31.32 C ATOM 452 CE1 PHE A 29 -7.765 -1.569 -15.311 1.00 0.35 C ATOM 453 CE2 PHE A 29 -5.923 -0.048 -15.221 1.00 3.03 C ATOM 454 CZ PHE A 29 -6.601 -1.067 -15.859 1.00 70.11 C ATOM 0 H PHE A 29 -8.016 3.075 -12.961 1.00 44.24 H new ATOM 0 HA PHE A 29 -10.117 1.013 -12.744 1.00 3.33 H new ATOM 0 HB2 PHE A 29 -7.271 1.018 -11.656 1.00 14.33 H new ATOM 0 HB3 PHE A 29 -8.415 -0.305 -11.548 1.00 14.33 H new ATOM 0 HD1 PHE A 29 -9.161 -1.443 -13.702 1.00 3.53 H new ATOM 0 HD2 PHE A 29 -5.873 1.261 -13.539 1.00 31.32 H new ATOM 0 HE1 PHE A 29 -8.296 -2.367 -15.808 1.00 0.35 H new ATOM 0 HE2 PHE A 29 -5.013 0.347 -15.649 1.00 3.03 H new ATOM 0 HZ PHE A 29 -6.222 -1.471 -16.786 1.00 70.11 H new ATOM 464 N LYS A 30 -10.419 1.305 -10.203 1.00 23.22 N ATOM 465 CA LYS A 30 -10.695 1.617 -8.811 1.00 4.04 C ATOM 466 C LYS A 30 -10.966 0.344 -8.021 1.00 50.41 C ATOM 467 O LYS A 30 -11.475 -0.640 -8.562 1.00 62.04 O ATOM 468 CB LYS A 30 -11.854 2.621 -8.681 1.00 42.10 C ATOM 469 CG LYS A 30 -13.161 2.209 -9.348 1.00 21.54 C ATOM 470 CD LYS A 30 -14.031 1.363 -8.433 1.00 60.24 C ATOM 471 CE LYS A 30 -15.445 1.232 -8.979 1.00 62.11 C ATOM 472 NZ LYS A 30 -16.168 2.535 -8.974 1.00 33.21 N ATOM 0 H LYS A 30 -10.904 0.480 -10.555 1.00 23.22 H new ATOM 0 HA LYS A 30 -9.810 2.093 -8.388 1.00 4.04 H new ATOM 0 HB2 LYS A 30 -12.046 2.792 -7.622 1.00 42.10 H new ATOM 0 HB3 LYS A 30 -11.535 3.573 -9.105 1.00 42.10 H new ATOM 0 HG2 LYS A 30 -13.711 3.101 -9.647 1.00 21.54 H new ATOM 0 HG3 LYS A 30 -12.942 1.650 -10.258 1.00 21.54 H new ATOM 0 HD2 LYS A 30 -13.589 0.373 -8.321 1.00 60.24 H new ATOM 0 HD3 LYS A 30 -14.062 1.812 -7.440 1.00 60.24 H new ATOM 0 HE2 LYS A 30 -15.406 0.843 -9.996 1.00 62.11 H new ATOM 0 HE3 LYS A 30 -15.999 0.508 -8.382 1.00 62.11 H new ATOM 0 HZ1 LYS A 30 -17.148 2.389 -9.290 1.00 33.21 H new ATOM 0 HZ2 LYS A 30 -16.169 2.928 -8.011 1.00 33.21 H new ATOM 0 HZ3 LYS A 30 -15.692 3.199 -9.618 1.00 33.21 H new ATOM 486 N ILE A 31 -10.588 0.364 -6.754 1.00 62.33 N ATOM 487 CA ILE A 31 -10.789 -0.770 -5.868 1.00 1.44 C ATOM 488 C ILE A 31 -12.159 -0.683 -5.202 1.00 53.42 C ATOM 489 O ILE A 31 -12.501 0.334 -4.598 1.00 1.33 O ATOM 490 CB ILE A 31 -9.669 -0.840 -4.795 1.00 3.12 C ATOM 491 CG1 ILE A 31 -9.993 -1.893 -3.728 1.00 43.13 C ATOM 492 CG2 ILE A 31 -9.443 0.528 -4.157 1.00 44.25 C ATOM 493 CD1 ILE A 31 -8.903 -2.063 -2.692 1.00 34.33 C ATOM 0 H ILE A 31 -10.135 1.164 -6.312 1.00 62.33 H new ATOM 0 HA ILE A 31 -10.745 -1.682 -6.464 1.00 1.44 H new ATOM 0 HB ILE A 31 -8.746 -1.140 -5.292 1.00 3.12 H new ATOM 0 HG12 ILE A 31 -10.920 -1.616 -3.226 1.00 43.13 H new ATOM 0 HG13 ILE A 31 -10.170 -2.851 -4.217 1.00 43.13 H new ATOM 0 HG21 ILE A 31 -8.654 0.455 -3.408 1.00 44.25 H new ATOM 0 HG22 ILE A 31 -9.149 1.244 -4.925 1.00 44.25 H new ATOM 0 HG23 ILE A 31 -10.364 0.864 -3.681 1.00 44.25 H new ATOM 0 HD11 ILE A 31 -9.202 -2.823 -1.971 1.00 34.33 H new ATOM 0 HD12 ILE A 31 -7.980 -2.371 -3.183 1.00 34.33 H new ATOM 0 HD13 ILE A 31 -8.741 -1.117 -2.176 1.00 34.33 H new ATOM 505 N ASP A 32 -12.948 -1.741 -5.333 1.00 30.42 N ATOM 506 CA ASP A 32 -14.288 -1.758 -4.759 1.00 33.32 C ATOM 507 C ASP A 32 -14.664 -3.174 -4.329 1.00 0.12 C ATOM 508 O ASP A 32 -13.853 -4.097 -4.453 1.00 23.44 O ATOM 509 CB ASP A 32 -15.311 -1.214 -5.768 1.00 43.24 C ATOM 510 CG ASP A 32 -16.456 -0.462 -5.106 1.00 1.44 C ATOM 511 OD1 ASP A 32 -17.225 -1.078 -4.335 1.00 32.22 O ATOM 512 OD2 ASP A 32 -16.603 0.750 -5.364 1.00 71.24 O ATOM 0 H ASP A 32 -12.686 -2.594 -5.828 1.00 30.42 H new ATOM 0 HA ASP A 32 -14.296 -1.115 -3.879 1.00 33.32 H new ATOM 0 HB2 ASP A 32 -14.805 -0.550 -6.469 1.00 43.24 H new ATOM 0 HB3 ASP A 32 -15.716 -2.042 -6.349 1.00 43.24 H new ATOM 517 N LYS A 33 -15.903 -3.309 -3.846 1.00 45.31 N ATOM 518 CA LYS A 33 -16.476 -4.542 -3.281 1.00 25.22 C ATOM 519 C LYS A 33 -15.643 -5.127 -2.134 1.00 70.11 C ATOM 520 O LYS A 33 -14.422 -5.001 -2.084 1.00 44.24 O ATOM 521 CB LYS A 33 -16.808 -5.599 -4.360 1.00 52.53 C ATOM 522 CG LYS A 33 -15.632 -6.254 -5.074 1.00 21.03 C ATOM 523 CD LYS A 33 -16.115 -6.965 -6.333 1.00 34.13 C ATOM 524 CE LYS A 33 -14.972 -7.504 -7.180 1.00 13.34 C ATOM 525 NZ LYS A 33 -14.333 -8.704 -6.579 1.00 24.30 N ATOM 0 H LYS A 33 -16.564 -2.532 -3.836 1.00 45.31 H new ATOM 0 HA LYS A 33 -17.426 -4.241 -2.840 1.00 25.22 H new ATOM 0 HB2 LYS A 33 -17.401 -6.385 -3.892 1.00 52.53 H new ATOM 0 HB3 LYS A 33 -17.441 -5.128 -5.112 1.00 52.53 H new ATOM 0 HG2 LYS A 33 -14.889 -5.500 -5.335 1.00 21.03 H new ATOM 0 HG3 LYS A 33 -15.144 -6.966 -4.409 1.00 21.03 H new ATOM 0 HD2 LYS A 33 -16.772 -7.788 -6.051 1.00 34.13 H new ATOM 0 HD3 LYS A 33 -16.709 -6.273 -6.930 1.00 34.13 H new ATOM 0 HE2 LYS A 33 -15.347 -7.755 -8.172 1.00 13.34 H new ATOM 0 HE3 LYS A 33 -14.222 -6.724 -7.310 1.00 13.34 H new ATOM 0 HZ1 LYS A 33 -13.786 -9.207 -7.307 1.00 24.30 H new ATOM 0 HZ2 LYS A 33 -13.698 -8.410 -5.810 1.00 24.30 H new ATOM 0 HZ3 LYS A 33 -15.067 -9.335 -6.200 1.00 24.30 H new ATOM 539 N ASN A 34 -16.336 -5.764 -1.198 1.00 40.12 N ATOM 540 CA ASN A 34 -15.715 -6.277 0.025 1.00 31.21 C ATOM 541 C ASN A 34 -14.767 -7.436 -0.287 1.00 34.24 C ATOM 542 O ASN A 34 -13.921 -7.807 0.528 1.00 52.30 O ATOM 543 CB ASN A 34 -16.802 -6.709 1.017 1.00 22.44 C ATOM 544 CG ASN A 34 -16.248 -7.072 2.381 1.00 15.44 C ATOM 545 OD1 ASN A 34 -16.002 -6.202 3.219 1.00 63.45 O ATOM 546 ND2 ASN A 34 -16.077 -8.358 2.628 1.00 72.22 N ATOM 0 H ASN A 34 -17.339 -5.941 -1.261 1.00 40.12 H new ATOM 0 HA ASN A 34 -15.123 -5.482 0.478 1.00 31.21 H new ATOM 0 HB2 ASN A 34 -17.526 -5.902 1.128 1.00 22.44 H new ATOM 0 HB3 ASN A 34 -17.339 -7.565 0.609 1.00 22.44 H new ATOM 0 HD21 ASN A 34 -15.730 -8.661 3.538 1.00 72.22 H new ATOM 0 HD22 ASN A 34 -16.292 -9.048 1.909 1.00 72.22 H new ATOM 553 N ASP A 35 -14.914 -7.993 -1.481 1.00 0.14 N ATOM 554 CA ASP A 35 -14.006 -9.020 -1.980 1.00 31.20 C ATOM 555 C ASP A 35 -12.648 -8.407 -2.330 1.00 54.24 C ATOM 556 O ASP A 35 -11.682 -9.121 -2.597 1.00 41.01 O ATOM 557 CB ASP A 35 -14.621 -9.697 -3.207 1.00 62.52 C ATOM 558 CG ASP A 35 -13.786 -10.841 -3.738 1.00 52.15 C ATOM 559 OD1 ASP A 35 -13.626 -11.849 -3.020 1.00 35.11 O ATOM 560 OD2 ASP A 35 -13.320 -10.750 -4.893 1.00 32.21 O ATOM 0 H ASP A 35 -15.662 -7.748 -2.130 1.00 0.14 H new ATOM 0 HA ASP A 35 -13.851 -9.768 -1.202 1.00 31.20 H new ATOM 0 HB2 ASP A 35 -15.613 -10.069 -2.950 1.00 62.52 H new ATOM 0 HB3 ASP A 35 -14.753 -8.956 -3.995 1.00 62.52 H new ATOM 565 N THR A 36 -12.602 -7.072 -2.313 1.00 20.41 N ATOM 566 CA THR A 36 -11.393 -6.284 -2.568 1.00 63.14 C ATOM 567 C THR A 36 -10.727 -6.638 -3.895 1.00 13.21 C ATOM 568 O THR A 36 -9.819 -7.473 -3.959 1.00 64.31 O ATOM 569 CB THR A 36 -10.364 -6.382 -1.414 1.00 2.23 C ATOM 570 OG1 THR A 36 -9.989 -7.745 -1.178 1.00 22.11 O ATOM 571 CG2 THR A 36 -10.928 -5.779 -0.136 1.00 31.13 C ATOM 0 H THR A 36 -13.421 -6.497 -2.117 1.00 20.41 H new ATOM 0 HA THR A 36 -11.735 -5.251 -2.629 1.00 63.14 H new ATOM 0 HB THR A 36 -9.479 -5.819 -1.711 1.00 2.23 H new ATOM 0 HG1 THR A 36 -10.305 -8.304 -1.918 1.00 22.11 H new ATOM 0 HG21 THR A 36 -10.189 -5.859 0.661 1.00 31.13 H new ATOM 0 HG22 THR A 36 -11.169 -4.729 -0.304 1.00 31.13 H new ATOM 0 HG23 THR A 36 -11.831 -6.317 0.152 1.00 31.13 H new ATOM 579 N ALA A 37 -11.192 -5.997 -4.954 1.00 31.53 N ATOM 580 CA ALA A 37 -10.619 -6.188 -6.272 1.00 33.15 C ATOM 581 C ALA A 37 -10.621 -4.878 -7.041 1.00 14.32 C ATOM 582 O ALA A 37 -11.406 -3.973 -6.745 1.00 42.11 O ATOM 583 CB ALA A 37 -11.373 -7.261 -7.039 1.00 43.51 C ATOM 0 H ALA A 37 -11.969 -5.337 -4.924 1.00 31.53 H new ATOM 0 HA ALA A 37 -9.588 -6.521 -6.154 1.00 33.15 H new ATOM 0 HB1 ALA A 37 -10.925 -7.386 -8.025 1.00 43.51 H new ATOM 0 HB2 ALA A 37 -11.320 -8.203 -6.494 1.00 43.51 H new ATOM 0 HB3 ALA A 37 -12.416 -6.964 -7.150 1.00 43.51 H new ATOM 589 N ILE A 38 -9.734 -4.781 -8.013 1.00 40.40 N ATOM 590 CA ILE A 38 -9.611 -3.583 -8.825 1.00 51.51 C ATOM 591 C ILE A 38 -10.449 -3.724 -10.092 1.00 73.14 C ATOM 592 O ILE A 38 -10.243 -4.649 -10.875 1.00 42.21 O ATOM 593 CB ILE A 38 -8.137 -3.345 -9.204 1.00 54.00 C ATOM 594 CG1 ILE A 38 -7.251 -3.493 -7.964 1.00 34.23 C ATOM 595 CG2 ILE A 38 -7.965 -1.966 -9.817 1.00 44.45 C ATOM 596 CD1 ILE A 38 -5.775 -3.606 -8.274 1.00 53.22 C ATOM 0 H ILE A 38 -9.082 -5.525 -8.262 1.00 40.40 H new ATOM 0 HA ILE A 38 -9.971 -2.732 -8.247 1.00 51.51 H new ATOM 0 HB ILE A 38 -7.837 -4.089 -9.942 1.00 54.00 H new ATOM 0 HG12 ILE A 38 -7.410 -2.635 -7.311 1.00 34.23 H new ATOM 0 HG13 ILE A 38 -7.564 -4.377 -7.409 1.00 34.23 H new ATOM 0 HG21 ILE A 38 -6.918 -1.813 -10.080 1.00 44.45 H new ATOM 0 HG22 ILE A 38 -8.579 -1.887 -10.714 1.00 44.45 H new ATOM 0 HG23 ILE A 38 -8.274 -1.207 -9.098 1.00 44.45 H new ATOM 0 HD11 ILE A 38 -5.215 -3.708 -7.345 1.00 53.22 H new ATOM 0 HD12 ILE A 38 -5.601 -4.481 -8.900 1.00 53.22 H new ATOM 0 HD13 ILE A 38 -5.444 -2.711 -8.801 1.00 53.22 H new ATOM 608 N VAL A 39 -11.384 -2.806 -10.296 1.00 54.32 N ATOM 609 CA VAL A 39 -12.302 -2.892 -11.423 1.00 73.24 C ATOM 610 C VAL A 39 -12.273 -1.596 -12.245 1.00 32.20 C ATOM 611 O VAL A 39 -11.782 -0.566 -11.777 1.00 70.40 O ATOM 612 CB VAL A 39 -13.743 -3.201 -10.933 1.00 54.12 C ATOM 613 CG1 VAL A 39 -14.326 -2.025 -10.160 1.00 62.24 C ATOM 614 CG2 VAL A 39 -14.652 -3.608 -12.089 1.00 1.45 C ATOM 0 H VAL A 39 -11.527 -1.994 -9.696 1.00 54.32 H new ATOM 0 HA VAL A 39 -11.979 -3.710 -12.066 1.00 73.24 H new ATOM 0 HB VAL A 39 -13.682 -4.049 -10.251 1.00 54.12 H new ATOM 0 HG11 VAL A 39 -15.335 -2.271 -9.830 1.00 62.24 H new ATOM 0 HG12 VAL A 39 -13.701 -1.815 -9.292 1.00 62.24 H new ATOM 0 HG13 VAL A 39 -14.359 -1.147 -10.804 1.00 62.24 H new ATOM 0 HG21 VAL A 39 -15.652 -3.817 -11.709 1.00 1.45 H new ATOM 0 HG22 VAL A 39 -14.702 -2.797 -12.816 1.00 1.45 H new ATOM 0 HG23 VAL A 39 -14.252 -4.501 -12.569 1.00 1.45 H new ATOM 624 N VAL A 40 -12.788 -1.663 -13.469 1.00 13.15 N ATOM 625 CA VAL A 40 -12.795 -0.528 -14.385 1.00 54.23 C ATOM 626 C VAL A 40 -13.736 0.569 -13.904 1.00 70.35 C ATOM 627 O VAL A 40 -14.909 0.315 -13.629 1.00 51.34 O ATOM 628 CB VAL A 40 -13.239 -0.961 -15.800 1.00 21.30 C ATOM 629 CG1 VAL A 40 -13.173 0.205 -16.775 1.00 54.40 C ATOM 630 CG2 VAL A 40 -12.400 -2.128 -16.295 1.00 63.22 C ATOM 0 H VAL A 40 -13.213 -2.507 -13.854 1.00 13.15 H new ATOM 0 HA VAL A 40 -11.775 -0.145 -14.417 1.00 54.23 H new ATOM 0 HB VAL A 40 -14.277 -1.289 -15.740 1.00 21.30 H new ATOM 0 HG11 VAL A 40 -13.491 -0.128 -17.763 1.00 54.40 H new ATOM 0 HG12 VAL A 40 -13.831 1.004 -16.432 1.00 54.40 H new ATOM 0 HG13 VAL A 40 -12.150 0.576 -16.829 1.00 54.40 H new ATOM 0 HG21 VAL A 40 -12.730 -2.416 -17.293 1.00 63.22 H new ATOM 0 HG22 VAL A 40 -11.351 -1.833 -16.331 1.00 63.22 H new ATOM 0 HG23 VAL A 40 -12.516 -2.973 -15.616 1.00 63.22 H new ATOM 640 N GLU A 41 -13.221 1.783 -13.810 1.00 3.24 N ATOM 641 CA GLU A 41 -14.045 2.939 -13.498 1.00 12.41 C ATOM 642 C GLU A 41 -14.486 3.614 -14.793 1.00 2.42 C ATOM 643 O GLU A 41 -15.669 3.895 -14.993 1.00 70.15 O ATOM 644 CB GLU A 41 -13.264 3.931 -12.627 1.00 0.11 C ATOM 645 CG GLU A 41 -14.059 5.168 -12.234 1.00 22.40 C ATOM 646 CD GLU A 41 -15.264 4.839 -11.377 1.00 33.34 C ATOM 647 OE1 GLU A 41 -15.096 4.699 -10.149 1.00 12.50 O ATOM 648 OE2 GLU A 41 -16.377 4.718 -11.926 1.00 13.20 O ATOM 0 H GLU A 41 -12.232 1.994 -13.946 1.00 3.24 H new ATOM 0 HA GLU A 41 -14.924 2.611 -12.944 1.00 12.41 H new ATOM 0 HB2 GLU A 41 -12.933 3.422 -11.722 1.00 0.11 H new ATOM 0 HB3 GLU A 41 -12.368 4.243 -13.164 1.00 0.11 H new ATOM 0 HG2 GLU A 41 -13.410 5.856 -11.692 1.00 22.40 H new ATOM 0 HG3 GLU A 41 -14.389 5.685 -13.135 1.00 22.40 H new ATOM 655 N LYS A 42 -13.529 3.825 -15.688 1.00 3.00 N ATOM 656 CA LYS A 42 -13.781 4.497 -16.955 1.00 21.33 C ATOM 657 C LYS A 42 -12.715 4.095 -17.965 1.00 50.23 C ATOM 658 O LYS A 42 -11.526 4.145 -17.669 1.00 25.12 O ATOM 659 CB LYS A 42 -13.793 6.026 -16.743 1.00 55.34 C ATOM 660 CG LYS A 42 -14.065 6.858 -17.997 1.00 22.13 C ATOM 661 CD LYS A 42 -12.806 7.075 -18.828 1.00 1.03 C ATOM 662 CE LYS A 42 -13.047 8.022 -19.995 1.00 31.50 C ATOM 663 NZ LYS A 42 -14.124 7.546 -20.903 1.00 31.20 N ATOM 0 H LYS A 42 -12.560 3.536 -15.556 1.00 3.00 H new ATOM 0 HA LYS A 42 -14.755 4.199 -17.342 1.00 21.33 H new ATOM 0 HB2 LYS A 42 -14.550 6.267 -15.996 1.00 55.34 H new ATOM 0 HB3 LYS A 42 -12.830 6.326 -16.330 1.00 55.34 H new ATOM 0 HG2 LYS A 42 -14.819 6.359 -18.606 1.00 22.13 H new ATOM 0 HG3 LYS A 42 -14.478 7.824 -17.707 1.00 22.13 H new ATOM 0 HD2 LYS A 42 -12.017 7.477 -18.192 1.00 1.03 H new ATOM 0 HD3 LYS A 42 -12.452 6.116 -19.207 1.00 1.03 H new ATOM 0 HE2 LYS A 42 -13.310 9.007 -19.610 1.00 31.50 H new ATOM 0 HE3 LYS A 42 -12.123 8.137 -20.562 1.00 31.50 H new ATOM 0 HZ1 LYS A 42 -14.124 8.118 -21.771 1.00 31.20 H new ATOM 0 HZ2 LYS A 42 -13.958 6.548 -21.146 1.00 31.20 H new ATOM 0 HZ3 LYS A 42 -15.045 7.638 -20.428 1.00 31.20 H new ATOM 677 N VAL A 43 -13.141 3.683 -19.145 1.00 72.34 N ATOM 678 CA VAL A 43 -12.219 3.329 -20.209 1.00 43.53 C ATOM 679 C VAL A 43 -12.338 4.334 -21.353 1.00 43.33 C ATOM 680 O VAL A 43 -13.384 4.959 -21.536 1.00 11.14 O ATOM 681 CB VAL A 43 -12.481 1.893 -20.726 1.00 21.15 C ATOM 682 CG1 VAL A 43 -13.828 1.795 -21.430 1.00 3.04 C ATOM 683 CG2 VAL A 43 -11.358 1.426 -21.639 1.00 65.10 C ATOM 0 H VAL A 43 -14.126 3.585 -19.392 1.00 72.34 H new ATOM 0 HA VAL A 43 -11.206 3.358 -19.807 1.00 43.53 H new ATOM 0 HB VAL A 43 -12.509 1.232 -19.860 1.00 21.15 H new ATOM 0 HG11 VAL A 43 -13.982 0.775 -21.781 1.00 3.04 H new ATOM 0 HG12 VAL A 43 -14.623 2.063 -20.734 1.00 3.04 H new ATOM 0 HG13 VAL A 43 -13.845 2.477 -22.280 1.00 3.04 H new ATOM 0 HG21 VAL A 43 -11.569 0.415 -21.987 1.00 65.10 H new ATOM 0 HG22 VAL A 43 -11.283 2.096 -22.495 1.00 65.10 H new ATOM 0 HG23 VAL A 43 -10.416 1.432 -21.090 1.00 65.10 H new ATOM 693 N GLY A 44 -11.257 4.524 -22.089 1.00 13.44 N ATOM 694 CA GLY A 44 -11.280 5.419 -23.223 1.00 1.21 C ATOM 695 C GLY A 44 -11.056 4.681 -24.522 1.00 1.35 C ATOM 696 O GLY A 44 -10.246 3.752 -24.580 1.00 20.12 O ATOM 0 H GLY A 44 -10.359 4.071 -21.920 1.00 13.44 H new ATOM 0 HA2 GLY A 44 -12.239 5.936 -23.259 1.00 1.21 H new ATOM 0 HA3 GLY A 44 -10.511 6.182 -23.100 1.00 1.21 H new ATOM 700 N GLU A 45 -11.777 5.087 -25.557 1.00 13.24 N ATOM 701 CA GLU A 45 -11.650 4.480 -26.874 1.00 45.42 C ATOM 702 C GLU A 45 -10.263 4.785 -27.447 1.00 2.32 C ATOM 703 O GLU A 45 -9.566 5.666 -26.947 1.00 14.42 O ATOM 704 CB GLU A 45 -12.752 5.030 -27.789 1.00 55.32 C ATOM 705 CG GLU A 45 -13.429 3.985 -28.667 1.00 41.21 C ATOM 706 CD GLU A 45 -12.577 3.544 -29.838 1.00 11.32 C ATOM 707 OE1 GLU A 45 -12.630 4.204 -30.900 1.00 13.35 O ATOM 708 OE2 GLU A 45 -11.849 2.547 -29.705 1.00 61.12 O ATOM 0 H GLU A 45 -12.462 5.841 -25.509 1.00 13.24 H new ATOM 0 HA GLU A 45 -11.761 3.398 -26.801 1.00 45.42 H new ATOM 0 HB2 GLU A 45 -13.510 5.513 -27.173 1.00 55.32 H new ATOM 0 HB3 GLU A 45 -12.323 5.801 -28.430 1.00 55.32 H new ATOM 0 HG2 GLU A 45 -13.677 3.115 -28.059 1.00 41.21 H new ATOM 0 HG3 GLU A 45 -14.369 4.390 -29.042 1.00 41.21 H new ATOM 715 N LYS A 46 -9.872 4.067 -28.492 1.00 43.41 N ATOM 716 CA LYS A 46 -8.565 4.260 -29.126 1.00 35.24 C ATOM 717 C LYS A 46 -8.452 5.654 -29.753 1.00 43.31 C ATOM 718 O LYS A 46 -7.369 6.085 -30.151 1.00 23.32 O ATOM 719 CB LYS A 46 -8.352 3.194 -30.202 1.00 4.52 C ATOM 720 CG LYS A 46 -9.339 3.310 -31.348 1.00 61.20 C ATOM 721 CD LYS A 46 -9.288 2.113 -32.275 1.00 24.02 C ATOM 722 CE LYS A 46 -10.296 2.266 -33.399 1.00 32.41 C ATOM 723 NZ LYS A 46 -11.687 2.416 -32.887 1.00 74.13 N ATOM 0 H LYS A 46 -10.442 3.340 -28.924 1.00 43.41 H new ATOM 0 HA LYS A 46 -7.798 4.169 -28.357 1.00 35.24 H new ATOM 0 HB2 LYS A 46 -7.338 3.276 -30.592 1.00 4.52 H new ATOM 0 HB3 LYS A 46 -8.441 2.206 -29.751 1.00 4.52 H new ATOM 0 HG2 LYS A 46 -10.347 3.413 -30.947 1.00 61.20 H new ATOM 0 HG3 LYS A 46 -9.128 4.216 -31.916 1.00 61.20 H new ATOM 0 HD2 LYS A 46 -8.285 2.010 -32.690 1.00 24.02 H new ATOM 0 HD3 LYS A 46 -9.496 1.202 -31.714 1.00 24.02 H new ATOM 0 HE2 LYS A 46 -10.036 3.136 -34.002 1.00 32.41 H new ATOM 0 HE3 LYS A 46 -10.243 1.396 -34.054 1.00 32.41 H new ATOM 0 HZ1 LYS A 46 -12.357 2.364 -33.681 1.00 74.13 H new ATOM 0 HZ2 LYS A 46 -11.892 1.653 -32.211 1.00 74.13 H new ATOM 0 HZ3 LYS A 46 -11.784 3.336 -32.411 1.00 74.13 H new ATOM 737 N ASN A 47 -9.582 6.343 -29.859 1.00 74.04 N ATOM 738 CA ASN A 47 -9.614 7.690 -30.423 1.00 51.50 C ATOM 739 C ASN A 47 -10.040 8.702 -29.365 1.00 2.20 C ATOM 740 O ASN A 47 -10.453 9.816 -29.688 1.00 5.35 O ATOM 741 CB ASN A 47 -10.575 7.755 -31.613 1.00 13.12 C ATOM 742 CG ASN A 47 -10.144 6.894 -32.790 1.00 42.33 C ATOM 743 OD1 ASN A 47 -8.842 6.723 -32.968 1.00 44.32 O flip ATOM 744 ND2 ASN A 47 -10.981 6.385 -33.538 1.00 24.02 N flip ATOM 0 H ASN A 47 -10.492 5.991 -29.561 1.00 74.04 H new ATOM 0 HA ASN A 47 -8.609 7.935 -30.767 1.00 51.50 H new ATOM 0 HB2 ASN A 47 -11.566 7.440 -31.287 1.00 13.12 H new ATOM 0 HB3 ASN A 47 -10.662 8.790 -31.943 1.00 13.12 H new ATOM 0 HD21 ASN A 47 -11.975 6.538 -33.370 1.00 24.02 H new ATOM 0 HD22 ASN A 47 -10.679 5.810 -34.325 1.00 24.02 H new ATOM 751 N ALA A 48 -9.916 8.317 -28.103 1.00 23.44 N ATOM 752 CA ALA A 48 -10.341 9.166 -26.998 1.00 70.32 C ATOM 753 C ALA A 48 -9.453 10.400 -26.876 1.00 63.02 C ATOM 754 O ALA A 48 -8.232 10.314 -27.019 1.00 61.30 O ATOM 755 CB ALA A 48 -10.332 8.383 -25.696 1.00 44.55 C ATOM 0 H ALA A 48 -9.524 7.420 -27.818 1.00 23.44 H new ATOM 0 HA ALA A 48 -11.358 9.500 -27.204 1.00 70.32 H new ATOM 0 HB1 ALA A 48 -10.652 9.031 -24.880 1.00 44.55 H new ATOM 0 HB2 ALA A 48 -11.014 7.536 -25.776 1.00 44.55 H new ATOM 0 HB3 ALA A 48 -9.324 8.019 -25.497 1.00 44.55 H new ATOM 761 N PRO A 49 -10.063 11.567 -26.632 1.00 22.34 N ATOM 762 CA PRO A 49 -9.345 12.825 -26.456 1.00 24.11 C ATOM 763 C PRO A 49 -8.847 13.006 -25.025 1.00 74.25 C ATOM 764 O PRO A 49 -9.309 12.324 -24.106 1.00 40.31 O ATOM 765 CB PRO A 49 -10.400 13.893 -26.790 1.00 52.22 C ATOM 766 CG PRO A 49 -11.675 13.153 -27.076 1.00 2.43 C ATOM 767 CD PRO A 49 -11.504 11.769 -26.525 1.00 51.01 C ATOM 0 HA PRO A 49 -8.455 12.876 -27.083 1.00 24.11 H new ATOM 0 HB2 PRO A 49 -10.530 14.584 -25.957 1.00 52.22 H new ATOM 0 HB3 PRO A 49 -10.093 14.486 -27.652 1.00 52.22 H new ATOM 0 HG2 PRO A 49 -12.525 13.652 -26.611 1.00 2.43 H new ATOM 0 HG3 PRO A 49 -11.872 13.121 -28.148 1.00 2.43 H new ATOM 0 HD2 PRO A 49 -11.849 11.696 -25.494 1.00 51.01 H new ATOM 0 HD3 PRO A 49 -12.062 11.030 -27.101 1.00 51.01 H new ATOM 775 N TYR A 50 -7.910 13.932 -24.840 1.00 52.53 N ATOM 776 CA TYR A 50 -7.380 14.230 -23.513 1.00 23.43 C ATOM 777 C TYR A 50 -8.446 14.879 -22.637 1.00 5.04 C ATOM 778 O TYR A 50 -8.504 14.628 -21.433 1.00 31.12 O ATOM 779 CB TYR A 50 -6.161 15.154 -23.600 1.00 52.21 C ATOM 780 CG TYR A 50 -4.946 14.527 -24.245 1.00 45.42 C ATOM 781 CD1 TYR A 50 -4.260 13.491 -23.623 1.00 31.04 C ATOM 782 CD2 TYR A 50 -4.476 14.982 -25.468 1.00 45.25 C ATOM 783 CE1 TYR A 50 -3.142 12.924 -24.207 1.00 61.30 C ATOM 784 CE2 TYR A 50 -3.359 14.423 -26.058 1.00 51.01 C ATOM 785 CZ TYR A 50 -2.696 13.395 -25.422 1.00 61.22 C ATOM 786 OH TYR A 50 -1.582 12.835 -26.004 1.00 41.11 O ATOM 0 H TYR A 50 -7.503 14.488 -25.592 1.00 52.53 H new ATOM 0 HA TYR A 50 -7.074 13.285 -23.064 1.00 23.43 H new ATOM 0 HB2 TYR A 50 -6.436 16.046 -24.163 1.00 52.21 H new ATOM 0 HB3 TYR A 50 -5.896 15.481 -22.595 1.00 52.21 H new ATOM 0 HD1 TYR A 50 -4.605 13.123 -22.668 1.00 31.04 H new ATOM 0 HD2 TYR A 50 -4.993 15.788 -25.968 1.00 45.25 H new ATOM 0 HE1 TYR A 50 -2.622 12.117 -23.713 1.00 61.30 H new ATOM 0 HE2 TYR A 50 -3.007 14.789 -27.011 1.00 51.01 H new ATOM 0 HH TYR A 50 -1.401 13.280 -26.858 1.00 41.11 H new ATOM 796 N ALA A 51 -9.285 15.707 -23.255 1.00 62.34 N ATOM 797 CA ALA A 51 -10.337 16.428 -22.545 1.00 53.03 C ATOM 798 C ALA A 51 -11.207 15.492 -21.713 1.00 63.50 C ATOM 799 O ALA A 51 -11.457 15.759 -20.537 1.00 30.23 O ATOM 800 CB ALA A 51 -11.196 17.204 -23.531 1.00 73.01 C ATOM 0 H ALA A 51 -9.255 15.896 -24.257 1.00 62.34 H new ATOM 0 HA ALA A 51 -9.854 17.124 -21.859 1.00 53.03 H new ATOM 0 HB1 ALA A 51 -11.978 17.738 -22.991 1.00 73.01 H new ATOM 0 HB2 ALA A 51 -10.575 17.919 -24.071 1.00 73.01 H new ATOM 0 HB3 ALA A 51 -11.652 16.512 -24.239 1.00 73.01 H new ATOM 806 N GLU A 52 -11.657 14.395 -22.319 1.00 2.50 N ATOM 807 CA GLU A 52 -12.509 13.435 -21.623 1.00 73.35 C ATOM 808 C GLU A 52 -11.780 12.840 -20.422 1.00 31.24 C ATOM 809 O GLU A 52 -12.334 12.764 -19.325 1.00 10.31 O ATOM 810 CB GLU A 52 -12.962 12.322 -22.575 1.00 22.22 C ATOM 811 CG GLU A 52 -13.881 11.304 -21.919 1.00 61.42 C ATOM 812 CD GLU A 52 -14.448 10.298 -22.897 1.00 53.42 C ATOM 813 OE1 GLU A 52 -15.488 10.594 -23.522 1.00 74.24 O ATOM 814 OE2 GLU A 52 -13.878 9.193 -23.024 1.00 52.44 O ATOM 0 H GLU A 52 -11.447 14.150 -23.287 1.00 2.50 H new ATOM 0 HA GLU A 52 -13.392 13.964 -21.265 1.00 73.35 H new ATOM 0 HB2 GLU A 52 -13.476 12.769 -23.426 1.00 22.22 H new ATOM 0 HB3 GLU A 52 -12.084 11.809 -22.966 1.00 22.22 H new ATOM 0 HG2 GLU A 52 -13.331 10.775 -21.141 1.00 61.42 H new ATOM 0 HG3 GLU A 52 -14.702 11.827 -21.429 1.00 61.42 H new ATOM 821 N PHE A 53 -10.532 12.442 -20.633 1.00 74.24 N ATOM 822 CA PHE A 53 -9.717 11.856 -19.574 1.00 60.24 C ATOM 823 C PHE A 53 -9.606 12.808 -18.387 1.00 21.00 C ATOM 824 O PHE A 53 -9.738 12.397 -17.233 1.00 51.22 O ATOM 825 CB PHE A 53 -8.323 11.514 -20.114 1.00 22.21 C ATOM 826 CG PHE A 53 -7.405 10.890 -19.099 1.00 14.23 C ATOM 827 CD1 PHE A 53 -7.670 9.629 -18.587 1.00 71.41 C ATOM 828 CD2 PHE A 53 -6.276 11.563 -18.659 1.00 72.02 C ATOM 829 CE1 PHE A 53 -6.828 9.053 -17.657 1.00 74.14 C ATOM 830 CE2 PHE A 53 -5.430 10.991 -17.728 1.00 11.14 C ATOM 831 CZ PHE A 53 -5.706 9.734 -17.227 1.00 55.14 C ATOM 0 H PHE A 53 -10.059 12.515 -21.534 1.00 74.24 H new ATOM 0 HA PHE A 53 -10.200 10.941 -19.232 1.00 60.24 H new ATOM 0 HB2 PHE A 53 -8.430 10.833 -20.958 1.00 22.21 H new ATOM 0 HB3 PHE A 53 -7.860 12.424 -20.495 1.00 22.21 H new ATOM 0 HD1 PHE A 53 -8.545 9.091 -18.920 1.00 71.41 H new ATOM 0 HD2 PHE A 53 -6.055 12.546 -19.048 1.00 72.02 H new ATOM 0 HE1 PHE A 53 -7.047 8.070 -17.266 1.00 74.14 H new ATOM 0 HE2 PHE A 53 -4.554 11.526 -17.393 1.00 11.14 H new ATOM 0 HZ PHE A 53 -5.046 9.284 -16.500 1.00 55.14 H new ATOM 841 N VAL A 54 -9.378 14.081 -18.681 1.00 1.33 N ATOM 842 CA VAL A 54 -9.257 15.090 -17.642 1.00 12.13 C ATOM 843 C VAL A 54 -10.584 15.286 -16.917 1.00 24.53 C ATOM 844 O VAL A 54 -10.633 15.244 -15.689 1.00 11.35 O ATOM 845 CB VAL A 54 -8.778 16.443 -18.216 1.00 61.10 C ATOM 846 CG1 VAL A 54 -8.704 17.503 -17.125 1.00 2.15 C ATOM 847 CG2 VAL A 54 -7.428 16.287 -18.898 1.00 12.13 C ATOM 0 H VAL A 54 -9.273 14.438 -19.631 1.00 1.33 H new ATOM 0 HA VAL A 54 -8.510 14.731 -16.934 1.00 12.13 H new ATOM 0 HB VAL A 54 -9.506 16.770 -18.958 1.00 61.10 H new ATOM 0 HG11 VAL A 54 -8.364 18.445 -17.555 1.00 2.15 H new ATOM 0 HG12 VAL A 54 -9.691 17.641 -16.684 1.00 2.15 H new ATOM 0 HG13 VAL A 54 -8.003 17.183 -16.354 1.00 2.15 H new ATOM 0 HG21 VAL A 54 -7.108 17.250 -19.296 1.00 12.13 H new ATOM 0 HG22 VAL A 54 -6.694 15.931 -18.175 1.00 12.13 H new ATOM 0 HG23 VAL A 54 -7.513 15.568 -19.713 1.00 12.13 H new ATOM 857 N GLU A 55 -11.663 15.469 -17.673 1.00 12.01 N ATOM 858 CA GLU A 55 -12.963 15.777 -17.080 1.00 31.35 C ATOM 859 C GLU A 55 -13.499 14.619 -16.242 1.00 22.24 C ATOM 860 O GLU A 55 -14.165 14.844 -15.231 1.00 25.04 O ATOM 861 CB GLU A 55 -13.983 16.163 -18.150 1.00 5.53 C ATOM 862 CG GLU A 55 -13.630 17.439 -18.896 1.00 14.35 C ATOM 863 CD GLU A 55 -14.800 17.992 -19.681 1.00 70.32 C ATOM 864 OE1 GLU A 55 -15.241 17.332 -20.647 1.00 34.14 O ATOM 865 OE2 GLU A 55 -15.297 19.084 -19.321 1.00 1.43 O ATOM 0 H GLU A 55 -11.665 15.410 -18.691 1.00 12.01 H new ATOM 0 HA GLU A 55 -12.809 16.629 -16.418 1.00 31.35 H new ATOM 0 HB2 GLU A 55 -14.072 15.346 -18.866 1.00 5.53 H new ATOM 0 HB3 GLU A 55 -14.960 16.284 -17.682 1.00 5.53 H new ATOM 0 HG2 GLU A 55 -13.287 18.190 -18.184 1.00 14.35 H new ATOM 0 HG3 GLU A 55 -12.801 17.242 -19.576 1.00 14.35 H new ATOM 872 N GLU A 56 -13.210 13.387 -16.651 1.00 14.53 N ATOM 873 CA GLU A 56 -13.639 12.216 -15.887 1.00 61.25 C ATOM 874 C GLU A 56 -13.018 12.216 -14.492 1.00 30.21 C ATOM 875 O GLU A 56 -13.664 11.846 -13.513 1.00 51.23 O ATOM 876 CB GLU A 56 -13.279 10.924 -16.623 1.00 74.32 C ATOM 877 CG GLU A 56 -14.097 10.693 -17.880 1.00 43.12 C ATOM 878 CD GLU A 56 -15.577 10.547 -17.595 1.00 4.10 C ATOM 879 OE1 GLU A 56 -16.026 9.414 -17.324 1.00 24.34 O ATOM 880 OE2 GLU A 56 -16.302 11.563 -17.648 1.00 31.22 O ATOM 0 H GLU A 56 -12.685 13.173 -17.499 1.00 14.53 H new ATOM 0 HA GLU A 56 -14.723 12.267 -15.783 1.00 61.25 H new ATOM 0 HB2 GLU A 56 -12.222 10.949 -16.887 1.00 74.32 H new ATOM 0 HB3 GLU A 56 -13.419 10.080 -15.948 1.00 74.32 H new ATOM 0 HG2 GLU A 56 -13.944 11.526 -18.567 1.00 43.12 H new ATOM 0 HG3 GLU A 56 -13.738 9.795 -18.383 1.00 43.12 H new ATOM 887 N MET A 57 -11.765 12.641 -14.412 1.00 75.30 N ATOM 888 CA MET A 57 -11.071 12.751 -13.135 1.00 73.22 C ATOM 889 C MET A 57 -11.513 14.028 -12.421 1.00 22.42 C ATOM 890 O MET A 57 -11.714 14.042 -11.204 1.00 53.13 O ATOM 891 CB MET A 57 -9.552 12.738 -13.376 1.00 0.20 C ATOM 892 CG MET A 57 -8.699 12.731 -12.115 1.00 63.04 C ATOM 893 SD MET A 57 -8.405 14.380 -11.443 1.00 51.35 S ATOM 894 CE MET A 57 -7.284 13.994 -10.101 1.00 50.50 C ATOM 0 H MET A 57 -11.206 12.916 -15.219 1.00 75.30 H new ATOM 0 HA MET A 57 -11.322 11.903 -12.497 1.00 73.22 H new ATOM 0 HB2 MET A 57 -9.301 11.859 -13.971 1.00 0.20 H new ATOM 0 HB3 MET A 57 -9.286 13.612 -13.971 1.00 0.20 H new ATOM 0 HG2 MET A 57 -9.188 12.119 -11.357 1.00 63.04 H new ATOM 0 HG3 MET A 57 -7.741 12.260 -12.335 1.00 63.04 H new ATOM 0 HE1 MET A 57 -7.006 14.912 -9.583 1.00 50.50 H new ATOM 0 HE2 MET A 57 -7.774 13.317 -9.401 1.00 50.50 H new ATOM 0 HE3 MET A 57 -6.389 13.518 -10.500 1.00 50.50 H new ATOM 904 N LYS A 58 -11.701 15.081 -13.209 1.00 20.50 N ATOM 905 CA LYS A 58 -12.126 16.384 -12.716 1.00 44.01 C ATOM 906 C LYS A 58 -13.439 16.289 -11.942 1.00 31.32 C ATOM 907 O LYS A 58 -13.535 16.775 -10.816 1.00 15.11 O ATOM 908 CB LYS A 58 -12.237 17.349 -13.913 1.00 51.44 C ATOM 909 CG LYS A 58 -13.011 18.640 -13.672 1.00 31.33 C ATOM 910 CD LYS A 58 -14.477 18.483 -14.049 1.00 4.23 C ATOM 911 CE LYS A 58 -15.118 19.811 -14.418 1.00 10.01 C ATOM 912 NZ LYS A 58 -15.090 20.792 -13.301 1.00 74.41 N ATOM 0 H LYS A 58 -11.561 15.052 -14.219 1.00 20.50 H new ATOM 0 HA LYS A 58 -11.386 16.766 -12.013 1.00 44.01 H new ATOM 0 HB2 LYS A 58 -11.229 17.610 -14.236 1.00 51.44 H new ATOM 0 HB3 LYS A 58 -12.709 16.817 -14.739 1.00 51.44 H new ATOM 0 HG2 LYS A 58 -12.931 18.924 -12.623 1.00 31.33 H new ATOM 0 HG3 LYS A 58 -12.567 19.447 -14.255 1.00 31.33 H new ATOM 0 HD2 LYS A 58 -14.563 17.794 -14.889 1.00 4.23 H new ATOM 0 HD3 LYS A 58 -15.020 18.038 -13.215 1.00 4.23 H new ATOM 0 HE2 LYS A 58 -14.600 20.233 -15.279 1.00 10.01 H new ATOM 0 HE3 LYS A 58 -16.151 19.640 -14.720 1.00 10.01 H new ATOM 0 HZ1 LYS A 58 -15.147 21.757 -13.685 1.00 74.41 H new ATOM 0 HZ2 LYS A 58 -15.899 20.622 -12.670 1.00 74.41 H new ATOM 0 HZ3 LYS A 58 -14.205 20.684 -12.766 1.00 74.41 H new ATOM 926 N LYS A 59 -14.430 15.626 -12.529 1.00 51.01 N ATOM 927 CA LYS A 59 -15.763 15.560 -11.937 1.00 72.52 C ATOM 928 C LYS A 59 -15.762 14.751 -10.640 1.00 3.22 C ATOM 929 O LYS A 59 -16.640 14.921 -9.792 1.00 60.13 O ATOM 930 CB LYS A 59 -16.761 14.961 -12.933 1.00 22.32 C ATOM 931 CG LYS A 59 -16.514 13.497 -13.253 1.00 55.12 C ATOM 932 CD LYS A 59 -17.482 12.994 -14.309 1.00 24.02 C ATOM 933 CE LYS A 59 -17.343 11.497 -14.525 1.00 53.32 C ATOM 934 NZ LYS A 59 -18.189 11.012 -15.649 1.00 3.23 N ATOM 0 H LYS A 59 -14.336 15.127 -13.414 1.00 51.01 H new ATOM 0 HA LYS A 59 -16.068 16.578 -11.696 1.00 72.52 H new ATOM 0 HB2 LYS A 59 -17.768 15.069 -12.531 1.00 22.32 H new ATOM 0 HB3 LYS A 59 -16.724 15.536 -13.859 1.00 22.32 H new ATOM 0 HG2 LYS A 59 -15.490 13.366 -13.603 1.00 55.12 H new ATOM 0 HG3 LYS A 59 -16.619 12.901 -12.346 1.00 55.12 H new ATOM 0 HD2 LYS A 59 -18.503 13.226 -14.007 1.00 24.02 H new ATOM 0 HD3 LYS A 59 -17.301 13.516 -15.248 1.00 24.02 H new ATOM 0 HE2 LYS A 59 -16.299 11.256 -14.727 1.00 53.32 H new ATOM 0 HE3 LYS A 59 -17.620 10.972 -13.611 1.00 53.32 H new ATOM 0 HZ1 LYS A 59 -18.265 9.976 -15.604 1.00 3.23 H new ATOM 0 HZ2 LYS A 59 -19.137 11.432 -15.576 1.00 3.23 H new ATOM 0 HZ3 LYS A 59 -17.756 11.288 -16.553 1.00 3.23 H new ATOM 948 N LEU A 60 -14.773 13.879 -10.480 1.00 5.31 N ATOM 949 CA LEU A 60 -14.686 13.044 -9.288 1.00 24.21 C ATOM 950 C LEU A 60 -14.113 13.829 -8.114 1.00 20.12 C ATOM 951 O LEU A 60 -14.622 13.752 -6.995 1.00 43.34 O ATOM 952 CB LEU A 60 -13.832 11.800 -9.560 1.00 13.11 C ATOM 953 CG LEU A 60 -14.417 10.817 -10.579 1.00 44.23 C ATOM 954 CD1 LEU A 60 -13.471 9.646 -10.800 1.00 24.31 C ATOM 955 CD2 LEU A 60 -15.782 10.319 -10.124 1.00 32.22 C ATOM 0 H LEU A 60 -14.024 13.732 -11.157 1.00 5.31 H new ATOM 0 HA LEU A 60 -15.695 12.725 -9.028 1.00 24.21 H new ATOM 0 HB2 LEU A 60 -12.852 12.122 -9.911 1.00 13.11 H new ATOM 0 HB3 LEU A 60 -13.676 11.273 -8.619 1.00 13.11 H new ATOM 0 HG LEU A 60 -14.541 11.343 -11.526 1.00 44.23 H new ATOM 0 HD11 LEU A 60 -13.905 8.960 -11.527 1.00 24.31 H new ATOM 0 HD12 LEU A 60 -12.516 10.015 -11.175 1.00 24.31 H new ATOM 0 HD13 LEU A 60 -13.313 9.123 -9.857 1.00 24.31 H new ATOM 0 HD21 LEU A 60 -16.180 9.622 -10.862 1.00 32.22 H new ATOM 0 HD22 LEU A 60 -15.683 9.813 -9.164 1.00 32.22 H new ATOM 0 HD23 LEU A 60 -16.462 11.165 -10.020 1.00 32.22 H new ATOM 967 N VAL A 61 -13.071 14.604 -8.377 1.00 41.43 N ATOM 968 CA VAL A 61 -12.411 15.381 -7.333 1.00 64.03 C ATOM 969 C VAL A 61 -13.348 16.455 -6.781 1.00 25.41 C ATOM 970 O VAL A 61 -13.204 16.902 -5.641 1.00 44.31 O ATOM 971 CB VAL A 61 -11.118 16.041 -7.862 1.00 4.15 C ATOM 972 CG1 VAL A 61 -10.394 16.796 -6.758 1.00 5.20 C ATOM 973 CG2 VAL A 61 -10.204 14.995 -8.474 1.00 52.43 C ATOM 0 H VAL A 61 -12.662 14.713 -9.305 1.00 41.43 H new ATOM 0 HA VAL A 61 -12.148 14.693 -6.530 1.00 64.03 H new ATOM 0 HB VAL A 61 -11.398 16.759 -8.633 1.00 4.15 H new ATOM 0 HG11 VAL A 61 -9.488 17.249 -7.161 1.00 5.20 H new ATOM 0 HG12 VAL A 61 -11.045 17.576 -6.363 1.00 5.20 H new ATOM 0 HG13 VAL A 61 -10.129 16.105 -5.958 1.00 5.20 H new ATOM 0 HG21 VAL A 61 -9.297 15.475 -8.842 1.00 52.43 H new ATOM 0 HG22 VAL A 61 -9.941 14.254 -7.719 1.00 52.43 H new ATOM 0 HG23 VAL A 61 -10.716 14.504 -9.301 1.00 52.43 H new ATOM 983 N GLU A 62 -14.329 16.845 -7.587 1.00 4.32 N ATOM 984 CA GLU A 62 -15.299 17.854 -7.181 1.00 40.51 C ATOM 985 C GLU A 62 -16.227 17.320 -6.095 1.00 43.32 C ATOM 986 O GLU A 62 -16.896 18.092 -5.407 1.00 73.01 O ATOM 987 CB GLU A 62 -16.112 18.329 -8.385 1.00 74.15 C ATOM 988 CG GLU A 62 -15.249 18.921 -9.482 1.00 14.13 C ATOM 989 CD GLU A 62 -16.052 19.444 -10.648 1.00 41.14 C ATOM 990 OE1 GLU A 62 -16.627 18.633 -11.398 1.00 31.35 O ATOM 991 OE2 GLU A 62 -16.087 20.676 -10.841 1.00 11.14 O ATOM 0 H GLU A 62 -14.473 16.477 -8.527 1.00 4.32 H new ATOM 0 HA GLU A 62 -14.749 18.701 -6.771 1.00 40.51 H new ATOM 0 HB2 GLU A 62 -16.679 17.490 -8.788 1.00 74.15 H new ATOM 0 HB3 GLU A 62 -16.836 19.075 -8.057 1.00 74.15 H new ATOM 0 HG2 GLU A 62 -14.650 19.732 -9.068 1.00 14.13 H new ATOM 0 HG3 GLU A 62 -14.553 18.162 -9.839 1.00 14.13 H new ATOM 998 N ASP A 63 -16.265 16.002 -5.939 1.00 40.13 N ATOM 999 CA ASP A 63 -17.050 15.398 -4.873 1.00 63.22 C ATOM 1000 C ASP A 63 -16.247 15.397 -3.579 1.00 32.24 C ATOM 1001 O ASP A 63 -16.809 15.466 -2.485 1.00 20.21 O ATOM 1002 CB ASP A 63 -17.475 13.976 -5.235 1.00 41.42 C ATOM 1003 CG ASP A 63 -18.378 13.365 -4.179 1.00 61.01 C ATOM 1004 OD1 ASP A 63 -19.567 13.735 -4.119 1.00 21.33 O ATOM 1005 OD2 ASP A 63 -17.900 12.516 -3.398 1.00 53.10 O ATOM 0 H ASP A 63 -15.766 15.338 -6.531 1.00 40.13 H new ATOM 0 HA ASP A 63 -17.955 15.990 -4.736 1.00 63.22 H new ATOM 0 HB2 ASP A 63 -17.994 13.986 -6.194 1.00 41.42 H new ATOM 0 HB3 ASP A 63 -16.589 13.353 -5.358 1.00 41.42 H new ATOM 1010 N GLY A 64 -14.926 15.333 -3.707 1.00 30.20 N ATOM 1011 CA GLY A 64 -14.068 15.476 -2.550 1.00 60.21 C ATOM 1012 C GLY A 64 -13.033 14.374 -2.413 1.00 44.33 C ATOM 1013 O GLY A 64 -11.906 14.508 -2.881 1.00 20.41 O ATOM 0 H GLY A 64 -14.437 15.185 -4.590 1.00 30.20 H new ATOM 0 HA2 GLY A 64 -13.556 16.437 -2.606 1.00 60.21 H new ATOM 0 HA3 GLY A 64 -14.685 15.495 -1.652 1.00 60.21 H new ATOM 1017 N LYS A 65 -13.430 13.273 -1.795 1.00 11.53 N ATOM 1018 CA LYS A 65 -12.486 12.250 -1.350 1.00 31.23 C ATOM 1019 C LYS A 65 -12.255 11.181 -2.415 1.00 62.31 C ATOM 1020 O LYS A 65 -11.865 10.054 -2.100 1.00 31.25 O ATOM 1021 CB LYS A 65 -13.027 11.594 -0.079 1.00 4.45 C ATOM 1022 CG LYS A 65 -13.507 12.598 0.955 1.00 50.54 C ATOM 1023 CD LYS A 65 -14.175 11.918 2.137 1.00 41.24 C ATOM 1024 CE LYS A 65 -14.871 12.930 3.032 1.00 54.23 C ATOM 1025 NZ LYS A 65 -16.020 13.582 2.345 1.00 45.14 N ATOM 0 H LYS A 65 -14.406 13.061 -1.587 1.00 11.53 H new ATOM 0 HA LYS A 65 -11.529 12.734 -1.157 1.00 31.23 H new ATOM 0 HB2 LYS A 65 -13.851 10.931 -0.343 1.00 4.45 H new ATOM 0 HB3 LYS A 65 -12.247 10.973 0.362 1.00 4.45 H new ATOM 0 HG2 LYS A 65 -12.662 13.189 1.307 1.00 50.54 H new ATOM 0 HG3 LYS A 65 -14.209 13.290 0.490 1.00 50.54 H new ATOM 0 HD2 LYS A 65 -14.900 11.187 1.778 1.00 41.24 H new ATOM 0 HD3 LYS A 65 -13.430 11.370 2.714 1.00 41.24 H new ATOM 0 HE2 LYS A 65 -15.223 12.433 3.936 1.00 54.23 H new ATOM 0 HE3 LYS A 65 -14.156 13.691 3.344 1.00 54.23 H new ATOM 0 HZ1 LYS A 65 -16.661 13.992 3.054 1.00 45.14 H new ATOM 0 HZ2 LYS A 65 -15.669 14.335 1.719 1.00 45.14 H new ATOM 0 HZ3 LYS A 65 -16.534 12.875 1.782 1.00 45.14 H new ATOM 1039 N GLU A 66 -12.467 11.533 -3.669 1.00 34.25 N ATOM 1040 CA GLU A 66 -12.346 10.565 -4.745 1.00 21.23 C ATOM 1041 C GLU A 66 -10.914 10.459 -5.250 1.00 73.32 C ATOM 1042 O GLU A 66 -10.232 11.460 -5.456 1.00 0.22 O ATOM 1043 CB GLU A 66 -13.284 10.918 -5.896 1.00 21.30 C ATOM 1044 CG GLU A 66 -14.751 10.804 -5.530 1.00 60.13 C ATOM 1045 CD GLU A 66 -15.086 9.454 -4.929 1.00 11.35 C ATOM 1046 OE1 GLU A 66 -14.779 8.424 -5.563 1.00 13.42 O ATOM 1047 OE2 GLU A 66 -15.651 9.419 -3.812 1.00 74.03 O ATOM 0 H GLU A 66 -12.722 12.474 -3.967 1.00 34.25 H new ATOM 0 HA GLU A 66 -12.631 9.594 -4.340 1.00 21.23 H new ATOM 0 HB2 GLU A 66 -13.077 11.936 -6.225 1.00 21.30 H new ATOM 0 HB3 GLU A 66 -13.075 10.261 -6.740 1.00 21.30 H new ATOM 0 HG2 GLU A 66 -15.009 11.590 -4.820 1.00 60.13 H new ATOM 0 HG3 GLU A 66 -15.360 10.965 -6.420 1.00 60.13 H new ATOM 1054 N CYS A 67 -10.474 9.224 -5.436 1.00 53.30 N ATOM 1055 CA CYS A 67 -9.164 8.932 -5.990 1.00 5.43 C ATOM 1056 C CYS A 67 -9.261 7.709 -6.893 1.00 55.34 C ATOM 1057 O CYS A 67 -10.071 6.815 -6.641 1.00 40.13 O ATOM 1058 CB CYS A 67 -8.150 8.707 -4.864 1.00 25.54 C ATOM 1059 SG CYS A 67 -8.757 7.658 -3.523 1.00 62.43 S ATOM 0 H CYS A 67 -11.019 8.393 -5.205 1.00 53.30 H new ATOM 0 HA CYS A 67 -8.820 9.779 -6.583 1.00 5.43 H new ATOM 0 HB2 CYS A 67 -7.251 8.257 -5.284 1.00 25.54 H new ATOM 0 HB3 CYS A 67 -7.860 9.674 -4.452 1.00 25.54 H new ATOM 0 HG CYS A 67 -7.829 7.525 -2.622 1.00 62.43 H new ATOM 1065 N ARG A 68 -8.466 7.687 -7.953 1.00 34.01 N ATOM 1066 CA ARG A 68 -8.532 6.625 -8.953 1.00 14.42 C ATOM 1067 C ARG A 68 -7.139 6.309 -9.477 1.00 24.24 C ATOM 1068 O ARG A 68 -6.269 7.175 -9.484 1.00 62.40 O ATOM 1069 CB ARG A 68 -9.433 7.028 -10.128 1.00 32.11 C ATOM 1070 CG ARG A 68 -10.905 7.210 -9.774 1.00 71.12 C ATOM 1071 CD ARG A 68 -11.504 5.947 -9.172 1.00 22.11 C ATOM 1072 NE ARG A 68 -12.955 6.045 -9.015 1.00 51.23 N ATOM 1073 CZ ARG A 68 -13.568 6.621 -7.980 1.00 32.44 C ATOM 1074 NH1 ARG A 68 -12.871 7.105 -6.961 1.00 1.44 N ATOM 1075 NH2 ARG A 68 -14.889 6.683 -7.950 1.00 60.23 N ATOM 0 H ARG A 68 -7.761 8.398 -8.146 1.00 34.01 H new ATOM 0 HA ARG A 68 -8.954 5.742 -8.473 1.00 14.42 H new ATOM 0 HB2 ARG A 68 -9.058 7.960 -10.552 1.00 32.11 H new ATOM 0 HB3 ARG A 68 -9.352 6.269 -10.906 1.00 32.11 H new ATOM 0 HG2 ARG A 68 -11.009 8.034 -9.068 1.00 71.12 H new ATOM 0 HG3 ARG A 68 -11.462 7.485 -10.669 1.00 71.12 H new ATOM 0 HD2 ARG A 68 -11.266 5.095 -9.808 1.00 22.11 H new ATOM 0 HD3 ARG A 68 -11.047 5.757 -8.201 1.00 22.11 H new ATOM 0 HE ARG A 68 -13.539 5.645 -9.749 1.00 51.23 H new ATOM 0 HH11 ARG A 68 -11.853 7.039 -6.962 1.00 1.44 H new ATOM 0 HH12 ARG A 68 -13.353 7.543 -6.176 1.00 1.44 H new ATOM 0 HH21 ARG A 68 -15.435 6.291 -8.717 1.00 60.23 H new ATOM 0 HH22 ARG A 68 -15.361 7.123 -7.160 1.00 60.23 H new ATOM 1089 N TYR A 69 -6.915 5.070 -9.882 1.00 21.33 N ATOM 1090 CA TYR A 69 -5.648 4.693 -10.493 1.00 33.13 C ATOM 1091 C TYR A 69 -5.833 4.637 -12.003 1.00 62.11 C ATOM 1092 O TYR A 69 -6.740 3.969 -12.490 1.00 21.24 O ATOM 1093 CB TYR A 69 -5.172 3.335 -9.963 1.00 24.31 C ATOM 1094 CG TYR A 69 -3.674 3.143 -10.045 1.00 52.34 C ATOM 1095 CD1 TYR A 69 -3.042 2.944 -11.264 1.00 1.51 C ATOM 1096 CD2 TYR A 69 -2.891 3.172 -8.898 1.00 54.11 C ATOM 1097 CE1 TYR A 69 -1.673 2.777 -11.337 1.00 14.34 C ATOM 1098 CE2 TYR A 69 -1.521 3.008 -8.963 1.00 35.54 C ATOM 1099 CZ TYR A 69 -0.917 2.810 -10.185 1.00 63.34 C ATOM 1100 OH TYR A 69 0.447 2.647 -10.257 1.00 73.42 O ATOM 0 H TYR A 69 -7.590 4.310 -9.800 1.00 21.33 H new ATOM 0 HA TYR A 69 -4.888 5.433 -10.240 1.00 33.13 H new ATOM 0 HB2 TYR A 69 -5.487 3.229 -8.925 1.00 24.31 H new ATOM 0 HB3 TYR A 69 -5.663 2.542 -10.527 1.00 24.31 H new ATOM 0 HD1 TYR A 69 -3.630 2.919 -12.170 1.00 1.51 H new ATOM 0 HD2 TYR A 69 -3.362 3.326 -7.938 1.00 54.11 H new ATOM 0 HE1 TYR A 69 -1.196 2.621 -12.294 1.00 14.34 H new ATOM 0 HE2 TYR A 69 -0.927 3.035 -8.061 1.00 35.54 H new ATOM 0 HH TYR A 69 0.830 2.698 -9.357 1.00 73.42 H new ATOM 1110 N ALA A 70 -4.990 5.333 -12.747 1.00 34.24 N ATOM 1111 CA ALA A 70 -5.185 5.433 -14.185 1.00 15.43 C ATOM 1112 C ALA A 70 -4.011 4.862 -14.969 1.00 1.34 C ATOM 1113 O ALA A 70 -2.848 5.060 -14.612 1.00 51.13 O ATOM 1114 CB ALA A 70 -5.429 6.880 -14.583 1.00 41.52 C ATOM 0 H ALA A 70 -4.176 5.831 -12.387 1.00 34.24 H new ATOM 0 HA ALA A 70 -6.061 4.835 -14.435 1.00 15.43 H new ATOM 0 HB1 ALA A 70 -5.573 6.941 -15.662 1.00 41.52 H new ATOM 0 HB2 ALA A 70 -6.319 7.252 -14.076 1.00 41.52 H new ATOM 0 HB3 ALA A 70 -4.569 7.486 -14.297 1.00 41.52 H new ATOM 1120 N ALA A 71 -4.338 4.142 -16.033 1.00 31.13 N ATOM 1121 CA ALA A 71 -3.347 3.621 -16.959 1.00 44.43 C ATOM 1122 C ALA A 71 -3.614 4.177 -18.350 1.00 5.23 C ATOM 1123 O ALA A 71 -4.682 3.956 -18.917 1.00 51.44 O ATOM 1124 CB ALA A 71 -3.387 2.100 -16.978 1.00 0.14 C ATOM 0 H ALA A 71 -5.299 3.903 -16.277 1.00 31.13 H new ATOM 0 HA ALA A 71 -2.354 3.931 -16.634 1.00 44.43 H new ATOM 0 HB1 ALA A 71 -2.639 1.725 -17.676 1.00 0.14 H new ATOM 0 HB2 ALA A 71 -3.175 1.718 -15.979 1.00 0.14 H new ATOM 0 HB3 ALA A 71 -4.376 1.766 -17.292 1.00 0.14 H new ATOM 1130 N VAL A 72 -2.656 4.911 -18.892 1.00 11.25 N ATOM 1131 CA VAL A 72 -2.850 5.568 -20.173 1.00 32.50 C ATOM 1132 C VAL A 72 -1.724 5.245 -21.150 1.00 52.00 C ATOM 1133 O VAL A 72 -0.545 5.453 -20.853 1.00 60.51 O ATOM 1134 CB VAL A 72 -2.989 7.103 -20.002 1.00 72.24 C ATOM 1135 CG1 VAL A 72 -1.833 7.677 -19.196 1.00 43.23 C ATOM 1136 CG2 VAL A 72 -3.096 7.794 -21.357 1.00 20.30 C ATOM 0 H VAL A 72 -1.742 5.066 -18.468 1.00 11.25 H new ATOM 0 HA VAL A 72 -3.779 5.181 -20.591 1.00 32.50 H new ATOM 0 HB VAL A 72 -3.909 7.291 -19.448 1.00 72.24 H new ATOM 0 HG11 VAL A 72 -1.960 8.755 -19.094 1.00 43.23 H new ATOM 0 HG12 VAL A 72 -1.816 7.219 -18.207 1.00 43.23 H new ATOM 0 HG13 VAL A 72 -0.894 7.469 -19.708 1.00 43.23 H new ATOM 0 HG21 VAL A 72 -3.193 8.870 -21.210 1.00 20.30 H new ATOM 0 HG22 VAL A 72 -2.201 7.587 -21.943 1.00 20.30 H new ATOM 0 HG23 VAL A 72 -3.972 7.420 -21.888 1.00 20.30 H new ATOM 1146 N ASP A 73 -2.100 4.698 -22.298 1.00 42.03 N ATOM 1147 CA ASP A 73 -1.166 4.459 -23.387 1.00 51.44 C ATOM 1148 C ASP A 73 -1.486 5.390 -24.540 1.00 1.14 C ATOM 1149 O ASP A 73 -2.625 5.449 -25.006 1.00 3.31 O ATOM 1150 CB ASP A 73 -1.233 3.008 -23.876 1.00 14.44 C ATOM 1151 CG ASP A 73 -0.272 2.736 -25.026 1.00 3.01 C ATOM 1152 OD1 ASP A 73 -0.585 3.124 -26.175 1.00 24.45 O ATOM 1153 OD2 ASP A 73 0.791 2.132 -24.787 1.00 61.21 O ATOM 0 H ASP A 73 -3.057 4.409 -22.499 1.00 42.03 H new ATOM 0 HA ASP A 73 -0.159 4.648 -23.016 1.00 51.44 H new ATOM 0 HB2 ASP A 73 -1.003 2.338 -23.048 1.00 14.44 H new ATOM 0 HB3 ASP A 73 -2.250 2.782 -24.196 1.00 14.44 H new ATOM 1158 N VAL A 74 -0.491 6.125 -24.983 1.00 13.54 N ATOM 1159 CA VAL A 74 -0.650 7.007 -26.119 1.00 2.04 C ATOM 1160 C VAL A 74 0.626 7.013 -26.946 1.00 72.13 C ATOM 1161 O VAL A 74 1.725 7.193 -26.412 1.00 34.22 O ATOM 1162 CB VAL A 74 -1.026 8.447 -25.683 1.00 30.12 C ATOM 1163 CG1 VAL A 74 0.004 9.024 -24.719 1.00 1.04 C ATOM 1164 CG2 VAL A 74 -1.197 9.353 -26.896 1.00 34.54 C ATOM 0 H VAL A 74 0.442 6.130 -24.572 1.00 13.54 H new ATOM 0 HA VAL A 74 -1.473 6.631 -26.727 1.00 2.04 H new ATOM 0 HB VAL A 74 -1.979 8.394 -25.157 1.00 30.12 H new ATOM 0 HG11 VAL A 74 -0.290 10.034 -24.434 1.00 1.04 H new ATOM 0 HG12 VAL A 74 0.060 8.397 -23.829 1.00 1.04 H new ATOM 0 HG13 VAL A 74 0.980 9.054 -25.204 1.00 1.04 H new ATOM 0 HG21 VAL A 74 -1.461 10.358 -26.565 1.00 34.54 H new ATOM 0 HG22 VAL A 74 -0.264 9.389 -27.458 1.00 34.54 H new ATOM 0 HG23 VAL A 74 -1.989 8.961 -27.534 1.00 34.54 H new ATOM 1174 N GLU A 75 0.492 6.781 -28.240 1.00 42.14 N ATOM 1175 CA GLU A 75 1.646 6.791 -29.109 1.00 73.43 C ATOM 1176 C GLU A 75 1.913 8.212 -29.584 1.00 62.31 C ATOM 1177 O GLU A 75 1.199 8.758 -30.426 1.00 43.43 O ATOM 1178 CB GLU A 75 1.486 5.815 -30.293 1.00 5.52 C ATOM 1179 CG GLU A 75 0.271 6.046 -31.184 1.00 63.25 C ATOM 1180 CD GLU A 75 -1.054 5.665 -30.547 1.00 4.34 C ATOM 1181 OE1 GLU A 75 -1.662 6.518 -29.870 1.00 24.15 O ATOM 1182 OE2 GLU A 75 -1.503 4.514 -30.737 1.00 72.23 O ATOM 0 H GLU A 75 -0.395 6.586 -28.704 1.00 42.14 H new ATOM 0 HA GLU A 75 2.509 6.442 -28.542 1.00 73.43 H new ATOM 0 HB2 GLU A 75 2.382 5.873 -30.911 1.00 5.52 H new ATOM 0 HB3 GLU A 75 1.436 4.800 -29.899 1.00 5.52 H new ATOM 0 HG2 GLU A 75 0.236 7.099 -31.465 1.00 63.25 H new ATOM 0 HG3 GLU A 75 0.396 5.475 -32.104 1.00 63.25 H new ATOM 1189 N VAL A 76 2.940 8.815 -29.014 1.00 62.03 N ATOM 1190 CA VAL A 76 3.291 10.182 -29.340 1.00 61.51 C ATOM 1191 C VAL A 76 4.168 10.204 -30.577 1.00 42.02 C ATOM 1192 O VAL A 76 5.201 9.536 -30.627 1.00 51.23 O ATOM 1193 CB VAL A 76 4.019 10.882 -28.170 1.00 70.34 C ATOM 1194 CG1 VAL A 76 4.258 12.352 -28.480 1.00 74.34 C ATOM 1195 CG2 VAL A 76 3.233 10.728 -26.878 1.00 11.25 C ATOM 0 H VAL A 76 3.547 8.377 -28.321 1.00 62.03 H new ATOM 0 HA VAL A 76 2.367 10.728 -29.531 1.00 61.51 H new ATOM 0 HB VAL A 76 4.989 10.401 -28.041 1.00 70.34 H new ATOM 0 HG11 VAL A 76 4.772 12.822 -27.641 1.00 74.34 H new ATOM 0 HG12 VAL A 76 4.872 12.440 -29.376 1.00 74.34 H new ATOM 0 HG13 VAL A 76 3.302 12.849 -28.645 1.00 74.34 H new ATOM 0 HG21 VAL A 76 3.763 11.228 -26.068 1.00 11.25 H new ATOM 0 HG22 VAL A 76 2.246 11.176 -26.997 1.00 11.25 H new ATOM 0 HG23 VAL A 76 3.125 9.669 -26.642 1.00 11.25 H new ATOM 1205 N THR A 77 3.733 10.944 -31.581 1.00 3.04 N ATOM 1206 CA THR A 77 4.469 11.046 -32.823 1.00 1.43 C ATOM 1207 C THR A 77 5.650 11.994 -32.675 1.00 31.43 C ATOM 1208 O THR A 77 5.489 13.204 -32.504 1.00 34.35 O ATOM 1209 CB THR A 77 3.555 11.492 -33.982 1.00 62.52 C ATOM 1210 OG1 THR A 77 4.307 11.624 -35.189 1.00 33.30 O ATOM 1211 CG2 THR A 77 2.828 12.798 -33.676 1.00 10.51 C ATOM 0 H THR A 77 2.869 11.485 -31.557 1.00 3.04 H new ATOM 0 HA THR A 77 4.852 10.054 -33.063 1.00 1.43 H new ATOM 0 HB THR A 77 2.799 10.717 -34.108 1.00 62.52 H new ATOM 0 HG1 THR A 77 3.713 11.906 -35.915 1.00 33.30 H new ATOM 0 HG21 THR A 77 2.197 13.070 -34.522 1.00 10.51 H new ATOM 0 HG22 THR A 77 2.209 12.670 -32.788 1.00 10.51 H new ATOM 0 HG23 THR A 77 3.558 13.588 -33.499 1.00 10.51 H new ATOM 1219 N VAL A 78 6.842 11.430 -32.694 1.00 62.12 N ATOM 1220 CA VAL A 78 8.051 12.208 -32.533 1.00 11.44 C ATOM 1221 C VAL A 78 9.116 11.697 -33.485 1.00 21.32 C ATOM 1222 O VAL A 78 9.100 10.528 -33.856 1.00 63.23 O ATOM 1223 CB VAL A 78 8.613 12.112 -31.101 1.00 25.24 C ATOM 1224 CG1 VAL A 78 9.397 13.362 -30.775 1.00 54.11 C ATOM 1225 CG2 VAL A 78 7.520 11.886 -30.066 1.00 54.31 C ATOM 0 H VAL A 78 6.997 10.430 -32.820 1.00 62.12 H new ATOM 0 HA VAL A 78 7.795 13.246 -32.744 1.00 11.44 H new ATOM 0 HB VAL A 78 9.273 11.245 -31.062 1.00 25.24 H new ATOM 0 HG11 VAL A 78 9.792 13.290 -29.762 1.00 54.11 H new ATOM 0 HG12 VAL A 78 10.222 13.468 -31.480 1.00 54.11 H new ATOM 0 HG13 VAL A 78 8.743 14.231 -30.848 1.00 54.11 H new ATOM 0 HG21 VAL A 78 7.966 11.825 -29.073 1.00 54.31 H new ATOM 0 HG22 VAL A 78 6.813 12.715 -30.096 1.00 54.31 H new ATOM 0 HG23 VAL A 78 6.997 10.955 -30.286 1.00 54.31 H new ATOM 1235 N GLN A 79 10.037 12.555 -33.883 1.00 31.33 N ATOM 1236 CA GLN A 79 11.148 12.110 -34.700 1.00 33.43 C ATOM 1237 C GLN A 79 12.146 11.380 -33.810 1.00 50.13 C ATOM 1238 O GLN A 79 12.869 12.001 -33.028 1.00 41.34 O ATOM 1239 CB GLN A 79 11.812 13.301 -35.394 1.00 2.21 C ATOM 1240 CG GLN A 79 12.836 12.912 -36.448 1.00 61.05 C ATOM 1241 CD GLN A 79 13.531 14.118 -37.045 1.00 40.43 C ATOM 1242 OE1 GLN A 79 13.731 15.128 -36.369 1.00 54.14 O ATOM 1243 NE2 GLN A 79 13.884 14.033 -38.318 1.00 14.30 N ATOM 0 H GLN A 79 10.038 13.550 -33.657 1.00 31.33 H new ATOM 0 HA GLN A 79 10.788 11.433 -35.475 1.00 33.43 H new ATOM 0 HB2 GLN A 79 11.040 13.913 -35.861 1.00 2.21 H new ATOM 0 HB3 GLN A 79 12.299 13.922 -34.641 1.00 2.21 H new ATOM 0 HG2 GLN A 79 13.579 12.250 -36.003 1.00 61.05 H new ATOM 0 HG3 GLN A 79 12.343 12.350 -37.241 1.00 61.05 H new ATOM 0 HE21 GLN A 79 13.700 13.178 -38.842 1.00 14.30 H new ATOM 0 HE22 GLN A 79 14.340 14.823 -38.775 1.00 14.30 H new ATOM 1252 N ARG A 80 12.165 10.059 -33.918 1.00 15.13 N ATOM 1253 CA ARG A 80 13.004 9.228 -33.063 1.00 63.24 C ATOM 1254 C ARG A 80 13.788 8.241 -33.911 1.00 2.22 C ATOM 1255 O ARG A 80 13.574 8.152 -35.120 1.00 23.44 O ATOM 1256 CB ARG A 80 12.155 8.450 -32.041 1.00 33.43 C ATOM 1257 CG ARG A 80 11.200 9.305 -31.216 1.00 33.11 C ATOM 1258 CD ARG A 80 11.928 10.333 -30.358 1.00 62.11 C ATOM 1259 NE ARG A 80 12.804 9.717 -29.358 1.00 2.30 N ATOM 1260 CZ ARG A 80 12.543 9.700 -28.046 1.00 14.42 C ATOM 1261 NH1 ARG A 80 11.381 10.159 -27.589 1.00 32.33 N ATOM 1262 NH2 ARG A 80 13.443 9.215 -27.193 1.00 23.52 N ATOM 0 H ARG A 80 11.606 9.537 -34.593 1.00 15.13 H new ATOM 0 HA ARG A 80 13.688 9.883 -32.524 1.00 63.24 H new ATOM 0 HB2 ARG A 80 11.576 7.694 -32.572 1.00 33.43 H new ATOM 0 HB3 ARG A 80 12.824 7.921 -31.362 1.00 33.43 H new ATOM 0 HG2 ARG A 80 10.508 9.819 -31.884 1.00 33.11 H new ATOM 0 HG3 ARG A 80 10.602 8.659 -30.574 1.00 33.11 H new ATOM 0 HD2 ARG A 80 12.520 10.984 -31.002 1.00 62.11 H new ATOM 0 HD3 ARG A 80 11.196 10.964 -29.854 1.00 62.11 H new ATOM 0 HE ARG A 80 13.664 9.275 -29.682 1.00 2.30 H new ATOM 0 HH11 ARG A 80 10.686 10.525 -28.240 1.00 32.33 H new ATOM 0 HH12 ARG A 80 11.185 10.145 -26.588 1.00 32.33 H new ATOM 0 HH21 ARG A 80 14.333 8.856 -27.540 1.00 23.52 H new ATOM 0 HH22 ARG A 80 13.243 9.203 -26.193 1.00 23.52 H new ATOM 1276 N GLN A 81 14.687 7.499 -33.275 1.00 75.04 N ATOM 1277 CA GLN A 81 15.440 6.457 -33.960 1.00 30.14 C ATOM 1278 C GLN A 81 14.496 5.425 -34.565 1.00 24.43 C ATOM 1279 O GLN A 81 13.471 5.081 -33.972 1.00 63.42 O ATOM 1280 CB GLN A 81 16.413 5.764 -33.007 1.00 25.20 C ATOM 1281 CG GLN A 81 17.542 6.656 -32.523 1.00 73.20 C ATOM 1282 CD GLN A 81 18.596 5.877 -31.767 1.00 20.44 C ATOM 1283 OE1 GLN A 81 18.531 5.735 -30.545 1.00 34.24 O ATOM 1284 NE2 GLN A 81 19.566 5.349 -32.495 1.00 35.44 N ATOM 0 H GLN A 81 14.912 7.600 -32.285 1.00 75.04 H new ATOM 0 HA GLN A 81 16.012 6.932 -34.757 1.00 30.14 H new ATOM 0 HB2 GLN A 81 15.859 5.395 -32.144 1.00 25.20 H new ATOM 0 HB3 GLN A 81 16.839 4.895 -33.508 1.00 25.20 H new ATOM 0 HG2 GLN A 81 18.002 7.154 -33.377 1.00 73.20 H new ATOM 0 HG3 GLN A 81 17.137 7.437 -31.879 1.00 73.20 H new ATOM 0 HE21 GLN A 81 19.581 5.492 -33.505 1.00 35.44 H new ATOM 0 HE22 GLN A 81 20.299 4.799 -32.047 1.00 35.44 H new ATOM 1293 N GLY A 82 14.848 4.940 -35.741 1.00 73.10 N ATOM 1294 CA GLY A 82 14.011 3.987 -36.434 1.00 21.31 C ATOM 1295 C GLY A 82 13.521 4.544 -37.750 1.00 31.02 C ATOM 1296 O GLY A 82 13.477 3.838 -38.758 1.00 62.54 O ATOM 0 H GLY A 82 15.706 5.191 -36.233 1.00 73.10 H new ATOM 0 HA2 GLY A 82 14.571 3.069 -36.611 1.00 21.31 H new ATOM 0 HA3 GLY A 82 13.159 3.725 -35.807 1.00 21.31 H new ATOM 1300 N ALA A 83 13.175 5.821 -37.740 1.00 60.33 N ATOM 1301 CA ALA A 83 12.702 6.502 -38.933 1.00 32.20 C ATOM 1302 C ALA A 83 13.282 7.907 -38.986 1.00 55.43 C ATOM 1303 O ALA A 83 13.764 8.419 -37.979 1.00 12.12 O ATOM 1304 CB ALA A 83 11.178 6.547 -38.952 1.00 33.12 C ATOM 0 H ALA A 83 13.214 6.412 -36.909 1.00 60.33 H new ATOM 0 HA ALA A 83 13.035 5.951 -39.813 1.00 32.20 H new ATOM 0 HB1 ALA A 83 10.840 7.060 -39.852 1.00 33.12 H new ATOM 0 HB2 ALA A 83 10.784 5.531 -38.944 1.00 33.12 H new ATOM 0 HB3 ALA A 83 10.819 7.082 -38.073 1.00 33.12 H new ATOM 1310 N GLU A 84 13.242 8.528 -40.153 1.00 24.14 N ATOM 1311 CA GLU A 84 13.773 9.877 -40.309 1.00 33.50 C ATOM 1312 C GLU A 84 12.691 10.924 -40.063 1.00 33.33 C ATOM 1313 O GLU A 84 12.923 12.119 -40.245 1.00 4.01 O ATOM 1314 CB GLU A 84 14.362 10.064 -41.708 1.00 74.23 C ATOM 1315 CG GLU A 84 13.367 9.797 -42.825 1.00 32.31 C ATOM 1316 CD GLU A 84 13.892 10.196 -44.186 1.00 53.15 C ATOM 1317 OE1 GLU A 84 14.905 9.617 -44.631 1.00 55.32 O ATOM 1318 OE2 GLU A 84 13.283 11.085 -44.823 1.00 75.10 O ATOM 0 H GLU A 84 12.850 8.124 -41.004 1.00 24.14 H new ATOM 0 HA GLU A 84 14.561 10.011 -39.568 1.00 33.50 H new ATOM 0 HB2 GLU A 84 14.737 11.083 -41.802 1.00 74.23 H new ATOM 0 HB3 GLU A 84 15.216 9.397 -41.826 1.00 74.23 H new ATOM 0 HG2 GLU A 84 13.115 8.737 -42.835 1.00 32.31 H new ATOM 0 HG3 GLU A 84 12.445 10.342 -42.622 1.00 32.31 H new ATOM 1325 N GLY A 85 11.519 10.480 -39.639 1.00 20.41 N ATOM 1326 CA GLY A 85 10.405 11.389 -39.479 1.00 62.43 C ATOM 1327 C GLY A 85 9.518 11.029 -38.308 1.00 53.13 C ATOM 1328 O GLY A 85 10.009 10.708 -37.225 1.00 73.22 O ATOM 0 H GLY A 85 11.319 9.508 -39.403 1.00 20.41 H new ATOM 0 HA2 GLY A 85 10.785 12.402 -39.343 1.00 62.43 H new ATOM 0 HA3 GLY A 85 9.810 11.392 -40.392 1.00 62.43 H new ATOM 1332 N THR A 86 8.213 11.066 -38.538 1.00 53.45 N ATOM 1333 CA THR A 86 7.233 10.847 -37.487 1.00 31.24 C ATOM 1334 C THR A 86 7.242 9.399 -36.998 1.00 43.02 C ATOM 1335 O THR A 86 6.786 8.490 -37.696 1.00 41.01 O ATOM 1336 CB THR A 86 5.816 11.221 -37.973 1.00 12.22 C ATOM 1337 OG1 THR A 86 5.546 10.593 -39.236 1.00 43.45 O ATOM 1338 CG2 THR A 86 5.669 12.730 -38.113 1.00 70.11 C ATOM 0 H THR A 86 7.806 11.248 -39.455 1.00 53.45 H new ATOM 0 HA THR A 86 7.509 11.492 -36.653 1.00 31.24 H new ATOM 0 HB THR A 86 5.100 10.869 -37.230 1.00 12.22 H new ATOM 0 HG1 THR A 86 5.910 9.683 -39.233 1.00 43.45 H new ATOM 0 HG21 THR A 86 4.662 12.967 -38.457 1.00 70.11 H new ATOM 0 HG22 THR A 86 5.844 13.204 -37.147 1.00 70.11 H new ATOM 0 HG23 THR A 86 6.396 13.101 -38.836 1.00 70.11 H new ATOM 1346 N SER A 87 7.783 9.189 -35.808 1.00 71.13 N ATOM 1347 CA SER A 87 7.812 7.872 -35.198 1.00 32.41 C ATOM 1348 C SER A 87 6.850 7.832 -34.014 1.00 63.14 C ATOM 1349 O SER A 87 6.943 8.650 -33.097 1.00 53.31 O ATOM 1350 CB SER A 87 9.238 7.529 -34.750 1.00 71.21 C ATOM 1351 OG SER A 87 9.363 6.158 -34.406 1.00 43.33 O ATOM 0 H SER A 87 8.211 9.922 -35.242 1.00 71.13 H new ATOM 0 HA SER A 87 7.496 7.129 -35.930 1.00 32.41 H new ATOM 0 HB2 SER A 87 9.939 7.769 -35.550 1.00 71.21 H new ATOM 0 HB3 SER A 87 9.509 8.146 -33.893 1.00 71.21 H new ATOM 0 HG SER A 87 10.284 5.973 -34.127 1.00 43.33 H new ATOM 1357 N THR A 88 5.915 6.896 -34.049 1.00 62.03 N ATOM 1358 CA THR A 88 4.909 6.781 -33.008 1.00 14.32 C ATOM 1359 C THR A 88 5.256 5.655 -32.042 1.00 3.24 C ATOM 1360 O THR A 88 5.213 4.476 -32.407 1.00 24.23 O ATOM 1361 CB THR A 88 3.518 6.511 -33.614 1.00 31.51 C ATOM 1362 OG1 THR A 88 3.584 5.371 -34.482 1.00 54.31 O ATOM 1363 CG2 THR A 88 3.012 7.716 -34.390 1.00 50.35 C ATOM 0 H THR A 88 5.833 6.202 -34.792 1.00 62.03 H new ATOM 0 HA THR A 88 4.889 7.728 -32.468 1.00 14.32 H new ATOM 0 HB THR A 88 2.822 6.315 -32.798 1.00 31.51 H new ATOM 0 HG1 THR A 88 4.206 4.712 -34.109 1.00 54.31 H new ATOM 0 HG21 THR A 88 2.029 7.495 -34.805 1.00 50.35 H new ATOM 0 HG22 THR A 88 2.939 8.574 -33.722 1.00 50.35 H new ATOM 0 HG23 THR A 88 3.705 7.944 -35.200 1.00 50.35 H new ATOM 1371 N LEU A 89 5.614 6.011 -30.820 1.00 25.10 N ATOM 1372 CA LEU A 89 5.907 5.015 -29.802 1.00 65.33 C ATOM 1373 C LEU A 89 4.772 4.940 -28.793 1.00 25.44 C ATOM 1374 O LEU A 89 4.502 5.903 -28.074 1.00 74.11 O ATOM 1375 CB LEU A 89 7.229 5.319 -29.081 1.00 44.34 C ATOM 1376 CG LEU A 89 8.507 5.129 -29.911 1.00 4.22 C ATOM 1377 CD1 LEU A 89 8.689 6.263 -30.909 1.00 1.22 C ATOM 1378 CD2 LEU A 89 9.720 5.024 -28.999 1.00 22.42 C ATOM 0 H LEU A 89 5.709 6.978 -30.509 1.00 25.10 H new ATOM 0 HA LEU A 89 6.008 4.052 -30.302 1.00 65.33 H new ATOM 0 HB2 LEU A 89 7.199 6.350 -28.728 1.00 44.34 H new ATOM 0 HB3 LEU A 89 7.294 4.682 -28.199 1.00 44.34 H new ATOM 0 HG LEU A 89 8.409 4.200 -30.473 1.00 4.22 H new ATOM 0 HD11 LEU A 89 9.602 6.101 -31.482 1.00 1.22 H new ATOM 0 HD12 LEU A 89 7.836 6.292 -31.587 1.00 1.22 H new ATOM 0 HD13 LEU A 89 8.760 7.210 -30.374 1.00 1.22 H new ATOM 0 HD21 LEU A 89 10.618 4.890 -29.602 1.00 22.42 H new ATOM 0 HD22 LEU A 89 9.812 5.936 -28.409 1.00 22.42 H new ATOM 0 HD23 LEU A 89 9.600 4.171 -28.331 1.00 22.42 H new ATOM 1390 N ASN A 90 4.104 3.794 -28.756 1.00 20.30 N ATOM 1391 CA ASN A 90 3.027 3.560 -27.801 1.00 52.55 C ATOM 1392 C ASN A 90 3.605 3.275 -26.429 1.00 31.42 C ATOM 1393 O ASN A 90 4.235 2.237 -26.215 1.00 71.53 O ATOM 1394 CB ASN A 90 2.144 2.388 -28.242 1.00 23.22 C ATOM 1395 CG ASN A 90 1.152 2.759 -29.313 1.00 44.44 C ATOM 1396 OD1 ASN A 90 1.434 2.642 -30.508 1.00 1.43 O ATOM 1397 ND2 ASN A 90 -0.019 3.198 -28.893 1.00 50.31 N ATOM 0 H ASN A 90 4.290 3.008 -29.379 1.00 20.30 H new ATOM 0 HA ASN A 90 2.411 4.458 -27.758 1.00 52.55 H new ATOM 0 HB2 ASN A 90 2.779 1.582 -28.609 1.00 23.22 H new ATOM 0 HB3 ASN A 90 1.606 2.002 -27.376 1.00 23.22 H new ATOM 0 HD21 ASN A 90 -0.738 3.458 -29.568 1.00 50.31 H new ATOM 0 HD22 ASN A 90 -0.205 3.277 -27.893 1.00 50.31 H new ATOM 1404 N LYS A 91 3.428 4.213 -25.517 1.00 61.51 N ATOM 1405 CA LYS A 91 3.922 4.056 -24.162 1.00 62.34 C ATOM 1406 C LYS A 91 2.797 4.208 -23.154 1.00 52.25 C ATOM 1407 O LYS A 91 2.201 5.280 -23.022 1.00 64.44 O ATOM 1408 CB LYS A 91 5.038 5.061 -23.864 1.00 14.23 C ATOM 1409 CG LYS A 91 6.432 4.461 -23.969 1.00 24.01 C ATOM 1410 CD LYS A 91 6.755 4.020 -25.387 1.00 43.11 C ATOM 1411 CE LYS A 91 7.909 3.034 -25.411 1.00 2.30 C ATOM 1412 NZ LYS A 91 7.536 1.724 -24.811 1.00 3.13 N ATOM 0 H LYS A 91 2.944 5.094 -25.691 1.00 61.51 H new ATOM 0 HA LYS A 91 4.332 3.050 -24.074 1.00 62.34 H new ATOM 0 HB2 LYS A 91 4.957 5.899 -24.557 1.00 14.23 H new ATOM 0 HB3 LYS A 91 4.897 5.463 -22.860 1.00 14.23 H new ATOM 0 HG2 LYS A 91 7.168 5.194 -23.641 1.00 24.01 H new ATOM 0 HG3 LYS A 91 6.511 3.607 -23.296 1.00 24.01 H new ATOM 0 HD2 LYS A 91 5.874 3.562 -25.837 1.00 43.11 H new ATOM 0 HD3 LYS A 91 7.006 4.891 -25.992 1.00 43.11 H new ATOM 0 HE2 LYS A 91 8.234 2.882 -26.440 1.00 2.30 H new ATOM 0 HE3 LYS A 91 8.756 3.454 -24.868 1.00 2.30 H new ATOM 0 HZ1 LYS A 91 8.188 0.988 -25.151 1.00 3.13 H new ATOM 0 HZ2 LYS A 91 7.596 1.787 -23.775 1.00 3.13 H new ATOM 0 HZ3 LYS A 91 6.564 1.480 -25.088 1.00 3.13 H new ATOM 1426 N VAL A 92 2.505 3.122 -22.461 1.00 73.12 N ATOM 1427 CA VAL A 92 1.499 3.128 -21.421 1.00 20.12 C ATOM 1428 C VAL A 92 2.148 3.387 -20.068 1.00 64.52 C ATOM 1429 O VAL A 92 3.100 2.709 -19.676 1.00 32.11 O ATOM 1430 CB VAL A 92 0.692 1.807 -21.394 1.00 30.15 C ATOM 1431 CG1 VAL A 92 1.609 0.595 -21.299 1.00 24.31 C ATOM 1432 CG2 VAL A 92 -0.318 1.812 -20.254 1.00 3.41 C ATOM 0 H VAL A 92 2.956 2.218 -22.604 1.00 73.12 H new ATOM 0 HA VAL A 92 0.797 3.932 -21.640 1.00 20.12 H new ATOM 0 HB VAL A 92 0.146 1.735 -22.335 1.00 30.15 H new ATOM 0 HG11 VAL A 92 1.009 -0.315 -21.282 1.00 24.31 H new ATOM 0 HG12 VAL A 92 2.275 0.574 -22.161 1.00 24.31 H new ATOM 0 HG13 VAL A 92 2.200 0.657 -20.385 1.00 24.31 H new ATOM 0 HG21 VAL A 92 -0.873 0.874 -20.255 1.00 3.41 H new ATOM 0 HG22 VAL A 92 0.206 1.922 -19.304 1.00 3.41 H new ATOM 0 HG23 VAL A 92 -1.011 2.643 -20.385 1.00 3.41 H new ATOM 1442 N ILE A 93 1.648 4.388 -19.376 1.00 31.13 N ATOM 1443 CA ILE A 93 2.197 4.772 -18.095 1.00 21.41 C ATOM 1444 C ILE A 93 1.126 4.670 -17.012 1.00 32.32 C ATOM 1445 O ILE A 93 -0.073 4.737 -17.302 1.00 24.41 O ATOM 1446 CB ILE A 93 2.778 6.210 -18.161 1.00 32.55 C ATOM 1447 CG1 ILE A 93 3.516 6.570 -16.870 1.00 64.05 C ATOM 1448 CG2 ILE A 93 1.677 7.224 -18.442 1.00 1.12 C ATOM 1449 CD1 ILE A 93 4.199 7.919 -16.921 1.00 72.35 C ATOM 0 H ILE A 93 0.857 4.954 -19.683 1.00 31.13 H new ATOM 0 HA ILE A 93 3.009 4.090 -17.843 1.00 21.41 H new ATOM 0 HB ILE A 93 3.496 6.239 -18.981 1.00 32.55 H new ATOM 0 HG12 ILE A 93 2.808 6.561 -16.042 1.00 64.05 H new ATOM 0 HG13 ILE A 93 4.261 5.802 -16.661 1.00 64.05 H new ATOM 0 HG21 ILE A 93 2.106 8.225 -18.484 1.00 1.12 H new ATOM 0 HG22 ILE A 93 1.203 6.992 -19.396 1.00 1.12 H new ATOM 0 HG23 ILE A 93 0.932 7.182 -17.647 1.00 1.12 H new ATOM 0 HD11 ILE A 93 4.702 8.108 -15.973 1.00 72.35 H new ATOM 0 HD12 ILE A 93 4.932 7.926 -17.728 1.00 72.35 H new ATOM 0 HD13 ILE A 93 3.456 8.696 -17.099 1.00 72.35 H new ATOM 1461 N PHE A 94 1.558 4.490 -15.774 1.00 51.12 N ATOM 1462 CA PHE A 94 0.644 4.437 -14.645 1.00 60.23 C ATOM 1463 C PHE A 94 0.641 5.767 -13.917 1.00 13.03 C ATOM 1464 O PHE A 94 1.686 6.244 -13.477 1.00 22.31 O ATOM 1465 CB PHE A 94 1.043 3.334 -13.661 1.00 51.01 C ATOM 1466 CG PHE A 94 0.532 1.963 -14.002 1.00 30.33 C ATOM 1467 CD1 PHE A 94 -0.757 1.782 -14.477 1.00 1.04 C ATOM 1468 CD2 PHE A 94 1.336 0.851 -13.822 1.00 72.34 C ATOM 1469 CE1 PHE A 94 -1.232 0.516 -14.768 1.00 53.44 C ATOM 1470 CE2 PHE A 94 0.866 -0.416 -14.107 1.00 32.43 C ATOM 1471 CZ PHE A 94 -0.419 -0.584 -14.582 1.00 55.24 C ATOM 0 H PHE A 94 2.541 4.378 -15.525 1.00 51.12 H new ATOM 0 HA PHE A 94 -0.351 4.220 -15.033 1.00 60.23 H new ATOM 0 HB2 PHE A 94 2.131 3.296 -13.603 1.00 51.01 H new ATOM 0 HB3 PHE A 94 0.680 3.604 -12.669 1.00 51.01 H new ATOM 0 HD1 PHE A 94 -1.398 2.639 -14.622 1.00 1.04 H new ATOM 0 HD2 PHE A 94 2.344 0.976 -13.454 1.00 72.34 H new ATOM 0 HE1 PHE A 94 -2.238 0.388 -15.140 1.00 53.44 H new ATOM 0 HE2 PHE A 94 1.504 -1.275 -13.958 1.00 32.43 H new ATOM 0 HZ PHE A 94 -0.788 -1.574 -14.808 1.00 55.24 H new ATOM 1481 N VAL A 95 -0.531 6.366 -13.800 1.00 1.22 N ATOM 1482 CA VAL A 95 -0.666 7.622 -13.087 1.00 11.15 C ATOM 1483 C VAL A 95 -1.438 7.400 -11.793 1.00 14.32 C ATOM 1484 O VAL A 95 -2.654 7.185 -11.803 1.00 25.43 O ATOM 1485 CB VAL A 95 -1.375 8.698 -13.933 1.00 3.14 C ATOM 1486 CG1 VAL A 95 -1.263 10.058 -13.261 1.00 1.51 C ATOM 1487 CG2 VAL A 95 -0.798 8.745 -15.340 1.00 55.35 C ATOM 0 H VAL A 95 -1.401 6.003 -14.189 1.00 1.22 H new ATOM 0 HA VAL A 95 0.339 7.983 -12.868 1.00 11.15 H new ATOM 0 HB VAL A 95 -2.430 8.436 -14.009 1.00 3.14 H new ATOM 0 HG11 VAL A 95 -1.768 10.808 -13.870 1.00 1.51 H new ATOM 0 HG12 VAL A 95 -1.728 10.017 -12.276 1.00 1.51 H new ATOM 0 HG13 VAL A 95 -0.212 10.326 -13.154 1.00 1.51 H new ATOM 0 HG21 VAL A 95 -1.313 9.511 -15.919 1.00 55.35 H new ATOM 0 HG22 VAL A 95 0.265 8.982 -15.290 1.00 55.35 H new ATOM 0 HG23 VAL A 95 -0.932 7.776 -15.821 1.00 55.35 H new ATOM 1497 N GLN A 96 -0.713 7.415 -10.689 1.00 23.40 N ATOM 1498 CA GLN A 96 -1.293 7.184 -9.378 1.00 74.43 C ATOM 1499 C GLN A 96 -1.885 8.473 -8.816 1.00 1.42 C ATOM 1500 O GLN A 96 -1.152 9.378 -8.424 1.00 2.21 O ATOM 1501 CB GLN A 96 -0.224 6.624 -8.436 1.00 64.14 C ATOM 1502 CG GLN A 96 -0.682 6.474 -6.996 1.00 42.03 C ATOM 1503 CD GLN A 96 0.386 5.871 -6.104 1.00 40.41 C ATOM 1504 OE1 GLN A 96 1.193 5.052 -6.541 1.00 32.22 O ATOM 1505 NE2 GLN A 96 0.415 6.292 -4.849 1.00 73.25 N ATOM 0 H GLN A 96 0.292 7.587 -10.676 1.00 23.40 H new ATOM 0 HA GLN A 96 -2.101 6.458 -9.470 1.00 74.43 H new ATOM 0 HB2 GLN A 96 0.098 5.651 -8.807 1.00 64.14 H new ATOM 0 HB3 GLN A 96 0.647 7.279 -8.462 1.00 64.14 H new ATOM 0 HG2 GLN A 96 -0.967 7.451 -6.606 1.00 42.03 H new ATOM 0 HG3 GLN A 96 -1.573 5.846 -6.965 1.00 42.03 H new ATOM 0 HE21 GLN A 96 -0.272 6.972 -4.523 1.00 73.25 H new ATOM 0 HE22 GLN A 96 1.124 5.936 -4.208 1.00 73.25 H new ATOM 1514 N TYR A 97 -3.207 8.557 -8.788 1.00 74.52 N ATOM 1515 CA TYR A 97 -3.879 9.725 -8.236 1.00 70.44 C ATOM 1516 C TYR A 97 -4.121 9.540 -6.747 1.00 25.21 C ATOM 1517 O TYR A 97 -5.086 8.894 -6.335 1.00 54.42 O ATOM 1518 CB TYR A 97 -5.210 9.994 -8.941 1.00 31.13 C ATOM 1519 CG TYR A 97 -5.074 10.309 -10.412 1.00 52.11 C ATOM 1520 CD1 TYR A 97 -4.224 11.314 -10.848 1.00 63.30 C ATOM 1521 CD2 TYR A 97 -5.794 9.598 -11.364 1.00 75.52 C ATOM 1522 CE1 TYR A 97 -4.098 11.603 -12.192 1.00 11.30 C ATOM 1523 CE2 TYR A 97 -5.673 9.882 -12.709 1.00 43.31 C ATOM 1524 CZ TYR A 97 -4.824 10.884 -13.118 1.00 12.01 C ATOM 1525 OH TYR A 97 -4.701 11.172 -14.458 1.00 60.14 O ATOM 0 H TYR A 97 -3.834 7.833 -9.140 1.00 74.52 H new ATOM 0 HA TYR A 97 -3.227 10.584 -8.397 1.00 70.44 H new ATOM 0 HB2 TYR A 97 -5.854 9.122 -8.825 1.00 31.13 H new ATOM 0 HB3 TYR A 97 -5.709 10.827 -8.446 1.00 31.13 H new ATOM 0 HD1 TYR A 97 -3.653 11.879 -10.126 1.00 63.30 H new ATOM 0 HD2 TYR A 97 -6.460 8.809 -11.046 1.00 75.52 H new ATOM 0 HE1 TYR A 97 -3.433 12.390 -12.517 1.00 11.30 H new ATOM 0 HE2 TYR A 97 -6.241 9.321 -13.436 1.00 43.31 H new ATOM 0 HH TYR A 97 -5.151 10.479 -14.984 1.00 60.14 H new ATOM 1535 N CYS A 98 -3.231 10.095 -5.947 1.00 42.51 N ATOM 1536 CA CYS A 98 -3.343 10.012 -4.505 1.00 73.23 C ATOM 1537 C CYS A 98 -3.179 11.391 -3.882 1.00 13.54 C ATOM 1538 O CYS A 98 -2.094 11.978 -3.917 1.00 53.44 O ATOM 1539 CB CYS A 98 -2.302 9.038 -3.947 1.00 72.44 C ATOM 1540 SG CYS A 98 -0.611 9.360 -4.503 1.00 35.23 S ATOM 0 H CYS A 98 -2.416 10.612 -6.276 1.00 42.51 H new ATOM 0 HA CYS A 98 -4.334 9.637 -4.251 1.00 73.23 H new ATOM 0 HB2 CYS A 98 -2.329 9.080 -2.858 1.00 72.44 H new ATOM 0 HB3 CYS A 98 -2.580 8.024 -4.234 1.00 72.44 H new ATOM 0 HG CYS A 98 -0.380 10.639 -4.472 1.00 35.23 H new ATOM 1546 N PRO A 99 -4.269 11.948 -3.343 1.00 24.54 N ATOM 1547 CA PRO A 99 -4.234 13.231 -2.653 1.00 31.20 C ATOM 1548 C PRO A 99 -3.548 13.118 -1.295 1.00 53.34 C ATOM 1549 O PRO A 99 -3.774 12.161 -0.556 1.00 34.05 O ATOM 1550 CB PRO A 99 -5.714 13.604 -2.478 1.00 61.04 C ATOM 1551 CG PRO A 99 -6.485 12.607 -3.283 1.00 50.11 C ATOM 1552 CD PRO A 99 -5.621 11.384 -3.376 1.00 13.12 C ATOM 0 HA PRO A 99 -3.669 13.978 -3.210 1.00 31.20 H new ATOM 0 HB2 PRO A 99 -6.005 13.567 -1.428 1.00 61.04 H new ATOM 0 HB3 PRO A 99 -5.905 14.619 -2.826 1.00 61.04 H new ATOM 0 HG2 PRO A 99 -7.437 12.375 -2.806 1.00 50.11 H new ATOM 0 HG3 PRO A 99 -6.712 12.999 -4.274 1.00 50.11 H new ATOM 0 HD2 PRO A 99 -5.796 10.700 -2.546 1.00 13.12 H new ATOM 0 HD3 PRO A 99 -5.806 10.826 -4.294 1.00 13.12 H new ATOM 1560 N ASP A 100 -2.715 14.100 -0.979 1.00 43.42 N ATOM 1561 CA ASP A 100 -1.958 14.116 0.275 1.00 15.55 C ATOM 1562 C ASP A 100 -2.873 14.044 1.499 1.00 13.32 C ATOM 1563 O ASP A 100 -2.592 13.327 2.460 1.00 71.43 O ATOM 1564 CB ASP A 100 -1.101 15.384 0.333 1.00 33.00 C ATOM 1565 CG ASP A 100 -0.446 15.594 1.682 1.00 31.20 C ATOM 1566 OD1 ASP A 100 0.474 14.824 2.027 1.00 34.11 O ATOM 1567 OD2 ASP A 100 -0.845 16.536 2.398 1.00 32.31 O ATOM 0 H ASP A 100 -2.542 14.907 -1.579 1.00 43.42 H new ATOM 0 HA ASP A 100 -1.321 13.232 0.296 1.00 15.55 H new ATOM 0 HB2 ASP A 100 -0.329 15.330 -0.435 1.00 33.00 H new ATOM 0 HB3 ASP A 100 -1.723 16.248 0.099 1.00 33.00 H new ATOM 1572 N ASN A 101 -3.982 14.763 1.443 1.00 75.25 N ATOM 1573 CA ASN A 101 -4.883 14.879 2.586 1.00 33.44 C ATOM 1574 C ASN A 101 -6.075 13.918 2.448 1.00 11.33 C ATOM 1575 O ASN A 101 -7.143 14.143 3.017 1.00 32.03 O ATOM 1576 CB ASN A 101 -5.356 16.334 2.708 1.00 51.23 C ATOM 1577 CG ASN A 101 -5.915 16.670 4.079 1.00 44.42 C ATOM 1578 OD1 ASN A 101 -7.118 16.581 4.315 1.00 45.10 O ATOM 1579 ND2 ASN A 101 -5.044 17.067 4.994 1.00 50.52 N ATOM 0 H ASN A 101 -4.284 15.278 0.616 1.00 75.25 H new ATOM 0 HA ASN A 101 -4.349 14.600 3.494 1.00 33.44 H new ATOM 0 HB2 ASN A 101 -4.521 17.000 2.490 1.00 51.23 H new ATOM 0 HB3 ASN A 101 -6.120 16.525 1.955 1.00 51.23 H new ATOM 0 HD21 ASN A 101 -5.364 17.311 5.931 1.00 50.52 H new ATOM 0 HD22 ASN A 101 -4.053 17.129 4.762 1.00 50.52 H new ATOM 1586 N ALA A 102 -5.882 12.837 1.697 1.00 21.23 N ATOM 1587 CA ALA A 102 -6.950 11.865 1.465 1.00 24.43 C ATOM 1588 C ALA A 102 -7.200 10.991 2.698 1.00 41.31 C ATOM 1589 O ALA A 102 -6.258 10.602 3.396 1.00 50.21 O ATOM 1590 CB ALA A 102 -6.623 10.996 0.260 1.00 2.25 C ATOM 0 H ALA A 102 -4.999 12.611 1.239 1.00 21.23 H new ATOM 0 HA ALA A 102 -7.865 12.423 1.265 1.00 24.43 H new ATOM 0 HB1 ALA A 102 -7.427 10.278 0.100 1.00 2.25 H new ATOM 0 HB2 ALA A 102 -6.517 11.625 -0.624 1.00 2.25 H new ATOM 0 HB3 ALA A 102 -5.690 10.462 0.439 1.00 2.25 H new ATOM 1596 N PRO A 103 -8.483 10.675 2.971 1.00 43.11 N ATOM 1597 CA PRO A 103 -8.893 9.856 4.125 1.00 62.04 C ATOM 1598 C PRO A 103 -8.132 8.535 4.222 1.00 54.53 C ATOM 1599 O PRO A 103 -7.912 7.857 3.217 1.00 51.43 O ATOM 1600 CB PRO A 103 -10.378 9.601 3.868 1.00 31.50 C ATOM 1601 CG PRO A 103 -10.817 10.763 3.050 1.00 11.02 C ATOM 1602 CD PRO A 103 -9.646 11.109 2.173 1.00 11.30 C ATOM 0 HA PRO A 103 -8.686 10.361 5.068 1.00 62.04 H new ATOM 0 HB2 PRO A 103 -10.534 8.661 3.339 1.00 31.50 H new ATOM 0 HB3 PRO A 103 -10.938 9.538 4.801 1.00 31.50 H new ATOM 0 HG2 PRO A 103 -11.693 10.512 2.452 1.00 11.02 H new ATOM 0 HG3 PRO A 103 -11.094 11.606 3.684 1.00 11.02 H new ATOM 0 HD2 PRO A 103 -9.693 10.590 1.216 1.00 11.30 H new ATOM 0 HD3 PRO A 103 -9.608 12.176 1.955 1.00 11.30 H new ATOM 1610 N VAL A 104 -7.770 8.176 5.451 1.00 53.12 N ATOM 1611 CA VAL A 104 -6.879 7.048 5.723 1.00 21.45 C ATOM 1612 C VAL A 104 -7.319 5.753 5.037 1.00 53.14 C ATOM 1613 O VAL A 104 -6.602 5.234 4.183 1.00 32.42 O ATOM 1614 CB VAL A 104 -6.756 6.792 7.240 1.00 41.15 C ATOM 1615 CG1 VAL A 104 -5.743 5.692 7.523 1.00 35.23 C ATOM 1616 CG2 VAL A 104 -6.375 8.072 7.969 1.00 54.22 C ATOM 0 H VAL A 104 -8.087 8.660 6.291 1.00 53.12 H new ATOM 0 HA VAL A 104 -5.912 7.334 5.310 1.00 21.45 H new ATOM 0 HB VAL A 104 -7.727 6.462 7.609 1.00 41.15 H new ATOM 0 HG11 VAL A 104 -5.673 5.529 8.599 1.00 35.23 H new ATOM 0 HG12 VAL A 104 -6.061 4.770 7.036 1.00 35.23 H new ATOM 0 HG13 VAL A 104 -4.767 5.988 7.137 1.00 35.23 H new ATOM 0 HG21 VAL A 104 -6.293 7.872 9.037 1.00 54.22 H new ATOM 0 HG22 VAL A 104 -5.418 8.434 7.593 1.00 54.22 H new ATOM 0 HG23 VAL A 104 -7.141 8.829 7.800 1.00 54.22 H new ATOM 1626 N ARG A 105 -8.499 5.252 5.397 1.00 70.05 N ATOM 1627 CA ARG A 105 -8.941 3.921 4.963 1.00 74.32 C ATOM 1628 C ARG A 105 -8.949 3.787 3.446 1.00 15.14 C ATOM 1629 O ARG A 105 -8.478 2.791 2.900 1.00 40.14 O ATOM 1630 CB ARG A 105 -10.338 3.600 5.507 1.00 3.52 C ATOM 1631 CG ARG A 105 -10.360 3.078 6.938 1.00 25.20 C ATOM 1632 CD ARG A 105 -9.775 4.073 7.926 1.00 30.31 C ATOM 1633 NE ARG A 105 -10.011 3.666 9.307 1.00 40.43 N ATOM 1634 CZ ARG A 105 -9.098 3.733 10.274 1.00 62.32 C ATOM 1635 NH1 ARG A 105 -7.858 4.119 9.998 1.00 44.52 N ATOM 1636 NH2 ARG A 105 -9.420 3.398 11.513 1.00 1.41 N ATOM 0 H ARG A 105 -9.169 5.745 5.988 1.00 70.05 H new ATOM 0 HA ARG A 105 -8.222 3.209 5.367 1.00 74.32 H new ATOM 0 HB2 ARG A 105 -10.949 4.501 5.454 1.00 3.52 H new ATOM 0 HB3 ARG A 105 -10.805 2.859 4.857 1.00 3.52 H new ATOM 0 HG2 ARG A 105 -11.387 2.848 7.222 1.00 25.20 H new ATOM 0 HG3 ARG A 105 -9.799 2.145 6.990 1.00 25.20 H new ATOM 0 HD2 ARG A 105 -8.703 4.170 7.753 1.00 30.31 H new ATOM 0 HD3 ARG A 105 -10.215 5.056 7.756 1.00 30.31 H new ATOM 0 HE ARG A 105 -10.935 3.307 9.547 1.00 40.43 H new ATOM 0 HH11 ARG A 105 -7.602 4.366 9.042 1.00 44.52 H new ATOM 0 HH12 ARG A 105 -7.162 4.169 10.742 1.00 44.52 H new ATOM 0 HH21 ARG A 105 -10.368 3.088 11.728 1.00 1.41 H new ATOM 0 HH22 ARG A 105 -8.720 3.449 12.253 1.00 1.41 H new ATOM 1650 N ARG A 106 -9.473 4.791 2.771 1.00 45.41 N ATOM 1651 CA ARG A 106 -9.606 4.744 1.325 1.00 24.01 C ATOM 1652 C ARG A 106 -8.246 4.657 0.630 1.00 70.15 C ATOM 1653 O ARG A 106 -8.008 3.749 -0.167 1.00 73.11 O ATOM 1654 CB ARG A 106 -10.385 5.961 0.833 1.00 52.20 C ATOM 1655 CG ARG A 106 -10.547 6.011 -0.674 1.00 32.44 C ATOM 1656 CD ARG A 106 -11.578 7.044 -1.086 1.00 11.41 C ATOM 1657 NE ARG A 106 -12.925 6.669 -0.661 1.00 2.41 N ATOM 1658 CZ ARG A 106 -14.034 7.166 -1.200 1.00 24.55 C ATOM 1659 NH1 ARG A 106 -13.953 8.120 -2.121 1.00 52.12 N ATOM 1660 NH2 ARG A 106 -15.220 6.730 -0.800 1.00 62.42 N ATOM 0 H ARG A 106 -9.815 5.651 3.200 1.00 45.41 H new ATOM 0 HA ARG A 106 -10.157 3.839 1.069 1.00 24.01 H new ATOM 0 HB2 ARG A 106 -11.372 5.962 1.296 1.00 52.20 H new ATOM 0 HB3 ARG A 106 -9.876 6.866 1.165 1.00 52.20 H new ATOM 0 HG2 ARG A 106 -9.589 6.247 -1.137 1.00 32.44 H new ATOM 0 HG3 ARG A 106 -10.846 5.030 -1.042 1.00 32.44 H new ATOM 0 HD2 ARG A 106 -11.317 8.010 -0.654 1.00 11.41 H new ATOM 0 HD3 ARG A 106 -11.559 7.164 -2.169 1.00 11.41 H new ATOM 0 HE ARG A 106 -13.020 5.987 0.092 1.00 2.41 H new ATOM 0 HH11 ARG A 106 -13.041 8.470 -2.414 1.00 52.12 H new ATOM 0 HH12 ARG A 106 -14.803 8.502 -2.535 1.00 52.12 H new ATOM 0 HH21 ARG A 106 -15.283 6.012 -0.078 1.00 62.42 H new ATOM 0 HH22 ARG A 106 -16.070 7.112 -1.214 1.00 62.42 H new ATOM 1674 N ARG A 107 -7.345 5.581 0.941 1.00 34.01 N ATOM 1675 CA ARG A 107 -6.063 5.626 0.247 1.00 21.25 C ATOM 1676 C ARG A 107 -5.083 4.570 0.760 1.00 44.31 C ATOM 1677 O ARG A 107 -4.131 4.229 0.062 1.00 1.20 O ATOM 1678 CB ARG A 107 -5.443 7.036 0.252 1.00 30.01 C ATOM 1679 CG ARG A 107 -5.483 7.774 1.580 1.00 44.54 C ATOM 1680 CD ARG A 107 -4.404 7.313 2.540 1.00 33.13 C ATOM 1681 NE ARG A 107 -4.341 8.169 3.726 1.00 35.33 N ATOM 1682 CZ ARG A 107 -3.549 7.937 4.770 1.00 15.20 C ATOM 1683 NH1 ARG A 107 -2.763 6.867 4.783 1.00 73.13 N ATOM 1684 NH2 ARG A 107 -3.543 8.776 5.798 1.00 44.14 N ATOM 0 H ARG A 107 -7.473 6.297 1.656 1.00 34.01 H new ATOM 0 HA ARG A 107 -6.273 5.378 -0.793 1.00 21.25 H new ATOM 0 HB2 ARG A 107 -4.403 6.956 -0.066 1.00 30.01 H new ATOM 0 HB3 ARG A 107 -5.959 7.641 -0.494 1.00 30.01 H new ATOM 0 HG2 ARG A 107 -5.370 8.843 1.400 1.00 44.54 H new ATOM 0 HG3 ARG A 107 -6.460 7.630 2.042 1.00 44.54 H new ATOM 0 HD2 ARG A 107 -4.600 6.284 2.842 1.00 33.13 H new ATOM 0 HD3 ARG A 107 -3.439 7.319 2.034 1.00 33.13 H new ATOM 0 HE ARG A 107 -4.941 8.994 3.754 1.00 35.33 H new ATOM 0 HH11 ARG A 107 -2.766 6.222 3.993 1.00 73.13 H new ATOM 0 HH12 ARG A 107 -2.156 6.690 5.583 1.00 73.13 H new ATOM 0 HH21 ARG A 107 -4.146 9.599 5.788 1.00 44.14 H new ATOM 0 HH22 ARG A 107 -2.936 8.598 6.598 1.00 44.14 H new ATOM 1698 N MET A 108 -5.299 4.047 1.967 1.00 73.15 N ATOM 1699 CA MET A 108 -4.443 2.970 2.462 1.00 3.14 C ATOM 1700 C MET A 108 -4.709 1.692 1.666 1.00 42.31 C ATOM 1701 O MET A 108 -3.788 0.931 1.377 1.00 72.34 O ATOM 1702 CB MET A 108 -4.628 2.719 3.971 1.00 61.45 C ATOM 1703 CG MET A 108 -5.945 2.059 4.354 1.00 41.31 C ATOM 1704 SD MET A 108 -6.113 1.807 6.133 1.00 24.41 S ATOM 1705 CE MET A 108 -4.754 0.682 6.448 1.00 50.44 C ATOM 0 H MET A 108 -6.038 4.342 2.605 1.00 73.15 H new ATOM 0 HA MET A 108 -3.407 3.279 2.321 1.00 3.14 H new ATOM 0 HB2 MET A 108 -3.808 2.093 4.324 1.00 61.45 H new ATOM 0 HB3 MET A 108 -4.550 3.671 4.495 1.00 61.45 H new ATOM 0 HG2 MET A 108 -6.771 2.676 4.000 1.00 41.31 H new ATOM 0 HG3 MET A 108 -6.025 1.097 3.847 1.00 41.31 H new ATOM 0 HE1 MET A 108 -4.916 0.173 7.398 1.00 50.44 H new ATOM 0 HE2 MET A 108 -4.699 -0.055 5.647 1.00 50.44 H new ATOM 0 HE3 MET A 108 -3.820 1.242 6.491 1.00 50.44 H new ATOM 1715 N LEU A 109 -5.969 1.479 1.290 1.00 15.43 N ATOM 1716 CA LEU A 109 -6.337 0.351 0.441 1.00 72.12 C ATOM 1717 C LEU A 109 -5.859 0.600 -0.981 1.00 53.14 C ATOM 1718 O LEU A 109 -5.298 -0.286 -1.627 1.00 73.10 O ATOM 1719 CB LEU A 109 -7.853 0.140 0.452 1.00 64.03 C ATOM 1720 CG LEU A 109 -8.452 -0.234 1.809 1.00 35.42 C ATOM 1721 CD1 LEU A 109 -9.963 -0.363 1.701 1.00 44.15 C ATOM 1722 CD2 LEU A 109 -7.842 -1.532 2.322 1.00 33.32 C ATOM 0 H LEU A 109 -6.752 2.074 1.561 1.00 15.43 H new ATOM 0 HA LEU A 109 -5.860 -0.548 0.830 1.00 72.12 H new ATOM 0 HB2 LEU A 109 -8.333 1.054 0.101 1.00 64.03 H new ATOM 0 HB3 LEU A 109 -8.099 -0.644 -0.264 1.00 64.03 H new ATOM 0 HG LEU A 109 -8.221 0.559 2.520 1.00 35.42 H new ATOM 0 HD11 LEU A 109 -10.376 -0.629 2.674 1.00 44.15 H new ATOM 0 HD12 LEU A 109 -10.387 0.587 1.375 1.00 44.15 H new ATOM 0 HD13 LEU A 109 -10.211 -1.139 0.977 1.00 44.15 H new ATOM 0 HD21 LEU A 109 -8.280 -1.783 3.288 1.00 33.32 H new ATOM 0 HD22 LEU A 109 -8.044 -2.334 1.613 1.00 33.32 H new ATOM 0 HD23 LEU A 109 -6.765 -1.409 2.433 1.00 33.32 H new ATOM 1734 N TYR A 110 -6.079 1.826 -1.446 1.00 74.33 N ATOM 1735 CA TYR A 110 -5.643 2.258 -2.769 1.00 33.13 C ATOM 1736 C TYR A 110 -4.147 2.008 -2.959 1.00 62.15 C ATOM 1737 O TYR A 110 -3.723 1.422 -3.955 1.00 13.23 O ATOM 1738 CB TYR A 110 -5.963 3.748 -2.945 1.00 65.20 C ATOM 1739 CG TYR A 110 -5.513 4.342 -4.261 1.00 73.33 C ATOM 1740 CD1 TYR A 110 -6.268 4.174 -5.413 1.00 61.53 C ATOM 1741 CD2 TYR A 110 -4.339 5.081 -4.349 1.00 40.12 C ATOM 1742 CE1 TYR A 110 -5.866 4.724 -6.614 1.00 34.12 C ATOM 1743 CE2 TYR A 110 -3.933 5.635 -5.545 1.00 62.42 C ATOM 1744 CZ TYR A 110 -4.698 5.453 -6.674 1.00 51.42 C ATOM 1745 OH TYR A 110 -4.298 6.006 -7.868 1.00 51.40 O ATOM 0 H TYR A 110 -6.565 2.549 -0.915 1.00 74.33 H new ATOM 0 HA TYR A 110 -6.176 1.680 -3.524 1.00 33.13 H new ATOM 0 HB2 TYR A 110 -7.040 3.888 -2.849 1.00 65.20 H new ATOM 0 HB3 TYR A 110 -5.495 4.304 -2.133 1.00 65.20 H new ATOM 0 HD1 TYR A 110 -7.184 3.604 -5.370 1.00 61.53 H new ATOM 0 HD2 TYR A 110 -3.734 5.224 -3.466 1.00 40.12 H new ATOM 0 HE1 TYR A 110 -6.464 4.584 -7.502 1.00 34.12 H new ATOM 0 HE2 TYR A 110 -3.019 6.209 -5.595 1.00 62.42 H new ATOM 0 HH TYR A 110 -3.783 5.346 -8.378 1.00 51.40 H new ATOM 1755 N ALA A 111 -3.356 2.426 -1.980 1.00 72.24 N ATOM 1756 CA ALA A 111 -1.906 2.287 -2.053 1.00 51.52 C ATOM 1757 C ALA A 111 -1.473 0.829 -1.929 1.00 65.14 C ATOM 1758 O ALA A 111 -0.374 0.458 -2.341 1.00 2.42 O ATOM 1759 CB ALA A 111 -1.239 3.130 -0.977 1.00 21.30 C ATOM 0 H ALA A 111 -3.694 2.865 -1.124 1.00 72.24 H new ATOM 0 HA ALA A 111 -1.588 2.644 -3.033 1.00 51.52 H new ATOM 0 HB1 ALA A 111 -0.157 3.016 -1.044 1.00 21.30 H new ATOM 0 HB2 ALA A 111 -1.503 4.178 -1.120 1.00 21.30 H new ATOM 0 HB3 ALA A 111 -1.578 2.801 0.005 1.00 21.30 H new ATOM 1765 N SER A 112 -2.331 -0.002 -1.362 1.00 32.13 N ATOM 1766 CA SER A 112 -2.007 -1.404 -1.176 1.00 10.14 C ATOM 1767 C SER A 112 -2.405 -2.244 -2.387 1.00 64.24 C ATOM 1768 O SER A 112 -1.943 -3.370 -2.537 1.00 4.42 O ATOM 1769 CB SER A 112 -2.656 -1.934 0.101 1.00 10.23 C ATOM 1770 OG SER A 112 -2.049 -1.344 1.242 1.00 14.42 O ATOM 0 H SER A 112 -3.254 0.270 -1.024 1.00 32.13 H new ATOM 0 HA SER A 112 -0.925 -1.486 -1.074 1.00 10.14 H new ATOM 0 HB2 SER A 112 -3.723 -1.714 0.093 1.00 10.23 H new ATOM 0 HB3 SER A 112 -2.555 -3.018 0.146 1.00 10.23 H new ATOM 0 HG SER A 112 -2.515 -0.512 1.467 1.00 14.42 H new ATOM 1776 N SER A 113 -3.247 -1.700 -3.252 1.00 71.13 N ATOM 1777 CA SER A 113 -3.612 -2.398 -4.476 1.00 14.43 C ATOM 1778 C SER A 113 -2.619 -2.093 -5.598 1.00 14.13 C ATOM 1779 O SER A 113 -2.637 -2.736 -6.649 1.00 33.24 O ATOM 1780 CB SER A 113 -5.035 -2.026 -4.902 1.00 5.40 C ATOM 1781 OG SER A 113 -5.229 -0.621 -4.918 1.00 4.44 O ATOM 0 H SER A 113 -3.687 -0.787 -3.132 1.00 71.13 H new ATOM 0 HA SER A 113 -3.578 -3.469 -4.277 1.00 14.43 H new ATOM 0 HB2 SER A 113 -5.236 -2.432 -5.893 1.00 5.40 H new ATOM 0 HB3 SER A 113 -5.750 -2.484 -4.219 1.00 5.40 H new ATOM 0 HG SER A 113 -4.410 -0.174 -4.619 1.00 4.44 H new ATOM 1787 N VAL A 114 -1.741 -1.119 -5.353 1.00 51.23 N ATOM 1788 CA VAL A 114 -0.779 -0.669 -6.358 1.00 44.34 C ATOM 1789 C VAL A 114 0.125 -1.806 -6.836 1.00 74.41 C ATOM 1790 O VAL A 114 0.294 -2.009 -8.038 1.00 32.32 O ATOM 1791 CB VAL A 114 0.098 0.488 -5.826 1.00 4.40 C ATOM 1792 CG1 VAL A 114 1.140 0.901 -6.857 1.00 0.22 C ATOM 1793 CG2 VAL A 114 -0.768 1.677 -5.442 1.00 13.14 C ATOM 0 H VAL A 114 -1.677 -0.625 -4.463 1.00 51.23 H new ATOM 0 HA VAL A 114 -1.368 -0.313 -7.203 1.00 44.34 H new ATOM 0 HB VAL A 114 0.621 0.135 -4.937 1.00 4.40 H new ATOM 0 HG11 VAL A 114 1.743 1.716 -6.458 1.00 0.22 H new ATOM 0 HG12 VAL A 114 1.783 0.051 -7.085 1.00 0.22 H new ATOM 0 HG13 VAL A 114 0.640 1.232 -7.767 1.00 0.22 H new ATOM 0 HG21 VAL A 114 -0.135 2.483 -5.069 1.00 13.14 H new ATOM 0 HG22 VAL A 114 -1.319 2.023 -6.316 1.00 13.14 H new ATOM 0 HG23 VAL A 114 -1.471 1.379 -4.664 1.00 13.14 H new ATOM 1803 N ARG A 115 0.684 -2.556 -5.891 1.00 31.33 N ATOM 1804 CA ARG A 115 1.635 -3.619 -6.214 1.00 20.23 C ATOM 1805 C ARG A 115 0.991 -4.679 -7.108 1.00 43.32 C ATOM 1806 O ARG A 115 1.641 -5.233 -7.995 1.00 32.33 O ATOM 1807 CB ARG A 115 2.185 -4.250 -4.921 1.00 51.43 C ATOM 1808 CG ARG A 115 3.258 -5.313 -5.146 1.00 63.14 C ATOM 1809 CD ARG A 115 2.668 -6.713 -5.264 1.00 20.12 C ATOM 1810 NE ARG A 115 3.656 -7.684 -5.731 1.00 3.50 N ATOM 1811 CZ ARG A 115 3.854 -8.884 -5.184 1.00 73.53 C ATOM 1812 NH1 ARG A 115 3.154 -9.269 -4.123 1.00 44.12 N ATOM 1813 NH2 ARG A 115 4.758 -9.699 -5.708 1.00 65.53 N ATOM 0 H ARG A 115 0.496 -2.449 -4.894 1.00 31.33 H new ATOM 0 HA ARG A 115 2.466 -3.182 -6.767 1.00 20.23 H new ATOM 0 HB2 ARG A 115 2.598 -3.461 -4.293 1.00 51.43 H new ATOM 0 HB3 ARG A 115 1.358 -4.697 -4.369 1.00 51.43 H new ATOM 0 HG2 ARG A 115 3.815 -5.078 -6.053 1.00 63.14 H new ATOM 0 HG3 ARG A 115 3.969 -5.289 -4.320 1.00 63.14 H new ATOM 0 HD2 ARG A 115 2.281 -7.027 -4.294 1.00 20.12 H new ATOM 0 HD3 ARG A 115 1.824 -6.694 -5.953 1.00 20.12 H new ATOM 0 HE ARG A 115 4.234 -7.426 -6.531 1.00 3.50 H new ATOM 0 HH11 ARG A 115 2.456 -8.645 -3.718 1.00 44.12 H new ATOM 0 HH12 ARG A 115 3.314 -10.189 -3.713 1.00 44.12 H new ATOM 0 HH21 ARG A 115 5.296 -9.407 -6.524 1.00 65.53 H new ATOM 0 HH22 ARG A 115 4.916 -10.619 -5.296 1.00 65.53 H new ATOM 1827 N ALA A 116 -0.293 -4.932 -6.887 1.00 62.12 N ATOM 1828 CA ALA A 116 -1.010 -5.957 -7.629 1.00 55.21 C ATOM 1829 C ALA A 116 -1.217 -5.547 -9.084 1.00 54.43 C ATOM 1830 O ALA A 116 -0.769 -6.237 -9.999 1.00 71.23 O ATOM 1831 CB ALA A 116 -2.344 -6.252 -6.959 1.00 12.24 C ATOM 0 H ALA A 116 -0.859 -4.439 -6.197 1.00 62.12 H new ATOM 0 HA ALA A 116 -0.406 -6.864 -7.625 1.00 55.21 H new ATOM 0 HB1 ALA A 116 -2.872 -7.021 -7.523 1.00 12.24 H new ATOM 0 HB2 ALA A 116 -2.170 -6.603 -5.942 1.00 12.24 H new ATOM 0 HB3 ALA A 116 -2.946 -5.344 -6.932 1.00 12.24 H new ATOM 1837 N LEU A 117 -1.870 -4.408 -9.292 1.00 5.23 N ATOM 1838 CA LEU A 117 -2.228 -3.970 -10.639 1.00 13.45 C ATOM 1839 C LEU A 117 -0.995 -3.644 -11.479 1.00 4.33 C ATOM 1840 O LEU A 117 -0.992 -3.843 -12.692 1.00 33.51 O ATOM 1841 CB LEU A 117 -3.193 -2.769 -10.582 1.00 11.44 C ATOM 1842 CG LEU A 117 -2.757 -1.574 -9.716 1.00 73.02 C ATOM 1843 CD1 LEU A 117 -1.766 -0.687 -10.452 1.00 12.21 C ATOM 1844 CD2 LEU A 117 -3.968 -0.762 -9.282 1.00 53.01 C ATOM 0 H LEU A 117 -2.162 -3.773 -8.549 1.00 5.23 H new ATOM 0 HA LEU A 117 -2.739 -4.799 -11.129 1.00 13.45 H new ATOM 0 HB2 LEU A 117 -3.353 -2.412 -11.599 1.00 11.44 H new ATOM 0 HB3 LEU A 117 -4.156 -3.123 -10.214 1.00 11.44 H new ATOM 0 HG LEU A 117 -2.260 -1.970 -8.830 1.00 73.02 H new ATOM 0 HD11 LEU A 117 -1.479 0.147 -9.812 1.00 12.21 H new ATOM 0 HD12 LEU A 117 -0.880 -1.267 -10.711 1.00 12.21 H new ATOM 0 HD13 LEU A 117 -2.227 -0.304 -11.362 1.00 12.21 H new ATOM 0 HD21 LEU A 117 -3.642 0.079 -8.670 1.00 53.01 H new ATOM 0 HD22 LEU A 117 -4.491 -0.389 -10.163 1.00 53.01 H new ATOM 0 HD23 LEU A 117 -4.640 -1.394 -8.701 1.00 53.01 H new ATOM 1856 N LYS A 118 0.058 -3.174 -10.830 1.00 33.34 N ATOM 1857 CA LYS A 118 1.250 -2.749 -11.537 1.00 14.40 C ATOM 1858 C LYS A 118 2.035 -3.953 -12.057 1.00 15.25 C ATOM 1859 O LYS A 118 2.525 -3.949 -13.190 1.00 54.11 O ATOM 1860 CB LYS A 118 2.105 -1.877 -10.612 1.00 1.13 C ATOM 1861 CG LYS A 118 3.287 -1.222 -11.296 1.00 13.14 C ATOM 1862 CD LYS A 118 4.527 -2.091 -11.231 1.00 61.40 C ATOM 1863 CE LYS A 118 5.563 -1.621 -12.226 1.00 0.23 C ATOM 1864 NZ LYS A 118 6.885 -2.257 -11.998 1.00 34.51 N ATOM 0 H LYS A 118 0.109 -3.078 -9.816 1.00 33.34 H new ATOM 0 HA LYS A 118 0.962 -2.157 -12.406 1.00 14.40 H new ATOM 0 HB2 LYS A 118 1.475 -1.101 -10.177 1.00 1.13 H new ATOM 0 HB3 LYS A 118 2.470 -2.490 -9.788 1.00 1.13 H new ATOM 0 HG2 LYS A 118 3.038 -1.021 -12.338 1.00 13.14 H new ATOM 0 HG3 LYS A 118 3.492 -0.260 -10.826 1.00 13.14 H new ATOM 0 HD2 LYS A 118 4.944 -2.063 -10.224 1.00 61.40 H new ATOM 0 HD3 LYS A 118 4.262 -3.128 -11.438 1.00 61.40 H new ATOM 0 HE2 LYS A 118 5.223 -1.846 -13.237 1.00 0.23 H new ATOM 0 HE3 LYS A 118 5.666 -0.538 -12.158 1.00 0.23 H new ATOM 0 HZ1 LYS A 118 7.494 -2.098 -12.826 1.00 34.51 H new ATOM 0 HZ2 LYS A 118 7.330 -1.840 -11.156 1.00 34.51 H new ATOM 0 HZ3 LYS A 118 6.758 -3.279 -11.853 1.00 34.51 H new ATOM 1878 N ALA A 119 2.131 -4.991 -11.239 1.00 43.04 N ATOM 1879 CA ALA A 119 2.898 -6.174 -11.604 1.00 23.21 C ATOM 1880 C ALA A 119 2.088 -7.111 -12.493 1.00 4.34 C ATOM 1881 O ALA A 119 2.608 -7.667 -13.463 1.00 45.00 O ATOM 1882 CB ALA A 119 3.367 -6.904 -10.356 1.00 13.11 C ATOM 0 H ALA A 119 1.689 -5.039 -10.321 1.00 43.04 H new ATOM 0 HA ALA A 119 3.769 -5.846 -12.172 1.00 23.21 H new ATOM 0 HB1 ALA A 119 3.939 -7.786 -10.644 1.00 13.11 H new ATOM 0 HB2 ALA A 119 3.996 -6.241 -9.762 1.00 13.11 H new ATOM 0 HB3 ALA A 119 2.502 -7.209 -9.766 1.00 13.11 H new ATOM 1888 N SER A 120 0.808 -7.262 -12.175 1.00 2.01 N ATOM 1889 CA SER A 120 -0.053 -8.217 -12.865 1.00 31.21 C ATOM 1890 C SER A 120 -0.293 -7.829 -14.323 1.00 20.21 C ATOM 1891 O SER A 120 -0.483 -8.699 -15.173 1.00 32.33 O ATOM 1892 CB SER A 120 -1.389 -8.344 -12.129 1.00 34.32 C ATOM 1893 OG SER A 120 -2.228 -9.314 -12.736 1.00 44.54 O ATOM 0 H SER A 120 0.340 -6.732 -11.439 1.00 2.01 H new ATOM 0 HA SER A 120 0.460 -9.179 -12.864 1.00 31.21 H new ATOM 0 HB2 SER A 120 -1.208 -8.617 -11.089 1.00 34.32 H new ATOM 0 HB3 SER A 120 -1.894 -7.378 -12.121 1.00 34.32 H new ATOM 0 HG SER A 120 -2.985 -8.867 -13.169 1.00 44.54 H new ATOM 1899 N LEU A 121 -0.271 -6.535 -14.625 1.00 20.14 N ATOM 1900 CA LEU A 121 -0.612 -6.086 -15.970 1.00 44.43 C ATOM 1901 C LEU A 121 0.625 -6.008 -16.864 1.00 64.44 C ATOM 1902 O LEU A 121 0.531 -5.661 -18.040 1.00 15.44 O ATOM 1903 CB LEU A 121 -1.363 -4.748 -15.931 1.00 10.34 C ATOM 1904 CG LEU A 121 -2.879 -4.858 -15.684 1.00 13.14 C ATOM 1905 CD1 LEU A 121 -3.180 -5.495 -14.336 1.00 12.12 C ATOM 1906 CD2 LEU A 121 -3.544 -3.494 -15.776 1.00 64.53 C ATOM 0 H LEU A 121 -0.026 -5.792 -13.971 1.00 20.14 H new ATOM 0 HA LEU A 121 -1.280 -6.828 -16.407 1.00 44.43 H new ATOM 0 HB2 LEU A 121 -0.927 -4.127 -15.149 1.00 10.34 H new ATOM 0 HB3 LEU A 121 -1.201 -4.230 -16.876 1.00 10.34 H new ATOM 0 HG LEU A 121 -3.288 -5.502 -16.463 1.00 13.14 H new ATOM 0 HD11 LEU A 121 -4.259 -5.557 -14.196 1.00 12.12 H new ATOM 0 HD12 LEU A 121 -2.752 -6.497 -14.303 1.00 12.12 H new ATOM 0 HD13 LEU A 121 -2.745 -4.889 -13.542 1.00 12.12 H new ATOM 0 HD21 LEU A 121 -4.614 -3.598 -15.598 1.00 64.53 H new ATOM 0 HD22 LEU A 121 -3.115 -2.829 -15.027 1.00 64.53 H new ATOM 0 HD23 LEU A 121 -3.381 -3.076 -16.769 1.00 64.53 H new ATOM 1918 N GLY A 122 1.780 -6.347 -16.298 1.00 21.53 N ATOM 1919 CA GLY A 122 2.990 -6.485 -17.093 1.00 14.43 C ATOM 1920 C GLY A 122 3.708 -5.175 -17.361 1.00 43.55 C ATOM 1921 O GLY A 122 4.491 -5.076 -18.305 1.00 31.32 O ATOM 0 H GLY A 122 1.901 -6.529 -15.302 1.00 21.53 H new ATOM 0 HA2 GLY A 122 3.673 -7.163 -16.581 1.00 14.43 H new ATOM 0 HA3 GLY A 122 2.735 -6.949 -18.046 1.00 14.43 H new ATOM 1925 N LEU A 123 3.466 -4.169 -16.535 1.00 22.22 N ATOM 1926 CA LEU A 123 4.156 -2.889 -16.683 1.00 72.41 C ATOM 1927 C LEU A 123 5.355 -2.820 -15.747 1.00 60.43 C ATOM 1928 O LEU A 123 5.791 -1.740 -15.352 1.00 42.44 O ATOM 1929 CB LEU A 123 3.218 -1.705 -16.426 1.00 31.11 C ATOM 1930 CG LEU A 123 2.147 -1.476 -17.495 1.00 31.12 C ATOM 1931 CD1 LEU A 123 0.984 -2.433 -17.304 1.00 53.53 C ATOM 1932 CD2 LEU A 123 1.670 -0.032 -17.474 1.00 53.24 C ATOM 0 H LEU A 123 2.804 -4.209 -15.760 1.00 22.22 H new ATOM 0 HA LEU A 123 4.502 -2.822 -17.714 1.00 72.41 H new ATOM 0 HB2 LEU A 123 2.724 -1.856 -15.466 1.00 31.11 H new ATOM 0 HB3 LEU A 123 3.818 -0.800 -16.337 1.00 31.11 H new ATOM 0 HG LEU A 123 2.590 -1.673 -18.471 1.00 31.12 H new ATOM 0 HD11 LEU A 123 0.234 -2.253 -18.074 1.00 53.53 H new ATOM 0 HD12 LEU A 123 1.342 -3.460 -17.379 1.00 53.53 H new ATOM 0 HD13 LEU A 123 0.540 -2.274 -16.321 1.00 53.53 H new ATOM 0 HD21 LEU A 123 0.909 0.111 -18.241 1.00 53.24 H new ATOM 0 HD22 LEU A 123 1.247 0.197 -16.496 1.00 53.24 H new ATOM 0 HD23 LEU A 123 2.512 0.632 -17.670 1.00 53.24 H new ATOM 1944 N GLU A 124 5.889 -3.988 -15.413 1.00 70.34 N ATOM 1945 CA GLU A 124 7.023 -4.100 -14.501 1.00 72.35 C ATOM 1946 C GLU A 124 8.204 -3.236 -14.935 1.00 31.02 C ATOM 1947 O GLU A 124 8.768 -2.506 -14.122 1.00 24.31 O ATOM 1948 CB GLU A 124 7.456 -5.559 -14.377 1.00 53.40 C ATOM 1949 CG GLU A 124 6.512 -6.393 -13.528 1.00 34.24 C ATOM 1950 CD GLU A 124 6.602 -6.051 -12.054 1.00 71.44 C ATOM 1951 OE1 GLU A 124 6.411 -4.869 -11.696 1.00 2.42 O ATOM 1952 OE2 GLU A 124 6.888 -6.960 -11.248 1.00 12.44 O ATOM 0 H GLU A 124 5.550 -4.883 -15.765 1.00 70.34 H new ATOM 0 HA GLU A 124 6.694 -3.733 -13.529 1.00 72.35 H new ATOM 0 HB2 GLU A 124 7.522 -5.998 -15.373 1.00 53.40 H new ATOM 0 HB3 GLU A 124 8.455 -5.599 -13.944 1.00 53.40 H new ATOM 0 HG2 GLU A 124 5.489 -6.240 -13.871 1.00 34.24 H new ATOM 0 HG3 GLU A 124 6.741 -7.450 -13.667 1.00 34.24 H new ATOM 1959 N SER A 125 8.557 -3.307 -16.209 1.00 41.03 N ATOM 1960 CA SER A 125 9.708 -2.575 -16.723 1.00 63.31 C ATOM 1961 C SER A 125 9.313 -1.186 -17.227 1.00 71.03 C ATOM 1962 O SER A 125 10.095 -0.519 -17.903 1.00 21.12 O ATOM 1963 CB SER A 125 10.365 -3.374 -17.850 1.00 31.41 C ATOM 1964 OG SER A 125 10.670 -4.693 -17.425 1.00 64.05 O ATOM 0 H SER A 125 8.064 -3.864 -16.907 1.00 41.03 H new ATOM 0 HA SER A 125 10.416 -2.442 -15.905 1.00 63.31 H new ATOM 0 HB2 SER A 125 9.698 -3.410 -18.712 1.00 31.41 H new ATOM 0 HB3 SER A 125 11.277 -2.872 -18.173 1.00 31.41 H new ATOM 0 HG SER A 125 11.088 -5.186 -18.162 1.00 64.05 H new ATOM 1970 N LEU A 126 8.108 -0.745 -16.890 1.00 64.04 N ATOM 1971 CA LEU A 126 7.629 0.557 -17.332 1.00 71.11 C ATOM 1972 C LEU A 126 7.646 1.558 -16.183 1.00 40.03 C ATOM 1973 O LEU A 126 8.098 1.242 -15.081 1.00 43.41 O ATOM 1974 CB LEU A 126 6.229 0.436 -17.937 1.00 54.34 C ATOM 1975 CG LEU A 126 6.149 -0.449 -19.185 1.00 2.20 C ATOM 1976 CD1 LEU A 126 4.743 -0.450 -19.756 1.00 22.21 C ATOM 1977 CD2 LEU A 126 7.149 0.013 -20.235 1.00 41.30 C ATOM 0 H LEU A 126 7.447 -1.267 -16.315 1.00 64.04 H new ATOM 0 HA LEU A 126 8.301 0.927 -18.106 1.00 71.11 H new ATOM 0 HB2 LEU A 126 5.554 0.037 -17.180 1.00 54.34 H new ATOM 0 HB3 LEU A 126 5.870 1.433 -18.191 1.00 54.34 H new ATOM 0 HG LEU A 126 6.401 -1.469 -18.894 1.00 2.20 H new ATOM 0 HD11 LEU A 126 4.710 -1.085 -20.641 1.00 22.21 H new ATOM 0 HD12 LEU A 126 4.047 -0.833 -19.009 1.00 22.21 H new ATOM 0 HD13 LEU A 126 4.460 0.567 -20.028 1.00 22.21 H new ATOM 0 HD21 LEU A 126 7.077 -0.628 -21.113 1.00 41.30 H new ATOM 0 HD22 LEU A 126 6.930 1.043 -20.518 1.00 41.30 H new ATOM 0 HD23 LEU A 126 8.158 -0.044 -19.826 1.00 41.30 H new ATOM 1989 N PHE A 127 7.147 2.759 -16.436 1.00 74.44 N ATOM 1990 CA PHE A 127 7.285 3.853 -15.483 1.00 35.31 C ATOM 1991 C PHE A 127 5.937 4.215 -14.857 1.00 71.41 C ATOM 1992 O PHE A 127 4.883 4.021 -15.466 1.00 24.14 O ATOM 1993 CB PHE A 127 7.898 5.073 -16.185 1.00 25.42 C ATOM 1994 CG PHE A 127 8.492 6.089 -15.247 1.00 45.32 C ATOM 1995 CD1 PHE A 127 9.695 5.835 -14.607 1.00 43.31 C ATOM 1996 CD2 PHE A 127 7.852 7.293 -15.007 1.00 33.40 C ATOM 1997 CE1 PHE A 127 10.249 6.764 -13.747 1.00 4.33 C ATOM 1998 CE2 PHE A 127 8.404 8.227 -14.149 1.00 15.11 C ATOM 1999 CZ PHE A 127 9.602 7.961 -13.518 1.00 31.42 C ATOM 0 H PHE A 127 6.644 3.001 -17.290 1.00 74.44 H new ATOM 0 HA PHE A 127 7.946 3.531 -14.678 1.00 35.31 H new ATOM 0 HB2 PHE A 127 8.673 4.732 -16.872 1.00 25.42 H new ATOM 0 HB3 PHE A 127 7.129 5.557 -16.787 1.00 25.42 H new ATOM 0 HD1 PHE A 127 10.206 4.900 -14.783 1.00 43.31 H new ATOM 0 HD2 PHE A 127 6.912 7.505 -15.495 1.00 33.40 H new ATOM 0 HE1 PHE A 127 11.187 6.553 -13.255 1.00 4.33 H new ATOM 0 HE2 PHE A 127 7.897 9.164 -13.973 1.00 15.11 H new ATOM 0 HZ PHE A 127 10.033 8.689 -12.846 1.00 31.42 H new ATOM 2009 N GLN A 128 5.983 4.728 -13.631 1.00 33.34 N ATOM 2010 CA GLN A 128 4.783 5.162 -12.927 1.00 64.14 C ATOM 2011 C GLN A 128 5.005 6.539 -12.307 1.00 15.14 C ATOM 2012 O GLN A 128 6.066 6.812 -11.747 1.00 20.11 O ATOM 2013 CB GLN A 128 4.396 4.142 -11.845 1.00 15.00 C ATOM 2014 CG GLN A 128 3.137 4.511 -11.071 1.00 71.14 C ATOM 2015 CD GLN A 128 3.424 5.014 -9.667 1.00 10.03 C ATOM 2016 OE1 GLN A 128 3.655 6.201 -9.453 1.00 12.22 O ATOM 2017 NE2 GLN A 128 3.384 4.114 -8.699 1.00 44.03 N ATOM 0 H GLN A 128 6.846 4.853 -13.102 1.00 33.34 H new ATOM 0 HA GLN A 128 3.964 5.230 -13.643 1.00 64.14 H new ATOM 0 HB2 GLN A 128 4.251 3.168 -12.313 1.00 15.00 H new ATOM 0 HB3 GLN A 128 5.224 4.039 -11.144 1.00 15.00 H new ATOM 0 HG2 GLN A 128 2.592 5.279 -11.621 1.00 71.14 H new ATOM 0 HG3 GLN A 128 2.486 3.639 -11.012 1.00 71.14 H new ATOM 0 HE21 GLN A 128 3.189 3.137 -8.919 1.00 44.03 H new ATOM 0 HE22 GLN A 128 3.548 4.397 -7.733 1.00 44.03 H new ATOM 2026 N VAL A 129 4.004 7.403 -12.423 1.00 53.41 N ATOM 2027 CA VAL A 129 4.072 8.744 -11.859 1.00 53.43 C ATOM 2028 C VAL A 129 2.897 8.969 -10.916 1.00 33.02 C ATOM 2029 O VAL A 129 1.762 8.611 -11.236 1.00 71.24 O ATOM 2030 CB VAL A 129 4.051 9.829 -12.961 1.00 23.12 C ATOM 2031 CG1 VAL A 129 4.148 11.224 -12.357 1.00 2.14 C ATOM 2032 CG2 VAL A 129 5.174 9.611 -13.960 1.00 25.15 C ATOM 0 H VAL A 129 3.130 7.196 -12.906 1.00 53.41 H new ATOM 0 HA VAL A 129 5.013 8.825 -11.315 1.00 53.43 H new ATOM 0 HB VAL A 129 3.100 9.747 -13.487 1.00 23.12 H new ATOM 0 HG11 VAL A 129 4.131 11.967 -13.154 1.00 2.14 H new ATOM 0 HG12 VAL A 129 3.304 11.390 -11.688 1.00 2.14 H new ATOM 0 HG13 VAL A 129 5.079 11.314 -11.797 1.00 2.14 H new ATOM 0 HG21 VAL A 129 5.137 10.387 -14.724 1.00 25.15 H new ATOM 0 HG22 VAL A 129 6.133 9.655 -13.444 1.00 25.15 H new ATOM 0 HG23 VAL A 129 5.059 8.634 -14.429 1.00 25.15 H new ATOM 2042 N GLN A 130 3.169 9.542 -9.752 1.00 23.10 N ATOM 2043 CA GLN A 130 2.118 9.838 -8.789 1.00 2.44 C ATOM 2044 C GLN A 130 1.700 11.304 -8.882 1.00 32.13 C ATOM 2045 O GLN A 130 2.532 12.187 -9.097 1.00 55.42 O ATOM 2046 CB GLN A 130 2.571 9.495 -7.364 1.00 33.15 C ATOM 2047 CG GLN A 130 3.798 10.263 -6.906 1.00 71.03 C ATOM 2048 CD GLN A 130 4.193 9.928 -5.483 1.00 62.13 C ATOM 2049 OE1 GLN A 130 3.733 10.560 -4.533 1.00 34.42 O ATOM 2050 NE2 GLN A 130 5.056 8.937 -5.323 1.00 3.24 N ATOM 0 H GLN A 130 4.106 9.811 -9.452 1.00 23.10 H new ATOM 0 HA GLN A 130 1.254 9.219 -9.029 1.00 2.44 H new ATOM 0 HB2 GLN A 130 1.751 9.696 -6.675 1.00 33.15 H new ATOM 0 HB3 GLN A 130 2.781 8.427 -7.307 1.00 33.15 H new ATOM 0 HG2 GLN A 130 4.631 10.042 -7.573 1.00 71.03 H new ATOM 0 HG3 GLN A 130 3.603 11.333 -6.984 1.00 71.03 H new ATOM 0 HE21 GLN A 130 5.415 8.437 -6.136 1.00 3.24 H new ATOM 0 HE22 GLN A 130 5.362 8.674 -4.386 1.00 3.24 H new ATOM 2059 N ALA A 131 0.409 11.547 -8.728 1.00 72.41 N ATOM 2060 CA ALA A 131 -0.149 12.886 -8.816 1.00 71.20 C ATOM 2061 C ALA A 131 -1.297 13.035 -7.829 1.00 4.14 C ATOM 2062 O ALA A 131 -1.919 12.045 -7.443 1.00 20.54 O ATOM 2063 CB ALA A 131 -0.629 13.162 -10.234 1.00 20.13 C ATOM 0 H ALA A 131 -0.282 10.821 -8.538 1.00 72.41 H new ATOM 0 HA ALA A 131 0.625 13.611 -8.565 1.00 71.20 H new ATOM 0 HB1 ALA A 131 -1.045 14.168 -10.288 1.00 20.13 H new ATOM 0 HB2 ALA A 131 0.210 13.079 -10.925 1.00 20.13 H new ATOM 0 HB3 ALA A 131 -1.396 12.437 -10.506 1.00 20.13 H new ATOM 2069 N SER A 132 -1.569 14.257 -7.401 1.00 24.52 N ATOM 2070 CA SER A 132 -2.655 14.498 -6.468 1.00 3.51 C ATOM 2071 C SER A 132 -3.824 15.203 -7.152 1.00 54.01 C ATOM 2072 O SER A 132 -4.963 14.744 -7.065 1.00 65.22 O ATOM 2073 CB SER A 132 -2.163 15.308 -5.267 1.00 12.41 C ATOM 2074 OG SER A 132 -1.170 14.594 -4.544 1.00 13.44 O ATOM 0 H SER A 132 -1.056 15.092 -7.683 1.00 24.52 H new ATOM 0 HA SER A 132 -3.011 13.532 -6.110 1.00 3.51 H new ATOM 0 HB2 SER A 132 -1.756 16.260 -5.608 1.00 12.41 H new ATOM 0 HB3 SER A 132 -3.002 15.537 -4.610 1.00 12.41 H new ATOM 0 HG SER A 132 -1.501 13.696 -4.333 1.00 13.44 H new ATOM 2080 N GLU A 133 -3.553 16.308 -7.839 1.00 13.32 N ATOM 2081 CA GLU A 133 -4.619 17.054 -8.496 1.00 22.35 C ATOM 2082 C GLU A 133 -4.380 17.173 -10.000 1.00 31.51 C ATOM 2083 O GLU A 133 -3.422 16.617 -10.539 1.00 12.42 O ATOM 2084 CB GLU A 133 -4.788 18.444 -7.878 1.00 70.12 C ATOM 2085 CG GLU A 133 -3.579 19.348 -8.029 1.00 42.44 C ATOM 2086 CD GLU A 133 -3.923 20.795 -7.758 1.00 32.53 C ATOM 2087 OE1 GLU A 133 -4.358 21.484 -8.702 1.00 42.25 O ATOM 2088 OE2 GLU A 133 -3.777 21.246 -6.604 1.00 55.12 O ATOM 0 H GLU A 133 -2.619 16.702 -7.954 1.00 13.32 H new ATOM 0 HA GLU A 133 -5.540 16.492 -8.342 1.00 22.35 H new ATOM 0 HB2 GLU A 133 -5.649 18.930 -8.336 1.00 70.12 H new ATOM 0 HB3 GLU A 133 -5.012 18.332 -6.817 1.00 70.12 H new ATOM 0 HG2 GLU A 133 -2.796 19.026 -7.342 1.00 42.44 H new ATOM 0 HG3 GLU A 133 -3.177 19.253 -9.038 1.00 42.44 H new ATOM 2095 N MET A 134 -5.254 17.923 -10.664 1.00 73.12 N ATOM 2096 CA MET A 134 -5.224 18.058 -12.119 1.00 25.33 C ATOM 2097 C MET A 134 -3.992 18.824 -12.597 1.00 62.54 C ATOM 2098 O MET A 134 -3.487 18.572 -13.689 1.00 74.12 O ATOM 2099 CB MET A 134 -6.495 18.751 -12.614 1.00 44.11 C ATOM 2100 CG MET A 134 -7.755 17.925 -12.406 1.00 21.04 C ATOM 2101 SD MET A 134 -9.256 18.811 -12.861 1.00 15.40 S ATOM 2102 CE MET A 134 -9.264 20.123 -11.642 1.00 71.13 C ATOM 0 H MET A 134 -6.000 18.452 -10.213 1.00 73.12 H new ATOM 0 HA MET A 134 -5.172 17.053 -12.538 1.00 25.33 H new ATOM 0 HB2 MET A 134 -6.605 19.704 -12.097 1.00 44.11 H new ATOM 0 HB3 MET A 134 -6.388 18.975 -13.675 1.00 44.11 H new ATOM 0 HG2 MET A 134 -7.686 17.011 -12.996 1.00 21.04 H new ATOM 0 HG3 MET A 134 -7.819 17.626 -11.360 1.00 21.04 H new ATOM 0 HE1 MET A 134 -10.258 20.205 -11.202 1.00 71.13 H new ATOM 0 HE2 MET A 134 -8.539 19.898 -10.860 1.00 71.13 H new ATOM 0 HE3 MET A 134 -9.000 21.066 -12.121 1.00 71.13 H new ATOM 2112 N SER A 135 -3.498 19.742 -11.773 1.00 63.20 N ATOM 2113 CA SER A 135 -2.318 20.526 -12.126 1.00 72.11 C ATOM 2114 C SER A 135 -1.085 19.628 -12.237 1.00 20.24 C ATOM 2115 O SER A 135 -0.104 19.970 -12.901 1.00 43.05 O ATOM 2116 CB SER A 135 -2.085 21.614 -11.078 1.00 64.00 C ATOM 2117 OG SER A 135 -3.265 22.373 -10.868 1.00 64.53 O ATOM 0 H SER A 135 -3.894 19.962 -10.859 1.00 63.20 H new ATOM 0 HA SER A 135 -2.489 20.994 -13.096 1.00 72.11 H new ATOM 0 HB2 SER A 135 -1.768 21.159 -10.139 1.00 64.00 H new ATOM 0 HB3 SER A 135 -1.278 22.271 -11.402 1.00 64.00 H new ATOM 0 HG SER A 135 -3.590 22.226 -9.955 1.00 64.53 H new ATOM 2123 N ASP A 136 -1.149 18.467 -11.599 1.00 34.11 N ATOM 2124 CA ASP A 136 -0.037 17.528 -11.616 1.00 42.24 C ATOM 2125 C ASP A 136 -0.087 16.675 -12.874 1.00 40.11 C ATOM 2126 O ASP A 136 0.935 16.420 -13.508 1.00 1.11 O ATOM 2127 CB ASP A 136 -0.070 16.611 -10.390 1.00 4.14 C ATOM 2128 CG ASP A 136 -0.145 17.362 -9.078 1.00 32.24 C ATOM 2129 OD1 ASP A 136 0.462 18.447 -8.969 1.00 71.42 O ATOM 2130 OD2 ASP A 136 -0.824 16.870 -8.148 1.00 43.24 O ATOM 0 H ASP A 136 -1.959 18.154 -11.064 1.00 34.11 H new ATOM 0 HA ASP A 136 0.886 18.108 -11.599 1.00 42.24 H new ATOM 0 HB2 ASP A 136 -0.929 15.944 -10.468 1.00 4.14 H new ATOM 0 HB3 ASP A 136 0.822 15.984 -10.391 1.00 4.14 H new ATOM 2135 N LEU A 137 -1.295 16.262 -13.243 1.00 61.21 N ATOM 2136 CA LEU A 137 -1.489 15.327 -14.346 1.00 51.41 C ATOM 2137 C LEU A 137 -1.518 16.037 -15.693 1.00 73.22 C ATOM 2138 O LEU A 137 -1.624 15.394 -16.737 1.00 65.12 O ATOM 2139 CB LEU A 137 -2.785 14.523 -14.134 1.00 3.02 C ATOM 2140 CG LEU A 137 -4.077 15.349 -14.008 1.00 12.20 C ATOM 2141 CD1 LEU A 137 -4.651 15.700 -15.375 1.00 64.32 C ATOM 2142 CD2 LEU A 137 -5.109 14.608 -13.176 1.00 21.21 C ATOM 0 H LEU A 137 -2.159 16.562 -12.792 1.00 61.21 H new ATOM 0 HA LEU A 137 -0.639 14.644 -14.357 1.00 51.41 H new ATOM 0 HB2 LEU A 137 -2.900 13.830 -14.968 1.00 3.02 H new ATOM 0 HB3 LEU A 137 -2.673 13.921 -13.232 1.00 3.02 H new ATOM 0 HG LEU A 137 -3.823 16.281 -13.502 1.00 12.20 H new ATOM 0 HD11 LEU A 137 -5.563 16.283 -15.248 1.00 64.32 H new ATOM 0 HD12 LEU A 137 -3.922 16.284 -15.937 1.00 64.32 H new ATOM 0 HD13 LEU A 137 -4.879 14.784 -15.920 1.00 64.32 H new ATOM 0 HD21 LEU A 137 -6.015 15.210 -13.099 1.00 21.21 H new ATOM 0 HD22 LEU A 137 -5.345 13.656 -13.652 1.00 21.21 H new ATOM 0 HD23 LEU A 137 -4.709 14.426 -12.178 1.00 21.21 H new ATOM 2154 N ASP A 138 -1.426 17.361 -15.667 1.00 11.24 N ATOM 2155 CA ASP A 138 -1.475 18.148 -16.889 1.00 61.04 C ATOM 2156 C ASP A 138 -0.359 17.711 -17.839 1.00 72.34 C ATOM 2157 O ASP A 138 0.785 17.492 -17.419 1.00 32.01 O ATOM 2158 CB ASP A 138 -1.359 19.642 -16.574 1.00 44.24 C ATOM 2159 CG ASP A 138 -1.854 20.524 -17.708 1.00 54.23 C ATOM 2160 OD1 ASP A 138 -1.622 20.182 -18.884 1.00 32.22 O ATOM 2161 OD2 ASP A 138 -2.488 21.562 -17.425 1.00 74.12 O ATOM 0 H ASP A 138 -1.317 17.910 -14.814 1.00 11.24 H new ATOM 0 HA ASP A 138 -2.436 17.978 -17.375 1.00 61.04 H new ATOM 0 HB2 ASP A 138 -1.930 19.864 -15.672 1.00 44.24 H new ATOM 0 HB3 ASP A 138 -0.318 19.884 -16.360 1.00 44.24 H new ATOM 2166 N GLU A 139 -0.705 17.599 -19.116 1.00 55.53 N ATOM 2167 CA GLU A 139 0.185 17.062 -20.140 1.00 23.33 C ATOM 2168 C GLU A 139 1.493 17.852 -20.240 1.00 11.14 C ATOM 2169 O GLU A 139 2.498 17.333 -20.722 1.00 3.44 O ATOM 2170 CB GLU A 139 -0.548 16.995 -21.487 1.00 45.52 C ATOM 2171 CG GLU A 139 -1.086 18.326 -21.982 1.00 73.44 C ATOM 2172 CD GLU A 139 -0.126 19.021 -22.916 1.00 21.25 C ATOM 2173 OE1 GLU A 139 0.138 18.481 -24.010 1.00 65.22 O ATOM 2174 OE2 GLU A 139 0.352 20.117 -22.573 1.00 24.14 O ATOM 0 H GLU A 139 -1.618 17.880 -19.473 1.00 55.53 H new ATOM 0 HA GLU A 139 0.466 16.050 -19.850 1.00 23.33 H new ATOM 0 HB2 GLU A 139 0.133 16.592 -22.237 1.00 45.52 H new ATOM 0 HB3 GLU A 139 -1.377 16.293 -21.400 1.00 45.52 H new ATOM 0 HG2 GLU A 139 -2.034 18.164 -22.494 1.00 73.44 H new ATOM 0 HG3 GLU A 139 -1.291 18.972 -21.129 1.00 73.44 H new ATOM 2181 N LYS A 140 1.473 19.104 -19.777 1.00 75.04 N ATOM 2182 CA LYS A 140 2.669 19.953 -19.756 1.00 32.45 C ATOM 2183 C LYS A 140 3.858 19.260 -19.075 1.00 10.45 C ATOM 2184 O LYS A 140 5.012 19.625 -19.308 1.00 54.53 O ATOM 2185 CB LYS A 140 2.356 21.296 -19.074 1.00 54.54 C ATOM 2186 CG LYS A 140 1.599 21.173 -17.756 1.00 4.42 C ATOM 2187 CD LYS A 140 2.519 20.895 -16.579 1.00 62.34 C ATOM 2188 CE LYS A 140 1.752 20.327 -15.395 1.00 62.23 C ATOM 2189 NZ LYS A 140 2.614 20.191 -14.196 1.00 54.22 N ATOM 0 H LYS A 140 0.636 19.556 -19.409 1.00 75.04 H new ATOM 0 HA LYS A 140 2.959 20.139 -20.790 1.00 32.45 H new ATOM 0 HB2 LYS A 140 3.292 21.824 -18.893 1.00 54.54 H new ATOM 0 HB3 LYS A 140 1.771 21.910 -19.759 1.00 54.54 H new ATOM 0 HG2 LYS A 140 1.046 22.094 -17.571 1.00 4.42 H new ATOM 0 HG3 LYS A 140 0.865 20.371 -17.836 1.00 4.42 H new ATOM 0 HD2 LYS A 140 3.296 20.193 -16.881 1.00 62.34 H new ATOM 0 HD3 LYS A 140 3.020 21.816 -16.281 1.00 62.34 H new ATOM 0 HE2 LYS A 140 0.907 20.976 -15.164 1.00 62.23 H new ATOM 0 HE3 LYS A 140 1.342 19.353 -15.661 1.00 62.23 H new ATOM 0 HZ1 LYS A 140 2.110 19.648 -13.466 1.00 54.22 H new ATOM 0 HZ2 LYS A 140 3.491 19.694 -14.453 1.00 54.22 H new ATOM 0 HZ3 LYS A 140 2.847 21.135 -13.827 1.00 54.22 H new ATOM 2203 N SER A 141 3.577 18.272 -18.230 1.00 11.34 N ATOM 2204 CA SER A 141 4.630 17.481 -17.605 1.00 40.12 C ATOM 2205 C SER A 141 4.559 16.021 -18.056 1.00 53.41 C ATOM 2206 O SER A 141 5.493 15.512 -18.673 1.00 21.34 O ATOM 2207 CB SER A 141 4.532 17.564 -16.079 1.00 61.21 C ATOM 2208 OG SER A 141 4.680 18.902 -15.628 1.00 12.44 O ATOM 0 H SER A 141 2.630 18.001 -17.963 1.00 11.34 H new ATOM 0 HA SER A 141 5.589 17.893 -17.919 1.00 40.12 H new ATOM 0 HB2 SER A 141 3.569 17.171 -15.752 1.00 61.21 H new ATOM 0 HB3 SER A 141 5.302 16.938 -15.628 1.00 61.21 H new ATOM 0 HG SER A 141 5.140 18.907 -14.763 1.00 12.44 H new ATOM 2214 N VAL A 142 3.428 15.374 -17.778 1.00 0.12 N ATOM 2215 CA VAL A 142 3.275 13.935 -18.006 1.00 10.45 C ATOM 2216 C VAL A 142 3.511 13.556 -19.471 1.00 43.30 C ATOM 2217 O VAL A 142 4.244 12.611 -19.763 1.00 1.32 O ATOM 2218 CB VAL A 142 1.875 13.446 -17.575 1.00 2.43 C ATOM 2219 CG1 VAL A 142 1.752 11.937 -17.738 1.00 10.44 C ATOM 2220 CG2 VAL A 142 1.582 13.859 -16.137 1.00 61.13 C ATOM 0 H VAL A 142 2.599 15.826 -17.392 1.00 0.12 H new ATOM 0 HA VAL A 142 4.034 13.446 -17.395 1.00 10.45 H new ATOM 0 HB VAL A 142 1.137 13.916 -18.224 1.00 2.43 H new ATOM 0 HG11 VAL A 142 0.757 11.617 -17.428 1.00 10.44 H new ATOM 0 HG12 VAL A 142 1.910 11.670 -18.783 1.00 10.44 H new ATOM 0 HG13 VAL A 142 2.501 11.442 -17.120 1.00 10.44 H new ATOM 0 HG21 VAL A 142 0.591 13.505 -15.852 1.00 61.13 H new ATOM 0 HG22 VAL A 142 2.328 13.422 -15.474 1.00 61.13 H new ATOM 0 HG23 VAL A 142 1.617 14.945 -16.056 1.00 61.13 H new ATOM 2230 N LYS A 143 2.904 14.312 -20.384 1.00 25.32 N ATOM 2231 CA LYS A 143 2.997 14.024 -21.817 1.00 22.32 C ATOM 2232 C LYS A 143 4.454 14.040 -22.278 1.00 55.02 C ATOM 2233 O LYS A 143 4.891 13.165 -23.024 1.00 61.20 O ATOM 2234 CB LYS A 143 2.152 15.044 -22.604 1.00 74.23 C ATOM 2235 CG LYS A 143 2.139 14.865 -24.123 1.00 35.14 C ATOM 2236 CD LYS A 143 3.357 15.492 -24.790 1.00 21.24 C ATOM 2237 CE LYS A 143 3.453 16.989 -24.525 1.00 13.43 C ATOM 2238 NZ LYS A 143 2.383 17.765 -25.212 1.00 5.51 N ATOM 0 H LYS A 143 2.340 15.131 -20.157 1.00 25.32 H new ATOM 0 HA LYS A 143 2.605 13.025 -22.008 1.00 22.32 H new ATOM 0 HB2 LYS A 143 1.125 14.993 -22.242 1.00 74.23 H new ATOM 0 HB3 LYS A 143 2.521 16.045 -22.378 1.00 74.23 H new ATOM 0 HG2 LYS A 143 2.104 13.802 -24.361 1.00 35.14 H new ATOM 0 HG3 LYS A 143 1.233 15.313 -24.532 1.00 35.14 H new ATOM 0 HD2 LYS A 143 4.260 15.002 -24.427 1.00 21.24 H new ATOM 0 HD3 LYS A 143 3.310 15.318 -25.865 1.00 21.24 H new ATOM 0 HE2 LYS A 143 3.394 17.168 -23.451 1.00 13.43 H new ATOM 0 HE3 LYS A 143 4.427 17.350 -24.855 1.00 13.43 H new ATOM 0 HZ1 LYS A 143 2.762 18.685 -25.516 1.00 5.51 H new ATOM 0 HZ2 LYS A 143 2.050 17.236 -26.043 1.00 5.51 H new ATOM 0 HZ3 LYS A 143 1.589 17.917 -24.557 1.00 5.51 H new ATOM 2252 N SER A 144 5.202 15.030 -21.819 1.00 64.43 N ATOM 2253 CA SER A 144 6.593 15.180 -22.211 1.00 2.24 C ATOM 2254 C SER A 144 7.478 14.161 -21.497 1.00 24.13 C ATOM 2255 O SER A 144 8.461 13.676 -22.060 1.00 21.23 O ATOM 2256 CB SER A 144 7.057 16.599 -21.902 1.00 65.43 C ATOM 2257 OG SER A 144 6.183 17.547 -22.492 1.00 42.31 O ATOM 0 H SER A 144 4.867 15.744 -21.172 1.00 64.43 H new ATOM 0 HA SER A 144 6.677 14.998 -23.282 1.00 2.24 H new ATOM 0 HB2 SER A 144 7.092 16.750 -20.823 1.00 65.43 H new ATOM 0 HB3 SER A 144 8.070 16.747 -22.277 1.00 65.43 H new ATOM 0 HG SER A 144 6.494 18.453 -22.283 1.00 42.31 H new ATOM 2263 N ASP A 145 7.109 13.828 -20.267 1.00 13.41 N ATOM 2264 CA ASP A 145 7.877 12.890 -19.456 1.00 24.33 C ATOM 2265 C ASP A 145 7.817 11.483 -20.043 1.00 5.54 C ATOM 2266 O ASP A 145 8.849 10.828 -20.212 1.00 14.22 O ATOM 2267 CB ASP A 145 7.359 12.892 -18.017 1.00 55.12 C ATOM 2268 CG ASP A 145 8.156 11.988 -17.100 1.00 70.15 C ATOM 2269 OD1 ASP A 145 9.395 12.154 -17.021 1.00 63.12 O ATOM 2270 OD2 ASP A 145 7.542 11.137 -16.426 1.00 25.42 O ATOM 0 H ASP A 145 6.277 14.196 -19.806 1.00 13.41 H new ATOM 0 HA ASP A 145 8.919 13.210 -19.456 1.00 24.33 H new ATOM 0 HB2 ASP A 145 7.386 13.910 -17.628 1.00 55.12 H new ATOM 0 HB3 ASP A 145 6.316 12.577 -18.012 1.00 55.12 H new ATOM 2275 N LEU A 146 6.613 11.027 -20.382 1.00 74.32 N ATOM 2276 CA LEU A 146 6.448 9.707 -20.981 1.00 4.34 C ATOM 2277 C LEU A 146 7.008 9.693 -22.403 1.00 14.51 C ATOM 2278 O LEU A 146 7.380 8.643 -22.926 1.00 14.03 O ATOM 2279 CB LEU A 146 4.971 9.266 -20.949 1.00 55.21 C ATOM 2280 CG LEU A 146 3.970 10.131 -21.729 1.00 62.20 C ATOM 2281 CD1 LEU A 146 3.919 9.727 -23.196 1.00 10.54 C ATOM 2282 CD2 LEU A 146 2.586 10.026 -21.105 1.00 52.41 C ATOM 0 H LEU A 146 5.745 11.547 -20.253 1.00 74.32 H new ATOM 0 HA LEU A 146 7.014 8.986 -20.391 1.00 4.34 H new ATOM 0 HB2 LEU A 146 4.913 8.248 -21.335 1.00 55.21 H new ATOM 0 HB3 LEU A 146 4.650 9.231 -19.908 1.00 55.21 H new ATOM 0 HG LEU A 146 4.306 11.167 -21.676 1.00 62.20 H new ATOM 0 HD11 LEU A 146 3.202 10.357 -23.722 1.00 10.54 H new ATOM 0 HD12 LEU A 146 4.906 9.850 -23.642 1.00 10.54 H new ATOM 0 HD13 LEU A 146 3.613 8.684 -23.276 1.00 10.54 H new ATOM 0 HD21 LEU A 146 1.886 10.644 -21.667 1.00 52.41 H new ATOM 0 HD22 LEU A 146 2.254 8.988 -21.128 1.00 52.41 H new ATOM 0 HD23 LEU A 146 2.626 10.371 -20.072 1.00 52.41 H new ATOM 2294 N MET A 147 7.079 10.870 -23.016 1.00 54.44 N ATOM 2295 CA MET A 147 7.673 11.011 -24.340 1.00 22.44 C ATOM 2296 C MET A 147 9.185 10.848 -24.236 1.00 35.51 C ATOM 2297 O MET A 147 9.819 10.204 -25.075 1.00 0.23 O ATOM 2298 CB MET A 147 7.308 12.377 -24.941 1.00 32.23 C ATOM 2299 CG MET A 147 7.700 12.557 -26.404 1.00 64.23 C ATOM 2300 SD MET A 147 9.463 12.857 -26.648 1.00 53.30 S ATOM 2301 CE MET A 147 9.681 14.385 -25.733 1.00 33.31 C ATOM 0 H MET A 147 6.732 11.742 -22.616 1.00 54.44 H new ATOM 0 HA MET A 147 7.281 10.237 -25.000 1.00 22.44 H new ATOM 0 HB2 MET A 147 6.232 12.524 -24.847 1.00 32.23 H new ATOM 0 HB3 MET A 147 7.789 13.158 -24.352 1.00 32.23 H new ATOM 0 HG2 MET A 147 7.411 11.666 -26.961 1.00 64.23 H new ATOM 0 HG3 MET A 147 7.137 13.391 -26.822 1.00 64.23 H new ATOM 0 HE1 MET A 147 10.355 15.044 -26.280 1.00 33.31 H new ATOM 0 HE2 MET A 147 8.716 14.876 -25.609 1.00 33.31 H new ATOM 0 HE3 MET A 147 10.105 14.165 -24.753 1.00 33.31 H new ATOM 2311 N SER A 148 9.751 11.425 -23.188 1.00 15.05 N ATOM 2312 CA SER A 148 11.169 11.296 -22.917 1.00 54.23 C ATOM 2313 C SER A 148 11.518 9.837 -22.636 1.00 10.22 C ATOM 2314 O SER A 148 12.368 9.250 -23.307 1.00 41.32 O ATOM 2315 CB SER A 148 11.552 12.183 -21.727 1.00 75.15 C ATOM 2316 OG SER A 148 12.943 12.134 -21.466 1.00 72.45 O ATOM 0 H SER A 148 9.243 11.991 -22.508 1.00 15.05 H new ATOM 0 HA SER A 148 11.734 11.622 -23.791 1.00 54.23 H new ATOM 0 HB2 SER A 148 11.255 13.212 -21.929 1.00 75.15 H new ATOM 0 HB3 SER A 148 11.004 11.861 -20.842 1.00 75.15 H new ATOM 0 HG SER A 148 13.153 12.712 -20.703 1.00 72.45 H new ATOM 2322 N ASN A 149 10.814 9.239 -21.682 1.00 50.53 N ATOM 2323 CA ASN A 149 11.096 7.871 -21.255 1.00 43.22 C ATOM 2324 C ASN A 149 10.557 6.828 -22.233 1.00 24.13 C ATOM 2325 O ASN A 149 10.472 5.646 -21.896 1.00 22.44 O ATOM 2326 CB ASN A 149 10.542 7.620 -19.852 1.00 54.53 C ATOM 2327 CG ASN A 149 11.521 8.022 -18.766 1.00 13.53 C ATOM 2328 OD1 ASN A 149 12.329 8.934 -18.944 1.00 1.21 O ATOM 2329 ND2 ASN A 149 11.465 7.339 -17.633 1.00 74.44 N ATOM 0 H ASN A 149 10.040 9.681 -21.187 1.00 50.53 H new ATOM 0 HA ASN A 149 12.181 7.764 -21.237 1.00 43.22 H new ATOM 0 HB2 ASN A 149 9.614 8.177 -19.725 1.00 54.53 H new ATOM 0 HB3 ASN A 149 10.297 6.563 -19.744 1.00 54.53 H new ATOM 0 HD21 ASN A 149 12.105 7.562 -16.871 1.00 74.44 H new ATOM 0 HD22 ASN A 149 10.782 6.590 -17.522 1.00 74.44 H new ATOM 2336 N GLN A 150 10.187 7.261 -23.438 1.00 3.23 N ATOM 2337 CA GLN A 150 9.831 6.331 -24.506 1.00 73.30 C ATOM 2338 C GLN A 150 10.977 5.355 -24.746 1.00 35.34 C ATOM 2339 O GLN A 150 10.769 4.145 -24.829 1.00 52.10 O ATOM 2340 CB GLN A 150 9.502 7.083 -25.797 1.00 72.21 C ATOM 2341 CG GLN A 150 8.057 7.550 -25.883 1.00 13.40 C ATOM 2342 CD GLN A 150 7.791 8.407 -27.106 1.00 72.10 C ATOM 2343 OE1 GLN A 150 6.788 9.264 -27.016 1.00 2.32 O flip ATOM 2344 NE2 GLN A 150 8.465 8.286 -28.128 1.00 4.33 N flip ATOM 0 H GLN A 150 10.126 8.246 -23.697 1.00 3.23 H new ATOM 0 HA GLN A 150 8.944 5.776 -24.199 1.00 73.30 H new ATOM 0 HB2 GLN A 150 10.159 7.948 -25.880 1.00 72.21 H new ATOM 0 HB3 GLN A 150 9.717 6.437 -26.648 1.00 72.21 H new ATOM 0 HG2 GLN A 150 7.399 6.681 -25.903 1.00 13.40 H new ATOM 0 HG3 GLN A 150 7.809 8.117 -24.986 1.00 13.40 H new ATOM 0 HE21 GLN A 150 9.231 7.613 -28.157 1.00 4.33 H new ATOM 0 HE22 GLN A 150 8.258 8.859 -28.946 1.00 4.33 H new ATOM 2353 N ARG A 151 12.186 5.895 -24.850 1.00 60.51 N ATOM 2354 CA ARG A 151 13.393 5.083 -24.918 1.00 63.52 C ATOM 2355 C ARG A 151 14.630 5.940 -24.647 1.00 13.44 C ATOM 2356 O ARG A 151 15.191 6.572 -25.540 1.00 22.40 O ATOM 2357 CB ARG A 151 13.494 4.308 -26.253 1.00 4.14 C ATOM 2358 CG ARG A 151 13.361 5.144 -27.523 1.00 10.54 C ATOM 2359 CD ARG A 151 14.718 5.518 -28.104 1.00 72.31 C ATOM 2360 NE ARG A 151 15.567 4.345 -28.322 1.00 33.40 N ATOM 2361 CZ ARG A 151 16.800 4.214 -27.827 1.00 43.25 C ATOM 2362 NH1 ARG A 151 17.300 5.136 -27.015 1.00 42.01 N ATOM 2363 NH2 ARG A 151 17.516 3.138 -28.121 1.00 0.20 N ATOM 0 H ARG A 151 12.356 6.900 -24.889 1.00 60.51 H new ATOM 0 HA ARG A 151 13.337 4.327 -24.135 1.00 63.52 H new ATOM 0 HB2 ARG A 151 14.454 3.793 -26.280 1.00 4.14 H new ATOM 0 HB3 ARG A 151 12.720 3.540 -26.264 1.00 4.14 H new ATOM 0 HG2 ARG A 151 12.790 4.587 -28.266 1.00 10.54 H new ATOM 0 HG3 ARG A 151 12.798 6.051 -27.303 1.00 10.54 H new ATOM 0 HD2 ARG A 151 14.575 6.042 -29.049 1.00 72.31 H new ATOM 0 HD3 ARG A 151 15.222 6.210 -27.429 1.00 72.31 H new ATOM 0 HE ARG A 151 15.194 3.582 -28.886 1.00 33.40 H new ATOM 0 HH11 ARG A 151 16.742 5.952 -26.765 1.00 42.01 H new ATOM 0 HH12 ARG A 151 18.243 5.029 -26.641 1.00 42.01 H new ATOM 0 HH21 ARG A 151 17.125 2.414 -28.723 1.00 0.20 H new ATOM 0 HH22 ARG A 151 18.458 3.034 -27.745 1.00 0.20 H new ATOM 2377 N ILE A 152 15.007 5.998 -23.383 1.00 2.01 N ATOM 2378 CA ILE A 152 16.195 6.717 -22.953 1.00 1.11 C ATOM 2379 C ILE A 152 16.854 5.955 -21.812 1.00 74.34 C ATOM 2380 O ILE A 152 17.910 5.332 -22.047 1.00 14.50 O ATOM 2381 CB ILE A 152 15.877 8.171 -22.509 1.00 51.50 C ATOM 2382 CG1 ILE A 152 15.562 9.052 -23.726 1.00 52.35 C ATOM 2383 CG2 ILE A 152 17.033 8.765 -21.715 1.00 32.31 C ATOM 2384 CD1 ILE A 152 15.312 10.506 -23.383 1.00 65.52 C ATOM 2385 OXT ILE A 152 16.282 5.936 -20.701 1.00 0.00 O ATOM 0 H ILE A 152 14.498 5.547 -22.623 1.00 2.01 H new ATOM 0 HA ILE A 152 16.873 6.785 -23.804 1.00 1.11 H new ATOM 0 HB ILE A 152 14.999 8.139 -21.864 1.00 51.50 H new ATOM 0 HG12 ILE A 152 16.392 8.992 -24.430 1.00 52.35 H new ATOM 0 HG13 ILE A 152 14.684 8.653 -24.234 1.00 52.35 H new ATOM 0 HG21 ILE A 152 16.784 9.783 -21.417 1.00 32.31 H new ATOM 0 HG22 ILE A 152 17.213 8.160 -20.826 1.00 32.31 H new ATOM 0 HG23 ILE A 152 17.931 8.777 -22.333 1.00 32.31 H new ATOM 0 HD11 ILE A 152 15.097 11.063 -24.295 1.00 65.52 H new ATOM 0 HD12 ILE A 152 14.462 10.579 -22.704 1.00 65.52 H new ATOM 0 HD13 ILE A 152 16.197 10.924 -22.903 1.00 65.52 H new TER 2397 ILE A 152