USER MOD reduce.3.24.130724 H: found=0, std=0, add=1340, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1333 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 131 GLN :FLIP amide:sc= -0.0476 F(o=-3.4,f=-2.5) USER MOD Set 1.2: A 158 GLN : amide:sc= -2.44 K(o=-2.5,f=-8.1!) USER MOD Set 2.1: A 106 ASN : amide:sc= 0.983 K(o=2.1,f=-3.5) USER MOD Set 2.2: A 114 LYS NZ :NH3+ -126:sc= 1.14 (180deg=0) USER MOD Set 3.1: A 71 SER OG : rot 180:sc= 0.00386 USER MOD Set 3.2: A 96 LYS NZ :NH3+ 148:sc= -0.0304 (180deg=-0.464) USER MOD Set 4.1: A 76 SER OG : rot 180:sc= 0.0309 USER MOD Set 4.2: A 110 LYS NZ :NH3+ -124:sc= -0.0671 (180deg=-2.61!) USER MOD Set 5.1: A 19 SER OG : rot 137:sc= 2.17 USER MOD Set 5.2: A 72 THR OG1 : rot -16:sc= 1.26 USER MOD Set 5.3: A 142 SER OG : rot 180:sc= -0.0976 USER MOD Set 6.1: A 7 SER OG : rot 103:sc= 0.944 USER MOD Set 6.2: A 10 GLN : amide:sc= -0.706 K(o=0.24,f=-4.4!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= -2.69 (180deg=-7.57!) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 64:sc= 0.364 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 151:sc= -2.21! (180deg=-2.68) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 87:sc= 0.35 USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.97 K(o=-2,f=-11!) USER MOD Single : A 48 LYS NZ :NH3+ 176:sc= -0.0619 (180deg=-0.066) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -0.531 K(o=-0.53,f=-2) USER MOD Single : A 53 SER OG : rot -170:sc= -2.22 USER MOD Single : A 55 HIS :FLIP no HD1:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 62:sc= -0.708 USER MOD Single : A 59 SER OG : rot 72:sc= 0.865 USER MOD Single : A 65 SER OG : rot -170:sc= -0.371 USER MOD Single : A 73 THR OG1 : rot -48:sc= -0.306! USER MOD Single : A 75 HIS : no HE2:sc= -1.08 K(o=-1.1,f=-3.2) USER MOD Single : A 92 CYS SG : rot 12:sc= 0.0185 USER MOD Single : A 101 THR OG1 : rot -70:sc= 0.627 USER MOD Single : A 105 ASN :FLIP amide:sc= -0.154 F(o=-0.73,f=-0.15) USER MOD Single : A 107 SER OG : rot 154:sc= -0.446 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot -88:sc= -0.17 USER MOD Single : A 113 SER OG : rot 180:sc= 0.0535 USER MOD Single : A 116 CYS SG : rot 69:sc= 0.929 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 79:sc= 0.0267 USER MOD Single : A 122 SER OG : rot -71:sc= 1.3 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 THR OG1 : rot -169:sc= -1.15 USER MOD Single : A 141 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 146 HIS :FLIP no HE2:sc= -0.358 F(o=-1.3,f=-0.36) USER MOD Single : A 149 HIS : no HE2:sc= -6.15! C(o=-6.1!,f=-8.3!) USER MOD Single : A 151 SER OG : rot 137:sc= 0.00434 USER MOD Single : A 153 ASN :FLIP amide:sc= -2.27! C(o=-2.9!,f=-2.3!) USER MOD Single : A 160 THR OG1 : rot 62:sc= 0.922 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 LYS NZ :NH3+ -145:sc= 0.00157 (180deg=0) USER MOD Single : A 165 ASN : amide:sc= -2.18 K(o=-2.2,f=-4.1!) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 171 SER OG : rot 180:sc= -0.518 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.433 -0.782 -4.991 1.00 2.78 N ATOM 2 CA MET A 1 -15.578 0.262 -3.983 1.00 1.14 C ATOM 3 C MET A 1 -14.954 1.569 -4.460 1.00 1.00 C ATOM 4 O MET A 1 -13.949 1.565 -5.172 1.00 0.97 O ATOM 5 CB MET A 1 -14.930 -0.175 -2.667 1.00 3.49 C ATOM 6 CG MET A 1 -15.886 -0.160 -1.485 1.00 4.96 C ATOM 7 SD MET A 1 -15.355 0.965 -0.179 1.00 7.35 S ATOM 8 CE MET A 1 -16.932 1.427 0.532 1.00 8.12 C ATOM 0 H1 MET A 1 -16.347 -1.257 -5.133 1.00 2.78 H new ATOM 0 H2 MET A 1 -15.120 -0.358 -5.888 1.00 2.78 H new ATOM 0 H3 MET A 1 -14.728 -1.477 -4.672 1.00 2.78 H new ATOM 0 HA MET A 1 -16.643 0.427 -3.818 1.00 1.14 H new ATOM 0 HB2 MET A 1 -14.528 -1.181 -2.786 1.00 3.49 H new ATOM 0 HB3 MET A 1 -14.087 0.482 -2.451 1.00 3.49 H new ATOM 0 HG2 MET A 1 -16.879 0.131 -1.829 1.00 4.96 H new ATOM 0 HG3 MET A 1 -15.972 -1.168 -1.079 1.00 4.96 H new ATOM 0 HE1 MET A 1 -16.770 2.122 1.356 1.00 8.12 H new ATOM 0 HE2 MET A 1 -17.549 1.904 -0.230 1.00 8.12 H new ATOM 0 HE3 MET A 1 -17.439 0.536 0.904 1.00 8.12 H new ATOM 17 N ALA A 2 -15.555 2.686 -4.064 1.00 0.99 N ATOM 18 CA ALA A 2 -15.056 4.000 -4.452 1.00 0.94 C ATOM 19 C ALA A 2 -13.875 4.417 -3.582 1.00 0.69 C ATOM 20 O ALA A 2 -13.161 5.368 -3.902 1.00 0.66 O ATOM 21 CB ALA A 2 -16.170 5.035 -4.364 1.00 1.04 C ATOM 0 H ALA A 2 -16.388 2.708 -3.475 1.00 0.99 H new ATOM 0 HA ALA A 2 -14.711 3.940 -5.484 1.00 0.94 H new ATOM 0 HB1 ALA A 2 -15.783 6.011 -4.656 1.00 1.04 H new ATOM 0 HB2 ALA A 2 -16.983 4.752 -5.032 1.00 1.04 H new ATOM 0 HB3 ALA A 2 -16.541 5.084 -3.340 1.00 1.04 H new ATOM 27 N ASP A 3 -13.675 3.700 -2.482 1.00 0.58 N ATOM 28 CA ASP A 3 -12.579 3.996 -1.566 1.00 0.40 C ATOM 29 C ASP A 3 -11.237 3.953 -2.291 1.00 0.33 C ATOM 30 O ASP A 3 -10.355 4.774 -2.037 1.00 0.41 O ATOM 31 CB ASP A 3 -12.576 3.003 -0.403 1.00 0.43 C ATOM 32 CG ASP A 3 -11.469 3.282 0.594 1.00 1.69 C ATOM 33 OD1 ASP A 3 -10.825 4.345 0.483 1.00 2.88 O ATOM 34 OD2 ASP A 3 -11.246 2.435 1.486 1.00 2.83 O ATOM 0 H ASP A 3 -14.257 2.910 -2.203 1.00 0.58 H new ATOM 0 HA ASP A 3 -12.728 5.002 -1.174 1.00 0.40 H new ATOM 0 HB2 ASP A 3 -13.539 3.042 0.107 1.00 0.43 H new ATOM 0 HB3 ASP A 3 -12.463 1.991 -0.793 1.00 0.43 H new ATOM 39 N PHE A 4 -11.091 2.991 -3.195 1.00 0.24 N ATOM 40 CA PHE A 4 -9.856 2.839 -3.956 1.00 0.23 C ATOM 41 C PHE A 4 -10.129 2.917 -5.455 1.00 0.23 C ATOM 42 O PHE A 4 -9.288 2.540 -6.271 1.00 0.37 O ATOM 43 CB PHE A 4 -9.183 1.506 -3.618 1.00 0.20 C ATOM 44 CG PHE A 4 -9.185 1.190 -2.149 1.00 0.21 C ATOM 45 CD1 PHE A 4 -8.682 2.099 -1.231 1.00 1.92 C ATOM 46 CD2 PHE A 4 -9.690 -0.014 -1.688 1.00 1.96 C ATOM 47 CE1 PHE A 4 -8.683 1.809 0.121 1.00 1.89 C ATOM 48 CE2 PHE A 4 -9.694 -0.308 -0.336 1.00 2.01 C ATOM 49 CZ PHE A 4 -9.191 0.605 0.568 1.00 0.28 C ATOM 0 H PHE A 4 -11.812 2.305 -3.419 1.00 0.24 H new ATOM 0 HA PHE A 4 -9.187 3.655 -3.682 1.00 0.23 H new ATOM 0 HB2 PHE A 4 -9.691 0.705 -4.155 1.00 0.20 H new ATOM 0 HB3 PHE A 4 -8.154 1.527 -3.976 1.00 0.20 H new ATOM 0 HD1 PHE A 4 -8.286 3.043 -1.575 1.00 1.92 H new ATOM 0 HD2 PHE A 4 -10.085 -0.732 -2.392 1.00 1.96 H new ATOM 0 HE1 PHE A 4 -8.287 2.524 0.827 1.00 1.89 H new ATOM 0 HE2 PHE A 4 -10.090 -1.251 0.011 1.00 2.01 H new ATOM 0 HZ PHE A 4 -9.195 0.378 1.624 1.00 0.28 H new ATOM 59 N GLY A 5 -11.310 3.408 -5.812 1.00 0.23 N ATOM 60 CA GLY A 5 -11.674 3.527 -7.212 1.00 0.24 C ATOM 61 C GLY A 5 -11.694 2.188 -7.921 1.00 0.20 C ATOM 62 O GLY A 5 -11.243 2.076 -9.061 1.00 0.23 O ATOM 0 H GLY A 5 -12.023 3.726 -5.156 1.00 0.23 H new ATOM 0 HA2 GLY A 5 -12.657 3.991 -7.290 1.00 0.24 H new ATOM 0 HA3 GLY A 5 -10.968 4.189 -7.713 1.00 0.24 H new ATOM 66 N ILE A 6 -12.217 1.170 -7.245 1.00 0.17 N ATOM 67 CA ILE A 6 -12.293 -0.169 -7.818 1.00 0.18 C ATOM 68 C ILE A 6 -13.524 -0.317 -8.704 1.00 0.19 C ATOM 69 O ILE A 6 -14.494 0.429 -8.569 1.00 0.23 O ATOM 70 CB ILE A 6 -12.329 -1.248 -6.721 1.00 0.23 C ATOM 71 CG1 ILE A 6 -11.339 -0.907 -5.604 1.00 0.27 C ATOM 72 CG2 ILE A 6 -12.018 -2.615 -7.313 1.00 0.28 C ATOM 73 CD1 ILE A 6 -12.001 -0.399 -4.343 1.00 0.33 C ATOM 0 H ILE A 6 -12.594 1.247 -6.300 1.00 0.17 H new ATOM 0 HA ILE A 6 -11.396 -0.307 -8.422 1.00 0.18 H new ATOM 0 HB ILE A 6 -13.332 -1.277 -6.294 1.00 0.23 H new ATOM 0 HG12 ILE A 6 -10.754 -1.795 -5.365 1.00 0.27 H new ATOM 0 HG13 ILE A 6 -10.640 -0.153 -5.967 1.00 0.27 H new ATOM 0 HG21 ILE A 6 -12.047 -3.368 -6.525 1.00 0.28 H new ATOM 0 HG22 ILE A 6 -12.758 -2.858 -8.075 1.00 0.28 H new ATOM 0 HG23 ILE A 6 -11.025 -2.599 -7.763 1.00 0.28 H new ATOM 0 HD11 ILE A 6 -11.239 -0.178 -3.596 1.00 0.33 H new ATOM 0 HD12 ILE A 6 -12.563 0.507 -4.567 1.00 0.33 H new ATOM 0 HD13 ILE A 6 -12.679 -1.160 -3.956 1.00 0.33 H new ATOM 85 N SER A 7 -13.479 -1.289 -9.611 1.00 0.23 N ATOM 86 CA SER A 7 -14.591 -1.536 -10.522 1.00 0.26 C ATOM 87 C SER A 7 -14.684 -3.017 -10.877 1.00 0.23 C ATOM 88 O SER A 7 -13.747 -3.781 -10.649 1.00 0.21 O ATOM 89 CB SER A 7 -14.428 -0.703 -11.795 1.00 0.34 C ATOM 90 OG SER A 7 -13.612 0.431 -11.563 1.00 1.35 O ATOM 0 H SER A 7 -12.685 -1.917 -9.734 1.00 0.23 H new ATOM 0 HA SER A 7 -15.513 -1.243 -10.020 1.00 0.26 H new ATOM 0 HB2 SER A 7 -13.988 -1.317 -12.581 1.00 0.34 H new ATOM 0 HB3 SER A 7 -15.407 -0.383 -12.152 1.00 0.34 H new ATOM 0 HG SER A 7 -12.715 0.268 -11.924 1.00 1.35 H new ATOM 96 N ALA A 8 -15.822 -3.414 -11.437 1.00 0.23 N ATOM 97 CA ALA A 8 -16.038 -4.803 -11.824 1.00 0.22 C ATOM 98 C ALA A 8 -15.569 -5.052 -13.255 1.00 0.19 C ATOM 99 O ALA A 8 -15.936 -4.322 -14.175 1.00 0.20 O ATOM 100 CB ALA A 8 -17.507 -5.169 -11.678 1.00 0.27 C ATOM 0 H ALA A 8 -16.608 -2.794 -11.633 1.00 0.23 H new ATOM 0 HA ALA A 8 -15.449 -5.436 -11.160 1.00 0.22 H new ATOM 0 HB1 ALA A 8 -17.654 -6.209 -11.970 1.00 0.27 H new ATOM 0 HB2 ALA A 8 -17.813 -5.037 -10.640 1.00 0.27 H new ATOM 0 HB3 ALA A 8 -18.108 -4.524 -12.319 1.00 0.27 H new ATOM 106 N GLY A 9 -14.755 -6.087 -13.433 1.00 0.20 N ATOM 107 CA GLY A 9 -14.248 -6.412 -14.754 1.00 0.20 C ATOM 108 C GLY A 9 -12.749 -6.219 -14.864 1.00 0.19 C ATOM 109 O GLY A 9 -12.146 -6.563 -15.881 1.00 0.25 O ATOM 0 H GLY A 9 -14.437 -6.706 -12.687 1.00 0.20 H new ATOM 0 HA2 GLY A 9 -14.496 -7.447 -14.990 1.00 0.20 H new ATOM 0 HA3 GLY A 9 -14.747 -5.787 -15.495 1.00 0.20 H new ATOM 113 N GLN A 10 -12.147 -5.667 -13.816 1.00 0.19 N ATOM 114 CA GLN A 10 -10.708 -5.425 -13.803 1.00 0.18 C ATOM 115 C GLN A 10 -10.018 -6.309 -12.768 1.00 0.17 C ATOM 116 O GLN A 10 -10.674 -6.929 -11.930 1.00 0.21 O ATOM 117 CB GLN A 10 -10.420 -3.952 -13.505 1.00 0.25 C ATOM 118 CG GLN A 10 -11.347 -3.349 -12.462 1.00 0.33 C ATOM 119 CD GLN A 10 -11.057 -1.884 -12.201 1.00 0.82 C ATOM 120 OE1 GLN A 10 -11.713 -1.002 -12.755 1.00 1.15 O ATOM 121 NE2 GLN A 10 -10.069 -1.616 -11.355 1.00 1.16 N ATOM 0 H GLN A 10 -12.632 -5.379 -12.966 1.00 0.19 H new ATOM 0 HA GLN A 10 -10.314 -5.673 -14.788 1.00 0.18 H new ATOM 0 HB2 GLN A 10 -9.390 -3.854 -13.163 1.00 0.25 H new ATOM 0 HB3 GLN A 10 -10.505 -3.380 -14.429 1.00 0.25 H new ATOM 0 HG2 GLN A 10 -12.380 -3.458 -12.793 1.00 0.33 H new ATOM 0 HG3 GLN A 10 -11.251 -3.906 -11.530 1.00 0.33 H new ATOM 0 HE21 GLN A 10 -9.551 -2.378 -10.918 1.00 1.16 H new ATOM 0 HE22 GLN A 10 -9.828 -0.648 -11.142 1.00 1.16 H new ATOM 130 N PHE A 11 -8.694 -6.362 -12.833 1.00 0.15 N ATOM 131 CA PHE A 11 -7.914 -7.172 -11.903 1.00 0.16 C ATOM 132 C PHE A 11 -7.354 -6.314 -10.770 1.00 0.20 C ATOM 133 O PHE A 11 -6.870 -5.206 -10.998 1.00 0.56 O ATOM 134 CB PHE A 11 -6.771 -7.874 -12.638 1.00 0.21 C ATOM 135 CG PHE A 11 -7.183 -9.153 -13.306 1.00 0.23 C ATOM 136 CD1 PHE A 11 -8.383 -9.236 -13.994 1.00 1.24 C ATOM 137 CD2 PHE A 11 -6.372 -10.275 -13.246 1.00 1.32 C ATOM 138 CE1 PHE A 11 -8.767 -10.412 -14.610 1.00 1.23 C ATOM 139 CE2 PHE A 11 -6.750 -11.454 -13.860 1.00 1.35 C ATOM 140 CZ PHE A 11 -7.949 -11.524 -14.543 1.00 0.32 C ATOM 0 H PHE A 11 -8.137 -5.854 -13.520 1.00 0.15 H new ATOM 0 HA PHE A 11 -8.576 -7.924 -11.473 1.00 0.16 H new ATOM 0 HB2 PHE A 11 -6.363 -7.197 -13.388 1.00 0.21 H new ATOM 0 HB3 PHE A 11 -5.970 -8.085 -11.930 1.00 0.21 H new ATOM 0 HD1 PHE A 11 -9.027 -8.370 -14.050 1.00 1.24 H new ATOM 0 HD2 PHE A 11 -5.434 -10.228 -12.713 1.00 1.32 H new ATOM 0 HE1 PHE A 11 -9.705 -10.462 -15.143 1.00 1.23 H new ATOM 0 HE2 PHE A 11 -6.108 -12.321 -13.806 1.00 1.35 H new ATOM 0 HZ PHE A 11 -8.246 -12.445 -15.023 1.00 0.32 H new ATOM 150 N VAL A 12 -7.427 -6.835 -9.550 1.00 0.23 N ATOM 151 CA VAL A 12 -6.929 -6.119 -8.383 1.00 0.21 C ATOM 152 C VAL A 12 -6.235 -7.068 -7.411 1.00 0.23 C ATOM 153 O VAL A 12 -6.756 -8.135 -7.091 1.00 0.31 O ATOM 154 CB VAL A 12 -8.067 -5.387 -7.645 1.00 0.22 C ATOM 155 CG1 VAL A 12 -7.515 -4.583 -6.478 1.00 1.86 C ATOM 156 CG2 VAL A 12 -8.835 -4.492 -8.605 1.00 1.86 C ATOM 0 H VAL A 12 -7.826 -7.751 -9.344 1.00 0.23 H new ATOM 0 HA VAL A 12 -6.210 -5.384 -8.745 1.00 0.21 H new ATOM 0 HB VAL A 12 -8.758 -6.131 -7.248 1.00 0.22 H new ATOM 0 HG11 VAL A 12 -8.333 -4.073 -5.969 1.00 1.86 H new ATOM 0 HG12 VAL A 12 -7.014 -5.253 -5.779 1.00 1.86 H new ATOM 0 HG13 VAL A 12 -6.802 -3.846 -6.849 1.00 1.86 H new ATOM 0 HG21 VAL A 12 -9.635 -3.983 -8.067 1.00 1.86 H new ATOM 0 HG22 VAL A 12 -8.158 -3.753 -9.034 1.00 1.86 H new ATOM 0 HG23 VAL A 12 -9.263 -5.098 -9.403 1.00 1.86 H new ATOM 166 N ALA A 13 -5.056 -6.669 -6.944 1.00 0.19 N ATOM 167 CA ALA A 13 -4.293 -7.483 -6.007 1.00 0.21 C ATOM 168 C ALA A 13 -4.260 -6.841 -4.622 1.00 0.20 C ATOM 169 O ALA A 13 -3.811 -5.706 -4.464 1.00 0.26 O ATOM 170 CB ALA A 13 -2.876 -7.695 -6.524 1.00 0.22 C ATOM 0 H ALA A 13 -4.610 -5.788 -7.199 1.00 0.19 H new ATOM 0 HA ALA A 13 -4.786 -8.451 -5.920 1.00 0.21 H new ATOM 0 HB1 ALA A 13 -2.317 -8.305 -5.814 1.00 0.22 H new ATOM 0 HB2 ALA A 13 -2.913 -8.202 -7.488 1.00 0.22 H new ATOM 0 HB3 ALA A 13 -2.383 -6.730 -6.640 1.00 0.22 H new ATOM 176 N VAL A 14 -4.741 -7.576 -3.625 1.00 0.16 N ATOM 177 CA VAL A 14 -4.768 -7.080 -2.254 1.00 0.14 C ATOM 178 C VAL A 14 -3.534 -7.535 -1.482 1.00 0.15 C ATOM 179 O VAL A 14 -3.313 -8.732 -1.295 1.00 0.17 O ATOM 180 CB VAL A 14 -6.031 -7.553 -1.511 1.00 0.15 C ATOM 181 CG1 VAL A 14 -6.017 -7.062 -0.071 1.00 0.16 C ATOM 182 CG2 VAL A 14 -7.282 -7.077 -2.232 1.00 0.16 C ATOM 0 H VAL A 14 -5.117 -8.517 -3.741 1.00 0.16 H new ATOM 0 HA VAL A 14 -4.777 -5.991 -2.310 1.00 0.14 H new ATOM 0 HB VAL A 14 -6.039 -8.643 -1.499 1.00 0.15 H new ATOM 0 HG11 VAL A 14 -6.917 -7.405 0.439 1.00 0.16 H new ATOM 0 HG12 VAL A 14 -5.138 -7.456 0.439 1.00 0.16 H new ATOM 0 HG13 VAL A 14 -5.986 -5.973 -0.058 1.00 0.16 H new ATOM 0 HG21 VAL A 14 -8.165 -7.420 -1.693 1.00 0.16 H new ATOM 0 HG22 VAL A 14 -7.284 -5.988 -2.276 1.00 0.16 H new ATOM 0 HG23 VAL A 14 -7.295 -7.481 -3.244 1.00 0.16 H new ATOM 192 N VAL A 15 -2.734 -6.572 -1.033 1.00 0.14 N ATOM 193 CA VAL A 15 -1.524 -6.874 -0.278 1.00 0.14 C ATOM 194 C VAL A 15 -1.732 -6.632 1.213 1.00 0.14 C ATOM 195 O VAL A 15 -1.923 -5.496 1.647 1.00 0.20 O ATOM 196 CB VAL A 15 -0.334 -6.025 -0.763 1.00 0.15 C ATOM 197 CG1 VAL A 15 0.957 -6.495 -0.110 1.00 0.18 C ATOM 198 CG2 VAL A 15 -0.225 -6.080 -2.279 1.00 0.18 C ATOM 0 H VAL A 15 -2.903 -5.577 -1.179 1.00 0.14 H new ATOM 0 HA VAL A 15 -1.301 -7.928 -0.445 1.00 0.14 H new ATOM 0 HB VAL A 15 -0.505 -4.989 -0.471 1.00 0.15 H new ATOM 0 HG11 VAL A 15 1.787 -5.884 -0.464 1.00 0.18 H new ATOM 0 HG12 VAL A 15 0.873 -6.400 0.973 1.00 0.18 H new ATOM 0 HG13 VAL A 15 1.137 -7.538 -0.370 1.00 0.18 H new ATOM 0 HG21 VAL A 15 0.621 -5.475 -2.605 1.00 0.18 H new ATOM 0 HG22 VAL A 15 -0.076 -7.112 -2.596 1.00 0.18 H new ATOM 0 HG23 VAL A 15 -1.141 -5.692 -2.724 1.00 0.18 H new ATOM 208 N TRP A 16 -1.696 -7.707 1.992 1.00 0.10 N ATOM 209 CA TRP A 16 -1.879 -7.612 3.435 1.00 0.10 C ATOM 210 C TRP A 16 -0.598 -7.982 4.174 1.00 0.13 C ATOM 211 O TRP A 16 0.336 -8.525 3.583 1.00 0.14 O ATOM 212 CB TRP A 16 -3.023 -8.523 3.886 1.00 0.10 C ATOM 213 CG TRP A 16 -2.725 -9.982 3.707 1.00 0.11 C ATOM 214 CD1 TRP A 16 -2.613 -10.654 2.524 1.00 0.10 C ATOM 215 CD2 TRP A 16 -2.505 -10.945 4.743 1.00 0.13 C ATOM 216 NE1 TRP A 16 -2.337 -11.979 2.763 1.00 0.12 N ATOM 217 CE2 TRP A 16 -2.265 -12.183 4.115 1.00 0.14 C ATOM 218 CE3 TRP A 16 -2.486 -10.881 6.139 1.00 0.16 C ATOM 219 CZ2 TRP A 16 -2.009 -13.345 4.837 1.00 0.18 C ATOM 220 CZ3 TRP A 16 -2.232 -12.037 6.854 1.00 0.20 C ATOM 221 CH2 TRP A 16 -1.996 -13.255 6.202 1.00 0.20 C ATOM 0 H TRP A 16 -1.542 -8.655 1.648 1.00 0.10 H new ATOM 0 HA TRP A 16 -2.129 -6.579 3.676 1.00 0.10 H new ATOM 0 HB2 TRP A 16 -3.240 -8.330 4.937 1.00 0.10 H new ATOM 0 HB3 TRP A 16 -3.922 -8.271 3.324 1.00 0.10 H new ATOM 0 HD1 TRP A 16 -2.725 -10.210 1.546 1.00 0.10 H new ATOM 0 HE1 TRP A 16 -2.207 -12.695 2.048 1.00 0.12 H new ATOM 0 HE3 TRP A 16 -2.666 -9.947 6.650 1.00 0.16 H new ATOM 0 HZ2 TRP A 16 -1.827 -14.285 4.337 1.00 0.18 H new ATOM 0 HZ3 TRP A 16 -2.215 -12.001 7.933 1.00 0.20 H new ATOM 0 HH2 TRP A 16 -1.800 -14.140 6.789 1.00 0.20 H new ATOM 232 N ASP A 17 -0.558 -7.683 5.467 1.00 0.15 N ATOM 233 CA ASP A 17 0.610 -7.986 6.286 1.00 0.18 C ATOM 234 C ASP A 17 0.203 -8.288 7.725 1.00 0.17 C ATOM 235 O ASP A 17 -0.982 -8.447 8.025 1.00 0.15 O ATOM 236 CB ASP A 17 1.596 -6.816 6.258 1.00 0.21 C ATOM 237 CG ASP A 17 1.041 -5.574 6.928 1.00 0.60 C ATOM 238 OD1 ASP A 17 0.093 -4.976 6.376 1.00 1.78 O ATOM 239 OD2 ASP A 17 1.554 -5.200 8.004 1.00 1.58 O ATOM 0 H ASP A 17 -1.321 -7.231 5.971 1.00 0.15 H new ATOM 0 HA ASP A 17 1.094 -8.870 5.871 1.00 0.18 H new ATOM 0 HB2 ASP A 17 2.520 -7.111 6.755 1.00 0.21 H new ATOM 0 HB3 ASP A 17 1.851 -6.584 5.224 1.00 0.21 H new ATOM 244 N LYS A 18 1.190 -8.370 8.610 1.00 0.20 N ATOM 245 CA LYS A 18 0.935 -8.653 10.017 1.00 0.20 C ATOM 246 C LYS A 18 0.006 -7.607 10.624 1.00 0.20 C ATOM 247 O LYS A 18 -0.827 -7.920 11.475 1.00 0.22 O ATOM 248 CB LYS A 18 2.252 -8.695 10.797 1.00 0.23 C ATOM 249 CG LYS A 18 2.206 -9.598 12.017 1.00 1.14 C ATOM 250 CD LYS A 18 3.589 -10.112 12.382 1.00 1.37 C ATOM 251 CE LYS A 18 3.588 -10.806 13.735 1.00 2.69 C ATOM 252 NZ LYS A 18 2.949 -12.150 13.670 1.00 3.64 N ATOM 0 H LYS A 18 2.175 -8.244 8.377 1.00 0.20 H new ATOM 0 HA LYS A 18 0.449 -9.626 10.083 1.00 0.20 H new ATOM 0 HB2 LYS A 18 3.047 -9.035 10.133 1.00 0.23 H new ATOM 0 HB3 LYS A 18 2.510 -7.684 11.113 1.00 0.23 H new ATOM 0 HG2 LYS A 18 1.786 -9.050 12.861 1.00 1.14 H new ATOM 0 HG3 LYS A 18 1.543 -10.441 11.822 1.00 1.14 H new ATOM 0 HD2 LYS A 18 3.934 -10.807 11.616 1.00 1.37 H new ATOM 0 HD3 LYS A 18 4.294 -9.281 12.399 1.00 1.37 H new ATOM 0 HE2 LYS A 18 4.613 -10.908 14.091 1.00 2.69 H new ATOM 0 HE3 LYS A 18 3.059 -10.187 14.460 1.00 2.69 H new ATOM 0 HZ1 LYS A 18 2.969 -12.590 14.612 1.00 3.64 H new ATOM 0 HZ2 LYS A 18 1.963 -12.051 13.355 1.00 3.64 H new ATOM 0 HZ3 LYS A 18 3.469 -12.749 12.998 1.00 3.64 H new ATOM 266 N SER A 19 0.153 -6.362 10.180 1.00 0.20 N ATOM 267 CA SER A 19 -0.672 -5.269 10.680 1.00 0.21 C ATOM 268 C SER A 19 -2.087 -5.354 10.119 1.00 0.19 C ATOM 269 O SER A 19 -2.977 -4.612 10.532 1.00 0.20 O ATOM 270 CB SER A 19 -0.047 -3.921 10.315 1.00 0.24 C ATOM 271 OG SER A 19 1.304 -3.854 10.741 1.00 1.45 O ATOM 0 H SER A 19 0.836 -6.086 9.475 1.00 0.20 H new ATOM 0 HA SER A 19 -0.725 -5.355 11.765 1.00 0.21 H new ATOM 0 HB2 SER A 19 -0.100 -3.772 9.236 1.00 0.24 H new ATOM 0 HB3 SER A 19 -0.618 -3.115 10.776 1.00 0.24 H new ATOM 0 HG SER A 19 1.851 -3.456 10.032 1.00 1.45 H new ATOM 277 N SER A 20 -2.288 -6.267 9.173 1.00 0.17 N ATOM 278 CA SER A 20 -3.594 -6.449 8.550 1.00 0.15 C ATOM 279 C SER A 20 -4.248 -7.743 9.028 1.00 0.16 C ATOM 280 O SER A 20 -4.026 -8.821 8.475 1.00 0.16 O ATOM 281 CB SER A 20 -3.458 -6.464 7.027 1.00 0.12 C ATOM 282 OG SER A 20 -2.499 -5.516 6.591 1.00 0.12 O ATOM 0 H SER A 20 -1.563 -6.892 8.821 1.00 0.17 H new ATOM 0 HA SER A 20 -4.229 -5.612 8.842 1.00 0.15 H new ATOM 0 HB2 SER A 20 -3.166 -7.460 6.695 1.00 0.12 H new ATOM 0 HB3 SER A 20 -4.423 -6.246 6.570 1.00 0.12 H new ATOM 0 HG SER A 20 -1.616 -5.761 6.937 1.00 0.12 H new ATOM 288 N PRO A 21 -5.072 -7.636 10.079 1.00 0.18 N ATOM 289 CA PRO A 21 -5.777 -8.786 10.654 1.00 0.19 C ATOM 290 C PRO A 21 -6.865 -9.320 9.729 1.00 0.18 C ATOM 291 O PRO A 21 -7.545 -8.554 9.047 1.00 0.16 O ATOM 292 CB PRO A 21 -6.394 -8.219 11.935 1.00 0.22 C ATOM 293 CG PRO A 21 -6.538 -6.760 11.675 1.00 0.22 C ATOM 294 CD PRO A 21 -5.384 -6.382 10.788 1.00 0.20 C ATOM 0 HA PRO A 21 -5.109 -9.631 10.824 1.00 0.19 H new ATOM 0 HB2 PRO A 21 -7.359 -8.680 12.147 1.00 0.22 H new ATOM 0 HB3 PRO A 21 -5.755 -8.406 12.798 1.00 0.22 H new ATOM 0 HG2 PRO A 21 -7.490 -6.542 11.191 1.00 0.22 H new ATOM 0 HG3 PRO A 21 -6.517 -6.194 12.606 1.00 0.22 H new ATOM 0 HD2 PRO A 21 -5.654 -5.585 10.095 1.00 0.20 H new ATOM 0 HD3 PRO A 21 -4.532 -6.025 11.367 1.00 0.20 H new ATOM 302 N VAL A 22 -7.025 -10.640 9.712 1.00 0.19 N ATOM 303 CA VAL A 22 -8.033 -11.277 8.872 1.00 0.18 C ATOM 304 C VAL A 22 -9.389 -10.601 9.034 1.00 0.19 C ATOM 305 O VAL A 22 -10.175 -10.531 8.088 1.00 0.18 O ATOM 306 CB VAL A 22 -8.174 -12.774 9.204 1.00 0.21 C ATOM 307 CG1 VAL A 22 -9.297 -13.398 8.389 1.00 0.21 C ATOM 308 CG2 VAL A 22 -6.860 -13.500 8.958 1.00 0.22 C ATOM 0 H VAL A 22 -6.470 -11.289 10.270 1.00 0.19 H new ATOM 0 HA VAL A 22 -7.699 -11.171 7.840 1.00 0.18 H new ATOM 0 HB VAL A 22 -8.425 -12.872 10.260 1.00 0.21 H new ATOM 0 HG11 VAL A 22 -9.382 -14.456 8.637 1.00 0.21 H new ATOM 0 HG12 VAL A 22 -10.236 -12.895 8.619 1.00 0.21 H new ATOM 0 HG13 VAL A 22 -9.079 -13.291 7.327 1.00 0.21 H new ATOM 0 HG21 VAL A 22 -6.978 -14.557 9.198 1.00 0.22 H new ATOM 0 HG22 VAL A 22 -6.577 -13.395 7.911 1.00 0.22 H new ATOM 0 HG23 VAL A 22 -6.083 -13.069 9.589 1.00 0.22 H new ATOM 318 N GLU A 23 -9.659 -10.107 10.239 1.00 0.21 N ATOM 319 CA GLU A 23 -10.923 -9.437 10.523 1.00 0.23 C ATOM 320 C GLU A 23 -11.211 -8.356 9.485 1.00 0.22 C ATOM 321 O GLU A 23 -12.281 -8.334 8.878 1.00 0.23 O ATOM 322 CB GLU A 23 -10.893 -8.820 11.923 1.00 0.26 C ATOM 323 CG GLU A 23 -10.450 -9.789 13.006 1.00 0.28 C ATOM 324 CD GLU A 23 -11.442 -9.881 14.150 1.00 1.31 C ATOM 325 OE1 GLU A 23 -11.970 -8.827 14.562 1.00 2.42 O ATOM 326 OE2 GLU A 23 -11.691 -11.006 14.629 1.00 2.42 O ATOM 0 H GLU A 23 -9.020 -10.158 11.033 1.00 0.21 H new ATOM 0 HA GLU A 23 -11.718 -10.181 10.477 1.00 0.23 H new ATOM 0 HB2 GLU A 23 -10.221 -7.962 11.918 1.00 0.26 H new ATOM 0 HB3 GLU A 23 -11.887 -8.445 12.167 1.00 0.26 H new ATOM 0 HG2 GLU A 23 -10.313 -10.778 12.569 1.00 0.28 H new ATOM 0 HG3 GLU A 23 -9.481 -9.475 13.395 1.00 0.28 H new ATOM 333 N ALA A 24 -10.249 -7.460 9.289 1.00 0.20 N ATOM 334 CA ALA A 24 -10.399 -6.377 8.326 1.00 0.20 C ATOM 335 C ALA A 24 -9.952 -6.815 6.935 1.00 0.17 C ATOM 336 O ALA A 24 -10.627 -6.544 5.940 1.00 0.18 O ATOM 337 CB ALA A 24 -9.610 -5.156 8.776 1.00 0.21 C ATOM 0 H ALA A 24 -9.358 -7.463 9.785 1.00 0.20 H new ATOM 0 HA ALA A 24 -11.455 -6.113 8.274 1.00 0.20 H new ATOM 0 HB1 ALA A 24 -9.732 -4.355 8.047 1.00 0.21 H new ATOM 0 HB2 ALA A 24 -9.978 -4.822 9.746 1.00 0.21 H new ATOM 0 HB3 ALA A 24 -8.554 -5.415 8.858 1.00 0.21 H new ATOM 343 N LEU A 25 -8.810 -7.491 6.871 1.00 0.15 N ATOM 344 CA LEU A 25 -8.271 -7.967 5.601 1.00 0.13 C ATOM 345 C LEU A 25 -9.318 -8.763 4.830 1.00 0.13 C ATOM 346 O LEU A 25 -9.719 -8.381 3.729 1.00 0.14 O ATOM 347 CB LEU A 25 -7.032 -8.829 5.841 1.00 0.12 C ATOM 348 CG LEU A 25 -6.345 -9.380 4.591 1.00 0.10 C ATOM 349 CD1 LEU A 25 -6.942 -10.725 4.204 1.00 0.11 C ATOM 350 CD2 LEU A 25 -6.462 -8.393 3.439 1.00 0.10 C ATOM 0 H LEU A 25 -8.239 -7.722 7.684 1.00 0.15 H new ATOM 0 HA LEU A 25 -7.991 -7.099 5.005 1.00 0.13 H new ATOM 0 HB2 LEU A 25 -6.306 -8.238 6.400 1.00 0.12 H new ATOM 0 HB3 LEU A 25 -7.316 -9.669 6.475 1.00 0.12 H new ATOM 0 HG LEU A 25 -5.288 -9.524 4.814 1.00 0.10 H new ATOM 0 HD11 LEU A 25 -6.441 -11.102 3.312 1.00 0.11 H new ATOM 0 HD12 LEU A 25 -6.807 -11.432 5.023 1.00 0.11 H new ATOM 0 HD13 LEU A 25 -8.006 -10.605 3.999 1.00 0.11 H new ATOM 0 HD21 LEU A 25 -5.967 -8.802 2.558 1.00 0.10 H new ATOM 0 HD22 LEU A 25 -7.514 -8.217 3.216 1.00 0.10 H new ATOM 0 HD23 LEU A 25 -5.988 -7.452 3.717 1.00 0.10 H new ATOM 362 N LYS A 26 -9.760 -9.871 5.415 1.00 0.13 N ATOM 363 CA LYS A 26 -10.764 -10.722 4.786 1.00 0.14 C ATOM 364 C LYS A 26 -11.955 -9.897 4.313 1.00 0.16 C ATOM 365 O LYS A 26 -12.530 -10.168 3.258 1.00 0.19 O ATOM 366 CB LYS A 26 -11.232 -11.802 5.763 1.00 0.14 C ATOM 367 CG LYS A 26 -11.771 -13.046 5.081 1.00 0.35 C ATOM 368 CD LYS A 26 -13.217 -13.312 5.467 1.00 0.97 C ATOM 369 CE LYS A 26 -13.341 -13.700 6.932 1.00 1.83 C ATOM 370 NZ LYS A 26 -14.204 -12.748 7.687 1.00 3.34 N ATOM 0 H LYS A 26 -9.438 -10.201 6.325 1.00 0.13 H new ATOM 0 HA LYS A 26 -10.308 -11.200 3.919 1.00 0.14 H new ATOM 0 HB2 LYS A 26 -10.399 -12.083 6.407 1.00 0.14 H new ATOM 0 HB3 LYS A 26 -12.007 -11.386 6.407 1.00 0.14 H new ATOM 0 HG2 LYS A 26 -11.698 -12.930 4.000 1.00 0.35 H new ATOM 0 HG3 LYS A 26 -11.157 -13.905 5.352 1.00 0.35 H new ATOM 0 HD2 LYS A 26 -13.816 -12.422 5.273 1.00 0.97 H new ATOM 0 HD3 LYS A 26 -13.620 -14.110 4.843 1.00 0.97 H new ATOM 0 HE2 LYS A 26 -13.756 -14.705 7.008 1.00 1.83 H new ATOM 0 HE3 LYS A 26 -12.350 -13.730 7.385 1.00 1.83 H new ATOM 0 HZ1 LYS A 26 -14.263 -13.047 8.681 1.00 3.34 H new ATOM 0 HZ2 LYS A 26 -13.795 -11.793 7.636 1.00 3.34 H new ATOM 0 HZ3 LYS A 26 -15.157 -12.738 7.271 1.00 3.34 H new ATOM 384 N GLY A 27 -12.321 -8.888 5.097 1.00 0.17 N ATOM 385 CA GLY A 27 -13.442 -8.039 4.740 1.00 0.20 C ATOM 386 C GLY A 27 -13.148 -7.164 3.539 1.00 0.18 C ATOM 387 O GLY A 27 -13.958 -7.072 2.615 1.00 0.20 O ATOM 0 H GLY A 27 -11.861 -8.643 5.974 1.00 0.17 H new ATOM 0 HA2 GLY A 27 -14.312 -8.661 4.528 1.00 0.20 H new ATOM 0 HA3 GLY A 27 -13.701 -7.408 5.590 1.00 0.20 H new ATOM 391 N LEU A 28 -11.987 -6.519 3.548 1.00 0.17 N ATOM 392 CA LEU A 28 -11.586 -5.646 2.449 1.00 0.17 C ATOM 393 C LEU A 28 -11.465 -6.429 1.148 1.00 0.15 C ATOM 394 O LEU A 28 -11.845 -5.946 0.082 1.00 0.17 O ATOM 395 CB LEU A 28 -10.257 -4.963 2.773 1.00 0.17 C ATOM 396 CG LEU A 28 -10.305 -3.877 3.847 1.00 0.28 C ATOM 397 CD1 LEU A 28 -8.934 -3.243 4.028 1.00 0.37 C ATOM 398 CD2 LEU A 28 -11.340 -2.819 3.490 1.00 0.47 C ATOM 0 H LEU A 28 -11.306 -6.584 4.304 1.00 0.17 H new ATOM 0 HA LEU A 28 -12.356 -4.885 2.322 1.00 0.17 H new ATOM 0 HB2 LEU A 28 -9.546 -5.727 3.089 1.00 0.17 H new ATOM 0 HB3 LEU A 28 -9.865 -4.522 1.856 1.00 0.17 H new ATOM 0 HG LEU A 28 -10.596 -4.339 4.790 1.00 0.28 H new ATOM 0 HD11 LEU A 28 -8.988 -2.472 4.797 1.00 0.37 H new ATOM 0 HD12 LEU A 28 -8.217 -4.007 4.330 1.00 0.37 H new ATOM 0 HD13 LEU A 28 -8.613 -2.795 3.087 1.00 0.37 H new ATOM 0 HD21 LEU A 28 -11.360 -2.054 4.266 1.00 0.47 H new ATOM 0 HD22 LEU A 28 -11.078 -2.362 2.536 1.00 0.47 H new ATOM 0 HD23 LEU A 28 -12.323 -3.283 3.412 1.00 0.47 H new ATOM 410 N VAL A 29 -10.934 -7.646 1.241 1.00 0.15 N ATOM 411 CA VAL A 29 -10.765 -8.498 0.071 1.00 0.16 C ATOM 412 C VAL A 29 -12.087 -9.139 -0.338 1.00 0.17 C ATOM 413 O VAL A 29 -12.329 -9.387 -1.520 1.00 0.18 O ATOM 414 CB VAL A 29 -9.728 -9.607 0.329 1.00 0.19 C ATOM 415 CG1 VAL A 29 -8.404 -9.006 0.776 1.00 0.34 C ATOM 416 CG2 VAL A 29 -10.251 -10.595 1.361 1.00 0.62 C ATOM 0 H VAL A 29 -10.614 -8.062 2.115 1.00 0.15 H new ATOM 0 HA VAL A 29 -10.409 -7.859 -0.737 1.00 0.16 H new ATOM 0 HB VAL A 29 -9.558 -10.146 -0.603 1.00 0.19 H new ATOM 0 HG11 VAL A 29 -7.684 -9.804 0.954 1.00 0.34 H new ATOM 0 HG12 VAL A 29 -8.025 -8.342 -0.001 1.00 0.34 H new ATOM 0 HG13 VAL A 29 -8.553 -8.441 1.696 1.00 0.34 H new ATOM 0 HG21 VAL A 29 -9.506 -11.372 1.531 1.00 0.62 H new ATOM 0 HG22 VAL A 29 -10.451 -10.072 2.296 1.00 0.62 H new ATOM 0 HG23 VAL A 29 -11.172 -11.049 0.996 1.00 0.62 H new ATOM 426 N ASP A 30 -12.938 -9.403 0.647 1.00 0.19 N ATOM 427 CA ASP A 30 -14.237 -10.015 0.390 1.00 0.22 C ATOM 428 C ASP A 30 -15.094 -9.116 -0.496 1.00 0.22 C ATOM 429 O ASP A 30 -15.520 -9.518 -1.580 1.00 0.23 O ATOM 430 CB ASP A 30 -14.963 -10.294 1.707 1.00 0.24 C ATOM 431 CG ASP A 30 -16.386 -10.768 1.495 1.00 0.27 C ATOM 432 OD1 ASP A 30 -16.569 -11.897 0.997 1.00 1.82 O ATOM 433 OD2 ASP A 30 -17.321 -10.007 1.829 1.00 1.49 O ATOM 0 H ASP A 30 -12.752 -9.203 1.630 1.00 0.19 H new ATOM 0 HA ASP A 30 -14.071 -10.958 -0.131 1.00 0.22 H new ATOM 0 HB2 ASP A 30 -14.412 -11.048 2.269 1.00 0.24 H new ATOM 0 HB3 ASP A 30 -14.972 -9.388 2.313 1.00 0.24 H new ATOM 438 N LYS A 31 -15.347 -7.899 -0.028 1.00 0.23 N ATOM 439 CA LYS A 31 -16.154 -6.942 -0.777 1.00 0.24 C ATOM 440 C LYS A 31 -15.571 -6.710 -2.168 1.00 0.22 C ATOM 441 O LYS A 31 -16.305 -6.625 -3.153 1.00 0.25 O ATOM 442 CB LYS A 31 -16.241 -5.615 -0.021 1.00 0.26 C ATOM 443 CG LYS A 31 -14.903 -5.129 0.508 1.00 0.30 C ATOM 444 CD LYS A 31 -14.537 -3.769 -0.065 1.00 0.35 C ATOM 445 CE LYS A 31 -14.970 -2.639 0.858 1.00 0.70 C ATOM 446 NZ LYS A 31 -14.305 -2.723 2.188 1.00 3.13 N ATOM 0 H LYS A 31 -15.005 -7.551 0.868 1.00 0.23 H new ATOM 0 HA LYS A 31 -17.156 -7.357 -0.887 1.00 0.24 H new ATOM 0 HB2 LYS A 31 -16.658 -4.856 -0.683 1.00 0.26 H new ATOM 0 HB3 LYS A 31 -16.934 -5.726 0.813 1.00 0.26 H new ATOM 0 HG2 LYS A 31 -14.941 -5.068 1.596 1.00 0.30 H new ATOM 0 HG3 LYS A 31 -14.127 -5.852 0.256 1.00 0.30 H new ATOM 0 HD2 LYS A 31 -13.460 -3.718 -0.224 1.00 0.35 H new ATOM 0 HD3 LYS A 31 -15.009 -3.645 -1.040 1.00 0.35 H new ATOM 0 HE2 LYS A 31 -14.735 -1.681 0.394 1.00 0.70 H new ATOM 0 HE3 LYS A 31 -16.051 -2.672 0.990 1.00 0.70 H new ATOM 0 HZ1 LYS A 31 -14.210 -1.768 2.589 1.00 3.13 H new ATOM 0 HZ2 LYS A 31 -14.878 -3.311 2.826 1.00 3.13 H new ATOM 0 HZ3 LYS A 31 -13.362 -3.148 2.079 1.00 3.13 H new ATOM 460 N LEU A 32 -14.248 -6.612 -2.240 1.00 0.19 N ATOM 461 CA LEU A 32 -13.567 -6.392 -3.512 1.00 0.18 C ATOM 462 C LEU A 32 -13.604 -7.649 -4.375 1.00 0.18 C ATOM 463 O LEU A 32 -13.508 -7.576 -5.600 1.00 0.20 O ATOM 464 CB LEU A 32 -12.116 -5.970 -3.269 1.00 0.17 C ATOM 465 CG LEU A 32 -11.915 -4.587 -2.648 1.00 0.17 C ATOM 466 CD1 LEU A 32 -10.446 -4.349 -2.337 1.00 0.17 C ATOM 467 CD2 LEU A 32 -12.448 -3.504 -3.575 1.00 0.23 C ATOM 0 H LEU A 32 -13.626 -6.681 -1.434 1.00 0.19 H new ATOM 0 HA LEU A 32 -14.088 -5.595 -4.042 1.00 0.18 H new ATOM 0 HB2 LEU A 32 -11.647 -6.710 -2.620 1.00 0.17 H new ATOM 0 HB3 LEU A 32 -11.586 -6.000 -4.221 1.00 0.17 H new ATOM 0 HG LEU A 32 -12.474 -4.545 -1.713 1.00 0.17 H new ATOM 0 HD11 LEU A 32 -10.323 -3.360 -1.896 1.00 0.17 H new ATOM 0 HD12 LEU A 32 -10.096 -5.106 -1.635 1.00 0.17 H new ATOM 0 HD13 LEU A 32 -9.865 -4.411 -3.257 1.00 0.17 H new ATOM 0 HD21 LEU A 32 -12.297 -2.526 -3.117 1.00 0.23 H new ATOM 0 HD22 LEU A 32 -11.917 -3.545 -4.526 1.00 0.23 H new ATOM 0 HD23 LEU A 32 -13.513 -3.663 -3.747 1.00 0.23 H new ATOM 479 N GLN A 33 -13.747 -8.801 -3.727 1.00 0.18 N ATOM 480 CA GLN A 33 -13.799 -10.075 -4.435 1.00 0.21 C ATOM 481 C GLN A 33 -15.174 -10.296 -5.057 1.00 0.24 C ATOM 482 O GLN A 33 -15.314 -11.032 -6.032 1.00 0.27 O ATOM 483 CB GLN A 33 -13.464 -11.225 -3.487 1.00 0.21 C ATOM 484 CG GLN A 33 -11.992 -11.606 -3.486 1.00 0.20 C ATOM 485 CD GLN A 33 -11.777 -13.106 -3.513 1.00 0.26 C ATOM 486 OE1 GLN A 33 -11.997 -13.758 -4.535 1.00 0.26 O ATOM 487 NE2 GLN A 33 -11.344 -13.662 -2.387 1.00 0.38 N ATOM 0 H GLN A 33 -13.829 -8.878 -2.713 1.00 0.18 H new ATOM 0 HA GLN A 33 -13.059 -10.047 -5.235 1.00 0.21 H new ATOM 0 HB2 GLN A 33 -13.759 -10.948 -2.475 1.00 0.21 H new ATOM 0 HB3 GLN A 33 -14.056 -12.097 -3.764 1.00 0.21 H new ATOM 0 HG2 GLN A 33 -11.504 -11.157 -4.351 1.00 0.20 H new ATOM 0 HG3 GLN A 33 -11.514 -11.190 -2.599 1.00 0.20 H new ATOM 0 HE21 GLN A 33 -11.175 -13.083 -1.564 1.00 0.38 H new ATOM 0 HE22 GLN A 33 -11.180 -14.668 -2.345 1.00 0.38 H new ATOM 496 N ALA A 34 -16.187 -9.653 -4.485 1.00 0.24 N ATOM 497 CA ALA A 34 -17.551 -9.779 -4.984 1.00 0.28 C ATOM 498 C ALA A 34 -17.860 -8.698 -6.013 1.00 0.29 C ATOM 499 O ALA A 34 -18.663 -8.905 -6.924 1.00 0.31 O ATOM 500 CB ALA A 34 -18.542 -9.714 -3.831 1.00 0.30 C ATOM 0 H ALA A 34 -16.089 -9.040 -3.676 1.00 0.24 H new ATOM 0 HA ALA A 34 -17.645 -10.748 -5.475 1.00 0.28 H new ATOM 0 HB1 ALA A 34 -19.557 -9.809 -4.218 1.00 0.30 H new ATOM 0 HB2 ALA A 34 -18.342 -10.527 -3.133 1.00 0.30 H new ATOM 0 HB3 ALA A 34 -18.438 -8.759 -3.316 1.00 0.30 H new ATOM 506 N LEU A 35 -17.222 -7.542 -5.862 1.00 0.26 N ATOM 507 CA LEU A 35 -17.429 -6.428 -6.779 1.00 0.26 C ATOM 508 C LEU A 35 -16.421 -6.468 -7.922 1.00 0.25 C ATOM 509 O LEU A 35 -16.741 -6.118 -9.059 1.00 0.27 O ATOM 510 CB LEU A 35 -17.316 -5.098 -6.030 1.00 0.24 C ATOM 511 CG LEU A 35 -15.897 -4.584 -5.784 1.00 0.20 C ATOM 512 CD1 LEU A 35 -15.416 -3.758 -6.967 1.00 0.20 C ATOM 513 CD2 LEU A 35 -15.839 -3.768 -4.502 1.00 0.21 C ATOM 0 H LEU A 35 -16.557 -7.353 -5.112 1.00 0.26 H new ATOM 0 HA LEU A 35 -18.430 -6.518 -7.200 1.00 0.26 H new ATOM 0 HB2 LEU A 35 -17.863 -4.340 -6.591 1.00 0.24 H new ATOM 0 HB3 LEU A 35 -17.815 -5.203 -5.067 1.00 0.24 H new ATOM 0 HG LEU A 35 -15.235 -5.443 -5.673 1.00 0.20 H new ATOM 0 HD11 LEU A 35 -14.404 -3.401 -6.774 1.00 0.20 H new ATOM 0 HD12 LEU A 35 -15.418 -4.374 -7.866 1.00 0.20 H new ATOM 0 HD13 LEU A 35 -16.081 -2.906 -7.110 1.00 0.20 H new ATOM 0 HD21 LEU A 35 -14.821 -3.411 -4.344 1.00 0.21 H new ATOM 0 HD22 LEU A 35 -16.514 -2.916 -4.582 1.00 0.21 H new ATOM 0 HD23 LEU A 35 -16.140 -4.391 -3.660 1.00 0.21 H new ATOM 525 N THR A 36 -15.202 -6.897 -7.615 1.00 0.22 N ATOM 526 CA THR A 36 -14.147 -6.985 -8.617 1.00 0.23 C ATOM 527 C THR A 36 -13.920 -8.428 -9.052 1.00 0.29 C ATOM 528 O THR A 36 -13.783 -8.714 -10.241 1.00 0.36 O ATOM 529 CB THR A 36 -12.821 -6.405 -8.089 1.00 0.21 C ATOM 530 OG1 THR A 36 -13.081 -5.460 -7.043 1.00 0.18 O ATOM 531 CG2 THR A 36 -12.042 -5.728 -9.206 1.00 0.25 C ATOM 0 H THR A 36 -14.920 -7.189 -6.679 1.00 0.22 H new ATOM 0 HA THR A 36 -14.476 -6.398 -9.474 1.00 0.23 H new ATOM 0 HB THR A 36 -12.223 -7.227 -7.697 1.00 0.21 H new ATOM 0 HG1 THR A 36 -13.138 -5.930 -6.185 1.00 0.18 H new ATOM 0 HG21 THR A 36 -11.110 -5.327 -8.808 1.00 0.25 H new ATOM 0 HG22 THR A 36 -11.820 -6.455 -9.987 1.00 0.25 H new ATOM 0 HG23 THR A 36 -12.637 -4.916 -9.625 1.00 0.25 H new ATOM 539 N GLY A 37 -13.882 -9.335 -8.081 1.00 0.27 N ATOM 540 CA GLY A 37 -13.671 -10.738 -8.384 1.00 0.33 C ATOM 541 C GLY A 37 -14.825 -11.342 -9.160 1.00 0.37 C ATOM 542 O GLY A 37 -14.722 -12.459 -9.666 1.00 0.42 O ATOM 0 H GLY A 37 -13.994 -9.123 -7.090 1.00 0.27 H new ATOM 0 HA2 GLY A 37 -12.752 -10.848 -8.960 1.00 0.33 H new ATOM 0 HA3 GLY A 37 -13.533 -11.291 -7.455 1.00 0.33 H new ATOM 546 N ASN A 38 -15.927 -10.604 -9.250 1.00 0.36 N ATOM 547 CA ASN A 38 -17.105 -11.076 -9.967 1.00 0.41 C ATOM 548 C ASN A 38 -16.905 -10.966 -11.475 1.00 0.37 C ATOM 549 O ASN A 38 -16.921 -11.969 -12.187 1.00 0.52 O ATOM 550 CB ASN A 38 -18.339 -10.275 -9.546 1.00 0.44 C ATOM 551 CG ASN A 38 -19.482 -10.411 -10.533 1.00 1.41 C ATOM 552 OD1 ASN A 38 -19.903 -9.433 -11.150 1.00 2.92 O ATOM 553 ND2 ASN A 38 -19.991 -11.628 -10.684 1.00 2.56 N ATOM 0 H ASN A 38 -16.028 -9.678 -8.835 1.00 0.36 H new ATOM 0 HA ASN A 38 -17.257 -12.125 -9.714 1.00 0.41 H new ATOM 0 HB2 ASN A 38 -18.669 -10.612 -8.563 1.00 0.44 H new ATOM 0 HB3 ASN A 38 -18.070 -9.223 -9.449 1.00 0.44 H new ATOM 0 HD21 ASN A 38 -20.763 -11.781 -11.333 1.00 2.56 H new ATOM 0 HD22 ASN A 38 -19.610 -12.410 -10.151 1.00 2.56 H new ATOM 560 N GLU A 39 -16.716 -9.741 -11.954 1.00 0.30 N ATOM 561 CA GLU A 39 -16.513 -9.500 -13.378 1.00 0.46 C ATOM 562 C GLU A 39 -15.040 -9.644 -13.749 1.00 0.38 C ATOM 563 O GLU A 39 -14.701 -10.239 -14.771 1.00 0.43 O ATOM 564 CB GLU A 39 -17.011 -8.105 -13.759 1.00 0.67 C ATOM 565 CG GLU A 39 -18.500 -8.050 -14.057 1.00 0.70 C ATOM 566 CD GLU A 39 -18.802 -8.158 -15.539 1.00 0.86 C ATOM 567 OE1 GLU A 39 -18.518 -7.190 -16.275 1.00 2.06 O ATOM 568 OE2 GLU A 39 -19.322 -9.211 -15.963 1.00 1.56 O ATOM 0 H GLU A 39 -16.699 -8.900 -11.377 1.00 0.30 H new ATOM 0 HA GLU A 39 -17.085 -10.245 -13.931 1.00 0.46 H new ATOM 0 HB2 GLU A 39 -16.786 -7.414 -12.947 1.00 0.67 H new ATOM 0 HB3 GLU A 39 -16.461 -7.759 -14.634 1.00 0.67 H new ATOM 0 HG2 GLU A 39 -19.003 -8.859 -13.527 1.00 0.70 H new ATOM 0 HG3 GLU A 39 -18.909 -7.115 -13.674 1.00 0.70 H new ATOM 575 N GLY A 40 -14.167 -9.094 -12.911 1.00 0.31 N ATOM 576 CA GLY A 40 -12.741 -9.171 -13.166 1.00 0.27 C ATOM 577 C GLY A 40 -12.075 -10.301 -12.405 1.00 0.26 C ATOM 578 O GLY A 40 -12.447 -11.463 -12.556 1.00 0.34 O ATOM 0 H GLY A 40 -14.423 -8.596 -12.059 1.00 0.31 H new ATOM 0 HA2 GLY A 40 -12.573 -9.308 -14.234 1.00 0.27 H new ATOM 0 HA3 GLY A 40 -12.274 -8.226 -12.889 1.00 0.27 H new ATOM 582 N ARG A 41 -11.087 -9.957 -11.586 1.00 0.20 N ATOM 583 CA ARG A 41 -10.365 -10.951 -10.801 1.00 0.18 C ATOM 584 C ARG A 41 -9.706 -10.309 -9.585 1.00 0.17 C ATOM 585 O ARG A 41 -9.386 -9.120 -9.593 1.00 0.16 O ATOM 586 CB ARG A 41 -9.370 -11.785 -11.622 1.00 0.19 C ATOM 587 CG ARG A 41 -8.983 -13.098 -10.915 1.00 0.19 C ATOM 588 CD ARG A 41 -8.257 -14.069 -11.852 1.00 0.20 C ATOM 589 NE ARG A 41 -7.877 -15.298 -11.138 1.00 0.22 N ATOM 590 CZ ARG A 41 -7.634 -16.499 -11.697 1.00 1.11 C ATOM 591 NH1 ARG A 41 -7.741 -16.701 -13.019 1.00 2.25 N ATOM 592 NH2 ARG A 41 -7.275 -17.521 -10.909 1.00 0.98 N ATOM 0 H ARG A 41 -10.768 -8.998 -11.449 1.00 0.20 H new ATOM 0 HA ARG A 41 -11.110 -11.665 -10.450 1.00 0.18 H new ATOM 0 HB2 ARG A 41 -9.807 -12.014 -12.594 1.00 0.19 H new ATOM 0 HB3 ARG A 41 -8.472 -11.196 -11.807 1.00 0.19 H new ATOM 0 HG2 ARG A 41 -8.344 -12.874 -10.061 1.00 0.19 H new ATOM 0 HG3 ARG A 41 -9.881 -13.576 -10.524 1.00 0.19 H new ATOM 0 HD2 ARG A 41 -8.901 -14.317 -12.696 1.00 0.20 H new ATOM 0 HD3 ARG A 41 -7.367 -13.590 -12.261 1.00 0.20 H new ATOM 0 HE ARG A 41 -7.789 -15.234 -10.124 1.00 0.22 H new ATOM 0 HH11 ARG A 41 -8.013 -15.933 -13.632 1.00 2.25 H new ATOM 0 HH12 ARG A 41 -7.550 -17.623 -13.411 1.00 2.25 H new ATOM 0 HH21 ARG A 41 -7.189 -17.383 -9.902 1.00 0.98 H new ATOM 0 HH22 ARG A 41 -7.087 -18.437 -11.316 1.00 0.98 H new ATOM 606 N VAL A 42 -9.504 -11.104 -8.538 1.00 0.17 N ATOM 607 CA VAL A 42 -8.882 -10.614 -7.314 1.00 0.16 C ATOM 608 C VAL A 42 -7.885 -11.625 -6.760 1.00 0.16 C ATOM 609 O VAL A 42 -8.207 -12.800 -6.590 1.00 0.28 O ATOM 610 CB VAL A 42 -9.935 -10.305 -6.233 1.00 0.17 C ATOM 611 CG1 VAL A 42 -9.263 -9.883 -4.936 1.00 0.18 C ATOM 612 CG2 VAL A 42 -10.897 -9.230 -6.718 1.00 0.20 C ATOM 0 H VAL A 42 -9.762 -12.090 -8.514 1.00 0.17 H new ATOM 0 HA VAL A 42 -8.357 -9.695 -7.574 1.00 0.16 H new ATOM 0 HB VAL A 42 -10.507 -11.213 -6.039 1.00 0.17 H new ATOM 0 HG11 VAL A 42 -10.024 -9.669 -4.185 1.00 0.18 H new ATOM 0 HG12 VAL A 42 -8.619 -10.688 -4.581 1.00 0.18 H new ATOM 0 HG13 VAL A 42 -8.664 -8.989 -5.111 1.00 0.18 H new ATOM 0 HG21 VAL A 42 -11.634 -9.024 -5.942 1.00 0.20 H new ATOM 0 HG22 VAL A 42 -10.342 -8.319 -6.942 1.00 0.20 H new ATOM 0 HG23 VAL A 42 -11.405 -9.576 -7.618 1.00 0.20 H new ATOM 622 N SER A 43 -6.671 -11.159 -6.482 1.00 0.10 N ATOM 623 CA SER A 43 -5.624 -12.024 -5.951 1.00 0.10 C ATOM 624 C SER A 43 -5.182 -11.555 -4.567 1.00 0.09 C ATOM 625 O SER A 43 -5.309 -10.379 -4.228 1.00 0.11 O ATOM 626 CB SER A 43 -4.424 -12.050 -6.901 1.00 0.12 C ATOM 627 OG SER A 43 -3.512 -13.074 -6.542 1.00 0.16 O ATOM 0 H SER A 43 -6.389 -10.188 -6.616 1.00 0.10 H new ATOM 0 HA SER A 43 -6.030 -13.032 -5.862 1.00 0.10 H new ATOM 0 HB2 SER A 43 -4.769 -12.207 -7.923 1.00 0.12 H new ATOM 0 HB3 SER A 43 -3.918 -11.085 -6.880 1.00 0.12 H new ATOM 0 HG SER A 43 -2.755 -13.071 -7.165 1.00 0.16 H new ATOM 633 N VAL A 44 -4.661 -12.486 -3.773 1.00 0.11 N ATOM 634 CA VAL A 44 -4.199 -12.169 -2.427 1.00 0.12 C ATOM 635 C VAL A 44 -2.694 -12.375 -2.301 1.00 0.13 C ATOM 636 O VAL A 44 -2.159 -13.395 -2.731 1.00 0.15 O ATOM 637 CB VAL A 44 -4.914 -13.033 -1.372 1.00 0.14 C ATOM 638 CG1 VAL A 44 -4.563 -14.501 -1.556 1.00 0.15 C ATOM 639 CG2 VAL A 44 -4.557 -12.563 0.031 1.00 0.17 C ATOM 0 H VAL A 44 -4.549 -13.464 -4.039 1.00 0.11 H new ATOM 0 HA VAL A 44 -4.436 -11.120 -2.249 1.00 0.12 H new ATOM 0 HB VAL A 44 -5.990 -12.922 -1.506 1.00 0.14 H new ATOM 0 HG11 VAL A 44 -5.078 -15.096 -0.801 1.00 0.15 H new ATOM 0 HG12 VAL A 44 -4.873 -14.828 -2.549 1.00 0.15 H new ATOM 0 HG13 VAL A 44 -3.486 -14.634 -1.450 1.00 0.15 H new ATOM 0 HG21 VAL A 44 -5.071 -13.184 0.765 1.00 0.17 H new ATOM 0 HG22 VAL A 44 -3.480 -12.643 0.178 1.00 0.17 H new ATOM 0 HG23 VAL A 44 -4.864 -11.525 0.156 1.00 0.17 H new ATOM 649 N GLU A 45 -2.016 -11.396 -1.708 1.00 0.12 N ATOM 650 CA GLU A 45 -0.571 -11.469 -1.525 1.00 0.13 C ATOM 651 C GLU A 45 -0.156 -10.825 -0.207 1.00 0.11 C ATOM 652 O GLU A 45 -0.835 -9.934 0.302 1.00 0.10 O ATOM 653 CB GLU A 45 0.147 -10.786 -2.689 1.00 0.15 C ATOM 654 CG GLU A 45 -0.367 -11.208 -4.055 1.00 0.19 C ATOM 655 CD GLU A 45 0.158 -10.329 -5.174 1.00 0.25 C ATOM 656 OE1 GLU A 45 0.349 -9.117 -4.936 1.00 1.88 O ATOM 657 OE2 GLU A 45 0.378 -10.851 -6.287 1.00 1.97 O ATOM 0 H GLU A 45 -2.444 -10.544 -1.347 1.00 0.12 H new ATOM 0 HA GLU A 45 -0.286 -12.521 -1.499 1.00 0.13 H new ATOM 0 HB2 GLU A 45 0.039 -9.706 -2.588 1.00 0.15 H new ATOM 0 HB3 GLU A 45 1.213 -11.007 -2.627 1.00 0.15 H new ATOM 0 HG2 GLU A 45 -0.078 -12.242 -4.244 1.00 0.19 H new ATOM 0 HG3 GLU A 45 -1.457 -11.177 -4.054 1.00 0.19 H new ATOM 664 N ASN A 46 0.964 -11.282 0.343 1.00 0.12 N ATOM 665 CA ASN A 46 1.471 -10.751 1.602 1.00 0.13 C ATOM 666 C ASN A 46 2.623 -9.780 1.361 1.00 0.16 C ATOM 667 O ASN A 46 3.476 -10.017 0.506 1.00 0.23 O ATOM 668 CB ASN A 46 1.932 -11.892 2.511 1.00 0.17 C ATOM 669 CG ASN A 46 1.760 -11.566 3.982 1.00 0.18 C ATOM 670 OD1 ASN A 46 1.908 -10.415 4.397 1.00 0.46 O ATOM 671 ND2 ASN A 46 1.445 -12.580 4.781 1.00 0.42 N ATOM 0 H ASN A 46 1.538 -12.020 -0.064 1.00 0.12 H new ATOM 0 HA ASN A 46 0.661 -10.209 2.091 1.00 0.13 H new ATOM 0 HB2 ASN A 46 1.367 -12.793 2.273 1.00 0.17 H new ATOM 0 HB3 ASN A 46 2.981 -12.111 2.311 1.00 0.17 H new ATOM 0 HD21 ASN A 46 1.316 -12.421 5.780 1.00 0.42 H new ATOM 0 HD22 ASN A 46 1.332 -13.517 4.395 1.00 0.42 H new ATOM 678 N ILE A 47 2.639 -8.689 2.119 1.00 0.15 N ATOM 679 CA ILE A 47 3.686 -7.685 1.988 1.00 0.18 C ATOM 680 C ILE A 47 5.069 -8.319 2.066 1.00 0.23 C ATOM 681 O ILE A 47 5.959 -7.996 1.279 1.00 0.34 O ATOM 682 CB ILE A 47 3.568 -6.602 3.077 1.00 0.15 C ATOM 683 CG1 ILE A 47 2.495 -5.580 2.695 1.00 0.29 C ATOM 684 CG2 ILE A 47 4.909 -5.917 3.291 1.00 0.25 C ATOM 685 CD1 ILE A 47 2.308 -4.488 3.726 1.00 0.23 C ATOM 0 H ILE A 47 1.939 -8.478 2.830 1.00 0.15 H new ATOM 0 HA ILE A 47 3.556 -7.221 1.010 1.00 0.18 H new ATOM 0 HB ILE A 47 3.273 -7.078 4.012 1.00 0.15 H new ATOM 0 HG12 ILE A 47 2.760 -5.126 1.740 1.00 0.29 H new ATOM 0 HG13 ILE A 47 1.547 -6.098 2.549 1.00 0.29 H new ATOM 0 HG21 ILE A 47 4.809 -5.154 4.063 1.00 0.25 H new ATOM 0 HG22 ILE A 47 5.649 -6.654 3.603 1.00 0.25 H new ATOM 0 HG23 ILE A 47 5.232 -5.450 2.360 1.00 0.25 H new ATOM 0 HD11 ILE A 47 1.533 -3.799 3.390 1.00 0.23 H new ATOM 0 HD12 ILE A 47 2.012 -4.932 4.677 1.00 0.23 H new ATOM 0 HD13 ILE A 47 3.244 -3.945 3.855 1.00 0.23 H new ATOM 697 N LYS A 48 5.245 -9.226 3.020 1.00 0.28 N ATOM 698 CA LYS A 48 6.520 -9.911 3.202 1.00 0.35 C ATOM 699 C LYS A 48 6.738 -10.951 2.108 1.00 0.24 C ATOM 700 O LYS A 48 7.869 -11.370 1.855 1.00 0.25 O ATOM 701 CB LYS A 48 6.571 -10.580 4.577 1.00 0.51 C ATOM 702 CG LYS A 48 5.359 -11.444 4.880 1.00 0.61 C ATOM 703 CD LYS A 48 4.783 -11.134 6.250 1.00 0.82 C ATOM 704 CE LYS A 48 4.228 -9.719 6.317 1.00 2.69 C ATOM 705 NZ LYS A 48 4.543 -9.059 7.614 1.00 3.68 N ATOM 0 H LYS A 48 4.520 -9.505 3.681 1.00 0.28 H new ATOM 0 HA LYS A 48 7.316 -9.170 3.137 1.00 0.35 H new ATOM 0 HB2 LYS A 48 7.469 -11.194 4.639 1.00 0.51 H new ATOM 0 HB3 LYS A 48 6.658 -9.810 5.343 1.00 0.51 H new ATOM 0 HG2 LYS A 48 4.596 -11.282 4.118 1.00 0.61 H new ATOM 0 HG3 LYS A 48 5.640 -12.496 4.832 1.00 0.61 H new ATOM 0 HD2 LYS A 48 3.992 -11.847 6.483 1.00 0.82 H new ATOM 0 HD3 LYS A 48 5.557 -11.258 7.007 1.00 0.82 H new ATOM 0 HE2 LYS A 48 4.641 -9.128 5.499 1.00 2.69 H new ATOM 0 HE3 LYS A 48 3.147 -9.746 6.177 1.00 2.69 H new ATOM 0 HZ1 LYS A 48 4.207 -8.075 7.593 1.00 3.68 H new ATOM 0 HZ2 LYS A 48 4.071 -9.570 8.387 1.00 3.68 H new ATOM 0 HZ3 LYS A 48 5.571 -9.070 7.769 1.00 3.68 H new ATOM 719 N GLN A 49 5.652 -11.363 1.463 1.00 0.29 N ATOM 720 CA GLN A 49 5.728 -12.355 0.397 1.00 0.30 C ATOM 721 C GLN A 49 5.506 -11.706 -0.966 1.00 0.34 C ATOM 722 O GLN A 49 5.198 -12.385 -1.946 1.00 0.43 O ATOM 723 CB GLN A 49 4.691 -13.458 0.624 1.00 0.42 C ATOM 724 CG GLN A 49 4.687 -14.005 2.042 1.00 1.67 C ATOM 725 CD GLN A 49 5.155 -15.446 2.114 1.00 2.22 C ATOM 726 OE1 GLN A 49 6.331 -15.739 1.900 1.00 3.52 O ATOM 727 NE2 GLN A 49 4.234 -16.354 2.415 1.00 1.63 N ATOM 0 H GLN A 49 4.710 -11.026 1.660 1.00 0.29 H new ATOM 0 HA GLN A 49 6.726 -12.794 0.413 1.00 0.30 H new ATOM 0 HB2 GLN A 49 3.700 -13.068 0.391 1.00 0.42 H new ATOM 0 HB3 GLN A 49 4.883 -14.275 -0.071 1.00 0.42 H new ATOM 0 HG2 GLN A 49 5.331 -13.386 2.668 1.00 1.67 H new ATOM 0 HG3 GLN A 49 3.680 -13.933 2.452 1.00 1.67 H new ATOM 0 HE21 GLN A 49 3.270 -16.066 2.585 1.00 1.63 H new ATOM 0 HE22 GLN A 49 4.490 -17.339 2.476 1.00 1.63 H new ATOM 736 N LEU A 50 5.667 -10.389 -1.020 1.00 0.34 N ATOM 737 CA LEU A 50 5.484 -9.647 -2.264 1.00 0.43 C ATOM 738 C LEU A 50 6.375 -10.207 -3.368 1.00 0.41 C ATOM 739 O LEU A 50 6.079 -10.061 -4.554 1.00 0.41 O ATOM 740 CB LEU A 50 5.791 -8.166 -2.046 1.00 0.56 C ATOM 741 CG LEU A 50 4.713 -7.182 -2.499 1.00 0.67 C ATOM 742 CD1 LEU A 50 4.418 -6.170 -1.403 1.00 2.70 C ATOM 743 CD2 LEU A 50 5.138 -6.475 -3.779 1.00 2.15 C ATOM 0 H LEU A 50 5.924 -9.813 -0.219 1.00 0.34 H new ATOM 0 HA LEU A 50 4.444 -9.754 -2.573 1.00 0.43 H new ATOM 0 HB2 LEU A 50 5.976 -8.007 -0.984 1.00 0.56 H new ATOM 0 HB3 LEU A 50 6.716 -7.927 -2.570 1.00 0.56 H new ATOM 0 HG LEU A 50 3.801 -7.743 -2.703 1.00 0.67 H new ATOM 0 HD11 LEU A 50 3.648 -5.478 -1.744 1.00 2.70 H new ATOM 0 HD12 LEU A 50 4.068 -6.691 -0.511 1.00 2.70 H new ATOM 0 HD13 LEU A 50 5.326 -5.615 -1.166 1.00 2.70 H new ATOM 0 HD21 LEU A 50 4.358 -5.778 -4.086 1.00 2.15 H new ATOM 0 HD22 LEU A 50 6.064 -5.928 -3.602 1.00 2.15 H new ATOM 0 HD23 LEU A 50 5.297 -7.212 -4.566 1.00 2.15 H new ATOM 755 N LEU A 51 7.466 -10.852 -2.969 1.00 0.42 N ATOM 756 CA LEU A 51 8.400 -11.438 -3.925 1.00 0.45 C ATOM 757 C LEU A 51 7.672 -12.339 -4.916 1.00 0.42 C ATOM 758 O LEU A 51 8.044 -12.418 -6.086 1.00 0.39 O ATOM 759 CB LEU A 51 9.479 -12.234 -3.190 1.00 0.54 C ATOM 760 CG LEU A 51 10.869 -11.596 -3.140 1.00 0.69 C ATOM 761 CD1 LEU A 51 10.780 -10.167 -2.627 1.00 0.63 C ATOM 762 CD2 LEU A 51 11.803 -12.421 -2.266 1.00 1.03 C ATOM 0 H LEU A 51 7.726 -10.982 -1.991 1.00 0.42 H new ATOM 0 HA LEU A 51 8.871 -10.627 -4.480 1.00 0.45 H new ATOM 0 HB2 LEU A 51 9.143 -12.405 -2.167 1.00 0.54 H new ATOM 0 HB3 LEU A 51 9.567 -13.212 -3.664 1.00 0.54 H new ATOM 0 HG LEU A 51 11.275 -11.574 -4.151 1.00 0.69 H new ATOM 0 HD11 LEU A 51 11.777 -9.728 -2.598 1.00 0.63 H new ATOM 0 HD12 LEU A 51 10.145 -9.581 -3.291 1.00 0.63 H new ATOM 0 HD13 LEU A 51 10.354 -10.166 -1.624 1.00 0.63 H new ATOM 0 HD21 LEU A 51 12.787 -11.953 -2.242 1.00 1.03 H new ATOM 0 HD22 LEU A 51 11.402 -12.475 -1.254 1.00 1.03 H new ATOM 0 HD23 LEU A 51 11.890 -13.427 -2.675 1.00 1.03 H new ATOM 774 N GLN A 52 6.633 -13.015 -4.438 1.00 0.45 N ATOM 775 CA GLN A 52 5.851 -13.911 -5.284 1.00 0.48 C ATOM 776 C GLN A 52 4.754 -13.147 -6.018 1.00 0.44 C ATOM 777 O GLN A 52 4.183 -13.642 -6.990 1.00 0.47 O ATOM 778 CB GLN A 52 5.234 -15.032 -4.444 1.00 0.58 C ATOM 779 CG GLN A 52 6.204 -15.652 -3.452 1.00 0.64 C ATOM 780 CD GLN A 52 7.489 -16.120 -4.107 1.00 0.73 C ATOM 781 OE1 GLN A 52 7.544 -16.322 -5.320 1.00 1.20 O ATOM 782 NE2 GLN A 52 8.534 -16.295 -3.305 1.00 0.84 N ATOM 0 H GLN A 52 6.313 -12.960 -3.471 1.00 0.45 H new ATOM 0 HA GLN A 52 6.522 -14.348 -6.024 1.00 0.48 H new ATOM 0 HB2 GLN A 52 4.375 -14.638 -3.901 1.00 0.58 H new ATOM 0 HB3 GLN A 52 4.861 -15.810 -5.110 1.00 0.58 H new ATOM 0 HG2 GLN A 52 6.440 -14.923 -2.677 1.00 0.64 H new ATOM 0 HG3 GLN A 52 5.723 -16.497 -2.959 1.00 0.64 H new ATOM 0 HE21 GLN A 52 8.445 -16.116 -2.305 1.00 0.84 H new ATOM 0 HE22 GLN A 52 9.425 -16.608 -3.690 1.00 0.84 H new ATOM 791 N SER A 53 4.463 -11.939 -5.546 1.00 0.42 N ATOM 792 CA SER A 53 3.432 -11.109 -6.156 1.00 0.43 C ATOM 793 C SER A 53 3.806 -10.742 -7.589 1.00 0.39 C ATOM 794 O SER A 53 2.974 -10.251 -8.352 1.00 0.42 O ATOM 795 CB SER A 53 3.218 -9.838 -5.331 1.00 0.47 C ATOM 796 OG SER A 53 2.793 -10.148 -4.017 1.00 0.88 O ATOM 0 H SER A 53 4.927 -11.514 -4.743 1.00 0.42 H new ATOM 0 HA SER A 53 2.505 -11.681 -6.177 1.00 0.43 H new ATOM 0 HB2 SER A 53 4.145 -9.266 -5.291 1.00 0.47 H new ATOM 0 HB3 SER A 53 2.475 -9.206 -5.817 1.00 0.47 H new ATOM 0 HG SER A 53 2.512 -9.327 -3.562 1.00 0.88 H new ATOM 802 N ALA A 54 5.062 -10.986 -7.946 1.00 0.35 N ATOM 803 CA ALA A 54 5.546 -10.684 -9.288 1.00 0.34 C ATOM 804 C ALA A 54 5.026 -11.700 -10.300 1.00 0.32 C ATOM 805 O ALA A 54 5.805 -12.383 -10.966 1.00 0.35 O ATOM 806 CB ALA A 54 7.067 -10.652 -9.305 1.00 0.34 C ATOM 0 H ALA A 54 5.763 -11.392 -7.326 1.00 0.35 H new ATOM 0 HA ALA A 54 5.169 -9.701 -9.571 1.00 0.34 H new ATOM 0 HB1 ALA A 54 7.415 -10.426 -10.313 1.00 0.34 H new ATOM 0 HB2 ALA A 54 7.422 -9.885 -8.617 1.00 0.34 H new ATOM 0 HB3 ALA A 54 7.455 -11.623 -8.997 1.00 0.34 H new ATOM 812 N HIS A 55 3.705 -11.793 -10.412 1.00 0.31 N ATOM 813 CA HIS A 55 3.081 -12.726 -11.344 1.00 0.31 C ATOM 814 C HIS A 55 3.471 -12.399 -12.781 1.00 0.33 C ATOM 815 O HIS A 55 4.222 -13.141 -13.417 1.00 0.34 O ATOM 816 CB HIS A 55 1.560 -12.687 -11.195 1.00 0.33 C ATOM 817 CG HIS A 55 1.066 -13.311 -9.926 1.00 0.32 C ATOM 818 ND1 HIS A 55 1.513 -13.200 -8.653 1.00 0.31 N flip ATOM 819 CD2 HIS A 55 -0.013 -14.166 -9.878 1.00 0.40 C flip ATOM 820 CE1 HIS A 55 0.702 -13.984 -7.867 1.00 0.32 C flip ATOM 821 NE2 HIS A 55 -0.212 -14.555 -8.631 1.00 0.39 N flip ATOM 0 H HIS A 55 3.046 -11.234 -9.870 1.00 0.31 H new ATOM 0 HA HIS A 55 3.436 -13.729 -11.109 1.00 0.31 H new ATOM 0 HB2 HIS A 55 1.226 -11.650 -11.234 1.00 0.33 H new ATOM 0 HB3 HIS A 55 1.107 -13.200 -12.043 1.00 0.33 H new ATOM 0 HD2 HIS A 55 -0.605 -14.471 -10.728 1.00 0.40 H new ATOM 0 HE1 HIS A 55 0.797 -14.112 -6.799 1.00 0.32 H new ATOM 0 HE2 HIS A 55 -0.946 -15.188 -8.313 1.00 0.39 H new ATOM 829 N LYS A 56 2.957 -11.285 -13.292 1.00 0.36 N ATOM 830 CA LYS A 56 3.250 -10.859 -14.655 1.00 0.40 C ATOM 831 C LYS A 56 3.419 -9.343 -14.726 1.00 0.30 C ATOM 832 O LYS A 56 3.509 -8.672 -13.700 1.00 0.25 O ATOM 833 CB LYS A 56 2.134 -11.304 -15.602 1.00 0.46 C ATOM 834 CG LYS A 56 1.581 -12.682 -15.284 1.00 0.98 C ATOM 835 CD LYS A 56 0.371 -12.600 -14.370 1.00 0.76 C ATOM 836 CE LYS A 56 -0.823 -11.977 -15.078 1.00 1.05 C ATOM 837 NZ LYS A 56 -1.769 -13.010 -15.583 1.00 1.23 N ATOM 0 H LYS A 56 2.334 -10.660 -12.781 1.00 0.36 H new ATOM 0 HA LYS A 56 4.185 -11.326 -14.962 1.00 0.40 H new ATOM 0 HB2 LYS A 56 1.322 -10.577 -15.561 1.00 0.46 H new ATOM 0 HB3 LYS A 56 2.513 -11.301 -16.624 1.00 0.46 H new ATOM 0 HG2 LYS A 56 1.305 -13.187 -16.210 1.00 0.98 H new ATOM 0 HG3 LYS A 56 2.355 -13.285 -14.811 1.00 0.98 H new ATOM 0 HD2 LYS A 56 0.108 -13.599 -14.022 1.00 0.76 H new ATOM 0 HD3 LYS A 56 0.620 -12.011 -13.487 1.00 0.76 H new ATOM 0 HE2 LYS A 56 -1.345 -11.311 -14.391 1.00 1.05 H new ATOM 0 HE3 LYS A 56 -0.474 -11.366 -15.911 1.00 1.05 H new ATOM 0 HZ1 LYS A 56 -2.569 -12.545 -16.059 1.00 1.23 H new ATOM 0 HZ2 LYS A 56 -1.278 -13.631 -16.258 1.00 1.23 H new ATOM 0 HZ3 LYS A 56 -2.122 -13.577 -14.786 1.00 1.23 H new ATOM 851 N GLU A 57 3.459 -8.815 -15.945 1.00 0.38 N ATOM 852 CA GLU A 57 3.617 -7.380 -16.150 1.00 0.31 C ATOM 853 C GLU A 57 2.299 -6.746 -16.590 1.00 0.28 C ATOM 854 O GLU A 57 1.638 -7.236 -17.506 1.00 0.34 O ATOM 855 CB GLU A 57 4.700 -7.106 -17.193 1.00 0.34 C ATOM 856 CG GLU A 57 4.912 -5.629 -17.479 1.00 0.33 C ATOM 857 CD GLU A 57 5.779 -5.389 -18.699 1.00 0.69 C ATOM 858 OE1 GLU A 57 5.572 -6.077 -19.720 1.00 1.96 O ATOM 859 OE2 GLU A 57 6.666 -4.511 -18.632 1.00 1.49 O ATOM 0 H GLU A 57 3.384 -9.359 -16.805 1.00 0.38 H new ATOM 0 HA GLU A 57 3.917 -6.935 -15.202 1.00 0.31 H new ATOM 0 HB2 GLU A 57 5.640 -7.539 -16.851 1.00 0.34 H new ATOM 0 HB3 GLU A 57 4.435 -7.612 -18.121 1.00 0.34 H new ATOM 0 HG2 GLU A 57 3.945 -5.149 -17.625 1.00 0.33 H new ATOM 0 HG3 GLU A 57 5.374 -5.158 -16.611 1.00 0.33 H new ATOM 866 N SER A 58 1.925 -5.655 -15.930 1.00 0.24 N ATOM 867 CA SER A 58 0.686 -4.955 -16.250 1.00 0.26 C ATOM 868 C SER A 58 -0.484 -5.932 -16.330 1.00 0.31 C ATOM 869 O SER A 58 -0.992 -6.221 -17.413 1.00 0.53 O ATOM 870 CB SER A 58 0.826 -4.201 -17.573 1.00 0.30 C ATOM 871 OG SER A 58 1.810 -4.802 -18.399 1.00 1.16 O ATOM 0 H SER A 58 2.462 -5.236 -15.170 1.00 0.24 H new ATOM 0 HA SER A 58 0.487 -4.239 -15.453 1.00 0.26 H new ATOM 0 HB2 SER A 58 -0.132 -4.190 -18.092 1.00 0.30 H new ATOM 0 HB3 SER A 58 1.095 -3.163 -17.377 1.00 0.30 H new ATOM 0 HG SER A 58 1.537 -5.717 -18.620 1.00 1.16 H new ATOM 877 N SER A 59 -0.905 -6.436 -15.175 1.00 0.15 N ATOM 878 CA SER A 59 -2.013 -7.384 -15.113 1.00 0.18 C ATOM 879 C SER A 59 -3.093 -6.896 -14.153 1.00 0.15 C ATOM 880 O SER A 59 -4.283 -7.118 -14.375 1.00 0.15 O ATOM 881 CB SER A 59 -1.509 -8.761 -14.675 1.00 0.24 C ATOM 882 OG SER A 59 -0.912 -8.701 -13.390 1.00 0.25 O ATOM 0 H SER A 59 -0.497 -6.205 -14.269 1.00 0.15 H new ATOM 0 HA SER A 59 -2.447 -7.464 -16.110 1.00 0.18 H new ATOM 0 HB2 SER A 59 -2.339 -9.468 -14.661 1.00 0.24 H new ATOM 0 HB3 SER A 59 -0.784 -9.134 -15.399 1.00 0.24 H new ATOM 0 HG SER A 59 -1.608 -8.574 -12.712 1.00 0.25 H new ATOM 888 N PHE A 60 -2.668 -6.227 -13.085 1.00 0.13 N ATOM 889 CA PHE A 60 -3.598 -5.707 -12.089 1.00 0.12 C ATOM 890 C PHE A 60 -3.852 -4.218 -12.307 1.00 0.11 C ATOM 891 O PHE A 60 -2.928 -3.405 -12.247 1.00 0.12 O ATOM 892 CB PHE A 60 -3.052 -5.943 -10.679 1.00 0.13 C ATOM 893 CG PHE A 60 -2.885 -7.395 -10.336 1.00 0.13 C ATOM 894 CD1 PHE A 60 -3.947 -8.129 -9.833 1.00 1.34 C ATOM 895 CD2 PHE A 60 -1.665 -8.027 -10.516 1.00 1.47 C ATOM 896 CE1 PHE A 60 -3.797 -9.466 -9.517 1.00 1.34 C ATOM 897 CE2 PHE A 60 -1.509 -9.364 -10.201 1.00 1.48 C ATOM 898 CZ PHE A 60 -2.576 -10.084 -9.700 1.00 0.15 C ATOM 0 H PHE A 60 -1.686 -6.033 -12.888 1.00 0.13 H new ATOM 0 HA PHE A 60 -4.544 -6.238 -12.198 1.00 0.12 H new ATOM 0 HB2 PHE A 60 -2.089 -5.442 -10.583 1.00 0.13 H new ATOM 0 HB3 PHE A 60 -3.725 -5.482 -9.956 1.00 0.13 H new ATOM 0 HD1 PHE A 60 -4.904 -7.650 -9.686 1.00 1.34 H new ATOM 0 HD2 PHE A 60 -0.827 -7.469 -10.907 1.00 1.47 H new ATOM 0 HE1 PHE A 60 -4.634 -10.027 -9.127 1.00 1.34 H new ATOM 0 HE2 PHE A 60 -0.553 -9.845 -10.347 1.00 1.48 H new ATOM 0 HZ PHE A 60 -2.455 -11.128 -9.452 1.00 0.15 H new ATOM 908 N ASP A 61 -5.107 -3.869 -12.561 1.00 0.11 N ATOM 909 CA ASP A 61 -5.484 -2.478 -12.786 1.00 0.12 C ATOM 910 C ASP A 61 -5.418 -1.680 -11.489 1.00 0.11 C ATOM 911 O ASP A 61 -5.348 -0.450 -11.509 1.00 0.14 O ATOM 912 CB ASP A 61 -6.892 -2.398 -13.378 1.00 0.12 C ATOM 913 CG ASP A 61 -7.104 -3.391 -14.505 1.00 0.13 C ATOM 914 OD1 ASP A 61 -7.134 -4.607 -14.227 1.00 1.42 O ATOM 915 OD2 ASP A 61 -7.240 -2.948 -15.665 1.00 1.54 O ATOM 0 H ASP A 61 -5.882 -4.530 -12.616 1.00 0.11 H new ATOM 0 HA ASP A 61 -4.776 -2.046 -13.493 1.00 0.12 H new ATOM 0 HB2 ASP A 61 -7.624 -2.583 -12.592 1.00 0.12 H new ATOM 0 HB3 ASP A 61 -7.070 -1.389 -13.749 1.00 0.12 H new ATOM 920 N ILE A 62 -5.441 -2.386 -10.363 1.00 0.10 N ATOM 921 CA ILE A 62 -5.383 -1.742 -9.056 1.00 0.11 C ATOM 922 C ILE A 62 -4.621 -2.601 -8.054 1.00 0.10 C ATOM 923 O ILE A 62 -4.687 -3.830 -8.098 1.00 0.13 O ATOM 924 CB ILE A 62 -6.793 -1.458 -8.506 1.00 0.15 C ATOM 925 CG1 ILE A 62 -7.557 -0.530 -9.453 1.00 0.17 C ATOM 926 CG2 ILE A 62 -6.706 -0.850 -7.115 1.00 0.17 C ATOM 927 CD1 ILE A 62 -8.889 -0.070 -8.904 1.00 0.25 C ATOM 0 H ILE A 62 -5.499 -3.404 -10.330 1.00 0.10 H new ATOM 0 HA ILE A 62 -4.858 -0.796 -9.192 1.00 0.11 H new ATOM 0 HB ILE A 62 -7.336 -2.400 -8.436 1.00 0.15 H new ATOM 0 HG12 ILE A 62 -6.941 0.343 -9.668 1.00 0.17 H new ATOM 0 HG13 ILE A 62 -7.722 -1.045 -10.399 1.00 0.17 H new ATOM 0 HG21 ILE A 62 -7.711 -0.655 -6.740 1.00 0.17 H new ATOM 0 HG22 ILE A 62 -6.197 -1.544 -6.446 1.00 0.17 H new ATOM 0 HG23 ILE A 62 -6.148 0.085 -7.161 1.00 0.17 H new ATOM 0 HD11 ILE A 62 -9.375 0.584 -9.628 1.00 0.25 H new ATOM 0 HD12 ILE A 62 -9.523 -0.936 -8.715 1.00 0.25 H new ATOM 0 HD13 ILE A 62 -8.730 0.474 -7.973 1.00 0.25 H new ATOM 939 N ILE A 63 -3.899 -1.946 -7.151 1.00 0.10 N ATOM 940 CA ILE A 63 -3.127 -2.650 -6.135 1.00 0.09 C ATOM 941 C ILE A 63 -3.279 -1.986 -4.770 1.00 0.10 C ATOM 942 O ILE A 63 -3.075 -0.778 -4.629 1.00 0.15 O ATOM 943 CB ILE A 63 -1.633 -2.707 -6.502 1.00 0.09 C ATOM 944 CG1 ILE A 63 -1.428 -3.545 -7.765 1.00 0.11 C ATOM 945 CG2 ILE A 63 -0.824 -3.275 -5.345 1.00 0.10 C ATOM 946 CD1 ILE A 63 -1.518 -5.035 -7.522 1.00 0.16 C ATOM 0 H ILE A 63 -3.833 -0.929 -7.102 1.00 0.10 H new ATOM 0 HA ILE A 63 -3.520 -3.666 -6.088 1.00 0.09 H new ATOM 0 HB ILE A 63 -1.284 -1.694 -6.700 1.00 0.09 H new ATOM 0 HG12 ILE A 63 -2.175 -3.260 -8.506 1.00 0.11 H new ATOM 0 HG13 ILE A 63 -0.452 -3.313 -8.191 1.00 0.11 H new ATOM 0 HG21 ILE A 63 0.230 -3.309 -5.620 1.00 0.10 H new ATOM 0 HG22 ILE A 63 -0.950 -2.641 -4.467 1.00 0.10 H new ATOM 0 HG23 ILE A 63 -1.172 -4.283 -5.118 1.00 0.10 H new ATOM 0 HD11 ILE A 63 -1.363 -5.567 -8.461 1.00 0.16 H new ATOM 0 HD12 ILE A 63 -0.753 -5.334 -6.805 1.00 0.16 H new ATOM 0 HD13 ILE A 63 -2.503 -5.280 -7.125 1.00 0.16 H new ATOM 958 N LEU A 64 -3.636 -2.780 -3.768 1.00 0.09 N ATOM 959 CA LEU A 64 -3.813 -2.270 -2.412 1.00 0.10 C ATOM 960 C LEU A 64 -2.702 -2.767 -1.494 1.00 0.10 C ATOM 961 O LEU A 64 -2.318 -3.936 -1.544 1.00 0.12 O ATOM 962 CB LEU A 64 -5.175 -2.696 -1.861 1.00 0.13 C ATOM 963 CG LEU A 64 -6.398 -2.215 -2.645 1.00 0.15 C ATOM 964 CD1 LEU A 64 -6.224 -0.765 -3.068 1.00 0.18 C ATOM 965 CD2 LEU A 64 -6.634 -3.102 -3.859 1.00 0.17 C ATOM 0 H LEU A 64 -3.809 -3.780 -3.868 1.00 0.09 H new ATOM 0 HA LEU A 64 -3.767 -1.182 -2.450 1.00 0.10 H new ATOM 0 HB2 LEU A 64 -5.202 -3.785 -1.817 1.00 0.13 H new ATOM 0 HB3 LEU A 64 -5.260 -2.333 -0.837 1.00 0.13 H new ATOM 0 HG LEU A 64 -7.271 -2.280 -1.996 1.00 0.15 H new ATOM 0 HD11 LEU A 64 -7.103 -0.440 -3.624 1.00 0.18 H new ATOM 0 HD12 LEU A 64 -6.103 -0.140 -2.183 1.00 0.18 H new ATOM 0 HD13 LEU A 64 -5.341 -0.674 -3.700 1.00 0.18 H new ATOM 0 HD21 LEU A 64 -7.507 -2.746 -4.405 1.00 0.17 H new ATOM 0 HD22 LEU A 64 -5.760 -3.068 -4.510 1.00 0.17 H new ATOM 0 HD23 LEU A 64 -6.804 -4.128 -3.533 1.00 0.17 H new ATOM 977 N SER A 65 -2.192 -1.874 -0.653 1.00 0.10 N ATOM 978 CA SER A 65 -1.124 -2.220 0.276 1.00 0.11 C ATOM 979 C SER A 65 -1.467 -1.770 1.693 1.00 0.12 C ATOM 980 O SER A 65 -1.255 -0.613 2.056 1.00 0.17 O ATOM 981 CB SER A 65 0.195 -1.585 -0.168 1.00 0.11 C ATOM 982 OG SER A 65 0.143 -1.202 -1.532 1.00 0.14 O ATOM 0 H SER A 65 -2.502 -0.904 -0.596 1.00 0.10 H new ATOM 0 HA SER A 65 -1.015 -3.305 0.275 1.00 0.11 H new ATOM 0 HB2 SER A 65 0.409 -0.713 0.450 1.00 0.11 H new ATOM 0 HB3 SER A 65 1.011 -2.291 -0.016 1.00 0.11 H new ATOM 0 HG SER A 65 1.039 -0.946 -1.834 1.00 0.14 H new ATOM 988 N GLY A 66 -2.001 -2.691 2.488 1.00 0.10 N ATOM 989 CA GLY A 66 -2.366 -2.371 3.855 1.00 0.11 C ATOM 990 C GLY A 66 -3.287 -1.169 3.942 1.00 0.13 C ATOM 991 O GLY A 66 -2.859 -0.078 4.322 1.00 0.16 O ATOM 0 H GLY A 66 -2.188 -3.654 2.209 1.00 0.10 H new ATOM 0 HA2 GLY A 66 -2.855 -3.233 4.309 1.00 0.11 H new ATOM 0 HA3 GLY A 66 -1.463 -2.176 4.433 1.00 0.11 H new ATOM 995 N LEU A 67 -4.551 -1.367 3.588 1.00 0.14 N ATOM 996 CA LEU A 67 -5.535 -0.290 3.627 1.00 0.16 C ATOM 997 C LEU A 67 -6.525 -0.499 4.767 1.00 0.22 C ATOM 998 O LEU A 67 -7.725 -0.659 4.540 1.00 0.59 O ATOM 999 CB LEU A 67 -6.282 -0.207 2.294 1.00 0.16 C ATOM 1000 CG LEU A 67 -5.611 0.622 1.199 1.00 0.20 C ATOM 1001 CD1 LEU A 67 -5.625 2.099 1.565 1.00 0.23 C ATOM 1002 CD2 LEU A 67 -4.187 0.142 0.963 1.00 0.25 C ATOM 0 H LEU A 67 -4.920 -2.263 3.270 1.00 0.14 H new ATOM 0 HA LEU A 67 -5.006 0.647 3.798 1.00 0.16 H new ATOM 0 HB2 LEU A 67 -6.427 -1.220 1.918 1.00 0.16 H new ATOM 0 HB3 LEU A 67 -7.272 0.208 2.481 1.00 0.16 H new ATOM 0 HG LEU A 67 -6.174 0.492 0.275 1.00 0.20 H new ATOM 0 HD11 LEU A 67 -5.143 2.674 0.774 1.00 0.23 H new ATOM 0 HD12 LEU A 67 -6.655 2.435 1.682 1.00 0.23 H new ATOM 0 HD13 LEU A 67 -5.086 2.247 2.501 1.00 0.23 H new ATOM 0 HD21 LEU A 67 -3.725 0.744 0.180 1.00 0.25 H new ATOM 0 HD22 LEU A 67 -3.612 0.241 1.884 1.00 0.25 H new ATOM 0 HD23 LEU A 67 -4.202 -0.904 0.656 1.00 0.25 H new ATOM 1014 N VAL A 68 -6.017 -0.492 5.995 1.00 0.24 N ATOM 1015 CA VAL A 68 -6.858 -0.677 7.172 1.00 0.22 C ATOM 1016 C VAL A 68 -6.596 0.407 8.212 1.00 0.23 C ATOM 1017 O VAL A 68 -5.556 1.068 8.206 1.00 0.26 O ATOM 1018 CB VAL A 68 -6.628 -2.058 7.816 1.00 0.21 C ATOM 1019 CG1 VAL A 68 -7.675 -3.051 7.339 1.00 0.24 C ATOM 1020 CG2 VAL A 68 -5.224 -2.560 7.510 1.00 0.22 C ATOM 0 H VAL A 68 -5.027 -0.360 6.201 1.00 0.24 H new ATOM 0 HA VAL A 68 -7.892 -0.610 6.835 1.00 0.22 H new ATOM 0 HB VAL A 68 -6.726 -1.957 8.897 1.00 0.21 H new ATOM 0 HG11 VAL A 68 -7.496 -4.020 7.805 1.00 0.24 H new ATOM 0 HG12 VAL A 68 -8.667 -2.694 7.614 1.00 0.24 H new ATOM 0 HG13 VAL A 68 -7.614 -3.152 6.255 1.00 0.24 H new ATOM 0 HG21 VAL A 68 -5.078 -3.536 7.972 1.00 0.22 H new ATOM 0 HG22 VAL A 68 -5.096 -2.646 6.431 1.00 0.22 H new ATOM 0 HG23 VAL A 68 -4.492 -1.857 7.907 1.00 0.22 H new ATOM 1030 N PRO A 69 -7.559 0.596 9.126 1.00 0.22 N ATOM 1031 CA PRO A 69 -7.454 1.599 10.189 1.00 0.24 C ATOM 1032 C PRO A 69 -6.402 1.232 11.231 1.00 0.24 C ATOM 1033 O PRO A 69 -6.525 0.223 11.923 1.00 0.29 O ATOM 1034 CB PRO A 69 -8.850 1.598 10.818 1.00 0.25 C ATOM 1035 CG PRO A 69 -9.396 0.243 10.524 1.00 0.22 C ATOM 1036 CD PRO A 69 -8.824 -0.154 9.191 1.00 0.20 C ATOM 0 HA PRO A 69 -7.146 2.570 9.802 1.00 0.24 H new ATOM 0 HB2 PRO A 69 -8.801 1.781 11.891 1.00 0.25 H new ATOM 0 HB3 PRO A 69 -9.478 2.379 10.390 1.00 0.25 H new ATOM 0 HG2 PRO A 69 -9.111 -0.469 11.299 1.00 0.22 H new ATOM 0 HG3 PRO A 69 -10.485 0.260 10.492 1.00 0.22 H new ATOM 0 HD2 PRO A 69 -8.657 -1.229 9.129 1.00 0.20 H new ATOM 0 HD3 PRO A 69 -9.492 0.112 8.372 1.00 0.20 H new ATOM 1044 N GLY A 70 -5.367 2.061 11.336 1.00 0.21 N ATOM 1045 CA GLY A 70 -4.308 1.805 12.296 1.00 0.21 C ATOM 1046 C GLY A 70 -3.202 0.942 11.723 1.00 0.20 C ATOM 1047 O GLY A 70 -2.297 0.522 12.444 1.00 0.22 O ATOM 0 H GLY A 70 -5.243 2.904 10.775 1.00 0.21 H new ATOM 0 HA2 GLY A 70 -3.888 2.754 12.630 1.00 0.21 H new ATOM 0 HA3 GLY A 70 -4.729 1.315 13.174 1.00 0.21 H new ATOM 1051 N SER A 71 -3.275 0.677 10.424 1.00 0.20 N ATOM 1052 CA SER A 71 -2.273 -0.147 9.754 1.00 0.20 C ATOM 1053 C SER A 71 -0.873 0.415 9.977 1.00 0.20 C ATOM 1054 O SER A 71 -0.691 1.621 10.137 1.00 0.26 O ATOM 1055 CB SER A 71 -2.570 -0.230 8.255 1.00 0.23 C ATOM 1056 OG SER A 71 -1.835 0.743 7.536 1.00 0.71 O ATOM 0 H SER A 71 -4.016 1.020 9.813 1.00 0.20 H new ATOM 0 HA SER A 71 -2.316 -1.149 10.181 1.00 0.20 H new ATOM 0 HB2 SER A 71 -2.321 -1.225 7.886 1.00 0.23 H new ATOM 0 HB3 SER A 71 -3.637 -0.085 8.084 1.00 0.23 H new ATOM 0 HG SER A 71 -2.041 0.669 6.581 1.00 0.71 H new ATOM 1062 N THR A 72 0.119 -0.473 9.985 1.00 0.18 N ATOM 1063 CA THR A 72 1.505 -0.068 10.189 1.00 0.19 C ATOM 1064 C THR A 72 2.445 -0.850 9.278 1.00 0.19 C ATOM 1065 O THR A 72 2.673 -2.043 9.480 1.00 0.20 O ATOM 1066 CB THR A 72 1.940 -0.270 11.653 1.00 0.22 C ATOM 1067 OG1 THR A 72 2.028 -1.669 11.949 1.00 0.26 O ATOM 1068 CG2 THR A 72 0.957 0.393 12.606 1.00 0.22 C ATOM 0 H THR A 72 -0.012 -1.476 9.853 1.00 0.18 H new ATOM 0 HA THR A 72 1.564 0.992 9.944 1.00 0.19 H new ATOM 0 HB THR A 72 2.918 0.192 11.785 1.00 0.22 H new ATOM 0 HG1 THR A 72 1.556 -2.180 11.258 1.00 0.26 H new ATOM 0 HG21 THR A 72 1.285 0.237 13.634 1.00 0.22 H new ATOM 0 HG22 THR A 72 0.913 1.462 12.398 1.00 0.22 H new ATOM 0 HG23 THR A 72 -0.032 -0.044 12.471 1.00 0.22 H new ATOM 1076 N THR A 73 2.989 -0.170 8.274 1.00 0.20 N ATOM 1077 CA THR A 73 3.905 -0.801 7.331 1.00 0.21 C ATOM 1078 C THR A 73 4.702 0.242 6.558 1.00 0.22 C ATOM 1079 O THR A 73 4.245 1.370 6.362 1.00 0.29 O ATOM 1080 CB THR A 73 3.151 -1.700 6.333 1.00 0.20 C ATOM 1081 OG1 THR A 73 1.925 -2.158 6.913 1.00 0.24 O ATOM 1082 CG2 THR A 73 4.004 -2.894 5.928 1.00 0.22 C ATOM 0 H THR A 73 2.811 0.818 8.093 1.00 0.20 H new ATOM 0 HA THR A 73 4.589 -1.415 7.916 1.00 0.21 H new ATOM 0 HB THR A 73 2.932 -1.111 5.442 1.00 0.20 H new ATOM 0 HG1 THR A 73 2.098 -2.501 7.815 1.00 0.24 H new ATOM 0 HG21 THR A 73 3.450 -3.514 5.223 1.00 0.22 H new ATOM 0 HG22 THR A 73 4.923 -2.542 5.458 1.00 0.22 H new ATOM 0 HG23 THR A 73 4.251 -3.482 6.812 1.00 0.22 H new ATOM 1090 N LEU A 74 5.896 -0.139 6.118 1.00 0.18 N ATOM 1091 CA LEU A 74 6.758 0.764 5.364 1.00 0.19 C ATOM 1092 C LEU A 74 7.267 0.094 4.091 1.00 0.19 C ATOM 1093 O LEU A 74 8.193 -0.716 4.130 1.00 0.23 O ATOM 1094 CB LEU A 74 7.940 1.210 6.226 1.00 0.20 C ATOM 1095 CG LEU A 74 7.595 2.059 7.450 1.00 0.23 C ATOM 1096 CD1 LEU A 74 8.378 1.584 8.666 1.00 0.36 C ATOM 1097 CD2 LEU A 74 7.873 3.530 7.176 1.00 0.33 C ATOM 0 H LEU A 74 6.289 -1.068 6.271 1.00 0.18 H new ATOM 0 HA LEU A 74 6.170 1.638 5.083 1.00 0.19 H new ATOM 0 HB2 LEU A 74 8.473 0.321 6.564 1.00 0.20 H new ATOM 0 HB3 LEU A 74 8.629 1.776 5.598 1.00 0.20 H new ATOM 0 HG LEU A 74 6.531 1.945 7.659 1.00 0.23 H new ATOM 0 HD11 LEU A 74 8.120 2.199 9.528 1.00 0.36 H new ATOM 0 HD12 LEU A 74 8.129 0.544 8.875 1.00 0.36 H new ATOM 0 HD13 LEU A 74 9.446 1.668 8.467 1.00 0.36 H new ATOM 0 HD21 LEU A 74 7.621 4.118 8.058 1.00 0.33 H new ATOM 0 HD22 LEU A 74 8.929 3.663 6.940 1.00 0.33 H new ATOM 0 HD23 LEU A 74 7.268 3.864 6.333 1.00 0.33 H new ATOM 1109 N HIS A 75 6.655 0.440 2.962 1.00 0.18 N ATOM 1110 CA HIS A 75 7.048 -0.126 1.676 1.00 0.19 C ATOM 1111 C HIS A 75 8.324 0.533 1.160 1.00 0.21 C ATOM 1112 O HIS A 75 8.583 1.705 1.429 1.00 0.28 O ATOM 1113 CB HIS A 75 5.924 0.047 0.654 1.00 0.19 C ATOM 1114 CG HIS A 75 4.585 -0.400 1.156 1.00 0.17 C ATOM 1115 ND1 HIS A 75 3.808 0.359 2.004 1.00 0.18 N ATOM 1116 CD2 HIS A 75 3.886 -1.537 0.924 1.00 0.17 C ATOM 1117 CE1 HIS A 75 2.688 -0.291 2.273 1.00 0.17 C ATOM 1118 NE2 HIS A 75 2.712 -1.444 1.629 1.00 0.16 N ATOM 0 H HIS A 75 5.886 1.109 2.912 1.00 0.18 H new ATOM 0 HA HIS A 75 7.240 -1.189 1.819 1.00 0.19 H new ATOM 0 HB2 HIS A 75 5.863 1.097 0.367 1.00 0.19 H new ATOM 0 HB3 HIS A 75 6.172 -0.516 -0.246 1.00 0.19 H new ATOM 0 HD1 HIS A 75 4.058 1.279 2.368 1.00 0.18 H new ATOM 0 HD2 HIS A 75 4.195 -2.363 0.300 1.00 0.17 H new ATOM 0 HE1 HIS A 75 1.890 0.061 2.910 1.00 0.17 H new ATOM 1126 N SER A 76 9.119 -0.231 0.418 1.00 0.20 N ATOM 1127 CA SER A 76 10.372 0.276 -0.131 1.00 0.22 C ATOM 1128 C SER A 76 10.424 0.074 -1.643 1.00 0.21 C ATOM 1129 O SER A 76 9.500 -0.481 -2.237 1.00 0.22 O ATOM 1130 CB SER A 76 11.563 -0.421 0.530 1.00 0.23 C ATOM 1131 OG SER A 76 12.038 0.322 1.638 1.00 0.55 O ATOM 0 H SER A 76 8.918 -1.203 0.183 1.00 0.20 H new ATOM 0 HA SER A 76 10.425 1.345 0.077 1.00 0.22 H new ATOM 0 HB2 SER A 76 11.269 -1.419 0.856 1.00 0.23 H new ATOM 0 HB3 SER A 76 12.364 -0.547 -0.198 1.00 0.23 H new ATOM 0 HG SER A 76 12.798 -0.145 2.044 1.00 0.55 H new ATOM 1137 N ALA A 77 11.510 0.529 -2.258 1.00 0.23 N ATOM 1138 CA ALA A 77 11.685 0.397 -3.698 1.00 0.24 C ATOM 1139 C ALA A 77 11.455 -1.042 -4.149 1.00 0.24 C ATOM 1140 O ALA A 77 10.772 -1.288 -5.143 1.00 0.35 O ATOM 1141 CB ALA A 77 13.073 0.865 -4.108 1.00 0.26 C ATOM 0 H ALA A 77 12.283 0.993 -1.780 1.00 0.23 H new ATOM 0 HA ALA A 77 10.943 1.027 -4.188 1.00 0.24 H new ATOM 0 HB1 ALA A 77 13.188 0.760 -5.187 1.00 0.26 H new ATOM 0 HB2 ALA A 77 13.201 1.911 -3.829 1.00 0.26 H new ATOM 0 HB3 ALA A 77 13.825 0.260 -3.602 1.00 0.26 H new ATOM 1147 N GLU A 78 12.031 -1.987 -3.413 1.00 0.18 N ATOM 1148 CA GLU A 78 11.889 -3.401 -3.740 1.00 0.20 C ATOM 1149 C GLU A 78 10.417 -3.798 -3.813 1.00 0.20 C ATOM 1150 O GLU A 78 9.984 -4.441 -4.768 1.00 0.28 O ATOM 1151 CB GLU A 78 12.610 -4.262 -2.701 1.00 0.23 C ATOM 1152 CG GLU A 78 13.989 -4.724 -3.143 1.00 0.26 C ATOM 1153 CD GLU A 78 15.001 -4.701 -2.015 1.00 0.80 C ATOM 1154 OE1 GLU A 78 14.716 -5.291 -0.952 1.00 1.52 O ATOM 1155 OE2 GLU A 78 16.077 -4.094 -2.196 1.00 2.32 O ATOM 0 H GLU A 78 12.600 -1.800 -2.587 1.00 0.18 H new ATOM 0 HA GLU A 78 12.341 -3.569 -4.718 1.00 0.20 H new ATOM 0 HB2 GLU A 78 12.706 -3.695 -1.775 1.00 0.23 H new ATOM 0 HB3 GLU A 78 11.998 -5.136 -2.478 1.00 0.23 H new ATOM 0 HG2 GLU A 78 13.918 -5.736 -3.542 1.00 0.26 H new ATOM 0 HG3 GLU A 78 14.340 -4.085 -3.954 1.00 0.26 H new ATOM 1162 N ILE A 79 9.656 -3.411 -2.795 1.00 0.17 N ATOM 1163 CA ILE A 79 8.232 -3.726 -2.743 1.00 0.19 C ATOM 1164 C ILE A 79 7.463 -2.967 -3.819 1.00 0.19 C ATOM 1165 O ILE A 79 6.775 -3.567 -4.646 1.00 0.21 O ATOM 1166 CB ILE A 79 7.632 -3.391 -1.365 1.00 0.19 C ATOM 1167 CG1 ILE A 79 8.222 -4.307 -0.291 1.00 0.21 C ATOM 1168 CG2 ILE A 79 6.117 -3.519 -1.403 1.00 0.24 C ATOM 1169 CD1 ILE A 79 9.545 -3.820 0.260 1.00 0.21 C ATOM 0 H ILE A 79 10.000 -2.879 -1.995 1.00 0.17 H new ATOM 0 HA ILE A 79 8.138 -4.797 -2.920 1.00 0.19 H new ATOM 0 HB ILE A 79 7.885 -2.360 -1.116 1.00 0.19 H new ATOM 0 HG12 ILE A 79 7.509 -4.399 0.528 1.00 0.21 H new ATOM 0 HG13 ILE A 79 8.357 -5.304 -0.710 1.00 0.21 H new ATOM 0 HG21 ILE A 79 5.707 -3.279 -0.422 1.00 0.24 H new ATOM 0 HG22 ILE A 79 5.712 -2.830 -2.144 1.00 0.24 H new ATOM 0 HG23 ILE A 79 5.845 -4.540 -1.670 1.00 0.24 H new ATOM 0 HD11 ILE A 79 9.903 -4.518 1.016 1.00 0.21 H new ATOM 0 HD12 ILE A 79 10.274 -3.755 -0.548 1.00 0.21 H new ATOM 0 HD13 ILE A 79 9.412 -2.836 0.709 1.00 0.21 H new ATOM 1181 N LEU A 80 7.583 -1.644 -3.803 1.00 0.17 N ATOM 1182 CA LEU A 80 6.900 -0.803 -4.778 1.00 0.19 C ATOM 1183 C LEU A 80 7.159 -1.294 -6.199 1.00 0.20 C ATOM 1184 O LEU A 80 6.263 -1.291 -7.041 1.00 0.20 O ATOM 1185 CB LEU A 80 7.359 0.651 -4.637 1.00 0.19 C ATOM 1186 CG LEU A 80 7.061 1.321 -3.295 1.00 0.20 C ATOM 1187 CD1 LEU A 80 7.447 2.791 -3.337 1.00 0.21 C ATOM 1188 CD2 LEU A 80 5.591 1.164 -2.936 1.00 0.26 C ATOM 0 H LEU A 80 8.147 -1.131 -3.125 1.00 0.17 H new ATOM 0 HA LEU A 80 5.829 -0.861 -4.583 1.00 0.19 H new ATOM 0 HB2 LEU A 80 8.435 0.690 -4.809 1.00 0.19 H new ATOM 0 HB3 LEU A 80 6.889 1.238 -5.426 1.00 0.19 H new ATOM 0 HG LEU A 80 7.657 0.831 -2.525 1.00 0.20 H new ATOM 0 HD11 LEU A 80 7.228 3.252 -2.374 1.00 0.21 H new ATOM 0 HD12 LEU A 80 8.512 2.882 -3.549 1.00 0.21 H new ATOM 0 HD13 LEU A 80 6.878 3.295 -4.118 1.00 0.21 H new ATOM 0 HD21 LEU A 80 5.397 1.647 -1.978 1.00 0.26 H new ATOM 0 HD22 LEU A 80 4.976 1.628 -3.707 1.00 0.26 H new ATOM 0 HD23 LEU A 80 5.345 0.105 -2.865 1.00 0.26 H new ATOM 1200 N ALA A 81 8.393 -1.717 -6.457 1.00 0.24 N ATOM 1201 CA ALA A 81 8.770 -2.215 -7.774 1.00 0.27 C ATOM 1202 C ALA A 81 7.832 -3.329 -8.228 1.00 0.25 C ATOM 1203 O ALA A 81 7.212 -3.236 -9.286 1.00 0.27 O ATOM 1204 CB ALA A 81 10.210 -2.707 -7.760 1.00 0.31 C ATOM 0 H ALA A 81 9.148 -1.725 -5.771 1.00 0.24 H new ATOM 0 HA ALA A 81 8.686 -1.393 -8.485 1.00 0.27 H new ATOM 0 HB1 ALA A 81 10.478 -3.076 -8.750 1.00 0.31 H new ATOM 0 HB2 ALA A 81 10.873 -1.886 -7.487 1.00 0.31 H new ATOM 0 HB3 ALA A 81 10.312 -3.512 -7.033 1.00 0.31 H new ATOM 1210 N GLU A 82 7.737 -4.381 -7.422 1.00 0.24 N ATOM 1211 CA GLU A 82 6.876 -5.514 -7.743 1.00 0.23 C ATOM 1212 C GLU A 82 5.454 -5.048 -8.039 1.00 0.19 C ATOM 1213 O GLU A 82 4.813 -5.532 -8.973 1.00 0.21 O ATOM 1214 CB GLU A 82 6.865 -6.519 -6.589 1.00 0.25 C ATOM 1215 CG GLU A 82 7.458 -7.869 -6.952 1.00 0.32 C ATOM 1216 CD GLU A 82 8.456 -8.365 -5.924 1.00 1.71 C ATOM 1217 OE1 GLU A 82 8.234 -8.123 -4.719 1.00 2.93 O ATOM 1218 OE2 GLU A 82 9.458 -8.993 -6.325 1.00 2.55 O ATOM 0 H GLU A 82 8.245 -4.473 -6.542 1.00 0.24 H new ATOM 0 HA GLU A 82 7.275 -6.000 -8.634 1.00 0.23 H new ATOM 0 HB2 GLU A 82 7.421 -6.101 -5.749 1.00 0.25 H new ATOM 0 HB3 GLU A 82 5.838 -6.661 -6.252 1.00 0.25 H new ATOM 0 HG2 GLU A 82 6.655 -8.599 -7.054 1.00 0.32 H new ATOM 0 HG3 GLU A 82 7.948 -7.797 -7.923 1.00 0.32 H new ATOM 1225 N ILE A 83 4.966 -4.107 -7.239 1.00 0.15 N ATOM 1226 CA ILE A 83 3.619 -3.575 -7.415 1.00 0.13 C ATOM 1227 C ILE A 83 3.449 -2.961 -8.801 1.00 0.12 C ATOM 1228 O ILE A 83 2.715 -3.488 -9.638 1.00 0.12 O ATOM 1229 CB ILE A 83 3.290 -2.513 -6.351 1.00 0.13 C ATOM 1230 CG1 ILE A 83 3.491 -3.087 -4.946 1.00 0.13 C ATOM 1231 CG2 ILE A 83 1.863 -2.014 -6.525 1.00 0.15 C ATOM 1232 CD1 ILE A 83 2.519 -4.191 -4.600 1.00 0.21 C ATOM 0 H ILE A 83 5.483 -3.696 -6.462 1.00 0.15 H new ATOM 0 HA ILE A 83 2.931 -4.413 -7.304 1.00 0.13 H new ATOM 0 HB ILE A 83 3.968 -1.669 -6.479 1.00 0.13 H new ATOM 0 HG12 ILE A 83 4.508 -3.470 -4.861 1.00 0.13 H new ATOM 0 HG13 ILE A 83 3.390 -2.284 -4.216 1.00 0.13 H new ATOM 0 HG21 ILE A 83 1.645 -1.263 -5.765 1.00 0.15 H new ATOM 0 HG22 ILE A 83 1.750 -1.572 -7.515 1.00 0.15 H new ATOM 0 HG23 ILE A 83 1.170 -2.849 -6.420 1.00 0.15 H new ATOM 0 HD11 ILE A 83 2.720 -4.550 -3.591 1.00 0.21 H new ATOM 0 HD12 ILE A 83 1.500 -3.808 -4.653 1.00 0.21 H new ATOM 0 HD13 ILE A 83 2.635 -5.013 -5.307 1.00 0.21 H new ATOM 1244 N ALA A 84 4.132 -1.846 -9.036 1.00 0.14 N ATOM 1245 CA ALA A 84 4.059 -1.163 -10.321 1.00 0.15 C ATOM 1246 C ALA A 84 4.322 -2.128 -11.472 1.00 0.17 C ATOM 1247 O ALA A 84 3.749 -1.990 -12.553 1.00 0.23 O ATOM 1248 CB ALA A 84 5.049 -0.008 -10.362 1.00 0.18 C ATOM 0 H ALA A 84 4.742 -1.397 -8.353 1.00 0.14 H new ATOM 0 HA ALA A 84 3.050 -0.767 -10.437 1.00 0.15 H new ATOM 0 HB1 ALA A 84 4.984 0.493 -11.328 1.00 0.18 H new ATOM 0 HB2 ALA A 84 4.814 0.701 -9.568 1.00 0.18 H new ATOM 0 HB3 ALA A 84 6.060 -0.390 -10.219 1.00 0.18 H new ATOM 1254 N ARG A 85 5.190 -3.104 -11.233 1.00 0.17 N ATOM 1255 CA ARG A 85 5.529 -4.091 -12.251 1.00 0.19 C ATOM 1256 C ARG A 85 4.282 -4.822 -12.738 1.00 0.15 C ATOM 1257 O ARG A 85 3.987 -4.839 -13.933 1.00 0.18 O ATOM 1258 CB ARG A 85 6.646 -5.057 -11.789 1.00 0.21 C ATOM 1259 CG ARG A 85 6.869 -6.286 -12.693 1.00 0.37 C ATOM 1260 CD ARG A 85 7.369 -5.958 -14.107 1.00 0.49 C ATOM 1261 NE ARG A 85 8.815 -5.677 -14.129 1.00 0.91 N ATOM 1262 CZ ARG A 85 9.791 -6.604 -14.212 1.00 1.61 C ATOM 1263 NH1 ARG A 85 9.516 -7.917 -14.282 1.00 3.06 N ATOM 1264 NH2 ARG A 85 11.071 -6.209 -14.220 1.00 1.82 N ATOM 0 H ARG A 85 5.672 -3.233 -10.343 1.00 0.17 H new ATOM 0 HA ARG A 85 5.942 -3.554 -13.105 1.00 0.19 H new ATOM 0 HB2 ARG A 85 7.581 -4.500 -11.723 1.00 0.21 H new ATOM 0 HB3 ARG A 85 6.410 -5.404 -10.783 1.00 0.21 H new ATOM 0 HG2 ARG A 85 7.589 -6.948 -12.212 1.00 0.37 H new ATOM 0 HG3 ARG A 85 5.932 -6.837 -12.772 1.00 0.37 H new ATOM 0 HD2 ARG A 85 7.152 -6.794 -14.772 1.00 0.49 H new ATOM 0 HD3 ARG A 85 6.826 -5.095 -14.493 1.00 0.49 H new ATOM 0 HE ARG A 85 9.102 -4.700 -14.077 1.00 0.91 H new ATOM 0 HH11 ARG A 85 8.547 -8.236 -14.273 1.00 3.06 H new ATOM 0 HH12 ARG A 85 10.276 -8.595 -14.344 1.00 3.06 H new ATOM 0 HH21 ARG A 85 11.299 -5.216 -14.164 1.00 1.82 H new ATOM 0 HH22 ARG A 85 11.818 -6.901 -14.282 1.00 1.82 H new ATOM 1278 N ILE A 86 3.553 -5.425 -11.805 1.00 0.15 N ATOM 1279 CA ILE A 86 2.337 -6.155 -12.138 1.00 0.14 C ATOM 1280 C ILE A 86 1.161 -5.206 -12.331 1.00 0.15 C ATOM 1281 O ILE A 86 0.069 -5.623 -12.720 1.00 0.17 O ATOM 1282 CB ILE A 86 1.980 -7.182 -11.046 1.00 0.16 C ATOM 1283 CG1 ILE A 86 1.692 -6.472 -9.723 1.00 0.16 C ATOM 1284 CG2 ILE A 86 3.107 -8.190 -10.879 1.00 0.22 C ATOM 1285 CD1 ILE A 86 1.148 -7.389 -8.650 1.00 0.20 C ATOM 0 H ILE A 86 3.784 -5.422 -10.812 1.00 0.15 H new ATOM 0 HA ILE A 86 2.532 -6.682 -13.072 1.00 0.14 H new ATOM 0 HB ILE A 86 1.082 -7.718 -11.351 1.00 0.16 H new ATOM 0 HG12 ILE A 86 2.610 -6.008 -9.362 1.00 0.16 H new ATOM 0 HG13 ILE A 86 0.977 -5.669 -9.900 1.00 0.16 H new ATOM 0 HG21 ILE A 86 2.840 -8.909 -10.104 1.00 0.22 H new ATOM 0 HG22 ILE A 86 3.268 -8.715 -11.821 1.00 0.22 H new ATOM 0 HG23 ILE A 86 4.021 -7.670 -10.592 1.00 0.22 H new ATOM 0 HD11 ILE A 86 0.967 -6.817 -7.740 1.00 0.20 H new ATOM 0 HD12 ILE A 86 0.213 -7.833 -8.991 1.00 0.20 H new ATOM 0 HD13 ILE A 86 1.871 -8.178 -8.445 1.00 0.20 H new ATOM 1297 N LEU A 87 1.389 -3.926 -12.058 1.00 0.14 N ATOM 1298 CA LEU A 87 0.348 -2.914 -12.204 1.00 0.15 C ATOM 1299 C LEU A 87 0.139 -2.556 -13.672 1.00 0.17 C ATOM 1300 O LEU A 87 1.093 -2.256 -14.390 1.00 0.40 O ATOM 1301 CB LEU A 87 0.713 -1.660 -11.408 1.00 0.18 C ATOM 1302 CG LEU A 87 -0.432 -0.994 -10.645 1.00 0.18 C ATOM 1303 CD1 LEU A 87 0.066 0.238 -9.904 1.00 0.24 C ATOM 1304 CD2 LEU A 87 -1.564 -0.626 -11.594 1.00 0.17 C ATOM 0 H LEU A 87 2.286 -3.564 -11.734 1.00 0.14 H new ATOM 0 HA LEU A 87 -0.583 -3.326 -11.814 1.00 0.15 H new ATOM 0 HB2 LEU A 87 1.495 -1.921 -10.695 1.00 0.18 H new ATOM 0 HB3 LEU A 87 1.139 -0.929 -12.095 1.00 0.18 H new ATOM 0 HG LEU A 87 -0.816 -1.704 -9.912 1.00 0.18 H new ATOM 0 HD11 LEU A 87 -0.763 0.699 -9.367 1.00 0.24 H new ATOM 0 HD12 LEU A 87 0.841 -0.052 -9.195 1.00 0.24 H new ATOM 0 HD13 LEU A 87 0.477 0.951 -10.619 1.00 0.24 H new ATOM 0 HD21 LEU A 87 -2.370 -0.153 -11.033 1.00 0.17 H new ATOM 0 HD22 LEU A 87 -1.194 0.066 -12.351 1.00 0.17 H new ATOM 0 HD23 LEU A 87 -1.940 -1.527 -12.079 1.00 0.17 H new ATOM 1316 N ARG A 88 -1.115 -2.588 -14.111 1.00 0.17 N ATOM 1317 CA ARG A 88 -1.449 -2.265 -15.492 1.00 0.17 C ATOM 1318 C ARG A 88 -1.263 -0.775 -15.763 1.00 0.18 C ATOM 1319 O ARG A 88 -1.227 0.048 -14.848 1.00 0.17 O ATOM 1320 CB ARG A 88 -2.927 -2.634 -15.758 1.00 0.17 C ATOM 1321 CG ARG A 88 -3.091 -3.987 -16.442 1.00 0.20 C ATOM 1322 CD ARG A 88 -4.547 -4.310 -16.766 1.00 0.19 C ATOM 1323 NE ARG A 88 -4.649 -5.512 -17.607 1.00 0.31 N ATOM 1324 CZ ARG A 88 -5.750 -6.271 -17.761 1.00 1.14 C ATOM 1325 NH1 ARG A 88 -6.883 -6.017 -17.087 1.00 2.26 N ATOM 1326 NH2 ARG A 88 -5.716 -7.304 -18.614 1.00 1.14 N ATOM 0 H ARG A 88 -1.916 -2.834 -13.530 1.00 0.17 H new ATOM 0 HA ARG A 88 -0.787 -2.831 -16.147 1.00 0.17 H new ATOM 0 HB2 ARG A 88 -3.469 -2.643 -14.812 1.00 0.17 H new ATOM 0 HB3 ARG A 88 -3.382 -1.862 -16.379 1.00 0.17 H new ATOM 0 HG2 ARG A 88 -2.507 -3.997 -17.362 1.00 0.20 H new ATOM 0 HG3 ARG A 88 -2.685 -4.767 -15.798 1.00 0.20 H new ATOM 0 HD2 ARG A 88 -5.103 -4.461 -15.841 1.00 0.19 H new ATOM 0 HD3 ARG A 88 -5.005 -3.464 -17.279 1.00 0.19 H new ATOM 0 HE ARG A 88 -3.813 -5.795 -18.118 1.00 0.31 H new ATOM 0 HH11 ARG A 88 -6.925 -5.231 -16.438 1.00 2.26 H new ATOM 0 HH12 ARG A 88 -7.702 -6.610 -17.224 1.00 2.26 H new ATOM 0 HH21 ARG A 88 -4.863 -7.506 -19.136 1.00 1.14 H new ATOM 0 HH22 ARG A 88 -6.543 -7.888 -18.741 1.00 1.14 H new ATOM 1340 N PRO A 89 -1.139 -0.418 -17.050 1.00 0.21 N ATOM 1341 CA PRO A 89 -0.955 0.973 -17.472 1.00 0.23 C ATOM 1342 C PRO A 89 -2.207 1.816 -17.256 1.00 0.23 C ATOM 1343 O PRO A 89 -3.235 1.592 -17.892 1.00 0.25 O ATOM 1344 CB PRO A 89 -0.642 0.853 -18.966 1.00 0.27 C ATOM 1345 CG PRO A 89 -1.273 -0.431 -19.382 1.00 0.27 C ATOM 1346 CD PRO A 89 -1.173 -1.346 -18.193 1.00 0.23 C ATOM 0 HA PRO A 89 -0.175 1.472 -16.898 1.00 0.23 H new ATOM 0 HB2 PRO A 89 -1.051 1.695 -19.525 1.00 0.27 H new ATOM 0 HB3 PRO A 89 0.433 0.843 -19.146 1.00 0.27 H new ATOM 0 HG2 PRO A 89 -2.313 -0.279 -19.671 1.00 0.27 H new ATOM 0 HG3 PRO A 89 -0.761 -0.856 -20.245 1.00 0.27 H new ATOM 0 HD2 PRO A 89 -2.025 -2.024 -18.135 1.00 0.23 H new ATOM 0 HD3 PRO A 89 -0.276 -1.964 -18.236 1.00 0.23 H new ATOM 1354 N GLY A 90 -2.113 2.789 -16.354 1.00 0.22 N ATOM 1355 CA GLY A 90 -3.246 3.650 -16.071 1.00 0.22 C ATOM 1356 C GLY A 90 -4.005 3.221 -14.832 1.00 0.20 C ATOM 1357 O GLY A 90 -5.044 3.793 -14.502 1.00 0.21 O ATOM 0 H GLY A 90 -1.272 2.996 -15.815 1.00 0.22 H new ATOM 0 HA2 GLY A 90 -2.897 4.674 -15.943 1.00 0.22 H new ATOM 0 HA3 GLY A 90 -3.922 3.648 -16.926 1.00 0.22 H new ATOM 1361 N GLY A 91 -3.486 2.210 -14.141 1.00 0.17 N ATOM 1362 CA GLY A 91 -4.136 1.721 -12.940 1.00 0.14 C ATOM 1363 C GLY A 91 -3.933 2.645 -11.755 1.00 0.17 C ATOM 1364 O GLY A 91 -3.532 3.797 -11.919 1.00 0.20 O ATOM 0 H GLY A 91 -2.627 1.721 -14.392 1.00 0.17 H new ATOM 0 HA2 GLY A 91 -5.203 1.606 -13.129 1.00 0.14 H new ATOM 0 HA3 GLY A 91 -3.747 0.732 -12.697 1.00 0.14 H new ATOM 1368 N CYS A 92 -4.212 2.138 -10.558 1.00 0.19 N ATOM 1369 CA CYS A 92 -4.062 2.927 -9.340 1.00 0.23 C ATOM 1370 C CYS A 92 -3.426 2.096 -8.231 1.00 0.24 C ATOM 1371 O CYS A 92 -3.650 0.889 -8.137 1.00 0.36 O ATOM 1372 CB CYS A 92 -5.420 3.459 -8.882 1.00 0.25 C ATOM 1373 SG CYS A 92 -6.082 4.785 -9.917 1.00 0.40 S ATOM 0 H CYS A 92 -4.543 1.185 -10.406 1.00 0.19 H new ATOM 0 HA CYS A 92 -3.406 3.770 -9.559 1.00 0.23 H new ATOM 0 HB2 CYS A 92 -6.134 2.635 -8.865 1.00 0.25 H new ATOM 0 HB3 CYS A 92 -5.329 3.823 -7.859 1.00 0.25 H new ATOM 0 HG CYS A 92 -5.389 4.867 -11.014 1.00 0.40 H new ATOM 1379 N LEU A 93 -2.629 2.751 -7.393 1.00 0.17 N ATOM 1380 CA LEU A 93 -1.957 2.072 -6.290 1.00 0.18 C ATOM 1381 C LEU A 93 -2.185 2.813 -4.976 1.00 0.19 C ATOM 1382 O LEU A 93 -1.906 4.008 -4.867 1.00 0.40 O ATOM 1383 CB LEU A 93 -0.458 1.959 -6.571 1.00 0.23 C ATOM 1384 CG LEU A 93 0.396 1.386 -5.440 1.00 0.21 C ATOM 1385 CD1 LEU A 93 0.731 2.467 -4.423 1.00 0.27 C ATOM 1386 CD2 LEU A 93 -0.319 0.222 -4.767 1.00 0.14 C ATOM 0 H LEU A 93 -2.433 3.750 -7.456 1.00 0.17 H new ATOM 0 HA LEU A 93 -2.379 1.071 -6.201 1.00 0.18 H new ATOM 0 HB2 LEU A 93 -0.320 1.336 -7.455 1.00 0.23 H new ATOM 0 HB3 LEU A 93 -0.079 2.951 -6.818 1.00 0.23 H new ATOM 0 HG LEU A 93 1.328 1.016 -5.867 1.00 0.21 H new ATOM 0 HD11 LEU A 93 1.339 2.040 -3.625 1.00 0.27 H new ATOM 0 HD12 LEU A 93 1.285 3.268 -4.913 1.00 0.27 H new ATOM 0 HD13 LEU A 93 -0.191 2.868 -4.001 1.00 0.27 H new ATOM 0 HD21 LEU A 93 0.304 -0.173 -3.965 1.00 0.14 H new ATOM 0 HD22 LEU A 93 -1.267 0.567 -4.354 1.00 0.14 H new ATOM 0 HD23 LEU A 93 -0.507 -0.562 -5.500 1.00 0.14 H new ATOM 1398 N PHE A 94 -2.692 2.096 -3.978 1.00 0.13 N ATOM 1399 CA PHE A 94 -2.956 2.684 -2.671 1.00 0.11 C ATOM 1400 C PHE A 94 -2.179 1.955 -1.578 1.00 0.11 C ATOM 1401 O PHE A 94 -2.196 0.726 -1.506 1.00 0.11 O ATOM 1402 CB PHE A 94 -4.454 2.642 -2.362 1.00 0.10 C ATOM 1403 CG PHE A 94 -5.300 3.315 -3.405 1.00 0.12 C ATOM 1404 CD1 PHE A 94 -5.749 2.612 -4.511 1.00 1.78 C ATOM 1405 CD2 PHE A 94 -5.648 4.650 -3.278 1.00 1.88 C ATOM 1406 CE1 PHE A 94 -6.526 3.229 -5.472 1.00 1.76 C ATOM 1407 CE2 PHE A 94 -6.427 5.273 -4.235 1.00 1.91 C ATOM 1408 CZ PHE A 94 -6.868 4.560 -5.333 1.00 0.17 C ATOM 0 H PHE A 94 -2.928 1.106 -4.050 1.00 0.13 H new ATOM 0 HA PHE A 94 -2.626 3.723 -2.695 1.00 0.11 H new ATOM 0 HB2 PHE A 94 -4.768 1.603 -2.266 1.00 0.10 H new ATOM 0 HB3 PHE A 94 -4.632 3.119 -1.398 1.00 0.10 H new ATOM 0 HD1 PHE A 94 -5.489 1.570 -4.623 1.00 1.78 H new ATOM 0 HD2 PHE A 94 -5.306 5.211 -2.421 1.00 1.88 H new ATOM 0 HE1 PHE A 94 -6.866 2.671 -6.332 1.00 1.76 H new ATOM 0 HE2 PHE A 94 -6.690 6.315 -4.125 1.00 1.91 H new ATOM 0 HZ PHE A 94 -7.479 5.042 -6.081 1.00 0.17 H new ATOM 1418 N LEU A 95 -1.501 2.721 -0.732 1.00 0.12 N ATOM 1419 CA LEU A 95 -0.716 2.148 0.358 1.00 0.12 C ATOM 1420 C LEU A 95 -0.687 3.088 1.559 1.00 0.13 C ATOM 1421 O LEU A 95 -0.887 4.295 1.422 1.00 0.18 O ATOM 1422 CB LEU A 95 0.710 1.857 -0.114 1.00 0.12 C ATOM 1423 CG LEU A 95 1.351 2.919 -1.008 1.00 0.12 C ATOM 1424 CD1 LEU A 95 1.566 4.210 -0.234 1.00 0.12 C ATOM 1425 CD2 LEU A 95 2.667 2.411 -1.579 1.00 0.14 C ATOM 0 H LEU A 95 -1.478 3.740 -0.778 1.00 0.12 H new ATOM 0 HA LEU A 95 -1.188 1.214 0.663 1.00 0.12 H new ATOM 0 HB2 LEU A 95 1.341 1.721 0.764 1.00 0.12 H new ATOM 0 HB3 LEU A 95 0.706 0.910 -0.654 1.00 0.12 H new ATOM 0 HG LEU A 95 0.674 3.126 -1.837 1.00 0.12 H new ATOM 0 HD11 LEU A 95 2.023 4.954 -0.887 1.00 0.12 H new ATOM 0 HD12 LEU A 95 0.607 4.583 0.125 1.00 0.12 H new ATOM 0 HD13 LEU A 95 2.223 4.020 0.615 1.00 0.12 H new ATOM 0 HD21 LEU A 95 3.109 3.180 -2.213 1.00 0.14 H new ATOM 0 HD22 LEU A 95 3.351 2.175 -0.763 1.00 0.14 H new ATOM 0 HD23 LEU A 95 2.485 1.514 -2.170 1.00 0.14 H new ATOM 1437 N LYS A 96 -0.432 2.526 2.736 1.00 0.15 N ATOM 1438 CA LYS A 96 -0.372 3.312 3.963 1.00 0.17 C ATOM 1439 C LYS A 96 0.938 3.064 4.705 1.00 0.15 C ATOM 1440 O LYS A 96 1.300 1.919 4.975 1.00 0.15 O ATOM 1441 CB LYS A 96 -1.557 2.973 4.869 1.00 0.19 C ATOM 1442 CG LYS A 96 -2.678 3.996 4.814 1.00 1.36 C ATOM 1443 CD LYS A 96 -2.600 4.972 5.976 1.00 0.55 C ATOM 1444 CE LYS A 96 -3.715 4.731 6.981 1.00 0.77 C ATOM 1445 NZ LYS A 96 -3.787 3.304 7.396 1.00 2.04 N ATOM 0 H LYS A 96 -0.263 1.528 2.866 1.00 0.15 H new ATOM 0 HA LYS A 96 -0.421 4.367 3.692 1.00 0.17 H new ATOM 0 HB2 LYS A 96 -1.953 1.998 4.586 1.00 0.19 H new ATOM 0 HB3 LYS A 96 -1.205 2.888 5.897 1.00 0.19 H new ATOM 0 HG2 LYS A 96 -2.626 4.544 3.873 1.00 1.36 H new ATOM 0 HG3 LYS A 96 -3.640 3.484 4.832 1.00 1.36 H new ATOM 0 HD2 LYS A 96 -1.634 4.873 6.472 1.00 0.55 H new ATOM 0 HD3 LYS A 96 -2.662 5.993 5.600 1.00 0.55 H new ATOM 0 HE2 LYS A 96 -3.554 5.357 7.859 1.00 0.77 H new ATOM 0 HE3 LYS A 96 -4.668 5.031 6.545 1.00 0.77 H new ATOM 0 HZ1 LYS A 96 -4.114 3.245 8.381 1.00 2.04 H new ATOM 0 HZ2 LYS A 96 -4.453 2.796 6.779 1.00 2.04 H new ATOM 0 HZ3 LYS A 96 -2.844 2.872 7.318 1.00 2.04 H new ATOM 1459 N GLU A 97 1.642 4.144 5.030 1.00 0.14 N ATOM 1460 CA GLU A 97 2.910 4.039 5.742 1.00 0.13 C ATOM 1461 C GLU A 97 3.161 5.283 6.590 1.00 0.13 C ATOM 1462 O GLU A 97 2.776 6.396 6.233 1.00 0.12 O ATOM 1463 CB GLU A 97 4.061 3.843 4.752 1.00 0.13 C ATOM 1464 CG GLU A 97 4.342 5.064 3.893 1.00 0.26 C ATOM 1465 CD GLU A 97 5.794 5.498 3.952 1.00 1.05 C ATOM 1466 OE1 GLU A 97 6.598 4.990 3.145 1.00 2.33 O ATOM 1467 OE2 GLU A 97 6.124 6.345 4.807 1.00 2.22 O ATOM 0 H GLU A 97 1.357 5.099 4.812 1.00 0.14 H new ATOM 0 HA GLU A 97 2.857 3.174 6.403 1.00 0.13 H new ATOM 0 HB2 GLU A 97 4.964 3.583 5.305 1.00 0.13 H new ATOM 0 HB3 GLU A 97 3.830 2.998 4.103 1.00 0.13 H new ATOM 0 HG2 GLU A 97 4.074 4.846 2.859 1.00 0.26 H new ATOM 0 HG3 GLU A 97 3.707 5.887 4.220 1.00 0.26 H new ATOM 1474 N PRO A 98 3.826 5.092 7.739 1.00 0.15 N ATOM 1475 CA PRO A 98 4.143 6.186 8.661 1.00 0.15 C ATOM 1476 C PRO A 98 5.198 7.132 8.097 1.00 0.14 C ATOM 1477 O PRO A 98 6.142 6.700 7.433 1.00 0.18 O ATOM 1478 CB PRO A 98 4.681 5.461 9.897 1.00 0.19 C ATOM 1479 CG PRO A 98 5.205 4.166 9.381 1.00 0.20 C ATOM 1480 CD PRO A 98 4.316 3.791 8.227 1.00 0.17 C ATOM 0 HA PRO A 98 3.276 6.815 8.862 1.00 0.15 H new ATOM 0 HB2 PRO A 98 5.466 6.039 10.384 1.00 0.19 H new ATOM 0 HB3 PRO A 98 3.896 5.303 10.636 1.00 0.19 H new ATOM 0 HG2 PRO A 98 6.242 4.265 9.059 1.00 0.20 H new ATOM 0 HG3 PRO A 98 5.183 3.400 10.156 1.00 0.20 H new ATOM 0 HD2 PRO A 98 4.865 3.253 7.455 1.00 0.17 H new ATOM 0 HD3 PRO A 98 3.497 3.146 8.544 1.00 0.17 H new ATOM 1488 N VAL A 99 5.033 8.423 8.366 1.00 0.12 N ATOM 1489 CA VAL A 99 5.972 9.430 7.886 1.00 0.11 C ATOM 1490 C VAL A 99 6.471 10.305 9.030 1.00 0.12 C ATOM 1491 O VAL A 99 5.738 10.578 9.980 1.00 0.14 O ATOM 1492 CB VAL A 99 5.332 10.326 6.809 1.00 0.11 C ATOM 1493 CG1 VAL A 99 4.720 9.479 5.703 1.00 0.17 C ATOM 1494 CG2 VAL A 99 4.290 11.243 7.430 1.00 0.13 C ATOM 0 H VAL A 99 4.258 8.796 8.914 1.00 0.12 H new ATOM 0 HA VAL A 99 6.815 8.895 7.448 1.00 0.11 H new ATOM 0 HB VAL A 99 6.111 10.947 6.367 1.00 0.11 H new ATOM 0 HG11 VAL A 99 4.273 10.130 4.952 1.00 0.17 H new ATOM 0 HG12 VAL A 99 5.496 8.870 5.240 1.00 0.17 H new ATOM 0 HG13 VAL A 99 3.952 8.830 6.124 1.00 0.17 H new ATOM 0 HG21 VAL A 99 3.848 11.869 6.655 1.00 0.13 H new ATOM 0 HG22 VAL A 99 3.511 10.643 7.900 1.00 0.13 H new ATOM 0 HG23 VAL A 99 4.763 11.875 8.181 1.00 0.13 H new ATOM 1504 N GLU A 100 7.722 10.744 8.931 1.00 0.12 N ATOM 1505 CA GLU A 100 8.318 11.589 9.958 1.00 0.15 C ATOM 1506 C GLU A 100 8.415 13.036 9.485 1.00 0.24 C ATOM 1507 O GLU A 100 8.863 13.309 8.370 1.00 0.31 O ATOM 1508 CB GLU A 100 9.709 11.071 10.333 1.00 0.22 C ATOM 1509 CG GLU A 100 9.695 10.058 11.466 1.00 0.29 C ATOM 1510 CD GLU A 100 11.013 9.321 11.605 1.00 0.78 C ATOM 1511 OE1 GLU A 100 11.862 9.450 10.698 1.00 2.04 O ATOM 1512 OE2 GLU A 100 11.195 8.617 12.620 1.00 1.66 O ATOM 0 H GLU A 100 8.342 10.528 8.150 1.00 0.12 H new ATOM 0 HA GLU A 100 7.675 11.554 10.837 1.00 0.15 H new ATOM 0 HB2 GLU A 100 10.167 10.616 9.455 1.00 0.22 H new ATOM 0 HB3 GLU A 100 10.337 11.915 10.619 1.00 0.22 H new ATOM 0 HG2 GLU A 100 9.468 10.568 12.402 1.00 0.29 H new ATOM 0 HG3 GLU A 100 8.896 9.337 11.294 1.00 0.29 H new ATOM 1519 N THR A 101 7.989 13.962 10.339 1.00 0.27 N ATOM 1520 CA THR A 101 8.025 15.381 10.007 1.00 0.38 C ATOM 1521 C THR A 101 9.178 16.081 10.715 1.00 0.54 C ATOM 1522 O THR A 101 9.125 17.285 10.967 1.00 1.37 O ATOM 1523 CB THR A 101 6.705 16.078 10.385 1.00 0.49 C ATOM 1524 OG1 THR A 101 6.306 15.692 11.706 1.00 0.93 O ATOM 1525 CG2 THR A 101 5.605 15.729 9.394 1.00 0.67 C ATOM 0 H THR A 101 7.615 13.755 11.265 1.00 0.27 H new ATOM 0 HA THR A 101 8.169 15.451 8.929 1.00 0.38 H new ATOM 0 HB THR A 101 6.868 17.155 10.357 1.00 0.49 H new ATOM 0 HG1 THR A 101 6.018 14.755 11.700 1.00 0.93 H new ATOM 0 HG21 THR A 101 4.682 16.233 9.682 1.00 0.67 H new ATOM 0 HG22 THR A 101 5.899 16.053 8.395 1.00 0.67 H new ATOM 0 HG23 THR A 101 5.444 14.651 9.393 1.00 0.67 H new ATOM 1533 N ALA A 102 10.220 15.321 11.035 1.00 0.53 N ATOM 1534 CA ALA A 102 11.389 15.871 11.713 1.00 0.50 C ATOM 1535 C ALA A 102 12.640 15.063 11.392 1.00 0.55 C ATOM 1536 O ALA A 102 13.599 15.049 12.164 1.00 0.67 O ATOM 1537 CB ALA A 102 11.156 15.913 13.216 1.00 0.54 C ATOM 0 H ALA A 102 10.279 14.322 10.836 1.00 0.53 H new ATOM 0 HA ALA A 102 11.543 16.888 11.352 1.00 0.50 H new ATOM 0 HB1 ALA A 102 12.036 16.325 13.709 1.00 0.54 H new ATOM 0 HB2 ALA A 102 10.291 16.540 13.433 1.00 0.54 H new ATOM 0 HB3 ALA A 102 10.973 14.903 13.584 1.00 0.54 H new ATOM 1543 N VAL A 103 12.626 14.387 10.246 1.00 0.51 N ATOM 1544 CA VAL A 103 13.760 13.575 9.822 1.00 0.56 C ATOM 1545 C VAL A 103 13.951 13.644 8.312 1.00 0.56 C ATOM 1546 O VAL A 103 13.024 13.977 7.573 1.00 0.50 O ATOM 1547 CB VAL A 103 13.584 12.103 10.240 1.00 0.59 C ATOM 1548 CG1 VAL A 103 14.911 11.363 10.161 1.00 0.70 C ATOM 1549 CG2 VAL A 103 12.998 12.013 11.642 1.00 0.56 C ATOM 0 H VAL A 103 11.841 14.386 9.595 1.00 0.51 H new ATOM 0 HA VAL A 103 14.643 13.982 10.316 1.00 0.56 H new ATOM 0 HB VAL A 103 12.888 11.628 9.548 1.00 0.59 H new ATOM 0 HG11 VAL A 103 14.767 10.325 10.460 1.00 0.70 H new ATOM 0 HG12 VAL A 103 15.286 11.397 9.138 1.00 0.70 H new ATOM 0 HG13 VAL A 103 15.632 11.836 10.828 1.00 0.70 H new ATOM 0 HG21 VAL A 103 12.881 10.966 11.921 1.00 0.56 H new ATOM 0 HG22 VAL A 103 13.668 12.504 12.348 1.00 0.56 H new ATOM 0 HG23 VAL A 103 12.026 12.505 11.662 1.00 0.56 H new ATOM 1559 N ASP A 104 15.158 13.326 7.859 1.00 0.64 N ATOM 1560 CA ASP A 104 15.473 13.349 6.435 1.00 0.66 C ATOM 1561 C ASP A 104 14.549 12.413 5.660 1.00 0.55 C ATOM 1562 O ASP A 104 13.648 11.803 6.231 1.00 0.46 O ATOM 1563 CB ASP A 104 16.932 12.953 6.205 1.00 0.77 C ATOM 1564 CG ASP A 104 17.728 14.048 5.524 1.00 0.89 C ATOM 1565 OD1 ASP A 104 18.091 15.029 6.206 1.00 1.51 O ATOM 1566 OD2 ASP A 104 17.989 13.923 4.309 1.00 2.07 O ATOM 0 H ASP A 104 15.936 13.049 8.458 1.00 0.64 H new ATOM 0 HA ASP A 104 15.321 14.365 6.071 1.00 0.66 H new ATOM 0 HB2 ASP A 104 17.395 12.712 7.162 1.00 0.77 H new ATOM 0 HB3 ASP A 104 16.969 12.049 5.597 1.00 0.77 H new ATOM 1571 N ASN A 105 14.783 12.306 4.355 1.00 0.60 N ATOM 1572 CA ASN A 105 13.972 11.447 3.502 1.00 0.57 C ATOM 1573 C ASN A 105 14.213 9.975 3.825 1.00 0.47 C ATOM 1574 O ASN A 105 13.337 9.293 4.354 1.00 0.39 O ATOM 1575 CB ASN A 105 14.284 11.715 2.028 1.00 0.69 C ATOM 1576 CG ASN A 105 14.402 13.196 1.723 1.00 1.12 C ATOM 1577 OD1 ASN A 105 13.410 13.969 2.149 1.00 1.98 O flip ATOM 1578 ND2 ASN A 105 15.374 13.638 1.110 1.00 2.09 N flip ATOM 0 H ASN A 105 15.527 12.804 3.867 1.00 0.60 H new ATOM 0 HA ASN A 105 12.923 11.675 3.692 1.00 0.57 H new ATOM 0 HB2 ASN A 105 15.215 11.216 1.760 1.00 0.69 H new ATOM 0 HB3 ASN A 105 13.500 11.280 1.408 1.00 0.69 H new ATOM 0 HD21 ASN A 105 16.113 13.006 0.802 1.00 2.09 H new ATOM 0 HD22 ASN A 105 15.440 14.636 0.910 1.00 2.09 H new ATOM 1585 N ASN A 106 15.411 9.494 3.503 1.00 0.60 N ATOM 1586 CA ASN A 106 15.767 8.103 3.760 1.00 0.55 C ATOM 1587 C ASN A 106 15.608 7.764 5.238 1.00 0.48 C ATOM 1588 O ASN A 106 14.655 7.091 5.632 1.00 0.42 O ATOM 1589 CB ASN A 106 17.208 7.835 3.316 1.00 0.63 C ATOM 1590 CG ASN A 106 17.277 7.044 2.025 1.00 0.69 C ATOM 1591 OD1 ASN A 106 17.155 7.603 0.935 1.00 1.16 O ATOM 1592 ND2 ASN A 106 17.474 5.736 2.143 1.00 1.99 N ATOM 0 H ASN A 106 16.149 10.045 3.065 1.00 0.60 H new ATOM 0 HA ASN A 106 15.091 7.469 3.186 1.00 0.55 H new ATOM 0 HB2 ASN A 106 17.728 8.784 3.186 1.00 0.63 H new ATOM 0 HB3 ASN A 106 17.732 7.290 4.101 1.00 0.63 H new ATOM 0 HD21 ASN A 106 17.530 5.151 1.309 1.00 1.99 H new ATOM 0 HD22 ASN A 106 17.570 5.316 3.068 1.00 1.99 H new ATOM 1599 N SER A 107 16.547 8.234 6.053 1.00 0.52 N ATOM 1600 CA SER A 107 16.511 7.978 7.488 1.00 0.50 C ATOM 1601 C SER A 107 16.350 6.488 7.771 1.00 0.48 C ATOM 1602 O SER A 107 16.462 5.657 6.869 1.00 0.49 O ATOM 1603 CB SER A 107 15.370 8.761 8.140 1.00 0.46 C ATOM 1604 OG SER A 107 14.961 9.842 7.321 1.00 1.81 O ATOM 0 H SER A 107 17.342 8.794 5.744 1.00 0.52 H new ATOM 0 HA SER A 107 17.458 8.310 7.914 1.00 0.50 H new ATOM 0 HB2 SER A 107 14.525 8.097 8.320 1.00 0.46 H new ATOM 0 HB3 SER A 107 15.691 9.138 9.111 1.00 0.46 H new ATOM 0 HG SER A 107 14.025 10.062 7.513 1.00 1.81 H new ATOM 1610 N LYS A 108 16.081 6.157 9.029 1.00 0.48 N ATOM 1611 CA LYS A 108 15.901 4.767 9.433 1.00 0.52 C ATOM 1612 C LYS A 108 14.493 4.282 9.103 1.00 0.47 C ATOM 1613 O LYS A 108 14.170 3.109 9.289 1.00 0.55 O ATOM 1614 CB LYS A 108 16.167 4.612 10.933 1.00 0.60 C ATOM 1615 CG LYS A 108 15.306 5.515 11.799 1.00 0.59 C ATOM 1616 CD LYS A 108 16.123 6.179 12.894 1.00 0.97 C ATOM 1617 CE LYS A 108 16.610 7.557 12.469 1.00 1.80 C ATOM 1618 NZ LYS A 108 16.291 8.596 13.486 1.00 2.16 N ATOM 0 H LYS A 108 15.983 6.832 9.787 1.00 0.48 H new ATOM 0 HA LYS A 108 16.615 4.158 8.878 1.00 0.52 H new ATOM 0 HB2 LYS A 108 15.993 3.575 11.219 1.00 0.60 H new ATOM 0 HB3 LYS A 108 17.217 4.826 11.131 1.00 0.60 H new ATOM 0 HG2 LYS A 108 14.839 6.279 11.178 1.00 0.59 H new ATOM 0 HG3 LYS A 108 14.501 4.932 12.247 1.00 0.59 H new ATOM 0 HD2 LYS A 108 15.519 6.268 13.797 1.00 0.97 H new ATOM 0 HD3 LYS A 108 16.978 5.551 13.143 1.00 0.97 H new ATOM 0 HE2 LYS A 108 17.687 7.527 12.306 1.00 1.80 H new ATOM 0 HE3 LYS A 108 16.151 7.827 11.518 1.00 1.80 H new ATOM 0 HZ1 LYS A 108 16.639 9.520 13.159 1.00 2.16 H new ATOM 0 HZ2 LYS A 108 15.261 8.643 13.623 1.00 2.16 H new ATOM 0 HZ3 LYS A 108 16.750 8.352 14.387 1.00 2.16 H new ATOM 1632 N VAL A 109 13.659 5.193 8.608 1.00 0.38 N ATOM 1633 CA VAL A 109 12.287 4.858 8.249 1.00 0.35 C ATOM 1634 C VAL A 109 11.835 5.637 7.018 1.00 0.28 C ATOM 1635 O VAL A 109 12.334 6.728 6.743 1.00 0.33 O ATOM 1636 CB VAL A 109 11.317 5.144 9.410 1.00 0.34 C ATOM 1637 CG1 VAL A 109 11.918 4.694 10.733 1.00 0.51 C ATOM 1638 CG2 VAL A 109 10.961 6.623 9.453 1.00 0.19 C ATOM 0 H VAL A 109 13.911 6.168 8.447 1.00 0.38 H new ATOM 0 HA VAL A 109 12.270 3.791 8.026 1.00 0.35 H new ATOM 0 HB VAL A 109 10.401 4.577 9.243 1.00 0.34 H new ATOM 0 HG11 VAL A 109 11.218 4.905 11.541 1.00 0.51 H new ATOM 0 HG12 VAL A 109 12.118 3.623 10.696 1.00 0.51 H new ATOM 0 HG13 VAL A 109 12.849 5.231 10.911 1.00 0.51 H new ATOM 0 HG21 VAL A 109 10.275 6.808 10.279 1.00 0.19 H new ATOM 0 HG22 VAL A 109 11.867 7.211 9.595 1.00 0.19 H new ATOM 0 HG23 VAL A 109 10.486 6.910 8.515 1.00 0.19 H new ATOM 1648 N LYS A 110 10.886 5.070 6.281 1.00 0.33 N ATOM 1649 CA LYS A 110 10.364 5.711 5.081 1.00 0.34 C ATOM 1650 C LYS A 110 9.508 6.922 5.439 1.00 0.28 C ATOM 1651 O LYS A 110 8.399 6.779 5.958 1.00 0.31 O ATOM 1652 CB LYS A 110 9.541 4.714 4.261 1.00 0.47 C ATOM 1653 CG LYS A 110 9.788 4.805 2.766 1.00 0.82 C ATOM 1654 CD LYS A 110 11.230 4.473 2.419 1.00 1.45 C ATOM 1655 CE LYS A 110 11.310 3.464 1.283 1.00 1.30 C ATOM 1656 NZ LYS A 110 12.714 3.237 0.841 1.00 2.08 N ATOM 0 H LYS A 110 10.463 4.167 6.494 1.00 0.33 H new ATOM 0 HA LYS A 110 11.210 6.051 4.484 1.00 0.34 H new ATOM 0 HB2 LYS A 110 9.770 3.703 4.598 1.00 0.47 H new ATOM 0 HB3 LYS A 110 8.482 4.882 4.457 1.00 0.47 H new ATOM 0 HG2 LYS A 110 9.120 4.120 2.243 1.00 0.82 H new ATOM 0 HG3 LYS A 110 9.551 5.810 2.417 1.00 0.82 H new ATOM 0 HD2 LYS A 110 11.757 5.384 2.136 1.00 1.45 H new ATOM 0 HD3 LYS A 110 11.735 4.073 3.299 1.00 1.45 H new ATOM 0 HE2 LYS A 110 10.873 2.519 1.605 1.00 1.30 H new ATOM 0 HE3 LYS A 110 10.717 3.818 0.440 1.00 1.30 H new ATOM 0 HZ1 LYS A 110 12.792 3.429 -0.178 1.00 2.08 H new ATOM 0 HZ2 LYS A 110 13.349 3.874 1.363 1.00 2.08 H new ATOM 0 HZ3 LYS A 110 12.982 2.250 1.029 1.00 2.08 H new ATOM 1670 N THR A 111 10.025 8.113 5.158 1.00 0.26 N ATOM 1671 CA THR A 111 9.309 9.347 5.450 1.00 0.21 C ATOM 1672 C THR A 111 8.363 9.715 4.314 1.00 0.20 C ATOM 1673 O THR A 111 8.308 9.030 3.293 1.00 0.22 O ATOM 1674 CB THR A 111 10.280 10.517 5.694 1.00 0.23 C ATOM 1675 OG1 THR A 111 10.935 10.874 4.472 1.00 0.25 O ATOM 1676 CG2 THR A 111 11.318 10.149 6.743 1.00 0.27 C ATOM 0 H THR A 111 10.940 8.249 4.727 1.00 0.26 H new ATOM 0 HA THR A 111 8.732 9.170 6.357 1.00 0.21 H new ATOM 0 HB THR A 111 9.704 11.368 6.058 1.00 0.23 H new ATOM 0 HG1 THR A 111 11.749 10.338 4.368 1.00 0.25 H new ATOM 0 HG21 THR A 111 11.993 10.991 6.898 1.00 0.27 H new ATOM 0 HG22 THR A 111 10.818 9.907 7.681 1.00 0.27 H new ATOM 0 HG23 THR A 111 11.889 9.285 6.403 1.00 0.27 H new ATOM 1684 N ALA A 112 7.621 10.803 4.496 1.00 0.18 N ATOM 1685 CA ALA A 112 6.679 11.264 3.483 1.00 0.19 C ATOM 1686 C ALA A 112 7.369 11.452 2.136 1.00 0.24 C ATOM 1687 O ALA A 112 6.941 10.895 1.126 1.00 0.27 O ATOM 1688 CB ALA A 112 6.020 12.561 3.928 1.00 0.21 C ATOM 0 H ALA A 112 7.654 11.381 5.335 1.00 0.18 H new ATOM 0 HA ALA A 112 5.910 10.501 3.363 1.00 0.19 H new ATOM 0 HB1 ALA A 112 5.319 12.894 3.163 1.00 0.21 H new ATOM 0 HB2 ALA A 112 5.485 12.395 4.863 1.00 0.21 H new ATOM 0 HB3 ALA A 112 6.784 13.324 4.078 1.00 0.21 H new ATOM 1694 N SER A 113 8.439 12.241 2.132 1.00 0.28 N ATOM 1695 CA SER A 113 9.186 12.508 0.908 1.00 0.35 C ATOM 1696 C SER A 113 9.708 11.210 0.297 1.00 0.36 C ATOM 1697 O SER A 113 9.527 10.954 -0.894 1.00 0.38 O ATOM 1698 CB SER A 113 10.352 13.455 1.192 1.00 0.44 C ATOM 1699 OG SER A 113 10.034 14.355 2.240 1.00 0.48 O ATOM 0 H SER A 113 8.808 12.706 2.962 1.00 0.28 H new ATOM 0 HA SER A 113 8.510 12.980 0.195 1.00 0.35 H new ATOM 0 HB2 SER A 113 11.237 12.878 1.460 1.00 0.44 H new ATOM 0 HB3 SER A 113 10.598 14.015 0.290 1.00 0.44 H new ATOM 0 HG SER A 113 10.796 14.949 2.404 1.00 0.48 H new ATOM 1705 N LYS A 114 10.356 10.395 1.122 1.00 0.37 N ATOM 1706 CA LYS A 114 10.904 9.123 0.666 1.00 0.41 C ATOM 1707 C LYS A 114 9.817 8.254 0.042 1.00 0.37 C ATOM 1708 O LYS A 114 10.036 7.612 -0.987 1.00 0.39 O ATOM 1709 CB LYS A 114 11.559 8.380 1.832 1.00 0.45 C ATOM 1710 CG LYS A 114 12.946 7.846 1.513 1.00 0.51 C ATOM 1711 CD LYS A 114 12.932 6.968 0.272 1.00 0.62 C ATOM 1712 CE LYS A 114 14.243 6.215 0.108 1.00 1.12 C ATOM 1713 NZ LYS A 114 15.144 6.878 -0.875 1.00 1.81 N ATOM 0 H LYS A 114 10.515 10.593 2.110 1.00 0.37 H new ATOM 0 HA LYS A 114 11.657 9.332 -0.093 1.00 0.41 H new ATOM 0 HB2 LYS A 114 11.626 9.052 2.688 1.00 0.45 H new ATOM 0 HB3 LYS A 114 10.918 7.549 2.128 1.00 0.45 H new ATOM 0 HG2 LYS A 114 13.632 8.679 1.363 1.00 0.51 H new ATOM 0 HG3 LYS A 114 13.321 7.273 2.361 1.00 0.51 H new ATOM 0 HD2 LYS A 114 12.108 6.257 0.337 1.00 0.62 H new ATOM 0 HD3 LYS A 114 12.752 7.584 -0.609 1.00 0.62 H new ATOM 0 HE2 LYS A 114 14.746 6.147 1.073 1.00 1.12 H new ATOM 0 HE3 LYS A 114 14.038 5.195 -0.218 1.00 1.12 H new ATOM 0 HZ1 LYS A 114 15.429 6.192 -1.603 1.00 1.81 H new ATOM 0 HZ2 LYS A 114 14.644 7.671 -1.324 1.00 1.81 H new ATOM 0 HZ3 LYS A 114 15.989 7.235 -0.385 1.00 1.81 H new ATOM 1727 N LEU A 115 8.647 8.239 0.668 1.00 0.32 N ATOM 1728 CA LEU A 115 7.523 7.450 0.173 1.00 0.30 C ATOM 1729 C LEU A 115 7.102 7.914 -1.217 1.00 0.28 C ATOM 1730 O LEU A 115 7.039 7.120 -2.156 1.00 0.31 O ATOM 1731 CB LEU A 115 6.340 7.549 1.137 1.00 0.26 C ATOM 1732 CG LEU A 115 5.122 6.692 0.794 1.00 0.30 C ATOM 1733 CD1 LEU A 115 4.271 7.372 -0.267 1.00 0.33 C ATOM 1734 CD2 LEU A 115 5.556 5.311 0.326 1.00 0.38 C ATOM 0 H LEU A 115 8.450 8.764 1.520 1.00 0.32 H new ATOM 0 HA LEU A 115 7.843 6.410 0.107 1.00 0.30 H new ATOM 0 HB2 LEU A 115 6.685 7.273 2.133 1.00 0.26 H new ATOM 0 HB3 LEU A 115 6.024 8.591 1.187 1.00 0.26 H new ATOM 0 HG LEU A 115 4.519 6.576 1.695 1.00 0.30 H new ATOM 0 HD11 LEU A 115 3.409 6.746 -0.498 1.00 0.33 H new ATOM 0 HD12 LEU A 115 3.929 8.338 0.105 1.00 0.33 H new ATOM 0 HD13 LEU A 115 4.864 7.520 -1.170 1.00 0.33 H new ATOM 0 HD21 LEU A 115 4.676 4.715 0.086 1.00 0.38 H new ATOM 0 HD22 LEU A 115 6.182 5.407 -0.561 1.00 0.38 H new ATOM 0 HD23 LEU A 115 6.122 4.820 1.117 1.00 0.38 H new ATOM 1746 N CYS A 116 6.816 9.206 -1.341 1.00 0.24 N ATOM 1747 CA CYS A 116 6.402 9.779 -2.617 1.00 0.25 C ATOM 1748 C CYS A 116 7.466 9.553 -3.685 1.00 0.31 C ATOM 1749 O CYS A 116 7.167 9.105 -4.792 1.00 0.34 O ATOM 1750 CB CYS A 116 6.124 11.274 -2.464 1.00 0.28 C ATOM 1751 SG CYS A 116 4.971 11.678 -1.132 1.00 0.27 S ATOM 0 H CYS A 116 6.863 9.876 -0.573 1.00 0.24 H new ATOM 0 HA CYS A 116 5.486 9.278 -2.931 1.00 0.25 H new ATOM 0 HB2 CYS A 116 7.066 11.791 -2.284 1.00 0.28 H new ATOM 0 HB3 CYS A 116 5.725 11.656 -3.404 1.00 0.28 H new ATOM 0 HG CYS A 116 5.534 11.442 0.016 1.00 0.27 H new ATOM 1757 N SER A 117 8.713 9.870 -3.347 1.00 0.32 N ATOM 1758 CA SER A 117 9.823 9.707 -4.278 1.00 0.37 C ATOM 1759 C SER A 117 9.972 8.248 -4.696 1.00 0.35 C ATOM 1760 O SER A 117 10.122 7.942 -5.880 1.00 0.34 O ATOM 1761 CB SER A 117 11.124 10.203 -3.647 1.00 0.45 C ATOM 1762 OG SER A 117 11.807 11.090 -4.515 1.00 0.55 O ATOM 0 H SER A 117 8.979 10.241 -2.435 1.00 0.32 H new ATOM 0 HA SER A 117 9.609 10.302 -5.166 1.00 0.37 H new ATOM 0 HB2 SER A 117 10.906 10.707 -2.705 1.00 0.45 H new ATOM 0 HB3 SER A 117 11.765 9.353 -3.413 1.00 0.45 H new ATOM 0 HG SER A 117 12.635 11.394 -4.087 1.00 0.55 H new ATOM 1768 N ALA A 118 9.929 7.350 -3.718 1.00 0.34 N ATOM 1769 CA ALA A 118 10.057 5.923 -3.982 1.00 0.34 C ATOM 1770 C ALA A 118 8.929 5.429 -4.882 1.00 0.29 C ATOM 1771 O ALA A 118 9.158 4.657 -5.815 1.00 0.33 O ATOM 1772 CB ALA A 118 10.074 5.143 -2.675 1.00 0.36 C ATOM 0 H ALA A 118 9.806 7.586 -2.733 1.00 0.34 H new ATOM 0 HA ALA A 118 11.001 5.757 -4.502 1.00 0.34 H new ATOM 0 HB1 ALA A 118 10.170 4.078 -2.888 1.00 0.36 H new ATOM 0 HB2 ALA A 118 10.918 5.469 -2.068 1.00 0.36 H new ATOM 0 HB3 ALA A 118 9.146 5.322 -2.132 1.00 0.36 H new ATOM 1778 N LEU A 119 7.710 5.876 -4.595 1.00 0.23 N ATOM 1779 CA LEU A 119 6.546 5.477 -5.378 1.00 0.19 C ATOM 1780 C LEU A 119 6.667 5.962 -6.819 1.00 0.20 C ATOM 1781 O LEU A 119 6.534 5.181 -7.763 1.00 0.22 O ATOM 1782 CB LEU A 119 5.269 6.032 -4.747 1.00 0.15 C ATOM 1783 CG LEU A 119 3.973 5.300 -5.098 1.00 0.20 C ATOM 1784 CD1 LEU A 119 4.077 3.827 -4.733 1.00 0.29 C ATOM 1785 CD2 LEU A 119 2.788 5.943 -4.393 1.00 0.21 C ATOM 0 H LEU A 119 7.503 6.514 -3.827 1.00 0.23 H new ATOM 0 HA LEU A 119 6.498 4.388 -5.384 1.00 0.19 H new ATOM 0 HB2 LEU A 119 5.388 6.019 -3.664 1.00 0.15 H new ATOM 0 HB3 LEU A 119 5.165 7.076 -5.044 1.00 0.15 H new ATOM 0 HG LEU A 119 3.815 5.377 -6.174 1.00 0.20 H new ATOM 0 HD11 LEU A 119 3.146 3.322 -4.990 1.00 0.29 H new ATOM 0 HD12 LEU A 119 4.900 3.373 -5.284 1.00 0.29 H new ATOM 0 HD13 LEU A 119 4.260 3.729 -3.663 1.00 0.29 H new ATOM 0 HD21 LEU A 119 1.875 5.408 -4.655 1.00 0.21 H new ATOM 0 HD22 LEU A 119 2.938 5.898 -3.314 1.00 0.21 H new ATOM 0 HD23 LEU A 119 2.701 6.984 -4.704 1.00 0.21 H new ATOM 1797 N THR A 120 6.924 7.257 -6.982 1.00 0.22 N ATOM 1798 CA THR A 120 7.063 7.846 -8.309 1.00 0.25 C ATOM 1799 C THR A 120 8.287 7.294 -9.029 1.00 0.29 C ATOM 1800 O THR A 120 8.347 7.291 -10.259 1.00 0.33 O ATOM 1801 CB THR A 120 7.176 9.381 -8.231 1.00 0.26 C ATOM 1802 OG1 THR A 120 5.991 9.931 -7.644 1.00 0.24 O ATOM 1803 CG2 THR A 120 7.387 9.979 -9.615 1.00 0.30 C ATOM 0 H THR A 120 7.040 7.917 -6.213 1.00 0.22 H new ATOM 0 HA THR A 120 6.166 7.582 -8.869 1.00 0.25 H new ATOM 0 HB THR A 120 8.037 9.629 -7.610 1.00 0.26 H new ATOM 0 HG1 THR A 120 6.031 9.829 -6.670 1.00 0.24 H new ATOM 0 HG21 THR A 120 7.464 11.063 -9.535 1.00 0.30 H new ATOM 0 HG22 THR A 120 8.305 9.581 -10.047 1.00 0.30 H new ATOM 0 HG23 THR A 120 6.543 9.721 -10.255 1.00 0.30 H new ATOM 1811 N LEU A 121 9.262 6.826 -8.257 1.00 0.36 N ATOM 1812 CA LEU A 121 10.487 6.269 -8.822 1.00 0.41 C ATOM 1813 C LEU A 121 10.305 4.794 -9.165 1.00 0.33 C ATOM 1814 O LEU A 121 11.103 4.216 -9.905 1.00 0.32 O ATOM 1815 CB LEU A 121 11.647 6.439 -7.843 1.00 0.58 C ATOM 1816 CG LEU A 121 12.293 7.825 -7.800 1.00 0.71 C ATOM 1817 CD1 LEU A 121 13.142 7.980 -6.547 1.00 0.87 C ATOM 1818 CD2 LEU A 121 13.133 8.061 -9.047 1.00 0.79 C ATOM 0 H LEU A 121 9.228 6.821 -7.238 1.00 0.36 H new ATOM 0 HA LEU A 121 10.715 6.811 -9.740 1.00 0.41 H new ATOM 0 HB2 LEU A 121 11.290 6.196 -6.842 1.00 0.58 H new ATOM 0 HB3 LEU A 121 12.417 5.709 -8.093 1.00 0.58 H new ATOM 0 HG LEU A 121 11.501 8.573 -7.772 1.00 0.71 H new ATOM 0 HD11 LEU A 121 13.593 8.972 -6.534 1.00 0.87 H new ATOM 0 HD12 LEU A 121 12.514 7.855 -5.665 1.00 0.87 H new ATOM 0 HD13 LEU A 121 13.927 7.224 -6.544 1.00 0.87 H new ATOM 0 HD21 LEU A 121 13.585 9.052 -8.999 1.00 0.79 H new ATOM 0 HD22 LEU A 121 13.918 7.307 -9.105 1.00 0.79 H new ATOM 0 HD23 LEU A 121 12.499 7.994 -9.931 1.00 0.79 H new ATOM 1830 N SER A 122 9.252 4.191 -8.624 1.00 0.32 N ATOM 1831 CA SER A 122 8.967 2.781 -8.872 1.00 0.35 C ATOM 1832 C SER A 122 8.211 2.602 -10.185 1.00 0.29 C ATOM 1833 O SER A 122 7.801 1.496 -10.532 1.00 0.39 O ATOM 1834 CB SER A 122 8.154 2.194 -7.717 1.00 0.44 C ATOM 1835 OG SER A 122 6.798 2.599 -7.791 1.00 2.34 O ATOM 0 H SER A 122 8.582 4.655 -8.011 1.00 0.32 H new ATOM 0 HA SER A 122 9.916 2.250 -8.945 1.00 0.35 H new ATOM 0 HB2 SER A 122 8.214 1.106 -7.742 1.00 0.44 H new ATOM 0 HB3 SER A 122 8.581 2.515 -6.767 1.00 0.44 H new ATOM 0 HG SER A 122 6.728 3.551 -7.570 1.00 2.34 H new ATOM 1841 N GLY A 123 8.030 3.702 -10.910 1.00 0.21 N ATOM 1842 CA GLY A 123 7.323 3.645 -12.177 1.00 0.29 C ATOM 1843 C GLY A 123 5.945 4.271 -12.100 1.00 0.31 C ATOM 1844 O GLY A 123 5.248 4.382 -13.109 1.00 0.59 O ATOM 0 H GLY A 123 8.359 4.630 -10.644 1.00 0.21 H new ATOM 0 HA2 GLY A 123 7.909 4.157 -12.940 1.00 0.29 H new ATOM 0 HA3 GLY A 123 7.229 2.605 -12.491 1.00 0.29 H new ATOM 1848 N LEU A 124 5.549 4.680 -10.900 1.00 0.17 N ATOM 1849 CA LEU A 124 4.243 5.297 -10.694 1.00 0.17 C ATOM 1850 C LEU A 124 4.304 6.799 -10.953 1.00 0.16 C ATOM 1851 O LEU A 124 5.383 7.372 -11.097 1.00 0.17 O ATOM 1852 CB LEU A 124 3.752 5.034 -9.269 1.00 0.17 C ATOM 1853 CG LEU A 124 2.481 4.194 -9.142 1.00 0.24 C ATOM 1854 CD1 LEU A 124 2.582 2.941 -9.999 1.00 0.25 C ATOM 1855 CD2 LEU A 124 2.227 3.827 -7.687 1.00 0.30 C ATOM 0 H LEU A 124 6.113 4.596 -10.055 1.00 0.17 H new ATOM 0 HA LEU A 124 3.543 4.853 -11.401 1.00 0.17 H new ATOM 0 HB2 LEU A 124 4.549 4.536 -8.717 1.00 0.17 H new ATOM 0 HB3 LEU A 124 3.579 5.994 -8.783 1.00 0.17 H new ATOM 0 HG LEU A 124 1.639 4.787 -9.499 1.00 0.24 H new ATOM 0 HD11 LEU A 124 1.669 2.355 -9.896 1.00 0.25 H new ATOM 0 HD12 LEU A 124 2.716 3.224 -11.043 1.00 0.25 H new ATOM 0 HD13 LEU A 124 3.434 2.345 -9.673 1.00 0.25 H new ATOM 0 HD21 LEU A 124 1.318 3.229 -7.616 1.00 0.30 H new ATOM 0 HD22 LEU A 124 3.070 3.252 -7.304 1.00 0.30 H new ATOM 0 HD23 LEU A 124 2.110 4.736 -7.097 1.00 0.30 H new ATOM 1867 N VAL A 125 3.135 7.432 -11.011 1.00 0.16 N ATOM 1868 CA VAL A 125 3.056 8.867 -11.250 1.00 0.17 C ATOM 1869 C VAL A 125 1.832 9.471 -10.569 1.00 0.17 C ATOM 1870 O VAL A 125 0.966 8.748 -10.075 1.00 0.17 O ATOM 1871 CB VAL A 125 2.999 9.184 -12.757 1.00 0.19 C ATOM 1872 CG1 VAL A 125 4.289 8.757 -13.440 1.00 0.23 C ATOM 1873 CG2 VAL A 125 1.797 8.507 -13.398 1.00 0.20 C ATOM 0 H VAL A 125 2.232 6.973 -10.896 1.00 0.16 H new ATOM 0 HA VAL A 125 3.959 9.308 -10.827 1.00 0.17 H new ATOM 0 HB VAL A 125 2.889 10.261 -12.881 1.00 0.19 H new ATOM 0 HG11 VAL A 125 4.231 8.988 -14.504 1.00 0.23 H new ATOM 0 HG12 VAL A 125 5.129 9.292 -12.997 1.00 0.23 H new ATOM 0 HG13 VAL A 125 4.432 7.684 -13.309 1.00 0.23 H new ATOM 0 HG21 VAL A 125 1.772 8.741 -14.462 1.00 0.20 H new ATOM 0 HG22 VAL A 125 1.874 7.428 -13.266 1.00 0.20 H new ATOM 0 HG23 VAL A 125 0.883 8.866 -12.926 1.00 0.20 H new ATOM 1883 N GLU A 126 1.767 10.798 -10.548 1.00 0.20 N ATOM 1884 CA GLU A 126 0.649 11.498 -9.928 1.00 0.23 C ATOM 1885 C GLU A 126 0.418 11.001 -8.504 1.00 0.20 C ATOM 1886 O GLU A 126 -0.716 10.753 -8.097 1.00 0.20 O ATOM 1887 CB GLU A 126 -0.623 11.309 -10.758 1.00 0.26 C ATOM 1888 CG GLU A 126 -0.391 11.401 -12.256 1.00 0.28 C ATOM 1889 CD GLU A 126 -1.422 12.269 -12.954 1.00 0.93 C ATOM 1890 OE1 GLU A 126 -1.232 13.501 -12.993 1.00 2.43 O ATOM 1891 OE2 GLU A 126 -2.418 11.712 -13.462 1.00 1.38 O ATOM 0 H GLU A 126 2.475 11.410 -10.953 1.00 0.20 H new ATOM 0 HA GLU A 126 0.895 12.559 -9.889 1.00 0.23 H new ATOM 0 HB2 GLU A 126 -1.058 10.337 -10.525 1.00 0.26 H new ATOM 0 HB3 GLU A 126 -1.353 12.063 -10.465 1.00 0.26 H new ATOM 0 HG2 GLU A 126 0.604 11.805 -12.442 1.00 0.28 H new ATOM 0 HG3 GLU A 126 -0.414 10.400 -12.686 1.00 0.28 H new ATOM 1898 N VAL A 127 1.504 10.858 -7.750 1.00 0.19 N ATOM 1899 CA VAL A 127 1.422 10.390 -6.372 1.00 0.18 C ATOM 1900 C VAL A 127 1.021 11.522 -5.432 1.00 0.24 C ATOM 1901 O VAL A 127 1.451 12.663 -5.597 1.00 0.32 O ATOM 1902 CB VAL A 127 2.763 9.797 -5.899 1.00 0.21 C ATOM 1903 CG1 VAL A 127 2.672 9.361 -4.445 1.00 0.24 C ATOM 1904 CG2 VAL A 127 3.172 8.632 -6.789 1.00 0.23 C ATOM 0 H VAL A 127 2.451 11.060 -8.071 1.00 0.19 H new ATOM 0 HA VAL A 127 0.660 9.611 -6.347 1.00 0.18 H new ATOM 0 HB VAL A 127 3.529 10.569 -5.974 1.00 0.21 H new ATOM 0 HG11 VAL A 127 3.629 8.945 -4.129 1.00 0.24 H new ATOM 0 HG12 VAL A 127 2.427 10.221 -3.822 1.00 0.24 H new ATOM 0 HG13 VAL A 127 1.895 8.604 -4.340 1.00 0.24 H new ATOM 0 HG21 VAL A 127 4.121 8.224 -6.441 1.00 0.23 H new ATOM 0 HG22 VAL A 127 2.407 7.856 -6.748 1.00 0.23 H new ATOM 0 HG23 VAL A 127 3.281 8.980 -7.816 1.00 0.23 H new ATOM 1914 N LYS A 128 0.193 11.196 -4.444 1.00 0.21 N ATOM 1915 CA LYS A 128 -0.267 12.183 -3.474 1.00 0.27 C ATOM 1916 C LYS A 128 -1.000 11.510 -2.318 1.00 0.22 C ATOM 1917 O LYS A 128 -1.480 10.384 -2.448 1.00 0.16 O ATOM 1918 CB LYS A 128 -1.186 13.204 -4.152 1.00 0.36 C ATOM 1919 CG LYS A 128 -2.492 12.609 -4.648 1.00 0.37 C ATOM 1920 CD LYS A 128 -2.396 12.192 -6.106 1.00 0.61 C ATOM 1921 CE LYS A 128 -2.994 10.812 -6.332 1.00 1.52 C ATOM 1922 NZ LYS A 128 -3.887 10.782 -7.522 1.00 1.62 N ATOM 0 H LYS A 128 -0.173 10.256 -4.294 1.00 0.21 H new ATOM 0 HA LYS A 128 0.606 12.698 -3.075 1.00 0.27 H new ATOM 0 HB2 LYS A 128 -1.406 14.007 -3.448 1.00 0.36 H new ATOM 0 HB3 LYS A 128 -0.658 13.654 -4.993 1.00 0.36 H new ATOM 0 HG2 LYS A 128 -2.754 11.745 -4.038 1.00 0.37 H new ATOM 0 HG3 LYS A 128 -3.294 13.338 -4.529 1.00 0.37 H new ATOM 0 HD2 LYS A 128 -2.915 12.921 -6.729 1.00 0.61 H new ATOM 0 HD3 LYS A 128 -1.351 12.192 -6.418 1.00 0.61 H new ATOM 0 HE2 LYS A 128 -2.192 10.086 -6.462 1.00 1.52 H new ATOM 0 HE3 LYS A 128 -3.557 10.511 -5.448 1.00 1.52 H new ATOM 0 HZ1 LYS A 128 -4.274 9.824 -7.641 1.00 1.62 H new ATOM 0 HZ2 LYS A 128 -4.667 11.457 -7.388 1.00 1.62 H new ATOM 0 HZ3 LYS A 128 -3.345 11.044 -8.370 1.00 1.62 H new ATOM 1936 N GLU A 129 -1.082 12.207 -1.191 1.00 0.28 N ATOM 1937 CA GLU A 129 -1.759 11.675 -0.012 1.00 0.24 C ATOM 1938 C GLU A 129 -3.274 11.775 -0.164 1.00 0.23 C ATOM 1939 O GLU A 129 -3.789 12.716 -0.768 1.00 0.28 O ATOM 1940 CB GLU A 129 -1.311 12.427 1.243 1.00 0.25 C ATOM 1941 CG GLU A 129 -2.284 12.308 2.404 1.00 0.22 C ATOM 1942 CD GLU A 129 -1.771 12.974 3.666 1.00 1.16 C ATOM 1943 OE1 GLU A 129 -0.541 13.155 3.781 1.00 2.35 O ATOM 1944 OE2 GLU A 129 -2.598 13.311 4.538 1.00 1.93 O ATOM 0 H GLU A 129 -0.689 13.140 -1.068 1.00 0.28 H new ATOM 0 HA GLU A 129 -1.489 10.624 0.087 1.00 0.24 H new ATOM 0 HB2 GLU A 129 -0.338 12.048 1.555 1.00 0.25 H new ATOM 0 HB3 GLU A 129 -1.179 13.481 0.997 1.00 0.25 H new ATOM 0 HG2 GLU A 129 -3.236 12.757 2.122 1.00 0.22 H new ATOM 0 HG3 GLU A 129 -2.476 11.254 2.606 1.00 0.22 H new ATOM 1951 N LEU A 130 -3.983 10.796 0.389 1.00 0.20 N ATOM 1952 CA LEU A 130 -5.439 10.771 0.316 1.00 0.22 C ATOM 1953 C LEU A 130 -6.059 11.155 1.656 1.00 0.22 C ATOM 1954 O LEU A 130 -7.091 11.824 1.703 1.00 0.25 O ATOM 1955 CB LEU A 130 -5.925 9.383 -0.104 1.00 0.21 C ATOM 1956 CG LEU A 130 -5.169 8.728 -1.260 1.00 0.20 C ATOM 1957 CD1 LEU A 130 -3.950 7.979 -0.745 1.00 0.17 C ATOM 1958 CD2 LEU A 130 -6.085 7.792 -2.034 1.00 0.22 C ATOM 0 H LEU A 130 -3.573 10.010 0.893 1.00 0.20 H new ATOM 0 HA LEU A 130 -5.752 11.501 -0.431 1.00 0.22 H new ATOM 0 HB2 LEU A 130 -5.868 8.723 0.761 1.00 0.21 H new ATOM 0 HB3 LEU A 130 -6.977 9.457 -0.380 1.00 0.21 H new ATOM 0 HG LEU A 130 -4.829 9.512 -1.936 1.00 0.20 H new ATOM 0 HD11 LEU A 130 -3.425 7.519 -1.582 1.00 0.17 H new ATOM 0 HD12 LEU A 130 -3.283 8.675 -0.236 1.00 0.17 H new ATOM 0 HD13 LEU A 130 -4.267 7.205 -0.047 1.00 0.17 H new ATOM 0 HD21 LEU A 130 -5.530 7.335 -2.853 1.00 0.22 H new ATOM 0 HD22 LEU A 130 -6.456 7.013 -1.368 1.00 0.22 H new ATOM 0 HD23 LEU A 130 -6.926 8.357 -2.436 1.00 0.22 H new ATOM 1970 N GLN A 131 -5.420 10.731 2.741 1.00 0.18 N ATOM 1971 CA GLN A 131 -5.907 11.032 4.082 1.00 0.18 C ATOM 1972 C GLN A 131 -4.776 10.958 5.102 1.00 0.18 C ATOM 1973 O GLN A 131 -3.644 10.608 4.765 1.00 0.19 O ATOM 1974 CB GLN A 131 -7.024 10.064 4.470 1.00 0.20 C ATOM 1975 CG GLN A 131 -6.529 8.667 4.809 1.00 0.22 C ATOM 1976 CD GLN A 131 -7.292 7.583 4.075 1.00 0.39 C ATOM 1977 OE1 GLN A 131 -7.394 7.719 2.758 1.00 1.11 O flip ATOM 1978 NE2 GLN A 131 -7.785 6.634 4.684 1.00 0.63 N flip ATOM 0 H GLN A 131 -4.563 10.178 2.718 1.00 0.18 H new ATOM 0 HA GLN A 131 -6.301 12.048 4.078 1.00 0.18 H new ATOM 0 HB2 GLN A 131 -7.562 10.468 5.328 1.00 0.20 H new ATOM 0 HB3 GLN A 131 -7.738 9.998 3.649 1.00 0.20 H new ATOM 0 HG2 GLN A 131 -5.470 8.591 4.562 1.00 0.22 H new ATOM 0 HG3 GLN A 131 -6.618 8.505 5.883 1.00 0.22 H new ATOM 0 HE21 GLN A 131 -7.682 6.569 5.697 1.00 0.63 H new ATOM 0 HE22 GLN A 131 -8.296 5.912 4.176 1.00 0.63 H new ATOM 1987 N ARG A 132 -5.088 11.291 6.350 1.00 0.18 N ATOM 1988 CA ARG A 132 -4.097 11.264 7.419 1.00 0.21 C ATOM 1989 C ARG A 132 -4.643 10.541 8.647 1.00 0.27 C ATOM 1990 O ARG A 132 -5.793 10.741 9.037 1.00 0.54 O ATOM 1991 CB ARG A 132 -3.755 12.745 7.713 1.00 0.30 C ATOM 1992 CG ARG A 132 -3.187 13.104 9.093 1.00 1.06 C ATOM 1993 CD ARG A 132 -4.250 13.511 10.121 1.00 1.72 C ATOM 1994 NE ARG A 132 -3.646 14.275 11.222 1.00 2.50 N ATOM 1995 CZ ARG A 132 -4.316 14.822 12.252 1.00 3.29 C ATOM 1996 NH1 ARG A 132 -5.633 14.619 12.424 1.00 3.71 N ATOM 1997 NH2 ARG A 132 -3.650 15.596 13.120 1.00 4.12 N ATOM 0 H ARG A 132 -6.020 11.583 6.646 1.00 0.18 H new ATOM 0 HA ARG A 132 -3.201 10.714 7.132 1.00 0.21 H new ATOM 0 HB2 ARG A 132 -3.037 13.075 6.963 1.00 0.30 H new ATOM 0 HB3 ARG A 132 -4.662 13.331 7.565 1.00 0.30 H new ATOM 0 HG2 ARG A 132 -2.632 12.249 9.479 1.00 1.06 H new ATOM 0 HG3 ARG A 132 -2.475 13.921 8.980 1.00 1.06 H new ATOM 0 HD2 ARG A 132 -5.020 14.111 9.636 1.00 1.72 H new ATOM 0 HD3 ARG A 132 -4.740 12.621 10.516 1.00 1.72 H new ATOM 0 HE ARG A 132 -2.634 14.401 11.203 1.00 2.50 H new ATOM 0 HH11 ARG A 132 -6.150 14.038 11.764 1.00 3.71 H new ATOM 0 HH12 ARG A 132 -6.116 15.046 13.214 1.00 3.71 H new ATOM 0 HH21 ARG A 132 -2.652 15.762 12.993 1.00 4.12 H new ATOM 0 HH22 ARG A 132 -4.142 16.019 13.907 1.00 4.12 H new ATOM 2011 N GLU A 133 -3.810 9.699 9.251 1.00 0.13 N ATOM 2012 CA GLU A 133 -4.210 8.945 10.433 1.00 0.13 C ATOM 2013 C GLU A 133 -3.255 9.207 11.593 1.00 0.13 C ATOM 2014 O GLU A 133 -2.037 9.267 11.427 1.00 0.13 O ATOM 2015 CB GLU A 133 -4.253 7.447 10.121 1.00 0.14 C ATOM 2016 CG GLU A 133 -3.969 6.567 11.325 1.00 0.14 C ATOM 2017 CD GLU A 133 -4.056 5.089 11.000 1.00 0.17 C ATOM 2018 OE1 GLU A 133 -5.119 4.648 10.514 1.00 1.84 O ATOM 2019 OE2 GLU A 133 -3.059 4.371 11.231 1.00 1.73 O ATOM 0 H GLU A 133 -2.854 9.522 8.941 1.00 0.13 H new ATOM 0 HA GLU A 133 -5.207 9.276 10.723 1.00 0.13 H new ATOM 0 HB2 GLU A 133 -5.235 7.196 9.721 1.00 0.14 H new ATOM 0 HB3 GLU A 133 -3.525 7.226 9.340 1.00 0.14 H new ATOM 0 HG2 GLU A 133 -2.974 6.793 11.709 1.00 0.14 H new ATOM 0 HG3 GLU A 133 -4.678 6.803 12.118 1.00 0.14 H new ATOM 2026 N PRO A 134 -3.820 9.367 12.799 1.00 0.15 N ATOM 2027 CA PRO A 134 -3.037 9.625 14.012 1.00 0.17 C ATOM 2028 C PRO A 134 -2.223 8.411 14.446 1.00 0.17 C ATOM 2029 O PRO A 134 -2.473 7.291 13.999 1.00 0.20 O ATOM 2030 CB PRO A 134 -4.104 9.955 15.059 1.00 0.20 C ATOM 2031 CG PRO A 134 -5.336 9.271 14.574 1.00 0.20 C ATOM 2032 CD PRO A 134 -5.266 9.308 13.072 1.00 0.17 C ATOM 0 HA PRO A 134 -2.305 10.419 13.863 1.00 0.17 H new ATOM 0 HB2 PRO A 134 -3.814 9.595 16.046 1.00 0.20 H new ATOM 0 HB3 PRO A 134 -4.256 11.031 15.144 1.00 0.20 H new ATOM 0 HG2 PRO A 134 -5.381 8.244 14.937 1.00 0.20 H new ATOM 0 HG3 PRO A 134 -6.231 9.777 14.936 1.00 0.20 H new ATOM 0 HD2 PRO A 134 -5.723 8.424 12.627 1.00 0.17 H new ATOM 0 HD3 PRO A 134 -5.787 10.175 12.667 1.00 0.17 H new ATOM 2040 N LEU A 135 -1.249 8.640 15.320 1.00 0.16 N ATOM 2041 CA LEU A 135 -0.399 7.563 15.815 1.00 0.16 C ATOM 2042 C LEU A 135 -0.915 7.030 17.148 1.00 0.20 C ATOM 2043 O LEU A 135 -1.155 7.795 18.084 1.00 0.29 O ATOM 2044 CB LEU A 135 1.041 8.057 15.973 1.00 0.18 C ATOM 2045 CG LEU A 135 2.115 7.232 15.264 1.00 0.18 C ATOM 2046 CD1 LEU A 135 1.992 5.762 15.635 1.00 0.18 C ATOM 2047 CD2 LEU A 135 2.017 7.413 13.756 1.00 0.18 C ATOM 0 H LEU A 135 -1.029 9.561 15.700 1.00 0.16 H new ATOM 0 HA LEU A 135 -0.422 6.751 15.088 1.00 0.16 H new ATOM 0 HB2 LEU A 135 1.095 9.081 15.604 1.00 0.18 H new ATOM 0 HB3 LEU A 135 1.278 8.089 17.036 1.00 0.18 H new ATOM 0 HG LEU A 135 3.093 7.587 15.590 1.00 0.18 H new ATOM 0 HD11 LEU A 135 2.765 5.191 15.121 1.00 0.18 H new ATOM 0 HD12 LEU A 135 2.113 5.647 16.712 1.00 0.18 H new ATOM 0 HD13 LEU A 135 1.010 5.393 15.338 1.00 0.18 H new ATOM 0 HD21 LEU A 135 2.789 6.819 13.267 1.00 0.18 H new ATOM 0 HD22 LEU A 135 1.035 7.085 13.413 1.00 0.18 H new ATOM 0 HD23 LEU A 135 2.156 8.465 13.506 1.00 0.18 H new ATOM 2059 N THR A 136 -1.081 5.714 17.229 1.00 0.24 N ATOM 2060 CA THR A 136 -1.568 5.079 18.447 1.00 0.29 C ATOM 2061 C THR A 136 -0.423 4.449 19.234 1.00 0.24 C ATOM 2062 O THR A 136 0.659 4.196 18.706 1.00 0.22 O ATOM 2063 CB THR A 136 -2.616 3.995 18.136 1.00 0.36 C ATOM 2064 OG1 THR A 136 -2.531 3.613 16.757 1.00 1.26 O ATOM 2065 CG2 THR A 136 -4.019 4.495 18.441 1.00 1.15 C ATOM 0 H THR A 136 -0.885 5.067 16.465 1.00 0.24 H new ATOM 0 HA THR A 136 -2.032 5.862 19.047 1.00 0.29 H new ATOM 0 HB THR A 136 -2.410 3.130 18.767 1.00 0.36 H new ATOM 0 HG1 THR A 136 -3.304 3.058 16.523 1.00 1.26 H new ATOM 0 HG21 THR A 136 -4.742 3.712 18.213 1.00 1.15 H new ATOM 0 HG22 THR A 136 -4.090 4.759 19.496 1.00 1.15 H new ATOM 0 HG23 THR A 136 -4.232 5.374 17.832 1.00 1.15 H new ATOM 2073 N PRO A 137 -0.665 4.192 20.528 1.00 0.29 N ATOM 2074 CA PRO A 137 0.334 3.589 21.416 1.00 0.30 C ATOM 2075 C PRO A 137 0.606 2.127 21.073 1.00 0.26 C ATOM 2076 O PRO A 137 1.709 1.626 21.288 1.00 0.32 O ATOM 2077 CB PRO A 137 -0.305 3.705 22.801 1.00 0.38 C ATOM 2078 CG PRO A 137 -1.771 3.755 22.538 1.00 0.40 C ATOM 2079 CD PRO A 137 -1.931 4.470 21.224 1.00 0.38 C ATOM 0 HA PRO A 137 1.302 4.084 21.337 1.00 0.30 H new ATOM 0 HB2 PRO A 137 -0.044 2.854 23.430 1.00 0.38 H new ATOM 0 HB3 PRO A 137 0.035 4.601 23.320 1.00 0.38 H new ATOM 0 HG2 PRO A 137 -2.194 2.751 22.490 1.00 0.40 H new ATOM 0 HG3 PRO A 137 -2.293 4.283 23.336 1.00 0.40 H new ATOM 0 HD2 PRO A 137 -2.788 4.095 20.664 1.00 0.38 H new ATOM 0 HD3 PRO A 137 -2.086 5.540 21.365 1.00 0.38 H new ATOM 2087 N GLU A 138 -0.407 1.451 20.540 1.00 0.26 N ATOM 2088 CA GLU A 138 -0.276 0.047 20.170 1.00 0.32 C ATOM 2089 C GLU A 138 0.317 -0.093 18.772 1.00 0.30 C ATOM 2090 O GLU A 138 0.810 -1.158 18.399 1.00 0.32 O ATOM 2091 CB GLU A 138 -1.638 -0.648 20.230 1.00 0.41 C ATOM 2092 CG GLU A 138 -2.140 -0.883 21.644 1.00 0.52 C ATOM 2093 CD GLU A 138 -1.587 -2.155 22.258 1.00 1.62 C ATOM 2094 OE1 GLU A 138 -0.446 -2.121 22.765 1.00 2.71 O ATOM 2095 OE2 GLU A 138 -2.293 -3.183 22.229 1.00 2.79 O ATOM 0 H GLU A 138 -1.326 1.853 20.355 1.00 0.26 H new ATOM 0 HA GLU A 138 0.398 -0.429 20.882 1.00 0.32 H new ATOM 0 HB2 GLU A 138 -2.368 -0.045 19.690 1.00 0.41 H new ATOM 0 HB3 GLU A 138 -1.571 -1.606 19.714 1.00 0.41 H new ATOM 0 HG2 GLU A 138 -1.865 -0.033 22.269 1.00 0.52 H new ATOM 0 HG3 GLU A 138 -3.229 -0.932 21.635 1.00 0.52 H new ATOM 2102 N GLU A 139 0.266 0.990 18.001 1.00 0.26 N ATOM 2103 CA GLU A 139 0.797 0.986 16.644 1.00 0.25 C ATOM 2104 C GLU A 139 2.287 1.315 16.641 1.00 0.24 C ATOM 2105 O GLU A 139 3.099 0.574 16.087 1.00 0.24 O ATOM 2106 CB GLU A 139 0.040 1.990 15.773 1.00 0.24 C ATOM 2107 CG GLU A 139 -1.273 1.455 15.229 1.00 0.40 C ATOM 2108 CD GLU A 139 -2.000 0.570 16.222 1.00 1.17 C ATOM 2109 OE1 GLU A 139 -2.388 1.077 17.297 1.00 2.48 O ATOM 2110 OE2 GLU A 139 -2.181 -0.630 15.927 1.00 1.99 O ATOM 0 H GLU A 139 -0.137 1.880 18.294 1.00 0.26 H new ATOM 0 HA GLU A 139 0.663 -0.014 16.232 1.00 0.25 H new ATOM 0 HB2 GLU A 139 -0.158 2.889 16.357 1.00 0.24 H new ATOM 0 HB3 GLU A 139 0.676 2.286 14.938 1.00 0.24 H new ATOM 0 HG2 GLU A 139 -1.916 2.292 14.955 1.00 0.40 H new ATOM 0 HG3 GLU A 139 -1.080 0.889 14.317 1.00 0.40 H new ATOM 2117 N VAL A 140 2.640 2.436 17.265 1.00 0.23 N ATOM 2118 CA VAL A 140 4.032 2.865 17.336 1.00 0.23 C ATOM 2119 C VAL A 140 4.935 1.727 17.795 1.00 0.24 C ATOM 2120 O VAL A 140 6.034 1.545 17.273 1.00 0.24 O ATOM 2121 CB VAL A 140 4.202 4.059 18.294 1.00 0.24 C ATOM 2122 CG1 VAL A 140 3.646 3.725 19.670 1.00 0.25 C ATOM 2123 CG2 VAL A 140 5.665 4.464 18.384 1.00 0.26 C ATOM 0 H VAL A 140 1.981 3.062 17.728 1.00 0.23 H new ATOM 0 HA VAL A 140 4.321 3.171 16.330 1.00 0.23 H new ATOM 0 HB VAL A 140 3.638 4.904 17.898 1.00 0.24 H new ATOM 0 HG11 VAL A 140 3.775 4.581 20.332 1.00 0.25 H new ATOM 0 HG12 VAL A 140 2.585 3.488 19.586 1.00 0.25 H new ATOM 0 HG13 VAL A 140 4.178 2.866 20.079 1.00 0.25 H new ATOM 0 HG21 VAL A 140 5.767 5.309 19.065 1.00 0.26 H new ATOM 0 HG22 VAL A 140 6.253 3.625 18.756 1.00 0.26 H new ATOM 0 HG23 VAL A 140 6.025 4.749 17.395 1.00 0.26 H new ATOM 2133 N GLN A 141 4.463 0.963 18.776 1.00 0.27 N ATOM 2134 CA GLN A 141 5.231 -0.160 19.305 1.00 0.29 C ATOM 2135 C GLN A 141 5.310 -1.294 18.289 1.00 0.25 C ATOM 2136 O GLN A 141 6.319 -1.993 18.201 1.00 0.25 O ATOM 2137 CB GLN A 141 4.602 -0.665 20.605 1.00 0.35 C ATOM 2138 CG GLN A 141 3.141 -1.061 20.459 1.00 0.40 C ATOM 2139 CD GLN A 141 2.911 -2.540 20.697 1.00 0.50 C ATOM 2140 OE1 GLN A 141 2.884 -3.316 19.620 1.00 1.27 O flip ATOM 2141 NE2 GLN A 141 2.757 -2.981 21.837 1.00 0.66 N flip ATOM 0 H GLN A 141 3.555 1.100 19.220 1.00 0.27 H new ATOM 0 HA GLN A 141 6.243 0.188 19.510 1.00 0.29 H new ATOM 0 HB2 GLN A 141 5.169 -1.524 20.964 1.00 0.35 H new ATOM 0 HB3 GLN A 141 4.685 0.112 21.365 1.00 0.35 H new ATOM 0 HG2 GLN A 141 2.540 -0.486 21.164 1.00 0.40 H new ATOM 0 HG3 GLN A 141 2.796 -0.800 19.459 1.00 0.40 H new ATOM 0 HE21 GLN A 141 2.785 -2.348 22.637 1.00 0.66 H new ATOM 0 HE22 GLN A 141 2.601 -3.979 21.981 1.00 0.66 H new ATOM 2150 N SER A 142 4.238 -1.470 17.522 1.00 0.25 N ATOM 2151 CA SER A 142 4.184 -2.523 16.514 1.00 0.24 C ATOM 2152 C SER A 142 5.141 -2.222 15.364 1.00 0.20 C ATOM 2153 O SER A 142 5.872 -3.100 14.904 1.00 0.21 O ATOM 2154 CB SER A 142 2.758 -2.673 15.978 1.00 0.29 C ATOM 2155 OG SER A 142 2.644 -2.134 14.673 1.00 0.33 O ATOM 0 H SER A 142 3.396 -0.897 17.579 1.00 0.25 H new ATOM 0 HA SER A 142 4.489 -3.458 16.984 1.00 0.24 H new ATOM 0 HB2 SER A 142 2.480 -3.727 15.965 1.00 0.29 H new ATOM 0 HB3 SER A 142 2.060 -2.168 16.646 1.00 0.29 H new ATOM 0 HG SER A 142 1.724 -2.244 14.353 1.00 0.33 H new ATOM 2161 N VAL A 143 5.132 -0.976 14.903 1.00 0.19 N ATOM 2162 CA VAL A 143 6.000 -0.559 13.809 1.00 0.17 C ATOM 2163 C VAL A 143 7.462 -0.543 14.242 1.00 0.16 C ATOM 2164 O VAL A 143 8.358 -0.812 13.442 1.00 0.19 O ATOM 2165 CB VAL A 143 5.615 0.841 13.290 1.00 0.17 C ATOM 2166 CG1 VAL A 143 5.685 1.864 14.412 1.00 0.18 C ATOM 2167 CG2 VAL A 143 6.514 1.244 12.131 1.00 0.19 C ATOM 0 H VAL A 143 4.533 -0.237 15.271 1.00 0.19 H new ATOM 0 HA VAL A 143 5.870 -1.286 13.007 1.00 0.17 H new ATOM 0 HB VAL A 143 4.588 0.806 12.928 1.00 0.17 H new ATOM 0 HG11 VAL A 143 5.410 2.846 14.027 1.00 0.18 H new ATOM 0 HG12 VAL A 143 4.995 1.580 15.207 1.00 0.18 H new ATOM 0 HG13 VAL A 143 6.700 1.901 14.808 1.00 0.18 H new ATOM 0 HG21 VAL A 143 6.229 2.235 11.777 1.00 0.19 H new ATOM 0 HG22 VAL A 143 7.551 1.263 12.465 1.00 0.19 H new ATOM 0 HG23 VAL A 143 6.407 0.524 11.320 1.00 0.19 H new ATOM 2177 N ARG A 144 7.694 -0.230 15.512 1.00 0.19 N ATOM 2178 CA ARG A 144 9.048 -0.179 16.051 1.00 0.23 C ATOM 2179 C ARG A 144 9.591 -1.585 16.290 1.00 0.24 C ATOM 2180 O ARG A 144 10.796 -1.818 16.204 1.00 0.28 O ATOM 2181 CB ARG A 144 9.014 0.535 17.418 1.00 0.30 C ATOM 2182 CG ARG A 144 10.399 0.678 18.072 1.00 0.40 C ATOM 2183 CD ARG A 144 10.694 -0.391 19.136 1.00 1.57 C ATOM 2184 NE ARG A 144 12.103 -0.334 19.556 1.00 1.75 N ATOM 2185 CZ ARG A 144 12.589 -0.721 20.750 1.00 1.97 C ATOM 2186 NH1 ARG A 144 11.791 -1.188 21.723 1.00 2.33 N ATOM 2187 NH2 ARG A 144 13.910 -0.644 20.970 1.00 2.12 N ATOM 0 H ARG A 144 6.962 -0.008 16.187 1.00 0.19 H new ATOM 0 HA ARG A 144 9.681 0.346 15.335 1.00 0.23 H new ATOM 0 HB2 ARG A 144 8.578 1.526 17.290 1.00 0.30 H new ATOM 0 HB3 ARG A 144 8.359 -0.018 18.091 1.00 0.30 H new ATOM 0 HG2 ARG A 144 11.164 0.627 17.297 1.00 0.40 H new ATOM 0 HG3 ARG A 144 10.474 1.664 18.530 1.00 0.40 H new ATOM 0 HD2 ARG A 144 10.046 -0.240 19.999 1.00 1.57 H new ATOM 0 HD3 ARG A 144 10.468 -1.380 18.737 1.00 1.57 H new ATOM 0 HE ARG A 144 12.773 0.033 18.880 1.00 1.75 H new ATOM 0 HH11 ARG A 144 10.785 -1.258 21.568 1.00 2.33 H new ATOM 0 HH12 ARG A 144 12.190 -1.473 22.617 1.00 2.33 H new ATOM 0 HH21 ARG A 144 14.529 -0.296 20.238 1.00 2.12 H new ATOM 0 HH22 ARG A 144 14.295 -0.933 21.869 1.00 2.12 H new ATOM 2201 N GLU A 145 8.691 -2.518 16.587 1.00 0.25 N ATOM 2202 CA GLU A 145 9.081 -3.901 16.839 1.00 0.27 C ATOM 2203 C GLU A 145 9.072 -4.713 15.548 1.00 0.24 C ATOM 2204 O GLU A 145 9.710 -5.762 15.456 1.00 0.26 O ATOM 2205 CB GLU A 145 8.142 -4.540 17.865 1.00 0.30 C ATOM 2206 CG GLU A 145 8.481 -4.189 19.304 1.00 0.35 C ATOM 2207 CD GLU A 145 9.785 -4.812 19.764 1.00 0.39 C ATOM 2208 OE1 GLU A 145 10.389 -5.571 18.977 1.00 1.62 O ATOM 2209 OE2 GLU A 145 10.200 -4.540 20.910 1.00 1.77 O ATOM 0 H GLU A 145 7.689 -2.342 16.659 1.00 0.25 H new ATOM 0 HA GLU A 145 10.095 -3.899 17.238 1.00 0.27 H new ATOM 0 HB2 GLU A 145 7.120 -4.225 17.655 1.00 0.30 H new ATOM 0 HB3 GLU A 145 8.173 -5.623 17.747 1.00 0.30 H new ATOM 0 HG2 GLU A 145 8.545 -3.106 19.405 1.00 0.35 H new ATOM 0 HG3 GLU A 145 7.673 -4.523 19.956 1.00 0.35 H new ATOM 2216 N HIS A 146 8.343 -4.220 14.552 1.00 0.22 N ATOM 2217 CA HIS A 146 8.249 -4.899 13.264 1.00 0.24 C ATOM 2218 C HIS A 146 9.274 -4.342 12.280 1.00 0.26 C ATOM 2219 O HIS A 146 9.787 -5.065 11.424 1.00 0.30 O ATOM 2220 CB HIS A 146 6.840 -4.756 12.689 1.00 0.25 C ATOM 2221 CG HIS A 146 5.826 -5.626 13.364 1.00 0.26 C ATOM 2222 ND1 HIS A 146 5.691 -5.984 14.661 1.00 0.32 N flip ATOM 2223 CD2 HIS A 146 4.793 -6.241 12.689 1.00 0.26 C flip ATOM 2224 CE1 HIS A 146 4.589 -6.800 14.746 1.00 0.33 C flip ATOM 2225 NE2 HIS A 146 4.065 -6.938 13.542 1.00 0.30 N flip ATOM 0 H HIS A 146 7.809 -3.353 14.612 1.00 0.22 H new ATOM 0 HA HIS A 146 8.462 -5.956 13.422 1.00 0.24 H new ATOM 0 HB2 HIS A 146 6.527 -3.715 12.772 1.00 0.25 H new ATOM 0 HB3 HIS A 146 6.864 -4.998 11.626 1.00 0.25 H new ATOM 0 HD1 HIS A 146 6.295 -5.701 15.433 1.00 0.32 H new ATOM 0 HD2 HIS A 146 4.608 -6.165 11.628 1.00 0.26 H new ATOM 0 HE1 HIS A 146 4.213 -7.255 15.650 1.00 0.33 H new ATOM 2233 N LEU A 147 9.565 -3.052 12.406 1.00 0.25 N ATOM 2234 CA LEU A 147 10.528 -2.397 11.528 1.00 0.29 C ATOM 2235 C LEU A 147 11.586 -1.653 12.336 1.00 0.32 C ATOM 2236 O LEU A 147 12.784 -1.865 12.154 1.00 0.36 O ATOM 2237 CB LEU A 147 9.811 -1.424 10.588 1.00 0.31 C ATOM 2238 CG LEU A 147 8.664 -2.009 9.764 1.00 0.34 C ATOM 2239 CD1 LEU A 147 7.322 -1.597 10.348 1.00 0.29 C ATOM 2240 CD2 LEU A 147 8.773 -1.570 8.310 1.00 0.45 C ATOM 0 H LEU A 147 9.148 -2.439 13.107 1.00 0.25 H new ATOM 0 HA LEU A 147 11.024 -3.167 10.937 1.00 0.29 H new ATOM 0 HB2 LEU A 147 9.420 -0.598 11.182 1.00 0.31 H new ATOM 0 HB3 LEU A 147 10.547 -1.004 9.902 1.00 0.31 H new ATOM 0 HG LEU A 147 8.734 -3.096 9.801 1.00 0.34 H new ATOM 0 HD11 LEU A 147 6.518 -2.023 9.748 1.00 0.29 H new ATOM 0 HD12 LEU A 147 7.243 -1.962 11.372 1.00 0.29 H new ATOM 0 HD13 LEU A 147 7.241 -0.510 10.343 1.00 0.29 H new ATOM 0 HD21 LEU A 147 7.948 -1.996 7.739 1.00 0.45 H new ATOM 0 HD22 LEU A 147 8.730 -0.482 8.254 1.00 0.45 H new ATOM 0 HD23 LEU A 147 9.719 -1.917 7.895 1.00 0.45 H new ATOM 2252 N GLY A 148 11.134 -0.781 13.233 1.00 0.29 N ATOM 2253 CA GLY A 148 12.055 -0.021 14.058 1.00 0.34 C ATOM 2254 C GLY A 148 11.738 1.461 14.067 1.00 0.34 C ATOM 2255 O GLY A 148 12.543 2.273 14.525 1.00 0.39 O ATOM 0 H GLY A 148 10.147 -0.588 13.403 1.00 0.29 H new ATOM 0 HA2 GLY A 148 12.023 -0.402 15.079 1.00 0.34 H new ATOM 0 HA3 GLY A 148 13.072 -0.170 13.694 1.00 0.34 H new ATOM 2259 N HIS A 149 10.563 1.815 13.558 1.00 0.32 N ATOM 2260 CA HIS A 149 10.141 3.211 13.507 1.00 0.32 C ATOM 2261 C HIS A 149 9.836 3.737 14.907 1.00 0.33 C ATOM 2262 O HIS A 149 8.966 3.211 15.601 1.00 0.32 O ATOM 2263 CB HIS A 149 8.910 3.363 12.613 1.00 0.29 C ATOM 2264 CG HIS A 149 8.700 4.760 12.115 1.00 0.46 C ATOM 2265 ND1 HIS A 149 8.108 5.046 10.904 1.00 1.07 N ATOM 2266 CD2 HIS A 149 9.006 5.954 12.674 1.00 0.39 C ATOM 2267 CE1 HIS A 149 8.059 6.355 10.738 1.00 1.12 C ATOM 2268 NE2 HIS A 149 8.597 6.929 11.798 1.00 0.58 N ATOM 0 H HIS A 149 9.886 1.155 13.175 1.00 0.32 H new ATOM 0 HA HIS A 149 10.959 3.797 13.087 1.00 0.32 H new ATOM 0 HB2 HIS A 149 9.006 2.692 11.759 1.00 0.29 H new ATOM 0 HB3 HIS A 149 8.027 3.047 13.168 1.00 0.29 H new ATOM 0 HD1 HIS A 149 7.762 4.354 10.239 1.00 1.07 H new ATOM 0 HD2 HIS A 149 9.483 6.111 13.630 1.00 0.39 H new ATOM 0 HE1 HIS A 149 7.649 6.869 9.881 1.00 1.12 H new ATOM 2276 N GLU A 150 10.557 4.777 15.313 1.00 0.40 N ATOM 2277 CA GLU A 150 10.362 5.372 16.630 1.00 0.45 C ATOM 2278 C GLU A 150 10.734 6.852 16.620 1.00 0.51 C ATOM 2279 O GLU A 150 11.906 7.208 16.484 1.00 0.66 O ATOM 2280 CB GLU A 150 11.199 4.632 17.677 1.00 0.50 C ATOM 2281 CG GLU A 150 10.461 4.384 18.982 1.00 0.98 C ATOM 2282 CD GLU A 150 10.565 5.552 19.943 1.00 1.69 C ATOM 2283 OE1 GLU A 150 11.543 6.321 19.839 1.00 2.02 O ATOM 2284 OE2 GLU A 150 9.666 5.698 20.798 1.00 3.27 O ATOM 0 H GLU A 150 11.280 5.224 14.750 1.00 0.40 H new ATOM 0 HA GLU A 150 9.307 5.282 16.888 1.00 0.45 H new ATOM 0 HB2 GLU A 150 11.520 3.676 17.264 1.00 0.50 H new ATOM 0 HB3 GLU A 150 12.100 5.209 17.883 1.00 0.50 H new ATOM 0 HG2 GLU A 150 9.410 4.186 18.769 1.00 0.98 H new ATOM 0 HG3 GLU A 150 10.863 3.490 19.458 1.00 0.98 H new ATOM 2291 N SER A 151 9.729 7.710 16.762 1.00 0.41 N ATOM 2292 CA SER A 151 9.949 9.151 16.765 1.00 0.46 C ATOM 2293 C SER A 151 8.769 9.880 17.403 1.00 0.43 C ATOM 2294 O SER A 151 7.761 9.265 17.751 1.00 0.44 O ATOM 2295 CB SER A 151 10.163 9.657 15.337 1.00 0.44 C ATOM 2296 OG SER A 151 11.406 10.328 15.216 1.00 1.05 O ATOM 0 H SER A 151 8.754 7.432 16.876 1.00 0.41 H new ATOM 0 HA SER A 151 10.842 9.357 17.355 1.00 0.46 H new ATOM 0 HB2 SER A 151 10.129 8.818 14.641 1.00 0.44 H new ATOM 0 HB3 SER A 151 9.353 10.332 15.062 1.00 0.44 H new ATOM 0 HG SER A 151 11.844 10.058 14.382 1.00 1.05 H new ATOM 2302 N ASP A 152 8.904 11.192 17.552 1.00 0.49 N ATOM 2303 CA ASP A 152 7.850 12.006 18.147 1.00 0.52 C ATOM 2304 C ASP A 152 7.153 12.852 17.087 1.00 0.36 C ATOM 2305 O ASP A 152 6.084 13.409 17.327 1.00 0.42 O ATOM 2306 CB ASP A 152 8.428 12.908 19.239 1.00 0.73 C ATOM 2307 CG ASP A 152 9.016 14.189 18.681 1.00 0.79 C ATOM 2308 OD1 ASP A 152 10.212 14.186 18.324 1.00 2.24 O ATOM 2309 OD2 ASP A 152 8.280 15.195 18.603 1.00 1.50 O ATOM 0 H ASP A 152 9.733 11.715 17.269 1.00 0.49 H new ATOM 0 HA ASP A 152 7.115 11.336 18.592 1.00 0.52 H new ATOM 0 HB2 ASP A 152 7.644 13.153 19.956 1.00 0.73 H new ATOM 0 HB3 ASP A 152 9.200 12.365 19.784 1.00 0.73 H new ATOM 2314 N ASN A 153 7.770 12.947 15.913 1.00 0.28 N ATOM 2315 CA ASN A 153 7.210 13.728 14.815 1.00 0.24 C ATOM 2316 C ASN A 153 6.608 12.815 13.750 1.00 0.20 C ATOM 2317 O ASN A 153 6.273 13.262 12.653 1.00 0.36 O ATOM 2318 CB ASN A 153 8.288 14.617 14.192 1.00 0.41 C ATOM 2319 CG ASN A 153 8.723 15.734 15.120 1.00 0.93 C ATOM 2320 OD1 ASN A 153 9.758 15.477 15.911 1.00 1.83 O flip ATOM 2321 ND2 ASN A 153 8.135 16.817 15.124 1.00 0.96 N flip ATOM 0 H ASN A 153 8.658 12.493 15.698 1.00 0.28 H new ATOM 0 HA ASN A 153 6.417 14.359 15.217 1.00 0.24 H new ATOM 0 HB2 ASN A 153 9.153 14.007 13.932 1.00 0.41 H new ATOM 0 HB3 ASN A 153 7.910 15.046 13.264 1.00 0.41 H new ATOM 0 HD21 ASN A 153 7.344 16.970 14.499 1.00 0.96 H new ATOM 0 HD22 ASN A 153 8.439 17.560 15.753 1.00 0.96 H new ATOM 2328 N LEU A 154 6.474 11.537 14.083 1.00 0.18 N ATOM 2329 CA LEU A 154 5.912 10.561 13.155 1.00 0.17 C ATOM 2330 C LEU A 154 4.402 10.737 13.027 1.00 0.15 C ATOM 2331 O LEU A 154 3.768 11.382 13.863 1.00 0.16 O ATOM 2332 CB LEU A 154 6.232 9.140 13.623 1.00 0.21 C ATOM 2333 CG LEU A 154 6.218 8.912 15.134 1.00 0.23 C ATOM 2334 CD1 LEU A 154 4.946 9.476 15.748 1.00 0.24 C ATOM 2335 CD2 LEU A 154 6.353 7.430 15.451 1.00 0.32 C ATOM 0 H LEU A 154 6.746 11.152 14.987 1.00 0.18 H new ATOM 0 HA LEU A 154 6.363 10.726 12.177 1.00 0.17 H new ATOM 0 HB2 LEU A 154 5.514 8.458 13.166 1.00 0.21 H new ATOM 0 HB3 LEU A 154 7.217 8.867 13.244 1.00 0.21 H new ATOM 0 HG LEU A 154 7.070 9.436 15.568 1.00 0.23 H new ATOM 0 HD11 LEU A 154 4.954 9.304 16.824 1.00 0.24 H new ATOM 0 HD12 LEU A 154 4.891 10.547 15.552 1.00 0.24 H new ATOM 0 HD13 LEU A 154 4.080 8.982 15.308 1.00 0.24 H new ATOM 0 HD21 LEU A 154 6.341 7.286 16.531 1.00 0.32 H new ATOM 0 HD22 LEU A 154 5.522 6.885 15.003 1.00 0.32 H new ATOM 0 HD23 LEU A 154 7.293 7.055 15.046 1.00 0.32 H new ATOM 2347 N LEU A 155 3.831 10.158 11.977 1.00 0.15 N ATOM 2348 CA LEU A 155 2.393 10.250 11.740 1.00 0.14 C ATOM 2349 C LEU A 155 1.980 9.378 10.560 1.00 0.12 C ATOM 2350 O LEU A 155 2.574 9.447 9.485 1.00 0.13 O ATOM 2351 CB LEU A 155 1.991 11.704 11.480 1.00 0.16 C ATOM 2352 CG LEU A 155 0.492 12.000 11.516 1.00 0.17 C ATOM 2353 CD1 LEU A 155 -0.149 11.664 10.178 1.00 0.18 C ATOM 2354 CD2 LEU A 155 -0.180 11.226 12.641 1.00 0.15 C ATOM 0 H LEU A 155 4.340 9.620 11.276 1.00 0.15 H new ATOM 0 HA LEU A 155 1.879 9.891 12.631 1.00 0.14 H new ATOM 0 HB2 LEU A 155 2.484 12.335 12.220 1.00 0.16 H new ATOM 0 HB3 LEU A 155 2.376 11.998 10.504 1.00 0.16 H new ATOM 0 HG LEU A 155 0.356 13.065 11.705 1.00 0.17 H new ATOM 0 HD11 LEU A 155 -1.216 11.881 10.221 1.00 0.18 H new ATOM 0 HD12 LEU A 155 0.312 12.264 9.393 1.00 0.18 H new ATOM 0 HD13 LEU A 155 -0.002 10.606 9.960 1.00 0.18 H new ATOM 0 HD21 LEU A 155 -1.247 11.450 12.650 1.00 0.15 H new ATOM 0 HD22 LEU A 155 -0.035 10.157 12.484 1.00 0.15 H new ATOM 0 HD23 LEU A 155 0.260 11.516 13.595 1.00 0.15 H new ATOM 2366 N PHE A 156 0.955 8.556 10.769 1.00 0.11 N ATOM 2367 CA PHE A 156 0.460 7.670 9.721 1.00 0.10 C ATOM 2368 C PHE A 156 -0.309 8.456 8.663 1.00 0.10 C ATOM 2369 O PHE A 156 -1.160 9.284 8.987 1.00 0.12 O ATOM 2370 CB PHE A 156 -0.438 6.587 10.323 1.00 0.11 C ATOM 2371 CG PHE A 156 0.324 5.488 11.006 1.00 0.13 C ATOM 2372 CD1 PHE A 156 1.231 4.714 10.300 1.00 1.71 C ATOM 2373 CD2 PHE A 156 0.134 5.228 12.354 1.00 1.84 C ATOM 2374 CE1 PHE A 156 1.933 3.701 10.925 1.00 1.69 C ATOM 2375 CE2 PHE A 156 0.834 4.216 12.984 1.00 1.88 C ATOM 2376 CZ PHE A 156 1.735 3.452 12.269 1.00 0.20 C ATOM 0 H PHE A 156 0.452 8.485 11.654 1.00 0.11 H new ATOM 0 HA PHE A 156 1.318 7.197 9.243 1.00 0.10 H new ATOM 0 HB2 PHE A 156 -1.118 7.047 11.040 1.00 0.11 H new ATOM 0 HB3 PHE A 156 -1.053 6.155 9.533 1.00 0.11 H new ATOM 0 HD1 PHE A 156 1.391 4.905 9.249 1.00 1.71 H new ATOM 0 HD2 PHE A 156 -0.569 5.823 12.919 1.00 1.84 H new ATOM 0 HE1 PHE A 156 2.636 3.104 10.363 1.00 1.69 H new ATOM 0 HE2 PHE A 156 0.676 4.023 14.035 1.00 1.88 H new ATOM 0 HZ PHE A 156 2.284 2.662 12.760 1.00 0.20 H new ATOM 2386 N VAL A 157 -0.003 8.189 7.398 1.00 0.12 N ATOM 2387 CA VAL A 157 -0.664 8.870 6.292 1.00 0.14 C ATOM 2388 C VAL A 157 -0.867 7.928 5.109 1.00 0.13 C ATOM 2389 O VAL A 157 0.000 7.112 4.799 1.00 0.18 O ATOM 2390 CB VAL A 157 0.141 10.096 5.824 1.00 0.17 C ATOM 2391 CG1 VAL A 157 -0.457 11.375 6.391 1.00 0.22 C ATOM 2392 CG2 VAL A 157 1.602 9.958 6.224 1.00 0.15 C ATOM 0 H VAL A 157 0.699 7.506 7.114 1.00 0.12 H new ATOM 0 HA VAL A 157 -1.635 9.202 6.661 1.00 0.14 H new ATOM 0 HB VAL A 157 0.089 10.150 4.737 1.00 0.17 H new ATOM 0 HG11 VAL A 157 0.125 12.231 6.050 1.00 0.22 H new ATOM 0 HG12 VAL A 157 -1.487 11.477 6.050 1.00 0.22 H new ATOM 0 HG13 VAL A 157 -0.438 11.334 7.480 1.00 0.22 H new ATOM 0 HG21 VAL A 157 2.156 10.833 5.885 1.00 0.15 H new ATOM 0 HG22 VAL A 157 1.676 9.879 7.309 1.00 0.15 H new ATOM 0 HG23 VAL A 157 2.022 9.063 5.765 1.00 0.15 H new ATOM 2402 N GLN A 158 -2.017 8.048 4.454 1.00 0.16 N ATOM 2403 CA GLN A 158 -2.333 7.207 3.307 1.00 0.16 C ATOM 2404 C GLN A 158 -1.955 7.901 2.002 1.00 0.15 C ATOM 2405 O GLN A 158 -2.370 9.032 1.748 1.00 0.15 O ATOM 2406 CB GLN A 158 -3.822 6.857 3.298 1.00 0.17 C ATOM 2407 CG GLN A 158 -4.196 5.809 2.262 1.00 0.20 C ATOM 2408 CD GLN A 158 -5.409 4.997 2.665 1.00 0.43 C ATOM 2409 OE1 GLN A 158 -5.420 4.352 3.714 1.00 1.65 O ATOM 2410 NE2 GLN A 158 -6.443 5.023 1.831 1.00 1.40 N ATOM 0 H GLN A 158 -2.745 8.719 4.698 1.00 0.16 H new ATOM 0 HA GLN A 158 -1.752 6.289 3.392 1.00 0.16 H new ATOM 0 HB2 GLN A 158 -4.108 6.497 4.286 1.00 0.17 H new ATOM 0 HB3 GLN A 158 -4.398 7.763 3.110 1.00 0.17 H new ATOM 0 HG2 GLN A 158 -4.393 6.300 1.309 1.00 0.20 H new ATOM 0 HG3 GLN A 158 -3.350 5.139 2.107 1.00 0.20 H new ATOM 0 HE21 GLN A 158 -6.392 5.571 0.972 1.00 1.40 H new ATOM 0 HE22 GLN A 158 -7.288 4.495 2.050 1.00 1.40 H new ATOM 2419 N ILE A 159 -1.165 7.217 1.180 1.00 0.18 N ATOM 2420 CA ILE A 159 -0.732 7.767 -0.098 1.00 0.19 C ATOM 2421 C ILE A 159 -1.125 6.853 -1.252 1.00 0.18 C ATOM 2422 O ILE A 159 -1.273 5.642 -1.078 1.00 0.19 O ATOM 2423 CB ILE A 159 0.792 7.990 -0.127 1.00 0.23 C ATOM 2424 CG1 ILE A 159 1.255 8.678 1.159 1.00 0.28 C ATOM 2425 CG2 ILE A 159 1.184 8.812 -1.345 1.00 0.27 C ATOM 2426 CD1 ILE A 159 1.881 7.732 2.159 1.00 0.34 C ATOM 0 H ILE A 159 -0.812 6.281 1.377 1.00 0.18 H new ATOM 0 HA ILE A 159 -1.233 8.728 -0.214 1.00 0.19 H new ATOM 0 HB ILE A 159 1.284 7.020 -0.194 1.00 0.23 H new ATOM 0 HG12 ILE A 159 1.976 9.455 0.906 1.00 0.28 H new ATOM 0 HG13 ILE A 159 0.402 9.173 1.624 1.00 0.28 H new ATOM 0 HG21 ILE A 159 2.264 8.961 -1.351 1.00 0.27 H new ATOM 0 HG22 ILE A 159 0.885 8.285 -2.251 1.00 0.27 H new ATOM 0 HG23 ILE A 159 0.684 9.780 -1.307 1.00 0.27 H new ATOM 0 HD11 ILE A 159 2.185 8.289 3.045 1.00 0.34 H new ATOM 0 HD12 ILE A 159 1.156 6.969 2.441 1.00 0.34 H new ATOM 0 HD13 ILE A 159 2.754 7.256 1.712 1.00 0.34 H new ATOM 2438 N THR A 160 -1.290 7.438 -2.434 1.00 0.23 N ATOM 2439 CA THR A 160 -1.664 6.676 -3.619 1.00 0.23 C ATOM 2440 C THR A 160 -0.894 7.153 -4.845 1.00 0.20 C ATOM 2441 O THR A 160 -0.301 8.230 -4.837 1.00 0.31 O ATOM 2442 CB THR A 160 -3.175 6.784 -3.902 1.00 0.26 C ATOM 2443 OG1 THR A 160 -3.504 6.048 -5.085 1.00 0.35 O ATOM 2444 CG2 THR A 160 -3.592 8.237 -4.068 1.00 0.23 C ATOM 0 H THR A 160 -1.170 8.438 -2.596 1.00 0.23 H new ATOM 0 HA THR A 160 -1.412 5.635 -3.418 1.00 0.23 H new ATOM 0 HB THR A 160 -3.713 6.364 -3.052 1.00 0.26 H new ATOM 0 HG1 THR A 160 -3.290 5.101 -4.951 1.00 0.35 H new ATOM 0 HG21 THR A 160 -4.662 8.288 -4.267 1.00 0.23 H new ATOM 0 HG22 THR A 160 -3.366 8.787 -3.154 1.00 0.23 H new ATOM 0 HG23 THR A 160 -3.047 8.679 -4.902 1.00 0.23 H new ATOM 2452 N GLY A 161 -0.907 6.342 -5.898 1.00 0.13 N ATOM 2453 CA GLY A 161 -0.207 6.700 -7.118 1.00 0.17 C ATOM 2454 C GLY A 161 -0.798 6.030 -8.344 1.00 0.16 C ATOM 2455 O GLY A 161 -1.108 4.838 -8.322 1.00 0.17 O ATOM 0 H GLY A 161 -1.389 5.444 -5.928 1.00 0.13 H new ATOM 0 HA2 GLY A 161 -0.240 7.782 -7.248 1.00 0.17 H new ATOM 0 HA3 GLY A 161 0.843 6.421 -7.026 1.00 0.17 H new ATOM 2459 N LYS A 162 -0.956 6.798 -9.416 1.00 0.17 N ATOM 2460 CA LYS A 162 -1.514 6.274 -10.658 1.00 0.18 C ATOM 2461 C LYS A 162 -0.410 5.762 -11.577 1.00 0.17 C ATOM 2462 O LYS A 162 0.652 6.373 -11.689 1.00 0.18 O ATOM 2463 CB LYS A 162 -2.327 7.355 -11.373 1.00 0.19 C ATOM 2464 CG LYS A 162 -3.172 6.824 -12.518 1.00 0.21 C ATOM 2465 CD LYS A 162 -3.326 7.857 -13.623 1.00 0.26 C ATOM 2466 CE LYS A 162 -4.706 8.494 -13.601 1.00 1.38 C ATOM 2467 NZ LYS A 162 -4.921 9.393 -14.769 1.00 1.64 N ATOM 0 H LYS A 162 -0.706 7.786 -9.450 1.00 0.17 H new ATOM 0 HA LYS A 162 -2.171 5.441 -10.408 1.00 0.18 H new ATOM 0 HB2 LYS A 162 -2.978 7.846 -10.650 1.00 0.19 H new ATOM 0 HB3 LYS A 162 -1.647 8.115 -11.757 1.00 0.19 H new ATOM 0 HG2 LYS A 162 -2.712 5.922 -12.923 1.00 0.21 H new ATOM 0 HG3 LYS A 162 -4.156 6.540 -12.144 1.00 0.21 H new ATOM 0 HD2 LYS A 162 -2.566 8.630 -13.509 1.00 0.26 H new ATOM 0 HD3 LYS A 162 -3.158 7.384 -14.591 1.00 0.26 H new ATOM 0 HE2 LYS A 162 -5.466 7.713 -13.599 1.00 1.38 H new ATOM 0 HE3 LYS A 162 -4.829 9.061 -12.679 1.00 1.38 H new ATOM 0 HZ1 LYS A 162 -5.873 9.808 -14.717 1.00 1.64 H new ATOM 0 HZ2 LYS A 162 -4.211 10.153 -14.757 1.00 1.64 H new ATOM 0 HZ3 LYS A 162 -4.829 8.847 -15.649 1.00 1.64 H new ATOM 2481 N LYS A 163 -0.668 4.636 -12.235 1.00 0.19 N ATOM 2482 CA LYS A 163 0.301 4.044 -13.148 1.00 0.20 C ATOM 2483 C LYS A 163 0.251 4.723 -14.512 1.00 0.20 C ATOM 2484 O LYS A 163 -0.818 4.976 -15.068 1.00 0.20 O ATOM 2485 CB LYS A 163 0.037 2.545 -13.303 1.00 0.23 C ATOM 2486 CG LYS A 163 1.291 1.728 -13.562 1.00 0.61 C ATOM 2487 CD LYS A 163 1.596 1.632 -15.047 1.00 1.08 C ATOM 2488 CE LYS A 163 3.080 1.410 -15.298 1.00 0.69 C ATOM 2489 NZ LYS A 163 3.390 -0.022 -15.562 1.00 1.26 N ATOM 0 H LYS A 163 -1.541 4.115 -12.152 1.00 0.19 H new ATOM 0 HA LYS A 163 1.295 4.190 -12.726 1.00 0.20 H new ATOM 0 HB2 LYS A 163 -0.447 2.175 -12.399 1.00 0.23 H new ATOM 0 HB3 LYS A 163 -0.662 2.391 -14.125 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.136 2.182 -13.045 1.00 0.61 H new ATOM 0 HG3 LYS A 163 1.166 0.727 -13.150 1.00 0.61 H new ATOM 0 HD2 LYS A 163 1.025 0.813 -15.485 1.00 1.08 H new ATOM 0 HD3 LYS A 163 1.274 2.546 -15.545 1.00 1.08 H new ATOM 0 HE2 LYS A 163 3.399 2.013 -16.148 1.00 0.69 H new ATOM 0 HE3 LYS A 163 3.650 1.751 -14.434 1.00 0.69 H new ATOM 0 HZ1 LYS A 163 4.320 -0.256 -15.159 1.00 1.26 H new ATOM 0 HZ2 LYS A 163 2.662 -0.621 -15.124 1.00 1.26 H new ATOM 0 HZ3 LYS A 163 3.405 -0.190 -16.588 1.00 1.26 H new ATOM 2503 N PRO A 164 1.433 5.024 -15.069 1.00 0.20 N ATOM 2504 CA PRO A 164 1.549 5.677 -16.377 1.00 0.22 C ATOM 2505 C PRO A 164 1.135 4.760 -17.521 1.00 0.24 C ATOM 2506 O PRO A 164 1.622 3.634 -17.635 1.00 0.36 O ATOM 2507 CB PRO A 164 3.040 6.015 -16.473 1.00 0.24 C ATOM 2508 CG PRO A 164 3.711 5.022 -15.587 1.00 0.24 C ATOM 2509 CD PRO A 164 2.748 4.753 -14.463 1.00 0.21 C ATOM 0 HA PRO A 164 0.895 6.545 -16.459 1.00 0.22 H new ATOM 0 HB2 PRO A 164 3.399 5.936 -17.499 1.00 0.24 H new ATOM 0 HB3 PRO A 164 3.237 7.035 -16.144 1.00 0.24 H new ATOM 0 HG2 PRO A 164 3.941 4.106 -16.131 1.00 0.24 H new ATOM 0 HG3 PRO A 164 4.655 5.413 -15.207 1.00 0.24 H new ATOM 0 HD2 PRO A 164 2.822 3.725 -14.107 1.00 0.21 H new ATOM 0 HD3 PRO A 164 2.938 5.401 -13.607 1.00 0.21 H new ATOM 2517 N ASN A 165 0.234 5.246 -18.367 1.00 0.21 N ATOM 2518 CA ASN A 165 -0.246 4.468 -19.505 1.00 0.22 C ATOM 2519 C ASN A 165 0.297 5.029 -20.814 1.00 0.27 C ATOM 2520 O ASN A 165 0.539 6.230 -20.936 1.00 0.30 O ATOM 2521 CB ASN A 165 -1.775 4.460 -19.534 1.00 0.22 C ATOM 2522 CG ASN A 165 -2.325 3.960 -20.857 1.00 0.25 C ATOM 2523 OD1 ASN A 165 -2.271 4.659 -21.867 1.00 0.28 O ATOM 2524 ND2 ASN A 165 -2.858 2.743 -20.852 1.00 0.28 N ATOM 0 H ASN A 165 -0.179 6.175 -18.287 1.00 0.21 H new ATOM 0 HA ASN A 165 0.113 3.445 -19.393 1.00 0.22 H new ATOM 0 HB2 ASN A 165 -2.148 3.829 -18.727 1.00 0.22 H new ATOM 0 HB3 ASN A 165 -2.145 5.468 -19.348 1.00 0.22 H new ATOM 0 HD21 ASN A 165 -3.245 2.352 -21.711 1.00 0.28 H new ATOM 0 HD22 ASN A 165 -2.880 2.200 -19.989 1.00 0.28 H new ATOM 2531 N PHE A 166 0.486 4.151 -21.795 1.00 0.29 N ATOM 2532 CA PHE A 166 1.000 4.557 -23.097 1.00 0.36 C ATOM 2533 C PHE A 166 2.430 5.076 -22.978 1.00 1.80 C ATOM 2534 O PHE A 166 2.828 5.597 -21.937 1.00 3.26 O ATOM 2535 CB PHE A 166 0.104 5.634 -23.710 1.00 1.85 C ATOM 2536 CG PHE A 166 0.370 5.878 -25.167 1.00 2.96 C ATOM 2537 CD1 PHE A 166 0.397 4.825 -26.067 1.00 3.67 C ATOM 2538 CD2 PHE A 166 0.594 7.162 -25.640 1.00 4.23 C ATOM 2539 CE1 PHE A 166 0.643 5.047 -27.409 1.00 5.06 C ATOM 2540 CE2 PHE A 166 0.840 7.391 -26.980 1.00 5.55 C ATOM 2541 CZ PHE A 166 0.864 6.332 -27.866 1.00 5.82 C ATOM 0 H PHE A 166 0.290 3.153 -21.712 1.00 0.29 H new ATOM 0 HA PHE A 166 1.002 3.683 -23.748 1.00 0.36 H new ATOM 0 HB2 PHE A 166 -0.939 5.343 -23.583 1.00 1.85 H new ATOM 0 HB3 PHE A 166 0.244 6.566 -23.162 1.00 1.85 H new ATOM 0 HD1 PHE A 166 0.224 3.819 -25.716 1.00 3.67 H new ATOM 0 HD2 PHE A 166 0.576 7.994 -24.952 1.00 4.23 H new ATOM 0 HE1 PHE A 166 0.662 4.217 -28.100 1.00 5.06 H new ATOM 0 HE2 PHE A 166 1.013 8.397 -27.334 1.00 5.55 H new ATOM 0 HZ PHE A 166 1.055 6.508 -28.914 1.00 5.82 H new ATOM 2551 N GLU A 167 3.197 4.931 -24.054 1.00 2.66 N ATOM 2552 CA GLU A 167 4.584 5.383 -24.070 1.00 4.15 C ATOM 2553 C GLU A 167 4.665 6.895 -23.872 1.00 4.25 C ATOM 2554 O GLU A 167 4.461 7.666 -24.808 1.00 5.00 O ATOM 2555 CB GLU A 167 5.255 4.995 -25.390 1.00 5.65 C ATOM 2556 CG GLU A 167 6.240 3.846 -25.255 1.00 7.13 C ATOM 2557 CD GLU A 167 7.681 4.316 -25.197 1.00 8.69 C ATOM 2558 OE1 GLU A 167 8.125 4.986 -26.153 1.00 9.42 O ATOM 2559 OE2 GLU A 167 8.363 4.015 -24.195 1.00 9.58 O ATOM 0 H GLU A 167 2.882 4.505 -24.925 1.00 2.66 H new ATOM 0 HA GLU A 167 5.108 4.896 -23.247 1.00 4.15 H new ATOM 0 HB2 GLU A 167 4.486 4.721 -26.112 1.00 5.65 H new ATOM 0 HB3 GLU A 167 5.776 5.864 -25.793 1.00 5.65 H new ATOM 0 HG2 GLU A 167 6.010 3.279 -24.353 1.00 7.13 H new ATOM 0 HG3 GLU A 167 6.117 3.166 -26.098 1.00 7.13 H new ATOM 2566 N VAL A 168 4.962 7.309 -22.644 1.00 3.94 N ATOM 2567 CA VAL A 168 5.071 8.727 -22.322 1.00 4.32 C ATOM 2568 C VAL A 168 6.510 9.107 -21.995 1.00 4.66 C ATOM 2569 O VAL A 168 6.934 10.238 -22.231 1.00 5.28 O ATOM 2570 CB VAL A 168 4.169 9.101 -21.131 1.00 4.18 C ATOM 2571 CG1 VAL A 168 2.707 9.116 -21.551 1.00 4.60 C ATOM 2572 CG2 VAL A 168 4.390 8.141 -19.973 1.00 4.34 C ATOM 0 H VAL A 168 5.131 6.683 -21.857 1.00 3.94 H new ATOM 0 HA VAL A 168 4.745 9.279 -23.204 1.00 4.32 H new ATOM 0 HB VAL A 168 4.436 10.104 -20.797 1.00 4.18 H new ATOM 0 HG11 VAL A 168 2.086 9.382 -20.696 1.00 4.60 H new ATOM 0 HG12 VAL A 168 2.564 9.848 -22.346 1.00 4.60 H new ATOM 0 HG13 VAL A 168 2.422 8.128 -21.913 1.00 4.60 H new ATOM 0 HG21 VAL A 168 3.744 8.421 -19.140 1.00 4.34 H new ATOM 0 HG22 VAL A 168 4.152 7.126 -20.291 1.00 4.34 H new ATOM 0 HG23 VAL A 168 5.432 8.187 -19.656 1.00 4.34 H new ATOM 2582 N GLY A 169 7.259 8.154 -21.449 1.00 4.83 N ATOM 2583 CA GLY A 169 8.644 8.409 -21.098 1.00 5.39 C ATOM 2584 C GLY A 169 8.859 8.479 -19.600 1.00 5.49 C ATOM 2585 O GLY A 169 9.947 8.175 -19.106 1.00 6.32 O ATOM 0 H GLY A 169 6.932 7.210 -21.243 1.00 4.83 H new ATOM 0 HA2 GLY A 169 9.272 7.622 -21.516 1.00 5.39 H new ATOM 0 HA3 GLY A 169 8.964 9.347 -21.552 1.00 5.39 H new ATOM 2589 N SER A 170 7.822 8.880 -18.871 1.00 5.01 N ATOM 2590 CA SER A 170 7.905 8.994 -17.421 1.00 5.45 C ATOM 2591 C SER A 170 7.797 7.622 -16.761 1.00 5.75 C ATOM 2592 O SER A 170 6.725 7.222 -16.307 1.00 6.62 O ATOM 2593 CB SER A 170 6.800 9.913 -16.896 1.00 5.84 C ATOM 2594 OG SER A 170 7.122 10.415 -15.611 1.00 7.00 O ATOM 0 H SER A 170 6.914 9.131 -19.262 1.00 5.01 H new ATOM 0 HA SER A 170 8.875 9.424 -17.170 1.00 5.45 H new ATOM 0 HB2 SER A 170 6.653 10.743 -17.588 1.00 5.84 H new ATOM 0 HB3 SER A 170 5.858 9.366 -16.851 1.00 5.84 H new ATOM 0 HG SER A 170 6.401 11.001 -15.298 1.00 7.00 H new ATOM 2600 N SER A 171 8.915 6.906 -16.713 1.00 5.66 N ATOM 2601 CA SER A 171 8.948 5.577 -16.113 1.00 6.41 C ATOM 2602 C SER A 171 10.369 5.195 -15.712 1.00 5.91 C ATOM 2603 O SER A 171 11.278 6.025 -15.741 1.00 5.70 O ATOM 2604 CB SER A 171 8.384 4.541 -17.087 1.00 7.44 C ATOM 2605 OG SER A 171 7.637 5.163 -18.119 1.00 8.00 O ATOM 0 H SER A 171 9.811 7.224 -17.083 1.00 5.66 H new ATOM 0 HA SER A 171 8.330 5.596 -15.215 1.00 6.41 H new ATOM 0 HB2 SER A 171 9.200 3.964 -17.522 1.00 7.44 H new ATOM 0 HB3 SER A 171 7.749 3.838 -16.548 1.00 7.44 H new ATOM 0 HG SER A 171 7.289 4.479 -18.729 1.00 8.00 H new ATOM 2611 N ARG A 172 10.553 3.933 -15.339 1.00 6.19 N ATOM 2612 CA ARG A 172 11.863 3.441 -14.930 1.00 6.12 C ATOM 2613 C ARG A 172 11.986 1.943 -15.191 1.00 7.49 C ATOM 2614 O ARG A 172 11.151 1.155 -14.745 1.00 8.34 O ATOM 2615 CB ARG A 172 12.146 3.757 -13.446 1.00 5.53 C ATOM 2616 CG ARG A 172 13.648 3.598 -13.141 1.00 5.91 C ATOM 2617 CD ARG A 172 13.998 3.833 -11.668 1.00 6.49 C ATOM 2618 NE ARG A 172 13.585 2.703 -10.822 1.00 7.26 N ATOM 2619 CZ ARG A 172 13.790 2.613 -9.494 1.00 8.37 C ATOM 2620 NH1 ARG A 172 14.422 3.582 -8.813 1.00 8.85 N ATOM 2621 NH2 ARG A 172 13.349 1.534 -8.835 1.00 9.48 N ATOM 0 H ARG A 172 9.812 3.233 -15.312 1.00 6.19 H new ATOM 0 HA ARG A 172 12.611 3.959 -15.531 1.00 6.12 H new ATOM 0 HB2 ARG A 172 11.827 4.774 -13.217 1.00 5.53 H new ATOM 0 HB3 ARG A 172 11.566 3.090 -12.808 1.00 5.53 H new ATOM 0 HG2 ARG A 172 13.965 2.595 -13.427 1.00 5.91 H new ATOM 0 HG3 ARG A 172 14.212 4.298 -13.757 1.00 5.91 H new ATOM 0 HD2 ARG A 172 15.073 3.987 -11.570 1.00 6.49 H new ATOM 0 HD3 ARG A 172 13.512 4.744 -11.320 1.00 6.49 H new ATOM 0 HE ARG A 172 13.105 1.926 -11.277 1.00 7.26 H new ATOM 0 HH11 ARG A 172 14.760 4.411 -9.301 1.00 8.85 H new ATOM 0 HH12 ARG A 172 14.564 3.489 -7.807 1.00 8.85 H new ATOM 0 HH21 ARG A 172 12.864 0.792 -9.339 1.00 9.48 H new ATOM 0 HH22 ARG A 172 13.498 1.454 -7.829 1.00 9.48 H new TER 2635 ARG A 172