USER MOD reduce.3.24.130724 H: found=0, std=0, add=1228, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1226 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 128 SER OG : rot -99:sc= 0.128 USER MOD Set 1.2: A 130 ASN : amide:sc= -0.195 K(o=-0.068,f=-2.8!) USER MOD Set 2.1: A 108 TYR OH : rot 104:sc= 1.18 USER MOD Set 2.2: A 152 HIS : no HD1:sc= 0.0509 K(o=1.2,f=-6.4!) USER MOD Set 2.3: A 155 HIS : no HD1:sc= -0.0154 X(o=1.2,f=1.2) USER MOD Set 3.1: A 103 TYR OH : rot 83:sc= 1.3 USER MOD Set 3.2: A 157 HIS : no HE2:sc= 0.605 K(o=1.9,f=-4.1) USER MOD Set 4.1: A 82 ASN : amide:sc= -0.836 K(o=-7.3,f=-4.5!) USER MOD Set 4.2: A 83 ASN : amide:sc= -6.48! K(o=-7.3!,f=-1.5) USER MOD Single : A 1 MET CE :methyl -160:sc= -0.133 (180deg=-0.692) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -170:sc= -0.0114 (180deg=-0.123) USER MOD Single : A 11 ASN : amide:sc= 0.0712 K(o=0.071,f=-6.1!) USER MOD Single : A 13 GLN : amide:sc= -1.09 K(o=-1.1,f=-7.8!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.824! K(o=-0.82!,f=-0.027) USER MOD Single : A 32 GLN : amide:sc= -1.39 K(o=-1.4,f=-6.2!) USER MOD Single : A 36 MET CE :methyl -177:sc= -1.09 (180deg=-1.18) USER MOD Single : A 37 ASN : amide:sc= -1.86 K(o=-1.9,f=-3.1) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.42) USER MOD Single : A 55 THR OG1 : rot 43:sc= -1.29! USER MOD Single : A 58 SER OG : rot -7:sc= 0.876 USER MOD Single : A 68 THR OG1 : rot 108:sc= -0.774 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0.556 K(o=0.56,f=-0.19) USER MOD Single : A 79 ASN : amide:sc= -0.655 K(o=-0.65,f=-2.5) USER MOD Single : A 81 LYS NZ :NH3+ -171:sc= -0.0145 (180deg=-0.117) USER MOD Single : A 84 ASN : amide:sc= -0.287 K(o=-0.29,f=-3.2!) USER MOD Single : A 94 GLN : amide:sc= 0.319 X(o=0.32,f=0) USER MOD Single : A 101 THR OG1 : rot 140:sc= 0.56 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -0.683 K(o=-0.68,f=0) USER MOD Single : A 122 MET CE :methyl -136:sc= -4.13! (180deg=-5.9!) USER MOD Single : A 125 HIS : no HE2:sc= -0.767 X(o=-0.77,f=-1.2) USER MOD Single : A 131 TYR OH : rot 180:sc= 0.801 USER MOD Single : A 136 SER OG : rot 85:sc= 0.917 USER MOD Single : A 143 GLN : amide:sc= -0.714 K(o=-0.71,f=-3.6!) USER MOD Single : A 144 GLN : amide:sc= -0.89 X(o=-0.89,f=-0.59) USER MOD Single : A 149 SER OG : rot 83:sc= 0.67 USER MOD Single : A 153 HIS : no HD1:sc= -2.54 K(o=-2.5,f=-2) USER MOD Single : A 154 HIS : no HD1:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 156 HIS : no HE2:sc= 0.533 K(o=0.53,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.270 0.345 22.317 1.00 54.03 N ATOM 2 CA MET A 1 3.152 0.382 21.115 1.00 50.34 C ATOM 3 C MET A 1 3.874 -0.960 20.913 1.00 60.12 C ATOM 4 O MET A 1 4.844 -1.262 21.608 1.00 53.14 O ATOM 5 CB MET A 1 4.176 1.521 21.249 1.00 41.45 C ATOM 6 CG MET A 1 5.109 1.662 20.050 1.00 10.11 C ATOM 7 SD MET A 1 6.292 3.014 20.231 1.00 74.00 S ATOM 8 CE MET A 1 5.184 4.420 20.337 1.00 21.44 C ATOM 0 H1 MET A 1 1.796 1.264 22.428 1.00 54.03 H new ATOM 0 H2 MET A 1 1.555 -0.401 22.200 1.00 54.03 H new ATOM 0 H3 MET A 1 2.843 0.147 23.162 1.00 54.03 H new ATOM 0 HA MET A 1 2.527 0.562 20.240 1.00 50.34 H new ATOM 0 HB2 MET A 1 3.642 2.460 21.393 1.00 41.45 H new ATOM 0 HB3 MET A 1 4.775 1.354 22.144 1.00 41.45 H new ATOM 0 HG2 MET A 1 5.652 0.728 19.908 1.00 10.11 H new ATOM 0 HG3 MET A 1 4.514 1.825 19.151 1.00 10.11 H new ATOM 0 HE1 MET A 1 5.730 5.332 20.097 1.00 21.44 H new ATOM 0 HE2 MET A 1 4.364 4.291 19.631 1.00 21.44 H new ATOM 0 HE3 MET A 1 4.784 4.492 21.348 1.00 21.44 H new ATOM 20 N ARG A 2 3.387 -1.764 19.968 1.00 60.43 N ATOM 21 CA ARG A 2 3.989 -3.069 19.665 1.00 51.33 C ATOM 22 C ARG A 2 4.834 -3.010 18.382 1.00 73.03 C ATOM 23 O ARG A 2 4.334 -2.652 17.311 1.00 50.12 O ATOM 24 CB ARG A 2 2.890 -4.127 19.512 1.00 21.52 C ATOM 25 CG ARG A 2 3.418 -5.549 19.331 1.00 61.45 C ATOM 26 CD ARG A 2 2.288 -6.552 19.109 1.00 62.53 C ATOM 27 NE ARG A 2 1.256 -6.449 20.136 1.00 15.25 N ATOM 28 CZ ARG A 2 0.658 -7.469 20.679 1.00 72.53 C ATOM 29 NH1 ARG A 2 0.981 -8.679 20.346 1.00 11.35 N ATOM 30 NH2 ARG A 2 -0.261 -7.277 21.566 1.00 22.45 N ATOM 0 H ARG A 2 2.574 -1.536 19.395 1.00 60.43 H new ATOM 0 HA ARG A 2 4.645 -3.338 20.493 1.00 51.33 H new ATOM 0 HB2 ARG A 2 2.247 -4.098 20.392 1.00 21.52 H new ATOM 0 HB3 ARG A 2 2.268 -3.869 18.654 1.00 21.52 H new ATOM 0 HG2 ARG A 2 4.101 -5.577 18.482 1.00 61.45 H new ATOM 0 HG3 ARG A 2 3.992 -5.838 20.211 1.00 61.45 H new ATOM 0 HD2 ARG A 2 1.842 -6.384 18.129 1.00 62.53 H new ATOM 0 HD3 ARG A 2 2.696 -7.563 19.105 1.00 62.53 H new ATOM 0 HE ARG A 2 0.986 -5.516 20.448 1.00 15.25 H new ATOM 0 HH11 ARG A 2 1.711 -8.839 19.652 1.00 11.35 H new ATOM 0 HH12 ARG A 2 0.505 -9.471 20.778 1.00 11.35 H new ATOM 0 HH21 ARG A 2 -0.516 -6.328 21.839 1.00 22.45 H new ATOM 0 HH22 ARG A 2 -0.732 -8.075 21.994 1.00 22.45 H new ATOM 44 N VAL A 3 6.107 -3.376 18.490 1.00 73.31 N ATOM 45 CA VAL A 3 7.034 -3.317 17.355 1.00 33.42 C ATOM 46 C VAL A 3 6.898 -4.538 16.425 1.00 24.52 C ATOM 47 O VAL A 3 7.192 -5.673 16.813 1.00 64.52 O ATOM 48 CB VAL A 3 8.499 -3.204 17.843 1.00 24.10 C ATOM 49 CG1 VAL A 3 9.473 -3.165 16.666 1.00 60.32 C ATOM 50 CG2 VAL A 3 8.671 -1.974 18.735 1.00 65.43 C ATOM 0 H VAL A 3 6.526 -3.719 19.354 1.00 73.31 H new ATOM 0 HA VAL A 3 6.769 -2.426 16.786 1.00 33.42 H new ATOM 0 HB VAL A 3 8.729 -4.092 18.432 1.00 24.10 H new ATOM 0 HG11 VAL A 3 10.493 -3.085 17.041 1.00 60.32 H new ATOM 0 HG12 VAL A 3 9.372 -4.078 16.080 1.00 60.32 H new ATOM 0 HG13 VAL A 3 9.249 -2.303 16.037 1.00 60.32 H new ATOM 0 HG21 VAL A 3 9.706 -1.909 19.070 1.00 65.43 H new ATOM 0 HG22 VAL A 3 8.415 -1.077 18.171 1.00 65.43 H new ATOM 0 HG23 VAL A 3 8.014 -2.058 19.601 1.00 65.43 H new ATOM 60 N TYR A 4 6.449 -4.291 15.197 1.00 21.10 N ATOM 61 CA TYR A 4 6.353 -5.331 14.169 1.00 53.13 C ATOM 62 C TYR A 4 7.564 -5.297 13.229 1.00 30.23 C ATOM 63 O TYR A 4 7.926 -4.248 12.696 1.00 40.24 O ATOM 64 CB TYR A 4 5.069 -5.159 13.344 1.00 31.23 C ATOM 65 CG TYR A 4 3.825 -5.737 13.994 1.00 50.15 C ATOM 66 CD1 TYR A 4 3.214 -5.110 15.072 1.00 73.23 C ATOM 67 CD2 TYR A 4 3.263 -6.918 13.519 1.00 42.44 C ATOM 68 CE1 TYR A 4 2.076 -5.640 15.653 1.00 11.20 C ATOM 69 CE2 TYR A 4 2.127 -7.452 14.094 1.00 12.20 C ATOM 70 CZ TYR A 4 1.538 -6.813 15.163 1.00 65.01 C ATOM 71 OH TYR A 4 0.405 -7.342 15.742 1.00 1.12 O ATOM 0 H TYR A 4 6.142 -3.370 14.885 1.00 21.10 H new ATOM 0 HA TYR A 4 6.331 -6.293 14.681 1.00 53.13 H new ATOM 0 HB2 TYR A 4 4.909 -4.096 13.161 1.00 31.23 H new ATOM 0 HB3 TYR A 4 5.210 -5.632 12.372 1.00 31.23 H new ATOM 0 HD1 TYR A 4 3.634 -4.195 15.463 1.00 73.23 H new ATOM 0 HD2 TYR A 4 3.724 -7.426 12.685 1.00 42.44 H new ATOM 0 HE1 TYR A 4 1.610 -5.137 16.488 1.00 11.20 H new ATOM 0 HE2 TYR A 4 1.702 -8.367 13.707 1.00 12.20 H new ATOM 0 HH TYR A 4 0.156 -8.169 15.278 1.00 1.12 H new ATOM 81 N LYS A 5 8.183 -6.456 13.040 1.00 24.24 N ATOM 82 CA LYS A 5 9.285 -6.611 12.087 1.00 30.34 C ATOM 83 C LYS A 5 8.806 -7.373 10.835 1.00 64.10 C ATOM 84 O LYS A 5 7.747 -8.006 10.860 1.00 43.14 O ATOM 85 CB LYS A 5 10.452 -7.347 12.768 1.00 51.52 C ATOM 86 CG LYS A 5 11.044 -6.583 13.948 1.00 33.51 C ATOM 87 CD LYS A 5 12.110 -7.395 14.675 1.00 53.23 C ATOM 88 CE LYS A 5 12.692 -6.630 15.860 1.00 71.44 C ATOM 89 NZ LYS A 5 13.412 -5.399 15.435 1.00 61.33 N ATOM 0 H LYS A 5 7.940 -7.313 13.538 1.00 24.24 H new ATOM 0 HA LYS A 5 9.630 -5.628 11.768 1.00 30.34 H new ATOM 0 HB2 LYS A 5 10.106 -8.321 13.113 1.00 51.52 H new ATOM 0 HB3 LYS A 5 11.236 -7.529 12.033 1.00 51.52 H new ATOM 0 HG2 LYS A 5 11.479 -5.648 13.594 1.00 33.51 H new ATOM 0 HG3 LYS A 5 10.249 -6.321 14.646 1.00 33.51 H new ATOM 0 HD2 LYS A 5 11.678 -8.333 15.024 1.00 53.23 H new ATOM 0 HD3 LYS A 5 12.909 -7.652 13.980 1.00 53.23 H new ATOM 0 HE2 LYS A 5 11.889 -6.361 16.546 1.00 71.44 H new ATOM 0 HE3 LYS A 5 13.376 -7.278 16.408 1.00 71.44 H new ATOM 0 HZ1 LYS A 5 13.932 -5.004 16.245 1.00 61.33 H new ATOM 0 HZ2 LYS A 5 14.082 -5.634 14.675 1.00 61.33 H new ATOM 0 HZ3 LYS A 5 12.726 -4.698 15.088 1.00 61.33 H new ATOM 103 N PRO A 6 9.566 -7.338 9.714 1.00 31.22 N ATOM 104 CA PRO A 6 9.165 -8.036 8.475 1.00 61.52 C ATOM 105 C PRO A 6 9.067 -9.557 8.667 1.00 2.24 C ATOM 106 O PRO A 6 8.490 -10.262 7.842 1.00 3.41 O ATOM 107 CB PRO A 6 10.281 -7.678 7.476 1.00 3.03 C ATOM 108 CG PRO A 6 11.446 -7.291 8.327 1.00 32.53 C ATOM 109 CD PRO A 6 10.860 -6.640 9.553 1.00 3.52 C ATOM 0 HA PRO A 6 8.173 -7.733 8.140 1.00 61.52 H new ATOM 0 HB2 PRO A 6 10.524 -8.525 6.834 1.00 3.03 H new ATOM 0 HB3 PRO A 6 9.979 -6.859 6.823 1.00 3.03 H new ATOM 0 HG2 PRO A 6 12.042 -8.164 8.595 1.00 32.53 H new ATOM 0 HG3 PRO A 6 12.106 -6.604 7.797 1.00 32.53 H new ATOM 0 HD2 PRO A 6 11.501 -6.771 10.425 1.00 3.52 H new ATOM 0 HD3 PRO A 6 10.725 -5.567 9.415 1.00 3.52 H new ATOM 117 N GLU A 7 9.635 -10.048 9.766 1.00 30.12 N ATOM 118 CA GLU A 7 9.584 -11.473 10.111 1.00 20.11 C ATOM 119 C GLU A 7 8.411 -11.789 11.062 1.00 60.55 C ATOM 120 O GLU A 7 8.218 -12.936 11.466 1.00 30.13 O ATOM 121 CB GLU A 7 10.920 -11.895 10.735 1.00 33.45 C ATOM 122 CG GLU A 7 11.302 -11.084 11.966 1.00 53.30 C ATOM 123 CD GLU A 7 12.735 -11.332 12.406 1.00 43.23 C ATOM 124 OE1 GLU A 7 12.980 -12.302 13.148 1.00 64.41 O ATOM 125 OE2 GLU A 7 13.624 -10.557 12.004 1.00 13.54 O ATOM 0 H GLU A 7 10.142 -9.476 10.441 1.00 30.12 H new ATOM 0 HA GLU A 7 9.415 -12.043 9.197 1.00 20.11 H new ATOM 0 HB2 GLU A 7 10.867 -12.949 11.007 1.00 33.45 H new ATOM 0 HB3 GLU A 7 11.707 -11.798 9.987 1.00 33.45 H new ATOM 0 HG2 GLU A 7 11.169 -10.023 11.753 1.00 53.30 H new ATOM 0 HG3 GLU A 7 10.626 -11.332 12.784 1.00 53.30 H new ATOM 132 N ASP A 8 7.648 -10.760 11.437 1.00 30.14 N ATOM 133 CA ASP A 8 6.406 -10.941 12.207 1.00 33.03 C ATOM 134 C ASP A 8 5.183 -10.923 11.283 1.00 53.32 C ATOM 135 O ASP A 8 4.195 -11.623 11.522 1.00 41.12 O ATOM 136 CB ASP A 8 6.259 -9.845 13.271 1.00 4.30 C ATOM 137 CG ASP A 8 7.284 -9.972 14.378 1.00 65.51 C ATOM 138 OD1 ASP A 8 7.194 -10.939 15.163 1.00 1.12 O ATOM 139 OD2 ASP A 8 8.189 -9.118 14.467 1.00 2.51 O ATOM 0 H ASP A 8 7.866 -9.787 11.221 1.00 30.14 H new ATOM 0 HA ASP A 8 6.463 -11.911 12.701 1.00 33.03 H new ATOM 0 HB2 ASP A 8 6.359 -8.868 12.798 1.00 4.30 H new ATOM 0 HB3 ASP A 8 5.258 -9.891 13.700 1.00 4.30 H new ATOM 144 N VAL A 9 5.259 -10.111 10.232 1.00 42.44 N ATOM 145 CA VAL A 9 4.166 -9.980 9.264 1.00 3.34 C ATOM 146 C VAL A 9 3.856 -11.325 8.571 1.00 23.53 C ATOM 147 O VAL A 9 4.738 -11.933 7.958 1.00 70.05 O ATOM 148 CB VAL A 9 4.503 -8.914 8.186 1.00 42.14 C ATOM 149 CG1 VAL A 9 3.353 -8.751 7.191 1.00 3.43 C ATOM 150 CG2 VAL A 9 4.851 -7.576 8.841 1.00 70.03 C ATOM 0 H VAL A 9 6.071 -9.529 10.025 1.00 42.44 H new ATOM 0 HA VAL A 9 3.285 -9.663 9.822 1.00 3.34 H new ATOM 0 HB VAL A 9 5.375 -9.261 7.631 1.00 42.14 H new ATOM 0 HG11 VAL A 9 3.618 -7.998 6.449 1.00 3.43 H new ATOM 0 HG12 VAL A 9 3.166 -9.702 6.693 1.00 3.43 H new ATOM 0 HG13 VAL A 9 2.454 -8.436 7.722 1.00 3.43 H new ATOM 0 HG21 VAL A 9 5.084 -6.843 8.069 1.00 70.03 H new ATOM 0 HG22 VAL A 9 4.002 -7.227 9.429 1.00 70.03 H new ATOM 0 HG23 VAL A 9 5.715 -7.704 9.493 1.00 70.03 H new ATOM 160 N PRO A 10 2.603 -11.813 8.676 1.00 31.21 N ATOM 161 CA PRO A 10 2.175 -13.063 8.016 1.00 21.02 C ATOM 162 C PRO A 10 2.260 -12.988 6.478 1.00 14.24 C ATOM 163 O PRO A 10 1.709 -12.078 5.858 1.00 20.33 O ATOM 164 CB PRO A 10 0.711 -13.230 8.466 1.00 64.22 C ATOM 165 CG PRO A 10 0.562 -12.346 9.662 1.00 74.42 C ATOM 166 CD PRO A 10 1.509 -11.200 9.448 1.00 10.02 C ATOM 0 HA PRO A 10 2.818 -13.899 8.291 1.00 21.02 H new ATOM 0 HB2 PRO A 10 0.021 -12.940 7.674 1.00 64.22 H new ATOM 0 HB3 PRO A 10 0.492 -14.268 8.715 1.00 64.22 H new ATOM 0 HG2 PRO A 10 -0.464 -11.992 9.760 1.00 74.42 H new ATOM 0 HG3 PRO A 10 0.802 -12.885 10.578 1.00 74.42 H new ATOM 0 HD2 PRO A 10 1.037 -10.384 8.901 1.00 10.02 H new ATOM 0 HD3 PRO A 10 1.864 -10.788 10.393 1.00 10.02 H new ATOM 174 N ASN A 11 2.944 -13.952 5.867 1.00 74.23 N ATOM 175 CA ASN A 11 3.089 -13.986 4.407 1.00 53.31 C ATOM 176 C ASN A 11 1.790 -14.455 3.721 1.00 25.15 C ATOM 177 O ASN A 11 1.627 -15.631 3.385 1.00 3.01 O ATOM 178 CB ASN A 11 4.285 -14.871 4.007 1.00 31.21 C ATOM 179 CG ASN A 11 4.210 -16.281 4.571 1.00 33.01 C ATOM 180 OD1 ASN A 11 3.585 -16.526 5.599 1.00 31.43 O ATOM 181 ND2 ASN A 11 4.868 -17.216 3.917 1.00 73.45 N ATOM 0 H ASN A 11 3.407 -14.719 6.355 1.00 74.23 H new ATOM 0 HA ASN A 11 3.285 -12.971 4.062 1.00 53.31 H new ATOM 0 HB2 ASN A 11 4.339 -14.925 2.920 1.00 31.21 H new ATOM 0 HB3 ASN A 11 5.206 -14.400 4.349 1.00 31.21 H new ATOM 0 HD21 ASN A 11 4.868 -18.176 4.262 1.00 73.45 H new ATOM 0 HD22 ASN A 11 5.378 -16.980 3.066 1.00 73.45 H new ATOM 188 N VAL A 12 0.863 -13.517 3.519 1.00 32.00 N ATOM 189 CA VAL A 12 -0.466 -13.845 2.975 1.00 13.32 C ATOM 190 C VAL A 12 -0.407 -14.386 1.532 1.00 30.42 C ATOM 191 O VAL A 12 -1.272 -15.154 1.122 1.00 73.24 O ATOM 192 CB VAL A 12 -1.431 -12.630 3.041 1.00 71.10 C ATOM 193 CG1 VAL A 12 -1.711 -12.240 4.492 1.00 33.21 C ATOM 194 CG2 VAL A 12 -0.874 -11.441 2.259 1.00 44.00 C ATOM 0 H VAL A 12 1.002 -12.527 3.721 1.00 32.00 H new ATOM 0 HA VAL A 12 -0.854 -14.640 3.612 1.00 13.32 H new ATOM 0 HB VAL A 12 -2.373 -12.924 2.577 1.00 71.10 H new ATOM 0 HG11 VAL A 12 -2.389 -11.387 4.515 1.00 33.21 H new ATOM 0 HG12 VAL A 12 -2.168 -13.081 5.013 1.00 33.21 H new ATOM 0 HG13 VAL A 12 -0.776 -11.973 4.984 1.00 33.21 H new ATOM 0 HG21 VAL A 12 -1.571 -10.605 2.323 1.00 44.00 H new ATOM 0 HG22 VAL A 12 0.087 -11.146 2.681 1.00 44.00 H new ATOM 0 HG23 VAL A 12 -0.740 -11.723 1.215 1.00 44.00 H new ATOM 204 N GLN A 13 0.626 -14.007 0.778 1.00 70.32 N ATOM 205 CA GLN A 13 0.796 -14.481 -0.611 1.00 43.10 C ATOM 206 C GLN A 13 0.941 -16.012 -0.691 1.00 22.24 C ATOM 207 O GLN A 13 0.812 -16.599 -1.766 1.00 73.10 O ATOM 208 CB GLN A 13 2.010 -13.802 -1.271 1.00 74.24 C ATOM 209 CG GLN A 13 1.752 -12.374 -1.754 1.00 14.12 C ATOM 210 CD GLN A 13 1.303 -11.430 -0.650 1.00 62.52 C ATOM 211 OE1 GLN A 13 1.648 -11.602 0.510 1.00 33.24 O ATOM 212 NE2 GLN A 13 0.531 -10.421 -1.005 1.00 75.41 N ATOM 0 H GLN A 13 1.360 -13.375 1.098 1.00 70.32 H new ATOM 0 HA GLN A 13 -0.109 -14.207 -1.153 1.00 43.10 H new ATOM 0 HB2 GLN A 13 2.835 -13.788 -0.558 1.00 74.24 H new ATOM 0 HB3 GLN A 13 2.332 -14.406 -2.119 1.00 74.24 H new ATOM 0 HG2 GLN A 13 2.663 -11.983 -2.207 1.00 14.12 H new ATOM 0 HG3 GLN A 13 0.991 -12.395 -2.534 1.00 14.12 H new ATOM 0 HE21 GLN A 13 0.261 -10.305 -1.982 1.00 75.41 H new ATOM 0 HE22 GLN A 13 0.205 -9.757 -0.303 1.00 75.41 H new ATOM 221 N LEU A 14 1.219 -16.650 0.446 1.00 72.50 N ATOM 222 CA LEU A 14 1.299 -18.113 0.514 1.00 71.23 C ATOM 223 C LEU A 14 -0.113 -18.728 0.491 1.00 21.33 C ATOM 224 O LEU A 14 -0.404 -19.622 -0.309 1.00 31.34 O ATOM 225 CB LEU A 14 2.070 -18.535 1.784 1.00 71.03 C ATOM 226 CG LEU A 14 2.490 -20.024 1.877 1.00 12.11 C ATOM 227 CD1 LEU A 14 3.588 -20.202 2.925 1.00 25.14 C ATOM 228 CD2 LEU A 14 1.301 -20.928 2.213 1.00 23.23 C ATOM 0 H LEU A 14 1.393 -16.179 1.334 1.00 72.50 H new ATOM 0 HA LEU A 14 1.839 -18.485 -0.357 1.00 71.23 H new ATOM 0 HB2 LEU A 14 2.969 -17.922 1.857 1.00 71.03 H new ATOM 0 HB3 LEU A 14 1.453 -18.300 2.651 1.00 71.03 H new ATOM 0 HG LEU A 14 2.871 -20.318 0.899 1.00 12.11 H new ATOM 0 HD11 LEU A 14 3.873 -21.253 2.979 1.00 25.14 H new ATOM 0 HD12 LEU A 14 4.456 -19.605 2.647 1.00 25.14 H new ATOM 0 HD13 LEU A 14 3.219 -19.876 3.897 1.00 25.14 H new ATOM 0 HD21 LEU A 14 1.636 -21.964 2.269 1.00 23.23 H new ATOM 0 HD22 LEU A 14 0.878 -20.631 3.172 1.00 23.23 H new ATOM 0 HD23 LEU A 14 0.542 -20.834 1.437 1.00 23.23 H new ATOM 240 N ALA A 15 -0.985 -18.242 1.373 1.00 22.25 N ATOM 241 CA ALA A 15 -2.360 -18.751 1.474 1.00 22.31 C ATOM 242 C ALA A 15 -3.359 -17.823 0.766 1.00 41.44 C ATOM 243 O ALA A 15 -3.920 -18.170 -0.277 1.00 51.41 O ATOM 244 CB ALA A 15 -2.743 -18.930 2.940 1.00 63.31 C ATOM 0 H ALA A 15 -0.767 -17.494 2.032 1.00 22.25 H new ATOM 0 HA ALA A 15 -2.400 -19.718 0.973 1.00 22.31 H new ATOM 0 HB1 ALA A 15 -3.763 -19.307 3.006 1.00 63.31 H new ATOM 0 HB2 ALA A 15 -2.062 -19.640 3.410 1.00 63.31 H new ATOM 0 HB3 ALA A 15 -2.677 -17.971 3.453 1.00 63.31 H new ATOM 250 N ASP A 16 -3.569 -16.638 1.333 1.00 34.43 N ATOM 251 CA ASP A 16 -4.476 -15.643 0.752 1.00 2.35 C ATOM 252 C ASP A 16 -3.810 -14.850 -0.385 1.00 4.24 C ATOM 253 O ASP A 16 -3.749 -13.614 -0.358 1.00 25.22 O ATOM 254 CB ASP A 16 -4.975 -14.694 1.846 1.00 15.51 C ATOM 255 CG ASP A 16 -5.994 -15.351 2.757 1.00 14.40 C ATOM 256 OD1 ASP A 16 -5.589 -16.099 3.664 1.00 31.34 O ATOM 257 OD2 ASP A 16 -7.209 -15.130 2.552 1.00 75.32 O ATOM 0 H ASP A 16 -3.122 -16.339 2.200 1.00 34.43 H new ATOM 0 HA ASP A 16 -5.323 -16.176 0.319 1.00 2.35 H new ATOM 0 HB2 ASP A 16 -4.128 -14.350 2.440 1.00 15.51 H new ATOM 0 HB3 ASP A 16 -5.419 -13.812 1.384 1.00 15.51 H new ATOM 262 N SER A 17 -3.330 -15.568 -1.399 1.00 51.02 N ATOM 263 CA SER A 17 -2.729 -14.941 -2.583 1.00 23.34 C ATOM 264 C SER A 17 -3.771 -14.138 -3.367 1.00 73.35 C ATOM 265 O SER A 17 -3.428 -13.300 -4.199 1.00 5.12 O ATOM 266 CB SER A 17 -2.102 -16.003 -3.496 1.00 21.24 C ATOM 267 OG SER A 17 -3.074 -16.937 -3.943 1.00 75.52 O ATOM 0 H SER A 17 -3.344 -16.588 -1.428 1.00 51.02 H new ATOM 0 HA SER A 17 -1.950 -14.261 -2.239 1.00 23.34 H new ATOM 0 HB2 SER A 17 -1.637 -15.519 -4.355 1.00 21.24 H new ATOM 0 HB3 SER A 17 -1.311 -16.527 -2.959 1.00 21.24 H new ATOM 0 HG SER A 17 -2.647 -17.601 -4.524 1.00 75.52 H new ATOM 273 N THR A 18 -5.048 -14.410 -3.098 1.00 32.52 N ATOM 274 CA THR A 18 -6.159 -13.672 -3.719 1.00 51.43 C ATOM 275 C THR A 18 -6.651 -12.514 -2.829 1.00 25.42 C ATOM 276 O THR A 18 -7.626 -11.835 -3.158 1.00 0.25 O ATOM 277 CB THR A 18 -7.351 -14.610 -4.017 1.00 32.44 C ATOM 278 OG1 THR A 18 -7.832 -15.202 -2.800 1.00 42.31 O ATOM 279 CG2 THR A 18 -6.945 -15.712 -4.993 1.00 21.41 C ATOM 0 H THR A 18 -5.345 -15.140 -2.450 1.00 32.52 H new ATOM 0 HA THR A 18 -5.772 -13.260 -4.651 1.00 51.43 H new ATOM 0 HB THR A 18 -8.144 -14.015 -4.470 1.00 32.44 H new ATOM 0 HG1 THR A 18 -8.588 -15.793 -3.000 1.00 42.31 H new ATOM 0 HG21 THR A 18 -7.800 -16.359 -5.187 1.00 21.41 H new ATOM 0 HG22 THR A 18 -6.609 -15.264 -5.928 1.00 21.41 H new ATOM 0 HG23 THR A 18 -6.135 -16.300 -4.561 1.00 21.41 H new ATOM 287 N ARG A 19 -5.978 -12.300 -1.698 1.00 32.14 N ATOM 288 CA ARG A 19 -6.307 -11.190 -0.788 1.00 53.40 C ATOM 289 C ARG A 19 -5.262 -10.066 -0.901 1.00 23.01 C ATOM 290 O ARG A 19 -5.603 -8.905 -1.108 1.00 53.31 O ATOM 291 CB ARG A 19 -6.364 -11.689 0.663 1.00 2.41 C ATOM 292 CG ARG A 19 -6.819 -10.630 1.667 1.00 4.20 C ATOM 293 CD ARG A 19 -6.562 -11.051 3.115 1.00 43.02 C ATOM 294 NE ARG A 19 -7.165 -12.344 3.442 1.00 31.44 N ATOM 295 CZ ARG A 19 -7.650 -12.659 4.613 1.00 52.34 C ATOM 296 NH1 ARG A 19 -7.663 -11.795 5.581 1.00 11.50 N ATOM 297 NH2 ARG A 19 -8.110 -13.850 4.816 1.00 21.24 N ATOM 0 H ARG A 19 -5.199 -12.879 -1.385 1.00 32.14 H new ATOM 0 HA ARG A 19 -7.283 -10.797 -1.074 1.00 53.40 H new ATOM 0 HB2 ARG A 19 -7.042 -12.541 0.717 1.00 2.41 H new ATOM 0 HB3 ARG A 19 -5.376 -12.048 0.952 1.00 2.41 H new ATOM 0 HG2 ARG A 19 -6.297 -9.694 1.465 1.00 4.20 H new ATOM 0 HG3 ARG A 19 -7.883 -10.438 1.531 1.00 4.20 H new ATOM 0 HD2 ARG A 19 -5.487 -11.101 3.289 1.00 43.02 H new ATOM 0 HD3 ARG A 19 -6.958 -10.289 3.786 1.00 43.02 H new ATOM 0 HE ARG A 19 -7.209 -13.047 2.705 1.00 31.44 H new ATOM 0 HH11 ARG A 19 -7.292 -10.857 5.432 1.00 11.50 H new ATOM 0 HH12 ARG A 19 -8.045 -12.054 6.491 1.00 11.50 H new ATOM 0 HH21 ARG A 19 -8.093 -14.538 4.064 1.00 21.24 H new ATOM 0 HH22 ARG A 19 -8.490 -14.101 5.729 1.00 21.24 H new ATOM 311 N LEU A 20 -3.985 -10.439 -0.736 1.00 34.35 N ATOM 312 CA LEU A 20 -2.844 -9.501 -0.826 1.00 63.04 C ATOM 313 C LEU A 20 -2.845 -8.450 0.307 1.00 41.24 C ATOM 314 O LEU A 20 -1.961 -7.593 0.366 1.00 33.50 O ATOM 315 CB LEU A 20 -2.787 -8.795 -2.200 1.00 41.14 C ATOM 316 CG LEU A 20 -2.564 -9.712 -3.426 1.00 11.04 C ATOM 317 CD1 LEU A 20 -3.881 -10.303 -3.924 1.00 45.34 C ATOM 318 CD2 LEU A 20 -1.856 -8.952 -4.545 1.00 14.03 C ATOM 0 H LEU A 20 -3.708 -11.400 -0.536 1.00 34.35 H new ATOM 0 HA LEU A 20 -1.950 -10.113 -0.710 1.00 63.04 H new ATOM 0 HB2 LEU A 20 -3.719 -8.249 -2.345 1.00 41.14 H new ATOM 0 HB3 LEU A 20 -1.986 -8.056 -2.174 1.00 41.14 H new ATOM 0 HG LEU A 20 -1.926 -10.539 -3.113 1.00 11.04 H new ATOM 0 HD11 LEU A 20 -3.690 -10.942 -4.786 1.00 45.34 H new ATOM 0 HD12 LEU A 20 -4.339 -10.892 -3.129 1.00 45.34 H new ATOM 0 HD13 LEU A 20 -4.555 -9.497 -4.213 1.00 45.34 H new ATOM 0 HD21 LEU A 20 -1.709 -9.614 -5.398 1.00 14.03 H new ATOM 0 HD22 LEU A 20 -2.465 -8.100 -4.848 1.00 14.03 H new ATOM 0 HD23 LEU A 20 -0.888 -8.598 -4.189 1.00 14.03 H new ATOM 330 N VAL A 21 -3.818 -8.530 1.211 1.00 2.21 N ATOM 331 CA VAL A 21 -3.928 -7.588 2.334 1.00 42.43 C ATOM 332 C VAL A 21 -3.547 -8.245 3.672 1.00 62.44 C ATOM 333 O VAL A 21 -3.873 -9.405 3.922 1.00 32.40 O ATOM 334 CB VAL A 21 -5.366 -7.015 2.434 1.00 50.52 C ATOM 335 CG1 VAL A 21 -5.543 -6.163 3.692 1.00 12.41 C ATOM 336 CG2 VAL A 21 -5.712 -6.205 1.184 1.00 43.25 C ATOM 0 H VAL A 21 -4.549 -9.241 1.191 1.00 2.21 H new ATOM 0 HA VAL A 21 -3.226 -6.777 2.137 1.00 42.43 H new ATOM 0 HB VAL A 21 -6.054 -7.858 2.504 1.00 50.52 H new ATOM 0 HG11 VAL A 21 -6.562 -5.778 3.730 1.00 12.41 H new ATOM 0 HG12 VAL A 21 -5.353 -6.774 4.575 1.00 12.41 H new ATOM 0 HG13 VAL A 21 -4.841 -5.330 3.669 1.00 12.41 H new ATOM 0 HG21 VAL A 21 -6.725 -5.812 1.274 1.00 43.25 H new ATOM 0 HG22 VAL A 21 -5.010 -5.378 1.080 1.00 43.25 H new ATOM 0 HG23 VAL A 21 -5.649 -6.847 0.305 1.00 43.25 H new ATOM 346 N THR A 22 -2.849 -7.494 4.523 1.00 41.44 N ATOM 347 CA THR A 22 -2.474 -7.962 5.867 1.00 1.41 C ATOM 348 C THR A 22 -2.819 -6.900 6.923 1.00 11.31 C ATOM 349 O THR A 22 -2.127 -5.885 7.048 1.00 3.23 O ATOM 350 CB THR A 22 -0.959 -8.281 5.958 1.00 54.31 C ATOM 351 OG1 THR A 22 -0.583 -9.202 4.924 1.00 12.32 O ATOM 352 CG2 THR A 22 -0.596 -8.870 7.318 1.00 11.30 C ATOM 0 H THR A 22 -2.527 -6.550 4.308 1.00 41.44 H new ATOM 0 HA THR A 22 -3.039 -8.874 6.057 1.00 1.41 H new ATOM 0 HB THR A 22 -0.416 -7.345 5.830 1.00 54.31 H new ATOM 0 HG1 THR A 22 0.376 -9.395 4.990 1.00 12.32 H new ATOM 0 HG21 THR A 22 0.473 -9.082 7.349 1.00 11.30 H new ATOM 0 HG22 THR A 22 -0.847 -8.156 8.102 1.00 11.30 H new ATOM 0 HG23 THR A 22 -1.154 -9.793 7.475 1.00 11.30 H new ATOM 360 N ASP A 23 -3.900 -7.118 7.668 1.00 61.30 N ATOM 361 CA ASP A 23 -4.344 -6.152 8.675 1.00 64.12 C ATOM 362 C ASP A 23 -3.929 -6.566 10.102 1.00 65.12 C ATOM 363 O ASP A 23 -4.588 -7.374 10.758 1.00 70.21 O ATOM 364 CB ASP A 23 -5.862 -5.944 8.574 1.00 3.13 C ATOM 365 CG ASP A 23 -6.657 -7.225 8.776 1.00 11.12 C ATOM 366 OD1 ASP A 23 -6.456 -8.184 8.004 1.00 4.52 O ATOM 367 OD2 ASP A 23 -7.495 -7.269 9.705 1.00 23.30 O ATOM 0 H ASP A 23 -4.484 -7.951 7.596 1.00 61.30 H new ATOM 0 HA ASP A 23 -3.846 -5.204 8.470 1.00 64.12 H new ATOM 0 HB2 ASP A 23 -6.172 -5.210 9.318 1.00 3.13 H new ATOM 0 HB3 ASP A 23 -6.101 -5.526 7.596 1.00 3.13 H new ATOM 372 N GLU A 24 -2.809 -6.011 10.565 1.00 23.41 N ATOM 373 CA GLU A 24 -2.324 -6.250 11.932 1.00 52.13 C ATOM 374 C GLU A 24 -2.673 -5.069 12.852 1.00 42.40 C ATOM 375 O GLU A 24 -3.125 -5.255 13.981 1.00 34.21 O ATOM 376 CB GLU A 24 -0.805 -6.483 11.920 1.00 35.32 C ATOM 377 CG GLU A 24 -0.372 -7.725 11.141 1.00 4.34 C ATOM 378 CD GLU A 24 -0.914 -9.014 11.746 1.00 40.14 C ATOM 379 OE1 GLU A 24 -0.431 -9.415 12.826 1.00 30.02 O ATOM 380 OE2 GLU A 24 -1.829 -9.626 11.154 1.00 0.34 O ATOM 0 H GLU A 24 -2.216 -5.390 10.014 1.00 23.41 H new ATOM 0 HA GLU A 24 -2.817 -7.141 12.320 1.00 52.13 H new ATOM 0 HB2 GLU A 24 -0.317 -5.608 11.490 1.00 35.32 H new ATOM 0 HB3 GLU A 24 -0.453 -6.571 12.948 1.00 35.32 H new ATOM 0 HG2 GLU A 24 -0.714 -7.640 10.110 1.00 4.34 H new ATOM 0 HG3 GLU A 24 0.717 -7.771 11.113 1.00 4.34 H new ATOM 387 N ALA A 25 -2.452 -3.847 12.356 1.00 3.23 N ATOM 388 CA ALA A 25 -2.814 -2.626 13.095 1.00 14.53 C ATOM 389 C ALA A 25 -4.331 -2.506 13.314 1.00 40.22 C ATOM 390 O ALA A 25 -4.781 -1.826 14.235 1.00 5.43 O ATOM 391 CB ALA A 25 -2.302 -1.395 12.357 1.00 53.20 C ATOM 0 H ALA A 25 -2.024 -3.674 11.446 1.00 3.23 H new ATOM 0 HA ALA A 25 -2.343 -2.692 14.076 1.00 14.53 H new ATOM 0 HB1 ALA A 25 -2.575 -0.498 12.912 1.00 53.20 H new ATOM 0 HB2 ALA A 25 -1.217 -1.450 12.267 1.00 53.20 H new ATOM 0 HB3 ALA A 25 -2.747 -1.356 11.363 1.00 53.20 H new ATOM 397 N GLY A 26 -5.108 -3.159 12.452 1.00 73.15 N ATOM 398 CA GLY A 26 -6.564 -3.100 12.549 1.00 13.35 C ATOM 399 C GLY A 26 -7.143 -1.739 12.162 1.00 64.13 C ATOM 400 O GLY A 26 -8.204 -1.347 12.648 1.00 50.33 O ATOM 0 H GLY A 26 -4.757 -3.731 11.684 1.00 73.15 H new ATOM 0 HA2 GLY A 26 -6.995 -3.866 11.905 1.00 13.35 H new ATOM 0 HA3 GLY A 26 -6.863 -3.337 13.570 1.00 13.35 H new ATOM 404 N LEU A 27 -6.451 -1.021 11.276 1.00 21.50 N ATOM 405 CA LEU A 27 -6.895 0.309 10.823 1.00 14.31 C ATOM 406 C LEU A 27 -7.869 0.209 9.636 1.00 41.34 C ATOM 407 O LEU A 27 -8.238 1.218 9.037 1.00 5.25 O ATOM 408 CB LEU A 27 -5.677 1.162 10.434 1.00 2.12 C ATOM 409 CG LEU A 27 -4.686 1.450 11.576 1.00 31.25 C ATOM 410 CD1 LEU A 27 -3.455 2.183 11.052 1.00 34.43 C ATOM 411 CD2 LEU A 27 -5.361 2.256 12.683 1.00 3.25 C ATOM 0 H LEU A 27 -5.577 -1.335 10.854 1.00 21.50 H new ATOM 0 HA LEU A 27 -7.425 0.784 11.648 1.00 14.31 H new ATOM 0 HB2 LEU A 27 -5.142 0.657 9.629 1.00 2.12 H new ATOM 0 HB3 LEU A 27 -6.032 2.112 10.034 1.00 2.12 H new ATOM 0 HG LEU A 27 -4.362 0.497 11.994 1.00 31.25 H new ATOM 0 HD11 LEU A 27 -2.768 2.376 11.876 1.00 34.43 H new ATOM 0 HD12 LEU A 27 -2.958 1.568 10.302 1.00 34.43 H new ATOM 0 HD13 LEU A 27 -3.758 3.129 10.603 1.00 34.43 H new ATOM 0 HD21 LEU A 27 -4.644 2.449 13.481 1.00 3.25 H new ATOM 0 HD22 LEU A 27 -5.717 3.203 12.278 1.00 3.25 H new ATOM 0 HD23 LEU A 27 -6.204 1.692 13.082 1.00 3.25 H new ATOM 423 N LEU A 28 -8.277 -1.016 9.304 1.00 21.32 N ATOM 424 CA LEU A 28 -9.203 -1.258 8.190 1.00 42.12 C ATOM 425 C LEU A 28 -10.528 -1.863 8.679 1.00 74.32 C ATOM 426 O LEU A 28 -10.541 -2.915 9.316 1.00 24.44 O ATOM 427 CB LEU A 28 -8.556 -2.205 7.162 1.00 70.11 C ATOM 428 CG LEU A 28 -7.314 -1.655 6.442 1.00 32.44 C ATOM 429 CD1 LEU A 28 -6.704 -2.717 5.526 1.00 12.12 C ATOM 430 CD2 LEU A 28 -7.664 -0.399 5.649 1.00 22.30 C ATOM 0 H LEU A 28 -7.981 -1.862 9.791 1.00 21.32 H new ATOM 0 HA LEU A 28 -9.417 -0.296 7.724 1.00 42.12 H new ATOM 0 HB2 LEU A 28 -8.280 -3.129 7.670 1.00 70.11 H new ATOM 0 HB3 LEU A 28 -9.304 -2.464 6.412 1.00 70.11 H new ATOM 0 HG LEU A 28 -6.573 -1.389 7.196 1.00 32.44 H new ATOM 0 HD11 LEU A 28 -5.827 -2.306 5.027 1.00 12.12 H new ATOM 0 HD12 LEU A 28 -6.412 -3.584 6.118 1.00 12.12 H new ATOM 0 HD13 LEU A 28 -7.438 -3.019 4.779 1.00 12.12 H new ATOM 0 HD21 LEU A 28 -6.772 -0.025 5.147 1.00 22.30 H new ATOM 0 HD22 LEU A 28 -8.425 -0.638 4.906 1.00 22.30 H new ATOM 0 HD23 LEU A 28 -8.046 0.365 6.327 1.00 22.30 H new ATOM 442 N SER A 29 -11.640 -1.187 8.394 1.00 74.22 N ATOM 443 CA SER A 29 -12.972 -1.746 8.671 1.00 71.55 C ATOM 444 C SER A 29 -13.219 -2.984 7.797 1.00 74.10 C ATOM 445 O SER A 29 -12.763 -3.035 6.654 1.00 11.41 O ATOM 446 CB SER A 29 -14.070 -0.699 8.419 1.00 13.15 C ATOM 447 OG SER A 29 -13.936 0.416 9.291 1.00 1.54 O ATOM 0 H SER A 29 -11.651 -0.257 7.974 1.00 74.22 H new ATOM 0 HA SER A 29 -13.007 -2.036 9.721 1.00 71.55 H new ATOM 0 HB2 SER A 29 -14.021 -0.361 7.384 1.00 13.15 H new ATOM 0 HB3 SER A 29 -15.049 -1.156 8.559 1.00 13.15 H new ATOM 0 HG SER A 29 -14.647 1.064 9.105 1.00 1.54 H new ATOM 453 N ASN A 30 -13.949 -3.967 8.327 1.00 53.15 N ATOM 454 CA ASN A 30 -14.144 -5.258 7.641 1.00 65.25 C ATOM 455 C ASN A 30 -14.558 -5.093 6.166 1.00 65.42 C ATOM 456 O ASN A 30 -14.008 -5.750 5.280 1.00 14.33 O ATOM 457 CB ASN A 30 -15.168 -6.112 8.395 1.00 33.43 C ATOM 458 CG ASN A 30 -14.692 -6.515 9.784 1.00 21.23 C ATOM 459 OD1 ASN A 30 -15.489 -6.687 10.700 1.00 72.24 O ATOM 460 ND2 ASN A 30 -13.394 -6.681 9.955 1.00 64.10 N ATOM 0 H ASN A 30 -14.418 -3.899 9.230 1.00 53.15 H new ATOM 0 HA ASN A 30 -13.180 -5.767 7.641 1.00 65.25 H new ATOM 0 HB2 ASN A 30 -16.102 -5.558 8.483 1.00 33.43 H new ATOM 0 HB3 ASN A 30 -15.383 -7.009 7.815 1.00 33.43 H new ATOM 0 HD21 ASN A 30 -13.031 -6.959 10.867 1.00 64.10 H new ATOM 0 HD22 ASN A 30 -12.754 -6.531 9.175 1.00 64.10 H new ATOM 467 N ALA A 31 -15.519 -4.213 5.903 1.00 15.55 N ATOM 468 CA ALA A 31 -15.928 -3.911 4.526 1.00 42.14 C ATOM 469 C ALA A 31 -14.758 -3.332 3.713 1.00 11.02 C ATOM 470 O ALA A 31 -14.499 -3.764 2.591 1.00 34.44 O ATOM 471 CB ALA A 31 -17.105 -2.942 4.521 1.00 50.11 C ATOM 0 H ALA A 31 -16.030 -3.696 6.618 1.00 15.55 H new ATOM 0 HA ALA A 31 -16.238 -4.844 4.056 1.00 42.14 H new ATOM 0 HB1 ALA A 31 -17.396 -2.728 3.493 1.00 50.11 H new ATOM 0 HB2 ALA A 31 -17.946 -3.389 5.051 1.00 50.11 H new ATOM 0 HB3 ALA A 31 -16.815 -2.015 5.016 1.00 50.11 H new ATOM 477 N GLN A 32 -14.041 -2.364 4.294 1.00 23.33 N ATOM 478 CA GLN A 32 -12.882 -1.744 3.634 1.00 63.23 C ATOM 479 C GLN A 32 -11.818 -2.787 3.265 1.00 75.24 C ATOM 480 O GLN A 32 -11.179 -2.688 2.215 1.00 63.14 O ATOM 481 CB GLN A 32 -12.260 -0.667 4.537 1.00 75.31 C ATOM 482 CG GLN A 32 -13.141 0.561 4.756 1.00 31.13 C ATOM 483 CD GLN A 32 -13.364 1.378 3.491 1.00 74.23 C ATOM 484 OE1 GLN A 32 -13.396 0.855 2.383 1.00 54.33 O ATOM 485 NE2 GLN A 32 -13.515 2.676 3.647 1.00 74.31 N ATOM 0 H GLN A 32 -14.242 -1.991 5.222 1.00 23.33 H new ATOM 0 HA GLN A 32 -13.240 -1.281 2.714 1.00 63.23 H new ATOM 0 HB2 GLN A 32 -12.030 -1.111 5.506 1.00 75.31 H new ATOM 0 HB3 GLN A 32 -11.314 -0.347 4.101 1.00 75.31 H new ATOM 0 HG2 GLN A 32 -14.106 0.241 5.148 1.00 31.13 H new ATOM 0 HG3 GLN A 32 -12.684 1.197 5.514 1.00 31.13 H new ATOM 0 HE21 GLN A 32 -13.484 3.084 4.581 1.00 74.31 H new ATOM 0 HE22 GLN A 32 -13.663 3.274 2.834 1.00 74.31 H new ATOM 494 N GLU A 33 -11.630 -3.774 4.144 1.00 12.40 N ATOM 495 CA GLU A 33 -10.728 -4.898 3.875 1.00 51.21 C ATOM 496 C GLU A 33 -11.104 -5.579 2.553 1.00 61.11 C ATOM 497 O GLU A 33 -10.285 -5.704 1.644 1.00 63.31 O ATOM 498 CB GLU A 33 -10.813 -5.927 5.013 1.00 63.30 C ATOM 499 CG GLU A 33 -10.440 -5.381 6.390 1.00 32.32 C ATOM 500 CD GLU A 33 -10.809 -6.333 7.524 1.00 42.41 C ATOM 501 OE1 GLU A 33 -11.032 -7.536 7.257 1.00 53.41 O ATOM 502 OE2 GLU A 33 -10.890 -5.880 8.686 1.00 63.32 O ATOM 0 H GLU A 33 -12.092 -3.818 5.052 1.00 12.40 H new ATOM 0 HA GLU A 33 -9.711 -4.513 3.806 1.00 51.21 H new ATOM 0 HB2 GLU A 33 -11.829 -6.320 5.055 1.00 63.30 H new ATOM 0 HB3 GLU A 33 -10.156 -6.765 4.778 1.00 63.30 H new ATOM 0 HG2 GLU A 33 -9.368 -5.186 6.420 1.00 32.32 H new ATOM 0 HG3 GLU A 33 -10.942 -4.426 6.545 1.00 32.32 H new ATOM 509 N GLU A 34 -12.368 -5.984 2.450 1.00 12.44 N ATOM 510 CA GLU A 34 -12.867 -6.692 1.271 1.00 74.12 C ATOM 511 C GLU A 34 -12.861 -5.793 0.022 1.00 23.31 C ATOM 512 O GLU A 34 -12.486 -6.229 -1.068 1.00 64.40 O ATOM 513 CB GLU A 34 -14.280 -7.220 1.544 1.00 40.14 C ATOM 514 CG GLU A 34 -14.796 -8.179 0.480 1.00 63.21 C ATOM 515 CD GLU A 34 -13.866 -9.367 0.260 1.00 22.05 C ATOM 516 OE1 GLU A 34 -13.652 -10.142 1.216 1.00 25.32 O ATOM 517 OE2 GLU A 34 -13.330 -9.522 -0.862 1.00 32.13 O ATOM 0 H GLU A 34 -13.071 -5.833 3.174 1.00 12.44 H new ATOM 0 HA GLU A 34 -12.199 -7.530 1.071 1.00 74.12 H new ATOM 0 HB2 GLU A 34 -14.288 -7.726 2.510 1.00 40.14 H new ATOM 0 HB3 GLU A 34 -14.965 -6.375 1.621 1.00 40.14 H new ATOM 0 HG2 GLU A 34 -15.781 -8.543 0.771 1.00 63.21 H new ATOM 0 HG3 GLU A 34 -14.920 -7.641 -0.460 1.00 63.21 H new ATOM 524 N VAL A 35 -13.274 -4.535 0.184 1.00 25.31 N ATOM 525 CA VAL A 35 -13.236 -3.560 -0.916 1.00 45.21 C ATOM 526 C VAL A 35 -11.800 -3.383 -1.442 1.00 31.13 C ATOM 527 O VAL A 35 -11.575 -3.212 -2.643 1.00 41.03 O ATOM 528 CB VAL A 35 -13.804 -2.185 -0.473 1.00 3.41 C ATOM 529 CG1 VAL A 35 -13.709 -1.158 -1.601 1.00 31.21 C ATOM 530 CG2 VAL A 35 -15.250 -2.328 -0.003 1.00 2.42 C ATOM 0 H VAL A 35 -13.638 -4.165 1.062 1.00 25.31 H new ATOM 0 HA VAL A 35 -13.863 -3.951 -1.717 1.00 45.21 H new ATOM 0 HB VAL A 35 -13.200 -1.827 0.361 1.00 3.41 H new ATOM 0 HG11 VAL A 35 -14.114 -0.205 -1.261 1.00 31.21 H new ATOM 0 HG12 VAL A 35 -12.665 -1.027 -1.887 1.00 31.21 H new ATOM 0 HG13 VAL A 35 -14.279 -1.509 -2.461 1.00 31.21 H new ATOM 0 HG21 VAL A 35 -15.631 -1.354 0.304 1.00 2.42 H new ATOM 0 HG22 VAL A 35 -15.861 -2.716 -0.818 1.00 2.42 H new ATOM 0 HG23 VAL A 35 -15.292 -3.016 0.841 1.00 2.42 H new ATOM 540 N MET A 36 -10.826 -3.427 -0.535 1.00 40.13 N ATOM 541 CA MET A 36 -9.415 -3.346 -0.917 1.00 20.43 C ATOM 542 C MET A 36 -8.963 -4.643 -1.604 1.00 51.02 C ATOM 543 O MET A 36 -8.302 -4.601 -2.646 1.00 1.14 O ATOM 544 CB MET A 36 -8.547 -3.040 0.312 1.00 72.51 C ATOM 545 CG MET A 36 -7.073 -2.819 -0.006 1.00 63.13 C ATOM 546 SD MET A 36 -6.159 -2.140 1.394 1.00 72.14 S ATOM 547 CE MET A 36 -6.988 -0.566 1.617 1.00 51.43 C ATOM 0 H MET A 36 -10.986 -3.518 0.468 1.00 40.13 H new ATOM 0 HA MET A 36 -9.294 -2.531 -1.631 1.00 20.43 H new ATOM 0 HB2 MET A 36 -8.938 -2.151 0.807 1.00 72.51 H new ATOM 0 HB3 MET A 36 -8.635 -3.864 1.020 1.00 72.51 H new ATOM 0 HG2 MET A 36 -6.623 -3.766 -0.305 1.00 63.13 H new ATOM 0 HG3 MET A 36 -6.985 -2.142 -0.856 1.00 63.13 H new ATOM 0 HE1 MET A 36 -6.499 -0.007 2.414 1.00 51.43 H new ATOM 0 HE2 MET A 36 -6.939 0.006 0.690 1.00 51.43 H new ATOM 0 HE3 MET A 36 -8.031 -0.739 1.882 1.00 51.43 H new ATOM 557 N ASN A 37 -9.352 -5.786 -1.031 1.00 64.40 N ATOM 558 CA ASN A 37 -9.059 -7.102 -1.623 1.00 61.33 C ATOM 559 C ASN A 37 -9.530 -7.170 -3.081 1.00 44.53 C ATOM 560 O ASN A 37 -8.754 -7.480 -3.979 1.00 72.54 O ATOM 561 CB ASN A 37 -9.746 -8.225 -0.832 1.00 42.54 C ATOM 562 CG ASN A 37 -9.318 -8.285 0.621 1.00 13.21 C ATOM 563 OD1 ASN A 37 -8.203 -7.932 0.972 1.00 41.33 O ATOM 564 ND2 ASN A 37 -10.203 -8.748 1.479 1.00 13.04 N ATOM 0 H ASN A 37 -9.872 -5.830 -0.155 1.00 64.40 H new ATOM 0 HA ASN A 37 -7.978 -7.236 -1.585 1.00 61.33 H new ATOM 0 HB2 ASN A 37 -10.826 -8.085 -0.880 1.00 42.54 H new ATOM 0 HB3 ASN A 37 -9.527 -9.181 -1.308 1.00 42.54 H new ATOM 0 HD21 ASN A 37 -9.965 -8.820 2.468 1.00 13.04 H new ATOM 0 HD22 ASN A 37 -11.126 -9.035 1.154 1.00 13.04 H new ATOM 571 N GLY A 38 -10.810 -6.867 -3.300 1.00 25.02 N ATOM 572 CA GLY A 38 -11.387 -6.921 -4.639 1.00 73.34 C ATOM 573 C GLY A 38 -10.635 -6.075 -5.664 1.00 74.21 C ATOM 574 O GLY A 38 -10.555 -6.435 -6.839 1.00 34.42 O ATOM 0 H GLY A 38 -11.463 -6.583 -2.569 1.00 25.02 H new ATOM 0 HA2 GLY A 38 -11.403 -7.957 -4.977 1.00 73.34 H new ATOM 0 HA3 GLY A 38 -12.423 -6.585 -4.593 1.00 73.34 H new ATOM 578 N ARG A 39 -10.075 -4.953 -5.217 1.00 64.22 N ATOM 579 CA ARG A 39 -9.309 -4.062 -6.096 1.00 4.42 C ATOM 580 C ARG A 39 -7.917 -4.642 -6.417 1.00 75.25 C ATOM 581 O ARG A 39 -7.522 -4.705 -7.582 1.00 45.21 O ATOM 582 CB ARG A 39 -9.192 -2.667 -5.461 1.00 44.45 C ATOM 583 CG ARG A 39 -10.508 -1.889 -5.471 1.00 1.11 C ATOM 584 CD ARG A 39 -10.406 -0.564 -4.718 1.00 14.55 C ATOM 585 NE ARG A 39 -10.345 -0.751 -3.268 1.00 0.33 N ATOM 586 CZ ARG A 39 -10.377 0.229 -2.401 1.00 43.32 C ATOM 587 NH1 ARG A 39 -10.452 1.456 -2.811 1.00 14.02 N ATOM 588 NH2 ARG A 39 -10.346 -0.023 -1.129 1.00 43.30 N ATOM 0 H ARG A 39 -10.136 -4.636 -4.249 1.00 64.22 H new ATOM 0 HA ARG A 39 -9.846 -3.973 -7.040 1.00 4.42 H new ATOM 0 HB2 ARG A 39 -8.846 -2.771 -4.432 1.00 44.45 H new ATOM 0 HB3 ARG A 39 -8.434 -2.094 -5.995 1.00 44.45 H new ATOM 0 HG2 ARG A 39 -10.805 -1.696 -6.502 1.00 1.11 H new ATOM 0 HG3 ARG A 39 -11.291 -2.500 -5.022 1.00 1.11 H new ATOM 0 HD2 ARG A 39 -9.517 -0.028 -5.050 1.00 14.55 H new ATOM 0 HD3 ARG A 39 -11.266 0.059 -4.966 1.00 14.55 H new ATOM 0 HE ARG A 39 -10.273 -1.704 -2.911 1.00 0.33 H new ATOM 0 HH11 ARG A 39 -10.486 1.659 -3.810 1.00 14.02 H new ATOM 0 HH12 ARG A 39 -10.477 2.219 -2.135 1.00 14.02 H new ATOM 0 HH21 ARG A 39 -10.296 -0.988 -0.801 1.00 43.30 H new ATOM 0 HH22 ARG A 39 -10.371 0.743 -0.456 1.00 43.30 H new ATOM 602 N LEU A 40 -7.188 -5.076 -5.388 1.00 4.22 N ATOM 603 CA LEU A 40 -5.863 -5.688 -5.581 1.00 61.35 C ATOM 604 C LEU A 40 -5.969 -6.983 -6.398 1.00 54.42 C ATOM 605 O LEU A 40 -5.238 -7.194 -7.366 1.00 61.31 O ATOM 606 CB LEU A 40 -5.221 -5.991 -4.222 1.00 50.01 C ATOM 607 CG LEU A 40 -5.086 -4.788 -3.274 1.00 10.14 C ATOM 608 CD1 LEU A 40 -4.446 -5.214 -1.957 1.00 75.35 C ATOM 609 CD2 LEU A 40 -4.283 -3.668 -3.932 1.00 64.23 C ATOM 0 H LEU A 40 -7.487 -5.018 -4.414 1.00 4.22 H new ATOM 0 HA LEU A 40 -5.241 -4.981 -6.129 1.00 61.35 H new ATOM 0 HB2 LEU A 40 -5.811 -6.760 -3.724 1.00 50.01 H new ATOM 0 HB3 LEU A 40 -4.230 -6.410 -4.393 1.00 50.01 H new ATOM 0 HG LEU A 40 -6.084 -4.406 -3.060 1.00 10.14 H new ATOM 0 HD11 LEU A 40 -4.358 -4.350 -1.299 1.00 75.35 H new ATOM 0 HD12 LEU A 40 -5.066 -5.972 -1.480 1.00 75.35 H new ATOM 0 HD13 LEU A 40 -3.455 -5.625 -2.150 1.00 75.35 H new ATOM 0 HD21 LEU A 40 -4.200 -2.827 -3.244 1.00 64.23 H new ATOM 0 HD22 LEU A 40 -3.287 -4.033 -4.181 1.00 64.23 H new ATOM 0 HD23 LEU A 40 -4.789 -3.344 -4.842 1.00 64.23 H new ATOM 621 N ARG A 41 -6.897 -7.838 -5.987 1.00 12.45 N ATOM 622 CA ARG A 41 -7.174 -9.111 -6.659 1.00 2.34 C ATOM 623 C ARG A 41 -7.508 -8.906 -8.150 1.00 73.50 C ATOM 624 O ARG A 41 -7.026 -9.646 -9.013 1.00 74.23 O ATOM 625 CB ARG A 41 -8.325 -9.811 -5.914 1.00 31.32 C ATOM 626 CG ARG A 41 -8.775 -11.143 -6.502 1.00 20.10 C ATOM 627 CD ARG A 41 -9.688 -11.893 -5.529 1.00 14.41 C ATOM 628 NE ARG A 41 -10.830 -11.083 -5.085 1.00 60.31 N ATOM 629 CZ ARG A 41 -11.127 -10.832 -3.830 1.00 55.35 C ATOM 630 NH1 ARG A 41 -10.347 -11.231 -2.872 1.00 61.41 N ATOM 631 NH2 ARG A 41 -12.196 -10.157 -3.543 1.00 43.22 N ATOM 0 H ARG A 41 -7.486 -7.670 -5.171 1.00 12.45 H new ATOM 0 HA ARG A 41 -6.283 -9.739 -6.631 1.00 2.34 H new ATOM 0 HB2 ARG A 41 -8.019 -9.975 -4.881 1.00 31.32 H new ATOM 0 HB3 ARG A 41 -9.181 -9.137 -5.889 1.00 31.32 H new ATOM 0 HG2 ARG A 41 -9.302 -10.971 -7.441 1.00 20.10 H new ATOM 0 HG3 ARG A 41 -7.903 -11.755 -6.733 1.00 20.10 H new ATOM 0 HD2 ARG A 41 -10.056 -12.800 -6.008 1.00 14.41 H new ATOM 0 HD3 ARG A 41 -9.109 -12.204 -4.660 1.00 14.41 H new ATOM 0 HE ARG A 41 -11.436 -10.687 -5.803 1.00 60.31 H new ATOM 0 HH11 ARG A 41 -9.493 -11.745 -3.090 1.00 61.41 H new ATOM 0 HH12 ARG A 41 -10.588 -11.030 -1.901 1.00 61.41 H new ATOM 0 HH21 ARG A 41 -12.804 -9.822 -4.291 1.00 43.22 H new ATOM 0 HH22 ARG A 41 -12.429 -9.961 -2.570 1.00 43.22 H new ATOM 645 N ALA A 42 -8.314 -7.886 -8.449 1.00 63.10 N ATOM 646 CA ALA A 42 -8.655 -7.548 -9.837 1.00 42.43 C ATOM 647 C ALA A 42 -7.404 -7.171 -10.650 1.00 30.33 C ATOM 648 O ALA A 42 -7.177 -7.697 -11.740 1.00 14.03 O ATOM 649 CB ALA A 42 -9.672 -6.411 -9.867 1.00 53.30 C ATOM 0 H ALA A 42 -8.744 -7.279 -7.751 1.00 63.10 H new ATOM 0 HA ALA A 42 -9.095 -8.432 -10.299 1.00 42.43 H new ATOM 0 HB1 ALA A 42 -9.917 -6.169 -10.901 1.00 53.30 H new ATOM 0 HB2 ALA A 42 -10.577 -6.718 -9.342 1.00 53.30 H new ATOM 0 HB3 ALA A 42 -9.250 -5.532 -9.379 1.00 53.30 H new ATOM 655 N ILE A 43 -6.587 -6.268 -10.103 1.00 72.53 N ATOM 656 CA ILE A 43 -5.343 -5.842 -10.759 1.00 53.12 C ATOM 657 C ILE A 43 -4.379 -7.025 -10.947 1.00 33.30 C ATOM 658 O ILE A 43 -3.790 -7.205 -12.015 1.00 2.54 O ATOM 659 CB ILE A 43 -4.625 -4.734 -9.942 1.00 23.32 C ATOM 660 CG1 ILE A 43 -5.556 -3.525 -9.739 1.00 63.14 C ATOM 661 CG2 ILE A 43 -3.329 -4.305 -10.628 1.00 31.22 C ATOM 662 CD1 ILE A 43 -4.962 -2.430 -8.878 1.00 73.43 C ATOM 0 H ILE A 43 -6.763 -5.815 -9.206 1.00 72.53 H new ATOM 0 HA ILE A 43 -5.622 -5.445 -11.735 1.00 53.12 H new ATOM 0 HB ILE A 43 -4.371 -5.143 -8.964 1.00 23.32 H new ATOM 0 HG12 ILE A 43 -5.812 -3.109 -10.713 1.00 63.14 H new ATOM 0 HG13 ILE A 43 -6.486 -3.867 -9.284 1.00 63.14 H new ATOM 0 HG21 ILE A 43 -2.844 -3.528 -10.037 1.00 31.22 H new ATOM 0 HG22 ILE A 43 -2.663 -5.163 -10.716 1.00 31.22 H new ATOM 0 HG23 ILE A 43 -3.554 -3.917 -11.622 1.00 31.22 H new ATOM 0 HD11 ILE A 43 -5.678 -1.614 -8.782 1.00 73.43 H new ATOM 0 HD12 ILE A 43 -4.732 -2.829 -7.890 1.00 73.43 H new ATOM 0 HD13 ILE A 43 -4.048 -2.058 -9.341 1.00 73.43 H new ATOM 674 N ARG A 44 -4.238 -7.830 -9.897 1.00 64.41 N ATOM 675 CA ARG A 44 -3.360 -9.006 -9.915 1.00 0.40 C ATOM 676 C ARG A 44 -3.824 -10.019 -10.981 1.00 64.15 C ATOM 677 O ARG A 44 -3.010 -10.709 -11.594 1.00 73.12 O ATOM 678 CB ARG A 44 -3.342 -9.653 -8.512 1.00 31.14 C ATOM 679 CG ARG A 44 -2.037 -10.370 -8.143 1.00 52.34 C ATOM 680 CD ARG A 44 -1.808 -11.657 -8.932 1.00 14.45 C ATOM 681 NE ARG A 44 -0.574 -12.330 -8.524 1.00 74.31 N ATOM 682 CZ ARG A 44 -0.239 -13.540 -8.888 1.00 73.40 C ATOM 683 NH1 ARG A 44 -1.004 -14.231 -9.671 1.00 22.22 N ATOM 684 NH2 ARG A 44 0.872 -14.058 -8.474 1.00 42.41 N ATOM 0 H ARG A 44 -4.725 -7.690 -9.012 1.00 64.41 H new ATOM 0 HA ARG A 44 -2.349 -8.693 -10.176 1.00 0.40 H new ATOM 0 HB2 ARG A 44 -3.536 -8.879 -7.769 1.00 31.14 H new ATOM 0 HB3 ARG A 44 -4.162 -10.368 -8.448 1.00 31.14 H new ATOM 0 HG2 ARG A 44 -1.199 -9.694 -8.314 1.00 52.34 H new ATOM 0 HG3 ARG A 44 -2.047 -10.602 -7.078 1.00 52.34 H new ATOM 0 HD2 ARG A 44 -2.654 -12.329 -8.786 1.00 14.45 H new ATOM 0 HD3 ARG A 44 -1.763 -11.428 -9.997 1.00 14.45 H new ATOM 0 HE ARG A 44 0.067 -11.821 -7.915 1.00 74.31 H new ATOM 0 HH11 ARG A 44 -1.879 -13.832 -10.011 1.00 22.22 H new ATOM 0 HH12 ARG A 44 -0.732 -15.174 -9.948 1.00 22.22 H new ATOM 0 HH21 ARG A 44 1.488 -13.522 -7.863 1.00 42.41 H new ATOM 0 HH22 ARG A 44 1.132 -15.002 -8.759 1.00 42.41 H new ATOM 698 N SER A 45 -5.135 -10.092 -11.198 1.00 22.52 N ATOM 699 CA SER A 45 -5.711 -10.999 -12.203 1.00 10.05 C ATOM 700 C SER A 45 -5.566 -10.444 -13.629 1.00 75.30 C ATOM 701 O SER A 45 -5.131 -11.149 -14.539 1.00 3.32 O ATOM 702 CB SER A 45 -7.194 -11.255 -11.904 1.00 15.23 C ATOM 703 OG SER A 45 -7.780 -12.109 -12.878 1.00 55.34 O ATOM 0 H SER A 45 -5.824 -9.535 -10.693 1.00 22.52 H new ATOM 0 HA SER A 45 -5.156 -11.935 -12.146 1.00 10.05 H new ATOM 0 HB2 SER A 45 -7.295 -11.704 -10.916 1.00 15.23 H new ATOM 0 HB3 SER A 45 -7.731 -10.307 -11.879 1.00 15.23 H new ATOM 0 HG SER A 45 -8.724 -12.255 -12.660 1.00 55.34 H new ATOM 709 N SER A 46 -5.935 -9.176 -13.824 1.00 34.25 N ATOM 710 CA SER A 46 -5.885 -8.552 -15.161 1.00 53.23 C ATOM 711 C SER A 46 -4.487 -8.010 -15.492 1.00 65.30 C ATOM 712 O SER A 46 -3.795 -8.542 -16.361 1.00 54.54 O ATOM 713 CB SER A 46 -6.910 -7.416 -15.275 1.00 21.30 C ATOM 714 OG SER A 46 -6.922 -6.870 -16.587 1.00 65.42 O ATOM 0 H SER A 46 -6.270 -8.560 -13.083 1.00 34.25 H new ATOM 0 HA SER A 46 -6.128 -9.335 -15.880 1.00 53.23 H new ATOM 0 HB2 SER A 46 -7.902 -7.790 -15.024 1.00 21.30 H new ATOM 0 HB3 SER A 46 -6.673 -6.634 -14.554 1.00 21.30 H new ATOM 0 HG SER A 46 -7.584 -6.149 -16.635 1.00 65.42 H new ATOM 720 N HIS A 47 -4.066 -6.964 -14.780 1.00 22.34 N ATOM 721 CA HIS A 47 -2.764 -6.323 -15.032 1.00 21.51 C ATOM 722 C HIS A 47 -1.594 -7.225 -14.611 1.00 60.13 C ATOM 723 O HIS A 47 -0.439 -6.953 -14.949 1.00 2.30 O ATOM 724 CB HIS A 47 -2.675 -4.990 -14.278 1.00 72.32 C ATOM 725 CG HIS A 47 -3.711 -3.988 -14.682 1.00 43.24 C ATOM 726 ND1 HIS A 47 -3.466 -3.066 -15.667 1.00 15.02 N ATOM 727 CD2 HIS A 47 -4.960 -3.794 -14.196 1.00 4.13 C ATOM 728 CE1 HIS A 47 -4.561 -2.334 -15.760 1.00 52.23 C ATOM 729 NE2 HIS A 47 -5.494 -2.739 -14.888 1.00 41.51 N ATOM 0 H HIS A 47 -4.603 -6.539 -14.024 1.00 22.34 H new ATOM 0 HA HIS A 47 -2.690 -6.147 -16.105 1.00 21.51 H new ATOM 0 HB2 HIS A 47 -2.769 -5.183 -13.209 1.00 72.32 H new ATOM 0 HB3 HIS A 47 -1.687 -4.559 -14.439 1.00 72.32 H new ATOM 0 HD2 HIS A 47 -5.442 -4.361 -13.414 1.00 4.13 H new ATOM 0 HE1 HIS A 47 -4.688 -1.514 -16.451 1.00 52.23 H new ATOM 0 HE2 HIS A 47 -6.424 -2.339 -14.763 1.00 41.51 H new ATOM 737 N ALA A 48 -1.901 -8.277 -13.850 1.00 22.40 N ATOM 738 CA ALA A 48 -0.893 -9.229 -13.361 1.00 35.45 C ATOM 739 C ALA A 48 0.079 -8.575 -12.368 1.00 33.43 C ATOM 740 O ALA A 48 1.132 -9.131 -12.053 1.00 23.00 O ATOM 741 CB ALA A 48 -0.134 -9.859 -14.527 1.00 51.24 C ATOM 0 H ALA A 48 -2.852 -8.496 -13.554 1.00 22.40 H new ATOM 0 HA ALA A 48 -1.423 -10.017 -12.825 1.00 35.45 H new ATOM 0 HB1 ALA A 48 0.607 -10.560 -14.143 1.00 51.24 H new ATOM 0 HB2 ALA A 48 -0.834 -10.389 -15.173 1.00 51.24 H new ATOM 0 HB3 ALA A 48 0.368 -9.078 -15.099 1.00 51.24 H new ATOM 747 N VAL A 49 -0.291 -7.398 -11.868 1.00 41.45 N ATOM 748 CA VAL A 49 0.529 -6.669 -10.899 1.00 32.03 C ATOM 749 C VAL A 49 0.260 -7.162 -9.475 1.00 2.22 C ATOM 750 O VAL A 49 -0.852 -7.023 -8.961 1.00 72.31 O ATOM 751 CB VAL A 49 0.263 -5.142 -10.963 1.00 11.02 C ATOM 752 CG1 VAL A 49 1.126 -4.390 -9.949 1.00 2.22 C ATOM 753 CG2 VAL A 49 0.502 -4.611 -12.378 1.00 31.24 C ATOM 0 H VAL A 49 -1.159 -6.925 -12.119 1.00 41.45 H new ATOM 0 HA VAL A 49 1.570 -6.858 -11.160 1.00 32.03 H new ATOM 0 HB VAL A 49 -0.782 -4.971 -10.705 1.00 11.02 H new ATOM 0 HG11 VAL A 49 0.919 -3.322 -10.016 1.00 2.22 H new ATOM 0 HG12 VAL A 49 0.896 -4.742 -8.943 1.00 2.22 H new ATOM 0 HG13 VAL A 49 2.179 -4.569 -10.164 1.00 2.22 H new ATOM 0 HG21 VAL A 49 0.310 -3.538 -12.401 1.00 31.24 H new ATOM 0 HG22 VAL A 49 1.535 -4.801 -12.668 1.00 31.24 H new ATOM 0 HG23 VAL A 49 -0.169 -5.115 -13.074 1.00 31.24 H new ATOM 763 N GLU A 50 1.269 -7.745 -8.839 1.00 31.44 N ATOM 764 CA GLU A 50 1.131 -8.198 -7.458 1.00 42.41 C ATOM 765 C GLU A 50 1.195 -7.000 -6.497 1.00 23.12 C ATOM 766 O GLU A 50 2.271 -6.541 -6.118 1.00 72.24 O ATOM 767 CB GLU A 50 2.217 -9.236 -7.136 1.00 71.03 C ATOM 768 CG GLU A 50 2.233 -10.404 -8.121 1.00 31.10 C ATOM 769 CD GLU A 50 3.238 -11.489 -7.759 1.00 11.53 C ATOM 770 OE1 GLU A 50 4.440 -11.316 -8.052 1.00 61.13 O ATOM 771 OE2 GLU A 50 2.819 -12.530 -7.200 1.00 15.43 O ATOM 0 H GLU A 50 2.186 -7.915 -9.253 1.00 31.44 H new ATOM 0 HA GLU A 50 0.159 -8.675 -7.330 1.00 42.41 H new ATOM 0 HB2 GLU A 50 3.192 -8.748 -7.142 1.00 71.03 H new ATOM 0 HB3 GLU A 50 2.059 -9.619 -6.128 1.00 71.03 H new ATOM 0 HG2 GLU A 50 1.237 -10.843 -8.168 1.00 31.10 H new ATOM 0 HG3 GLU A 50 2.462 -10.026 -9.117 1.00 31.10 H new ATOM 778 N PHE A 51 0.018 -6.501 -6.126 1.00 13.44 N ATOM 779 CA PHE A 51 -0.120 -5.282 -5.318 1.00 52.23 C ATOM 780 C PHE A 51 -0.613 -5.632 -3.903 1.00 1.44 C ATOM 781 O PHE A 51 -1.786 -5.941 -3.705 1.00 50.14 O ATOM 782 CB PHE A 51 -1.106 -4.339 -6.035 1.00 12.21 C ATOM 783 CG PHE A 51 -1.223 -2.935 -5.476 1.00 53.54 C ATOM 784 CD1 PHE A 51 -0.453 -2.502 -4.401 1.00 4.45 C ATOM 785 CD2 PHE A 51 -2.120 -2.042 -6.048 1.00 23.31 C ATOM 786 CE1 PHE A 51 -0.583 -1.212 -3.914 1.00 54.11 C ATOM 787 CE2 PHE A 51 -2.251 -0.758 -5.564 1.00 40.13 C ATOM 788 CZ PHE A 51 -1.482 -0.341 -4.499 1.00 23.41 C ATOM 0 H PHE A 51 -0.873 -6.929 -6.376 1.00 13.44 H new ATOM 0 HA PHE A 51 0.845 -4.786 -5.211 1.00 52.23 H new ATOM 0 HB2 PHE A 51 -0.810 -4.267 -7.081 1.00 12.21 H new ATOM 0 HB3 PHE A 51 -2.094 -4.798 -6.015 1.00 12.21 H new ATOM 0 HD1 PHE A 51 0.253 -3.178 -3.942 1.00 4.45 H new ATOM 0 HD2 PHE A 51 -2.724 -2.359 -6.885 1.00 23.31 H new ATOM 0 HE1 PHE A 51 0.018 -0.887 -3.078 1.00 54.11 H new ATOM 0 HE2 PHE A 51 -2.956 -0.079 -6.019 1.00 40.13 H new ATOM 0 HZ PHE A 51 -1.582 0.666 -4.122 1.00 23.41 H new ATOM 798 N ALA A 52 0.290 -5.595 -2.924 1.00 70.31 N ATOM 799 CA ALA A 52 -0.034 -6.007 -1.550 1.00 33.45 C ATOM 800 C ALA A 52 -0.096 -4.813 -0.583 1.00 24.33 C ATOM 801 O ALA A 52 0.698 -3.881 -0.684 1.00 63.20 O ATOM 802 CB ALA A 52 0.986 -7.029 -1.058 1.00 44.34 C ATOM 0 H ALA A 52 1.253 -5.285 -3.052 1.00 70.31 H new ATOM 0 HA ALA A 52 -1.026 -6.459 -1.570 1.00 33.45 H new ATOM 0 HB1 ALA A 52 0.739 -7.329 -0.040 1.00 44.34 H new ATOM 0 HB2 ALA A 52 0.968 -7.904 -1.708 1.00 44.34 H new ATOM 0 HB3 ALA A 52 1.982 -6.586 -1.074 1.00 44.34 H new ATOM 808 N VAL A 53 -1.039 -4.859 0.363 1.00 62.55 N ATOM 809 CA VAL A 53 -1.195 -3.795 1.368 1.00 23.55 C ATOM 810 C VAL A 53 -1.098 -4.358 2.798 1.00 22.42 C ATOM 811 O VAL A 53 -1.816 -5.289 3.163 1.00 25.52 O ATOM 812 CB VAL A 53 -2.549 -3.053 1.209 1.00 43.53 C ATOM 813 CG1 VAL A 53 -2.696 -1.960 2.269 1.00 43.24 C ATOM 814 CG2 VAL A 53 -2.683 -2.464 -0.195 1.00 65.24 C ATOM 0 H VAL A 53 -1.709 -5.622 0.456 1.00 62.55 H new ATOM 0 HA VAL A 53 -0.381 -3.089 1.202 1.00 23.55 H new ATOM 0 HB VAL A 53 -3.351 -3.777 1.352 1.00 43.53 H new ATOM 0 HG11 VAL A 53 -3.652 -1.453 2.139 1.00 43.24 H new ATOM 0 HG12 VAL A 53 -2.655 -2.408 3.262 1.00 43.24 H new ATOM 0 HG13 VAL A 53 -1.886 -1.239 2.163 1.00 43.24 H new ATOM 0 HG21 VAL A 53 -3.639 -1.949 -0.284 1.00 65.24 H new ATOM 0 HG22 VAL A 53 -1.872 -1.757 -0.372 1.00 65.24 H new ATOM 0 HG23 VAL A 53 -2.633 -3.265 -0.932 1.00 65.24 H new ATOM 824 N VAL A 54 -0.209 -3.781 3.605 1.00 70.10 N ATOM 825 CA VAL A 54 0.005 -4.220 4.990 1.00 62.42 C ATOM 826 C VAL A 54 -0.176 -3.053 5.974 1.00 54.25 C ATOM 827 O VAL A 54 0.257 -1.932 5.708 1.00 52.20 O ATOM 828 CB VAL A 54 1.427 -4.818 5.172 1.00 3.13 C ATOM 829 CG1 VAL A 54 1.641 -5.320 6.602 1.00 20.45 C ATOM 830 CG2 VAL A 54 1.677 -5.935 4.158 1.00 53.30 C ATOM 0 H VAL A 54 0.382 -2.999 3.322 1.00 70.10 H new ATOM 0 HA VAL A 54 -0.739 -4.988 5.202 1.00 62.42 H new ATOM 0 HB VAL A 54 2.150 -4.023 4.990 1.00 3.13 H new ATOM 0 HG11 VAL A 54 2.646 -5.732 6.696 1.00 20.45 H new ATOM 0 HG12 VAL A 54 1.522 -4.491 7.300 1.00 20.45 H new ATOM 0 HG13 VAL A 54 0.908 -6.094 6.829 1.00 20.45 H new ATOM 0 HG21 VAL A 54 2.678 -6.340 4.303 1.00 53.30 H new ATOM 0 HG22 VAL A 54 0.941 -6.727 4.300 1.00 53.30 H new ATOM 0 HG23 VAL A 54 1.590 -5.535 3.148 1.00 53.30 H new ATOM 840 N THR A 55 -0.817 -3.315 7.113 1.00 42.23 N ATOM 841 CA THR A 55 -1.022 -2.282 8.143 1.00 51.51 C ATOM 842 C THR A 55 -0.393 -2.691 9.482 1.00 30.25 C ATOM 843 O THR A 55 -0.735 -3.731 10.049 1.00 40.05 O ATOM 844 CB THR A 55 -2.526 -1.991 8.372 1.00 60.44 C ATOM 845 OG1 THR A 55 -3.201 -3.182 8.803 1.00 34.32 O ATOM 846 CG2 THR A 55 -3.189 -1.463 7.102 1.00 13.35 C ATOM 0 H THR A 55 -1.204 -4.228 7.351 1.00 42.23 H new ATOM 0 HA THR A 55 -0.534 -1.381 7.772 1.00 51.51 H new ATOM 0 HB THR A 55 -2.602 -1.226 9.145 1.00 60.44 H new ATOM 0 HG1 THR A 55 -2.653 -3.646 9.470 1.00 34.32 H new ATOM 0 HG21 THR A 55 -4.244 -1.269 7.296 1.00 13.35 H new ATOM 0 HG22 THR A 55 -2.700 -0.539 6.794 1.00 13.35 H new ATOM 0 HG23 THR A 55 -3.097 -2.204 6.308 1.00 13.35 H new ATOM 854 N LEU A 56 0.513 -1.857 9.994 1.00 64.11 N ATOM 855 CA LEU A 56 1.214 -2.133 11.258 1.00 0.53 C ATOM 856 C LEU A 56 1.131 -0.928 12.214 1.00 54.45 C ATOM 857 O LEU A 56 1.193 0.226 11.778 1.00 5.11 O ATOM 858 CB LEU A 56 2.687 -2.465 10.981 1.00 72.21 C ATOM 859 CG LEU A 56 2.940 -3.626 10.005 1.00 44.12 C ATOM 860 CD1 LEU A 56 4.426 -3.743 9.692 1.00 23.22 C ATOM 861 CD2 LEU A 56 2.413 -4.939 10.573 1.00 12.15 C ATOM 0 H LEU A 56 0.783 -0.978 9.553 1.00 64.11 H new ATOM 0 HA LEU A 56 0.728 -2.986 11.732 1.00 0.53 H new ATOM 0 HB2 LEU A 56 3.173 -1.572 10.588 1.00 72.21 H new ATOM 0 HB3 LEU A 56 3.171 -2.700 11.929 1.00 72.21 H new ATOM 0 HG LEU A 56 2.403 -3.415 9.080 1.00 44.12 H new ATOM 0 HD11 LEU A 56 4.588 -4.569 9.000 1.00 23.22 H new ATOM 0 HD12 LEU A 56 4.776 -2.816 9.238 1.00 23.22 H new ATOM 0 HD13 LEU A 56 4.978 -3.928 10.613 1.00 23.22 H new ATOM 0 HD21 LEU A 56 2.604 -5.745 9.864 1.00 12.15 H new ATOM 0 HD22 LEU A 56 2.918 -5.157 11.514 1.00 12.15 H new ATOM 0 HD23 LEU A 56 1.340 -4.856 10.747 1.00 12.15 H new ATOM 873 N PRO A 57 0.981 -1.173 13.534 1.00 42.33 N ATOM 874 CA PRO A 57 0.924 -0.092 14.533 1.00 63.34 C ATOM 875 C PRO A 57 2.256 0.675 14.643 1.00 1.31 C ATOM 876 O PRO A 57 2.297 1.894 14.478 1.00 12.23 O ATOM 877 CB PRO A 57 0.595 -0.827 15.845 1.00 33.55 C ATOM 878 CG PRO A 57 1.039 -2.235 15.622 1.00 41.41 C ATOM 879 CD PRO A 57 0.852 -2.507 14.152 1.00 21.20 C ATOM 0 HA PRO A 57 0.189 0.669 14.271 1.00 63.34 H new ATOM 0 HB2 PRO A 57 1.117 -0.378 16.690 1.00 33.55 H new ATOM 0 HB3 PRO A 57 -0.471 -0.780 16.067 1.00 33.55 H new ATOM 0 HG2 PRO A 57 2.082 -2.365 15.912 1.00 41.41 H new ATOM 0 HG3 PRO A 57 0.452 -2.928 16.224 1.00 41.41 H new ATOM 0 HD2 PRO A 57 1.604 -3.199 13.773 1.00 21.20 H new ATOM 0 HD3 PRO A 57 -0.122 -2.952 13.947 1.00 21.20 H new ATOM 887 N SER A 58 3.346 -0.047 14.906 1.00 74.50 N ATOM 888 CA SER A 58 4.675 0.569 15.021 1.00 41.22 C ATOM 889 C SER A 58 5.781 -0.413 14.617 1.00 54.45 C ATOM 890 O SER A 58 5.658 -1.615 14.830 1.00 51.10 O ATOM 891 CB SER A 58 4.922 1.056 16.457 1.00 11.33 C ATOM 892 OG SER A 58 4.888 -0.017 17.385 1.00 12.41 O ATOM 0 H SER A 58 3.338 -1.058 15.044 1.00 74.50 H new ATOM 0 HA SER A 58 4.701 1.421 14.341 1.00 41.22 H new ATOM 0 HB2 SER A 58 5.890 1.555 16.511 1.00 11.33 H new ATOM 0 HB3 SER A 58 4.167 1.795 16.726 1.00 11.33 H new ATOM 0 HG SER A 58 4.595 -0.834 16.930 1.00 12.41 H new ATOM 898 N ILE A 59 6.861 0.106 14.032 1.00 35.23 N ATOM 899 CA ILE A 59 7.999 -0.729 13.609 1.00 5.34 C ATOM 900 C ILE A 59 9.288 -0.367 14.369 1.00 35.52 C ATOM 901 O ILE A 59 10.376 -0.852 14.046 1.00 71.22 O ATOM 902 CB ILE A 59 8.251 -0.596 12.082 1.00 62.11 C ATOM 903 CG1 ILE A 59 8.506 0.875 11.703 1.00 75.44 C ATOM 904 CG2 ILE A 59 7.071 -1.164 11.294 1.00 42.24 C ATOM 905 CD1 ILE A 59 8.766 1.091 10.226 1.00 54.33 C ATOM 0 H ILE A 59 6.977 1.101 13.838 1.00 35.23 H new ATOM 0 HA ILE A 59 7.735 -1.760 13.844 1.00 5.34 H new ATOM 0 HB ILE A 59 9.140 -1.172 11.826 1.00 62.11 H new ATOM 0 HG12 ILE A 59 7.644 1.472 12.001 1.00 75.44 H new ATOM 0 HG13 ILE A 59 9.361 1.243 12.270 1.00 75.44 H new ATOM 0 HG21 ILE A 59 7.264 -1.063 10.226 1.00 42.24 H new ATOM 0 HG22 ILE A 59 6.942 -2.218 11.541 1.00 42.24 H new ATOM 0 HG23 ILE A 59 6.164 -0.617 11.552 1.00 42.24 H new ATOM 0 HD11 ILE A 59 8.936 2.151 10.038 1.00 54.33 H new ATOM 0 HD12 ILE A 59 9.646 0.523 9.925 1.00 54.33 H new ATOM 0 HD13 ILE A 59 7.903 0.755 9.652 1.00 54.33 H new ATOM 917 N GLY A 60 9.155 0.475 15.394 1.00 41.43 N ATOM 918 CA GLY A 60 10.316 0.936 16.146 1.00 62.20 C ATOM 919 C GLY A 60 11.227 1.851 15.332 1.00 21.43 C ATOM 920 O GLY A 60 10.752 2.707 14.582 1.00 22.30 O ATOM 0 H GLY A 60 8.263 0.847 15.718 1.00 41.43 H new ATOM 0 HA2 GLY A 60 9.978 1.467 17.036 1.00 62.20 H new ATOM 0 HA3 GLY A 60 10.888 0.073 16.487 1.00 62.20 H new ATOM 924 N ASP A 61 12.537 1.660 15.460 1.00 13.32 N ATOM 925 CA ASP A 61 13.521 2.481 14.740 1.00 55.13 C ATOM 926 C ASP A 61 13.929 1.847 13.398 1.00 55.24 C ATOM 927 O ASP A 61 14.927 2.241 12.789 1.00 21.55 O ATOM 928 CB ASP A 61 14.754 2.697 15.624 1.00 50.41 C ATOM 929 CG ASP A 61 14.413 3.460 16.891 1.00 31.34 C ATOM 930 OD1 ASP A 61 14.208 4.691 16.810 1.00 32.43 O ATOM 931 OD2 ASP A 61 14.349 2.838 17.971 1.00 63.05 O ATOM 0 H ASP A 61 12.948 0.942 16.057 1.00 13.32 H new ATOM 0 HA ASP A 61 13.058 3.441 14.514 1.00 55.13 H new ATOM 0 HB2 ASP A 61 15.187 1.732 15.886 1.00 50.41 H new ATOM 0 HB3 ASP A 61 15.512 3.244 15.063 1.00 50.41 H new ATOM 936 N ALA A 62 13.148 0.871 12.936 1.00 35.12 N ATOM 937 CA ALA A 62 13.397 0.228 11.642 1.00 71.04 C ATOM 938 C ALA A 62 12.959 1.136 10.475 1.00 74.21 C ATOM 939 O ALA A 62 11.853 1.678 10.486 1.00 22.33 O ATOM 940 CB ALA A 62 12.672 -1.115 11.576 1.00 31.10 C ATOM 0 H ALA A 62 12.337 0.507 13.437 1.00 35.12 H new ATOM 0 HA ALA A 62 14.469 0.057 11.547 1.00 71.04 H new ATOM 0 HB1 ALA A 62 12.863 -1.585 10.611 1.00 31.10 H new ATOM 0 HB2 ALA A 62 13.034 -1.764 12.373 1.00 31.10 H new ATOM 0 HB3 ALA A 62 11.600 -0.956 11.696 1.00 31.10 H new ATOM 946 N PRO A 63 13.827 1.329 9.459 1.00 74.43 N ATOM 947 CA PRO A 63 13.493 2.156 8.285 1.00 1.52 C ATOM 948 C PRO A 63 12.462 1.479 7.359 1.00 34.33 C ATOM 949 O PRO A 63 12.665 0.352 6.904 1.00 43.11 O ATOM 950 CB PRO A 63 14.846 2.326 7.582 1.00 33.13 C ATOM 951 CG PRO A 63 15.645 1.131 7.989 1.00 42.03 C ATOM 952 CD PRO A 63 15.193 0.773 9.380 1.00 35.30 C ATOM 0 HA PRO A 63 13.026 3.100 8.564 1.00 1.52 H new ATOM 0 HB2 PRO A 63 14.726 2.371 6.500 1.00 33.13 H new ATOM 0 HB3 PRO A 63 15.336 3.251 7.887 1.00 33.13 H new ATOM 0 HG2 PRO A 63 15.481 0.301 7.301 1.00 42.03 H new ATOM 0 HG3 PRO A 63 16.712 1.353 7.972 1.00 42.03 H new ATOM 0 HD2 PRO A 63 15.196 -0.306 9.537 1.00 35.30 H new ATOM 0 HD3 PRO A 63 15.846 1.207 10.137 1.00 35.30 H new ATOM 960 N LEU A 64 11.365 2.184 7.077 1.00 51.50 N ATOM 961 CA LEU A 64 10.242 1.624 6.305 1.00 64.31 C ATOM 962 C LEU A 64 10.648 1.229 4.871 1.00 32.45 C ATOM 963 O LEU A 64 10.200 0.204 4.355 1.00 73.24 O ATOM 964 CB LEU A 64 9.081 2.631 6.271 1.00 25.21 C ATOM 965 CG LEU A 64 7.822 2.168 5.521 1.00 33.53 C ATOM 966 CD1 LEU A 64 7.291 0.863 6.109 1.00 15.42 C ATOM 967 CD2 LEU A 64 6.750 3.258 5.551 1.00 25.05 C ATOM 0 H LEU A 64 11.225 3.150 7.372 1.00 51.50 H new ATOM 0 HA LEU A 64 9.925 0.710 6.807 1.00 64.31 H new ATOM 0 HB2 LEU A 64 8.803 2.872 7.297 1.00 25.21 H new ATOM 0 HB3 LEU A 64 9.437 3.553 5.812 1.00 25.21 H new ATOM 0 HG LEU A 64 8.090 1.982 4.481 1.00 33.53 H new ATOM 0 HD11 LEU A 64 6.400 0.554 5.563 1.00 15.42 H new ATOM 0 HD12 LEU A 64 8.054 0.089 6.026 1.00 15.42 H new ATOM 0 HD13 LEU A 64 7.039 1.013 7.159 1.00 15.42 H new ATOM 0 HD21 LEU A 64 5.866 2.913 5.015 1.00 25.05 H new ATOM 0 HD22 LEU A 64 6.485 3.479 6.585 1.00 25.05 H new ATOM 0 HD23 LEU A 64 7.134 4.160 5.074 1.00 25.05 H new ATOM 979 N GLU A 65 11.502 2.033 4.243 1.00 43.31 N ATOM 980 CA GLU A 65 11.960 1.769 2.866 1.00 51.22 C ATOM 981 C GLU A 65 12.706 0.429 2.788 1.00 44.01 C ATOM 982 O GLU A 65 12.590 -0.322 1.819 1.00 51.33 O ATOM 983 CB GLU A 65 12.888 2.898 2.373 1.00 10.11 C ATOM 984 CG GLU A 65 12.260 4.294 2.359 1.00 24.15 C ATOM 985 CD GLU A 65 11.881 4.803 3.745 1.00 1.43 C ATOM 986 OE1 GLU A 65 12.749 4.795 4.649 1.00 14.32 O ATOM 987 OE2 GLU A 65 10.714 5.184 3.948 1.00 74.30 O ATOM 0 H GLU A 65 11.896 2.876 4.660 1.00 43.31 H new ATOM 0 HA GLU A 65 11.078 1.725 2.227 1.00 51.22 H new ATOM 0 HB2 GLU A 65 13.775 2.922 3.007 1.00 10.11 H new ATOM 0 HB3 GLU A 65 13.224 2.657 1.364 1.00 10.11 H new ATOM 0 HG2 GLU A 65 12.959 4.994 1.902 1.00 24.15 H new ATOM 0 HG3 GLU A 65 11.370 4.277 1.731 1.00 24.15 H new ATOM 994 N ASP A 66 13.491 0.164 3.820 1.00 44.41 N ATOM 995 CA ASP A 66 14.233 -1.090 3.953 1.00 65.04 C ATOM 996 C ASP A 66 13.302 -2.236 4.392 1.00 61.24 C ATOM 997 O ASP A 66 13.444 -3.380 3.955 1.00 71.12 O ATOM 998 CB ASP A 66 15.361 -0.889 4.970 1.00 11.12 C ATOM 999 CG ASP A 66 16.322 0.215 4.548 1.00 0.14 C ATOM 1000 OD1 ASP A 66 15.896 1.390 4.472 1.00 40.13 O ATOM 1001 OD2 ASP A 66 17.502 -0.088 4.279 1.00 21.43 O ATOM 0 H ASP A 66 13.635 0.812 4.595 1.00 44.41 H new ATOM 0 HA ASP A 66 14.656 -1.365 2.987 1.00 65.04 H new ATOM 0 HB2 ASP A 66 14.933 -0.645 5.942 1.00 11.12 H new ATOM 0 HB3 ASP A 66 15.911 -1.822 5.090 1.00 11.12 H new ATOM 1006 N PHE A 67 12.348 -1.906 5.260 1.00 32.45 N ATOM 1007 CA PHE A 67 11.334 -2.857 5.725 1.00 20.13 C ATOM 1008 C PHE A 67 10.587 -3.486 4.536 1.00 62.24 C ATOM 1009 O PHE A 67 10.488 -4.712 4.421 1.00 60.31 O ATOM 1010 CB PHE A 67 10.342 -2.126 6.650 1.00 72.40 C ATOM 1011 CG PHE A 67 9.299 -3.014 7.287 1.00 50.11 C ATOM 1012 CD1 PHE A 67 8.203 -3.467 6.559 1.00 74.44 C ATOM 1013 CD2 PHE A 67 9.413 -3.393 8.616 1.00 4.54 C ATOM 1014 CE1 PHE A 67 7.251 -4.278 7.145 1.00 40.35 C ATOM 1015 CE2 PHE A 67 8.462 -4.202 9.204 1.00 71.52 C ATOM 1016 CZ PHE A 67 7.382 -4.646 8.468 1.00 44.32 C ATOM 0 H PHE A 67 12.254 -0.973 5.662 1.00 32.45 H new ATOM 0 HA PHE A 67 11.826 -3.659 6.275 1.00 20.13 H new ATOM 0 HB2 PHE A 67 10.904 -1.625 7.439 1.00 72.40 H new ATOM 0 HB3 PHE A 67 9.836 -1.349 6.076 1.00 72.40 H new ATOM 0 HD1 PHE A 67 8.096 -3.181 5.523 1.00 74.44 H new ATOM 0 HD2 PHE A 67 10.256 -3.051 9.198 1.00 4.54 H new ATOM 0 HE1 PHE A 67 6.406 -4.623 6.569 1.00 40.35 H new ATOM 0 HE2 PHE A 67 8.563 -4.488 10.241 1.00 71.52 H new ATOM 0 HZ PHE A 67 6.640 -5.281 8.928 1.00 44.32 H new ATOM 1026 N THR A 68 10.064 -2.632 3.658 1.00 64.22 N ATOM 1027 CA THR A 68 9.323 -3.083 2.477 1.00 11.23 C ATOM 1028 C THR A 68 10.197 -3.914 1.536 1.00 4.41 C ATOM 1029 O THR A 68 9.724 -4.874 0.931 1.00 53.33 O ATOM 1030 CB THR A 68 8.728 -1.891 1.694 1.00 22.31 C ATOM 1031 OG1 THR A 68 9.740 -0.902 1.456 1.00 43.34 O ATOM 1032 CG2 THR A 68 7.570 -1.267 2.464 1.00 61.15 C ATOM 0 H THR A 68 10.139 -1.618 3.741 1.00 64.22 H new ATOM 0 HA THR A 68 8.512 -3.711 2.847 1.00 11.23 H new ATOM 0 HB THR A 68 8.355 -2.260 0.739 1.00 22.31 H new ATOM 0 HG1 THR A 68 9.988 -0.909 0.508 1.00 43.34 H new ATOM 0 HG21 THR A 68 7.165 -0.430 1.896 1.00 61.15 H new ATOM 0 HG22 THR A 68 6.790 -2.013 2.616 1.00 61.15 H new ATOM 0 HG23 THR A 68 7.926 -0.911 3.431 1.00 61.15 H new ATOM 1040 N LEU A 69 11.470 -3.545 1.417 1.00 13.01 N ATOM 1041 CA LEU A 69 12.431 -4.328 0.632 1.00 43.43 C ATOM 1042 C LEU A 69 12.502 -5.778 1.147 1.00 15.30 C ATOM 1043 O LEU A 69 12.382 -6.734 0.378 1.00 51.43 O ATOM 1044 CB LEU A 69 13.820 -3.673 0.690 1.00 1.14 C ATOM 1045 CG LEU A 69 14.921 -4.379 -0.124 1.00 3.03 C ATOM 1046 CD1 LEU A 69 14.580 -4.385 -1.614 1.00 14.43 C ATOM 1047 CD2 LEU A 69 16.276 -3.719 0.118 1.00 1.21 C ATOM 0 H LEU A 69 11.863 -2.710 1.852 1.00 13.01 H new ATOM 0 HA LEU A 69 12.094 -4.349 -0.404 1.00 43.43 H new ATOM 0 HB2 LEU A 69 13.733 -2.646 0.336 1.00 1.14 H new ATOM 0 HB3 LEU A 69 14.137 -3.625 1.732 1.00 1.14 H new ATOM 0 HG LEU A 69 14.980 -5.414 0.212 1.00 3.03 H new ATOM 0 HD11 LEU A 69 15.373 -4.889 -2.167 1.00 14.43 H new ATOM 0 HD12 LEU A 69 13.638 -4.911 -1.770 1.00 14.43 H new ATOM 0 HD13 LEU A 69 14.485 -3.359 -1.970 1.00 14.43 H new ATOM 0 HD21 LEU A 69 17.040 -4.232 -0.466 1.00 1.21 H new ATOM 0 HD22 LEU A 69 16.230 -2.673 -0.184 1.00 1.21 H new ATOM 0 HD23 LEU A 69 16.527 -3.780 1.177 1.00 1.21 H new ATOM 1059 N LYS A 70 12.679 -5.926 2.461 1.00 31.34 N ATOM 1060 CA LYS A 70 12.701 -7.246 3.108 1.00 22.54 C ATOM 1061 C LYS A 70 11.389 -8.015 2.879 1.00 4.22 C ATOM 1062 O LYS A 70 11.400 -9.179 2.468 1.00 12.31 O ATOM 1063 CB LYS A 70 12.942 -7.092 4.619 1.00 43.24 C ATOM 1064 CG LYS A 70 14.352 -6.639 4.989 1.00 53.53 C ATOM 1065 CD LYS A 70 15.399 -7.708 4.678 1.00 52.02 C ATOM 1066 CE LYS A 70 15.115 -9.017 5.415 1.00 13.20 C ATOM 1067 NZ LYS A 70 16.180 -10.031 5.196 1.00 30.42 N ATOM 0 H LYS A 70 12.810 -5.145 3.104 1.00 31.34 H new ATOM 0 HA LYS A 70 13.514 -7.815 2.658 1.00 22.54 H new ATOM 0 HB2 LYS A 70 12.226 -6.373 5.017 1.00 43.24 H new ATOM 0 HB3 LYS A 70 12.740 -8.046 5.106 1.00 43.24 H new ATOM 0 HG2 LYS A 70 14.594 -5.726 4.445 1.00 53.53 H new ATOM 0 HG3 LYS A 70 14.387 -6.396 6.051 1.00 53.53 H new ATOM 0 HD2 LYS A 70 15.420 -7.893 3.604 1.00 52.02 H new ATOM 0 HD3 LYS A 70 16.386 -7.341 4.958 1.00 52.02 H new ATOM 0 HE2 LYS A 70 15.021 -8.817 6.482 1.00 13.20 H new ATOM 0 HE3 LYS A 70 14.159 -9.420 5.080 1.00 13.20 H new ATOM 0 HZ1 LYS A 70 15.943 -10.901 5.715 1.00 30.42 H new ATOM 0 HZ2 LYS A 70 16.254 -10.243 4.181 1.00 30.42 H new ATOM 0 HZ3 LYS A 70 17.089 -9.660 5.539 1.00 30.42 H new ATOM 1081 N LEU A 71 10.264 -7.356 3.150 1.00 60.24 N ATOM 1082 CA LEU A 71 8.945 -7.991 3.050 1.00 64.33 C ATOM 1083 C LEU A 71 8.621 -8.392 1.597 1.00 34.42 C ATOM 1084 O LEU A 71 8.121 -9.487 1.338 1.00 3.11 O ATOM 1085 CB LEU A 71 7.868 -7.046 3.606 1.00 24.31 C ATOM 1086 CG LEU A 71 6.473 -7.669 3.800 1.00 13.30 C ATOM 1087 CD1 LEU A 71 6.525 -8.827 4.797 1.00 12.10 C ATOM 1088 CD2 LEU A 71 5.468 -6.610 4.254 1.00 41.04 C ATOM 0 H LEU A 71 10.236 -6.379 3.442 1.00 60.24 H new ATOM 0 HA LEU A 71 8.959 -8.905 3.644 1.00 64.33 H new ATOM 0 HB2 LEU A 71 8.210 -6.659 4.566 1.00 24.31 H new ATOM 0 HB3 LEU A 71 7.775 -6.194 2.933 1.00 24.31 H new ATOM 0 HG LEU A 71 6.143 -8.065 2.840 1.00 13.30 H new ATOM 0 HD11 LEU A 71 5.527 -9.250 4.916 1.00 12.10 H new ATOM 0 HD12 LEU A 71 7.203 -9.596 4.426 1.00 12.10 H new ATOM 0 HD13 LEU A 71 6.882 -8.462 5.760 1.00 12.10 H new ATOM 0 HD21 LEU A 71 4.489 -7.070 4.385 1.00 41.04 H new ATOM 0 HD22 LEU A 71 5.796 -6.179 5.200 1.00 41.04 H new ATOM 0 HD23 LEU A 71 5.402 -5.825 3.501 1.00 41.04 H new ATOM 1100 N ALA A 72 8.931 -7.511 0.651 1.00 73.01 N ATOM 1101 CA ALA A 72 8.710 -7.793 -0.771 1.00 52.54 C ATOM 1102 C ALA A 72 9.585 -8.960 -1.257 1.00 71.30 C ATOM 1103 O ALA A 72 9.142 -9.796 -2.049 1.00 33.13 O ATOM 1104 CB ALA A 72 8.979 -6.544 -1.603 1.00 61.03 C ATOM 0 H ALA A 72 9.336 -6.594 0.839 1.00 73.01 H new ATOM 0 HA ALA A 72 7.668 -8.087 -0.896 1.00 52.54 H new ATOM 0 HB1 ALA A 72 8.812 -6.766 -2.657 1.00 61.03 H new ATOM 0 HB2 ALA A 72 8.306 -5.746 -1.289 1.00 61.03 H new ATOM 0 HB3 ALA A 72 10.012 -6.226 -1.459 1.00 61.03 H new ATOM 1110 N ARG A 73 10.831 -9.007 -0.782 1.00 70.33 N ATOM 1111 CA ARG A 73 11.761 -10.086 -1.137 1.00 74.12 C ATOM 1112 C ARG A 73 11.251 -11.457 -0.664 1.00 51.12 C ATOM 1113 O ARG A 73 11.162 -12.399 -1.454 1.00 23.44 O ATOM 1114 CB ARG A 73 13.155 -9.808 -0.550 1.00 14.22 C ATOM 1115 CG ARG A 73 13.948 -8.747 -1.312 1.00 23.20 C ATOM 1116 CD ARG A 73 15.270 -8.419 -0.623 1.00 73.54 C ATOM 1117 NE ARG A 73 16.053 -9.620 -0.331 1.00 4.42 N ATOM 1118 CZ ARG A 73 17.355 -9.688 -0.395 1.00 54.32 C ATOM 1119 NH1 ARG A 73 18.057 -8.682 -0.806 1.00 34.32 N ATOM 1120 NH2 ARG A 73 17.953 -10.782 -0.058 1.00 64.32 N ATOM 0 H ARG A 73 11.222 -8.310 -0.149 1.00 70.33 H new ATOM 0 HA ARG A 73 11.830 -10.114 -2.224 1.00 74.12 H new ATOM 0 HB2 ARG A 73 13.045 -9.490 0.487 1.00 14.22 H new ATOM 0 HB3 ARG A 73 13.726 -10.737 -0.540 1.00 14.22 H new ATOM 0 HG2 ARG A 73 14.144 -9.099 -2.325 1.00 23.20 H new ATOM 0 HG3 ARG A 73 13.350 -7.840 -1.400 1.00 23.20 H new ATOM 0 HD2 ARG A 73 15.853 -7.752 -1.258 1.00 73.54 H new ATOM 0 HD3 ARG A 73 15.071 -7.882 0.305 1.00 73.54 H new ATOM 0 HE ARG A 73 15.546 -10.462 -0.059 1.00 4.42 H new ATOM 0 HH11 ARG A 73 17.594 -7.818 -1.087 1.00 34.32 H new ATOM 0 HH12 ARG A 73 19.074 -8.753 -0.849 1.00 34.32 H new ATOM 0 HH21 ARG A 73 17.408 -11.585 0.256 1.00 64.32 H new ATOM 0 HH22 ARG A 73 18.970 -10.843 -0.105 1.00 64.32 H new ATOM 1134 N GLN A 74 10.908 -11.568 0.620 1.00 12.42 N ATOM 1135 CA GLN A 74 10.435 -12.842 1.187 1.00 72.12 C ATOM 1136 C GLN A 74 9.112 -13.303 0.542 1.00 60.21 C ATOM 1137 O GLN A 74 8.823 -14.500 0.484 1.00 34.34 O ATOM 1138 CB GLN A 74 10.261 -12.724 2.709 1.00 55.23 C ATOM 1139 CG GLN A 74 9.276 -11.642 3.136 1.00 14.41 C ATOM 1140 CD GLN A 74 8.964 -11.672 4.620 1.00 31.03 C ATOM 1141 OE1 GLN A 74 8.025 -12.329 5.055 1.00 62.31 O ATOM 1142 NE2 GLN A 74 9.744 -10.962 5.410 1.00 3.04 N ATOM 0 H GLN A 74 10.947 -10.798 1.288 1.00 12.42 H new ATOM 0 HA GLN A 74 11.194 -13.593 0.968 1.00 72.12 H new ATOM 0 HB2 GLN A 74 9.924 -13.683 3.102 1.00 55.23 H new ATOM 0 HB3 GLN A 74 11.231 -12.517 3.161 1.00 55.23 H new ATOM 0 HG2 GLN A 74 9.684 -10.665 2.876 1.00 14.41 H new ATOM 0 HG3 GLN A 74 8.350 -11.760 2.574 1.00 14.41 H new ATOM 0 HE21 GLN A 74 10.517 -10.426 5.016 1.00 3.04 H new ATOM 0 HE22 GLN A 74 9.575 -10.948 6.416 1.00 3.04 H new ATOM 1151 N TRP A 75 8.312 -12.350 0.068 1.00 42.23 N ATOM 1152 CA TRP A 75 7.037 -12.662 -0.596 1.00 50.04 C ATOM 1153 C TRP A 75 7.212 -12.931 -2.102 1.00 34.45 C ATOM 1154 O TRP A 75 6.248 -13.255 -2.793 1.00 51.23 O ATOM 1155 CB TRP A 75 6.033 -11.516 -0.378 1.00 53.24 C ATOM 1156 CG TRP A 75 5.523 -11.417 1.033 1.00 71.50 C ATOM 1157 CD1 TRP A 75 5.920 -12.162 2.107 1.00 15.55 C ATOM 1158 CD2 TRP A 75 4.507 -10.527 1.517 1.00 35.00 C ATOM 1159 NE1 TRP A 75 5.217 -11.793 3.225 1.00 21.13 N ATOM 1160 CE2 TRP A 75 4.340 -10.795 2.889 1.00 2.35 C ATOM 1161 CE3 TRP A 75 3.722 -9.534 0.923 1.00 41.02 C ATOM 1162 CZ2 TRP A 75 3.420 -10.104 3.675 1.00 50.42 C ATOM 1163 CZ3 TRP A 75 2.809 -8.849 1.706 1.00 44.02 C ATOM 1164 CH2 TRP A 75 2.665 -9.140 3.068 1.00 44.42 C ATOM 0 H TRP A 75 8.520 -11.353 0.129 1.00 42.23 H new ATOM 0 HA TRP A 75 6.653 -13.577 -0.145 1.00 50.04 H new ATOM 0 HB2 TRP A 75 6.507 -10.573 -0.650 1.00 53.24 H new ATOM 0 HB3 TRP A 75 5.187 -11.653 -1.052 1.00 53.24 H new ATOM 0 HD1 TRP A 75 6.678 -12.931 2.080 1.00 15.55 H new ATOM 0 HE1 TRP A 75 5.329 -12.196 4.155 1.00 21.13 H new ATOM 0 HE3 TRP A 75 3.826 -9.306 -0.127 1.00 41.02 H new ATOM 0 HZ2 TRP A 75 3.308 -10.323 4.727 1.00 50.42 H new ATOM 0 HZ3 TRP A 75 2.198 -8.078 1.260 1.00 44.02 H new ATOM 0 HH2 TRP A 75 1.941 -8.591 3.652 1.00 44.42 H new ATOM 1175 N GLY A 76 8.439 -12.798 -2.607 1.00 55.21 N ATOM 1176 CA GLY A 76 8.693 -13.012 -4.034 1.00 72.45 C ATOM 1177 C GLY A 76 8.103 -11.921 -4.926 1.00 10.45 C ATOM 1178 O GLY A 76 8.038 -12.068 -6.147 1.00 61.25 O ATOM 0 H GLY A 76 9.262 -12.547 -2.060 1.00 55.21 H new ATOM 0 HA2 GLY A 76 9.769 -13.064 -4.200 1.00 72.45 H new ATOM 0 HA3 GLY A 76 8.278 -13.976 -4.329 1.00 72.45 H new ATOM 1182 N VAL A 77 7.673 -10.821 -4.311 1.00 73.30 N ATOM 1183 CA VAL A 77 7.094 -9.693 -5.043 1.00 3.32 C ATOM 1184 C VAL A 77 8.163 -8.623 -5.340 1.00 61.14 C ATOM 1185 O VAL A 77 7.976 -7.761 -6.200 1.00 52.22 O ATOM 1186 CB VAL A 77 5.928 -9.061 -4.241 1.00 53.11 C ATOM 1187 CG1 VAL A 77 5.238 -7.955 -5.035 1.00 53.54 C ATOM 1188 CG2 VAL A 77 4.922 -10.131 -3.815 1.00 54.54 C ATOM 0 H VAL A 77 7.715 -10.685 -3.301 1.00 73.30 H new ATOM 0 HA VAL A 77 6.708 -10.073 -5.989 1.00 3.32 H new ATOM 0 HB VAL A 77 6.351 -8.609 -3.344 1.00 53.11 H new ATOM 0 HG11 VAL A 77 4.426 -7.534 -4.442 1.00 53.54 H new ATOM 0 HG12 VAL A 77 5.959 -7.172 -5.270 1.00 53.54 H new ATOM 0 HG13 VAL A 77 4.836 -8.368 -5.960 1.00 53.54 H new ATOM 0 HG21 VAL A 77 4.112 -9.666 -3.253 1.00 54.54 H new ATOM 0 HG22 VAL A 77 4.516 -10.621 -4.700 1.00 54.54 H new ATOM 0 HG23 VAL A 77 5.421 -10.870 -3.188 1.00 54.54 H new ATOM 1198 N GLY A 78 9.290 -8.700 -4.631 1.00 70.03 N ATOM 1199 CA GLY A 78 10.397 -7.767 -4.845 1.00 2.21 C ATOM 1200 C GLY A 78 11.768 -8.433 -4.735 1.00 11.12 C ATOM 1201 O GLY A 78 12.745 -7.801 -4.330 1.00 21.31 O ATOM 0 H GLY A 78 9.460 -9.397 -3.906 1.00 70.03 H new ATOM 0 HA2 GLY A 78 10.297 -7.314 -5.831 1.00 2.21 H new ATOM 0 HA3 GLY A 78 10.331 -6.960 -4.115 1.00 2.21 H new ATOM 1205 N ASN A 79 11.837 -9.709 -5.114 1.00 44.53 N ATOM 1206 CA ASN A 79 13.081 -10.493 -5.034 1.00 70.02 C ATOM 1207 C ASN A 79 14.197 -9.897 -5.913 1.00 71.14 C ATOM 1208 O ASN A 79 14.296 -10.196 -7.106 1.00 40.25 O ATOM 1209 CB ASN A 79 12.796 -11.950 -5.426 1.00 50.24 C ATOM 1210 CG ASN A 79 12.010 -12.051 -6.723 1.00 51.03 C ATOM 1211 OD1 ASN A 79 10.786 -11.989 -6.719 1.00 54.20 O ATOM 1212 ND2 ASN A 79 12.696 -12.204 -7.836 1.00 70.54 N ATOM 0 H ASN A 79 11.042 -10.230 -5.483 1.00 44.53 H new ATOM 0 HA ASN A 79 13.439 -10.458 -4.005 1.00 70.02 H new ATOM 0 HB2 ASN A 79 13.738 -12.487 -5.531 1.00 50.24 H new ATOM 0 HB3 ASN A 79 12.239 -12.438 -4.626 1.00 50.24 H new ATOM 0 HD21 ASN A 79 12.209 -12.275 -8.730 1.00 70.54 H new ATOM 0 HD22 ASN A 79 13.714 -12.252 -7.805 1.00 70.54 H new ATOM 1219 N GLU A 80 15.032 -9.044 -5.311 1.00 3.22 N ATOM 1220 CA GLU A 80 16.074 -8.318 -6.049 1.00 60.15 C ATOM 1221 C GLU A 80 15.482 -7.638 -7.299 1.00 61.42 C ATOM 1222 O GLU A 80 15.926 -7.864 -8.427 1.00 73.12 O ATOM 1223 CB GLU A 80 17.221 -9.269 -6.425 1.00 60.21 C ATOM 1224 CG GLU A 80 18.410 -8.592 -7.102 1.00 1.24 C ATOM 1225 CD GLU A 80 19.470 -9.584 -7.552 1.00 44.21 C ATOM 1226 OE1 GLU A 80 19.131 -10.526 -8.302 1.00 62.41 O ATOM 1227 OE2 GLU A 80 20.648 -9.425 -7.170 1.00 53.11 O ATOM 0 H GLU A 80 15.007 -8.838 -4.312 1.00 3.22 H new ATOM 0 HA GLU A 80 16.478 -7.536 -5.405 1.00 60.15 H new ATOM 0 HB2 GLU A 80 17.570 -9.771 -5.523 1.00 60.21 H new ATOM 0 HB3 GLU A 80 16.833 -10.041 -7.089 1.00 60.21 H new ATOM 0 HG2 GLU A 80 18.058 -8.026 -7.964 1.00 1.24 H new ATOM 0 HG3 GLU A 80 18.857 -7.876 -6.412 1.00 1.24 H new ATOM 1234 N LYS A 81 14.465 -6.808 -7.070 1.00 35.14 N ATOM 1235 CA LYS A 81 13.760 -6.094 -8.143 1.00 21.32 C ATOM 1236 C LYS A 81 12.948 -7.062 -9.030 1.00 5.41 C ATOM 1237 O LYS A 81 13.480 -7.716 -9.925 1.00 52.11 O ATOM 1238 CB LYS A 81 14.735 -5.247 -8.991 1.00 11.12 C ATOM 1239 CG LYS A 81 15.330 -4.038 -8.254 1.00 14.42 C ATOM 1240 CD LYS A 81 16.225 -4.448 -7.084 1.00 44.14 C ATOM 1241 CE LYS A 81 16.771 -3.241 -6.327 1.00 71.13 C ATOM 1242 NZ LYS A 81 17.596 -2.356 -7.193 1.00 14.00 N ATOM 0 H LYS A 81 14.104 -6.609 -6.137 1.00 35.14 H new ATOM 0 HA LYS A 81 13.054 -5.412 -7.669 1.00 21.32 H new ATOM 0 HB2 LYS A 81 15.549 -5.886 -9.333 1.00 11.12 H new ATOM 0 HB3 LYS A 81 14.212 -4.894 -9.880 1.00 11.12 H new ATOM 0 HG2 LYS A 81 15.908 -3.437 -8.956 1.00 14.42 H new ATOM 0 HG3 LYS A 81 14.521 -3.407 -7.885 1.00 14.42 H new ATOM 0 HD2 LYS A 81 15.659 -5.079 -6.399 1.00 44.14 H new ATOM 0 HD3 LYS A 81 17.056 -5.048 -7.457 1.00 44.14 H new ATOM 0 HE2 LYS A 81 15.941 -2.669 -5.913 1.00 71.13 H new ATOM 0 HE3 LYS A 81 17.372 -3.585 -5.485 1.00 71.13 H new ATOM 0 HZ1 LYS A 81 18.068 -1.638 -6.607 1.00 14.00 H new ATOM 0 HZ2 LYS A 81 18.313 -2.925 -7.688 1.00 14.00 H new ATOM 0 HZ3 LYS A 81 16.985 -1.886 -7.891 1.00 14.00 H new ATOM 1256 N ASN A 82 11.649 -7.141 -8.749 1.00 0.05 N ATOM 1257 CA ASN A 82 10.721 -8.024 -9.473 1.00 25.22 C ATOM 1258 C ASN A 82 9.951 -7.236 -10.550 1.00 30.52 C ATOM 1259 O ASN A 82 9.865 -6.010 -10.488 1.00 35.34 O ATOM 1260 CB ASN A 82 9.757 -8.643 -8.453 1.00 63.42 C ATOM 1261 CG ASN A 82 8.729 -9.586 -9.049 1.00 50.03 C ATOM 1262 OD1 ASN A 82 8.973 -10.252 -10.049 1.00 53.24 O ATOM 1263 ND2 ASN A 82 7.564 -9.643 -8.431 1.00 11.05 N ATOM 0 H ASN A 82 11.204 -6.595 -8.012 1.00 0.05 H new ATOM 0 HA ASN A 82 11.275 -8.812 -9.983 1.00 25.22 H new ATOM 0 HB2 ASN A 82 10.337 -9.184 -7.706 1.00 63.42 H new ATOM 0 HB3 ASN A 82 9.236 -7.840 -7.932 1.00 63.42 H new ATOM 0 HD21 ASN A 82 6.829 -10.257 -8.783 1.00 11.05 H new ATOM 0 HD22 ASN A 82 7.398 -9.073 -7.601 1.00 11.05 H new ATOM 1270 N ASN A 83 9.393 -7.933 -11.539 1.00 11.13 N ATOM 1271 CA ASN A 83 8.664 -7.266 -12.629 1.00 3.12 C ATOM 1272 C ASN A 83 7.340 -6.622 -12.141 1.00 31.02 C ATOM 1273 O ASN A 83 7.347 -5.507 -11.616 1.00 12.23 O ATOM 1274 CB ASN A 83 8.419 -8.237 -13.800 1.00 72.40 C ATOM 1275 CG ASN A 83 7.987 -9.632 -13.361 1.00 3.31 C ATOM 1276 OD1 ASN A 83 8.212 -10.606 -14.065 1.00 72.32 O ATOM 1277 ND2 ASN A 83 7.385 -9.749 -12.191 1.00 41.43 N ATOM 0 H ASN A 83 9.428 -8.950 -11.613 1.00 11.13 H new ATOM 0 HA ASN A 83 9.294 -6.452 -12.989 1.00 3.12 H new ATOM 0 HB2 ASN A 83 7.653 -7.818 -14.453 1.00 72.40 H new ATOM 0 HB3 ASN A 83 9.332 -8.318 -14.390 1.00 72.40 H new ATOM 0 HD21 ASN A 83 7.096 -10.668 -11.856 1.00 41.43 H new ATOM 0 HD22 ASN A 83 7.209 -8.920 -11.623 1.00 41.43 H new ATOM 1284 N ASN A 84 6.212 -7.314 -12.316 1.00 0.40 N ATOM 1285 CA ASN A 84 4.915 -6.802 -11.857 1.00 40.41 C ATOM 1286 C ASN A 84 4.748 -6.975 -10.337 1.00 72.02 C ATOM 1287 O ASN A 84 4.053 -7.884 -9.877 1.00 41.40 O ATOM 1288 CB ASN A 84 3.768 -7.515 -12.587 1.00 40.23 C ATOM 1289 CG ASN A 84 3.791 -7.304 -14.091 1.00 22.34 C ATOM 1290 OD1 ASN A 84 4.845 -7.150 -14.698 1.00 72.41 O ATOM 1291 ND2 ASN A 84 2.625 -7.298 -14.704 1.00 70.14 N ATOM 0 H ASN A 84 6.168 -8.226 -12.770 1.00 0.40 H new ATOM 0 HA ASN A 84 4.883 -5.737 -12.087 1.00 40.41 H new ATOM 0 HB2 ASN A 84 3.820 -8.583 -12.376 1.00 40.23 H new ATOM 0 HB3 ASN A 84 2.817 -7.158 -12.191 1.00 40.23 H new ATOM 0 HD21 ASN A 84 2.580 -7.162 -15.714 1.00 70.14 H new ATOM 0 HD22 ASN A 84 1.767 -7.429 -14.169 1.00 70.14 H new ATOM 1298 N GLY A 85 5.395 -6.108 -9.561 1.00 42.43 N ATOM 1299 CA GLY A 85 5.320 -6.200 -8.105 1.00 23.13 C ATOM 1300 C GLY A 85 5.278 -4.839 -7.415 1.00 35.11 C ATOM 1301 O GLY A 85 6.096 -3.962 -7.708 1.00 1.34 O ATOM 0 H GLY A 85 5.971 -5.342 -9.911 1.00 42.43 H new ATOM 0 HA2 GLY A 85 4.431 -6.767 -7.829 1.00 23.13 H new ATOM 0 HA3 GLY A 85 6.181 -6.759 -7.738 1.00 23.13 H new ATOM 1305 N LEU A 86 4.325 -4.669 -6.496 1.00 13.13 N ATOM 1306 CA LEU A 86 4.168 -3.420 -5.739 1.00 24.42 C ATOM 1307 C LEU A 86 3.712 -3.704 -4.296 1.00 74.20 C ATOM 1308 O LEU A 86 2.678 -4.337 -4.071 1.00 65.41 O ATOM 1309 CB LEU A 86 3.157 -2.495 -6.438 1.00 30.33 C ATOM 1310 CG LEU A 86 2.874 -1.156 -5.729 1.00 55.43 C ATOM 1311 CD1 LEU A 86 4.157 -0.347 -5.548 1.00 40.15 C ATOM 1312 CD2 LEU A 86 1.838 -0.348 -6.510 1.00 54.44 C ATOM 0 H LEU A 86 3.643 -5.388 -6.255 1.00 13.13 H new ATOM 0 HA LEU A 86 5.138 -2.924 -5.702 1.00 24.42 H new ATOM 0 HB2 LEU A 86 3.521 -2.283 -7.443 1.00 30.33 H new ATOM 0 HB3 LEU A 86 2.215 -3.033 -6.547 1.00 30.33 H new ATOM 0 HG LEU A 86 2.473 -1.376 -4.740 1.00 55.43 H new ATOM 0 HD11 LEU A 86 3.927 0.592 -5.045 1.00 40.15 H new ATOM 0 HD12 LEU A 86 4.865 -0.917 -4.946 1.00 40.15 H new ATOM 0 HD13 LEU A 86 4.596 -0.138 -6.524 1.00 40.15 H new ATOM 0 HD21 LEU A 86 1.649 0.595 -5.996 1.00 54.44 H new ATOM 0 HD22 LEU A 86 2.215 -0.146 -7.513 1.00 54.44 H new ATOM 0 HD23 LEU A 86 0.910 -0.916 -6.579 1.00 54.44 H new ATOM 1324 N LEU A 87 4.486 -3.234 -3.325 1.00 52.33 N ATOM 1325 CA LEU A 87 4.159 -3.427 -1.906 1.00 24.04 C ATOM 1326 C LEU A 87 3.815 -2.093 -1.223 1.00 13.02 C ATOM 1327 O LEU A 87 4.502 -1.093 -1.412 1.00 42.04 O ATOM 1328 CB LEU A 87 5.337 -4.101 -1.183 1.00 4.45 C ATOM 1329 CG LEU A 87 5.134 -4.366 0.321 1.00 41.11 C ATOM 1330 CD1 LEU A 87 3.951 -5.305 0.555 1.00 43.24 C ATOM 1331 CD2 LEU A 87 6.407 -4.936 0.943 1.00 1.42 C ATOM 0 H LEU A 87 5.348 -2.714 -3.489 1.00 52.33 H new ATOM 0 HA LEU A 87 3.281 -4.070 -1.847 1.00 24.04 H new ATOM 0 HB2 LEU A 87 5.546 -5.051 -1.675 1.00 4.45 H new ATOM 0 HB3 LEU A 87 6.221 -3.476 -1.307 1.00 4.45 H new ATOM 0 HG LEU A 87 4.911 -3.415 0.806 1.00 41.11 H new ATOM 0 HD11 LEU A 87 3.829 -5.476 1.624 1.00 43.24 H new ATOM 0 HD12 LEU A 87 3.044 -4.854 0.154 1.00 43.24 H new ATOM 0 HD13 LEU A 87 4.136 -6.255 0.054 1.00 43.24 H new ATOM 0 HD21 LEU A 87 6.244 -5.116 2.005 1.00 1.42 H new ATOM 0 HD22 LEU A 87 6.664 -5.874 0.451 1.00 1.42 H new ATOM 0 HD23 LEU A 87 7.223 -4.225 0.817 1.00 1.42 H new ATOM 1343 N LEU A 88 2.747 -2.090 -0.433 1.00 63.45 N ATOM 1344 CA LEU A 88 2.320 -0.904 0.318 1.00 2.51 C ATOM 1345 C LEU A 88 2.198 -1.217 1.815 1.00 22.42 C ATOM 1346 O LEU A 88 1.437 -2.095 2.211 1.00 44.35 O ATOM 1347 CB LEU A 88 0.972 -0.397 -0.220 1.00 35.14 C ATOM 1348 CG LEU A 88 0.345 0.775 0.558 1.00 24.22 C ATOM 1349 CD1 LEU A 88 1.270 1.990 0.561 1.00 13.50 C ATOM 1350 CD2 LEU A 88 -1.020 1.134 -0.025 1.00 61.45 C ATOM 0 H LEU A 88 2.151 -2.905 -0.292 1.00 63.45 H new ATOM 0 HA LEU A 88 3.075 -0.129 0.189 1.00 2.51 H new ATOM 0 HB2 LEU A 88 1.107 -0.091 -1.257 1.00 35.14 H new ATOM 0 HB3 LEU A 88 0.266 -1.228 -0.222 1.00 35.14 H new ATOM 0 HG LEU A 88 0.206 0.460 1.592 1.00 24.22 H new ATOM 0 HD11 LEU A 88 0.802 2.802 1.117 1.00 13.50 H new ATOM 0 HD12 LEU A 88 2.217 1.726 1.032 1.00 13.50 H new ATOM 0 HD13 LEU A 88 1.453 2.311 -0.465 1.00 13.50 H new ATOM 0 HD21 LEU A 88 -1.449 1.964 0.537 1.00 61.45 H new ATOM 0 HD22 LEU A 88 -0.905 1.424 -1.069 1.00 61.45 H new ATOM 0 HD23 LEU A 88 -1.682 0.271 0.041 1.00 61.45 H new ATOM 1362 N VAL A 89 2.953 -0.502 2.646 1.00 42.01 N ATOM 1363 CA VAL A 89 2.909 -0.703 4.103 1.00 75.24 C ATOM 1364 C VAL A 89 2.609 0.610 4.845 1.00 2.33 C ATOM 1365 O VAL A 89 3.279 1.622 4.634 1.00 0.34 O ATOM 1366 CB VAL A 89 4.242 -1.300 4.636 1.00 71.55 C ATOM 1367 CG1 VAL A 89 4.191 -1.478 6.155 1.00 73.33 C ATOM 1368 CG2 VAL A 89 4.555 -2.630 3.947 1.00 22.41 C ATOM 0 H VAL A 89 3.604 0.222 2.342 1.00 42.01 H new ATOM 0 HA VAL A 89 2.102 -1.410 4.295 1.00 75.24 H new ATOM 0 HB VAL A 89 5.043 -0.598 4.403 1.00 71.55 H new ATOM 0 HG11 VAL A 89 5.135 -1.897 6.504 1.00 73.33 H new ATOM 0 HG12 VAL A 89 4.026 -0.511 6.629 1.00 73.33 H new ATOM 0 HG13 VAL A 89 3.376 -2.153 6.415 1.00 73.33 H new ATOM 0 HG21 VAL A 89 5.492 -3.029 4.335 1.00 22.41 H new ATOM 0 HG22 VAL A 89 3.750 -3.339 4.141 1.00 22.41 H new ATOM 0 HG23 VAL A 89 4.646 -2.471 2.873 1.00 22.41 H new ATOM 1378 N LEU A 90 1.589 0.579 5.705 1.00 64.31 N ATOM 1379 CA LEU A 90 1.200 1.738 6.520 1.00 32.15 C ATOM 1380 C LEU A 90 1.713 1.604 7.965 1.00 51.45 C ATOM 1381 O LEU A 90 1.362 0.656 8.675 1.00 61.24 O ATOM 1382 CB LEU A 90 -0.333 1.879 6.528 1.00 34.33 C ATOM 1383 CG LEU A 90 -0.906 2.899 7.534 1.00 62.24 C ATOM 1384 CD1 LEU A 90 -0.587 4.334 7.129 1.00 75.42 C ATOM 1385 CD2 LEU A 90 -2.412 2.708 7.710 1.00 2.11 C ATOM 0 H LEU A 90 1.009 -0.246 5.858 1.00 64.31 H new ATOM 0 HA LEU A 90 1.651 2.627 6.079 1.00 32.15 H new ATOM 0 HB2 LEU A 90 -0.659 2.162 5.527 1.00 34.33 H new ATOM 0 HB3 LEU A 90 -0.768 0.903 6.741 1.00 34.33 H new ATOM 0 HG LEU A 90 -0.422 2.714 8.493 1.00 62.24 H new ATOM 0 HD11 LEU A 90 -1.008 5.021 7.863 1.00 75.42 H new ATOM 0 HD12 LEU A 90 0.494 4.468 7.084 1.00 75.42 H new ATOM 0 HD13 LEU A 90 -1.019 4.540 6.150 1.00 75.42 H new ATOM 0 HD21 LEU A 90 -2.791 3.439 8.424 1.00 2.11 H new ATOM 0 HD22 LEU A 90 -2.911 2.846 6.751 1.00 2.11 H new ATOM 0 HD23 LEU A 90 -2.610 1.702 8.081 1.00 2.11 H new ATOM 1397 N VAL A 91 2.538 2.558 8.397 1.00 1.44 N ATOM 1398 CA VAL A 91 3.037 2.588 9.777 1.00 21.31 C ATOM 1399 C VAL A 91 2.322 3.673 10.603 1.00 61.33 C ATOM 1400 O VAL A 91 2.632 4.861 10.490 1.00 11.23 O ATOM 1401 CB VAL A 91 4.569 2.828 9.818 1.00 73.43 C ATOM 1402 CG1 VAL A 91 5.084 2.874 11.259 1.00 72.43 C ATOM 1403 CG2 VAL A 91 5.303 1.754 9.016 1.00 21.22 C ATOM 0 H VAL A 91 2.877 3.322 7.812 1.00 1.44 H new ATOM 0 HA VAL A 91 2.824 1.613 10.215 1.00 21.31 H new ATOM 0 HB VAL A 91 4.769 3.797 9.361 1.00 73.43 H new ATOM 0 HG11 VAL A 91 6.161 3.043 11.255 1.00 72.43 H new ATOM 0 HG12 VAL A 91 4.591 3.684 11.796 1.00 72.43 H new ATOM 0 HG13 VAL A 91 4.867 1.927 11.753 1.00 72.43 H new ATOM 0 HG21 VAL A 91 6.376 1.939 9.057 1.00 21.22 H new ATOM 0 HG22 VAL A 91 5.088 0.773 9.440 1.00 21.22 H new ATOM 0 HG23 VAL A 91 4.969 1.782 7.979 1.00 21.22 H new ATOM 1413 N LEU A 92 1.369 3.248 11.436 1.00 24.04 N ATOM 1414 CA LEU A 92 0.579 4.169 12.273 1.00 1.41 C ATOM 1415 C LEU A 92 1.477 5.035 13.181 1.00 24.23 C ATOM 1416 O LEU A 92 1.178 6.202 13.437 1.00 21.35 O ATOM 1417 CB LEU A 92 -0.419 3.367 13.122 1.00 62.24 C ATOM 1418 CG LEU A 92 -1.326 4.189 14.054 1.00 11.20 C ATOM 1419 CD1 LEU A 92 -2.241 5.108 13.247 1.00 41.12 C ATOM 1420 CD2 LEU A 92 -2.144 3.264 14.955 1.00 3.23 C ATOM 0 H LEU A 92 1.121 2.266 11.553 1.00 24.04 H new ATOM 0 HA LEU A 92 0.038 4.845 11.611 1.00 1.41 H new ATOM 0 HB2 LEU A 92 -1.052 2.787 12.451 1.00 62.24 H new ATOM 0 HB3 LEU A 92 0.141 2.654 13.728 1.00 62.24 H new ATOM 0 HG LEU A 92 -0.694 4.813 14.686 1.00 11.20 H new ATOM 0 HD11 LEU A 92 -2.873 5.680 13.926 1.00 41.12 H new ATOM 0 HD12 LEU A 92 -1.636 5.792 12.652 1.00 41.12 H new ATOM 0 HD13 LEU A 92 -2.867 4.509 12.586 1.00 41.12 H new ATOM 0 HD21 LEU A 92 -2.780 3.861 15.608 1.00 3.23 H new ATOM 0 HD22 LEU A 92 -2.765 2.613 14.340 1.00 3.23 H new ATOM 0 HD23 LEU A 92 -1.471 2.657 15.560 1.00 3.23 H new ATOM 1432 N ASP A 93 2.574 4.445 13.648 1.00 74.05 N ATOM 1433 CA ASP A 93 3.550 5.123 14.520 1.00 31.20 C ATOM 1434 C ASP A 93 4.018 6.482 13.953 1.00 33.14 C ATOM 1435 O ASP A 93 4.246 7.436 14.701 1.00 24.42 O ATOM 1436 CB ASP A 93 4.754 4.194 14.718 1.00 60.30 C ATOM 1437 CG ASP A 93 5.860 4.813 15.555 1.00 74.25 C ATOM 1438 OD1 ASP A 93 5.733 4.839 16.792 1.00 53.51 O ATOM 1439 OD2 ASP A 93 6.864 5.271 14.971 1.00 31.11 O ATOM 0 H ASP A 93 2.819 3.478 13.435 1.00 74.05 H new ATOM 0 HA ASP A 93 3.062 5.336 15.471 1.00 31.20 H new ATOM 0 HB2 ASP A 93 4.419 3.273 15.195 1.00 60.30 H new ATOM 0 HB3 ASP A 93 5.156 3.919 13.743 1.00 60.30 H new ATOM 1444 N GLN A 94 4.163 6.561 12.632 1.00 0.23 N ATOM 1445 CA GLN A 94 4.672 7.774 11.974 1.00 42.43 C ATOM 1446 C GLN A 94 3.761 8.235 10.821 1.00 15.14 C ATOM 1447 O GLN A 94 4.076 9.205 10.130 1.00 32.32 O ATOM 1448 CB GLN A 94 6.099 7.515 11.459 1.00 72.34 C ATOM 1449 CG GLN A 94 7.160 7.503 12.563 1.00 74.11 C ATOM 1450 CD GLN A 94 8.408 6.724 12.180 1.00 31.45 C ATOM 1451 OE1 GLN A 94 9.338 7.257 11.583 1.00 65.51 O ATOM 1452 NE2 GLN A 94 8.453 5.464 12.559 1.00 64.25 N ATOM 0 H GLN A 94 3.936 5.801 11.991 1.00 0.23 H new ATOM 0 HA GLN A 94 4.684 8.577 12.711 1.00 42.43 H new ATOM 0 HB2 GLN A 94 6.119 6.558 10.938 1.00 72.34 H new ATOM 0 HB3 GLN A 94 6.357 8.282 10.728 1.00 72.34 H new ATOM 0 HG2 GLN A 94 7.438 8.529 12.803 1.00 74.11 H new ATOM 0 HG3 GLN A 94 6.731 7.070 13.467 1.00 74.11 H new ATOM 0 HE21 GLN A 94 7.662 5.052 13.054 1.00 64.25 H new ATOM 0 HE22 GLN A 94 9.279 4.900 12.358 1.00 64.25 H new ATOM 1461 N ARG A 95 2.634 7.543 10.626 1.00 41.33 N ATOM 1462 CA ARG A 95 1.698 7.845 9.524 1.00 10.21 C ATOM 1463 C ARG A 95 2.383 7.771 8.149 1.00 4.54 C ATOM 1464 O ARG A 95 1.889 8.321 7.166 1.00 63.13 O ATOM 1465 CB ARG A 95 1.055 9.229 9.719 1.00 12.11 C ATOM 1466 CG ARG A 95 0.002 9.271 10.823 1.00 43.25 C ATOM 1467 CD ARG A 95 -0.583 10.670 10.989 1.00 25.14 C ATOM 1468 NE ARG A 95 -1.744 10.681 11.878 1.00 53.25 N ATOM 1469 CZ ARG A 95 -2.302 11.766 12.335 1.00 12.40 C ATOM 1470 NH1 ARG A 95 -1.793 12.931 12.075 1.00 25.45 N ATOM 1471 NH2 ARG A 95 -3.365 11.680 13.065 1.00 32.13 N ATOM 0 H ARG A 95 2.342 6.765 11.217 1.00 41.33 H new ATOM 0 HA ARG A 95 0.919 7.083 9.549 1.00 10.21 H new ATOM 0 HB2 ARG A 95 1.837 9.953 9.948 1.00 12.11 H new ATOM 0 HB3 ARG A 95 0.596 9.541 8.781 1.00 12.11 H new ATOM 0 HG2 ARG A 95 -0.797 8.567 10.591 1.00 43.25 H new ATOM 0 HG3 ARG A 95 0.448 8.948 11.764 1.00 43.25 H new ATOM 0 HD2 ARG A 95 0.182 11.337 11.385 1.00 25.14 H new ATOM 0 HD3 ARG A 95 -0.871 11.060 10.013 1.00 25.14 H new ATOM 0 HE ARG A 95 -2.141 9.784 12.157 1.00 53.25 H new ATOM 0 HH11 ARG A 95 -0.948 13.003 11.508 1.00 25.45 H new ATOM 0 HH12 ARG A 95 -2.238 13.774 12.438 1.00 25.45 H new ATOM 0 HH21 ARG A 95 -3.763 10.766 13.281 1.00 32.13 H new ATOM 0 HH22 ARG A 95 -3.806 12.526 13.425 1.00 32.13 H new ATOM 1485 N ARG A 96 3.507 7.066 8.084 1.00 50.34 N ATOM 1486 CA ARG A 96 4.263 6.930 6.839 1.00 52.21 C ATOM 1487 C ARG A 96 3.884 5.652 6.095 1.00 3.52 C ATOM 1488 O ARG A 96 3.679 4.600 6.703 1.00 72.41 O ATOM 1489 CB ARG A 96 5.767 6.930 7.123 1.00 13.44 C ATOM 1490 CG ARG A 96 6.301 8.274 7.600 1.00 65.23 C ATOM 1491 CD ARG A 96 7.771 8.181 8.005 1.00 45.14 C ATOM 1492 NE ARG A 96 8.328 9.476 8.391 1.00 21.23 N ATOM 1493 CZ ARG A 96 9.541 9.867 8.099 1.00 1.31 C ATOM 1494 NH1 ARG A 96 10.332 9.106 7.413 1.00 74.12 N ATOM 1495 NH2 ARG A 96 9.958 11.024 8.492 1.00 14.31 N ATOM 0 H ARG A 96 3.918 6.578 8.880 1.00 50.34 H new ATOM 0 HA ARG A 96 4.013 7.784 6.209 1.00 52.21 H new ATOM 0 HB2 ARG A 96 5.985 6.174 7.877 1.00 13.44 H new ATOM 0 HB3 ARG A 96 6.299 6.639 6.217 1.00 13.44 H new ATOM 0 HG2 ARG A 96 6.187 9.014 6.808 1.00 65.23 H new ATOM 0 HG3 ARG A 96 5.710 8.621 8.448 1.00 65.23 H new ATOM 0 HD2 ARG A 96 7.872 7.483 8.836 1.00 45.14 H new ATOM 0 HD3 ARG A 96 8.348 7.774 7.175 1.00 45.14 H new ATOM 0 HE ARG A 96 7.734 10.114 8.921 1.00 21.23 H new ATOM 0 HH11 ARG A 96 10.011 8.192 7.095 1.00 74.12 H new ATOM 0 HH12 ARG A 96 11.276 9.421 7.191 1.00 74.12 H new ATOM 0 HH21 ARG A 96 9.341 11.633 9.030 1.00 14.31 H new ATOM 0 HH22 ARG A 96 10.904 11.329 8.264 1.00 14.31 H new ATOM 1509 N VAL A 97 3.809 5.754 4.776 1.00 60.43 N ATOM 1510 CA VAL A 97 3.517 4.602 3.921 1.00 10.14 C ATOM 1511 C VAL A 97 4.545 4.503 2.781 1.00 34.23 C ATOM 1512 O VAL A 97 5.025 5.518 2.267 1.00 22.13 O ATOM 1513 CB VAL A 97 2.080 4.663 3.329 1.00 74.33 C ATOM 1514 CG1 VAL A 97 1.057 4.975 4.409 1.00 32.12 C ATOM 1515 CG2 VAL A 97 1.983 5.674 2.192 1.00 42.10 C ATOM 0 H VAL A 97 3.947 6.627 4.267 1.00 60.43 H new ATOM 0 HA VAL A 97 3.583 3.713 4.548 1.00 10.14 H new ATOM 0 HB VAL A 97 1.858 3.678 2.919 1.00 74.33 H new ATOM 0 HG11 VAL A 97 0.061 5.012 3.967 1.00 32.12 H new ATOM 0 HG12 VAL A 97 1.087 4.198 5.173 1.00 32.12 H new ATOM 0 HG13 VAL A 97 1.289 5.939 4.862 1.00 32.12 H new ATOM 0 HG21 VAL A 97 0.965 5.688 1.804 1.00 42.10 H new ATOM 0 HG22 VAL A 97 2.244 6.665 2.563 1.00 42.10 H new ATOM 0 HG23 VAL A 97 2.671 5.392 1.395 1.00 42.10 H new ATOM 1525 N ARG A 98 4.894 3.281 2.400 1.00 3.13 N ATOM 1526 CA ARG A 98 5.888 3.050 1.340 1.00 33.33 C ATOM 1527 C ARG A 98 5.301 2.235 0.179 1.00 34.41 C ATOM 1528 O ARG A 98 4.716 1.174 0.386 1.00 52.53 O ATOM 1529 CB ARG A 98 7.117 2.324 1.918 1.00 31.31 C ATOM 1530 CG ARG A 98 8.101 1.798 0.864 1.00 12.13 C ATOM 1531 CD ARG A 98 8.945 2.898 0.225 1.00 41.22 C ATOM 1532 NE ARG A 98 9.718 2.386 -0.908 1.00 71.51 N ATOM 1533 CZ ARG A 98 9.865 3.011 -2.046 1.00 43.31 C ATOM 1534 NH1 ARG A 98 9.371 4.193 -2.214 1.00 33.11 N ATOM 1535 NH2 ARG A 98 10.512 2.453 -3.018 1.00 24.02 N ATOM 0 H ARG A 98 4.507 2.428 2.805 1.00 3.13 H new ATOM 0 HA ARG A 98 6.187 4.023 0.949 1.00 33.33 H new ATOM 0 HB2 ARG A 98 7.647 3.007 2.582 1.00 31.31 H new ATOM 0 HB3 ARG A 98 6.775 1.487 2.527 1.00 31.31 H new ATOM 0 HG2 ARG A 98 8.762 1.065 1.327 1.00 12.13 H new ATOM 0 HG3 ARG A 98 7.544 1.278 0.085 1.00 12.13 H new ATOM 0 HD2 ARG A 98 8.297 3.708 -0.111 1.00 41.22 H new ATOM 0 HD3 ARG A 98 9.622 3.319 0.969 1.00 41.22 H new ATOM 0 HE ARG A 98 10.173 1.479 -0.802 1.00 71.51 H new ATOM 0 HH11 ARG A 98 8.862 4.645 -1.455 1.00 33.11 H new ATOM 0 HH12 ARG A 98 9.490 4.674 -3.106 1.00 33.11 H new ATOM 0 HH21 ARG A 98 10.910 1.521 -2.898 1.00 24.02 H new ATOM 0 HH22 ARG A 98 10.624 2.945 -3.905 1.00 24.02 H new ATOM 1549 N PHE A 99 5.466 2.749 -1.041 1.00 43.53 N ATOM 1550 CA PHE A 99 5.125 2.009 -2.266 1.00 73.41 C ATOM 1551 C PHE A 99 6.400 1.426 -2.892 1.00 60.33 C ATOM 1552 O PHE A 99 7.171 2.145 -3.525 1.00 31.54 O ATOM 1553 CB PHE A 99 4.433 2.923 -3.289 1.00 23.45 C ATOM 1554 CG PHE A 99 3.007 3.283 -2.959 1.00 34.13 C ATOM 1555 CD1 PHE A 99 1.965 2.455 -3.354 1.00 41.30 C ATOM 1556 CD2 PHE A 99 2.706 4.453 -2.276 1.00 54.44 C ATOM 1557 CE1 PHE A 99 0.653 2.786 -3.073 1.00 32.43 C ATOM 1558 CE2 PHE A 99 1.396 4.786 -1.992 1.00 32.12 C ATOM 1559 CZ PHE A 99 0.368 3.953 -2.392 1.00 61.54 C ATOM 0 H PHE A 99 5.837 3.684 -1.212 1.00 43.53 H new ATOM 0 HA PHE A 99 4.440 1.205 -1.996 1.00 73.41 H new ATOM 0 HB2 PHE A 99 5.012 3.842 -3.383 1.00 23.45 H new ATOM 0 HB3 PHE A 99 4.452 2.434 -4.263 1.00 23.45 H new ATOM 0 HD1 PHE A 99 2.182 1.541 -3.887 1.00 41.30 H new ATOM 0 HD2 PHE A 99 3.504 5.110 -1.963 1.00 54.44 H new ATOM 0 HE1 PHE A 99 -0.148 2.133 -3.386 1.00 32.43 H new ATOM 0 HE2 PHE A 99 1.175 5.698 -1.457 1.00 32.12 H new ATOM 0 HZ PHE A 99 -0.657 4.214 -2.172 1.00 61.54 H new ATOM 1569 N GLU A 100 6.626 0.132 -2.702 1.00 15.25 N ATOM 1570 CA GLU A 100 7.863 -0.503 -3.159 1.00 52.10 C ATOM 1571 C GLU A 100 7.677 -1.226 -4.503 1.00 22.22 C ATOM 1572 O GLU A 100 6.958 -2.224 -4.591 1.00 40.34 O ATOM 1573 CB GLU A 100 8.368 -1.493 -2.098 1.00 20.14 C ATOM 1574 CG GLU A 100 9.825 -1.897 -2.285 1.00 15.42 C ATOM 1575 CD GLU A 100 10.760 -0.702 -2.221 1.00 63.12 C ATOM 1576 OE1 GLU A 100 11.026 -0.214 -1.103 1.00 32.02 O ATOM 1577 OE2 GLU A 100 11.203 -0.219 -3.285 1.00 24.24 O ATOM 0 H GLU A 100 5.974 -0.499 -2.237 1.00 15.25 H new ATOM 0 HA GLU A 100 8.601 0.285 -3.308 1.00 52.10 H new ATOM 0 HB2 GLU A 100 8.247 -1.047 -1.111 1.00 20.14 H new ATOM 0 HB3 GLU A 100 7.746 -2.388 -2.122 1.00 20.14 H new ATOM 0 HG2 GLU A 100 10.103 -2.617 -1.515 1.00 15.42 H new ATOM 0 HG3 GLU A 100 9.942 -2.398 -3.246 1.00 15.42 H new ATOM 1584 N THR A 101 8.329 -0.708 -5.543 1.00 14.40 N ATOM 1585 CA THR A 101 8.322 -1.337 -6.874 1.00 2.15 C ATOM 1586 C THR A 101 9.623 -2.096 -7.143 1.00 52.21 C ATOM 1587 O THR A 101 10.677 -1.762 -6.601 1.00 52.23 O ATOM 1588 CB THR A 101 8.147 -0.298 -8.008 1.00 73.25 C ATOM 1589 OG1 THR A 101 9.135 0.737 -7.882 1.00 50.10 O ATOM 1590 CG2 THR A 101 6.751 0.312 -8.002 1.00 42.52 C ATOM 0 H THR A 101 8.874 0.152 -5.494 1.00 14.40 H new ATOM 0 HA THR A 101 7.476 -2.024 -6.869 1.00 2.15 H new ATOM 0 HB THR A 101 8.280 -0.816 -8.958 1.00 73.25 H new ATOM 0 HG1 THR A 101 9.465 0.984 -8.771 1.00 50.10 H new ATOM 0 HG21 THR A 101 6.667 1.036 -8.812 1.00 42.52 H new ATOM 0 HG22 THR A 101 6.010 -0.475 -8.140 1.00 42.52 H new ATOM 0 HG23 THR A 101 6.576 0.812 -7.049 1.00 42.52 H new ATOM 1598 N GLY A 102 9.540 -3.124 -7.983 1.00 53.34 N ATOM 1599 CA GLY A 102 10.742 -3.801 -8.455 1.00 2.40 C ATOM 1600 C GLY A 102 11.371 -3.081 -9.646 1.00 24.22 C ATOM 1601 O GLY A 102 12.139 -2.136 -9.476 1.00 40.53 O ATOM 0 H GLY A 102 8.665 -3.502 -8.346 1.00 53.34 H new ATOM 0 HA2 GLY A 102 11.467 -3.862 -7.643 1.00 2.40 H new ATOM 0 HA3 GLY A 102 10.495 -4.824 -8.739 1.00 2.40 H new ATOM 1605 N TYR A 103 11.042 -3.527 -10.856 1.00 11.00 N ATOM 1606 CA TYR A 103 11.473 -2.834 -12.077 1.00 72.22 C ATOM 1607 C TYR A 103 10.384 -2.864 -13.163 1.00 71.44 C ATOM 1608 O TYR A 103 10.344 -1.999 -14.035 1.00 10.51 O ATOM 1609 CB TYR A 103 12.782 -3.425 -12.617 1.00 72.33 C ATOM 1610 CG TYR A 103 12.652 -4.806 -13.222 1.00 71.21 C ATOM 1611 CD1 TYR A 103 12.352 -4.962 -14.569 1.00 24.43 C ATOM 1612 CD2 TYR A 103 12.842 -5.945 -12.456 1.00 65.32 C ATOM 1613 CE1 TYR A 103 12.244 -6.214 -15.137 1.00 55.23 C ATOM 1614 CE2 TYR A 103 12.734 -7.205 -13.015 1.00 43.10 C ATOM 1615 CZ TYR A 103 12.437 -7.334 -14.356 1.00 31.02 C ATOM 1616 OH TYR A 103 12.336 -8.586 -14.921 1.00 41.33 O ATOM 0 H TYR A 103 10.480 -4.362 -11.022 1.00 11.00 H new ATOM 0 HA TYR A 103 11.649 -1.793 -11.808 1.00 72.22 H new ATOM 0 HB2 TYR A 103 13.185 -2.750 -13.371 1.00 72.33 H new ATOM 0 HB3 TYR A 103 13.508 -3.466 -11.805 1.00 72.33 H new ATOM 0 HD1 TYR A 103 12.200 -4.087 -15.183 1.00 24.43 H new ATOM 0 HD2 TYR A 103 13.078 -5.847 -11.407 1.00 65.32 H new ATOM 0 HE1 TYR A 103 12.010 -6.317 -16.186 1.00 55.23 H new ATOM 0 HE2 TYR A 103 12.881 -8.084 -12.405 1.00 43.10 H new ATOM 0 HH TYR A 103 13.183 -8.817 -15.357 1.00 41.33 H new ATOM 1626 N GLY A 104 9.482 -3.846 -13.089 1.00 44.24 N ATOM 1627 CA GLY A 104 8.456 -4.001 -14.119 1.00 15.24 C ATOM 1628 C GLY A 104 7.471 -2.838 -14.169 1.00 74.44 C ATOM 1629 O GLY A 104 6.925 -2.513 -15.223 1.00 41.24 O ATOM 0 H GLY A 104 9.442 -4.535 -12.338 1.00 44.24 H new ATOM 0 HA2 GLY A 104 8.939 -4.101 -15.091 1.00 15.24 H new ATOM 0 HA3 GLY A 104 7.907 -4.925 -13.939 1.00 15.24 H new ATOM 1633 N LEU A 105 7.250 -2.208 -13.018 1.00 73.45 N ATOM 1634 CA LEU A 105 6.296 -1.104 -12.908 1.00 64.50 C ATOM 1635 C LEU A 105 6.961 0.267 -13.100 1.00 31.44 C ATOM 1636 O LEU A 105 6.287 1.290 -13.050 1.00 75.41 O ATOM 1637 CB LEU A 105 5.585 -1.160 -11.548 1.00 20.13 C ATOM 1638 CG LEU A 105 4.781 -2.444 -11.287 1.00 54.21 C ATOM 1639 CD1 LEU A 105 4.118 -2.397 -9.916 1.00 62.10 C ATOM 1640 CD2 LEU A 105 3.737 -2.666 -12.381 1.00 34.42 C ATOM 0 H LEU A 105 7.720 -2.443 -12.144 1.00 73.45 H new ATOM 0 HA LEU A 105 5.568 -1.223 -13.710 1.00 64.50 H new ATOM 0 HB2 LEU A 105 6.331 -1.050 -10.761 1.00 20.13 H new ATOM 0 HB3 LEU A 105 4.912 -0.306 -11.471 1.00 20.13 H new ATOM 0 HG LEU A 105 5.475 -3.284 -11.304 1.00 54.21 H new ATOM 0 HD11 LEU A 105 3.554 -3.316 -9.753 1.00 62.10 H new ATOM 0 HD12 LEU A 105 4.882 -2.298 -9.145 1.00 62.10 H new ATOM 0 HD13 LEU A 105 3.442 -1.543 -9.868 1.00 62.10 H new ATOM 0 HD21 LEU A 105 3.181 -3.581 -12.174 1.00 34.42 H new ATOM 0 HD22 LEU A 105 3.049 -1.821 -12.404 1.00 34.42 H new ATOM 0 HD23 LEU A 105 4.235 -2.755 -13.346 1.00 34.42 H new ATOM 1652 N GLU A 106 8.272 0.293 -13.341 1.00 51.32 N ATOM 1653 CA GLU A 106 8.988 1.563 -13.551 1.00 2.24 C ATOM 1654 C GLU A 106 8.467 2.307 -14.794 1.00 52.34 C ATOM 1655 O GLU A 106 8.668 3.511 -14.942 1.00 73.50 O ATOM 1656 CB GLU A 106 10.498 1.314 -13.678 1.00 25.34 C ATOM 1657 CG GLU A 106 11.160 0.828 -12.389 1.00 35.24 C ATOM 1658 CD GLU A 106 11.195 1.892 -11.299 1.00 63.33 C ATOM 1659 OE1 GLU A 106 11.986 2.852 -11.429 1.00 42.53 O ATOM 1660 OE2 GLU A 106 10.440 1.774 -10.309 1.00 13.00 O ATOM 0 H GLU A 106 8.860 -0.539 -13.396 1.00 51.32 H new ATOM 0 HA GLU A 106 8.803 2.193 -12.681 1.00 2.24 H new ATOM 0 HB2 GLU A 106 10.669 0.577 -14.462 1.00 25.34 H new ATOM 0 HB3 GLU A 106 10.982 2.237 -13.997 1.00 25.34 H new ATOM 0 HG2 GLU A 106 10.624 -0.046 -12.019 1.00 35.24 H new ATOM 0 HG3 GLU A 106 12.178 0.507 -12.609 1.00 35.24 H new ATOM 1667 N GLY A 107 7.805 1.579 -15.692 1.00 25.41 N ATOM 1668 CA GLY A 107 7.207 2.194 -16.876 1.00 75.22 C ATOM 1669 C GLY A 107 5.728 2.531 -16.695 1.00 31.35 C ATOM 1670 O GLY A 107 5.036 2.854 -17.664 1.00 4.10 O ATOM 0 H GLY A 107 7.670 0.570 -15.624 1.00 25.41 H new ATOM 0 HA2 GLY A 107 7.754 3.105 -17.120 1.00 75.22 H new ATOM 0 HA3 GLY A 107 7.318 1.519 -17.724 1.00 75.22 H new ATOM 1674 N TYR A 108 5.242 2.457 -15.454 1.00 64.11 N ATOM 1675 CA TYR A 108 3.834 2.757 -15.140 1.00 73.23 C ATOM 1676 C TYR A 108 3.741 3.611 -13.869 1.00 5.35 C ATOM 1677 O TYR A 108 3.196 4.716 -13.875 1.00 41.43 O ATOM 1678 CB TYR A 108 3.033 1.461 -14.922 1.00 74.00 C ATOM 1679 CG TYR A 108 3.234 0.414 -16.001 1.00 61.13 C ATOM 1680 CD1 TYR A 108 2.532 0.472 -17.198 1.00 62.03 C ATOM 1681 CD2 TYR A 108 4.135 -0.629 -15.821 1.00 35.43 C ATOM 1682 CE1 TYR A 108 2.721 -0.478 -18.182 1.00 44.43 C ATOM 1683 CE2 TYR A 108 4.333 -1.579 -16.801 1.00 72.03 C ATOM 1684 CZ TYR A 108 3.624 -1.501 -17.979 1.00 73.24 C ATOM 1685 OH TYR A 108 3.830 -2.440 -18.966 1.00 42.43 O ATOM 0 H TYR A 108 5.802 2.191 -14.644 1.00 64.11 H new ATOM 0 HA TYR A 108 3.416 3.303 -15.986 1.00 73.23 H new ATOM 0 HB2 TYR A 108 3.313 1.032 -13.960 1.00 74.00 H new ATOM 0 HB3 TYR A 108 1.973 1.708 -14.865 1.00 74.00 H new ATOM 0 HD1 TYR A 108 1.827 1.273 -17.362 1.00 62.03 H new ATOM 0 HD2 TYR A 108 4.690 -0.697 -14.897 1.00 35.43 H new ATOM 0 HE1 TYR A 108 2.165 -0.420 -19.106 1.00 44.43 H new ATOM 0 HE2 TYR A 108 5.040 -2.380 -16.645 1.00 72.03 H new ATOM 0 HH TYR A 108 4.682 -2.261 -19.416 1.00 42.43 H new ATOM 1695 N LEU A 109 4.298 3.075 -12.787 1.00 73.14 N ATOM 1696 CA LEU A 109 4.257 3.701 -11.462 1.00 13.05 C ATOM 1697 C LEU A 109 5.676 4.021 -10.951 1.00 43.20 C ATOM 1698 O LEU A 109 6.238 3.262 -10.160 1.00 43.20 O ATOM 1699 CB LEU A 109 3.571 2.739 -10.482 1.00 74.13 C ATOM 1700 CG LEU A 109 2.166 2.274 -10.894 1.00 21.35 C ATOM 1701 CD1 LEU A 109 1.824 0.946 -10.225 1.00 24.32 C ATOM 1702 CD2 LEU A 109 1.126 3.338 -10.552 1.00 13.41 C ATOM 0 H LEU A 109 4.796 2.185 -12.802 1.00 73.14 H new ATOM 0 HA LEU A 109 3.703 4.637 -11.535 1.00 13.05 H new ATOM 0 HB2 LEU A 109 4.204 1.861 -10.357 1.00 74.13 H new ATOM 0 HB3 LEU A 109 3.504 3.225 -9.508 1.00 74.13 H new ATOM 0 HG LEU A 109 2.155 2.124 -11.974 1.00 21.35 H new ATOM 0 HD11 LEU A 109 0.825 0.632 -10.529 1.00 24.32 H new ATOM 0 HD12 LEU A 109 2.549 0.190 -10.526 1.00 24.32 H new ATOM 0 HD13 LEU A 109 1.853 1.066 -9.142 1.00 24.32 H new ATOM 0 HD21 LEU A 109 0.137 2.990 -10.851 1.00 13.41 H new ATOM 0 HD22 LEU A 109 1.135 3.524 -9.478 1.00 13.41 H new ATOM 0 HD23 LEU A 109 1.362 4.261 -11.082 1.00 13.41 H new ATOM 1714 N PRO A 110 6.292 5.124 -11.419 1.00 63.33 N ATOM 1715 CA PRO A 110 7.617 5.546 -10.937 1.00 42.10 C ATOM 1716 C PRO A 110 7.620 5.898 -9.438 1.00 50.52 C ATOM 1717 O PRO A 110 6.634 6.424 -8.909 1.00 73.05 O ATOM 1718 CB PRO A 110 7.930 6.795 -11.782 1.00 43.42 C ATOM 1719 CG PRO A 110 7.027 6.695 -12.963 1.00 32.15 C ATOM 1720 CD PRO A 110 5.777 6.027 -12.461 1.00 54.01 C ATOM 0 HA PRO A 110 8.353 4.749 -11.040 1.00 42.10 H new ATOM 0 HB2 PRO A 110 7.744 7.710 -11.219 1.00 43.42 H new ATOM 0 HB3 PRO A 110 8.977 6.815 -12.085 1.00 43.42 H new ATOM 0 HG2 PRO A 110 6.807 7.681 -13.373 1.00 32.15 H new ATOM 0 HG3 PRO A 110 7.489 6.114 -13.761 1.00 32.15 H new ATOM 0 HD2 PRO A 110 5.066 6.748 -12.057 1.00 54.01 H new ATOM 0 HD3 PRO A 110 5.263 5.481 -13.252 1.00 54.01 H new ATOM 1728 N ASP A 111 8.740 5.621 -8.772 1.00 12.42 N ATOM 1729 CA ASP A 111 8.909 5.915 -7.342 1.00 42.32 C ATOM 1730 C ASP A 111 8.543 7.385 -7.023 1.00 42.51 C ATOM 1731 O ASP A 111 8.033 7.694 -5.942 1.00 20.21 O ATOM 1732 CB ASP A 111 10.359 5.598 -6.935 1.00 40.04 C ATOM 1733 CG ASP A 111 10.652 5.850 -5.464 1.00 51.34 C ATOM 1734 OD1 ASP A 111 10.278 5.012 -4.620 1.00 11.04 O ATOM 1735 OD2 ASP A 111 11.278 6.885 -5.147 1.00 3.21 O ATOM 0 H ASP A 111 9.556 5.188 -9.203 1.00 12.42 H new ATOM 0 HA ASP A 111 8.229 5.289 -6.764 1.00 42.32 H new ATOM 0 HB2 ASP A 111 10.571 4.554 -7.165 1.00 40.04 H new ATOM 0 HB3 ASP A 111 11.036 6.201 -7.539 1.00 40.04 H new ATOM 1740 N GLY A 112 8.797 8.284 -7.980 1.00 65.52 N ATOM 1741 CA GLY A 112 8.395 9.684 -7.836 1.00 73.12 C ATOM 1742 C GLY A 112 6.879 9.880 -7.866 1.00 13.54 C ATOM 1743 O GLY A 112 6.322 10.618 -7.049 1.00 23.41 O ATOM 0 H GLY A 112 9.275 8.068 -8.855 1.00 65.52 H new ATOM 0 HA2 GLY A 112 8.787 10.073 -6.896 1.00 73.12 H new ATOM 0 HA3 GLY A 112 8.847 10.270 -8.637 1.00 73.12 H new ATOM 1747 N LEU A 113 6.210 9.218 -8.809 1.00 72.12 N ATOM 1748 CA LEU A 113 4.746 9.279 -8.919 1.00 20.34 C ATOM 1749 C LEU A 113 4.079 8.749 -7.642 1.00 14.44 C ATOM 1750 O LEU A 113 3.201 9.395 -7.064 1.00 73.14 O ATOM 1751 CB LEU A 113 4.283 8.461 -10.135 1.00 62.21 C ATOM 1752 CG LEU A 113 2.761 8.388 -10.349 1.00 53.42 C ATOM 1753 CD1 LEU A 113 2.174 9.775 -10.611 1.00 52.23 C ATOM 1754 CD2 LEU A 113 2.425 7.437 -11.495 1.00 13.42 C ATOM 0 H LEU A 113 6.657 8.630 -9.512 1.00 72.12 H new ATOM 0 HA LEU A 113 4.451 10.320 -9.050 1.00 20.34 H new ATOM 0 HB2 LEU A 113 4.737 8.886 -11.030 1.00 62.21 H new ATOM 0 HB3 LEU A 113 4.666 7.446 -10.034 1.00 62.21 H new ATOM 0 HG LEU A 113 2.311 8.001 -9.435 1.00 53.42 H new ATOM 0 HD11 LEU A 113 1.097 9.692 -10.759 1.00 52.23 H new ATOM 0 HD12 LEU A 113 2.375 10.422 -9.757 1.00 52.23 H new ATOM 0 HD13 LEU A 113 2.631 10.201 -11.504 1.00 52.23 H new ATOM 0 HD21 LEU A 113 1.344 7.399 -11.631 1.00 13.42 H new ATOM 0 HD22 LEU A 113 2.894 7.793 -12.412 1.00 13.42 H new ATOM 0 HD23 LEU A 113 2.797 6.439 -11.261 1.00 13.42 H new ATOM 1766 N LEU A 114 4.518 7.571 -7.208 1.00 4.55 N ATOM 1767 CA LEU A 114 4.026 6.955 -5.973 1.00 23.34 C ATOM 1768 C LEU A 114 4.234 7.886 -4.766 1.00 4.14 C ATOM 1769 O LEU A 114 3.392 7.960 -3.868 1.00 21.32 O ATOM 1770 CB LEU A 114 4.747 5.621 -5.748 1.00 51.13 C ATOM 1771 CG LEU A 114 4.564 4.584 -6.870 1.00 61.23 C ATOM 1772 CD1 LEU A 114 5.471 3.377 -6.655 1.00 22.11 C ATOM 1773 CD2 LEU A 114 3.102 4.151 -6.970 1.00 31.10 C ATOM 0 H LEU A 114 5.221 7.017 -7.697 1.00 4.55 H new ATOM 0 HA LEU A 114 2.955 6.778 -6.074 1.00 23.34 H new ATOM 0 HB2 LEU A 114 5.812 5.817 -5.626 1.00 51.13 H new ATOM 0 HB3 LEU A 114 4.393 5.188 -4.812 1.00 51.13 H new ATOM 0 HG LEU A 114 4.849 5.053 -7.812 1.00 61.23 H new ATOM 0 HD11 LEU A 114 5.321 2.661 -7.463 1.00 22.11 H new ATOM 0 HD12 LEU A 114 6.512 3.701 -6.646 1.00 22.11 H new ATOM 0 HD13 LEU A 114 5.230 2.906 -5.702 1.00 22.11 H new ATOM 0 HD21 LEU A 114 2.994 3.418 -7.769 1.00 31.10 H new ATOM 0 HD22 LEU A 114 2.789 3.707 -6.025 1.00 31.10 H new ATOM 0 HD23 LEU A 114 2.480 5.019 -7.187 1.00 31.10 H new ATOM 1785 N SER A 115 5.360 8.601 -4.763 1.00 31.11 N ATOM 1786 CA SER A 115 5.661 9.591 -3.718 1.00 33.21 C ATOM 1787 C SER A 115 4.556 10.655 -3.619 1.00 12.21 C ATOM 1788 O SER A 115 4.088 10.977 -2.523 1.00 52.25 O ATOM 1789 CB SER A 115 7.007 10.271 -3.995 1.00 11.42 C ATOM 1790 OG SER A 115 7.286 11.280 -3.038 1.00 12.32 O ATOM 0 H SER A 115 6.085 8.515 -5.475 1.00 31.11 H new ATOM 0 HA SER A 115 5.713 9.060 -2.768 1.00 33.21 H new ATOM 0 HB2 SER A 115 7.802 9.525 -3.982 1.00 11.42 H new ATOM 0 HB3 SER A 115 6.996 10.708 -4.994 1.00 11.42 H new ATOM 0 HG SER A 115 8.151 11.693 -3.241 1.00 12.32 H new ATOM 1796 N ARG A 116 4.130 11.196 -4.766 1.00 43.33 N ATOM 1797 CA ARG A 116 3.046 12.185 -4.777 1.00 0.42 C ATOM 1798 C ARG A 116 1.723 11.563 -4.309 1.00 20.12 C ATOM 1799 O ARG A 116 0.983 12.180 -3.549 1.00 70.31 O ATOM 1800 CB ARG A 116 2.848 12.810 -6.165 1.00 33.42 C ATOM 1801 CG ARG A 116 1.704 13.824 -6.187 1.00 42.50 C ATOM 1802 CD ARG A 116 1.414 14.375 -7.577 1.00 55.15 C ATOM 1803 NE ARG A 116 0.190 15.176 -7.576 1.00 34.41 N ATOM 1804 CZ ARG A 116 -0.266 15.841 -8.600 1.00 12.24 C ATOM 1805 NH1 ARG A 116 0.378 15.862 -9.721 1.00 53.54 N ATOM 1806 NH2 ARG A 116 -1.376 16.492 -8.497 1.00 52.42 N ATOM 0 H ARG A 116 4.512 10.971 -5.685 1.00 43.33 H new ATOM 0 HA ARG A 116 3.341 12.972 -4.084 1.00 0.42 H new ATOM 0 HB2 ARG A 116 3.771 13.300 -6.475 1.00 33.42 H new ATOM 0 HB3 ARG A 116 2.646 12.022 -6.890 1.00 33.42 H new ATOM 0 HG2 ARG A 116 0.803 13.353 -5.795 1.00 42.50 H new ATOM 0 HG3 ARG A 116 1.948 14.651 -5.520 1.00 42.50 H new ATOM 0 HD2 ARG A 116 2.252 14.985 -7.913 1.00 55.15 H new ATOM 0 HD3 ARG A 116 1.315 13.552 -8.285 1.00 55.15 H new ATOM 0 HE ARG A 116 -0.347 15.217 -6.709 1.00 34.41 H new ATOM 0 HH11 ARG A 116 1.257 15.353 -9.814 1.00 53.54 H new ATOM 0 HH12 ARG A 116 0.007 16.388 -10.513 1.00 53.54 H new ATOM 0 HH21 ARG A 116 -1.892 16.484 -7.617 1.00 52.42 H new ATOM 0 HH22 ARG A 116 -1.737 17.014 -9.295 1.00 52.42 H new ATOM 1820 N ILE A 117 1.435 10.337 -4.757 1.00 62.34 N ATOM 1821 CA ILE A 117 0.192 9.643 -4.378 1.00 1.13 C ATOM 1822 C ILE A 117 -0.013 9.662 -2.852 1.00 75.20 C ATOM 1823 O ILE A 117 -1.129 9.870 -2.361 1.00 35.25 O ATOM 1824 CB ILE A 117 0.185 8.174 -4.889 1.00 61.30 C ATOM 1825 CG1 ILE A 117 0.217 8.149 -6.429 1.00 24.05 C ATOM 1826 CG2 ILE A 117 -1.034 7.411 -4.360 1.00 63.15 C ATOM 1827 CD1 ILE A 117 0.214 6.755 -7.030 1.00 3.41 C ATOM 0 H ILE A 117 2.041 9.803 -5.380 1.00 62.34 H new ATOM 0 HA ILE A 117 -0.631 10.180 -4.850 1.00 1.13 H new ATOM 0 HB ILE A 117 1.078 7.675 -4.511 1.00 61.30 H new ATOM 0 HG12 ILE A 117 -0.645 8.697 -6.808 1.00 24.05 H new ATOM 0 HG13 ILE A 117 1.107 8.678 -6.771 1.00 24.05 H new ATOM 0 HG21 ILE A 117 -1.013 6.387 -4.733 1.00 63.15 H new ATOM 0 HG22 ILE A 117 -1.012 7.400 -3.270 1.00 63.15 H new ATOM 0 HG23 ILE A 117 -1.946 7.902 -4.700 1.00 63.15 H new ATOM 0 HD11 ILE A 117 0.238 6.828 -8.117 1.00 3.41 H new ATOM 0 HD12 ILE A 117 1.091 6.208 -6.684 1.00 3.41 H new ATOM 0 HD13 ILE A 117 -0.688 6.228 -6.721 1.00 3.41 H new ATOM 1839 N ILE A 118 1.080 9.482 -2.114 1.00 73.34 N ATOM 1840 CA ILE A 118 1.057 9.561 -0.652 1.00 3.42 C ATOM 1841 C ILE A 118 0.595 10.951 -0.172 1.00 75.41 C ATOM 1842 O ILE A 118 -0.324 11.072 0.634 1.00 71.12 O ATOM 1843 CB ILE A 118 2.462 9.265 -0.063 1.00 43.33 C ATOM 1844 CG1 ILE A 118 2.978 7.906 -0.571 1.00 0.22 C ATOM 1845 CG2 ILE A 118 2.431 9.301 1.466 1.00 72.53 C ATOM 1846 CD1 ILE A 118 4.402 7.589 -0.153 1.00 4.42 C ATOM 0 H ILE A 118 1.999 9.279 -2.506 1.00 73.34 H new ATOM 0 HA ILE A 118 0.348 8.811 -0.301 1.00 3.42 H new ATOM 0 HB ILE A 118 3.148 10.042 -0.400 1.00 43.33 H new ATOM 0 HG12 ILE A 118 2.319 7.119 -0.204 1.00 0.22 H new ATOM 0 HG13 ILE A 118 2.918 7.890 -1.659 1.00 0.22 H new ATOM 0 HG21 ILE A 118 3.427 9.091 1.855 1.00 72.53 H new ATOM 0 HG22 ILE A 118 2.112 10.288 1.800 1.00 72.53 H new ATOM 0 HG23 ILE A 118 1.732 8.550 1.834 1.00 72.53 H new ATOM 0 HD11 ILE A 118 4.690 6.616 -0.550 1.00 4.42 H new ATOM 0 HD12 ILE A 118 5.074 8.353 -0.543 1.00 4.42 H new ATOM 0 HD13 ILE A 118 4.466 7.570 0.935 1.00 4.42 H new ATOM 1858 N HIS A 119 1.220 12.000 -0.701 1.00 31.10 N ATOM 1859 CA HIS A 119 0.948 13.375 -0.251 1.00 32.21 C ATOM 1860 C HIS A 119 -0.315 13.977 -0.898 1.00 2.13 C ATOM 1861 O HIS A 119 -0.884 14.938 -0.383 1.00 43.21 O ATOM 1862 CB HIS A 119 2.162 14.268 -0.543 1.00 53.35 C ATOM 1863 CG HIS A 119 3.366 13.941 0.290 1.00 32.03 C ATOM 1864 ND1 HIS A 119 4.107 14.896 0.953 1.00 72.51 N ATOM 1865 CD2 HIS A 119 3.961 12.755 0.567 1.00 73.11 C ATOM 1866 CE1 HIS A 119 5.097 14.317 1.598 1.00 52.30 C ATOM 1867 NE2 HIS A 119 5.032 13.022 1.382 1.00 23.33 N ATOM 0 H HIS A 119 1.918 11.931 -1.441 1.00 31.10 H new ATOM 0 HA HIS A 119 0.765 13.330 0.823 1.00 32.21 H new ATOM 0 HB2 HIS A 119 2.425 14.176 -1.597 1.00 53.35 H new ATOM 0 HB3 HIS A 119 1.886 15.309 -0.373 1.00 53.35 H new ATOM 0 HD2 HIS A 119 3.651 11.783 0.213 1.00 73.11 H new ATOM 0 HE1 HIS A 119 5.837 14.820 2.202 1.00 52.30 H new ATOM 0 HE2 HIS A 119 5.675 12.326 1.760 1.00 23.33 H new ATOM 1876 N ASP A 120 -0.755 13.399 -2.012 1.00 72.40 N ATOM 1877 CA ASP A 120 -1.867 13.960 -2.788 1.00 22.13 C ATOM 1878 C ASP A 120 -3.241 13.537 -2.224 1.00 64.32 C ATOM 1879 O ASP A 120 -4.119 14.376 -2.024 1.00 51.13 O ATOM 1880 CB ASP A 120 -1.738 13.534 -4.257 1.00 22.53 C ATOM 1881 CG ASP A 120 -2.570 14.396 -5.191 1.00 10.34 C ATOM 1882 OD1 ASP A 120 -3.767 14.107 -5.371 1.00 22.11 O ATOM 1883 OD2 ASP A 120 -2.025 15.379 -5.740 1.00 34.32 O ATOM 0 H ASP A 120 -0.361 12.542 -2.401 1.00 72.40 H new ATOM 0 HA ASP A 120 -1.811 15.046 -2.715 1.00 22.13 H new ATOM 0 HB2 ASP A 120 -0.691 13.587 -4.556 1.00 22.53 H new ATOM 0 HB3 ASP A 120 -2.046 12.493 -4.358 1.00 22.53 H new ATOM 1888 N ARG A 121 -3.424 12.236 -1.972 1.00 72.00 N ATOM 1889 CA ARG A 121 -4.721 11.721 -1.487 1.00 73.43 C ATOM 1890 C ARG A 121 -4.626 11.044 -0.105 1.00 60.44 C ATOM 1891 O ARG A 121 -5.579 11.084 0.670 1.00 31.33 O ATOM 1892 CB ARG A 121 -5.345 10.746 -2.507 1.00 43.54 C ATOM 1893 CG ARG A 121 -4.398 9.665 -3.034 1.00 21.20 C ATOM 1894 CD ARG A 121 -3.563 10.163 -4.214 1.00 31.55 C ATOM 1895 NE ARG A 121 -4.402 10.580 -5.334 1.00 3.01 N ATOM 1896 CZ ARG A 121 -3.957 11.045 -6.470 1.00 42.51 C ATOM 1897 NH1 ARG A 121 -2.685 11.182 -6.687 1.00 31.01 N ATOM 1898 NH2 ARG A 121 -4.800 11.376 -7.390 1.00 74.44 N ATOM 0 H ARG A 121 -2.704 11.524 -2.092 1.00 72.00 H new ATOM 0 HA ARG A 121 -5.366 12.592 -1.375 1.00 73.43 H new ATOM 0 HB2 ARG A 121 -6.204 10.260 -2.044 1.00 43.54 H new ATOM 0 HB3 ARG A 121 -5.722 11.321 -3.353 1.00 43.54 H new ATOM 0 HG2 ARG A 121 -3.735 9.341 -2.232 1.00 21.20 H new ATOM 0 HG3 ARG A 121 -4.977 8.794 -3.341 1.00 21.20 H new ATOM 0 HD2 ARG A 121 -2.943 11.000 -3.893 1.00 31.55 H new ATOM 0 HD3 ARG A 121 -2.887 9.372 -4.541 1.00 31.55 H new ATOM 0 HE ARG A 121 -5.413 10.502 -5.220 1.00 3.01 H new ATOM 0 HH11 ARG A 121 -2.014 10.925 -5.964 1.00 31.01 H new ATOM 0 HH12 ARG A 121 -2.357 11.547 -7.581 1.00 31.01 H new ATOM 0 HH21 ARG A 121 -5.801 11.273 -7.225 1.00 74.44 H new ATOM 0 HH22 ARG A 121 -4.465 11.740 -8.282 1.00 74.44 H new ATOM 1912 N MET A 122 -3.489 10.427 0.210 1.00 23.35 N ATOM 1913 CA MET A 122 -3.342 9.698 1.482 1.00 2.00 C ATOM 1914 C MET A 122 -3.215 10.635 2.702 1.00 13.41 C ATOM 1915 O MET A 122 -4.001 10.538 3.651 1.00 24.24 O ATOM 1916 CB MET A 122 -2.136 8.755 1.421 1.00 53.25 C ATOM 1917 CG MET A 122 -2.411 7.439 0.707 1.00 52.35 C ATOM 1918 SD MET A 122 -0.998 6.323 0.773 1.00 40.43 S ATOM 1919 CE MET A 122 -1.748 4.781 0.258 1.00 34.35 C ATOM 0 H MET A 122 -2.661 10.413 -0.386 1.00 23.35 H new ATOM 0 HA MET A 122 -4.256 9.120 1.616 1.00 2.00 H new ATOM 0 HB2 MET A 122 -1.315 9.265 0.917 1.00 53.25 H new ATOM 0 HB3 MET A 122 -1.803 8.542 2.437 1.00 53.25 H new ATOM 0 HG2 MET A 122 -3.276 6.955 1.161 1.00 52.35 H new ATOM 0 HG3 MET A 122 -2.667 7.638 -0.334 1.00 52.35 H new ATOM 0 HE1 MET A 122 -1.401 3.974 0.903 1.00 34.35 H new ATOM 0 HE2 MET A 122 -2.833 4.862 0.330 1.00 34.35 H new ATOM 0 HE3 MET A 122 -1.468 4.567 -0.773 1.00 34.35 H new ATOM 1929 N ILE A 123 -2.222 11.532 2.677 1.00 55.42 N ATOM 1930 CA ILE A 123 -1.941 12.426 3.816 1.00 14.50 C ATOM 1931 C ILE A 123 -3.198 13.170 4.323 1.00 60.42 C ATOM 1932 O ILE A 123 -3.493 13.124 5.521 1.00 22.52 O ATOM 1933 CB ILE A 123 -0.819 13.454 3.487 1.00 4.44 C ATOM 1934 CG1 ILE A 123 0.512 12.735 3.190 1.00 73.21 C ATOM 1935 CG2 ILE A 123 -0.644 14.461 4.628 1.00 53.00 C ATOM 1936 CD1 ILE A 123 1.074 11.953 4.358 1.00 72.02 C ATOM 0 H ILE A 123 -1.597 11.661 1.881 1.00 55.42 H new ATOM 0 HA ILE A 123 -1.596 11.772 4.617 1.00 14.50 H new ATOM 0 HB ILE A 123 -1.119 14.003 2.594 1.00 4.44 H new ATOM 0 HG12 ILE A 123 0.364 12.055 2.351 1.00 73.21 H new ATOM 0 HG13 ILE A 123 1.248 13.475 2.876 1.00 73.21 H new ATOM 0 HG21 ILE A 123 0.146 15.167 4.372 1.00 53.00 H new ATOM 0 HG22 ILE A 123 -1.578 15.001 4.783 1.00 53.00 H new ATOM 0 HG23 ILE A 123 -0.375 13.932 5.542 1.00 53.00 H new ATOM 0 HD11 ILE A 123 2.010 11.479 4.062 1.00 72.02 H new ATOM 0 HD12 ILE A 123 1.257 12.628 5.194 1.00 72.02 H new ATOM 0 HD13 ILE A 123 0.360 11.187 4.660 1.00 72.02 H new ATOM 1948 N PRO A 124 -3.967 13.863 3.438 1.00 35.33 N ATOM 1949 CA PRO A 124 -5.186 14.591 3.853 1.00 71.30 C ATOM 1950 C PRO A 124 -6.172 13.719 4.657 1.00 11.41 C ATOM 1951 O PRO A 124 -6.902 14.219 5.516 1.00 71.22 O ATOM 1952 CB PRO A 124 -5.818 15.051 2.520 1.00 14.43 C ATOM 1953 CG PRO A 124 -5.108 14.280 1.456 1.00 72.24 C ATOM 1954 CD PRO A 124 -3.727 14.012 1.991 1.00 3.23 C ATOM 0 HA PRO A 124 -4.943 15.413 4.526 1.00 71.30 H new ATOM 0 HB2 PRO A 124 -6.889 14.849 2.503 1.00 14.43 H new ATOM 0 HB3 PRO A 124 -5.694 16.124 2.376 1.00 14.43 H new ATOM 0 HG2 PRO A 124 -5.629 13.348 1.236 1.00 72.24 H new ATOM 0 HG3 PRO A 124 -5.063 14.848 0.527 1.00 72.24 H new ATOM 0 HD2 PRO A 124 -3.292 13.112 1.557 1.00 3.23 H new ATOM 0 HD3 PRO A 124 -3.042 14.832 1.776 1.00 3.23 H new ATOM 1962 N HIS A 125 -6.176 12.417 4.386 1.00 1.31 N ATOM 1963 CA HIS A 125 -7.053 11.481 5.096 1.00 1.23 C ATOM 1964 C HIS A 125 -6.440 11.018 6.429 1.00 70.24 C ATOM 1965 O HIS A 125 -7.103 11.055 7.468 1.00 35.05 O ATOM 1966 CB HIS A 125 -7.396 10.281 4.207 1.00 74.31 C ATOM 1967 CG HIS A 125 -8.403 10.606 3.145 1.00 43.10 C ATOM 1968 ND1 HIS A 125 -9.604 11.191 3.464 1.00 33.24 N ATOM 1969 CD2 HIS A 125 -8.347 10.416 1.806 1.00 12.41 C ATOM 1970 CE1 HIS A 125 -10.248 11.345 2.324 1.00 2.33 C ATOM 1971 NE2 HIS A 125 -9.530 10.889 1.289 1.00 13.13 N ATOM 0 H HIS A 125 -5.582 11.982 3.680 1.00 1.31 H new ATOM 0 HA HIS A 125 -7.975 12.013 5.332 1.00 1.23 H new ATOM 0 HB2 HIS A 125 -6.485 9.913 3.735 1.00 74.31 H new ATOM 0 HB3 HIS A 125 -7.781 9.473 4.829 1.00 74.31 H new ATOM 0 HD1 HIS A 125 -9.931 11.453 4.394 1.00 33.24 H new ATOM 0 HD2 HIS A 125 -7.531 9.978 1.251 1.00 12.41 H new ATOM 0 HE1 HIS A 125 -11.231 11.784 2.236 1.00 2.33 H new ATOM 1979 N PHE A 126 -5.170 10.604 6.408 1.00 33.45 N ATOM 1980 CA PHE A 126 -4.489 10.140 7.629 1.00 30.34 C ATOM 1981 C PHE A 126 -4.536 11.202 8.731 1.00 13.33 C ATOM 1982 O PHE A 126 -4.860 10.914 9.882 1.00 21.22 O ATOM 1983 CB PHE A 126 -3.025 9.797 7.337 1.00 51.41 C ATOM 1984 CG PHE A 126 -2.833 8.674 6.356 1.00 24.12 C ATOM 1985 CD1 PHE A 126 -3.708 7.600 6.324 1.00 41.04 C ATOM 1986 CD2 PHE A 126 -1.769 8.695 5.471 1.00 75.43 C ATOM 1987 CE1 PHE A 126 -3.523 6.564 5.432 1.00 52.42 C ATOM 1988 CE2 PHE A 126 -1.575 7.660 4.579 1.00 23.03 C ATOM 1989 CZ PHE A 126 -2.454 6.594 4.556 1.00 74.32 C ATOM 0 H PHE A 126 -4.593 10.579 5.568 1.00 33.45 H new ATOM 0 HA PHE A 126 -5.015 9.248 7.970 1.00 30.34 H new ATOM 0 HB2 PHE A 126 -2.526 10.687 6.954 1.00 51.41 H new ATOM 0 HB3 PHE A 126 -2.533 9.533 8.273 1.00 51.41 H new ATOM 0 HD1 PHE A 126 -4.545 7.574 7.006 1.00 41.04 H new ATOM 0 HD2 PHE A 126 -1.084 9.530 5.479 1.00 75.43 H new ATOM 0 HE1 PHE A 126 -4.211 5.732 5.418 1.00 52.42 H new ATOM 0 HE2 PHE A 126 -0.736 7.683 3.899 1.00 23.03 H new ATOM 0 HZ PHE A 126 -2.306 5.786 3.855 1.00 74.32 H new ATOM 1999 N ARG A 127 -4.223 12.435 8.356 1.00 73.24 N ATOM 2000 CA ARG A 127 -4.227 13.564 9.289 1.00 65.12 C ATOM 2001 C ARG A 127 -5.646 13.871 9.807 1.00 70.41 C ATOM 2002 O ARG A 127 -5.820 14.567 10.810 1.00 33.42 O ATOM 2003 CB ARG A 127 -3.628 14.787 8.590 1.00 15.45 C ATOM 2004 CG ARG A 127 -4.463 15.298 7.421 1.00 31.20 C ATOM 2005 CD ARG A 127 -3.704 16.326 6.585 1.00 20.21 C ATOM 2006 NE ARG A 127 -2.969 17.276 7.413 1.00 2.41 N ATOM 2007 CZ ARG A 127 -1.947 17.972 6.996 1.00 13.24 C ATOM 2008 NH1 ARG A 127 -1.583 17.931 5.754 1.00 44.14 N ATOM 2009 NH2 ARG A 127 -1.302 18.718 7.826 1.00 12.23 N ATOM 0 H ARG A 127 -3.960 12.685 7.403 1.00 73.24 H new ATOM 0 HA ARG A 127 -3.623 13.303 10.158 1.00 65.12 H new ATOM 0 HB2 ARG A 127 -3.511 15.589 9.319 1.00 15.45 H new ATOM 0 HB3 ARG A 127 -2.631 14.536 8.229 1.00 15.45 H new ATOM 0 HG2 ARG A 127 -4.754 14.459 6.789 1.00 31.20 H new ATOM 0 HG3 ARG A 127 -5.382 15.745 7.800 1.00 31.20 H new ATOM 0 HD2 ARG A 127 -3.009 15.811 5.922 1.00 20.21 H new ATOM 0 HD3 ARG A 127 -4.407 16.867 5.951 1.00 20.21 H new ATOM 0 HE ARG A 127 -3.273 17.404 8.378 1.00 2.41 H new ATOM 0 HH11 ARG A 127 -2.097 17.351 5.091 1.00 44.14 H new ATOM 0 HH12 ARG A 127 -0.783 18.479 5.439 1.00 44.14 H new ATOM 0 HH21 ARG A 127 -1.591 18.762 8.803 1.00 12.23 H new ATOM 0 HH22 ARG A 127 -0.502 19.264 7.506 1.00 12.23 H new ATOM 2023 N SER A 128 -6.651 13.351 9.106 1.00 4.21 N ATOM 2024 CA SER A 128 -8.055 13.473 9.529 1.00 54.34 C ATOM 2025 C SER A 128 -8.463 12.293 10.427 1.00 71.44 C ATOM 2026 O SER A 128 -9.495 12.332 11.095 1.00 1.53 O ATOM 2027 CB SER A 128 -8.983 13.515 8.302 1.00 11.53 C ATOM 2028 OG SER A 128 -10.349 13.588 8.684 1.00 43.13 O ATOM 0 H SER A 128 -6.523 12.836 8.235 1.00 4.21 H new ATOM 0 HA SER A 128 -8.152 14.400 10.093 1.00 54.34 H new ATOM 0 HB2 SER A 128 -8.731 14.376 7.683 1.00 11.53 H new ATOM 0 HB3 SER A 128 -8.822 12.626 7.692 1.00 11.53 H new ATOM 0 HG SER A 128 -10.751 12.696 8.632 1.00 43.13 H new ATOM 2034 N GLY A 129 -7.634 11.252 10.448 1.00 71.44 N ATOM 2035 CA GLY A 129 -7.983 10.013 11.139 1.00 72.13 C ATOM 2036 C GLY A 129 -8.562 8.971 10.186 1.00 42.43 C ATOM 2037 O GLY A 129 -8.899 7.854 10.588 1.00 3.22 O ATOM 0 H GLY A 129 -6.719 11.241 9.996 1.00 71.44 H new ATOM 0 HA2 GLY A 129 -7.096 9.607 11.625 1.00 72.13 H new ATOM 0 HA3 GLY A 129 -8.707 10.228 11.925 1.00 72.13 H new ATOM 2041 N ASN A 130 -8.668 9.346 8.914 1.00 60.21 N ATOM 2042 CA ASN A 130 -9.200 8.470 7.866 1.00 21.42 C ATOM 2043 C ASN A 130 -8.099 7.562 7.287 1.00 24.03 C ATOM 2044 O ASN A 130 -7.697 7.714 6.133 1.00 1.11 O ATOM 2045 CB ASN A 130 -9.815 9.320 6.741 1.00 34.41 C ATOM 2046 CG ASN A 130 -11.001 10.156 7.188 1.00 72.03 C ATOM 2047 OD1 ASN A 130 -11.116 10.540 8.348 1.00 74.31 O ATOM 2048 ND2 ASN A 130 -11.882 10.467 6.258 1.00 15.43 N ATOM 0 H ASN A 130 -8.388 10.267 8.577 1.00 60.21 H new ATOM 0 HA ASN A 130 -9.967 7.836 8.310 1.00 21.42 H new ATOM 0 HB2 ASN A 130 -9.048 9.980 6.336 1.00 34.41 H new ATOM 0 HB3 ASN A 130 -10.130 8.662 5.931 1.00 34.41 H new ATOM 0 HD21 ASN A 130 -12.690 11.044 6.493 1.00 15.43 H new ATOM 0 HD22 ASN A 130 -11.756 10.131 5.303 1.00 15.43 H new ATOM 2055 N TYR A 131 -7.606 6.626 8.094 1.00 61.24 N ATOM 2056 CA TYR A 131 -6.528 5.726 7.659 1.00 21.14 C ATOM 2057 C TYR A 131 -7.022 4.710 6.612 1.00 23.30 C ATOM 2058 O TYR A 131 -6.395 4.530 5.566 1.00 22.21 O ATOM 2059 CB TYR A 131 -5.905 5.010 8.869 1.00 54.21 C ATOM 2060 CG TYR A 131 -5.278 5.967 9.874 1.00 63.34 C ATOM 2061 CD1 TYR A 131 -3.973 6.423 9.709 1.00 72.11 C ATOM 2062 CD2 TYR A 131 -5.994 6.423 10.977 1.00 72.30 C ATOM 2063 CE1 TYR A 131 -3.403 7.303 10.612 1.00 64.01 C ATOM 2064 CE2 TYR A 131 -5.429 7.301 11.884 1.00 20.40 C ATOM 2065 CZ TYR A 131 -4.136 7.740 11.698 1.00 52.24 C ATOM 2066 OH TYR A 131 -3.573 8.620 12.598 1.00 34.30 O ATOM 0 H TYR A 131 -7.930 6.467 9.048 1.00 61.24 H new ATOM 0 HA TYR A 131 -5.759 6.334 7.182 1.00 21.14 H new ATOM 0 HB2 TYR A 131 -6.673 4.420 9.369 1.00 54.21 H new ATOM 0 HB3 TYR A 131 -5.145 4.312 8.518 1.00 54.21 H new ATOM 0 HD1 TYR A 131 -3.396 6.084 8.862 1.00 72.11 H new ATOM 0 HD2 TYR A 131 -7.009 6.085 11.127 1.00 72.30 H new ATOM 0 HE1 TYR A 131 -2.389 7.647 10.468 1.00 64.01 H new ATOM 0 HE2 TYR A 131 -5.999 7.642 12.736 1.00 20.40 H new ATOM 0 HH TYR A 131 -4.222 8.828 13.302 1.00 34.30 H new ATOM 2076 N ALA A 132 -8.151 4.060 6.888 1.00 61.31 N ATOM 2077 CA ALA A 132 -8.755 3.117 5.934 1.00 54.30 C ATOM 2078 C ALA A 132 -9.167 3.826 4.633 1.00 35.22 C ATOM 2079 O ALA A 132 -8.991 3.298 3.530 1.00 43.14 O ATOM 2080 CB ALA A 132 -9.966 2.432 6.562 1.00 32.41 C ATOM 0 H ALA A 132 -8.669 4.165 7.761 1.00 61.31 H new ATOM 0 HA ALA A 132 -8.006 2.365 5.688 1.00 54.30 H new ATOM 0 HB1 ALA A 132 -10.403 1.737 5.845 1.00 32.41 H new ATOM 0 HB2 ALA A 132 -9.654 1.886 7.453 1.00 32.41 H new ATOM 0 HB3 ALA A 132 -10.707 3.183 6.837 1.00 32.41 H new ATOM 2086 N GLU A 133 -9.726 5.026 4.784 1.00 4.20 N ATOM 2087 CA GLU A 133 -10.108 5.871 3.646 1.00 51.45 C ATOM 2088 C GLU A 133 -8.875 6.241 2.798 1.00 3.24 C ATOM 2089 O GLU A 133 -8.869 6.065 1.577 1.00 4.32 O ATOM 2090 CB GLU A 133 -10.791 7.142 4.178 1.00 4.34 C ATOM 2091 CG GLU A 133 -11.368 8.067 3.111 1.00 52.45 C ATOM 2092 CD GLU A 133 -12.605 7.498 2.434 1.00 41.13 C ATOM 2093 OE1 GLU A 133 -13.705 7.576 3.026 1.00 71.15 O ATOM 2094 OE2 GLU A 133 -12.490 6.976 1.310 1.00 43.52 O ATOM 0 H GLU A 133 -9.928 5.441 5.694 1.00 4.20 H new ATOM 0 HA GLU A 133 -10.798 5.321 3.006 1.00 51.45 H new ATOM 0 HB2 GLU A 133 -11.594 6.847 4.853 1.00 4.34 H new ATOM 0 HB3 GLU A 133 -10.067 7.703 4.769 1.00 4.34 H new ATOM 0 HG2 GLU A 133 -11.619 9.025 3.566 1.00 52.45 H new ATOM 0 HG3 GLU A 133 -10.606 8.262 2.357 1.00 52.45 H new ATOM 2101 N GLY A 134 -7.827 6.732 3.464 1.00 61.14 N ATOM 2102 CA GLY A 134 -6.595 7.119 2.778 1.00 33.41 C ATOM 2103 C GLY A 134 -5.944 5.978 2.001 1.00 42.00 C ATOM 2104 O GLY A 134 -5.554 6.150 0.843 1.00 62.02 O ATOM 0 H GLY A 134 -7.808 6.870 4.474 1.00 61.14 H new ATOM 0 HA2 GLY A 134 -6.813 7.937 2.091 1.00 33.41 H new ATOM 0 HA3 GLY A 134 -5.885 7.499 3.512 1.00 33.41 H new ATOM 2108 N LEU A 135 -5.817 4.812 2.636 1.00 24.32 N ATOM 2109 CA LEU A 135 -5.265 3.626 1.968 1.00 71.13 C ATOM 2110 C LEU A 135 -6.076 3.264 0.714 1.00 54.12 C ATOM 2111 O LEU A 135 -5.510 2.970 -0.341 1.00 14.15 O ATOM 2112 CB LEU A 135 -5.233 2.431 2.928 1.00 63.13 C ATOM 2113 CG LEU A 135 -4.288 2.571 4.131 1.00 60.51 C ATOM 2114 CD1 LEU A 135 -4.379 1.339 5.030 1.00 24.32 C ATOM 2115 CD2 LEU A 135 -2.849 2.796 3.666 1.00 71.32 C ATOM 0 H LEU A 135 -6.087 4.661 3.608 1.00 24.32 H new ATOM 0 HA LEU A 135 -4.246 3.866 1.662 1.00 71.13 H new ATOM 0 HB2 LEU A 135 -6.243 2.260 3.300 1.00 63.13 H new ATOM 0 HB3 LEU A 135 -4.946 1.543 2.365 1.00 63.13 H new ATOM 0 HG LEU A 135 -4.597 3.441 4.710 1.00 60.51 H new ATOM 0 HD11 LEU A 135 -3.703 1.456 5.877 1.00 24.32 H new ATOM 0 HD12 LEU A 135 -5.401 1.229 5.394 1.00 24.32 H new ATOM 0 HD13 LEU A 135 -4.099 0.452 4.462 1.00 24.32 H new ATOM 0 HD21 LEU A 135 -2.197 2.892 4.534 1.00 71.32 H new ATOM 0 HD22 LEU A 135 -2.525 1.949 3.061 1.00 71.32 H new ATOM 0 HD23 LEU A 135 -2.797 3.707 3.070 1.00 71.32 H new ATOM 2127 N SER A 136 -7.403 3.292 0.836 1.00 71.54 N ATOM 2128 CA SER A 136 -8.293 3.010 -0.298 1.00 14.01 C ATOM 2129 C SER A 136 -8.072 4.001 -1.448 1.00 24.31 C ATOM 2130 O SER A 136 -8.010 3.606 -2.612 1.00 30.11 O ATOM 2131 CB SER A 136 -9.763 3.030 0.143 1.00 33.02 C ATOM 2132 OG SER A 136 -10.071 1.902 0.950 1.00 21.13 O ATOM 0 H SER A 136 -7.888 3.507 1.707 1.00 71.54 H new ATOM 0 HA SER A 136 -8.049 2.012 -0.661 1.00 14.01 H new ATOM 0 HB2 SER A 136 -9.966 3.945 0.699 1.00 33.02 H new ATOM 0 HB3 SER A 136 -10.409 3.040 -0.735 1.00 33.02 H new ATOM 0 HG SER A 136 -9.828 2.089 1.881 1.00 21.13 H new ATOM 2138 N GLU A 137 -7.952 5.285 -1.115 1.00 45.52 N ATOM 2139 CA GLU A 137 -7.659 6.324 -2.111 1.00 21.23 C ATOM 2140 C GLU A 137 -6.307 6.078 -2.801 1.00 3.23 C ATOM 2141 O GLU A 137 -6.171 6.275 -4.009 1.00 3.01 O ATOM 2142 CB GLU A 137 -7.671 7.712 -1.450 1.00 71.43 C ATOM 2143 CG GLU A 137 -9.056 8.175 -1.007 1.00 13.34 C ATOM 2144 CD GLU A 137 -9.994 8.435 -2.179 1.00 62.23 C ATOM 2145 OE1 GLU A 137 -10.648 7.480 -2.657 1.00 41.22 O ATOM 2146 OE2 GLU A 137 -10.073 9.594 -2.637 1.00 3.22 O ATOM 0 H GLU A 137 -8.053 5.635 -0.162 1.00 45.52 H new ATOM 0 HA GLU A 137 -8.436 6.283 -2.874 1.00 21.23 H new ATOM 0 HB2 GLU A 137 -7.010 7.697 -0.584 1.00 71.43 H new ATOM 0 HB3 GLU A 137 -7.262 8.440 -2.150 1.00 71.43 H new ATOM 0 HG2 GLU A 137 -9.496 7.419 -0.356 1.00 13.34 H new ATOM 0 HG3 GLU A 137 -8.958 9.086 -0.417 1.00 13.34 H new ATOM 2153 N GLY A 138 -5.310 5.652 -2.026 1.00 53.02 N ATOM 2154 CA GLY A 138 -4.005 5.323 -2.594 1.00 14.15 C ATOM 2155 C GLY A 138 -4.067 4.169 -3.592 1.00 3.12 C ATOM 2156 O GLY A 138 -3.573 4.281 -4.716 1.00 55.03 O ATOM 0 H GLY A 138 -5.380 5.528 -1.016 1.00 53.02 H new ATOM 0 HA2 GLY A 138 -3.597 6.204 -3.089 1.00 14.15 H new ATOM 0 HA3 GLY A 138 -3.318 5.064 -1.788 1.00 14.15 H new ATOM 2160 N VAL A 139 -4.679 3.060 -3.177 1.00 0.30 N ATOM 2161 CA VAL A 139 -4.872 1.899 -4.055 1.00 11.00 C ATOM 2162 C VAL A 139 -5.669 2.279 -5.316 1.00 72.24 C ATOM 2163 O VAL A 139 -5.303 1.918 -6.435 1.00 24.34 O ATOM 2164 CB VAL A 139 -5.616 0.762 -3.314 1.00 2.23 C ATOM 2165 CG1 VAL A 139 -5.878 -0.424 -4.242 1.00 21.41 C ATOM 2166 CG2 VAL A 139 -4.837 0.318 -2.075 1.00 33.43 C ATOM 0 H VAL A 139 -5.052 2.938 -2.235 1.00 0.30 H new ATOM 0 HA VAL A 139 -3.881 1.553 -4.349 1.00 11.00 H new ATOM 0 HB VAL A 139 -6.580 1.153 -2.989 1.00 2.23 H new ATOM 0 HG11 VAL A 139 -6.402 -1.207 -3.693 1.00 21.41 H new ATOM 0 HG12 VAL A 139 -6.490 -0.099 -5.084 1.00 21.41 H new ATOM 0 HG13 VAL A 139 -4.929 -0.813 -4.612 1.00 21.41 H new ATOM 0 HG21 VAL A 139 -5.380 -0.482 -1.571 1.00 33.43 H new ATOM 0 HG22 VAL A 139 -3.853 -0.044 -2.374 1.00 33.43 H new ATOM 0 HG23 VAL A 139 -4.722 1.163 -1.396 1.00 33.43 H new ATOM 2176 N LEU A 140 -6.762 3.011 -5.113 1.00 55.30 N ATOM 2177 CA LEU A 140 -7.612 3.476 -6.216 1.00 34.55 C ATOM 2178 C LEU A 140 -6.824 4.361 -7.198 1.00 14.21 C ATOM 2179 O LEU A 140 -7.004 4.269 -8.416 1.00 74.21 O ATOM 2180 CB LEU A 140 -8.814 4.245 -5.650 1.00 62.00 C ATOM 2181 CG LEU A 140 -9.857 4.711 -6.679 1.00 53.23 C ATOM 2182 CD1 LEU A 140 -10.460 3.521 -7.421 1.00 50.13 C ATOM 2183 CD2 LEU A 140 -10.948 5.529 -5.994 1.00 1.24 C ATOM 0 H LEU A 140 -7.085 3.299 -4.189 1.00 55.30 H new ATOM 0 HA LEU A 140 -7.965 2.605 -6.769 1.00 34.55 H new ATOM 0 HB2 LEU A 140 -9.313 3.612 -4.916 1.00 62.00 H new ATOM 0 HB3 LEU A 140 -8.443 5.120 -5.116 1.00 62.00 H new ATOM 0 HG LEU A 140 -9.357 5.344 -7.412 1.00 53.23 H new ATOM 0 HD11 LEU A 140 -11.195 3.877 -8.143 1.00 50.13 H new ATOM 0 HD12 LEU A 140 -9.671 2.980 -7.943 1.00 50.13 H new ATOM 0 HD13 LEU A 140 -10.946 2.855 -6.707 1.00 50.13 H new ATOM 0 HD21 LEU A 140 -11.679 5.852 -6.735 1.00 1.24 H new ATOM 0 HD22 LEU A 140 -11.442 4.917 -5.239 1.00 1.24 H new ATOM 0 HD23 LEU A 140 -10.503 6.403 -5.518 1.00 1.24 H new ATOM 2195 N ALA A 141 -5.948 5.211 -6.659 1.00 21.24 N ATOM 2196 CA ALA A 141 -5.097 6.080 -7.483 1.00 30.44 C ATOM 2197 C ALA A 141 -4.153 5.252 -8.371 1.00 1.14 C ATOM 2198 O ALA A 141 -4.075 5.464 -9.583 1.00 71.55 O ATOM 2199 CB ALA A 141 -4.300 7.033 -6.597 1.00 63.11 C ATOM 0 H ALA A 141 -5.807 5.318 -5.654 1.00 21.24 H new ATOM 0 HA ALA A 141 -5.743 6.666 -8.137 1.00 30.44 H new ATOM 0 HB1 ALA A 141 -3.674 7.671 -7.220 1.00 63.11 H new ATOM 0 HB2 ALA A 141 -4.986 7.652 -6.019 1.00 63.11 H new ATOM 0 HB3 ALA A 141 -3.670 6.458 -5.918 1.00 63.11 H new ATOM 2205 N VAL A 142 -3.446 4.303 -7.755 1.00 44.45 N ATOM 2206 CA VAL A 142 -2.571 3.379 -8.489 1.00 35.45 C ATOM 2207 C VAL A 142 -3.351 2.625 -9.577 1.00 52.52 C ATOM 2208 O VAL A 142 -2.920 2.545 -10.732 1.00 23.25 O ATOM 2209 CB VAL A 142 -1.912 2.356 -7.527 1.00 24.32 C ATOM 2210 CG1 VAL A 142 -1.091 1.322 -8.296 1.00 33.05 C ATOM 2211 CG2 VAL A 142 -1.049 3.075 -6.490 1.00 40.33 C ATOM 0 H VAL A 142 -3.461 4.152 -6.746 1.00 44.45 H new ATOM 0 HA VAL A 142 -1.792 3.977 -8.962 1.00 35.45 H new ATOM 0 HB VAL A 142 -2.707 1.824 -7.004 1.00 24.32 H new ATOM 0 HG11 VAL A 142 -0.642 0.619 -7.594 1.00 33.05 H new ATOM 0 HG12 VAL A 142 -1.740 0.782 -8.985 1.00 33.05 H new ATOM 0 HG13 VAL A 142 -0.305 1.826 -8.858 1.00 33.05 H new ATOM 0 HG21 VAL A 142 -0.595 2.342 -5.824 1.00 40.33 H new ATOM 0 HG22 VAL A 142 -0.266 3.639 -6.997 1.00 40.33 H new ATOM 0 HG23 VAL A 142 -1.670 3.757 -5.909 1.00 40.33 H new ATOM 2221 N GLN A 143 -4.502 2.075 -9.190 1.00 35.52 N ATOM 2222 CA GLN A 143 -5.408 1.394 -10.128 1.00 34.22 C ATOM 2223 C GLN A 143 -5.721 2.270 -11.358 1.00 73.12 C ATOM 2224 O GLN A 143 -5.789 1.779 -12.488 1.00 45.44 O ATOM 2225 CB GLN A 143 -6.718 1.029 -9.414 1.00 54.13 C ATOM 2226 CG GLN A 143 -7.684 0.210 -10.265 1.00 23.23 C ATOM 2227 CD GLN A 143 -9.042 0.033 -9.607 1.00 1.45 C ATOM 2228 OE1 GLN A 143 -9.507 0.894 -8.870 1.00 12.04 O ATOM 2229 NE2 GLN A 143 -9.691 -1.081 -9.869 1.00 13.45 N ATOM 0 H GLN A 143 -4.835 2.086 -8.226 1.00 35.52 H new ATOM 0 HA GLN A 143 -4.907 0.490 -10.475 1.00 34.22 H new ATOM 0 HB2 GLN A 143 -6.482 0.468 -8.510 1.00 54.13 H new ATOM 0 HB3 GLN A 143 -7.216 1.946 -9.100 1.00 54.13 H new ATOM 0 HG2 GLN A 143 -7.814 0.698 -11.231 1.00 23.23 H new ATOM 0 HG3 GLN A 143 -7.249 -0.770 -10.459 1.00 23.23 H new ATOM 0 HE21 GLN A 143 -9.277 -1.779 -10.487 1.00 13.45 H new ATOM 0 HE22 GLN A 143 -10.608 -1.247 -9.454 1.00 13.45 H new ATOM 2238 N GLN A 144 -5.921 3.568 -11.127 1.00 22.53 N ATOM 2239 CA GLN A 144 -6.220 4.514 -12.211 1.00 34.24 C ATOM 2240 C GLN A 144 -5.003 4.746 -13.124 1.00 44.33 C ATOM 2241 O GLN A 144 -5.137 4.788 -14.348 1.00 31.02 O ATOM 2242 CB GLN A 144 -6.715 5.854 -11.641 1.00 53.22 C ATOM 2243 CG GLN A 144 -8.077 5.763 -10.959 1.00 33.22 C ATOM 2244 CD GLN A 144 -8.583 7.103 -10.445 1.00 55.22 C ATOM 2245 OE1 GLN A 144 -8.250 8.161 -10.973 1.00 73.44 O ATOM 2246 NE2 GLN A 144 -9.414 7.066 -9.422 1.00 3.01 N ATOM 0 H GLN A 144 -5.882 3.992 -10.200 1.00 22.53 H new ATOM 0 HA GLN A 144 -7.010 4.070 -12.816 1.00 34.24 H new ATOM 0 HB2 GLN A 144 -5.983 6.227 -10.924 1.00 53.22 H new ATOM 0 HB3 GLN A 144 -6.771 6.584 -12.448 1.00 53.22 H new ATOM 0 HG2 GLN A 144 -8.802 5.355 -11.663 1.00 33.22 H new ATOM 0 HG3 GLN A 144 -8.013 5.063 -10.126 1.00 33.22 H new ATOM 0 HE21 GLN A 144 -9.671 6.171 -9.006 1.00 3.01 H new ATOM 0 HE22 GLN A 144 -9.800 7.932 -9.047 1.00 3.01 H new ATOM 2255 N VAL A 145 -3.818 4.893 -12.531 1.00 73.31 N ATOM 2256 CA VAL A 145 -2.590 5.117 -13.306 1.00 60.15 C ATOM 2257 C VAL A 145 -2.333 3.974 -14.304 1.00 42.21 C ATOM 2258 O VAL A 145 -2.110 4.212 -15.492 1.00 42.23 O ATOM 2259 CB VAL A 145 -1.350 5.271 -12.390 1.00 25.04 C ATOM 2260 CG1 VAL A 145 -0.090 5.516 -13.224 1.00 0.53 C ATOM 2261 CG2 VAL A 145 -1.556 6.394 -11.374 1.00 31.05 C ATOM 0 H VAL A 145 -3.679 4.862 -11.521 1.00 73.31 H new ATOM 0 HA VAL A 145 -2.744 6.046 -13.855 1.00 60.15 H new ATOM 0 HB VAL A 145 -1.219 4.340 -11.838 1.00 25.04 H new ATOM 0 HG11 VAL A 145 0.770 5.621 -12.562 1.00 0.53 H new ATOM 0 HG12 VAL A 145 0.071 4.673 -13.896 1.00 0.53 H new ATOM 0 HG13 VAL A 145 -0.212 6.428 -13.808 1.00 0.53 H new ATOM 0 HG21 VAL A 145 -0.671 6.481 -10.744 1.00 31.05 H new ATOM 0 HG22 VAL A 145 -1.721 7.334 -11.900 1.00 31.05 H new ATOM 0 HG23 VAL A 145 -2.423 6.168 -10.753 1.00 31.05 H new ATOM 2271 N LEU A 146 -2.374 2.733 -13.811 1.00 51.32 N ATOM 2272 CA LEU A 146 -2.156 1.547 -14.655 1.00 53.04 C ATOM 2273 C LEU A 146 -3.082 1.542 -15.883 1.00 15.11 C ATOM 2274 O LEU A 146 -2.627 1.351 -17.011 1.00 11.21 O ATOM 2275 CB LEU A 146 -2.367 0.266 -13.833 1.00 4.51 C ATOM 2276 CG LEU A 146 -1.315 0.007 -12.741 1.00 22.53 C ATOM 2277 CD1 LEU A 146 -1.687 -1.220 -11.912 1.00 51.44 C ATOM 2278 CD2 LEU A 146 0.073 -0.162 -13.365 1.00 20.34 C ATOM 0 H LEU A 146 -2.556 2.520 -12.830 1.00 51.32 H new ATOM 0 HA LEU A 146 -1.128 1.583 -15.014 1.00 53.04 H new ATOM 0 HB2 LEU A 146 -3.350 0.312 -13.364 1.00 4.51 H new ATOM 0 HB3 LEU A 146 -2.378 -0.585 -14.513 1.00 4.51 H new ATOM 0 HG LEU A 146 -1.291 0.870 -12.076 1.00 22.53 H new ATOM 0 HD11 LEU A 146 -0.929 -1.385 -11.146 1.00 51.44 H new ATOM 0 HD12 LEU A 146 -2.655 -1.058 -11.437 1.00 51.44 H new ATOM 0 HD13 LEU A 146 -1.743 -2.094 -12.561 1.00 51.44 H new ATOM 0 HD21 LEU A 146 0.806 -0.344 -12.579 1.00 20.34 H new ATOM 0 HD22 LEU A 146 0.062 -1.007 -14.054 1.00 20.34 H new ATOM 0 HD23 LEU A 146 0.341 0.745 -13.907 1.00 20.34 H new ATOM 2290 N ASP A 147 -4.372 1.787 -15.657 1.00 53.23 N ATOM 2291 CA ASP A 147 -5.373 1.797 -16.734 1.00 51.10 C ATOM 2292 C ASP A 147 -5.003 2.787 -17.859 1.00 43.23 C ATOM 2293 O ASP A 147 -5.266 2.534 -19.040 1.00 24.24 O ATOM 2294 CB ASP A 147 -6.749 2.143 -16.142 1.00 32.45 C ATOM 2295 CG ASP A 147 -7.842 2.238 -17.194 1.00 35.12 C ATOM 2296 OD1 ASP A 147 -8.248 1.188 -17.737 1.00 75.42 O ATOM 2297 OD2 ASP A 147 -8.299 3.366 -17.486 1.00 54.43 O ATOM 0 H ASP A 147 -4.755 1.983 -14.732 1.00 53.23 H new ATOM 0 HA ASP A 147 -5.402 0.804 -17.183 1.00 51.10 H new ATOM 0 HB2 ASP A 147 -7.024 1.385 -15.408 1.00 32.45 H new ATOM 0 HB3 ASP A 147 -6.681 3.092 -15.610 1.00 32.45 H new ATOM 2302 N GLY A 148 -4.380 3.906 -17.490 1.00 64.35 N ATOM 2303 CA GLY A 148 -4.002 4.922 -18.474 1.00 50.32 C ATOM 2304 C GLY A 148 -2.526 4.888 -18.870 1.00 74.54 C ATOM 2305 O GLY A 148 -2.081 5.697 -19.687 1.00 3.53 O ATOM 0 H GLY A 148 -4.128 4.131 -16.528 1.00 64.35 H new ATOM 0 HA2 GLY A 148 -4.610 4.790 -19.369 1.00 50.32 H new ATOM 0 HA3 GLY A 148 -4.237 5.907 -18.071 1.00 50.32 H new ATOM 2309 N SER A 149 -1.760 3.954 -18.305 1.00 32.30 N ATOM 2310 CA SER A 149 -0.313 3.860 -18.585 1.00 71.42 C ATOM 2311 C SER A 149 0.053 2.552 -19.299 1.00 1.24 C ATOM 2312 O SER A 149 1.227 2.189 -19.386 1.00 34.32 O ATOM 2313 CB SER A 149 0.493 3.974 -17.282 1.00 11.50 C ATOM 2314 OG SER A 149 0.278 5.227 -16.649 1.00 55.22 O ATOM 0 H SER A 149 -2.108 3.251 -17.653 1.00 32.30 H new ATOM 0 HA SER A 149 -0.062 4.688 -19.248 1.00 71.42 H new ATOM 0 HB2 SER A 149 0.209 3.169 -16.605 1.00 11.50 H new ATOM 0 HB3 SER A 149 1.554 3.850 -17.497 1.00 11.50 H new ATOM 0 HG SER A 149 -0.550 5.191 -16.126 1.00 55.22 H new ATOM 2320 N LEU A 150 -0.947 1.858 -19.843 1.00 44.34 N ATOM 2321 CA LEU A 150 -0.718 0.583 -20.543 1.00 70.20 C ATOM 2322 C LEU A 150 0.091 0.762 -21.841 1.00 74.15 C ATOM 2323 O LEU A 150 0.396 -0.206 -22.528 1.00 64.21 O ATOM 2324 CB LEU A 150 -2.053 -0.118 -20.835 1.00 71.32 C ATOM 2325 CG LEU A 150 -2.844 -0.547 -19.587 1.00 24.44 C ATOM 2326 CD1 LEU A 150 -4.115 -1.299 -19.976 1.00 42.21 C ATOM 2327 CD2 LEU A 150 -1.969 -1.398 -18.670 1.00 62.03 C ATOM 0 H LEU A 150 -1.923 2.152 -19.815 1.00 44.34 H new ATOM 0 HA LEU A 150 -0.123 -0.043 -19.879 1.00 70.20 H new ATOM 0 HB2 LEU A 150 -2.675 0.550 -21.430 1.00 71.32 H new ATOM 0 HB3 LEU A 150 -1.858 -1.000 -21.445 1.00 71.32 H new ATOM 0 HG LEU A 150 -3.141 0.351 -19.045 1.00 24.44 H new ATOM 0 HD11 LEU A 150 -4.655 -1.591 -19.075 1.00 42.21 H new ATOM 0 HD12 LEU A 150 -4.748 -0.654 -20.585 1.00 42.21 H new ATOM 0 HD13 LEU A 150 -3.851 -2.190 -20.545 1.00 42.21 H new ATOM 0 HD21 LEU A 150 -2.542 -1.694 -17.792 1.00 62.03 H new ATOM 0 HD22 LEU A 150 -1.640 -2.289 -19.205 1.00 62.03 H new ATOM 0 HD23 LEU A 150 -1.099 -0.820 -18.358 1.00 62.03 H new ATOM 2339 N GLU A 151 0.445 2.002 -22.159 1.00 32.22 N ATOM 2340 CA GLU A 151 1.320 2.323 -23.303 1.00 62.35 C ATOM 2341 C GLU A 151 2.556 1.399 -23.378 1.00 62.45 C ATOM 2342 O GLU A 151 3.032 1.053 -24.462 1.00 21.43 O ATOM 2343 CB GLU A 151 1.783 3.782 -23.170 1.00 72.11 C ATOM 2344 CG GLU A 151 2.791 4.231 -24.225 1.00 24.13 C ATOM 2345 CD GLU A 151 3.419 5.576 -23.888 1.00 54.22 C ATOM 2346 OE1 GLU A 151 2.831 6.622 -24.232 1.00 13.31 O ATOM 2347 OE2 GLU A 151 4.496 5.591 -23.257 1.00 0.52 O ATOM 0 H GLU A 151 0.138 2.822 -21.636 1.00 32.22 H new ATOM 0 HA GLU A 151 0.748 2.172 -24.218 1.00 62.35 H new ATOM 0 HB2 GLU A 151 0.910 4.432 -23.222 1.00 72.11 H new ATOM 0 HB3 GLU A 151 2.225 3.920 -22.183 1.00 72.11 H new ATOM 0 HG2 GLU A 151 3.575 3.480 -24.318 1.00 24.13 H new ATOM 0 HG3 GLU A 151 2.295 4.296 -25.194 1.00 24.13 H new ATOM 2354 N HIS A 152 3.056 0.995 -22.216 1.00 31.41 N ATOM 2355 CA HIS A 152 4.298 0.217 -22.118 1.00 15.55 C ATOM 2356 C HIS A 152 4.073 -1.310 -22.271 1.00 64.43 C ATOM 2357 O HIS A 152 5.027 -2.085 -22.216 1.00 52.43 O ATOM 2358 CB HIS A 152 4.949 0.533 -20.762 1.00 41.13 C ATOM 2359 CG HIS A 152 6.265 -0.143 -20.512 1.00 64.54 C ATOM 2360 ND1 HIS A 152 6.371 -1.377 -19.906 1.00 50.22 N ATOM 2361 CD2 HIS A 152 7.534 0.260 -20.757 1.00 25.23 C ATOM 2362 CE1 HIS A 152 7.642 -1.700 -19.786 1.00 51.23 C ATOM 2363 NE2 HIS A 152 8.371 -0.726 -20.294 1.00 70.42 N ATOM 0 H HIS A 152 2.619 1.193 -21.316 1.00 31.41 H new ATOM 0 HA HIS A 152 4.950 0.504 -22.943 1.00 15.55 H new ATOM 0 HB2 HIS A 152 5.093 1.611 -20.688 1.00 41.13 H new ATOM 0 HB3 HIS A 152 4.257 0.249 -19.970 1.00 41.13 H new ATOM 0 HD2 HIS A 152 7.833 1.185 -21.229 1.00 25.23 H new ATOM 0 HE1 HIS A 152 8.023 -2.610 -19.346 1.00 51.23 H new ATOM 0 HE2 HIS A 152 9.390 -0.708 -20.336 1.00 70.42 H new ATOM 2372 N HIS A 153 2.823 -1.736 -22.496 1.00 23.03 N ATOM 2373 CA HIS A 153 2.478 -3.178 -22.502 1.00 52.25 C ATOM 2374 C HIS A 153 3.051 -3.950 -23.713 1.00 75.43 C ATOM 2375 O HIS A 153 2.309 -4.348 -24.610 1.00 41.33 O ATOM 2376 CB HIS A 153 0.946 -3.382 -22.414 1.00 64.04 C ATOM 2377 CG HIS A 153 0.134 -2.762 -23.529 1.00 15.11 C ATOM 2378 ND1 HIS A 153 -1.239 -2.652 -23.475 1.00 51.44 N ATOM 2379 CD2 HIS A 153 0.495 -2.213 -24.719 1.00 61.11 C ATOM 2380 CE1 HIS A 153 -1.683 -2.073 -24.571 1.00 42.50 C ATOM 2381 NE2 HIS A 153 -0.655 -1.794 -25.342 1.00 11.30 N ATOM 0 H HIS A 153 2.034 -1.114 -22.676 1.00 23.03 H new ATOM 0 HA HIS A 153 2.953 -3.597 -21.615 1.00 52.25 H new ATOM 0 HB2 HIS A 153 0.742 -4.452 -22.393 1.00 64.04 H new ATOM 0 HB3 HIS A 153 0.598 -2.973 -21.466 1.00 64.04 H new ATOM 0 HD2 HIS A 153 1.500 -2.123 -25.103 1.00 61.11 H new ATOM 0 HE1 HIS A 153 -2.718 -1.863 -24.799 1.00 42.50 H new ATOM 0 HE2 HIS A 153 -0.704 -1.340 -26.254 1.00 11.30 H new ATOM 2390 N HIS A 154 4.371 -4.162 -23.729 1.00 75.34 N ATOM 2391 CA HIS A 154 5.034 -4.946 -24.793 1.00 11.04 C ATOM 2392 C HIS A 154 6.565 -4.938 -24.649 1.00 75.41 C ATOM 2393 O HIS A 154 7.280 -5.430 -25.524 1.00 63.45 O ATOM 2394 CB HIS A 154 4.663 -4.424 -26.193 1.00 51.23 C ATOM 2395 CG HIS A 154 5.147 -3.035 -26.479 1.00 61.11 C ATOM 2396 ND1 HIS A 154 6.330 -2.775 -27.129 1.00 70.50 N ATOM 2397 CD2 HIS A 154 4.596 -1.828 -26.214 1.00 1.23 C ATOM 2398 CE1 HIS A 154 6.489 -1.474 -27.253 1.00 41.12 C ATOM 2399 NE2 HIS A 154 5.450 -0.872 -26.707 1.00 10.24 N ATOM 0 H HIS A 154 5.009 -3.803 -23.018 1.00 75.34 H new ATOM 0 HA HIS A 154 4.676 -5.969 -24.681 1.00 11.04 H new ATOM 0 HB2 HIS A 154 5.074 -5.101 -26.942 1.00 51.23 H new ATOM 0 HB3 HIS A 154 3.579 -4.449 -26.302 1.00 51.23 H new ATOM 0 HD2 HIS A 154 3.658 -1.649 -25.709 1.00 1.23 H new ATOM 0 HE1 HIS A 154 7.328 -0.983 -27.722 1.00 41.12 H new ATOM 0 HE2 HIS A 154 5.305 0.136 -26.659 1.00 10.24 H new ATOM 2408 N HIS A 155 7.072 -4.390 -23.547 1.00 32.41 N ATOM 2409 CA HIS A 155 8.521 -4.242 -23.367 1.00 64.15 C ATOM 2410 C HIS A 155 9.051 -5.064 -22.180 1.00 12.34 C ATOM 2411 O HIS A 155 8.423 -5.140 -21.125 1.00 50.20 O ATOM 2412 CB HIS A 155 8.883 -2.763 -23.184 1.00 14.35 C ATOM 2413 CG HIS A 155 10.355 -2.521 -23.022 1.00 70.32 C ATOM 2414 ND1 HIS A 155 11.255 -2.631 -24.061 1.00 74.20 N ATOM 2415 CD2 HIS A 155 11.086 -2.183 -21.933 1.00 32.41 C ATOM 2416 CE1 HIS A 155 12.470 -2.371 -23.618 1.00 40.45 C ATOM 2417 NE2 HIS A 155 12.392 -2.096 -22.333 1.00 2.23 N ATOM 0 H HIS A 155 6.510 -4.043 -22.770 1.00 32.41 H new ATOM 0 HA HIS A 155 8.998 -4.628 -24.268 1.00 64.15 H new ATOM 0 HB2 HIS A 155 8.523 -2.200 -24.045 1.00 14.35 H new ATOM 0 HB3 HIS A 155 8.361 -2.375 -22.309 1.00 14.35 H new ATOM 0 HD2 HIS A 155 10.709 -2.014 -20.935 1.00 32.41 H new ATOM 0 HE1 HIS A 155 13.374 -2.382 -24.209 1.00 40.45 H new ATOM 0 HE2 HIS A 155 13.180 -1.856 -21.731 1.00 2.23 H new ATOM 2426 N HIS A 156 10.224 -5.661 -22.379 1.00 21.04 N ATOM 2427 CA HIS A 156 10.929 -6.411 -21.335 1.00 62.33 C ATOM 2428 C HIS A 156 12.433 -6.093 -21.377 1.00 44.01 C ATOM 2429 O HIS A 156 12.856 -5.170 -22.071 1.00 61.22 O ATOM 2430 CB HIS A 156 10.702 -7.920 -21.518 1.00 14.54 C ATOM 2431 CG HIS A 156 11.078 -8.433 -22.881 1.00 22.33 C ATOM 2432 ND1 HIS A 156 12.383 -8.617 -23.291 1.00 13.41 N ATOM 2433 CD2 HIS A 156 10.306 -8.809 -23.929 1.00 35.10 C ATOM 2434 CE1 HIS A 156 12.395 -9.080 -24.524 1.00 74.10 C ATOM 2435 NE2 HIS A 156 11.151 -9.206 -24.934 1.00 11.22 N ATOM 0 H HIS A 156 10.717 -5.640 -23.272 1.00 21.04 H new ATOM 0 HA HIS A 156 10.534 -6.113 -20.364 1.00 62.33 H new ATOM 0 HB2 HIS A 156 11.280 -8.458 -20.766 1.00 14.54 H new ATOM 0 HB3 HIS A 156 9.651 -8.144 -21.333 1.00 14.54 H new ATOM 0 HD1 HIS A 156 13.210 -8.424 -22.726 1.00 13.41 H new ATOM 0 HD2 HIS A 156 9.227 -8.798 -23.966 1.00 35.10 H new ATOM 0 HE1 HIS A 156 13.277 -9.316 -25.101 1.00 74.10 H new ATOM 2444 N HIS A 157 13.240 -6.853 -20.634 1.00 73.14 N ATOM 2445 CA HIS A 157 14.704 -6.680 -20.675 1.00 33.24 C ATOM 2446 C HIS A 157 15.379 -7.805 -21.494 1.00 63.11 C ATOM 2447 O HIS A 157 15.105 -7.887 -22.713 1.00 38.94 O ATOM 2448 CB HIS A 157 15.278 -6.592 -19.244 1.00 44.01 C ATOM 2449 CG HIS A 157 14.921 -7.747 -18.350 1.00 4.11 C ATOM 2450 ND1 HIS A 157 15.811 -8.745 -18.022 1.00 62.04 N ATOM 2451 CD2 HIS A 157 13.771 -8.048 -17.700 1.00 34.35 C ATOM 2452 CE1 HIS A 157 15.230 -9.606 -17.213 1.00 31.00 C ATOM 2453 NE2 HIS A 157 13.992 -9.207 -16.999 1.00 53.11 N ATOM 2454 OXT HIS A 157 16.167 -8.595 -20.932 1.00 38.94 O ATOM 0 H HIS A 157 12.916 -7.586 -20.003 1.00 73.14 H new ATOM 0 HA HIS A 157 14.924 -5.740 -21.182 1.00 33.24 H new ATOM 0 HB2 HIS A 157 16.364 -6.521 -19.307 1.00 44.01 H new ATOM 0 HB3 HIS A 157 14.925 -5.670 -18.782 1.00 44.01 H new ATOM 0 HD1 HIS A 157 16.773 -8.808 -18.355 1.00 62.04 H new ATOM 0 HD2 HIS A 157 12.852 -7.482 -17.728 1.00 34.35 H new ATOM 0 HE1 HIS A 157 15.690 -10.490 -16.795 1.00 31.00 H new TER 2463 HIS A 157