USER MOD reduce.3.24.130724 H: found=0, std=0, add=1403, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1403 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: B 60 MET CE :methyl 179:sc= 0 (180deg=0) USER MOD Set 1.2: B 61 LYS NZ :NH3+ 173:sc= 1.23 (180deg=-0.00454) USER MOD Set 1.3: B 67 GLN : amide:sc= 1.29 K(o=2.5,f=-8!) USER MOD Set 2.1: A 60 MET CE :methyl 149:sc= -0.188 (180deg=-0.383) USER MOD Set 2.2: A 67 GLN : amide:sc= 0.0998 X(o=-0.088,f=-0.33) USER MOD Set 3.1: A 45 GLN : amide:sc= 2.17 K(o=3.6,f=-3.8!) USER MOD Set 3.2: B 7 THR OG1 : rot -117:sc= 1.41 USER MOD Single : A 7 THR OG1 : rot 170:sc= 1.19 USER MOD Single : A 12 SER OG : rot -81:sc= 1.04 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 85:sc= 1.02 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.093) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -86:sc= 1.25 USER MOD Single : A 34 SER OG : rot 178:sc= 1.6 USER MOD Single : A 36 ASN : amide:sc= 2.32 K(o=2.3,f=-0.2) USER MOD Single : A 39 LYS NZ :NH3+ -142:sc= 1.17 (180deg=0.749) USER MOD Single : A 43 THR OG1 : rot 85:sc= 1.17 USER MOD Single : A 44 GLN : amide:sc= -0.754 K(o=-0.75,f=-0.11) USER MOD Single : A 48 HIS : no HD1:sc= -0.0165 X(o=-0.016,f=0) USER MOD Single : A 51 LYS NZ :NH3+ -157:sc= 1.2 (180deg=0.212) USER MOD Single : A 55 SER OG : rot 180:sc= 0.00204 USER MOD Single : A 59 LYS NZ :NH3+ -132:sc= 1.09 (180deg=0.146) USER MOD Single : A 61 LYS NZ :NH3+ 178:sc= 2.47 (180deg=2.3) USER MOD Single : A 62 SER OG : rot 73:sc= 1.15 USER MOD Single : A 66 ASN : amide:sc= 1.03 K(o=1,f=-3.1!) USER MOD Single : A 69 SER OG : rot -50:sc= 1.21 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.711 K(o=-0.71,f=-2.1) USER MOD Single : A 76 TYR OH : rot 171:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -157:sc= 1.22 (180deg=1.09) USER MOD Single : A 89 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.021) USER MOD Single : B 12 SER OG : rot -4:sc= 0.305 USER MOD Single : B 15 THR OG1 : rot -52:sc= 1.23 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 133:sc= 1.22 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 1.23 K(o=1.2,f=-1.2) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot -155:sc= 1.05 USER MOD Single : B 34 SER OG : rot 180:sc= 0.494 USER MOD Single : B 36 ASN : amide:sc= 1.02 K(o=1,f=-0.41) USER MOD Single : B 39 LYS NZ :NH3+ -177:sc= 1.8 (180deg=1.77) USER MOD Single : B 43 THR OG1 : rot 79:sc= 0.229 USER MOD Single : B 44 GLN : amide:sc= -0.528 K(o=-0.53,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.0419 K(o=-0.042,f=-0.86) USER MOD Single : B 48 HIS : no HD1:sc= -0.0728 X(o=-0.073,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot -56:sc= 0.595 USER MOD Single : B 59 LYS NZ :NH3+ -178:sc= 0.849 (180deg=0.81) USER MOD Single : B 62 SER OG : rot 80:sc= 1.17 USER MOD Single : B 66 ASN : amide:sc= 0.599 K(o=0.6,f=-4.6!) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -171:sc= 2.34 (180deg=2.21) USER MOD Single : B 74 ASN : amide:sc= 0.611 K(o=0.61,f=-0.39) USER MOD Single : B 76 TYR OH : rot 130:sc= 0 USER MOD Single : B 85 LYS NZ :NH3+ 158:sc= 2.41 (180deg=0.246) USER MOD Single : B 89 LYS NZ :NH3+ -99:sc= 0.0617 (180deg=-1.47!) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 7.981 -17.632 -15.183 1.00 2.25 N ATOM 41 CA GLU A 4 8.358 -16.422 -14.481 1.00 1.68 C ATOM 42 C GLU A 4 7.438 -16.273 -13.256 1.00 1.64 C ATOM 43 O GLU A 4 6.546 -15.426 -13.250 1.00 1.66 O ATOM 44 CB GLU A 4 8.294 -15.237 -15.471 1.00 2.27 C ATOM 45 CG GLU A 4 7.084 -15.206 -16.430 1.00 3.56 C ATOM 46 CD GLU A 4 7.154 -16.253 -17.538 1.00 4.48 C ATOM 47 OE1 GLU A 4 7.944 -16.057 -18.484 1.00 4.66 O ATOM 48 OE2 GLU A 4 6.465 -17.288 -17.373 1.00 5.73 O ATOM 0 HA GLU A 4 9.381 -16.454 -14.106 1.00 1.68 H new ATOM 0 HB2 GLU A 4 8.297 -14.311 -14.896 1.00 2.27 H new ATOM 0 HB3 GLU A 4 9.204 -15.243 -16.070 1.00 2.27 H new ATOM 0 HG2 GLU A 4 6.171 -15.359 -15.854 1.00 3.56 H new ATOM 0 HG3 GLU A 4 7.014 -14.216 -16.881 1.00 3.56 H new ATOM 55 N PRO A 5 7.608 -17.113 -12.217 1.00 2.10 N ATOM 56 CA PRO A 5 6.738 -17.112 -11.053 1.00 2.26 C ATOM 57 C PRO A 5 7.011 -15.876 -10.195 1.00 1.72 C ATOM 58 O PRO A 5 7.814 -15.927 -9.266 1.00 2.16 O ATOM 59 CB PRO A 5 7.055 -18.415 -10.311 1.00 3.15 C ATOM 60 CG PRO A 5 8.526 -18.652 -10.648 1.00 3.39 C ATOM 61 CD PRO A 5 8.606 -18.166 -12.095 1.00 2.82 C ATOM 0 HA PRO A 5 5.681 -17.066 -11.315 1.00 2.26 H new ATOM 0 HB2 PRO A 5 6.898 -18.317 -9.237 1.00 3.15 H new ATOM 0 HB3 PRO A 5 6.425 -19.237 -10.651 1.00 3.15 H new ATOM 0 HG2 PRO A 5 9.190 -18.089 -9.992 1.00 3.39 H new ATOM 0 HG3 PRO A 5 8.801 -19.703 -10.555 1.00 3.39 H new ATOM 0 HD2 PRO A 5 9.602 -17.789 -12.326 1.00 2.82 H new ATOM 0 HD3 PRO A 5 8.403 -18.979 -12.792 1.00 2.82 H new ATOM 69 N LEU A 6 6.325 -14.769 -10.489 1.00 1.07 N ATOM 70 CA LEU A 6 6.351 -13.598 -9.635 1.00 1.00 C ATOM 71 C LEU A 6 5.716 -13.992 -8.301 1.00 1.01 C ATOM 72 O LEU A 6 4.707 -14.700 -8.290 1.00 1.09 O ATOM 73 CB LEU A 6 5.575 -12.464 -10.318 1.00 1.20 C ATOM 74 CG LEU A 6 6.136 -12.081 -11.701 1.00 1.05 C ATOM 75 CD1 LEU A 6 5.239 -10.998 -12.312 1.00 1.42 C ATOM 76 CD2 LEU A 6 7.568 -11.539 -11.600 1.00 1.26 C ATOM 0 H LEU A 6 5.743 -14.667 -11.320 1.00 1.07 H new ATOM 0 HA LEU A 6 7.367 -13.245 -9.460 1.00 1.00 H new ATOM 0 HB2 LEU A 6 4.532 -12.763 -10.428 1.00 1.20 H new ATOM 0 HB3 LEU A 6 5.589 -11.585 -9.673 1.00 1.20 H new ATOM 0 HG LEU A 6 6.154 -12.975 -12.324 1.00 1.05 H new ATOM 0 HD11 LEU A 6 5.624 -10.717 -13.292 1.00 1.42 H new ATOM 0 HD12 LEU A 6 4.225 -11.383 -12.418 1.00 1.42 H new ATOM 0 HD13 LEU A 6 5.230 -10.124 -11.661 1.00 1.42 H new ATOM 0 HD21 LEU A 6 7.930 -11.280 -12.595 1.00 1.26 H new ATOM 0 HD22 LEU A 6 7.577 -10.651 -10.968 1.00 1.26 H new ATOM 0 HD23 LEU A 6 8.216 -12.301 -11.166 1.00 1.26 H new ATOM 88 N THR A 7 6.301 -13.576 -7.177 1.00 1.00 N ATOM 89 CA THR A 7 5.706 -13.858 -5.878 1.00 1.08 C ATOM 90 C THR A 7 4.374 -13.120 -5.759 1.00 1.01 C ATOM 91 O THR A 7 4.073 -12.247 -6.570 1.00 1.10 O ATOM 92 CB THR A 7 6.671 -13.509 -4.740 1.00 1.19 C ATOM 93 OG1 THR A 7 6.187 -14.078 -3.540 1.00 1.94 O ATOM 94 CG2 THR A 7 6.834 -12.000 -4.533 1.00 1.07 C ATOM 0 H THR A 7 7.174 -13.050 -7.143 1.00 1.00 H new ATOM 0 HA THR A 7 5.510 -14.927 -5.794 1.00 1.08 H new ATOM 0 HB THR A 7 7.648 -13.909 -5.012 1.00 1.19 H new ATOM 0 HG1 THR A 7 6.870 -13.998 -2.841 1.00 1.94 H new ATOM 0 HG21 THR A 7 7.529 -11.818 -3.714 1.00 1.07 H new ATOM 0 HG22 THR A 7 7.222 -11.547 -5.445 1.00 1.07 H new ATOM 0 HG23 THR A 7 5.867 -11.559 -4.292 1.00 1.07 H new ATOM 102 N GLU A 8 3.578 -13.430 -4.734 1.00 1.11 N ATOM 103 CA GLU A 8 2.258 -12.836 -4.602 1.00 1.09 C ATOM 104 C GLU A 8 2.387 -11.317 -4.519 1.00 0.92 C ATOM 105 O GLU A 8 1.698 -10.574 -5.213 1.00 0.92 O ATOM 106 CB GLU A 8 1.547 -13.394 -3.369 1.00 1.37 C ATOM 107 CG GLU A 8 0.114 -12.854 -3.316 1.00 2.04 C ATOM 108 CD GLU A 8 -0.592 -13.325 -2.054 1.00 2.59 C ATOM 109 OE1 GLU A 8 -0.470 -14.529 -1.750 1.00 2.52 O ATOM 110 OE2 GLU A 8 -1.207 -12.458 -1.387 1.00 3.70 O ATOM 0 H GLU A 8 3.827 -14.084 -3.992 1.00 1.11 H new ATOM 0 HA GLU A 8 1.659 -13.087 -5.477 1.00 1.09 H new ATOM 0 HB2 GLU A 8 1.535 -14.483 -3.405 1.00 1.37 H new ATOM 0 HB3 GLU A 8 2.087 -13.111 -2.466 1.00 1.37 H new ATOM 0 HG2 GLU A 8 0.129 -11.764 -3.345 1.00 2.04 H new ATOM 0 HG3 GLU A 8 -0.439 -13.188 -4.194 1.00 2.04 H new ATOM 117 N LEU A 9 3.291 -10.847 -3.661 1.00 0.82 N ATOM 118 CA LEU A 9 3.486 -9.424 -3.491 1.00 0.74 C ATOM 119 C LEU A 9 3.858 -8.775 -4.830 1.00 0.66 C ATOM 120 O LEU A 9 3.245 -7.775 -5.179 1.00 0.65 O ATOM 121 CB LEU A 9 4.452 -9.123 -2.338 1.00 0.74 C ATOM 122 CG LEU A 9 3.801 -9.436 -0.971 1.00 0.77 C ATOM 123 CD1 LEU A 9 4.156 -10.824 -0.430 1.00 1.15 C ATOM 124 CD2 LEU A 9 4.213 -8.379 0.059 1.00 1.64 C ATOM 0 H LEU A 9 3.892 -11.433 -3.081 1.00 0.82 H new ATOM 0 HA LEU A 9 2.548 -8.960 -3.187 1.00 0.74 H new ATOM 0 HB2 LEU A 9 5.360 -9.715 -2.456 1.00 0.74 H new ATOM 0 HB3 LEU A 9 4.748 -8.075 -2.372 1.00 0.74 H new ATOM 0 HG LEU A 9 2.724 -9.420 -1.136 1.00 0.77 H new ATOM 0 HD11 LEU A 9 3.665 -10.976 0.531 1.00 1.15 H new ATOM 0 HD12 LEU A 9 3.820 -11.586 -1.134 1.00 1.15 H new ATOM 0 HD13 LEU A 9 5.236 -10.899 -0.302 1.00 1.15 H new ATOM 0 HD21 LEU A 9 3.750 -8.607 1.019 1.00 1.64 H new ATOM 0 HD22 LEU A 9 5.297 -8.382 0.169 1.00 1.64 H new ATOM 0 HD23 LEU A 9 3.885 -7.396 -0.278 1.00 1.64 H new ATOM 136 N GLU A 10 4.784 -9.361 -5.602 1.00 0.65 N ATOM 137 CA GLU A 10 5.144 -8.901 -6.942 1.00 0.66 C ATOM 138 C GLU A 10 3.924 -8.879 -7.871 1.00 0.65 C ATOM 139 O GLU A 10 3.651 -7.858 -8.501 1.00 0.69 O ATOM 140 CB GLU A 10 6.247 -9.786 -7.546 1.00 0.73 C ATOM 141 CG GLU A 10 7.623 -9.530 -6.914 1.00 1.01 C ATOM 142 CD GLU A 10 8.672 -10.573 -7.298 1.00 1.17 C ATOM 143 OE1 GLU A 10 8.271 -11.741 -7.500 1.00 2.12 O ATOM 144 OE2 GLU A 10 9.859 -10.187 -7.362 1.00 1.75 O ATOM 0 H GLU A 10 5.311 -10.182 -5.303 1.00 0.65 H new ATOM 0 HA GLU A 10 5.521 -7.883 -6.847 1.00 0.66 H new ATOM 0 HB2 GLU A 10 5.980 -10.834 -7.413 1.00 0.73 H new ATOM 0 HB3 GLU A 10 6.305 -9.606 -8.619 1.00 0.73 H new ATOM 0 HG2 GLU A 10 7.975 -8.544 -7.216 1.00 1.01 H new ATOM 0 HG3 GLU A 10 7.519 -9.513 -5.829 1.00 1.01 H new ATOM 151 N GLU A 11 3.205 -10.000 -7.977 1.00 0.64 N ATOM 152 CA GLU A 11 2.076 -10.122 -8.891 1.00 0.63 C ATOM 153 C GLU A 11 1.062 -9.021 -8.573 1.00 0.67 C ATOM 154 O GLU A 11 0.648 -8.258 -9.446 1.00 0.73 O ATOM 155 CB GLU A 11 1.512 -11.565 -8.894 1.00 0.67 C ATOM 156 CG GLU A 11 0.286 -11.904 -8.032 1.00 2.16 C ATOM 157 CD GLU A 11 -1.010 -11.242 -8.497 1.00 3.69 C ATOM 158 OE1 GLU A 11 -1.242 -11.249 -9.725 1.00 3.93 O ATOM 159 OE2 GLU A 11 -1.732 -10.722 -7.619 1.00 5.19 O ATOM 0 H GLU A 11 3.391 -10.842 -7.433 1.00 0.64 H new ATOM 0 HA GLU A 11 2.389 -9.963 -9.923 1.00 0.63 H new ATOM 0 HB2 GLU A 11 1.265 -11.816 -9.925 1.00 0.67 H new ATOM 0 HB3 GLU A 11 2.319 -12.231 -8.589 1.00 0.67 H new ATOM 0 HG2 GLU A 11 0.147 -12.985 -8.027 1.00 2.16 H new ATOM 0 HG3 GLU A 11 0.485 -11.604 -7.003 1.00 2.16 H new ATOM 166 N SER A 12 0.719 -8.892 -7.291 1.00 0.68 N ATOM 167 CA SER A 12 -0.303 -7.967 -6.847 1.00 0.75 C ATOM 168 C SER A 12 0.158 -6.520 -7.015 1.00 0.70 C ATOM 169 O SER A 12 -0.605 -5.695 -7.522 1.00 0.75 O ATOM 170 CB SER A 12 -0.743 -8.295 -5.418 1.00 0.88 C ATOM 171 OG SER A 12 0.361 -8.259 -4.541 1.00 1.33 O ATOM 0 H SER A 12 1.147 -9.430 -6.537 1.00 0.68 H new ATOM 0 HA SER A 12 -1.183 -8.082 -7.479 1.00 0.75 H new ATOM 0 HB2 SER A 12 -1.498 -7.581 -5.091 1.00 0.88 H new ATOM 0 HB3 SER A 12 -1.205 -9.282 -5.391 1.00 0.88 H new ATOM 0 HG SER A 12 0.860 -9.100 -4.608 1.00 1.33 H new ATOM 177 N ILE A 13 1.400 -6.175 -6.643 1.00 0.65 N ATOM 178 CA ILE A 13 1.837 -4.815 -6.877 1.00 0.68 C ATOM 179 C ILE A 13 1.867 -4.533 -8.372 1.00 0.69 C ATOM 180 O ILE A 13 1.455 -3.452 -8.770 1.00 0.72 O ATOM 181 CB ILE A 13 3.097 -4.400 -6.113 1.00 0.73 C ATOM 182 CG1 ILE A 13 4.308 -5.305 -6.339 1.00 0.73 C ATOM 183 CG2 ILE A 13 2.759 -4.298 -4.618 1.00 0.75 C ATOM 184 CD1 ILE A 13 5.217 -4.767 -7.422 1.00 0.81 C ATOM 0 H ILE A 13 2.081 -6.793 -6.201 1.00 0.65 H new ATOM 0 HA ILE A 13 1.094 -4.151 -6.435 1.00 0.68 H new ATOM 0 HB ILE A 13 3.402 -3.432 -6.510 1.00 0.73 H new ATOM 0 HG12 ILE A 13 4.868 -5.402 -5.409 1.00 0.73 H new ATOM 0 HG13 ILE A 13 3.969 -6.304 -6.612 1.00 0.73 H new ATOM 0 HG21 ILE A 13 3.649 -4.003 -4.063 1.00 0.75 H new ATOM 0 HG22 ILE A 13 1.977 -3.553 -4.472 1.00 0.75 H new ATOM 0 HG23 ILE A 13 2.411 -5.266 -4.257 1.00 0.75 H new ATOM 0 HD11 ILE A 13 6.065 -5.439 -7.552 1.00 0.81 H new ATOM 0 HD12 ILE A 13 4.664 -4.695 -8.359 1.00 0.81 H new ATOM 0 HD13 ILE A 13 5.577 -3.779 -7.137 1.00 0.81 H new ATOM 196 N GLU A 14 2.252 -5.496 -9.215 1.00 0.67 N ATOM 197 CA GLU A 14 2.141 -5.291 -10.649 1.00 0.71 C ATOM 198 C GLU A 14 0.681 -5.014 -11.033 1.00 0.73 C ATOM 199 O GLU A 14 0.402 -4.023 -11.704 1.00 0.81 O ATOM 200 CB GLU A 14 2.744 -6.454 -11.443 1.00 0.75 C ATOM 201 CG GLU A 14 3.134 -5.944 -12.837 1.00 0.86 C ATOM 202 CD GLU A 14 3.490 -7.086 -13.776 1.00 1.98 C ATOM 203 OE1 GLU A 14 4.608 -7.620 -13.617 1.00 3.12 O ATOM 204 OE2 GLU A 14 2.637 -7.395 -14.636 1.00 3.22 O ATOM 0 H GLU A 14 2.632 -6.399 -8.933 1.00 0.67 H new ATOM 0 HA GLU A 14 2.728 -4.412 -10.916 1.00 0.71 H new ATOM 0 HB2 GLU A 14 3.618 -6.851 -10.927 1.00 0.75 H new ATOM 0 HB3 GLU A 14 2.025 -7.269 -11.526 1.00 0.75 H new ATOM 0 HG2 GLU A 14 2.308 -5.371 -13.259 1.00 0.86 H new ATOM 0 HG3 GLU A 14 3.983 -5.265 -12.752 1.00 0.86 H new ATOM 211 N THR A 15 -0.261 -5.853 -10.586 1.00 0.70 N ATOM 212 CA THR A 15 -1.669 -5.751 -10.970 1.00 0.75 C ATOM 213 C THR A 15 -2.271 -4.383 -10.592 1.00 0.78 C ATOM 214 O THR A 15 -3.032 -3.782 -11.357 1.00 0.87 O ATOM 215 CB THR A 15 -2.473 -6.983 -10.490 1.00 0.81 C ATOM 216 OG1 THR A 15 -3.376 -7.374 -11.504 1.00 1.29 O ATOM 217 CG2 THR A 15 -3.292 -6.792 -9.212 1.00 0.84 C ATOM 0 H THR A 15 -0.065 -6.623 -9.946 1.00 0.70 H new ATOM 0 HA THR A 15 -1.739 -5.780 -12.057 1.00 0.75 H new ATOM 0 HB THR A 15 -1.713 -7.731 -10.266 1.00 0.81 H new ATOM 0 HG1 THR A 15 -3.886 -8.155 -11.204 1.00 1.29 H new ATOM 0 HG21 THR A 15 -3.813 -7.719 -8.972 1.00 0.84 H new ATOM 0 HG22 THR A 15 -2.627 -6.526 -8.390 1.00 0.84 H new ATOM 0 HG23 THR A 15 -4.020 -5.995 -9.362 1.00 0.84 H new ATOM 225 N VAL A 16 -1.899 -3.832 -9.433 1.00 0.73 N ATOM 226 CA VAL A 16 -2.334 -2.484 -9.071 1.00 0.74 C ATOM 227 C VAL A 16 -1.505 -1.423 -9.805 1.00 0.74 C ATOM 228 O VAL A 16 -2.062 -0.411 -10.215 1.00 0.77 O ATOM 229 CB VAL A 16 -2.427 -2.245 -7.553 1.00 0.73 C ATOM 230 CG1 VAL A 16 -3.271 -3.332 -6.874 1.00 0.70 C ATOM 231 CG2 VAL A 16 -1.059 -2.149 -6.885 1.00 0.71 C ATOM 0 H VAL A 16 -1.307 -4.291 -8.741 1.00 0.73 H new ATOM 0 HA VAL A 16 -3.364 -2.385 -9.415 1.00 0.74 H new ATOM 0 HB VAL A 16 -2.918 -1.280 -7.426 1.00 0.73 H new ATOM 0 HG11 VAL A 16 -3.320 -3.138 -5.802 1.00 0.70 H new ATOM 0 HG12 VAL A 16 -4.278 -3.324 -7.291 1.00 0.70 H new ATOM 0 HG13 VAL A 16 -2.815 -4.307 -7.046 1.00 0.70 H new ATOM 0 HG21 VAL A 16 -1.187 -1.980 -5.816 1.00 0.71 H new ATOM 0 HG22 VAL A 16 -0.511 -3.078 -7.043 1.00 0.71 H new ATOM 0 HG23 VAL A 16 -0.500 -1.320 -7.319 1.00 0.71 H new ATOM 241 N VAL A 17 -0.199 -1.634 -10.009 1.00 0.73 N ATOM 242 CA VAL A 17 0.661 -0.709 -10.746 1.00 0.73 C ATOM 243 C VAL A 17 0.141 -0.515 -12.171 1.00 0.74 C ATOM 244 O VAL A 17 0.123 0.610 -12.660 1.00 0.71 O ATOM 245 CB VAL A 17 2.136 -1.155 -10.709 1.00 0.73 C ATOM 246 CG1 VAL A 17 3.000 -0.458 -11.773 1.00 0.78 C ATOM 247 CG2 VAL A 17 2.746 -0.819 -9.340 1.00 0.73 C ATOM 0 H VAL A 17 0.291 -2.459 -9.663 1.00 0.73 H new ATOM 0 HA VAL A 17 0.626 0.262 -10.253 1.00 0.73 H new ATOM 0 HB VAL A 17 2.134 -2.227 -10.905 1.00 0.73 H new ATOM 0 HG11 VAL A 17 4.028 -0.813 -11.697 1.00 0.78 H new ATOM 0 HG12 VAL A 17 2.610 -0.686 -12.765 1.00 0.78 H new ATOM 0 HG13 VAL A 17 2.976 0.620 -11.612 1.00 0.78 H new ATOM 0 HG21 VAL A 17 3.789 -1.136 -9.319 1.00 0.73 H new ATOM 0 HG22 VAL A 17 2.690 0.256 -9.171 1.00 0.73 H new ATOM 0 HG23 VAL A 17 2.193 -1.339 -8.558 1.00 0.73 H new ATOM 257 N THR A 18 -0.297 -1.575 -12.849 1.00 0.80 N ATOM 258 CA THR A 18 -0.870 -1.435 -14.181 1.00 0.84 C ATOM 259 C THR A 18 -2.179 -0.634 -14.121 1.00 0.83 C ATOM 260 O THR A 18 -2.396 0.240 -14.960 1.00 0.90 O ATOM 261 CB THR A 18 -0.979 -2.793 -14.898 1.00 0.89 C ATOM 262 OG1 THR A 18 -1.413 -2.617 -16.231 1.00 0.92 O ATOM 263 CG2 THR A 18 -1.896 -3.789 -14.191 1.00 0.89 C ATOM 0 H THR A 18 -0.265 -2.532 -12.499 1.00 0.80 H new ATOM 0 HA THR A 18 -0.193 -0.851 -14.804 1.00 0.84 H new ATOM 0 HB THR A 18 0.024 -3.218 -14.880 1.00 0.89 H new ATOM 0 HG1 THR A 18 -1.475 -3.490 -16.673 1.00 0.92 H new ATOM 0 HG21 THR A 18 -1.923 -4.722 -14.754 1.00 0.89 H new ATOM 0 HG22 THR A 18 -1.518 -3.982 -13.187 1.00 0.89 H new ATOM 0 HG23 THR A 18 -2.902 -3.375 -14.127 1.00 0.89 H new ATOM 271 N THR A 19 -3.040 -0.884 -13.126 1.00 0.78 N ATOM 272 CA THR A 19 -4.282 -0.142 -12.968 1.00 0.81 C ATOM 273 C THR A 19 -3.976 1.346 -12.726 1.00 0.81 C ATOM 274 O THR A 19 -4.512 2.224 -13.397 1.00 0.84 O ATOM 275 CB THR A 19 -5.121 -0.799 -11.858 1.00 0.83 C ATOM 276 OG1 THR A 19 -5.214 -2.191 -12.107 1.00 0.82 O ATOM 277 CG2 THR A 19 -6.552 -0.251 -11.831 1.00 0.92 C ATOM 0 H THR A 19 -2.891 -1.602 -12.417 1.00 0.78 H new ATOM 0 HA THR A 19 -4.881 -0.178 -13.878 1.00 0.81 H new ATOM 0 HB THR A 19 -4.631 -0.585 -10.908 1.00 0.83 H new ATOM 0 HG1 THR A 19 -4.430 -2.643 -11.732 1.00 0.82 H new ATOM 0 HG21 THR A 19 -7.113 -0.739 -11.034 1.00 0.92 H new ATOM 0 HG22 THR A 19 -6.527 0.824 -11.651 1.00 0.92 H new ATOM 0 HG23 THR A 19 -7.035 -0.448 -12.788 1.00 0.92 H new ATOM 285 N PHE A 20 -3.049 1.626 -11.807 1.00 0.79 N ATOM 286 CA PHE A 20 -2.465 2.944 -11.601 1.00 0.76 C ATOM 287 C PHE A 20 -2.023 3.532 -12.941 1.00 0.76 C ATOM 288 O PHE A 20 -2.466 4.611 -13.306 1.00 0.75 O ATOM 289 CB PHE A 20 -1.298 2.841 -10.604 1.00 0.80 C ATOM 290 CG PHE A 20 -0.255 3.944 -10.681 1.00 1.17 C ATOM 291 CD1 PHE A 20 -0.503 5.185 -10.075 1.00 2.27 C ATOM 292 CD2 PHE A 20 0.967 3.730 -11.350 1.00 2.49 C ATOM 293 CE1 PHE A 20 0.503 6.167 -10.038 1.00 2.87 C ATOM 294 CE2 PHE A 20 1.920 4.761 -11.425 1.00 3.19 C ATOM 295 CZ PHE A 20 1.694 5.978 -10.761 1.00 2.91 C ATOM 0 H PHE A 20 -2.677 0.920 -11.171 1.00 0.79 H new ATOM 0 HA PHE A 20 -3.208 3.619 -11.176 1.00 0.76 H new ATOM 0 HB2 PHE A 20 -1.709 2.827 -9.595 1.00 0.80 H new ATOM 0 HB3 PHE A 20 -0.798 1.885 -10.758 1.00 0.80 H new ATOM 0 HD1 PHE A 20 -1.469 5.387 -9.636 1.00 2.27 H new ATOM 0 HD2 PHE A 20 1.172 2.772 -11.806 1.00 2.49 H new ATOM 0 HE1 PHE A 20 0.361 7.065 -9.455 1.00 2.87 H new ATOM 0 HE2 PHE A 20 2.827 4.617 -11.994 1.00 3.19 H new ATOM 0 HZ PHE A 20 2.432 6.765 -10.806 1.00 2.91 H new ATOM 305 N PHE A 21 -1.162 2.831 -13.679 1.00 0.83 N ATOM 306 CA PHE A 21 -0.528 3.353 -14.878 1.00 0.88 C ATOM 307 C PHE A 21 -1.554 3.680 -15.965 1.00 0.91 C ATOM 308 O PHE A 21 -1.502 4.754 -16.572 1.00 0.95 O ATOM 309 CB PHE A 21 0.538 2.380 -15.387 1.00 0.96 C ATOM 310 CG PHE A 21 1.310 2.914 -16.578 1.00 1.54 C ATOM 311 CD1 PHE A 21 2.105 4.069 -16.437 1.00 2.04 C ATOM 312 CD2 PHE A 21 1.140 2.337 -17.851 1.00 3.16 C ATOM 313 CE1 PHE A 21 2.721 4.644 -17.562 1.00 2.84 C ATOM 314 CE2 PHE A 21 1.769 2.904 -18.972 1.00 3.95 C ATOM 315 CZ PHE A 21 2.556 4.060 -18.830 1.00 3.46 C ATOM 0 H PHE A 21 -0.886 1.875 -13.454 1.00 0.83 H new ATOM 0 HA PHE A 21 -0.036 4.290 -14.617 1.00 0.88 H new ATOM 0 HB2 PHE A 21 1.235 2.159 -14.579 1.00 0.96 H new ATOM 0 HB3 PHE A 21 0.061 1.439 -15.663 1.00 0.96 H new ATOM 0 HD1 PHE A 21 2.241 4.513 -15.462 1.00 2.04 H new ATOM 0 HD2 PHE A 21 0.525 1.457 -17.966 1.00 3.16 H new ATOM 0 HE1 PHE A 21 3.321 5.535 -17.452 1.00 2.84 H new ATOM 0 HE2 PHE A 21 1.648 2.451 -19.945 1.00 3.95 H new ATOM 0 HZ PHE A 21 3.033 4.499 -19.694 1.00 3.46 H new ATOM 325 N THR A 22 -2.507 2.773 -16.200 1.00 0.95 N ATOM 326 CA THR A 22 -3.530 2.994 -17.211 1.00 1.04 C ATOM 327 C THR A 22 -4.382 4.223 -16.864 1.00 1.01 C ATOM 328 O THR A 22 -4.891 4.883 -17.767 1.00 1.28 O ATOM 329 CB THR A 22 -4.325 1.708 -17.510 1.00 1.13 C ATOM 330 OG1 THR A 22 -4.787 1.739 -18.845 1.00 2.06 O ATOM 331 CG2 THR A 22 -5.524 1.475 -16.589 1.00 2.23 C ATOM 0 H THR A 22 -2.586 1.885 -15.704 1.00 0.95 H new ATOM 0 HA THR A 22 -3.050 3.236 -18.159 1.00 1.04 H new ATOM 0 HB THR A 22 -3.630 0.886 -17.336 1.00 1.13 H new ATOM 0 HG1 THR A 22 -5.291 0.921 -19.036 1.00 2.06 H new ATOM 0 HG21 THR A 22 -6.025 0.549 -16.871 1.00 2.23 H new ATOM 0 HG22 THR A 22 -5.181 1.403 -15.557 1.00 2.23 H new ATOM 0 HG23 THR A 22 -6.222 2.307 -16.682 1.00 2.23 H new ATOM 339 N PHE A 23 -4.486 4.583 -15.576 1.00 0.79 N ATOM 340 CA PHE A 23 -4.988 5.894 -15.176 1.00 0.76 C ATOM 341 C PHE A 23 -3.921 6.980 -15.286 1.00 0.70 C ATOM 342 O PHE A 23 -4.215 8.088 -15.697 1.00 0.83 O ATOM 343 CB PHE A 23 -5.571 5.861 -13.760 1.00 0.85 C ATOM 344 CG PHE A 23 -6.926 5.195 -13.669 1.00 0.90 C ATOM 345 CD1 PHE A 23 -8.016 5.744 -14.370 1.00 2.26 C ATOM 346 CD2 PHE A 23 -7.123 4.085 -12.827 1.00 2.00 C ATOM 347 CE1 PHE A 23 -9.303 5.216 -14.190 1.00 2.57 C ATOM 348 CE2 PHE A 23 -8.420 3.590 -12.616 1.00 2.42 C ATOM 349 CZ PHE A 23 -9.515 4.220 -13.228 1.00 2.05 C ATOM 0 H PHE A 23 -4.227 3.979 -14.796 1.00 0.79 H new ATOM 0 HA PHE A 23 -5.787 6.145 -15.874 1.00 0.76 H new ATOM 0 HB2 PHE A 23 -4.875 5.338 -13.104 1.00 0.85 H new ATOM 0 HB3 PHE A 23 -5.654 6.882 -13.388 1.00 0.85 H new ATOM 0 HD1 PHE A 23 -7.862 6.572 -15.046 1.00 2.26 H new ATOM 0 HD2 PHE A 23 -6.279 3.615 -12.344 1.00 2.00 H new ATOM 0 HE1 PHE A 23 -10.126 5.575 -14.790 1.00 2.57 H new ATOM 0 HE2 PHE A 23 -8.575 2.727 -11.985 1.00 2.42 H new ATOM 0 HZ PHE A 23 -10.521 3.937 -12.957 1.00 2.05 H new ATOM 359 N ALA A 24 -2.671 6.712 -14.929 1.00 0.67 N ATOM 360 CA ALA A 24 -1.604 7.700 -14.890 1.00 0.81 C ATOM 361 C ALA A 24 -1.489 8.413 -16.229 1.00 0.82 C ATOM 362 O ALA A 24 -1.226 9.624 -16.255 1.00 0.85 O ATOM 363 CB ALA A 24 -0.269 7.045 -14.522 1.00 1.02 C ATOM 0 H ALA A 24 -2.366 5.779 -14.652 1.00 0.67 H new ATOM 0 HA ALA A 24 -1.850 8.434 -14.123 1.00 0.81 H new ATOM 0 HB1 ALA A 24 0.514 7.803 -14.499 1.00 1.02 H new ATOM 0 HB2 ALA A 24 -0.351 6.578 -13.540 1.00 1.02 H new ATOM 0 HB3 ALA A 24 -0.019 6.287 -15.264 1.00 1.02 H new ATOM 369 N ARG A 25 -1.686 7.648 -17.311 1.00 0.84 N ATOM 370 CA ARG A 25 -1.623 8.110 -18.688 1.00 0.95 C ATOM 371 C ARG A 25 -2.732 9.088 -19.046 1.00 0.92 C ATOM 372 O ARG A 25 -2.606 9.737 -20.085 1.00 1.11 O ATOM 373 CB ARG A 25 -1.582 6.925 -19.673 1.00 1.08 C ATOM 374 CG ARG A 25 -2.935 6.221 -19.873 1.00 1.58 C ATOM 375 CD ARG A 25 -3.589 6.443 -21.252 1.00 1.96 C ATOM 376 NE ARG A 25 -3.871 7.865 -21.542 1.00 2.72 N ATOM 377 CZ ARG A 25 -4.909 8.367 -22.230 1.00 3.44 C ATOM 378 NH1 ARG A 25 -5.714 7.548 -22.915 1.00 3.46 N ATOM 379 NH2 ARG A 25 -5.140 9.687 -22.227 1.00 4.87 N ATOM 0 H ARG A 25 -1.901 6.654 -17.239 1.00 0.84 H new ATOM 0 HA ARG A 25 -0.690 8.665 -18.779 1.00 0.95 H new ATOM 0 HB2 ARG A 25 -1.226 7.283 -20.639 1.00 1.08 H new ATOM 0 HB3 ARG A 25 -0.855 6.195 -19.315 1.00 1.08 H new ATOM 0 HG2 ARG A 25 -2.796 5.150 -19.722 1.00 1.58 H new ATOM 0 HG3 ARG A 25 -3.624 6.565 -19.102 1.00 1.58 H new ATOM 0 HD2 ARG A 25 -2.933 6.044 -22.026 1.00 1.96 H new ATOM 0 HD3 ARG A 25 -4.520 5.878 -21.301 1.00 1.96 H new ATOM 0 HE ARG A 25 -3.201 8.542 -21.178 1.00 2.72 H new ATOM 0 HH11 ARG A 25 -5.539 6.543 -22.914 1.00 3.46 H new ATOM 0 HH12 ARG A 25 -6.503 7.928 -23.438 1.00 3.46 H new ATOM 0 HH21 ARG A 25 -4.527 10.311 -21.702 1.00 4.87 H new ATOM 0 HH22 ARG A 25 -5.929 10.068 -22.750 1.00 4.87 H new ATOM 393 N GLN A 26 -3.852 9.123 -18.313 1.00 0.79 N ATOM 394 CA GLN A 26 -5.034 9.856 -18.743 1.00 0.79 C ATOM 395 C GLN A 26 -4.689 11.286 -19.154 1.00 0.86 C ATOM 396 O GLN A 26 -4.798 11.630 -20.334 1.00 1.00 O ATOM 397 CB GLN A 26 -6.104 9.824 -17.642 1.00 0.73 C ATOM 398 CG GLN A 26 -7.426 9.224 -18.091 1.00 0.89 C ATOM 399 CD GLN A 26 -7.425 7.694 -18.051 1.00 1.05 C ATOM 400 OE1 GLN A 26 -8.391 7.075 -17.623 1.00 2.04 O ATOM 401 NE2 GLN A 26 -6.327 7.070 -18.466 1.00 2.52 N ATOM 0 H GLN A 26 -3.957 8.648 -17.417 1.00 0.79 H new ATOM 0 HA GLN A 26 -5.440 9.366 -19.628 1.00 0.79 H new ATOM 0 HB2 GLN A 26 -5.724 9.252 -16.796 1.00 0.73 H new ATOM 0 HB3 GLN A 26 -6.278 10.840 -17.287 1.00 0.73 H new ATOM 0 HG2 GLN A 26 -8.226 9.599 -17.453 1.00 0.89 H new ATOM 0 HG3 GLN A 26 -7.645 9.557 -19.106 1.00 0.89 H new ATOM 0 HE21 GLN A 26 -5.536 7.609 -18.818 1.00 2.52 H new ATOM 0 HE22 GLN A 26 -6.275 6.052 -18.432 1.00 2.52 H new ATOM 410 N GLU A 27 -4.259 12.067 -18.169 1.00 0.84 N ATOM 411 CA GLU A 27 -4.085 13.504 -18.205 1.00 0.92 C ATOM 412 C GLU A 27 -2.646 13.861 -17.845 1.00 0.89 C ATOM 413 O GLU A 27 -2.022 13.172 -17.027 1.00 1.28 O ATOM 414 CB GLU A 27 -4.970 14.122 -17.119 1.00 1.04 C ATOM 415 CG GLU A 27 -6.471 13.852 -17.275 1.00 1.17 C ATOM 416 CD GLU A 27 -7.154 13.961 -15.918 1.00 1.80 C ATOM 417 OE1 GLU A 27 -6.774 14.880 -15.159 1.00 2.11 O ATOM 418 OE2 GLU A 27 -7.998 13.089 -15.627 1.00 3.25 O ATOM 0 H GLU A 27 -4.006 11.678 -17.261 1.00 0.84 H new ATOM 0 HA GLU A 27 -4.337 13.868 -19.201 1.00 0.92 H new ATOM 0 HB2 GLU A 27 -4.647 13.743 -16.149 1.00 1.04 H new ATOM 0 HB3 GLU A 27 -4.809 15.200 -17.110 1.00 1.04 H new ATOM 0 HG2 GLU A 27 -6.909 14.567 -17.972 1.00 1.17 H new ATOM 0 HG3 GLU A 27 -6.630 12.859 -17.695 1.00 1.17 H new ATOM 425 N GLY A 28 -2.182 14.995 -18.376 1.00 1.19 N ATOM 426 CA GLY A 28 -1.121 15.800 -17.788 1.00 1.72 C ATOM 427 C GLY A 28 0.025 14.961 -17.237 1.00 1.55 C ATOM 428 O GLY A 28 0.251 14.967 -16.030 1.00 2.03 O ATOM 0 H GLY A 28 -2.545 15.383 -19.246 1.00 1.19 H new ATOM 0 HA2 GLY A 28 -0.733 16.486 -18.541 1.00 1.72 H new ATOM 0 HA3 GLY A 28 -1.537 16.409 -16.986 1.00 1.72 H new ATOM 432 N ARG A 29 0.709 14.214 -18.108 1.00 1.40 N ATOM 433 CA ARG A 29 1.883 13.434 -17.736 1.00 1.46 C ATOM 434 C ARG A 29 1.569 12.029 -17.174 1.00 1.31 C ATOM 435 O ARG A 29 0.816 11.850 -16.202 1.00 1.25 O ATOM 436 CB ARG A 29 3.018 14.216 -17.051 1.00 1.72 C ATOM 437 CG ARG A 29 3.950 14.951 -18.028 1.00 2.39 C ATOM 438 CD ARG A 29 3.326 16.199 -18.662 1.00 3.37 C ATOM 439 NE ARG A 29 4.294 16.855 -19.557 1.00 4.23 N ATOM 440 CZ ARG A 29 4.065 17.973 -20.264 1.00 5.24 C ATOM 441 NH1 ARG A 29 2.893 18.606 -20.144 1.00 5.73 N ATOM 442 NH2 ARG A 29 5.006 18.448 -21.089 1.00 6.20 N ATOM 0 H ARG A 29 0.460 14.136 -19.094 1.00 1.40 H new ATOM 0 HA ARG A 29 2.351 13.202 -18.693 1.00 1.46 H new ATOM 0 HB2 ARG A 29 2.582 14.942 -16.365 1.00 1.72 H new ATOM 0 HB3 ARG A 29 3.610 13.525 -16.450 1.00 1.72 H new ATOM 0 HG2 ARG A 29 4.859 15.240 -17.500 1.00 2.39 H new ATOM 0 HG3 ARG A 29 4.246 14.263 -18.820 1.00 2.39 H new ATOM 0 HD2 ARG A 29 2.432 15.923 -19.221 1.00 3.37 H new ATOM 0 HD3 ARG A 29 3.012 16.893 -17.882 1.00 3.37 H new ATOM 0 HE ARG A 29 5.214 16.424 -19.647 1.00 4.23 H new ATOM 0 HH11 ARG A 29 2.177 18.239 -19.517 1.00 5.73 H new ATOM 0 HH12 ARG A 29 2.715 19.456 -20.679 1.00 5.73 H new ATOM 0 HH21 ARG A 29 5.897 17.960 -21.181 1.00 6.20 H new ATOM 0 HH22 ARG A 29 4.832 19.297 -21.626 1.00 6.20 H new ATOM 456 N LYS A 30 1.953 11.022 -17.967 1.00 1.44 N ATOM 457 CA LYS A 30 1.774 9.586 -17.768 1.00 1.49 C ATOM 458 C LYS A 30 2.572 9.001 -16.594 1.00 1.49 C ATOM 459 O LYS A 30 3.248 7.984 -16.740 1.00 1.72 O ATOM 460 CB LYS A 30 2.074 8.865 -19.097 1.00 1.73 C ATOM 461 CG LYS A 30 3.512 9.079 -19.607 1.00 1.91 C ATOM 462 CD LYS A 30 3.754 8.249 -20.873 1.00 2.33 C ATOM 463 CE LYS A 30 5.189 8.465 -21.377 1.00 2.82 C ATOM 464 NZ LYS A 30 5.468 7.706 -22.615 1.00 3.84 N ATOM 0 H LYS A 30 2.441 11.213 -18.842 1.00 1.44 H new ATOM 0 HA LYS A 30 0.737 9.420 -17.478 1.00 1.49 H new ATOM 0 HB2 LYS A 30 1.899 7.797 -18.968 1.00 1.73 H new ATOM 0 HB3 LYS A 30 1.373 9.214 -19.856 1.00 1.73 H new ATOM 0 HG2 LYS A 30 3.677 10.135 -19.819 1.00 1.91 H new ATOM 0 HG3 LYS A 30 4.226 8.794 -18.834 1.00 1.91 H new ATOM 0 HD2 LYS A 30 3.589 7.192 -20.662 1.00 2.33 H new ATOM 0 HD3 LYS A 30 3.041 8.535 -21.647 1.00 2.33 H new ATOM 0 HE2 LYS A 30 5.352 9.527 -21.560 1.00 2.82 H new ATOM 0 HE3 LYS A 30 5.893 8.164 -20.602 1.00 2.82 H new ATOM 0 HZ1 LYS A 30 6.447 7.883 -22.917 1.00 3.84 H new ATOM 0 HZ2 LYS A 30 5.339 6.690 -22.436 1.00 3.84 H new ATOM 0 HZ3 LYS A 30 4.814 8.011 -23.364 1.00 3.84 H new ATOM 478 N ASP A 31 2.476 9.625 -15.420 1.00 1.42 N ATOM 479 CA ASP A 31 3.396 9.385 -14.313 1.00 1.54 C ATOM 480 C ASP A 31 2.844 10.068 -13.063 1.00 1.39 C ATOM 481 O ASP A 31 2.609 9.433 -12.039 1.00 1.61 O ATOM 482 CB ASP A 31 4.800 9.901 -14.688 1.00 1.90 C ATOM 483 CG ASP A 31 4.764 11.222 -15.443 1.00 3.34 C ATOM 484 OD1 ASP A 31 4.509 12.242 -14.768 1.00 4.28 O ATOM 485 OD2 ASP A 31 4.894 11.182 -16.686 1.00 4.36 O ATOM 0 H ASP A 31 1.754 10.314 -15.211 1.00 1.42 H new ATOM 0 HA ASP A 31 3.488 8.319 -14.106 1.00 1.54 H new ATOM 0 HB2 ASP A 31 5.391 10.023 -13.780 1.00 1.90 H new ATOM 0 HB3 ASP A 31 5.305 9.153 -15.299 1.00 1.90 H new ATOM 490 N SER A 32 2.579 11.361 -13.196 1.00 1.24 N ATOM 491 CA SER A 32 1.977 12.240 -12.217 1.00 1.26 C ATOM 492 C SER A 32 0.460 12.060 -12.300 1.00 1.04 C ATOM 493 O SER A 32 -0.126 12.022 -13.394 1.00 0.95 O ATOM 494 CB SER A 32 2.410 13.676 -12.558 1.00 1.48 C ATOM 495 OG SER A 32 2.554 13.815 -13.963 1.00 2.15 O ATOM 0 H SER A 32 2.799 11.855 -14.061 1.00 1.24 H new ATOM 0 HA SER A 32 2.292 12.017 -11.198 1.00 1.26 H new ATOM 0 HB2 SER A 32 1.671 14.386 -12.187 1.00 1.48 H new ATOM 0 HB3 SER A 32 3.352 13.909 -12.062 1.00 1.48 H new ATOM 0 HG SER A 32 3.456 13.537 -14.229 1.00 2.15 H new ATOM 501 N LEU A 33 -0.180 11.867 -11.146 1.00 1.03 N ATOM 502 CA LEU A 33 -1.604 11.592 -11.060 1.00 0.94 C ATOM 503 C LEU A 33 -2.359 12.886 -10.743 1.00 0.78 C ATOM 504 O LEU A 33 -2.001 13.610 -9.816 1.00 0.87 O ATOM 505 CB LEU A 33 -1.868 10.466 -10.049 1.00 1.27 C ATOM 506 CG LEU A 33 -1.844 9.059 -10.665 1.00 1.34 C ATOM 507 CD1 LEU A 33 -3.133 8.764 -11.430 1.00 1.53 C ATOM 508 CD2 LEU A 33 -0.609 8.827 -11.535 1.00 2.60 C ATOM 0 H LEU A 33 0.286 11.899 -10.239 1.00 1.03 H new ATOM 0 HA LEU A 33 -1.979 11.234 -12.019 1.00 0.94 H new ATOM 0 HB2 LEU A 33 -1.120 10.519 -9.258 1.00 1.27 H new ATOM 0 HB3 LEU A 33 -2.839 10.631 -9.581 1.00 1.27 H new ATOM 0 HG LEU A 33 -1.780 8.353 -9.837 1.00 1.34 H new ATOM 0 HD11 LEU A 33 -3.083 7.761 -11.853 1.00 1.53 H new ATOM 0 HD12 LEU A 33 -3.983 8.829 -10.750 1.00 1.53 H new ATOM 0 HD13 LEU A 33 -3.254 9.491 -12.233 1.00 1.53 H new ATOM 0 HD21 LEU A 33 -0.639 7.818 -11.947 1.00 2.60 H new ATOM 0 HD22 LEU A 33 -0.596 9.552 -12.349 1.00 2.60 H new ATOM 0 HD23 LEU A 33 0.290 8.945 -10.930 1.00 2.60 H new ATOM 520 N SER A 34 -3.396 13.163 -11.536 1.00 0.90 N ATOM 521 CA SER A 34 -4.287 14.304 -11.399 1.00 1.03 C ATOM 522 C SER A 34 -5.359 13.995 -10.354 1.00 1.07 C ATOM 523 O SER A 34 -5.632 12.833 -10.043 1.00 1.12 O ATOM 524 CB SER A 34 -4.941 14.574 -12.767 1.00 1.61 C ATOM 525 OG SER A 34 -6.080 15.413 -12.692 1.00 2.84 O ATOM 0 H SER A 34 -3.644 12.567 -12.326 1.00 0.90 H new ATOM 0 HA SER A 34 -3.731 15.184 -11.075 1.00 1.03 H new ATOM 0 HB2 SER A 34 -4.205 15.031 -13.429 1.00 1.61 H new ATOM 0 HB3 SER A 34 -5.228 13.624 -13.218 1.00 1.61 H new ATOM 0 HG SER A 34 -6.427 15.575 -13.594 1.00 2.84 H new ATOM 531 N VAL A 35 -6.009 15.046 -9.847 1.00 1.19 N ATOM 532 CA VAL A 35 -7.214 14.900 -9.048 1.00 1.26 C ATOM 533 C VAL A 35 -8.277 14.149 -9.843 1.00 1.13 C ATOM 534 O VAL A 35 -8.982 13.314 -9.279 1.00 1.02 O ATOM 535 CB VAL A 35 -7.727 16.263 -8.549 1.00 1.43 C ATOM 536 CG1 VAL A 35 -8.181 17.204 -9.672 1.00 1.68 C ATOM 537 CG2 VAL A 35 -8.892 16.071 -7.569 1.00 2.54 C ATOM 0 H VAL A 35 -5.712 16.013 -9.981 1.00 1.19 H new ATOM 0 HA VAL A 35 -6.975 14.314 -8.161 1.00 1.26 H new ATOM 0 HB VAL A 35 -6.875 16.731 -8.056 1.00 1.43 H new ATOM 0 HG11 VAL A 35 -8.529 18.143 -9.242 1.00 1.68 H new ATOM 0 HG12 VAL A 35 -7.345 17.400 -10.343 1.00 1.68 H new ATOM 0 HG13 VAL A 35 -8.993 16.739 -10.231 1.00 1.68 H new ATOM 0 HG21 VAL A 35 -9.243 17.044 -7.226 1.00 2.54 H new ATOM 0 HG22 VAL A 35 -9.706 15.548 -8.070 1.00 2.54 H new ATOM 0 HG23 VAL A 35 -8.555 15.485 -6.714 1.00 2.54 H new ATOM 547 N ASN A 36 -8.401 14.431 -11.147 1.00 1.19 N ATOM 548 CA ASN A 36 -9.429 13.764 -11.926 1.00 1.13 C ATOM 549 C ASN A 36 -9.055 12.296 -12.086 1.00 1.06 C ATOM 550 O ASN A 36 -9.798 11.461 -11.592 1.00 1.06 O ATOM 551 CB ASN A 36 -9.751 14.470 -13.237 1.00 1.20 C ATOM 552 CG ASN A 36 -10.879 13.699 -13.924 1.00 1.25 C ATOM 553 OD1 ASN A 36 -12.041 13.886 -13.577 1.00 1.84 O ATOM 554 ND2 ASN A 36 -10.547 12.797 -14.839 1.00 1.60 N ATOM 0 H ASN A 36 -7.821 15.093 -11.662 1.00 1.19 H new ATOM 0 HA ASN A 36 -10.372 13.816 -11.381 1.00 1.13 H new ATOM 0 HB2 ASN A 36 -10.052 15.501 -13.051 1.00 1.20 H new ATOM 0 HB3 ASN A 36 -8.869 14.506 -13.877 1.00 1.20 H new ATOM 0 HD21 ASN A 36 -11.270 12.229 -15.281 1.00 1.60 H new ATOM 0 HD22 ASN A 36 -9.569 12.672 -15.100 1.00 1.60 H new ATOM 561 N GLU A 37 -7.878 11.981 -12.644 1.00 1.08 N ATOM 562 CA GLU A 37 -7.319 10.625 -12.657 1.00 1.10 C ATOM 563 C GLU A 37 -7.572 9.884 -11.340 1.00 1.04 C ATOM 564 O GLU A 37 -8.025 8.741 -11.331 1.00 1.08 O ATOM 565 CB GLU A 37 -5.804 10.685 -12.894 1.00 1.24 C ATOM 566 CG GLU A 37 -5.485 10.840 -14.381 1.00 0.77 C ATOM 567 CD GLU A 37 -4.046 11.251 -14.699 1.00 0.76 C ATOM 568 OE1 GLU A 37 -3.303 11.826 -13.875 1.00 1.58 O ATOM 569 OE2 GLU A 37 -3.539 11.023 -15.812 1.00 1.77 O ATOM 0 H GLU A 37 -7.282 12.669 -13.104 1.00 1.08 H new ATOM 0 HA GLU A 37 -7.816 10.084 -13.462 1.00 1.10 H new ATOM 0 HB2 GLU A 37 -5.379 11.521 -12.339 1.00 1.24 H new ATOM 0 HB3 GLU A 37 -5.337 9.778 -12.511 1.00 1.24 H new ATOM 0 HG2 GLU A 37 -5.695 9.895 -14.882 1.00 0.77 H new ATOM 0 HG3 GLU A 37 -6.160 11.583 -14.806 1.00 0.77 H new ATOM 576 N PHE A 38 -7.259 10.529 -10.216 1.00 1.00 N ATOM 577 CA PHE A 38 -7.555 9.967 -8.913 1.00 0.97 C ATOM 578 C PHE A 38 -9.055 9.685 -8.772 1.00 0.92 C ATOM 579 O PHE A 38 -9.441 8.563 -8.442 1.00 0.91 O ATOM 580 CB PHE A 38 -7.015 10.884 -7.807 1.00 1.01 C ATOM 581 CG PHE A 38 -7.375 10.470 -6.392 1.00 1.00 C ATOM 582 CD1 PHE A 38 -7.515 9.110 -6.056 1.00 2.25 C ATOM 583 CD2 PHE A 38 -7.724 11.457 -5.452 1.00 2.04 C ATOM 584 CE1 PHE A 38 -8.148 8.746 -4.859 1.00 2.50 C ATOM 585 CE2 PHE A 38 -8.302 11.088 -4.227 1.00 2.69 C ATOM 586 CZ PHE A 38 -8.534 9.732 -3.938 1.00 2.32 C ATOM 0 H PHE A 38 -6.801 11.440 -10.189 1.00 1.00 H new ATOM 0 HA PHE A 38 -7.049 9.007 -8.810 1.00 0.97 H new ATOM 0 HB2 PHE A 38 -5.929 10.927 -7.891 1.00 1.01 H new ATOM 0 HB3 PHE A 38 -7.388 11.893 -7.979 1.00 1.01 H new ATOM 0 HD1 PHE A 38 -7.135 8.348 -6.720 1.00 2.25 H new ATOM 0 HD2 PHE A 38 -7.547 12.499 -5.673 1.00 2.04 H new ATOM 0 HE1 PHE A 38 -8.339 7.705 -4.645 1.00 2.50 H new ATOM 0 HE2 PHE A 38 -8.569 11.847 -3.506 1.00 2.69 H new ATOM 0 HZ PHE A 38 -9.008 9.450 -3.010 1.00 2.32 H new ATOM 596 N LYS A 39 -9.915 10.673 -9.043 1.00 0.93 N ATOM 597 CA LYS A 39 -11.348 10.471 -8.928 1.00 0.94 C ATOM 598 C LYS A 39 -11.819 9.309 -9.813 1.00 0.94 C ATOM 599 O LYS A 39 -12.666 8.524 -9.384 1.00 0.92 O ATOM 600 CB LYS A 39 -12.160 11.759 -9.129 1.00 0.99 C ATOM 601 CG LYS A 39 -13.597 11.518 -8.625 1.00 1.05 C ATOM 602 CD LYS A 39 -14.317 12.792 -8.148 1.00 1.27 C ATOM 603 CE LYS A 39 -15.529 12.367 -7.297 1.00 1.76 C ATOM 604 NZ LYS A 39 -16.247 13.485 -6.649 1.00 2.50 N ATOM 0 H LYS A 39 -9.639 11.609 -9.340 1.00 0.93 H new ATOM 0 HA LYS A 39 -11.547 10.182 -7.896 1.00 0.94 H new ATOM 0 HB2 LYS A 39 -11.701 12.584 -8.584 1.00 0.99 H new ATOM 0 HB3 LYS A 39 -12.170 12.039 -10.182 1.00 0.99 H new ATOM 0 HG2 LYS A 39 -14.180 11.062 -9.425 1.00 1.05 H new ATOM 0 HG3 LYS A 39 -13.567 10.801 -7.804 1.00 1.05 H new ATOM 0 HD2 LYS A 39 -13.641 13.415 -7.563 1.00 1.27 H new ATOM 0 HD3 LYS A 39 -14.641 13.388 -9.001 1.00 1.27 H new ATOM 0 HE2 LYS A 39 -16.228 11.822 -7.931 1.00 1.76 H new ATOM 0 HE3 LYS A 39 -15.191 11.674 -6.526 1.00 1.76 H new ATOM 0 HZ1 LYS A 39 -16.555 13.196 -5.699 1.00 2.50 H new ATOM 0 HZ2 LYS A 39 -15.614 14.306 -6.573 1.00 2.50 H new ATOM 0 HZ3 LYS A 39 -17.078 13.741 -7.219 1.00 2.50 H new ATOM 618 N GLU A 40 -11.253 9.158 -11.013 1.00 1.01 N ATOM 619 CA GLU A 40 -11.582 8.057 -11.906 1.00 1.02 C ATOM 620 C GLU A 40 -11.381 6.701 -11.219 1.00 0.97 C ATOM 621 O GLU A 40 -12.153 5.777 -11.456 1.00 1.00 O ATOM 622 CB GLU A 40 -10.784 8.114 -13.218 1.00 1.08 C ATOM 623 CG GLU A 40 -10.891 9.443 -13.988 1.00 1.25 C ATOM 624 CD GLU A 40 -12.198 9.679 -14.729 1.00 1.77 C ATOM 625 OE1 GLU A 40 -13.089 8.806 -14.642 1.00 2.96 O ATOM 626 OE2 GLU A 40 -12.267 10.753 -15.369 1.00 2.15 O ATOM 0 H GLU A 40 -10.554 9.799 -11.388 1.00 1.01 H new ATOM 0 HA GLU A 40 -12.637 8.166 -12.156 1.00 1.02 H new ATOM 0 HB2 GLU A 40 -9.734 7.924 -12.995 1.00 1.08 H new ATOM 0 HB3 GLU A 40 -11.123 7.307 -13.867 1.00 1.08 H new ATOM 0 HG2 GLU A 40 -10.742 10.261 -13.284 1.00 1.25 H new ATOM 0 HG3 GLU A 40 -10.074 9.490 -14.708 1.00 1.25 H new ATOM 633 N LEU A 41 -10.378 6.564 -10.343 1.00 0.94 N ATOM 634 CA LEU A 41 -10.091 5.297 -9.675 1.00 0.93 C ATOM 635 C LEU A 41 -11.272 4.953 -8.773 1.00 0.86 C ATOM 636 O LEU A 41 -11.864 3.874 -8.872 1.00 0.84 O ATOM 637 CB LEU A 41 -8.764 5.431 -8.902 1.00 0.95 C ATOM 638 CG LEU A 41 -8.185 4.175 -8.223 1.00 1.06 C ATOM 639 CD1 LEU A 41 -9.025 3.655 -7.052 1.00 2.58 C ATOM 640 CD2 LEU A 41 -7.891 3.046 -9.210 1.00 1.69 C ATOM 0 H LEU A 41 -9.750 7.324 -10.082 1.00 0.94 H new ATOM 0 HA LEU A 41 -9.968 4.481 -10.387 1.00 0.93 H new ATOM 0 HB2 LEU A 41 -8.013 5.811 -9.594 1.00 0.95 H new ATOM 0 HB3 LEU A 41 -8.902 6.191 -8.133 1.00 0.95 H new ATOM 0 HG LEU A 41 -7.237 4.516 -7.806 1.00 1.06 H new ATOM 0 HD11 LEU A 41 -8.550 2.770 -6.628 1.00 2.58 H new ATOM 0 HD12 LEU A 41 -9.100 4.428 -6.287 1.00 2.58 H new ATOM 0 HD13 LEU A 41 -10.023 3.397 -7.406 1.00 2.58 H new ATOM 0 HD21 LEU A 41 -7.485 2.189 -8.672 1.00 1.69 H new ATOM 0 HD22 LEU A 41 -8.812 2.755 -9.715 1.00 1.69 H new ATOM 0 HD23 LEU A 41 -7.165 3.388 -9.948 1.00 1.69 H new ATOM 652 N VAL A 42 -11.624 5.905 -7.905 1.00 0.86 N ATOM 653 CA VAL A 42 -12.632 5.702 -6.878 1.00 0.85 C ATOM 654 C VAL A 42 -14.000 5.516 -7.529 1.00 0.88 C ATOM 655 O VAL A 42 -14.778 4.652 -7.131 1.00 0.98 O ATOM 656 CB VAL A 42 -12.600 6.820 -5.819 1.00 0.86 C ATOM 657 CG1 VAL A 42 -11.363 6.689 -4.920 1.00 0.93 C ATOM 658 CG2 VAL A 42 -12.631 8.233 -6.383 1.00 0.91 C ATOM 0 H VAL A 42 -11.213 6.839 -7.900 1.00 0.86 H new ATOM 0 HA VAL A 42 -12.408 4.787 -6.330 1.00 0.85 H new ATOM 0 HB VAL A 42 -13.520 6.679 -5.251 1.00 0.86 H new ATOM 0 HG11 VAL A 42 -11.364 7.490 -4.181 1.00 0.93 H new ATOM 0 HG12 VAL A 42 -11.384 5.725 -4.411 1.00 0.93 H new ATOM 0 HG13 VAL A 42 -10.462 6.758 -5.529 1.00 0.93 H new ATOM 0 HG21 VAL A 42 -12.605 8.952 -5.564 1.00 0.91 H new ATOM 0 HG22 VAL A 42 -11.766 8.386 -7.028 1.00 0.91 H new ATOM 0 HG23 VAL A 42 -13.544 8.374 -6.961 1.00 0.91 H new ATOM 668 N THR A 43 -14.260 6.317 -8.560 1.00 0.89 N ATOM 669 CA THR A 43 -15.462 6.246 -9.366 1.00 0.99 C ATOM 670 C THR A 43 -15.572 4.879 -10.047 1.00 1.00 C ATOM 671 O THR A 43 -16.605 4.221 -9.945 1.00 1.09 O ATOM 672 CB THR A 43 -15.410 7.398 -10.375 1.00 1.12 C ATOM 673 OG1 THR A 43 -15.369 8.620 -9.667 1.00 1.15 O ATOM 674 CG2 THR A 43 -16.618 7.422 -11.316 1.00 1.32 C ATOM 0 H THR A 43 -13.619 7.051 -8.860 1.00 0.89 H new ATOM 0 HA THR A 43 -16.355 6.350 -8.749 1.00 0.99 H new ATOM 0 HB THR A 43 -14.519 7.254 -10.987 1.00 1.12 H new ATOM 0 HG1 THR A 43 -14.442 8.829 -9.429 1.00 1.15 H new ATOM 0 HG21 THR A 43 -16.524 8.260 -12.007 1.00 1.32 H new ATOM 0 HG22 THR A 43 -16.659 6.490 -11.879 1.00 1.32 H new ATOM 0 HG23 THR A 43 -17.532 7.534 -10.732 1.00 1.32 H new ATOM 682 N GLN A 44 -14.531 4.465 -10.774 1.00 0.96 N ATOM 683 CA GLN A 44 -14.601 3.294 -11.629 1.00 1.01 C ATOM 684 C GLN A 44 -14.658 2.005 -10.803 1.00 0.97 C ATOM 685 O GLN A 44 -15.496 1.150 -11.083 1.00 1.01 O ATOM 686 CB GLN A 44 -13.439 3.325 -12.630 1.00 1.16 C ATOM 687 CG GLN A 44 -13.583 2.241 -13.707 1.00 1.37 C ATOM 688 CD GLN A 44 -12.480 2.387 -14.746 1.00 1.55 C ATOM 689 OE1 GLN A 44 -12.709 2.872 -15.848 1.00 2.13 O ATOM 690 NE2 GLN A 44 -11.260 2.005 -14.386 1.00 2.37 N ATOM 0 H GLN A 44 -13.625 4.934 -10.782 1.00 0.96 H new ATOM 0 HA GLN A 44 -15.528 3.311 -12.203 1.00 1.01 H new ATOM 0 HB2 GLN A 44 -13.395 4.305 -13.105 1.00 1.16 H new ATOM 0 HB3 GLN A 44 -12.498 3.186 -12.098 1.00 1.16 H new ATOM 0 HG2 GLN A 44 -13.533 1.253 -13.249 1.00 1.37 H new ATOM 0 HG3 GLN A 44 -14.558 2.321 -14.187 1.00 1.37 H new ATOM 0 HE21 GLN A 44 -11.103 1.605 -13.461 1.00 2.37 H new ATOM 0 HE22 GLN A 44 -10.480 2.112 -15.035 1.00 2.37 H new ATOM 699 N GLN A 45 -13.780 1.843 -9.804 1.00 1.03 N ATOM 700 CA GLN A 45 -13.800 0.664 -8.940 1.00 1.26 C ATOM 701 C GLN A 45 -13.194 0.964 -7.569 1.00 1.22 C ATOM 702 O GLN A 45 -12.029 0.646 -7.338 1.00 2.49 O ATOM 703 CB GLN A 45 -13.049 -0.522 -9.576 1.00 2.03 C ATOM 704 CG GLN A 45 -13.854 -1.323 -10.605 1.00 2.85 C ATOM 705 CD GLN A 45 -13.297 -2.740 -10.705 1.00 3.67 C ATOM 706 OE1 GLN A 45 -13.617 -3.580 -9.865 1.00 4.97 O ATOM 707 NE2 GLN A 45 -12.444 -2.996 -11.693 1.00 3.54 N ATOM 0 H GLN A 45 -13.048 2.516 -9.577 1.00 1.03 H new ATOM 0 HA GLN A 45 -14.848 0.392 -8.815 1.00 1.26 H new ATOM 0 HB2 GLN A 45 -12.147 -0.145 -10.057 1.00 2.03 H new ATOM 0 HB3 GLN A 45 -12.729 -1.197 -8.782 1.00 2.03 H new ATOM 0 HG2 GLN A 45 -14.904 -1.355 -10.315 1.00 2.85 H new ATOM 0 HG3 GLN A 45 -13.807 -0.834 -11.578 1.00 2.85 H new ATOM 0 HE21 GLN A 45 -12.209 -2.266 -12.366 1.00 3.54 H new ATOM 0 HE22 GLN A 45 -12.025 -3.922 -11.778 1.00 3.54 H new ATOM 716 N LEU A 46 -13.993 1.480 -6.629 1.00 0.97 N ATOM 717 CA LEU A 46 -13.637 1.429 -5.215 1.00 0.96 C ATOM 718 C LEU A 46 -14.881 1.557 -4.311 1.00 1.39 C ATOM 719 O LEU A 46 -14.982 2.489 -3.513 1.00 1.85 O ATOM 720 CB LEU A 46 -12.559 2.489 -4.948 1.00 0.96 C ATOM 721 CG LEU A 46 -11.505 1.990 -3.963 1.00 1.13 C ATOM 722 CD1 LEU A 46 -10.551 0.983 -4.622 1.00 1.54 C ATOM 723 CD2 LEU A 46 -10.721 3.198 -3.461 1.00 1.73 C ATOM 0 H LEU A 46 -14.885 1.935 -6.824 1.00 0.97 H new ATOM 0 HA LEU A 46 -13.218 0.455 -4.963 1.00 0.96 H new ATOM 0 HB2 LEU A 46 -12.078 2.763 -5.887 1.00 0.96 H new ATOM 0 HB3 LEU A 46 -13.026 3.391 -4.554 1.00 0.96 H new ATOM 0 HG LEU A 46 -11.998 1.477 -3.137 1.00 1.13 H new ATOM 0 HD11 LEU A 46 -9.814 0.649 -3.892 1.00 1.54 H new ATOM 0 HD12 LEU A 46 -11.119 0.126 -4.982 1.00 1.54 H new ATOM 0 HD13 LEU A 46 -10.042 1.459 -5.460 1.00 1.54 H new ATOM 0 HD21 LEU A 46 -9.959 2.869 -2.754 1.00 1.73 H new ATOM 0 HD22 LEU A 46 -10.243 3.697 -4.304 1.00 1.73 H new ATOM 0 HD23 LEU A 46 -11.400 3.892 -2.966 1.00 1.73 H new ATOM 735 N PRO A 47 -15.855 0.640 -4.446 1.00 1.37 N ATOM 736 CA PRO A 47 -17.187 0.779 -3.886 1.00 1.71 C ATOM 737 C PRO A 47 -17.219 0.774 -2.357 1.00 1.91 C ATOM 738 O PRO A 47 -17.801 1.688 -1.773 1.00 2.33 O ATOM 739 CB PRO A 47 -18.012 -0.373 -4.473 1.00 1.77 C ATOM 740 CG PRO A 47 -16.965 -1.431 -4.809 1.00 1.48 C ATOM 741 CD PRO A 47 -15.766 -0.581 -5.222 1.00 1.20 C ATOM 0 HA PRO A 47 -17.598 1.753 -4.151 1.00 1.71 H new ATOM 0 HB2 PRO A 47 -18.744 -0.747 -3.757 1.00 1.77 H new ATOM 0 HB3 PRO A 47 -18.564 -0.060 -5.359 1.00 1.77 H new ATOM 0 HG2 PRO A 47 -16.738 -2.065 -3.952 1.00 1.48 H new ATOM 0 HG3 PRO A 47 -17.294 -2.088 -5.614 1.00 1.48 H new ATOM 0 HD2 PRO A 47 -14.830 -1.103 -5.022 1.00 1.20 H new ATOM 0 HD3 PRO A 47 -15.789 -0.367 -6.290 1.00 1.20 H new ATOM 749 N HIS A 48 -16.661 -0.247 -1.693 1.00 1.84 N ATOM 750 CA HIS A 48 -16.851 -0.423 -0.253 1.00 2.05 C ATOM 751 C HIS A 48 -15.564 -0.082 0.490 1.00 1.98 C ATOM 752 O HIS A 48 -15.188 -0.737 1.462 1.00 2.83 O ATOM 753 CB HIS A 48 -17.413 -1.817 0.073 1.00 2.26 C ATOM 754 CG HIS A 48 -18.274 -1.780 1.314 1.00 2.69 C ATOM 755 ND1 HIS A 48 -19.600 -1.414 1.344 1.00 2.86 N ATOM 756 CD2 HIS A 48 -17.827 -1.787 2.609 1.00 3.87 C ATOM 757 CE1 HIS A 48 -19.941 -1.209 2.628 1.00 3.44 C ATOM 758 NE2 HIS A 48 -18.884 -1.393 3.439 1.00 3.95 N ATOM 0 H HIS A 48 -16.077 -0.959 -2.131 1.00 1.84 H new ATOM 0 HA HIS A 48 -17.608 0.277 0.101 1.00 2.05 H new ATOM 0 HB2 HIS A 48 -18.000 -2.182 -0.770 1.00 2.26 H new ATOM 0 HB3 HIS A 48 -16.592 -2.519 0.217 1.00 2.26 H new ATOM 0 HD2 HIS A 48 -16.831 -2.051 2.934 1.00 3.87 H new ATOM 0 HE1 HIS A 48 -20.930 -0.934 2.963 1.00 3.44 H new ATOM 0 HE2 HIS A 48 -18.858 -1.271 4.451 1.00 3.95 H new ATOM 766 N LEU A 49 -14.921 0.992 0.037 1.00 1.58 N ATOM 767 CA LEU A 49 -13.665 1.494 0.556 1.00 1.61 C ATOM 768 C LEU A 49 -13.889 2.968 0.902 1.00 1.48 C ATOM 769 O LEU A 49 -14.476 3.281 1.937 1.00 1.61 O ATOM 770 CB LEU A 49 -12.565 1.212 -0.487 1.00 1.47 C ATOM 771 CG LEU A 49 -11.467 0.270 0.011 1.00 1.09 C ATOM 772 CD1 LEU A 49 -12.004 -1.115 0.390 1.00 0.92 C ATOM 773 CD2 LEU A 49 -10.454 0.089 -1.118 1.00 1.10 C ATOM 0 H LEU A 49 -15.282 1.555 -0.734 1.00 1.58 H new ATOM 0 HA LEU A 49 -13.326 1.004 1.469 1.00 1.61 H new ATOM 0 HB2 LEU A 49 -13.024 0.782 -1.377 1.00 1.47 H new ATOM 0 HB3 LEU A 49 -12.111 2.157 -0.787 1.00 1.47 H new ATOM 0 HG LEU A 49 -11.025 0.713 0.903 1.00 1.09 H new ATOM 0 HD11 LEU A 49 -11.182 -1.742 0.736 1.00 0.92 H new ATOM 0 HD12 LEU A 49 -12.743 -1.014 1.185 1.00 0.92 H new ATOM 0 HD13 LEU A 49 -12.469 -1.576 -0.481 1.00 0.92 H new ATOM 0 HD21 LEU A 49 -9.658 -0.580 -0.789 1.00 1.10 H new ATOM 0 HD22 LEU A 49 -10.952 -0.339 -1.988 1.00 1.10 H new ATOM 0 HD23 LEU A 49 -10.028 1.057 -1.383 1.00 1.10 H new ATOM 785 N LEU A 50 -13.490 3.893 0.030 1.00 1.41 N ATOM 786 CA LEU A 50 -13.421 5.307 0.350 1.00 1.53 C ATOM 787 C LEU A 50 -14.753 5.966 0.016 1.00 1.70 C ATOM 788 O LEU A 50 -14.816 6.922 -0.753 1.00 2.60 O ATOM 789 CB LEU A 50 -12.235 5.920 -0.404 1.00 1.45 C ATOM 790 CG LEU A 50 -10.900 5.272 0.012 1.00 1.28 C ATOM 791 CD1 LEU A 50 -9.794 5.806 -0.898 1.00 1.39 C ATOM 792 CD2 LEU A 50 -10.550 5.601 1.467 1.00 1.41 C ATOM 0 H LEU A 50 -13.205 3.674 -0.924 1.00 1.41 H new ATOM 0 HA LEU A 50 -13.251 5.469 1.414 1.00 1.53 H new ATOM 0 HB2 LEU A 50 -12.382 5.795 -1.477 1.00 1.45 H new ATOM 0 HB3 LEU A 50 -12.195 6.992 -0.211 1.00 1.45 H new ATOM 0 HG LEU A 50 -10.994 4.190 -0.081 1.00 1.28 H new ATOM 0 HD11 LEU A 50 -8.842 5.356 -0.616 1.00 1.39 H new ATOM 0 HD12 LEU A 50 -10.022 5.554 -1.934 1.00 1.39 H new ATOM 0 HD13 LEU A 50 -9.729 6.889 -0.794 1.00 1.39 H new ATOM 0 HD21 LEU A 50 -9.603 5.129 1.729 1.00 1.41 H new ATOM 0 HD22 LEU A 50 -10.462 6.681 1.585 1.00 1.41 H new ATOM 0 HD23 LEU A 50 -11.336 5.227 2.124 1.00 1.41 H new ATOM 804 N LYS A 51 -15.825 5.431 0.602 1.00 1.38 N ATOM 805 CA LYS A 51 -17.171 5.933 0.383 1.00 1.41 C ATOM 806 C LYS A 51 -17.290 7.396 0.831 1.00 1.52 C ATOM 807 O LYS A 51 -16.508 7.855 1.669 1.00 2.45 O ATOM 808 CB LYS A 51 -18.216 4.988 1.009 1.00 1.46 C ATOM 809 CG LYS A 51 -18.123 4.788 2.534 1.00 2.02 C ATOM 810 CD LYS A 51 -18.831 5.864 3.371 1.00 2.97 C ATOM 811 CE LYS A 51 -20.367 5.792 3.320 1.00 3.76 C ATOM 812 NZ LYS A 51 -20.985 7.009 3.891 1.00 4.92 N ATOM 0 H LYS A 51 -15.778 4.637 1.241 1.00 1.38 H new ATOM 0 HA LYS A 51 -17.386 5.939 -0.686 1.00 1.41 H new ATOM 0 HB2 LYS A 51 -19.209 5.371 0.773 1.00 1.46 H new ATOM 0 HB3 LYS A 51 -18.128 4.013 0.529 1.00 1.46 H new ATOM 0 HG2 LYS A 51 -18.547 3.816 2.785 1.00 2.02 H new ATOM 0 HG3 LYS A 51 -17.071 4.760 2.819 1.00 2.02 H new ATOM 0 HD2 LYS A 51 -18.508 5.773 4.408 1.00 2.97 H new ATOM 0 HD3 LYS A 51 -18.513 6.847 3.023 1.00 2.97 H new ATOM 0 HE2 LYS A 51 -20.693 5.667 2.287 1.00 3.76 H new ATOM 0 HE3 LYS A 51 -20.710 4.916 3.870 1.00 3.76 H new ATOM 0 HZ1 LYS A 51 -21.954 6.793 4.202 1.00 4.92 H new ATOM 0 HZ2 LYS A 51 -20.424 7.334 4.704 1.00 4.92 H new ATOM 0 HZ3 LYS A 51 -21.012 7.756 3.168 1.00 4.92 H new ATOM 826 N ASP A 52 -18.288 8.093 0.273 1.00 1.50 N ATOM 827 CA ASP A 52 -18.531 9.538 0.343 1.00 1.72 C ATOM 828 C ASP A 52 -17.711 10.264 -0.726 1.00 1.67 C ATOM 829 O ASP A 52 -17.202 11.359 -0.500 1.00 2.03 O ATOM 830 CB ASP A 52 -18.354 10.143 1.749 1.00 2.16 C ATOM 831 CG ASP A 52 -19.191 9.448 2.808 1.00 3.28 C ATOM 832 OD1 ASP A 52 -20.378 9.172 2.532 1.00 4.56 O ATOM 833 OD2 ASP A 52 -18.630 9.106 3.874 1.00 3.99 O ATOM 0 H ASP A 52 -19.002 7.623 -0.283 1.00 1.50 H new ATOM 0 HA ASP A 52 -19.589 9.691 0.128 1.00 1.72 H new ATOM 0 HB2 ASP A 52 -17.303 10.088 2.032 1.00 2.16 H new ATOM 0 HB3 ASP A 52 -18.621 11.199 1.719 1.00 2.16 H new ATOM 838 N VAL A 53 -17.649 9.699 -1.937 1.00 1.43 N ATOM 839 CA VAL A 53 -16.869 10.227 -3.056 1.00 1.39 C ATOM 840 C VAL A 53 -17.469 11.503 -3.677 1.00 1.36 C ATOM 841 O VAL A 53 -17.214 11.808 -4.844 1.00 1.58 O ATOM 842 CB VAL A 53 -16.651 9.128 -4.117 1.00 1.35 C ATOM 843 CG1 VAL A 53 -15.893 7.932 -3.531 1.00 2.23 C ATOM 844 CG2 VAL A 53 -17.965 8.637 -4.743 1.00 1.71 C ATOM 0 H VAL A 53 -18.152 8.843 -2.169 1.00 1.43 H new ATOM 0 HA VAL A 53 -15.903 10.530 -2.653 1.00 1.39 H new ATOM 0 HB VAL A 53 -16.054 9.589 -4.904 1.00 1.35 H new ATOM 0 HG11 VAL A 53 -15.755 7.175 -4.303 1.00 2.23 H new ATOM 0 HG12 VAL A 53 -14.920 8.261 -3.167 1.00 2.23 H new ATOM 0 HG13 VAL A 53 -16.464 7.508 -2.705 1.00 2.23 H new ATOM 0 HG21 VAL A 53 -17.750 7.865 -5.482 1.00 1.71 H new ATOM 0 HG22 VAL A 53 -18.607 8.225 -3.965 1.00 1.71 H new ATOM 0 HG23 VAL A 53 -18.471 9.472 -5.228 1.00 1.71 H new ATOM 854 N GLY A 54 -18.231 12.291 -2.918 1.00 1.43 N ATOM 855 CA GLY A 54 -18.589 13.635 -3.332 1.00 1.48 C ATOM 856 C GLY A 54 -17.331 14.473 -3.157 1.00 1.41 C ATOM 857 O GLY A 54 -16.598 14.717 -4.124 1.00 1.50 O ATOM 0 H GLY A 54 -18.610 12.015 -2.012 1.00 1.43 H new ATOM 0 HA2 GLY A 54 -18.926 13.648 -4.368 1.00 1.48 H new ATOM 0 HA3 GLY A 54 -19.406 14.026 -2.726 1.00 1.48 H new ATOM 861 N SER A 55 -17.055 14.814 -1.897 1.00 1.65 N ATOM 862 CA SER A 55 -15.898 15.552 -1.418 1.00 1.62 C ATOM 863 C SER A 55 -14.614 14.721 -1.490 1.00 1.30 C ATOM 864 O SER A 55 -13.891 14.565 -0.509 1.00 1.36 O ATOM 865 CB SER A 55 -16.192 15.968 0.027 1.00 1.94 C ATOM 866 OG SER A 55 -17.479 16.557 0.087 1.00 2.84 O ATOM 0 H SER A 55 -17.683 14.561 -1.134 1.00 1.65 H new ATOM 0 HA SER A 55 -15.731 16.423 -2.052 1.00 1.62 H new ATOM 0 HB2 SER A 55 -16.144 15.100 0.685 1.00 1.94 H new ATOM 0 HB3 SER A 55 -15.439 16.674 0.376 1.00 1.94 H new ATOM 0 HG SER A 55 -17.674 16.824 1.010 1.00 2.84 H new ATOM 872 N LEU A 56 -14.307 14.194 -2.675 1.00 1.13 N ATOM 873 CA LEU A 56 -13.097 13.457 -2.975 1.00 0.96 C ATOM 874 C LEU A 56 -11.868 14.321 -2.659 1.00 0.88 C ATOM 875 O LEU A 56 -10.822 13.808 -2.260 1.00 0.87 O ATOM 876 CB LEU A 56 -13.237 13.033 -4.445 1.00 0.98 C ATOM 877 CG LEU A 56 -12.137 12.151 -5.041 1.00 0.98 C ATOM 878 CD1 LEU A 56 -10.972 12.992 -5.567 1.00 1.00 C ATOM 879 CD2 LEU A 56 -11.685 11.066 -4.067 1.00 1.15 C ATOM 0 H LEU A 56 -14.926 14.277 -3.481 1.00 1.13 H new ATOM 0 HA LEU A 56 -12.956 12.565 -2.365 1.00 0.96 H new ATOM 0 HB2 LEU A 56 -14.185 12.505 -4.553 1.00 0.98 H new ATOM 0 HB3 LEU A 56 -13.305 13.937 -5.049 1.00 0.98 H new ATOM 0 HG LEU A 56 -12.562 11.630 -5.899 1.00 0.98 H new ATOM 0 HD11 LEU A 56 -10.208 12.335 -5.983 1.00 1.00 H new ATOM 0 HD12 LEU A 56 -11.332 13.668 -6.343 1.00 1.00 H new ATOM 0 HD13 LEU A 56 -10.545 13.573 -4.750 1.00 1.00 H new ATOM 0 HD21 LEU A 56 -10.904 10.463 -4.530 1.00 1.15 H new ATOM 0 HD22 LEU A 56 -11.296 11.530 -3.161 1.00 1.15 H new ATOM 0 HD23 LEU A 56 -12.532 10.429 -3.813 1.00 1.15 H new ATOM 891 N ASP A 57 -12.027 15.646 -2.760 1.00 1.00 N ATOM 892 CA ASP A 57 -11.066 16.640 -2.312 1.00 1.16 C ATOM 893 C ASP A 57 -10.531 16.349 -0.902 1.00 1.18 C ATOM 894 O ASP A 57 -9.375 16.680 -0.611 1.00 1.28 O ATOM 895 CB ASP A 57 -11.700 18.034 -2.369 1.00 1.48 C ATOM 896 CG ASP A 57 -12.609 18.260 -1.177 1.00 2.82 C ATOM 897 OD1 ASP A 57 -13.731 17.714 -1.217 1.00 3.43 O ATOM 898 OD2 ASP A 57 -12.113 18.893 -0.218 1.00 4.21 O ATOM 0 H ASP A 57 -12.862 16.062 -3.172 1.00 1.00 H new ATOM 0 HA ASP A 57 -10.211 16.597 -2.986 1.00 1.16 H new ATOM 0 HB2 ASP A 57 -10.919 18.794 -2.386 1.00 1.48 H new ATOM 0 HB3 ASP A 57 -12.269 18.142 -3.292 1.00 1.48 H new ATOM 903 N GLU A 58 -11.353 15.773 -0.012 1.00 1.23 N ATOM 904 CA GLU A 58 -10.928 15.310 1.304 1.00 1.43 C ATOM 905 C GLU A 58 -9.686 14.441 1.121 1.00 1.20 C ATOM 906 O GLU A 58 -8.602 14.730 1.634 1.00 1.21 O ATOM 907 CB GLU A 58 -12.058 14.485 1.959 1.00 1.82 C ATOM 908 CG GLU A 58 -11.672 13.924 3.342 1.00 2.00 C ATOM 909 CD GLU A 58 -12.489 12.699 3.757 1.00 2.78 C ATOM 910 OE1 GLU A 58 -13.644 12.562 3.307 1.00 3.03 O ATOM 911 OE2 GLU A 58 -11.908 11.862 4.485 1.00 4.04 O ATOM 0 H GLU A 58 -12.344 15.617 -0.195 1.00 1.23 H new ATOM 0 HA GLU A 58 -10.702 16.158 1.950 1.00 1.43 H new ATOM 0 HB2 GLU A 58 -12.944 15.111 2.062 1.00 1.82 H new ATOM 0 HB3 GLU A 58 -12.326 13.659 1.300 1.00 1.82 H new ATOM 0 HG2 GLU A 58 -10.615 13.659 3.335 1.00 2.00 H new ATOM 0 HG3 GLU A 58 -11.800 14.706 4.090 1.00 2.00 H new ATOM 918 N LYS A 59 -9.863 13.355 0.371 1.00 1.07 N ATOM 919 CA LYS A 59 -8.836 12.354 0.222 1.00 1.00 C ATOM 920 C LYS A 59 -7.701 12.914 -0.620 1.00 0.92 C ATOM 921 O LYS A 59 -6.543 12.681 -0.295 1.00 0.99 O ATOM 922 CB LYS A 59 -9.425 11.053 -0.336 1.00 1.03 C ATOM 923 CG LYS A 59 -8.755 9.829 0.306 1.00 1.94 C ATOM 924 CD LYS A 59 -9.506 9.333 1.555 1.00 2.32 C ATOM 925 CE LYS A 59 -9.686 10.402 2.646 1.00 2.68 C ATOM 926 NZ LYS A 59 -10.423 9.896 3.820 1.00 3.70 N ATOM 0 H LYS A 59 -10.721 13.155 -0.143 1.00 1.07 H new ATOM 0 HA LYS A 59 -8.418 12.098 1.196 1.00 1.00 H new ATOM 0 HB2 LYS A 59 -10.498 11.025 -0.149 1.00 1.03 H new ATOM 0 HB3 LYS A 59 -9.289 11.022 -1.417 1.00 1.03 H new ATOM 0 HG2 LYS A 59 -8.701 9.023 -0.426 1.00 1.94 H new ATOM 0 HG3 LYS A 59 -7.730 10.081 0.578 1.00 1.94 H new ATOM 0 HD2 LYS A 59 -10.488 8.968 1.254 1.00 2.32 H new ATOM 0 HD3 LYS A 59 -8.966 8.485 1.977 1.00 2.32 H new ATOM 0 HE2 LYS A 59 -8.707 10.761 2.963 1.00 2.68 H new ATOM 0 HE3 LYS A 59 -10.218 11.256 2.228 1.00 2.68 H new ATOM 0 HZ1 LYS A 59 -11.172 10.571 4.077 1.00 3.70 H new ATOM 0 HZ2 LYS A 59 -10.850 8.976 3.592 1.00 3.70 H new ATOM 0 HZ3 LYS A 59 -9.768 9.785 4.620 1.00 3.70 H new ATOM 940 N MET A 60 -8.025 13.691 -1.656 1.00 0.86 N ATOM 941 CA MET A 60 -7.017 14.365 -2.464 1.00 0.82 C ATOM 942 C MET A 60 -6.040 15.100 -1.547 1.00 0.88 C ATOM 943 O MET A 60 -4.845 14.822 -1.569 1.00 0.88 O ATOM 944 CB MET A 60 -7.688 15.303 -3.471 1.00 0.89 C ATOM 945 CG MET A 60 -6.685 15.971 -4.418 1.00 0.88 C ATOM 946 SD MET A 60 -5.826 17.414 -3.745 1.00 1.33 S ATOM 947 CE MET A 60 -4.792 17.825 -5.159 1.00 1.39 C ATOM 0 H MET A 60 -8.985 13.867 -1.953 1.00 0.86 H new ATOM 0 HA MET A 60 -6.449 13.634 -3.039 1.00 0.82 H new ATOM 0 HB2 MET A 60 -8.415 14.740 -4.057 1.00 0.89 H new ATOM 0 HB3 MET A 60 -8.240 16.073 -2.932 1.00 0.89 H new ATOM 0 HG2 MET A 60 -5.941 15.231 -4.713 1.00 0.88 H new ATOM 0 HG3 MET A 60 -7.211 16.272 -5.324 1.00 0.88 H new ATOM 0 HE1 MET A 60 -4.624 18.902 -5.186 1.00 1.39 H new ATOM 0 HE2 MET A 60 -3.835 17.311 -5.072 1.00 1.39 H new ATOM 0 HE3 MET A 60 -5.290 17.512 -6.077 1.00 1.39 H new ATOM 957 N LYS A 61 -6.551 15.996 -0.699 1.00 0.97 N ATOM 958 CA LYS A 61 -5.701 16.729 0.229 1.00 1.10 C ATOM 959 C LYS A 61 -5.021 15.789 1.233 1.00 1.14 C ATOM 960 O LYS A 61 -3.862 16.001 1.578 1.00 1.27 O ATOM 961 CB LYS A 61 -6.495 17.859 0.893 1.00 1.19 C ATOM 962 CG LYS A 61 -6.722 18.977 -0.137 1.00 1.37 C ATOM 963 CD LYS A 61 -7.462 20.190 0.443 1.00 1.56 C ATOM 964 CE LYS A 61 -8.966 20.173 0.142 1.00 1.88 C ATOM 965 NZ LYS A 61 -9.661 19.007 0.720 1.00 3.46 N ATOM 0 H LYS A 61 -7.543 16.227 -0.639 1.00 0.97 H new ATOM 0 HA LYS A 61 -4.888 17.196 -0.327 1.00 1.10 H new ATOM 0 HB2 LYS A 61 -7.451 17.484 1.259 1.00 1.19 H new ATOM 0 HB3 LYS A 61 -5.952 18.245 1.756 1.00 1.19 H new ATOM 0 HG2 LYS A 61 -5.759 19.301 -0.531 1.00 1.37 H new ATOM 0 HG3 LYS A 61 -7.292 18.579 -0.977 1.00 1.37 H new ATOM 0 HD2 LYS A 61 -7.313 20.218 1.522 1.00 1.56 H new ATOM 0 HD3 LYS A 61 -7.026 21.103 0.038 1.00 1.56 H new ATOM 0 HE2 LYS A 61 -9.418 21.086 0.530 1.00 1.88 H new ATOM 0 HE3 LYS A 61 -9.114 20.178 -0.938 1.00 1.88 H new ATOM 0 HZ1 LYS A 61 -10.678 19.070 0.511 1.00 3.46 H new ATOM 0 HZ2 LYS A 61 -9.276 18.134 0.307 1.00 3.46 H new ATOM 0 HZ3 LYS A 61 -9.519 18.994 1.750 1.00 3.46 H new ATOM 979 N SER A 62 -5.709 14.734 1.683 1.00 1.13 N ATOM 980 CA SER A 62 -5.086 13.725 2.540 1.00 1.23 C ATOM 981 C SER A 62 -3.881 13.047 1.868 1.00 1.17 C ATOM 982 O SER A 62 -2.962 12.614 2.565 1.00 1.45 O ATOM 983 CB SER A 62 -6.099 12.657 2.966 1.00 1.35 C ATOM 984 OG SER A 62 -7.265 13.227 3.531 1.00 1.95 O ATOM 0 H SER A 62 -6.691 14.559 1.469 1.00 1.13 H new ATOM 0 HA SER A 62 -4.727 14.256 3.422 1.00 1.23 H new ATOM 0 HB2 SER A 62 -6.373 12.052 2.102 1.00 1.35 H new ATOM 0 HB3 SER A 62 -5.636 11.986 3.690 1.00 1.35 H new ATOM 0 HG SER A 62 -7.804 13.637 2.823 1.00 1.95 H new ATOM 990 N LEU A 63 -3.918 12.892 0.538 1.00 0.94 N ATOM 991 CA LEU A 63 -2.913 12.196 -0.258 1.00 0.95 C ATOM 992 C LEU A 63 -1.776 13.131 -0.676 1.00 0.94 C ATOM 993 O LEU A 63 -0.603 12.796 -0.503 1.00 1.04 O ATOM 994 CB LEU A 63 -3.564 11.595 -1.511 1.00 0.95 C ATOM 995 CG LEU A 63 -4.583 10.481 -1.228 1.00 1.03 C ATOM 996 CD1 LEU A 63 -5.567 10.395 -2.396 1.00 1.53 C ATOM 997 CD2 LEU A 63 -3.908 9.122 -1.059 1.00 1.31 C ATOM 0 H LEU A 63 -4.680 13.264 -0.029 1.00 0.94 H new ATOM 0 HA LEU A 63 -2.492 11.404 0.361 1.00 0.95 H new ATOM 0 HB2 LEU A 63 -4.060 12.392 -2.065 1.00 0.95 H new ATOM 0 HB3 LEU A 63 -2.781 11.198 -2.157 1.00 0.95 H new ATOM 0 HG LEU A 63 -5.096 10.727 -0.298 1.00 1.03 H new ATOM 0 HD11 LEU A 63 -6.294 9.606 -2.202 1.00 1.53 H new ATOM 0 HD12 LEU A 63 -6.086 11.347 -2.506 1.00 1.53 H new ATOM 0 HD13 LEU A 63 -5.024 10.170 -3.314 1.00 1.53 H new ATOM 0 HD21 LEU A 63 -4.664 8.362 -0.860 1.00 1.31 H new ATOM 0 HD22 LEU A 63 -3.369 8.868 -1.972 1.00 1.31 H new ATOM 0 HD23 LEU A 63 -3.208 9.165 -0.224 1.00 1.31 H new ATOM 1009 N ASP A 64 -2.113 14.280 -1.268 1.00 0.88 N ATOM 1010 CA ASP A 64 -1.164 15.223 -1.846 1.00 0.90 C ATOM 1011 C ASP A 64 -0.455 15.998 -0.729 1.00 1.08 C ATOM 1012 O ASP A 64 -0.690 17.189 -0.540 1.00 1.23 O ATOM 1013 CB ASP A 64 -1.907 16.147 -2.831 1.00 0.87 C ATOM 1014 CG ASP A 64 -0.973 17.107 -3.547 1.00 0.94 C ATOM 1015 OD1 ASP A 64 0.232 16.776 -3.612 1.00 1.14 O ATOM 1016 OD2 ASP A 64 -1.452 18.158 -4.030 1.00 1.52 O ATOM 0 H ASP A 64 -3.082 14.584 -1.359 1.00 0.88 H new ATOM 0 HA ASP A 64 -0.392 14.696 -2.406 1.00 0.90 H new ATOM 0 HB2 ASP A 64 -2.432 15.539 -3.568 1.00 0.87 H new ATOM 0 HB3 ASP A 64 -2.663 16.716 -2.290 1.00 0.87 H new ATOM 1021 N VAL A 65 0.401 15.308 0.032 1.00 1.18 N ATOM 1022 CA VAL A 65 0.990 15.805 1.272 1.00 1.40 C ATOM 1023 C VAL A 65 1.641 17.185 1.135 1.00 1.42 C ATOM 1024 O VAL A 65 1.487 18.021 2.021 1.00 1.52 O ATOM 1025 CB VAL A 65 1.969 14.777 1.873 1.00 1.58 C ATOM 1026 CG1 VAL A 65 1.222 13.545 2.401 1.00 1.92 C ATOM 1027 CG2 VAL A 65 3.060 14.329 0.889 1.00 1.69 C ATOM 0 H VAL A 65 0.709 14.365 -0.207 1.00 1.18 H new ATOM 0 HA VAL A 65 0.160 15.940 1.966 1.00 1.40 H new ATOM 0 HB VAL A 65 2.463 15.291 2.697 1.00 1.58 H new ATOM 0 HG11 VAL A 65 1.938 12.837 2.819 1.00 1.92 H new ATOM 0 HG12 VAL A 65 0.519 13.850 3.176 1.00 1.92 H new ATOM 0 HG13 VAL A 65 0.678 13.071 1.584 1.00 1.92 H new ATOM 0 HG21 VAL A 65 3.714 13.606 1.376 1.00 1.69 H new ATOM 0 HG22 VAL A 65 2.596 13.869 0.016 1.00 1.69 H new ATOM 0 HG23 VAL A 65 3.645 15.194 0.575 1.00 1.69 H new ATOM 1037 N ASN A 66 2.385 17.430 0.050 1.00 1.41 N ATOM 1038 CA ASN A 66 3.053 18.717 -0.163 1.00 1.52 C ATOM 1039 C ASN A 66 2.121 19.757 -0.799 1.00 1.52 C ATOM 1040 O ASN A 66 2.506 20.913 -0.934 1.00 1.70 O ATOM 1041 CB ASN A 66 4.326 18.538 -0.999 1.00 1.62 C ATOM 1042 CG ASN A 66 4.029 18.238 -2.462 1.00 1.19 C ATOM 1043 OD1 ASN A 66 2.994 17.664 -2.798 1.00 1.08 O ATOM 1044 ND2 ASN A 66 4.933 18.596 -3.364 1.00 2.03 N ATOM 0 H ASN A 66 2.539 16.751 -0.695 1.00 1.41 H new ATOM 0 HA ASN A 66 3.334 19.099 0.818 1.00 1.52 H new ATOM 0 HB2 ASN A 66 4.930 19.443 -0.933 1.00 1.62 H new ATOM 0 HB3 ASN A 66 4.921 17.727 -0.579 1.00 1.62 H new ATOM 0 HD21 ASN A 66 4.775 18.396 -4.352 1.00 2.03 H new ATOM 0 HD22 ASN A 66 5.786 19.071 -3.070 1.00 2.03 H new ATOM 1051 N GLN A 67 0.916 19.341 -1.192 1.00 1.41 N ATOM 1052 CA GLN A 67 -0.121 20.148 -1.800 1.00 1.45 C ATOM 1053 C GLN A 67 0.367 20.964 -3.000 1.00 1.44 C ATOM 1054 O GLN A 67 0.275 22.189 -3.027 1.00 1.65 O ATOM 1055 CB GLN A 67 -0.964 20.893 -0.753 1.00 1.60 C ATOM 1056 CG GLN A 67 -2.436 20.453 -0.836 1.00 1.98 C ATOM 1057 CD GLN A 67 -3.142 20.941 -2.103 1.00 2.76 C ATOM 1058 OE1 GLN A 67 -3.893 21.908 -2.046 1.00 2.97 O ATOM 1059 NE2 GLN A 67 -2.961 20.291 -3.252 1.00 4.47 N ATOM 0 H GLN A 67 0.629 18.368 -1.083 1.00 1.41 H new ATOM 0 HA GLN A 67 -0.836 19.471 -2.267 1.00 1.45 H new ATOM 0 HB2 GLN A 67 -0.574 20.694 0.245 1.00 1.60 H new ATOM 0 HB3 GLN A 67 -0.890 21.968 -0.916 1.00 1.60 H new ATOM 0 HG2 GLN A 67 -2.486 19.365 -0.797 1.00 1.98 H new ATOM 0 HG3 GLN A 67 -2.970 20.828 0.037 1.00 1.98 H new ATOM 0 HE21 GLN A 67 -2.334 19.487 -3.290 1.00 4.47 H new ATOM 0 HE22 GLN A 67 -3.449 20.597 -4.094 1.00 4.47 H new ATOM 1068 N ASP A 68 0.861 20.245 -4.011 1.00 1.29 N ATOM 1069 CA ASP A 68 1.308 20.787 -5.292 1.00 1.30 C ATOM 1070 C ASP A 68 0.255 20.571 -6.392 1.00 1.33 C ATOM 1071 O ASP A 68 0.414 21.120 -7.478 1.00 1.83 O ATOM 1072 CB ASP A 68 2.665 20.165 -5.685 1.00 1.25 C ATOM 1073 CG ASP A 68 2.596 18.656 -5.773 1.00 1.09 C ATOM 1074 OD1 ASP A 68 1.479 18.112 -5.794 1.00 1.07 O ATOM 1075 OD2 ASP A 68 3.581 17.926 -5.533 1.00 1.14 O ATOM 0 H ASP A 68 0.964 19.232 -3.956 1.00 1.29 H new ATOM 0 HA ASP A 68 1.439 21.864 -5.182 1.00 1.30 H new ATOM 0 HB2 ASP A 68 2.984 20.569 -6.646 1.00 1.25 H new ATOM 0 HB3 ASP A 68 3.420 20.451 -4.952 1.00 1.25 H new ATOM 1080 N SER A 69 -0.799 19.784 -6.126 1.00 1.14 N ATOM 1081 CA SER A 69 -1.854 19.360 -7.045 1.00 1.14 C ATOM 1082 C SER A 69 -1.468 18.180 -7.945 1.00 1.04 C ATOM 1083 O SER A 69 -2.313 17.701 -8.701 1.00 1.15 O ATOM 1084 CB SER A 69 -2.544 20.522 -7.783 1.00 1.29 C ATOM 1085 OG SER A 69 -1.829 20.984 -8.911 1.00 2.63 O ATOM 0 H SER A 69 -0.942 19.401 -5.191 1.00 1.14 H new ATOM 0 HA SER A 69 -2.631 18.953 -6.398 1.00 1.14 H new ATOM 0 HB2 SER A 69 -3.536 20.201 -8.100 1.00 1.29 H new ATOM 0 HB3 SER A 69 -2.683 21.350 -7.088 1.00 1.29 H new ATOM 0 HG SER A 69 -0.896 21.150 -8.661 1.00 2.63 H new ATOM 1091 N GLU A 70 -0.239 17.667 -7.823 1.00 0.96 N ATOM 1092 CA GLU A 70 0.216 16.463 -8.502 1.00 0.87 C ATOM 1093 C GLU A 70 0.400 15.367 -7.462 1.00 0.80 C ATOM 1094 O GLU A 70 1.169 15.526 -6.513 1.00 0.84 O ATOM 1095 CB GLU A 70 1.560 16.697 -9.197 1.00 0.97 C ATOM 1096 CG GLU A 70 1.443 17.539 -10.472 1.00 1.24 C ATOM 1097 CD GLU A 70 2.749 17.514 -11.262 1.00 2.02 C ATOM 1098 OE1 GLU A 70 3.310 16.402 -11.382 1.00 2.70 O ATOM 1099 OE2 GLU A 70 3.161 18.597 -11.726 1.00 3.05 O ATOM 0 H GLU A 70 0.478 18.092 -7.235 1.00 0.96 H new ATOM 0 HA GLU A 70 -0.523 16.183 -9.252 1.00 0.87 H new ATOM 0 HB2 GLU A 70 2.239 17.193 -8.503 1.00 0.97 H new ATOM 0 HB3 GLU A 70 2.006 15.734 -9.445 1.00 0.97 H new ATOM 0 HG2 GLU A 70 0.631 17.158 -11.091 1.00 1.24 H new ATOM 0 HG3 GLU A 70 1.190 18.567 -10.212 1.00 1.24 H new ATOM 1106 N LEU A 71 -0.250 14.224 -7.648 1.00 0.76 N ATOM 1107 CA LEU A 71 0.051 13.043 -6.866 1.00 0.78 C ATOM 1108 C LEU A 71 1.234 12.360 -7.566 1.00 0.80 C ATOM 1109 O LEU A 71 1.021 11.655 -8.554 1.00 0.88 O ATOM 1110 CB LEU A 71 -1.182 12.127 -6.842 1.00 0.85 C ATOM 1111 CG LEU A 71 -2.422 12.578 -6.055 1.00 0.92 C ATOM 1112 CD1 LEU A 71 -2.167 12.512 -4.550 1.00 0.95 C ATOM 1113 CD2 LEU A 71 -2.958 13.966 -6.428 1.00 0.95 C ATOM 0 H LEU A 71 -0.991 14.096 -8.338 1.00 0.76 H new ATOM 0 HA LEU A 71 0.304 13.281 -5.833 1.00 0.78 H new ATOM 0 HB2 LEU A 71 -1.489 11.959 -7.874 1.00 0.85 H new ATOM 0 HB3 LEU A 71 -0.869 11.163 -6.442 1.00 0.85 H new ATOM 0 HG LEU A 71 -3.200 11.870 -6.341 1.00 0.92 H new ATOM 0 HD11 LEU A 71 -3.060 12.836 -4.015 1.00 0.95 H new ATOM 0 HD12 LEU A 71 -1.926 11.487 -4.266 1.00 0.95 H new ATOM 0 HD13 LEU A 71 -1.333 13.165 -4.293 1.00 0.95 H new ATOM 0 HD21 LEU A 71 -3.833 14.194 -5.819 1.00 0.95 H new ATOM 0 HD22 LEU A 71 -2.186 14.714 -6.249 1.00 0.95 H new ATOM 0 HD23 LEU A 71 -3.237 13.977 -7.482 1.00 0.95 H new ATOM 1125 N LYS A 72 2.480 12.567 -7.113 1.00 0.82 N ATOM 1126 CA LYS A 72 3.587 11.798 -7.684 1.00 0.84 C ATOM 1127 C LYS A 72 3.466 10.332 -7.246 1.00 0.76 C ATOM 1128 O LYS A 72 2.787 10.049 -6.263 1.00 0.75 O ATOM 1129 CB LYS A 72 4.971 12.407 -7.373 1.00 1.15 C ATOM 1130 CG LYS A 72 5.465 12.269 -5.922 1.00 1.81 C ATOM 1131 CD LYS A 72 6.979 12.531 -5.825 1.00 2.78 C ATOM 1132 CE LYS A 72 7.539 12.153 -4.440 1.00 4.76 C ATOM 1133 NZ LYS A 72 9.018 12.123 -4.430 1.00 6.13 N ATOM 0 H LYS A 72 2.737 13.232 -6.384 1.00 0.82 H new ATOM 0 HA LYS A 72 3.511 11.842 -8.770 1.00 0.84 H new ATOM 0 HB2 LYS A 72 5.705 11.942 -8.030 1.00 1.15 H new ATOM 0 HB3 LYS A 72 4.943 13.467 -7.626 1.00 1.15 H new ATOM 0 HG2 LYS A 72 4.929 12.972 -5.284 1.00 1.81 H new ATOM 0 HG3 LYS A 72 5.241 11.268 -5.552 1.00 1.81 H new ATOM 0 HD2 LYS A 72 7.497 11.959 -6.595 1.00 2.78 H new ATOM 0 HD3 LYS A 72 7.179 13.584 -6.022 1.00 2.78 H new ATOM 0 HE2 LYS A 72 7.186 12.869 -3.698 1.00 4.76 H new ATOM 0 HE3 LYS A 72 7.154 11.176 -4.148 1.00 4.76 H new ATOM 0 HZ1 LYS A 72 9.354 11.865 -3.480 1.00 6.13 H new ATOM 0 HZ2 LYS A 72 9.356 11.421 -5.119 1.00 6.13 H new ATOM 0 HZ3 LYS A 72 9.386 13.062 -4.684 1.00 6.13 H new ATOM 1147 N PHE A 73 4.159 9.411 -7.929 1.00 0.80 N ATOM 1148 CA PHE A 73 4.041 7.963 -7.733 1.00 0.83 C ATOM 1149 C PHE A 73 3.871 7.558 -6.262 1.00 0.79 C ATOM 1150 O PHE A 73 2.951 6.818 -5.938 1.00 0.90 O ATOM 1151 CB PHE A 73 5.269 7.227 -8.289 1.00 0.91 C ATOM 1152 CG PHE A 73 5.551 7.373 -9.774 1.00 2.03 C ATOM 1153 CD1 PHE A 73 6.201 8.517 -10.283 1.00 3.43 C ATOM 1154 CD2 PHE A 73 5.246 6.308 -10.643 1.00 3.22 C ATOM 1155 CE1 PHE A 73 6.539 8.589 -11.645 1.00 4.89 C ATOM 1156 CE2 PHE A 73 5.550 6.398 -12.012 1.00 4.69 C ATOM 1157 CZ PHE A 73 6.206 7.535 -12.512 1.00 5.29 C ATOM 0 H PHE A 73 4.834 9.661 -8.652 1.00 0.80 H new ATOM 0 HA PHE A 73 3.140 7.676 -8.275 1.00 0.83 H new ATOM 0 HB2 PHE A 73 6.146 7.573 -7.743 1.00 0.91 H new ATOM 0 HB3 PHE A 73 5.155 6.165 -8.069 1.00 0.91 H new ATOM 0 HD1 PHE A 73 6.439 9.339 -9.624 1.00 3.43 H new ATOM 0 HD2 PHE A 73 4.776 5.417 -10.255 1.00 3.22 H new ATOM 0 HE1 PHE A 73 7.056 9.457 -12.026 1.00 4.89 H new ATOM 0 HE2 PHE A 73 5.279 5.593 -12.679 1.00 4.69 H new ATOM 0 HZ PHE A 73 6.454 7.599 -13.561 1.00 5.29 H new ATOM 1167 N ASN A 74 4.762 8.019 -5.378 1.00 0.71 N ATOM 1168 CA ASN A 74 4.712 7.687 -3.953 1.00 0.71 C ATOM 1169 C ASN A 74 3.450 8.263 -3.293 1.00 0.78 C ATOM 1170 O ASN A 74 2.776 7.575 -2.527 1.00 1.03 O ATOM 1171 CB ASN A 74 6.003 8.160 -3.268 1.00 0.66 C ATOM 1172 CG ASN A 74 5.955 8.070 -1.744 1.00 0.86 C ATOM 1173 OD1 ASN A 74 6.565 7.184 -1.159 1.00 1.50 O ATOM 1174 ND2 ASN A 74 5.282 9.008 -1.081 1.00 1.46 N ATOM 0 H ASN A 74 5.537 8.632 -5.631 1.00 0.71 H new ATOM 0 HA ASN A 74 4.649 6.605 -3.837 1.00 0.71 H new ATOM 0 HB2 ASN A 74 6.838 7.562 -3.633 1.00 0.66 H new ATOM 0 HB3 ASN A 74 6.200 9.192 -3.557 1.00 0.66 H new ATOM 0 HD21 ASN A 74 5.266 9.000 -0.061 1.00 1.46 H new ATOM 0 HD22 ASN A 74 4.782 9.735 -1.593 1.00 1.46 H new ATOM 1181 N GLU A 75 3.132 9.531 -3.580 1.00 0.69 N ATOM 1182 CA GLU A 75 1.950 10.185 -3.038 1.00 0.73 C ATOM 1183 C GLU A 75 0.700 9.427 -3.471 1.00 0.78 C ATOM 1184 O GLU A 75 -0.183 9.177 -2.656 1.00 0.85 O ATOM 1185 CB GLU A 75 1.852 11.638 -3.513 1.00 0.73 C ATOM 1186 CG GLU A 75 3.027 12.508 -3.060 1.00 0.84 C ATOM 1187 CD GLU A 75 2.850 13.914 -3.602 1.00 0.87 C ATOM 1188 OE1 GLU A 75 2.843 14.118 -4.835 1.00 1.70 O ATOM 1189 OE2 GLU A 75 2.634 14.877 -2.842 1.00 1.89 O ATOM 0 H GLU A 75 3.689 10.125 -4.193 1.00 0.69 H new ATOM 0 HA GLU A 75 2.031 10.183 -1.951 1.00 0.73 H new ATOM 0 HB2 GLU A 75 1.797 11.653 -4.602 1.00 0.73 H new ATOM 0 HB3 GLU A 75 0.924 12.072 -3.141 1.00 0.73 H new ATOM 0 HG2 GLU A 75 3.079 12.530 -1.971 1.00 0.84 H new ATOM 0 HG3 GLU A 75 3.966 12.084 -3.416 1.00 0.84 H new ATOM 1196 N TYR A 76 0.620 9.058 -4.752 1.00 0.85 N ATOM 1197 CA TYR A 76 -0.513 8.289 -5.227 1.00 0.88 C ATOM 1198 C TYR A 76 -0.523 6.909 -4.590 1.00 1.00 C ATOM 1199 O TYR A 76 -1.585 6.475 -4.142 1.00 1.06 O ATOM 1200 CB TYR A 76 -0.536 8.165 -6.748 1.00 0.81 C ATOM 1201 CG TYR A 76 -1.881 7.656 -7.226 1.00 0.85 C ATOM 1202 CD1 TYR A 76 -2.926 8.568 -7.455 1.00 2.20 C ATOM 1203 CD2 TYR A 76 -2.139 6.275 -7.299 1.00 2.07 C ATOM 1204 CE1 TYR A 76 -4.156 8.115 -7.954 1.00 2.72 C ATOM 1205 CE2 TYR A 76 -3.389 5.818 -7.756 1.00 2.31 C ATOM 1206 CZ TYR A 76 -4.378 6.740 -8.131 1.00 2.10 C ATOM 1207 OH TYR A 76 -5.531 6.295 -8.702 1.00 2.85 O ATOM 0 H TYR A 76 1.318 9.279 -5.462 1.00 0.85 H new ATOM 0 HA TYR A 76 -1.411 8.831 -4.932 1.00 0.88 H new ATOM 0 HB2 TYR A 76 -0.328 9.135 -7.200 1.00 0.81 H new ATOM 0 HB3 TYR A 76 0.252 7.486 -7.074 1.00 0.81 H new ATOM 0 HD1 TYR A 76 -2.782 9.618 -7.247 1.00 2.20 H new ATOM 0 HD2 TYR A 76 -1.379 5.567 -7.005 1.00 2.07 H new ATOM 0 HE1 TYR A 76 -4.932 8.824 -8.202 1.00 2.72 H new ATOM 0 HE2 TYR A 76 -3.587 4.758 -7.818 1.00 2.31 H new ATOM 0 HH TYR A 76 -5.461 5.333 -8.874 1.00 2.85 H new ATOM 1217 N TRP A 77 0.641 6.234 -4.539 1.00 1.03 N ATOM 1218 CA TRP A 77 0.779 4.968 -3.831 1.00 1.03 C ATOM 1219 C TRP A 77 0.042 5.108 -2.511 1.00 0.97 C ATOM 1220 O TRP A 77 -0.712 4.197 -2.193 1.00 0.89 O ATOM 1221 CB TRP A 77 2.234 4.467 -3.617 1.00 1.06 C ATOM 1222 CG TRP A 77 2.502 3.912 -2.235 1.00 0.83 C ATOM 1223 CD1 TRP A 77 1.710 3.044 -1.570 1.00 1.43 C ATOM 1224 CD2 TRP A 77 3.512 4.261 -1.245 1.00 2.28 C ATOM 1225 NE1 TRP A 77 1.804 3.353 -0.226 1.00 1.53 N ATOM 1226 CE2 TRP A 77 2.965 4.036 0.051 1.00 2.23 C ATOM 1227 CE3 TRP A 77 4.874 4.605 -1.268 1.00 4.16 C ATOM 1228 CZ2 TRP A 77 3.661 4.402 1.226 1.00 3.75 C ATOM 1229 CZ3 TRP A 77 5.599 4.364 -0.085 1.00 5.27 C ATOM 1230 CH2 TRP A 77 4.996 4.788 1.094 1.00 5.24 C ATOM 0 H TRP A 77 1.499 6.556 -4.986 1.00 1.03 H new ATOM 0 HA TRP A 77 0.346 4.193 -4.464 1.00 1.03 H new ATOM 0 HB2 TRP A 77 2.453 3.695 -4.355 1.00 1.06 H new ATOM 0 HB3 TRP A 77 2.922 5.292 -3.805 1.00 1.06 H new ATOM 0 HD1 TRP A 77 1.114 2.256 -2.006 1.00 1.43 H new ATOM 0 HE1 TRP A 77 1.102 3.106 0.471 1.00 1.53 H new ATOM 0 HE3 TRP A 77 5.339 5.031 -2.145 1.00 4.16 H new ATOM 0 HZ2 TRP A 77 3.177 4.384 2.191 1.00 3.75 H new ATOM 0 HZ3 TRP A 77 6.564 3.880 -0.093 1.00 5.27 H new ATOM 0 HH2 TRP A 77 5.516 5.366 1.843 1.00 5.24 H new ATOM 1241 N ARG A 78 0.240 6.201 -1.755 1.00 1.07 N ATOM 1242 CA ARG A 78 -0.412 6.333 -0.459 1.00 1.10 C ATOM 1243 C ARG A 78 -1.840 5.801 -0.499 1.00 1.02 C ATOM 1244 O ARG A 78 -2.166 5.013 0.364 1.00 1.10 O ATOM 1245 CB ARG A 78 -0.486 7.756 0.079 1.00 1.14 C ATOM 1246 CG ARG A 78 0.836 8.458 0.382 1.00 1.95 C ATOM 1247 CD ARG A 78 0.578 9.941 0.700 1.00 2.12 C ATOM 1248 NE ARG A 78 0.241 10.231 2.110 1.00 2.05 N ATOM 1249 CZ ARG A 78 -0.985 10.278 2.670 1.00 2.58 C ATOM 1250 NH1 ARG A 78 -2.014 9.616 2.146 1.00 3.40 N ATOM 1251 NH2 ARG A 78 -1.191 11.023 3.756 1.00 3.58 N ATOM 0 H ARG A 78 0.835 6.986 -2.019 1.00 1.07 H new ATOM 0 HA ARG A 78 0.224 5.748 0.206 1.00 1.10 H new ATOM 0 HB2 ARG A 78 -1.032 8.362 -0.644 1.00 1.14 H new ATOM 0 HB3 ARG A 78 -1.078 7.741 0.994 1.00 1.14 H new ATOM 0 HG2 ARG A 78 1.329 7.976 1.226 1.00 1.95 H new ATOM 0 HG3 ARG A 78 1.508 8.371 -0.472 1.00 1.95 H new ATOM 0 HD2 ARG A 78 1.465 10.514 0.429 1.00 2.12 H new ATOM 0 HD3 ARG A 78 -0.236 10.296 0.068 1.00 2.12 H new ATOM 0 HE ARG A 78 1.028 10.417 2.732 1.00 2.05 H new ATOM 0 HH11 ARG A 78 -1.885 9.057 1.302 1.00 3.40 H new ATOM 0 HH12 ARG A 78 -2.932 9.667 2.588 1.00 3.40 H new ATOM 0 HH21 ARG A 78 -0.422 11.556 4.162 1.00 3.58 H new ATOM 0 HH22 ARG A 78 -2.118 11.060 4.181 1.00 3.58 H new ATOM 1265 N LEU A 79 -2.653 6.129 -1.510 1.00 0.93 N ATOM 1266 CA LEU A 79 -3.986 5.560 -1.663 1.00 0.93 C ATOM 1267 C LEU A 79 -4.000 4.042 -1.444 1.00 0.98 C ATOM 1268 O LEU A 79 -4.699 3.554 -0.569 1.00 1.10 O ATOM 1269 CB LEU A 79 -4.523 5.904 -3.059 1.00 0.89 C ATOM 1270 CG LEU A 79 -6.014 5.564 -3.199 1.00 0.94 C ATOM 1271 CD1 LEU A 79 -6.850 6.640 -2.507 1.00 0.95 C ATOM 1272 CD2 LEU A 79 -6.389 5.500 -4.684 1.00 0.95 C ATOM 0 H LEU A 79 -2.401 6.795 -2.240 1.00 0.93 H new ATOM 0 HA LEU A 79 -4.629 5.994 -0.897 1.00 0.93 H new ATOM 0 HB2 LEU A 79 -4.373 6.966 -3.254 1.00 0.89 H new ATOM 0 HB3 LEU A 79 -3.954 5.358 -3.812 1.00 0.89 H new ATOM 0 HG LEU A 79 -6.210 4.598 -2.735 1.00 0.94 H new ATOM 0 HD11 LEU A 79 -7.908 6.399 -2.606 1.00 0.95 H new ATOM 0 HD12 LEU A 79 -6.585 6.683 -1.450 1.00 0.95 H new ATOM 0 HD13 LEU A 79 -6.653 7.607 -2.970 1.00 0.95 H new ATOM 0 HD21 LEU A 79 -7.447 5.259 -4.782 1.00 0.95 H new ATOM 0 HD22 LEU A 79 -6.192 6.465 -5.151 1.00 0.95 H new ATOM 0 HD23 LEU A 79 -5.794 4.731 -5.177 1.00 0.95 H new ATOM 1284 N ILE A 80 -3.198 3.307 -2.213 1.00 0.98 N ATOM 1285 CA ILE A 80 -3.038 1.854 -2.180 1.00 1.11 C ATOM 1286 C ILE A 80 -2.508 1.475 -0.799 1.00 1.35 C ATOM 1287 O ILE A 80 -2.956 0.504 -0.190 1.00 1.37 O ATOM 1288 CB ILE A 80 -2.101 1.384 -3.318 1.00 1.15 C ATOM 1289 CG1 ILE A 80 -2.780 1.400 -4.702 1.00 1.23 C ATOM 1290 CG2 ILE A 80 -1.607 -0.051 -3.082 1.00 1.43 C ATOM 1291 CD1 ILE A 80 -3.247 2.780 -5.167 1.00 1.62 C ATOM 0 H ILE A 80 -2.604 3.738 -2.921 1.00 0.98 H new ATOM 0 HA ILE A 80 -3.992 1.354 -2.346 1.00 1.11 H new ATOM 0 HB ILE A 80 -1.273 2.093 -3.308 1.00 1.15 H new ATOM 0 HG12 ILE A 80 -2.083 1.000 -5.438 1.00 1.23 H new ATOM 0 HG13 ILE A 80 -3.639 0.729 -4.678 1.00 1.23 H new ATOM 0 HG21 ILE A 80 -0.951 -0.349 -3.900 1.00 1.43 H new ATOM 0 HG22 ILE A 80 -1.058 -0.097 -2.142 1.00 1.43 H new ATOM 0 HG23 ILE A 80 -2.461 -0.727 -3.037 1.00 1.43 H new ATOM 0 HD11 ILE A 80 -3.712 2.695 -6.149 1.00 1.62 H new ATOM 0 HD12 ILE A 80 -3.971 3.178 -4.456 1.00 1.62 H new ATOM 0 HD13 ILE A 80 -2.391 3.452 -5.228 1.00 1.62 H new ATOM 1303 N GLY A 81 -1.575 2.292 -0.303 1.00 1.61 N ATOM 1304 CA GLY A 81 -1.074 2.242 1.050 1.00 1.84 C ATOM 1305 C GLY A 81 -2.239 2.093 2.027 1.00 1.86 C ATOM 1306 O GLY A 81 -2.276 1.218 2.889 1.00 2.12 O ATOM 0 H GLY A 81 -1.141 3.027 -0.861 1.00 1.61 H new ATOM 0 HA2 GLY A 81 -0.384 1.405 1.162 1.00 1.84 H new ATOM 0 HA3 GLY A 81 -0.513 3.149 1.274 1.00 1.84 H new ATOM 1310 N GLU A 82 -3.168 3.040 1.889 1.00 1.63 N ATOM 1311 CA GLU A 82 -4.269 3.318 2.776 1.00 1.70 C ATOM 1312 C GLU A 82 -5.308 2.225 2.581 1.00 1.68 C ATOM 1313 O GLU A 82 -5.867 1.754 3.555 1.00 1.74 O ATOM 1314 CB GLU A 82 -4.823 4.728 2.491 1.00 1.55 C ATOM 1315 CG GLU A 82 -3.767 5.856 2.552 1.00 1.53 C ATOM 1316 CD GLU A 82 -3.863 6.818 3.727 1.00 1.80 C ATOM 1317 OE1 GLU A 82 -4.040 6.312 4.859 1.00 2.35 O ATOM 1318 OE2 GLU A 82 -3.665 8.033 3.484 1.00 2.70 O ATOM 0 H GLU A 82 -3.158 3.674 1.090 1.00 1.63 H new ATOM 0 HA GLU A 82 -3.956 3.315 3.820 1.00 1.70 H new ATOM 0 HB2 GLU A 82 -5.283 4.731 1.503 1.00 1.55 H new ATOM 0 HB3 GLU A 82 -5.612 4.947 3.210 1.00 1.55 H new ATOM 0 HG2 GLU A 82 -2.779 5.397 2.568 1.00 1.53 H new ATOM 0 HG3 GLU A 82 -3.834 6.435 1.631 1.00 1.53 H new ATOM 1325 N LEU A 83 -5.547 1.761 1.353 1.00 1.60 N ATOM 1326 CA LEU A 83 -6.514 0.698 1.113 1.00 1.50 C ATOM 1327 C LEU A 83 -6.226 -0.513 2.002 1.00 1.47 C ATOM 1328 O LEU A 83 -7.142 -1.064 2.607 1.00 1.47 O ATOM 1329 CB LEU A 83 -6.553 0.278 -0.358 1.00 1.56 C ATOM 1330 CG LEU A 83 -6.822 1.401 -1.372 1.00 1.19 C ATOM 1331 CD1 LEU A 83 -7.290 0.789 -2.695 1.00 1.55 C ATOM 1332 CD2 LEU A 83 -7.740 2.517 -0.852 1.00 2.21 C ATOM 0 H LEU A 83 -5.083 2.107 0.513 1.00 1.60 H new ATOM 0 HA LEU A 83 -7.495 1.098 1.369 1.00 1.50 H new ATOM 0 HB2 LEU A 83 -5.600 -0.189 -0.607 1.00 1.56 H new ATOM 0 HB3 LEU A 83 -7.323 -0.484 -0.477 1.00 1.56 H new ATOM 0 HG LEU A 83 -5.881 1.923 -1.545 1.00 1.19 H new ATOM 0 HD11 LEU A 83 -7.481 1.584 -3.416 1.00 1.55 H new ATOM 0 HD12 LEU A 83 -6.517 0.126 -3.083 1.00 1.55 H new ATOM 0 HD13 LEU A 83 -8.205 0.221 -2.529 1.00 1.55 H new ATOM 0 HD21 LEU A 83 -7.877 3.268 -1.630 1.00 2.21 H new ATOM 0 HD22 LEU A 83 -8.708 2.095 -0.580 1.00 2.21 H new ATOM 0 HD23 LEU A 83 -7.288 2.981 0.024 1.00 2.21 H new ATOM 1344 N ALA A 84 -4.950 -0.894 2.128 1.00 1.47 N ATOM 1345 CA ALA A 84 -4.539 -1.991 3.000 1.00 1.47 C ATOM 1346 C ALA A 84 -4.956 -1.777 4.466 1.00 1.43 C ATOM 1347 O ALA A 84 -5.061 -2.736 5.224 1.00 1.65 O ATOM 1348 CB ALA A 84 -3.028 -2.203 2.884 1.00 1.51 C ATOM 0 H ALA A 84 -4.179 -0.450 1.629 1.00 1.47 H new ATOM 0 HA ALA A 84 -5.059 -2.889 2.666 1.00 1.47 H new ATOM 0 HB1 ALA A 84 -2.724 -3.022 3.536 1.00 1.51 H new ATOM 0 HB2 ALA A 84 -2.773 -2.446 1.853 1.00 1.51 H new ATOM 0 HB3 ALA A 84 -2.509 -1.292 3.181 1.00 1.51 H new ATOM 1354 N LYS A 85 -5.142 -0.525 4.887 1.00 1.24 N ATOM 1355 CA LYS A 85 -5.754 -0.129 6.152 1.00 1.15 C ATOM 1356 C LYS A 85 -7.298 -0.105 6.052 1.00 1.12 C ATOM 1357 O LYS A 85 -7.988 -0.785 6.815 1.00 1.09 O ATOM 1358 CB LYS A 85 -5.067 1.184 6.556 1.00 1.34 C ATOM 1359 CG LYS A 85 -5.666 2.026 7.681 1.00 0.94 C ATOM 1360 CD LYS A 85 -5.158 3.477 7.544 1.00 1.56 C ATOM 1361 CE LYS A 85 -3.634 3.629 7.370 1.00 1.15 C ATOM 1362 NZ LYS A 85 -3.268 5.003 6.960 1.00 1.47 N ATOM 0 H LYS A 85 -4.855 0.278 4.327 1.00 1.24 H new ATOM 0 HA LYS A 85 -5.596 -0.849 6.955 1.00 1.15 H new ATOM 0 HB2 LYS A 85 -4.041 0.944 6.837 1.00 1.34 H new ATOM 0 HB3 LYS A 85 -5.015 1.813 5.668 1.00 1.34 H new ATOM 0 HG2 LYS A 85 -6.755 2.001 7.632 1.00 0.94 H new ATOM 0 HG3 LYS A 85 -5.382 1.617 8.650 1.00 0.94 H new ATOM 0 HD2 LYS A 85 -5.652 3.938 6.689 1.00 1.56 H new ATOM 0 HD3 LYS A 85 -5.463 4.036 8.428 1.00 1.56 H new ATOM 0 HE2 LYS A 85 -3.134 3.382 8.306 1.00 1.15 H new ATOM 0 HE3 LYS A 85 -3.280 2.919 6.623 1.00 1.15 H new ATOM 0 HZ1 LYS A 85 -2.343 4.989 6.485 1.00 1.47 H new ATOM 0 HZ2 LYS A 85 -3.987 5.373 6.306 1.00 1.47 H new ATOM 0 HZ3 LYS A 85 -3.216 5.614 7.800 1.00 1.47 H new ATOM 1376 N GLU A 86 -7.865 0.668 5.122 1.00 1.19 N ATOM 1377 CA GLU A 86 -9.309 0.863 4.969 1.00 1.22 C ATOM 1378 C GLU A 86 -10.066 -0.449 4.755 1.00 1.28 C ATOM 1379 O GLU A 86 -11.225 -0.553 5.154 1.00 1.39 O ATOM 1380 CB GLU A 86 -9.616 1.884 3.866 1.00 1.35 C ATOM 1381 CG GLU A 86 -8.885 3.218 4.080 1.00 1.51 C ATOM 1382 CD GLU A 86 -9.122 3.833 5.457 1.00 2.11 C ATOM 1383 OE1 GLU A 86 -10.198 4.443 5.626 1.00 1.80 O ATOM 1384 OE2 GLU A 86 -8.229 3.683 6.322 1.00 3.86 O ATOM 0 H GLU A 86 -7.318 1.189 4.437 1.00 1.19 H new ATOM 0 HA GLU A 86 -9.672 1.270 5.913 1.00 1.22 H new ATOM 0 HB2 GLU A 86 -9.330 1.468 2.900 1.00 1.35 H new ATOM 0 HB3 GLU A 86 -10.690 2.064 3.830 1.00 1.35 H new ATOM 0 HG2 GLU A 86 -7.815 3.063 3.940 1.00 1.51 H new ATOM 0 HG3 GLU A 86 -9.207 3.925 3.316 1.00 1.51 H new ATOM 1391 N ILE A 87 -9.400 -1.469 4.207 1.00 1.32 N ATOM 1392 CA ILE A 87 -9.891 -2.843 4.145 1.00 1.41 C ATOM 1393 C ILE A 87 -10.551 -3.284 5.456 1.00 1.21 C ATOM 1394 O ILE A 87 -11.488 -4.079 5.422 1.00 1.50 O ATOM 1395 CB ILE A 87 -8.733 -3.787 3.779 1.00 1.56 C ATOM 1396 CG1 ILE A 87 -9.186 -5.197 3.371 1.00 1.94 C ATOM 1397 CG2 ILE A 87 -7.757 -3.923 4.952 1.00 1.52 C ATOM 1398 CD1 ILE A 87 -10.171 -5.174 2.204 1.00 0.96 C ATOM 0 H ILE A 87 -8.479 -1.356 3.783 1.00 1.32 H new ATOM 0 HA ILE A 87 -10.660 -2.889 3.374 1.00 1.41 H new ATOM 0 HB ILE A 87 -8.252 -3.327 2.915 1.00 1.56 H new ATOM 0 HG12 ILE A 87 -8.314 -5.791 3.096 1.00 1.94 H new ATOM 0 HG13 ILE A 87 -9.650 -5.689 4.226 1.00 1.94 H new ATOM 0 HG21 ILE A 87 -6.945 -4.595 4.674 1.00 1.52 H new ATOM 0 HG22 ILE A 87 -7.349 -2.944 5.201 1.00 1.52 H new ATOM 0 HG23 ILE A 87 -8.282 -4.328 5.817 1.00 1.52 H new ATOM 0 HD11 ILE A 87 -10.461 -6.194 1.953 1.00 0.96 H new ATOM 0 HD12 ILE A 87 -11.056 -4.604 2.486 1.00 0.96 H new ATOM 0 HD13 ILE A 87 -9.699 -4.708 1.339 1.00 0.96 H new ATOM 1410 N ARG A 88 -10.054 -2.782 6.594 1.00 1.03 N ATOM 1411 CA ARG A 88 -10.637 -3.006 7.908 1.00 1.28 C ATOM 1412 C ARG A 88 -10.878 -1.703 8.681 1.00 1.30 C ATOM 1413 O ARG A 88 -11.406 -1.775 9.794 1.00 1.61 O ATOM 1414 CB ARG A 88 -9.773 -4.008 8.689 1.00 1.65 C ATOM 1415 CG ARG A 88 -8.352 -3.520 9.012 1.00 1.76 C ATOM 1416 CD ARG A 88 -8.118 -3.265 10.509 1.00 2.04 C ATOM 1417 NE ARG A 88 -9.068 -2.272 11.041 1.00 3.25 N ATOM 1418 CZ ARG A 88 -8.813 -1.157 11.742 1.00 4.66 C ATOM 1419 NH1 ARG A 88 -7.573 -0.869 12.154 1.00 5.20 N ATOM 1420 NH2 ARG A 88 -9.824 -0.332 12.023 1.00 6.15 N ATOM 0 H ARG A 88 -9.218 -2.198 6.619 1.00 1.03 H new ATOM 0 HA ARG A 88 -11.629 -3.438 7.774 1.00 1.28 H new ATOM 0 HB2 ARG A 88 -10.279 -4.252 9.623 1.00 1.65 H new ATOM 0 HB3 ARG A 88 -9.703 -4.931 8.114 1.00 1.65 H new ATOM 0 HG2 ARG A 88 -7.633 -4.260 8.661 1.00 1.76 H new ATOM 0 HG3 ARG A 88 -8.158 -2.600 8.460 1.00 1.76 H new ATOM 0 HD2 ARG A 88 -8.221 -4.200 11.059 1.00 2.04 H new ATOM 0 HD3 ARG A 88 -7.098 -2.914 10.665 1.00 2.04 H new ATOM 0 HE ARG A 88 -10.053 -2.458 10.850 1.00 3.25 H new ATOM 0 HH11 ARG A 88 -6.803 -1.502 11.936 1.00 5.20 H new ATOM 0 HH12 ARG A 88 -7.397 -0.017 12.686 1.00 5.20 H new ATOM 0 HH21 ARG A 88 -10.767 -0.555 11.706 1.00 6.15 H new ATOM 0 HH22 ARG A 88 -9.653 0.521 12.555 1.00 6.15 H new ATOM 1434 N LYS A 89 -10.449 -0.540 8.171 1.00 1.34 N ATOM 1435 CA LYS A 89 -10.692 0.768 8.780 1.00 1.52 C ATOM 1436 C LYS A 89 -11.826 1.560 8.099 1.00 2.16 C ATOM 1437 O LYS A 89 -12.084 2.696 8.493 1.00 2.65 O ATOM 1438 CB LYS A 89 -9.357 1.532 8.850 1.00 1.32 C ATOM 1439 CG LYS A 89 -9.486 2.932 9.458 1.00 1.38 C ATOM 1440 CD LYS A 89 -8.150 3.436 10.009 1.00 1.57 C ATOM 1441 CE LYS A 89 -8.371 4.611 10.971 1.00 2.11 C ATOM 1442 NZ LYS A 89 -8.853 4.159 12.295 1.00 3.41 N ATOM 0 H LYS A 89 -9.912 -0.485 7.305 1.00 1.34 H new ATOM 0 HA LYS A 89 -11.064 0.623 9.794 1.00 1.52 H new ATOM 0 HB2 LYS A 89 -8.646 0.953 9.439 1.00 1.32 H new ATOM 0 HB3 LYS A 89 -8.943 1.617 7.845 1.00 1.32 H new ATOM 0 HG2 LYS A 89 -9.852 3.625 8.701 1.00 1.38 H new ATOM 0 HG3 LYS A 89 -10.226 2.914 10.258 1.00 1.38 H new ATOM 0 HD2 LYS A 89 -7.636 2.627 10.527 1.00 1.57 H new ATOM 0 HD3 LYS A 89 -7.506 3.748 9.187 1.00 1.57 H new ATOM 0 HE2 LYS A 89 -7.438 5.160 11.093 1.00 2.11 H new ATOM 0 HE3 LYS A 89 -9.094 5.303 10.539 1.00 2.11 H new ATOM 0 HZ1 LYS A 89 -8.844 4.959 12.959 1.00 3.41 H new ATOM 0 HZ2 LYS A 89 -9.823 3.794 12.205 1.00 3.41 H new ATOM 0 HZ3 LYS A 89 -8.231 3.406 12.652 1.00 3.41 H new ATOM 1710 N LEU B 6 -15.962 -8.001 -1.707 1.00 1.41 N ATOM 1711 CA LEU B 6 -15.477 -6.733 -2.233 1.00 1.29 C ATOM 1712 C LEU B 6 -15.010 -6.902 -3.697 1.00 1.27 C ATOM 1713 O LEU B 6 -14.981 -8.031 -4.185 1.00 1.73 O ATOM 1714 CB LEU B 6 -14.409 -6.202 -1.256 1.00 1.58 C ATOM 1715 CG LEU B 6 -13.480 -7.242 -0.588 1.00 1.60 C ATOM 1716 CD1 LEU B 6 -12.691 -8.055 -1.616 1.00 2.57 C ATOM 1717 CD2 LEU B 6 -12.491 -6.544 0.344 1.00 2.90 C ATOM 0 HA LEU B 6 -16.262 -5.979 -2.290 1.00 1.29 H new ATOM 0 HB2 LEU B 6 -13.785 -5.488 -1.794 1.00 1.58 H new ATOM 0 HB3 LEU B 6 -14.919 -5.649 -0.467 1.00 1.58 H new ATOM 0 HG LEU B 6 -14.120 -7.922 -0.026 1.00 1.60 H new ATOM 0 HD11 LEU B 6 -12.053 -8.772 -1.100 1.00 2.57 H new ATOM 0 HD12 LEU B 6 -13.384 -8.588 -2.267 1.00 2.57 H new ATOM 0 HD13 LEU B 6 -12.074 -7.384 -2.214 1.00 2.57 H new ATOM 0 HD21 LEU B 6 -11.842 -7.287 0.808 1.00 2.90 H new ATOM 0 HD22 LEU B 6 -11.886 -5.841 -0.228 1.00 2.90 H new ATOM 0 HD23 LEU B 6 -13.038 -6.006 1.118 1.00 2.90 H new ATOM 1729 N THR B 7 -14.738 -5.805 -4.423 1.00 1.13 N ATOM 1730 CA THR B 7 -14.483 -5.811 -5.874 1.00 1.16 C ATOM 1731 C THR B 7 -13.013 -6.073 -6.227 1.00 1.15 C ATOM 1732 O THR B 7 -12.203 -6.346 -5.358 1.00 1.92 O ATOM 1733 CB THR B 7 -14.983 -4.510 -6.529 1.00 1.22 C ATOM 1734 OG1 THR B 7 -15.161 -4.730 -7.918 1.00 1.62 O ATOM 1735 CG2 THR B 7 -14.041 -3.318 -6.315 1.00 1.14 C ATOM 0 H THR B 7 -14.688 -4.873 -4.011 1.00 1.13 H new ATOM 0 HA THR B 7 -15.051 -6.648 -6.281 1.00 1.16 H new ATOM 0 HB THR B 7 -15.926 -4.251 -6.048 1.00 1.22 H new ATOM 0 HG1 THR B 7 -14.549 -4.154 -8.422 1.00 1.62 H new ATOM 0 HG21 THR B 7 -14.455 -2.435 -6.803 1.00 1.14 H new ATOM 0 HG22 THR B 7 -13.934 -3.126 -5.247 1.00 1.14 H new ATOM 0 HG23 THR B 7 -13.064 -3.545 -6.743 1.00 1.14 H new ATOM 1743 N GLU B 8 -12.655 -5.932 -7.508 1.00 1.14 N ATOM 1744 CA GLU B 8 -11.368 -6.309 -8.080 1.00 1.10 C ATOM 1745 C GLU B 8 -10.181 -5.659 -7.356 1.00 0.99 C ATOM 1746 O GLU B 8 -9.386 -6.345 -6.713 1.00 0.98 O ATOM 1747 CB GLU B 8 -11.410 -5.960 -9.571 1.00 1.27 C ATOM 1748 CG GLU B 8 -10.260 -6.582 -10.363 1.00 1.49 C ATOM 1749 CD GLU B 8 -10.403 -6.278 -11.852 1.00 1.83 C ATOM 1750 OE1 GLU B 8 -11.054 -5.251 -12.160 1.00 2.19 O ATOM 1751 OE2 GLU B 8 -9.867 -7.071 -12.651 1.00 2.33 O ATOM 0 H GLU B 8 -13.287 -5.533 -8.202 1.00 1.14 H new ATOM 0 HA GLU B 8 -11.207 -7.379 -7.951 1.00 1.10 H new ATOM 0 HB2 GLU B 8 -12.357 -6.298 -9.991 1.00 1.27 H new ATOM 0 HB3 GLU B 8 -11.379 -4.877 -9.686 1.00 1.27 H new ATOM 0 HG2 GLU B 8 -9.309 -6.195 -9.998 1.00 1.49 H new ATOM 0 HG3 GLU B 8 -10.246 -7.661 -10.207 1.00 1.49 H new ATOM 1758 N LEU B 9 -10.037 -4.332 -7.448 1.00 0.96 N ATOM 1759 CA LEU B 9 -8.984 -3.629 -6.724 1.00 0.92 C ATOM 1760 C LEU B 9 -9.015 -3.965 -5.233 1.00 0.80 C ATOM 1761 O LEU B 9 -7.974 -4.189 -4.619 1.00 0.76 O ATOM 1762 CB LEU B 9 -9.088 -2.116 -6.954 1.00 0.96 C ATOM 1763 CG LEU B 9 -8.422 -1.716 -8.279 1.00 1.17 C ATOM 1764 CD1 LEU B 9 -8.823 -0.287 -8.649 1.00 1.20 C ATOM 1765 CD2 LEU B 9 -6.890 -1.753 -8.152 1.00 1.42 C ATOM 0 H LEU B 9 -10.635 -3.731 -8.015 1.00 0.96 H new ATOM 0 HA LEU B 9 -8.024 -3.966 -7.114 1.00 0.92 H new ATOM 0 HB2 LEU B 9 -10.136 -1.817 -6.964 1.00 0.96 H new ATOM 0 HB3 LEU B 9 -8.613 -1.585 -6.129 1.00 0.96 H new ATOM 0 HG LEU B 9 -8.748 -2.422 -9.043 1.00 1.17 H new ATOM 0 HD11 LEU B 9 -8.348 -0.008 -9.590 1.00 1.20 H new ATOM 0 HD12 LEU B 9 -9.906 -0.230 -8.758 1.00 1.20 H new ATOM 0 HD13 LEU B 9 -8.501 0.396 -7.863 1.00 1.20 H new ATOM 0 HD21 LEU B 9 -6.439 -1.466 -9.102 1.00 1.42 H new ATOM 0 HD22 LEU B 9 -6.572 -1.058 -7.375 1.00 1.42 H new ATOM 0 HD23 LEU B 9 -6.571 -2.761 -7.889 1.00 1.42 H new ATOM 1777 N GLU B 10 -10.216 -4.015 -4.656 1.00 0.78 N ATOM 1778 CA GLU B 10 -10.395 -4.375 -3.265 1.00 0.69 C ATOM 1779 C GLU B 10 -9.794 -5.774 -2.987 1.00 0.85 C ATOM 1780 O GLU B 10 -9.084 -5.941 -1.998 1.00 1.24 O ATOM 1781 CB GLU B 10 -11.870 -4.206 -2.869 1.00 0.79 C ATOM 1782 CG GLU B 10 -12.398 -2.767 -3.056 1.00 1.46 C ATOM 1783 CD GLU B 10 -13.896 -2.571 -2.767 1.00 2.10 C ATOM 1784 OE1 GLU B 10 -14.651 -3.550 -2.943 1.00 2.73 O ATOM 1785 OE2 GLU B 10 -14.296 -1.426 -2.458 1.00 3.17 O ATOM 0 H GLU B 10 -11.086 -3.806 -5.146 1.00 0.78 H new ATOM 0 HA GLU B 10 -9.839 -3.699 -2.616 1.00 0.69 H new ATOM 0 HB2 GLU B 10 -12.478 -4.888 -3.464 1.00 0.79 H new ATOM 0 HB3 GLU B 10 -11.993 -4.497 -1.826 1.00 0.79 H new ATOM 0 HG2 GLU B 10 -11.830 -2.102 -2.405 1.00 1.46 H new ATOM 0 HG3 GLU B 10 -12.199 -2.456 -4.082 1.00 1.46 H new ATOM 1792 N GLU B 11 -9.993 -6.761 -3.871 1.00 0.76 N ATOM 1793 CA GLU B 11 -9.395 -8.092 -3.776 1.00 0.74 C ATOM 1794 C GLU B 11 -7.871 -7.990 -3.836 1.00 0.73 C ATOM 1795 O GLU B 11 -7.174 -8.588 -3.018 1.00 0.82 O ATOM 1796 CB GLU B 11 -9.865 -9.014 -4.918 1.00 0.83 C ATOM 1797 CG GLU B 11 -11.374 -9.303 -4.954 1.00 1.86 C ATOM 1798 CD GLU B 11 -11.701 -10.697 -4.433 1.00 2.90 C ATOM 1799 OE1 GLU B 11 -11.548 -11.645 -5.233 1.00 3.36 O ATOM 1800 OE2 GLU B 11 -12.084 -10.794 -3.248 1.00 4.03 O ATOM 0 H GLU B 11 -10.590 -6.649 -4.691 1.00 0.76 H new ATOM 0 HA GLU B 11 -9.714 -8.518 -2.825 1.00 0.74 H new ATOM 0 HB2 GLU B 11 -9.576 -8.564 -5.868 1.00 0.83 H new ATOM 0 HB3 GLU B 11 -9.333 -9.962 -4.839 1.00 0.83 H new ATOM 0 HG2 GLU B 11 -11.900 -8.560 -4.355 1.00 1.86 H new ATOM 0 HG3 GLU B 11 -11.738 -9.204 -5.977 1.00 1.86 H new ATOM 1807 N SER B 12 -7.334 -7.263 -4.822 1.00 0.76 N ATOM 1808 CA SER B 12 -5.892 -7.211 -5.019 1.00 0.88 C ATOM 1809 C SER B 12 -5.177 -6.492 -3.869 1.00 0.93 C ATOM 1810 O SER B 12 -4.014 -6.798 -3.608 1.00 1.17 O ATOM 1811 CB SER B 12 -5.530 -6.658 -6.399 1.00 1.19 C ATOM 1812 OG SER B 12 -6.056 -5.365 -6.592 1.00 1.55 O ATOM 0 H SER B 12 -7.875 -6.710 -5.487 1.00 0.76 H new ATOM 0 HA SER B 12 -5.522 -8.236 -4.998 1.00 0.88 H new ATOM 0 HB2 SER B 12 -4.446 -6.631 -6.508 1.00 1.19 H new ATOM 0 HB3 SER B 12 -5.911 -7.326 -7.171 1.00 1.19 H new ATOM 0 HG SER B 12 -6.600 -5.114 -5.816 1.00 1.55 H new ATOM 1818 N ILE B 13 -5.846 -5.582 -3.151 1.00 0.85 N ATOM 1819 CA ILE B 13 -5.319 -5.103 -1.875 1.00 0.94 C ATOM 1820 C ILE B 13 -5.613 -6.100 -0.740 1.00 0.90 C ATOM 1821 O ILE B 13 -4.784 -6.256 0.154 1.00 0.97 O ATOM 1822 CB ILE B 13 -5.659 -3.622 -1.602 1.00 1.07 C ATOM 1823 CG1 ILE B 13 -7.155 -3.284 -1.541 1.00 0.86 C ATOM 1824 CG2 ILE B 13 -5.016 -2.768 -2.708 1.00 1.26 C ATOM 1825 CD1 ILE B 13 -7.781 -3.500 -0.166 1.00 0.98 C ATOM 0 H ILE B 13 -6.737 -5.171 -3.428 1.00 0.85 H new ATOM 0 HA ILE B 13 -4.231 -5.080 -1.933 1.00 0.94 H new ATOM 0 HB ILE B 13 -5.268 -3.408 -0.607 1.00 1.07 H new ATOM 0 HG12 ILE B 13 -7.295 -2.243 -1.834 1.00 0.86 H new ATOM 0 HG13 ILE B 13 -7.686 -3.895 -2.271 1.00 0.86 H new ATOM 0 HG21 ILE B 13 -5.244 -1.716 -2.534 1.00 1.26 H new ATOM 0 HG22 ILE B 13 -3.936 -2.912 -2.697 1.00 1.26 H new ATOM 0 HG23 ILE B 13 -5.412 -3.070 -3.678 1.00 1.26 H new ATOM 0 HD11 ILE B 13 -8.839 -3.240 -0.203 1.00 0.98 H new ATOM 0 HD12 ILE B 13 -7.674 -4.546 0.122 1.00 0.98 H new ATOM 0 HD13 ILE B 13 -7.277 -2.869 0.566 1.00 0.98 H new ATOM 1837 N GLU B 14 -6.736 -6.830 -0.776 1.00 0.82 N ATOM 1838 CA GLU B 14 -7.012 -7.859 0.224 1.00 0.82 C ATOM 1839 C GLU B 14 -5.903 -8.917 0.237 1.00 0.79 C ATOM 1840 O GLU B 14 -5.324 -9.153 1.289 1.00 0.82 O ATOM 1841 CB GLU B 14 -8.407 -8.488 0.061 1.00 0.87 C ATOM 1842 CG GLU B 14 -8.988 -8.965 1.407 1.00 1.01 C ATOM 1843 CD GLU B 14 -8.123 -9.990 2.130 1.00 1.70 C ATOM 1844 OE1 GLU B 14 -7.846 -11.037 1.510 1.00 2.59 O ATOM 1845 OE2 GLU B 14 -7.747 -9.705 3.289 1.00 2.97 O ATOM 0 H GLU B 14 -7.462 -6.725 -1.485 1.00 0.82 H new ATOM 0 HA GLU B 14 -7.019 -7.368 1.197 1.00 0.82 H new ATOM 0 HB2 GLU B 14 -9.083 -7.760 -0.387 1.00 0.87 H new ATOM 0 HB3 GLU B 14 -8.346 -9.332 -0.627 1.00 0.87 H new ATOM 0 HG2 GLU B 14 -9.128 -8.101 2.057 1.00 1.01 H new ATOM 0 HG3 GLU B 14 -9.974 -9.396 1.233 1.00 1.01 H new ATOM 1852 N THR B 15 -5.560 -9.530 -0.904 1.00 0.77 N ATOM 1853 CA THR B 15 -4.599 -10.641 -0.941 1.00 0.77 C ATOM 1854 C THR B 15 -3.319 -10.310 -0.146 1.00 0.75 C ATOM 1855 O THR B 15 -2.863 -11.076 0.703 1.00 0.77 O ATOM 1856 CB THR B 15 -4.350 -11.122 -2.382 1.00 0.81 C ATOM 1857 OG1 THR B 15 -3.676 -12.364 -2.392 1.00 1.18 O ATOM 1858 CG2 THR B 15 -3.606 -10.125 -3.267 1.00 0.74 C ATOM 0 H THR B 15 -5.935 -9.274 -1.817 1.00 0.77 H new ATOM 0 HA THR B 15 -5.038 -11.496 -0.427 1.00 0.77 H new ATOM 0 HB THR B 15 -5.345 -11.229 -2.815 1.00 0.81 H new ATOM 0 HG1 THR B 15 -2.873 -12.305 -1.833 1.00 1.18 H new ATOM 0 HG21 THR B 15 -3.476 -10.549 -4.263 1.00 0.74 H new ATOM 0 HG22 THR B 15 -4.181 -9.202 -3.338 1.00 0.74 H new ATOM 0 HG23 THR B 15 -2.629 -9.912 -2.833 1.00 0.74 H new ATOM 1866 N VAL B 16 -2.789 -9.103 -0.340 1.00 0.78 N ATOM 1867 CA VAL B 16 -1.608 -8.655 0.384 1.00 0.78 C ATOM 1868 C VAL B 16 -1.914 -8.411 1.865 1.00 0.78 C ATOM 1869 O VAL B 16 -1.057 -8.671 2.706 1.00 0.79 O ATOM 1870 CB VAL B 16 -0.908 -7.463 -0.292 1.00 0.81 C ATOM 1871 CG1 VAL B 16 -0.394 -7.855 -1.679 1.00 0.90 C ATOM 1872 CG2 VAL B 16 -1.783 -6.215 -0.422 1.00 0.89 C ATOM 0 H VAL B 16 -3.163 -8.418 -0.996 1.00 0.78 H new ATOM 0 HA VAL B 16 -0.885 -9.470 0.345 1.00 0.78 H new ATOM 0 HB VAL B 16 -0.080 -7.206 0.369 1.00 0.81 H new ATOM 0 HG11 VAL B 16 0.098 -6.998 -2.140 1.00 0.90 H new ATOM 0 HG12 VAL B 16 0.318 -8.675 -1.585 1.00 0.90 H new ATOM 0 HG13 VAL B 16 -1.231 -8.171 -2.301 1.00 0.90 H new ATOM 0 HG21 VAL B 16 -1.215 -5.422 -0.908 1.00 0.89 H new ATOM 0 HG22 VAL B 16 -2.664 -6.449 -1.019 1.00 0.89 H new ATOM 0 HG23 VAL B 16 -2.094 -5.884 0.569 1.00 0.89 H new ATOM 1882 N VAL B 17 -3.119 -7.941 2.207 1.00 0.80 N ATOM 1883 CA VAL B 17 -3.561 -7.807 3.590 1.00 0.81 C ATOM 1884 C VAL B 17 -3.626 -9.181 4.260 1.00 0.79 C ATOM 1885 O VAL B 17 -3.051 -9.353 5.330 1.00 0.85 O ATOM 1886 CB VAL B 17 -4.898 -7.052 3.676 1.00 0.85 C ATOM 1887 CG1 VAL B 17 -5.499 -7.088 5.090 1.00 0.89 C ATOM 1888 CG2 VAL B 17 -4.694 -5.595 3.247 1.00 0.94 C ATOM 0 H VAL B 17 -3.815 -7.643 1.524 1.00 0.80 H new ATOM 0 HA VAL B 17 -2.831 -7.209 4.135 1.00 0.81 H new ATOM 0 HB VAL B 17 -5.598 -7.552 3.007 1.00 0.85 H new ATOM 0 HG11 VAL B 17 -6.442 -6.541 5.099 1.00 0.89 H new ATOM 0 HG12 VAL B 17 -5.677 -8.123 5.384 1.00 0.89 H new ATOM 0 HG13 VAL B 17 -4.805 -6.626 5.792 1.00 0.89 H new ATOM 0 HG21 VAL B 17 -5.642 -5.061 3.309 1.00 0.94 H new ATOM 0 HG22 VAL B 17 -3.967 -5.120 3.906 1.00 0.94 H new ATOM 0 HG23 VAL B 17 -4.327 -5.566 2.221 1.00 0.94 H new ATOM 1898 N THR B 18 -4.308 -10.165 3.676 1.00 0.75 N ATOM 1899 CA THR B 18 -4.378 -11.497 4.270 1.00 0.78 C ATOM 1900 C THR B 18 -2.972 -12.109 4.391 1.00 0.77 C ATOM 1901 O THR B 18 -2.620 -12.639 5.449 1.00 0.81 O ATOM 1902 CB THR B 18 -5.409 -12.382 3.547 1.00 0.88 C ATOM 1903 OG1 THR B 18 -5.509 -13.641 4.181 1.00 0.92 O ATOM 1904 CG2 THR B 18 -5.096 -12.578 2.068 1.00 1.04 C ATOM 0 H THR B 18 -4.817 -10.065 2.798 1.00 0.75 H new ATOM 0 HA THR B 18 -4.752 -11.419 5.291 1.00 0.78 H new ATOM 0 HB THR B 18 -6.362 -11.856 3.608 1.00 0.88 H new ATOM 0 HG1 THR B 18 -6.169 -14.192 3.711 1.00 0.92 H new ATOM 0 HG21 THR B 18 -5.859 -13.211 1.615 1.00 1.04 H new ATOM 0 HG22 THR B 18 -5.083 -11.610 1.567 1.00 1.04 H new ATOM 0 HG23 THR B 18 -4.121 -13.054 1.962 1.00 1.04 H new ATOM 1912 N THR B 19 -2.126 -11.976 3.363 1.00 0.77 N ATOM 1913 CA THR B 19 -0.737 -12.411 3.425 1.00 0.82 C ATOM 1914 C THR B 19 0.002 -11.714 4.581 1.00 0.85 C ATOM 1915 O THR B 19 0.626 -12.373 5.415 1.00 0.92 O ATOM 1916 CB THR B 19 -0.113 -12.221 2.035 1.00 0.96 C ATOM 1917 OG1 THR B 19 -0.814 -13.100 1.180 1.00 1.09 O ATOM 1918 CG2 THR B 19 1.374 -12.578 1.983 1.00 0.94 C ATOM 0 H THR B 19 -2.390 -11.564 2.468 1.00 0.77 H new ATOM 0 HA THR B 19 -0.656 -13.472 3.663 1.00 0.82 H new ATOM 0 HB THR B 19 -0.187 -11.172 1.750 1.00 0.96 H new ATOM 0 HG1 THR B 19 -1.076 -12.623 0.365 1.00 1.09 H new ATOM 0 HG21 THR B 19 1.751 -12.421 0.972 1.00 0.94 H new ATOM 0 HG22 THR B 19 1.925 -11.945 2.678 1.00 0.94 H new ATOM 0 HG23 THR B 19 1.507 -13.623 2.261 1.00 0.94 H new ATOM 1926 N PHE B 20 -0.112 -10.387 4.683 1.00 0.82 N ATOM 1927 CA PHE B 20 0.361 -9.632 5.840 1.00 0.87 C ATOM 1928 C PHE B 20 -0.134 -10.283 7.134 1.00 0.88 C ATOM 1929 O PHE B 20 0.666 -10.585 8.012 1.00 0.92 O ATOM 1930 CB PHE B 20 -0.067 -8.157 5.731 1.00 0.92 C ATOM 1931 CG PHE B 20 -0.409 -7.464 7.040 1.00 1.52 C ATOM 1932 CD1 PHE B 20 0.584 -7.255 8.013 1.00 2.45 C ATOM 1933 CD2 PHE B 20 -1.749 -7.155 7.344 1.00 2.85 C ATOM 1934 CE1 PHE B 20 0.242 -6.724 9.269 1.00 3.40 C ATOM 1935 CE2 PHE B 20 -2.098 -6.691 8.620 1.00 3.91 C ATOM 1936 CZ PHE B 20 -1.102 -6.476 9.586 1.00 3.88 C ATOM 0 H PHE B 20 -0.537 -9.806 3.960 1.00 0.82 H new ATOM 0 HA PHE B 20 1.451 -9.650 5.861 1.00 0.87 H new ATOM 0 HB2 PHE B 20 0.736 -7.601 5.248 1.00 0.92 H new ATOM 0 HB3 PHE B 20 -0.935 -8.099 5.074 1.00 0.92 H new ATOM 0 HD1 PHE B 20 1.612 -7.503 7.795 1.00 2.45 H new ATOM 0 HD2 PHE B 20 -2.512 -7.276 6.590 1.00 2.85 H new ATOM 0 HE1 PHE B 20 1.015 -6.507 9.991 1.00 3.40 H new ATOM 0 HE2 PHE B 20 -3.133 -6.499 8.860 1.00 3.91 H new ATOM 0 HZ PHE B 20 -1.370 -6.121 10.570 1.00 3.88 H new ATOM 1946 N PHE B 21 -1.442 -10.504 7.247 1.00 0.88 N ATOM 1947 CA PHE B 21 -2.093 -10.982 8.454 1.00 0.91 C ATOM 1948 C PHE B 21 -1.531 -12.338 8.878 1.00 0.94 C ATOM 1949 O PHE B 21 -1.179 -12.523 10.044 1.00 0.97 O ATOM 1950 CB PHE B 21 -3.609 -11.031 8.228 1.00 1.02 C ATOM 1951 CG PHE B 21 -4.441 -11.296 9.470 1.00 1.09 C ATOM 1952 CD1 PHE B 21 -4.495 -10.331 10.492 1.00 1.81 C ATOM 1953 CD2 PHE B 21 -5.286 -12.420 9.527 1.00 2.28 C ATOM 1954 CE1 PHE B 21 -5.434 -10.455 11.531 1.00 2.08 C ATOM 1955 CE2 PHE B 21 -6.228 -12.542 10.563 1.00 2.54 C ATOM 1956 CZ PHE B 21 -6.320 -11.546 11.551 1.00 1.87 C ATOM 0 H PHE B 21 -2.092 -10.350 6.477 1.00 0.88 H new ATOM 0 HA PHE B 21 -1.891 -10.292 9.273 1.00 0.91 H new ATOM 0 HB2 PHE B 21 -3.926 -10.083 7.794 1.00 1.02 H new ATOM 0 HB3 PHE B 21 -3.826 -11.806 7.493 1.00 1.02 H new ATOM 0 HD1 PHE B 21 -3.814 -9.493 10.479 1.00 1.81 H new ATOM 0 HD2 PHE B 21 -5.211 -13.190 8.774 1.00 2.28 H new ATOM 0 HE1 PHE B 21 -5.475 -9.712 12.314 1.00 2.08 H new ATOM 0 HE2 PHE B 21 -6.881 -13.401 10.600 1.00 2.54 H new ATOM 0 HZ PHE B 21 -7.070 -11.619 12.324 1.00 1.87 H new ATOM 1966 N THR B 22 -1.413 -13.289 7.946 1.00 0.99 N ATOM 1967 CA THR B 22 -0.849 -14.585 8.299 1.00 1.08 C ATOM 1968 C THR B 22 0.596 -14.411 8.786 1.00 1.02 C ATOM 1969 O THR B 22 0.929 -14.876 9.870 1.00 1.09 O ATOM 1970 CB THR B 22 -1.069 -15.652 7.212 1.00 1.21 C ATOM 1971 OG1 THR B 22 -0.889 -16.936 7.773 1.00 2.63 O ATOM 1972 CG2 THR B 22 -0.163 -15.526 5.988 1.00 2.44 C ATOM 0 H THR B 22 -1.693 -13.187 6.970 1.00 0.99 H new ATOM 0 HA THR B 22 -1.399 -14.999 9.144 1.00 1.08 H new ATOM 0 HB THR B 22 -2.087 -15.495 6.855 1.00 1.21 H new ATOM 0 HG1 THR B 22 -1.030 -17.617 7.083 1.00 2.63 H new ATOM 0 HG21 THR B 22 -0.395 -16.322 5.280 1.00 2.44 H new ATOM 0 HG22 THR B 22 -0.326 -14.559 5.512 1.00 2.44 H new ATOM 0 HG23 THR B 22 0.879 -15.607 6.297 1.00 2.44 H new ATOM 1980 N PHE B 23 1.441 -13.653 8.075 1.00 1.03 N ATOM 1981 CA PHE B 23 2.780 -13.361 8.596 1.00 1.04 C ATOM 1982 C PHE B 23 2.721 -12.639 9.947 1.00 0.97 C ATOM 1983 O PHE B 23 3.550 -12.862 10.823 1.00 1.14 O ATOM 1984 CB PHE B 23 3.612 -12.571 7.576 1.00 1.12 C ATOM 1985 CG PHE B 23 4.333 -13.455 6.578 1.00 1.25 C ATOM 1986 CD1 PHE B 23 5.608 -13.964 6.895 1.00 2.34 C ATOM 1987 CD2 PHE B 23 3.689 -13.872 5.400 1.00 2.34 C ATOM 1988 CE1 PHE B 23 6.229 -14.889 6.038 1.00 2.79 C ATOM 1989 CE2 PHE B 23 4.307 -14.800 4.547 1.00 2.87 C ATOM 1990 CZ PHE B 23 5.576 -15.310 4.867 1.00 2.58 C ATOM 0 H PHE B 23 1.230 -13.242 7.165 1.00 1.03 H new ATOM 0 HA PHE B 23 3.278 -14.316 8.764 1.00 1.04 H new ATOM 0 HB2 PHE B 23 2.958 -11.885 7.037 1.00 1.12 H new ATOM 0 HB3 PHE B 23 4.344 -11.963 8.107 1.00 1.12 H new ATOM 0 HD1 PHE B 23 6.108 -13.643 7.797 1.00 2.34 H new ATOM 0 HD2 PHE B 23 2.715 -13.477 5.150 1.00 2.34 H new ATOM 0 HE1 PHE B 23 7.208 -15.276 6.279 1.00 2.79 H new ATOM 0 HE2 PHE B 23 3.807 -15.122 3.645 1.00 2.87 H new ATOM 0 HZ PHE B 23 6.050 -16.026 4.213 1.00 2.58 H new ATOM 2000 N ALA B 24 1.732 -11.775 10.147 1.00 0.83 N ATOM 2001 CA ALA B 24 1.561 -11.026 11.372 1.00 0.81 C ATOM 2002 C ALA B 24 1.255 -11.979 12.513 1.00 0.95 C ATOM 2003 O ALA B 24 1.681 -11.714 13.636 1.00 1.02 O ATOM 2004 CB ALA B 24 0.478 -9.952 11.234 1.00 0.79 C ATOM 0 H ALA B 24 1.018 -11.577 9.446 1.00 0.83 H new ATOM 0 HA ALA B 24 2.492 -10.503 11.590 1.00 0.81 H new ATOM 0 HB1 ALA B 24 0.380 -9.411 12.175 1.00 0.79 H new ATOM 0 HB2 ALA B 24 0.755 -9.255 10.443 1.00 0.79 H new ATOM 0 HB3 ALA B 24 -0.473 -10.424 10.986 1.00 0.79 H new ATOM 2010 N ARG B 25 0.524 -13.068 12.261 1.00 1.01 N ATOM 2011 CA ARG B 25 0.156 -13.998 13.318 1.00 1.10 C ATOM 2012 C ARG B 25 1.352 -14.697 13.942 1.00 1.23 C ATOM 2013 O ARG B 25 1.163 -15.333 14.978 1.00 1.47 O ATOM 2014 CB ARG B 25 -0.921 -15.006 12.872 1.00 1.16 C ATOM 2015 CG ARG B 25 -0.401 -16.233 12.097 1.00 1.63 C ATOM 2016 CD ARG B 25 -0.605 -17.575 12.816 1.00 1.77 C ATOM 2017 NE ARG B 25 0.301 -17.738 13.970 1.00 2.18 N ATOM 2018 CZ ARG B 25 0.690 -18.910 14.494 1.00 2.97 C ATOM 2019 NH1 ARG B 25 0.113 -20.045 14.085 1.00 3.30 N ATOM 2020 NH2 ARG B 25 1.650 -18.951 15.422 1.00 4.05 N ATOM 0 H ARG B 25 0.179 -13.322 11.335 1.00 1.01 H new ATOM 0 HA ARG B 25 -0.286 -13.383 14.102 1.00 1.10 H new ATOM 0 HB2 ARG B 25 -1.455 -15.356 13.756 1.00 1.16 H new ATOM 0 HB3 ARG B 25 -1.646 -14.484 12.247 1.00 1.16 H new ATOM 0 HG2 ARG B 25 -0.901 -16.274 11.129 1.00 1.63 H new ATOM 0 HG3 ARG B 25 0.663 -16.099 11.901 1.00 1.63 H new ATOM 0 HD2 ARG B 25 -1.638 -17.649 13.155 1.00 1.77 H new ATOM 0 HD3 ARG B 25 -0.442 -18.390 12.111 1.00 1.77 H new ATOM 0 HE ARG B 25 0.661 -16.889 14.405 1.00 2.18 H new ATOM 0 HH11 ARG B 25 -0.620 -20.018 13.377 1.00 3.30 H new ATOM 0 HH12 ARG B 25 0.406 -20.938 14.481 1.00 3.30 H new ATOM 0 HH21 ARG B 25 2.092 -18.087 15.737 1.00 4.05 H new ATOM 0 HH22 ARG B 25 1.941 -19.846 15.816 1.00 4.05 H new ATOM 2034 N GLN B 26 2.513 -14.716 13.276 1.00 1.17 N ATOM 2035 CA GLN B 26 3.496 -15.747 13.527 1.00 1.30 C ATOM 2036 C GLN B 26 3.810 -15.966 15.015 1.00 1.48 C ATOM 2037 O GLN B 26 3.508 -17.046 15.525 1.00 1.66 O ATOM 2038 CB GLN B 26 4.775 -15.359 12.776 1.00 1.18 C ATOM 2039 CG GLN B 26 5.511 -16.516 12.129 1.00 1.39 C ATOM 2040 CD GLN B 26 4.956 -16.881 10.757 1.00 1.61 C ATOM 2041 OE1 GLN B 26 3.761 -17.127 10.612 1.00 1.88 O ATOM 2042 NE2 GLN B 26 5.810 -16.919 9.741 1.00 2.15 N ATOM 0 H GLN B 26 2.782 -14.032 12.569 1.00 1.17 H new ATOM 0 HA GLN B 26 3.083 -16.693 13.176 1.00 1.30 H new ATOM 0 HB2 GLN B 26 4.520 -14.633 12.004 1.00 1.18 H new ATOM 0 HB3 GLN B 26 5.451 -14.861 13.472 1.00 1.18 H new ATOM 0 HG2 GLN B 26 6.566 -16.260 12.032 1.00 1.39 H new ATOM 0 HG3 GLN B 26 5.453 -17.387 12.782 1.00 1.39 H new ATOM 0 HE21 GLN B 26 6.796 -16.709 9.896 1.00 2.15 H new ATOM 0 HE22 GLN B 26 5.480 -17.158 8.806 1.00 2.15 H new ATOM 2051 N GLU B 27 4.425 -14.991 15.696 1.00 1.50 N ATOM 2052 CA GLU B 27 4.877 -15.228 17.063 1.00 1.66 C ATOM 2053 C GLU B 27 3.844 -14.825 18.124 1.00 1.68 C ATOM 2054 O GLU B 27 3.072 -15.650 18.607 1.00 1.91 O ATOM 2055 CB GLU B 27 6.193 -14.449 17.246 1.00 1.80 C ATOM 2056 CG GLU B 27 7.363 -14.977 16.409 1.00 2.10 C ATOM 2057 CD GLU B 27 8.572 -14.062 16.597 1.00 2.55 C ATOM 2058 OE1 GLU B 27 8.396 -12.845 16.357 1.00 2.76 O ATOM 2059 OE2 GLU B 27 9.616 -14.578 17.048 1.00 3.30 O ATOM 0 H GLU B 27 4.615 -14.057 15.332 1.00 1.50 H new ATOM 0 HA GLU B 27 5.025 -16.298 17.209 1.00 1.66 H new ATOM 0 HB2 GLU B 27 6.021 -13.404 16.989 1.00 1.80 H new ATOM 0 HB3 GLU B 27 6.474 -14.476 18.299 1.00 1.80 H new ATOM 0 HG2 GLU B 27 7.612 -15.994 16.712 1.00 2.10 H new ATOM 0 HG3 GLU B 27 7.083 -15.017 15.356 1.00 2.10 H new ATOM 2066 N GLY B 28 3.772 -13.519 18.414 1.00 1.79 N ATOM 2067 CA GLY B 28 2.692 -12.787 19.049 1.00 1.88 C ATOM 2068 C GLY B 28 1.751 -12.177 18.024 1.00 1.44 C ATOM 2069 O GLY B 28 2.155 -11.992 16.873 1.00 1.53 O ATOM 0 H GLY B 28 4.548 -12.898 18.184 1.00 1.79 H new ATOM 0 HA2 GLY B 28 2.134 -13.456 19.703 1.00 1.88 H new ATOM 0 HA3 GLY B 28 3.106 -11.999 19.678 1.00 1.88 H new ATOM 2073 N ARG B 29 0.615 -11.646 18.498 1.00 1.36 N ATOM 2074 CA ARG B 29 -0.065 -10.480 17.929 1.00 1.29 C ATOM 2075 C ARG B 29 -0.210 -10.534 16.404 1.00 1.21 C ATOM 2076 O ARG B 29 0.707 -10.118 15.679 1.00 1.15 O ATOM 2077 CB ARG B 29 0.689 -9.199 18.323 1.00 1.45 C ATOM 2078 CG ARG B 29 0.452 -8.741 19.769 1.00 1.95 C ATOM 2079 CD ARG B 29 -0.689 -7.715 19.814 1.00 1.66 C ATOM 2080 NE ARG B 29 -0.995 -7.290 21.188 1.00 2.29 N ATOM 2081 CZ ARG B 29 -0.407 -6.280 21.856 1.00 2.75 C ATOM 2082 NH1 ARG B 29 0.637 -5.625 21.338 1.00 3.39 N ATOM 2083 NH2 ARG B 29 -0.879 -5.921 23.055 1.00 3.56 N ATOM 0 H ARG B 29 0.132 -12.029 19.311 1.00 1.36 H new ATOM 0 HA ARG B 29 -1.074 -10.482 18.340 1.00 1.29 H new ATOM 0 HB2 ARG B 29 1.757 -9.361 18.177 1.00 1.45 H new ATOM 0 HB3 ARG B 29 0.393 -8.396 17.648 1.00 1.45 H new ATOM 0 HG2 ARG B 29 0.206 -9.599 20.395 1.00 1.95 H new ATOM 0 HG3 ARG B 29 1.364 -8.302 20.174 1.00 1.95 H new ATOM 0 HD2 ARG B 29 -0.417 -6.844 19.217 1.00 1.66 H new ATOM 0 HD3 ARG B 29 -1.582 -8.146 19.361 1.00 1.66 H new ATOM 0 HE ARG B 29 -1.721 -7.809 21.681 1.00 2.29 H new ATOM 0 HH11 ARG B 29 1.001 -5.888 20.422 1.00 3.39 H new ATOM 0 HH12 ARG B 29 1.070 -4.862 21.859 1.00 3.39 H new ATOM 0 HH21 ARG B 29 -1.678 -6.411 23.456 1.00 3.56 H new ATOM 0 HH22 ARG B 29 -0.440 -5.157 23.568 1.00 3.56 H new ATOM 2097 N LYS B 30 -1.375 -10.979 15.924 1.00 1.26 N ATOM 2098 CA LYS B 30 -1.733 -10.962 14.510 1.00 1.20 C ATOM 2099 C LYS B 30 -2.128 -9.544 14.052 1.00 1.13 C ATOM 2100 O LYS B 30 -3.198 -9.329 13.490 1.00 1.56 O ATOM 2101 CB LYS B 30 -2.811 -12.026 14.221 1.00 1.45 C ATOM 2102 CG LYS B 30 -4.150 -11.845 14.955 1.00 1.73 C ATOM 2103 CD LYS B 30 -5.047 -13.061 14.687 1.00 2.12 C ATOM 2104 CE LYS B 30 -6.410 -12.894 15.374 1.00 2.59 C ATOM 2105 NZ LYS B 30 -7.288 -14.068 15.168 1.00 3.56 N ATOM 0 H LYS B 30 -2.106 -11.367 16.521 1.00 1.26 H new ATOM 0 HA LYS B 30 -0.861 -11.230 13.914 1.00 1.20 H new ATOM 0 HB2 LYS B 30 -3.006 -12.036 13.149 1.00 1.45 H new ATOM 0 HB3 LYS B 30 -2.406 -13.004 14.480 1.00 1.45 H new ATOM 0 HG2 LYS B 30 -3.978 -11.735 16.026 1.00 1.73 H new ATOM 0 HG3 LYS B 30 -4.643 -10.934 14.616 1.00 1.73 H new ATOM 0 HD2 LYS B 30 -5.188 -13.185 13.613 1.00 2.12 H new ATOM 0 HD3 LYS B 30 -4.560 -13.966 15.051 1.00 2.12 H new ATOM 0 HE2 LYS B 30 -6.260 -12.738 16.442 1.00 2.59 H new ATOM 0 HE3 LYS B 30 -6.903 -12.002 14.988 1.00 2.59 H new ATOM 0 HZ1 LYS B 30 -8.196 -13.911 15.649 1.00 3.56 H new ATOM 0 HZ2 LYS B 30 -7.454 -14.203 14.150 1.00 3.56 H new ATOM 0 HZ3 LYS B 30 -6.831 -14.916 15.560 1.00 3.56 H new ATOM 2119 N ASP B 31 -1.250 -8.577 14.318 1.00 1.26 N ATOM 2120 CA ASP B 31 -1.381 -7.164 13.975 1.00 1.31 C ATOM 2121 C ASP B 31 0.037 -6.682 13.717 1.00 1.34 C ATOM 2122 O ASP B 31 0.411 -6.354 12.593 1.00 1.71 O ATOM 2123 CB ASP B 31 -2.067 -6.389 15.124 1.00 1.52 C ATOM 2124 CG ASP B 31 -1.417 -5.048 15.473 1.00 2.91 C ATOM 2125 OD1 ASP B 31 -1.243 -4.200 14.569 1.00 4.09 O ATOM 2126 OD2 ASP B 31 -1.051 -4.904 16.661 1.00 3.96 O ATOM 0 H ASP B 31 -0.377 -8.772 14.808 1.00 1.26 H new ATOM 0 HA ASP B 31 -2.009 -7.002 13.099 1.00 1.31 H new ATOM 0 HB2 ASP B 31 -3.108 -6.212 14.853 1.00 1.52 H new ATOM 0 HB3 ASP B 31 -2.072 -7.017 16.015 1.00 1.52 H new ATOM 2131 N SER B 32 0.840 -6.710 14.776 1.00 1.15 N ATOM 2132 CA SER B 32 2.204 -6.264 14.731 1.00 1.21 C ATOM 2133 C SER B 32 3.075 -7.331 14.089 1.00 1.18 C ATOM 2134 O SER B 32 2.933 -8.526 14.387 1.00 1.17 O ATOM 2135 CB SER B 32 2.648 -5.976 16.159 1.00 1.41 C ATOM 2136 OG SER B 32 2.367 -7.086 16.988 1.00 2.04 O ATOM 0 H SER B 32 0.547 -7.049 15.693 1.00 1.15 H new ATOM 0 HA SER B 32 2.298 -5.359 14.131 1.00 1.21 H new ATOM 0 HB2 SER B 32 3.716 -5.758 16.179 1.00 1.41 H new ATOM 0 HB3 SER B 32 2.135 -5.091 16.536 1.00 1.41 H new ATOM 0 HG SER B 32 2.271 -6.785 17.916 1.00 2.04 H new ATOM 2142 N LEU B 33 4.014 -6.904 13.250 1.00 1.26 N ATOM 2143 CA LEU B 33 5.166 -7.716 12.922 1.00 1.27 C ATOM 2144 C LEU B 33 6.252 -7.380 13.945 1.00 1.27 C ATOM 2145 O LEU B 33 6.571 -6.218 14.175 1.00 1.41 O ATOM 2146 CB LEU B 33 5.630 -7.489 11.479 1.00 1.34 C ATOM 2147 CG LEU B 33 4.824 -8.211 10.395 1.00 1.43 C ATOM 2148 CD1 LEU B 33 5.008 -9.729 10.414 1.00 2.61 C ATOM 2149 CD2 LEU B 33 3.349 -7.829 10.447 1.00 1.39 C ATOM 0 H LEU B 33 3.993 -5.996 12.787 1.00 1.26 H new ATOM 0 HA LEU B 33 4.919 -8.776 12.974 1.00 1.27 H new ATOM 0 HB2 LEU B 33 5.602 -6.419 11.273 1.00 1.34 H new ATOM 0 HB3 LEU B 33 6.671 -7.802 11.399 1.00 1.34 H new ATOM 0 HG LEU B 33 5.229 -7.869 9.443 1.00 1.43 H new ATOM 0 HD11 LEU B 33 4.410 -10.178 9.621 1.00 2.61 H new ATOM 0 HD12 LEU B 33 6.059 -9.970 10.256 1.00 2.61 H new ATOM 0 HD13 LEU B 33 4.686 -10.122 11.378 1.00 2.61 H new ATOM 0 HD21 LEU B 33 2.808 -8.360 9.664 1.00 1.39 H new ATOM 0 HD22 LEU B 33 2.937 -8.099 11.420 1.00 1.39 H new ATOM 0 HD23 LEU B 33 3.246 -6.755 10.295 1.00 1.39 H new ATOM 2161 N SER B 34 6.802 -8.412 14.566 1.00 1.43 N ATOM 2162 CA SER B 34 8.046 -8.379 15.306 1.00 1.45 C ATOM 2163 C SER B 34 9.201 -8.519 14.318 1.00 1.20 C ATOM 2164 O SER B 34 9.023 -8.477 13.104 1.00 1.19 O ATOM 2165 CB SER B 34 8.081 -9.422 16.430 1.00 1.85 C ATOM 2166 OG SER B 34 9.112 -9.066 17.336 1.00 2.86 O ATOM 0 H SER B 34 6.370 -9.336 14.565 1.00 1.43 H new ATOM 0 HA SER B 34 8.142 -7.422 15.819 1.00 1.45 H new ATOM 0 HB2 SER B 34 7.120 -9.459 16.944 1.00 1.85 H new ATOM 0 HB3 SER B 34 8.262 -10.416 16.020 1.00 1.85 H new ATOM 0 HG SER B 34 9.149 -9.721 18.064 1.00 2.86 H new ATOM 2172 N VAL B 35 10.386 -8.710 14.878 1.00 1.32 N ATOM 2173 CA VAL B 35 11.707 -8.771 14.278 1.00 1.10 C ATOM 2174 C VAL B 35 11.621 -10.054 13.452 1.00 1.36 C ATOM 2175 O VAL B 35 11.276 -9.940 12.271 1.00 2.63 O ATOM 2176 CB VAL B 35 12.824 -8.693 15.331 1.00 1.79 C ATOM 2177 CG1 VAL B 35 14.210 -8.823 14.685 1.00 2.22 C ATOM 2178 CG2 VAL B 35 12.753 -7.332 16.038 1.00 2.42 C ATOM 0 H VAL B 35 10.449 -8.842 15.887 1.00 1.32 H new ATOM 0 HA VAL B 35 11.978 -7.925 13.646 1.00 1.10 H new ATOM 0 HB VAL B 35 12.682 -9.513 16.035 1.00 1.79 H new ATOM 0 HG11 VAL B 35 14.978 -8.764 15.456 1.00 2.22 H new ATOM 0 HG12 VAL B 35 14.284 -9.782 14.172 1.00 2.22 H new ATOM 0 HG13 VAL B 35 14.354 -8.016 13.967 1.00 2.22 H new ATOM 0 HG21 VAL B 35 13.543 -7.269 16.787 1.00 2.42 H new ATOM 0 HG22 VAL B 35 12.883 -6.535 15.306 1.00 2.42 H new ATOM 0 HG23 VAL B 35 11.783 -7.224 16.524 1.00 2.42 H new ATOM 2188 N ASN B 36 12.111 -11.207 13.908 1.00 1.60 N ATOM 2189 CA ASN B 36 11.974 -12.414 13.090 1.00 1.52 C ATOM 2190 C ASN B 36 10.495 -12.845 13.107 1.00 1.30 C ATOM 2191 O ASN B 36 10.062 -13.770 13.787 1.00 1.56 O ATOM 2192 CB ASN B 36 12.844 -13.541 13.651 1.00 2.04 C ATOM 2193 CG ASN B 36 12.805 -14.758 12.721 1.00 2.14 C ATOM 2194 OD1 ASN B 36 13.682 -14.918 11.876 1.00 2.68 O ATOM 2195 ND2 ASN B 36 11.772 -15.584 12.848 1.00 2.03 N ATOM 0 H ASN B 36 12.587 -11.332 14.801 1.00 1.60 H new ATOM 0 HA ASN B 36 12.298 -12.205 12.071 1.00 1.52 H new ATOM 0 HB2 ASN B 36 13.871 -13.194 13.764 1.00 2.04 H new ATOM 0 HB3 ASN B 36 12.491 -13.822 14.643 1.00 2.04 H new ATOM 0 HD21 ASN B 36 11.684 -16.390 12.229 1.00 2.03 H new ATOM 0 HD22 ASN B 36 11.067 -15.412 13.565 1.00 2.03 H new ATOM 2202 N GLU B 37 9.751 -12.102 12.294 1.00 1.18 N ATOM 2203 CA GLU B 37 8.350 -12.150 11.948 1.00 1.05 C ATOM 2204 C GLU B 37 8.288 -11.308 10.676 1.00 0.89 C ATOM 2205 O GLU B 37 7.921 -11.776 9.600 1.00 0.92 O ATOM 2206 CB GLU B 37 7.491 -11.518 13.061 1.00 1.32 C ATOM 2207 CG GLU B 37 6.279 -12.404 13.321 1.00 1.02 C ATOM 2208 CD GLU B 37 5.257 -11.802 14.274 1.00 1.14 C ATOM 2209 OE1 GLU B 37 5.210 -10.578 14.523 1.00 1.55 O ATOM 2210 OE2 GLU B 37 4.307 -12.481 14.716 1.00 1.80 O ATOM 0 H GLU B 37 10.198 -11.336 11.790 1.00 1.18 H new ATOM 0 HA GLU B 37 7.971 -13.163 11.817 1.00 1.05 H new ATOM 0 HB2 GLU B 37 8.079 -11.408 13.972 1.00 1.32 H new ATOM 0 HB3 GLU B 37 7.170 -10.519 12.766 1.00 1.32 H new ATOM 0 HG2 GLU B 37 5.790 -12.619 12.371 1.00 1.02 H new ATOM 0 HG3 GLU B 37 6.620 -13.356 13.727 1.00 1.02 H new ATOM 2217 N PHE B 38 8.753 -10.057 10.800 1.00 0.87 N ATOM 2218 CA PHE B 38 8.964 -9.180 9.666 1.00 0.80 C ATOM 2219 C PHE B 38 10.035 -9.781 8.767 1.00 0.72 C ATOM 2220 O PHE B 38 9.818 -9.934 7.566 1.00 0.73 O ATOM 2221 CB PHE B 38 9.367 -7.773 10.124 1.00 0.80 C ATOM 2222 CG PHE B 38 9.152 -6.730 9.052 1.00 0.80 C ATOM 2223 CD1 PHE B 38 10.009 -6.675 7.940 1.00 1.98 C ATOM 2224 CD2 PHE B 38 8.021 -5.896 9.105 1.00 1.77 C ATOM 2225 CE1 PHE B 38 9.741 -5.781 6.892 1.00 2.09 C ATOM 2226 CE2 PHE B 38 7.782 -4.967 8.083 1.00 1.91 C ATOM 2227 CZ PHE B 38 8.628 -4.930 6.971 1.00 1.29 C ATOM 0 H PHE B 38 8.991 -9.634 11.697 1.00 0.87 H new ATOM 0 HA PHE B 38 8.032 -9.086 9.109 1.00 0.80 H new ATOM 0 HB2 PHE B 38 8.790 -7.504 11.009 1.00 0.80 H new ATOM 0 HB3 PHE B 38 10.417 -7.777 10.417 1.00 0.80 H new ATOM 0 HD1 PHE B 38 10.874 -7.320 7.892 1.00 1.98 H new ATOM 0 HD2 PHE B 38 7.335 -5.972 9.935 1.00 1.77 H new ATOM 0 HE1 PHE B 38 10.389 -5.748 6.028 1.00 2.09 H new ATOM 0 HE2 PHE B 38 6.949 -4.284 8.154 1.00 1.91 H new ATOM 0 HZ PHE B 38 8.423 -4.240 6.165 1.00 1.29 H new ATOM 2237 N LYS B 39 11.206 -10.121 9.329 1.00 0.70 N ATOM 2238 CA LYS B 39 12.290 -10.623 8.492 1.00 0.70 C ATOM 2239 C LYS B 39 11.821 -11.845 7.687 1.00 0.69 C ATOM 2240 O LYS B 39 12.157 -11.972 6.513 1.00 0.67 O ATOM 2241 CB LYS B 39 13.602 -10.841 9.260 1.00 0.79 C ATOM 2242 CG LYS B 39 14.761 -11.087 8.268 1.00 0.85 C ATOM 2243 CD LYS B 39 16.132 -11.157 8.965 1.00 1.13 C ATOM 2244 CE LYS B 39 16.857 -9.799 9.061 1.00 1.49 C ATOM 2245 NZ LYS B 39 17.746 -9.525 7.904 1.00 2.78 N ATOM 0 H LYS B 39 11.416 -10.059 10.325 1.00 0.70 H new ATOM 0 HA LYS B 39 12.544 -9.846 7.771 1.00 0.70 H new ATOM 0 HB2 LYS B 39 13.820 -9.970 9.878 1.00 0.79 H new ATOM 0 HB3 LYS B 39 13.502 -11.692 9.933 1.00 0.79 H new ATOM 0 HG2 LYS B 39 14.583 -12.018 7.731 1.00 0.85 H new ATOM 0 HG3 LYS B 39 14.775 -10.289 7.526 1.00 0.85 H new ATOM 0 HD2 LYS B 39 15.997 -11.557 9.970 1.00 1.13 H new ATOM 0 HD3 LYS B 39 16.767 -11.859 8.425 1.00 1.13 H new ATOM 0 HE2 LYS B 39 16.116 -9.004 9.137 1.00 1.49 H new ATOM 0 HE3 LYS B 39 17.447 -9.774 9.977 1.00 1.49 H new ATOM 0 HZ1 LYS B 39 18.242 -8.623 8.053 1.00 2.78 H new ATOM 0 HZ2 LYS B 39 18.443 -10.292 7.812 1.00 2.78 H new ATOM 0 HZ3 LYS B 39 17.177 -9.468 7.035 1.00 2.78 H new ATOM 2259 N GLU B 40 10.987 -12.704 8.280 1.00 0.73 N ATOM 2260 CA GLU B 40 10.410 -13.838 7.577 1.00 0.73 C ATOM 2261 C GLU B 40 9.644 -13.428 6.314 1.00 0.64 C ATOM 2262 O GLU B 40 9.726 -14.129 5.307 1.00 0.65 O ATOM 2263 CB GLU B 40 9.531 -14.673 8.516 1.00 0.85 C ATOM 2264 CG GLU B 40 10.351 -15.193 9.703 1.00 1.07 C ATOM 2265 CD GLU B 40 9.659 -16.346 10.416 1.00 1.72 C ATOM 2266 OE1 GLU B 40 8.428 -16.485 10.233 1.00 2.63 O ATOM 2267 OE2 GLU B 40 10.394 -17.071 11.122 1.00 2.76 O ATOM 0 H GLU B 40 10.698 -12.628 9.255 1.00 0.73 H new ATOM 0 HA GLU B 40 11.242 -14.457 7.242 1.00 0.73 H new ATOM 0 HB2 GLU B 40 8.700 -14.068 8.878 1.00 0.85 H new ATOM 0 HB3 GLU B 40 9.100 -15.512 7.969 1.00 0.85 H new ATOM 0 HG2 GLU B 40 11.330 -15.520 9.351 1.00 1.07 H new ATOM 0 HG3 GLU B 40 10.521 -14.380 10.409 1.00 1.07 H new ATOM 2274 N LEU B 41 8.921 -12.304 6.336 1.00 0.63 N ATOM 2275 CA LEU B 41 8.142 -11.856 5.186 1.00 0.61 C ATOM 2276 C LEU B 41 9.108 -11.574 4.041 1.00 0.57 C ATOM 2277 O LEU B 41 8.946 -12.081 2.931 1.00 0.58 O ATOM 2278 CB LEU B 41 7.291 -10.632 5.584 1.00 0.69 C ATOM 2279 CG LEU B 41 6.484 -9.926 4.476 1.00 0.68 C ATOM 2280 CD1 LEU B 41 7.299 -8.889 3.698 1.00 2.55 C ATOM 2281 CD2 LEU B 41 5.755 -10.896 3.545 1.00 2.16 C ATOM 0 H LEU B 41 8.862 -11.686 7.146 1.00 0.63 H new ATOM 0 HA LEU B 41 7.441 -12.620 4.850 1.00 0.61 H new ATOM 0 HB2 LEU B 41 6.592 -10.948 6.358 1.00 0.69 H new ATOM 0 HB3 LEU B 41 7.955 -9.895 6.036 1.00 0.69 H new ATOM 0 HG LEU B 41 5.711 -9.372 5.008 1.00 0.68 H new ATOM 0 HD11 LEU B 41 6.671 -8.431 2.934 1.00 2.55 H new ATOM 0 HD12 LEU B 41 7.658 -8.120 4.382 1.00 2.55 H new ATOM 0 HD13 LEU B 41 8.150 -9.377 3.223 1.00 2.55 H new ATOM 0 HD21 LEU B 41 5.207 -10.333 2.789 1.00 2.16 H new ATOM 0 HD22 LEU B 41 6.481 -11.547 3.057 1.00 2.16 H new ATOM 0 HD23 LEU B 41 5.057 -11.501 4.124 1.00 2.16 H new ATOM 2293 N VAL B 42 10.133 -10.770 4.329 1.00 0.55 N ATOM 2294 CA VAL B 42 11.046 -10.292 3.306 1.00 0.56 C ATOM 2295 C VAL B 42 11.887 -11.454 2.782 1.00 0.59 C ATOM 2296 O VAL B 42 11.974 -11.660 1.574 1.00 0.71 O ATOM 2297 CB VAL B 42 11.860 -9.081 3.792 1.00 0.57 C ATOM 2298 CG1 VAL B 42 10.961 -7.843 3.891 1.00 0.65 C ATOM 2299 CG2 VAL B 42 12.546 -9.256 5.142 1.00 0.54 C ATOM 0 H VAL B 42 10.347 -10.438 5.270 1.00 0.55 H new ATOM 0 HA VAL B 42 10.480 -9.912 2.456 1.00 0.56 H new ATOM 0 HB VAL B 42 12.645 -8.969 3.044 1.00 0.57 H new ATOM 0 HG11 VAL B 42 11.549 -6.993 4.236 1.00 0.65 H new ATOM 0 HG12 VAL B 42 10.541 -7.619 2.911 1.00 0.65 H new ATOM 0 HG13 VAL B 42 10.153 -8.036 4.597 1.00 0.65 H new ATOM 0 HG21 VAL B 42 13.093 -8.347 5.393 1.00 0.54 H new ATOM 0 HG22 VAL B 42 11.796 -9.452 5.908 1.00 0.54 H new ATOM 0 HG23 VAL B 42 13.240 -10.095 5.091 1.00 0.54 H new ATOM 2309 N THR B 43 12.462 -12.234 3.697 1.00 0.60 N ATOM 2310 CA THR B 43 13.219 -13.433 3.382 1.00 0.71 C ATOM 2311 C THR B 43 12.399 -14.383 2.510 1.00 0.74 C ATOM 2312 O THR B 43 12.867 -14.817 1.460 1.00 0.84 O ATOM 2313 CB THR B 43 13.632 -14.083 4.708 1.00 0.77 C ATOM 2314 OG1 THR B 43 14.542 -13.232 5.373 1.00 0.84 O ATOM 2315 CG2 THR B 43 14.308 -15.447 4.522 1.00 0.92 C ATOM 0 H THR B 43 12.410 -12.041 4.697 1.00 0.60 H new ATOM 0 HA THR B 43 14.110 -13.184 2.805 1.00 0.71 H new ATOM 0 HB THR B 43 12.720 -14.236 5.284 1.00 0.77 H new ATOM 0 HG1 THR B 43 14.051 -12.503 5.806 1.00 0.84 H new ATOM 0 HG21 THR B 43 14.577 -15.856 5.496 1.00 0.92 H new ATOM 0 HG22 THR B 43 13.621 -16.128 4.020 1.00 0.92 H new ATOM 0 HG23 THR B 43 15.207 -15.328 3.918 1.00 0.92 H new ATOM 2323 N GLN B 44 11.200 -14.755 2.966 1.00 0.70 N ATOM 2324 CA GLN B 44 10.450 -15.827 2.339 1.00 0.78 C ATOM 2325 C GLN B 44 9.794 -15.344 1.044 1.00 0.82 C ATOM 2326 O GLN B 44 9.977 -15.952 -0.007 1.00 0.89 O ATOM 2327 CB GLN B 44 9.435 -16.392 3.341 1.00 0.83 C ATOM 2328 CG GLN B 44 8.887 -17.752 2.883 1.00 1.02 C ATOM 2329 CD GLN B 44 7.767 -18.274 3.779 1.00 1.23 C ATOM 2330 OE1 GLN B 44 6.906 -19.025 3.335 1.00 1.90 O ATOM 2331 NE2 GLN B 44 7.755 -17.890 5.054 1.00 1.39 N ATOM 0 H GLN B 44 10.735 -14.326 3.766 1.00 0.70 H new ATOM 0 HA GLN B 44 11.125 -16.635 2.058 1.00 0.78 H new ATOM 0 HB2 GLN B 44 9.908 -16.499 4.317 1.00 0.83 H new ATOM 0 HB3 GLN B 44 8.611 -15.689 3.461 1.00 0.83 H new ATOM 0 HG2 GLN B 44 8.517 -17.663 1.862 1.00 1.02 H new ATOM 0 HG3 GLN B 44 9.700 -18.478 2.866 1.00 1.02 H new ATOM 0 HE21 GLN B 44 8.480 -17.265 5.405 1.00 1.39 H new ATOM 0 HE22 GLN B 44 7.021 -18.221 5.680 1.00 1.39 H new ATOM 2340 N GLN B 45 8.982 -14.286 1.126 1.00 0.84 N ATOM 2341 CA GLN B 45 8.071 -13.951 0.042 1.00 0.91 C ATOM 2342 C GLN B 45 8.738 -13.191 -1.103 1.00 0.94 C ATOM 2343 O GLN B 45 8.501 -13.526 -2.259 1.00 1.06 O ATOM 2344 CB GLN B 45 6.857 -13.173 0.563 1.00 1.01 C ATOM 2345 CG GLN B 45 6.120 -13.888 1.703 1.00 1.53 C ATOM 2346 CD GLN B 45 5.661 -15.282 1.300 1.00 1.79 C ATOM 2347 OE1 GLN B 45 6.263 -16.275 1.691 1.00 3.05 O ATOM 2348 NE2 GLN B 45 4.591 -15.373 0.514 1.00 2.00 N ATOM 0 H GLN B 45 8.941 -13.655 1.927 1.00 0.84 H new ATOM 0 HA GLN B 45 7.738 -14.904 -0.370 1.00 0.91 H new ATOM 0 HB2 GLN B 45 7.184 -12.193 0.910 1.00 1.01 H new ATOM 0 HB3 GLN B 45 6.162 -13.004 -0.260 1.00 1.01 H new ATOM 0 HG2 GLN B 45 6.776 -13.959 2.570 1.00 1.53 H new ATOM 0 HG3 GLN B 45 5.256 -13.295 2.004 1.00 1.53 H new ATOM 0 HE21 GLN B 45 4.112 -14.527 0.205 1.00 2.00 H new ATOM 0 HE22 GLN B 45 4.250 -16.288 0.220 1.00 2.00 H new ATOM 2357 N LEU B 46 9.469 -12.111 -0.812 1.00 0.88 N ATOM 2358 CA LEU B 46 9.722 -11.064 -1.807 1.00 0.90 C ATOM 2359 C LEU B 46 10.483 -11.527 -3.058 1.00 1.12 C ATOM 2360 O LEU B 46 10.412 -10.863 -4.092 1.00 1.40 O ATOM 2361 CB LEU B 46 10.344 -9.823 -1.158 1.00 1.05 C ATOM 2362 CG LEU B 46 9.268 -8.838 -0.663 1.00 0.98 C ATOM 2363 CD1 LEU B 46 8.261 -9.470 0.310 1.00 2.22 C ATOM 2364 CD2 LEU B 46 9.966 -7.642 -0.015 1.00 1.60 C ATOM 0 H LEU B 46 9.894 -11.939 0.099 1.00 0.88 H new ATOM 0 HA LEU B 46 8.741 -10.787 -2.194 1.00 0.90 H new ATOM 0 HB2 LEU B 46 10.972 -10.127 -0.320 1.00 1.05 H new ATOM 0 HB3 LEU B 46 10.992 -9.322 -1.877 1.00 1.05 H new ATOM 0 HG LEU B 46 8.682 -8.523 -1.526 1.00 0.98 H new ATOM 0 HD11 LEU B 46 7.533 -8.720 0.618 1.00 2.22 H new ATOM 0 HD12 LEU B 46 7.746 -10.294 -0.184 1.00 2.22 H new ATOM 0 HD13 LEU B 46 8.789 -9.845 1.187 1.00 2.22 H new ATOM 0 HD21 LEU B 46 9.218 -6.934 0.342 1.00 1.60 H new ATOM 0 HD22 LEU B 46 10.571 -7.985 0.825 1.00 1.60 H new ATOM 0 HD23 LEU B 46 10.607 -7.154 -0.749 1.00 1.60 H new ATOM 2376 N PRO B 47 11.222 -12.642 -3.010 1.00 1.27 N ATOM 2377 CA PRO B 47 12.503 -12.677 -2.326 1.00 1.19 C ATOM 2378 C PRO B 47 13.520 -11.719 -2.982 1.00 1.03 C ATOM 2379 O PRO B 47 14.597 -11.509 -2.429 1.00 1.41 O ATOM 2380 CB PRO B 47 12.962 -14.125 -2.503 1.00 1.44 C ATOM 2381 CG PRO B 47 12.510 -14.436 -3.932 1.00 1.73 C ATOM 2382 CD PRO B 47 11.209 -13.642 -4.069 1.00 1.94 C ATOM 0 HA PRO B 47 12.424 -12.366 -1.284 1.00 1.19 H new ATOM 0 HB2 PRO B 47 14.041 -14.227 -2.386 1.00 1.44 H new ATOM 0 HB3 PRO B 47 12.498 -14.791 -1.775 1.00 1.44 H new ATOM 0 HG2 PRO B 47 13.252 -14.122 -4.666 1.00 1.73 H new ATOM 0 HG3 PRO B 47 12.347 -15.504 -4.079 1.00 1.73 H new ATOM 0 HD2 PRO B 47 11.145 -13.169 -5.049 1.00 1.94 H new ATOM 0 HD3 PRO B 47 10.343 -14.297 -3.974 1.00 1.94 H new ATOM 2390 N HIS B 48 13.212 -11.187 -4.175 1.00 1.03 N ATOM 2391 CA HIS B 48 14.092 -10.353 -4.982 1.00 1.11 C ATOM 2392 C HIS B 48 13.634 -8.893 -4.962 1.00 1.08 C ATOM 2393 O HIS B 48 14.473 -7.996 -4.987 1.00 1.74 O ATOM 2394 CB HIS B 48 14.109 -10.894 -6.419 1.00 1.19 C ATOM 2395 CG HIS B 48 15.228 -10.332 -7.264 1.00 1.45 C ATOM 2396 ND1 HIS B 48 16.384 -10.997 -7.604 1.00 2.49 N ATOM 2397 CD2 HIS B 48 15.294 -9.080 -7.816 1.00 2.17 C ATOM 2398 CE1 HIS B 48 17.131 -10.160 -8.342 1.00 2.48 C ATOM 2399 NE2 HIS B 48 16.516 -8.975 -8.491 1.00 2.07 N ATOM 0 H HIS B 48 12.304 -11.337 -4.614 1.00 1.03 H new ATOM 0 HA HIS B 48 15.099 -10.386 -4.566 1.00 1.11 H new ATOM 0 HB2 HIS B 48 14.198 -11.980 -6.388 1.00 1.19 H new ATOM 0 HB3 HIS B 48 13.156 -10.666 -6.895 1.00 1.19 H new ATOM 0 HD2 HIS B 48 14.539 -8.312 -7.743 1.00 2.17 H new ATOM 0 HE1 HIS B 48 18.096 -10.406 -8.759 1.00 2.48 H new ATOM 0 HE2 HIS B 48 16.869 -8.161 -8.995 1.00 2.07 H new ATOM 2407 N LEU B 49 12.313 -8.657 -4.959 1.00 0.86 N ATOM 2408 CA LEU B 49 11.712 -7.331 -5.100 1.00 0.82 C ATOM 2409 C LEU B 49 12.379 -6.306 -4.183 1.00 0.96 C ATOM 2410 O LEU B 49 12.737 -5.216 -4.627 1.00 1.40 O ATOM 2411 CB LEU B 49 10.209 -7.443 -4.829 1.00 0.75 C ATOM 2412 CG LEU B 49 9.449 -6.143 -5.122 1.00 0.72 C ATOM 2413 CD1 LEU B 49 9.379 -5.834 -6.617 1.00 0.75 C ATOM 2414 CD2 LEU B 49 8.016 -6.292 -4.626 1.00 0.79 C ATOM 0 H LEU B 49 11.623 -9.401 -4.856 1.00 0.86 H new ATOM 0 HA LEU B 49 11.868 -6.971 -6.117 1.00 0.82 H new ATOM 0 HB2 LEU B 49 9.794 -8.245 -5.439 1.00 0.75 H new ATOM 0 HB3 LEU B 49 10.053 -7.722 -3.787 1.00 0.75 H new ATOM 0 HG LEU B 49 9.982 -5.336 -4.620 1.00 0.72 H new ATOM 0 HD11 LEU B 49 8.831 -4.904 -6.771 1.00 0.75 H new ATOM 0 HD12 LEU B 49 10.389 -5.731 -7.015 1.00 0.75 H new ATOM 0 HD13 LEU B 49 8.867 -6.646 -7.133 1.00 0.75 H new ATOM 0 HD21 LEU B 49 7.464 -5.374 -4.828 1.00 0.79 H new ATOM 0 HD22 LEU B 49 7.537 -7.125 -5.142 1.00 0.79 H new ATOM 0 HD23 LEU B 49 8.020 -6.484 -3.553 1.00 0.79 H new ATOM 2426 N LEU B 50 12.583 -6.678 -2.919 1.00 0.77 N ATOM 2427 CA LEU B 50 13.646 -6.106 -2.114 1.00 0.83 C ATOM 2428 C LEU B 50 14.687 -7.206 -1.965 1.00 0.97 C ATOM 2429 O LEU B 50 14.341 -8.346 -1.665 1.00 1.74 O ATOM 2430 CB LEU B 50 13.135 -5.623 -0.754 1.00 1.02 C ATOM 2431 CG LEU B 50 12.092 -4.506 -0.901 1.00 0.67 C ATOM 2432 CD1 LEU B 50 11.476 -4.206 0.467 1.00 1.13 C ATOM 2433 CD2 LEU B 50 12.687 -3.212 -1.472 1.00 0.99 C ATOM 0 H LEU B 50 12.019 -7.377 -2.435 1.00 0.77 H new ATOM 0 HA LEU B 50 14.068 -5.221 -2.590 1.00 0.83 H new ATOM 0 HB2 LEU B 50 12.696 -6.461 -0.212 1.00 1.02 H new ATOM 0 HB3 LEU B 50 13.973 -5.262 -0.158 1.00 1.02 H new ATOM 0 HG LEU B 50 11.337 -4.860 -1.603 1.00 0.67 H new ATOM 0 HD11 LEU B 50 10.735 -3.413 0.366 1.00 1.13 H new ATOM 0 HD12 LEU B 50 10.996 -5.104 0.855 1.00 1.13 H new ATOM 0 HD13 LEU B 50 12.258 -3.886 1.156 1.00 1.13 H new ATOM 0 HD21 LEU B 50 11.905 -2.457 -1.554 1.00 0.99 H new ATOM 0 HD22 LEU B 50 13.473 -2.850 -0.809 1.00 0.99 H new ATOM 0 HD23 LEU B 50 13.106 -3.409 -2.459 1.00 0.99 H new ATOM 2445 N LYS B 51 15.938 -6.846 -2.228 1.00 0.91 N ATOM 2446 CA LYS B 51 17.098 -7.723 -2.188 1.00 1.15 C ATOM 2447 C LYS B 51 17.916 -7.417 -0.930 1.00 1.25 C ATOM 2448 O LYS B 51 17.478 -6.621 -0.103 1.00 1.78 O ATOM 2449 CB LYS B 51 17.908 -7.527 -3.478 1.00 1.48 C ATOM 2450 CG LYS B 51 18.176 -6.041 -3.770 1.00 1.74 C ATOM 2451 CD LYS B 51 19.494 -5.842 -4.523 1.00 2.84 C ATOM 2452 CE LYS B 51 19.475 -6.545 -5.888 1.00 4.25 C ATOM 2453 NZ LYS B 51 20.766 -6.409 -6.590 1.00 5.80 N ATOM 0 H LYS B 51 16.180 -5.890 -2.487 1.00 0.91 H new ATOM 0 HA LYS B 51 16.801 -8.770 -2.136 1.00 1.15 H new ATOM 0 HB2 LYS B 51 18.857 -8.057 -3.394 1.00 1.48 H new ATOM 0 HB3 LYS B 51 17.369 -7.969 -4.315 1.00 1.48 H new ATOM 0 HG2 LYS B 51 17.355 -5.632 -4.359 1.00 1.74 H new ATOM 0 HG3 LYS B 51 18.204 -5.485 -2.833 1.00 1.74 H new ATOM 0 HD2 LYS B 51 19.676 -4.777 -4.664 1.00 2.84 H new ATOM 0 HD3 LYS B 51 20.318 -6.230 -3.924 1.00 2.84 H new ATOM 0 HE2 LYS B 51 19.245 -7.602 -5.750 1.00 4.25 H new ATOM 0 HE3 LYS B 51 18.680 -6.124 -6.503 1.00 4.25 H new ATOM 0 HZ1 LYS B 51 20.715 -6.896 -7.507 1.00 5.80 H new ATOM 0 HZ2 LYS B 51 20.973 -5.401 -6.744 1.00 5.80 H new ATOM 0 HZ3 LYS B 51 21.521 -6.834 -6.014 1.00 5.80 H new ATOM 2467 N ASP B 52 19.082 -8.068 -0.784 1.00 1.63 N ATOM 2468 CA ASP B 52 20.010 -7.893 0.328 1.00 1.94 C ATOM 2469 C ASP B 52 19.265 -7.863 1.660 1.00 1.69 C ATOM 2470 O ASP B 52 19.548 -7.077 2.560 1.00 2.17 O ATOM 2471 CB ASP B 52 21.020 -6.756 0.090 1.00 2.63 C ATOM 2472 CG ASP B 52 20.401 -5.404 -0.238 1.00 3.03 C ATOM 2473 OD1 ASP B 52 20.222 -5.155 -1.452 1.00 4.63 O ATOM 2474 OD2 ASP B 52 20.167 -4.628 0.712 1.00 2.87 O ATOM 0 H ASP B 52 19.409 -8.753 -1.465 1.00 1.63 H new ATOM 0 HA ASP B 52 20.653 -8.771 0.389 1.00 1.94 H new ATOM 0 HB2 ASP B 52 21.640 -6.649 0.980 1.00 2.63 H new ATOM 0 HB3 ASP B 52 21.682 -7.043 -0.727 1.00 2.63 H new ATOM 2479 N VAL B 53 18.367 -8.846 1.797 1.00 1.25 N ATOM 2480 CA VAL B 53 17.474 -9.094 2.915 1.00 1.12 C ATOM 2481 C VAL B 53 18.191 -9.166 4.269 1.00 1.38 C ATOM 2482 O VAL B 53 17.554 -9.093 5.323 1.00 1.50 O ATOM 2483 CB VAL B 53 16.662 -10.364 2.576 1.00 1.08 C ATOM 2484 CG1 VAL B 53 17.020 -11.599 3.411 1.00 2.84 C ATOM 2485 CG2 VAL B 53 15.178 -10.040 2.656 1.00 2.64 C ATOM 0 H VAL B 53 18.243 -9.542 1.062 1.00 1.25 H new ATOM 0 HA VAL B 53 16.799 -8.248 3.044 1.00 1.12 H new ATOM 0 HB VAL B 53 16.932 -10.650 1.559 1.00 1.08 H new ATOM 0 HG11 VAL B 53 16.399 -12.440 3.102 1.00 2.84 H new ATOM 0 HG12 VAL B 53 18.070 -11.849 3.260 1.00 2.84 H new ATOM 0 HG13 VAL B 53 16.846 -11.388 4.466 1.00 2.84 H new ATOM 0 HG21 VAL B 53 14.598 -10.931 2.418 1.00 2.64 H new ATOM 0 HG22 VAL B 53 14.932 -9.706 3.664 1.00 2.64 H new ATOM 0 HG23 VAL B 53 14.939 -9.251 1.943 1.00 2.64 H new ATOM 2495 N GLY B 54 19.521 -9.304 4.251 1.00 1.90 N ATOM 2496 CA GLY B 54 20.355 -9.026 5.407 1.00 2.35 C ATOM 2497 C GLY B 54 19.988 -7.667 6.009 1.00 2.01 C ATOM 2498 O GLY B 54 19.539 -7.622 7.160 1.00 2.32 O ATOM 0 H GLY B 54 20.042 -9.612 3.430 1.00 1.90 H new ATOM 0 HA2 GLY B 54 20.227 -9.809 6.154 1.00 2.35 H new ATOM 0 HA3 GLY B 54 21.406 -9.032 5.116 1.00 2.35 H new ATOM 2502 N SER B 55 20.117 -6.605 5.200 1.00 1.63 N ATOM 2503 CA SER B 55 20.051 -5.184 5.552 1.00 1.65 C ATOM 2504 C SER B 55 18.621 -4.700 5.848 1.00 1.36 C ATOM 2505 O SER B 55 18.228 -3.598 5.462 1.00 1.50 O ATOM 2506 CB SER B 55 20.675 -4.373 4.401 1.00 2.11 C ATOM 2507 OG SER B 55 20.790 -3.009 4.755 1.00 2.65 O ATOM 0 H SER B 55 20.284 -6.731 4.202 1.00 1.63 H new ATOM 0 HA SER B 55 20.608 -5.035 6.477 1.00 1.65 H new ATOM 0 HB2 SER B 55 21.659 -4.775 4.158 1.00 2.11 H new ATOM 0 HB3 SER B 55 20.061 -4.471 3.506 1.00 2.11 H new ATOM 0 HG SER B 55 19.910 -2.663 5.013 1.00 2.65 H new ATOM 2513 N LEU B 56 17.832 -5.528 6.528 1.00 1.09 N ATOM 2514 CA LEU B 56 16.451 -5.282 6.880 1.00 0.93 C ATOM 2515 C LEU B 56 16.362 -4.144 7.902 1.00 0.98 C ATOM 2516 O LEU B 56 15.394 -3.387 7.910 1.00 0.92 O ATOM 2517 CB LEU B 56 15.922 -6.629 7.402 1.00 0.85 C ATOM 2518 CG LEU B 56 14.438 -6.734 7.759 1.00 0.78 C ATOM 2519 CD1 LEU B 56 14.183 -6.335 9.214 1.00 0.93 C ATOM 2520 CD2 LEU B 56 13.575 -5.939 6.782 1.00 0.69 C ATOM 0 H LEU B 56 18.163 -6.433 6.862 1.00 1.09 H new ATOM 0 HA LEU B 56 15.842 -4.948 6.040 1.00 0.93 H new ATOM 0 HB2 LEU B 56 16.137 -7.386 6.648 1.00 0.85 H new ATOM 0 HB3 LEU B 56 16.497 -6.891 8.290 1.00 0.85 H new ATOM 0 HG LEU B 56 14.145 -7.780 7.663 1.00 0.78 H new ATOM 0 HD11 LEU B 56 13.119 -6.421 9.434 1.00 0.93 H new ATOM 0 HD12 LEU B 56 14.745 -6.994 9.876 1.00 0.93 H new ATOM 0 HD13 LEU B 56 14.504 -5.305 9.370 1.00 0.93 H new ATOM 0 HD21 LEU B 56 12.526 -6.034 7.063 1.00 0.69 H new ATOM 0 HD22 LEU B 56 13.865 -4.889 6.812 1.00 0.69 H new ATOM 0 HD23 LEU B 56 13.717 -6.326 5.773 1.00 0.69 H new ATOM 2532 N ASP B 57 17.377 -4.013 8.757 1.00 1.20 N ATOM 2533 CA ASP B 57 17.504 -2.975 9.768 1.00 1.35 C ATOM 2534 C ASP B 57 17.131 -1.587 9.237 1.00 1.29 C ATOM 2535 O ASP B 57 16.298 -0.926 9.849 1.00 1.23 O ATOM 2536 CB ASP B 57 18.929 -2.995 10.332 1.00 1.81 C ATOM 2537 CG ASP B 57 19.941 -3.032 9.202 1.00 3.10 C ATOM 2538 OD1 ASP B 57 20.067 -4.139 8.632 1.00 3.66 O ATOM 2539 OD2 ASP B 57 20.465 -1.952 8.863 1.00 4.33 O ATOM 0 H ASP B 57 18.166 -4.659 8.760 1.00 1.20 H new ATOM 0 HA ASP B 57 16.794 -3.188 10.567 1.00 1.35 H new ATOM 0 HB2 ASP B 57 19.095 -2.113 10.950 1.00 1.81 H new ATOM 0 HB3 ASP B 57 19.061 -3.865 10.976 1.00 1.81 H new ATOM 2544 N GLU B 58 17.710 -1.128 8.121 1.00 1.38 N ATOM 2545 CA GLU B 58 17.439 0.222 7.629 1.00 1.35 C ATOM 2546 C GLU B 58 15.945 0.415 7.334 1.00 1.17 C ATOM 2547 O GLU B 58 15.358 1.443 7.686 1.00 1.20 O ATOM 2548 CB GLU B 58 18.395 0.606 6.480 1.00 1.55 C ATOM 2549 CG GLU B 58 17.910 0.415 5.025 1.00 2.00 C ATOM 2550 CD GLU B 58 17.530 1.736 4.358 1.00 2.45 C ATOM 2551 OE1 GLU B 58 18.386 2.646 4.361 1.00 2.60 O ATOM 2552 OE2 GLU B 58 16.413 1.860 3.808 1.00 4.11 O ATOM 0 H GLU B 58 18.361 -1.666 7.550 1.00 1.38 H new ATOM 0 HA GLU B 58 17.660 0.942 8.417 1.00 1.35 H new ATOM 0 HB2 GLU B 58 18.661 1.656 6.606 1.00 1.55 H new ATOM 0 HB3 GLU B 58 19.311 0.028 6.603 1.00 1.55 H new ATOM 0 HG2 GLU B 58 18.695 -0.069 4.444 1.00 2.00 H new ATOM 0 HG3 GLU B 58 17.049 -0.253 5.017 1.00 2.00 H new ATOM 2559 N LYS B 59 15.306 -0.607 6.751 1.00 0.97 N ATOM 2560 CA LYS B 59 13.865 -0.612 6.575 1.00 0.78 C ATOM 2561 C LYS B 59 13.200 -0.569 7.948 1.00 0.59 C ATOM 2562 O LYS B 59 12.473 0.377 8.215 1.00 0.60 O ATOM 2563 CB LYS B 59 13.393 -1.806 5.733 1.00 0.81 C ATOM 2564 CG LYS B 59 13.852 -1.784 4.265 1.00 1.14 C ATOM 2565 CD LYS B 59 13.054 -0.820 3.365 1.00 2.19 C ATOM 2566 CE LYS B 59 13.791 0.507 3.129 1.00 2.95 C ATOM 2567 NZ LYS B 59 13.096 1.379 2.159 1.00 4.66 N ATOM 0 H LYS B 59 15.775 -1.440 6.395 1.00 0.97 H new ATOM 0 HA LYS B 59 13.569 0.274 6.014 1.00 0.78 H new ATOM 0 HB2 LYS B 59 13.753 -2.724 6.197 1.00 0.81 H new ATOM 0 HB3 LYS B 59 12.304 -1.842 5.758 1.00 0.81 H new ATOM 0 HG2 LYS B 59 14.906 -1.507 4.230 1.00 1.14 H new ATOM 0 HG3 LYS B 59 13.774 -2.792 3.857 1.00 1.14 H new ATOM 0 HD2 LYS B 59 12.860 -1.300 2.406 1.00 2.19 H new ATOM 0 HD3 LYS B 59 12.085 -0.618 3.823 1.00 2.19 H new ATOM 0 HE2 LYS B 59 13.894 1.035 4.077 1.00 2.95 H new ATOM 0 HE3 LYS B 59 14.799 0.300 2.768 1.00 2.95 H new ATOM 0 HZ1 LYS B 59 13.652 2.245 2.011 1.00 4.66 H new ATOM 0 HZ2 LYS B 59 12.990 0.877 1.255 1.00 4.66 H new ATOM 0 HZ3 LYS B 59 12.157 1.629 2.528 1.00 4.66 H new ATOM 2581 N MET B 60 13.458 -1.544 8.827 1.00 0.60 N ATOM 2582 CA MET B 60 12.862 -1.612 10.162 1.00 0.66 C ATOM 2583 C MET B 60 12.884 -0.246 10.854 1.00 0.69 C ATOM 2584 O MET B 60 11.849 0.243 11.300 1.00 0.72 O ATOM 2585 CB MET B 60 13.552 -2.714 10.980 1.00 0.91 C ATOM 2586 CG MET B 60 12.895 -2.976 12.343 1.00 0.98 C ATOM 2587 SD MET B 60 13.413 -1.899 13.707 1.00 1.65 S ATOM 2588 CE MET B 60 12.378 -2.565 15.032 1.00 1.62 C ATOM 0 H MET B 60 14.094 -2.316 8.627 1.00 0.60 H new ATOM 0 HA MET B 60 11.809 -1.879 10.075 1.00 0.66 H new ATOM 0 HB2 MET B 60 13.550 -3.638 10.402 1.00 0.91 H new ATOM 0 HB3 MET B 60 14.595 -2.439 11.137 1.00 0.91 H new ATOM 0 HG2 MET B 60 11.815 -2.883 12.225 1.00 0.98 H new ATOM 0 HG3 MET B 60 13.097 -4.009 12.627 1.00 0.98 H new ATOM 0 HE1 MET B 60 12.581 -2.027 15.958 1.00 1.62 H new ATOM 0 HE2 MET B 60 11.327 -2.447 14.767 1.00 1.62 H new ATOM 0 HE3 MET B 60 12.601 -3.623 15.171 1.00 1.62 H new ATOM 2598 N LYS B 61 14.054 0.395 10.879 1.00 0.81 N ATOM 2599 CA LYS B 61 14.248 1.723 11.436 1.00 0.95 C ATOM 2600 C LYS B 61 13.296 2.741 10.796 1.00 0.80 C ATOM 2601 O LYS B 61 12.690 3.550 11.496 1.00 0.86 O ATOM 2602 CB LYS B 61 15.718 2.143 11.246 1.00 1.31 C ATOM 2603 CG LYS B 61 16.240 2.973 12.424 1.00 1.93 C ATOM 2604 CD LYS B 61 16.621 2.044 13.589 1.00 1.70 C ATOM 2605 CE LYS B 61 17.202 2.807 14.785 1.00 2.65 C ATOM 2606 NZ LYS B 61 16.194 3.666 15.436 1.00 4.08 N ATOM 0 H LYS B 61 14.910 -0.010 10.502 1.00 0.81 H new ATOM 0 HA LYS B 61 14.018 1.697 12.501 1.00 0.95 H new ATOM 0 HB2 LYS B 61 16.336 1.253 11.129 1.00 1.31 H new ATOM 0 HB3 LYS B 61 15.813 2.720 10.326 1.00 1.31 H new ATOM 0 HG2 LYS B 61 17.107 3.556 12.114 1.00 1.93 H new ATOM 0 HG3 LYS B 61 15.478 3.682 12.747 1.00 1.93 H new ATOM 0 HD2 LYS B 61 15.739 1.489 13.910 1.00 1.70 H new ATOM 0 HD3 LYS B 61 17.349 1.311 13.241 1.00 1.70 H new ATOM 0 HE2 LYS B 61 17.596 2.096 15.511 1.00 2.65 H new ATOM 0 HE3 LYS B 61 18.040 3.420 14.452 1.00 2.65 H new ATOM 0 HZ1 LYS B 61 16.593 4.071 16.307 1.00 4.08 H new ATOM 0 HZ2 LYS B 61 15.923 4.434 14.789 1.00 4.08 H new ATOM 0 HZ3 LYS B 61 15.355 3.099 15.671 1.00 4.08 H new ATOM 2620 N SER B 62 13.186 2.714 9.465 1.00 0.81 N ATOM 2621 CA SER B 62 12.321 3.612 8.710 1.00 0.93 C ATOM 2622 C SER B 62 10.834 3.276 8.887 1.00 0.89 C ATOM 2623 O SER B 62 9.987 4.150 8.732 1.00 1.09 O ATOM 2624 CB SER B 62 12.697 3.556 7.225 1.00 1.09 C ATOM 2625 OG SER B 62 14.075 3.820 7.042 1.00 1.44 O ATOM 0 H SER B 62 13.703 2.059 8.879 1.00 0.81 H new ATOM 0 HA SER B 62 12.471 4.620 9.098 1.00 0.93 H new ATOM 0 HB2 SER B 62 12.454 2.573 6.821 1.00 1.09 H new ATOM 0 HB3 SER B 62 12.106 4.284 6.669 1.00 1.09 H new ATOM 0 HG SER B 62 14.592 3.011 7.240 1.00 1.44 H new ATOM 2631 N LEU B 63 10.508 2.006 9.135 1.00 0.74 N ATOM 2632 CA LEU B 63 9.147 1.503 9.245 1.00 0.83 C ATOM 2633 C LEU B 63 8.566 1.777 10.634 1.00 0.94 C ATOM 2634 O LEU B 63 7.526 2.415 10.768 1.00 1.07 O ATOM 2635 CB LEU B 63 9.140 -0.006 8.970 1.00 0.80 C ATOM 2636 CG LEU B 63 9.516 -0.410 7.535 1.00 0.91 C ATOM 2637 CD1 LEU B 63 9.817 -1.906 7.506 1.00 1.20 C ATOM 2638 CD2 LEU B 63 8.379 -0.123 6.566 1.00 1.07 C ATOM 0 H LEU B 63 11.211 1.279 9.268 1.00 0.74 H new ATOM 0 HA LEU B 63 8.528 2.019 8.511 1.00 0.83 H new ATOM 0 HB2 LEU B 63 9.833 -0.488 9.660 1.00 0.80 H new ATOM 0 HB3 LEU B 63 8.146 -0.395 9.192 1.00 0.80 H new ATOM 0 HG LEU B 63 10.387 0.170 7.231 1.00 0.91 H new ATOM 0 HD11 LEU B 63 10.085 -2.204 6.492 1.00 1.20 H new ATOM 0 HD12 LEU B 63 10.646 -2.123 8.179 1.00 1.20 H new ATOM 0 HD13 LEU B 63 8.935 -2.461 7.826 1.00 1.20 H new ATOM 0 HD21 LEU B 63 8.675 -0.419 5.560 1.00 1.07 H new ATOM 0 HD22 LEU B 63 7.495 -0.687 6.865 1.00 1.07 H new ATOM 0 HD23 LEU B 63 8.151 0.943 6.578 1.00 1.07 H new ATOM 2650 N ASP B 64 9.236 1.274 11.673 1.00 0.94 N ATOM 2651 CA ASP B 64 8.754 1.149 13.050 1.00 1.09 C ATOM 2652 C ASP B 64 8.308 2.458 13.724 1.00 1.23 C ATOM 2653 O ASP B 64 7.825 2.414 14.853 1.00 1.36 O ATOM 2654 CB ASP B 64 9.757 0.353 13.907 1.00 1.07 C ATOM 2655 CG ASP B 64 9.147 -0.163 15.210 1.00 1.31 C ATOM 2656 OD1 ASP B 64 7.903 -0.293 15.238 1.00 1.35 O ATOM 2657 OD2 ASP B 64 9.906 -0.405 16.177 1.00 1.84 O ATOM 0 H ASP B 64 10.188 0.922 11.569 1.00 0.94 H new ATOM 0 HA ASP B 64 7.825 0.584 12.977 1.00 1.09 H new ATOM 0 HB2 ASP B 64 10.132 -0.491 13.328 1.00 1.07 H new ATOM 0 HB3 ASP B 64 10.613 0.987 14.138 1.00 1.07 H new ATOM 2662 N VAL B 65 8.593 3.614 13.115 1.00 1.24 N ATOM 2663 CA VAL B 65 9.204 4.840 13.634 1.00 1.33 C ATOM 2664 C VAL B 65 8.888 5.284 15.069 1.00 1.48 C ATOM 2665 O VAL B 65 9.719 5.971 15.660 1.00 1.60 O ATOM 2666 CB VAL B 65 8.896 6.005 12.672 1.00 1.37 C ATOM 2667 CG1 VAL B 65 9.428 5.731 11.262 1.00 1.43 C ATOM 2668 CG2 VAL B 65 7.391 6.308 12.581 1.00 1.88 C ATOM 0 H VAL B 65 8.373 3.724 12.125 1.00 1.24 H new ATOM 0 HA VAL B 65 10.259 4.573 13.690 1.00 1.33 H new ATOM 0 HB VAL B 65 9.404 6.873 13.091 1.00 1.37 H new ATOM 0 HG11 VAL B 65 9.191 6.575 10.614 1.00 1.43 H new ATOM 0 HG12 VAL B 65 10.509 5.595 11.301 1.00 1.43 H new ATOM 0 HG13 VAL B 65 8.963 4.828 10.867 1.00 1.43 H new ATOM 0 HG21 VAL B 65 7.228 7.136 11.891 1.00 1.88 H new ATOM 0 HG22 VAL B 65 6.863 5.425 12.220 1.00 1.88 H new ATOM 0 HG23 VAL B 65 7.014 6.578 13.567 1.00 1.88 H new ATOM 2678 N ASN B 66 7.745 4.924 15.662 1.00 1.52 N ATOM 2679 CA ASN B 66 7.558 5.146 17.098 1.00 1.62 C ATOM 2680 C ASN B 66 8.597 4.356 17.908 1.00 1.69 C ATOM 2681 O ASN B 66 8.930 4.730 19.028 1.00 1.92 O ATOM 2682 CB ASN B 66 6.117 4.848 17.545 1.00 1.68 C ATOM 2683 CG ASN B 66 5.799 3.361 17.703 1.00 2.20 C ATOM 2684 OD1 ASN B 66 6.434 2.495 17.108 1.00 2.03 O ATOM 2685 ND2 ASN B 66 4.796 3.024 18.502 1.00 3.34 N ATOM 0 H ASN B 66 6.955 4.489 15.185 1.00 1.52 H new ATOM 0 HA ASN B 66 7.722 6.205 17.298 1.00 1.62 H new ATOM 0 HB2 ASN B 66 5.933 5.349 18.495 1.00 1.68 H new ATOM 0 HB3 ASN B 66 5.428 5.279 16.819 1.00 1.68 H new ATOM 0 HD21 ASN B 66 4.549 2.042 18.624 1.00 3.34 H new ATOM 0 HD22 ASN B 66 4.271 3.747 18.994 1.00 3.34 H new ATOM 2692 N GLN B 67 9.111 3.275 17.314 1.00 1.56 N ATOM 2693 CA GLN B 67 10.157 2.416 17.833 1.00 1.69 C ATOM 2694 C GLN B 67 9.714 1.668 19.091 1.00 1.69 C ATOM 2695 O GLN B 67 10.268 1.846 20.174 1.00 1.77 O ATOM 2696 CB GLN B 67 11.506 3.131 17.962 1.00 2.04 C ATOM 2697 CG GLN B 67 12.649 2.102 17.999 1.00 2.78 C ATOM 2698 CD GLN B 67 13.083 1.632 16.609 1.00 3.23 C ATOM 2699 OE1 GLN B 67 14.085 2.124 16.091 1.00 2.89 O ATOM 2700 NE2 GLN B 67 12.383 0.693 15.978 1.00 4.85 N ATOM 0 H GLN B 67 8.780 2.965 16.400 1.00 1.56 H new ATOM 0 HA GLN B 67 10.335 1.641 17.087 1.00 1.69 H new ATOM 0 HB2 GLN B 67 11.647 3.812 17.123 1.00 2.04 H new ATOM 0 HB3 GLN B 67 11.521 3.735 18.869 1.00 2.04 H new ATOM 0 HG2 GLN B 67 13.506 2.539 18.512 1.00 2.78 H new ATOM 0 HG3 GLN B 67 12.333 1.239 18.585 1.00 2.78 H new ATOM 0 HE21 GLN B 67 11.554 0.293 16.418 1.00 4.85 H new ATOM 0 HE22 GLN B 67 12.675 0.373 15.055 1.00 4.85 H new ATOM 2709 N ASP B 68 8.727 0.794 18.909 1.00 1.76 N ATOM 2710 CA ASP B 68 8.157 -0.096 19.912 1.00 1.77 C ATOM 2711 C ASP B 68 8.549 -1.558 19.623 1.00 1.77 C ATOM 2712 O ASP B 68 8.270 -2.426 20.444 1.00 2.40 O ATOM 2713 CB ASP B 68 6.622 0.082 19.927 1.00 1.81 C ATOM 2714 CG ASP B 68 6.027 -0.129 18.548 1.00 1.68 C ATOM 2715 OD1 ASP B 68 6.754 -0.631 17.677 1.00 1.69 O ATOM 2716 OD2 ASP B 68 4.958 0.399 18.176 1.00 1.86 O ATOM 0 H ASP B 68 8.277 0.683 18.000 1.00 1.76 H new ATOM 0 HA ASP B 68 8.552 0.157 20.896 1.00 1.77 H new ATOM 0 HB2 ASP B 68 6.179 -0.625 20.628 1.00 1.81 H new ATOM 0 HB3 ASP B 68 6.374 1.082 20.283 1.00 1.81 H new ATOM 2721 N SER B 69 9.168 -1.855 18.467 1.00 1.47 N ATOM 2722 CA SER B 69 9.409 -3.215 17.987 1.00 1.43 C ATOM 2723 C SER B 69 8.117 -3.999 17.698 1.00 1.37 C ATOM 2724 O SER B 69 8.171 -5.216 17.522 1.00 1.49 O ATOM 2725 CB SER B 69 10.363 -3.977 18.913 1.00 1.55 C ATOM 2726 OG SER B 69 11.530 -3.206 19.129 1.00 1.88 O ATOM 0 H SER B 69 9.519 -1.138 17.832 1.00 1.47 H new ATOM 0 HA SER B 69 9.904 -3.116 17.021 1.00 1.43 H new ATOM 0 HB2 SER B 69 9.873 -4.188 19.863 1.00 1.55 H new ATOM 0 HB3 SER B 69 10.626 -4.938 18.470 1.00 1.55 H new ATOM 0 HG SER B 69 12.139 -3.693 19.723 1.00 1.88 H new ATOM 2732 N GLU B 70 6.983 -3.302 17.584 1.00 1.30 N ATOM 2733 CA GLU B 70 5.787 -3.752 16.901 1.00 1.21 C ATOM 2734 C GLU B 70 5.694 -2.914 15.625 1.00 1.13 C ATOM 2735 O GLU B 70 5.239 -1.767 15.672 1.00 1.15 O ATOM 2736 CB GLU B 70 4.520 -3.518 17.752 1.00 1.27 C ATOM 2737 CG GLU B 70 4.255 -4.587 18.825 1.00 1.55 C ATOM 2738 CD GLU B 70 2.771 -4.696 19.178 1.00 2.27 C ATOM 2739 OE1 GLU B 70 2.083 -3.654 19.257 1.00 2.66 O ATOM 2740 OE2 GLU B 70 2.285 -5.843 19.313 1.00 3.15 O ATOM 0 H GLU B 70 6.878 -2.370 17.985 1.00 1.30 H new ATOM 0 HA GLU B 70 5.846 -4.822 16.702 1.00 1.21 H new ATOM 0 HB2 GLU B 70 4.602 -2.547 18.240 1.00 1.27 H new ATOM 0 HB3 GLU B 70 3.657 -3.469 17.087 1.00 1.27 H new ATOM 0 HG2 GLU B 70 4.614 -5.553 18.470 1.00 1.55 H new ATOM 0 HG3 GLU B 70 4.824 -4.346 19.723 1.00 1.55 H new ATOM 2747 N LEU B 71 6.090 -3.484 14.488 1.00 1.18 N ATOM 2748 CA LEU B 71 5.801 -2.931 13.173 1.00 1.21 C ATOM 2749 C LEU B 71 4.286 -3.049 13.018 1.00 1.22 C ATOM 2750 O LEU B 71 3.780 -4.124 12.702 1.00 1.24 O ATOM 2751 CB LEU B 71 6.506 -3.751 12.085 1.00 1.24 C ATOM 2752 CG LEU B 71 8.033 -3.641 11.978 1.00 1.38 C ATOM 2753 CD1 LEU B 71 8.424 -2.403 11.170 1.00 1.54 C ATOM 2754 CD2 LEU B 71 8.783 -3.660 13.316 1.00 1.37 C ATOM 0 H LEU B 71 6.626 -4.351 14.457 1.00 1.18 H new ATOM 0 HA LEU B 71 6.147 -1.902 13.077 1.00 1.21 H new ATOM 0 HB2 LEU B 71 6.257 -4.800 12.243 1.00 1.24 H new ATOM 0 HB3 LEU B 71 6.082 -3.464 11.123 1.00 1.24 H new ATOM 0 HG LEU B 71 8.346 -4.548 11.461 1.00 1.38 H new ATOM 0 HD11 LEU B 71 9.510 -2.340 11.104 1.00 1.54 H new ATOM 0 HD12 LEU B 71 8.003 -2.475 10.167 1.00 1.54 H new ATOM 0 HD13 LEU B 71 8.038 -1.510 11.662 1.00 1.54 H new ATOM 0 HD21 LEU B 71 9.854 -3.577 13.134 1.00 1.37 H new ATOM 0 HD22 LEU B 71 8.453 -2.822 13.930 1.00 1.37 H new ATOM 0 HD23 LEU B 71 8.575 -4.595 13.837 1.00 1.37 H new ATOM 2766 N LYS B 72 3.560 -1.982 13.343 1.00 1.26 N ATOM 2767 CA LYS B 72 2.169 -2.067 13.757 1.00 1.43 C ATOM 2768 C LYS B 72 1.242 -2.136 12.548 1.00 1.47 C ATOM 2769 O LYS B 72 1.617 -1.654 11.480 1.00 1.19 O ATOM 2770 CB LYS B 72 1.870 -0.790 14.565 1.00 1.49 C ATOM 2771 CG LYS B 72 0.555 -0.810 15.351 1.00 2.15 C ATOM 2772 CD LYS B 72 0.626 -1.953 16.374 1.00 3.56 C ATOM 2773 CE LYS B 72 -0.423 -1.855 17.480 1.00 3.91 C ATOM 2774 NZ LYS B 72 -0.329 -3.034 18.363 1.00 5.36 N ATOM 0 H LYS B 72 3.926 -1.030 13.325 1.00 1.26 H new ATOM 0 HA LYS B 72 2.003 -2.968 14.348 1.00 1.43 H new ATOM 0 HB2 LYS B 72 2.690 -0.620 15.263 1.00 1.49 H new ATOM 0 HB3 LYS B 72 1.853 0.058 13.881 1.00 1.49 H new ATOM 0 HG2 LYS B 72 0.399 0.143 15.856 1.00 2.15 H new ATOM 0 HG3 LYS B 72 -0.289 -0.955 14.677 1.00 2.15 H new ATOM 0 HD2 LYS B 72 0.504 -2.903 15.853 1.00 3.56 H new ATOM 0 HD3 LYS B 72 1.618 -1.963 16.826 1.00 3.56 H new ATOM 0 HE2 LYS B 72 -0.272 -0.943 18.058 1.00 3.91 H new ATOM 0 HE3 LYS B 72 -1.420 -1.794 17.044 1.00 3.91 H new ATOM 0 HZ1 LYS B 72 -1.136 -3.042 19.019 1.00 5.36 H new ATOM 0 HZ2 LYS B 72 -0.342 -3.900 17.788 1.00 5.36 H new ATOM 0 HZ3 LYS B 72 0.557 -2.992 18.906 1.00 5.36 H new ATOM 2788 N PHE B 73 -0.014 -2.570 12.722 1.00 1.88 N ATOM 2789 CA PHE B 73 -1.041 -2.306 11.720 1.00 1.86 C ATOM 2790 C PHE B 73 -1.610 -0.899 11.945 1.00 2.30 C ATOM 2791 O PHE B 73 -2.799 -0.720 12.197 1.00 2.90 O ATOM 2792 CB PHE B 73 -2.149 -3.361 11.788 1.00 2.16 C ATOM 2793 CG PHE B 73 -3.095 -3.505 10.602 1.00 1.76 C ATOM 2794 CD1 PHE B 73 -2.927 -2.779 9.404 1.00 2.52 C ATOM 2795 CD2 PHE B 73 -4.135 -4.450 10.693 1.00 2.90 C ATOM 2796 CE1 PHE B 73 -3.766 -3.027 8.303 1.00 3.87 C ATOM 2797 CE2 PHE B 73 -4.978 -4.691 9.594 1.00 3.81 C ATOM 2798 CZ PHE B 73 -4.786 -3.987 8.394 1.00 4.22 C ATOM 0 H PHE B 73 -0.334 -3.096 13.535 1.00 1.88 H new ATOM 0 HA PHE B 73 -0.599 -2.359 10.725 1.00 1.86 H new ATOM 0 HB2 PHE B 73 -1.675 -4.329 11.952 1.00 2.16 H new ATOM 0 HB3 PHE B 73 -2.754 -3.149 12.670 1.00 2.16 H new ATOM 0 HD1 PHE B 73 -2.152 -2.031 9.332 1.00 2.52 H new ATOM 0 HD2 PHE B 73 -4.286 -4.994 11.614 1.00 2.90 H new ATOM 0 HE1 PHE B 73 -3.625 -2.477 7.384 1.00 3.87 H new ATOM 0 HE2 PHE B 73 -5.773 -5.418 9.673 1.00 3.81 H new ATOM 0 HZ PHE B 73 -5.422 -4.184 7.543 1.00 4.22 H new ATOM 2808 N ASN B 74 -0.767 0.121 11.775 1.00 2.16 N ATOM 2809 CA ASN B 74 -0.575 0.557 10.401 1.00 2.08 C ATOM 2810 C ASN B 74 0.668 1.445 10.212 1.00 1.60 C ATOM 2811 O ASN B 74 0.618 2.465 9.527 1.00 1.85 O ATOM 2812 CB ASN B 74 -1.883 1.211 9.931 1.00 2.44 C ATOM 2813 CG ASN B 74 -2.338 2.452 10.711 1.00 3.85 C ATOM 2814 OD1 ASN B 74 -3.439 2.476 11.251 1.00 5.19 O ATOM 2815 ND2 ASN B 74 -1.555 3.528 10.729 1.00 3.98 N ATOM 0 H ASN B 74 -0.251 0.619 12.500 1.00 2.16 H new ATOM 0 HA ASN B 74 -0.359 -0.304 9.769 1.00 2.08 H new ATOM 0 HB2 ASN B 74 -1.771 1.487 8.883 1.00 2.44 H new ATOM 0 HB3 ASN B 74 -2.676 0.465 9.981 1.00 2.44 H new ATOM 0 HD21 ASN B 74 -1.869 4.380 11.194 1.00 3.98 H new ATOM 0 HD22 ASN B 74 -0.641 3.501 10.278 1.00 3.98 H new ATOM 2822 N GLU B 75 1.819 0.970 10.692 1.00 1.25 N ATOM 2823 CA GLU B 75 3.157 1.279 10.214 1.00 1.06 C ATOM 2824 C GLU B 75 3.483 0.330 9.057 1.00 1.00 C ATOM 2825 O GLU B 75 3.882 0.753 7.974 1.00 1.03 O ATOM 2826 CB GLU B 75 4.152 1.071 11.359 1.00 0.89 C ATOM 2827 CG GLU B 75 3.863 1.955 12.584 1.00 1.06 C ATOM 2828 CD GLU B 75 4.593 1.441 13.811 1.00 1.00 C ATOM 2829 OE1 GLU B 75 5.029 0.274 13.837 1.00 2.24 O ATOM 2830 OE2 GLU B 75 4.744 2.138 14.832 1.00 1.58 O ATOM 0 H GLU B 75 1.836 0.317 11.476 1.00 1.25 H new ATOM 0 HA GLU B 75 3.218 2.312 9.871 1.00 1.06 H new ATOM 0 HB2 GLU B 75 4.133 0.024 11.662 1.00 0.89 H new ATOM 0 HB3 GLU B 75 5.159 1.280 10.998 1.00 0.89 H new ATOM 0 HG2 GLU B 75 4.170 2.980 12.377 1.00 1.06 H new ATOM 0 HG3 GLU B 75 2.790 1.976 12.777 1.00 1.06 H new ATOM 2837 N TYR B 76 3.317 -0.973 9.338 1.00 0.95 N ATOM 2838 CA TYR B 76 3.737 -2.116 8.536 1.00 0.94 C ATOM 2839 C TYR B 76 3.502 -1.918 7.048 1.00 0.90 C ATOM 2840 O TYR B 76 4.380 -2.266 6.255 1.00 0.95 O ATOM 2841 CB TYR B 76 3.006 -3.373 9.037 1.00 1.01 C ATOM 2842 CG TYR B 76 3.178 -4.572 8.127 1.00 1.06 C ATOM 2843 CD1 TYR B 76 2.312 -4.738 7.030 1.00 1.98 C ATOM 2844 CD2 TYR B 76 4.337 -5.361 8.221 1.00 2.58 C ATOM 2845 CE1 TYR B 76 2.658 -5.609 5.985 1.00 2.46 C ATOM 2846 CE2 TYR B 76 4.662 -6.264 7.194 1.00 3.17 C ATOM 2847 CZ TYR B 76 3.833 -6.373 6.068 1.00 2.59 C ATOM 2848 OH TYR B 76 4.163 -7.242 5.072 1.00 3.53 O ATOM 0 H TYR B 76 2.851 -1.268 10.196 1.00 0.95 H new ATOM 0 HA TYR B 76 4.814 -2.230 8.658 1.00 0.94 H new ATOM 0 HB2 TYR B 76 3.373 -3.626 10.032 1.00 1.01 H new ATOM 0 HB3 TYR B 76 1.943 -3.151 9.136 1.00 1.01 H new ATOM 0 HD1 TYR B 76 1.380 -4.194 6.992 1.00 1.98 H new ATOM 0 HD2 TYR B 76 4.980 -5.273 9.085 1.00 2.58 H new ATOM 0 HE1 TYR B 76 2.020 -5.691 5.117 1.00 2.46 H new ATOM 0 HE2 TYR B 76 5.550 -6.874 7.272 1.00 3.17 H new ATOM 0 HH TYR B 76 5.091 -7.088 4.798 1.00 3.53 H new ATOM 2858 N TRP B 77 2.330 -1.374 6.683 1.00 0.87 N ATOM 2859 CA TRP B 77 1.979 -1.085 5.298 1.00 0.83 C ATOM 2860 C TRP B 77 3.211 -0.552 4.572 1.00 0.87 C ATOM 2861 O TRP B 77 3.494 -1.019 3.476 1.00 1.00 O ATOM 2862 CB TRP B 77 0.767 -0.121 5.180 1.00 0.81 C ATOM 2863 CG TRP B 77 0.908 1.028 4.208 1.00 0.87 C ATOM 2864 CD1 TRP B 77 1.443 0.968 2.969 1.00 1.67 C ATOM 2865 CD2 TRP B 77 0.447 2.409 4.310 1.00 1.98 C ATOM 2866 NE1 TRP B 77 1.759 2.239 2.559 1.00 1.98 N ATOM 2867 CE2 TRP B 77 1.098 3.184 3.303 1.00 2.19 C ATOM 2868 CE3 TRP B 77 -0.549 3.084 5.035 1.00 3.50 C ATOM 2869 CZ2 TRP B 77 0.909 4.579 3.184 1.00 3.38 C ATOM 2870 CZ3 TRP B 77 -1.042 4.262 4.451 1.00 4.47 C ATOM 2871 CH2 TRP B 77 -0.091 5.160 3.965 1.00 4.54 C ATOM 0 H TRP B 77 1.600 -1.124 7.350 1.00 0.87 H new ATOM 0 HA TRP B 77 1.658 -2.011 4.820 1.00 0.83 H new ATOM 0 HB2 TRP B 77 -0.107 -0.706 4.892 1.00 0.81 H new ATOM 0 HB3 TRP B 77 0.563 0.292 6.168 1.00 0.81 H new ATOM 0 HD1 TRP B 77 1.597 0.066 2.395 1.00 1.67 H new ATOM 0 HE1 TRP B 77 2.403 2.454 1.798 1.00 1.98 H new ATOM 0 HE3 TRP B 77 -0.913 2.719 5.984 1.00 3.50 H new ATOM 0 HZ2 TRP B 77 1.515 5.172 2.515 1.00 3.38 H new ATOM 0 HZ3 TRP B 77 -2.101 4.462 4.382 1.00 4.47 H new ATOM 0 HH2 TRP B 77 -0.126 6.219 4.176 1.00 4.54 H new ATOM 2882 N ARG B 78 3.918 0.423 5.154 1.00 0.81 N ATOM 2883 CA ARG B 78 4.960 1.188 4.484 1.00 0.76 C ATOM 2884 C ARG B 78 5.819 0.335 3.551 1.00 0.64 C ATOM 2885 O ARG B 78 6.020 0.740 2.419 1.00 0.69 O ATOM 2886 CB ARG B 78 5.847 1.872 5.521 1.00 0.80 C ATOM 2887 CG ARG B 78 5.177 3.051 6.236 1.00 1.12 C ATOM 2888 CD ARG B 78 5.228 4.322 5.384 1.00 1.83 C ATOM 2889 NE ARG B 78 4.696 5.470 6.134 1.00 2.83 N ATOM 2890 CZ ARG B 78 4.792 6.751 5.747 1.00 3.70 C ATOM 2891 NH1 ARG B 78 5.352 7.051 4.569 1.00 4.03 N ATOM 2892 NH2 ARG B 78 4.330 7.725 6.540 1.00 4.92 N ATOM 0 H ARG B 78 3.774 0.703 6.124 1.00 0.81 H new ATOM 0 HA ARG B 78 4.459 1.932 3.864 1.00 0.76 H new ATOM 0 HB2 ARG B 78 6.153 1.136 6.265 1.00 0.80 H new ATOM 0 HB3 ARG B 78 6.754 2.226 5.031 1.00 0.80 H new ATOM 0 HG2 ARG B 78 4.140 2.802 6.459 1.00 1.12 H new ATOM 0 HG3 ARG B 78 5.674 3.230 7.190 1.00 1.12 H new ATOM 0 HD2 ARG B 78 6.256 4.523 5.082 1.00 1.83 H new ATOM 0 HD3 ARG B 78 4.650 4.178 4.471 1.00 1.83 H new ATOM 0 HE ARG B 78 4.218 5.278 7.014 1.00 2.83 H new ATOM 0 HH11 ARG B 78 5.705 6.306 3.968 1.00 4.03 H new ATOM 0 HH12 ARG B 78 5.426 8.024 4.273 1.00 4.03 H new ATOM 0 HH21 ARG B 78 3.905 7.493 7.438 1.00 4.92 H new ATOM 0 HH22 ARG B 78 4.403 8.699 6.246 1.00 4.92 H new ATOM 2906 N LEU B 79 6.289 -0.844 3.969 1.00 0.58 N ATOM 2907 CA LEU B 79 7.087 -1.711 3.108 1.00 0.53 C ATOM 2908 C LEU B 79 6.366 -2.093 1.811 1.00 0.59 C ATOM 2909 O LEU B 79 6.948 -2.038 0.733 1.00 0.57 O ATOM 2910 CB LEU B 79 7.441 -2.982 3.876 1.00 0.69 C ATOM 2911 CG LEU B 79 8.534 -3.773 3.140 1.00 0.71 C ATOM 2912 CD1 LEU B 79 9.905 -3.306 3.629 1.00 0.69 C ATOM 2913 CD2 LEU B 79 8.330 -5.279 3.314 1.00 0.86 C ATOM 0 H LEU B 79 6.127 -1.218 4.904 1.00 0.58 H new ATOM 0 HA LEU B 79 7.982 -1.155 2.827 1.00 0.53 H new ATOM 0 HB2 LEU B 79 7.784 -2.724 4.878 1.00 0.69 H new ATOM 0 HB3 LEU B 79 6.552 -3.602 3.993 1.00 0.69 H new ATOM 0 HG LEU B 79 8.473 -3.580 2.069 1.00 0.71 H new ATOM 0 HD11 LEU B 79 10.685 -3.863 3.111 1.00 0.69 H new ATOM 0 HD12 LEU B 79 10.022 -2.242 3.423 1.00 0.69 H new ATOM 0 HD13 LEU B 79 9.987 -3.479 4.702 1.00 0.69 H new ATOM 0 HD21 LEU B 79 9.116 -5.816 2.784 1.00 0.86 H new ATOM 0 HD22 LEU B 79 8.369 -5.531 4.374 1.00 0.86 H new ATOM 0 HD23 LEU B 79 7.359 -5.564 2.909 1.00 0.86 H new ATOM 2925 N ILE B 80 5.101 -2.489 1.923 1.00 0.81 N ATOM 2926 CA ILE B 80 4.240 -2.843 0.801 1.00 0.93 C ATOM 2927 C ILE B 80 4.016 -1.570 -0.006 1.00 1.08 C ATOM 2928 O ILE B 80 4.081 -1.569 -1.237 1.00 1.11 O ATOM 2929 CB ILE B 80 2.918 -3.481 1.277 1.00 1.18 C ATOM 2930 CG1 ILE B 80 3.234 -4.774 2.054 1.00 1.62 C ATOM 2931 CG2 ILE B 80 2.010 -3.773 0.069 1.00 1.34 C ATOM 2932 CD1 ILE B 80 1.996 -5.628 2.345 1.00 2.02 C ATOM 0 H ILE B 80 4.634 -2.575 2.826 1.00 0.81 H new ATOM 0 HA ILE B 80 4.711 -3.601 0.175 1.00 0.93 H new ATOM 0 HB ILE B 80 2.390 -2.792 1.937 1.00 1.18 H new ATOM 0 HG12 ILE B 80 3.949 -5.367 1.483 1.00 1.62 H new ATOM 0 HG13 ILE B 80 3.716 -4.514 2.996 1.00 1.62 H new ATOM 0 HG21 ILE B 80 1.079 -4.223 0.414 1.00 1.34 H new ATOM 0 HG22 ILE B 80 1.791 -2.843 -0.455 1.00 1.34 H new ATOM 0 HG23 ILE B 80 2.516 -4.460 -0.609 1.00 1.34 H new ATOM 0 HD11 ILE B 80 2.292 -6.522 2.894 1.00 2.02 H new ATOM 0 HD12 ILE B 80 1.289 -5.052 2.943 1.00 2.02 H new ATOM 0 HD13 ILE B 80 1.525 -5.918 1.406 1.00 2.02 H new ATOM 2944 N GLY B 81 3.808 -0.477 0.735 1.00 1.33 N ATOM 2945 CA GLY B 81 3.736 0.873 0.239 1.00 1.64 C ATOM 2946 C GLY B 81 4.859 1.084 -0.774 1.00 1.51 C ATOM 2947 O GLY B 81 4.652 1.487 -1.915 1.00 1.80 O ATOM 0 H GLY B 81 3.681 -0.528 1.746 1.00 1.33 H new ATOM 0 HA2 GLY B 81 2.768 1.053 -0.228 1.00 1.64 H new ATOM 0 HA3 GLY B 81 3.830 1.583 1.061 1.00 1.64 H new ATOM 2951 N GLU B 82 6.076 0.833 -0.289 1.00 1.16 N ATOM 2952 CA GLU B 82 7.316 1.104 -0.962 1.00 1.19 C ATOM 2953 C GLU B 82 7.450 0.157 -2.141 1.00 1.14 C ATOM 2954 O GLU B 82 7.497 0.601 -3.284 1.00 1.37 O ATOM 2955 CB GLU B 82 8.468 0.922 0.035 1.00 1.00 C ATOM 2956 CG GLU B 82 8.515 1.998 1.128 1.00 0.90 C ATOM 2957 CD GLU B 82 9.849 2.727 1.095 1.00 1.12 C ATOM 2958 OE1 GLU B 82 9.980 3.614 0.221 1.00 2.13 O ATOM 2959 OE2 GLU B 82 10.741 2.343 1.888 1.00 2.20 O ATOM 0 H GLU B 82 6.214 0.414 0.631 1.00 1.16 H new ATOM 0 HA GLU B 82 7.342 2.127 -1.337 1.00 1.19 H new ATOM 0 HB2 GLU B 82 8.378 -0.057 0.505 1.00 1.00 H new ATOM 0 HB3 GLU B 82 9.412 0.929 -0.510 1.00 1.00 H new ATOM 0 HG2 GLU B 82 7.701 2.708 0.983 1.00 0.90 H new ATOM 0 HG3 GLU B 82 8.368 1.539 2.106 1.00 0.90 H new ATOM 2966 N LEU B 83 7.492 -1.151 -1.883 1.00 0.87 N ATOM 2967 CA LEU B 83 7.794 -2.123 -2.921 1.00 0.87 C ATOM 2968 C LEU B 83 6.878 -1.956 -4.143 1.00 0.87 C ATOM 2969 O LEU B 83 7.318 -2.167 -5.275 1.00 0.94 O ATOM 2970 CB LEU B 83 7.922 -3.542 -2.345 1.00 1.32 C ATOM 2971 CG LEU B 83 6.642 -4.104 -1.716 1.00 0.72 C ATOM 2972 CD1 LEU B 83 5.694 -4.782 -2.705 1.00 1.95 C ATOM 2973 CD2 LEU B 83 6.987 -5.115 -0.615 1.00 1.33 C ATOM 0 H LEU B 83 7.320 -1.556 -0.963 1.00 0.87 H new ATOM 0 HA LEU B 83 8.786 -1.922 -3.325 1.00 0.87 H new ATOM 0 HB2 LEU B 83 8.243 -4.214 -3.141 1.00 1.32 H new ATOM 0 HB3 LEU B 83 8.710 -3.542 -1.591 1.00 1.32 H new ATOM 0 HG LEU B 83 6.122 -3.234 -1.315 1.00 0.72 H new ATOM 0 HD11 LEU B 83 4.816 -5.150 -2.174 1.00 1.95 H new ATOM 0 HD12 LEU B 83 5.385 -4.063 -3.464 1.00 1.95 H new ATOM 0 HD13 LEU B 83 6.204 -5.618 -3.184 1.00 1.95 H new ATOM 0 HD21 LEU B 83 6.068 -5.505 -0.178 1.00 1.33 H new ATOM 0 HD22 LEU B 83 7.563 -5.936 -1.042 1.00 1.33 H new ATOM 0 HD23 LEU B 83 7.576 -4.623 0.159 1.00 1.33 H new ATOM 2985 N ALA B 84 5.644 -1.478 -3.919 1.00 0.96 N ATOM 2986 CA ALA B 84 4.753 -1.053 -4.987 1.00 1.14 C ATOM 2987 C ALA B 84 5.389 -0.066 -5.974 1.00 1.19 C ATOM 2988 O ALA B 84 5.266 -0.273 -7.178 1.00 1.51 O ATOM 2989 CB ALA B 84 3.439 -0.511 -4.421 1.00 1.25 C ATOM 0 H ALA B 84 5.244 -1.379 -2.986 1.00 0.96 H new ATOM 0 HA ALA B 84 4.539 -1.948 -5.572 1.00 1.14 H new ATOM 0 HB1 ALA B 84 2.791 -0.200 -5.240 1.00 1.25 H new ATOM 0 HB2 ALA B 84 2.943 -1.290 -3.842 1.00 1.25 H new ATOM 0 HB3 ALA B 84 3.645 0.344 -3.777 1.00 1.25 H new ATOM 2995 N LYS B 85 6.059 1.002 -5.511 1.00 1.01 N ATOM 2996 CA LYS B 85 6.808 1.850 -6.439 1.00 1.15 C ATOM 2997 C LYS B 85 8.134 1.207 -6.850 1.00 1.07 C ATOM 2998 O LYS B 85 8.548 1.342 -8.004 1.00 1.12 O ATOM 2999 CB LYS B 85 6.943 3.328 -6.033 1.00 1.54 C ATOM 3000 CG LYS B 85 8.168 3.738 -5.202 1.00 1.02 C ATOM 3001 CD LYS B 85 7.936 3.494 -3.712 1.00 1.77 C ATOM 3002 CE LYS B 85 8.359 4.684 -2.851 1.00 0.76 C ATOM 3003 NZ LYS B 85 9.702 4.488 -2.266 1.00 1.54 N ATOM 0 H LYS B 85 6.096 1.289 -4.533 1.00 1.01 H new ATOM 0 HA LYS B 85 6.182 1.906 -7.329 1.00 1.15 H new ATOM 0 HB2 LYS B 85 6.942 3.926 -6.944 1.00 1.54 H new ATOM 0 HB3 LYS B 85 6.051 3.603 -5.471 1.00 1.54 H new ATOM 0 HG2 LYS B 85 9.040 3.174 -5.533 1.00 1.02 H new ATOM 0 HG3 LYS B 85 8.388 4.792 -5.370 1.00 1.02 H new ATOM 0 HD2 LYS B 85 6.880 3.284 -3.542 1.00 1.77 H new ATOM 0 HD3 LYS B 85 8.492 2.609 -3.401 1.00 1.77 H new ATOM 0 HE2 LYS B 85 8.355 5.590 -3.456 1.00 0.76 H new ATOM 0 HE3 LYS B 85 7.632 4.831 -2.052 1.00 0.76 H new ATOM 0 HZ1 LYS B 85 10.110 5.411 -2.015 1.00 1.54 H new ATOM 0 HZ2 LYS B 85 9.626 3.900 -1.412 1.00 1.54 H new ATOM 0 HZ3 LYS B 85 10.317 4.015 -2.959 1.00 1.54 H new ATOM 3017 N GLU B 86 8.829 0.562 -5.905 1.00 1.01 N ATOM 3018 CA GLU B 86 10.220 0.172 -6.108 1.00 1.04 C ATOM 3019 C GLU B 86 10.415 -0.689 -7.353 1.00 0.89 C ATOM 3020 O GLU B 86 11.458 -0.565 -7.991 1.00 1.04 O ATOM 3021 CB GLU B 86 10.779 -0.618 -4.914 1.00 1.07 C ATOM 3022 CG GLU B 86 10.837 0.181 -3.603 1.00 1.28 C ATOM 3023 CD GLU B 86 11.633 1.477 -3.706 1.00 1.92 C ATOM 3024 OE1 GLU B 86 12.841 1.374 -3.996 1.00 2.05 O ATOM 3025 OE2 GLU B 86 11.022 2.545 -3.466 1.00 2.94 O ATOM 0 H GLU B 86 8.447 0.302 -4.996 1.00 1.01 H new ATOM 0 HA GLU B 86 10.757 1.114 -6.224 1.00 1.04 H new ATOM 0 HB2 GLU B 86 10.164 -1.505 -4.759 1.00 1.07 H new ATOM 0 HB3 GLU B 86 11.783 -0.965 -5.160 1.00 1.07 H new ATOM 0 HG2 GLU B 86 9.821 0.414 -3.286 1.00 1.28 H new ATOM 0 HG3 GLU B 86 11.278 -0.444 -2.827 1.00 1.28 H new ATOM 3032 N ILE B 87 9.442 -1.543 -7.706 1.00 0.71 N ATOM 3033 CA ILE B 87 9.482 -2.297 -8.951 1.00 0.71 C ATOM 3034 C ILE B 87 9.950 -1.421 -10.120 1.00 0.78 C ATOM 3035 O ILE B 87 10.794 -1.828 -10.915 1.00 0.93 O ATOM 3036 CB ILE B 87 8.102 -2.931 -9.204 1.00 0.71 C ATOM 3037 CG1 ILE B 87 8.222 -3.947 -10.350 1.00 0.76 C ATOM 3038 CG2 ILE B 87 6.999 -1.903 -9.505 1.00 0.84 C ATOM 3039 CD1 ILE B 87 7.136 -5.003 -10.211 1.00 0.66 C ATOM 0 H ILE B 87 8.615 -1.724 -7.136 1.00 0.71 H new ATOM 0 HA ILE B 87 10.215 -3.099 -8.866 1.00 0.71 H new ATOM 0 HB ILE B 87 7.797 -3.428 -8.283 1.00 0.71 H new ATOM 0 HG12 ILE B 87 8.129 -3.440 -11.310 1.00 0.76 H new ATOM 0 HG13 ILE B 87 9.205 -4.417 -10.331 1.00 0.76 H new ATOM 0 HG21 ILE B 87 6.055 -2.421 -9.673 1.00 0.84 H new ATOM 0 HG22 ILE B 87 6.895 -1.223 -8.659 1.00 0.84 H new ATOM 0 HG23 ILE B 87 7.265 -1.335 -10.397 1.00 0.84 H new ATOM 0 HD11 ILE B 87 7.222 -5.723 -11.025 1.00 0.66 H new ATOM 0 HD12 ILE B 87 7.249 -5.518 -9.257 1.00 0.66 H new ATOM 0 HD13 ILE B 87 6.157 -4.526 -10.251 1.00 0.66 H new ATOM 3051 N ARG B 88 9.394 -0.209 -10.216 1.00 0.86 N ATOM 3052 CA ARG B 88 9.822 0.809 -11.154 1.00 1.09 C ATOM 3053 C ARG B 88 11.018 1.607 -10.618 1.00 1.13 C ATOM 3054 O ARG B 88 11.898 1.990 -11.387 1.00 1.42 O ATOM 3055 CB ARG B 88 8.621 1.712 -11.469 1.00 1.36 C ATOM 3056 CG ARG B 88 8.867 2.592 -12.699 1.00 1.88 C ATOM 3057 CD ARG B 88 7.648 3.493 -12.946 1.00 2.39 C ATOM 3058 NE ARG B 88 7.727 4.193 -14.239 1.00 3.04 N ATOM 3059 CZ ARG B 88 8.484 5.270 -14.503 1.00 3.03 C ATOM 3060 NH1 ARG B 88 9.280 5.772 -13.554 1.00 3.30 N ATOM 3061 NH2 ARG B 88 8.442 5.837 -15.713 1.00 3.90 N ATOM 0 H ARG B 88 8.617 0.089 -9.626 1.00 0.86 H new ATOM 0 HA ARG B 88 10.169 0.338 -12.074 1.00 1.09 H new ATOM 0 HB2 ARG B 88 7.738 1.095 -11.636 1.00 1.36 H new ATOM 0 HB3 ARG B 88 8.409 2.345 -10.608 1.00 1.36 H new ATOM 0 HG2 ARG B 88 9.757 3.202 -12.549 1.00 1.88 H new ATOM 0 HG3 ARG B 88 9.052 1.968 -13.573 1.00 1.88 H new ATOM 0 HD2 ARG B 88 6.741 2.890 -12.916 1.00 2.39 H new ATOM 0 HD3 ARG B 88 7.571 4.225 -12.142 1.00 2.39 H new ATOM 0 HE ARG B 88 7.156 3.827 -15.001 1.00 3.04 H new ATOM 0 HH11 ARG B 88 9.311 5.337 -12.632 1.00 3.30 H new ATOM 0 HH12 ARG B 88 9.856 6.590 -13.752 1.00 3.30 H new ATOM 0 HH21 ARG B 88 7.835 5.451 -16.436 1.00 3.90 H new ATOM 0 HH22 ARG B 88 9.017 6.655 -15.913 1.00 3.90 H new ATOM 3075 N LYS B 89 10.972 1.992 -9.336 1.00 1.06 N ATOM 3076 CA LYS B 89 11.515 3.268 -8.896 1.00 1.60 C ATOM 3077 C LYS B 89 12.398 3.191 -7.641 1.00 2.23 C ATOM 3078 O LYS B 89 12.041 3.733 -6.598 1.00 3.35 O ATOM 3079 CB LYS B 89 10.308 4.167 -8.645 1.00 2.48 C ATOM 3080 CG LYS B 89 10.681 5.637 -8.733 1.00 3.21 C ATOM 3081 CD LYS B 89 9.451 6.354 -8.213 1.00 3.92 C ATOM 3082 CE LYS B 89 9.569 7.847 -8.531 1.00 5.21 C ATOM 3083 NZ LYS B 89 8.662 8.648 -7.701 1.00 6.18 N ATOM 0 H LYS B 89 10.562 1.431 -8.589 1.00 1.06 H new ATOM 0 HA LYS B 89 12.184 3.652 -9.666 1.00 1.60 H new ATOM 0 HB2 LYS B 89 9.529 3.944 -9.374 1.00 2.48 H new ATOM 0 HB3 LYS B 89 9.893 3.954 -7.660 1.00 2.48 H new ATOM 0 HG2 LYS B 89 11.561 5.863 -8.130 1.00 3.21 H new ATOM 0 HG3 LYS B 89 10.912 5.930 -9.757 1.00 3.21 H new ATOM 0 HD2 LYS B 89 8.553 5.942 -8.673 1.00 3.92 H new ATOM 0 HD3 LYS B 89 9.356 6.205 -7.137 1.00 3.92 H new ATOM 0 HE2 LYS B 89 10.596 8.174 -8.369 1.00 5.21 H new ATOM 0 HE3 LYS B 89 9.343 8.015 -9.584 1.00 5.21 H new ATOM 0 HZ1 LYS B 89 7.805 8.877 -8.244 1.00 6.18 H new ATOM 0 HZ2 LYS B 89 8.400 8.107 -6.852 1.00 6.18 H new ATOM 0 HZ3 LYS B 89 9.137 9.528 -7.417 1.00 6.18 H new