USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.196 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot -46:sc= -0.154 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0.383 K(o=0.38,f=-1.6!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 138:sc= 0.678 (180deg=-0.345) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 THR OG1 : rot 130:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 47 SER OG : rot 42:sc= 0.0529 USER MOD Single : A 50 SER OG : rot -148:sc= 1.25 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -68:sc= 0.0598 USER MOD Single : A 68 THR OG1 : rot 90:sc= 0.269 USER MOD Single : A 69 THR OG1 : rot -61:sc= 0.29 USER MOD Single : A 78 SER OG : rot 39:sc= 0.209 USER MOD Single : A 90 ASN : amide:sc= -0.0316 K(o=-0.032,f=-0.93) USER MOD Single : A 93 MET CE :methyl 137:sc= -1.95 (180deg=-6.58!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 161:sc= -0.0222 (180deg=-0.0589) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.115 F(o=-1.5,f=-0.12) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 30:sc= 1.17 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.17 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot -15:sc= 1.28 USER MOD Single : A 128 TYR OH : rot 52:sc= 0.813 USER MOD Single : A 129 ASN :FLIP amide:sc= -0.0344 F(o=-1.1,f=-0.034) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -38.140 8.411 2.840 1.00 0.00 N ATOM 2 CA GLY A 1 -36.875 7.809 2.434 1.00 0.00 C ATOM 3 C GLY A 1 -35.763 8.456 3.223 1.00 0.00 C ATOM 4 O GLY A 1 -36.053 8.962 4.307 1.00 0.00 O ATOM 0 H1 GLY A 1 -38.819 7.662 3.082 1.00 0.00 H new ATOM 0 H2 GLY A 1 -37.985 9.019 3.669 1.00 0.00 H new ATOM 0 H3 GLY A 1 -38.519 8.982 2.058 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -36.892 6.734 2.614 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -36.714 7.951 1.365 1.00 0.00 H new ATOM 8 N ASP A 2 -34.564 8.479 2.649 1.00 0.00 N ATOM 9 CA ASP A 2 -33.299 8.190 3.326 1.00 0.00 C ATOM 10 C ASP A 2 -33.328 6.672 3.470 1.00 0.00 C ATOM 11 O ASP A 2 -33.937 6.120 4.387 1.00 0.00 O ATOM 12 CB ASP A 2 -33.055 8.962 4.636 1.00 0.00 C ATOM 13 CG ASP A 2 -31.572 8.913 5.033 1.00 0.00 C ATOM 14 OD1 ASP A 2 -30.771 9.660 4.435 1.00 0.00 O ATOM 15 OD2 ASP A 2 -31.219 8.157 5.974 1.00 0.00 O ATOM 0 H ASP A 2 -34.439 8.708 1.663 1.00 0.00 H new ATOM 0 HA ASP A 2 -32.440 8.541 2.754 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -33.369 9.999 4.516 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -33.663 8.535 5.433 1.00 0.00 H new ATOM 20 N ASP A 3 -32.907 6.017 2.391 1.00 0.00 N ATOM 21 CA ASP A 3 -33.183 4.633 2.053 1.00 0.00 C ATOM 22 C ASP A 3 -32.122 4.217 1.034 1.00 0.00 C ATOM 23 O ASP A 3 -31.777 4.970 0.120 1.00 0.00 O ATOM 24 CB ASP A 3 -34.630 4.421 1.553 1.00 0.00 C ATOM 25 CG ASP A 3 -35.140 5.325 0.418 1.00 0.00 C ATOM 26 OD1 ASP A 3 -35.179 6.565 0.614 1.00 0.00 O ATOM 27 OD2 ASP A 3 -35.707 4.780 -0.553 1.00 0.00 O ATOM 0 H ASP A 3 -32.327 6.473 1.687 1.00 0.00 H new ATOM 0 HA ASP A 3 -33.122 3.998 2.937 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -34.721 3.386 1.223 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -35.299 4.544 2.405 1.00 0.00 H new ATOM 32 N ASP A 4 -31.512 3.059 1.284 1.00 0.00 N ATOM 33 CA ASP A 4 -30.244 2.609 0.716 1.00 0.00 C ATOM 34 C ASP A 4 -30.189 1.090 0.874 1.00 0.00 C ATOM 35 O ASP A 4 -30.831 0.561 1.790 1.00 0.00 O ATOM 36 CB ASP A 4 -29.076 3.222 1.519 1.00 0.00 C ATOM 37 CG ASP A 4 -28.540 4.530 0.950 1.00 0.00 C ATOM 38 OD1 ASP A 4 -28.193 4.529 -0.254 1.00 0.00 O ATOM 39 OD2 ASP A 4 -28.383 5.488 1.740 1.00 0.00 O ATOM 0 H ASP A 4 -31.912 2.373 1.924 1.00 0.00 H new ATOM 0 HA ASP A 4 -30.166 2.907 -0.329 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -29.406 3.394 2.544 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -28.262 2.498 1.563 1.00 0.00 H new ATOM 44 N GLU A 5 -29.361 0.390 0.092 1.00 0.00 N ATOM 45 CA GLU A 5 -29.232 -1.066 0.176 1.00 0.00 C ATOM 46 C GLU A 5 -27.762 -1.541 0.194 1.00 0.00 C ATOM 47 O GLU A 5 -27.329 -2.296 -0.684 1.00 0.00 O ATOM 48 CB GLU A 5 -30.105 -1.742 -0.894 1.00 0.00 C ATOM 49 CG GLU A 5 -29.766 -1.401 -2.360 1.00 0.00 C ATOM 50 CD GLU A 5 -29.971 -2.576 -3.324 1.00 0.00 C ATOM 51 OE1 GLU A 5 -29.600 -3.728 -2.981 1.00 0.00 O ATOM 52 OE2 GLU A 5 -30.311 -2.322 -4.496 1.00 0.00 O ATOM 0 H GLU A 5 -28.763 0.817 -0.615 1.00 0.00 H new ATOM 0 HA GLU A 5 -29.617 -1.389 1.143 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -30.030 -2.822 -0.767 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -31.145 -1.471 -0.710 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -30.385 -0.564 -2.683 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -28.729 -1.071 -2.418 1.00 0.00 H new ATOM 59 N PRO A 6 -26.968 -1.149 1.206 1.00 0.00 N ATOM 60 CA PRO A 6 -25.548 -1.448 1.263 1.00 0.00 C ATOM 61 C PRO A 6 -25.336 -2.935 1.560 1.00 0.00 C ATOM 62 O PRO A 6 -25.428 -3.359 2.718 1.00 0.00 O ATOM 63 CB PRO A 6 -24.999 -0.534 2.365 1.00 0.00 C ATOM 64 CG PRO A 6 -26.173 -0.392 3.336 1.00 0.00 C ATOM 65 CD PRO A 6 -27.378 -0.416 2.396 1.00 0.00 C ATOM 0 HA PRO A 6 -25.029 -1.266 0.322 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -24.128 -0.972 2.852 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -24.690 0.432 1.967 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -26.204 -1.208 4.058 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -26.120 0.536 3.905 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -28.231 -0.899 2.873 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -27.688 0.597 2.139 1.00 0.00 H new ATOM 73 N GLY A 7 -24.986 -3.745 0.560 1.00 0.00 N ATOM 74 CA GLY A 7 -24.789 -5.169 0.785 1.00 0.00 C ATOM 75 C GLY A 7 -24.708 -6.035 -0.465 1.00 0.00 C ATOM 76 O GLY A 7 -25.153 -7.181 -0.386 1.00 0.00 O ATOM 0 H GLY A 7 -24.836 -3.440 -0.402 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.871 -5.303 1.357 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -25.607 -5.536 1.405 1.00 0.00 H new ATOM 80 N GLY A 8 -24.162 -5.553 -1.586 1.00 0.00 N ATOM 81 CA GLY A 8 -23.986 -6.333 -2.810 1.00 0.00 C ATOM 82 C GLY A 8 -22.551 -6.230 -3.327 1.00 0.00 C ATOM 83 O GLY A 8 -21.657 -6.867 -2.763 1.00 0.00 O ATOM 0 H GLY A 8 -23.825 -4.594 -1.667 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -24.233 -7.377 -2.618 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -24.677 -5.978 -3.574 1.00 0.00 H new ATOM 87 N LYS A 9 -22.314 -5.484 -4.410 1.00 0.00 N ATOM 88 CA LYS A 9 -20.982 -5.389 -5.018 1.00 0.00 C ATOM 89 C LYS A 9 -20.066 -4.552 -4.128 1.00 0.00 C ATOM 90 O LYS A 9 -20.473 -3.494 -3.629 1.00 0.00 O ATOM 91 CB LYS A 9 -21.058 -4.716 -6.401 1.00 0.00 C ATOM 92 CG LYS A 9 -21.684 -5.565 -7.515 1.00 0.00 C ATOM 93 CD LYS A 9 -20.696 -6.567 -8.128 1.00 0.00 C ATOM 94 CE LYS A 9 -21.330 -7.233 -9.355 1.00 0.00 C ATOM 95 NZ LYS A 9 -20.477 -8.307 -9.901 1.00 0.00 N ATOM 0 H LYS A 9 -23.030 -4.935 -4.886 1.00 0.00 H new ATOM 0 HA LYS A 9 -20.590 -6.400 -5.127 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -21.631 -3.793 -6.306 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -20.050 -4.435 -6.705 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -22.541 -6.106 -7.114 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -22.060 -4.907 -8.299 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -19.776 -6.057 -8.414 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -20.426 -7.323 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -22.302 -7.644 -9.083 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -21.506 -6.482 -10.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -20.941 -8.732 -10.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -19.558 -7.910 -10.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -20.330 -9.037 -9.175 1.00 0.00 H new ATOM 109 N GLY A 10 -18.792 -4.931 -4.085 1.00 0.00 N ATOM 110 CA GLY A 10 -17.731 -4.181 -3.432 1.00 0.00 C ATOM 111 C GLY A 10 -17.591 -4.508 -1.948 1.00 0.00 C ATOM 112 O GLY A 10 -18.500 -5.053 -1.313 1.00 0.00 O ATOM 0 H GLY A 10 -18.463 -5.794 -4.517 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -16.786 -4.388 -3.934 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -17.925 -3.115 -3.546 1.00 0.00 H new ATOM 116 N ALA A 11 -16.462 -4.104 -1.359 1.00 0.00 N ATOM 117 CA ALA A 11 -16.166 -4.294 0.055 1.00 0.00 C ATOM 118 C ALA A 11 -15.574 -3.038 0.678 1.00 0.00 C ATOM 119 O ALA A 11 -15.137 -2.128 -0.019 1.00 0.00 O ATOM 120 CB ALA A 11 -15.204 -5.478 0.243 1.00 0.00 C ATOM 0 H ALA A 11 -15.716 -3.627 -1.866 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.106 -4.509 0.563 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.991 -5.609 1.304 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -15.663 -6.385 -0.150 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -14.275 -5.280 -0.292 1.00 0.00 H new ATOM 126 N MET A 12 -15.528 -3.011 2.006 1.00 0.00 N ATOM 127 CA MET A 12 -14.601 -2.155 2.722 1.00 0.00 C ATOM 128 C MET A 12 -13.260 -2.892 2.815 1.00 0.00 C ATOM 129 O MET A 12 -13.260 -4.130 2.893 1.00 0.00 O ATOM 130 CB MET A 12 -15.139 -1.850 4.123 1.00 0.00 C ATOM 131 CG MET A 12 -16.328 -0.895 4.057 1.00 0.00 C ATOM 132 SD MET A 12 -17.043 -0.465 5.664 1.00 0.00 S ATOM 133 CE MET A 12 -17.978 -1.970 6.036 1.00 0.00 C ATOM 0 H MET A 12 -16.127 -3.577 2.607 1.00 0.00 H new ATOM 0 HA MET A 12 -14.475 -1.207 2.198 1.00 0.00 H new ATOM 0 HB2 MET A 12 -15.440 -2.777 4.611 1.00 0.00 H new ATOM 0 HB3 MET A 12 -14.349 -1.411 4.732 1.00 0.00 H new ATOM 0 HG2 MET A 12 -16.013 0.021 3.558 1.00 0.00 H new ATOM 0 HG3 MET A 12 -17.104 -1.345 3.438 1.00 0.00 H new ATOM 0 HE1 MET A 12 -18.477 -1.860 6.999 1.00 0.00 H new ATOM 0 HE2 MET A 12 -18.723 -2.137 5.258 1.00 0.00 H new ATOM 0 HE3 MET A 12 -17.298 -2.821 6.075 1.00 0.00 H new ATOM 143 N TYR A 13 -12.150 -2.152 2.814 1.00 0.00 N ATOM 144 CA TYR A 13 -10.816 -2.651 3.130 1.00 0.00 C ATOM 145 C TYR A 13 -9.952 -1.506 3.660 1.00 0.00 C ATOM 146 O TYR A 13 -10.184 -0.333 3.345 1.00 0.00 O ATOM 147 CB TYR A 13 -10.144 -3.309 1.909 1.00 0.00 C ATOM 148 CG TYR A 13 -9.506 -2.360 0.897 1.00 0.00 C ATOM 149 CD1 TYR A 13 -10.285 -1.365 0.275 1.00 0.00 C ATOM 150 CD2 TYR A 13 -8.126 -2.447 0.601 1.00 0.00 C ATOM 151 CE1 TYR A 13 -9.704 -0.463 -0.631 1.00 0.00 C ATOM 152 CE2 TYR A 13 -7.538 -1.558 -0.322 1.00 0.00 C ATOM 153 CZ TYR A 13 -8.335 -0.566 -0.945 1.00 0.00 C ATOM 154 OH TYR A 13 -7.816 0.356 -1.792 1.00 0.00 O ATOM 0 H TYR A 13 -12.158 -1.158 2.586 1.00 0.00 H new ATOM 0 HA TYR A 13 -10.916 -3.419 3.897 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.376 -3.993 2.268 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -10.890 -3.911 1.391 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -11.340 -1.295 0.497 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -7.519 -3.198 1.084 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -10.306 0.309 -1.087 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -6.486 -1.633 -0.553 1.00 0.00 H new ATOM 0 HH TYR A 13 -8.416 0.471 -2.558 1.00 0.00 H new ATOM 164 N GLU A 14 -8.903 -1.866 4.388 1.00 0.00 N ATOM 165 CA GLU A 14 -7.899 -1.006 4.994 1.00 0.00 C ATOM 166 C GLU A 14 -6.558 -1.666 4.644 1.00 0.00 C ATOM 167 O GLU A 14 -6.378 -2.864 4.870 1.00 0.00 O ATOM 168 CB GLU A 14 -8.194 -0.941 6.503 1.00 0.00 C ATOM 169 CG GLU A 14 -7.087 -0.426 7.438 1.00 0.00 C ATOM 170 CD GLU A 14 -7.474 -0.621 8.910 1.00 0.00 C ATOM 171 OE1 GLU A 14 -8.676 -0.467 9.256 1.00 0.00 O ATOM 172 OE2 GLU A 14 -6.568 -0.923 9.721 1.00 0.00 O ATOM 0 H GLU A 14 -8.719 -2.850 4.585 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.890 0.025 4.640 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.070 -0.308 6.644 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -8.468 -1.943 6.832 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.156 -0.954 7.230 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.904 0.631 7.243 1.00 0.00 H new ATOM 179 N VAL A 15 -5.635 -0.925 4.043 1.00 0.00 N ATOM 180 CA VAL A 15 -4.287 -1.394 3.733 1.00 0.00 C ATOM 181 C VAL A 15 -3.354 -0.398 4.399 1.00 0.00 C ATOM 182 O VAL A 15 -3.472 0.821 4.246 1.00 0.00 O ATOM 183 CB VAL A 15 -4.072 -1.629 2.217 1.00 0.00 C ATOM 184 CG1 VAL A 15 -4.640 -0.498 1.352 1.00 0.00 C ATOM 185 CG2 VAL A 15 -2.599 -1.750 1.853 1.00 0.00 C ATOM 0 H VAL A 15 -5.804 0.038 3.751 1.00 0.00 H new ATOM 0 HA VAL A 15 -4.082 -2.389 4.128 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.600 -2.561 2.015 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.459 -0.719 0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.713 -0.411 1.525 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.153 0.441 1.615 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -2.502 -1.914 0.780 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -2.080 -0.832 2.128 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -2.159 -2.591 2.390 1.00 0.00 H new ATOM 195 N THR A 16 -2.499 -0.957 5.243 1.00 0.00 N ATOM 196 CA THR A 16 -1.497 -0.237 5.992 1.00 0.00 C ATOM 197 C THR A 16 -0.183 -0.409 5.233 1.00 0.00 C ATOM 198 O THR A 16 0.121 -1.519 4.773 1.00 0.00 O ATOM 199 CB THR A 16 -1.464 -0.821 7.411 1.00 0.00 C ATOM 200 OG1 THR A 16 -2.790 -0.937 7.924 1.00 0.00 O ATOM 201 CG2 THR A 16 -0.680 0.094 8.331 1.00 0.00 C ATOM 0 H THR A 16 -2.489 -1.960 5.427 1.00 0.00 H new ATOM 0 HA THR A 16 -1.699 0.830 6.090 1.00 0.00 H new ATOM 0 HB THR A 16 -0.992 -1.803 7.365 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.759 -1.312 8.829 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.662 -0.329 9.336 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.340 0.194 7.961 1.00 0.00 H new ATOM 0 HG23 THR A 16 -1.154 1.075 8.359 1.00 0.00 H new ATOM 209 N ILE A 17 0.581 0.676 5.121 1.00 0.00 N ATOM 210 CA ILE A 17 1.879 0.693 4.477 1.00 0.00 C ATOM 211 C ILE A 17 2.832 1.359 5.459 1.00 0.00 C ATOM 212 O ILE A 17 2.468 2.368 6.070 1.00 0.00 O ATOM 213 CB ILE A 17 1.775 1.419 3.109 1.00 0.00 C ATOM 214 CG1 ILE A 17 3.126 1.430 2.366 1.00 0.00 C ATOM 215 CG2 ILE A 17 1.233 2.860 3.224 1.00 0.00 C ATOM 216 CD1 ILE A 17 3.496 0.060 1.807 1.00 0.00 C ATOM 0 H ILE A 17 0.301 1.586 5.487 1.00 0.00 H new ATOM 0 HA ILE A 17 2.254 -0.304 4.245 1.00 0.00 H new ATOM 0 HB ILE A 17 1.053 0.842 2.531 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.083 2.152 1.551 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.909 1.765 3.047 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.185 3.311 2.233 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.235 2.840 3.662 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.896 3.448 3.859 1.00 0.00 H new ATOM 0 HD11 ILE A 17 4.455 0.124 1.294 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.568 -0.659 2.623 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.729 -0.265 1.104 1.00 0.00 H new ATOM 228 N GLU A 18 4.057 0.846 5.569 1.00 0.00 N ATOM 229 CA GLU A 18 5.099 1.525 6.304 1.00 0.00 C ATOM 230 C GLU A 18 6.386 1.516 5.503 1.00 0.00 C ATOM 231 O GLU A 18 6.853 0.460 5.066 1.00 0.00 O ATOM 232 CB GLU A 18 5.315 0.872 7.670 1.00 0.00 C ATOM 233 CG GLU A 18 5.640 1.968 8.664 1.00 0.00 C ATOM 234 CD GLU A 18 6.144 1.477 10.019 1.00 0.00 C ATOM 235 OE1 GLU A 18 5.423 0.718 10.701 1.00 0.00 O ATOM 236 OE2 GLU A 18 7.212 1.959 10.468 1.00 0.00 O ATOM 0 H GLU A 18 4.343 -0.041 5.154 1.00 0.00 H new ATOM 0 HA GLU A 18 4.791 2.558 6.469 1.00 0.00 H new ATOM 0 HB2 GLU A 18 4.422 0.329 7.979 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.128 0.147 7.622 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.394 2.623 8.227 1.00 0.00 H new ATOM 0 HG3 GLU A 18 4.747 2.572 8.822 1.00 0.00 H new ATOM 243 N GLN A 19 6.982 2.695 5.360 1.00 0.00 N ATOM 244 CA GLN A 19 8.188 2.906 4.591 1.00 0.00 C ATOM 245 C GLN A 19 9.128 3.625 5.550 1.00 0.00 C ATOM 246 O GLN A 19 8.821 4.703 6.064 1.00 0.00 O ATOM 247 CB GLN A 19 7.879 3.682 3.288 1.00 0.00 C ATOM 248 CG GLN A 19 6.608 3.170 2.574 1.00 0.00 C ATOM 249 CD GLN A 19 6.169 4.094 1.454 1.00 0.00 C ATOM 250 OE1 GLN A 19 6.297 3.764 0.276 1.00 0.00 O ATOM 251 NE2 GLN A 19 5.599 5.225 1.825 1.00 0.00 N ATOM 0 H GLN A 19 6.625 3.548 5.790 1.00 0.00 H new ATOM 0 HA GLN A 19 8.651 1.986 4.236 1.00 0.00 H new ATOM 0 HB2 GLN A 19 7.758 4.740 3.520 1.00 0.00 H new ATOM 0 HB3 GLN A 19 8.729 3.599 2.611 1.00 0.00 H new ATOM 0 HG2 GLN A 19 6.796 2.175 2.170 1.00 0.00 H new ATOM 0 HG3 GLN A 19 5.800 3.072 3.299 1.00 0.00 H new ATOM 0 HE21 GLN A 19 5.517 5.454 2.816 1.00 0.00 H new ATOM 0 HE22 GLN A 19 5.241 5.871 1.121 1.00 0.00 H new ATOM 260 N SER A 20 10.232 2.980 5.888 1.00 0.00 N ATOM 261 CA SER A 20 11.286 3.512 6.732 1.00 0.00 C ATOM 262 C SER A 20 12.636 3.271 6.064 1.00 0.00 C ATOM 263 O SER A 20 12.774 2.419 5.178 1.00 0.00 O ATOM 264 CB SER A 20 11.185 2.879 8.121 1.00 0.00 C ATOM 265 OG SER A 20 10.937 1.487 8.074 1.00 0.00 O ATOM 0 H SER A 20 10.425 2.031 5.567 1.00 0.00 H new ATOM 0 HA SER A 20 11.180 4.589 6.860 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.112 3.060 8.666 1.00 0.00 H new ATOM 0 HB3 SER A 20 10.386 3.367 8.680 1.00 0.00 H new ATOM 0 HG SER A 20 10.883 1.133 8.986 1.00 0.00 H new ATOM 271 N GLY A 21 13.645 4.036 6.479 1.00 0.00 N ATOM 272 CA GLY A 21 14.908 4.146 5.767 1.00 0.00 C ATOM 273 C GLY A 21 14.769 5.148 4.622 1.00 0.00 C ATOM 274 O GLY A 21 13.812 5.927 4.573 1.00 0.00 O ATOM 0 H GLY A 21 13.604 4.600 7.328 1.00 0.00 H new ATOM 0 HA2 GLY A 21 15.695 4.467 6.450 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.202 3.172 5.377 1.00 0.00 H new ATOM 278 N ASP A 22 15.731 5.139 3.704 1.00 0.00 N ATOM 279 CA ASP A 22 15.937 6.183 2.699 1.00 0.00 C ATOM 280 C ASP A 22 15.068 6.023 1.440 1.00 0.00 C ATOM 281 O ASP A 22 15.533 6.178 0.313 1.00 0.00 O ATOM 282 CB ASP A 22 17.431 6.246 2.378 1.00 0.00 C ATOM 283 CG ASP A 22 17.880 7.626 1.905 1.00 0.00 C ATOM 284 OD1 ASP A 22 17.211 8.647 2.183 1.00 0.00 O ATOM 285 OD2 ASP A 22 19.032 7.743 1.435 1.00 0.00 O ATOM 0 H ASP A 22 16.411 4.382 3.635 1.00 0.00 H new ATOM 0 HA ASP A 22 15.605 7.133 3.117 1.00 0.00 H new ATOM 0 HB2 ASP A 22 18.000 5.969 3.265 1.00 0.00 H new ATOM 0 HB3 ASP A 22 17.663 5.510 1.608 1.00 0.00 H new ATOM 290 N PHE A 23 13.802 5.647 1.624 1.00 0.00 N ATOM 291 CA PHE A 23 12.849 5.193 0.608 1.00 0.00 C ATOM 292 C PHE A 23 12.676 6.124 -0.591 1.00 0.00 C ATOM 293 O PHE A 23 12.119 5.714 -1.609 1.00 0.00 O ATOM 294 CB PHE A 23 11.488 4.958 1.276 1.00 0.00 C ATOM 295 CG PHE A 23 10.890 6.140 2.029 1.00 0.00 C ATOM 296 CD1 PHE A 23 10.374 7.251 1.330 1.00 0.00 C ATOM 297 CD2 PHE A 23 10.823 6.117 3.436 1.00 0.00 C ATOM 298 CE1 PHE A 23 9.830 8.342 2.029 1.00 0.00 C ATOM 299 CE2 PHE A 23 10.251 7.196 4.139 1.00 0.00 C ATOM 300 CZ PHE A 23 9.752 8.304 3.431 1.00 0.00 C ATOM 0 H PHE A 23 13.384 5.652 2.555 1.00 0.00 H new ATOM 0 HA PHE A 23 13.268 4.275 0.196 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.779 4.648 0.508 1.00 0.00 H new ATOM 0 HB3 PHE A 23 11.588 4.125 1.972 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.397 7.263 0.250 1.00 0.00 H new ATOM 0 HD2 PHE A 23 11.212 5.268 3.979 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.473 9.207 1.490 1.00 0.00 H new ATOM 0 HE2 PHE A 23 10.196 7.172 5.217 1.00 0.00 H new ATOM 0 HZ PHE A 23 9.307 9.129 3.967 1.00 0.00 H new ATOM 310 N ARG A 24 13.108 7.381 -0.498 1.00 0.00 N ATOM 311 CA ARG A 24 12.998 8.297 -1.619 1.00 0.00 C ATOM 312 C ARG A 24 13.889 7.842 -2.786 1.00 0.00 C ATOM 313 O ARG A 24 13.575 8.162 -3.930 1.00 0.00 O ATOM 314 CB ARG A 24 13.275 9.752 -1.196 1.00 0.00 C ATOM 315 CG ARG A 24 12.847 10.175 0.228 1.00 0.00 C ATOM 316 CD ARG A 24 12.632 11.692 0.215 1.00 0.00 C ATOM 317 NE ARG A 24 12.144 12.234 1.489 1.00 0.00 N ATOM 318 CZ ARG A 24 11.208 13.184 1.613 1.00 0.00 C ATOM 319 NH1 ARG A 24 10.655 13.785 0.557 1.00 0.00 N ATOM 320 NH2 ARG A 24 10.806 13.527 2.823 1.00 0.00 N ATOM 0 H ARG A 24 13.534 7.781 0.338 1.00 0.00 H new ATOM 0 HA ARG A 24 11.968 8.275 -1.974 1.00 0.00 H new ATOM 0 HB2 ARG A 24 14.346 9.932 -1.293 1.00 0.00 H new ATOM 0 HB3 ARG A 24 12.775 10.410 -1.907 1.00 0.00 H new ATOM 0 HG2 ARG A 24 11.932 9.661 0.521 1.00 0.00 H new ATOM 0 HG3 ARG A 24 13.612 9.903 0.955 1.00 0.00 H new ATOM 0 HD2 ARG A 24 13.573 12.180 -0.040 1.00 0.00 H new ATOM 0 HD3 ARG A 24 11.920 11.942 -0.572 1.00 0.00 H new ATOM 0 HE ARG A 24 12.549 11.858 2.346 1.00 0.00 H new ATOM 0 HH11 ARG A 24 10.943 13.525 -0.386 1.00 0.00 H new ATOM 0 HH12 ARG A 24 9.945 14.504 0.694 1.00 0.00 H new ATOM 0 HH21 ARG A 24 11.207 13.071 3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 24 10.094 14.248 2.939 1.00 0.00 H new ATOM 334 N SER A 25 14.957 7.081 -2.530 1.00 0.00 N ATOM 335 CA SER A 25 15.902 6.555 -3.517 1.00 0.00 C ATOM 336 C SER A 25 15.385 5.348 -4.333 1.00 0.00 C ATOM 337 O SER A 25 16.160 4.454 -4.687 1.00 0.00 O ATOM 338 CB SER A 25 17.167 6.172 -2.758 1.00 0.00 C ATOM 339 OG SER A 25 17.885 7.311 -2.329 1.00 0.00 O ATOM 0 H SER A 25 15.197 6.801 -1.579 1.00 0.00 H new ATOM 0 HA SER A 25 16.075 7.332 -4.261 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.902 5.562 -1.894 1.00 0.00 H new ATOM 0 HB3 SER A 25 17.804 5.560 -3.397 1.00 0.00 H new ATOM 0 HG SER A 25 18.689 7.028 -1.845 1.00 0.00 H new ATOM 345 N PHE A 26 14.082 5.280 -4.589 1.00 0.00 N ATOM 346 CA PHE A 26 13.437 4.207 -5.344 1.00 0.00 C ATOM 347 C PHE A 26 12.292 4.764 -6.178 1.00 0.00 C ATOM 348 O PHE A 26 11.783 5.853 -5.917 1.00 0.00 O ATOM 349 CB PHE A 26 12.885 3.143 -4.377 1.00 0.00 C ATOM 350 CG PHE A 26 13.944 2.257 -3.763 1.00 0.00 C ATOM 351 CD1 PHE A 26 14.453 1.174 -4.503 1.00 0.00 C ATOM 352 CD2 PHE A 26 14.425 2.518 -2.467 1.00 0.00 C ATOM 353 CE1 PHE A 26 15.444 0.352 -3.950 1.00 0.00 C ATOM 354 CE2 PHE A 26 15.414 1.690 -1.913 1.00 0.00 C ATOM 355 CZ PHE A 26 15.926 0.613 -2.660 1.00 0.00 C ATOM 0 H PHE A 26 13.425 5.991 -4.268 1.00 0.00 H new ATOM 0 HA PHE A 26 14.177 3.755 -6.004 1.00 0.00 H new ATOM 0 HB2 PHE A 26 12.337 3.643 -3.578 1.00 0.00 H new ATOM 0 HB3 PHE A 26 12.169 2.518 -4.912 1.00 0.00 H new ATOM 0 HD1 PHE A 26 14.080 0.976 -5.497 1.00 0.00 H new ATOM 0 HD2 PHE A 26 14.035 3.351 -1.901 1.00 0.00 H new ATOM 0 HE1 PHE A 26 15.835 -0.480 -4.516 1.00 0.00 H new ATOM 0 HE2 PHE A 26 15.781 1.879 -0.915 1.00 0.00 H new ATOM 0 HZ PHE A 26 16.695 -0.016 -2.237 1.00 0.00 H new ATOM 365 N ILE A 27 11.807 3.953 -7.110 1.00 0.00 N ATOM 366 CA ILE A 27 10.707 4.232 -8.008 1.00 0.00 C ATOM 367 C ILE A 27 9.527 3.423 -7.493 1.00 0.00 C ATOM 368 O ILE A 27 9.264 2.294 -7.923 1.00 0.00 O ATOM 369 CB ILE A 27 11.091 3.854 -9.444 1.00 0.00 C ATOM 370 CG1 ILE A 27 12.477 4.371 -9.866 1.00 0.00 C ATOM 371 CG2 ILE A 27 10.015 4.294 -10.444 1.00 0.00 C ATOM 372 CD1 ILE A 27 12.681 5.887 -9.744 1.00 0.00 C ATOM 0 H ILE A 27 12.201 3.025 -7.264 1.00 0.00 H new ATOM 0 HA ILE A 27 10.451 5.291 -8.033 1.00 0.00 H new ATOM 0 HB ILE A 27 11.155 2.766 -9.456 1.00 0.00 H new ATOM 0 HG12 ILE A 27 13.232 3.870 -9.260 1.00 0.00 H new ATOM 0 HG13 ILE A 27 12.654 4.080 -10.901 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.318 4.011 -11.452 1.00 0.00 H new ATOM 0 HG22 ILE A 27 9.070 3.808 -10.199 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.891 5.376 -10.392 1.00 0.00 H new ATOM 0 HD11 ILE A 27 13.690 6.145 -10.066 1.00 0.00 H new ATOM 0 HD12 ILE A 27 11.956 6.403 -10.373 1.00 0.00 H new ATOM 0 HD13 ILE A 27 12.543 6.190 -8.706 1.00 0.00 H new ATOM 384 N LYS A 28 8.849 3.995 -6.507 1.00 0.00 N ATOM 385 CA LYS A 28 7.656 3.414 -5.917 1.00 0.00 C ATOM 386 C LYS A 28 6.407 3.897 -6.650 1.00 0.00 C ATOM 387 O LYS A 28 6.439 4.914 -7.349 1.00 0.00 O ATOM 388 CB LYS A 28 7.645 3.679 -4.396 1.00 0.00 C ATOM 389 CG LYS A 28 7.972 5.127 -3.973 1.00 0.00 C ATOM 390 CD LYS A 28 9.410 5.361 -3.485 1.00 0.00 C ATOM 391 CE LYS A 28 9.990 6.705 -3.929 1.00 0.00 C ATOM 392 NZ LYS A 28 9.296 7.896 -3.414 1.00 0.00 N ATOM 0 H LYS A 28 9.118 4.887 -6.091 1.00 0.00 H new ATOM 0 HA LYS A 28 7.661 2.331 -6.037 1.00 0.00 H new ATOM 0 HB2 LYS A 28 6.661 3.418 -4.006 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.363 3.009 -3.923 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.781 5.787 -4.819 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.285 5.420 -3.179 1.00 0.00 H new ATOM 0 HD2 LYS A 28 9.430 5.307 -2.397 1.00 0.00 H new ATOM 0 HD3 LYS A 28 10.047 4.558 -3.856 1.00 0.00 H new ATOM 0 HE2 LYS A 28 11.034 6.751 -3.618 1.00 0.00 H new ATOM 0 HE3 LYS A 28 9.980 6.743 -5.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.997 8.608 -3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.687 8.292 -4.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.713 7.631 -2.595 1.00 0.00 H new ATOM 406 N SER A 29 5.291 3.212 -6.422 1.00 0.00 N ATOM 407 CA SER A 29 3.958 3.593 -6.893 1.00 0.00 C ATOM 408 C SER A 29 2.936 3.345 -5.778 1.00 0.00 C ATOM 409 O SER A 29 3.247 2.678 -4.781 1.00 0.00 O ATOM 410 CB SER A 29 3.596 2.789 -8.152 1.00 0.00 C ATOM 411 OG SER A 29 4.687 2.629 -9.048 1.00 0.00 O ATOM 0 H SER A 29 5.287 2.345 -5.885 1.00 0.00 H new ATOM 0 HA SER A 29 3.949 4.652 -7.151 1.00 0.00 H new ATOM 0 HB2 SER A 29 3.231 1.806 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.778 3.289 -8.671 1.00 0.00 H new ATOM 0 HG SER A 29 4.397 2.110 -9.827 1.00 0.00 H new ATOM 417 N VAL A 30 1.711 3.849 -5.947 1.00 0.00 N ATOM 418 CA VAL A 30 0.598 3.611 -5.032 1.00 0.00 C ATOM 419 C VAL A 30 -0.601 3.204 -5.869 1.00 0.00 C ATOM 420 O VAL A 30 -0.862 3.811 -6.912 1.00 0.00 O ATOM 421 CB VAL A 30 0.285 4.861 -4.193 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.760 4.621 -3.104 1.00 0.00 C ATOM 423 CG2 VAL A 30 1.528 5.333 -3.453 1.00 0.00 C ATOM 0 H VAL A 30 1.463 4.444 -6.738 1.00 0.00 H new ATOM 0 HA VAL A 30 0.856 2.821 -4.326 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.087 5.589 -4.914 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.930 5.546 -2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.694 4.294 -3.562 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.402 3.851 -2.420 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.287 6.218 -2.865 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.879 4.542 -2.791 1.00 0.00 H new ATOM 0 HG23 VAL A 30 2.309 5.577 -4.173 1.00 0.00 H new ATOM 433 N VAL A 31 -1.313 2.173 -5.409 1.00 0.00 N ATOM 434 CA VAL A 31 -2.490 1.639 -6.087 1.00 0.00 C ATOM 435 C VAL A 31 -3.611 1.378 -5.062 1.00 0.00 C ATOM 436 O VAL A 31 -4.534 0.601 -5.310 1.00 0.00 O ATOM 437 CB VAL A 31 -2.082 0.362 -6.877 1.00 0.00 C ATOM 438 CG1 VAL A 31 -3.083 0.002 -7.987 1.00 0.00 C ATOM 439 CG2 VAL A 31 -0.696 0.451 -7.546 1.00 0.00 C ATOM 0 H VAL A 31 -1.084 1.682 -4.545 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.884 2.359 -6.804 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.065 -0.406 -6.104 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.746 -0.897 -8.503 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.064 -0.178 -7.548 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.150 0.826 -8.698 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.487 -0.478 -8.076 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.685 1.281 -8.252 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.066 0.613 -6.784 1.00 0.00 H new ATOM 449 N VAL A 32 -3.579 2.068 -3.918 1.00 0.00 N ATOM 450 CA VAL A 32 -4.651 2.058 -2.929 1.00 0.00 C ATOM 451 C VAL A 32 -5.633 3.166 -3.300 1.00 0.00 C ATOM 452 O VAL A 32 -5.408 4.341 -3.007 1.00 0.00 O ATOM 453 CB VAL A 32 -4.139 2.087 -1.473 1.00 0.00 C ATOM 454 CG1 VAL A 32 -3.035 3.105 -1.191 1.00 0.00 C ATOM 455 CG2 VAL A 32 -5.293 2.268 -0.481 1.00 0.00 C ATOM 0 H VAL A 32 -2.791 2.659 -3.652 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.186 1.109 -2.957 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.677 1.110 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.745 3.046 -0.142 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.171 2.888 -1.819 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.400 4.108 -1.411 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.900 2.284 0.535 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.806 3.208 -0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -5.995 1.441 -0.585 1.00 0.00 H new ATOM 465 N VAL A 33 -6.702 2.798 -3.997 1.00 0.00 N ATOM 466 CA VAL A 33 -7.924 3.578 -4.064 1.00 0.00 C ATOM 467 C VAL A 33 -9.097 2.623 -4.313 1.00 0.00 C ATOM 468 O VAL A 33 -8.893 1.456 -4.656 1.00 0.00 O ATOM 469 CB VAL A 33 -7.808 4.700 -5.117 1.00 0.00 C ATOM 470 CG1 VAL A 33 -7.862 4.160 -6.555 1.00 0.00 C ATOM 471 CG2 VAL A 33 -8.859 5.790 -4.866 1.00 0.00 C ATOM 0 H VAL A 33 -6.741 1.935 -4.539 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.104 4.091 -3.119 1.00 0.00 H new ATOM 0 HB VAL A 33 -6.824 5.156 -5.006 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -7.776 4.988 -7.258 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.039 3.463 -6.713 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -8.809 3.645 -6.715 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -8.760 6.571 -5.619 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -9.856 5.354 -4.924 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -8.708 6.220 -3.876 1.00 0.00 H new ATOM 481 N ALA A 34 -10.318 3.129 -4.145 1.00 0.00 N ATOM 482 CA ALA A 34 -11.562 2.523 -4.575 1.00 0.00 C ATOM 483 C ALA A 34 -11.838 2.890 -6.028 1.00 0.00 C ATOM 484 O ALA A 34 -11.444 3.958 -6.488 1.00 0.00 O ATOM 485 CB ALA A 34 -12.687 3.110 -3.718 1.00 0.00 C ATOM 0 H ALA A 34 -10.466 4.024 -3.678 1.00 0.00 H new ATOM 0 HA ALA A 34 -11.502 1.439 -4.474 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -13.639 2.673 -4.018 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.499 2.885 -2.668 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -12.724 4.190 -3.857 1.00 0.00 H new ATOM 491 N ASN A 35 -12.644 2.074 -6.706 1.00 0.00 N ATOM 492 CA ASN A 35 -13.068 2.325 -8.087 1.00 0.00 C ATOM 493 C ASN A 35 -14.474 2.924 -8.207 1.00 0.00 C ATOM 494 O ASN A 35 -15.073 2.893 -9.282 1.00 0.00 O ATOM 495 CB ASN A 35 -12.889 1.034 -8.906 1.00 0.00 C ATOM 496 CG ASN A 35 -11.871 1.275 -10.012 1.00 0.00 C ATOM 497 OD1 ASN A 35 -12.240 1.584 -11.140 1.00 0.00 O ATOM 498 ND2 ASN A 35 -10.589 1.251 -9.685 1.00 0.00 N ATOM 0 H ASN A 35 -13.025 1.214 -6.312 1.00 0.00 H new ATOM 0 HA ASN A 35 -12.426 3.102 -8.503 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -12.555 0.223 -8.259 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -13.843 0.727 -9.335 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.881 1.493 -10.378 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -10.309 0.990 -8.740 1.00 0.00 H new ATOM 505 N GLY A 36 -15.024 3.423 -7.095 1.00 0.00 N ATOM 506 CA GLY A 36 -16.378 3.974 -7.045 1.00 0.00 C ATOM 507 C GLY A 36 -16.575 4.955 -5.884 1.00 0.00 C ATOM 508 O GLY A 36 -16.753 6.159 -6.085 1.00 0.00 O ATOM 0 H GLY A 36 -14.537 3.455 -6.199 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -16.594 4.482 -7.985 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -17.095 3.158 -6.951 1.00 0.00 H new ATOM 512 N THR A 37 -16.598 4.429 -4.658 1.00 0.00 N ATOM 513 CA THR A 37 -16.781 5.201 -3.429 1.00 0.00 C ATOM 514 C THR A 37 -15.551 6.086 -3.141 1.00 0.00 C ATOM 515 O THR A 37 -14.525 5.985 -3.825 1.00 0.00 O ATOM 516 CB THR A 37 -17.141 4.225 -2.286 1.00 0.00 C ATOM 517 OG1 THR A 37 -17.809 4.881 -1.227 1.00 0.00 O ATOM 518 CG2 THR A 37 -15.918 3.472 -1.743 1.00 0.00 C ATOM 0 H THR A 37 -16.487 3.429 -4.489 1.00 0.00 H new ATOM 0 HA THR A 37 -17.608 5.903 -3.532 1.00 0.00 H new ATOM 0 HB THR A 37 -17.816 3.491 -2.726 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.623 4.386 -0.998 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.230 2.801 -0.943 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.462 2.892 -2.545 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.193 4.187 -1.355 1.00 0.00 H new ATOM 526 N GLN A 38 -15.640 6.933 -2.114 1.00 0.00 N ATOM 527 CA GLN A 38 -14.528 7.742 -1.621 1.00 0.00 C ATOM 528 C GLN A 38 -13.609 6.903 -0.736 1.00 0.00 C ATOM 529 O GLN A 38 -13.997 5.859 -0.194 1.00 0.00 O ATOM 530 CB GLN A 38 -15.093 8.954 -0.852 1.00 0.00 C ATOM 531 CG GLN A 38 -15.471 10.080 -1.826 1.00 0.00 C ATOM 532 CD GLN A 38 -16.566 10.995 -1.294 1.00 0.00 C ATOM 533 OE1 GLN A 38 -17.722 10.583 -1.196 1.00 0.00 O ATOM 534 NE2 GLN A 38 -16.267 12.253 -1.013 1.00 0.00 N ATOM 0 H GLN A 38 -16.505 7.077 -1.593 1.00 0.00 H new ATOM 0 HA GLN A 38 -13.932 8.102 -2.460 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -15.969 8.652 -0.278 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -14.354 9.316 -0.138 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -14.584 10.675 -2.044 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -15.800 9.641 -2.768 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -15.305 12.580 -1.099 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -16.999 12.896 -0.711 1.00 0.00 H new ATOM 543 N LEU A 39 -12.374 7.379 -0.577 1.00 0.00 N ATOM 544 CA LEU A 39 -11.430 6.789 0.357 1.00 0.00 C ATOM 545 C LEU A 39 -11.200 7.728 1.522 1.00 0.00 C ATOM 546 O LEU A 39 -11.695 8.854 1.525 1.00 0.00 O ATOM 547 CB LEU A 39 -10.099 6.420 -0.325 1.00 0.00 C ATOM 548 CG LEU A 39 -9.719 4.993 0.101 1.00 0.00 C ATOM 549 CD1 LEU A 39 -10.224 4.024 -0.950 1.00 0.00 C ATOM 550 CD2 LEU A 39 -8.246 4.785 0.412 1.00 0.00 C ATOM 0 H LEU A 39 -12.007 8.180 -1.091 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.862 5.860 0.730 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.198 6.479 -1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.317 7.123 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.205 4.802 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -9.962 3.006 -0.662 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.307 4.110 -1.034 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.766 4.258 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.078 3.748 0.703 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.651 5.015 -0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.950 5.443 1.229 1.00 0.00 H new ATOM 562 N LYS A 40 -10.445 7.260 2.509 1.00 0.00 N ATOM 563 CA LYS A 40 -10.070 8.012 3.678 1.00 0.00 C ATOM 564 C LYS A 40 -8.570 7.859 3.855 1.00 0.00 C ATOM 565 O LYS A 40 -8.033 6.747 3.815 1.00 0.00 O ATOM 566 CB LYS A 40 -10.862 7.501 4.880 1.00 0.00 C ATOM 567 CG LYS A 40 -10.722 8.428 6.096 1.00 0.00 C ATOM 568 CD LYS A 40 -10.979 7.695 7.413 1.00 0.00 C ATOM 569 CE LYS A 40 -9.906 6.624 7.628 1.00 0.00 C ATOM 570 NZ LYS A 40 -10.081 5.856 8.872 1.00 0.00 N ATOM 0 H LYS A 40 -10.069 6.312 2.507 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.301 9.072 3.577 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -11.914 7.413 4.610 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.516 6.502 5.144 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.720 8.857 6.110 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -11.423 9.258 6.001 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.970 8.403 8.242 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -11.967 7.235 7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.916 5.937 6.782 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.926 7.101 7.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.322 5.150 8.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.043 6.501 9.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.002 5.373 8.855 1.00 0.00 H new ATOM 584 N ASP A 41 -7.914 9.002 3.981 1.00 0.00 N ATOM 585 CA ASP A 41 -6.514 9.138 4.344 1.00 0.00 C ATOM 586 C ASP A 41 -6.317 8.811 5.832 1.00 0.00 C ATOM 587 O ASP A 41 -7.281 8.759 6.599 1.00 0.00 O ATOM 588 CB ASP A 41 -6.111 10.580 4.032 1.00 0.00 C ATOM 589 CG ASP A 41 -4.675 10.929 4.405 1.00 0.00 C ATOM 590 OD1 ASP A 41 -3.781 10.076 4.216 1.00 0.00 O ATOM 591 OD2 ASP A 41 -4.472 12.041 4.941 1.00 0.00 O ATOM 0 H ASP A 41 -8.366 9.903 3.825 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.890 8.443 3.782 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -6.250 10.760 2.966 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -6.785 11.255 4.560 1.00 0.00 H new ATOM 596 N GLY A 42 -5.067 8.629 6.259 1.00 0.00 N ATOM 597 CA GLY A 42 -4.685 8.324 7.632 1.00 0.00 C ATOM 598 C GLY A 42 -3.819 9.413 8.279 1.00 0.00 C ATOM 599 O GLY A 42 -3.276 9.185 9.364 1.00 0.00 O ATOM 0 H GLY A 42 -4.265 8.693 5.632 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.586 8.184 8.229 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -4.141 7.380 7.649 1.00 0.00 H new ATOM 603 N ALA A 43 -3.640 10.582 7.652 1.00 0.00 N ATOM 604 CA ALA A 43 -3.084 11.725 8.370 1.00 0.00 C ATOM 605 C ALA A 43 -4.056 12.121 9.484 1.00 0.00 C ATOM 606 O ALA A 43 -3.696 12.139 10.663 1.00 0.00 O ATOM 607 CB ALA A 43 -2.810 12.898 7.428 1.00 0.00 C ATOM 0 H ALA A 43 -3.867 10.756 6.673 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.124 11.447 8.806 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -2.397 13.732 7.996 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.097 12.591 6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.741 13.208 6.953 1.00 0.00 H new ATOM 613 N THR A 44 -5.306 12.383 9.112 1.00 0.00 N ATOM 614 CA THR A 44 -6.296 13.043 9.961 1.00 0.00 C ATOM 615 C THR A 44 -7.664 12.350 9.879 1.00 0.00 C ATOM 616 O THR A 44 -8.529 12.591 10.726 1.00 0.00 O ATOM 617 CB THR A 44 -6.349 14.538 9.570 1.00 0.00 C ATOM 618 OG1 THR A 44 -6.320 14.662 8.168 1.00 0.00 O ATOM 619 CG2 THR A 44 -5.128 15.307 10.074 1.00 0.00 C ATOM 0 H THR A 44 -5.668 12.137 8.191 1.00 0.00 H new ATOM 0 HA THR A 44 -6.003 12.967 11.008 1.00 0.00 H new ATOM 0 HB THR A 44 -7.261 14.939 10.012 1.00 0.00 H new ATOM 0 HG1 THR A 44 -6.355 15.610 7.923 1.00 0.00 H new ATOM 0 HG21 THR A 44 -5.208 16.352 9.776 1.00 0.00 H new ATOM 0 HG22 THR A 44 -5.080 15.242 11.161 1.00 0.00 H new ATOM 0 HG23 THR A 44 -4.224 14.876 9.645 1.00 0.00 H new ATOM 627 N GLY A 45 -7.848 11.427 8.927 1.00 0.00 N ATOM 628 CA GLY A 45 -9.087 10.701 8.705 1.00 0.00 C ATOM 629 C GLY A 45 -10.008 11.470 7.759 1.00 0.00 C ATOM 630 O GLY A 45 -11.228 11.345 7.869 1.00 0.00 O ATOM 0 H GLY A 45 -7.110 11.163 8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -8.868 9.719 8.287 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -9.592 10.536 9.657 1.00 0.00 H new ATOM 634 N GLU A 46 -9.452 12.313 6.886 1.00 0.00 N ATOM 635 CA GLU A 46 -10.187 13.067 5.883 1.00 0.00 C ATOM 636 C GLU A 46 -10.599 12.100 4.776 1.00 0.00 C ATOM 637 O GLU A 46 -9.878 11.153 4.452 1.00 0.00 O ATOM 638 CB GLU A 46 -9.302 14.174 5.296 1.00 0.00 C ATOM 639 CG GLU A 46 -8.803 15.215 6.317 1.00 0.00 C ATOM 640 CD GLU A 46 -9.766 16.363 6.640 1.00 0.00 C ATOM 641 OE1 GLU A 46 -11.005 16.168 6.528 1.00 0.00 O ATOM 642 OE2 GLU A 46 -9.256 17.454 6.999 1.00 0.00 O ATOM 0 H GLU A 46 -8.448 12.491 6.862 1.00 0.00 H new ATOM 0 HA GLU A 46 -11.064 13.531 6.334 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.438 13.713 4.817 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.861 14.691 4.516 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.564 14.697 7.246 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.873 15.643 5.943 1.00 0.00 H new ATOM 649 N SER A 47 -11.750 12.373 4.171 1.00 0.00 N ATOM 650 CA SER A 47 -12.286 11.651 3.029 1.00 0.00 C ATOM 651 C SER A 47 -11.792 12.317 1.751 1.00 0.00 C ATOM 652 O SER A 47 -11.877 13.544 1.635 1.00 0.00 O ATOM 653 CB SER A 47 -13.816 11.644 3.095 1.00 0.00 C ATOM 654 OG SER A 47 -14.317 12.917 3.485 1.00 0.00 O ATOM 0 H SER A 47 -12.357 13.134 4.477 1.00 0.00 H new ATOM 0 HA SER A 47 -11.945 10.616 3.040 1.00 0.00 H new ATOM 0 HB2 SER A 47 -14.224 11.372 2.122 1.00 0.00 H new ATOM 0 HB3 SER A 47 -14.149 10.886 3.804 1.00 0.00 H new ATOM 0 HG SER A 47 -13.812 13.621 3.028 1.00 0.00 H new ATOM 660 N LEU A 48 -11.319 11.543 0.776 1.00 0.00 N ATOM 661 CA LEU A 48 -10.816 12.033 -0.506 1.00 0.00 C ATOM 662 C LEU A 48 -11.539 11.290 -1.631 1.00 0.00 C ATOM 663 O LEU A 48 -12.068 10.192 -1.426 1.00 0.00 O ATOM 664 CB LEU A 48 -9.286 11.851 -0.614 1.00 0.00 C ATOM 665 CG LEU A 48 -8.388 12.711 0.307 1.00 0.00 C ATOM 666 CD1 LEU A 48 -8.687 14.211 0.214 1.00 0.00 C ATOM 667 CD2 LEU A 48 -8.394 12.288 1.778 1.00 0.00 C ATOM 0 H LEU A 48 -11.274 10.527 0.859 1.00 0.00 H new ATOM 0 HA LEU A 48 -11.014 13.102 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -9.059 10.803 -0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -8.997 12.052 -1.646 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.388 12.523 -0.084 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -8.023 14.757 0.884 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.529 14.551 -0.810 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -9.722 14.394 0.501 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -7.738 12.945 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -9.408 12.356 2.172 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.041 11.260 1.863 1.00 0.00 H new ATOM 679 N ALA A 49 -11.566 11.905 -2.815 1.00 0.00 N ATOM 680 CA ALA A 49 -12.226 11.395 -4.011 1.00 0.00 C ATOM 681 C ALA A 49 -11.540 10.137 -4.554 1.00 0.00 C ATOM 682 O ALA A 49 -10.531 9.675 -4.015 1.00 0.00 O ATOM 683 CB ALA A 49 -12.256 12.506 -5.061 1.00 0.00 C ATOM 0 H ALA A 49 -11.111 12.805 -2.969 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.244 11.100 -3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.747 12.141 -5.963 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.806 13.362 -4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.236 12.808 -5.300 1.00 0.00 H new ATOM 689 N SER A 50 -12.064 9.603 -5.655 1.00 0.00 N ATOM 690 CA SER A 50 -11.484 8.476 -6.362 1.00 0.00 C ATOM 691 C SER A 50 -11.613 8.670 -7.884 1.00 0.00 C ATOM 692 O SER A 50 -12.526 9.372 -8.329 1.00 0.00 O ATOM 693 CB SER A 50 -12.182 7.197 -5.882 1.00 0.00 C ATOM 694 OG SER A 50 -13.591 7.299 -5.962 1.00 0.00 O ATOM 0 H SER A 50 -12.921 9.952 -6.085 1.00 0.00 H new ATOM 0 HA SER A 50 -10.418 8.398 -6.148 1.00 0.00 H new ATOM 0 HB2 SER A 50 -11.845 6.353 -6.484 1.00 0.00 H new ATOM 0 HB3 SER A 50 -11.892 6.990 -4.852 1.00 0.00 H new ATOM 0 HG SER A 50 -13.999 6.766 -5.247 1.00 0.00 H new ATOM 700 N PRO A 51 -10.777 8.003 -8.700 1.00 0.00 N ATOM 701 CA PRO A 51 -9.562 7.319 -8.281 1.00 0.00 C ATOM 702 C PRO A 51 -8.475 8.328 -7.889 1.00 0.00 C ATOM 703 O PRO A 51 -8.620 9.532 -8.104 1.00 0.00 O ATOM 704 CB PRO A 51 -9.155 6.473 -9.483 1.00 0.00 C ATOM 705 CG PRO A 51 -9.634 7.288 -10.679 1.00 0.00 C ATOM 706 CD PRO A 51 -10.870 8.022 -10.154 1.00 0.00 C ATOM 0 HA PRO A 51 -9.714 6.701 -7.396 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.077 6.313 -9.513 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -9.623 5.489 -9.456 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.869 7.986 -11.019 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.880 6.648 -11.526 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.901 9.046 -10.527 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -11.784 7.532 -10.491 1.00 0.00 H new ATOM 714 N VAL A 52 -7.396 7.822 -7.297 1.00 0.00 N ATOM 715 CA VAL A 52 -6.193 8.533 -6.895 1.00 0.00 C ATOM 716 C VAL A 52 -5.090 7.505 -7.124 1.00 0.00 C ATOM 717 O VAL A 52 -5.189 6.395 -6.596 1.00 0.00 O ATOM 718 CB VAL A 52 -6.289 9.011 -5.424 1.00 0.00 C ATOM 719 CG1 VAL A 52 -4.964 9.601 -4.919 1.00 0.00 C ATOM 720 CG2 VAL A 52 -7.378 10.079 -5.236 1.00 0.00 C ATOM 0 H VAL A 52 -7.339 6.829 -7.070 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.015 9.450 -7.456 1.00 0.00 H new ATOM 0 HB VAL A 52 -6.539 8.120 -4.848 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.080 9.922 -3.884 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.182 8.844 -4.979 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -4.688 10.456 -5.536 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.411 10.385 -4.190 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.152 10.943 -5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.345 9.667 -5.524 1.00 0.00 H new ATOM 730 N ILE A 53 -4.107 7.803 -7.970 1.00 0.00 N ATOM 731 CA ILE A 53 -3.070 6.871 -8.407 1.00 0.00 C ATOM 732 C ILE A 53 -1.778 7.694 -8.369 1.00 0.00 C ATOM 733 O ILE A 53 -1.721 8.777 -8.962 1.00 0.00 O ATOM 734 CB ILE A 53 -3.437 6.283 -9.800 1.00 0.00 C ATOM 735 CG1 ILE A 53 -4.717 5.394 -9.736 1.00 0.00 C ATOM 736 CG2 ILE A 53 -2.267 5.451 -10.358 1.00 0.00 C ATOM 737 CD1 ILE A 53 -5.387 5.109 -11.092 1.00 0.00 C ATOM 0 H ILE A 53 -4.007 8.730 -8.384 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.957 5.990 -7.775 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.638 7.126 -10.461 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.456 4.443 -9.271 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -5.444 5.879 -9.085 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.540 5.047 -11.333 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -1.387 6.085 -10.462 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.045 4.631 -9.675 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -6.267 4.484 -10.939 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.686 6.049 -11.555 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.683 4.592 -11.744 1.00 0.00 H new ATOM 749 N LEU A 54 -0.781 7.239 -7.599 1.00 0.00 N ATOM 750 CA LEU A 54 0.409 8.043 -7.286 1.00 0.00 C ATOM 751 C LEU A 54 1.661 7.352 -7.820 1.00 0.00 C ATOM 752 O LEU A 54 1.673 6.140 -8.066 1.00 0.00 O ATOM 753 CB LEU A 54 0.556 8.315 -5.772 1.00 0.00 C ATOM 754 CG LEU A 54 -0.719 8.744 -5.016 1.00 0.00 C ATOM 755 CD1 LEU A 54 -0.423 8.905 -3.520 1.00 0.00 C ATOM 756 CD2 LEU A 54 -1.277 10.066 -5.552 1.00 0.00 C ATOM 0 H LEU A 54 -0.775 6.310 -7.178 1.00 0.00 H new ATOM 0 HA LEU A 54 0.285 9.009 -7.775 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.943 7.412 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 54 1.308 9.092 -5.638 1.00 0.00 H new ATOM 0 HG LEU A 54 -1.462 7.961 -5.170 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.332 9.208 -3.000 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.072 7.956 -3.114 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.345 9.666 -3.381 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.174 10.335 -4.995 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.529 10.850 -5.436 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.525 9.955 -6.608 1.00 0.00 H new ATOM 768 N SER A 55 2.734 8.130 -7.927 1.00 0.00 N ATOM 769 CA SER A 55 4.033 7.739 -8.445 1.00 0.00 C ATOM 770 C SER A 55 5.114 8.236 -7.479 1.00 0.00 C ATOM 771 O SER A 55 4.793 8.749 -6.406 1.00 0.00 O ATOM 772 CB SER A 55 4.192 8.317 -9.858 1.00 0.00 C ATOM 773 OG SER A 55 4.781 7.342 -10.693 1.00 0.00 O ATOM 0 H SER A 55 2.715 9.107 -7.636 1.00 0.00 H new ATOM 0 HA SER A 55 4.129 6.656 -8.519 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.221 8.614 -10.254 1.00 0.00 H new ATOM 0 HB3 SER A 55 4.813 9.213 -9.830 1.00 0.00 H new ATOM 0 HG SER A 55 4.884 7.705 -11.598 1.00 0.00 H new ATOM 779 N ASP A 56 6.391 8.055 -7.826 1.00 0.00 N ATOM 780 CA ASP A 56 7.524 8.238 -6.908 1.00 0.00 C ATOM 781 C ASP A 56 7.570 9.634 -6.301 1.00 0.00 C ATOM 782 O ASP A 56 7.883 9.772 -5.115 1.00 0.00 O ATOM 783 CB ASP A 56 8.857 7.907 -7.602 1.00 0.00 C ATOM 784 CG ASP A 56 9.632 9.123 -8.124 1.00 0.00 C ATOM 785 OD1 ASP A 56 9.243 9.672 -9.177 1.00 0.00 O ATOM 786 OD2 ASP A 56 10.594 9.549 -7.456 1.00 0.00 O ATOM 0 H ASP A 56 6.673 7.773 -8.765 1.00 0.00 H new ATOM 0 HA ASP A 56 7.372 7.538 -6.087 1.00 0.00 H new ATOM 0 HB2 ASP A 56 9.490 7.365 -6.900 1.00 0.00 H new ATOM 0 HB3 ASP A 56 8.658 7.235 -8.437 1.00 0.00 H new ATOM 791 N GLU A 57 7.186 10.623 -7.103 1.00 0.00 N ATOM 792 CA GLU A 57 7.127 12.016 -6.732 1.00 0.00 C ATOM 793 C GLU A 57 6.122 12.247 -5.612 1.00 0.00 C ATOM 794 O GLU A 57 6.441 12.866 -4.597 1.00 0.00 O ATOM 795 CB GLU A 57 6.716 12.819 -7.960 1.00 0.00 C ATOM 796 CG GLU A 57 7.832 12.902 -8.994 1.00 0.00 C ATOM 797 CD GLU A 57 7.774 14.249 -9.696 1.00 0.00 C ATOM 798 OE1 GLU A 57 8.295 15.232 -9.124 1.00 0.00 O ATOM 799 OE2 GLU A 57 7.149 14.328 -10.776 1.00 0.00 O ATOM 0 H GLU A 57 6.897 10.459 -8.067 1.00 0.00 H new ATOM 0 HA GLU A 57 8.106 12.332 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.836 12.362 -8.413 1.00 0.00 H new ATOM 0 HB3 GLU A 57 6.430 13.826 -7.655 1.00 0.00 H new ATOM 0 HG2 GLU A 57 8.800 12.773 -8.511 1.00 0.00 H new ATOM 0 HG3 GLU A 57 7.729 12.096 -9.721 1.00 0.00 H new ATOM 806 N GLU A 58 4.910 11.740 -5.821 1.00 0.00 N ATOM 807 CA GLU A 58 3.766 11.832 -4.925 1.00 0.00 C ATOM 808 C GLU A 58 3.855 10.807 -3.780 1.00 0.00 C ATOM 809 O GLU A 58 2.858 10.551 -3.100 1.00 0.00 O ATOM 810 CB GLU A 58 2.497 11.667 -5.781 1.00 0.00 C ATOM 811 CG GLU A 58 2.177 12.924 -6.602 1.00 0.00 C ATOM 812 CD GLU A 58 1.905 14.134 -5.698 1.00 0.00 C ATOM 813 OE1 GLU A 58 0.865 14.106 -5.000 1.00 0.00 O ATOM 814 OE2 GLU A 58 2.714 15.093 -5.649 1.00 0.00 O ATOM 0 H GLU A 58 4.689 11.223 -6.672 1.00 0.00 H new ATOM 0 HA GLU A 58 3.744 12.802 -4.429 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.624 10.819 -6.454 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.652 11.435 -5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.011 13.147 -7.268 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.307 12.737 -7.232 1.00 0.00 H new ATOM 821 N LEU A 59 5.044 10.224 -3.582 1.00 0.00 N ATOM 822 CA LEU A 59 5.396 9.261 -2.555 1.00 0.00 C ATOM 823 C LEU A 59 6.510 9.843 -1.678 1.00 0.00 C ATOM 824 O LEU A 59 7.444 9.136 -1.301 1.00 0.00 O ATOM 825 CB LEU A 59 5.797 7.951 -3.266 1.00 0.00 C ATOM 826 CG LEU A 59 4.630 6.965 -3.393 1.00 0.00 C ATOM 827 CD1 LEU A 59 4.782 6.076 -4.635 1.00 0.00 C ATOM 828 CD2 LEU A 59 4.571 6.115 -2.120 1.00 0.00 C ATOM 0 H LEU A 59 5.838 10.436 -4.186 1.00 0.00 H new ATOM 0 HA LEU A 59 4.562 9.043 -1.887 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.180 8.184 -4.260 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.609 7.477 -2.715 1.00 0.00 H new ATOM 0 HG LEU A 59 3.700 7.521 -3.512 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.938 5.388 -4.696 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.806 6.700 -5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 59 5.709 5.507 -4.564 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.745 5.407 -2.193 1.00 0.00 H new ATOM 0 HD22 LEU A 59 5.507 5.570 -2.003 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.418 6.763 -1.257 1.00 0.00 H new ATOM 840 N ALA A 60 6.462 11.125 -1.338 1.00 0.00 N ATOM 841 CA ALA A 60 7.342 11.780 -0.374 1.00 0.00 C ATOM 842 C ALA A 60 6.876 11.526 1.081 1.00 0.00 C ATOM 843 O ALA A 60 7.178 12.335 1.960 1.00 0.00 O ATOM 844 CB ALA A 60 7.370 13.276 -0.711 1.00 0.00 C ATOM 0 H ALA A 60 5.780 11.766 -1.743 1.00 0.00 H new ATOM 0 HA ALA A 60 8.349 11.367 -0.442 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.020 13.795 -0.007 1.00 0.00 H new ATOM 0 HB2 ALA A 60 7.748 13.414 -1.724 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.361 13.684 -0.642 1.00 0.00 H new ATOM 850 N VAL A 61 6.117 10.456 1.364 1.00 0.00 N ATOM 851 CA VAL A 61 5.551 10.169 2.686 1.00 0.00 C ATOM 852 C VAL A 61 6.177 8.933 3.335 1.00 0.00 C ATOM 853 O VAL A 61 6.759 8.085 2.668 1.00 0.00 O ATOM 854 CB VAL A 61 4.012 10.059 2.615 1.00 0.00 C ATOM 855 CG1 VAL A 61 3.390 11.408 2.258 1.00 0.00 C ATOM 856 CG2 VAL A 61 3.492 8.991 1.642 1.00 0.00 C ATOM 0 H VAL A 61 5.876 9.754 0.665 1.00 0.00 H new ATOM 0 HA VAL A 61 5.799 11.012 3.331 1.00 0.00 H new ATOM 0 HB VAL A 61 3.707 9.745 3.613 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.306 11.308 2.213 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.656 12.143 3.017 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.764 11.736 1.288 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.402 8.984 1.657 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.839 9.217 0.634 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.865 8.012 1.943 1.00 0.00 H new ATOM 866 N GLU A 62 6.056 8.830 4.650 1.00 0.00 N ATOM 867 CA GLU A 62 6.615 7.794 5.494 1.00 0.00 C ATOM 868 C GLU A 62 5.660 6.592 5.522 1.00 0.00 C ATOM 869 O GLU A 62 5.867 5.585 4.842 1.00 0.00 O ATOM 870 CB GLU A 62 6.869 8.388 6.906 1.00 0.00 C ATOM 871 CG GLU A 62 7.676 9.700 6.930 1.00 0.00 C ATOM 872 CD GLU A 62 6.842 10.997 6.855 1.00 0.00 C ATOM 873 OE1 GLU A 62 6.271 11.286 5.778 1.00 0.00 O ATOM 874 OE2 GLU A 62 6.847 11.798 7.810 1.00 0.00 O ATOM 0 H GLU A 62 5.528 9.517 5.189 1.00 0.00 H new ATOM 0 HA GLU A 62 7.569 7.438 5.104 1.00 0.00 H new ATOM 0 HB2 GLU A 62 5.907 8.563 7.387 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.395 7.645 7.506 1.00 0.00 H new ATOM 0 HG2 GLU A 62 8.270 9.724 7.844 1.00 0.00 H new ATOM 0 HG3 GLU A 62 8.376 9.690 6.095 1.00 0.00 H new ATOM 881 N LYS A 63 4.590 6.686 6.306 1.00 0.00 N ATOM 882 CA LYS A 63 3.608 5.630 6.530 1.00 0.00 C ATOM 883 C LYS A 63 2.216 6.248 6.547 1.00 0.00 C ATOM 884 O LYS A 63 2.118 7.464 6.737 1.00 0.00 O ATOM 885 CB LYS A 63 3.944 4.912 7.853 1.00 0.00 C ATOM 886 CG LYS A 63 3.751 5.763 9.125 1.00 0.00 C ATOM 887 CD LYS A 63 5.027 5.997 9.947 1.00 0.00 C ATOM 888 CE LYS A 63 5.373 4.761 10.785 1.00 0.00 C ATOM 889 NZ LYS A 63 4.747 4.761 12.125 1.00 0.00 N ATOM 0 H LYS A 63 4.374 7.537 6.825 1.00 0.00 H new ATOM 0 HA LYS A 63 3.634 4.889 5.731 1.00 0.00 H new ATOM 0 HB2 LYS A 63 3.322 4.020 7.933 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.980 4.575 7.813 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.339 6.730 8.838 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.011 5.277 9.761 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.856 6.232 9.280 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.890 6.858 10.601 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.059 3.867 10.246 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.455 4.701 10.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.022 3.899 12.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.065 5.596 12.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.712 4.788 12.025 1.00 0.00 H new ATOM 903 N VAL A 64 1.172 5.435 6.381 1.00 0.00 N ATOM 904 CA VAL A 64 -0.212 5.850 6.599 1.00 0.00 C ATOM 905 C VAL A 64 -1.097 4.586 6.640 1.00 0.00 C ATOM 906 O VAL A 64 -0.714 3.541 6.098 1.00 0.00 O ATOM 907 CB VAL A 64 -0.614 6.881 5.508 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.777 6.287 4.111 1.00 0.00 C ATOM 909 CG2 VAL A 64 -1.860 7.665 5.902 1.00 0.00 C ATOM 0 H VAL A 64 1.265 4.462 6.089 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.345 6.359 7.554 1.00 0.00 H new ATOM 0 HB VAL A 64 0.233 7.565 5.450 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -1.058 7.074 3.411 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.165 5.839 3.794 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -1.554 5.523 4.129 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -2.108 8.375 5.113 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.693 6.977 6.045 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -1.672 8.205 6.830 1.00 0.00 H new ATOM 919 N THR A 65 -2.285 4.701 7.235 1.00 0.00 N ATOM 920 CA THR A 65 -3.292 3.656 7.312 1.00 0.00 C ATOM 921 C THR A 65 -4.492 4.100 6.482 1.00 0.00 C ATOM 922 O THR A 65 -5.329 4.875 6.956 1.00 0.00 O ATOM 923 CB THR A 65 -3.706 3.440 8.772 1.00 0.00 C ATOM 924 OG1 THR A 65 -2.586 3.241 9.606 1.00 0.00 O ATOM 925 CG2 THR A 65 -4.630 2.226 8.947 1.00 0.00 C ATOM 0 H THR A 65 -2.579 5.563 7.694 1.00 0.00 H new ATOM 0 HA THR A 65 -2.898 2.715 6.928 1.00 0.00 H new ATOM 0 HB THR A 65 -4.237 4.348 9.056 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.885 3.108 10.530 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.893 2.118 9.999 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.536 2.371 8.359 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.117 1.326 8.607 1.00 0.00 H new ATOM 933 N LEU A 66 -4.568 3.668 5.228 1.00 0.00 N ATOM 934 CA LEU A 66 -5.676 4.034 4.367 1.00 0.00 C ATOM 935 C LEU A 66 -6.846 3.110 4.633 1.00 0.00 C ATOM 936 O LEU A 66 -6.641 1.960 5.028 1.00 0.00 O ATOM 937 CB LEU A 66 -5.301 3.905 2.899 1.00 0.00 C ATOM 938 CG LEU A 66 -4.065 4.711 2.500 1.00 0.00 C ATOM 939 CD1 LEU A 66 -4.064 6.149 3.049 1.00 0.00 C ATOM 940 CD2 LEU A 66 -2.783 3.880 2.680 1.00 0.00 C ATOM 0 H LEU A 66 -3.873 3.064 4.789 1.00 0.00 H new ATOM 0 HA LEU A 66 -5.936 5.070 4.581 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -5.126 2.854 2.670 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -6.145 4.228 2.289 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.102 4.905 1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.158 6.661 2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.936 6.683 2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.098 6.123 4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.919 4.477 2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.685 3.584 3.724 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.836 2.989 2.054 1.00 0.00 H new ATOM 952 N SER A 67 -8.060 3.564 4.340 1.00 0.00 N ATOM 953 CA SER A 67 -9.230 2.715 4.343 1.00 0.00 C ATOM 954 C SER A 67 -10.259 3.392 3.479 1.00 0.00 C ATOM 955 O SER A 67 -10.266 4.611 3.352 1.00 0.00 O ATOM 956 CB SER A 67 -9.733 2.559 5.770 1.00 0.00 C ATOM 957 OG SER A 67 -10.922 1.793 5.911 1.00 0.00 O ATOM 0 H SER A 67 -8.253 4.535 4.094 1.00 0.00 H new ATOM 0 HA SER A 67 -9.011 1.719 3.958 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.948 2.095 6.367 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.907 3.551 6.188 1.00 0.00 H new ATOM 0 HG SER A 67 -11.674 2.279 5.512 1.00 0.00 H new ATOM 963 N THR A 68 -11.178 2.610 2.938 1.00 0.00 N ATOM 964 CA THR A 68 -12.376 3.118 2.294 1.00 0.00 C ATOM 965 C THR A 68 -13.233 3.907 3.280 1.00 0.00 C ATOM 966 O THR A 68 -13.119 3.705 4.492 1.00 0.00 O ATOM 967 CB THR A 68 -13.101 1.912 1.688 1.00 0.00 C ATOM 968 OG1 THR A 68 -12.999 0.733 2.476 1.00 0.00 O ATOM 969 CG2 THR A 68 -12.403 1.582 0.376 1.00 0.00 C ATOM 0 H THR A 68 -11.112 1.592 2.934 1.00 0.00 H new ATOM 0 HA THR A 68 -12.137 3.826 1.501 1.00 0.00 H new ATOM 0 HB THR A 68 -14.153 2.183 1.596 1.00 0.00 H new ATOM 0 HG1 THR A 68 -13.745 0.698 3.111 1.00 0.00 H new ATOM 0 HG21 THR A 68 -12.890 0.725 -0.090 1.00 0.00 H new ATOM 0 HG22 THR A 68 -12.461 2.441 -0.293 1.00 0.00 H new ATOM 0 HG23 THR A 68 -11.357 1.343 0.570 1.00 0.00 H new ATOM 977 N THR A 69 -14.108 4.778 2.769 1.00 0.00 N ATOM 978 CA THR A 69 -15.221 5.261 3.570 1.00 0.00 C ATOM 979 C THR A 69 -16.349 4.222 3.424 1.00 0.00 C ATOM 980 O THR A 69 -16.757 3.590 4.406 1.00 0.00 O ATOM 981 CB THR A 69 -15.607 6.706 3.177 1.00 0.00 C ATOM 982 OG1 THR A 69 -16.092 6.808 1.854 1.00 0.00 O ATOM 983 CG2 THR A 69 -14.434 7.677 3.335 1.00 0.00 C ATOM 0 H THR A 69 -14.064 5.154 1.822 1.00 0.00 H new ATOM 0 HA THR A 69 -14.967 5.346 4.627 1.00 0.00 H new ATOM 0 HB THR A 69 -16.407 6.977 3.866 1.00 0.00 H new ATOM 0 HG1 THR A 69 -15.397 6.516 1.228 1.00 0.00 H new ATOM 0 HG21 THR A 69 -14.751 8.680 3.048 1.00 0.00 H new ATOM 0 HG22 THR A 69 -14.105 7.684 4.374 1.00 0.00 H new ATOM 0 HG23 THR A 69 -13.610 7.360 2.696 1.00 0.00 H new ATOM 991 N GLY A 70 -16.778 3.977 2.178 1.00 0.00 N ATOM 992 CA GLY A 70 -17.876 3.106 1.771 1.00 0.00 C ATOM 993 C GLY A 70 -17.409 1.794 1.128 1.00 0.00 C ATOM 994 O GLY A 70 -16.321 1.297 1.415 1.00 0.00 O ATOM 0 H GLY A 70 -16.330 4.417 1.374 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -18.489 2.876 2.642 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -18.512 3.641 1.066 1.00 0.00 H new ATOM 998 N LYS A 71 -18.231 1.181 0.266 1.00 0.00 N ATOM 999 CA LYS A 71 -17.840 -0.032 -0.469 1.00 0.00 C ATOM 1000 C LYS A 71 -17.043 0.328 -1.716 1.00 0.00 C ATOM 1001 O LYS A 71 -17.590 0.927 -2.638 1.00 0.00 O ATOM 1002 CB LYS A 71 -19.064 -0.868 -0.874 1.00 0.00 C ATOM 1003 CG LYS A 71 -19.828 -1.477 0.305 1.00 0.00 C ATOM 1004 CD LYS A 71 -18.992 -2.393 1.190 1.00 0.00 C ATOM 1005 CE LYS A 71 -19.938 -2.985 2.235 1.00 0.00 C ATOM 1006 NZ LYS A 71 -19.335 -4.084 3.002 1.00 0.00 N ATOM 0 H LYS A 71 -19.175 1.506 0.059 1.00 0.00 H new ATOM 0 HA LYS A 71 -17.220 -0.627 0.202 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.745 -0.240 -1.448 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.738 -1.671 -1.535 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.232 -0.670 0.917 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -20.678 -2.040 -0.080 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -18.527 -3.182 0.599 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -18.186 -1.837 1.669 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -20.249 -2.198 2.922 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -20.838 -3.348 1.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -20.024 -4.444 3.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -19.062 -4.851 2.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -18.492 -3.737 3.502 1.00 0.00 H new ATOM 1020 N ALA A 72 -15.761 -0.025 -1.758 1.00 0.00 N ATOM 1021 CA ALA A 72 -14.937 0.031 -2.956 1.00 0.00 C ATOM 1022 C ALA A 72 -15.272 -1.148 -3.853 1.00 0.00 C ATOM 1023 O ALA A 72 -15.536 -2.242 -3.361 1.00 0.00 O ATOM 1024 CB ALA A 72 -13.468 -0.044 -2.566 1.00 0.00 C ATOM 0 H ALA A 72 -15.257 -0.366 -0.939 1.00 0.00 H new ATOM 0 HA ALA A 72 -15.130 0.965 -3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.851 -0.002 -3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -13.221 0.795 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -13.279 -0.979 -2.039 1.00 0.00 H new ATOM 1030 N ILE A 73 -15.232 -0.906 -5.159 1.00 0.00 N ATOM 1031 CA ILE A 73 -15.545 -1.888 -6.190 1.00 0.00 C ATOM 1032 C ILE A 73 -14.370 -2.859 -6.360 1.00 0.00 C ATOM 1033 O ILE A 73 -14.554 -4.077 -6.361 1.00 0.00 O ATOM 1034 CB ILE A 73 -15.863 -1.138 -7.511 1.00 0.00 C ATOM 1035 CG1 ILE A 73 -16.775 0.089 -7.268 1.00 0.00 C ATOM 1036 CG2 ILE A 73 -16.519 -2.097 -8.503 1.00 0.00 C ATOM 1037 CD1 ILE A 73 -17.483 0.687 -8.491 1.00 0.00 C ATOM 0 H ILE A 73 -14.974 0.004 -5.540 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.417 -2.476 -5.904 1.00 0.00 H new ATOM 0 HB ILE A 73 -14.924 -0.771 -7.925 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -17.536 -0.194 -6.541 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -16.172 0.873 -6.809 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -16.741 -1.567 -9.429 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -15.841 -2.924 -8.712 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -17.444 -2.485 -8.077 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.088 1.539 -8.181 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -16.740 1.016 -9.217 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -18.125 -0.068 -8.945 1.00 0.00 H new ATOM 1049 N GLU A 74 -13.175 -2.285 -6.504 1.00 0.00 N ATOM 1050 CA GLU A 74 -11.921 -2.928 -6.877 1.00 0.00 C ATOM 1051 C GLU A 74 -10.850 -2.277 -6.014 1.00 0.00 C ATOM 1052 O GLU A 74 -11.042 -1.140 -5.553 1.00 0.00 O ATOM 1053 CB GLU A 74 -11.579 -2.642 -8.349 1.00 0.00 C ATOM 1054 CG GLU A 74 -12.601 -3.127 -9.383 1.00 0.00 C ATOM 1055 CD GLU A 74 -12.544 -4.608 -9.714 1.00 0.00 C ATOM 1056 OE1 GLU A 74 -11.467 -5.216 -9.574 1.00 0.00 O ATOM 1057 OE2 GLU A 74 -13.567 -5.118 -10.225 1.00 0.00 O ATOM 0 H GLU A 74 -13.053 -1.284 -6.351 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.988 -4.007 -6.740 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.453 -1.566 -8.469 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.617 -3.103 -8.574 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.601 -2.892 -9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.457 -2.561 -10.303 1.00 0.00 H new ATOM 1064 N PHE A 75 -9.744 -2.994 -5.791 1.00 0.00 N ATOM 1065 CA PHE A 75 -8.692 -2.631 -4.864 1.00 0.00 C ATOM 1066 C PHE A 75 -7.479 -3.569 -4.981 1.00 0.00 C ATOM 1067 O PHE A 75 -7.559 -4.644 -5.568 1.00 0.00 O ATOM 1068 CB PHE A 75 -9.253 -2.610 -3.430 1.00 0.00 C ATOM 1069 CG PHE A 75 -10.474 -3.445 -3.097 1.00 0.00 C ATOM 1070 CD1 PHE A 75 -10.594 -4.754 -3.559 1.00 0.00 C ATOM 1071 CD2 PHE A 75 -11.519 -2.892 -2.354 1.00 0.00 C ATOM 1072 CE1 PHE A 75 -11.730 -5.525 -3.247 1.00 0.00 C ATOM 1073 CE2 PHE A 75 -12.677 -3.640 -2.073 1.00 0.00 C ATOM 1074 CZ PHE A 75 -12.788 -4.963 -2.523 1.00 0.00 C ATOM 0 H PHE A 75 -9.560 -3.873 -6.274 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.336 -1.632 -5.118 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.451 -2.921 -2.760 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.488 -1.574 -3.186 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.807 -5.182 -4.163 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -11.437 -1.878 -1.991 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -11.785 -6.555 -3.568 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -13.483 -3.194 -1.509 1.00 0.00 H new ATOM 0 HZ PHE A 75 -13.677 -5.540 -2.314 1.00 0.00 H new ATOM 1084 N ALA A 76 -6.351 -3.184 -4.384 1.00 0.00 N ATOM 1085 CA ALA A 76 -5.062 -3.875 -4.504 1.00 0.00 C ATOM 1086 C ALA A 76 -4.073 -3.480 -3.394 1.00 0.00 C ATOM 1087 O ALA A 76 -4.380 -2.631 -2.559 1.00 0.00 O ATOM 1088 CB ALA A 76 -4.473 -3.572 -5.889 1.00 0.00 C ATOM 0 H ALA A 76 -6.305 -2.359 -3.786 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.233 -4.945 -4.390 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.514 -4.078 -5.995 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.157 -3.925 -6.661 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.329 -2.497 -5.996 1.00 0.00 H new ATOM 1094 N VAL A 77 -2.884 -4.101 -3.373 1.00 0.00 N ATOM 1095 CA VAL A 77 -1.766 -3.766 -2.472 1.00 0.00 C ATOM 1096 C VAL A 77 -0.421 -4.160 -3.131 1.00 0.00 C ATOM 1097 O VAL A 77 0.500 -4.746 -2.558 1.00 0.00 O ATOM 1098 CB VAL A 77 -1.973 -4.398 -1.083 1.00 0.00 C ATOM 1099 CG1 VAL A 77 -1.859 -5.853 -1.043 1.00 0.00 C ATOM 1100 CG2 VAL A 77 -0.960 -3.921 -0.061 1.00 0.00 C ATOM 0 H VAL A 77 -2.665 -4.874 -4.001 1.00 0.00 H new ATOM 0 HA VAL A 77 -1.737 -2.689 -2.309 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.991 -4.084 -0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -2.020 -6.203 -0.023 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.607 -6.295 -1.701 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -0.864 -6.149 -1.375 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -1.157 -4.401 0.898 1.00 0.00 H new ATOM 0 HG22 VAL A 77 0.044 -4.179 -0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -1.038 -2.840 0.052 1.00 0.00 H new ATOM 1110 N SER A 78 -0.309 -3.882 -4.414 1.00 0.00 N ATOM 1111 CA SER A 78 0.887 -4.199 -5.178 1.00 0.00 C ATOM 1112 C SER A 78 2.015 -3.278 -4.724 1.00 0.00 C ATOM 1113 O SER A 78 1.933 -2.066 -4.933 1.00 0.00 O ATOM 1114 CB SER A 78 0.598 -4.061 -6.664 1.00 0.00 C ATOM 1115 OG SER A 78 -0.061 -2.831 -6.934 1.00 0.00 O ATOM 0 H SER A 78 -1.043 -3.430 -4.959 1.00 0.00 H new ATOM 0 HA SER A 78 1.195 -5.230 -5.003 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.530 -4.112 -7.227 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.022 -4.893 -6.998 1.00 0.00 H new ATOM 0 HG SER A 78 0.324 -2.124 -6.375 1.00 0.00 H new ATOM 1121 N GLY A 79 3.033 -3.848 -4.083 1.00 0.00 N ATOM 1122 CA GLY A 79 4.071 -3.114 -3.382 1.00 0.00 C ATOM 1123 C GLY A 79 5.453 -3.287 -3.998 1.00 0.00 C ATOM 1124 O GLY A 79 6.439 -2.966 -3.336 1.00 0.00 O ATOM 0 H GLY A 79 3.157 -4.859 -4.039 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.815 -2.055 -3.374 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.100 -3.443 -2.343 1.00 0.00 H new ATOM 1128 N GLY A 80 5.569 -3.830 -5.212 1.00 0.00 N ATOM 1129 CA GLY A 80 6.848 -3.863 -5.906 1.00 0.00 C ATOM 1130 C GLY A 80 7.321 -2.431 -6.190 1.00 0.00 C ATOM 1131 O GLY A 80 6.500 -1.536 -6.407 1.00 0.00 O ATOM 0 H GLY A 80 4.795 -4.249 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.588 -4.387 -5.300 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.751 -4.416 -6.840 1.00 0.00 H new ATOM 1135 N VAL A 81 8.637 -2.216 -6.207 1.00 0.00 N ATOM 1136 CA VAL A 81 9.269 -0.979 -6.664 1.00 0.00 C ATOM 1137 C VAL A 81 10.464 -1.355 -7.535 1.00 0.00 C ATOM 1138 O VAL A 81 10.798 -2.542 -7.632 1.00 0.00 O ATOM 1139 CB VAL A 81 9.640 -0.037 -5.487 1.00 0.00 C ATOM 1140 CG1 VAL A 81 8.521 0.093 -4.444 1.00 0.00 C ATOM 1141 CG2 VAL A 81 10.944 -0.397 -4.771 1.00 0.00 C ATOM 0 H VAL A 81 9.310 -2.916 -5.895 1.00 0.00 H new ATOM 0 HA VAL A 81 8.565 -0.399 -7.261 1.00 0.00 H new ATOM 0 HB VAL A 81 9.787 0.924 -5.981 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.842 0.764 -3.648 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.626 0.495 -4.919 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.299 -0.888 -4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.124 0.313 -3.964 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.867 -1.403 -4.359 1.00 0.00 H new ATOM 0 HG23 VAL A 81 11.771 -0.358 -5.480 1.00 0.00 H new ATOM 1151 N VAL A 82 11.104 -0.358 -8.150 1.00 0.00 N ATOM 1152 CA VAL A 82 12.361 -0.567 -8.844 1.00 0.00 C ATOM 1153 C VAL A 82 13.357 0.524 -8.434 1.00 0.00 C ATOM 1154 O VAL A 82 12.961 1.545 -7.874 1.00 0.00 O ATOM 1155 CB VAL A 82 12.082 -0.719 -10.358 1.00 0.00 C ATOM 1156 CG1 VAL A 82 11.539 0.558 -11.015 1.00 0.00 C ATOM 1157 CG2 VAL A 82 13.282 -1.220 -11.167 1.00 0.00 C ATOM 0 H VAL A 82 10.764 0.603 -8.177 1.00 0.00 H new ATOM 0 HA VAL A 82 12.849 -1.498 -8.558 1.00 0.00 H new ATOM 0 HB VAL A 82 11.307 -1.485 -10.387 1.00 0.00 H new ATOM 0 HG11 VAL A 82 11.367 0.377 -12.076 1.00 0.00 H new ATOM 0 HG12 VAL A 82 10.601 0.841 -10.539 1.00 0.00 H new ATOM 0 HG13 VAL A 82 12.263 1.364 -10.898 1.00 0.00 H new ATOM 0 HG21 VAL A 82 13.005 -1.299 -12.218 1.00 0.00 H new ATOM 0 HG22 VAL A 82 14.110 -0.519 -11.062 1.00 0.00 H new ATOM 0 HG23 VAL A 82 13.587 -2.199 -10.797 1.00 0.00 H new ATOM 1167 N ASP A 83 14.640 0.322 -8.726 1.00 0.00 N ATOM 1168 CA ASP A 83 15.747 1.274 -8.520 1.00 0.00 C ATOM 1169 C ASP A 83 15.865 2.269 -9.693 1.00 0.00 C ATOM 1170 O ASP A 83 16.691 3.182 -9.701 1.00 0.00 O ATOM 1171 CB ASP A 83 17.030 0.452 -8.307 1.00 0.00 C ATOM 1172 CG ASP A 83 18.320 1.274 -8.308 1.00 0.00 C ATOM 1173 OD1 ASP A 83 18.453 2.201 -7.479 1.00 0.00 O ATOM 1174 OD2 ASP A 83 19.175 0.971 -9.173 1.00 0.00 O ATOM 0 H ASP A 83 14.960 -0.556 -9.135 1.00 0.00 H new ATOM 0 HA ASP A 83 15.563 1.891 -7.641 1.00 0.00 H new ATOM 0 HB2 ASP A 83 16.953 -0.078 -7.358 1.00 0.00 H new ATOM 0 HB3 ASP A 83 17.096 -0.304 -9.090 1.00 0.00 H new ATOM 1179 N GLY A 84 14.994 2.131 -10.691 1.00 0.00 N ATOM 1180 CA GLY A 84 14.930 2.977 -11.867 1.00 0.00 C ATOM 1181 C GLY A 84 15.841 2.471 -12.972 1.00 0.00 C ATOM 1182 O GLY A 84 15.327 1.974 -13.977 1.00 0.00 O ATOM 0 H GLY A 84 14.288 1.395 -10.696 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.903 3.017 -12.231 1.00 0.00 H new ATOM 0 HA3 GLY A 84 15.213 3.995 -11.599 1.00 0.00 H new ATOM 1186 N GLU A 85 17.155 2.597 -12.817 1.00 0.00 N ATOM 1187 CA GLU A 85 18.126 2.256 -13.848 1.00 0.00 C ATOM 1188 C GLU A 85 19.264 1.403 -13.280 1.00 0.00 C ATOM 1189 O GLU A 85 19.062 0.689 -12.295 1.00 0.00 O ATOM 1190 CB GLU A 85 18.482 3.480 -14.720 1.00 0.00 C ATOM 1191 CG GLU A 85 19.233 4.650 -14.054 1.00 0.00 C ATOM 1192 CD GLU A 85 18.541 6.012 -14.232 1.00 0.00 C ATOM 1193 OE1 GLU A 85 18.013 6.340 -15.320 1.00 0.00 O ATOM 1194 OE2 GLU A 85 18.490 6.771 -13.236 1.00 0.00 O ATOM 0 H GLU A 85 17.581 2.944 -11.958 1.00 0.00 H new ATOM 0 HA GLU A 85 17.686 1.583 -14.584 1.00 0.00 H new ATOM 0 HB2 GLU A 85 19.086 3.129 -15.557 1.00 0.00 H new ATOM 0 HB3 GLU A 85 17.555 3.873 -15.138 1.00 0.00 H new ATOM 0 HG2 GLU A 85 19.339 4.443 -12.989 1.00 0.00 H new ATOM 0 HG3 GLU A 85 20.239 4.707 -14.469 1.00 0.00 H new ATOM 1201 N ASP A 86 20.372 1.299 -14.015 1.00 0.00 N ATOM 1202 CA ASP A 86 21.474 0.381 -13.740 1.00 0.00 C ATOM 1203 C ASP A 86 22.306 0.881 -12.551 1.00 0.00 C ATOM 1204 O ASP A 86 23.367 1.489 -12.735 1.00 0.00 O ATOM 1205 CB ASP A 86 22.303 0.172 -15.016 1.00 0.00 C ATOM 1206 CG ASP A 86 23.216 -1.058 -14.943 1.00 0.00 C ATOM 1207 OD1 ASP A 86 22.686 -2.183 -14.739 1.00 0.00 O ATOM 1208 OD2 ASP A 86 24.399 -0.984 -15.319 1.00 0.00 O ATOM 0 H ASP A 86 20.531 1.871 -14.845 1.00 0.00 H new ATOM 0 HA ASP A 86 21.084 -0.594 -13.449 1.00 0.00 H new ATOM 0 HB2 ASP A 86 21.630 0.068 -15.867 1.00 0.00 H new ATOM 0 HB3 ASP A 86 22.911 1.059 -15.197 1.00 0.00 H new ATOM 1213 N GLY A 87 21.782 0.669 -11.339 1.00 0.00 N ATOM 1214 CA GLY A 87 22.295 1.149 -10.059 1.00 0.00 C ATOM 1215 C GLY A 87 22.398 0.018 -9.033 1.00 0.00 C ATOM 1216 O GLY A 87 22.382 -1.160 -9.409 1.00 0.00 O ATOM 0 H GLY A 87 20.930 0.120 -11.223 1.00 0.00 H new ATOM 0 HA2 GLY A 87 23.277 1.598 -10.206 1.00 0.00 H new ATOM 0 HA3 GLY A 87 21.641 1.931 -9.674 1.00 0.00 H new ATOM 1220 N VAL A 88 22.555 0.357 -7.746 1.00 0.00 N ATOM 1221 CA VAL A 88 22.560 -0.554 -6.592 1.00 0.00 C ATOM 1222 C VAL A 88 21.946 0.177 -5.383 1.00 0.00 C ATOM 1223 O VAL A 88 21.746 1.393 -5.428 1.00 0.00 O ATOM 1224 CB VAL A 88 23.980 -1.082 -6.259 1.00 0.00 C ATOM 1225 CG1 VAL A 88 24.576 -1.965 -7.365 1.00 0.00 C ATOM 1226 CG2 VAL A 88 24.972 0.046 -5.947 1.00 0.00 C ATOM 0 H VAL A 88 22.689 1.329 -7.466 1.00 0.00 H new ATOM 0 HA VAL A 88 21.963 -1.431 -6.842 1.00 0.00 H new ATOM 0 HB VAL A 88 23.835 -1.692 -5.367 1.00 0.00 H new ATOM 0 HG11 VAL A 88 25.570 -2.300 -7.067 1.00 0.00 H new ATOM 0 HG12 VAL A 88 23.934 -2.831 -7.525 1.00 0.00 H new ATOM 0 HG13 VAL A 88 24.648 -1.391 -8.289 1.00 0.00 H new ATOM 0 HG21 VAL A 88 25.949 -0.381 -5.721 1.00 0.00 H new ATOM 0 HG22 VAL A 88 25.055 0.706 -6.810 1.00 0.00 H new ATOM 0 HG23 VAL A 88 24.617 0.615 -5.088 1.00 0.00 H new ATOM 1236 N VAL A 89 21.697 -0.543 -4.283 1.00 0.00 N ATOM 1237 CA VAL A 89 21.085 -0.013 -3.061 1.00 0.00 C ATOM 1238 C VAL A 89 22.143 0.242 -1.977 1.00 0.00 C ATOM 1239 O VAL A 89 23.197 -0.397 -1.996 1.00 0.00 O ATOM 1240 CB VAL A 89 19.982 -0.980 -2.572 1.00 0.00 C ATOM 1241 CG1 VAL A 89 18.928 -1.257 -3.658 1.00 0.00 C ATOM 1242 CG2 VAL A 89 20.541 -2.321 -2.067 1.00 0.00 C ATOM 0 H VAL A 89 21.922 -1.536 -4.217 1.00 0.00 H new ATOM 0 HA VAL A 89 20.624 0.950 -3.282 1.00 0.00 H new ATOM 0 HB VAL A 89 19.510 -0.466 -1.735 1.00 0.00 H new ATOM 0 HG11 VAL A 89 18.174 -1.941 -3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 89 18.452 -0.321 -3.950 1.00 0.00 H new ATOM 0 HG13 VAL A 89 19.410 -1.705 -4.527 1.00 0.00 H new ATOM 0 HG21 VAL A 89 19.719 -2.957 -1.737 1.00 0.00 H new ATOM 0 HG22 VAL A 89 21.082 -2.816 -2.873 1.00 0.00 H new ATOM 0 HG23 VAL A 89 21.218 -2.142 -1.232 1.00 0.00 H new ATOM 1252 N ASN A 90 21.822 1.072 -0.973 1.00 0.00 N ATOM 1253 CA ASN A 90 22.802 1.537 0.015 1.00 0.00 C ATOM 1254 C ASN A 90 22.543 0.950 1.408 1.00 0.00 C ATOM 1255 O ASN A 90 23.378 0.216 1.934 1.00 0.00 O ATOM 1256 CB ASN A 90 22.874 3.079 0.036 1.00 0.00 C ATOM 1257 CG ASN A 90 23.895 3.650 -0.945 1.00 0.00 C ATOM 1258 OD1 ASN A 90 24.418 2.967 -1.811 1.00 0.00 O ATOM 1259 ND2 ASN A 90 24.249 4.918 -0.817 1.00 0.00 N ATOM 0 H ASN A 90 20.881 1.437 -0.825 1.00 0.00 H new ATOM 0 HA ASN A 90 23.780 1.167 -0.293 1.00 0.00 H new ATOM 0 HB2 ASN A 90 21.890 3.485 -0.198 1.00 0.00 H new ATOM 0 HB3 ASN A 90 23.124 3.410 1.044 1.00 0.00 H new ATOM 0 HD21 ASN A 90 24.953 5.316 -1.439 1.00 0.00 H new ATOM 0 HD22 ASN A 90 23.818 5.498 -0.097 1.00 0.00 H new ATOM 1266 N GLU A 91 21.449 1.309 2.087 1.00 0.00 N ATOM 1267 CA GLU A 91 21.139 0.829 3.440 1.00 0.00 C ATOM 1268 C GLU A 91 20.031 -0.240 3.417 1.00 0.00 C ATOM 1269 O GLU A 91 19.290 -0.309 2.435 1.00 0.00 O ATOM 1270 CB GLU A 91 20.705 2.025 4.314 1.00 0.00 C ATOM 1271 CG GLU A 91 21.674 2.309 5.471 1.00 0.00 C ATOM 1272 CD GLU A 91 20.891 2.686 6.727 1.00 0.00 C ATOM 1273 OE1 GLU A 91 20.375 1.759 7.387 1.00 0.00 O ATOM 1274 OE2 GLU A 91 20.682 3.894 6.992 1.00 0.00 O ATOM 0 H GLU A 91 20.747 1.946 1.711 1.00 0.00 H new ATOM 0 HA GLU A 91 22.033 0.368 3.859 1.00 0.00 H new ATOM 0 HB2 GLU A 91 20.625 2.914 3.689 1.00 0.00 H new ATOM 0 HB3 GLU A 91 19.712 1.830 4.719 1.00 0.00 H new ATOM 0 HG2 GLU A 91 22.289 1.430 5.666 1.00 0.00 H new ATOM 0 HG3 GLU A 91 22.352 3.118 5.198 1.00 0.00 H new ATOM 1281 N PRO A 92 19.841 -1.046 4.487 1.00 0.00 N ATOM 1282 CA PRO A 92 18.669 -1.903 4.619 1.00 0.00 C ATOM 1283 C PRO A 92 17.385 -1.074 4.705 1.00 0.00 C ATOM 1284 O PRO A 92 17.048 -0.511 5.748 1.00 0.00 O ATOM 1285 CB PRO A 92 18.861 -2.751 5.874 1.00 0.00 C ATOM 1286 CG PRO A 92 20.010 -2.128 6.634 1.00 0.00 C ATOM 1287 CD PRO A 92 20.717 -1.203 5.641 1.00 0.00 C ATOM 0 HA PRO A 92 18.568 -2.542 3.742 1.00 0.00 H new ATOM 0 HB2 PRO A 92 17.954 -2.761 6.479 1.00 0.00 H new ATOM 0 HB3 PRO A 92 19.082 -3.786 5.614 1.00 0.00 H new ATOM 0 HG2 PRO A 92 19.650 -1.571 7.499 1.00 0.00 H new ATOM 0 HG3 PRO A 92 20.691 -2.892 7.009 1.00 0.00 H new ATOM 0 HD2 PRO A 92 20.924 -0.236 6.099 1.00 0.00 H new ATOM 0 HD3 PRO A 92 21.676 -1.625 5.340 1.00 0.00 H new ATOM 1295 N MET A 93 16.612 -1.040 3.626 1.00 0.00 N ATOM 1296 CA MET A 93 15.225 -0.603 3.679 1.00 0.00 C ATOM 1297 C MET A 93 14.427 -1.629 4.454 1.00 0.00 C ATOM 1298 O MET A 93 14.688 -2.830 4.355 1.00 0.00 O ATOM 1299 CB MET A 93 14.706 -0.440 2.236 1.00 0.00 C ATOM 1300 CG MET A 93 13.290 0.136 2.147 1.00 0.00 C ATOM 1301 SD MET A 93 13.258 1.675 1.196 1.00 0.00 S ATOM 1302 CE MET A 93 14.341 2.669 2.251 1.00 0.00 C ATOM 0 H MET A 93 16.928 -1.313 2.695 1.00 0.00 H new ATOM 0 HA MET A 93 15.127 0.357 4.185 1.00 0.00 H new ATOM 0 HB2 MET A 93 15.387 0.210 1.687 1.00 0.00 H new ATOM 0 HB3 MET A 93 14.724 -1.411 1.742 1.00 0.00 H new ATOM 0 HG2 MET A 93 12.628 -0.594 1.682 1.00 0.00 H new ATOM 0 HG3 MET A 93 12.907 0.319 3.151 1.00 0.00 H new ATOM 0 HE1 MET A 93 15.033 3.237 1.629 1.00 0.00 H new ATOM 0 HE2 MET A 93 13.739 3.356 2.845 1.00 0.00 H new ATOM 0 HE3 MET A 93 14.904 2.013 2.915 1.00 0.00 H new ATOM 1312 N GLN A 94 13.467 -1.157 5.242 1.00 0.00 N ATOM 1313 CA GLN A 94 12.595 -2.009 6.012 1.00 0.00 C ATOM 1314 C GLN A 94 11.169 -1.649 5.646 1.00 0.00 C ATOM 1315 O GLN A 94 10.823 -0.475 5.549 1.00 0.00 O ATOM 1316 CB GLN A 94 12.890 -1.822 7.498 1.00 0.00 C ATOM 1317 CG GLN A 94 12.201 -2.907 8.332 1.00 0.00 C ATOM 1318 CD GLN A 94 11.081 -2.352 9.216 1.00 0.00 C ATOM 1319 OE1 GLN A 94 11.322 -1.642 10.186 1.00 0.00 O ATOM 1320 NE2 GLN A 94 9.831 -2.670 8.922 1.00 0.00 N ATOM 0 H GLN A 94 13.278 -0.162 5.359 1.00 0.00 H new ATOM 0 HA GLN A 94 12.754 -3.065 5.792 1.00 0.00 H new ATOM 0 HB2 GLN A 94 13.966 -1.857 7.667 1.00 0.00 H new ATOM 0 HB3 GLN A 94 12.548 -0.838 7.820 1.00 0.00 H new ATOM 0 HG2 GLN A 94 11.790 -3.665 7.666 1.00 0.00 H new ATOM 0 HG3 GLN A 94 12.942 -3.402 8.960 1.00 0.00 H new ATOM 0 HE21 GLN A 94 9.631 -3.261 8.115 1.00 0.00 H new ATOM 0 HE22 GLN A 94 9.067 -2.324 9.503 1.00 0.00 H new ATOM 1329 N TRP A 95 10.352 -2.663 5.400 1.00 0.00 N ATOM 1330 CA TRP A 95 8.970 -2.566 4.964 1.00 0.00 C ATOM 1331 C TRP A 95 8.180 -3.637 5.619 1.00 0.00 C ATOM 1332 O TRP A 95 8.704 -4.656 6.077 1.00 0.00 O ATOM 1333 CB TRP A 95 8.882 -2.725 3.438 1.00 0.00 C ATOM 1334 CG TRP A 95 8.651 -1.533 2.576 1.00 0.00 C ATOM 1335 CD1 TRP A 95 9.288 -0.353 2.683 1.00 0.00 C ATOM 1336 CD2 TRP A 95 7.728 -1.386 1.447 1.00 0.00 C ATOM 1337 NE1 TRP A 95 8.803 0.526 1.742 1.00 0.00 N ATOM 1338 CE2 TRP A 95 7.832 -0.048 0.961 1.00 0.00 C ATOM 1339 CE3 TRP A 95 6.806 -2.245 0.802 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 7.029 0.436 -0.071 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 6.034 -1.785 -0.275 1.00 0.00 C ATOM 1342 CH2 TRP A 95 6.146 -0.453 -0.712 1.00 0.00 C ATOM 0 H TRP A 95 10.656 -3.631 5.506 1.00 0.00 H new ATOM 0 HA TRP A 95 8.574 -1.589 5.239 1.00 0.00 H new ATOM 0 HB2 TRP A 95 9.811 -3.189 3.107 1.00 0.00 H new ATOM 0 HB3 TRP A 95 8.080 -3.434 3.232 1.00 0.00 H new ATOM 0 HD1 TRP A 95 10.064 -0.129 3.400 1.00 0.00 H new ATOM 0 HE1 TRP A 95 9.126 1.488 1.638 1.00 0.00 H new ATOM 0 HE3 TRP A 95 6.696 -3.264 1.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 7.083 1.472 -0.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 5.350 -2.457 -0.771 1.00 0.00 H new ATOM 0 HH2 TRP A 95 5.550 -0.110 -1.545 1.00 0.00 H new ATOM 1353 N VAL A 96 6.902 -3.322 5.640 1.00 0.00 N ATOM 1354 CA VAL A 96 5.851 -4.020 6.266 1.00 0.00 C ATOM 1355 C VAL A 96 4.578 -3.532 5.600 1.00 0.00 C ATOM 1356 O VAL A 96 4.343 -2.324 5.507 1.00 0.00 O ATOM 1357 CB VAL A 96 5.921 -3.777 7.774 1.00 0.00 C ATOM 1358 CG1 VAL A 96 6.811 -4.764 8.546 1.00 0.00 C ATOM 1359 CG2 VAL A 96 6.329 -2.379 8.220 1.00 0.00 C ATOM 0 H VAL A 96 6.563 -2.485 5.166 1.00 0.00 H new ATOM 0 HA VAL A 96 5.903 -5.103 6.152 1.00 0.00 H new ATOM 0 HB VAL A 96 4.871 -3.930 8.024 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.798 -4.513 9.607 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.434 -5.778 8.409 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.833 -4.703 8.171 1.00 0.00 H new ATOM 0 HG21 VAL A 96 6.342 -2.334 9.309 1.00 0.00 H new ATOM 0 HG22 VAL A 96 7.323 -2.150 7.836 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.615 -1.651 7.835 1.00 0.00 H new ATOM 1369 N VAL A 97 3.789 -4.473 5.098 1.00 0.00 N ATOM 1370 CA VAL A 97 2.542 -4.211 4.400 1.00 0.00 C ATOM 1371 C VAL A 97 1.529 -5.192 4.978 1.00 0.00 C ATOM 1372 O VAL A 97 1.856 -6.372 5.150 1.00 0.00 O ATOM 1373 CB VAL A 97 2.714 -4.361 2.870 1.00 0.00 C ATOM 1374 CG1 VAL A 97 1.630 -3.544 2.156 1.00 0.00 C ATOM 1375 CG2 VAL A 97 4.084 -3.904 2.331 1.00 0.00 C ATOM 0 H VAL A 97 4.007 -5.467 5.168 1.00 0.00 H new ATOM 0 HA VAL A 97 2.203 -3.185 4.544 1.00 0.00 H new ATOM 0 HB VAL A 97 2.632 -5.429 2.669 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.748 -3.647 1.077 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.646 -3.909 2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 97 1.725 -2.494 2.432 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.115 -4.045 1.251 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.233 -2.850 2.564 1.00 0.00 H new ATOM 0 HG23 VAL A 97 4.873 -4.494 2.797 1.00 0.00 H new ATOM 1385 N THR A 98 0.328 -4.710 5.287 1.00 0.00 N ATOM 1386 CA THR A 98 -0.723 -5.506 5.895 1.00 0.00 C ATOM 1387 C THR A 98 -2.059 -5.072 5.288 1.00 0.00 C ATOM 1388 O THR A 98 -2.337 -3.871 5.204 1.00 0.00 O ATOM 1389 CB THR A 98 -0.740 -5.314 7.427 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.556 -5.341 8.005 1.00 0.00 O ATOM 1391 CG2 THR A 98 -1.566 -6.405 8.114 1.00 0.00 C ATOM 0 H THR A 98 0.058 -3.741 5.118 1.00 0.00 H new ATOM 0 HA THR A 98 -0.546 -6.564 5.700 1.00 0.00 H new ATOM 0 HB THR A 98 -1.182 -4.330 7.584 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.485 -5.213 8.974 1.00 0.00 H new ATOM 0 HG21 THR A 98 -1.559 -6.242 9.192 1.00 0.00 H new ATOM 0 HG22 THR A 98 -2.592 -6.369 7.748 1.00 0.00 H new ATOM 0 HG23 THR A 98 -1.136 -7.381 7.892 1.00 0.00 H new ATOM 1399 N VAL A 99 -2.895 -6.028 4.884 1.00 0.00 N ATOM 1400 CA VAL A 99 -4.271 -5.795 4.472 1.00 0.00 C ATOM 1401 C VAL A 99 -5.228 -6.320 5.530 1.00 0.00 C ATOM 1402 O VAL A 99 -5.122 -7.461 5.998 1.00 0.00 O ATOM 1403 CB VAL A 99 -4.572 -6.449 3.116 1.00 0.00 C ATOM 1404 CG1 VAL A 99 -5.978 -6.086 2.598 1.00 0.00 C ATOM 1405 CG2 VAL A 99 -3.557 -5.993 2.073 1.00 0.00 C ATOM 0 H VAL A 99 -2.623 -7.010 4.834 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.410 -4.720 4.361 1.00 0.00 H new ATOM 0 HB VAL A 99 -4.515 -7.527 3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -6.148 -6.570 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -6.728 -6.425 3.313 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.054 -5.005 2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -3.782 -6.464 1.116 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -3.608 -4.910 1.965 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.555 -6.279 2.391 1.00 0.00 H new ATOM 1415 N TYR A 100 -6.220 -5.489 5.821 1.00 0.00 N ATOM 1416 CA TYR A 100 -7.385 -5.795 6.610 1.00 0.00 C ATOM 1417 C TYR A 100 -8.578 -5.731 5.665 1.00 0.00 C ATOM 1418 O TYR A 100 -8.802 -4.734 4.971 1.00 0.00 O ATOM 1419 CB TYR A 100 -7.508 -4.819 7.784 1.00 0.00 C ATOM 1420 CG TYR A 100 -6.283 -4.768 8.677 1.00 0.00 C ATOM 1421 CD1 TYR A 100 -5.192 -3.951 8.320 1.00 0.00 C ATOM 1422 CD2 TYR A 100 -6.227 -5.548 9.847 1.00 0.00 C ATOM 1423 CE1 TYR A 100 -4.030 -3.931 9.109 1.00 0.00 C ATOM 1424 CE2 TYR A 100 -5.074 -5.522 10.652 1.00 0.00 C ATOM 1425 CZ TYR A 100 -3.970 -4.714 10.282 1.00 0.00 C ATOM 1426 OH TYR A 100 -2.863 -4.677 11.074 1.00 0.00 O ATOM 0 H TYR A 100 -6.224 -4.525 5.487 1.00 0.00 H new ATOM 0 HA TYR A 100 -7.324 -6.787 7.057 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -7.702 -3.820 7.393 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -8.372 -5.099 8.386 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -5.250 -3.336 7.434 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -7.068 -6.165 10.126 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.188 -3.320 8.820 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -5.030 -6.118 11.552 1.00 0.00 H new ATOM 0 HH TYR A 100 -2.989 -5.275 11.840 1.00 0.00 H new ATOM 1436 N LYS A 101 -9.336 -6.821 5.596 1.00 0.00 N ATOM 1437 CA LYS A 101 -10.666 -6.795 5.007 1.00 0.00 C ATOM 1438 C LYS A 101 -11.614 -6.156 6.026 1.00 0.00 C ATOM 1439 O LYS A 101 -11.227 -5.830 7.150 1.00 0.00 O ATOM 1440 CB LYS A 101 -11.102 -8.225 4.613 1.00 0.00 C ATOM 1441 CG LYS A 101 -11.792 -8.290 3.238 1.00 0.00 C ATOM 1442 CD LYS A 101 -10.790 -8.126 2.087 1.00 0.00 C ATOM 1443 CE LYS A 101 -11.433 -8.397 0.723 1.00 0.00 C ATOM 1444 NZ LYS A 101 -10.428 -8.382 -0.355 1.00 0.00 N ATOM 0 H LYS A 101 -9.048 -7.736 5.943 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.681 -6.205 4.091 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.227 -8.876 4.605 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -11.781 -8.613 5.372 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -12.309 -9.244 3.136 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -12.549 -7.509 3.174 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -10.383 -7.115 2.102 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -9.953 -8.808 2.235 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -11.936 -9.364 0.741 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -12.196 -7.645 0.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -10.808 -8.871 -1.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.200 -7.398 -0.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -9.566 -8.866 -0.033 1.00 0.00 H new ATOM 1458 N ASN A 102 -12.880 -6.043 5.632 1.00 0.00 N ATOM 1459 CA ASN A 102 -14.006 -5.598 6.441 1.00 0.00 C ATOM 1460 C ASN A 102 -14.147 -6.425 7.721 1.00 0.00 C ATOM 1461 O ASN A 102 -14.919 -7.382 7.775 1.00 0.00 O ATOM 1462 CB ASN A 102 -15.303 -5.528 5.605 1.00 0.00 C ATOM 1463 CG ASN A 102 -15.780 -6.832 4.974 1.00 0.00 C ATOM 1464 OD1 ASN A 102 -15.135 -7.277 3.907 1.00 0.00 O flip ATOM 1465 ND2 ASN A 102 -16.804 -7.390 5.360 1.00 0.00 N flip ATOM 0 H ASN A 102 -13.162 -6.275 4.680 1.00 0.00 H new ATOM 0 HA ASN A 102 -13.804 -4.579 6.772 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -16.100 -5.147 6.244 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -15.156 -4.798 4.809 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -17.296 -7.041 6.183 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -17.163 -8.202 4.858 1.00 0.00 H new ATOM 1472 N GLY A 103 -13.393 -6.034 8.748 1.00 0.00 N ATOM 1473 CA GLY A 103 -13.448 -6.572 10.097 1.00 0.00 C ATOM 1474 C GLY A 103 -12.489 -7.733 10.359 1.00 0.00 C ATOM 1475 O GLY A 103 -12.710 -8.466 11.328 1.00 0.00 O ATOM 0 H GLY A 103 -12.695 -5.297 8.652 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.229 -5.771 10.803 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -14.466 -6.906 10.300 1.00 0.00 H new ATOM 1479 N LYS A 104 -11.446 -7.946 9.545 1.00 0.00 N ATOM 1480 CA LYS A 104 -10.423 -8.967 9.806 1.00 0.00 C ATOM 1481 C LYS A 104 -9.105 -8.601 9.119 1.00 0.00 C ATOM 1482 O LYS A 104 -9.115 -7.812 8.179 1.00 0.00 O ATOM 1483 CB LYS A 104 -10.914 -10.349 9.330 1.00 0.00 C ATOM 1484 CG LYS A 104 -11.015 -10.449 7.801 1.00 0.00 C ATOM 1485 CD LYS A 104 -11.462 -11.830 7.324 1.00 0.00 C ATOM 1486 CE LYS A 104 -12.979 -12.000 7.382 1.00 0.00 C ATOM 1487 NZ LYS A 104 -13.373 -13.412 7.220 1.00 0.00 N ATOM 0 H LYS A 104 -11.288 -7.416 8.688 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.246 -9.011 10.881 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.233 -11.117 9.696 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -11.891 -10.554 9.768 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -11.719 -9.700 7.439 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.045 -10.215 7.362 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -11.120 -11.987 6.301 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -10.989 -12.595 7.939 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.352 -11.625 8.335 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -13.443 -11.400 6.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -14.409 -13.491 7.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -13.038 -13.762 6.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -12.950 -13.980 7.981 1.00 0.00 H new ATOM 1501 N GLU A 105 -8.012 -9.246 9.500 1.00 0.00 N ATOM 1502 CA GLU A 105 -6.713 -9.180 8.841 1.00 0.00 C ATOM 1503 C GLU A 105 -6.594 -10.388 7.917 1.00 0.00 C ATOM 1504 O GLU A 105 -7.019 -11.489 8.293 1.00 0.00 O ATOM 1505 CB GLU A 105 -5.628 -9.203 9.917 1.00 0.00 C ATOM 1506 CG GLU A 105 -4.213 -9.011 9.368 1.00 0.00 C ATOM 1507 CD GLU A 105 -3.175 -8.996 10.496 1.00 0.00 C ATOM 1508 OE1 GLU A 105 -3.482 -8.532 11.624 1.00 0.00 O ATOM 1509 OE2 GLU A 105 -2.026 -9.431 10.280 1.00 0.00 O ATOM 0 H GLU A 105 -8.005 -9.859 10.315 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.603 -8.269 8.253 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.835 -8.419 10.646 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -5.676 -10.153 10.449 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -3.980 -9.813 8.668 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -4.161 -8.076 8.810 1.00 0.00 H new ATOM 1516 N ILE A 106 -5.977 -10.218 6.743 1.00 0.00 N ATOM 1517 CA ILE A 106 -5.857 -11.293 5.750 1.00 0.00 C ATOM 1518 C ILE A 106 -4.467 -11.409 5.123 1.00 0.00 C ATOM 1519 O ILE A 106 -4.148 -12.459 4.571 1.00 0.00 O ATOM 1520 CB ILE A 106 -6.936 -11.166 4.659 1.00 0.00 C ATOM 1521 CG1 ILE A 106 -6.809 -9.888 3.806 1.00 0.00 C ATOM 1522 CG2 ILE A 106 -8.345 -11.249 5.268 1.00 0.00 C ATOM 1523 CD1 ILE A 106 -7.472 -10.081 2.444 1.00 0.00 C ATOM 0 H ILE A 106 -5.549 -9.338 6.455 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.015 -12.218 6.304 1.00 0.00 H new ATOM 0 HB ILE A 106 -6.774 -12.009 3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.273 -9.050 4.326 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.757 -9.637 3.672 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.089 -11.157 4.477 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -8.468 -12.208 5.772 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.478 -10.441 5.988 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.371 -9.168 1.858 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.990 -10.905 1.918 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -8.529 -10.308 2.583 1.00 0.00 H new ATOM 1535 N GLU A 107 -3.619 -10.381 5.212 1.00 0.00 N ATOM 1536 CA GLU A 107 -2.341 -10.393 4.518 1.00 0.00 C ATOM 1537 C GLU A 107 -1.327 -9.608 5.326 1.00 0.00 C ATOM 1538 O GLU A 107 -1.701 -8.599 5.922 1.00 0.00 O ATOM 1539 CB GLU A 107 -2.503 -9.746 3.138 1.00 0.00 C ATOM 1540 CG GLU A 107 -1.556 -10.398 2.131 1.00 0.00 C ATOM 1541 CD GLU A 107 -2.232 -11.483 1.276 1.00 0.00 C ATOM 1542 OE1 GLU A 107 -3.416 -11.352 0.881 1.00 0.00 O ATOM 1543 OE2 GLU A 107 -1.502 -12.404 0.845 1.00 0.00 O ATOM 0 H GLU A 107 -3.798 -9.537 5.756 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.999 -11.421 4.399 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -3.534 -9.851 2.799 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -2.296 -8.678 3.203 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -1.149 -9.629 1.475 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -0.715 -10.838 2.666 1.00 0.00 H new ATOM 1550 N LYS A 108 -0.062 -10.037 5.331 1.00 0.00 N ATOM 1551 CA LYS A 108 0.981 -9.496 6.201 1.00 0.00 C ATOM 1552 C LYS A 108 2.363 -9.955 5.723 1.00 0.00 C ATOM 1553 O LYS A 108 2.688 -11.145 5.841 1.00 0.00 O ATOM 1554 CB LYS A 108 0.713 -9.988 7.631 1.00 0.00 C ATOM 1555 CG LYS A 108 1.705 -9.391 8.632 1.00 0.00 C ATOM 1556 CD LYS A 108 1.502 -10.048 9.993 1.00 0.00 C ATOM 1557 CE LYS A 108 2.309 -9.298 11.048 1.00 0.00 C ATOM 1558 NZ LYS A 108 1.924 -9.715 12.404 1.00 0.00 N ATOM 0 H LYS A 108 0.270 -10.783 4.719 1.00 0.00 H new ATOM 0 HA LYS A 108 0.966 -8.406 6.174 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.303 -9.721 7.923 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.778 -11.076 7.659 1.00 0.00 H new ATOM 0 HG2 LYS A 108 2.727 -9.549 8.288 1.00 0.00 H new ATOM 0 HG3 LYS A 108 1.558 -8.314 8.709 1.00 0.00 H new ATOM 0 HD2 LYS A 108 0.444 -10.042 10.257 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.815 -11.091 9.955 1.00 0.00 H new ATOM 0 HE2 LYS A 108 3.372 -9.482 10.896 1.00 0.00 H new ATOM 0 HE3 LYS A 108 2.152 -8.225 10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 2.488 -9.190 13.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.914 -9.517 12.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.097 -10.734 12.516 1.00 0.00 H new ATOM 1572 N LYS A 109 3.193 -9.049 5.203 1.00 0.00 N ATOM 1573 CA LYS A 109 4.603 -9.319 4.878 1.00 0.00 C ATOM 1574 C LYS A 109 5.524 -8.259 5.474 1.00 0.00 C ATOM 1575 O LYS A 109 5.046 -7.205 5.897 1.00 0.00 O ATOM 1576 CB LYS A 109 4.797 -9.430 3.350 1.00 0.00 C ATOM 1577 CG LYS A 109 4.588 -10.851 2.816 1.00 0.00 C ATOM 1578 CD LYS A 109 5.754 -11.780 3.180 1.00 0.00 C ATOM 1579 CE LYS A 109 5.517 -13.205 2.665 1.00 0.00 C ATOM 1580 NZ LYS A 109 6.024 -14.208 3.620 1.00 0.00 N ATOM 0 H LYS A 109 2.905 -8.094 4.991 1.00 0.00 H new ATOM 0 HA LYS A 109 4.874 -10.275 5.326 1.00 0.00 H new ATOM 0 HB2 LYS A 109 4.100 -8.756 2.852 1.00 0.00 H new ATOM 0 HB3 LYS A 109 5.802 -9.096 3.093 1.00 0.00 H new ATOM 0 HG2 LYS A 109 3.661 -11.257 3.220 1.00 0.00 H new ATOM 0 HG3 LYS A 109 4.476 -10.818 1.732 1.00 0.00 H new ATOM 0 HD2 LYS A 109 6.679 -11.388 2.757 1.00 0.00 H new ATOM 0 HD3 LYS A 109 5.881 -11.799 4.262 1.00 0.00 H new ATOM 0 HE2 LYS A 109 4.451 -13.362 2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.011 -13.333 1.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 5.850 -15.163 3.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 7.046 -14.071 3.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 5.534 -14.099 4.531 1.00 0.00 H new ATOM 1594 N SER A 110 6.832 -8.536 5.466 1.00 0.00 N ATOM 1595 CA SER A 110 7.901 -7.607 5.810 1.00 0.00 C ATOM 1596 C SER A 110 9.097 -7.867 4.890 1.00 0.00 C ATOM 1597 O SER A 110 9.545 -9.013 4.755 1.00 0.00 O ATOM 1598 CB SER A 110 8.335 -7.766 7.277 1.00 0.00 C ATOM 1599 OG SER A 110 9.269 -6.771 7.661 1.00 0.00 O ATOM 0 H SER A 110 7.185 -9.457 5.207 1.00 0.00 H new ATOM 0 HA SER A 110 7.532 -6.590 5.679 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.459 -7.711 7.923 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.775 -8.753 7.421 1.00 0.00 H new ATOM 0 HG SER A 110 9.106 -5.953 7.146 1.00 0.00 H new ATOM 1605 N LEU A 111 9.665 -6.791 4.345 1.00 0.00 N ATOM 1606 CA LEU A 111 10.884 -6.787 3.548 1.00 0.00 C ATOM 1607 C LEU A 111 12.048 -6.377 4.457 1.00 0.00 C ATOM 1608 O LEU A 111 12.007 -5.263 4.992 1.00 0.00 O ATOM 1609 CB LEU A 111 10.719 -5.747 2.418 1.00 0.00 C ATOM 1610 CG LEU A 111 11.455 -6.042 1.121 1.00 0.00 C ATOM 1611 CD1 LEU A 111 10.834 -7.193 0.328 1.00 0.00 C ATOM 1612 CD2 LEU A 111 11.425 -4.748 0.286 1.00 0.00 C ATOM 0 H LEU A 111 9.267 -5.858 4.454 1.00 0.00 H new ATOM 0 HA LEU A 111 11.077 -7.770 3.120 1.00 0.00 H new ATOM 0 HB2 LEU A 111 9.657 -5.650 2.194 1.00 0.00 H new ATOM 0 HB3 LEU A 111 11.056 -4.780 2.791 1.00 0.00 H new ATOM 0 HG LEU A 111 12.472 -6.357 1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 111 11.405 -7.354 -0.587 1.00 0.00 H new ATOM 0 HD12 LEU A 111 10.851 -8.101 0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 111 9.803 -6.945 0.074 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.944 -4.912 -0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 111 10.391 -4.467 0.088 1.00 0.00 H new ATOM 0 HD23 LEU A 111 11.919 -3.948 0.837 1.00 0.00 H new ATOM 1624 N VAL A 112 13.051 -7.249 4.642 1.00 0.00 N ATOM 1625 CA VAL A 112 14.331 -6.886 5.253 1.00 0.00 C ATOM 1626 C VAL A 112 15.435 -7.690 4.555 1.00 0.00 C ATOM 1627 O VAL A 112 15.519 -8.912 4.730 1.00 0.00 O ATOM 1628 CB VAL A 112 14.360 -7.103 6.786 1.00 0.00 C ATOM 1629 CG1 VAL A 112 15.717 -6.711 7.403 1.00 0.00 C ATOM 1630 CG2 VAL A 112 13.302 -6.291 7.528 1.00 0.00 C ATOM 0 H VAL A 112 12.993 -8.230 4.369 1.00 0.00 H new ATOM 0 HA VAL A 112 14.490 -5.817 5.115 1.00 0.00 H new ATOM 0 HB VAL A 112 14.166 -8.169 6.905 1.00 0.00 H new ATOM 0 HG11 VAL A 112 15.690 -6.880 8.479 1.00 0.00 H new ATOM 0 HG12 VAL A 112 16.507 -7.318 6.960 1.00 0.00 H new ATOM 0 HG13 VAL A 112 15.915 -5.657 7.206 1.00 0.00 H new ATOM 0 HG21 VAL A 112 13.376 -6.488 8.597 1.00 0.00 H new ATOM 0 HG22 VAL A 112 13.463 -5.229 7.343 1.00 0.00 H new ATOM 0 HG23 VAL A 112 12.311 -6.575 7.174 1.00 0.00 H new ATOM 1640 N PHE A 113 16.312 -7.036 3.800 1.00 0.00 N ATOM 1641 CA PHE A 113 17.574 -7.575 3.297 1.00 0.00 C ATOM 1642 C PHE A 113 18.710 -6.547 3.407 1.00 0.00 C ATOM 1643 O PHE A 113 18.454 -5.352 3.538 1.00 0.00 O ATOM 1644 CB PHE A 113 17.408 -8.098 1.861 1.00 0.00 C ATOM 1645 CG PHE A 113 16.789 -7.089 0.901 1.00 0.00 C ATOM 1646 CD1 PHE A 113 17.590 -6.122 0.265 1.00 0.00 C ATOM 1647 CD2 PHE A 113 15.399 -7.096 0.663 1.00 0.00 C ATOM 1648 CE1 PHE A 113 17.018 -5.182 -0.609 1.00 0.00 C ATOM 1649 CE2 PHE A 113 14.823 -6.125 -0.174 1.00 0.00 C ATOM 1650 CZ PHE A 113 15.631 -5.179 -0.824 1.00 0.00 C ATOM 0 H PHE A 113 16.156 -6.071 3.508 1.00 0.00 H new ATOM 0 HA PHE A 113 17.855 -8.420 3.925 1.00 0.00 H new ATOM 0 HB2 PHE A 113 18.384 -8.396 1.479 1.00 0.00 H new ATOM 0 HB3 PHE A 113 16.787 -8.993 1.881 1.00 0.00 H new ATOM 0 HD1 PHE A 113 18.654 -6.102 0.450 1.00 0.00 H new ATOM 0 HD2 PHE A 113 14.776 -7.848 1.124 1.00 0.00 H new ATOM 0 HE1 PHE A 113 17.645 -4.463 -1.115 1.00 0.00 H new ATOM 0 HE2 PHE A 113 13.753 -6.107 -0.318 1.00 0.00 H new ATOM 0 HZ PHE A 113 15.187 -4.451 -1.487 1.00 0.00 H new ATOM 1660 N ARG A 114 19.966 -7.009 3.414 1.00 0.00 N ATOM 1661 CA ARG A 114 21.173 -6.184 3.381 1.00 0.00 C ATOM 1662 C ARG A 114 22.362 -7.058 3.027 1.00 0.00 C ATOM 1663 O ARG A 114 22.331 -8.264 3.266 1.00 0.00 O ATOM 1664 CB ARG A 114 21.461 -5.446 4.707 1.00 0.00 C ATOM 1665 CG ARG A 114 21.430 -6.247 6.024 1.00 0.00 C ATOM 1666 CD ARG A 114 20.022 -6.653 6.482 1.00 0.00 C ATOM 1667 NE ARG A 114 19.937 -6.770 7.949 1.00 0.00 N ATOM 1668 CZ ARG A 114 19.191 -6.012 8.766 1.00 0.00 C ATOM 1669 NH1 ARG A 114 18.384 -5.071 8.285 1.00 0.00 N ATOM 1670 NH2 ARG A 114 19.263 -6.192 10.078 1.00 0.00 N ATOM 0 H ARG A 114 20.174 -8.007 3.444 1.00 0.00 H new ATOM 0 HA ARG A 114 21.005 -5.414 2.628 1.00 0.00 H new ATOM 0 HB2 ARG A 114 22.446 -4.988 4.622 1.00 0.00 H new ATOM 0 HB3 ARG A 114 20.739 -4.635 4.797 1.00 0.00 H new ATOM 0 HG2 ARG A 114 22.034 -7.146 5.903 1.00 0.00 H new ATOM 0 HG3 ARG A 114 21.898 -5.652 6.809 1.00 0.00 H new ATOM 0 HD2 ARG A 114 19.299 -5.915 6.134 1.00 0.00 H new ATOM 0 HD3 ARG A 114 19.751 -7.605 6.025 1.00 0.00 H new ATOM 0 HE ARG A 114 20.501 -7.499 8.386 1.00 0.00 H new ATOM 0 HH11 ARG A 114 18.325 -4.916 7.279 1.00 0.00 H new ATOM 0 HH12 ARG A 114 17.824 -4.505 8.922 1.00 0.00 H new ATOM 0 HH21 ARG A 114 19.884 -6.905 10.462 1.00 0.00 H new ATOM 0 HH22 ARG A 114 18.698 -5.618 10.703 1.00 0.00 H new ATOM 1684 N ASP A 115 23.423 -6.407 2.563 1.00 0.00 N ATOM 1685 CA ASP A 115 24.639 -6.989 1.993 1.00 0.00 C ATOM 1686 C ASP A 115 25.299 -8.069 2.845 1.00 0.00 C ATOM 1687 O ASP A 115 25.888 -8.998 2.289 1.00 0.00 O ATOM 1688 CB ASP A 115 25.650 -5.869 1.697 1.00 0.00 C ATOM 1689 CG ASP A 115 25.567 -5.491 0.227 1.00 0.00 C ATOM 1690 OD1 ASP A 115 24.727 -4.624 -0.103 1.00 0.00 O ATOM 1691 OD2 ASP A 115 26.243 -6.170 -0.580 1.00 0.00 O ATOM 0 H ASP A 115 23.462 -5.388 2.575 1.00 0.00 H new ATOM 0 HA ASP A 115 24.325 -7.495 1.080 1.00 0.00 H new ATOM 0 HB2 ASP A 115 25.439 -5.000 2.320 1.00 0.00 H new ATOM 0 HB3 ASP A 115 26.659 -6.200 1.942 1.00 0.00 H new ATOM 1696 N GLY A 116 25.204 -7.970 4.174 1.00 0.00 N ATOM 1697 CA GLY A 116 25.837 -8.908 5.090 1.00 0.00 C ATOM 1698 C GLY A 116 25.165 -10.280 5.123 1.00 0.00 C ATOM 1699 O GLY A 116 25.652 -11.168 5.828 1.00 0.00 O ATOM 0 H GLY A 116 24.681 -7.230 4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 116 26.882 -9.031 4.805 1.00 0.00 H new ATOM 0 HA3 GLY A 116 25.828 -8.484 6.094 1.00 0.00 H new ATOM 1703 N LYS A 117 24.052 -10.493 4.409 1.00 0.00 N ATOM 1704 CA LYS A 117 23.453 -11.810 4.231 1.00 0.00 C ATOM 1705 C LYS A 117 23.262 -12.088 2.748 1.00 0.00 C ATOM 1706 O LYS A 117 23.228 -11.163 1.932 1.00 0.00 O ATOM 1707 CB LYS A 117 22.175 -11.939 5.084 1.00 0.00 C ATOM 1708 CG LYS A 117 20.896 -11.302 4.501 1.00 0.00 C ATOM 1709 CD LYS A 117 19.970 -10.815 5.627 1.00 0.00 C ATOM 1710 CE LYS A 117 18.493 -10.684 5.243 1.00 0.00 C ATOM 1711 NZ LYS A 117 17.807 -11.979 5.103 1.00 0.00 N ATOM 0 H LYS A 117 23.542 -9.746 3.937 1.00 0.00 H new ATOM 0 HA LYS A 117 24.119 -12.591 4.598 1.00 0.00 H new ATOM 0 HB2 LYS A 117 21.983 -12.998 5.254 1.00 0.00 H new ATOM 0 HB3 LYS A 117 22.367 -11.490 6.058 1.00 0.00 H new ATOM 0 HG2 LYS A 117 21.162 -10.465 3.855 1.00 0.00 H new ATOM 0 HG3 LYS A 117 20.372 -12.029 3.881 1.00 0.00 H new ATOM 0 HD2 LYS A 117 20.051 -11.505 6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 117 20.326 -9.846 5.975 1.00 0.00 H new ATOM 0 HE2 LYS A 117 17.980 -10.090 5.999 1.00 0.00 H new ATOM 0 HE3 LYS A 117 18.417 -10.138 4.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.813 -11.819 4.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 18.273 -12.540 4.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 17.850 -12.494 6.006 1.00 0.00 H new ATOM 1725 N GLU A 118 23.138 -13.377 2.429 1.00 0.00 N ATOM 1726 CA GLU A 118 22.972 -13.866 1.065 1.00 0.00 C ATOM 1727 C GLU A 118 21.716 -13.215 0.506 1.00 0.00 C ATOM 1728 O GLU A 118 20.678 -13.214 1.179 1.00 0.00 O ATOM 1729 CB GLU A 118 22.854 -15.394 1.058 1.00 0.00 C ATOM 1730 CG GLU A 118 24.121 -16.054 1.621 1.00 0.00 C ATOM 1731 CD GLU A 118 23.919 -17.513 2.014 1.00 0.00 C ATOM 1732 OE1 GLU A 118 22.805 -17.892 2.429 1.00 0.00 O ATOM 1733 OE2 GLU A 118 24.921 -18.269 1.999 1.00 0.00 O ATOM 0 H GLU A 118 23.151 -14.122 3.126 1.00 0.00 H new ATOM 0 HA GLU A 118 23.834 -13.610 0.449 1.00 0.00 H new ATOM 0 HB2 GLU A 118 21.990 -15.697 1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 118 22.681 -15.743 0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 118 24.915 -15.992 0.877 1.00 0.00 H new ATOM 0 HG3 GLU A 118 24.457 -15.493 2.493 1.00 0.00 H new ATOM 1740 N ILE A 119 21.837 -12.624 -0.676 1.00 0.00 N ATOM 1741 CA ILE A 119 20.801 -11.815 -1.280 1.00 0.00 C ATOM 1742 C ILE A 119 19.545 -12.660 -1.543 1.00 0.00 C ATOM 1743 O ILE A 119 19.568 -13.893 -1.651 1.00 0.00 O ATOM 1744 CB ILE A 119 21.400 -11.070 -2.504 1.00 0.00 C ATOM 1745 CG1 ILE A 119 20.393 -10.187 -3.263 1.00 0.00 C ATOM 1746 CG2 ILE A 119 22.124 -11.968 -3.521 1.00 0.00 C ATOM 1747 CD1 ILE A 119 19.843 -9.057 -2.396 1.00 0.00 C ATOM 0 H ILE A 119 22.678 -12.699 -1.249 1.00 0.00 H new ATOM 0 HA ILE A 119 20.448 -11.033 -0.607 1.00 0.00 H new ATOM 0 HB ILE A 119 22.142 -10.431 -2.026 1.00 0.00 H new ATOM 0 HG12 ILE A 119 20.876 -9.764 -4.144 1.00 0.00 H new ATOM 0 HG13 ILE A 119 19.568 -10.804 -3.618 1.00 0.00 H new ATOM 0 HG21 ILE A 119 22.507 -11.357 -4.338 1.00 0.00 H new ATOM 0 HG22 ILE A 119 22.953 -12.478 -3.030 1.00 0.00 H new ATOM 0 HG23 ILE A 119 21.426 -12.706 -3.916 1.00 0.00 H new ATOM 0 HD11 ILE A 119 19.137 -8.463 -2.977 1.00 0.00 H new ATOM 0 HD12 ILE A 119 19.335 -9.478 -1.529 1.00 0.00 H new ATOM 0 HD13 ILE A 119 20.664 -8.422 -2.063 1.00 0.00 H new ATOM 1759 N SER A 120 18.396 -12.000 -1.578 1.00 0.00 N ATOM 1760 CA SER A 120 17.101 -12.543 -1.809 1.00 0.00 C ATOM 1761 C SER A 120 16.344 -11.472 -2.563 1.00 0.00 C ATOM 1762 O SER A 120 16.210 -10.347 -2.081 1.00 0.00 O ATOM 1763 CB SER A 120 16.496 -12.789 -0.443 1.00 0.00 C ATOM 1764 OG SER A 120 17.172 -13.869 0.180 1.00 0.00 O ATOM 0 H SER A 120 18.363 -10.991 -1.432 1.00 0.00 H new ATOM 0 HA SER A 120 17.091 -13.473 -2.377 1.00 0.00 H new ATOM 0 HB2 SER A 120 16.577 -11.892 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.434 -13.016 -0.538 1.00 0.00 H new ATOM 0 HG SER A 120 16.784 -14.030 1.066 1.00 0.00 H new ATOM 1770 N THR A 121 15.916 -11.830 -3.760 1.00 0.00 N ATOM 1771 CA THR A 121 15.028 -11.054 -4.599 1.00 0.00 C ATOM 1772 C THR A 121 13.677 -10.881 -3.890 1.00 0.00 C ATOM 1773 O THR A 121 13.354 -11.618 -2.948 1.00 0.00 O ATOM 1774 CB THR A 121 14.873 -11.794 -5.953 1.00 0.00 C ATOM 1775 OG1 THR A 121 15.711 -12.947 -6.057 1.00 0.00 O ATOM 1776 CG2 THR A 121 15.281 -10.872 -7.098 1.00 0.00 C ATOM 0 H THR A 121 16.193 -12.712 -4.192 1.00 0.00 H new ATOM 0 HA THR A 121 15.433 -10.059 -4.785 1.00 0.00 H new ATOM 0 HB THR A 121 13.827 -12.095 -6.008 1.00 0.00 H new ATOM 0 HG1 THR A 121 15.572 -13.375 -6.928 1.00 0.00 H new ATOM 0 HG21 THR A 121 15.170 -11.398 -8.046 1.00 0.00 H new ATOM 0 HG22 THR A 121 14.644 -9.987 -7.097 1.00 0.00 H new ATOM 0 HG23 THR A 121 16.321 -10.571 -6.970 1.00 0.00 H new ATOM 1784 N ASP A 122 12.865 -9.929 -4.344 1.00 0.00 N ATOM 1785 CA ASP A 122 11.463 -9.833 -3.964 1.00 0.00 C ATOM 1786 C ASP A 122 10.729 -9.009 -5.017 1.00 0.00 C ATOM 1787 O ASP A 122 11.376 -8.237 -5.725 1.00 0.00 O ATOM 1788 CB ASP A 122 11.343 -9.158 -2.592 1.00 0.00 C ATOM 1789 CG ASP A 122 10.213 -9.764 -1.765 1.00 0.00 C ATOM 1790 OD1 ASP A 122 9.031 -9.402 -1.955 1.00 0.00 O ATOM 1791 OD2 ASP A 122 10.499 -10.617 -0.892 1.00 0.00 O ATOM 0 H ASP A 122 13.166 -9.199 -4.990 1.00 0.00 H new ATOM 0 HA ASP A 122 11.024 -10.829 -3.902 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.285 -9.260 -2.052 1.00 0.00 H new ATOM 0 HB3 ASP A 122 11.165 -8.091 -2.725 1.00 0.00 H new ATOM 1796 N ASP A 123 9.405 -9.147 -5.116 1.00 0.00 N ATOM 1797 CA ASP A 123 8.551 -8.369 -6.014 1.00 0.00 C ATOM 1798 C ASP A 123 7.079 -8.600 -5.650 1.00 0.00 C ATOM 1799 O ASP A 123 6.381 -9.409 -6.259 1.00 0.00 O ATOM 1800 CB ASP A 123 8.836 -8.621 -7.512 1.00 0.00 C ATOM 1801 CG ASP A 123 9.174 -10.057 -7.931 1.00 0.00 C ATOM 1802 OD1 ASP A 123 8.460 -11.026 -7.601 1.00 0.00 O ATOM 1803 OD2 ASP A 123 10.172 -10.270 -8.663 1.00 0.00 O ATOM 0 H ASP A 123 8.883 -9.822 -4.557 1.00 0.00 H new ATOM 0 HA ASP A 123 8.790 -7.316 -5.867 1.00 0.00 H new ATOM 0 HB2 ASP A 123 7.963 -8.300 -8.080 1.00 0.00 H new ATOM 0 HB3 ASP A 123 9.664 -7.978 -7.811 1.00 0.00 H new ATOM 1808 N LEU A 124 6.579 -7.876 -4.637 1.00 0.00 N ATOM 1809 CA LEU A 124 5.189 -8.003 -4.182 1.00 0.00 C ATOM 1810 C LEU A 124 4.215 -7.733 -5.332 1.00 0.00 C ATOM 1811 O LEU A 124 4.272 -6.684 -5.989 1.00 0.00 O ATOM 1812 CB LEU A 124 4.812 -7.000 -3.073 1.00 0.00 C ATOM 1813 CG LEU A 124 5.339 -7.246 -1.651 1.00 0.00 C ATOM 1814 CD1 LEU A 124 4.876 -6.057 -0.801 1.00 0.00 C ATOM 1815 CD2 LEU A 124 4.795 -8.551 -1.076 1.00 0.00 C ATOM 0 H LEU A 124 7.124 -7.191 -4.114 1.00 0.00 H new ATOM 0 HA LEU A 124 5.115 -9.021 -3.801 1.00 0.00 H new ATOM 0 HB2 LEU A 124 5.155 -6.014 -3.387 1.00 0.00 H new ATOM 0 HB3 LEU A 124 3.724 -6.958 -3.020 1.00 0.00 H new ATOM 0 HG LEU A 124 6.425 -7.333 -1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 124 5.226 -6.184 0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 124 5.285 -5.134 -1.213 1.00 0.00 H new ATOM 0 HD13 LEU A 124 3.787 -6.006 -0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 124 5.186 -8.696 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 124 3.707 -8.507 -1.039 1.00 0.00 H new ATOM 0 HD23 LEU A 124 5.103 -9.384 -1.708 1.00 0.00 H new ATOM 1827 N ASN A 125 3.220 -8.604 -5.463 1.00 0.00 N ATOM 1828 CA ASN A 125 2.086 -8.466 -6.354 1.00 0.00 C ATOM 1829 C ASN A 125 0.850 -8.937 -5.599 1.00 0.00 C ATOM 1830 O ASN A 125 0.795 -10.117 -5.254 1.00 0.00 O ATOM 1831 CB ASN A 125 2.317 -9.301 -7.619 1.00 0.00 C ATOM 1832 CG ASN A 125 1.254 -8.997 -8.660 1.00 0.00 C ATOM 1833 OD1 ASN A 125 0.275 -9.716 -8.804 1.00 0.00 O ATOM 1834 ND2 ASN A 125 1.366 -7.875 -9.352 1.00 0.00 N ATOM 0 H ASN A 125 3.186 -9.467 -4.921 1.00 0.00 H new ATOM 0 HA ASN A 125 1.953 -7.430 -6.666 1.00 0.00 H new ATOM 0 HB2 ASN A 125 3.305 -9.088 -8.027 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.297 -10.362 -7.370 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.634 -7.606 -10.009 1.00 0.00 H new ATOM 0 HD22 ASN A 125 2.184 -7.279 -9.228 1.00 0.00 H new ATOM 1841 N LEU A 126 -0.098 -8.043 -5.280 1.00 0.00 N ATOM 1842 CA LEU A 126 -1.444 -8.413 -4.851 1.00 0.00 C ATOM 1843 C LEU A 126 -2.495 -7.583 -5.584 1.00 0.00 C ATOM 1844 O LEU A 126 -2.217 -6.442 -5.960 1.00 0.00 O ATOM 1845 CB LEU A 126 -1.624 -8.117 -3.368 1.00 0.00 C ATOM 1846 CG LEU A 126 -1.673 -9.285 -2.385 1.00 0.00 C ATOM 1847 CD1 LEU A 126 -0.293 -9.901 -2.161 1.00 0.00 C ATOM 1848 CD2 LEU A 126 -2.111 -8.741 -1.013 1.00 0.00 C ATOM 0 H LEU A 126 0.055 -7.035 -5.315 1.00 0.00 H new ATOM 0 HA LEU A 126 -1.567 -9.475 -5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.809 -7.461 -3.061 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -2.549 -7.551 -3.254 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.353 -10.031 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.374 -10.728 -1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.099 -10.270 -3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.382 -9.145 -1.759 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.153 -9.559 -0.294 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.394 -7.994 -0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.097 -8.284 -1.101 1.00 0.00 H new ATOM 1860 N TYR A 127 -3.723 -8.101 -5.610 1.00 0.00 N ATOM 1861 CA TYR A 127 -4.938 -7.511 -6.143 1.00 0.00 C ATOM 1862 C TYR A 127 -6.101 -8.185 -5.406 1.00 0.00 C ATOM 1863 O TYR A 127 -5.918 -9.233 -4.776 1.00 0.00 O ATOM 1864 CB TYR A 127 -4.956 -7.746 -7.657 1.00 0.00 C ATOM 1865 CG TYR A 127 -6.251 -7.482 -8.397 1.00 0.00 C ATOM 1866 CD1 TYR A 127 -6.867 -6.219 -8.352 1.00 0.00 C ATOM 1867 CD2 TYR A 127 -6.814 -8.498 -9.185 1.00 0.00 C ATOM 1868 CE1 TYR A 127 -8.064 -5.987 -9.055 1.00 0.00 C ATOM 1869 CE2 TYR A 127 -7.960 -8.255 -9.946 1.00 0.00 C ATOM 1870 CZ TYR A 127 -8.615 -7.009 -9.865 1.00 0.00 C ATOM 1871 OH TYR A 127 -9.766 -6.855 -10.567 1.00 0.00 O ATOM 0 H TYR A 127 -3.902 -9.027 -5.222 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.010 -6.434 -5.992 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -4.182 -7.121 -8.102 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.672 -8.783 -7.839 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -6.420 -5.423 -7.775 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -6.357 -9.476 -9.203 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -8.561 -5.031 -8.977 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -8.346 -9.024 -10.599 1.00 0.00 H new ATOM 0 HH TYR A 127 -10.244 -6.064 -10.242 1.00 0.00 H new ATOM 1881 N TYR A 128 -7.276 -7.565 -5.433 1.00 0.00 N ATOM 1882 CA TYR A 128 -8.487 -7.971 -4.739 1.00 0.00 C ATOM 1883 C TYR A 128 -9.689 -7.487 -5.561 1.00 0.00 C ATOM 1884 O TYR A 128 -9.571 -6.507 -6.289 1.00 0.00 O ATOM 1885 CB TYR A 128 -8.486 -7.295 -3.362 1.00 0.00 C ATOM 1886 CG TYR A 128 -7.452 -7.775 -2.373 1.00 0.00 C ATOM 1887 CD1 TYR A 128 -7.610 -9.011 -1.732 1.00 0.00 C ATOM 1888 CD2 TYR A 128 -6.356 -6.952 -2.069 1.00 0.00 C ATOM 1889 CE1 TYR A 128 -6.689 -9.412 -0.756 1.00 0.00 C ATOM 1890 CE2 TYR A 128 -5.441 -7.336 -1.083 1.00 0.00 C ATOM 1891 CZ TYR A 128 -5.607 -8.573 -0.410 1.00 0.00 C ATOM 1892 OH TYR A 128 -4.756 -8.926 0.593 1.00 0.00 O ATOM 0 H TYR A 128 -7.414 -6.712 -5.975 1.00 0.00 H new ATOM 0 HA TYR A 128 -8.540 -9.053 -4.618 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -8.346 -6.224 -3.509 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -9.472 -7.429 -2.916 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -8.440 -9.653 -1.990 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -6.219 -6.020 -2.598 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -6.807 -10.367 -0.266 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -4.610 -6.692 -0.835 1.00 0.00 H new ATOM 0 HH TYR A 128 -4.431 -9.838 0.441 1.00 0.00 H new ATOM 1902 N ASN A 129 -10.853 -8.115 -5.409 1.00 0.00 N ATOM 1903 CA ASN A 129 -12.136 -7.699 -5.985 1.00 0.00 C ATOM 1904 C ASN A 129 -13.229 -8.561 -5.381 1.00 0.00 C ATOM 1905 O ASN A 129 -13.022 -9.120 -4.273 1.00 0.00 O ATOM 1906 CB ASN A 129 -12.114 -7.728 -7.523 1.00 0.00 C ATOM 1907 CG ASN A 129 -11.613 -9.041 -8.098 1.00 0.00 C ATOM 1908 OD1 ASN A 129 -10.304 -9.196 -8.160 1.00 0.00 O flip ATOM 1909 ND2 ASN A 129 -12.372 -9.919 -8.503 1.00 0.00 N flip ATOM 0 H ASN A 129 -10.934 -8.968 -4.856 1.00 0.00 H new ATOM 0 HA ASN A 129 -12.338 -6.657 -5.735 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -13.120 -7.538 -7.896 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -11.481 -6.917 -7.885 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -13.382 -9.785 -8.449 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -11.992 -10.781 -8.893 1.00 0.00 H new TER 1916 ASN A 129