USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1201 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 98 SER OG : rot -130:sc= -0.45 USER MOD Set 1.2: A 107 GLN : amide:sc= -0.439 K(o=-0.89,f=1.5) USER MOD Set 2.1: A 83 HIS : no HE2:sc= -1.61 K(o=-1.4,f=-0.63) USER MOD Set 2.2: A 89 SER OG : rot 95:sc= 0.172 USER MOD Set 3.1: A 34 ASN : amide:sc= -8.55! C(o=-11!,f=-2.8!) USER MOD Set 3.2: A 57 ASN : amide:sc= -2.09 K(o=-11,f=-2.8) USER MOD Set 4.1: A 35 ASN : amide:sc= 0 K(o=0.89,f=-1.4) USER MOD Set 4.2: A 77 TYR OH : rot -3:sc= 0.888 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 51:sc= 1.04 USER MOD Single : A 14 CYS SG : rot -14:sc= -9.29! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 1:sc= 0.625 USER MOD Single : A 40 MET CE :methyl 154:sc= -4.42! (180deg=-6.51!) USER MOD Single : A 41 LYS NZ :NH3+ 173:sc= 1.13 (180deg=1.08) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.0273 X(o=-0.027,f=0) USER MOD Single : A 48 MET CE :methyl -136:sc= -1.12 (180deg=-4.12!) USER MOD Single : A 56 GLN : amide:sc= -1.84 K(o=-1.8,f=-0.99) USER MOD Single : A 59 SER OG : rot 180:sc= -0.257 USER MOD Single : A 64 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000303) USER MOD Single : A 71 GLN : amide:sc= -0.261 X(o=-0.26,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.729 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.0858 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= -0.617 USER MOD Single : A 93 CYS SG : rot -142:sc= -1.18 USER MOD Single : A 97 SER OG : rot -160:sc= -1.04 USER MOD Single : A 102 CYS SG : rot -100:sc= -0.207 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.0768 X(o=-0.077,f=-0.00034) USER MOD Single : A 108 MET CE :methyl -156:sc= -0.0353 (180deg=-0.589) USER MOD Single : A 109 MET CE :methyl -170:sc= -3.15! (180deg=-4.01!) USER MOD Single : A 110 TYR OH : rot 86:sc= 0.243 USER MOD Single : A 113 SER OG : rot 112:sc= 1.31 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= -0.114 (180deg=-0.114) USER MOD Single : A 115 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.3!) USER MOD Single : A 119 GLN : amide:sc= -0.36 K(o=-0.36,f=-2.7!) USER MOD Single : A 120 THR OG1 : rot 88:sc= 1.23 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -68:sc= 0.421 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 175:sc= -0.615 (180deg=-0.752) USER MOD Single : A 146 SER OG : rot -62:sc= 0.0841 USER MOD Single : A 149 SER OG : rot 180:sc= -0.0786 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.952 -6.807 6.804 1.00 74.13 N ATOM 2 CA GLY A 1 9.628 -5.672 7.648 1.00 32.21 C ATOM 3 C GLY A 1 10.418 -5.669 8.942 1.00 14.30 C ATOM 4 O GLY A 1 11.593 -5.304 8.958 1.00 23.41 O ATOM 0 H1 GLY A 1 9.386 -6.764 5.932 1.00 74.13 H new ATOM 0 H2 GLY A 1 10.963 -6.782 6.562 1.00 74.13 H new ATOM 0 H3 GLY A 1 9.739 -7.689 7.312 1.00 74.13 H new ATOM 0 HA2 GLY A 1 9.826 -4.749 7.103 1.00 32.21 H new ATOM 0 HA3 GLY A 1 8.562 -5.685 7.876 1.00 32.21 H new ATOM 8 N SER A 2 9.771 -6.073 10.029 1.00 31.53 N ATOM 9 CA SER A 2 10.419 -6.110 11.335 1.00 35.35 C ATOM 10 C SER A 2 10.223 -7.469 12.000 1.00 22.32 C ATOM 11 O SER A 2 11.176 -8.075 12.491 1.00 30.22 O ATOM 12 CB SER A 2 9.862 -5.005 12.236 1.00 45.23 C ATOM 13 OG SER A 2 10.903 -4.184 12.738 1.00 62.41 O ATOM 0 H SER A 2 8.798 -6.380 10.032 1.00 31.53 H new ATOM 0 HA SER A 2 11.487 -5.946 11.188 1.00 35.35 H new ATOM 0 HB2 SER A 2 9.153 -4.396 11.675 1.00 45.23 H new ATOM 0 HB3 SER A 2 9.313 -5.450 13.066 1.00 45.23 H new ATOM 0 HG SER A 2 10.522 -3.485 13.309 1.00 62.41 H new ATOM 19 N SER A 3 8.981 -7.943 12.013 1.00 43.11 N ATOM 20 CA SER A 3 8.659 -9.228 12.621 1.00 52.32 C ATOM 21 C SER A 3 8.841 -10.363 11.619 1.00 20.43 C ATOM 22 O SER A 3 8.293 -10.330 10.518 1.00 14.02 O ATOM 23 CB SER A 3 7.221 -9.222 13.145 1.00 5.15 C ATOM 24 OG SER A 3 7.102 -10.015 14.314 1.00 70.25 O ATOM 0 H SER A 3 8.181 -7.456 11.609 1.00 43.11 H new ATOM 0 HA SER A 3 9.342 -9.389 13.455 1.00 52.32 H new ATOM 0 HB2 SER A 3 6.914 -8.199 13.363 1.00 5.15 H new ATOM 0 HB3 SER A 3 6.548 -9.600 12.375 1.00 5.15 H new ATOM 0 HG SER A 3 6.175 -9.994 14.631 1.00 70.25 H new ATOM 30 N GLY A 4 9.618 -11.370 12.010 1.00 50.20 N ATOM 31 CA GLY A 4 9.860 -12.502 11.135 1.00 22.53 C ATOM 32 C GLY A 4 11.330 -12.863 11.047 1.00 10.03 C ATOM 33 O GLY A 4 11.931 -13.294 12.031 1.00 62.11 O ATOM 0 H GLY A 4 10.083 -11.421 12.916 1.00 50.20 H new ATOM 0 HA2 GLY A 4 9.299 -13.363 11.497 1.00 22.53 H new ATOM 0 HA3 GLY A 4 9.485 -12.273 10.138 1.00 22.53 H new ATOM 37 N SER A 5 11.910 -12.687 9.864 1.00 4.32 N ATOM 38 CA SER A 5 13.319 -13.002 9.649 1.00 55.43 C ATOM 39 C SER A 5 14.167 -11.735 9.672 1.00 23.21 C ATOM 40 O SER A 5 13.647 -10.627 9.805 1.00 74.51 O ATOM 41 CB SER A 5 13.502 -13.730 8.315 1.00 2.45 C ATOM 42 OG SER A 5 13.056 -12.930 7.234 1.00 72.41 O ATOM 0 H SER A 5 11.427 -12.328 9.040 1.00 4.32 H new ATOM 0 HA SER A 5 13.649 -13.654 10.458 1.00 55.43 H new ATOM 0 HB2 SER A 5 14.553 -13.982 8.176 1.00 2.45 H new ATOM 0 HB3 SER A 5 12.948 -14.669 8.330 1.00 2.45 H new ATOM 0 HG SER A 5 13.185 -13.416 6.393 1.00 72.41 H new ATOM 48 N SER A 6 15.479 -11.906 9.541 1.00 72.43 N ATOM 49 CA SER A 6 16.403 -10.778 9.550 1.00 73.45 C ATOM 50 C SER A 6 17.830 -11.242 9.276 1.00 33.41 C ATOM 51 O SER A 6 18.108 -12.440 9.235 1.00 20.23 O ATOM 52 CB SER A 6 16.340 -10.051 10.893 1.00 33.03 C ATOM 53 OG SER A 6 16.247 -8.648 10.711 1.00 24.53 O ATOM 0 H SER A 6 15.926 -12.816 9.427 1.00 72.43 H new ATOM 0 HA SER A 6 16.105 -10.090 8.759 1.00 73.45 H new ATOM 0 HB2 SER A 6 15.480 -10.405 11.461 1.00 33.03 H new ATOM 0 HB3 SER A 6 17.228 -10.287 11.479 1.00 33.03 H new ATOM 0 HG SER A 6 16.206 -8.207 11.585 1.00 24.53 H new ATOM 59 N GLY A 7 18.732 -10.284 9.088 1.00 55.22 N ATOM 60 CA GLY A 7 20.120 -10.613 8.821 1.00 50.21 C ATOM 61 C GLY A 7 21.030 -9.405 8.914 1.00 64.13 C ATOM 62 O GLY A 7 20.722 -8.438 9.611 1.00 23.43 O ATOM 0 H GLY A 7 18.526 -9.285 9.116 1.00 55.22 H new ATOM 0 HA2 GLY A 7 20.453 -11.371 9.530 1.00 50.21 H new ATOM 0 HA3 GLY A 7 20.202 -11.050 7.826 1.00 50.21 H new ATOM 66 N SER A 8 22.157 -9.459 8.210 1.00 55.35 N ATOM 67 CA SER A 8 23.118 -8.363 8.221 1.00 2.02 C ATOM 68 C SER A 8 22.430 -7.033 7.927 1.00 34.31 C ATOM 69 O SER A 8 21.226 -6.988 7.676 1.00 15.15 O ATOM 70 CB SER A 8 24.223 -8.615 7.193 1.00 25.13 C ATOM 71 OG SER A 8 25.413 -9.059 7.823 1.00 24.03 O ATOM 0 H SER A 8 22.426 -10.250 7.625 1.00 55.35 H new ATOM 0 HA SER A 8 23.561 -8.312 9.216 1.00 2.02 H new ATOM 0 HB2 SER A 8 23.890 -9.361 6.471 1.00 25.13 H new ATOM 0 HB3 SER A 8 24.422 -7.699 6.636 1.00 25.13 H new ATOM 0 HG SER A 8 26.103 -9.215 7.145 1.00 24.03 H new ATOM 77 N ASP A 9 23.204 -5.954 7.960 1.00 51.53 N ATOM 78 CA ASP A 9 22.670 -4.622 7.696 1.00 13.11 C ATOM 79 C ASP A 9 22.900 -4.223 6.242 1.00 13.21 C ATOM 80 O ASP A 9 23.829 -3.479 5.931 1.00 61.31 O ATOM 81 CB ASP A 9 23.318 -3.596 8.628 1.00 72.11 C ATOM 82 CG ASP A 9 22.308 -2.631 9.218 1.00 72.45 C ATOM 83 OD1 ASP A 9 21.171 -3.063 9.503 1.00 11.34 O ATOM 84 OD2 ASP A 9 22.655 -1.446 9.394 1.00 13.50 O ATOM 0 H ASP A 9 24.203 -5.975 8.167 1.00 51.53 H new ATOM 0 HA ASP A 9 21.596 -4.644 7.882 1.00 13.11 H new ATOM 0 HB2 ASP A 9 23.833 -4.117 9.435 1.00 72.11 H new ATOM 0 HB3 ASP A 9 24.073 -3.035 8.077 1.00 72.11 H new ATOM 89 N SER A 10 22.045 -4.724 5.355 1.00 61.05 N ATOM 90 CA SER A 10 22.157 -4.423 3.933 1.00 64.35 C ATOM 91 C SER A 10 20.998 -5.038 3.154 1.00 20.00 C ATOM 92 O SER A 10 20.727 -6.234 3.263 1.00 73.43 O ATOM 93 CB SER A 10 23.488 -4.942 3.383 1.00 35.54 C ATOM 94 OG SER A 10 24.463 -3.915 3.352 1.00 74.23 O ATOM 0 H SER A 10 21.268 -5.339 5.596 1.00 61.05 H new ATOM 0 HA SER A 10 22.119 -3.340 3.812 1.00 64.35 H new ATOM 0 HB2 SER A 10 23.844 -5.766 4.001 1.00 35.54 H new ATOM 0 HB3 SER A 10 23.340 -5.338 2.378 1.00 35.54 H new ATOM 0 HG SER A 10 24.511 -3.483 4.230 1.00 74.23 H new ATOM 100 N LEU A 11 20.317 -4.212 2.368 1.00 43.53 N ATOM 101 CA LEU A 11 19.187 -4.672 1.570 1.00 52.21 C ATOM 102 C LEU A 11 19.221 -4.060 0.173 1.00 72.42 C ATOM 103 O LEU A 11 20.144 -3.323 -0.171 1.00 12.54 O ATOM 104 CB LEU A 11 17.870 -4.316 2.263 1.00 60.10 C ATOM 105 CG LEU A 11 17.715 -4.807 3.703 1.00 53.24 C ATOM 106 CD1 LEU A 11 16.749 -3.918 4.469 1.00 53.42 C ATOM 107 CD2 LEU A 11 17.243 -6.253 3.725 1.00 21.52 C ATOM 0 H LEU A 11 20.528 -3.219 2.266 1.00 43.53 H new ATOM 0 HA LEU A 11 19.259 -5.755 1.474 1.00 52.21 H new ATOM 0 HB2 LEU A 11 17.761 -3.232 2.256 1.00 60.10 H new ATOM 0 HB3 LEU A 11 17.050 -4.723 1.671 1.00 60.10 H new ATOM 0 HG LEU A 11 18.688 -4.756 4.191 1.00 53.24 H new ATOM 0 HD11 LEU A 11 16.651 -4.283 5.491 1.00 53.42 H new ATOM 0 HD12 LEU A 11 17.128 -2.896 4.483 1.00 53.42 H new ATOM 0 HD13 LEU A 11 15.774 -3.937 3.983 1.00 53.42 H new ATOM 0 HD21 LEU A 11 17.138 -6.586 4.758 1.00 21.52 H new ATOM 0 HD22 LEU A 11 16.280 -6.329 3.220 1.00 21.52 H new ATOM 0 HD23 LEU A 11 17.972 -6.882 3.213 1.00 21.52 H new ATOM 119 N VAL A 12 18.206 -4.371 -0.628 1.00 45.22 N ATOM 120 CA VAL A 12 18.118 -3.849 -1.987 1.00 23.21 C ATOM 121 C VAL A 12 17.375 -2.518 -2.018 1.00 21.40 C ATOM 122 O VAL A 12 16.638 -2.228 -2.960 1.00 33.42 O ATOM 123 CB VAL A 12 17.407 -4.844 -2.924 1.00 50.22 C ATOM 124 CG1 VAL A 12 17.598 -4.437 -4.378 1.00 11.24 C ATOM 125 CG2 VAL A 12 17.917 -6.257 -2.687 1.00 53.23 C ATOM 0 H VAL A 12 17.434 -4.981 -0.359 1.00 45.22 H new ATOM 0 HA VAL A 12 19.140 -3.699 -2.336 1.00 23.21 H new ATOM 0 HB VAL A 12 16.340 -4.826 -2.703 1.00 50.22 H new ATOM 0 HG11 VAL A 12 17.089 -5.151 -5.026 1.00 11.24 H new ATOM 0 HG12 VAL A 12 17.180 -3.443 -4.535 1.00 11.24 H new ATOM 0 HG13 VAL A 12 18.662 -4.425 -4.616 1.00 11.24 H new ATOM 0 HG21 VAL A 12 17.404 -6.946 -3.357 1.00 53.23 H new ATOM 0 HG22 VAL A 12 18.989 -6.294 -2.880 1.00 53.23 H new ATOM 0 HG23 VAL A 12 17.724 -6.545 -1.654 1.00 53.23 H new ATOM 135 N VAL A 13 17.576 -1.711 -0.981 1.00 53.22 N ATOM 136 CA VAL A 13 16.926 -0.409 -0.889 1.00 23.22 C ATOM 137 C VAL A 13 16.818 0.249 -2.260 1.00 14.23 C ATOM 138 O VAL A 13 17.777 0.259 -3.032 1.00 44.21 O ATOM 139 CB VAL A 13 17.689 0.533 0.061 1.00 10.03 C ATOM 140 CG1 VAL A 13 19.020 0.944 -0.549 1.00 12.15 C ATOM 141 CG2 VAL A 13 16.844 1.754 0.392 1.00 14.30 C ATOM 0 H VAL A 13 18.184 -1.936 -0.193 1.00 53.22 H new ATOM 0 HA VAL A 13 15.926 -0.582 -0.492 1.00 23.22 H new ATOM 0 HB VAL A 13 17.893 -0.002 0.989 1.00 10.03 H new ATOM 0 HG11 VAL A 13 19.545 1.609 0.137 1.00 12.15 H new ATOM 0 HG12 VAL A 13 19.627 0.057 -0.729 1.00 12.15 H new ATOM 0 HG13 VAL A 13 18.844 1.461 -1.492 1.00 12.15 H new ATOM 0 HG21 VAL A 13 17.398 2.409 1.064 1.00 14.30 H new ATOM 0 HG22 VAL A 13 16.607 2.292 -0.526 1.00 14.30 H new ATOM 0 HG23 VAL A 13 15.920 1.437 0.875 1.00 14.30 H new ATOM 151 N CYS A 14 15.645 0.797 -2.556 1.00 55.20 N ATOM 152 CA CYS A 14 15.411 1.458 -3.835 1.00 11.44 C ATOM 153 C CYS A 14 15.085 2.934 -3.633 1.00 21.12 C ATOM 154 O CYS A 14 15.193 3.457 -2.524 1.00 72.11 O ATOM 155 CB CYS A 14 14.269 0.770 -4.587 1.00 3.13 C ATOM 156 SG CYS A 14 12.636 1.464 -4.243 1.00 12.25 S ATOM 0 H CYS A 14 14.841 0.797 -1.928 1.00 55.20 H new ATOM 0 HA CYS A 14 16.324 1.384 -4.426 1.00 11.44 H new ATOM 0 HB2 CYS A 14 14.462 0.836 -5.658 1.00 3.13 H new ATOM 0 HB3 CYS A 14 14.264 -0.289 -4.328 1.00 3.13 H new ATOM 0 HG CYS A 14 12.702 2.228 -3.193 1.00 12.25 H new ATOM 162 N GLU A 15 14.690 3.601 -4.712 1.00 51.42 N ATOM 163 CA GLU A 15 14.352 5.018 -4.653 1.00 0.31 C ATOM 164 C GLU A 15 12.922 5.257 -5.128 1.00 34.43 C ATOM 165 O GLU A 15 12.455 4.621 -6.072 1.00 75.20 O ATOM 166 CB GLU A 15 15.326 5.834 -5.506 1.00 5.22 C ATOM 167 CG GLU A 15 14.951 5.886 -6.977 1.00 13.43 C ATOM 168 CD GLU A 15 16.134 6.206 -7.869 1.00 51.44 C ATOM 169 OE1 GLU A 15 16.870 7.167 -7.557 1.00 75.33 O ATOM 170 OE2 GLU A 15 16.324 5.498 -8.880 1.00 44.23 O ATOM 0 H GLU A 15 14.596 3.183 -5.638 1.00 51.42 H new ATOM 0 HA GLU A 15 14.431 5.340 -3.615 1.00 0.31 H new ATOM 0 HB2 GLU A 15 15.374 6.851 -5.116 1.00 5.22 H new ATOM 0 HB3 GLU A 15 16.325 5.408 -5.409 1.00 5.22 H new ATOM 0 HG2 GLU A 15 14.526 4.927 -7.274 1.00 13.43 H new ATOM 0 HG3 GLU A 15 14.176 6.638 -7.124 1.00 13.43 H new ATOM 177 N VAL A 16 12.230 6.179 -4.465 1.00 34.14 N ATOM 178 CA VAL A 16 10.853 6.503 -4.818 1.00 5.40 C ATOM 179 C VAL A 16 10.780 7.180 -6.182 1.00 21.33 C ATOM 180 O VAL A 16 10.919 8.398 -6.289 1.00 3.20 O ATOM 181 CB VAL A 16 10.205 7.422 -3.765 1.00 10.11 C ATOM 182 CG1 VAL A 16 11.088 8.631 -3.496 1.00 52.50 C ATOM 183 CG2 VAL A 16 8.818 7.854 -4.217 1.00 60.14 C ATOM 0 H VAL A 16 12.601 6.715 -3.680 1.00 34.14 H new ATOM 0 HA VAL A 16 10.305 5.561 -4.854 1.00 5.40 H new ATOM 0 HB VAL A 16 10.101 6.864 -2.835 1.00 10.11 H new ATOM 0 HG11 VAL A 16 10.614 9.269 -2.750 1.00 52.50 H new ATOM 0 HG12 VAL A 16 12.058 8.298 -3.126 1.00 52.50 H new ATOM 0 HG13 VAL A 16 11.226 9.194 -4.419 1.00 52.50 H new ATOM 0 HG21 VAL A 16 8.375 8.503 -3.461 1.00 60.14 H new ATOM 0 HG22 VAL A 16 8.895 8.395 -5.160 1.00 60.14 H new ATOM 0 HG23 VAL A 16 8.189 6.974 -4.354 1.00 60.14 H new ATOM 193 N ASP A 17 10.561 6.383 -7.221 1.00 22.22 N ATOM 194 CA ASP A 17 10.467 6.904 -8.579 1.00 40.13 C ATOM 195 C ASP A 17 9.830 8.291 -8.586 1.00 41.11 C ATOM 196 O ASP A 17 8.880 8.568 -7.854 1.00 22.43 O ATOM 197 CB ASP A 17 9.657 5.952 -9.460 1.00 13.03 C ATOM 198 CG ASP A 17 9.735 6.315 -10.930 1.00 41.51 C ATOM 199 OD1 ASP A 17 8.925 7.153 -11.378 1.00 20.40 O ATOM 200 OD2 ASP A 17 10.606 5.761 -11.632 1.00 5.31 O ATOM 0 H ASP A 17 10.445 5.372 -7.149 1.00 22.22 H new ATOM 0 HA ASP A 17 11.477 6.986 -8.981 1.00 40.13 H new ATOM 0 HB2 ASP A 17 10.021 4.934 -9.320 1.00 13.03 H new ATOM 0 HB3 ASP A 17 8.615 5.964 -9.141 1.00 13.03 H new ATOM 205 N PRO A 18 10.365 9.184 -9.433 1.00 15.03 N ATOM 206 CA PRO A 18 9.865 10.556 -9.554 1.00 53.15 C ATOM 207 C PRO A 18 8.487 10.615 -10.207 1.00 1.14 C ATOM 208 O PRO A 18 7.695 11.514 -9.925 1.00 30.22 O ATOM 209 CB PRO A 18 10.907 11.236 -10.445 1.00 44.14 C ATOM 210 CG PRO A 18 11.512 10.127 -11.235 1.00 12.00 C ATOM 211 CD PRO A 18 11.498 8.922 -10.335 1.00 44.12 C ATOM 0 HA PRO A 18 9.740 11.031 -8.581 1.00 53.15 H new ATOM 0 HB2 PRO A 18 10.447 11.980 -11.095 1.00 44.14 H new ATOM 0 HB3 PRO A 18 11.659 11.754 -9.850 1.00 44.14 H new ATOM 0 HG2 PRO A 18 10.943 9.941 -12.146 1.00 12.00 H new ATOM 0 HG3 PRO A 18 12.529 10.375 -11.540 1.00 12.00 H new ATOM 0 HD2 PRO A 18 11.357 8.000 -10.900 1.00 44.12 H new ATOM 0 HD3 PRO A 18 12.434 8.820 -9.786 1.00 44.12 H new ATOM 219 N GLU A 19 8.209 9.651 -11.080 1.00 1.53 N ATOM 220 CA GLU A 19 6.927 9.595 -11.772 1.00 10.54 C ATOM 221 C GLU A 19 5.812 9.172 -10.820 1.00 21.14 C ATOM 222 O GLU A 19 4.646 9.514 -11.019 1.00 5.23 O ATOM 223 CB GLU A 19 7.001 8.624 -12.952 1.00 44.10 C ATOM 224 CG GLU A 19 6.625 7.197 -12.590 1.00 41.21 C ATOM 225 CD GLU A 19 5.230 6.827 -13.054 1.00 61.54 C ATOM 226 OE1 GLU A 19 4.254 7.363 -12.490 1.00 73.44 O ATOM 227 OE2 GLU A 19 5.115 5.999 -13.984 1.00 14.04 O ATOM 0 H GLU A 19 8.854 8.899 -11.324 1.00 1.53 H new ATOM 0 HA GLU A 19 6.702 10.594 -12.146 1.00 10.54 H new ATOM 0 HB2 GLU A 19 6.339 8.976 -13.743 1.00 44.10 H new ATOM 0 HB3 GLU A 19 8.013 8.633 -13.356 1.00 44.10 H new ATOM 0 HG2 GLU A 19 7.346 6.511 -13.035 1.00 41.21 H new ATOM 0 HG3 GLU A 19 6.690 7.071 -11.509 1.00 41.21 H new ATOM 234 N LEU A 20 6.179 8.424 -9.784 1.00 43.34 N ATOM 235 CA LEU A 20 5.211 7.952 -8.800 1.00 4.51 C ATOM 236 C LEU A 20 5.058 8.957 -7.663 1.00 3.24 C ATOM 237 O LEU A 20 3.943 9.308 -7.276 1.00 44.32 O ATOM 238 CB LEU A 20 5.643 6.595 -8.242 1.00 23.50 C ATOM 239 CG LEU A 20 4.514 5.655 -7.817 1.00 1.42 C ATOM 240 CD1 LEU A 20 5.059 4.266 -7.523 1.00 54.22 C ATOM 241 CD2 LEU A 20 3.786 6.212 -6.603 1.00 1.23 C ATOM 0 H LEU A 20 7.140 8.132 -9.604 1.00 43.34 H new ATOM 0 HA LEU A 20 4.247 7.843 -9.297 1.00 4.51 H new ATOM 0 HB2 LEU A 20 6.245 6.089 -8.997 1.00 23.50 H new ATOM 0 HB3 LEU A 20 6.289 6.767 -7.381 1.00 23.50 H new ATOM 0 HG LEU A 20 3.802 5.577 -8.639 1.00 1.42 H new ATOM 0 HD11 LEU A 20 4.242 3.611 -7.222 1.00 54.22 H new ATOM 0 HD12 LEU A 20 5.535 3.865 -8.418 1.00 54.22 H new ATOM 0 HD13 LEU A 20 5.792 4.325 -6.718 1.00 54.22 H new ATOM 0 HD21 LEU A 20 2.986 5.530 -6.314 1.00 1.23 H new ATOM 0 HD22 LEU A 20 4.487 6.319 -5.776 1.00 1.23 H new ATOM 0 HD23 LEU A 20 3.362 7.186 -6.848 1.00 1.23 H new ATOM 253 N LYS A 21 6.185 9.417 -7.131 1.00 22.14 N ATOM 254 CA LYS A 21 6.178 10.384 -6.039 1.00 0.32 C ATOM 255 C LYS A 21 5.001 11.346 -6.173 1.00 10.43 C ATOM 256 O LYS A 21 4.292 11.611 -5.203 1.00 13.11 O ATOM 257 CB LYS A 21 7.491 11.168 -6.016 1.00 2.41 C ATOM 258 CG LYS A 21 7.725 11.926 -4.720 1.00 24.21 C ATOM 259 CD LYS A 21 8.438 13.245 -4.966 1.00 22.20 C ATOM 260 CE LYS A 21 9.908 13.165 -4.583 1.00 40.21 C ATOM 261 NZ LYS A 21 10.377 14.414 -3.921 1.00 61.53 N ATOM 0 H LYS A 21 7.116 9.136 -7.438 1.00 22.14 H new ATOM 0 HA LYS A 21 6.073 9.837 -5.102 1.00 0.32 H new ATOM 0 HB2 LYS A 21 8.319 10.478 -6.178 1.00 2.41 H new ATOM 0 HB3 LYS A 21 7.497 11.874 -6.846 1.00 2.41 H new ATOM 0 HG2 LYS A 21 6.770 12.114 -4.230 1.00 24.21 H new ATOM 0 HG3 LYS A 21 8.317 11.313 -4.041 1.00 24.21 H new ATOM 0 HD2 LYS A 21 8.349 13.517 -6.018 1.00 22.20 H new ATOM 0 HD3 LYS A 21 7.954 14.034 -4.391 1.00 22.20 H new ATOM 0 HE2 LYS A 21 10.063 12.319 -3.914 1.00 40.21 H new ATOM 0 HE3 LYS A 21 10.506 12.980 -5.475 1.00 40.21 H new ATOM 0 HZ1 LYS A 21 11.383 14.320 -3.675 1.00 61.53 H new ATOM 0 HZ2 LYS A 21 10.252 15.218 -4.569 1.00 61.53 H new ATOM 0 HZ3 LYS A 21 9.823 14.577 -3.056 1.00 61.53 H new ATOM 275 N GLU A 22 4.800 11.864 -7.381 1.00 20.02 N ATOM 276 CA GLU A 22 3.709 12.796 -7.639 1.00 4.01 C ATOM 277 C GLU A 22 2.356 12.120 -7.432 1.00 51.22 C ATOM 278 O GLU A 22 1.465 12.672 -6.785 1.00 4.12 O ATOM 279 CB GLU A 22 3.804 13.344 -9.065 1.00 4.45 C ATOM 280 CG GLU A 22 5.213 13.746 -9.468 1.00 64.15 C ATOM 281 CD GLU A 22 5.230 14.811 -10.548 1.00 34.21 C ATOM 282 OE1 GLU A 22 4.473 14.671 -11.532 1.00 2.21 O ATOM 283 OE2 GLU A 22 5.998 15.785 -10.408 1.00 3.40 O ATOM 0 H GLU A 22 5.378 11.654 -8.195 1.00 20.02 H new ATOM 0 HA GLU A 22 3.796 13.622 -6.933 1.00 4.01 H new ATOM 0 HB2 GLU A 22 3.437 12.589 -9.761 1.00 4.45 H new ATOM 0 HB3 GLU A 22 3.147 14.209 -9.158 1.00 4.45 H new ATOM 0 HG2 GLU A 22 5.746 14.114 -8.592 1.00 64.15 H new ATOM 0 HG3 GLU A 22 5.751 12.866 -9.822 1.00 64.15 H new ATOM 290 N THR A 23 2.209 10.922 -7.988 1.00 12.11 N ATOM 291 CA THR A 23 0.965 10.171 -7.867 1.00 24.14 C ATOM 292 C THR A 23 0.469 10.158 -6.425 1.00 62.33 C ATOM 293 O THR A 23 -0.722 10.336 -6.167 1.00 5.51 O ATOM 294 CB THR A 23 1.137 8.719 -8.353 1.00 1.35 C ATOM 295 OG1 THR A 23 1.166 8.681 -9.783 1.00 50.13 O ATOM 296 CG2 THR A 23 0.006 7.840 -7.839 1.00 13.22 C ATOM 0 H THR A 23 2.936 10.451 -8.527 1.00 12.11 H new ATOM 0 HA THR A 23 0.230 10.672 -8.496 1.00 24.14 H new ATOM 0 HB THR A 23 2.080 8.337 -7.962 1.00 1.35 H new ATOM 0 HG1 THR A 23 1.277 7.755 -10.083 1.00 50.13 H new ATOM 0 HG21 THR A 23 0.148 6.819 -8.194 1.00 13.22 H new ATOM 0 HG22 THR A 23 0.006 7.848 -6.749 1.00 13.22 H new ATOM 0 HG23 THR A 23 -0.947 8.222 -8.205 1.00 13.22 H new ATOM 304 N LEU A 24 1.388 9.947 -5.490 1.00 63.33 N ATOM 305 CA LEU A 24 1.044 9.912 -4.073 1.00 25.53 C ATOM 306 C LEU A 24 0.572 11.281 -3.593 1.00 22.20 C ATOM 307 O LEU A 24 -0.505 11.409 -3.012 1.00 25.41 O ATOM 308 CB LEU A 24 2.248 9.456 -3.247 1.00 72.40 C ATOM 309 CG LEU A 24 2.973 8.207 -3.749 1.00 52.23 C ATOM 310 CD1 LEU A 24 4.154 7.877 -2.850 1.00 13.14 C ATOM 311 CD2 LEU A 24 2.013 7.029 -3.827 1.00 22.10 C ATOM 0 H LEU A 24 2.377 9.797 -5.687 1.00 63.33 H new ATOM 0 HA LEU A 24 0.229 9.200 -3.940 1.00 25.53 H new ATOM 0 HB2 LEU A 24 2.965 10.276 -3.205 1.00 72.40 H new ATOM 0 HB3 LEU A 24 1.914 9.272 -2.226 1.00 72.40 H new ATOM 0 HG LEU A 24 3.352 8.408 -4.751 1.00 52.23 H new ATOM 0 HD11 LEU A 24 4.657 6.985 -3.223 1.00 13.14 H new ATOM 0 HD12 LEU A 24 4.853 8.713 -2.846 1.00 13.14 H new ATOM 0 HD13 LEU A 24 3.799 7.696 -1.835 1.00 13.14 H new ATOM 0 HD21 LEU A 24 2.546 6.149 -4.186 1.00 22.10 H new ATOM 0 HD22 LEU A 24 1.604 6.827 -2.837 1.00 22.10 H new ATOM 0 HD23 LEU A 24 1.201 7.267 -4.514 1.00 22.10 H new ATOM 323 N ARG A 25 1.386 12.302 -3.842 1.00 54.45 N ATOM 324 CA ARG A 25 1.051 13.662 -3.437 1.00 52.25 C ATOM 325 C ARG A 25 -0.318 14.070 -3.977 1.00 25.53 C ATOM 326 O ARG A 25 -1.028 14.863 -3.360 1.00 71.12 O ATOM 327 CB ARG A 25 2.118 14.641 -3.931 1.00 14.54 C ATOM 328 CG ARG A 25 1.790 16.097 -3.640 1.00 74.33 C ATOM 329 CD ARG A 25 3.049 16.943 -3.540 1.00 62.43 C ATOM 330 NE ARG A 25 3.427 17.514 -4.830 1.00 42.20 N ATOM 331 CZ ARG A 25 4.405 18.401 -4.982 1.00 65.34 C ATOM 332 NH1 ARG A 25 5.101 18.813 -3.932 1.00 13.34 N ATOM 333 NH2 ARG A 25 4.690 18.875 -6.188 1.00 63.10 N ATOM 0 H ARG A 25 2.282 12.213 -4.322 1.00 54.45 H new ATOM 0 HA ARG A 25 1.016 13.691 -2.348 1.00 52.25 H new ATOM 0 HB2 ARG A 25 3.071 14.392 -3.465 1.00 14.54 H new ATOM 0 HB3 ARG A 25 2.246 14.514 -5.006 1.00 14.54 H new ATOM 0 HG2 ARG A 25 1.148 16.491 -4.428 1.00 74.33 H new ATOM 0 HG3 ARG A 25 1.230 16.165 -2.708 1.00 74.33 H new ATOM 0 HD2 ARG A 25 2.890 17.746 -2.820 1.00 62.43 H new ATOM 0 HD3 ARG A 25 3.868 16.332 -3.160 1.00 62.43 H new ATOM 0 HE ARG A 25 2.913 17.216 -5.659 1.00 42.20 H new ATOM 0 HH11 ARG A 25 4.887 18.449 -3.003 1.00 13.34 H new ATOM 0 HH12 ARG A 25 5.851 19.494 -4.052 1.00 13.34 H new ATOM 0 HH21 ARG A 25 4.158 18.559 -6.999 1.00 63.10 H new ATOM 0 HH22 ARG A 25 5.441 19.556 -6.304 1.00 63.10 H new ATOM 347 N LYS A 26 -0.679 13.521 -5.131 1.00 51.00 N ATOM 348 CA LYS A 26 -1.961 13.825 -5.755 1.00 53.52 C ATOM 349 C LYS A 26 -3.077 12.981 -5.145 1.00 43.05 C ATOM 350 O LYS A 26 -4.205 13.448 -4.985 1.00 21.32 O ATOM 351 CB LYS A 26 -1.889 13.581 -7.264 1.00 71.30 C ATOM 352 CG LYS A 26 -0.560 13.978 -7.882 1.00 22.34 C ATOM 353 CD LYS A 26 -0.739 15.034 -8.958 1.00 45.24 C ATOM 354 CE LYS A 26 0.304 14.893 -10.056 1.00 63.34 C ATOM 355 NZ LYS A 26 -0.308 14.937 -11.413 1.00 51.43 N ATOM 0 H LYS A 26 -0.101 12.863 -5.654 1.00 51.00 H new ATOM 0 HA LYS A 26 -2.184 14.877 -5.574 1.00 53.52 H new ATOM 0 HB2 LYS A 26 -2.071 12.525 -7.462 1.00 71.30 H new ATOM 0 HB3 LYS A 26 -2.688 14.139 -7.752 1.00 71.30 H new ATOM 0 HG2 LYS A 26 0.104 14.357 -7.106 1.00 22.34 H new ATOM 0 HG3 LYS A 26 -0.080 13.098 -8.311 1.00 22.34 H new ATOM 0 HD2 LYS A 26 -1.737 14.950 -9.389 1.00 45.24 H new ATOM 0 HD3 LYS A 26 -0.667 16.026 -8.512 1.00 45.24 H new ATOM 0 HE2 LYS A 26 1.039 15.693 -9.963 1.00 63.34 H new ATOM 0 HE3 LYS A 26 0.839 13.952 -9.930 1.00 63.34 H new ATOM 0 HZ1 LYS A 26 0.436 14.838 -12.133 1.00 51.43 H new ATOM 0 HZ2 LYS A 26 -0.991 14.159 -11.511 1.00 51.43 H new ATOM 0 HZ3 LYS A 26 -0.797 15.845 -11.544 1.00 51.43 H new ATOM 369 N PHE A 27 -2.753 11.738 -4.806 1.00 74.45 N ATOM 370 CA PHE A 27 -3.728 10.829 -4.214 1.00 11.55 C ATOM 371 C PHE A 27 -4.282 11.400 -2.911 1.00 44.13 C ATOM 372 O PHE A 27 -5.456 11.217 -2.589 1.00 73.54 O ATOM 373 CB PHE A 27 -3.092 9.462 -3.955 1.00 4.13 C ATOM 374 CG PHE A 27 -4.089 8.343 -3.870 1.00 74.32 C ATOM 375 CD1 PHE A 27 -5.055 8.181 -4.851 1.00 63.21 C ATOM 376 CD2 PHE A 27 -4.062 7.453 -2.810 1.00 31.55 C ATOM 377 CE1 PHE A 27 -5.974 7.152 -4.777 1.00 21.42 C ATOM 378 CE2 PHE A 27 -4.979 6.420 -2.729 1.00 54.11 C ATOM 379 CZ PHE A 27 -5.936 6.271 -3.714 1.00 12.23 C ATOM 0 H PHE A 27 -1.824 11.337 -4.931 1.00 74.45 H new ATOM 0 HA PHE A 27 -4.551 10.711 -4.918 1.00 11.55 H new ATOM 0 HB2 PHE A 27 -2.381 9.244 -4.752 1.00 4.13 H new ATOM 0 HB3 PHE A 27 -2.525 9.504 -3.025 1.00 4.13 H new ATOM 0 HD1 PHE A 27 -5.090 8.868 -5.684 1.00 63.21 H new ATOM 0 HD2 PHE A 27 -3.316 7.566 -2.037 1.00 31.55 H new ATOM 0 HE1 PHE A 27 -6.721 7.037 -5.549 1.00 21.42 H new ATOM 0 HE2 PHE A 27 -4.947 5.732 -1.897 1.00 54.11 H new ATOM 0 HZ PHE A 27 -6.654 5.466 -3.653 1.00 12.23 H new ATOM 389 N ARG A 28 -3.427 12.092 -2.165 1.00 72.12 N ATOM 390 CA ARG A 28 -3.829 12.689 -0.897 1.00 24.44 C ATOM 391 C ARG A 28 -4.740 13.891 -1.125 1.00 42.53 C ATOM 392 O ARG A 28 -5.624 14.175 -0.318 1.00 11.54 O ATOM 393 CB ARG A 28 -2.597 13.113 -0.095 1.00 73.33 C ATOM 394 CG ARG A 28 -1.480 12.083 -0.105 1.00 24.34 C ATOM 395 CD ARG A 28 -1.006 11.762 1.305 1.00 35.52 C ATOM 396 NE ARG A 28 -0.481 12.941 1.988 1.00 40.12 N ATOM 397 CZ ARG A 28 -0.414 13.055 3.309 1.00 5.51 C ATOM 398 NH1 ARG A 28 -0.835 12.068 4.086 1.00 15.14 N ATOM 399 NH2 ARG A 28 0.078 14.160 3.856 1.00 2.14 N ATOM 0 H ARG A 28 -2.452 12.253 -2.417 1.00 72.12 H new ATOM 0 HA ARG A 28 -4.382 11.939 -0.331 1.00 24.44 H new ATOM 0 HB2 ARG A 28 -2.217 14.052 -0.498 1.00 73.33 H new ATOM 0 HB3 ARG A 28 -2.894 13.305 0.936 1.00 73.33 H new ATOM 0 HG2 ARG A 28 -1.829 11.171 -0.589 1.00 24.34 H new ATOM 0 HG3 ARG A 28 -0.643 12.457 -0.695 1.00 24.34 H new ATOM 0 HD2 ARG A 28 -1.834 11.349 1.880 1.00 35.52 H new ATOM 0 HD3 ARG A 28 -0.233 10.994 1.262 1.00 35.52 H new ATOM 0 HE ARG A 28 -0.148 13.719 1.419 1.00 40.12 H new ATOM 0 HH11 ARG A 28 -1.212 11.217 3.670 1.00 15.14 H new ATOM 0 HH12 ARG A 28 -0.782 12.159 5.101 1.00 15.14 H new ATOM 0 HH21 ARG A 28 0.405 14.922 3.261 1.00 2.14 H new ATOM 0 HH22 ARG A 28 0.129 14.247 4.871 1.00 2.14 H new ATOM 413 N PHE A 29 -4.516 14.593 -2.231 1.00 54.40 N ATOM 414 CA PHE A 29 -5.316 15.767 -2.566 1.00 0.00 C ATOM 415 C PHE A 29 -5.898 15.645 -3.971 1.00 50.12 C ATOM 416 O PHE A 29 -5.850 16.591 -4.758 1.00 65.22 O ATOM 417 CB PHE A 29 -4.466 17.036 -2.461 1.00 74.14 C ATOM 418 CG PHE A 29 -3.252 16.874 -1.592 1.00 1.34 C ATOM 419 CD1 PHE A 29 -3.363 16.350 -0.314 1.00 13.55 C ATOM 420 CD2 PHE A 29 -2.000 17.246 -2.053 1.00 42.32 C ATOM 421 CE1 PHE A 29 -2.247 16.201 0.489 1.00 72.12 C ATOM 422 CE2 PHE A 29 -0.880 17.098 -1.256 1.00 32.25 C ATOM 423 CZ PHE A 29 -1.005 16.575 0.017 1.00 43.21 C ATOM 0 H PHE A 29 -3.788 14.370 -2.910 1.00 54.40 H new ATOM 0 HA PHE A 29 -6.140 15.830 -1.855 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -4.150 17.336 -3.460 1.00 74.14 H new ATOM 0 HB3 PHE A 29 -5.081 17.844 -2.065 1.00 74.14 H new ATOM 0 HD1 PHE A 29 -4.332 16.055 0.059 1.00 13.55 H new ATOM 0 HD2 PHE A 29 -1.897 17.656 -3.047 1.00 42.32 H new ATOM 0 HE1 PHE A 29 -2.347 15.793 1.484 1.00 72.12 H new ATOM 0 HE2 PHE A 29 0.091 17.391 -1.628 1.00 32.25 H new ATOM 0 HZ PHE A 29 -0.132 16.459 0.642 1.00 43.21 H new ATOM 433 N ARG A 30 -6.447 14.475 -4.278 1.00 22.22 N ATOM 434 CA ARG A 30 -7.038 14.228 -5.588 1.00 43.43 C ATOM 435 C ARG A 30 -8.496 14.673 -5.620 1.00 15.51 C ATOM 436 O ARG A 30 -9.050 15.096 -4.605 1.00 21.12 O ATOM 437 CB ARG A 30 -6.938 12.744 -5.945 1.00 42.42 C ATOM 438 CG ARG A 30 -7.644 11.831 -4.956 1.00 12.30 C ATOM 439 CD ARG A 30 -7.123 10.405 -5.045 1.00 74.33 C ATOM 440 NE ARG A 30 -8.199 9.443 -5.269 1.00 62.15 N ATOM 441 CZ ARG A 30 -8.969 8.962 -4.300 1.00 2.11 C ATOM 442 NH1 ARG A 30 -8.784 9.352 -3.046 1.00 64.24 N ATOM 443 NH2 ARG A 30 -9.928 8.090 -4.583 1.00 62.25 N ATOM 0 H ARG A 30 -6.495 13.683 -3.638 1.00 22.22 H new ATOM 0 HA ARG A 30 -6.483 14.810 -6.324 1.00 43.43 H new ATOM 0 HB2 ARG A 30 -7.362 12.588 -6.937 1.00 42.42 H new ATOM 0 HB3 ARG A 30 -5.886 12.462 -6.000 1.00 42.42 H new ATOM 0 HG2 ARG A 30 -7.501 12.209 -3.944 1.00 12.30 H new ATOM 0 HG3 ARG A 30 -8.716 11.841 -5.151 1.00 12.30 H new ATOM 0 HD2 ARG A 30 -6.398 10.334 -5.856 1.00 74.33 H new ATOM 0 HD3 ARG A 30 -6.597 10.153 -4.124 1.00 74.33 H new ATOM 0 HE ARG A 30 -8.368 9.123 -6.223 1.00 62.15 H new ATOM 0 HH11 ARG A 30 -8.049 10.023 -2.824 1.00 64.24 H new ATOM 0 HH12 ARG A 30 -9.377 8.981 -2.304 1.00 64.24 H new ATOM 0 HH21 ARG A 30 -10.075 7.788 -5.546 1.00 62.25 H new ATOM 0 HH22 ARG A 30 -10.519 7.722 -3.837 1.00 62.25 H new ATOM 457 N LYS A 31 -9.115 14.575 -6.792 1.00 43.04 N ATOM 458 CA LYS A 31 -10.510 14.966 -6.958 1.00 25.52 C ATOM 459 C LYS A 31 -11.385 13.750 -7.244 1.00 22.11 C ATOM 460 O LYS A 31 -12.320 13.821 -8.040 1.00 3.22 O ATOM 461 CB LYS A 31 -10.644 15.983 -8.093 1.00 12.34 C ATOM 462 CG LYS A 31 -10.180 17.379 -7.716 1.00 1.00 C ATOM 463 CD LYS A 31 -11.335 18.237 -7.226 1.00 4.22 C ATOM 464 CE LYS A 31 -10.837 19.482 -6.507 1.00 73.14 C ATOM 465 NZ LYS A 31 -11.674 19.808 -5.318 1.00 51.44 N ATOM 0 H LYS A 31 -8.671 14.227 -7.642 1.00 43.04 H new ATOM 0 HA LYS A 31 -10.847 15.423 -6.028 1.00 25.52 H new ATOM 0 HB2 LYS A 31 -10.067 15.636 -8.950 1.00 12.34 H new ATOM 0 HB3 LYS A 31 -11.687 16.028 -8.408 1.00 12.34 H new ATOM 0 HG2 LYS A 31 -9.419 17.313 -6.938 1.00 1.00 H new ATOM 0 HG3 LYS A 31 -9.713 17.854 -8.579 1.00 1.00 H new ATOM 0 HD2 LYS A 31 -11.958 18.528 -8.072 1.00 4.22 H new ATOM 0 HD3 LYS A 31 -11.964 17.654 -6.553 1.00 4.22 H new ATOM 0 HE2 LYS A 31 -9.804 19.332 -6.194 1.00 73.14 H new ATOM 0 HE3 LYS A 31 -10.841 20.326 -7.197 1.00 73.14 H new ATOM 0 HZ1 LYS A 31 -11.302 20.662 -4.856 1.00 51.44 H new ATOM 0 HZ2 LYS A 31 -12.655 19.976 -5.620 1.00 51.44 H new ATOM 0 HZ3 LYS A 31 -11.650 19.013 -4.648 1.00 51.44 H new ATOM 479 N GLU A 32 -11.075 12.636 -6.588 1.00 40.11 N ATOM 480 CA GLU A 32 -11.835 11.405 -6.772 1.00 20.11 C ATOM 481 C GLU A 32 -12.822 11.198 -5.627 1.00 24.12 C ATOM 482 O GLU A 32 -13.978 10.835 -5.845 1.00 51.34 O ATOM 483 CB GLU A 32 -10.890 10.205 -6.869 1.00 50.43 C ATOM 484 CG GLU A 32 -9.988 10.239 -8.092 1.00 34.32 C ATOM 485 CD GLU A 32 -10.515 9.386 -9.229 1.00 24.10 C ATOM 486 OE1 GLU A 32 -11.737 9.130 -9.263 1.00 3.33 O ATOM 487 OE2 GLU A 32 -9.705 8.975 -10.087 1.00 21.24 O ATOM 0 H GLU A 32 -10.304 12.561 -5.925 1.00 40.11 H new ATOM 0 HA GLU A 32 -12.397 11.491 -7.702 1.00 20.11 H new ATOM 0 HB2 GLU A 32 -10.271 10.167 -5.972 1.00 50.43 H new ATOM 0 HB3 GLU A 32 -11.480 9.289 -6.888 1.00 50.43 H new ATOM 0 HG2 GLU A 32 -9.884 11.269 -8.433 1.00 34.32 H new ATOM 0 HG3 GLU A 32 -8.992 9.893 -7.814 1.00 34.32 H new ATOM 494 N THR A 33 -12.356 11.430 -4.403 1.00 14.22 N ATOM 495 CA THR A 33 -13.195 11.268 -3.223 1.00 31.23 C ATOM 496 C THR A 33 -13.962 9.952 -3.270 1.00 74.30 C ATOM 497 O THR A 33 -15.097 9.866 -2.802 1.00 52.23 O ATOM 498 CB THR A 33 -14.198 12.429 -3.082 1.00 24.32 C ATOM 499 OG1 THR A 33 -15.209 12.327 -4.091 1.00 5.21 O ATOM 500 CG2 THR A 33 -13.491 13.770 -3.197 1.00 41.04 C ATOM 0 H THR A 33 -11.402 11.731 -4.204 1.00 14.22 H new ATOM 0 HA THR A 33 -12.529 11.267 -2.360 1.00 31.23 H new ATOM 0 HB THR A 33 -14.661 12.364 -2.097 1.00 24.32 H new ATOM 0 HG1 THR A 33 -15.042 11.534 -4.642 1.00 5.21 H new ATOM 0 HG21 THR A 33 -14.219 14.575 -3.094 1.00 41.04 H new ATOM 0 HG22 THR A 33 -12.742 13.855 -2.410 1.00 41.04 H new ATOM 0 HG23 THR A 33 -13.004 13.843 -4.170 1.00 41.04 H new ATOM 508 N ASN A 34 -13.336 8.926 -3.838 1.00 5.01 N ATOM 509 CA ASN A 34 -13.960 7.613 -3.947 1.00 11.11 C ATOM 510 C ASN A 34 -12.947 6.504 -3.678 1.00 11.22 C ATOM 511 O ASN A 34 -11.831 6.531 -4.195 1.00 61.22 O ATOM 512 CB ASN A 34 -14.575 7.431 -5.336 1.00 54.42 C ATOM 513 CG ASN A 34 -13.525 7.241 -6.413 1.00 62.24 C ATOM 514 OD1 ASN A 34 -13.324 8.111 -7.260 1.00 5.04 O ATOM 515 ND2 ASN A 34 -12.851 6.097 -6.385 1.00 63.42 N ATOM 0 H ASN A 34 -12.396 8.979 -4.230 1.00 5.01 H new ATOM 0 HA ASN A 34 -14.748 7.550 -3.197 1.00 11.11 H new ATOM 0 HB2 ASN A 34 -15.241 6.568 -5.325 1.00 54.42 H new ATOM 0 HB3 ASN A 34 -15.185 8.301 -5.577 1.00 54.42 H new ATOM 0 HD21 ASN A 34 -12.133 5.911 -7.085 1.00 63.42 H new ATOM 0 HD22 ASN A 34 -13.052 5.404 -5.664 1.00 63.42 H new ATOM 522 N ASN A 35 -13.346 5.530 -2.866 1.00 31.13 N ATOM 523 CA ASN A 35 -12.473 4.412 -2.528 1.00 24.23 C ATOM 524 C ASN A 35 -11.624 4.003 -3.729 1.00 32.54 C ATOM 525 O ASN A 35 -12.151 3.581 -4.758 1.00 21.13 O ATOM 526 CB ASN A 35 -13.301 3.221 -2.044 1.00 22.40 C ATOM 527 CG ASN A 35 -13.806 3.405 -0.625 1.00 52.14 C ATOM 528 OD1 ASN A 35 -13.695 4.488 -0.052 1.00 43.52 O ATOM 529 ND2 ASN A 35 -14.365 2.345 -0.054 1.00 14.12 N ATOM 0 H ASN A 35 -14.268 5.493 -2.430 1.00 31.13 H new ATOM 0 HA ASN A 35 -11.807 4.732 -1.727 1.00 24.23 H new ATOM 0 HB2 ASN A 35 -14.150 3.076 -2.713 1.00 22.40 H new ATOM 0 HB3 ASN A 35 -12.696 2.316 -2.097 1.00 22.40 H new ATOM 0 HD21 ASN A 35 -14.724 2.409 0.899 1.00 14.12 H new ATOM 0 HD22 ASN A 35 -14.435 1.467 -0.568 1.00 14.12 H new ATOM 536 N ALA A 36 -10.310 4.129 -3.587 1.00 43.00 N ATOM 537 CA ALA A 36 -9.388 3.770 -4.658 1.00 24.31 C ATOM 538 C ALA A 36 -8.101 3.173 -4.098 1.00 71.13 C ATOM 539 O ALA A 36 -7.808 3.308 -2.910 1.00 51.42 O ATOM 540 CB ALA A 36 -9.077 4.986 -5.518 1.00 35.35 C ATOM 0 H ALA A 36 -9.859 4.477 -2.741 1.00 43.00 H new ATOM 0 HA ALA A 36 -9.869 3.014 -5.278 1.00 24.31 H new ATOM 0 HB1 ALA A 36 -8.388 4.703 -6.313 1.00 35.35 H new ATOM 0 HB2 ALA A 36 -9.999 5.367 -5.956 1.00 35.35 H new ATOM 0 HB3 ALA A 36 -8.621 5.761 -4.901 1.00 35.35 H new ATOM 546 N ALA A 37 -7.336 2.512 -4.961 1.00 33.11 N ATOM 547 CA ALA A 37 -6.081 1.895 -4.552 1.00 5.35 C ATOM 548 C ALA A 37 -4.995 2.115 -5.600 1.00 22.50 C ATOM 549 O ALA A 37 -5.289 2.320 -6.778 1.00 41.20 O ATOM 550 CB ALA A 37 -6.280 0.409 -4.299 1.00 30.15 C ATOM 0 H ALA A 37 -7.564 2.390 -5.948 1.00 33.11 H new ATOM 0 HA ALA A 37 -5.757 2.369 -3.625 1.00 5.35 H new ATOM 0 HB1 ALA A 37 -5.334 -0.038 -3.994 1.00 30.15 H new ATOM 0 HB2 ALA A 37 -7.018 0.270 -3.509 1.00 30.15 H new ATOM 0 HB3 ALA A 37 -6.631 -0.072 -5.212 1.00 30.15 H new ATOM 556 N ILE A 38 -3.740 2.070 -5.164 1.00 75.53 N ATOM 557 CA ILE A 38 -2.612 2.263 -6.066 1.00 45.21 C ATOM 558 C ILE A 38 -1.505 1.253 -5.785 1.00 22.22 C ATOM 559 O ILE A 38 -0.734 1.409 -4.838 1.00 25.32 O ATOM 560 CB ILE A 38 -2.035 3.686 -5.948 1.00 64.41 C ATOM 561 CG1 ILE A 38 -3.165 4.713 -5.869 1.00 52.33 C ATOM 562 CG2 ILE A 38 -1.120 3.986 -7.127 1.00 31.01 C ATOM 563 CD1 ILE A 38 -2.678 6.142 -5.774 1.00 4.14 C ATOM 0 H ILE A 38 -3.480 1.902 -4.192 1.00 75.53 H new ATOM 0 HA ILE A 38 -2.988 2.114 -7.078 1.00 45.21 H new ATOM 0 HB ILE A 38 -1.448 3.749 -5.032 1.00 64.41 H new ATOM 0 HG12 ILE A 38 -3.799 4.612 -6.750 1.00 52.33 H new ATOM 0 HG13 ILE A 38 -3.787 4.491 -5.001 1.00 52.33 H new ATOM 0 HG21 ILE A 38 -0.720 4.995 -7.029 1.00 31.01 H new ATOM 0 HG22 ILE A 38 -0.298 3.270 -7.141 1.00 31.01 H new ATOM 0 HG23 ILE A 38 -1.686 3.908 -8.056 1.00 31.01 H new ATOM 0 HD11 ILE A 38 -3.534 6.815 -5.721 1.00 4.14 H new ATOM 0 HD12 ILE A 38 -2.068 6.260 -4.878 1.00 4.14 H new ATOM 0 HD13 ILE A 38 -2.081 6.382 -6.654 1.00 4.14 H new ATOM 575 N ILE A 39 -1.431 0.218 -6.615 1.00 54.12 N ATOM 576 CA ILE A 39 -0.416 -0.817 -6.458 1.00 35.02 C ATOM 577 C ILE A 39 0.872 -0.436 -7.179 1.00 61.41 C ATOM 578 O ILE A 39 0.899 -0.321 -8.404 1.00 33.41 O ATOM 579 CB ILE A 39 -0.909 -2.175 -6.993 1.00 13.00 C ATOM 580 CG1 ILE A 39 -2.266 -2.526 -6.380 1.00 20.45 C ATOM 581 CG2 ILE A 39 0.111 -3.263 -6.695 1.00 1.44 C ATOM 582 CD1 ILE A 39 -3.255 -3.084 -7.380 1.00 41.31 C ATOM 0 H ILE A 39 -2.062 0.074 -7.403 1.00 54.12 H new ATOM 0 HA ILE A 39 -0.219 -0.907 -5.390 1.00 35.02 H new ATOM 0 HB ILE A 39 -1.028 -2.102 -8.074 1.00 13.00 H new ATOM 0 HG12 ILE A 39 -2.118 -3.254 -5.583 1.00 20.45 H new ATOM 0 HG13 ILE A 39 -2.690 -1.633 -5.921 1.00 20.45 H new ATOM 0 HG21 ILE A 39 -0.251 -4.217 -7.079 1.00 1.44 H new ATOM 0 HG22 ILE A 39 1.058 -3.015 -7.174 1.00 1.44 H new ATOM 0 HG23 ILE A 39 0.259 -3.338 -5.618 1.00 1.44 H new ATOM 0 HD11 ILE A 39 -4.194 -3.310 -6.875 1.00 41.31 H new ATOM 0 HD12 ILE A 39 -3.433 -2.349 -8.165 1.00 41.31 H new ATOM 0 HD13 ILE A 39 -2.851 -3.995 -7.821 1.00 41.31 H new ATOM 594 N MET A 40 1.940 -0.245 -6.411 1.00 31.33 N ATOM 595 CA MET A 40 3.233 0.119 -6.977 1.00 1.45 C ATOM 596 C MET A 40 4.220 -1.039 -6.866 1.00 41.34 C ATOM 597 O MET A 40 4.227 -1.769 -5.876 1.00 22.55 O ATOM 598 CB MET A 40 3.794 1.353 -6.268 1.00 4.11 C ATOM 599 CG MET A 40 2.761 2.443 -6.035 1.00 31.45 C ATOM 600 SD MET A 40 3.001 3.302 -4.468 1.00 34.21 S ATOM 601 CE MET A 40 1.608 2.683 -3.527 1.00 14.34 C ATOM 0 H MET A 40 1.935 -0.336 -5.395 1.00 31.33 H new ATOM 0 HA MET A 40 3.088 0.350 -8.032 1.00 1.45 H new ATOM 0 HB2 MET A 40 4.214 1.051 -5.309 1.00 4.11 H new ATOM 0 HB3 MET A 40 4.613 1.761 -6.860 1.00 4.11 H new ATOM 0 HG2 MET A 40 2.808 3.164 -6.851 1.00 31.45 H new ATOM 0 HG3 MET A 40 1.764 2.004 -6.055 1.00 31.45 H new ATOM 0 HE1 MET A 40 1.840 2.724 -2.463 1.00 14.34 H new ATOM 0 HE2 MET A 40 0.730 3.296 -3.731 1.00 14.34 H new ATOM 0 HE3 MET A 40 1.405 1.651 -3.814 1.00 14.34 H new ATOM 611 N LYS A 41 5.053 -1.200 -7.889 1.00 74.22 N ATOM 612 CA LYS A 41 6.045 -2.268 -7.907 1.00 74.43 C ATOM 613 C LYS A 41 7.459 -1.699 -7.847 1.00 34.24 C ATOM 614 O LYS A 41 7.649 -0.483 -7.832 1.00 32.04 O ATOM 615 CB LYS A 41 5.882 -3.123 -9.167 1.00 13.44 C ATOM 616 CG LYS A 41 6.288 -2.407 -10.444 1.00 31.32 C ATOM 617 CD LYS A 41 7.092 -3.315 -11.359 1.00 51.11 C ATOM 618 CE LYS A 41 6.823 -3.007 -12.825 1.00 73.31 C ATOM 619 NZ LYS A 41 7.594 -3.904 -13.730 1.00 54.02 N ATOM 0 H LYS A 41 5.060 -0.604 -8.717 1.00 74.22 H new ATOM 0 HA LYS A 41 5.885 -2.892 -7.028 1.00 74.43 H new ATOM 0 HB2 LYS A 41 6.480 -4.028 -9.062 1.00 13.44 H new ATOM 0 HB3 LYS A 41 4.841 -3.437 -9.251 1.00 13.44 H new ATOM 0 HG2 LYS A 41 5.397 -2.059 -10.966 1.00 31.32 H new ATOM 0 HG3 LYS A 41 6.877 -1.524 -10.196 1.00 31.32 H new ATOM 0 HD2 LYS A 41 8.155 -3.195 -11.150 1.00 51.11 H new ATOM 0 HD3 LYS A 41 6.842 -4.356 -11.153 1.00 51.11 H new ATOM 0 HE2 LYS A 41 5.758 -3.114 -13.029 1.00 73.31 H new ATOM 0 HE3 LYS A 41 7.085 -1.969 -13.032 1.00 73.31 H new ATOM 0 HZ1 LYS A 41 7.296 -3.744 -14.714 1.00 54.02 H new ATOM 0 HZ2 LYS A 41 8.610 -3.700 -13.638 1.00 54.02 H new ATOM 0 HZ3 LYS A 41 7.415 -4.895 -13.471 1.00 54.02 H new ATOM 633 N VAL A 42 8.448 -2.586 -7.812 1.00 41.51 N ATOM 634 CA VAL A 42 9.845 -2.171 -7.756 1.00 51.01 C ATOM 635 C VAL A 42 10.680 -2.911 -8.794 1.00 50.34 C ATOM 636 O VAL A 42 11.038 -4.074 -8.605 1.00 52.45 O ATOM 637 CB VAL A 42 10.447 -2.417 -6.360 1.00 14.43 C ATOM 638 CG1 VAL A 42 10.071 -3.799 -5.851 1.00 33.42 C ATOM 639 CG2 VAL A 42 11.958 -2.246 -6.394 1.00 4.34 C ATOM 0 H VAL A 42 8.308 -3.596 -7.821 1.00 41.51 H new ATOM 0 HA VAL A 42 9.867 -1.103 -7.971 1.00 51.01 H new ATOM 0 HB VAL A 42 10.035 -1.679 -5.672 1.00 14.43 H new ATOM 0 HG11 VAL A 42 10.506 -3.954 -4.864 1.00 33.42 H new ATOM 0 HG12 VAL A 42 8.986 -3.880 -5.787 1.00 33.42 H new ATOM 0 HG13 VAL A 42 10.451 -4.555 -6.537 1.00 33.42 H new ATOM 0 HG21 VAL A 42 12.367 -2.423 -5.399 1.00 4.34 H new ATOM 0 HG22 VAL A 42 12.389 -2.960 -7.096 1.00 4.34 H new ATOM 0 HG23 VAL A 42 12.202 -1.232 -6.711 1.00 4.34 H new ATOM 649 N ASP A 43 10.988 -2.228 -9.892 1.00 3.32 N ATOM 650 CA ASP A 43 11.784 -2.820 -10.962 1.00 2.51 C ATOM 651 C ASP A 43 13.186 -3.166 -10.469 1.00 31.22 C ATOM 652 O ASP A 43 13.970 -2.282 -10.123 1.00 71.15 O ATOM 653 CB ASP A 43 11.871 -1.861 -12.151 1.00 21.32 C ATOM 654 CG ASP A 43 10.558 -1.750 -12.901 1.00 12.02 C ATOM 655 OD1 ASP A 43 9.675 -2.604 -12.681 1.00 60.10 O ATOM 656 OD2 ASP A 43 10.415 -0.808 -13.708 1.00 55.13 O ATOM 0 H ASP A 43 10.699 -1.265 -10.064 1.00 3.32 H new ATOM 0 HA ASP A 43 11.293 -3.740 -11.281 1.00 2.51 H new ATOM 0 HB2 ASP A 43 12.169 -0.874 -11.797 1.00 21.32 H new ATOM 0 HB3 ASP A 43 12.649 -2.203 -12.834 1.00 21.32 H new ATOM 661 N LYS A 44 13.493 -4.458 -10.437 1.00 63.32 N ATOM 662 CA LYS A 44 14.800 -4.923 -9.988 1.00 32.14 C ATOM 663 C LYS A 44 15.898 -4.470 -10.944 1.00 12.41 C ATOM 664 O LYS A 44 17.079 -4.474 -10.594 1.00 42.54 O ATOM 665 CB LYS A 44 14.809 -6.449 -9.871 1.00 20.54 C ATOM 666 CG LYS A 44 16.045 -6.999 -9.183 1.00 21.55 C ATOM 667 CD LYS A 44 17.048 -7.542 -10.187 1.00 60.12 C ATOM 668 CE LYS A 44 17.676 -8.840 -9.704 1.00 31.33 C ATOM 669 NZ LYS A 44 18.375 -9.562 -10.802 1.00 55.45 N ATOM 0 H LYS A 44 12.854 -5.202 -10.717 1.00 63.32 H new ATOM 0 HA LYS A 44 14.995 -4.488 -9.008 1.00 32.14 H new ATOM 0 HB2 LYS A 44 13.924 -6.768 -9.320 1.00 20.54 H new ATOM 0 HB3 LYS A 44 14.736 -6.882 -10.869 1.00 20.54 H new ATOM 0 HG2 LYS A 44 16.512 -6.213 -8.590 1.00 21.55 H new ATOM 0 HG3 LYS A 44 15.756 -7.791 -8.492 1.00 21.55 H new ATOM 0 HD2 LYS A 44 16.552 -7.711 -11.143 1.00 60.12 H new ATOM 0 HD3 LYS A 44 17.829 -6.801 -10.359 1.00 60.12 H new ATOM 0 HE2 LYS A 44 18.384 -8.625 -8.903 1.00 31.33 H new ATOM 0 HE3 LYS A 44 16.903 -9.482 -9.282 1.00 31.33 H new ATOM 0 HZ1 LYS A 44 18.789 -10.441 -10.431 1.00 55.45 H new ATOM 0 HZ2 LYS A 44 17.695 -9.790 -11.555 1.00 55.45 H new ATOM 0 HZ3 LYS A 44 19.130 -8.960 -11.188 1.00 55.45 H new ATOM 683 N ASP A 45 15.502 -4.078 -12.149 1.00 62.13 N ATOM 684 CA ASP A 45 16.453 -3.618 -13.155 1.00 32.42 C ATOM 685 C ASP A 45 16.815 -2.153 -12.931 1.00 72.40 C ATOM 686 O ASP A 45 17.950 -1.741 -13.172 1.00 73.13 O ATOM 687 CB ASP A 45 15.873 -3.805 -14.559 1.00 24.24 C ATOM 688 CG ASP A 45 16.679 -4.781 -15.393 1.00 31.45 C ATOM 689 OD1 ASP A 45 17.921 -4.789 -15.263 1.00 11.34 O ATOM 690 OD2 ASP A 45 16.067 -5.540 -16.175 1.00 41.20 O ATOM 0 H ASP A 45 14.529 -4.069 -12.454 1.00 62.13 H new ATOM 0 HA ASP A 45 17.360 -4.215 -13.063 1.00 32.42 H new ATOM 0 HB2 ASP A 45 14.846 -4.161 -14.480 1.00 24.24 H new ATOM 0 HB3 ASP A 45 15.838 -2.841 -15.066 1.00 24.24 H new ATOM 695 N ARG A 46 15.843 -1.373 -12.470 1.00 62.34 N ATOM 696 CA ARG A 46 16.059 0.047 -12.217 1.00 22.34 C ATOM 697 C ARG A 46 16.160 0.322 -10.719 1.00 0.10 C ATOM 698 O ARG A 46 16.404 1.454 -10.303 1.00 31.43 O ATOM 699 CB ARG A 46 14.925 0.874 -12.824 1.00 33.14 C ATOM 700 CG ARG A 46 14.661 0.564 -14.287 1.00 75.33 C ATOM 701 CD ARG A 46 13.514 1.399 -14.836 1.00 73.11 C ATOM 702 NE ARG A 46 13.991 2.568 -15.569 1.00 51.34 N ATOM 703 CZ ARG A 46 13.241 3.257 -16.423 1.00 1.52 C ATOM 704 NH1 ARG A 46 11.986 2.895 -16.648 1.00 52.12 N ATOM 705 NH2 ARG A 46 13.747 4.310 -17.052 1.00 74.04 N ATOM 0 H ARG A 46 14.899 -1.700 -12.264 1.00 62.34 H new ATOM 0 HA ARG A 46 16.999 0.336 -12.686 1.00 22.34 H new ATOM 0 HB2 ARG A 46 14.013 0.698 -12.254 1.00 33.14 H new ATOM 0 HB3 ARG A 46 15.165 1.933 -12.723 1.00 33.14 H new ATOM 0 HG2 ARG A 46 15.563 0.755 -14.869 1.00 75.33 H new ATOM 0 HG3 ARG A 46 14.428 -0.495 -14.399 1.00 75.33 H new ATOM 0 HD2 ARG A 46 12.900 0.784 -15.494 1.00 73.11 H new ATOM 0 HD3 ARG A 46 12.875 1.722 -14.014 1.00 73.11 H new ATOM 0 HE ARG A 46 14.953 2.873 -15.417 1.00 51.34 H new ATOM 0 HH11 ARG A 46 11.594 2.086 -16.165 1.00 52.12 H new ATOM 0 HH12 ARG A 46 11.412 3.425 -17.304 1.00 52.12 H new ATOM 0 HH21 ARG A 46 14.712 4.591 -16.880 1.00 74.04 H new ATOM 0 HH22 ARG A 46 13.171 4.838 -17.707 1.00 74.04 H new ATOM 719 N GLN A 47 15.970 -0.721 -9.917 1.00 45.03 N ATOM 720 CA GLN A 47 16.039 -0.590 -8.467 1.00 33.13 C ATOM 721 C GLN A 47 15.293 0.655 -7.996 1.00 42.14 C ATOM 722 O GLN A 47 15.834 1.468 -7.248 1.00 23.25 O ATOM 723 CB GLN A 47 17.496 -0.531 -8.006 1.00 71.33 C ATOM 724 CG GLN A 47 18.351 -1.666 -8.546 1.00 71.04 C ATOM 725 CD GLN A 47 18.776 -2.641 -7.466 1.00 4.51 C ATOM 726 OE1 GLN A 47 19.543 -2.293 -6.567 1.00 60.32 O ATOM 727 NE2 GLN A 47 18.280 -3.870 -7.549 1.00 63.11 N ATOM 0 H GLN A 47 15.767 -1.665 -10.247 1.00 45.03 H new ATOM 0 HA GLN A 47 15.562 -1.466 -8.026 1.00 33.13 H new ATOM 0 HB2 GLN A 47 17.929 0.419 -8.318 1.00 71.33 H new ATOM 0 HB3 GLN A 47 17.525 -0.552 -6.917 1.00 71.33 H new ATOM 0 HG2 GLN A 47 17.794 -2.201 -9.315 1.00 71.04 H new ATOM 0 HG3 GLN A 47 19.238 -1.251 -9.025 1.00 71.04 H new ATOM 0 HE21 GLN A 47 17.648 -4.114 -8.311 1.00 63.11 H new ATOM 0 HE22 GLN A 47 18.531 -4.570 -6.851 1.00 63.11 H new ATOM 736 N MET A 48 14.050 0.797 -8.442 1.00 14.23 N ATOM 737 CA MET A 48 13.230 1.943 -8.065 1.00 55.20 C ATOM 738 C MET A 48 11.754 1.563 -8.011 1.00 22.41 C ATOM 739 O MET A 48 11.258 0.834 -8.871 1.00 22.13 O ATOM 740 CB MET A 48 13.436 3.092 -9.055 1.00 61.42 C ATOM 741 CG MET A 48 12.480 3.055 -10.236 1.00 65.03 C ATOM 742 SD MET A 48 13.196 3.765 -11.731 1.00 2.20 S ATOM 743 CE MET A 48 13.349 5.483 -11.250 1.00 33.34 C ATOM 0 H MET A 48 13.588 0.134 -9.064 1.00 14.23 H new ATOM 0 HA MET A 48 13.540 2.267 -7.072 1.00 55.20 H new ATOM 0 HB2 MET A 48 13.315 4.039 -8.530 1.00 61.42 H new ATOM 0 HB3 MET A 48 14.460 3.062 -9.426 1.00 61.42 H new ATOM 0 HG2 MET A 48 12.190 2.023 -10.432 1.00 65.03 H new ATOM 0 HG3 MET A 48 11.571 3.599 -9.980 1.00 65.03 H new ATOM 0 HE1 MET A 48 13.012 6.121 -12.067 1.00 33.34 H new ATOM 0 HE2 MET A 48 12.737 5.670 -10.367 1.00 33.34 H new ATOM 0 HE3 MET A 48 14.391 5.706 -11.022 1.00 33.34 H new ATOM 753 N VAL A 49 11.056 2.059 -6.995 1.00 14.24 N ATOM 754 CA VAL A 49 9.636 1.771 -6.829 1.00 25.23 C ATOM 755 C VAL A 49 8.795 2.556 -7.830 1.00 4.40 C ATOM 756 O VAL A 49 8.609 3.764 -7.687 1.00 2.24 O ATOM 757 CB VAL A 49 9.159 2.102 -5.402 1.00 42.43 C ATOM 758 CG1 VAL A 49 7.642 2.211 -5.359 1.00 22.12 C ATOM 759 CG2 VAL A 49 9.655 1.055 -4.418 1.00 3.04 C ATOM 0 H VAL A 49 11.451 2.663 -6.274 1.00 14.24 H new ATOM 0 HA VAL A 49 9.506 0.704 -7.009 1.00 25.23 H new ATOM 0 HB VAL A 49 9.577 3.066 -5.112 1.00 42.43 H new ATOM 0 HG11 VAL A 49 7.323 2.445 -4.343 1.00 22.12 H new ATOM 0 HG12 VAL A 49 7.315 3.002 -6.034 1.00 22.12 H new ATOM 0 HG13 VAL A 49 7.200 1.264 -5.669 1.00 22.12 H new ATOM 0 HG21 VAL A 49 9.309 1.305 -3.415 1.00 3.04 H new ATOM 0 HG22 VAL A 49 9.268 0.076 -4.702 1.00 3.04 H new ATOM 0 HG23 VAL A 49 10.745 1.032 -4.430 1.00 3.04 H new ATOM 769 N VAL A 50 8.290 1.861 -8.843 1.00 62.10 N ATOM 770 CA VAL A 50 7.467 2.492 -9.868 1.00 1.41 C ATOM 771 C VAL A 50 6.047 1.939 -9.850 1.00 73.24 C ATOM 772 O VAL A 50 5.835 0.751 -9.607 1.00 32.11 O ATOM 773 CB VAL A 50 8.068 2.291 -11.272 1.00 52.25 C ATOM 774 CG1 VAL A 50 9.438 2.944 -11.367 1.00 31.35 C ATOM 775 CG2 VAL A 50 8.149 0.810 -11.609 1.00 63.34 C ATOM 0 H VAL A 50 8.436 0.860 -8.976 1.00 62.10 H new ATOM 0 HA VAL A 50 7.441 3.558 -9.642 1.00 1.41 H new ATOM 0 HB VAL A 50 7.414 2.771 -12.000 1.00 52.25 H new ATOM 0 HG11 VAL A 50 9.846 2.791 -12.366 1.00 31.35 H new ATOM 0 HG12 VAL A 50 9.346 4.013 -11.173 1.00 31.35 H new ATOM 0 HG13 VAL A 50 10.106 2.497 -10.630 1.00 31.35 H new ATOM 0 HG21 VAL A 50 8.576 0.686 -12.604 1.00 63.34 H new ATOM 0 HG22 VAL A 50 8.780 0.305 -10.878 1.00 63.34 H new ATOM 0 HG23 VAL A 50 7.149 0.377 -11.587 1.00 63.34 H new ATOM 785 N LEU A 51 5.077 2.808 -10.111 1.00 11.00 N ATOM 786 CA LEU A 51 3.674 2.407 -10.125 1.00 3.11 C ATOM 787 C LEU A 51 3.478 1.142 -10.955 1.00 42.23 C ATOM 788 O LEU A 51 4.264 0.852 -11.856 1.00 50.43 O ATOM 789 CB LEU A 51 2.806 3.537 -10.683 1.00 63.10 C ATOM 790 CG LEU A 51 1.294 3.306 -10.640 1.00 4.14 C ATOM 791 CD1 LEU A 51 0.759 3.540 -9.235 1.00 62.11 C ATOM 792 CD2 LEU A 51 0.588 4.210 -11.639 1.00 44.13 C ATOM 0 H LEU A 51 5.236 3.795 -10.316 1.00 11.00 H new ATOM 0 HA LEU A 51 3.371 2.197 -9.099 1.00 3.11 H new ATOM 0 HB2 LEU A 51 3.030 4.448 -10.128 1.00 63.10 H new ATOM 0 HB3 LEU A 51 3.097 3.714 -11.718 1.00 63.10 H new ATOM 0 HG LEU A 51 1.095 2.270 -10.915 1.00 4.14 H new ATOM 0 HD11 LEU A 51 -0.318 3.371 -9.223 1.00 62.11 H new ATOM 0 HD12 LEU A 51 1.242 2.851 -8.542 1.00 62.11 H new ATOM 0 HD13 LEU A 51 0.969 4.566 -8.932 1.00 62.11 H new ATOM 0 HD21 LEU A 51 -0.486 4.032 -11.595 1.00 44.13 H new ATOM 0 HD22 LEU A 51 0.794 5.252 -11.395 1.00 44.13 H new ATOM 0 HD23 LEU A 51 0.950 3.994 -12.644 1.00 44.13 H new ATOM 804 N GLU A 52 2.423 0.396 -10.646 1.00 71.41 N ATOM 805 CA GLU A 52 2.123 -0.837 -11.365 1.00 22.11 C ATOM 806 C GLU A 52 0.672 -0.853 -11.837 1.00 32.21 C ATOM 807 O GLU A 52 0.367 -1.344 -12.924 1.00 33.33 O ATOM 808 CB GLU A 52 2.395 -2.052 -10.475 1.00 62.25 C ATOM 809 CG GLU A 52 2.027 -3.376 -11.123 1.00 52.23 C ATOM 810 CD GLU A 52 2.641 -4.565 -10.409 1.00 55.24 C ATOM 811 OE1 GLU A 52 2.267 -4.815 -9.244 1.00 63.05 O ATOM 812 OE2 GLU A 52 3.493 -5.246 -11.018 1.00 21.11 O ATOM 0 H GLU A 52 1.762 0.623 -9.903 1.00 71.41 H new ATOM 0 HA GLU A 52 2.772 -0.884 -12.240 1.00 22.11 H new ATOM 0 HB2 GLU A 52 3.452 -2.068 -10.210 1.00 62.25 H new ATOM 0 HB3 GLU A 52 1.835 -1.944 -9.546 1.00 62.25 H new ATOM 0 HG2 GLU A 52 0.942 -3.483 -11.132 1.00 52.23 H new ATOM 0 HG3 GLU A 52 2.356 -3.371 -12.162 1.00 52.23 H new ATOM 819 N ASP A 53 -0.218 -0.313 -11.011 1.00 62.34 N ATOM 820 CA ASP A 53 -1.637 -0.264 -11.343 1.00 60.22 C ATOM 821 C ASP A 53 -2.364 0.755 -10.472 1.00 2.21 C ATOM 822 O ASP A 53 -1.859 1.165 -9.428 1.00 4.01 O ATOM 823 CB ASP A 53 -2.271 -1.645 -11.172 1.00 32.15 C ATOM 824 CG ASP A 53 -2.138 -2.502 -12.415 1.00 23.31 C ATOM 825 OD1 ASP A 53 -2.769 -2.166 -13.438 1.00 1.23 O ATOM 826 OD2 ASP A 53 -1.402 -3.511 -12.364 1.00 1.01 O ATOM 0 H ASP A 53 0.018 0.097 -10.107 1.00 62.34 H new ATOM 0 HA ASP A 53 -1.731 0.043 -12.385 1.00 60.22 H new ATOM 0 HB2 ASP A 53 -1.802 -2.155 -10.331 1.00 32.15 H new ATOM 0 HB3 ASP A 53 -3.326 -1.529 -10.926 1.00 32.15 H new ATOM 831 N GLU A 54 -3.553 1.160 -10.910 1.00 4.14 N ATOM 832 CA GLU A 54 -4.348 2.133 -10.169 1.00 63.32 C ATOM 833 C GLU A 54 -5.839 1.901 -10.394 1.00 3.43 C ATOM 834 O GLU A 54 -6.371 2.203 -11.463 1.00 53.11 O ATOM 835 CB GLU A 54 -3.972 3.556 -10.588 1.00 13.01 C ATOM 836 CG GLU A 54 -3.020 4.244 -9.624 1.00 34.44 C ATOM 837 CD GLU A 54 -2.964 5.745 -9.832 1.00 2.24 C ATOM 838 OE1 GLU A 54 -2.223 6.190 -10.734 1.00 25.33 O ATOM 839 OE2 GLU A 54 -3.658 6.474 -9.093 1.00 74.44 O ATOM 0 H GLU A 54 -3.986 0.830 -11.773 1.00 4.14 H new ATOM 0 HA GLU A 54 -4.135 2.006 -9.108 1.00 63.32 H new ATOM 0 HB2 GLU A 54 -3.515 3.525 -11.577 1.00 13.01 H new ATOM 0 HB3 GLU A 54 -4.881 4.152 -10.675 1.00 13.01 H new ATOM 0 HG2 GLU A 54 -3.331 4.034 -8.600 1.00 34.44 H new ATOM 0 HG3 GLU A 54 -2.021 3.826 -9.746 1.00 34.44 H new ATOM 846 N LEU A 55 -6.507 1.363 -9.380 1.00 50.12 N ATOM 847 CA LEU A 55 -7.938 1.089 -9.465 1.00 42.54 C ATOM 848 C LEU A 55 -8.737 2.116 -8.670 1.00 64.53 C ATOM 849 O LEU A 55 -8.339 2.512 -7.575 1.00 14.13 O ATOM 850 CB LEU A 55 -8.239 -0.319 -8.951 1.00 43.11 C ATOM 851 CG LEU A 55 -7.327 -1.432 -9.467 1.00 61.51 C ATOM 852 CD1 LEU A 55 -7.294 -2.594 -8.486 1.00 3.04 C ATOM 853 CD2 LEU A 55 -7.786 -1.905 -10.839 1.00 62.14 C ATOM 0 H LEU A 55 -6.081 1.108 -8.489 1.00 50.12 H new ATOM 0 HA LEU A 55 -8.235 1.157 -10.512 1.00 42.54 H new ATOM 0 HB2 LEU A 55 -8.183 -0.306 -7.863 1.00 43.11 H new ATOM 0 HB3 LEU A 55 -9.267 -0.568 -9.214 1.00 43.11 H new ATOM 0 HG LEU A 55 -6.317 -1.033 -9.560 1.00 61.51 H new ATOM 0 HD11 LEU A 55 -6.640 -3.376 -8.871 1.00 3.04 H new ATOM 0 HD12 LEU A 55 -6.918 -2.247 -7.524 1.00 3.04 H new ATOM 0 HD13 LEU A 55 -8.301 -2.992 -8.360 1.00 3.04 H new ATOM 0 HD21 LEU A 55 -7.125 -2.697 -11.191 1.00 62.14 H new ATOM 0 HD22 LEU A 55 -8.805 -2.286 -10.770 1.00 62.14 H new ATOM 0 HD23 LEU A 55 -7.757 -1.071 -11.540 1.00 62.14 H new ATOM 865 N GLN A 56 -9.866 2.540 -9.228 1.00 3.22 N ATOM 866 CA GLN A 56 -10.722 3.521 -8.569 1.00 31.54 C ATOM 867 C GLN A 56 -12.102 2.935 -8.287 1.00 11.12 C ATOM 868 O GLN A 56 -12.553 2.024 -8.979 1.00 34.33 O ATOM 869 CB GLN A 56 -10.854 4.776 -9.433 1.00 34.33 C ATOM 870 CG GLN A 56 -9.542 5.516 -9.635 1.00 54.41 C ATOM 871 CD GLN A 56 -8.670 4.878 -10.698 1.00 60.53 C ATOM 872 OE1 GLN A 56 -9.014 4.877 -11.880 1.00 64.41 O ATOM 873 NE2 GLN A 56 -7.534 4.331 -10.282 1.00 11.04 N ATOM 0 H GLN A 56 -10.210 2.221 -10.134 1.00 3.22 H new ATOM 0 HA GLN A 56 -10.260 3.790 -7.619 1.00 31.54 H new ATOM 0 HB2 GLN A 56 -11.257 4.496 -10.406 1.00 34.33 H new ATOM 0 HB3 GLN A 56 -11.575 5.451 -8.971 1.00 34.33 H new ATOM 0 HG2 GLN A 56 -9.751 6.549 -9.914 1.00 54.41 H new ATOM 0 HG3 GLN A 56 -8.996 5.544 -8.692 1.00 54.41 H new ATOM 0 HE21 GLN A 56 -7.289 4.355 -9.292 1.00 11.04 H new ATOM 0 HE22 GLN A 56 -6.906 3.887 -10.952 1.00 11.04 H new ATOM 882 N ASN A 57 -12.766 3.464 -7.264 1.00 40.43 N ATOM 883 CA ASN A 57 -14.094 2.994 -6.890 1.00 74.13 C ATOM 884 C ASN A 57 -14.094 1.484 -6.667 1.00 4.54 C ATOM 885 O ASN A 57 -14.884 0.758 -7.271 1.00 34.44 O ATOM 886 CB ASN A 57 -15.112 3.361 -7.972 1.00 23.30 C ATOM 887 CG ASN A 57 -15.131 4.848 -8.268 1.00 61.21 C ATOM 888 OD1 ASN A 57 -16.044 5.563 -7.857 1.00 41.04 O ATOM 889 ND2 ASN A 57 -14.117 5.320 -8.986 1.00 54.40 N ATOM 0 H ASN A 57 -12.406 4.218 -6.680 1.00 40.43 H new ATOM 0 HA ASN A 57 -14.375 3.482 -5.956 1.00 74.13 H new ATOM 0 HB2 ASN A 57 -14.880 2.814 -8.886 1.00 23.30 H new ATOM 0 HB3 ASN A 57 -16.105 3.044 -7.655 1.00 23.30 H new ATOM 0 HD21 ASN A 57 -14.074 6.313 -9.217 1.00 54.40 H new ATOM 0 HD22 ASN A 57 -13.382 4.690 -9.306 1.00 54.40 H new ATOM 896 N ILE A 58 -13.203 1.021 -5.797 1.00 10.31 N ATOM 897 CA ILE A 58 -13.101 -0.401 -5.493 1.00 73.01 C ATOM 898 C ILE A 58 -13.126 -0.645 -3.988 1.00 54.35 C ATOM 899 O ILE A 58 -12.515 0.096 -3.218 1.00 61.13 O ATOM 900 CB ILE A 58 -11.813 -1.011 -6.079 1.00 55.51 C ATOM 901 CG1 ILE A 58 -11.157 -1.944 -5.060 1.00 61.43 C ATOM 902 CG2 ILE A 58 -10.849 0.089 -6.498 1.00 34.55 C ATOM 903 CD1 ILE A 58 -10.404 -1.215 -3.970 1.00 41.32 C ATOM 0 H ILE A 58 -12.542 1.609 -5.290 1.00 10.31 H new ATOM 0 HA ILE A 58 -13.964 -0.884 -5.951 1.00 73.01 H new ATOM 0 HB ILE A 58 -12.073 -1.594 -6.963 1.00 55.51 H new ATOM 0 HG12 ILE A 58 -11.925 -2.569 -4.604 1.00 61.43 H new ATOM 0 HG13 ILE A 58 -10.470 -2.612 -5.580 1.00 61.43 H new ATOM 0 HG21 ILE A 58 -9.944 -0.358 -6.910 1.00 34.55 H new ATOM 0 HG22 ILE A 58 -11.320 0.717 -7.254 1.00 34.55 H new ATOM 0 HG23 ILE A 58 -10.591 0.697 -5.631 1.00 34.55 H new ATOM 0 HD11 ILE A 58 -9.965 -1.939 -3.284 1.00 41.32 H new ATOM 0 HD12 ILE A 58 -9.613 -0.612 -4.415 1.00 41.32 H new ATOM 0 HD13 ILE A 58 -11.090 -0.568 -3.424 1.00 41.32 H new ATOM 915 N SER A 59 -13.838 -1.690 -3.576 1.00 12.35 N ATOM 916 CA SER A 59 -13.945 -2.030 -2.162 1.00 73.13 C ATOM 917 C SER A 59 -12.724 -2.821 -1.700 1.00 12.33 C ATOM 918 O SER A 59 -11.903 -3.268 -2.501 1.00 30.22 O ATOM 919 CB SER A 59 -15.218 -2.841 -1.907 1.00 2.24 C ATOM 920 OG SER A 59 -16.178 -2.073 -1.202 1.00 11.14 O ATOM 0 H SER A 59 -14.348 -2.315 -4.200 1.00 12.35 H new ATOM 0 HA SER A 59 -13.992 -1.102 -1.592 1.00 73.13 H new ATOM 0 HB2 SER A 59 -15.638 -3.172 -2.857 1.00 2.24 H new ATOM 0 HB3 SER A 59 -14.974 -3.737 -1.336 1.00 2.24 H new ATOM 0 HG SER A 59 -16.983 -2.612 -1.053 1.00 11.14 H new ATOM 926 N PRO A 60 -12.600 -2.995 -0.375 1.00 74.33 N ATOM 927 CA PRO A 60 -11.484 -3.731 0.224 1.00 32.55 C ATOM 928 C PRO A 60 -11.553 -5.227 -0.066 1.00 14.04 C ATOM 929 O PRO A 60 -10.705 -5.995 0.387 1.00 64.11 O ATOM 930 CB PRO A 60 -11.651 -3.470 1.724 1.00 52.12 C ATOM 931 CG PRO A 60 -13.102 -3.181 1.898 1.00 31.24 C ATOM 932 CD PRO A 60 -13.542 -2.488 0.637 1.00 22.41 C ATOM 0 HA PRO A 60 -10.523 -3.408 -0.175 1.00 32.55 H new ATOM 0 HB2 PRO A 60 -11.346 -4.335 2.313 1.00 52.12 H new ATOM 0 HB3 PRO A 60 -11.038 -2.630 2.051 1.00 52.12 H new ATOM 0 HG2 PRO A 60 -13.667 -4.100 2.055 1.00 31.24 H new ATOM 0 HG3 PRO A 60 -13.272 -2.549 2.770 1.00 31.24 H new ATOM 0 HD2 PRO A 60 -14.574 -2.731 0.384 1.00 22.41 H new ATOM 0 HD3 PRO A 60 -13.484 -1.404 0.733 1.00 22.41 H new ATOM 940 N GLU A 61 -12.567 -5.632 -0.823 1.00 34.11 N ATOM 941 CA GLU A 61 -12.747 -7.037 -1.172 1.00 44.11 C ATOM 942 C GLU A 61 -12.243 -7.313 -2.586 1.00 64.20 C ATOM 943 O GLU A 61 -11.843 -8.433 -2.905 1.00 13.20 O ATOM 944 CB GLU A 61 -14.220 -7.431 -1.058 1.00 13.22 C ATOM 945 CG GLU A 61 -14.571 -8.100 0.261 1.00 0.12 C ATOM 946 CD GLU A 61 -16.021 -7.895 0.652 1.00 40.01 C ATOM 947 OE1 GLU A 61 -16.909 -8.354 -0.096 1.00 62.44 O ATOM 948 OE2 GLU A 61 -16.269 -7.273 1.707 1.00 23.41 O ATOM 0 H GLU A 61 -13.277 -5.008 -1.207 1.00 34.11 H new ATOM 0 HA GLU A 61 -12.165 -7.636 -0.472 1.00 44.11 H new ATOM 0 HB2 GLU A 61 -14.836 -6.540 -1.179 1.00 13.22 H new ATOM 0 HB3 GLU A 61 -14.471 -8.106 -1.876 1.00 13.22 H new ATOM 0 HG2 GLU A 61 -14.366 -9.168 0.188 1.00 0.12 H new ATOM 0 HG3 GLU A 61 -13.927 -7.705 1.047 1.00 0.12 H new ATOM 955 N GLU A 62 -12.267 -6.285 -3.429 1.00 21.14 N ATOM 956 CA GLU A 62 -11.814 -6.418 -4.808 1.00 32.40 C ATOM 957 C GLU A 62 -10.298 -6.279 -4.899 1.00 64.02 C ATOM 958 O GLU A 62 -9.637 -7.018 -5.632 1.00 13.10 O ATOM 959 CB GLU A 62 -12.488 -5.367 -5.693 1.00 74.02 C ATOM 960 CG GLU A 62 -13.456 -5.955 -6.706 1.00 15.45 C ATOM 961 CD GLU A 62 -12.920 -5.906 -8.123 1.00 23.21 C ATOM 962 OE1 GLU A 62 -12.342 -4.868 -8.504 1.00 52.25 O ATOM 963 OE2 GLU A 62 -13.077 -6.909 -8.850 1.00 64.35 O ATOM 0 H GLU A 62 -12.595 -5.352 -3.181 1.00 21.14 H new ATOM 0 HA GLU A 62 -12.092 -7.411 -5.160 1.00 32.40 H new ATOM 0 HB2 GLU A 62 -13.023 -4.660 -5.059 1.00 74.02 H new ATOM 0 HB3 GLU A 62 -11.720 -4.803 -6.222 1.00 74.02 H new ATOM 0 HG2 GLU A 62 -13.671 -6.990 -6.439 1.00 15.45 H new ATOM 0 HG3 GLU A 62 -14.399 -5.411 -6.660 1.00 15.45 H new ATOM 970 N LEU A 63 -9.751 -5.328 -4.151 1.00 44.31 N ATOM 971 CA LEU A 63 -8.311 -5.090 -4.147 1.00 32.12 C ATOM 972 C LEU A 63 -7.547 -6.380 -3.865 1.00 21.22 C ATOM 973 O LEU A 63 -6.621 -6.738 -4.593 1.00 4.11 O ATOM 974 CB LEU A 63 -7.953 -4.033 -3.101 1.00 23.21 C ATOM 975 CG LEU A 63 -6.935 -2.978 -3.535 1.00 61.43 C ATOM 976 CD1 LEU A 63 -6.145 -2.473 -2.338 1.00 21.12 C ATOM 977 CD2 LEU A 63 -5.999 -3.544 -4.593 1.00 63.13 C ATOM 0 H LEU A 63 -10.282 -4.709 -3.539 1.00 44.31 H new ATOM 0 HA LEU A 63 -8.024 -4.728 -5.134 1.00 32.12 H new ATOM 0 HB2 LEU A 63 -8.868 -3.524 -2.800 1.00 23.21 H new ATOM 0 HB3 LEU A 63 -7.566 -4.541 -2.218 1.00 23.21 H new ATOM 0 HG LEU A 63 -7.476 -2.137 -3.968 1.00 61.43 H new ATOM 0 HD11 LEU A 63 -5.426 -1.723 -2.667 1.00 21.12 H new ATOM 0 HD12 LEU A 63 -6.827 -2.028 -1.613 1.00 21.12 H new ATOM 0 HD13 LEU A 63 -5.615 -3.305 -1.874 1.00 21.12 H new ATOM 0 HD21 LEU A 63 -5.281 -2.780 -4.890 1.00 63.13 H new ATOM 0 HD22 LEU A 63 -5.466 -4.403 -4.185 1.00 63.13 H new ATOM 0 HD23 LEU A 63 -6.578 -3.855 -5.462 1.00 63.13 H new ATOM 989 N LYS A 64 -7.943 -7.078 -2.805 1.00 1.40 N ATOM 990 CA LYS A 64 -7.299 -8.330 -2.428 1.00 54.40 C ATOM 991 C LYS A 64 -7.277 -9.304 -3.602 1.00 24.43 C ATOM 992 O LYS A 64 -6.325 -10.069 -3.769 1.00 42.32 O ATOM 993 CB LYS A 64 -8.025 -8.963 -1.239 1.00 73.23 C ATOM 994 CG LYS A 64 -8.373 -10.426 -1.449 1.00 61.42 C ATOM 995 CD LYS A 64 -8.670 -11.123 -0.131 1.00 22.31 C ATOM 996 CE LYS A 64 -10.072 -11.712 -0.115 1.00 32.23 C ATOM 997 NZ LYS A 64 -10.679 -11.663 1.244 1.00 62.21 N ATOM 0 H LYS A 64 -8.708 -6.797 -2.192 1.00 1.40 H new ATOM 0 HA LYS A 64 -6.271 -8.110 -2.142 1.00 54.40 H new ATOM 0 HB2 LYS A 64 -7.400 -8.871 -0.351 1.00 73.23 H new ATOM 0 HB3 LYS A 64 -8.941 -8.405 -1.044 1.00 73.23 H new ATOM 0 HG2 LYS A 64 -9.239 -10.504 -2.106 1.00 61.42 H new ATOM 0 HG3 LYS A 64 -7.546 -10.929 -1.950 1.00 61.42 H new ATOM 0 HD2 LYS A 64 -7.940 -11.915 0.036 1.00 22.31 H new ATOM 0 HD3 LYS A 64 -8.563 -10.413 0.689 1.00 22.31 H new ATOM 0 HE2 LYS A 64 -10.704 -11.165 -0.815 1.00 32.23 H new ATOM 0 HE3 LYS A 64 -10.036 -12.746 -0.459 1.00 32.23 H new ATOM 0 HZ1 LYS A 64 -11.640 -12.058 1.209 1.00 62.21 H new ATOM 0 HZ2 LYS A 64 -10.099 -12.220 1.903 1.00 62.21 H new ATOM 0 HZ3 LYS A 64 -10.722 -10.676 1.570 1.00 62.21 H new ATOM 1011 N LEU A 65 -8.328 -9.272 -4.412 1.00 12.41 N ATOM 1012 CA LEU A 65 -8.428 -10.152 -5.571 1.00 12.22 C ATOM 1013 C LEU A 65 -7.437 -9.740 -6.654 1.00 23.31 C ATOM 1014 O LEU A 65 -6.885 -10.587 -7.357 1.00 5.53 O ATOM 1015 CB LEU A 65 -9.852 -10.129 -6.132 1.00 64.04 C ATOM 1016 CG LEU A 65 -10.847 -11.087 -5.476 1.00 72.45 C ATOM 1017 CD1 LEU A 65 -10.608 -11.160 -3.977 1.00 55.40 C ATOM 1018 CD2 LEU A 65 -12.276 -10.656 -5.772 1.00 15.31 C ATOM 0 H LEU A 65 -9.124 -8.646 -4.288 1.00 12.41 H new ATOM 0 HA LEU A 65 -8.187 -11.165 -5.249 1.00 12.22 H new ATOM 0 HB2 LEU A 65 -10.241 -9.115 -6.041 1.00 64.04 H new ATOM 0 HB3 LEU A 65 -9.805 -10.358 -7.197 1.00 64.04 H new ATOM 0 HG LEU A 65 -10.696 -12.082 -5.895 1.00 72.45 H new ATOM 0 HD11 LEU A 65 -11.325 -11.846 -3.527 1.00 55.40 H new ATOM 0 HD12 LEU A 65 -9.596 -11.517 -3.787 1.00 55.40 H new ATOM 0 HD13 LEU A 65 -10.731 -10.169 -3.540 1.00 55.40 H new ATOM 0 HD21 LEU A 65 -12.971 -11.349 -5.297 1.00 15.31 H new ATOM 0 HD22 LEU A 65 -12.441 -9.652 -5.381 1.00 15.31 H new ATOM 0 HD23 LEU A 65 -12.441 -10.658 -6.849 1.00 15.31 H new ATOM 1030 N GLU A 66 -7.213 -8.436 -6.781 1.00 51.40 N ATOM 1031 CA GLU A 66 -6.286 -7.914 -7.777 1.00 71.03 C ATOM 1032 C GLU A 66 -4.849 -8.299 -7.438 1.00 43.32 C ATOM 1033 O GLU A 66 -4.023 -8.509 -8.329 1.00 32.44 O ATOM 1034 CB GLU A 66 -6.409 -6.392 -7.872 1.00 45.30 C ATOM 1035 CG GLU A 66 -7.831 -5.908 -8.097 1.00 20.13 C ATOM 1036 CD GLU A 66 -8.268 -6.033 -9.542 1.00 53.14 C ATOM 1037 OE1 GLU A 66 -8.513 -7.172 -9.993 1.00 45.52 O ATOM 1038 OE2 GLU A 66 -8.367 -4.991 -10.224 1.00 43.13 O ATOM 0 H GLU A 66 -7.661 -7.722 -6.206 1.00 51.40 H new ATOM 0 HA GLU A 66 -6.543 -8.353 -8.741 1.00 71.03 H new ATOM 0 HB2 GLU A 66 -6.024 -5.947 -6.954 1.00 45.30 H new ATOM 0 HB3 GLU A 66 -5.780 -6.036 -8.688 1.00 45.30 H new ATOM 0 HG2 GLU A 66 -8.510 -6.481 -7.465 1.00 20.13 H new ATOM 0 HG3 GLU A 66 -7.909 -4.866 -7.787 1.00 20.13 H new ATOM 1045 N LEU A 67 -4.556 -8.389 -6.146 1.00 13.44 N ATOM 1046 CA LEU A 67 -3.219 -8.748 -5.687 1.00 21.24 C ATOM 1047 C LEU A 67 -2.907 -10.206 -6.008 1.00 25.42 C ATOM 1048 O LEU A 67 -3.797 -11.052 -6.097 1.00 41.00 O ATOM 1049 CB LEU A 67 -3.092 -8.507 -4.181 1.00 74.25 C ATOM 1050 CG LEU A 67 -3.333 -7.073 -3.709 1.00 5.02 C ATOM 1051 CD1 LEU A 67 -3.339 -7.006 -2.190 1.00 2.32 C ATOM 1052 CD2 LEU A 67 -2.278 -6.138 -4.282 1.00 24.20 C ATOM 0 H LEU A 67 -5.227 -8.218 -5.397 1.00 13.44 H new ATOM 0 HA LEU A 67 -2.501 -8.117 -6.211 1.00 21.24 H new ATOM 0 HB2 LEU A 67 -3.797 -9.161 -3.668 1.00 74.25 H new ATOM 0 HB3 LEU A 67 -2.092 -8.808 -3.868 1.00 74.25 H new ATOM 0 HG LEU A 67 -4.309 -6.751 -4.071 1.00 5.02 H new ATOM 0 HD11 LEU A 67 -3.512 -5.978 -1.872 1.00 2.32 H new ATOM 0 HD12 LEU A 67 -4.132 -7.644 -1.801 1.00 2.32 H new ATOM 0 HD13 LEU A 67 -2.377 -7.348 -1.807 1.00 2.32 H new ATOM 0 HD21 LEU A 67 -2.466 -5.122 -3.935 1.00 24.20 H new ATOM 0 HD22 LEU A 67 -1.290 -6.458 -3.951 1.00 24.20 H new ATOM 0 HD23 LEU A 67 -2.322 -6.164 -5.371 1.00 24.20 H new ATOM 1064 N PRO A 68 -1.612 -10.510 -6.183 1.00 51.14 N ATOM 1065 CA PRO A 68 -1.152 -11.867 -6.495 1.00 70.30 C ATOM 1066 C PRO A 68 -1.316 -12.819 -5.315 1.00 70.52 C ATOM 1067 O PRO A 68 -2.033 -12.521 -4.360 1.00 43.12 O ATOM 1068 CB PRO A 68 0.330 -11.673 -6.823 1.00 11.44 C ATOM 1069 CG PRO A 68 0.720 -10.434 -6.093 1.00 4.51 C ATOM 1070 CD PRO A 68 -0.497 -9.553 -6.093 1.00 11.34 C ATOM 0 HA PRO A 68 -1.726 -12.316 -7.305 1.00 70.30 H new ATOM 0 HB2 PRO A 68 0.923 -12.528 -6.497 1.00 11.44 H new ATOM 0 HB3 PRO A 68 0.487 -11.566 -7.896 1.00 11.44 H new ATOM 0 HG2 PRO A 68 1.035 -10.664 -5.075 1.00 4.51 H new ATOM 0 HG3 PRO A 68 1.559 -9.940 -6.583 1.00 4.51 H new ATOM 0 HD2 PRO A 68 -0.557 -8.951 -5.187 1.00 11.34 H new ATOM 0 HD3 PRO A 68 -0.492 -8.861 -6.935 1.00 11.34 H new ATOM 1078 N GLU A 69 -0.647 -13.965 -5.387 1.00 44.44 N ATOM 1079 CA GLU A 69 -0.719 -14.960 -4.324 1.00 73.34 C ATOM 1080 C GLU A 69 0.645 -15.157 -3.669 1.00 31.31 C ATOM 1081 O GLU A 69 0.737 -15.607 -2.527 1.00 13.23 O ATOM 1082 CB GLU A 69 -1.229 -16.294 -4.878 1.00 5.42 C ATOM 1083 CG GLU A 69 -0.440 -16.796 -6.076 1.00 32.35 C ATOM 1084 CD GLU A 69 0.337 -18.063 -5.771 1.00 71.25 C ATOM 1085 OE1 GLU A 69 0.531 -18.368 -4.577 1.00 11.11 O ATOM 1086 OE2 GLU A 69 0.749 -18.748 -6.730 1.00 64.55 O ATOM 0 H GLU A 69 -0.049 -14.227 -6.170 1.00 44.44 H new ATOM 0 HA GLU A 69 -1.416 -14.598 -3.568 1.00 73.34 H new ATOM 0 HB2 GLU A 69 -1.191 -17.044 -4.088 1.00 5.42 H new ATOM 0 HB3 GLU A 69 -2.275 -16.184 -5.163 1.00 5.42 H new ATOM 0 HG2 GLU A 69 -1.123 -16.983 -6.904 1.00 32.35 H new ATOM 0 HG3 GLU A 69 0.252 -16.019 -6.403 1.00 32.35 H new ATOM 1093 N ARG A 70 1.701 -14.818 -4.401 1.00 0.44 N ATOM 1094 CA ARG A 70 3.059 -14.959 -3.893 1.00 4.24 C ATOM 1095 C ARG A 70 3.986 -13.921 -4.521 1.00 21.53 C ATOM 1096 O ARG A 70 5.058 -14.256 -5.022 1.00 3.34 O ATOM 1097 CB ARG A 70 3.589 -16.367 -4.173 1.00 50.02 C ATOM 1098 CG ARG A 70 3.241 -16.882 -5.560 1.00 70.30 C ATOM 1099 CD ARG A 70 4.275 -16.454 -6.590 1.00 13.03 C ATOM 1100 NE ARG A 70 4.415 -17.432 -7.665 1.00 73.22 N ATOM 1101 CZ ARG A 70 5.453 -17.473 -8.491 1.00 64.02 C ATOM 1102 NH1 ARG A 70 6.439 -16.594 -8.366 1.00 24.42 N ATOM 1103 NH2 ARG A 70 5.508 -18.393 -9.445 1.00 25.53 N ATOM 0 H ARG A 70 1.642 -14.444 -5.348 1.00 0.44 H new ATOM 0 HA ARG A 70 3.035 -14.795 -2.816 1.00 4.24 H new ATOM 0 HB2 ARG A 70 4.673 -16.369 -4.055 1.00 50.02 H new ATOM 0 HB3 ARG A 70 3.186 -17.053 -3.428 1.00 50.02 H new ATOM 0 HG2 ARG A 70 3.175 -17.970 -5.539 1.00 70.30 H new ATOM 0 HG3 ARG A 70 2.259 -16.509 -5.852 1.00 70.30 H new ATOM 0 HD2 ARG A 70 3.989 -15.490 -7.012 1.00 13.03 H new ATOM 0 HD3 ARG A 70 5.238 -16.314 -6.100 1.00 13.03 H new ATOM 0 HE ARG A 70 3.674 -18.122 -7.788 1.00 73.22 H new ATOM 0 HH11 ARG A 70 6.400 -15.885 -7.634 1.00 24.42 H new ATOM 0 HH12 ARG A 70 7.236 -16.627 -9.002 1.00 24.42 H new ATOM 0 HH21 ARG A 70 4.752 -19.070 -9.545 1.00 25.53 H new ATOM 0 HH22 ARG A 70 6.306 -18.423 -10.079 1.00 25.53 H new ATOM 1117 N GLN A 71 3.562 -12.661 -4.489 1.00 73.44 N ATOM 1118 CA GLN A 71 4.352 -11.576 -5.056 1.00 63.43 C ATOM 1119 C GLN A 71 4.252 -10.322 -4.196 1.00 4.33 C ATOM 1120 O GLN A 71 3.210 -9.671 -4.123 1.00 14.22 O ATOM 1121 CB GLN A 71 3.888 -11.269 -6.482 1.00 0.11 C ATOM 1122 CG GLN A 71 4.610 -12.081 -7.545 1.00 2.03 C ATOM 1123 CD GLN A 71 4.561 -11.427 -8.912 1.00 34.34 C ATOM 1124 OE1 GLN A 71 5.595 -11.177 -9.532 1.00 34.45 O ATOM 1125 NE2 GLN A 71 3.354 -11.147 -9.390 1.00 44.13 N ATOM 0 H GLN A 71 2.676 -12.368 -4.077 1.00 73.44 H new ATOM 0 HA GLN A 71 5.394 -11.895 -5.081 1.00 63.43 H new ATOM 0 HB2 GLN A 71 2.817 -11.460 -6.556 1.00 0.11 H new ATOM 0 HB3 GLN A 71 4.037 -10.208 -6.683 1.00 0.11 H new ATOM 0 HG2 GLN A 71 5.650 -12.217 -7.249 1.00 2.03 H new ATOM 0 HG3 GLN A 71 4.163 -13.073 -7.605 1.00 2.03 H new ATOM 0 HE21 GLN A 71 2.524 -11.372 -8.842 1.00 44.13 H new ATOM 0 HE22 GLN A 71 3.257 -10.707 -10.305 1.00 44.13 H new ATOM 1134 N PRO A 72 5.361 -9.973 -3.525 1.00 72.03 N ATOM 1135 CA PRO A 72 5.423 -8.793 -2.657 1.00 71.21 C ATOM 1136 C PRO A 72 5.371 -7.489 -3.445 1.00 75.52 C ATOM 1137 O PRO A 72 6.049 -7.340 -4.462 1.00 74.34 O ATOM 1138 CB PRO A 72 6.775 -8.940 -1.955 1.00 72.54 C ATOM 1139 CG PRO A 72 7.597 -9.763 -2.886 1.00 24.11 C ATOM 1140 CD PRO A 72 6.640 -10.703 -3.565 1.00 13.14 C ATOM 0 HA PRO A 72 4.575 -8.745 -1.974 1.00 71.21 H new ATOM 0 HB2 PRO A 72 7.235 -7.968 -1.774 1.00 72.54 H new ATOM 0 HB3 PRO A 72 6.667 -9.427 -0.986 1.00 72.54 H new ATOM 0 HG2 PRO A 72 8.109 -9.134 -3.614 1.00 24.11 H new ATOM 0 HG3 PRO A 72 8.366 -10.314 -2.344 1.00 24.11 H new ATOM 0 HD2 PRO A 72 6.947 -10.920 -4.588 1.00 13.14 H new ATOM 0 HD3 PRO A 72 6.575 -11.657 -3.042 1.00 13.14 H new ATOM 1148 N ARG A 73 4.563 -6.547 -2.969 1.00 74.31 N ATOM 1149 CA ARG A 73 4.422 -5.256 -3.630 1.00 62.24 C ATOM 1150 C ARG A 73 3.803 -4.227 -2.688 1.00 62.34 C ATOM 1151 O ARG A 73 3.443 -4.545 -1.555 1.00 32.33 O ATOM 1152 CB ARG A 73 3.562 -5.394 -4.888 1.00 45.21 C ATOM 1153 CG ARG A 73 2.224 -6.070 -4.639 1.00 40.53 C ATOM 1154 CD ARG A 73 1.467 -6.302 -5.938 1.00 44.32 C ATOM 1155 NE ARG A 73 2.159 -7.244 -6.813 1.00 21.42 N ATOM 1156 CZ ARG A 73 1.749 -7.543 -8.041 1.00 24.21 C ATOM 1157 NH1 ARG A 73 0.658 -6.975 -8.537 1.00 24.05 N ATOM 1158 NH2 ARG A 73 2.433 -8.410 -8.777 1.00 71.53 N ATOM 0 H ARG A 73 3.996 -6.654 -2.128 1.00 74.31 H new ATOM 0 HA ARG A 73 5.416 -4.911 -3.914 1.00 62.24 H new ATOM 0 HB2 ARG A 73 3.387 -4.404 -5.309 1.00 45.21 H new ATOM 0 HB3 ARG A 73 4.114 -5.964 -5.635 1.00 45.21 H new ATOM 0 HG2 ARG A 73 2.385 -7.023 -4.135 1.00 40.53 H new ATOM 0 HG3 ARG A 73 1.622 -5.454 -3.971 1.00 40.53 H new ATOM 0 HD2 ARG A 73 0.470 -6.681 -5.714 1.00 44.32 H new ATOM 0 HD3 ARG A 73 1.338 -5.352 -6.457 1.00 44.32 H new ATOM 0 HE ARG A 73 3.003 -7.697 -6.463 1.00 21.42 H new ATOM 0 HH11 ARG A 73 0.131 -6.306 -7.975 1.00 24.05 H new ATOM 0 HH12 ARG A 73 0.346 -7.207 -9.480 1.00 24.05 H new ATOM 0 HH21 ARG A 73 3.274 -8.847 -8.400 1.00 71.53 H new ATOM 0 HH22 ARG A 73 2.118 -8.639 -9.720 1.00 71.53 H new ATOM 1172 N PHE A 74 3.684 -2.993 -3.165 1.00 52.12 N ATOM 1173 CA PHE A 74 3.110 -1.916 -2.365 1.00 72.13 C ATOM 1174 C PHE A 74 1.739 -1.514 -2.899 1.00 53.31 C ATOM 1175 O PHE A 74 1.465 -1.634 -4.093 1.00 41.54 O ATOM 1176 CB PHE A 74 4.043 -0.704 -2.359 1.00 4.02 C ATOM 1177 CG PHE A 74 5.388 -0.985 -1.752 1.00 63.55 C ATOM 1178 CD1 PHE A 74 5.489 -1.542 -0.487 1.00 62.13 C ATOM 1179 CD2 PHE A 74 6.551 -0.694 -2.447 1.00 4.10 C ATOM 1180 CE1 PHE A 74 6.726 -1.802 0.073 1.00 14.14 C ATOM 1181 CE2 PHE A 74 7.790 -0.952 -1.891 1.00 52.13 C ATOM 1182 CZ PHE A 74 7.878 -1.507 -0.630 1.00 33.12 C ATOM 0 H PHE A 74 3.977 -2.713 -4.101 1.00 52.12 H new ATOM 0 HA PHE A 74 2.991 -2.279 -1.344 1.00 72.13 H new ATOM 0 HB2 PHE A 74 4.181 -0.357 -3.383 1.00 4.02 H new ATOM 0 HB3 PHE A 74 3.567 0.108 -1.809 1.00 4.02 H new ATOM 0 HD1 PHE A 74 4.592 -1.775 0.067 1.00 62.13 H new ATOM 0 HD2 PHE A 74 6.489 -0.261 -3.434 1.00 4.10 H new ATOM 0 HE1 PHE A 74 6.792 -2.236 1.060 1.00 14.14 H new ATOM 0 HE2 PHE A 74 8.689 -0.719 -2.443 1.00 52.13 H new ATOM 0 HZ PHE A 74 8.845 -1.710 -0.194 1.00 33.12 H new ATOM 1192 N VAL A 75 0.879 -1.036 -2.005 1.00 71.43 N ATOM 1193 CA VAL A 75 -0.465 -0.615 -2.384 1.00 61.40 C ATOM 1194 C VAL A 75 -0.994 0.454 -1.436 1.00 3.14 C ATOM 1195 O VAL A 75 -0.825 0.360 -0.220 1.00 51.04 O ATOM 1196 CB VAL A 75 -1.443 -1.805 -2.397 1.00 23.33 C ATOM 1197 CG1 VAL A 75 -2.788 -1.385 -2.971 1.00 63.20 C ATOM 1198 CG2 VAL A 75 -0.857 -2.968 -3.184 1.00 34.00 C ATOM 0 H VAL A 75 1.089 -0.931 -1.012 1.00 71.43 H new ATOM 0 HA VAL A 75 -0.395 -0.201 -3.390 1.00 61.40 H new ATOM 0 HB VAL A 75 -1.601 -2.134 -1.370 1.00 23.33 H new ATOM 0 HG11 VAL A 75 -3.466 -2.239 -2.972 1.00 63.20 H new ATOM 0 HG12 VAL A 75 -3.211 -0.587 -2.361 1.00 63.20 H new ATOM 0 HG13 VAL A 75 -2.652 -1.028 -3.992 1.00 63.20 H new ATOM 0 HG21 VAL A 75 -1.561 -3.800 -3.183 1.00 34.00 H new ATOM 0 HG22 VAL A 75 -0.668 -2.654 -4.211 1.00 34.00 H new ATOM 0 HG23 VAL A 75 0.079 -3.284 -2.723 1.00 34.00 H new ATOM 1208 N VAL A 76 -1.636 1.472 -2.000 1.00 13.15 N ATOM 1209 CA VAL A 76 -2.193 2.560 -1.204 1.00 61.22 C ATOM 1210 C VAL A 76 -3.708 2.629 -1.353 1.00 13.11 C ATOM 1211 O VAL A 76 -4.223 3.222 -2.301 1.00 52.05 O ATOM 1212 CB VAL A 76 -1.586 3.916 -1.607 1.00 41.34 C ATOM 1213 CG1 VAL A 76 -2.396 5.061 -1.017 1.00 74.40 C ATOM 1214 CG2 VAL A 76 -0.132 4.000 -1.168 1.00 42.45 C ATOM 0 H VAL A 76 -1.783 1.566 -3.005 1.00 13.15 H new ATOM 0 HA VAL A 76 -1.942 2.353 -0.164 1.00 61.22 H new ATOM 0 HB VAL A 76 -1.620 4.001 -2.693 1.00 41.34 H new ATOM 0 HG11 VAL A 76 -1.952 6.011 -1.313 1.00 74.40 H new ATOM 0 HG12 VAL A 76 -3.421 5.009 -1.385 1.00 74.40 H new ATOM 0 HG13 VAL A 76 -2.397 4.984 0.070 1.00 74.40 H new ATOM 0 HG21 VAL A 76 0.281 4.965 -1.461 1.00 42.45 H new ATOM 0 HG22 VAL A 76 -0.072 3.893 -0.085 1.00 42.45 H new ATOM 0 HG23 VAL A 76 0.438 3.202 -1.643 1.00 42.45 H new ATOM 1224 N TYR A 77 -4.417 2.021 -0.409 1.00 34.31 N ATOM 1225 CA TYR A 77 -5.875 2.012 -0.434 1.00 55.33 C ATOM 1226 C TYR A 77 -6.442 3.179 0.369 1.00 71.34 C ATOM 1227 O TYR A 77 -6.018 3.437 1.495 1.00 25.43 O ATOM 1228 CB TYR A 77 -6.408 0.690 0.120 1.00 32.35 C ATOM 1229 CG TYR A 77 -7.891 0.493 -0.102 1.00 51.44 C ATOM 1230 CD1 TYR A 77 -8.480 0.823 -1.318 1.00 14.24 C ATOM 1231 CD2 TYR A 77 -8.702 -0.022 0.900 1.00 73.41 C ATOM 1232 CE1 TYR A 77 -9.834 0.646 -1.526 1.00 33.34 C ATOM 1233 CE2 TYR A 77 -10.057 -0.204 0.700 1.00 2.11 C ATOM 1234 CZ TYR A 77 -10.618 0.131 -0.514 1.00 51.34 C ATOM 1235 OH TYR A 77 -11.967 -0.048 -0.717 1.00 13.33 O ATOM 0 H TYR A 77 -4.006 1.528 0.383 1.00 34.31 H new ATOM 0 HA TYR A 77 -6.195 2.119 -1.470 1.00 55.33 H new ATOM 0 HB2 TYR A 77 -5.867 -0.134 -0.346 1.00 32.35 H new ATOM 0 HB3 TYR A 77 -6.200 0.644 1.189 1.00 32.35 H new ATOM 0 HD1 TYR A 77 -7.869 1.224 -2.113 1.00 14.24 H new ATOM 0 HD2 TYR A 77 -8.266 -0.285 1.853 1.00 73.41 H new ATOM 0 HE1 TYR A 77 -10.277 0.909 -2.475 1.00 33.34 H new ATOM 0 HE2 TYR A 77 -10.673 -0.606 1.490 1.00 2.11 H new ATOM 0 HH TYR A 77 -12.211 0.282 -1.607 1.00 13.33 H new ATOM 1245 N SER A 78 -7.405 3.882 -0.219 1.00 21.22 N ATOM 1246 CA SER A 78 -8.029 5.024 0.439 1.00 13.02 C ATOM 1247 C SER A 78 -9.492 4.734 0.759 1.00 61.41 C ATOM 1248 O SER A 78 -10.366 4.876 -0.095 1.00 41.25 O ATOM 1249 CB SER A 78 -7.926 6.268 -0.445 1.00 62.23 C ATOM 1250 OG SER A 78 -8.271 7.437 0.277 1.00 10.11 O ATOM 0 H SER A 78 -7.770 3.681 -1.150 1.00 21.22 H new ATOM 0 HA SER A 78 -7.500 5.207 1.374 1.00 13.02 H new ATOM 0 HB2 SER A 78 -6.911 6.361 -0.830 1.00 62.23 H new ATOM 0 HB3 SER A 78 -8.585 6.161 -1.307 1.00 62.23 H new ATOM 0 HG SER A 78 -8.196 8.218 -0.310 1.00 10.11 H new ATOM 1256 N TYR A 79 -9.750 4.325 1.997 1.00 14.23 N ATOM 1257 CA TYR A 79 -11.106 4.012 2.431 1.00 34.34 C ATOM 1258 C TYR A 79 -11.847 5.276 2.857 1.00 74.34 C ATOM 1259 O TYR A 79 -11.234 6.303 3.147 1.00 62.12 O ATOM 1260 CB TYR A 79 -11.075 3.011 3.588 1.00 54.32 C ATOM 1261 CG TYR A 79 -12.415 2.826 4.263 1.00 21.40 C ATOM 1262 CD1 TYR A 79 -13.339 1.909 3.776 1.00 33.40 C ATOM 1263 CD2 TYR A 79 -12.757 3.565 5.389 1.00 60.43 C ATOM 1264 CE1 TYR A 79 -14.565 1.736 4.389 1.00 32.21 C ATOM 1265 CE2 TYR A 79 -13.980 3.398 6.009 1.00 12.14 C ATOM 1266 CZ TYR A 79 -14.881 2.483 5.505 1.00 20.41 C ATOM 1267 OH TYR A 79 -16.100 2.312 6.121 1.00 43.22 O ATOM 0 H TYR A 79 -9.038 4.203 2.717 1.00 14.23 H new ATOM 0 HA TYR A 79 -11.637 3.568 1.589 1.00 34.34 H new ATOM 0 HB2 TYR A 79 -10.729 2.047 3.215 1.00 54.32 H new ATOM 0 HB3 TYR A 79 -10.348 3.346 4.328 1.00 54.32 H new ATOM 0 HD1 TYR A 79 -13.094 1.322 2.903 1.00 33.40 H new ATOM 0 HD2 TYR A 79 -12.054 4.282 5.786 1.00 60.43 H new ATOM 0 HE1 TYR A 79 -15.272 1.020 3.997 1.00 32.21 H new ATOM 0 HE2 TYR A 79 -14.229 3.981 6.884 1.00 12.14 H new ATOM 0 HH TYR A 79 -16.164 2.913 6.892 1.00 43.22 H new ATOM 1277 N LYS A 80 -13.174 5.192 2.892 1.00 5.13 N ATOM 1278 CA LYS A 80 -14.001 6.327 3.284 1.00 62.23 C ATOM 1279 C LYS A 80 -14.676 6.069 4.628 1.00 45.43 C ATOM 1280 O LYS A 80 -15.559 5.219 4.737 1.00 30.20 O ATOM 1281 CB LYS A 80 -15.061 6.605 2.215 1.00 63.53 C ATOM 1282 CG LYS A 80 -15.912 7.828 2.505 1.00 35.23 C ATOM 1283 CD LYS A 80 -16.903 8.097 1.386 1.00 73.44 C ATOM 1284 CE LYS A 80 -18.198 7.326 1.589 1.00 12.15 C ATOM 1285 NZ LYS A 80 -18.665 6.682 0.331 1.00 45.15 N ATOM 0 H LYS A 80 -13.698 4.350 2.654 1.00 5.13 H new ATOM 0 HA LYS A 80 -13.355 7.199 3.382 1.00 62.23 H new ATOM 0 HB2 LYS A 80 -14.568 6.736 1.252 1.00 63.53 H new ATOM 0 HB3 LYS A 80 -15.710 5.734 2.124 1.00 63.53 H new ATOM 0 HG2 LYS A 80 -16.450 7.684 3.442 1.00 35.23 H new ATOM 0 HG3 LYS A 80 -15.268 8.697 2.638 1.00 35.23 H new ATOM 0 HD2 LYS A 80 -17.118 9.165 1.338 1.00 73.44 H new ATOM 0 HD3 LYS A 80 -16.459 7.818 0.431 1.00 73.44 H new ATOM 0 HE2 LYS A 80 -18.050 6.563 2.354 1.00 12.15 H new ATOM 0 HE3 LYS A 80 -18.969 8.002 1.958 1.00 12.15 H new ATOM 0 HZ1 LYS A 80 -19.550 6.167 0.513 1.00 45.15 H new ATOM 0 HZ2 LYS A 80 -18.831 7.411 -0.392 1.00 45.15 H new ATOM 0 HZ3 LYS A 80 -17.941 6.017 -0.008 1.00 45.15 H new ATOM 1299 N TYR A 81 -14.255 6.811 5.646 1.00 35.33 N ATOM 1300 CA TYR A 81 -14.818 6.663 6.983 1.00 35.44 C ATOM 1301 C TYR A 81 -15.761 7.816 7.309 1.00 41.41 C ATOM 1302 O TYR A 81 -15.416 8.985 7.128 1.00 32.02 O ATOM 1303 CB TYR A 81 -13.701 6.592 8.026 1.00 52.45 C ATOM 1304 CG TYR A 81 -14.002 5.657 9.175 1.00 41.43 C ATOM 1305 CD1 TYR A 81 -15.076 5.892 10.024 1.00 11.24 C ATOM 1306 CD2 TYR A 81 -13.214 4.538 9.410 1.00 63.34 C ATOM 1307 CE1 TYR A 81 -15.354 5.041 11.076 1.00 43.34 C ATOM 1308 CE2 TYR A 81 -13.486 3.681 10.458 1.00 23.45 C ATOM 1309 CZ TYR A 81 -14.556 3.936 11.288 1.00 21.05 C ATOM 1310 OH TYR A 81 -14.831 3.085 12.335 1.00 41.33 O ATOM 0 H TYR A 81 -13.526 7.521 5.571 1.00 35.33 H new ATOM 0 HA TYR A 81 -15.388 5.734 7.007 1.00 35.44 H new ATOM 0 HB2 TYR A 81 -12.781 6.270 7.539 1.00 52.45 H new ATOM 0 HB3 TYR A 81 -13.520 7.592 8.420 1.00 52.45 H new ATOM 0 HD1 TYR A 81 -15.704 6.755 9.859 1.00 11.24 H new ATOM 0 HD2 TYR A 81 -12.374 4.335 8.762 1.00 63.34 H new ATOM 0 HE1 TYR A 81 -16.191 5.240 11.729 1.00 43.34 H new ATOM 0 HE2 TYR A 81 -12.863 2.815 10.626 1.00 23.45 H new ATOM 0 HH TYR A 81 -14.176 2.356 12.345 1.00 41.33 H new ATOM 1320 N VAL A 82 -16.953 7.480 7.790 1.00 54.52 N ATOM 1321 CA VAL A 82 -17.947 8.487 8.143 1.00 13.22 C ATOM 1322 C VAL A 82 -17.931 8.774 9.640 1.00 31.32 C ATOM 1323 O VAL A 82 -17.516 7.934 10.440 1.00 15.13 O ATOM 1324 CB VAL A 82 -19.364 8.047 7.731 1.00 74.44 C ATOM 1325 CG1 VAL A 82 -20.362 9.170 7.964 1.00 14.14 C ATOM 1326 CG2 VAL A 82 -19.381 7.601 6.276 1.00 22.24 C ATOM 0 H VAL A 82 -17.254 6.518 7.944 1.00 54.52 H new ATOM 0 HA VAL A 82 -17.684 9.394 7.599 1.00 13.22 H new ATOM 0 HB VAL A 82 -19.657 7.200 8.351 1.00 74.44 H new ATOM 0 HG11 VAL A 82 -21.357 8.840 7.667 1.00 14.14 H new ATOM 0 HG12 VAL A 82 -20.369 9.437 9.021 1.00 14.14 H new ATOM 0 HG13 VAL A 82 -20.076 10.039 7.372 1.00 14.14 H new ATOM 0 HG21 VAL A 82 -20.390 7.293 6.002 1.00 22.24 H new ATOM 0 HG22 VAL A 82 -19.068 8.428 5.638 1.00 22.24 H new ATOM 0 HG23 VAL A 82 -18.698 6.762 6.145 1.00 22.24 H new ATOM 1336 N HIS A 83 -18.386 9.965 10.015 1.00 41.51 N ATOM 1337 CA HIS A 83 -18.426 10.363 11.417 1.00 22.43 C ATOM 1338 C HIS A 83 -19.777 10.025 12.040 1.00 40.21 C ATOM 1339 O HIS A 83 -19.948 8.964 12.640 1.00 40.02 O ATOM 1340 CB HIS A 83 -18.148 11.861 11.553 1.00 30.41 C ATOM 1341 CG HIS A 83 -16.741 12.242 11.210 1.00 50.45 C ATOM 1342 ND1 HIS A 83 -15.918 12.936 12.072 1.00 54.05 N ATOM 1343 CD2 HIS A 83 -16.012 12.022 10.090 1.00 22.54 C ATOM 1344 CE1 HIS A 83 -14.745 13.127 11.496 1.00 2.45 C ATOM 1345 NE2 HIS A 83 -14.775 12.582 10.294 1.00 31.14 N ATOM 0 H HIS A 83 -18.733 10.672 9.367 1.00 41.51 H new ATOM 0 HA HIS A 83 -17.652 9.808 11.948 1.00 22.43 H new ATOM 0 HB2 HIS A 83 -18.832 12.409 10.906 1.00 30.41 H new ATOM 0 HB3 HIS A 83 -18.360 12.170 12.576 1.00 30.41 H new ATOM 0 HD1 HIS A 83 -16.175 13.252 13.007 1.00 54.05 H new ATOM 0 HD2 HIS A 83 -16.342 11.503 9.202 1.00 22.54 H new ATOM 0 HE1 HIS A 83 -13.903 13.642 11.934 1.00 2.45 H new ATOM 1354 N ASP A 84 -20.734 10.936 11.894 1.00 32.43 N ATOM 1355 CA ASP A 84 -22.071 10.734 12.442 1.00 43.31 C ATOM 1356 C ASP A 84 -22.863 12.038 12.434 1.00 41.21 C ATOM 1357 O ASP A 84 -24.074 12.038 12.217 1.00 41.13 O ATOM 1358 CB ASP A 84 -21.983 10.185 13.867 1.00 72.34 C ATOM 1359 CG ASP A 84 -22.324 8.708 13.939 1.00 3.34 C ATOM 1360 OD1 ASP A 84 -23.349 8.308 13.352 1.00 31.54 O ATOM 1361 OD2 ASP A 84 -21.564 7.956 14.585 1.00 64.24 O ATOM 0 H ASP A 84 -20.609 11.820 11.401 1.00 32.43 H new ATOM 0 HA ASP A 84 -22.590 10.010 11.814 1.00 43.31 H new ATOM 0 HB2 ASP A 84 -20.976 10.342 14.253 1.00 72.34 H new ATOM 0 HB3 ASP A 84 -22.662 10.744 14.511 1.00 72.34 H new ATOM 1366 N ASP A 85 -22.170 13.146 12.675 1.00 74.33 N ATOM 1367 CA ASP A 85 -22.810 14.457 12.696 1.00 64.25 C ATOM 1368 C ASP A 85 -23.070 14.957 11.278 1.00 20.31 C ATOM 1369 O ASP A 85 -23.803 15.924 11.075 1.00 44.43 O ATOM 1370 CB ASP A 85 -21.938 15.461 13.451 1.00 62.22 C ATOM 1371 CG ASP A 85 -22.588 15.941 14.734 1.00 44.22 C ATOM 1372 OD1 ASP A 85 -23.834 15.903 14.819 1.00 43.43 O ATOM 1373 OD2 ASP A 85 -21.851 16.355 15.653 1.00 63.12 O ATOM 0 H ASP A 85 -21.167 13.163 12.858 1.00 74.33 H new ATOM 0 HA ASP A 85 -23.767 14.359 13.209 1.00 64.25 H new ATOM 0 HB2 ASP A 85 -20.977 15.001 13.683 1.00 62.22 H new ATOM 0 HB3 ASP A 85 -21.734 16.317 12.808 1.00 62.22 H new ATOM 1378 N GLY A 86 -22.464 14.291 10.300 1.00 74.11 N ATOM 1379 CA GLY A 86 -22.642 14.682 8.914 1.00 20.10 C ATOM 1380 C GLY A 86 -21.324 14.901 8.199 1.00 42.32 C ATOM 1381 O GLY A 86 -21.288 15.472 7.109 1.00 64.31 O ATOM 0 H GLY A 86 -21.853 13.487 10.443 1.00 74.11 H new ATOM 0 HA2 GLY A 86 -23.211 13.912 8.393 1.00 20.10 H new ATOM 0 HA3 GLY A 86 -23.232 15.598 8.871 1.00 20.10 H new ATOM 1385 N ARG A 87 -20.236 14.449 8.815 1.00 42.42 N ATOM 1386 CA ARG A 87 -18.909 14.602 8.233 1.00 64.25 C ATOM 1387 C ARG A 87 -18.294 13.240 7.915 1.00 12.41 C ATOM 1388 O ARG A 87 -18.359 12.315 8.725 1.00 43.24 O ATOM 1389 CB ARG A 87 -17.996 15.375 9.184 1.00 1.14 C ATOM 1390 CG ARG A 87 -18.429 16.816 9.407 1.00 63.11 C ATOM 1391 CD ARG A 87 -18.547 17.571 8.093 1.00 74.14 C ATOM 1392 NE ARG A 87 -18.630 19.014 8.296 1.00 52.34 N ATOM 1393 CZ ARG A 87 -17.581 19.778 8.582 1.00 71.02 C ATOM 1394 NH1 ARG A 87 -16.376 19.238 8.697 1.00 71.44 N ATOM 1395 NH2 ARG A 87 -17.737 21.084 8.752 1.00 11.24 N ATOM 0 H ARG A 87 -20.248 13.974 9.717 1.00 42.42 H new ATOM 0 HA ARG A 87 -19.011 15.162 7.304 1.00 64.25 H new ATOM 0 HB2 ARG A 87 -17.967 14.860 10.144 1.00 1.14 H new ATOM 0 HB3 ARG A 87 -16.981 15.367 8.787 1.00 1.14 H new ATOM 0 HG2 ARG A 87 -19.388 16.833 9.925 1.00 63.11 H new ATOM 0 HG3 ARG A 87 -17.709 17.318 10.053 1.00 63.11 H new ATOM 0 HD2 ARG A 87 -17.686 17.342 7.465 1.00 74.14 H new ATOM 0 HD3 ARG A 87 -19.432 17.229 7.557 1.00 74.14 H new ATOM 0 HE ARG A 87 -19.543 19.461 8.214 1.00 52.34 H new ATOM 0 HH11 ARG A 87 -16.252 18.234 8.566 1.00 71.44 H new ATOM 0 HH12 ARG A 87 -15.572 19.826 8.917 1.00 71.44 H new ATOM 0 HH21 ARG A 87 -18.663 21.503 8.663 1.00 11.24 H new ATOM 0 HH22 ARG A 87 -16.931 21.670 8.972 1.00 11.24 H new ATOM 1409 N VAL A 88 -17.700 13.127 6.732 1.00 33.23 N ATOM 1410 CA VAL A 88 -17.074 11.880 6.308 1.00 64.11 C ATOM 1411 C VAL A 88 -15.690 12.132 5.721 1.00 43.02 C ATOM 1412 O VAL A 88 -15.535 12.917 4.785 1.00 22.54 O ATOM 1413 CB VAL A 88 -17.936 11.145 5.265 1.00 10.32 C ATOM 1414 CG1 VAL A 88 -18.463 12.121 4.224 1.00 14.51 C ATOM 1415 CG2 VAL A 88 -17.140 10.029 4.606 1.00 64.14 C ATOM 0 H VAL A 88 -17.639 13.883 6.050 1.00 33.23 H new ATOM 0 HA VAL A 88 -16.981 11.255 7.196 1.00 64.11 H new ATOM 0 HB VAL A 88 -18.790 10.699 5.775 1.00 10.32 H new ATOM 0 HG11 VAL A 88 -19.070 11.583 3.495 1.00 14.51 H new ATOM 0 HG12 VAL A 88 -19.072 12.881 4.713 1.00 14.51 H new ATOM 0 HG13 VAL A 88 -17.625 12.599 3.716 1.00 14.51 H new ATOM 0 HG21 VAL A 88 -17.765 9.521 3.872 1.00 64.14 H new ATOM 0 HG22 VAL A 88 -16.266 10.450 4.109 1.00 64.14 H new ATOM 0 HG23 VAL A 88 -16.818 9.315 5.364 1.00 64.14 H new ATOM 1425 N SER A 89 -14.686 11.461 6.276 1.00 12.23 N ATOM 1426 CA SER A 89 -13.313 11.615 5.809 1.00 21.43 C ATOM 1427 C SER A 89 -12.768 10.291 5.283 1.00 24.41 C ATOM 1428 O SER A 89 -13.178 9.217 5.724 1.00 50.14 O ATOM 1429 CB SER A 89 -12.422 12.132 6.941 1.00 75.12 C ATOM 1430 OG SER A 89 -13.014 13.246 7.586 1.00 31.11 O ATOM 0 H SER A 89 -14.797 10.806 7.050 1.00 12.23 H new ATOM 0 HA SER A 89 -13.311 12.339 4.994 1.00 21.43 H new ATOM 0 HB2 SER A 89 -12.251 11.336 7.666 1.00 75.12 H new ATOM 0 HB3 SER A 89 -11.448 12.414 6.542 1.00 75.12 H new ATOM 0 HG SER A 89 -13.513 12.942 8.373 1.00 31.11 H new ATOM 1436 N TYR A 90 -11.839 10.376 4.336 1.00 33.21 N ATOM 1437 CA TYR A 90 -11.238 9.186 3.746 1.00 21.24 C ATOM 1438 C TYR A 90 -9.830 8.960 4.290 1.00 21.32 C ATOM 1439 O TYR A 90 -8.849 9.515 3.795 1.00 73.13 O ATOM 1440 CB TYR A 90 -11.193 9.313 2.223 1.00 52.33 C ATOM 1441 CG TYR A 90 -12.308 10.161 1.654 1.00 53.43 C ATOM 1442 CD1 TYR A 90 -13.525 9.594 1.293 1.00 2.10 C ATOM 1443 CD2 TYR A 90 -12.146 11.530 1.477 1.00 72.31 C ATOM 1444 CE1 TYR A 90 -14.546 10.365 0.772 1.00 20.21 C ATOM 1445 CE2 TYR A 90 -13.162 12.308 0.957 1.00 15.54 C ATOM 1446 CZ TYR A 90 -14.360 11.722 0.606 1.00 23.25 C ATOM 1447 OH TYR A 90 -15.375 12.493 0.089 1.00 11.14 O ATOM 0 H TYR A 90 -11.486 11.257 3.961 1.00 33.21 H new ATOM 0 HA TYR A 90 -11.854 8.328 4.014 1.00 21.24 H new ATOM 0 HB2 TYR A 90 -10.235 9.743 1.931 1.00 52.33 H new ATOM 0 HB3 TYR A 90 -11.243 8.318 1.782 1.00 52.33 H new ATOM 0 HD1 TYR A 90 -13.675 8.532 1.422 1.00 2.10 H new ATOM 0 HD2 TYR A 90 -11.210 11.993 1.751 1.00 72.31 H new ATOM 0 HE1 TYR A 90 -15.485 9.908 0.496 1.00 20.21 H new ATOM 0 HE2 TYR A 90 -13.019 13.370 0.826 1.00 15.54 H new ATOM 0 HH TYR A 90 -15.083 13.427 0.038 1.00 11.14 H new ATOM 1457 N PRO A 91 -9.727 8.124 5.334 1.00 53.01 N ATOM 1458 CA PRO A 91 -8.446 7.804 5.968 1.00 5.13 C ATOM 1459 C PRO A 91 -7.553 6.952 5.073 1.00 65.52 C ATOM 1460 O PRO A 91 -7.724 5.735 4.986 1.00 70.24 O ATOM 1461 CB PRO A 91 -8.853 7.020 7.218 1.00 51.04 C ATOM 1462 CG PRO A 91 -10.181 6.434 6.881 1.00 71.22 C ATOM 1463 CD PRO A 91 -10.854 7.428 5.976 1.00 35.32 C ATOM 0 HA PRO A 91 -7.863 8.700 6.182 1.00 5.13 H new ATOM 0 HB2 PRO A 91 -8.125 6.243 7.453 1.00 51.04 H new ATOM 0 HB3 PRO A 91 -8.917 7.671 8.090 1.00 51.04 H new ATOM 0 HG2 PRO A 91 -10.068 5.470 6.386 1.00 71.22 H new ATOM 0 HG3 PRO A 91 -10.772 6.263 7.781 1.00 71.22 H new ATOM 0 HD2 PRO A 91 -11.492 6.935 5.242 1.00 35.32 H new ATOM 0 HD3 PRO A 91 -11.486 8.118 6.536 1.00 35.32 H new ATOM 1471 N LEU A 92 -6.599 7.596 4.409 1.00 54.13 N ATOM 1472 CA LEU A 92 -5.679 6.896 3.520 1.00 50.12 C ATOM 1473 C LEU A 92 -4.685 6.056 4.316 1.00 34.05 C ATOM 1474 O LEU A 92 -4.132 6.513 5.317 1.00 14.21 O ATOM 1475 CB LEU A 92 -4.928 7.898 2.641 1.00 63.24 C ATOM 1476 CG LEU A 92 -5.400 8.006 1.191 1.00 74.34 C ATOM 1477 CD1 LEU A 92 -6.062 9.353 0.944 1.00 23.22 C ATOM 1478 CD2 LEU A 92 -4.237 7.797 0.233 1.00 4.25 C ATOM 0 H LEU A 92 -6.443 8.602 4.470 1.00 54.13 H new ATOM 0 HA LEU A 92 -6.263 6.230 2.885 1.00 50.12 H new ATOM 0 HB2 LEU A 92 -5.005 8.883 3.101 1.00 63.24 H new ATOM 0 HB3 LEU A 92 -3.872 7.629 2.639 1.00 63.24 H new ATOM 0 HG LEU A 92 -6.137 7.223 1.010 1.00 74.34 H new ATOM 0 HD11 LEU A 92 -6.392 9.412 -0.093 1.00 23.22 H new ATOM 0 HD12 LEU A 92 -6.922 9.462 1.605 1.00 23.22 H new ATOM 0 HD13 LEU A 92 -5.347 10.152 1.143 1.00 23.22 H new ATOM 0 HD21 LEU A 92 -4.593 7.878 -0.794 1.00 4.25 H new ATOM 0 HD22 LEU A 92 -3.476 8.556 0.414 1.00 4.25 H new ATOM 0 HD23 LEU A 92 -3.808 6.808 0.392 1.00 4.25 H new ATOM 1490 N CYS A 93 -4.464 4.827 3.865 1.00 61.03 N ATOM 1491 CA CYS A 93 -3.536 3.922 4.534 1.00 42.22 C ATOM 1492 C CYS A 93 -2.629 3.227 3.523 1.00 33.13 C ATOM 1493 O CYS A 93 -2.918 3.204 2.327 1.00 13.30 O ATOM 1494 CB CYS A 93 -4.304 2.881 5.350 1.00 51.33 C ATOM 1495 SG CYS A 93 -5.294 3.579 6.691 1.00 22.44 S ATOM 0 H CYS A 93 -4.915 4.434 3.039 1.00 61.03 H new ATOM 0 HA CYS A 93 -2.914 4.512 5.207 1.00 42.22 H new ATOM 0 HB2 CYS A 93 -4.959 2.322 4.682 1.00 51.33 H new ATOM 0 HB3 CYS A 93 -3.594 2.168 5.770 1.00 51.33 H new ATOM 0 HG CYS A 93 -5.248 2.788 7.722 1.00 22.44 H new ATOM 1501 N PHE A 94 -1.530 2.661 4.013 1.00 55.40 N ATOM 1502 CA PHE A 94 -0.580 1.968 3.152 1.00 25.52 C ATOM 1503 C PHE A 94 -0.640 0.460 3.378 1.00 33.34 C ATOM 1504 O PHE A 94 -0.185 -0.043 4.406 1.00 41.23 O ATOM 1505 CB PHE A 94 0.840 2.477 3.411 1.00 65.12 C ATOM 1506 CG PHE A 94 1.857 1.928 2.451 1.00 11.12 C ATOM 1507 CD1 PHE A 94 1.957 2.431 1.163 1.00 13.24 C ATOM 1508 CD2 PHE A 94 2.714 0.909 2.836 1.00 40.25 C ATOM 1509 CE1 PHE A 94 2.892 1.930 0.278 1.00 32.14 C ATOM 1510 CE2 PHE A 94 3.651 0.404 1.955 1.00 1.21 C ATOM 1511 CZ PHE A 94 3.739 0.914 0.674 1.00 72.33 C ATOM 0 H PHE A 94 -1.276 2.669 5.001 1.00 55.40 H new ATOM 0 HA PHE A 94 -0.850 2.173 2.116 1.00 25.52 H new ATOM 0 HB2 PHE A 94 0.844 3.565 3.350 1.00 65.12 H new ATOM 0 HB3 PHE A 94 1.132 2.214 4.428 1.00 65.12 H new ATOM 0 HD1 PHE A 94 1.296 3.224 0.848 1.00 13.24 H new ATOM 0 HD2 PHE A 94 2.649 0.505 3.836 1.00 40.25 H new ATOM 0 HE1 PHE A 94 2.960 2.332 -0.722 1.00 32.14 H new ATOM 0 HE2 PHE A 94 4.314 -0.389 2.268 1.00 1.21 H new ATOM 0 HZ PHE A 94 4.469 0.519 -0.017 1.00 72.33 H new ATOM 1521 N ILE A 95 -1.208 -0.254 2.412 1.00 24.44 N ATOM 1522 CA ILE A 95 -1.328 -1.704 2.506 1.00 51.33 C ATOM 1523 C ILE A 95 -0.151 -2.398 1.828 1.00 50.13 C ATOM 1524 O ILE A 95 0.071 -2.237 0.628 1.00 50.13 O ATOM 1525 CB ILE A 95 -2.639 -2.202 1.869 1.00 42.03 C ATOM 1526 CG1 ILE A 95 -3.843 -1.549 2.551 1.00 51.34 C ATOM 1527 CG2 ILE A 95 -2.730 -3.719 1.960 1.00 4.52 C ATOM 1528 CD1 ILE A 95 -5.144 -1.752 1.805 1.00 5.01 C ATOM 0 H ILE A 95 -1.592 0.147 1.556 1.00 24.44 H new ATOM 0 HA ILE A 95 -1.331 -1.953 3.567 1.00 51.33 H new ATOM 0 HB ILE A 95 -2.644 -1.920 0.816 1.00 42.03 H new ATOM 0 HG12 ILE A 95 -3.944 -1.954 3.558 1.00 51.34 H new ATOM 0 HG13 ILE A 95 -3.656 -0.480 2.655 1.00 51.34 H new ATOM 0 HG21 ILE A 95 -3.662 -4.056 1.506 1.00 4.52 H new ATOM 0 HG22 ILE A 95 -1.887 -4.166 1.433 1.00 4.52 H new ATOM 0 HG23 ILE A 95 -2.706 -4.023 3.007 1.00 4.52 H new ATOM 0 HD11 ILE A 95 -5.954 -1.262 2.346 1.00 5.01 H new ATOM 0 HD12 ILE A 95 -5.062 -1.322 0.807 1.00 5.01 H new ATOM 0 HD13 ILE A 95 -5.354 -2.818 1.724 1.00 5.01 H new ATOM 1540 N PHE A 96 0.598 -3.173 2.605 1.00 70.44 N ATOM 1541 CA PHE A 96 1.752 -3.894 2.080 1.00 4.30 C ATOM 1542 C PHE A 96 1.402 -5.352 1.800 1.00 42.32 C ATOM 1543 O PHE A 96 1.268 -6.157 2.720 1.00 31.13 O ATOM 1544 CB PHE A 96 2.919 -3.819 3.067 1.00 41.11 C ATOM 1545 CG PHE A 96 4.163 -4.507 2.579 1.00 54.30 C ATOM 1546 CD1 PHE A 96 4.234 -5.002 1.288 1.00 75.03 C ATOM 1547 CD2 PHE A 96 5.259 -4.657 3.413 1.00 63.02 C ATOM 1548 CE1 PHE A 96 5.376 -5.637 0.837 1.00 53.20 C ATOM 1549 CE2 PHE A 96 6.404 -5.290 2.966 1.00 4.35 C ATOM 1550 CZ PHE A 96 6.463 -5.780 1.677 1.00 44.30 C ATOM 0 H PHE A 96 0.427 -3.318 3.600 1.00 70.44 H new ATOM 0 HA PHE A 96 2.047 -3.423 1.142 1.00 4.30 H new ATOM 0 HB2 PHE A 96 3.147 -2.772 3.268 1.00 41.11 H new ATOM 0 HB3 PHE A 96 2.614 -4.266 4.013 1.00 41.11 H new ATOM 0 HD1 PHE A 96 3.388 -4.891 0.626 1.00 75.03 H new ATOM 0 HD2 PHE A 96 5.219 -4.276 4.423 1.00 63.02 H new ATOM 0 HE1 PHE A 96 5.418 -6.021 -0.172 1.00 53.20 H new ATOM 0 HE2 PHE A 96 7.252 -5.401 3.625 1.00 4.35 H new ATOM 0 HZ PHE A 96 7.357 -6.274 1.326 1.00 44.30 H new ATOM 1560 N SER A 97 1.253 -5.683 0.520 1.00 24.55 N ATOM 1561 CA SER A 97 0.914 -7.043 0.118 1.00 50.14 C ATOM 1562 C SER A 97 2.144 -7.945 0.159 1.00 23.12 C ATOM 1563 O SER A 97 2.955 -7.950 -0.766 1.00 0.31 O ATOM 1564 CB SER A 97 0.313 -7.045 -1.290 1.00 4.23 C ATOM 1565 OG SER A 97 -0.367 -8.261 -1.552 1.00 4.01 O ATOM 0 H SER A 97 1.362 -5.028 -0.255 1.00 24.55 H new ATOM 0 HA SER A 97 0.177 -7.431 0.822 1.00 50.14 H new ATOM 0 HB2 SER A 97 -0.378 -6.208 -1.395 1.00 4.23 H new ATOM 0 HB3 SER A 97 1.103 -6.901 -2.027 1.00 4.23 H new ATOM 0 HG SER A 97 -0.463 -8.380 -2.520 1.00 4.01 H new ATOM 1571 N SER A 98 2.274 -8.708 1.240 1.00 1.52 N ATOM 1572 CA SER A 98 3.406 -9.611 1.406 1.00 44.43 C ATOM 1573 C SER A 98 2.937 -10.997 1.835 1.00 33.55 C ATOM 1574 O SER A 98 2.748 -11.278 3.019 1.00 72.42 O ATOM 1575 CB SER A 98 4.387 -9.050 2.438 1.00 52.01 C ATOM 1576 OG SER A 98 5.674 -9.621 2.281 1.00 24.22 O ATOM 0 H SER A 98 1.609 -8.718 2.013 1.00 1.52 H new ATOM 0 HA SER A 98 3.912 -9.699 0.445 1.00 44.43 H new ATOM 0 HB2 SER A 98 4.451 -7.967 2.332 1.00 52.01 H new ATOM 0 HB3 SER A 98 4.017 -9.251 3.443 1.00 52.01 H new ATOM 0 HG SER A 98 5.996 -9.944 3.148 1.00 24.22 H new ATOM 1582 N PRO A 99 2.742 -11.886 0.851 1.00 61.35 N ATOM 1583 CA PRO A 99 2.292 -13.259 1.100 1.00 41.13 C ATOM 1584 C PRO A 99 3.361 -14.104 1.785 1.00 13.34 C ATOM 1585 O PRO A 99 4.378 -13.584 2.244 1.00 31.30 O ATOM 1586 CB PRO A 99 2.002 -13.798 -0.303 1.00 25.01 C ATOM 1587 CG PRO A 99 2.865 -12.987 -1.206 1.00 54.12 C ATOM 1588 CD PRO A 99 2.948 -11.621 -0.584 1.00 14.04 C ATOM 0 HA PRO A 99 1.432 -13.291 1.769 1.00 41.13 H new ATOM 0 HB2 PRO A 99 2.239 -14.859 -0.376 1.00 25.01 H new ATOM 0 HB3 PRO A 99 0.948 -13.689 -0.559 1.00 25.01 H new ATOM 0 HG2 PRO A 99 3.855 -13.432 -1.303 1.00 54.12 H new ATOM 0 HG3 PRO A 99 2.440 -12.934 -2.208 1.00 54.12 H new ATOM 0 HD2 PRO A 99 3.914 -11.152 -0.771 1.00 14.04 H new ATOM 0 HD3 PRO A 99 2.186 -10.951 -0.982 1.00 14.04 H new ATOM 1596 N VAL A 100 3.124 -15.411 1.850 1.00 42.04 N ATOM 1597 CA VAL A 100 4.068 -16.328 2.478 1.00 54.23 C ATOM 1598 C VAL A 100 4.858 -17.106 1.430 1.00 15.45 C ATOM 1599 O VAL A 100 5.982 -17.538 1.679 1.00 22.05 O ATOM 1600 CB VAL A 100 3.349 -17.324 3.407 1.00 35.21 C ATOM 1601 CG1 VAL A 100 2.646 -18.400 2.594 1.00 74.21 C ATOM 1602 CG2 VAL A 100 4.333 -17.943 4.387 1.00 1.44 C ATOM 0 H VAL A 100 2.287 -15.858 1.476 1.00 42.04 H new ATOM 0 HA VAL A 100 4.754 -15.721 3.069 1.00 54.23 H new ATOM 0 HB VAL A 100 2.595 -16.782 3.978 1.00 35.21 H new ATOM 0 HG11 VAL A 100 2.144 -19.095 3.267 1.00 74.21 H new ATOM 0 HG12 VAL A 100 1.911 -17.937 1.936 1.00 74.21 H new ATOM 0 HG13 VAL A 100 3.379 -18.941 1.995 1.00 74.21 H new ATOM 0 HG21 VAL A 100 3.808 -18.644 5.036 1.00 1.44 H new ATOM 0 HG22 VAL A 100 5.111 -18.471 3.836 1.00 1.44 H new ATOM 0 HG23 VAL A 100 4.786 -17.158 4.992 1.00 1.44 H new ATOM 1612 N GLY A 101 4.259 -17.280 0.256 1.00 63.52 N ATOM 1613 CA GLY A 101 4.921 -18.006 -0.813 1.00 63.40 C ATOM 1614 C GLY A 101 5.964 -17.168 -1.524 1.00 44.32 C ATOM 1615 O GLY A 101 6.697 -17.669 -2.377 1.00 63.14 O ATOM 0 H GLY A 101 3.328 -16.932 0.026 1.00 63.52 H new ATOM 0 HA2 GLY A 101 5.394 -18.898 -0.403 1.00 63.40 H new ATOM 0 HA3 GLY A 101 4.177 -18.343 -1.534 1.00 63.40 H new ATOM 1619 N CYS A 102 6.030 -15.887 -1.176 1.00 74.02 N ATOM 1620 CA CYS A 102 6.988 -14.976 -1.789 1.00 64.22 C ATOM 1621 C CYS A 102 8.420 -15.427 -1.514 1.00 52.41 C ATOM 1622 O CYS A 102 8.658 -16.297 -0.677 1.00 61.54 O ATOM 1623 CB CYS A 102 6.780 -13.554 -1.265 1.00 51.34 C ATOM 1624 SG CYS A 102 6.771 -13.425 0.538 1.00 32.42 S ATOM 0 H CYS A 102 5.430 -15.457 -0.472 1.00 74.02 H new ATOM 0 HA CYS A 102 6.823 -14.986 -2.866 1.00 64.22 H new ATOM 0 HB2 CYS A 102 7.569 -12.914 -1.660 1.00 51.34 H new ATOM 0 HB3 CYS A 102 5.835 -13.171 -1.651 1.00 51.34 H new ATOM 0 HG CYS A 102 5.544 -13.365 0.963 1.00 32.42 H new ATOM 1630 N LYS A 103 9.370 -14.830 -2.226 1.00 53.35 N ATOM 1631 CA LYS A 103 10.778 -15.169 -2.060 1.00 51.21 C ATOM 1632 C LYS A 103 11.510 -14.084 -1.278 1.00 22.22 C ATOM 1633 O LYS A 103 11.125 -12.915 -1.280 1.00 13.33 O ATOM 1634 CB LYS A 103 11.441 -15.363 -3.425 1.00 60.25 C ATOM 1635 CG LYS A 103 10.541 -16.036 -4.448 1.00 65.35 C ATOM 1636 CD LYS A 103 10.394 -15.191 -5.703 1.00 1.13 C ATOM 1637 CE LYS A 103 11.741 -14.930 -6.361 1.00 13.44 C ATOM 1638 NZ LYS A 103 12.028 -15.911 -7.442 1.00 65.21 N ATOM 0 H LYS A 103 9.190 -14.108 -2.924 1.00 53.35 H new ATOM 0 HA LYS A 103 10.838 -16.101 -1.498 1.00 51.21 H new ATOM 0 HB2 LYS A 103 11.752 -14.392 -3.810 1.00 60.25 H new ATOM 0 HB3 LYS A 103 12.344 -15.960 -3.299 1.00 60.25 H new ATOM 0 HG2 LYS A 103 10.952 -17.011 -4.711 1.00 65.35 H new ATOM 0 HG3 LYS A 103 9.559 -16.212 -4.010 1.00 65.35 H new ATOM 0 HD2 LYS A 103 9.735 -15.697 -6.409 1.00 1.13 H new ATOM 0 HD3 LYS A 103 9.921 -14.242 -5.450 1.00 1.13 H new ATOM 0 HE2 LYS A 103 11.755 -13.921 -6.773 1.00 13.44 H new ATOM 0 HE3 LYS A 103 12.528 -14.978 -5.609 1.00 13.44 H new ATOM 0 HZ1 LYS A 103 12.954 -15.700 -7.866 1.00 65.21 H new ATOM 0 HZ2 LYS A 103 12.040 -16.872 -7.044 1.00 65.21 H new ATOM 0 HZ3 LYS A 103 11.291 -15.848 -8.173 1.00 65.21 H new ATOM 1652 N PRO A 104 12.595 -14.476 -0.592 1.00 74.40 N ATOM 1653 CA PRO A 104 13.405 -13.553 0.206 1.00 1.51 C ATOM 1654 C PRO A 104 14.187 -12.571 -0.661 1.00 5.14 C ATOM 1655 O PRO A 104 14.656 -11.541 -0.178 1.00 41.01 O ATOM 1656 CB PRO A 104 14.360 -14.479 0.961 1.00 41.02 C ATOM 1657 CG PRO A 104 14.458 -15.698 0.111 1.00 75.35 C ATOM 1658 CD PRO A 104 13.113 -15.855 -0.544 1.00 52.31 C ATOM 0 HA PRO A 104 12.791 -12.931 0.857 1.00 1.51 H new ATOM 0 HB2 PRO A 104 15.336 -14.013 1.099 1.00 41.02 H new ATOM 0 HB3 PRO A 104 13.977 -14.718 1.953 1.00 41.02 H new ATOM 0 HG2 PRO A 104 15.245 -15.591 -0.635 1.00 75.35 H new ATOM 0 HG3 PRO A 104 14.704 -16.574 0.711 1.00 75.35 H new ATOM 0 HD2 PRO A 104 13.199 -16.287 -1.541 1.00 52.31 H new ATOM 0 HD3 PRO A 104 12.459 -16.510 0.032 1.00 52.31 H new ATOM 1666 N GLU A 105 14.324 -12.900 -1.942 1.00 2.55 N ATOM 1667 CA GLU A 105 15.051 -12.046 -2.875 1.00 12.52 C ATOM 1668 C GLU A 105 14.219 -10.825 -3.257 1.00 60.33 C ATOM 1669 O GLU A 105 14.744 -9.721 -3.391 1.00 11.32 O ATOM 1670 CB GLU A 105 15.430 -12.832 -4.131 1.00 31.44 C ATOM 1671 CG GLU A 105 16.632 -13.742 -3.940 1.00 31.45 C ATOM 1672 CD GLU A 105 16.863 -14.660 -5.124 1.00 4.11 C ATOM 1673 OE1 GLU A 105 15.872 -15.189 -5.669 1.00 21.24 O ATOM 1674 OE2 GLU A 105 18.037 -14.849 -5.507 1.00 63.41 O ATOM 0 H GLU A 105 13.942 -13.750 -2.357 1.00 2.55 H new ATOM 0 HA GLU A 105 15.961 -11.704 -2.381 1.00 12.52 H new ATOM 0 HB2 GLU A 105 14.576 -13.433 -4.445 1.00 31.44 H new ATOM 0 HB3 GLU A 105 15.640 -12.131 -4.939 1.00 31.44 H new ATOM 0 HG2 GLU A 105 17.522 -13.133 -3.778 1.00 31.45 H new ATOM 0 HG3 GLU A 105 16.489 -14.343 -3.042 1.00 31.45 H new ATOM 1681 N GLN A 106 12.918 -11.035 -3.433 1.00 13.14 N ATOM 1682 CA GLN A 106 12.013 -9.953 -3.801 1.00 1.11 C ATOM 1683 C GLN A 106 11.511 -9.217 -2.563 1.00 30.11 C ATOM 1684 O GLN A 106 11.568 -7.990 -2.493 1.00 22.11 O ATOM 1685 CB GLN A 106 10.828 -10.499 -4.600 1.00 21.23 C ATOM 1686 CG GLN A 106 11.215 -11.578 -5.599 1.00 54.21 C ATOM 1687 CD GLN A 106 12.183 -11.077 -6.652 1.00 65.14 C ATOM 1688 OE1 GLN A 106 13.250 -11.658 -6.857 1.00 22.12 O ATOM 1689 NE2 GLN A 106 11.817 -9.995 -7.328 1.00 21.00 N ATOM 0 H GLN A 106 12.468 -11.944 -3.327 1.00 13.14 H new ATOM 0 HA GLN A 106 12.566 -9.247 -4.421 1.00 1.11 H new ATOM 0 HB2 GLN A 106 10.089 -10.904 -3.908 1.00 21.23 H new ATOM 0 HB3 GLN A 106 10.349 -9.677 -5.132 1.00 21.23 H new ATOM 0 HG2 GLN A 106 11.665 -12.416 -5.067 1.00 54.21 H new ATOM 0 HG3 GLN A 106 10.316 -11.955 -6.087 1.00 54.21 H new ATOM 0 HE21 GLN A 106 10.924 -9.545 -7.126 1.00 21.00 H new ATOM 0 HE22 GLN A 106 12.429 -9.613 -8.050 1.00 21.00 H new ATOM 1698 N GLN A 107 11.018 -9.976 -1.589 1.00 33.31 N ATOM 1699 CA GLN A 107 10.504 -9.396 -0.354 1.00 43.12 C ATOM 1700 C GLN A 107 11.505 -8.412 0.241 1.00 3.33 C ATOM 1701 O GLN A 107 11.121 -7.404 0.835 1.00 11.03 O ATOM 1702 CB GLN A 107 10.189 -10.497 0.659 1.00 40.22 C ATOM 1703 CG GLN A 107 8.768 -10.441 1.197 1.00 73.23 C ATOM 1704 CD GLN A 107 8.705 -9.958 2.632 1.00 1.23 C ATOM 1705 OE1 GLN A 107 9.091 -10.673 3.557 1.00 52.40 O ATOM 1706 NE2 GLN A 107 8.218 -8.737 2.825 1.00 11.04 N ATOM 0 H GLN A 107 10.964 -10.994 -1.632 1.00 33.31 H new ATOM 0 HA GLN A 107 9.587 -8.856 -0.589 1.00 43.12 H new ATOM 0 HB2 GLN A 107 10.353 -11.468 0.191 1.00 40.22 H new ATOM 0 HB3 GLN A 107 10.887 -10.423 1.493 1.00 40.22 H new ATOM 0 HG2 GLN A 107 8.172 -9.779 0.569 1.00 73.23 H new ATOM 0 HG3 GLN A 107 8.320 -11.432 1.132 1.00 73.23 H new ATOM 0 HE21 GLN A 107 7.910 -8.179 2.029 1.00 11.04 H new ATOM 0 HE22 GLN A 107 8.153 -8.357 3.769 1.00 11.04 H new ATOM 1715 N MET A 108 12.790 -8.710 0.079 1.00 13.23 N ATOM 1716 CA MET A 108 13.846 -7.850 0.602 1.00 62.35 C ATOM 1717 C MET A 108 13.875 -6.516 -0.138 1.00 1.14 C ATOM 1718 O MET A 108 14.269 -5.494 0.424 1.00 35.12 O ATOM 1719 CB MET A 108 15.204 -8.544 0.480 1.00 53.12 C ATOM 1720 CG MET A 108 15.685 -9.170 1.779 1.00 65.03 C ATOM 1721 SD MET A 108 17.470 -9.040 1.993 1.00 5.55 S ATOM 1722 CE MET A 108 18.046 -9.608 0.396 1.00 43.45 C ATOM 0 H MET A 108 13.125 -9.540 -0.410 1.00 13.23 H new ATOM 0 HA MET A 108 13.638 -7.658 1.654 1.00 62.35 H new ATOM 0 HB2 MET A 108 15.140 -9.318 -0.285 1.00 53.12 H new ATOM 0 HB3 MET A 108 15.944 -7.820 0.139 1.00 53.12 H new ATOM 0 HG2 MET A 108 15.186 -8.685 2.618 1.00 65.03 H new ATOM 0 HG3 MET A 108 15.396 -10.221 1.800 1.00 65.03 H new ATOM 0 HE1 MET A 108 19.063 -9.989 0.490 1.00 43.45 H new ATOM 0 HE2 MET A 108 17.393 -10.402 0.035 1.00 43.45 H new ATOM 0 HE3 MET A 108 18.034 -8.779 -0.311 1.00 43.45 H new ATOM 1732 N MET A 109 13.457 -6.534 -1.399 1.00 70.00 N ATOM 1733 CA MET A 109 13.434 -5.324 -2.213 1.00 31.31 C ATOM 1734 C MET A 109 12.433 -4.315 -1.660 1.00 53.54 C ATOM 1735 O MET A 109 12.676 -3.108 -1.685 1.00 55.14 O ATOM 1736 CB MET A 109 13.085 -5.666 -3.662 1.00 40.15 C ATOM 1737 CG MET A 109 14.161 -6.470 -4.374 1.00 43.41 C ATOM 1738 SD MET A 109 13.541 -7.313 -5.842 1.00 44.55 S ATOM 1739 CE MET A 109 13.475 -5.955 -7.010 1.00 33.31 C ATOM 0 H MET A 109 13.130 -7.372 -1.879 1.00 70.00 H new ATOM 0 HA MET A 109 14.427 -4.876 -2.182 1.00 31.31 H new ATOM 0 HB2 MET A 109 12.152 -6.229 -3.679 1.00 40.15 H new ATOM 0 HB3 MET A 109 12.910 -4.742 -4.213 1.00 40.15 H new ATOM 0 HG2 MET A 109 14.977 -5.806 -4.659 1.00 43.41 H new ATOM 0 HG3 MET A 109 14.575 -7.206 -3.685 1.00 43.41 H new ATOM 0 HE1 MET A 109 12.947 -6.273 -7.909 1.00 33.31 H new ATOM 0 HE2 MET A 109 12.950 -5.113 -6.560 1.00 33.31 H new ATOM 0 HE3 MET A 109 14.488 -5.652 -7.273 1.00 33.31 H new ATOM 1749 N TYR A 110 11.307 -4.816 -1.164 1.00 61.31 N ATOM 1750 CA TYR A 110 10.268 -3.958 -0.608 1.00 31.32 C ATOM 1751 C TYR A 110 10.496 -3.722 0.882 1.00 34.50 C ATOM 1752 O TYR A 110 10.329 -2.609 1.378 1.00 72.25 O ATOM 1753 CB TYR A 110 8.889 -4.581 -0.833 1.00 31.44 C ATOM 1754 CG TYR A 110 8.677 -5.089 -2.241 1.00 31.22 C ATOM 1755 CD1 TYR A 110 9.182 -6.321 -2.639 1.00 51.34 C ATOM 1756 CD2 TYR A 110 7.969 -4.339 -3.172 1.00 31.52 C ATOM 1757 CE1 TYR A 110 8.991 -6.789 -3.925 1.00 32.12 C ATOM 1758 CE2 TYR A 110 7.771 -4.801 -4.459 1.00 12.51 C ATOM 1759 CZ TYR A 110 8.285 -6.026 -4.831 1.00 51.32 C ATOM 1760 OH TYR A 110 8.091 -6.488 -6.112 1.00 61.52 O ATOM 0 H TYR A 110 11.091 -5.812 -1.136 1.00 61.31 H new ATOM 0 HA TYR A 110 10.313 -2.997 -1.120 1.00 31.32 H new ATOM 0 HB2 TYR A 110 8.754 -5.406 -0.134 1.00 31.44 H new ATOM 0 HB3 TYR A 110 8.123 -3.840 -0.604 1.00 31.44 H new ATOM 0 HD1 TYR A 110 9.733 -6.923 -1.931 1.00 51.34 H new ATOM 0 HD2 TYR A 110 7.567 -3.379 -2.885 1.00 31.52 H new ATOM 0 HE1 TYR A 110 9.393 -7.747 -4.219 1.00 32.12 H new ATOM 0 HE2 TYR A 110 7.217 -4.206 -5.170 1.00 12.51 H new ATOM 0 HH TYR A 110 7.294 -7.058 -6.137 1.00 61.52 H new ATOM 1770 N ALA A 111 10.877 -4.780 1.590 1.00 60.42 N ATOM 1771 CA ALA A 111 11.131 -4.689 3.023 1.00 74.10 C ATOM 1772 C ALA A 111 12.211 -3.656 3.325 1.00 62.34 C ATOM 1773 O ALA A 111 12.288 -3.131 4.434 1.00 31.05 O ATOM 1774 CB ALA A 111 11.529 -6.050 3.575 1.00 11.22 C ATOM 0 H ALA A 111 11.017 -5.710 1.195 1.00 60.42 H new ATOM 0 HA ALA A 111 10.211 -4.366 3.511 1.00 74.10 H new ATOM 0 HB1 ALA A 111 11.716 -5.968 4.646 1.00 11.22 H new ATOM 0 HB2 ALA A 111 10.723 -6.763 3.401 1.00 11.22 H new ATOM 0 HB3 ALA A 111 12.434 -6.395 3.074 1.00 11.22 H new ATOM 1780 N GLY A 112 13.045 -3.371 2.330 1.00 43.34 N ATOM 1781 CA GLY A 112 14.110 -2.402 2.509 1.00 25.14 C ATOM 1782 C GLY A 112 13.768 -1.048 1.922 1.00 42.42 C ATOM 1783 O GLY A 112 14.310 -0.026 2.342 1.00 1.31 O ATOM 0 H GLY A 112 13.002 -3.794 1.403 1.00 43.34 H new ATOM 0 HA2 GLY A 112 14.320 -2.290 3.573 1.00 25.14 H new ATOM 0 HA3 GLY A 112 15.020 -2.777 2.042 1.00 25.14 H new ATOM 1787 N SER A 113 12.868 -1.039 0.944 1.00 43.40 N ATOM 1788 CA SER A 113 12.459 0.200 0.293 1.00 34.12 C ATOM 1789 C SER A 113 11.048 0.597 0.719 1.00 72.02 C ATOM 1790 O SER A 113 10.491 1.579 0.227 1.00 5.11 O ATOM 1791 CB SER A 113 12.519 0.046 -1.229 1.00 0.14 C ATOM 1792 OG SER A 113 13.646 -0.721 -1.618 1.00 52.52 O ATOM 0 H SER A 113 12.408 -1.876 0.585 1.00 43.40 H new ATOM 0 HA SER A 113 13.148 0.987 0.599 1.00 34.12 H new ATOM 0 HB2 SER A 113 11.608 -0.434 -1.586 1.00 0.14 H new ATOM 0 HB3 SER A 113 12.565 1.030 -1.696 1.00 0.14 H new ATOM 0 HG SER A 113 13.347 -1.580 -1.982 1.00 52.52 H new ATOM 1798 N LYS A 114 10.476 -0.174 1.637 1.00 55.44 N ATOM 1799 CA LYS A 114 9.131 0.096 2.132 1.00 14.14 C ATOM 1800 C LYS A 114 9.045 1.492 2.743 1.00 31.41 C ATOM 1801 O LYS A 114 8.371 2.372 2.210 1.00 21.53 O ATOM 1802 CB LYS A 114 8.728 -0.953 3.172 1.00 54.43 C ATOM 1803 CG LYS A 114 7.367 -0.698 3.797 1.00 70.33 C ATOM 1804 CD LYS A 114 6.759 -1.977 4.348 1.00 32.22 C ATOM 1805 CE LYS A 114 6.829 -2.018 5.867 1.00 45.44 C ATOM 1806 NZ LYS A 114 6.092 -3.186 6.424 1.00 10.51 N ATOM 0 H LYS A 114 10.923 -0.991 2.054 1.00 55.44 H new ATOM 0 HA LYS A 114 8.443 0.045 1.288 1.00 14.14 H new ATOM 0 HB2 LYS A 114 8.724 -1.936 2.701 1.00 54.43 H new ATOM 0 HB3 LYS A 114 9.481 -0.980 3.960 1.00 54.43 H new ATOM 0 HG2 LYS A 114 7.465 0.034 4.598 1.00 70.33 H new ATOM 0 HG3 LYS A 114 6.698 -0.267 3.052 1.00 70.33 H new ATOM 0 HD2 LYS A 114 5.720 -2.054 4.028 1.00 32.22 H new ATOM 0 HD3 LYS A 114 7.284 -2.838 3.935 1.00 32.22 H new ATOM 0 HE2 LYS A 114 7.872 -2.063 6.182 1.00 45.44 H new ATOM 0 HE3 LYS A 114 6.412 -1.097 6.275 1.00 45.44 H new ATOM 0 HZ1 LYS A 114 6.163 -3.179 7.462 1.00 10.51 H new ATOM 0 HZ2 LYS A 114 5.092 -3.130 6.145 1.00 10.51 H new ATOM 0 HZ3 LYS A 114 6.506 -4.066 6.055 1.00 10.51 H new ATOM 1820 N ASN A 115 9.734 1.685 3.863 1.00 4.12 N ATOM 1821 CA ASN A 115 9.736 2.975 4.545 1.00 71.54 C ATOM 1822 C ASN A 115 9.963 4.113 3.556 1.00 45.42 C ATOM 1823 O ASN A 115 9.333 5.166 3.651 1.00 42.32 O ATOM 1824 CB ASN A 115 10.818 3.000 5.627 1.00 13.21 C ATOM 1825 CG ASN A 115 10.298 2.541 6.975 1.00 43.10 C ATOM 1826 OD1 ASN A 115 9.145 2.790 7.326 1.00 74.00 O ATOM 1827 ND2 ASN A 115 11.149 1.865 7.739 1.00 43.30 N ATOM 0 H ASN A 115 10.297 0.966 4.317 1.00 4.12 H new ATOM 0 HA ASN A 115 8.761 3.113 5.012 1.00 71.54 H new ATOM 0 HB2 ASN A 115 11.647 2.360 5.323 1.00 13.21 H new ATOM 0 HB3 ASN A 115 11.213 4.012 5.718 1.00 13.21 H new ATOM 0 HD21 ASN A 115 10.855 1.530 8.657 1.00 43.30 H new ATOM 0 HD22 ASN A 115 12.096 1.681 7.408 1.00 43.30 H new ATOM 1834 N ARG A 116 10.867 3.893 2.606 1.00 34.24 N ATOM 1835 CA ARG A 116 11.178 4.901 1.600 1.00 61.22 C ATOM 1836 C ARG A 116 9.935 5.263 0.792 1.00 45.24 C ATOM 1837 O ARG A 116 9.607 6.440 0.633 1.00 75.10 O ATOM 1838 CB ARG A 116 12.278 4.396 0.664 1.00 32.11 C ATOM 1839 CG ARG A 116 12.529 5.304 -0.528 1.00 50.14 C ATOM 1840 CD ARG A 116 13.531 6.398 -0.193 1.00 72.04 C ATOM 1841 NE ARG A 116 13.948 7.140 -1.381 1.00 34.24 N ATOM 1842 CZ ARG A 116 14.639 8.274 -1.333 1.00 74.21 C ATOM 1843 NH1 ARG A 116 14.988 8.793 -0.165 1.00 23.43 N ATOM 1844 NH2 ARG A 116 14.981 8.891 -2.457 1.00 34.11 N ATOM 0 H ARG A 116 11.396 3.026 2.512 1.00 34.24 H new ATOM 0 HA ARG A 116 11.530 5.795 2.114 1.00 61.22 H new ATOM 0 HB2 ARG A 116 13.204 4.289 1.230 1.00 32.11 H new ATOM 0 HB3 ARG A 116 12.009 3.403 0.303 1.00 32.11 H new ATOM 0 HG2 ARG A 116 12.900 4.713 -1.365 1.00 50.14 H new ATOM 0 HG3 ARG A 116 11.590 5.755 -0.848 1.00 50.14 H new ATOM 0 HD2 ARG A 116 13.089 7.086 0.528 1.00 72.04 H new ATOM 0 HD3 ARG A 116 14.406 5.955 0.284 1.00 72.04 H new ATOM 0 HE ARG A 116 13.695 6.767 -2.296 1.00 34.24 H new ATOM 0 HH11 ARG A 116 14.726 8.322 0.701 1.00 23.43 H new ATOM 0 HH12 ARG A 116 15.518 9.664 -0.132 1.00 23.43 H new ATOM 0 HH21 ARG A 116 14.713 8.495 -3.358 1.00 34.11 H new ATOM 0 HH22 ARG A 116 15.511 9.761 -2.420 1.00 34.11 H new ATOM 1858 N LEU A 117 9.249 4.246 0.283 1.00 43.45 N ATOM 1859 CA LEU A 117 8.043 4.458 -0.510 1.00 61.32 C ATOM 1860 C LEU A 117 6.951 5.119 0.326 1.00 43.33 C ATOM 1861 O LEU A 117 6.420 6.166 -0.045 1.00 52.00 O ATOM 1862 CB LEU A 117 7.536 3.126 -1.068 1.00 43.24 C ATOM 1863 CG LEU A 117 6.366 3.212 -2.048 1.00 54.41 C ATOM 1864 CD1 LEU A 117 5.057 3.408 -1.300 1.00 51.34 C ATOM 1865 CD2 LEU A 117 6.586 4.340 -3.046 1.00 73.43 C ATOM 0 H LEU A 117 9.507 3.267 0.405 1.00 43.45 H new ATOM 0 HA LEU A 117 8.294 5.121 -1.338 1.00 61.32 H new ATOM 0 HB2 LEU A 117 8.365 2.624 -1.566 1.00 43.24 H new ATOM 0 HB3 LEU A 117 7.238 2.494 -0.231 1.00 43.24 H new ATOM 0 HG LEU A 117 6.310 2.273 -2.599 1.00 54.41 H new ATOM 0 HD11 LEU A 117 4.235 3.467 -2.014 1.00 51.34 H new ATOM 0 HD12 LEU A 117 4.893 2.567 -0.627 1.00 51.34 H new ATOM 0 HD13 LEU A 117 5.103 4.331 -0.722 1.00 51.34 H new ATOM 0 HD21 LEU A 117 5.743 4.386 -3.735 1.00 73.43 H new ATOM 0 HD22 LEU A 117 6.670 5.287 -2.512 1.00 73.43 H new ATOM 0 HD23 LEU A 117 7.503 4.157 -3.606 1.00 73.43 H new ATOM 1877 N VAL A 118 6.624 4.503 1.457 1.00 73.00 N ATOM 1878 CA VAL A 118 5.598 5.033 2.347 1.00 44.03 C ATOM 1879 C VAL A 118 5.909 6.470 2.748 1.00 4.35 C ATOM 1880 O VAL A 118 5.076 7.363 2.590 1.00 25.14 O ATOM 1881 CB VAL A 118 5.460 4.174 3.618 1.00 14.42 C ATOM 1882 CG1 VAL A 118 4.588 4.880 4.647 1.00 62.30 C ATOM 1883 CG2 VAL A 118 4.894 2.804 3.277 1.00 0.22 C ATOM 0 H VAL A 118 7.055 3.636 1.779 1.00 73.00 H new ATOM 0 HA VAL A 118 4.657 5.008 1.797 1.00 44.03 H new ATOM 0 HB VAL A 118 6.451 4.034 4.051 1.00 14.42 H new ATOM 0 HG11 VAL A 118 4.501 4.259 5.538 1.00 62.30 H new ATOM 0 HG12 VAL A 118 5.040 5.835 4.913 1.00 62.30 H new ATOM 0 HG13 VAL A 118 3.597 5.052 4.227 1.00 62.30 H new ATOM 0 HG21 VAL A 118 4.803 2.211 4.187 1.00 0.22 H new ATOM 0 HG22 VAL A 118 3.911 2.920 2.820 1.00 0.22 H new ATOM 0 HG23 VAL A 118 5.561 2.298 2.579 1.00 0.22 H new ATOM 1893 N GLN A 119 7.113 6.687 3.268 1.00 23.11 N ATOM 1894 CA GLN A 119 7.534 8.017 3.692 1.00 25.03 C ATOM 1895 C GLN A 119 7.284 9.044 2.593 1.00 22.41 C ATOM 1896 O GLN A 119 6.916 10.186 2.868 1.00 63.15 O ATOM 1897 CB GLN A 119 9.016 8.009 4.072 1.00 23.42 C ATOM 1898 CG GLN A 119 9.275 7.559 5.501 1.00 25.22 C ATOM 1899 CD GLN A 119 9.937 8.634 6.340 1.00 1.30 C ATOM 1900 OE1 GLN A 119 10.035 9.789 5.925 1.00 15.44 O ATOM 1901 NE2 GLN A 119 10.397 8.260 7.528 1.00 20.33 N ATOM 0 H GLN A 119 7.814 5.959 3.406 1.00 23.11 H new ATOM 0 HA GLN A 119 6.944 8.296 4.565 1.00 25.03 H new ATOM 0 HB2 GLN A 119 9.554 7.351 3.390 1.00 23.42 H new ATOM 0 HB3 GLN A 119 9.423 9.011 3.936 1.00 23.42 H new ATOM 0 HG2 GLN A 119 8.331 7.272 5.964 1.00 25.22 H new ATOM 0 HG3 GLN A 119 9.908 6.671 5.489 1.00 25.22 H new ATOM 0 HE21 GLN A 119 10.295 7.292 7.833 1.00 20.33 H new ATOM 0 HE22 GLN A 119 10.853 8.941 8.136 1.00 20.33 H new ATOM 1910 N THR A 120 7.487 8.630 1.346 1.00 24.44 N ATOM 1911 CA THR A 120 7.285 9.513 0.205 1.00 0.20 C ATOM 1912 C THR A 120 5.821 9.917 0.074 1.00 24.20 C ATOM 1913 O THR A 120 5.508 11.082 -0.168 1.00 50.34 O ATOM 1914 CB THR A 120 7.742 8.849 -1.107 1.00 43.34 C ATOM 1915 OG1 THR A 120 9.054 8.299 -0.948 1.00 23.33 O ATOM 1916 CG2 THR A 120 7.744 9.853 -2.250 1.00 64.01 C ATOM 0 H THR A 120 7.791 7.688 1.101 1.00 24.44 H new ATOM 0 HA THR A 120 7.890 10.402 0.383 1.00 0.20 H new ATOM 0 HB THR A 120 7.040 8.050 -1.346 1.00 43.34 H new ATOM 0 HG1 THR A 120 8.986 7.385 -0.600 1.00 23.33 H new ATOM 0 HG21 THR A 120 8.070 9.361 -3.166 1.00 64.01 H new ATOM 0 HG22 THR A 120 6.738 10.248 -2.389 1.00 64.01 H new ATOM 0 HG23 THR A 120 8.425 10.671 -2.015 1.00 64.01 H new ATOM 1924 N ALA A 121 4.928 8.946 0.237 1.00 54.45 N ATOM 1925 CA ALA A 121 3.496 9.202 0.139 1.00 45.10 C ATOM 1926 C ALA A 121 2.987 9.950 1.367 1.00 61.33 C ATOM 1927 O ALA A 121 1.914 10.549 1.338 1.00 11.33 O ATOM 1928 CB ALA A 121 2.738 7.895 -0.037 1.00 53.45 C ATOM 0 H ALA A 121 5.171 7.976 0.437 1.00 54.45 H new ATOM 0 HA ALA A 121 3.323 9.831 -0.734 1.00 45.10 H new ATOM 0 HB1 ALA A 121 1.670 8.101 -0.109 1.00 53.45 H new ATOM 0 HB2 ALA A 121 3.074 7.399 -0.948 1.00 53.45 H new ATOM 0 HB3 ALA A 121 2.926 7.247 0.819 1.00 53.45 H new ATOM 1934 N GLU A 122 3.765 9.909 2.444 1.00 62.51 N ATOM 1935 CA GLU A 122 3.391 10.581 3.683 1.00 70.10 C ATOM 1936 C GLU A 122 2.206 9.883 4.344 1.00 23.32 C ATOM 1937 O GLU A 122 1.270 10.532 4.812 1.00 53.43 O ATOM 1938 CB GLU A 122 3.045 12.046 3.409 1.00 42.20 C ATOM 1939 CG GLU A 122 3.078 12.922 4.650 1.00 1.14 C ATOM 1940 CD GLU A 122 4.258 13.874 4.661 1.00 30.45 C ATOM 1941 OE1 GLU A 122 4.650 14.345 3.573 1.00 3.14 O ATOM 1942 OE2 GLU A 122 4.790 14.148 5.758 1.00 72.24 O ATOM 0 H GLU A 122 4.658 9.418 2.484 1.00 62.51 H new ATOM 0 HA GLU A 122 4.242 10.536 4.362 1.00 70.10 H new ATOM 0 HB2 GLU A 122 3.745 12.445 2.675 1.00 42.20 H new ATOM 0 HB3 GLU A 122 2.051 12.099 2.964 1.00 42.20 H new ATOM 0 HG2 GLU A 122 2.153 13.495 4.710 1.00 1.14 H new ATOM 0 HG3 GLU A 122 3.119 12.289 5.536 1.00 1.14 H new ATOM 1949 N LEU A 123 2.254 8.556 4.381 1.00 44.14 N ATOM 1950 CA LEU A 123 1.185 7.768 4.984 1.00 45.30 C ATOM 1951 C LEU A 123 1.574 7.308 6.386 1.00 73.12 C ATOM 1952 O LEU A 123 2.146 6.232 6.562 1.00 21.31 O ATOM 1953 CB LEU A 123 0.861 6.557 4.109 1.00 71.23 C ATOM 1954 CG LEU A 123 0.469 6.860 2.662 1.00 72.14 C ATOM 1955 CD1 LEU A 123 0.828 5.692 1.756 1.00 61.21 C ATOM 1956 CD2 LEU A 123 -1.016 7.174 2.566 1.00 34.53 C ATOM 0 H LEU A 123 3.022 8.003 4.000 1.00 44.14 H new ATOM 0 HA LEU A 123 0.300 8.399 5.060 1.00 45.30 H new ATOM 0 HB2 LEU A 123 1.730 5.899 4.099 1.00 71.23 H new ATOM 0 HB3 LEU A 123 0.047 6.003 4.577 1.00 71.23 H new ATOM 0 HG LEU A 123 1.027 7.736 2.331 1.00 72.14 H new ATOM 0 HD11 LEU A 123 0.542 5.926 0.731 1.00 61.21 H new ATOM 0 HD12 LEU A 123 1.902 5.513 1.801 1.00 61.21 H new ATOM 0 HD13 LEU A 123 0.297 4.799 2.086 1.00 61.21 H new ATOM 0 HD21 LEU A 123 -1.277 7.387 1.529 1.00 34.53 H new ATOM 0 HD22 LEU A 123 -1.592 6.318 2.916 1.00 34.53 H new ATOM 0 HD23 LEU A 123 -1.245 8.043 3.183 1.00 34.53 H new ATOM 1968 N THR A 124 1.256 8.128 7.382 1.00 54.30 N ATOM 1969 CA THR A 124 1.570 7.806 8.768 1.00 4.14 C ATOM 1970 C THR A 124 0.956 6.471 9.175 1.00 52.11 C ATOM 1971 O THR A 124 1.426 5.816 10.105 1.00 51.33 O ATOM 1972 CB THR A 124 1.070 8.902 9.728 1.00 33.10 C ATOM 1973 OG1 THR A 124 1.480 8.605 11.068 1.00 64.45 O ATOM 1974 CG2 THR A 124 -0.445 9.021 9.671 1.00 51.25 C ATOM 0 H THR A 124 0.781 9.021 7.254 1.00 54.30 H new ATOM 0 HA THR A 124 2.656 7.740 8.838 1.00 4.14 H new ATOM 0 HB THR A 124 1.505 9.852 9.418 1.00 33.10 H new ATOM 0 HG1 THR A 124 1.159 9.307 11.671 1.00 64.45 H new ATOM 0 HG21 THR A 124 -0.775 9.801 10.357 1.00 51.25 H new ATOM 0 HG22 THR A 124 -0.752 9.276 8.657 1.00 51.25 H new ATOM 0 HG23 THR A 124 -0.896 8.071 9.958 1.00 51.25 H new ATOM 1982 N LYS A 125 -0.099 6.072 8.472 1.00 21.10 N ATOM 1983 CA LYS A 125 -0.779 4.814 8.757 1.00 5.34 C ATOM 1984 C LYS A 125 -0.432 3.759 7.711 1.00 11.33 C ATOM 1985 O LYS A 125 -1.035 3.713 6.639 1.00 13.12 O ATOM 1986 CB LYS A 125 -2.293 5.027 8.801 1.00 64.12 C ATOM 1987 CG LYS A 125 -2.730 6.088 9.797 1.00 41.24 C ATOM 1988 CD LYS A 125 -3.779 5.553 10.757 1.00 22.50 C ATOM 1989 CE LYS A 125 -4.902 6.557 10.971 1.00 71.40 C ATOM 1990 NZ LYS A 125 -4.612 7.479 12.103 1.00 71.11 N ATOM 0 H LYS A 125 -0.502 6.603 7.700 1.00 21.10 H new ATOM 0 HA LYS A 125 -0.441 4.459 9.731 1.00 5.34 H new ATOM 0 HB2 LYS A 125 -2.641 5.309 7.807 1.00 64.12 H new ATOM 0 HB3 LYS A 125 -2.777 4.083 9.053 1.00 64.12 H new ATOM 0 HG2 LYS A 125 -1.865 6.438 10.360 1.00 41.24 H new ATOM 0 HG3 LYS A 125 -3.131 6.948 9.261 1.00 41.24 H new ATOM 0 HD2 LYS A 125 -4.191 4.623 10.366 1.00 22.50 H new ATOM 0 HD3 LYS A 125 -3.312 5.318 11.714 1.00 22.50 H new ATOM 0 HE2 LYS A 125 -5.050 7.136 10.060 1.00 71.40 H new ATOM 0 HE3 LYS A 125 -5.833 6.025 11.165 1.00 71.40 H new ATOM 0 HZ1 LYS A 125 -5.400 8.148 12.217 1.00 71.11 H new ATOM 0 HZ2 LYS A 125 -4.496 6.929 12.978 1.00 71.11 H new ATOM 0 HZ3 LYS A 125 -3.737 8.006 11.906 1.00 71.11 H new ATOM 2004 N VAL A 126 0.542 2.912 8.031 1.00 74.21 N ATOM 2005 CA VAL A 126 0.965 1.856 7.120 1.00 24.12 C ATOM 2006 C VAL A 126 0.788 0.480 7.752 1.00 13.22 C ATOM 2007 O VAL A 126 1.562 0.079 8.621 1.00 3.31 O ATOM 2008 CB VAL A 126 2.438 2.032 6.705 1.00 65.42 C ATOM 2009 CG1 VAL A 126 3.260 2.568 7.866 1.00 62.44 C ATOM 2010 CG2 VAL A 126 3.010 0.715 6.200 1.00 75.03 C ATOM 0 H VAL A 126 1.052 2.937 8.914 1.00 74.21 H new ATOM 0 HA VAL A 126 0.333 1.929 6.235 1.00 24.12 H new ATOM 0 HB VAL A 126 2.484 2.758 5.893 1.00 65.42 H new ATOM 0 HG11 VAL A 126 4.298 2.686 7.553 1.00 62.44 H new ATOM 0 HG12 VAL A 126 2.863 3.534 8.177 1.00 62.44 H new ATOM 0 HG13 VAL A 126 3.210 1.869 8.701 1.00 62.44 H new ATOM 0 HG21 VAL A 126 4.051 0.858 5.911 1.00 75.03 H new ATOM 0 HG22 VAL A 126 2.952 -0.034 6.990 1.00 75.03 H new ATOM 0 HG23 VAL A 126 2.437 0.377 5.337 1.00 75.03 H new ATOM 2020 N PHE A 127 -0.238 -0.240 7.311 1.00 42.44 N ATOM 2021 CA PHE A 127 -0.519 -1.572 7.833 1.00 10.33 C ATOM 2022 C PHE A 127 0.150 -2.643 6.979 1.00 61.53 C ATOM 2023 O PHE A 127 0.583 -2.378 5.858 1.00 61.13 O ATOM 2024 CB PHE A 127 -2.029 -1.815 7.885 1.00 1.30 C ATOM 2025 CG PHE A 127 -2.819 -0.597 8.273 1.00 24.04 C ATOM 2026 CD1 PHE A 127 -2.365 0.250 9.271 1.00 1.14 C ATOM 2027 CD2 PHE A 127 -4.015 -0.300 7.639 1.00 1.44 C ATOM 2028 CE1 PHE A 127 -3.091 1.370 9.630 1.00 3.40 C ATOM 2029 CE2 PHE A 127 -4.744 0.820 7.994 1.00 23.35 C ATOM 2030 CZ PHE A 127 -4.280 1.656 8.991 1.00 53.35 C ATOM 0 H PHE A 127 -0.889 0.077 6.593 1.00 42.44 H new ATOM 0 HA PHE A 127 -0.113 -1.632 8.843 1.00 10.33 H new ATOM 0 HB2 PHE A 127 -2.367 -2.162 6.908 1.00 1.30 H new ATOM 0 HB3 PHE A 127 -2.236 -2.614 8.596 1.00 1.30 H new ATOM 0 HD1 PHE A 127 -1.434 0.033 9.774 1.00 1.14 H new ATOM 0 HD2 PHE A 127 -4.382 -0.951 6.859 1.00 1.44 H new ATOM 0 HE1 PHE A 127 -2.728 2.021 10.411 1.00 3.40 H new ATOM 0 HE2 PHE A 127 -5.675 1.041 7.493 1.00 23.35 H new ATOM 0 HZ PHE A 127 -4.847 2.532 9.270 1.00 53.35 H new ATOM 2040 N GLU A 128 0.233 -3.856 7.518 1.00 75.12 N ATOM 2041 CA GLU A 128 0.850 -4.968 6.806 1.00 23.12 C ATOM 2042 C GLU A 128 -0.073 -6.182 6.785 1.00 75.15 C ATOM 2043 O GLU A 128 -0.734 -6.489 7.777 1.00 74.34 O ATOM 2044 CB GLU A 128 2.184 -5.341 7.457 1.00 44.35 C ATOM 2045 CG GLU A 128 3.132 -6.076 6.524 1.00 64.05 C ATOM 2046 CD GLU A 128 4.414 -6.502 7.211 1.00 24.11 C ATOM 2047 OE1 GLU A 128 5.061 -5.641 7.845 1.00 43.24 O ATOM 2048 OE2 GLU A 128 4.772 -7.695 7.116 1.00 11.43 O ATOM 0 H GLU A 128 -0.120 -4.093 8.445 1.00 75.12 H new ATOM 0 HA GLU A 128 1.029 -4.652 5.778 1.00 23.12 H new ATOM 0 HB2 GLU A 128 2.671 -4.433 7.815 1.00 44.35 H new ATOM 0 HB3 GLU A 128 1.991 -5.964 8.330 1.00 44.35 H new ATOM 0 HG2 GLU A 128 2.630 -6.956 6.122 1.00 64.05 H new ATOM 0 HG3 GLU A 128 3.374 -5.433 5.678 1.00 64.05 H new ATOM 2055 N ILE A 129 -0.115 -6.867 5.646 1.00 10.31 N ATOM 2056 CA ILE A 129 -0.958 -8.047 5.496 1.00 52.34 C ATOM 2057 C ILE A 129 -0.126 -9.274 5.139 1.00 14.54 C ATOM 2058 O ILE A 129 0.601 -9.277 4.146 1.00 12.22 O ATOM 2059 CB ILE A 129 -2.032 -7.836 4.412 1.00 71.15 C ATOM 2060 CG1 ILE A 129 -1.415 -7.191 3.169 1.00 13.23 C ATOM 2061 CG2 ILE A 129 -3.168 -6.979 4.952 1.00 74.43 C ATOM 2062 CD1 ILE A 129 -2.236 -7.389 1.915 1.00 71.04 C ATOM 0 H ILE A 129 0.424 -6.625 4.815 1.00 10.31 H new ATOM 0 HA ILE A 129 -1.448 -8.210 6.456 1.00 52.34 H new ATOM 0 HB ILE A 129 -2.438 -8.808 4.130 1.00 71.15 H new ATOM 0 HG12 ILE A 129 -1.291 -6.123 3.347 1.00 13.23 H new ATOM 0 HG13 ILE A 129 -0.419 -7.605 3.011 1.00 13.23 H new ATOM 0 HG21 ILE A 129 -3.919 -6.839 4.175 1.00 74.43 H new ATOM 0 HG22 ILE A 129 -3.622 -7.475 5.810 1.00 74.43 H new ATOM 0 HG23 ILE A 129 -2.778 -6.009 5.259 1.00 74.43 H new ATOM 0 HD11 ILE A 129 -1.738 -6.906 1.074 1.00 71.04 H new ATOM 0 HD12 ILE A 129 -2.339 -8.455 1.712 1.00 71.04 H new ATOM 0 HD13 ILE A 129 -3.224 -6.949 2.054 1.00 71.04 H new ATOM 2074 N ARG A 130 -0.240 -10.316 5.956 1.00 55.10 N ATOM 2075 CA ARG A 130 0.500 -11.551 5.727 1.00 40.22 C ATOM 2076 C ARG A 130 -0.024 -12.278 4.491 1.00 3.45 C ATOM 2077 O ARG A 130 0.705 -13.033 3.846 1.00 1.41 O ATOM 2078 CB ARG A 130 0.401 -12.465 6.949 1.00 1.32 C ATOM 2079 CG ARG A 130 0.790 -13.906 6.666 1.00 22.43 C ATOM 2080 CD ARG A 130 2.252 -14.019 6.262 1.00 45.14 C ATOM 2081 NE ARG A 130 3.114 -14.315 7.403 1.00 43.51 N ATOM 2082 CZ ARG A 130 4.426 -14.500 7.304 1.00 45.31 C ATOM 2083 NH1 ARG A 130 5.023 -14.419 6.122 1.00 23.55 N ATOM 2084 NH2 ARG A 130 5.143 -14.764 8.389 1.00 64.45 N ATOM 0 H ARG A 130 -0.838 -10.329 6.782 1.00 55.10 H new ATOM 0 HA ARG A 130 1.545 -11.292 5.560 1.00 40.22 H new ATOM 0 HB2 ARG A 130 1.043 -12.073 7.738 1.00 1.32 H new ATOM 0 HB3 ARG A 130 -0.621 -12.441 7.328 1.00 1.32 H new ATOM 0 HG2 ARG A 130 0.608 -14.514 7.552 1.00 22.43 H new ATOM 0 HG3 ARG A 130 0.160 -14.305 5.871 1.00 22.43 H new ATOM 0 HD2 ARG A 130 2.361 -14.803 5.512 1.00 45.14 H new ATOM 0 HD3 ARG A 130 2.573 -13.087 5.798 1.00 45.14 H new ATOM 0 HE ARG A 130 2.686 -14.383 8.326 1.00 43.51 H new ATOM 0 HH11 ARG A 130 4.475 -14.214 5.287 1.00 23.55 H new ATOM 0 HH12 ARG A 130 6.030 -14.561 6.049 1.00 23.55 H new ATOM 0 HH21 ARG A 130 4.687 -14.825 9.299 1.00 64.45 H new ATOM 0 HH22 ARG A 130 6.150 -14.906 8.313 1.00 64.45 H new ATOM 2098 N THR A 131 -1.292 -12.046 4.167 1.00 0.31 N ATOM 2099 CA THR A 131 -1.913 -12.679 3.011 1.00 14.44 C ATOM 2100 C THR A 131 -3.111 -11.873 2.520 1.00 35.23 C ATOM 2101 O THR A 131 -3.885 -11.343 3.318 1.00 34.52 O ATOM 2102 CB THR A 131 -2.373 -14.113 3.335 1.00 31.54 C ATOM 2103 OG1 THR A 131 -3.112 -14.652 2.234 1.00 42.01 O ATOM 2104 CG2 THR A 131 -3.234 -14.135 4.590 1.00 21.20 C ATOM 0 H THR A 131 -1.909 -11.424 4.689 1.00 0.31 H new ATOM 0 HA THR A 131 -1.157 -12.716 2.227 1.00 14.44 H new ATOM 0 HB THR A 131 -1.487 -14.724 3.510 1.00 31.54 H new ATOM 0 HG1 THR A 131 -3.399 -15.564 2.448 1.00 42.01 H new ATOM 0 HG21 THR A 131 -3.547 -15.158 4.799 1.00 21.20 H new ATOM 0 HG22 THR A 131 -2.658 -13.752 5.433 1.00 21.20 H new ATOM 0 HG23 THR A 131 -4.114 -13.510 4.438 1.00 21.20 H new ATOM 2112 N THR A 132 -3.258 -11.783 1.202 1.00 71.30 N ATOM 2113 CA THR A 132 -4.361 -11.041 0.606 1.00 61.43 C ATOM 2114 C THR A 132 -5.631 -11.177 1.439 1.00 25.32 C ATOM 2115 O THR A 132 -6.330 -10.195 1.685 1.00 20.22 O ATOM 2116 CB THR A 132 -4.650 -11.522 -0.829 1.00 52.13 C ATOM 2117 OG1 THR A 132 -4.750 -12.950 -0.857 1.00 10.30 O ATOM 2118 CG2 THR A 132 -3.555 -11.067 -1.783 1.00 30.13 C ATOM 0 H THR A 132 -2.627 -12.215 0.527 1.00 71.30 H new ATOM 0 HA THR A 132 -4.058 -9.994 0.578 1.00 61.43 H new ATOM 0 HB THR A 132 -5.596 -11.086 -1.151 1.00 52.13 H new ATOM 0 HG1 THR A 132 -4.935 -13.247 -1.772 1.00 10.30 H new ATOM 0 HG21 THR A 132 -3.781 -11.418 -2.790 1.00 30.13 H new ATOM 0 HG22 THR A 132 -3.501 -9.978 -1.782 1.00 30.13 H new ATOM 0 HG23 THR A 132 -2.598 -11.478 -1.461 1.00 30.13 H new ATOM 2126 N ASP A 133 -5.920 -12.399 1.872 1.00 74.32 N ATOM 2127 CA ASP A 133 -7.105 -12.663 2.679 1.00 14.35 C ATOM 2128 C ASP A 133 -7.283 -11.589 3.750 1.00 72.33 C ATOM 2129 O ASP A 133 -8.374 -11.043 3.919 1.00 4.11 O ATOM 2130 CB ASP A 133 -7.006 -14.041 3.334 1.00 21.55 C ATOM 2131 CG ASP A 133 -7.204 -15.169 2.342 1.00 65.22 C ATOM 2132 OD1 ASP A 133 -8.371 -15.507 2.052 1.00 70.20 O ATOM 2133 OD2 ASP A 133 -6.192 -15.715 1.855 1.00 43.31 O ATOM 0 H ASP A 133 -5.350 -13.222 1.678 1.00 74.32 H new ATOM 0 HA ASP A 133 -7.974 -12.644 2.021 1.00 14.35 H new ATOM 0 HB2 ASP A 133 -6.030 -14.145 3.808 1.00 21.55 H new ATOM 0 HB3 ASP A 133 -7.754 -14.120 4.123 1.00 21.55 H new ATOM 2138 N ASP A 134 -6.206 -11.294 4.468 1.00 13.13 N ATOM 2139 CA ASP A 134 -6.243 -10.286 5.522 1.00 43.33 C ATOM 2140 C ASP A 134 -6.971 -9.031 5.048 1.00 24.35 C ATOM 2141 O ASP A 134 -7.837 -8.502 5.746 1.00 5.13 O ATOM 2142 CB ASP A 134 -4.823 -9.930 5.967 1.00 61.14 C ATOM 2143 CG ASP A 134 -4.714 -9.756 7.468 1.00 31.34 C ATOM 2144 OD1 ASP A 134 -5.129 -10.676 8.205 1.00 40.34 O ATOM 2145 OD2 ASP A 134 -4.212 -8.701 7.907 1.00 31.14 O ATOM 0 H ASP A 134 -5.297 -11.738 4.340 1.00 13.13 H new ATOM 0 HA ASP A 134 -6.787 -10.702 6.370 1.00 43.33 H new ATOM 0 HB2 ASP A 134 -4.137 -10.713 5.644 1.00 61.14 H new ATOM 0 HB3 ASP A 134 -4.511 -9.010 5.474 1.00 61.14 H new ATOM 2150 N LEU A 135 -6.613 -8.560 3.859 1.00 44.32 N ATOM 2151 CA LEU A 135 -7.230 -7.366 3.292 1.00 52.04 C ATOM 2152 C LEU A 135 -8.751 -7.495 3.275 1.00 5.44 C ATOM 2153 O LEU A 135 -9.339 -7.900 2.272 1.00 31.22 O ATOM 2154 CB LEU A 135 -6.712 -7.125 1.873 1.00 73.00 C ATOM 2155 CG LEU A 135 -7.473 -6.086 1.047 1.00 13.13 C ATOM 2156 CD1 LEU A 135 -8.041 -5.001 1.949 1.00 53.14 C ATOM 2157 CD2 LEU A 135 -6.567 -5.481 -0.014 1.00 54.32 C ATOM 0 H LEU A 135 -5.899 -8.986 3.269 1.00 44.32 H new ATOM 0 HA LEU A 135 -6.962 -6.516 3.919 1.00 52.04 H new ATOM 0 HB2 LEU A 135 -5.669 -6.816 1.936 1.00 73.00 H new ATOM 0 HB3 LEU A 135 -6.732 -8.073 1.335 1.00 73.00 H new ATOM 0 HG LEU A 135 -8.303 -6.584 0.545 1.00 13.13 H new ATOM 0 HD11 LEU A 135 -8.579 -4.270 1.345 1.00 53.14 H new ATOM 0 HD12 LEU A 135 -8.724 -5.449 2.671 1.00 53.14 H new ATOM 0 HD13 LEU A 135 -7.227 -4.505 2.479 1.00 53.14 H new ATOM 0 HD21 LEU A 135 -7.125 -4.744 -0.592 1.00 54.32 H new ATOM 0 HD22 LEU A 135 -5.717 -4.997 0.467 1.00 54.32 H new ATOM 0 HD23 LEU A 135 -6.209 -6.268 -0.678 1.00 54.32 H new ATOM 2169 N THR A 136 -9.381 -7.145 4.392 1.00 31.40 N ATOM 2170 CA THR A 136 -10.832 -7.221 4.506 1.00 71.00 C ATOM 2171 C THR A 136 -11.416 -5.894 4.975 1.00 11.42 C ATOM 2172 O THR A 136 -10.755 -5.127 5.673 1.00 1.15 O ATOM 2173 CB THR A 136 -11.262 -8.332 5.483 1.00 60.12 C ATOM 2174 OG1 THR A 136 -10.278 -8.488 6.511 1.00 3.43 O ATOM 2175 CG2 THR A 136 -11.452 -9.652 4.752 1.00 72.22 C ATOM 0 H THR A 136 -8.909 -6.806 5.230 1.00 31.40 H new ATOM 0 HA THR A 136 -11.215 -7.453 3.512 1.00 71.00 H new ATOM 0 HB THR A 136 -12.213 -8.043 5.931 1.00 60.12 H new ATOM 0 HG1 THR A 136 -9.457 -8.858 6.124 1.00 3.43 H new ATOM 0 HG21 THR A 136 -11.755 -10.421 5.462 1.00 72.22 H new ATOM 0 HG22 THR A 136 -12.223 -9.538 3.990 1.00 72.22 H new ATOM 0 HG23 THR A 136 -10.514 -9.944 4.279 1.00 72.22 H new ATOM 2183 N GLU A 137 -12.660 -5.629 4.586 1.00 70.21 N ATOM 2184 CA GLU A 137 -13.332 -4.394 4.967 1.00 54.41 C ATOM 2185 C GLU A 137 -13.186 -4.134 6.464 1.00 30.22 C ATOM 2186 O GLU A 137 -13.020 -2.992 6.895 1.00 31.23 O ATOM 2187 CB GLU A 137 -14.815 -4.456 4.591 1.00 24.12 C ATOM 2188 CG GLU A 137 -15.556 -3.149 4.818 1.00 25.02 C ATOM 2189 CD GLU A 137 -17.061 -3.310 4.731 1.00 20.22 C ATOM 2190 OE1 GLU A 137 -17.663 -3.810 5.704 1.00 2.51 O ATOM 2191 OE2 GLU A 137 -17.638 -2.935 3.688 1.00 5.41 O ATOM 0 H GLU A 137 -13.222 -6.254 4.007 1.00 70.21 H new ATOM 0 HA GLU A 137 -12.862 -3.573 4.426 1.00 54.41 H new ATOM 0 HB2 GLU A 137 -14.904 -4.736 3.541 1.00 24.12 H new ATOM 0 HB3 GLU A 137 -15.296 -5.242 5.173 1.00 24.12 H new ATOM 0 HG2 GLU A 137 -15.293 -2.752 5.798 1.00 25.02 H new ATOM 0 HG3 GLU A 137 -15.229 -2.417 4.079 1.00 25.02 H new ATOM 2198 N THR A 138 -13.250 -5.202 7.253 1.00 40.15 N ATOM 2199 CA THR A 138 -13.127 -5.092 8.701 1.00 43.20 C ATOM 2200 C THR A 138 -11.681 -4.840 9.112 1.00 1.32 C ATOM 2201 O THR A 138 -11.357 -3.789 9.666 1.00 54.24 O ATOM 2202 CB THR A 138 -13.635 -6.362 9.406 1.00 22.53 C ATOM 2203 OG1 THR A 138 -14.965 -6.667 8.970 1.00 22.13 O ATOM 2204 CG2 THR A 138 -13.619 -6.186 10.917 1.00 11.31 C ATOM 0 H THR A 138 -13.386 -6.154 6.913 1.00 40.15 H new ATOM 0 HA THR A 138 -13.742 -4.246 9.007 1.00 43.20 H new ATOM 0 HB THR A 138 -12.970 -7.185 9.145 1.00 22.53 H new ATOM 0 HG1 THR A 138 -15.280 -7.477 9.422 1.00 22.13 H new ATOM 0 HG21 THR A 138 -13.982 -7.097 11.393 1.00 11.31 H new ATOM 0 HG22 THR A 138 -12.601 -5.984 11.249 1.00 11.31 H new ATOM 0 HG23 THR A 138 -14.263 -5.351 11.193 1.00 11.31 H new ATOM 2212 N TRP A 139 -10.815 -5.808 8.836 1.00 33.15 N ATOM 2213 CA TRP A 139 -9.402 -5.690 9.178 1.00 72.11 C ATOM 2214 C TRP A 139 -8.899 -4.273 8.927 1.00 24.14 C ATOM 2215 O TRP A 139 -8.079 -3.752 9.685 1.00 5.30 O ATOM 2216 CB TRP A 139 -8.575 -6.689 8.367 1.00 35.21 C ATOM 2217 CG TRP A 139 -7.140 -6.286 8.215 1.00 63.11 C ATOM 2218 CD1 TRP A 139 -6.108 -6.594 9.054 1.00 33.41 C ATOM 2219 CD2 TRP A 139 -6.578 -5.499 7.158 1.00 15.33 C ATOM 2220 NE1 TRP A 139 -4.939 -6.046 8.584 1.00 15.21 N ATOM 2221 CE2 TRP A 139 -5.201 -5.370 7.421 1.00 30.13 C ATOM 2222 CE3 TRP A 139 -7.105 -4.893 6.015 1.00 13.53 C ATOM 2223 CZ2 TRP A 139 -4.347 -4.658 6.584 1.00 71.44 C ATOM 2224 CZ3 TRP A 139 -6.257 -4.186 5.184 1.00 63.42 C ATOM 2225 CH2 TRP A 139 -4.890 -4.075 5.471 1.00 45.23 C ATOM 0 H TRP A 139 -11.066 -6.683 8.376 1.00 33.15 H new ATOM 0 HA TRP A 139 -9.290 -5.913 10.239 1.00 72.11 H new ATOM 0 HB2 TRP A 139 -8.622 -7.665 8.850 1.00 35.21 H new ATOM 0 HB3 TRP A 139 -9.020 -6.801 7.378 1.00 35.21 H new ATOM 0 HD1 TRP A 139 -6.197 -7.182 9.955 1.00 33.41 H new ATOM 0 HE1 TRP A 139 -4.025 -6.129 9.028 1.00 15.21 H new ATOM 0 HE3 TRP A 139 -8.157 -4.976 5.785 1.00 13.53 H new ATOM 0 HZ2 TRP A 139 -3.294 -4.569 6.805 1.00 71.44 H new ATOM 0 HZ3 TRP A 139 -6.654 -3.711 4.299 1.00 63.42 H new ATOM 0 HH2 TRP A 139 -4.252 -3.518 4.801 1.00 45.23 H new ATOM 2236 N LEU A 140 -9.393 -3.653 7.862 1.00 62.35 N ATOM 2237 CA LEU A 140 -8.993 -2.295 7.512 1.00 63.21 C ATOM 2238 C LEU A 140 -9.633 -1.279 8.453 1.00 21.32 C ATOM 2239 O LEU A 140 -8.945 -0.617 9.230 1.00 2.13 O ATOM 2240 CB LEU A 140 -9.383 -1.984 6.066 1.00 72.14 C ATOM 2241 CG LEU A 140 -9.646 -0.513 5.743 1.00 14.32 C ATOM 2242 CD1 LEU A 140 -8.468 0.347 6.172 1.00 72.05 C ATOM 2243 CD2 LEU A 140 -9.929 -0.334 4.259 1.00 25.40 C ATOM 0 H LEU A 140 -10.072 -4.069 7.225 1.00 62.35 H new ATOM 0 HA LEU A 140 -7.910 -2.224 7.613 1.00 63.21 H new ATOM 0 HB2 LEU A 140 -8.589 -2.342 5.411 1.00 72.14 H new ATOM 0 HB3 LEU A 140 -10.279 -2.555 5.822 1.00 72.14 H new ATOM 0 HG LEU A 140 -10.526 -0.191 6.300 1.00 14.32 H new ATOM 0 HD11 LEU A 140 -8.674 1.391 5.934 1.00 72.05 H new ATOM 0 HD12 LEU A 140 -8.314 0.243 7.246 1.00 72.05 H new ATOM 0 HD13 LEU A 140 -7.571 0.024 5.644 1.00 72.05 H new ATOM 0 HD21 LEU A 140 -10.114 0.719 4.048 1.00 25.40 H new ATOM 0 HD22 LEU A 140 -9.070 -0.674 3.681 1.00 25.40 H new ATOM 0 HD23 LEU A 140 -10.807 -0.919 3.983 1.00 25.40 H new ATOM 2255 N LYS A 141 -10.955 -1.163 8.379 1.00 4.40 N ATOM 2256 CA LYS A 141 -11.689 -0.231 9.226 1.00 10.14 C ATOM 2257 C LYS A 141 -11.245 -0.351 10.681 1.00 60.23 C ATOM 2258 O LYS A 141 -11.457 0.559 11.480 1.00 54.21 O ATOM 2259 CB LYS A 141 -13.193 -0.490 9.118 1.00 14.13 C ATOM 2260 CG LYS A 141 -13.897 0.416 8.123 1.00 53.04 C ATOM 2261 CD LYS A 141 -15.007 -0.318 7.388 1.00 62.02 C ATOM 2262 CE LYS A 141 -16.367 -0.032 8.005 1.00 32.33 C ATOM 2263 NZ LYS A 141 -16.615 -0.865 9.214 1.00 65.52 N ATOM 0 H LYS A 141 -11.540 -1.703 7.741 1.00 4.40 H new ATOM 0 HA LYS A 141 -11.474 0.781 8.882 1.00 10.14 H new ATOM 0 HB2 LYS A 141 -13.354 -1.528 8.828 1.00 14.13 H new ATOM 0 HB3 LYS A 141 -13.647 -0.359 10.100 1.00 14.13 H new ATOM 0 HG2 LYS A 141 -14.313 1.278 8.645 1.00 53.04 H new ATOM 0 HG3 LYS A 141 -13.174 0.799 7.403 1.00 53.04 H new ATOM 0 HD2 LYS A 141 -15.011 -0.018 6.340 1.00 62.02 H new ATOM 0 HD3 LYS A 141 -14.814 -1.390 7.412 1.00 62.02 H new ATOM 0 HE2 LYS A 141 -16.430 1.023 8.272 1.00 32.33 H new ATOM 0 HE3 LYS A 141 -17.147 -0.221 7.268 1.00 32.33 H new ATOM 0 HZ1 LYS A 141 -17.552 -0.640 9.604 1.00 65.52 H new ATOM 0 HZ2 LYS A 141 -16.581 -1.872 8.955 1.00 65.52 H new ATOM 0 HZ3 LYS A 141 -15.886 -0.666 9.928 1.00 65.52 H new ATOM 2277 N GLU A 142 -10.625 -1.479 11.014 1.00 33.54 N ATOM 2278 CA GLU A 142 -10.151 -1.716 12.372 1.00 34.45 C ATOM 2279 C GLU A 142 -9.049 -0.728 12.744 1.00 40.32 C ATOM 2280 O GLU A 142 -9.161 0.003 13.729 1.00 11.12 O ATOM 2281 CB GLU A 142 -9.634 -3.150 12.513 1.00 13.33 C ATOM 2282 CG GLU A 142 -10.706 -4.146 12.922 1.00 62.14 C ATOM 2283 CD GLU A 142 -10.146 -5.318 13.702 1.00 2.02 C ATOM 2284 OE1 GLU A 142 -9.107 -5.870 13.282 1.00 2.33 O ATOM 2285 OE2 GLU A 142 -10.747 -5.684 14.735 1.00 64.45 O ATOM 0 H GLU A 142 -10.440 -2.242 10.363 1.00 33.54 H new ATOM 0 HA GLU A 142 -10.990 -1.571 13.052 1.00 34.45 H new ATOM 0 HB2 GLU A 142 -9.200 -3.466 11.564 1.00 13.33 H new ATOM 0 HB3 GLU A 142 -8.833 -3.167 13.252 1.00 13.33 H new ATOM 0 HG2 GLU A 142 -11.457 -3.638 13.527 1.00 62.14 H new ATOM 0 HG3 GLU A 142 -11.212 -4.516 12.030 1.00 62.14 H new ATOM 2292 N LYS A 143 -7.985 -0.711 11.949 1.00 63.21 N ATOM 2293 CA LYS A 143 -6.862 0.187 12.192 1.00 43.24 C ATOM 2294 C LYS A 143 -7.340 1.627 12.346 1.00 50.02 C ATOM 2295 O LYS A 143 -6.802 2.389 13.150 1.00 23.11 O ATOM 2296 CB LYS A 143 -5.851 0.094 11.047 1.00 20.32 C ATOM 2297 CG LYS A 143 -5.139 -1.246 10.972 1.00 63.14 C ATOM 2298 CD LYS A 143 -6.044 -2.328 10.407 1.00 14.42 C ATOM 2299 CE LYS A 143 -5.265 -3.321 9.559 1.00 13.51 C ATOM 2300 NZ LYS A 143 -3.987 -3.723 10.209 1.00 11.45 N ATOM 0 H LYS A 143 -7.876 -1.309 11.130 1.00 63.21 H new ATOM 0 HA LYS A 143 -6.380 -0.118 13.121 1.00 43.24 H new ATOM 0 HB2 LYS A 143 -6.365 0.276 10.103 1.00 20.32 H new ATOM 0 HB3 LYS A 143 -5.109 0.884 11.163 1.00 20.32 H new ATOM 0 HG2 LYS A 143 -4.250 -1.152 10.349 1.00 63.14 H new ATOM 0 HG3 LYS A 143 -4.801 -1.536 11.967 1.00 63.14 H new ATOM 0 HD2 LYS A 143 -6.537 -2.854 11.224 1.00 14.42 H new ATOM 0 HD3 LYS A 143 -6.828 -1.870 9.804 1.00 14.42 H new ATOM 0 HE2 LYS A 143 -5.877 -4.206 9.382 1.00 13.51 H new ATOM 0 HE3 LYS A 143 -5.054 -2.880 8.585 1.00 13.51 H new ATOM 0 HZ1 LYS A 143 -3.527 -4.463 9.641 1.00 11.45 H new ATOM 0 HZ2 LYS A 143 -3.358 -2.898 10.278 1.00 11.45 H new ATOM 0 HZ3 LYS A 143 -4.183 -4.090 11.162 1.00 11.45 H new ATOM 2314 N LEU A 144 -8.355 1.995 11.570 1.00 33.43 N ATOM 2315 CA LEU A 144 -8.908 3.344 11.621 1.00 3.23 C ATOM 2316 C LEU A 144 -9.771 3.532 12.865 1.00 23.33 C ATOM 2317 O LEU A 144 -9.660 4.539 13.563 1.00 75.13 O ATOM 2318 CB LEU A 144 -9.734 3.625 10.365 1.00 10.34 C ATOM 2319 CG LEU A 144 -9.277 2.918 9.089 1.00 40.31 C ATOM 2320 CD1 LEU A 144 -10.151 3.324 7.913 1.00 62.34 C ATOM 2321 CD2 LEU A 144 -7.815 3.228 8.801 1.00 12.45 C ATOM 0 H LEU A 144 -8.811 1.378 10.898 1.00 33.43 H new ATOM 0 HA LEU A 144 -8.078 4.049 11.668 1.00 3.23 H new ATOM 0 HB2 LEU A 144 -10.768 3.341 10.563 1.00 10.34 H new ATOM 0 HB3 LEU A 144 -9.728 4.700 10.183 1.00 10.34 H new ATOM 0 HG LEU A 144 -9.377 1.843 9.236 1.00 40.31 H new ATOM 0 HD11 LEU A 144 -9.811 2.811 7.013 1.00 62.34 H new ATOM 0 HD12 LEU A 144 -11.186 3.051 8.118 1.00 62.34 H new ATOM 0 HD13 LEU A 144 -10.083 4.402 7.764 1.00 62.34 H new ATOM 0 HD21 LEU A 144 -7.507 2.716 7.889 1.00 12.45 H new ATOM 0 HD22 LEU A 144 -7.689 4.303 8.674 1.00 12.45 H new ATOM 0 HD23 LEU A 144 -7.200 2.887 9.634 1.00 12.45 H new ATOM 2333 N ALA A 145 -10.630 2.554 13.136 1.00 42.23 N ATOM 2334 CA ALA A 145 -11.509 2.611 14.297 1.00 30.42 C ATOM 2335 C ALA A 145 -10.736 3.001 15.553 1.00 31.22 C ATOM 2336 O ALA A 145 -10.693 4.173 15.927 1.00 61.30 O ATOM 2337 CB ALA A 145 -12.204 1.272 14.498 1.00 22.31 C ATOM 0 H ALA A 145 -10.735 1.714 12.567 1.00 42.23 H new ATOM 0 HA ALA A 145 -12.263 3.377 14.114 1.00 30.42 H new ATOM 0 HB1 ALA A 145 -12.858 1.328 15.369 1.00 22.31 H new ATOM 0 HB2 ALA A 145 -12.796 1.033 13.615 1.00 22.31 H new ATOM 0 HB3 ALA A 145 -11.457 0.494 14.655 1.00 22.31 H new ATOM 2343 N SER A 146 -10.127 2.011 16.199 1.00 0.55 N ATOM 2344 CA SER A 146 -9.360 2.251 17.416 1.00 44.34 C ATOM 2345 C SER A 146 -8.450 1.066 17.727 1.00 53.21 C ATOM 2346 O SER A 146 -8.501 0.500 18.817 1.00 62.41 O ATOM 2347 CB SER A 146 -10.300 2.510 18.595 1.00 42.55 C ATOM 2348 OG SER A 146 -9.588 3.009 19.715 1.00 72.44 O ATOM 0 H SER A 146 -10.150 1.036 15.900 1.00 0.55 H new ATOM 0 HA SER A 146 -8.739 3.132 17.256 1.00 44.34 H new ATOM 0 HB2 SER A 146 -11.069 3.225 18.301 1.00 42.55 H new ATOM 0 HB3 SER A 146 -10.811 1.586 18.867 1.00 42.55 H new ATOM 0 HG SER A 146 -8.932 2.343 20.009 1.00 72.44 H new ATOM 2354 N GLY A 147 -7.618 0.697 16.758 1.00 21.30 N ATOM 2355 CA GLY A 147 -6.708 -0.419 16.947 1.00 52.34 C ATOM 2356 C GLY A 147 -5.428 -0.010 17.648 1.00 43.12 C ATOM 2357 O GLY A 147 -5.379 0.990 18.364 1.00 22.31 O ATOM 0 H GLY A 147 -7.557 1.150 15.846 1.00 21.30 H new ATOM 0 HA2 GLY A 147 -7.205 -1.195 17.529 1.00 52.34 H new ATOM 0 HA3 GLY A 147 -6.465 -0.854 15.978 1.00 52.34 H new ATOM 2361 N PRO A 148 -4.361 -0.798 17.445 1.00 41.40 N ATOM 2362 CA PRO A 148 -3.055 -0.533 18.057 1.00 71.34 C ATOM 2363 C PRO A 148 -2.379 0.701 17.469 1.00 62.12 C ATOM 2364 O PRO A 148 -1.226 0.999 17.783 1.00 33.52 O ATOM 2365 CB PRO A 148 -2.248 -1.792 17.728 1.00 61.11 C ATOM 2366 CG PRO A 148 -2.885 -2.339 16.497 1.00 11.11 C ATOM 2367 CD PRO A 148 -4.347 -2.005 16.604 1.00 62.35 C ATOM 0 HA PRO A 148 -3.139 -0.330 19.125 1.00 71.34 H new ATOM 0 HB2 PRO A 148 -1.197 -1.556 17.559 1.00 61.11 H new ATOM 0 HB3 PRO A 148 -2.285 -2.511 18.546 1.00 61.11 H new ATOM 0 HG2 PRO A 148 -2.448 -1.896 15.602 1.00 11.11 H new ATOM 0 HG3 PRO A 148 -2.735 -3.416 16.426 1.00 11.11 H new ATOM 0 HD2 PRO A 148 -4.789 -1.818 15.625 1.00 62.35 H new ATOM 0 HD3 PRO A 148 -4.913 -2.818 17.059 1.00 62.35 H new ATOM 2375 N SER A 149 -3.104 1.417 16.615 1.00 51.32 N ATOM 2376 CA SER A 149 -2.572 2.618 15.981 1.00 73.42 C ATOM 2377 C SER A 149 -1.722 3.419 16.961 1.00 4.54 C ATOM 2378 O SER A 149 -0.622 3.862 16.629 1.00 12.43 O ATOM 2379 CB SER A 149 -3.713 3.487 15.449 1.00 14.15 C ATOM 2380 OG SER A 149 -4.520 3.973 16.508 1.00 54.11 O ATOM 0 H SER A 149 -4.061 1.186 16.346 1.00 51.32 H new ATOM 0 HA SER A 149 -1.940 2.310 15.148 1.00 73.42 H new ATOM 0 HB2 SER A 149 -3.304 4.325 14.885 1.00 14.15 H new ATOM 0 HB3 SER A 149 -4.325 2.907 14.758 1.00 14.15 H new ATOM 0 HG SER A 149 -5.241 4.527 16.142 1.00 54.11 H new ATOM 2386 N SER A 150 -2.239 3.601 18.173 1.00 52.24 N ATOM 2387 CA SER A 150 -1.531 4.353 19.201 1.00 30.15 C ATOM 2388 C SER A 150 -0.045 4.006 19.201 1.00 70.52 C ATOM 2389 O SER A 150 0.359 2.955 18.704 1.00 30.11 O ATOM 2390 CB SER A 150 -2.133 4.065 20.578 1.00 23.33 C ATOM 2391 OG SER A 150 -1.911 5.145 21.468 1.00 45.21 O ATOM 0 H SER A 150 -3.146 3.237 18.466 1.00 52.24 H new ATOM 0 HA SER A 150 -1.639 5.415 18.979 1.00 30.15 H new ATOM 0 HB2 SER A 150 -3.204 3.885 20.480 1.00 23.33 H new ATOM 0 HB3 SER A 150 -1.693 3.156 20.988 1.00 23.33 H new ATOM 0 HG SER A 150 -2.307 4.937 22.340 1.00 45.21 H new ATOM 2397 N GLY A 151 0.765 4.899 19.762 1.00 32.41 N ATOM 2398 CA GLY A 151 2.197 4.670 19.816 1.00 43.22 C ATOM 2399 C GLY A 151 2.960 5.537 18.833 1.00 53.34 C ATOM 2400 O GLY A 151 3.998 6.104 19.171 1.00 12.30 O ATOM 0 H GLY A 151 0.455 5.776 20.180 1.00 32.41 H new ATOM 0 HA2 GLY A 151 2.556 4.869 20.826 1.00 43.22 H new ATOM 0 HA3 GLY A 151 2.402 3.620 19.606 1.00 43.22 H new TER 2404 GLY A 151