USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 832 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 84 ASN :FLIP amide:sc= -0.501 F(o=-2.9,f=0.4) USER MOD Set 1.2: A 102 THR OG1 : rot -137:sc= 0.902 USER MOD Set 2.1: A 63 HIS :FLIP no HE2:sc= -1.6 F(o=-7.9!,f=-4.6) USER MOD Set 2.2: A 79 TYR OH : rot -119:sc= -3.03! USER MOD Set 3.1: A 5 SER OG : rot 180:sc= -0.486 USER MOD Set 3.2: A 14 HIS : no HD1:sc= -13.3! C(o=-14!,f=-15!) USER MOD Single : A 1 VAL N :NH3+ -154:sc= -0.143 (180deg=-1.18) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -3.28! C(o=-3.3!,f=-7.4!) USER MOD Single : A 8 SER OG : rot 180:sc= 0.03 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.0191 X(o=-0.019,f=-0.18) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -20:sc= -3.71! USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 70:sc= -0.77 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.176 USER MOD Single : A 29 TYR OH : rot -100:sc= -1.96! USER MOD Single : A 30 SER OG : rot 180:sc= 0.0509 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot -62:sc= 0.935 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -50:sc= -6.91! USER MOD Single : A 40 ASN : amide:sc= -0.498 X(o=-0.5,f=-0.076) USER MOD Single : A 41 SER OG : rot 62:sc= 0.241 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -93:sc= -6.07! USER MOD Single : A 57 GLN : amide:sc= -2.26 K(o=-2.3,f=-7.2!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -120:sc= -0.189 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -18:sc= 1.17 USER MOD Single : A 73 SER OG : rot 180:sc= -0.112 USER MOD Single : A 76 LYS NZ :NH3+ -110:sc= 0 (180deg=-0.0391) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 22:sc= 0.672 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -2.98! C(o=-3!,f=-11!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 149:sc= 0.272 (180deg=0.0315) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -55:sc= -0.795! USER MOD Single : A 98 SER OG : rot -110:sc= -1.57! USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot -20:sc= 0.927 USER MOD Single : A 101 SER OG : rot 131:sc= 1.04 USER MOD Single : A 104 SER OG : rot 180:sc= -0.224 USER MOD Single : A 107 ASN : amide:sc= -2.98! C(o=-3!,f=-2.6!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.38! USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -41.437 13.938 12.406 1.00 0.00 N ATOM 2 CA VAL A 1 -40.915 13.858 11.011 1.00 0.00 C ATOM 3 C VAL A 1 -41.985 13.277 10.082 1.00 0.00 C ATOM 4 O VAL A 1 -42.138 12.077 9.969 1.00 0.00 O ATOM 5 CB VAL A 1 -39.707 12.926 11.098 1.00 0.00 C ATOM 6 CG1 VAL A 1 -39.140 12.689 9.697 1.00 0.00 C ATOM 7 CG2 VAL A 1 -38.632 13.568 11.979 1.00 0.00 C ATOM 0 H1 VAL A 1 -40.938 14.691 12.921 1.00 0.00 H new ATOM 0 H2 VAL A 1 -42.455 14.149 12.384 1.00 0.00 H new ATOM 0 H3 VAL A 1 -41.282 13.029 12.887 1.00 0.00 H new ATOM 0 HA VAL A 1 -40.646 14.835 10.609 1.00 0.00 H new ATOM 0 HB VAL A 1 -40.014 11.974 11.531 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -38.279 12.024 9.761 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -39.904 12.233 9.067 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -38.833 13.641 9.263 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -37.769 12.905 12.042 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -38.327 14.520 11.545 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -39.034 13.737 12.978 1.00 0.00 H new ATOM 19 N LYS A 2 -42.731 14.121 9.420 1.00 0.00 N ATOM 20 CA LYS A 2 -43.797 13.619 8.503 1.00 0.00 C ATOM 21 C LYS A 2 -43.182 13.066 7.215 1.00 0.00 C ATOM 22 O LYS A 2 -41.992 13.158 6.989 1.00 0.00 O ATOM 23 CB LYS A 2 -44.666 14.840 8.196 1.00 0.00 C ATOM 24 CG LYS A 2 -45.316 15.345 9.486 1.00 0.00 C ATOM 25 CD LYS A 2 -46.821 15.519 9.266 1.00 0.00 C ATOM 26 CE LYS A 2 -47.120 16.978 8.912 1.00 0.00 C ATOM 27 NZ LYS A 2 -47.839 17.525 10.096 1.00 0.00 N ATOM 0 H LYS A 2 -42.649 15.136 9.474 1.00 0.00 H new ATOM 0 HA LYS A 2 -44.371 12.808 8.952 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -44.059 15.628 7.750 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -45.434 14.579 7.468 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -45.136 14.639 10.297 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -44.869 16.294 9.784 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -47.160 14.862 8.465 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -47.366 15.233 10.165 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -46.202 17.533 8.717 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -47.731 17.048 8.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -48.077 18.523 9.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -48.712 16.982 10.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -47.230 17.452 10.936 1.00 0.00 H new ATOM 41 N CYS A 3 -43.992 12.494 6.368 1.00 0.00 N ATOM 42 CA CYS A 3 -43.473 11.932 5.089 1.00 0.00 C ATOM 43 C CYS A 3 -44.312 12.438 3.917 1.00 0.00 C ATOM 44 O CYS A 3 -45.442 12.852 4.083 1.00 0.00 O ATOM 45 CB CYS A 3 -43.615 10.419 5.233 1.00 0.00 C ATOM 46 SG CYS A 3 -43.008 9.617 3.733 1.00 0.00 S ATOM 0 H CYS A 3 -44.997 12.391 6.508 1.00 0.00 H new ATOM 0 HA CYS A 3 -42.441 12.227 4.896 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -43.052 10.070 6.099 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -44.659 10.155 5.404 1.00 0.00 H new ATOM 51 N GLN A 4 -43.768 12.406 2.735 1.00 0.00 N ATOM 52 CA GLN A 4 -44.536 12.883 1.553 1.00 0.00 C ATOM 53 C GLN A 4 -44.406 11.883 0.409 1.00 0.00 C ATOM 54 O GLN A 4 -43.730 10.879 0.517 1.00 0.00 O ATOM 55 CB GLN A 4 -43.904 14.222 1.176 1.00 0.00 C ATOM 56 CG GLN A 4 -44.262 15.269 2.234 1.00 0.00 C ATOM 57 CD GLN A 4 -43.148 15.344 3.278 1.00 0.00 C ATOM 58 OE1 GLN A 4 -43.257 14.767 4.341 1.00 0.00 O ATOM 59 NE2 GLN A 4 -42.071 16.035 3.019 1.00 0.00 N ATOM 0 H GLN A 4 -42.826 12.071 2.536 1.00 0.00 H new ATOM 0 HA GLN A 4 -45.600 12.988 1.765 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -42.821 14.118 1.103 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -44.260 14.542 0.197 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -44.400 16.243 1.764 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -45.206 15.009 2.713 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -41.979 16.520 2.126 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -41.322 16.090 3.709 1.00 0.00 H new ATOM 68 N SER A 5 -45.058 12.147 -0.682 1.00 0.00 N ATOM 69 CA SER A 5 -44.984 11.210 -1.835 1.00 0.00 C ATOM 70 C SER A 5 -43.530 10.804 -2.096 1.00 0.00 C ATOM 71 O SER A 5 -42.636 11.626 -2.057 1.00 0.00 O ATOM 72 CB SER A 5 -45.551 11.993 -3.017 1.00 0.00 C ATOM 73 OG SER A 5 -46.645 11.275 -3.573 1.00 0.00 O ATOM 0 H SER A 5 -45.640 12.971 -0.828 1.00 0.00 H new ATOM 0 HA SER A 5 -45.538 10.289 -1.657 1.00 0.00 H new ATOM 0 HB2 SER A 5 -45.877 12.981 -2.691 1.00 0.00 H new ATOM 0 HB3 SER A 5 -44.779 12.145 -3.772 1.00 0.00 H new ATOM 0 HG SER A 5 -47.013 11.775 -4.331 1.00 0.00 H new ATOM 79 N PRO A 6 -43.349 9.536 -2.345 1.00 0.00 N ATOM 80 CA PRO A 6 -41.991 8.986 -2.609 1.00 0.00 C ATOM 81 C PRO A 6 -41.461 9.460 -3.966 1.00 0.00 C ATOM 82 O PRO A 6 -42.223 9.780 -4.851 1.00 0.00 O ATOM 83 CB PRO A 6 -42.226 7.479 -2.633 1.00 0.00 C ATOM 84 CG PRO A 6 -43.659 7.326 -3.015 1.00 0.00 C ATOM 85 CD PRO A 6 -44.382 8.496 -2.406 1.00 0.00 C ATOM 0 HA PRO A 6 -41.255 9.302 -1.869 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -41.570 6.987 -3.351 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -42.026 7.031 -1.660 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -43.774 7.318 -4.099 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -44.062 6.383 -2.645 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -45.230 8.807 -3.016 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -44.772 8.257 -1.416 1.00 0.00 H new ATOM 93 N PRO A 7 -40.163 9.469 -4.087 1.00 0.00 N ATOM 94 CA PRO A 7 -39.526 9.885 -5.357 1.00 0.00 C ATOM 95 C PRO A 7 -39.679 8.776 -6.401 1.00 0.00 C ATOM 96 O PRO A 7 -40.165 7.701 -6.110 1.00 0.00 O ATOM 97 CB PRO A 7 -38.062 10.084 -4.978 1.00 0.00 C ATOM 98 CG PRO A 7 -37.849 9.223 -3.772 1.00 0.00 C ATOM 99 CD PRO A 7 -39.177 9.100 -3.066 1.00 0.00 C ATOM 0 HA PRO A 7 -39.966 10.782 -5.792 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -37.401 9.791 -5.793 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -37.851 11.130 -4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -37.476 8.241 -4.062 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -37.103 9.665 -3.112 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -39.342 8.086 -2.701 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -39.232 9.762 -2.202 1.00 0.00 H new ATOM 107 N SER A 8 -39.271 9.024 -7.613 1.00 0.00 N ATOM 108 CA SER A 8 -39.402 7.975 -8.665 1.00 0.00 C ATOM 109 C SER A 8 -38.429 6.830 -8.392 1.00 0.00 C ATOM 110 O SER A 8 -37.648 6.871 -7.462 1.00 0.00 O ATOM 111 CB SER A 8 -39.052 8.674 -9.975 1.00 0.00 C ATOM 112 OG SER A 8 -39.619 9.977 -9.978 1.00 0.00 O ATOM 0 H SER A 8 -38.854 9.902 -7.921 1.00 0.00 H new ATOM 0 HA SER A 8 -40.403 7.543 -8.692 1.00 0.00 H new ATOM 0 HB2 SER A 8 -37.970 8.736 -10.090 1.00 0.00 H new ATOM 0 HB3 SER A 8 -39.430 8.098 -10.820 1.00 0.00 H new ATOM 0 HG SER A 8 -39.394 10.430 -10.818 1.00 0.00 H new ATOM 118 N ILE A 9 -38.468 5.808 -9.199 1.00 0.00 N ATOM 119 CA ILE A 9 -37.540 4.659 -8.986 1.00 0.00 C ATOM 120 C ILE A 9 -37.009 4.123 -10.298 1.00 0.00 C ATOM 121 O ILE A 9 -37.174 4.706 -11.351 1.00 0.00 O ATOM 122 CB ILE A 9 -38.330 3.555 -8.278 1.00 0.00 C ATOM 123 CG1 ILE A 9 -39.819 3.593 -8.656 1.00 0.00 C ATOM 124 CG2 ILE A 9 -38.169 3.722 -6.778 1.00 0.00 C ATOM 125 CD1 ILE A 9 -40.235 2.212 -9.167 1.00 0.00 C ATOM 0 H ILE A 9 -39.099 5.717 -9.995 1.00 0.00 H new ATOM 0 HA ILE A 9 -36.687 4.990 -8.393 1.00 0.00 H new ATOM 0 HB ILE A 9 -37.938 2.588 -8.594 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -40.421 3.872 -7.791 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -39.994 4.347 -9.423 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -38.728 2.941 -6.263 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -37.114 3.647 -6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -38.550 4.698 -6.478 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -41.291 2.227 -9.438 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -39.639 1.953 -10.042 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -40.072 1.470 -8.385 1.00 0.00 H new ATOM 137 N SER A 10 -36.355 3.007 -10.219 1.00 0.00 N ATOM 138 CA SER A 10 -35.775 2.392 -11.432 1.00 0.00 C ATOM 139 C SER A 10 -36.798 2.370 -12.571 1.00 0.00 C ATOM 140 O SER A 10 -37.678 1.533 -12.612 1.00 0.00 O ATOM 141 CB SER A 10 -35.399 0.971 -11.016 1.00 0.00 C ATOM 142 OG SER A 10 -34.073 0.692 -11.446 1.00 0.00 O ATOM 0 H SER A 10 -36.196 2.489 -9.355 1.00 0.00 H new ATOM 0 HA SER A 10 -34.915 2.951 -11.801 1.00 0.00 H new ATOM 0 HB2 SER A 10 -35.473 0.865 -9.934 1.00 0.00 H new ATOM 0 HB3 SER A 10 -36.094 0.255 -11.455 1.00 0.00 H new ATOM 0 HG SER A 10 -33.827 -0.218 -11.179 1.00 0.00 H new ATOM 148 N ASN A 11 -36.684 3.283 -13.498 1.00 0.00 N ATOM 149 CA ASN A 11 -37.642 3.319 -14.642 1.00 0.00 C ATOM 150 C ASN A 11 -39.067 3.023 -14.164 1.00 0.00 C ATOM 151 O ASN A 11 -39.774 2.227 -14.750 1.00 0.00 O ATOM 152 CB ASN A 11 -37.159 2.225 -15.594 1.00 0.00 C ATOM 153 CG ASN A 11 -36.119 2.804 -16.555 1.00 0.00 C ATOM 154 OD1 ASN A 11 -36.360 3.807 -17.198 1.00 0.00 O ATOM 155 ND2 ASN A 11 -34.964 2.209 -16.682 1.00 0.00 N ATOM 0 H ASN A 11 -35.967 4.008 -13.513 1.00 0.00 H new ATOM 0 HA ASN A 11 -37.671 4.298 -15.120 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -36.726 1.401 -15.027 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -38.001 1.819 -16.155 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -34.264 2.586 -17.321 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -34.762 1.367 -16.142 1.00 0.00 H new ATOM 162 N GLY A 12 -39.496 3.658 -13.107 1.00 0.00 N ATOM 163 CA GLY A 12 -40.876 3.410 -12.599 1.00 0.00 C ATOM 164 C GLY A 12 -41.360 4.628 -11.808 1.00 0.00 C ATOM 165 O GLY A 12 -40.579 5.456 -11.385 1.00 0.00 O ATOM 0 H GLY A 12 -38.952 4.336 -12.574 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -41.551 3.213 -13.432 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -40.887 2.524 -11.964 1.00 0.00 H new ATOM 169 N ARG A 13 -42.645 4.742 -11.605 1.00 0.00 N ATOM 170 CA ARG A 13 -43.181 5.905 -10.841 1.00 0.00 C ATOM 171 C ARG A 13 -43.752 5.448 -9.506 1.00 0.00 C ATOM 172 O ARG A 13 -43.586 4.320 -9.087 1.00 0.00 O ATOM 173 CB ARG A 13 -44.296 6.485 -11.710 1.00 0.00 C ATOM 174 CG ARG A 13 -43.856 7.834 -12.282 1.00 0.00 C ATOM 175 CD ARG A 13 -42.838 7.608 -13.400 1.00 0.00 C ATOM 176 NE ARG A 13 -42.530 8.970 -13.918 1.00 0.00 N ATOM 177 CZ ARG A 13 -41.751 9.111 -14.955 1.00 0.00 C ATOM 178 NH1 ARG A 13 -40.821 8.229 -15.196 1.00 0.00 N ATOM 179 NH2 ARG A 13 -41.903 10.134 -15.751 1.00 0.00 N ATOM 0 H ARG A 13 -43.347 4.080 -11.935 1.00 0.00 H new ATOM 0 HA ARG A 13 -42.402 6.637 -10.628 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -44.534 5.796 -12.520 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -45.204 6.608 -11.119 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -44.720 8.377 -12.667 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -43.418 8.449 -11.496 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -41.941 7.116 -13.024 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -43.247 6.970 -14.184 1.00 0.00 H new ATOM 0 HE ARG A 13 -42.928 9.792 -13.463 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -40.703 7.429 -14.574 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -40.212 8.339 -16.007 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -42.631 10.823 -15.562 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -41.294 10.244 -16.562 1.00 0.00 H new ATOM 193 N HIS A 14 -44.426 6.334 -8.846 1.00 0.00 N ATOM 194 CA HIS A 14 -45.034 6.003 -7.527 1.00 0.00 C ATOM 195 C HIS A 14 -46.371 6.736 -7.375 1.00 0.00 C ATOM 196 O HIS A 14 -46.431 7.949 -7.410 1.00 0.00 O ATOM 197 CB HIS A 14 -44.015 6.492 -6.501 1.00 0.00 C ATOM 198 CG HIS A 14 -44.090 7.985 -6.384 1.00 0.00 C ATOM 199 ND1 HIS A 14 -44.832 8.599 -5.394 1.00 0.00 N ATOM 200 CD2 HIS A 14 -43.509 8.998 -7.103 1.00 0.00 C ATOM 201 CE1 HIS A 14 -44.675 9.922 -5.529 1.00 0.00 C ATOM 202 NE2 HIS A 14 -43.880 10.225 -6.560 1.00 0.00 N ATOM 0 H HIS A 14 -44.587 7.290 -9.164 1.00 0.00 H new ATOM 0 HA HIS A 14 -45.245 4.940 -7.408 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -44.211 6.032 -5.533 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -43.011 6.191 -6.800 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -42.863 8.864 -7.958 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -45.135 10.655 -4.883 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -43.605 11.154 -6.880 1.00 0.00 H new ATOM 210 N ASN A 15 -47.445 6.013 -7.218 1.00 0.00 N ATOM 211 CA ASN A 15 -48.772 6.678 -7.076 1.00 0.00 C ATOM 212 C ASN A 15 -49.536 6.098 -5.883 1.00 0.00 C ATOM 213 O ASN A 15 -50.393 5.250 -6.034 1.00 0.00 O ATOM 214 CB ASN A 15 -49.506 6.375 -8.383 1.00 0.00 C ATOM 215 CG ASN A 15 -50.178 7.649 -8.899 1.00 0.00 C ATOM 216 OD1 ASN A 15 -51.074 8.175 -8.269 1.00 0.00 O ATOM 217 ND2 ASN A 15 -49.781 8.171 -10.028 1.00 0.00 N ATOM 0 H ASN A 15 -47.462 4.994 -7.182 1.00 0.00 H new ATOM 0 HA ASN A 15 -48.679 7.749 -6.897 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -48.805 5.994 -9.126 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -50.253 5.597 -8.221 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -50.223 9.020 -10.381 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -49.029 7.730 -10.557 1.00 0.00 H new ATOM 224 N GLY A 16 -49.234 6.551 -4.698 1.00 0.00 N ATOM 225 CA GLY A 16 -49.944 6.028 -3.497 1.00 0.00 C ATOM 226 C GLY A 16 -51.166 6.900 -3.208 1.00 0.00 C ATOM 227 O GLY A 16 -51.597 7.019 -2.079 1.00 0.00 O ATOM 0 H GLY A 16 -48.526 7.261 -4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -50.252 4.996 -3.664 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -49.274 6.026 -2.637 1.00 0.00 H new ATOM 231 N TYR A 17 -51.729 7.505 -4.223 1.00 0.00 N ATOM 232 CA TYR A 17 -52.930 8.375 -4.024 1.00 0.00 C ATOM 233 C TYR A 17 -52.822 9.152 -2.708 1.00 0.00 C ATOM 234 O TYR A 17 -53.735 9.165 -1.907 1.00 0.00 O ATOM 235 CB TYR A 17 -54.131 7.421 -3.995 1.00 0.00 C ATOM 236 CG TYR A 17 -53.882 6.301 -3.011 1.00 0.00 C ATOM 237 CD1 TYR A 17 -54.233 6.460 -1.665 1.00 0.00 C ATOM 238 CD2 TYR A 17 -53.302 5.103 -3.447 1.00 0.00 C ATOM 239 CE1 TYR A 17 -54.002 5.421 -0.755 1.00 0.00 C ATOM 240 CE2 TYR A 17 -53.072 4.065 -2.537 1.00 0.00 C ATOM 241 CZ TYR A 17 -53.422 4.224 -1.191 1.00 0.00 C ATOM 242 OH TYR A 17 -53.195 3.200 -0.294 1.00 0.00 O ATOM 0 H TYR A 17 -51.407 7.434 -5.188 1.00 0.00 H new ATOM 0 HA TYR A 17 -53.026 9.116 -4.817 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -55.032 7.967 -3.716 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -54.303 7.010 -4.990 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -54.682 7.383 -1.329 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -53.032 4.980 -4.486 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -54.271 5.543 0.284 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -52.625 3.141 -2.873 1.00 0.00 H new ATOM 0 HH TYR A 17 -52.788 2.440 -0.761 1.00 0.00 H new ATOM 252 N GLU A 18 -51.712 9.799 -2.482 1.00 0.00 N ATOM 253 CA GLU A 18 -51.544 10.573 -1.219 1.00 0.00 C ATOM 254 C GLU A 18 -50.824 11.896 -1.499 1.00 0.00 C ATOM 255 O GLU A 18 -50.642 12.286 -2.635 1.00 0.00 O ATOM 256 CB GLU A 18 -50.692 9.679 -0.318 1.00 0.00 C ATOM 257 CG GLU A 18 -51.538 8.510 0.187 1.00 0.00 C ATOM 258 CD GLU A 18 -52.216 8.902 1.501 1.00 0.00 C ATOM 259 OE1 GLU A 18 -52.310 10.090 1.765 1.00 0.00 O ATOM 260 OE2 GLU A 18 -52.630 8.009 2.221 1.00 0.00 O ATOM 0 H GLU A 18 -50.914 9.825 -3.117 1.00 0.00 H new ATOM 0 HA GLU A 18 -52.500 10.824 -0.759 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -49.829 9.306 -0.869 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -50.308 10.254 0.524 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -52.289 8.243 -0.556 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -50.911 7.631 0.337 1.00 0.00 H new ATOM 267 N ASP A 19 -50.416 12.588 -0.471 1.00 0.00 N ATOM 268 CA ASP A 19 -49.711 13.885 -0.679 1.00 0.00 C ATOM 269 C ASP A 19 -48.677 14.111 0.428 1.00 0.00 C ATOM 270 O ASP A 19 -47.608 14.637 0.193 1.00 0.00 O ATOM 271 CB ASP A 19 -50.810 14.947 -0.614 1.00 0.00 C ATOM 272 CG ASP A 19 -52.007 14.493 -1.452 1.00 0.00 C ATOM 273 OD1 ASP A 19 -51.874 14.451 -2.664 1.00 0.00 O ATOM 274 OD2 ASP A 19 -53.035 14.196 -0.867 1.00 0.00 O ATOM 0 H ASP A 19 -50.540 12.312 0.503 1.00 0.00 H new ATOM 0 HA ASP A 19 -49.171 13.914 -1.625 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -51.116 15.107 0.420 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -50.433 15.900 -0.986 1.00 0.00 H new ATOM 279 N PHE A 20 -48.984 13.716 1.634 1.00 0.00 N ATOM 280 CA PHE A 20 -48.012 13.910 2.747 1.00 0.00 C ATOM 281 C PHE A 20 -48.045 12.710 3.698 1.00 0.00 C ATOM 282 O PHE A 20 -48.639 12.758 4.756 1.00 0.00 O ATOM 283 CB PHE A 20 -48.472 15.183 3.462 1.00 0.00 C ATOM 284 CG PHE A 20 -49.809 14.943 4.119 1.00 0.00 C ATOM 285 CD1 PHE A 20 -50.952 14.756 3.333 1.00 0.00 C ATOM 286 CD2 PHE A 20 -49.906 14.907 5.515 1.00 0.00 C ATOM 287 CE1 PHE A 20 -52.192 14.533 3.942 1.00 0.00 C ATOM 288 CE2 PHE A 20 -51.146 14.684 6.125 1.00 0.00 C ATOM 289 CZ PHE A 20 -52.289 14.497 5.339 1.00 0.00 C ATOM 0 H PHE A 20 -49.863 13.269 1.896 1.00 0.00 H new ATOM 0 HA PHE A 20 -46.987 13.996 2.388 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -47.736 15.477 4.210 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -48.548 16.004 2.750 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -50.877 14.784 2.256 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -49.024 15.051 6.121 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -53.074 14.389 3.335 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -51.221 14.656 7.202 1.00 0.00 H new ATOM 0 HZ PHE A 20 -53.246 14.325 5.810 1.00 0.00 H new ATOM 299 N TYR A 21 -47.405 11.634 3.332 1.00 0.00 N ATOM 300 CA TYR A 21 -47.397 10.438 4.219 1.00 0.00 C ATOM 301 C TYR A 21 -46.872 10.829 5.607 1.00 0.00 C ATOM 302 O TYR A 21 -46.769 11.995 5.929 1.00 0.00 O ATOM 303 CB TYR A 21 -46.465 9.445 3.524 1.00 0.00 C ATOM 304 CG TYR A 21 -47.214 8.765 2.403 1.00 0.00 C ATOM 305 CD1 TYR A 21 -48.303 7.935 2.694 1.00 0.00 C ATOM 306 CD2 TYR A 21 -46.815 8.954 1.075 1.00 0.00 C ATOM 307 CE1 TYR A 21 -48.991 7.293 1.659 1.00 0.00 C ATOM 308 CE2 TYR A 21 -47.502 8.311 0.040 1.00 0.00 C ATOM 309 CZ TYR A 21 -48.590 7.481 0.331 1.00 0.00 C ATOM 310 OH TYR A 21 -49.267 6.849 -0.692 1.00 0.00 O ATOM 0 H TYR A 21 -46.888 11.532 2.459 1.00 0.00 H new ATOM 0 HA TYR A 21 -48.388 10.010 4.372 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -45.590 9.962 3.132 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -46.104 8.705 4.238 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -48.612 7.790 3.719 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -45.977 9.596 0.849 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -49.831 6.653 1.884 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -47.192 8.455 -0.985 1.00 0.00 H new ATOM 0 HH TYR A 21 -49.766 6.086 -0.332 1.00 0.00 H new ATOM 320 N THR A 22 -46.546 9.873 6.435 1.00 0.00 N ATOM 321 CA THR A 22 -46.036 10.213 7.799 1.00 0.00 C ATOM 322 C THR A 22 -45.118 9.115 8.321 1.00 0.00 C ATOM 323 O THR A 22 -43.930 9.306 8.488 1.00 0.00 O ATOM 324 CB THR A 22 -47.287 10.322 8.673 1.00 0.00 C ATOM 325 OG1 THR A 22 -48.316 9.507 8.129 1.00 0.00 O ATOM 326 CG2 THR A 22 -47.757 11.777 8.718 1.00 0.00 C ATOM 0 H THR A 22 -46.609 8.876 6.229 1.00 0.00 H new ATOM 0 HA THR A 22 -45.452 11.133 7.797 1.00 0.00 H new ATOM 0 HB THR A 22 -47.053 9.987 9.684 1.00 0.00 H new ATOM 0 HG1 THR A 22 -49.117 9.575 8.689 1.00 0.00 H new ATOM 0 HG21 THR A 22 -48.648 11.852 9.341 1.00 0.00 H new ATOM 0 HG22 THR A 22 -46.968 12.402 9.137 1.00 0.00 H new ATOM 0 HG23 THR A 22 -47.990 12.115 7.708 1.00 0.00 H new ATOM 334 N ASP A 23 -45.665 7.973 8.591 1.00 0.00 N ATOM 335 CA ASP A 23 -44.839 6.858 9.120 1.00 0.00 C ATOM 336 C ASP A 23 -45.565 5.535 8.886 1.00 0.00 C ATOM 337 O ASP A 23 -46.762 5.432 9.070 1.00 0.00 O ATOM 338 CB ASP A 23 -44.704 7.173 10.607 1.00 0.00 C ATOM 339 CG ASP A 23 -44.349 5.900 11.380 1.00 0.00 C ATOM 340 OD1 ASP A 23 -43.828 4.984 10.765 1.00 0.00 O ATOM 341 OD2 ASP A 23 -44.604 5.864 12.572 1.00 0.00 O ATOM 0 H ASP A 23 -46.655 7.759 8.468 1.00 0.00 H new ATOM 0 HA ASP A 23 -43.865 6.764 8.640 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -43.933 7.928 10.759 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -45.637 7.590 10.985 1.00 0.00 H new ATOM 346 N GLY A 24 -44.859 4.530 8.454 1.00 0.00 N ATOM 347 CA GLY A 24 -45.522 3.228 8.180 1.00 0.00 C ATOM 348 C GLY A 24 -46.347 3.364 6.898 1.00 0.00 C ATOM 349 O GLY A 24 -47.094 2.481 6.529 1.00 0.00 O ATOM 0 H GLY A 24 -43.854 4.554 8.279 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -44.778 2.440 8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -46.163 2.946 9.015 1.00 0.00 H new ATOM 353 N SER A 25 -46.207 4.471 6.213 1.00 0.00 N ATOM 354 CA SER A 25 -46.970 4.676 4.949 1.00 0.00 C ATOM 355 C SER A 25 -46.381 3.814 3.847 1.00 0.00 C ATOM 356 O SER A 25 -45.229 3.444 3.897 1.00 0.00 O ATOM 357 CB SER A 25 -46.784 6.148 4.607 1.00 0.00 C ATOM 358 OG SER A 25 -47.672 6.932 5.391 1.00 0.00 O ATOM 0 H SER A 25 -45.595 5.243 6.477 1.00 0.00 H new ATOM 0 HA SER A 25 -48.021 4.407 5.054 1.00 0.00 H new ATOM 0 HB2 SER A 25 -45.753 6.449 4.795 1.00 0.00 H new ATOM 0 HB3 SER A 25 -46.976 6.313 3.547 1.00 0.00 H new ATOM 0 HG SER A 25 -47.382 6.916 6.327 1.00 0.00 H new ATOM 364 N VAL A 26 -47.150 3.495 2.848 1.00 0.00 N ATOM 365 CA VAL A 26 -46.602 2.656 1.753 1.00 0.00 C ATOM 366 C VAL A 26 -47.072 3.160 0.396 1.00 0.00 C ATOM 367 O VAL A 26 -48.111 3.779 0.273 1.00 0.00 O ATOM 368 CB VAL A 26 -47.130 1.249 2.024 1.00 0.00 C ATOM 369 CG1 VAL A 26 -46.852 0.355 0.817 1.00 0.00 C ATOM 370 CG2 VAL A 26 -46.425 0.676 3.251 1.00 0.00 C ATOM 0 H VAL A 26 -48.125 3.776 2.743 1.00 0.00 H new ATOM 0 HA VAL A 26 -45.513 2.683 1.728 1.00 0.00 H new ATOM 0 HB VAL A 26 -48.205 1.292 2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -47.230 -0.649 1.013 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -47.350 0.765 -0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -45.778 0.310 0.637 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -46.798 -0.329 3.449 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -45.351 0.635 3.067 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -46.621 1.313 4.114 1.00 0.00 H new ATOM 380 N VAL A 27 -46.305 2.906 -0.625 1.00 0.00 N ATOM 381 CA VAL A 27 -46.704 3.381 -1.977 1.00 0.00 C ATOM 382 C VAL A 27 -46.432 2.330 -3.034 1.00 0.00 C ATOM 383 O VAL A 27 -45.303 1.956 -3.278 1.00 0.00 O ATOM 384 CB VAL A 27 -45.845 4.608 -2.239 1.00 0.00 C ATOM 385 CG1 VAL A 27 -45.928 4.993 -3.718 1.00 0.00 C ATOM 386 CG2 VAL A 27 -46.369 5.747 -1.390 1.00 0.00 C ATOM 0 H VAL A 27 -45.424 2.393 -0.583 1.00 0.00 H new ATOM 0 HA VAL A 27 -47.771 3.598 -2.018 1.00 0.00 H new ATOM 0 HB VAL A 27 -44.806 4.396 -1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -45.311 5.873 -3.900 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -45.570 4.165 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -46.963 5.216 -3.979 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -45.765 6.638 -1.564 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -47.405 5.953 -1.657 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -46.314 5.471 -0.337 1.00 0.00 H new ATOM 396 N THR A 28 -47.447 1.874 -3.696 1.00 0.00 N ATOM 397 CA THR A 28 -47.203 0.884 -4.758 1.00 0.00 C ATOM 398 C THR A 28 -46.526 1.608 -5.916 1.00 0.00 C ATOM 399 O THR A 28 -47.141 2.387 -6.618 1.00 0.00 O ATOM 400 CB THR A 28 -48.577 0.346 -5.160 1.00 0.00 C ATOM 401 OG1 THR A 28 -49.580 0.940 -4.347 1.00 0.00 O ATOM 402 CG2 THR A 28 -48.600 -1.171 -4.975 1.00 0.00 C ATOM 0 H THR A 28 -48.421 2.141 -3.549 1.00 0.00 H new ATOM 0 HA THR A 28 -46.561 0.060 -4.446 1.00 0.00 H new ATOM 0 HB THR A 28 -48.771 0.589 -6.205 1.00 0.00 H new ATOM 0 HG1 THR A 28 -50.459 0.595 -4.608 1.00 0.00 H new ATOM 0 HG21 THR A 28 -49.578 -1.558 -5.261 1.00 0.00 H new ATOM 0 HG22 THR A 28 -47.833 -1.626 -5.602 1.00 0.00 H new ATOM 0 HG23 THR A 28 -48.405 -1.413 -3.930 1.00 0.00 H new ATOM 410 N TYR A 29 -45.257 1.390 -6.101 1.00 0.00 N ATOM 411 CA TYR A 29 -44.542 2.105 -7.189 1.00 0.00 C ATOM 412 C TYR A 29 -45.034 1.623 -8.556 1.00 0.00 C ATOM 413 O TYR A 29 -45.244 0.446 -8.773 1.00 0.00 O ATOM 414 CB TYR A 29 -43.066 1.733 -7.010 1.00 0.00 C ATOM 415 CG TYR A 29 -42.375 2.683 -6.056 1.00 0.00 C ATOM 416 CD1 TYR A 29 -43.076 3.732 -5.444 1.00 0.00 C ATOM 417 CD2 TYR A 29 -41.015 2.503 -5.782 1.00 0.00 C ATOM 418 CE1 TYR A 29 -42.415 4.593 -4.566 1.00 0.00 C ATOM 419 CE2 TYR A 29 -40.356 3.365 -4.902 1.00 0.00 C ATOM 420 CZ TYR A 29 -41.055 4.411 -4.293 1.00 0.00 C ATOM 421 OH TYR A 29 -40.405 5.262 -3.425 1.00 0.00 O ATOM 0 H TYR A 29 -44.686 0.750 -5.548 1.00 0.00 H new ATOM 0 HA TYR A 29 -44.708 3.181 -7.144 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -42.988 0.713 -6.632 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -42.563 1.754 -7.977 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -44.126 3.874 -5.652 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -40.473 1.696 -6.252 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -42.955 5.402 -4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -39.306 3.223 -4.692 1.00 0.00 H new ATOM 0 HH TYR A 29 -39.901 5.929 -3.937 1.00 0.00 H new ATOM 431 N SER A 30 -45.209 2.524 -9.483 1.00 0.00 N ATOM 432 CA SER A 30 -45.677 2.118 -10.839 1.00 0.00 C ATOM 433 C SER A 30 -44.472 1.905 -11.759 1.00 0.00 C ATOM 434 O SER A 30 -43.394 2.407 -11.509 1.00 0.00 O ATOM 435 CB SER A 30 -46.531 3.284 -11.338 1.00 0.00 C ATOM 436 OG SER A 30 -46.802 4.170 -10.258 1.00 0.00 O ATOM 0 H SER A 30 -45.048 3.524 -9.361 1.00 0.00 H new ATOM 0 HA SER A 30 -46.242 1.186 -10.821 1.00 0.00 H new ATOM 0 HB2 SER A 30 -46.011 3.814 -12.136 1.00 0.00 H new ATOM 0 HB3 SER A 30 -47.464 2.911 -11.759 1.00 0.00 H new ATOM 0 HG SER A 30 -47.348 4.918 -10.578 1.00 0.00 H new ATOM 442 N CYS A 31 -44.643 1.166 -12.820 1.00 0.00 N ATOM 443 CA CYS A 31 -43.502 0.926 -13.749 1.00 0.00 C ATOM 444 C CYS A 31 -43.869 1.375 -15.166 1.00 0.00 C ATOM 445 O CYS A 31 -45.015 1.333 -15.566 1.00 0.00 O ATOM 446 CB CYS A 31 -43.270 -0.585 -13.709 1.00 0.00 C ATOM 447 SG CYS A 31 -43.016 -1.110 -11.996 1.00 0.00 S ATOM 0 H CYS A 31 -45.521 0.719 -13.084 1.00 0.00 H new ATOM 0 HA CYS A 31 -42.611 1.483 -13.461 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -44.126 -1.107 -14.138 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -42.402 -0.847 -14.314 1.00 0.00 H new ATOM 452 N ASN A 32 -42.902 1.806 -15.929 1.00 0.00 N ATOM 453 CA ASN A 32 -43.193 2.258 -17.320 1.00 0.00 C ATOM 454 C ASN A 32 -44.117 1.257 -18.021 1.00 0.00 C ATOM 455 O ASN A 32 -43.953 0.059 -17.903 1.00 0.00 O ATOM 456 CB ASN A 32 -41.831 2.304 -18.013 1.00 0.00 C ATOM 457 CG ASN A 32 -41.618 3.685 -18.636 1.00 0.00 C ATOM 458 OD1 ASN A 32 -42.077 3.948 -19.730 1.00 0.00 O ATOM 459 ND2 ASN A 32 -40.936 4.584 -17.982 1.00 0.00 N ATOM 0 H ASN A 32 -41.923 1.865 -15.650 1.00 0.00 H new ATOM 0 HA ASN A 32 -43.697 3.224 -17.343 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -41.039 2.092 -17.295 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -41.777 1.534 -18.783 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -40.788 5.508 -18.389 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -40.551 4.363 -17.064 1.00 0.00 H new ATOM 466 N SER A 33 -45.086 1.738 -18.751 1.00 0.00 N ATOM 467 CA SER A 33 -46.018 0.812 -19.458 1.00 0.00 C ATOM 468 C SER A 33 -45.232 -0.318 -20.129 1.00 0.00 C ATOM 469 O SER A 33 -44.579 -0.120 -21.135 1.00 0.00 O ATOM 470 CB SER A 33 -46.716 1.678 -20.508 1.00 0.00 C ATOM 471 OG SER A 33 -46.725 0.992 -21.754 1.00 0.00 O ATOM 0 H SER A 33 -45.273 2.731 -18.889 1.00 0.00 H new ATOM 0 HA SER A 33 -46.730 0.343 -18.778 1.00 0.00 H new ATOM 0 HB2 SER A 33 -47.736 1.899 -20.194 1.00 0.00 H new ATOM 0 HB3 SER A 33 -46.200 2.633 -20.609 1.00 0.00 H new ATOM 0 HG SER A 33 -45.803 0.837 -22.049 1.00 0.00 H new ATOM 477 N GLY A 34 -45.290 -1.501 -19.581 1.00 0.00 N ATOM 478 CA GLY A 34 -44.548 -2.643 -20.188 1.00 0.00 C ATOM 479 C GLY A 34 -43.482 -3.141 -19.211 1.00 0.00 C ATOM 480 O GLY A 34 -42.578 -3.865 -19.579 1.00 0.00 O ATOM 0 H GLY A 34 -45.819 -1.726 -18.739 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -45.239 -3.451 -20.431 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -44.082 -2.331 -21.122 1.00 0.00 H new ATOM 484 N TYR A 35 -43.579 -2.756 -17.967 1.00 0.00 N ATOM 485 CA TYR A 35 -42.568 -3.205 -16.968 1.00 0.00 C ATOM 486 C TYR A 35 -43.261 -3.774 -15.726 1.00 0.00 C ATOM 487 O TYR A 35 -44.235 -3.233 -15.241 1.00 0.00 O ATOM 488 CB TYR A 35 -41.775 -1.945 -16.626 1.00 0.00 C ATOM 489 CG TYR A 35 -40.595 -1.836 -17.563 1.00 0.00 C ATOM 490 CD1 TYR A 35 -40.780 -1.412 -18.885 1.00 0.00 C ATOM 491 CD2 TYR A 35 -39.317 -2.168 -17.109 1.00 0.00 C ATOM 492 CE1 TYR A 35 -39.681 -1.322 -19.749 1.00 0.00 C ATOM 493 CE2 TYR A 35 -38.218 -2.077 -17.971 1.00 0.00 C ATOM 494 CZ TYR A 35 -38.400 -1.655 -19.291 1.00 0.00 C ATOM 495 OH TYR A 35 -37.316 -1.569 -20.142 1.00 0.00 O ATOM 0 H TYR A 35 -44.314 -2.151 -17.600 1.00 0.00 H new ATOM 0 HA TYR A 35 -41.925 -3.998 -17.351 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -42.410 -1.064 -16.717 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -41.432 -1.985 -15.592 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -41.768 -1.155 -19.238 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -39.176 -2.496 -16.090 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -39.822 -0.996 -20.769 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -37.230 -2.333 -17.617 1.00 0.00 H new ATOM 0 HH TYR A 35 -36.503 -1.835 -19.664 1.00 0.00 H new ATOM 505 N SER A 36 -42.768 -4.871 -15.214 1.00 0.00 N ATOM 506 CA SER A 36 -43.400 -5.485 -14.011 1.00 0.00 C ATOM 507 C SER A 36 -42.855 -4.860 -12.730 1.00 0.00 C ATOM 508 O SER A 36 -41.702 -4.487 -12.650 1.00 0.00 O ATOM 509 CB SER A 36 -43.028 -6.965 -14.073 1.00 0.00 C ATOM 510 OG SER A 36 -44.211 -7.723 -14.280 1.00 0.00 O ATOM 0 H SER A 36 -41.955 -5.368 -15.578 1.00 0.00 H new ATOM 0 HA SER A 36 -44.479 -5.329 -14.003 1.00 0.00 H new ATOM 0 HB2 SER A 36 -42.319 -7.143 -14.881 1.00 0.00 H new ATOM 0 HB3 SER A 36 -42.540 -7.271 -13.148 1.00 0.00 H new ATOM 0 HG SER A 36 -44.892 -7.450 -13.630 1.00 0.00 H new ATOM 516 N LEU A 37 -43.672 -4.761 -11.719 1.00 0.00 N ATOM 517 CA LEU A 37 -43.192 -4.180 -10.439 1.00 0.00 C ATOM 518 C LEU A 37 -42.769 -5.303 -9.495 1.00 0.00 C ATOM 519 O LEU A 37 -43.589 -5.934 -8.858 1.00 0.00 O ATOM 520 CB LEU A 37 -44.380 -3.414 -9.857 1.00 0.00 C ATOM 521 CG LEU A 37 -44.017 -2.915 -8.456 1.00 0.00 C ATOM 522 CD1 LEU A 37 -43.476 -1.487 -8.545 1.00 0.00 C ATOM 523 CD2 LEU A 37 -45.261 -2.934 -7.566 1.00 0.00 C ATOM 0 H LEU A 37 -44.648 -5.057 -11.725 1.00 0.00 H new ATOM 0 HA LEU A 37 -42.332 -3.526 -10.582 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -44.637 -2.573 -10.501 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -45.257 -4.059 -9.811 1.00 0.00 H new ATOM 0 HG LEU A 37 -43.255 -3.566 -8.028 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -43.218 -1.133 -7.547 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -42.587 -1.473 -9.176 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -44.237 -0.836 -8.976 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -45.001 -2.578 -6.569 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -46.025 -2.285 -7.995 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -45.645 -3.952 -7.499 1.00 0.00 H new ATOM 535 N ILE A 38 -41.497 -5.553 -9.393 1.00 0.00 N ATOM 536 CA ILE A 38 -41.031 -6.633 -8.477 1.00 0.00 C ATOM 537 C ILE A 38 -40.626 -6.012 -7.145 1.00 0.00 C ATOM 538 O ILE A 38 -40.603 -4.811 -6.997 1.00 0.00 O ATOM 539 CB ILE A 38 -39.816 -7.311 -9.142 1.00 0.00 C ATOM 540 CG1 ILE A 38 -39.695 -6.937 -10.627 1.00 0.00 C ATOM 541 CG2 ILE A 38 -39.980 -8.821 -9.046 1.00 0.00 C ATOM 542 CD1 ILE A 38 -40.987 -7.317 -11.356 1.00 0.00 C ATOM 0 H ILE A 38 -40.761 -5.061 -9.900 1.00 0.00 H new ATOM 0 HA ILE A 38 -41.816 -7.367 -8.295 1.00 0.00 H new ATOM 0 HB ILE A 38 -38.919 -6.972 -8.623 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -39.508 -5.868 -10.730 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -38.846 -7.454 -11.075 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -39.126 -9.310 -9.514 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -40.038 -9.115 -7.998 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -40.895 -9.121 -9.558 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -40.902 -7.052 -12.410 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -41.154 -8.390 -11.264 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -41.826 -6.780 -10.913 1.00 0.00 H new ATOM 554 N GLY A 39 -40.307 -6.812 -6.173 1.00 0.00 N ATOM 555 CA GLY A 39 -39.903 -6.243 -4.858 1.00 0.00 C ATOM 556 C GLY A 39 -41.144 -5.850 -4.057 1.00 0.00 C ATOM 557 O GLY A 39 -42.258 -5.942 -4.531 1.00 0.00 O ATOM 0 H GLY A 39 -40.307 -7.831 -6.228 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -39.316 -6.973 -4.301 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -39.266 -5.371 -5.009 1.00 0.00 H new ATOM 561 N ASN A 40 -40.956 -5.409 -2.842 1.00 0.00 N ATOM 562 CA ASN A 40 -42.120 -5.004 -2.005 1.00 0.00 C ATOM 563 C ASN A 40 -43.115 -4.201 -2.845 1.00 0.00 C ATOM 564 O ASN A 40 -42.842 -3.089 -3.250 1.00 0.00 O ATOM 565 CB ASN A 40 -41.525 -4.131 -0.898 1.00 0.00 C ATOM 566 CG ASN A 40 -41.445 -4.934 0.402 1.00 0.00 C ATOM 567 OD1 ASN A 40 -41.565 -4.383 1.478 1.00 0.00 O ATOM 568 ND2 ASN A 40 -41.243 -6.223 0.349 1.00 0.00 N ATOM 0 H ASN A 40 -40.045 -5.312 -2.393 1.00 0.00 H new ATOM 0 HA ASN A 40 -42.661 -5.860 -1.602 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -40.532 -3.787 -1.187 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -42.140 -3.243 -0.751 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -41.186 -6.766 1.210 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -41.142 -6.687 -0.554 1.00 0.00 H new ATOM 575 N SER A 41 -44.267 -4.752 -3.109 1.00 0.00 N ATOM 576 CA SER A 41 -45.277 -4.017 -3.923 1.00 0.00 C ATOM 577 C SER A 41 -45.849 -2.847 -3.120 1.00 0.00 C ATOM 578 O SER A 41 -47.046 -2.729 -2.941 1.00 0.00 O ATOM 579 CB SER A 41 -46.365 -5.045 -4.229 1.00 0.00 C ATOM 580 OG SER A 41 -46.953 -5.483 -3.011 1.00 0.00 O ATOM 0 H SER A 41 -44.553 -5.680 -2.796 1.00 0.00 H new ATOM 0 HA SER A 41 -44.850 -3.597 -4.834 1.00 0.00 H new ATOM 0 HB2 SER A 41 -47.125 -4.606 -4.876 1.00 0.00 H new ATOM 0 HB3 SER A 41 -45.940 -5.893 -4.766 1.00 0.00 H new ATOM 0 HG SER A 41 -47.369 -4.721 -2.556 1.00 0.00 H new ATOM 586 N GLY A 42 -45.002 -1.983 -2.631 1.00 0.00 N ATOM 587 CA GLY A 42 -45.496 -0.825 -1.837 1.00 0.00 C ATOM 588 C GLY A 42 -44.397 -0.333 -0.895 1.00 0.00 C ATOM 589 O GLY A 42 -44.229 -0.851 0.190 1.00 0.00 O ATOM 0 H GLY A 42 -43.990 -2.030 -2.747 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -45.802 -0.020 -2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -46.376 -1.115 -1.263 1.00 0.00 H new ATOM 593 N VAL A 43 -43.648 0.664 -1.298 1.00 0.00 N ATOM 594 CA VAL A 43 -42.566 1.179 -0.391 1.00 0.00 C ATOM 595 C VAL A 43 -43.136 1.336 1.011 1.00 0.00 C ATOM 596 O VAL A 43 -44.318 1.172 1.228 1.00 0.00 O ATOM 597 CB VAL A 43 -42.114 2.574 -0.870 1.00 0.00 C ATOM 598 CG1 VAL A 43 -40.598 2.581 -1.064 1.00 0.00 C ATOM 599 CG2 VAL A 43 -42.794 2.995 -2.172 1.00 0.00 C ATOM 0 H VAL A 43 -43.733 1.138 -2.197 1.00 0.00 H new ATOM 0 HA VAL A 43 -41.727 0.483 -0.399 1.00 0.00 H new ATOM 0 HB VAL A 43 -42.406 3.291 -0.102 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -40.279 3.567 -1.402 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -40.109 2.346 -0.119 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -40.323 1.835 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -42.440 3.984 -2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -42.554 2.277 -2.956 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -43.874 3.025 -2.026 1.00 0.00 H new ATOM 609 N LEU A 44 -42.314 1.685 1.959 1.00 0.00 N ATOM 610 CA LEU A 44 -42.822 1.881 3.342 1.00 0.00 C ATOM 611 C LEU A 44 -42.126 3.081 3.988 1.00 0.00 C ATOM 612 O LEU A 44 -41.007 2.982 4.450 1.00 0.00 O ATOM 613 CB LEU A 44 -42.478 0.586 4.086 1.00 0.00 C ATOM 614 CG LEU A 44 -42.544 0.821 5.601 1.00 0.00 C ATOM 615 CD1 LEU A 44 -43.608 -0.088 6.217 1.00 0.00 C ATOM 616 CD2 LEU A 44 -41.183 0.501 6.222 1.00 0.00 C ATOM 0 H LEU A 44 -41.314 1.843 1.836 1.00 0.00 H new ATOM 0 HA LEU A 44 -43.893 2.083 3.366 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -43.174 -0.203 3.801 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -41.480 0.249 3.805 1.00 0.00 H new ATOM 0 HG LEU A 44 -42.802 1.862 5.795 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -43.652 0.081 7.293 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -44.578 0.136 5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -43.353 -1.130 6.024 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -41.226 0.667 7.298 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -40.929 -0.541 6.025 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -40.423 1.148 5.785 1.00 0.00 H new ATOM 628 N CYS A 45 -42.777 4.213 4.035 1.00 0.00 N ATOM 629 CA CYS A 45 -42.129 5.397 4.668 1.00 0.00 C ATOM 630 C CYS A 45 -42.209 5.280 6.187 1.00 0.00 C ATOM 631 O CYS A 45 -43.266 5.408 6.777 1.00 0.00 O ATOM 632 CB CYS A 45 -42.909 6.625 4.201 1.00 0.00 C ATOM 633 SG CYS A 45 -41.871 8.094 4.414 1.00 0.00 S ATOM 0 H CYS A 45 -43.716 4.368 3.668 1.00 0.00 H new ATOM 0 HA CYS A 45 -41.078 5.468 4.388 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -43.196 6.514 3.155 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -43.830 6.728 4.775 1.00 0.00 H new ATOM 638 N SER A 46 -41.100 5.041 6.825 1.00 0.00 N ATOM 639 CA SER A 46 -41.109 4.920 8.310 1.00 0.00 C ATOM 640 C SER A 46 -40.243 6.021 8.926 1.00 0.00 C ATOM 641 O SER A 46 -39.107 6.216 8.542 1.00 0.00 O ATOM 642 CB SER A 46 -40.517 3.542 8.601 1.00 0.00 C ATOM 643 OG SER A 46 -41.291 2.903 9.609 1.00 0.00 O ATOM 0 H SER A 46 -40.188 4.924 6.384 1.00 0.00 H new ATOM 0 HA SER A 46 -42.109 5.026 8.731 1.00 0.00 H new ATOM 0 HB2 SER A 46 -40.509 2.938 7.694 1.00 0.00 H new ATOM 0 HB3 SER A 46 -39.482 3.640 8.928 1.00 0.00 H new ATOM 0 HG SER A 46 -40.916 2.018 9.798 1.00 0.00 H new ATOM 649 N GLY A 47 -40.770 6.746 9.873 1.00 0.00 N ATOM 650 CA GLY A 47 -39.975 7.836 10.505 1.00 0.00 C ATOM 651 C GLY A 47 -39.479 8.796 9.423 1.00 0.00 C ATOM 652 O GLY A 47 -38.427 9.393 9.542 1.00 0.00 O ATOM 0 H GLY A 47 -41.716 6.631 10.237 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -40.586 8.373 11.231 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -39.129 7.416 11.049 1.00 0.00 H new ATOM 656 N GLY A 48 -40.228 8.947 8.365 1.00 0.00 N ATOM 657 CA GLY A 48 -39.798 9.867 7.275 1.00 0.00 C ATOM 658 C GLY A 48 -38.648 9.232 6.497 1.00 0.00 C ATOM 659 O GLY A 48 -37.655 9.868 6.204 1.00 0.00 O ATOM 0 H GLY A 48 -41.118 8.474 8.209 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -40.634 10.072 6.606 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -39.484 10.823 7.694 1.00 0.00 H new ATOM 663 N GLU A 49 -38.772 7.979 6.162 1.00 0.00 N ATOM 664 CA GLU A 49 -37.682 7.301 5.403 1.00 0.00 C ATOM 665 C GLU A 49 -38.252 6.174 4.537 1.00 0.00 C ATOM 666 O GLU A 49 -38.483 5.076 5.003 1.00 0.00 O ATOM 667 CB GLU A 49 -36.752 6.733 6.475 1.00 0.00 C ATOM 668 CG GLU A 49 -35.924 7.866 7.083 1.00 0.00 C ATOM 669 CD GLU A 49 -34.733 7.277 7.840 1.00 0.00 C ATOM 670 OE1 GLU A 49 -34.345 6.165 7.521 1.00 0.00 O ATOM 671 OE2 GLU A 49 -34.229 7.947 8.725 1.00 0.00 O ATOM 0 H GLU A 49 -39.579 7.395 6.380 1.00 0.00 H new ATOM 0 HA GLU A 49 -37.165 7.984 4.729 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -37.334 6.237 7.251 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -36.094 5.981 6.040 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -35.574 8.537 6.298 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -36.540 8.459 7.758 1.00 0.00 H new ATOM 678 N TRP A 50 -38.476 6.436 3.278 1.00 0.00 N ATOM 679 CA TRP A 50 -39.026 5.377 2.382 1.00 0.00 C ATOM 680 C TRP A 50 -38.024 4.228 2.252 1.00 0.00 C ATOM 681 O TRP A 50 -36.878 4.429 1.903 1.00 0.00 O ATOM 682 CB TRP A 50 -39.229 6.070 1.034 1.00 0.00 C ATOM 683 CG TRP A 50 -40.358 7.044 1.143 1.00 0.00 C ATOM 684 CD1 TRP A 50 -40.222 8.387 1.229 1.00 0.00 C ATOM 685 CD2 TRP A 50 -41.788 6.774 1.182 1.00 0.00 C ATOM 686 NE1 TRP A 50 -41.479 8.958 1.318 1.00 0.00 N ATOM 687 CE2 TRP A 50 -42.476 8.004 1.293 1.00 0.00 C ATOM 688 CE3 TRP A 50 -42.546 5.591 1.132 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -43.868 8.061 1.354 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -43.950 5.641 1.192 1.00 0.00 C ATOM 691 CH2 TRP A 50 -44.609 6.874 1.303 1.00 0.00 C ATOM 0 H TRP A 50 -38.302 7.336 2.831 1.00 0.00 H new ATOM 0 HA TRP A 50 -39.953 4.948 2.763 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -38.316 6.586 0.736 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -39.444 5.332 0.261 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -39.286 8.925 1.228 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -41.648 9.961 1.393 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -42.047 4.637 1.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -44.371 9.013 1.440 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -44.523 4.726 1.152 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -45.687 6.908 1.349 1.00 0.00 H new ATOM 702 N SER A 51 -38.445 3.025 2.534 1.00 0.00 N ATOM 703 CA SER A 51 -37.509 1.870 2.429 1.00 0.00 C ATOM 704 C SER A 51 -38.192 0.682 1.744 1.00 0.00 C ATOM 705 O SER A 51 -39.383 0.688 1.501 1.00 0.00 O ATOM 706 CB SER A 51 -37.149 1.520 3.872 1.00 0.00 C ATOM 707 OG SER A 51 -35.796 1.088 3.925 1.00 0.00 O ATOM 0 H SER A 51 -39.393 2.793 2.831 1.00 0.00 H new ATOM 0 HA SER A 51 -36.629 2.111 1.833 1.00 0.00 H new ATOM 0 HB2 SER A 51 -37.291 2.388 4.516 1.00 0.00 H new ATOM 0 HB3 SER A 51 -37.808 0.736 4.244 1.00 0.00 H new ATOM 0 HG SER A 51 -35.560 0.864 4.849 1.00 0.00 H new ATOM 713 N ASP A 52 -37.437 -0.334 1.431 1.00 0.00 N ATOM 714 CA ASP A 52 -38.018 -1.532 0.758 1.00 0.00 C ATOM 715 C ASP A 52 -38.803 -1.122 -0.489 1.00 0.00 C ATOM 716 O ASP A 52 -40.003 -1.301 -0.564 1.00 0.00 O ATOM 717 CB ASP A 52 -38.939 -2.171 1.798 1.00 0.00 C ATOM 718 CG ASP A 52 -38.403 -3.553 2.174 1.00 0.00 C ATOM 719 OD1 ASP A 52 -38.528 -4.456 1.364 1.00 0.00 O ATOM 720 OD2 ASP A 52 -37.874 -3.684 3.266 1.00 0.00 O ATOM 0 H ASP A 52 -36.435 -0.387 1.613 1.00 0.00 H new ATOM 0 HA ASP A 52 -37.247 -2.226 0.423 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -38.998 -1.539 2.684 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -39.950 -2.257 1.400 1.00 0.00 H new ATOM 725 N PRO A 53 -38.080 -0.588 -1.428 1.00 0.00 N ATOM 726 CA PRO A 53 -38.667 -0.141 -2.705 1.00 0.00 C ATOM 727 C PRO A 53 -38.626 -1.276 -3.733 1.00 0.00 C ATOM 728 O PRO A 53 -37.595 -1.885 -3.940 1.00 0.00 O ATOM 729 CB PRO A 53 -37.737 0.989 -3.126 1.00 0.00 C ATOM 730 CG PRO A 53 -36.418 0.703 -2.456 1.00 0.00 C ATOM 731 CD PRO A 53 -36.645 -0.344 -1.386 1.00 0.00 C ATOM 0 HA PRO A 53 -39.710 0.163 -2.623 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -37.627 1.022 -4.210 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -38.132 1.957 -2.816 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -35.690 0.348 -3.186 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -36.010 1.613 -2.016 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -36.080 -1.253 -1.591 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -36.330 0.013 -0.406 1.00 0.00 H new ATOM 739 N PRO A 54 -39.750 -1.521 -4.348 1.00 0.00 N ATOM 740 CA PRO A 54 -39.834 -2.593 -5.368 1.00 0.00 C ATOM 741 C PRO A 54 -39.149 -2.155 -6.665 1.00 0.00 C ATOM 742 O PRO A 54 -38.677 -1.043 -6.789 1.00 0.00 O ATOM 743 CB PRO A 54 -41.332 -2.774 -5.574 1.00 0.00 C ATOM 744 CG PRO A 54 -41.940 -1.463 -5.185 1.00 0.00 C ATOM 745 CD PRO A 54 -41.033 -0.837 -4.155 1.00 0.00 C ATOM 0 HA PRO A 54 -39.338 -3.515 -5.063 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -41.560 -3.022 -6.610 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -41.719 -3.586 -4.959 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -42.041 -0.813 -6.054 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -42.941 -1.609 -4.778 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -40.939 0.238 -4.307 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -41.415 -0.984 -3.145 1.00 0.00 H new ATOM 753 N THR A 55 -39.081 -3.034 -7.623 1.00 0.00 N ATOM 754 CA THR A 55 -38.414 -2.696 -8.912 1.00 0.00 C ATOM 755 C THR A 55 -39.436 -2.470 -10.021 1.00 0.00 C ATOM 756 O THR A 55 -40.615 -2.711 -9.864 1.00 0.00 O ATOM 757 CB THR A 55 -37.583 -3.934 -9.249 1.00 0.00 C ATOM 758 OG1 THR A 55 -38.390 -5.088 -9.092 1.00 0.00 O ATOM 759 CG2 THR A 55 -36.384 -4.023 -8.310 1.00 0.00 C ATOM 0 H THR A 55 -39.461 -3.979 -7.569 1.00 0.00 H new ATOM 0 HA THR A 55 -37.824 -1.783 -8.827 1.00 0.00 H new ATOM 0 HB THR A 55 -37.228 -3.866 -10.277 1.00 0.00 H new ATOM 0 HG1 THR A 55 -38.275 -5.447 -8.187 1.00 0.00 H new ATOM 0 HG21 THR A 55 -35.795 -4.907 -8.555 1.00 0.00 H new ATOM 0 HG22 THR A 55 -35.766 -3.132 -8.424 1.00 0.00 H new ATOM 0 HG23 THR A 55 -36.733 -4.093 -7.280 1.00 0.00 H new ATOM 767 N CYS A 56 -38.965 -2.045 -11.155 1.00 0.00 N ATOM 768 CA CYS A 56 -39.855 -1.833 -12.324 1.00 0.00 C ATOM 769 C CYS A 56 -39.115 -2.324 -13.549 1.00 0.00 C ATOM 770 O CYS A 56 -38.578 -1.562 -14.328 1.00 0.00 O ATOM 771 CB CYS A 56 -40.120 -0.327 -12.387 1.00 0.00 C ATOM 772 SG CYS A 56 -41.529 0.082 -11.327 1.00 0.00 S ATOM 0 H CYS A 56 -37.982 -1.832 -11.324 1.00 0.00 H new ATOM 0 HA CYS A 56 -40.803 -2.368 -12.258 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -39.236 0.223 -12.063 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -40.324 -0.025 -13.414 1.00 0.00 H new ATOM 777 N GLN A 57 -39.051 -3.613 -13.687 1.00 0.00 N ATOM 778 CA GLN A 57 -38.311 -4.209 -14.818 1.00 0.00 C ATOM 779 C GLN A 57 -39.264 -4.940 -15.763 1.00 0.00 C ATOM 780 O GLN A 57 -40.430 -4.615 -15.867 1.00 0.00 O ATOM 781 CB GLN A 57 -37.339 -5.206 -14.182 1.00 0.00 C ATOM 782 CG GLN A 57 -36.921 -4.760 -12.773 1.00 0.00 C ATOM 783 CD GLN A 57 -36.018 -3.529 -12.872 1.00 0.00 C ATOM 784 OE1 GLN A 57 -36.398 -2.526 -13.445 1.00 0.00 O ATOM 785 NE2 GLN A 57 -34.830 -3.562 -12.334 1.00 0.00 N ATOM 0 H GLN A 57 -39.486 -4.285 -13.055 1.00 0.00 H new ATOM 0 HA GLN A 57 -37.798 -3.449 -15.407 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -37.806 -6.189 -14.130 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -36.454 -5.306 -14.811 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -37.804 -4.529 -12.177 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -36.396 -5.569 -12.265 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -34.511 -4.403 -11.853 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -34.220 -2.747 -12.394 1.00 0.00 H new ATOM 794 N ILE A 58 -38.771 -5.938 -16.444 1.00 0.00 N ATOM 795 CA ILE A 58 -39.635 -6.715 -17.379 1.00 0.00 C ATOM 796 C ILE A 58 -39.685 -8.170 -16.909 1.00 0.00 C ATOM 797 O ILE A 58 -38.688 -8.728 -16.495 1.00 0.00 O ATOM 798 CB ILE A 58 -38.985 -6.623 -18.774 1.00 0.00 C ATOM 799 CG1 ILE A 58 -37.899 -5.537 -18.809 1.00 0.00 C ATOM 800 CG2 ILE A 58 -40.059 -6.277 -19.805 1.00 0.00 C ATOM 801 CD1 ILE A 58 -36.578 -6.120 -18.303 1.00 0.00 C ATOM 0 H ILE A 58 -37.801 -6.251 -16.393 1.00 0.00 H new ATOM 0 HA ILE A 58 -40.653 -6.326 -17.410 1.00 0.00 H new ATOM 0 HB ILE A 58 -38.526 -7.585 -19.002 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -37.778 -5.162 -19.825 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -38.196 -4.691 -18.190 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -39.606 -6.210 -20.794 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -40.824 -7.053 -19.808 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -40.514 -5.320 -19.549 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -35.807 -5.350 -18.328 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -36.705 -6.474 -17.280 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -36.280 -6.952 -18.940 1.00 0.00 H new ATOM 813 N VAL A 59 -40.831 -8.787 -16.950 1.00 0.00 N ATOM 814 CA VAL A 59 -40.920 -10.199 -16.481 1.00 0.00 C ATOM 815 C VAL A 59 -41.577 -11.073 -17.521 1.00 0.00 C ATOM 816 O VAL A 59 -42.372 -11.935 -17.210 1.00 0.00 O ATOM 817 CB VAL A 59 -41.799 -10.147 -15.251 1.00 0.00 C ATOM 818 CG1 VAL A 59 -41.148 -9.270 -14.180 1.00 0.00 C ATOM 819 CG2 VAL A 59 -43.140 -9.564 -15.659 1.00 0.00 C ATOM 0 H VAL A 59 -41.704 -8.380 -17.285 1.00 0.00 H new ATOM 0 HA VAL A 59 -39.932 -10.615 -16.284 1.00 0.00 H new ATOM 0 HB VAL A 59 -41.933 -11.147 -14.838 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -41.787 -9.238 -13.298 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -40.177 -9.686 -13.910 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -41.015 -8.260 -14.568 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -43.795 -9.515 -14.789 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -42.994 -8.561 -16.060 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -43.595 -10.197 -16.421 1.00 0.00 H new ATOM 829 N LYS A 60 -41.248 -10.875 -18.744 1.00 0.00 N ATOM 830 CA LYS A 60 -41.868 -11.721 -19.793 1.00 0.00 C ATOM 831 C LYS A 60 -41.642 -13.181 -19.427 1.00 0.00 C ATOM 832 O LYS A 60 -41.040 -13.476 -18.420 1.00 0.00 O ATOM 833 CB LYS A 60 -41.162 -11.354 -21.097 1.00 0.00 C ATOM 834 CG LYS A 60 -41.932 -10.230 -21.793 1.00 0.00 C ATOM 835 CD LYS A 60 -41.071 -9.634 -22.907 1.00 0.00 C ATOM 836 CE LYS A 60 -41.371 -8.139 -23.040 1.00 0.00 C ATOM 837 NZ LYS A 60 -40.089 -7.520 -23.484 1.00 0.00 N ATOM 0 H LYS A 60 -40.584 -10.174 -19.073 1.00 0.00 H new ATOM 0 HA LYS A 60 -42.942 -11.566 -19.891 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -40.139 -11.037 -20.893 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -41.101 -12.226 -21.748 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -42.864 -10.615 -22.206 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -42.198 -9.457 -21.072 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -40.015 -9.785 -22.685 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -41.275 -10.142 -23.850 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -42.166 -7.960 -23.764 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -41.703 -7.718 -22.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -40.219 -6.494 -23.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -39.352 -7.700 -22.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -39.800 -7.934 -24.393 1.00 0.00 H new ATOM 851 N CYS A 61 -42.127 -14.100 -20.206 1.00 0.00 N ATOM 852 CA CYS A 61 -41.923 -15.530 -19.833 1.00 0.00 C ATOM 853 C CYS A 61 -41.707 -16.428 -21.049 1.00 0.00 C ATOM 854 O CYS A 61 -42.030 -16.074 -22.166 1.00 0.00 O ATOM 855 CB CYS A 61 -43.203 -15.938 -19.118 1.00 0.00 C ATOM 856 SG CYS A 61 -42.810 -16.404 -17.418 1.00 0.00 S ATOM 0 H CYS A 61 -42.646 -13.934 -21.068 1.00 0.00 H new ATOM 0 HA CYS A 61 -41.030 -15.639 -19.217 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -43.917 -15.114 -19.126 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -43.674 -16.773 -19.637 1.00 0.00 H new ATOM 861 N PRO A 62 -41.173 -17.584 -20.758 1.00 0.00 N ATOM 862 CA PRO A 62 -40.904 -18.600 -21.795 1.00 0.00 C ATOM 863 C PRO A 62 -42.163 -19.419 -22.074 1.00 0.00 C ATOM 864 O PRO A 62 -42.748 -19.348 -23.135 1.00 0.00 O ATOM 865 CB PRO A 62 -39.835 -19.480 -21.153 1.00 0.00 C ATOM 866 CG PRO A 62 -40.000 -19.317 -19.672 1.00 0.00 C ATOM 867 CD PRO A 62 -40.767 -18.041 -19.424 1.00 0.00 C ATOM 0 HA PRO A 62 -40.594 -18.170 -22.747 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -39.959 -20.522 -21.447 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -38.837 -19.176 -21.470 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -40.534 -20.170 -19.252 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -39.027 -19.278 -19.183 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -41.633 -18.217 -18.786 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -40.147 -17.298 -18.923 1.00 0.00 H new ATOM 875 N HIS A 63 -42.563 -20.205 -21.117 1.00 0.00 N ATOM 876 CA HIS A 63 -43.769 -21.068 -21.265 1.00 0.00 C ATOM 877 C HIS A 63 -43.702 -22.168 -20.214 1.00 0.00 C ATOM 878 O HIS A 63 -42.699 -22.844 -20.095 1.00 0.00 O ATOM 879 CB HIS A 63 -43.671 -21.692 -22.653 1.00 0.00 C ATOM 880 CG HIS A 63 -44.789 -21.195 -23.528 1.00 0.00 C ATOM 881 ND1 HIS A 63 -45.206 -19.931 -23.855 1.00 0.00 N flip ATOM 882 CD2 HIS A 63 -45.634 -22.059 -24.206 1.00 0.00 C flip ATOM 883 CE1 HIS A 63 -46.291 -20.004 -24.722 1.00 0.00 C flip ATOM 884 NE2 HIS A 63 -46.508 -21.310 -24.901 1.00 0.00 N flip ATOM 0 H HIS A 63 -42.094 -20.288 -20.215 1.00 0.00 H new ATOM 0 HA HIS A 63 -44.697 -20.509 -21.143 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -42.710 -21.445 -23.104 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -43.716 -22.778 -22.575 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -44.784 -19.067 -23.514 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -45.597 -23.138 -24.181 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -46.840 -19.182 -25.157 1.00 0.00 H new ATOM 892 N PRO A 64 -44.758 -22.319 -19.481 1.00 0.00 N ATOM 893 CA PRO A 64 -44.783 -23.355 -18.438 1.00 0.00 C ATOM 894 C PRO A 64 -45.026 -24.721 -19.071 1.00 0.00 C ATOM 895 O PRO A 64 -45.987 -25.399 -18.775 1.00 0.00 O ATOM 896 CB PRO A 64 -45.943 -22.943 -17.551 1.00 0.00 C ATOM 897 CG PRO A 64 -46.848 -22.132 -18.430 1.00 0.00 C ATOM 898 CD PRO A 64 -46.009 -21.562 -19.549 1.00 0.00 C ATOM 0 HA PRO A 64 -43.849 -23.438 -17.882 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -46.461 -23.815 -17.152 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -45.597 -22.359 -16.698 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -47.649 -22.753 -18.831 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -47.319 -21.332 -17.859 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -46.497 -21.686 -20.516 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -45.836 -20.494 -19.413 1.00 0.00 H new ATOM 906 N THR A 65 -44.150 -25.131 -19.936 1.00 0.00 N ATOM 907 CA THR A 65 -44.317 -26.462 -20.588 1.00 0.00 C ATOM 908 C THR A 65 -43.961 -27.548 -19.590 1.00 0.00 C ATOM 909 O THR A 65 -43.645 -27.270 -18.451 1.00 0.00 O ATOM 910 CB THR A 65 -43.331 -26.494 -21.759 1.00 0.00 C ATOM 911 OG1 THR A 65 -42.054 -26.894 -21.285 1.00 0.00 O ATOM 912 CG2 THR A 65 -43.228 -25.111 -22.390 1.00 0.00 C ATOM 0 H THR A 65 -43.324 -24.606 -20.223 1.00 0.00 H new ATOM 0 HA THR A 65 -45.340 -26.623 -20.929 1.00 0.00 H new ATOM 0 HB THR A 65 -43.685 -27.202 -22.508 1.00 0.00 H new ATOM 0 HG1 THR A 65 -41.420 -26.917 -22.032 1.00 0.00 H new ATOM 0 HG21 THR A 65 -42.525 -25.142 -23.222 1.00 0.00 H new ATOM 0 HG22 THR A 65 -44.208 -24.804 -22.755 1.00 0.00 H new ATOM 0 HG23 THR A 65 -42.877 -24.396 -21.645 1.00 0.00 H new ATOM 920 N ILE A 66 -43.994 -28.781 -19.992 1.00 0.00 N ATOM 921 CA ILE A 66 -43.636 -29.847 -19.027 1.00 0.00 C ATOM 922 C ILE A 66 -43.642 -31.224 -19.703 1.00 0.00 C ATOM 923 O ILE A 66 -44.113 -31.386 -20.811 1.00 0.00 O ATOM 924 CB ILE A 66 -44.686 -29.749 -17.895 1.00 0.00 C ATOM 925 CG1 ILE A 66 -45.020 -31.134 -17.339 1.00 0.00 C ATOM 926 CG2 ILE A 66 -45.975 -29.104 -18.400 1.00 0.00 C ATOM 927 CD1 ILE A 66 -46.023 -30.972 -16.200 1.00 0.00 C ATOM 0 H ILE A 66 -44.248 -29.094 -20.929 1.00 0.00 H new ATOM 0 HA ILE A 66 -42.627 -29.722 -18.634 1.00 0.00 H new ATOM 0 HB ILE A 66 -44.253 -29.133 -17.107 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -45.437 -31.766 -18.123 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -44.116 -31.626 -16.980 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -46.697 -29.047 -17.585 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -45.760 -28.100 -18.766 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -46.389 -29.704 -19.210 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -46.272 -31.952 -15.792 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -45.587 -30.353 -15.416 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -46.928 -30.495 -16.577 1.00 0.00 H new ATOM 939 N SER A 67 -43.109 -32.213 -19.034 1.00 0.00 N ATOM 940 CA SER A 67 -43.065 -33.584 -19.620 1.00 0.00 C ATOM 941 C SER A 67 -44.469 -34.190 -19.684 1.00 0.00 C ATOM 942 O SER A 67 -44.913 -34.852 -18.767 1.00 0.00 O ATOM 943 CB SER A 67 -42.177 -34.389 -18.671 1.00 0.00 C ATOM 944 OG SER A 67 -40.999 -33.646 -18.381 1.00 0.00 O ATOM 0 H SER A 67 -42.701 -32.129 -18.103 1.00 0.00 H new ATOM 0 HA SER A 67 -42.681 -33.580 -20.640 1.00 0.00 H new ATOM 0 HB2 SER A 67 -42.717 -34.610 -17.750 1.00 0.00 H new ATOM 0 HB3 SER A 67 -41.915 -35.345 -19.124 1.00 0.00 H new ATOM 0 HG SER A 67 -40.212 -34.154 -18.669 1.00 0.00 H new ATOM 950 N ASN A 68 -45.167 -33.977 -20.764 1.00 0.00 N ATOM 951 CA ASN A 68 -46.539 -34.550 -20.896 1.00 0.00 C ATOM 952 C ASN A 68 -47.386 -34.228 -19.661 1.00 0.00 C ATOM 953 O ASN A 68 -48.008 -35.098 -19.089 1.00 0.00 O ATOM 954 CB ASN A 68 -46.323 -36.060 -21.003 1.00 0.00 C ATOM 955 CG ASN A 68 -46.234 -36.466 -22.474 1.00 0.00 C ATOM 956 OD1 ASN A 68 -45.447 -35.921 -23.221 1.00 0.00 O ATOM 957 ND2 ASN A 68 -47.013 -37.412 -22.924 1.00 0.00 N ATOM 0 H ASN A 68 -44.848 -33.430 -21.564 1.00 0.00 H new ATOM 0 HA ASN A 68 -47.068 -34.140 -21.756 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -45.409 -36.344 -20.482 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -47.144 -36.589 -20.519 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -46.961 -37.693 -23.903 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -47.674 -37.870 -22.297 1.00 0.00 H new ATOM 964 N GLY A 69 -47.424 -32.994 -19.245 1.00 0.00 N ATOM 965 CA GLY A 69 -48.245 -32.648 -18.049 1.00 0.00 C ATOM 966 C GLY A 69 -48.484 -31.138 -18.010 1.00 0.00 C ATOM 967 O GLY A 69 -48.422 -30.519 -16.969 1.00 0.00 O ATOM 0 H GLY A 69 -46.927 -32.214 -19.676 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -49.198 -33.176 -18.084 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -47.736 -32.969 -17.140 1.00 0.00 H new ATOM 971 N TYR A 70 -48.741 -30.556 -19.150 1.00 0.00 N ATOM 972 CA TYR A 70 -48.987 -29.083 -19.242 1.00 0.00 C ATOM 973 C TYR A 70 -49.984 -28.580 -18.211 1.00 0.00 C ATOM 974 O TYR A 70 -50.109 -29.081 -17.117 1.00 0.00 O ATOM 975 CB TYR A 70 -49.528 -28.855 -20.653 1.00 0.00 C ATOM 976 CG TYR A 70 -50.783 -29.674 -20.865 1.00 0.00 C ATOM 977 CD1 TYR A 70 -52.031 -29.149 -20.495 1.00 0.00 C ATOM 978 CD2 TYR A 70 -50.707 -30.952 -21.434 1.00 0.00 C ATOM 979 CE1 TYR A 70 -53.195 -29.898 -20.692 1.00 0.00 C ATOM 980 CE2 TYR A 70 -51.874 -31.700 -21.632 1.00 0.00 C ATOM 981 CZ TYR A 70 -53.117 -31.174 -21.261 1.00 0.00 C ATOM 982 OH TYR A 70 -54.265 -31.913 -21.457 1.00 0.00 O ATOM 0 H TYR A 70 -48.792 -31.048 -20.042 1.00 0.00 H new ATOM 0 HA TYR A 70 -48.067 -28.534 -19.042 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -49.745 -27.797 -20.802 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -48.774 -29.132 -21.390 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -52.092 -28.164 -20.057 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -49.749 -31.360 -21.720 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -54.154 -29.492 -20.405 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -51.815 -32.685 -22.072 1.00 0.00 H new ATOM 0 HH TYR A 70 -54.034 -32.775 -21.863 1.00 0.00 H new ATOM 992 N LEU A 71 -50.645 -27.536 -18.562 1.00 0.00 N ATOM 993 CA LEU A 71 -51.604 -26.886 -17.646 1.00 0.00 C ATOM 994 C LEU A 71 -52.811 -26.392 -18.435 1.00 0.00 C ATOM 995 O LEU A 71 -52.689 -25.631 -19.374 1.00 0.00 O ATOM 996 CB LEU A 71 -50.810 -25.713 -17.038 1.00 0.00 C ATOM 997 CG LEU A 71 -49.770 -25.175 -18.038 1.00 0.00 C ATOM 998 CD1 LEU A 71 -50.369 -24.045 -18.861 1.00 0.00 C ATOM 999 CD2 LEU A 71 -48.569 -24.668 -17.271 1.00 0.00 C ATOM 0 H LEU A 71 -50.561 -27.088 -19.474 1.00 0.00 H new ATOM 0 HA LEU A 71 -51.990 -27.554 -16.876 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -51.495 -24.914 -16.754 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -50.309 -26.041 -16.128 1.00 0.00 H new ATOM 0 HG LEU A 71 -49.468 -25.975 -18.714 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -49.624 -23.673 -19.564 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -51.235 -24.415 -19.411 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -50.678 -23.237 -18.198 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -47.826 -24.285 -17.970 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -48.879 -23.870 -16.597 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -48.136 -25.484 -16.693 1.00 0.00 H new ATOM 1011 N SER A 72 -53.976 -26.836 -18.067 1.00 0.00 N ATOM 1012 CA SER A 72 -55.198 -26.414 -18.796 1.00 0.00 C ATOM 1013 C SER A 72 -55.917 -25.308 -18.016 1.00 0.00 C ATOM 1014 O SER A 72 -57.067 -25.003 -18.264 1.00 0.00 O ATOM 1015 CB SER A 72 -56.054 -27.675 -18.860 1.00 0.00 C ATOM 1016 OG SER A 72 -57.360 -27.338 -19.307 1.00 0.00 O ATOM 0 H SER A 72 -54.135 -27.476 -17.289 1.00 0.00 H new ATOM 0 HA SER A 72 -54.984 -26.012 -19.786 1.00 0.00 H new ATOM 0 HB2 SER A 72 -55.602 -28.400 -19.537 1.00 0.00 H new ATOM 0 HB3 SER A 72 -56.104 -28.144 -17.877 1.00 0.00 H new ATOM 0 HG SER A 72 -57.505 -26.375 -19.198 1.00 0.00 H new ATOM 1022 N SER A 73 -55.246 -24.715 -17.065 1.00 0.00 N ATOM 1023 CA SER A 73 -55.883 -23.637 -16.252 1.00 0.00 C ATOM 1024 C SER A 73 -55.959 -22.327 -17.042 1.00 0.00 C ATOM 1025 O SER A 73 -56.919 -22.067 -17.740 1.00 0.00 O ATOM 1026 CB SER A 73 -54.972 -23.475 -15.037 1.00 0.00 C ATOM 1027 OG SER A 73 -55.364 -22.320 -14.307 1.00 0.00 O ATOM 0 H SER A 73 -54.281 -24.931 -16.815 1.00 0.00 H new ATOM 0 HA SER A 73 -56.906 -23.889 -15.974 1.00 0.00 H new ATOM 0 HB2 SER A 73 -55.033 -24.359 -14.402 1.00 0.00 H new ATOM 0 HB3 SER A 73 -53.934 -23.383 -15.356 1.00 0.00 H new ATOM 0 HG SER A 73 -54.782 -22.214 -13.525 1.00 0.00 H new ATOM 1033 N GLY A 74 -54.961 -21.492 -16.930 1.00 0.00 N ATOM 1034 CA GLY A 74 -54.990 -20.197 -17.664 1.00 0.00 C ATOM 1035 C GLY A 74 -53.635 -19.936 -18.317 1.00 0.00 C ATOM 1036 O GLY A 74 -52.816 -19.198 -17.805 1.00 0.00 O ATOM 0 H GLY A 74 -54.129 -21.652 -16.362 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -55.771 -20.218 -18.424 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -55.234 -19.386 -16.978 1.00 0.00 H new ATOM 1040 N PHE A 75 -53.397 -20.529 -19.450 1.00 0.00 N ATOM 1041 CA PHE A 75 -52.100 -20.311 -20.149 1.00 0.00 C ATOM 1042 C PHE A 75 -52.284 -19.286 -21.271 1.00 0.00 C ATOM 1043 O PHE A 75 -53.127 -19.434 -22.134 1.00 0.00 O ATOM 1044 CB PHE A 75 -51.706 -21.695 -20.689 1.00 0.00 C ATOM 1045 CG PHE A 75 -50.972 -21.579 -22.012 1.00 0.00 C ATOM 1046 CD1 PHE A 75 -50.005 -20.583 -22.198 1.00 0.00 C ATOM 1047 CD2 PHE A 75 -51.260 -22.473 -23.051 1.00 0.00 C ATOM 1048 CE1 PHE A 75 -49.330 -20.481 -23.421 1.00 0.00 C ATOM 1049 CE2 PHE A 75 -50.583 -22.370 -24.273 1.00 0.00 C ATOM 1050 CZ PHE A 75 -49.619 -21.374 -24.458 1.00 0.00 C ATOM 0 H PHE A 75 -54.045 -21.157 -19.925 1.00 0.00 H new ATOM 0 HA PHE A 75 -51.322 -19.912 -19.498 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -51.073 -22.205 -19.963 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -52.599 -22.306 -20.818 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -49.780 -19.893 -21.398 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -52.005 -23.242 -22.910 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -48.585 -19.712 -23.564 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -50.806 -23.060 -25.073 1.00 0.00 H new ATOM 0 HZ PHE A 75 -49.098 -21.294 -25.401 1.00 0.00 H new ATOM 1060 N LYS A 76 -51.497 -18.248 -21.260 1.00 0.00 N ATOM 1061 CA LYS A 76 -51.614 -17.207 -22.316 1.00 0.00 C ATOM 1062 C LYS A 76 -50.381 -17.242 -23.222 1.00 0.00 C ATOM 1063 O LYS A 76 -49.298 -17.589 -22.793 1.00 0.00 O ATOM 1064 CB LYS A 76 -51.683 -15.888 -21.548 1.00 0.00 C ATOM 1065 CG LYS A 76 -51.712 -14.718 -22.531 1.00 0.00 C ATOM 1066 CD LYS A 76 -51.421 -13.419 -21.778 1.00 0.00 C ATOM 1067 CE LYS A 76 -52.737 -12.704 -21.465 1.00 0.00 C ATOM 1068 NZ LYS A 76 -53.104 -11.998 -22.724 1.00 0.00 N ATOM 0 H LYS A 76 -50.774 -18.075 -20.561 1.00 0.00 H new ATOM 0 HA LYS A 76 -52.483 -17.352 -22.958 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -52.573 -15.869 -20.919 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -50.822 -15.797 -20.885 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -50.972 -14.870 -23.317 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -52.686 -14.660 -23.017 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -50.883 -13.634 -20.855 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -50.779 -12.775 -22.378 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -53.511 -13.413 -21.171 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -52.618 -12.002 -20.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -52.996 -10.972 -22.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -52.480 -12.314 -23.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -54.092 -12.214 -22.968 1.00 0.00 H new ATOM 1082 N ARG A 77 -50.535 -16.887 -24.469 1.00 0.00 N ATOM 1083 CA ARG A 77 -49.369 -16.901 -25.401 1.00 0.00 C ATOM 1084 C ARG A 77 -48.130 -16.349 -24.697 1.00 0.00 C ATOM 1085 O ARG A 77 -47.039 -16.865 -24.835 1.00 0.00 O ATOM 1086 CB ARG A 77 -49.778 -15.992 -26.560 1.00 0.00 C ATOM 1087 CG ARG A 77 -49.445 -16.676 -27.886 1.00 0.00 C ATOM 1088 CD ARG A 77 -49.662 -15.692 -29.038 1.00 0.00 C ATOM 1089 NE ARG A 77 -48.337 -15.584 -29.707 1.00 0.00 N ATOM 1090 CZ ARG A 77 -47.828 -14.410 -29.961 1.00 0.00 C ATOM 1091 NH1 ARG A 77 -48.614 -13.382 -30.139 1.00 0.00 N ATOM 1092 NH2 ARG A 77 -46.533 -14.263 -30.036 1.00 0.00 N ATOM 0 H ARG A 77 -51.418 -16.588 -24.883 1.00 0.00 H new ATOM 0 HA ARG A 77 -49.121 -17.906 -25.741 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -50.845 -15.776 -26.508 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -49.256 -15.038 -26.490 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -48.411 -17.022 -27.879 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -50.075 -17.555 -28.022 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -50.424 -16.054 -29.728 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -49.999 -14.723 -28.671 1.00 0.00 H new ATOM 0 HE ARG A 77 -47.827 -16.428 -29.967 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -49.626 -13.497 -30.079 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -48.216 -12.464 -30.338 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -45.920 -15.066 -29.896 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -46.135 -13.345 -30.235 1.00 0.00 H new ATOM 1106 N SER A 78 -48.296 -15.305 -23.938 1.00 0.00 N ATOM 1107 CA SER A 78 -47.135 -14.713 -23.213 1.00 0.00 C ATOM 1108 C SER A 78 -47.543 -14.345 -21.784 1.00 0.00 C ATOM 1109 O SER A 78 -48.695 -14.074 -21.508 1.00 0.00 O ATOM 1110 CB SER A 78 -46.766 -13.460 -24.006 1.00 0.00 C ATOM 1111 OG SER A 78 -46.314 -13.840 -25.299 1.00 0.00 O ATOM 0 H SER A 78 -49.187 -14.833 -23.786 1.00 0.00 H new ATOM 0 HA SER A 78 -46.296 -15.405 -23.138 1.00 0.00 H new ATOM 0 HB2 SER A 78 -47.630 -12.801 -24.089 1.00 0.00 H new ATOM 0 HB3 SER A 78 -45.988 -12.902 -23.485 1.00 0.00 H new ATOM 0 HG SER A 78 -46.078 -13.039 -25.812 1.00 0.00 H new ATOM 1117 N TYR A 79 -46.610 -14.334 -20.873 1.00 0.00 N ATOM 1118 CA TYR A 79 -46.951 -13.984 -19.461 1.00 0.00 C ATOM 1119 C TYR A 79 -46.058 -12.840 -18.979 1.00 0.00 C ATOM 1120 O TYR A 79 -45.441 -12.146 -19.762 1.00 0.00 O ATOM 1121 CB TYR A 79 -46.671 -15.243 -18.629 1.00 0.00 C ATOM 1122 CG TYR A 79 -46.919 -16.493 -19.443 1.00 0.00 C ATOM 1123 CD1 TYR A 79 -45.998 -16.884 -20.423 1.00 0.00 C ATOM 1124 CD2 TYR A 79 -48.061 -17.268 -19.208 1.00 0.00 C ATOM 1125 CE1 TYR A 79 -46.219 -18.046 -21.167 1.00 0.00 C ATOM 1126 CE2 TYR A 79 -48.280 -18.434 -19.951 1.00 0.00 C ATOM 1127 CZ TYR A 79 -47.358 -18.823 -20.931 1.00 0.00 C ATOM 1128 OH TYR A 79 -47.569 -19.974 -21.657 1.00 0.00 O ATOM 0 H TYR A 79 -45.628 -14.551 -21.042 1.00 0.00 H new ATOM 0 HA TYR A 79 -47.989 -13.664 -19.369 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -45.639 -15.231 -18.279 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -47.307 -15.248 -17.744 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -45.116 -16.287 -20.604 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -48.773 -16.966 -18.454 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -45.510 -18.344 -21.925 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -49.160 -19.033 -19.769 1.00 0.00 H new ATOM 0 HH TYR A 79 -48.405 -19.894 -22.162 1.00 0.00 H new ATOM 1138 N SER A 80 -45.976 -12.647 -17.692 1.00 0.00 N ATOM 1139 CA SER A 80 -45.114 -11.560 -17.156 1.00 0.00 C ATOM 1140 C SER A 80 -44.666 -11.914 -15.730 1.00 0.00 C ATOM 1141 O SER A 80 -43.789 -12.729 -15.536 1.00 0.00 O ATOM 1142 CB SER A 80 -45.992 -10.310 -17.173 1.00 0.00 C ATOM 1143 OG SER A 80 -45.868 -9.668 -18.436 1.00 0.00 O ATOM 0 H SER A 80 -46.470 -13.196 -16.989 1.00 0.00 H new ATOM 0 HA SER A 80 -44.207 -11.410 -17.741 1.00 0.00 H new ATOM 0 HB2 SER A 80 -47.032 -10.579 -16.989 1.00 0.00 H new ATOM 0 HB3 SER A 80 -45.693 -9.630 -16.375 1.00 0.00 H new ATOM 0 HG SER A 80 -45.561 -10.316 -19.104 1.00 0.00 H new ATOM 1149 N TYR A 81 -45.260 -11.323 -14.730 1.00 0.00 N ATOM 1150 CA TYR A 81 -44.870 -11.648 -13.332 1.00 0.00 C ATOM 1151 C TYR A 81 -46.042 -12.386 -12.666 1.00 0.00 C ATOM 1152 O TYR A 81 -47.188 -12.042 -12.863 1.00 0.00 O ATOM 1153 CB TYR A 81 -44.560 -10.282 -12.695 1.00 0.00 C ATOM 1154 CG TYR A 81 -45.329 -10.073 -11.415 1.00 0.00 C ATOM 1155 CD1 TYR A 81 -45.148 -10.943 -10.337 1.00 0.00 C ATOM 1156 CD2 TYR A 81 -46.214 -8.995 -11.307 1.00 0.00 C ATOM 1157 CE1 TYR A 81 -45.854 -10.737 -9.147 1.00 0.00 C ATOM 1158 CE2 TYR A 81 -46.921 -8.787 -10.119 1.00 0.00 C ATOM 1159 CZ TYR A 81 -46.742 -9.658 -9.037 1.00 0.00 C ATOM 1160 OH TYR A 81 -47.439 -9.453 -7.864 1.00 0.00 O ATOM 0 H TYR A 81 -46.000 -10.627 -14.823 1.00 0.00 H new ATOM 0 HA TYR A 81 -44.006 -12.305 -13.235 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -43.491 -10.209 -12.493 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -44.806 -9.488 -13.400 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -44.464 -11.774 -10.422 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -46.351 -8.323 -12.142 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -45.715 -11.409 -8.313 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -47.605 -7.955 -10.036 1.00 0.00 H new ATOM 0 HH TYR A 81 -48.009 -8.661 -7.956 1.00 0.00 H new ATOM 1170 N ASN A 82 -45.753 -13.415 -11.916 1.00 0.00 N ATOM 1171 CA ASN A 82 -46.826 -14.223 -11.252 1.00 0.00 C ATOM 1172 C ASN A 82 -47.592 -15.055 -12.286 1.00 0.00 C ATOM 1173 O ASN A 82 -47.102 -16.058 -12.751 1.00 0.00 O ATOM 1174 CB ASN A 82 -47.751 -13.230 -10.543 1.00 0.00 C ATOM 1175 CG ASN A 82 -48.789 -14.004 -9.728 1.00 0.00 C ATOM 1176 OD1 ASN A 82 -49.386 -14.942 -10.217 1.00 0.00 O ATOM 1177 ND2 ASN A 82 -49.032 -13.646 -8.497 1.00 0.00 N ATOM 0 H ASN A 82 -44.804 -13.738 -11.730 1.00 0.00 H new ATOM 0 HA ASN A 82 -46.402 -14.928 -10.536 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -47.172 -12.577 -9.890 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -48.247 -12.591 -11.274 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -49.723 -14.154 -7.945 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -48.531 -12.858 -8.087 1.00 0.00 H new ATOM 1184 N ASP A 83 -48.787 -14.671 -12.645 1.00 0.00 N ATOM 1185 CA ASP A 83 -49.551 -15.486 -13.635 1.00 0.00 C ATOM 1186 C ASP A 83 -49.436 -16.967 -13.269 1.00 0.00 C ATOM 1187 O ASP A 83 -48.717 -17.720 -13.896 1.00 0.00 O ATOM 1188 CB ASP A 83 -48.889 -15.211 -14.986 1.00 0.00 C ATOM 1189 CG ASP A 83 -48.910 -13.708 -15.272 1.00 0.00 C ATOM 1190 OD1 ASP A 83 -49.609 -13.001 -14.565 1.00 0.00 O ATOM 1191 OD2 ASP A 83 -48.230 -13.292 -16.195 1.00 0.00 O ATOM 0 H ASP A 83 -49.264 -13.838 -12.301 1.00 0.00 H new ATOM 0 HA ASP A 83 -50.611 -15.234 -13.655 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -47.862 -15.576 -14.980 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -49.414 -15.749 -15.776 1.00 0.00 H new ATOM 1196 N ASN A 84 -50.126 -17.384 -12.241 1.00 0.00 N ATOM 1197 CA ASN A 84 -50.047 -18.810 -11.809 1.00 0.00 C ATOM 1198 C ASN A 84 -50.727 -19.733 -12.828 1.00 0.00 C ATOM 1199 O ASN A 84 -51.772 -19.420 -13.363 1.00 0.00 O ATOM 1200 CB ASN A 84 -50.791 -18.857 -10.475 1.00 0.00 C ATOM 1201 CG ASN A 84 -50.047 -19.778 -9.506 1.00 0.00 C ATOM 1202 OD1 ASN A 84 -49.500 -19.273 -8.435 1.00 0.00 O flip ATOM 1203 ND2 ASN A 84 -49.963 -20.970 -9.727 1.00 0.00 N flip ATOM 0 H ASN A 84 -50.743 -16.796 -11.680 1.00 0.00 H new ATOM 0 HA ASN A 84 -49.015 -19.149 -11.724 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -50.867 -17.855 -10.054 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -51.808 -19.217 -10.627 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -50.391 -21.365 -10.565 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -49.465 -21.576 -9.075 1.00 0.00 H new ATOM 1210 N VAL A 85 -50.148 -20.878 -13.085 1.00 0.00 N ATOM 1211 CA VAL A 85 -50.769 -21.831 -14.053 1.00 0.00 C ATOM 1212 C VAL A 85 -50.861 -23.229 -13.431 1.00 0.00 C ATOM 1213 O VAL A 85 -49.878 -23.777 -12.973 1.00 0.00 O ATOM 1214 CB VAL A 85 -49.841 -21.861 -15.271 1.00 0.00 C ATOM 1215 CG1 VAL A 85 -50.050 -20.599 -16.107 1.00 0.00 C ATOM 1216 CG2 VAL A 85 -48.382 -21.930 -14.817 1.00 0.00 C ATOM 0 H VAL A 85 -49.273 -21.194 -12.667 1.00 0.00 H new ATOM 0 HA VAL A 85 -51.779 -21.523 -14.324 1.00 0.00 H new ATOM 0 HB VAL A 85 -50.073 -22.741 -15.870 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -49.389 -20.623 -16.973 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -51.086 -20.552 -16.443 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -49.825 -19.721 -15.502 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -47.730 -21.951 -15.690 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -48.148 -21.055 -14.210 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -48.227 -22.833 -14.227 1.00 0.00 H new ATOM 1226 N ASP A 86 -52.027 -23.817 -13.419 1.00 0.00 N ATOM 1227 CA ASP A 86 -52.164 -25.185 -12.836 1.00 0.00 C ATOM 1228 C ASP A 86 -51.855 -26.225 -13.910 1.00 0.00 C ATOM 1229 O ASP A 86 -52.325 -26.132 -15.025 1.00 0.00 O ATOM 1230 CB ASP A 86 -53.621 -25.285 -12.388 1.00 0.00 C ATOM 1231 CG ASP A 86 -53.674 -25.438 -10.867 1.00 0.00 C ATOM 1232 OD1 ASP A 86 -53.498 -24.442 -10.185 1.00 0.00 O ATOM 1233 OD2 ASP A 86 -53.891 -26.548 -10.409 1.00 0.00 O ATOM 0 H ASP A 86 -52.888 -23.412 -13.786 1.00 0.00 H new ATOM 0 HA ASP A 86 -51.480 -25.361 -12.006 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -54.169 -24.394 -12.695 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -54.103 -26.137 -12.868 1.00 0.00 H new ATOM 1238 N PHE A 87 -51.051 -27.201 -13.597 1.00 0.00 N ATOM 1239 CA PHE A 87 -50.699 -28.218 -14.624 1.00 0.00 C ATOM 1240 C PHE A 87 -51.683 -29.386 -14.631 1.00 0.00 C ATOM 1241 O PHE A 87 -52.260 -29.746 -13.624 1.00 0.00 O ATOM 1242 CB PHE A 87 -49.290 -28.673 -14.260 1.00 0.00 C ATOM 1243 CG PHE A 87 -48.342 -27.562 -14.620 1.00 0.00 C ATOM 1244 CD1 PHE A 87 -48.274 -26.417 -13.820 1.00 0.00 C ATOM 1245 CD2 PHE A 87 -47.556 -27.661 -15.771 1.00 0.00 C ATOM 1246 CE1 PHE A 87 -47.420 -25.368 -14.172 1.00 0.00 C ATOM 1247 CE2 PHE A 87 -46.696 -26.616 -16.121 1.00 0.00 C ATOM 1248 CZ PHE A 87 -46.631 -25.469 -15.322 1.00 0.00 C ATOM 0 H PHE A 87 -50.625 -27.338 -12.681 1.00 0.00 H new ATOM 0 HA PHE A 87 -50.746 -27.804 -15.631 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -49.225 -28.901 -13.196 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -49.032 -29.585 -14.798 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -48.881 -26.343 -12.930 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -47.613 -28.544 -16.390 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -47.370 -24.482 -13.557 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -46.083 -26.694 -17.007 1.00 0.00 H new ATOM 0 HZ PHE A 87 -45.970 -24.660 -15.594 1.00 0.00 H new ATOM 1258 N LYS A 88 -51.876 -29.967 -15.782 1.00 0.00 N ATOM 1259 CA LYS A 88 -52.818 -31.108 -15.919 1.00 0.00 C ATOM 1260 C LYS A 88 -52.081 -32.334 -16.462 1.00 0.00 C ATOM 1261 O LYS A 88 -51.992 -32.536 -17.657 1.00 0.00 O ATOM 1262 CB LYS A 88 -53.843 -30.619 -16.937 1.00 0.00 C ATOM 1263 CG LYS A 88 -55.252 -30.986 -16.466 1.00 0.00 C ATOM 1264 CD LYS A 88 -55.672 -32.317 -17.093 1.00 0.00 C ATOM 1265 CE LYS A 88 -57.075 -32.181 -17.689 1.00 0.00 C ATOM 1266 NZ LYS A 88 -57.768 -33.450 -17.335 1.00 0.00 N ATOM 0 H LYS A 88 -51.411 -29.693 -16.648 1.00 0.00 H new ATOM 0 HA LYS A 88 -53.270 -31.401 -14.971 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -53.760 -29.539 -17.061 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -53.646 -31.068 -17.911 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -55.275 -31.061 -15.379 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -55.956 -30.202 -16.746 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -54.962 -32.606 -17.868 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -55.660 -33.105 -16.340 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -57.597 -31.318 -17.277 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -57.033 -32.042 -18.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -58.738 -33.432 -17.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -57.252 -34.254 -17.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -57.799 -33.552 -16.300 1.00 0.00 H new ATOM 1280 N CYS A 89 -51.549 -33.152 -15.598 1.00 0.00 N ATOM 1281 CA CYS A 89 -50.815 -34.357 -16.076 1.00 0.00 C ATOM 1282 C CYS A 89 -51.582 -35.035 -17.216 1.00 0.00 C ATOM 1283 O CYS A 89 -52.739 -35.381 -17.082 1.00 0.00 O ATOM 1284 CB CYS A 89 -50.725 -35.279 -14.864 1.00 0.00 C ATOM 1285 SG CYS A 89 -49.040 -35.922 -14.745 1.00 0.00 S ATOM 0 H CYS A 89 -51.590 -33.039 -14.585 1.00 0.00 H new ATOM 0 HA CYS A 89 -49.829 -34.106 -16.468 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -50.986 -34.735 -13.956 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -51.436 -36.099 -14.960 1.00 0.00 H new ATOM 1290 N LYS A 90 -50.942 -35.219 -18.337 1.00 0.00 N ATOM 1291 CA LYS A 90 -51.623 -35.868 -19.496 1.00 0.00 C ATOM 1292 C LYS A 90 -52.471 -37.061 -19.032 1.00 0.00 C ATOM 1293 O LYS A 90 -53.659 -36.945 -18.804 1.00 0.00 O ATOM 1294 CB LYS A 90 -50.483 -36.348 -20.397 1.00 0.00 C ATOM 1295 CG LYS A 90 -50.424 -35.480 -21.656 1.00 0.00 C ATOM 1296 CD LYS A 90 -51.462 -35.971 -22.667 1.00 0.00 C ATOM 1297 CE LYS A 90 -50.972 -37.267 -23.315 1.00 0.00 C ATOM 1298 NZ LYS A 90 -52.211 -37.975 -23.740 1.00 0.00 N ATOM 0 H LYS A 90 -49.973 -34.947 -18.503 1.00 0.00 H new ATOM 0 HA LYS A 90 -52.300 -35.184 -20.007 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -49.535 -36.294 -19.861 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -50.636 -37.392 -20.670 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -50.615 -34.438 -21.401 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -49.427 -35.523 -22.093 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -52.417 -36.139 -22.170 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -51.629 -35.211 -23.430 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -50.322 -37.062 -24.166 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -50.396 -37.867 -22.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -52.014 -38.539 -24.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -52.531 -38.603 -22.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -52.954 -37.278 -23.950 1.00 0.00 H new ATOM 1312 N TYR A 91 -51.860 -38.208 -18.897 1.00 0.00 N ATOM 1313 CA TYR A 91 -52.607 -39.424 -18.456 1.00 0.00 C ATOM 1314 C TYR A 91 -52.433 -39.639 -16.958 1.00 0.00 C ATOM 1315 O TYR A 91 -52.071 -38.741 -16.226 1.00 0.00 O ATOM 1316 CB TYR A 91 -51.968 -40.574 -19.237 1.00 0.00 C ATOM 1317 CG TYR A 91 -52.918 -41.042 -20.313 1.00 0.00 C ATOM 1318 CD1 TYR A 91 -53.425 -40.129 -21.245 1.00 0.00 C ATOM 1319 CD2 TYR A 91 -53.292 -42.390 -20.379 1.00 0.00 C ATOM 1320 CE1 TYR A 91 -54.305 -40.563 -22.244 1.00 0.00 C ATOM 1321 CE2 TYR A 91 -54.172 -42.824 -21.378 1.00 0.00 C ATOM 1322 CZ TYR A 91 -54.679 -41.910 -22.310 1.00 0.00 C ATOM 1323 OH TYR A 91 -55.546 -42.338 -23.295 1.00 0.00 O ATOM 0 H TYR A 91 -50.867 -38.356 -19.075 1.00 0.00 H new ATOM 0 HA TYR A 91 -53.678 -39.342 -18.640 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -51.029 -40.247 -19.683 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -51.731 -41.397 -18.563 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -53.137 -39.089 -21.194 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -52.902 -43.095 -19.660 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -54.695 -39.858 -22.964 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -54.460 -43.864 -21.430 1.00 0.00 H new ATOM 0 HH TYR A 91 -55.701 -43.301 -23.199 1.00 0.00 H new ATOM 1333 N GLY A 92 -52.694 -40.829 -16.508 1.00 0.00 N ATOM 1334 CA GLY A 92 -52.550 -41.149 -15.055 1.00 0.00 C ATOM 1335 C GLY A 92 -51.075 -41.051 -14.659 1.00 0.00 C ATOM 1336 O GLY A 92 -50.476 -41.999 -14.190 1.00 0.00 O ATOM 0 H GLY A 92 -53.006 -41.608 -17.088 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -53.145 -40.458 -14.458 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -52.927 -42.152 -14.853 1.00 0.00 H new ATOM 1340 N TYR A 93 -50.494 -39.907 -14.858 1.00 0.00 N ATOM 1341 CA TYR A 93 -49.058 -39.699 -14.520 1.00 0.00 C ATOM 1342 C TYR A 93 -48.948 -38.722 -13.345 1.00 0.00 C ATOM 1343 O TYR A 93 -49.871 -37.989 -13.051 1.00 0.00 O ATOM 1344 CB TYR A 93 -48.475 -39.091 -15.793 1.00 0.00 C ATOM 1345 CG TYR A 93 -47.951 -40.180 -16.700 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -48.454 -41.482 -16.599 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -46.965 -39.882 -17.647 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -47.969 -42.487 -17.445 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -46.480 -40.887 -18.493 1.00 0.00 C ATOM 1350 CZ TYR A 93 -46.982 -42.190 -18.391 1.00 0.00 C ATOM 1351 OH TYR A 93 -46.505 -43.180 -19.225 1.00 0.00 O ATOM 0 H TYR A 93 -50.961 -39.088 -15.249 1.00 0.00 H new ATOM 0 HA TYR A 93 -48.540 -40.610 -14.221 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -49.240 -38.513 -16.312 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -47.670 -38.401 -15.539 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -49.216 -41.712 -15.869 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -46.578 -38.877 -17.725 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -48.357 -43.492 -17.367 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -45.719 -40.657 -19.224 1.00 0.00 H new ATOM 0 HH TYR A 93 -45.825 -42.805 -19.822 1.00 0.00 H new ATOM 1361 N LYS A 94 -47.836 -38.706 -12.666 1.00 0.00 N ATOM 1362 CA LYS A 94 -47.691 -37.775 -11.510 1.00 0.00 C ATOM 1363 C LYS A 94 -46.873 -36.545 -11.911 1.00 0.00 C ATOM 1364 O LYS A 94 -45.862 -36.648 -12.570 1.00 0.00 O ATOM 1365 CB LYS A 94 -46.954 -38.582 -10.441 1.00 0.00 C ATOM 1366 CG LYS A 94 -46.444 -37.639 -9.352 1.00 0.00 C ATOM 1367 CD LYS A 94 -46.122 -38.445 -8.094 1.00 0.00 C ATOM 1368 CE LYS A 94 -44.687 -38.155 -7.651 1.00 0.00 C ATOM 1369 NZ LYS A 94 -44.678 -38.419 -6.185 1.00 0.00 N ATOM 0 H LYS A 94 -47.025 -39.293 -12.859 1.00 0.00 H new ATOM 0 HA LYS A 94 -48.655 -37.410 -11.156 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -47.621 -39.327 -10.008 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -46.120 -39.123 -10.889 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -45.554 -37.113 -9.698 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -47.196 -36.882 -9.130 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -46.819 -38.187 -7.296 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -46.244 -39.510 -8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -43.976 -38.795 -8.172 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -44.407 -37.124 -7.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -43.726 -38.242 -5.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -45.360 -37.790 -5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -44.942 -39.409 -6.009 1.00 0.00 H new ATOM 1383 N LEU A 95 -47.294 -35.379 -11.515 1.00 0.00 N ATOM 1384 CA LEU A 95 -46.520 -34.160 -11.877 1.00 0.00 C ATOM 1385 C LEU A 95 -45.319 -34.013 -10.943 1.00 0.00 C ATOM 1386 O LEU A 95 -45.404 -33.400 -9.897 1.00 0.00 O ATOM 1387 CB LEU A 95 -47.492 -32.995 -11.687 1.00 0.00 C ATOM 1388 CG LEU A 95 -48.453 -32.928 -12.874 1.00 0.00 C ATOM 1389 CD1 LEU A 95 -49.873 -32.662 -12.371 1.00 0.00 C ATOM 1390 CD2 LEU A 95 -48.025 -31.797 -13.811 1.00 0.00 C ATOM 0 H LEU A 95 -48.134 -35.216 -10.960 1.00 0.00 H new ATOM 0 HA LEU A 95 -46.135 -34.201 -12.896 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -48.052 -33.123 -10.760 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -46.940 -32.059 -11.600 1.00 0.00 H new ATOM 0 HG LEU A 95 -48.431 -33.876 -13.411 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -50.556 -32.615 -13.219 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -50.179 -33.467 -11.703 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -49.897 -31.715 -11.832 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -48.709 -31.748 -14.658 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -48.046 -30.850 -13.272 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -47.014 -31.986 -14.172 1.00 0.00 H new ATOM 1402 N SER A 96 -44.199 -34.569 -11.310 1.00 0.00 N ATOM 1403 CA SER A 96 -42.997 -34.457 -10.440 1.00 0.00 C ATOM 1404 C SER A 96 -42.484 -33.014 -10.446 1.00 0.00 C ATOM 1405 O SER A 96 -41.841 -32.580 -11.381 1.00 0.00 O ATOM 1406 CB SER A 96 -41.970 -35.403 -11.063 1.00 0.00 C ATOM 1407 OG SER A 96 -40.728 -34.726 -11.201 1.00 0.00 O ATOM 0 H SER A 96 -44.064 -35.095 -12.173 1.00 0.00 H new ATOM 0 HA SER A 96 -43.204 -34.716 -9.402 1.00 0.00 H new ATOM 0 HB2 SER A 96 -41.847 -36.287 -10.438 1.00 0.00 H new ATOM 0 HB3 SER A 96 -42.319 -35.747 -12.036 1.00 0.00 H new ATOM 0 HG SER A 96 -40.861 -33.899 -11.709 1.00 0.00 H new ATOM 1413 N GLY A 97 -42.767 -32.264 -9.414 1.00 0.00 N ATOM 1414 CA GLY A 97 -42.293 -30.850 -9.373 1.00 0.00 C ATOM 1415 C GLY A 97 -43.355 -29.957 -8.728 1.00 0.00 C ATOM 1416 O GLY A 97 -43.246 -29.573 -7.581 1.00 0.00 O ATOM 0 H GLY A 97 -43.303 -32.568 -8.601 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -41.362 -30.787 -8.809 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -42.078 -30.501 -10.383 1.00 0.00 H new ATOM 1420 N SER A 98 -44.376 -29.614 -9.463 1.00 0.00 N ATOM 1421 CA SER A 98 -45.443 -28.732 -8.902 1.00 0.00 C ATOM 1422 C SER A 98 -46.632 -28.640 -9.868 1.00 0.00 C ATOM 1423 O SER A 98 -46.507 -28.161 -10.978 1.00 0.00 O ATOM 1424 CB SER A 98 -44.769 -27.372 -8.748 1.00 0.00 C ATOM 1425 OG SER A 98 -45.300 -26.710 -7.608 1.00 0.00 O ATOM 0 H SER A 98 -44.520 -29.906 -10.430 1.00 0.00 H new ATOM 0 HA SER A 98 -45.841 -29.108 -7.959 1.00 0.00 H new ATOM 0 HB2 SER A 98 -43.692 -27.498 -8.641 1.00 0.00 H new ATOM 0 HB3 SER A 98 -44.932 -26.769 -9.641 1.00 0.00 H new ATOM 0 HG SER A 98 -45.846 -25.949 -7.896 1.00 0.00 H new ATOM 1431 N SER A 99 -47.784 -29.097 -9.453 1.00 0.00 N ATOM 1432 CA SER A 99 -48.983 -29.045 -10.345 1.00 0.00 C ATOM 1433 C SER A 99 -49.483 -27.606 -10.508 1.00 0.00 C ATOM 1434 O SER A 99 -50.432 -27.349 -11.224 1.00 0.00 O ATOM 1435 CB SER A 99 -50.035 -29.901 -9.640 1.00 0.00 C ATOM 1436 OG SER A 99 -50.996 -29.055 -9.021 1.00 0.00 O ATOM 0 H SER A 99 -47.948 -29.505 -8.533 1.00 0.00 H new ATOM 0 HA SER A 99 -48.759 -29.408 -11.348 1.00 0.00 H new ATOM 0 HB2 SER A 99 -50.523 -30.560 -10.357 1.00 0.00 H new ATOM 0 HB3 SER A 99 -49.561 -30.538 -8.893 1.00 0.00 H new ATOM 0 HG SER A 99 -51.672 -29.603 -8.570 1.00 0.00 H new ATOM 1442 N SER A 100 -48.855 -26.666 -9.860 1.00 0.00 N ATOM 1443 CA SER A 100 -49.299 -25.248 -9.992 1.00 0.00 C ATOM 1444 C SER A 100 -48.085 -24.319 -9.952 1.00 0.00 C ATOM 1445 O SER A 100 -47.420 -24.196 -8.942 1.00 0.00 O ATOM 1446 CB SER A 100 -50.214 -25.002 -8.792 1.00 0.00 C ATOM 1447 OG SER A 100 -49.424 -24.679 -7.656 1.00 0.00 O ATOM 0 H SER A 100 -48.055 -26.816 -9.245 1.00 0.00 H new ATOM 0 HA SER A 100 -49.815 -25.057 -10.933 1.00 0.00 H new ATOM 0 HB2 SER A 100 -50.907 -24.190 -9.010 1.00 0.00 H new ATOM 0 HB3 SER A 100 -50.815 -25.889 -8.591 1.00 0.00 H new ATOM 0 HG SER A 100 -48.505 -24.990 -7.797 1.00 0.00 H new ATOM 1453 N SER A 101 -47.781 -23.674 -11.045 1.00 0.00 N ATOM 1454 CA SER A 101 -46.598 -22.766 -11.066 1.00 0.00 C ATOM 1455 C SER A 101 -47.016 -21.328 -11.362 1.00 0.00 C ATOM 1456 O SER A 101 -48.171 -21.038 -11.594 1.00 0.00 O ATOM 1457 CB SER A 101 -45.709 -23.304 -12.187 1.00 0.00 C ATOM 1458 OG SER A 101 -45.669 -24.724 -12.116 1.00 0.00 O ATOM 0 H SER A 101 -48.298 -23.736 -11.922 1.00 0.00 H new ATOM 0 HA SER A 101 -46.086 -22.746 -10.104 1.00 0.00 H new ATOM 0 HB2 SER A 101 -46.095 -22.988 -13.156 1.00 0.00 H new ATOM 0 HB3 SER A 101 -44.703 -22.896 -12.096 1.00 0.00 H new ATOM 0 HG SER A 101 -45.842 -25.101 -13.004 1.00 0.00 H new ATOM 1464 N THR A 102 -46.077 -20.425 -11.352 1.00 0.00 N ATOM 1465 CA THR A 102 -46.408 -19.003 -11.632 1.00 0.00 C ATOM 1466 C THR A 102 -45.243 -18.326 -12.352 1.00 0.00 C ATOM 1467 O THR A 102 -44.109 -18.380 -11.917 1.00 0.00 O ATOM 1468 CB THR A 102 -46.645 -18.364 -10.261 1.00 0.00 C ATOM 1469 OG1 THR A 102 -47.024 -19.370 -9.332 1.00 0.00 O ATOM 1470 CG2 THR A 102 -47.757 -17.318 -10.367 1.00 0.00 C ATOM 0 H THR A 102 -45.093 -20.612 -11.161 1.00 0.00 H new ATOM 0 HA THR A 102 -47.281 -18.902 -12.276 1.00 0.00 H new ATOM 0 HB THR A 102 -45.729 -17.881 -9.921 1.00 0.00 H new ATOM 0 HG1 THR A 102 -47.763 -19.042 -8.778 1.00 0.00 H new ATOM 0 HG21 THR A 102 -47.924 -16.864 -9.390 1.00 0.00 H new ATOM 0 HG22 THR A 102 -47.465 -16.547 -11.080 1.00 0.00 H new ATOM 0 HG23 THR A 102 -48.676 -17.797 -10.707 1.00 0.00 H new ATOM 1478 N CYS A 103 -45.522 -17.684 -13.448 1.00 0.00 N ATOM 1479 CA CYS A 103 -44.451 -16.989 -14.204 1.00 0.00 C ATOM 1480 C CYS A 103 -43.957 -15.785 -13.400 1.00 0.00 C ATOM 1481 O CYS A 103 -44.461 -14.688 -13.531 1.00 0.00 O ATOM 1482 CB CYS A 103 -45.127 -16.542 -15.497 1.00 0.00 C ATOM 1483 SG CYS A 103 -44.097 -15.309 -16.321 1.00 0.00 S ATOM 0 H CYS A 103 -46.454 -17.611 -13.855 1.00 0.00 H new ATOM 0 HA CYS A 103 -43.583 -17.619 -14.398 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -45.283 -17.398 -16.153 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -46.110 -16.124 -15.280 1.00 0.00 H new ATOM 1488 N SER A 104 -42.985 -15.989 -12.560 1.00 0.00 N ATOM 1489 CA SER A 104 -42.462 -14.866 -11.729 1.00 0.00 C ATOM 1490 C SER A 104 -41.722 -13.847 -12.584 1.00 0.00 C ATOM 1491 O SER A 104 -41.642 -13.975 -13.789 1.00 0.00 O ATOM 1492 CB SER A 104 -41.505 -15.520 -10.733 1.00 0.00 C ATOM 1493 OG SER A 104 -41.991 -15.323 -9.411 1.00 0.00 O ATOM 0 H SER A 104 -42.526 -16.888 -12.410 1.00 0.00 H new ATOM 0 HA SER A 104 -43.269 -14.325 -11.234 1.00 0.00 H new ATOM 0 HB2 SER A 104 -41.415 -16.586 -10.944 1.00 0.00 H new ATOM 0 HB3 SER A 104 -40.508 -15.090 -10.834 1.00 0.00 H new ATOM 0 HG SER A 104 -41.379 -15.743 -8.771 1.00 0.00 H new ATOM 1499 N PRO A 105 -41.212 -12.856 -11.911 1.00 0.00 N ATOM 1500 CA PRO A 105 -40.475 -11.780 -12.588 1.00 0.00 C ATOM 1501 C PRO A 105 -39.044 -12.213 -12.882 1.00 0.00 C ATOM 1502 O PRO A 105 -38.308 -12.627 -12.008 1.00 0.00 O ATOM 1503 CB PRO A 105 -40.524 -10.632 -11.593 1.00 0.00 C ATOM 1504 CG PRO A 105 -40.720 -11.267 -10.250 1.00 0.00 C ATOM 1505 CD PRO A 105 -41.277 -12.654 -10.464 1.00 0.00 C ATOM 0 HA PRO A 105 -40.900 -11.507 -13.554 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -39.602 -10.051 -11.620 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -41.340 -9.947 -11.825 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -39.774 -11.316 -9.710 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -41.403 -10.672 -9.644 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -40.691 -13.403 -9.932 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -42.301 -12.731 -10.098 1.00 0.00 H new ATOM 1513 N GLY A 106 -38.656 -12.127 -14.119 1.00 0.00 N ATOM 1514 CA GLY A 106 -37.286 -12.537 -14.504 1.00 0.00 C ATOM 1515 C GLY A 106 -37.371 -13.518 -15.679 1.00 0.00 C ATOM 1516 O GLY A 106 -36.372 -13.877 -16.269 1.00 0.00 O ATOM 0 H GLY A 106 -39.236 -11.787 -14.886 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -36.696 -11.664 -14.784 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -36.781 -13.005 -13.659 1.00 0.00 H new ATOM 1520 N ASN A 107 -38.572 -13.941 -16.015 1.00 0.00 N ATOM 1521 CA ASN A 107 -38.790 -14.893 -17.155 1.00 0.00 C ATOM 1522 C ASN A 107 -38.575 -16.338 -16.719 1.00 0.00 C ATOM 1523 O ASN A 107 -37.483 -16.867 -16.790 1.00 0.00 O ATOM 1524 CB ASN A 107 -37.799 -14.503 -18.258 1.00 0.00 C ATOM 1525 CG ASN A 107 -37.751 -12.979 -18.391 1.00 0.00 C ATOM 1526 OD1 ASN A 107 -38.750 -12.311 -18.212 1.00 0.00 O ATOM 1527 ND2 ASN A 107 -36.625 -12.397 -18.701 1.00 0.00 N ATOM 0 H ASN A 107 -39.427 -13.659 -15.535 1.00 0.00 H new ATOM 0 HA ASN A 107 -39.817 -14.828 -17.514 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -36.807 -14.889 -18.023 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -38.099 -14.951 -19.205 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -36.584 -11.382 -18.793 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -35.786 -12.957 -18.851 1.00 0.00 H new ATOM 1534 N THR A 108 -39.623 -16.989 -16.282 1.00 0.00 N ATOM 1535 CA THR A 108 -39.495 -18.411 -15.859 1.00 0.00 C ATOM 1536 C THR A 108 -40.813 -18.942 -15.301 1.00 0.00 C ATOM 1537 O THR A 108 -41.846 -18.309 -15.391 1.00 0.00 O ATOM 1538 CB THR A 108 -38.418 -18.428 -14.780 1.00 0.00 C ATOM 1539 OG1 THR A 108 -38.156 -17.105 -14.331 1.00 0.00 O ATOM 1540 CG2 THR A 108 -37.156 -19.037 -15.374 1.00 0.00 C ATOM 0 H THR A 108 -40.560 -16.595 -16.201 1.00 0.00 H new ATOM 0 HA THR A 108 -39.235 -19.049 -16.704 1.00 0.00 H new ATOM 0 HB THR A 108 -38.753 -19.019 -13.927 1.00 0.00 H new ATOM 0 HG1 THR A 108 -37.464 -17.126 -13.637 1.00 0.00 H new ATOM 0 HG21 THR A 108 -36.372 -19.059 -14.617 1.00 0.00 H new ATOM 0 HG22 THR A 108 -37.365 -20.053 -15.709 1.00 0.00 H new ATOM 0 HG23 THR A 108 -36.826 -18.436 -16.222 1.00 0.00 H new ATOM 1548 N TRP A 109 -40.776 -20.115 -14.732 1.00 0.00 N ATOM 1549 CA TRP A 109 -42.014 -20.715 -14.171 1.00 0.00 C ATOM 1550 C TRP A 109 -41.720 -21.366 -12.818 1.00 0.00 C ATOM 1551 O TRP A 109 -41.334 -22.515 -12.738 1.00 0.00 O ATOM 1552 CB TRP A 109 -42.436 -21.748 -15.209 1.00 0.00 C ATOM 1553 CG TRP A 109 -43.293 -21.069 -16.226 1.00 0.00 C ATOM 1554 CD1 TRP A 109 -42.993 -20.912 -17.541 1.00 0.00 C ATOM 1555 CD2 TRP A 109 -44.584 -20.437 -16.019 1.00 0.00 C ATOM 1556 NE1 TRP A 109 -44.033 -20.230 -18.151 1.00 0.00 N ATOM 1557 CE2 TRP A 109 -45.040 -19.919 -17.252 1.00 0.00 C ATOM 1558 CE3 TRP A 109 -45.399 -20.277 -14.887 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 -46.268 -19.257 -17.355 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 -46.631 -19.616 -14.984 1.00 0.00 C ATOM 1561 CH2 TRP A 109 -47.068 -19.106 -16.215 1.00 0.00 C ATOM 0 H TRP A 109 -39.936 -20.685 -14.632 1.00 0.00 H new ATOM 0 HA TRP A 109 -42.799 -19.981 -13.988 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -41.560 -22.188 -15.684 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -42.984 -22.562 -14.734 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -42.095 -21.260 -18.029 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -44.055 -19.987 -19.141 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -45.074 -20.667 -13.934 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -46.597 -18.865 -18.306 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -47.248 -19.499 -14.105 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -48.019 -18.598 -16.284 1.00 0.00 H new ATOM 1572 N LYS A 110 -41.895 -20.630 -11.752 1.00 0.00 N ATOM 1573 CA LYS A 110 -41.620 -21.195 -10.400 1.00 0.00 C ATOM 1574 C LYS A 110 -42.937 -21.543 -9.690 1.00 0.00 C ATOM 1575 O LYS A 110 -43.908 -20.825 -9.819 1.00 0.00 O ATOM 1576 CB LYS A 110 -40.890 -20.078 -9.653 1.00 0.00 C ATOM 1577 CG LYS A 110 -39.610 -19.711 -10.408 1.00 0.00 C ATOM 1578 CD LYS A 110 -38.507 -19.367 -9.405 1.00 0.00 C ATOM 1579 CE LYS A 110 -37.310 -18.771 -10.148 1.00 0.00 C ATOM 1580 NZ LYS A 110 -36.535 -18.042 -9.105 1.00 0.00 N ATOM 0 H LYS A 110 -42.217 -19.662 -11.760 1.00 0.00 H new ATOM 0 HA LYS A 110 -41.033 -22.113 -10.446 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -41.535 -19.204 -9.563 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -40.648 -20.401 -8.640 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -39.296 -20.543 -11.039 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -39.794 -18.863 -11.067 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -38.880 -18.657 -8.667 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -38.203 -20.262 -8.862 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -36.708 -19.550 -10.615 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -37.633 -18.098 -10.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -35.696 -17.605 -9.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -37.132 -17.303 -8.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -36.235 -18.709 -8.366 1.00 0.00 H new ATOM 1594 N PRO A 111 -42.934 -22.628 -8.949 1.00 0.00 N ATOM 1595 CA PRO A 111 -41.726 -23.488 -8.811 1.00 0.00 C ATOM 1596 C PRO A 111 -41.436 -24.242 -10.113 1.00 0.00 C ATOM 1597 O PRO A 111 -42.245 -24.276 -11.020 1.00 0.00 O ATOM 1598 CB PRO A 111 -42.103 -24.461 -7.698 1.00 0.00 C ATOM 1599 CG PRO A 111 -43.594 -24.504 -7.717 1.00 0.00 C ATOM 1600 CD PRO A 111 -44.061 -23.146 -8.165 1.00 0.00 C ATOM 0 HA PRO A 111 -40.825 -22.915 -8.590 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -41.677 -25.448 -7.875 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -41.730 -24.121 -6.732 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -43.950 -25.279 -8.396 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -43.987 -24.741 -6.728 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -44.968 -23.213 -8.765 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -44.288 -22.501 -7.316 1.00 0.00 H new ATOM 1608 N GLU A 112 -40.277 -24.831 -10.210 1.00 0.00 N ATOM 1609 CA GLU A 112 -39.905 -25.573 -11.449 1.00 0.00 C ATOM 1610 C GLU A 112 -41.100 -26.342 -12.016 1.00 0.00 C ATOM 1611 O GLU A 112 -41.767 -27.082 -11.320 1.00 0.00 O ATOM 1612 CB GLU A 112 -38.813 -26.545 -11.012 1.00 0.00 C ATOM 1613 CG GLU A 112 -37.513 -25.776 -10.776 1.00 0.00 C ATOM 1614 CD GLU A 112 -36.386 -26.763 -10.472 1.00 0.00 C ATOM 1615 OE1 GLU A 112 -36.086 -27.573 -11.334 1.00 0.00 O ATOM 1616 OE2 GLU A 112 -35.844 -26.694 -9.382 1.00 0.00 O ATOM 0 H GLU A 112 -39.566 -24.831 -9.479 1.00 0.00 H new ATOM 0 HA GLU A 112 -39.573 -24.896 -12.236 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -39.114 -27.061 -10.100 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -38.663 -27.308 -11.776 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -37.264 -25.183 -11.656 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -37.635 -25.080 -9.946 1.00 0.00 H new ATOM 1623 N LEU A 113 -41.358 -26.178 -13.284 1.00 0.00 N ATOM 1624 CA LEU A 113 -42.493 -26.901 -13.928 1.00 0.00 C ATOM 1625 C LEU A 113 -42.581 -28.335 -13.408 1.00 0.00 C ATOM 1626 O LEU A 113 -41.582 -28.953 -13.099 1.00 0.00 O ATOM 1627 CB LEU A 113 -42.146 -26.900 -15.418 1.00 0.00 C ATOM 1628 CG LEU A 113 -43.032 -25.912 -16.198 1.00 0.00 C ATOM 1629 CD1 LEU A 113 -43.444 -24.727 -15.316 1.00 0.00 C ATOM 1630 CD2 LEU A 113 -42.244 -25.389 -17.402 1.00 0.00 C ATOM 0 H LEU A 113 -40.827 -25.569 -13.907 1.00 0.00 H new ATOM 0 HA LEU A 113 -43.455 -26.432 -13.719 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -41.097 -26.633 -15.549 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -42.273 -27.904 -15.824 1.00 0.00 H new ATOM 0 HG LEU A 113 -43.934 -26.431 -16.522 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -44.069 -24.045 -15.892 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -44.003 -25.092 -14.454 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -42.553 -24.201 -14.974 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -42.861 -24.687 -17.964 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -41.343 -24.883 -17.055 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -41.966 -26.224 -18.046 1.00 0.00 H new ATOM 1642 N PRO A 114 -43.789 -28.810 -13.342 1.00 0.00 N ATOM 1643 CA PRO A 114 -44.047 -30.189 -12.867 1.00 0.00 C ATOM 1644 C PRO A 114 -43.643 -31.216 -13.930 1.00 0.00 C ATOM 1645 O PRO A 114 -43.393 -30.878 -15.070 1.00 0.00 O ATOM 1646 CB PRO A 114 -45.554 -30.204 -12.629 1.00 0.00 C ATOM 1647 CG PRO A 114 -46.111 -29.122 -13.498 1.00 0.00 C ATOM 1648 CD PRO A 114 -45.023 -28.104 -13.703 1.00 0.00 C ATOM 0 HA PRO A 114 -43.476 -30.450 -11.976 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -45.982 -31.173 -12.887 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -45.787 -30.022 -11.580 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -46.441 -29.529 -14.454 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -46.982 -28.664 -13.029 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -44.994 -27.756 -14.736 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -45.177 -27.226 -13.075 1.00 0.00 H new ATOM 1656 N LYS A 115 -43.576 -32.470 -13.566 1.00 0.00 N ATOM 1657 CA LYS A 115 -43.186 -33.513 -14.559 1.00 0.00 C ATOM 1658 C LYS A 115 -44.174 -34.680 -14.538 1.00 0.00 C ATOM 1659 O LYS A 115 -44.157 -35.501 -13.648 1.00 0.00 O ATOM 1660 CB LYS A 115 -41.798 -33.980 -14.122 1.00 0.00 C ATOM 1661 CG LYS A 115 -41.391 -35.210 -14.936 1.00 0.00 C ATOM 1662 CD LYS A 115 -40.119 -34.901 -15.729 1.00 0.00 C ATOM 1663 CE LYS A 115 -38.917 -35.563 -15.049 1.00 0.00 C ATOM 1664 NZ LYS A 115 -37.719 -35.002 -15.738 1.00 0.00 N ATOM 0 H LYS A 115 -43.774 -32.816 -12.627 1.00 0.00 H new ATOM 0 HA LYS A 115 -43.187 -33.123 -15.577 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -41.072 -33.180 -14.266 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -41.802 -34.220 -13.059 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -41.221 -36.058 -14.273 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -42.196 -35.492 -15.615 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -40.218 -35.266 -16.751 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -39.968 -33.823 -15.788 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -38.897 -35.341 -13.982 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -38.956 -36.648 -15.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -36.857 -35.411 -15.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -37.760 -35.234 -16.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -37.703 -33.969 -15.620 1.00 0.00 H new ATOM 1678 N CYS A 116 -45.023 -34.766 -15.525 1.00 0.00 N ATOM 1679 CA CYS A 116 -46.000 -35.890 -15.575 1.00 0.00 C ATOM 1680 C CYS A 116 -45.241 -37.212 -15.661 1.00 0.00 C ATOM 1681 O CYS A 116 -44.751 -37.597 -16.704 1.00 0.00 O ATOM 1682 CB CYS A 116 -46.814 -35.632 -16.846 1.00 0.00 C ATOM 1683 SG CYS A 116 -48.510 -36.254 -16.669 1.00 0.00 S ATOM 0 H CYS A 116 -45.082 -34.105 -16.300 1.00 0.00 H new ATOM 0 HA CYS A 116 -46.641 -35.949 -14.695 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -46.835 -34.563 -17.058 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -46.332 -36.116 -17.695 1.00 0.00 H new ATOM 1688 N VAL A 117 -45.133 -37.899 -14.562 1.00 0.00 N ATOM 1689 CA VAL A 117 -44.398 -39.193 -14.552 1.00 0.00 C ATOM 1690 C VAL A 117 -45.336 -40.334 -14.239 1.00 0.00 C ATOM 1691 O VAL A 117 -46.530 -40.160 -14.106 1.00 0.00 O ATOM 1692 CB VAL A 117 -43.346 -39.077 -13.451 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -42.115 -38.422 -14.032 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -43.866 -38.227 -12.289 1.00 0.00 C ATOM 0 H VAL A 117 -45.525 -37.619 -13.663 1.00 0.00 H new ATOM 0 HA VAL A 117 -43.948 -39.393 -15.524 1.00 0.00 H new ATOM 0 HB VAL A 117 -43.113 -40.073 -13.073 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -41.352 -38.331 -13.259 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -41.731 -39.031 -14.851 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -42.372 -37.431 -14.406 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -43.100 -38.158 -11.517 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -44.108 -37.227 -12.649 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -44.761 -38.689 -11.872 1.00 0.00 H new ATOM 1704 N ARG A 118 -44.803 -41.508 -14.120 1.00 0.00 N ATOM 1705 CA ARG A 118 -45.676 -42.659 -13.815 1.00 0.00 C ATOM 1706 C ARG A 118 -45.484 -43.097 -12.360 1.00 0.00 C ATOM 1707 O ARG A 118 -46.423 -42.961 -11.592 1.00 0.00 O ATOM 1708 CB ARG A 118 -45.263 -43.786 -14.775 1.00 0.00 C ATOM 1709 CG ARG A 118 -44.724 -43.203 -16.086 1.00 0.00 C ATOM 1710 CD ARG A 118 -44.234 -44.339 -16.987 1.00 0.00 C ATOM 1711 NE ARG A 118 -42.930 -44.760 -16.401 1.00 0.00 N ATOM 1712 CZ ARG A 118 -42.664 -46.028 -16.247 1.00 0.00 C ATOM 1713 NH1 ARG A 118 -43.234 -46.913 -17.017 1.00 0.00 N ATOM 1714 NH2 ARG A 118 -41.826 -46.411 -15.322 1.00 0.00 N ATOM 1715 OXT ARG A 118 -44.402 -43.561 -12.039 1.00 0.00 O ATOM 0 H ARG A 118 -43.810 -41.719 -14.220 1.00 0.00 H new ATOM 0 HA ARG A 118 -46.728 -42.403 -13.942 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -44.501 -44.410 -14.307 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -46.119 -44.429 -14.981 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -45.505 -42.635 -16.592 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -43.908 -42.510 -15.880 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -44.945 -45.165 -17.003 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -44.114 -44.002 -18.017 1.00 0.00 H new ATOM 0 HE ARG A 118 -42.246 -44.057 -16.121 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -43.888 -46.614 -17.740 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -43.026 -47.904 -16.896 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -41.380 -45.719 -14.720 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -41.618 -47.402 -15.201 1.00 0.00 H new