USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1022 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 63 LYS NZ :NH3+ -146:sc= 0.0573 (180deg=-0.717) USER MOD Set 1.2: A 127 LYS NZ :NH3+ 149:sc= -0.601 (180deg=-1.58!) USER MOD Set 2.1: A 35 ASN : amide:sc= -5.23! C(o=-5.3!,f=-11!) USER MOD Set 2.2: A 89 LYS NZ :NH3+ 144:sc= -0.0836 (180deg=-0.169) USER MOD Set 3.1: A 28 TYR OH : rot -80:sc= -0.297 USER MOD Set 3.2: A 47 SER OG : rot -67:sc= 1.7 USER MOD Set 4.1: A 19 SER OG : rot -80:sc= -1.13 USER MOD Set 4.2: A 21 MET CE :methyl -173:sc= -2.91 (180deg=-2.6) USER MOD Single : A 12 SER OG : rot 19:sc= 0.418 USER MOD Single : A 20 HIS : no HD1:sc= -0.0297 X(o=-0.03,f=-0.25) USER MOD Single : A 30 THR OG1 : rot -150:sc= 0.11 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 55:sc= 0.835 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 40:sc= 1.27 USER MOD Single : A 48 SER OG : rot 77:sc= -0.63 USER MOD Single : A 52 THR OG1 : rot -100:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 120:sc= -0.599 USER MOD Single : A 58 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0109) USER MOD Single : A 61 ASN : amide:sc= -0.385 X(o=-0.39,f=-0.067) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 67 TYR OH : rot -130:sc= -0.985! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc=-0.00231 X(o=-0.0023,f=-0.12) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.3 X(o=-1.3,f=-0.95) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.806 X(o=-0.81,f=-0.54) USER MOD Single : A 100 MET CE :methyl -131:sc= -0.553 (180deg=-2.82!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -136:sc= -1.5 (180deg=-7.13!) USER MOD Single : A 112 THR OG1 : rot -64:sc= 0.321 USER MOD Single : A 113 MET CE :methyl -138:sc= -1.22 (180deg=-2.97!) USER MOD Single : A 120 TYR OH : rot 30:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -2.14 K(o=-2.1,f=-0.37) USER MOD Single : A 122 THR OG1 : rot -7:sc= -0.171 USER MOD Single : A 123 THR OG1 : rot -43:sc= 1.11 USER MOD Single : A 132 ASN : amide:sc= -4.38! C(o=-4.4!,f=-7.5!) USER MOD Single : A 134 THR OG1 : rot 180:sc=-0.00205 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.111 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 1.579 -1.262 3.931 1.00 62.11 N ATOM 2 CA SER A 12 2.113 -2.619 3.970 1.00 55.25 C ATOM 3 C SER A 12 3.242 -2.788 2.958 1.00 52.54 C ATOM 4 O SER A 12 3.334 -2.042 1.983 1.00 31.22 O ATOM 5 CB SER A 12 1.003 -3.634 3.687 1.00 43.21 C ATOM 6 OG SER A 12 -0.214 -3.243 4.298 1.00 2.44 O ATOM 0 HA SER A 12 2.514 -2.797 4.968 1.00 55.25 H new ATOM 0 HB2 SER A 12 0.859 -3.729 2.611 1.00 43.21 H new ATOM 0 HB3 SER A 12 1.300 -4.615 4.057 1.00 43.21 H new ATOM 0 HG SER A 12 -0.184 -2.285 4.504 1.00 2.44 H new ATOM 12 N GLY A 13 4.100 -3.774 3.197 1.00 22.41 N ATOM 13 CA GLY A 13 5.212 -4.024 2.299 1.00 25.31 C ATOM 14 C GLY A 13 5.354 -5.492 1.946 1.00 2.41 C ATOM 15 O GLY A 13 6.164 -6.205 2.539 1.00 22.33 O ATOM 0 H GLY A 13 4.045 -4.405 3.997 1.00 22.41 H new ATOM 0 HA2 GLY A 13 5.074 -3.446 1.385 1.00 25.31 H new ATOM 0 HA3 GLY A 13 6.135 -3.674 2.762 1.00 25.31 H new ATOM 19 N LEU A 14 4.564 -5.945 0.979 1.00 43.40 N ATOM 20 CA LEU A 14 4.604 -7.338 0.548 1.00 12.14 C ATOM 21 C LEU A 14 5.037 -7.445 -0.910 1.00 41.12 C ATOM 22 O LEU A 14 5.021 -6.459 -1.648 1.00 33.33 O ATOM 23 CB LEU A 14 3.232 -7.989 0.734 1.00 40.31 C ATOM 24 CG LEU A 14 3.170 -9.154 1.722 1.00 62.33 C ATOM 25 CD1 LEU A 14 3.926 -10.356 1.177 1.00 72.41 C ATOM 26 CD2 LEU A 14 3.731 -8.738 3.074 1.00 55.22 C ATOM 0 H LEU A 14 3.888 -5.368 0.478 1.00 43.40 H new ATOM 0 HA LEU A 14 5.335 -7.862 1.164 1.00 12.14 H new ATOM 0 HB2 LEU A 14 2.530 -7.223 1.062 1.00 40.31 H new ATOM 0 HB3 LEU A 14 2.886 -8.343 -0.237 1.00 40.31 H new ATOM 0 HG LEU A 14 2.126 -9.436 1.856 1.00 62.33 H new ATOM 0 HD11 LEU A 14 3.871 -11.176 1.893 1.00 72.41 H new ATOM 0 HD12 LEU A 14 3.480 -10.669 0.233 1.00 72.41 H new ATOM 0 HD13 LEU A 14 4.969 -10.086 1.014 1.00 72.41 H new ATOM 0 HD21 LEU A 14 3.679 -9.580 3.764 1.00 55.22 H new ATOM 0 HD22 LEU A 14 4.770 -8.428 2.957 1.00 55.22 H new ATOM 0 HD23 LEU A 14 3.147 -7.907 3.470 1.00 55.22 H new ATOM 38 N VAL A 15 5.423 -8.649 -1.321 1.00 14.01 N ATOM 39 CA VAL A 15 5.857 -8.886 -2.692 1.00 60.23 C ATOM 40 C VAL A 15 5.353 -10.231 -3.204 1.00 12.03 C ATOM 41 O VAL A 15 5.453 -11.257 -2.530 1.00 10.40 O ATOM 42 CB VAL A 15 7.392 -8.848 -2.809 1.00 43.34 C ATOM 43 CG1 VAL A 15 8.024 -9.877 -1.885 1.00 4.24 C ATOM 44 CG2 VAL A 15 7.822 -9.078 -4.250 1.00 63.32 C ATOM 0 H VAL A 15 5.444 -9.475 -0.723 1.00 14.01 H new ATOM 0 HA VAL A 15 5.433 -8.087 -3.300 1.00 60.23 H new ATOM 0 HB VAL A 15 7.738 -7.860 -2.504 1.00 43.34 H new ATOM 0 HG11 VAL A 15 9.109 -9.835 -1.982 1.00 4.24 H new ATOM 0 HG12 VAL A 15 7.743 -9.662 -0.854 1.00 4.24 H new ATOM 0 HG13 VAL A 15 7.674 -10.873 -2.156 1.00 4.24 H new ATOM 0 HG21 VAL A 15 8.910 -9.048 -4.314 1.00 63.32 H new ATOM 0 HG22 VAL A 15 7.466 -10.052 -4.585 1.00 63.32 H new ATOM 0 HG23 VAL A 15 7.399 -8.299 -4.885 1.00 63.32 H new ATOM 54 N PRO A 16 4.797 -10.229 -4.425 1.00 24.24 N ATOM 55 CA PRO A 16 4.267 -11.442 -5.055 1.00 10.23 C ATOM 56 C PRO A 16 5.369 -12.419 -5.450 1.00 72.02 C ATOM 57 O PRO A 16 5.748 -12.502 -6.619 1.00 34.24 O ATOM 58 CB PRO A 16 3.551 -10.911 -6.299 1.00 42.22 C ATOM 59 CG PRO A 16 4.235 -9.624 -6.609 1.00 53.12 C ATOM 60 CD PRO A 16 4.645 -9.043 -5.284 1.00 71.31 C ATOM 0 HA PRO A 16 3.620 -12.002 -4.381 1.00 10.23 H new ATOM 0 HB2 PRO A 16 3.630 -11.611 -7.130 1.00 42.22 H new ATOM 0 HB3 PRO A 16 2.488 -10.759 -6.110 1.00 42.22 H new ATOM 0 HG2 PRO A 16 5.102 -9.787 -7.249 1.00 53.12 H new ATOM 0 HG3 PRO A 16 3.568 -8.947 -7.143 1.00 53.12 H new ATOM 0 HD2 PRO A 16 5.576 -8.481 -5.362 1.00 71.31 H new ATOM 0 HD3 PRO A 16 3.891 -8.359 -4.895 1.00 71.31 H new ATOM 68 N ARG A 17 5.879 -13.157 -4.470 1.00 12.14 N ATOM 69 CA ARG A 17 6.938 -14.128 -4.716 1.00 31.11 C ATOM 70 C ARG A 17 6.622 -15.460 -4.042 1.00 74.11 C ATOM 71 O ARG A 17 6.302 -16.444 -4.708 1.00 13.20 O ATOM 72 CB ARG A 17 8.278 -13.593 -4.208 1.00 0.11 C ATOM 73 CG ARG A 17 8.753 -12.348 -4.939 1.00 2.00 C ATOM 74 CD ARG A 17 9.977 -12.637 -5.794 1.00 23.02 C ATOM 75 NE ARG A 17 9.620 -12.941 -7.177 1.00 33.13 N ATOM 76 CZ ARG A 17 10.513 -13.161 -8.135 1.00 54.24 C ATOM 77 NH1 ARG A 17 11.809 -13.111 -7.862 1.00 41.14 N ATOM 78 NH2 ARG A 17 10.109 -13.432 -9.370 1.00 41.41 N ATOM 0 H ARG A 17 5.576 -13.101 -3.498 1.00 12.14 H new ATOM 0 HA ARG A 17 7.004 -14.291 -5.792 1.00 31.11 H new ATOM 0 HB2 ARG A 17 8.191 -13.369 -3.145 1.00 0.11 H new ATOM 0 HB3 ARG A 17 9.033 -14.373 -4.308 1.00 0.11 H new ATOM 0 HG2 ARG A 17 7.950 -11.966 -5.569 1.00 2.00 H new ATOM 0 HG3 ARG A 17 8.989 -11.568 -4.215 1.00 2.00 H new ATOM 0 HD2 ARG A 17 10.645 -11.776 -5.773 1.00 23.02 H new ATOM 0 HD3 ARG A 17 10.526 -13.477 -5.368 1.00 23.02 H new ATOM 0 HE ARG A 17 8.631 -12.987 -7.421 1.00 33.13 H new ATOM 0 HH11 ARG A 17 12.123 -12.903 -6.914 1.00 41.14 H new ATOM 0 HH12 ARG A 17 12.493 -13.280 -8.600 1.00 41.14 H new ATOM 0 HH21 ARG A 17 9.112 -13.471 -9.583 1.00 41.41 H new ATOM 0 HH22 ARG A 17 10.795 -13.601 -10.106 1.00 41.41 H new ATOM 92 N GLY A 18 6.714 -15.483 -2.716 1.00 22.52 N ATOM 93 CA GLY A 18 6.436 -16.699 -1.974 1.00 73.31 C ATOM 94 C GLY A 18 6.366 -16.463 -0.478 1.00 63.04 C ATOM 95 O GLY A 18 5.358 -16.768 0.159 1.00 64.10 O ATOM 0 H GLY A 18 6.976 -14.681 -2.142 1.00 22.52 H new ATOM 0 HA2 GLY A 18 5.492 -17.122 -2.316 1.00 73.31 H new ATOM 0 HA3 GLY A 18 7.211 -17.436 -2.187 1.00 73.31 H new ATOM 99 N SER A 19 7.441 -15.919 0.084 1.00 60.32 N ATOM 100 CA SER A 19 7.500 -15.647 1.515 1.00 21.42 C ATOM 101 C SER A 19 7.944 -14.211 1.778 1.00 74.44 C ATOM 102 O SER A 19 8.343 -13.495 0.859 1.00 25.20 O ATOM 103 CB SER A 19 8.458 -16.623 2.202 1.00 42.41 C ATOM 104 OG SER A 19 8.882 -17.636 1.307 1.00 65.11 O ATOM 0 H SER A 19 8.283 -15.658 -0.430 1.00 60.32 H new ATOM 0 HA SER A 19 6.499 -15.780 1.926 1.00 21.42 H new ATOM 0 HB2 SER A 19 9.325 -16.081 2.580 1.00 42.41 H new ATOM 0 HB3 SER A 19 7.965 -17.076 3.062 1.00 42.41 H new ATOM 0 HG SER A 19 8.186 -18.322 1.236 1.00 65.11 H new ATOM 110 N HIS A 20 7.870 -13.797 3.038 1.00 13.14 N ATOM 111 CA HIS A 20 8.264 -12.446 3.423 1.00 31.35 C ATOM 112 C HIS A 20 9.783 -12.306 3.435 1.00 21.20 C ATOM 113 O HIS A 20 10.401 -12.236 4.497 1.00 42.42 O ATOM 114 CB HIS A 20 7.698 -12.100 4.801 1.00 74.31 C ATOM 115 CG HIS A 20 6.253 -12.462 4.963 1.00 63.01 C ATOM 116 ND1 HIS A 20 5.313 -12.269 3.973 1.00 44.24 N ATOM 117 CD2 HIS A 20 5.590 -13.010 6.008 1.00 54.23 C ATOM 118 CE1 HIS A 20 4.134 -12.680 4.402 1.00 72.31 C ATOM 119 NE2 HIS A 20 4.274 -13.135 5.634 1.00 22.10 N ATOM 0 H HIS A 20 7.541 -14.377 3.810 1.00 13.14 H new ATOM 0 HA HIS A 20 7.858 -11.752 2.687 1.00 31.35 H new ATOM 0 HB2 HIS A 20 8.281 -12.616 5.564 1.00 74.31 H new ATOM 0 HB3 HIS A 20 7.818 -11.031 4.976 1.00 74.31 H new ATOM 0 HD2 HIS A 20 6.016 -13.296 6.958 1.00 54.23 H new ATOM 0 HE1 HIS A 20 3.212 -12.649 3.841 1.00 72.31 H new ATOM 0 HE2 HIS A 20 3.527 -13.517 6.214 1.00 22.10 H new ATOM 127 N MET A 21 10.378 -12.267 2.247 1.00 30.42 N ATOM 128 CA MET A 21 11.825 -12.135 2.122 1.00 71.44 C ATOM 129 C MET A 21 12.197 -10.790 1.506 1.00 34.12 C ATOM 130 O MET A 21 13.358 -10.383 1.534 1.00 62.30 O ATOM 131 CB MET A 21 12.390 -13.273 1.269 1.00 21.00 C ATOM 132 CG MET A 21 13.046 -14.375 2.084 1.00 24.35 C ATOM 133 SD MET A 21 13.212 -15.916 1.163 1.00 33.41 S ATOM 134 CE MET A 21 11.610 -16.661 1.459 1.00 72.12 C ATOM 0 H MET A 21 9.881 -12.325 1.358 1.00 30.42 H new ATOM 0 HA MET A 21 12.258 -12.189 3.121 1.00 71.44 H new ATOM 0 HB2 MET A 21 11.585 -13.703 0.673 1.00 21.00 H new ATOM 0 HB3 MET A 21 13.121 -12.865 0.571 1.00 21.00 H new ATOM 0 HG2 MET A 21 14.032 -14.043 2.409 1.00 24.35 H new ATOM 0 HG3 MET A 21 12.457 -14.556 2.984 1.00 24.35 H new ATOM 0 HE1 MET A 21 11.601 -17.675 1.059 1.00 72.12 H new ATOM 0 HE2 MET A 21 11.416 -16.692 2.531 1.00 72.12 H new ATOM 0 HE3 MET A 21 10.837 -16.070 0.968 1.00 72.12 H new ATOM 144 N VAL A 22 11.203 -10.104 0.951 1.00 41.44 N ATOM 145 CA VAL A 22 11.426 -8.804 0.329 1.00 11.31 C ATOM 146 C VAL A 22 10.270 -7.852 0.615 1.00 33.25 C ATOM 147 O VAL A 22 9.123 -8.277 0.758 1.00 23.44 O ATOM 148 CB VAL A 22 11.604 -8.934 -1.195 1.00 51.43 C ATOM 149 CG1 VAL A 22 12.364 -7.738 -1.748 1.00 44.21 C ATOM 150 CG2 VAL A 22 12.315 -10.234 -1.539 1.00 41.44 C ATOM 0 H VAL A 22 10.236 -10.427 0.919 1.00 41.44 H new ATOM 0 HA VAL A 22 12.341 -8.400 0.761 1.00 11.31 H new ATOM 0 HB VAL A 22 10.618 -8.953 -1.658 1.00 51.43 H new ATOM 0 HG11 VAL A 22 12.480 -7.848 -2.826 1.00 44.21 H new ATOM 0 HG12 VAL A 22 11.810 -6.824 -1.534 1.00 44.21 H new ATOM 0 HG13 VAL A 22 13.347 -7.684 -1.281 1.00 44.21 H new ATOM 0 HG21 VAL A 22 12.432 -10.309 -2.620 1.00 41.44 H new ATOM 0 HG22 VAL A 22 13.297 -10.248 -1.066 1.00 41.44 H new ATOM 0 HG23 VAL A 22 11.726 -11.077 -1.178 1.00 41.44 H new ATOM 160 N ARG A 23 10.579 -6.562 0.698 1.00 73.24 N ATOM 161 CA ARG A 23 9.565 -5.550 0.968 1.00 43.53 C ATOM 162 C ARG A 23 9.823 -4.290 0.146 1.00 3.45 C ATOM 163 O ARG A 23 10.885 -4.137 -0.457 1.00 44.21 O ATOM 164 CB ARG A 23 9.543 -5.204 2.458 1.00 63.32 C ATOM 165 CG ARG A 23 9.761 -6.405 3.364 1.00 11.44 C ATOM 166 CD ARG A 23 9.034 -6.241 4.690 1.00 2.41 C ATOM 167 NE ARG A 23 9.944 -6.334 5.828 1.00 24.24 N ATOM 168 CZ ARG A 23 10.349 -7.486 6.353 1.00 11.51 C ATOM 169 NH1 ARG A 23 9.927 -8.635 5.844 1.00 15.41 N ATOM 170 NH2 ARG A 23 11.178 -7.489 7.389 1.00 43.11 N ATOM 0 H ARG A 23 11.523 -6.193 0.582 1.00 73.24 H new ATOM 0 HA ARG A 23 8.595 -5.958 0.683 1.00 43.53 H new ATOM 0 HB2 ARG A 23 10.314 -4.461 2.661 1.00 63.32 H new ATOM 0 HB3 ARG A 23 8.585 -4.744 2.702 1.00 63.32 H new ATOM 0 HG2 ARG A 23 9.410 -7.308 2.864 1.00 11.44 H new ATOM 0 HG3 ARG A 23 10.828 -6.536 3.546 1.00 11.44 H new ATOM 0 HD2 ARG A 23 8.528 -5.276 4.709 1.00 2.41 H new ATOM 0 HD3 ARG A 23 8.264 -7.007 4.778 1.00 2.41 H new ATOM 0 HE ARG A 23 10.288 -5.468 6.243 1.00 24.24 H new ATOM 0 HH11 ARG A 23 9.290 -8.637 5.047 1.00 15.41 H new ATOM 0 HH12 ARG A 23 10.239 -9.518 6.249 1.00 15.41 H new ATOM 0 HH21 ARG A 23 11.505 -6.607 7.783 1.00 43.11 H new ATOM 0 HH22 ARG A 23 11.488 -8.373 7.791 1.00 43.11 H new ATOM 184 N ARG A 24 8.845 -3.391 0.128 1.00 13.43 N ATOM 185 CA ARG A 24 8.965 -2.145 -0.620 1.00 21.20 C ATOM 186 C ARG A 24 9.628 -1.064 0.228 1.00 44.43 C ATOM 187 O ARG A 24 9.114 0.048 0.347 1.00 33.35 O ATOM 188 CB ARG A 24 7.588 -1.670 -1.086 1.00 15.04 C ATOM 189 CG ARG A 24 6.816 -2.717 -1.872 1.00 51.12 C ATOM 190 CD ARG A 24 6.426 -2.203 -3.249 1.00 72.44 C ATOM 191 NE ARG A 24 5.727 -0.923 -3.178 1.00 43.34 N ATOM 192 CZ ARG A 24 5.274 -0.273 -4.245 1.00 4.44 C ATOM 193 NH1 ARG A 24 5.445 -0.781 -5.457 1.00 44.22 N ATOM 194 NH2 ARG A 24 4.648 0.888 -4.099 1.00 5.31 N ATOM 0 H ARG A 24 7.960 -3.502 0.623 1.00 13.43 H new ATOM 0 HA ARG A 24 9.591 -2.333 -1.492 1.00 21.20 H new ATOM 0 HB2 ARG A 24 7.001 -1.375 -0.216 1.00 15.04 H new ATOM 0 HB3 ARG A 24 7.710 -0.781 -1.704 1.00 15.04 H new ATOM 0 HG2 ARG A 24 7.423 -3.616 -1.976 1.00 51.12 H new ATOM 0 HG3 ARG A 24 5.919 -3.000 -1.320 1.00 51.12 H new ATOM 0 HD2 ARG A 24 7.321 -2.094 -3.862 1.00 72.44 H new ATOM 0 HD3 ARG A 24 5.789 -2.937 -3.743 1.00 72.44 H new ATOM 0 HE ARG A 24 5.578 -0.505 -2.260 1.00 43.34 H new ATOM 0 HH11 ARG A 24 5.925 -1.673 -5.573 1.00 44.22 H new ATOM 0 HH12 ARG A 24 5.096 -0.280 -6.274 1.00 44.22 H new ATOM 0 HH21 ARG A 24 4.514 1.282 -3.168 1.00 5.31 H new ATOM 0 HH22 ARG A 24 4.300 1.387 -4.918 1.00 5.31 H new ATOM 208 N ALA A 25 10.773 -1.398 0.814 1.00 3.20 N ATOM 209 CA ALA A 25 11.508 -0.455 1.649 1.00 75.20 C ATOM 210 C ALA A 25 12.345 0.494 0.799 1.00 13.50 C ATOM 211 O ALA A 25 12.734 0.161 -0.320 1.00 41.23 O ATOM 212 CB ALA A 25 12.392 -1.202 2.636 1.00 62.52 C ATOM 0 H ALA A 25 11.212 -2.315 0.726 1.00 3.20 H new ATOM 0 HA ALA A 25 10.784 0.140 2.205 1.00 75.20 H new ATOM 0 HB1 ALA A 25 12.935 -0.486 3.253 1.00 62.52 H new ATOM 0 HB2 ALA A 25 11.773 -1.834 3.273 1.00 62.52 H new ATOM 0 HB3 ALA A 25 13.103 -1.823 2.090 1.00 62.52 H new ATOM 218 N ARG A 26 12.617 1.679 1.337 1.00 24.44 N ATOM 219 CA ARG A 26 13.407 2.677 0.627 1.00 51.31 C ATOM 220 C ARG A 26 14.844 2.201 0.439 1.00 3.02 C ATOM 221 O ARG A 26 15.161 1.037 0.684 1.00 20.45 O ATOM 222 CB ARG A 26 13.393 4.005 1.387 1.00 23.44 C ATOM 223 CG ARG A 26 13.189 5.217 0.493 1.00 21.35 C ATOM 224 CD ARG A 26 11.814 5.833 0.696 1.00 12.23 C ATOM 225 NE ARG A 26 11.606 6.267 2.075 1.00 5.12 N ATOM 226 CZ ARG A 26 12.225 7.310 2.618 1.00 34.03 C ATOM 227 NH1 ARG A 26 13.084 8.022 1.902 1.00 11.15 N ATOM 228 NH2 ARG A 26 11.983 7.643 3.880 1.00 62.30 N ATOM 0 H ARG A 26 12.302 1.971 2.262 1.00 24.44 H new ATOM 0 HA ARG A 26 12.960 2.824 -0.356 1.00 51.31 H new ATOM 0 HB2 ARG A 26 12.600 3.978 2.134 1.00 23.44 H new ATOM 0 HB3 ARG A 26 14.334 4.116 1.925 1.00 23.44 H new ATOM 0 HG2 ARG A 26 13.957 5.961 0.705 1.00 21.35 H new ATOM 0 HG3 ARG A 26 13.308 4.925 -0.550 1.00 21.35 H new ATOM 0 HD2 ARG A 26 11.696 6.685 0.026 1.00 12.23 H new ATOM 0 HD3 ARG A 26 11.048 5.106 0.425 1.00 12.23 H new ATOM 0 HE ARG A 26 10.950 5.741 2.653 1.00 5.12 H new ATOM 0 HH11 ARG A 26 13.271 7.770 0.932 1.00 11.15 H new ATOM 0 HH12 ARG A 26 13.558 8.822 2.322 1.00 11.15 H new ATOM 0 HH21 ARG A 26 11.322 7.098 4.433 1.00 62.30 H new ATOM 0 HH22 ARG A 26 12.458 8.444 4.296 1.00 62.30 H new ATOM 242 N CYS A 27 15.711 3.109 0.002 1.00 34.11 N ATOM 243 CA CYS A 27 17.114 2.783 -0.220 1.00 21.21 C ATOM 244 C CYS A 27 17.956 4.051 -0.332 1.00 20.44 C ATOM 245 O CYS A 27 17.593 4.989 -1.041 1.00 51.11 O ATOM 246 CB CYS A 27 17.269 1.941 -1.488 1.00 43.00 C ATOM 247 SG CYS A 27 18.289 0.447 -1.269 1.00 12.33 S ATOM 0 H CYS A 27 15.466 4.077 -0.205 1.00 34.11 H new ATOM 0 HA CYS A 27 17.467 2.208 0.636 1.00 21.21 H new ATOM 0 HB2 CYS A 27 16.280 1.645 -1.838 1.00 43.00 H new ATOM 0 HB3 CYS A 27 17.711 2.559 -2.270 1.00 43.00 H new ATOM 252 N TYR A 28 19.082 4.070 0.373 1.00 14.44 N ATOM 253 CA TYR A 28 19.974 5.223 0.356 1.00 65.04 C ATOM 254 C TYR A 28 21.427 4.784 0.199 1.00 3.34 C ATOM 255 O TYR A 28 21.819 3.689 0.602 1.00 31.25 O ATOM 256 CB TYR A 28 19.812 6.040 1.638 1.00 0.24 C ATOM 257 CG TYR A 28 20.212 5.290 2.889 1.00 44.42 C ATOM 258 CD1 TYR A 28 21.548 5.172 3.254 1.00 34.03 C ATOM 259 CD2 TYR A 28 19.255 4.701 3.706 1.00 40.24 C ATOM 260 CE1 TYR A 28 21.918 4.487 4.395 1.00 12.24 C ATOM 261 CE2 TYR A 28 19.616 4.016 4.849 1.00 31.25 C ATOM 262 CZ TYR A 28 20.948 3.911 5.190 1.00 45.12 C ATOM 263 OH TYR A 28 21.313 3.229 6.328 1.00 1.42 O ATOM 0 H TYR A 28 19.398 3.300 0.963 1.00 14.44 H new ATOM 0 HA TYR A 28 19.706 5.845 -0.498 1.00 65.04 H new ATOM 0 HB2 TYR A 28 20.413 6.946 1.560 1.00 0.24 H new ATOM 0 HB3 TYR A 28 18.772 6.354 1.730 1.00 0.24 H new ATOM 0 HD1 TYR A 28 22.309 5.623 2.635 1.00 34.03 H new ATOM 0 HD2 TYR A 28 18.211 4.780 3.442 1.00 40.24 H new ATOM 0 HE1 TYR A 28 22.961 4.403 4.664 1.00 12.24 H new ATOM 0 HE2 TYR A 28 18.859 3.565 5.473 1.00 31.25 H new ATOM 0 HH TYR A 28 21.619 2.330 6.087 1.00 1.42 H new ATOM 273 N PRO A 29 22.247 5.660 -0.400 1.00 5.21 N ATOM 274 CA PRO A 29 23.670 5.387 -0.623 1.00 4.51 C ATOM 275 C PRO A 29 24.469 5.379 0.676 1.00 64.52 C ATOM 276 O PRO A 29 24.523 6.379 1.392 1.00 55.12 O ATOM 277 CB PRO A 29 24.118 6.546 -1.518 1.00 34.01 C ATOM 278 CG PRO A 29 23.162 7.648 -1.216 1.00 51.34 C ATOM 279 CD PRO A 29 21.849 6.985 -0.906 1.00 30.45 C ATOM 0 HA PRO A 29 23.832 4.403 -1.063 1.00 4.51 H new ATOM 0 HB2 PRO A 29 25.144 6.841 -1.300 1.00 34.01 H new ATOM 0 HB3 PRO A 29 24.083 6.269 -2.572 1.00 34.01 H new ATOM 0 HG2 PRO A 29 23.507 8.243 -0.371 1.00 51.34 H new ATOM 0 HG3 PRO A 29 23.066 8.325 -2.065 1.00 51.34 H new ATOM 0 HD2 PRO A 29 21.282 7.545 -0.163 1.00 30.45 H new ATOM 0 HD3 PRO A 29 21.220 6.904 -1.793 1.00 30.45 H new ATOM 287 N THR A 30 25.091 4.242 0.975 1.00 2.10 N ATOM 288 CA THR A 30 25.887 4.103 2.188 1.00 61.20 C ATOM 289 C THR A 30 27.151 4.952 2.117 1.00 51.21 C ATOM 290 O THR A 30 27.246 5.995 2.763 1.00 2.43 O ATOM 291 CB THR A 30 26.282 2.635 2.435 1.00 22.41 C ATOM 292 OG1 THR A 30 25.605 1.782 1.505 1.00 32.24 O ATOM 293 CG2 THR A 30 25.942 2.215 3.857 1.00 21.41 C ATOM 0 H THR A 30 25.058 3.405 0.394 1.00 2.10 H new ATOM 0 HA THR A 30 25.266 4.449 3.014 1.00 61.20 H new ATOM 0 HB THR A 30 27.359 2.543 2.294 1.00 22.41 H new ATOM 0 HG1 THR A 30 25.457 0.904 1.914 1.00 32.24 H new ATOM 0 HG21 THR A 30 26.230 1.175 4.008 1.00 21.41 H new ATOM 0 HG22 THR A 30 26.482 2.847 4.562 1.00 21.41 H new ATOM 0 HG23 THR A 30 24.870 2.322 4.022 1.00 21.41 H new ATOM 301 N SER A 31 28.119 4.499 1.327 1.00 41.31 N ATOM 302 CA SER A 31 29.379 5.217 1.174 1.00 63.11 C ATOM 303 C SER A 31 29.495 5.819 -0.223 1.00 44.11 C ATOM 304 O SER A 31 28.564 5.742 -1.023 1.00 63.23 O ATOM 305 CB SER A 31 30.560 4.280 1.437 1.00 35.33 C ATOM 306 OG SER A 31 30.532 3.786 2.765 1.00 2.24 O ATOM 0 H SER A 31 28.055 3.638 0.783 1.00 41.31 H new ATOM 0 HA SER A 31 29.398 6.027 1.903 1.00 63.11 H new ATOM 0 HB2 SER A 31 30.531 3.447 0.735 1.00 35.33 H new ATOM 0 HB3 SER A 31 31.496 4.811 1.263 1.00 35.33 H new ATOM 0 HG SER A 31 31.296 3.188 2.908 1.00 2.24 H new ATOM 312 N ASN A 32 30.646 6.419 -0.508 1.00 45.21 N ATOM 313 CA ASN A 32 30.886 7.036 -1.808 1.00 33.20 C ATOM 314 C ASN A 32 30.946 5.980 -2.908 1.00 0.31 C ATOM 315 O ASN A 32 30.292 6.109 -3.942 1.00 72.12 O ATOM 316 CB ASN A 32 32.188 7.838 -1.783 1.00 64.13 C ATOM 317 CG ASN A 32 31.956 9.324 -1.977 1.00 62.11 C ATOM 318 OD1 ASN A 32 32.346 9.897 -2.995 1.00 32.22 O ATOM 319 ND2 ASN A 32 31.319 9.956 -0.998 1.00 75.54 N ATOM 0 H ASN A 32 31.427 6.491 0.144 1.00 45.21 H new ATOM 0 HA ASN A 32 30.057 7.710 -2.021 1.00 33.20 H new ATOM 0 HB2 ASN A 32 32.695 7.673 -0.832 1.00 64.13 H new ATOM 0 HB3 ASN A 32 32.852 7.472 -2.566 1.00 64.13 H new ATOM 0 HD21 ASN A 32 31.135 10.957 -1.072 1.00 75.54 H new ATOM 0 HD22 ASN A 32 31.014 9.441 -0.172 1.00 75.54 H new ATOM 326 N ALA A 33 31.735 4.937 -2.676 1.00 64.51 N ATOM 327 CA ALA A 33 31.879 3.857 -3.645 1.00 43.54 C ATOM 328 C ALA A 33 30.897 2.727 -3.359 1.00 14.24 C ATOM 329 O ALA A 33 30.105 2.345 -4.221 1.00 33.34 O ATOM 330 CB ALA A 33 33.307 3.332 -3.642 1.00 21.33 C ATOM 0 H ALA A 33 32.285 4.816 -1.825 1.00 64.51 H new ATOM 0 HA ALA A 33 31.653 4.257 -4.633 1.00 43.54 H new ATOM 0 HB1 ALA A 33 33.400 2.526 -4.370 1.00 21.33 H new ATOM 0 HB2 ALA A 33 33.992 4.139 -3.904 1.00 21.33 H new ATOM 0 HB3 ALA A 33 33.554 2.955 -2.650 1.00 21.33 H new ATOM 336 N THR A 34 30.953 2.195 -2.142 1.00 32.33 N ATOM 337 CA THR A 34 30.069 1.107 -1.742 1.00 23.11 C ATOM 338 C THR A 34 30.359 0.659 -0.314 1.00 5.31 C ATOM 339 O THR A 34 31.515 0.593 0.103 1.00 50.30 O ATOM 340 CB THR A 34 30.206 -0.103 -2.685 1.00 20.41 C ATOM 341 OG1 THR A 34 29.540 -1.240 -2.123 1.00 52.34 O ATOM 342 CG2 THR A 34 31.670 -0.437 -2.929 1.00 1.24 C ATOM 0 H THR A 34 31.601 2.500 -1.416 1.00 32.33 H new ATOM 0 HA THR A 34 29.050 1.490 -1.800 1.00 23.11 H new ATOM 0 HB THR A 34 29.745 0.154 -3.638 1.00 20.41 H new ATOM 0 HG1 THR A 34 28.607 -1.010 -1.931 1.00 52.34 H new ATOM 0 HG21 THR A 34 31.741 -1.295 -3.598 1.00 1.24 H new ATOM 0 HG22 THR A 34 32.168 0.420 -3.383 1.00 1.24 H new ATOM 0 HG23 THR A 34 32.152 -0.675 -1.981 1.00 1.24 H new ATOM 350 N ASN A 35 29.303 0.352 0.431 1.00 13.14 N ATOM 351 CA ASN A 35 29.445 -0.090 1.814 1.00 50.11 C ATOM 352 C ASN A 35 30.436 -1.245 1.916 1.00 21.35 C ATOM 353 O ASN A 35 30.567 -2.050 0.994 1.00 74.42 O ATOM 354 CB ASN A 35 28.088 -0.516 2.377 1.00 13.12 C ATOM 355 CG ASN A 35 28.216 -1.271 3.686 1.00 2.22 C ATOM 356 OD1 ASN A 35 27.764 -2.410 3.806 1.00 45.24 O ATOM 357 ND2 ASN A 35 28.835 -0.637 4.676 1.00 34.40 N ATOM 0 H ASN A 35 28.339 0.401 0.101 1.00 13.14 H new ATOM 0 HA ASN A 35 29.827 0.746 2.400 1.00 50.11 H new ATOM 0 HB2 ASN A 35 27.468 0.367 2.529 1.00 13.12 H new ATOM 0 HB3 ASN A 35 27.576 -1.143 1.647 1.00 13.12 H new ATOM 0 HD21 ASN A 35 28.951 -1.094 5.580 1.00 34.40 H new ATOM 0 HD22 ASN A 35 29.194 0.307 4.532 1.00 34.40 H new ATOM 364 N THR A 36 31.133 -1.321 3.046 1.00 61.50 N ATOM 365 CA THR A 36 32.113 -2.377 3.270 1.00 73.12 C ATOM 366 C THR A 36 31.829 -3.124 4.568 1.00 20.11 C ATOM 367 O THR A 36 31.324 -2.546 5.531 1.00 33.50 O ATOM 368 CB THR A 36 33.545 -1.813 3.318 1.00 63.22 C ATOM 369 OG1 THR A 36 33.688 -0.756 2.362 1.00 20.33 O ATOM 370 CG2 THR A 36 34.566 -2.904 3.031 1.00 21.12 C ATOM 0 H THR A 36 31.037 -0.664 3.820 1.00 61.50 H new ATOM 0 HA THR A 36 32.031 -3.068 2.431 1.00 73.12 H new ATOM 0 HB THR A 36 33.725 -1.423 4.320 1.00 63.22 H new ATOM 0 HG1 THR A 36 34.601 -0.402 2.400 1.00 20.33 H new ATOM 0 HG21 THR A 36 35.570 -2.482 3.070 1.00 21.12 H new ATOM 0 HG22 THR A 36 34.475 -3.693 3.777 1.00 21.12 H new ATOM 0 HG23 THR A 36 34.386 -3.319 2.040 1.00 21.12 H new ATOM 378 N CYS A 37 32.158 -4.411 4.588 1.00 33.45 N ATOM 379 CA CYS A 37 31.939 -5.238 5.769 1.00 72.41 C ATOM 380 C CYS A 37 33.138 -6.145 6.028 1.00 64.31 C ATOM 381 O CYS A 37 33.523 -6.944 5.173 1.00 34.03 O ATOM 382 CB CYS A 37 30.675 -6.083 5.598 1.00 15.03 C ATOM 383 SG CYS A 37 30.343 -7.214 6.987 1.00 14.24 S ATOM 0 H CYS A 37 32.577 -4.904 3.800 1.00 33.45 H new ATOM 0 HA CYS A 37 31.814 -4.577 6.626 1.00 72.41 H new ATOM 0 HB2 CYS A 37 29.821 -5.418 5.473 1.00 15.03 H new ATOM 0 HB3 CYS A 37 30.762 -6.666 4.681 1.00 15.03 H new ATOM 388 N PHE A 38 33.726 -6.016 7.213 1.00 71.12 N ATOM 389 CA PHE A 38 34.882 -6.823 7.585 1.00 42.11 C ATOM 390 C PHE A 38 35.952 -6.774 6.498 1.00 72.53 C ATOM 391 O PHE A 38 36.474 -7.807 6.079 1.00 2.40 O ATOM 392 CB PHE A 38 34.460 -8.272 7.837 1.00 41.14 C ATOM 393 CG PHE A 38 33.886 -8.500 9.205 1.00 15.25 C ATOM 394 CD1 PHE A 38 33.402 -7.439 9.954 1.00 53.44 C ATOM 395 CD2 PHE A 38 33.829 -9.775 9.744 1.00 73.10 C ATOM 396 CE1 PHE A 38 32.873 -7.646 11.214 1.00 43.52 C ATOM 397 CE2 PHE A 38 33.301 -9.988 11.004 1.00 70.34 C ATOM 398 CZ PHE A 38 32.822 -8.922 11.739 1.00 73.01 C ATOM 0 H PHE A 38 33.421 -5.360 7.932 1.00 71.12 H new ATOM 0 HA PHE A 38 35.302 -6.410 8.502 1.00 42.11 H new ATOM 0 HB2 PHE A 38 33.722 -8.562 7.089 1.00 41.14 H new ATOM 0 HB3 PHE A 38 35.324 -8.922 7.701 1.00 41.14 H new ATOM 0 HD1 PHE A 38 33.439 -6.439 9.548 1.00 53.44 H new ATOM 0 HD2 PHE A 38 34.201 -10.613 9.173 1.00 73.10 H new ATOM 0 HE1 PHE A 38 32.500 -6.810 11.787 1.00 43.52 H new ATOM 0 HE2 PHE A 38 33.263 -10.987 11.413 1.00 70.34 H new ATOM 0 HZ PHE A 38 32.408 -9.086 12.723 1.00 73.01 H new ATOM 408 N GLY A 39 36.272 -5.566 6.044 1.00 30.21 N ATOM 409 CA GLY A 39 37.277 -5.405 5.009 1.00 15.53 C ATOM 410 C GLY A 39 36.719 -5.637 3.619 1.00 42.41 C ATOM 411 O GLY A 39 36.842 -4.781 2.743 1.00 55.41 O ATOM 0 H GLY A 39 35.854 -4.696 6.374 1.00 30.21 H new ATOM 0 HA2 GLY A 39 37.695 -4.400 5.066 1.00 15.53 H new ATOM 0 HA3 GLY A 39 38.095 -6.102 5.190 1.00 15.53 H new ATOM 415 N SER A 40 36.107 -6.798 3.415 1.00 74.51 N ATOM 416 CA SER A 40 35.533 -7.143 2.119 1.00 23.22 C ATOM 417 C SER A 40 34.337 -6.252 1.800 1.00 33.13 C ATOM 418 O SER A 40 33.350 -6.230 2.537 1.00 41.34 O ATOM 419 CB SER A 40 35.109 -8.613 2.100 1.00 14.24 C ATOM 420 OG SER A 40 35.950 -9.376 1.254 1.00 64.12 O ATOM 0 H SER A 40 35.995 -7.517 4.130 1.00 74.51 H new ATOM 0 HA SER A 40 36.296 -6.983 1.357 1.00 23.22 H new ATOM 0 HB2 SER A 40 35.143 -9.017 3.112 1.00 14.24 H new ATOM 0 HB3 SER A 40 34.077 -8.692 1.759 1.00 14.24 H new ATOM 0 HG SER A 40 35.659 -10.312 1.261 1.00 64.12 H new ATOM 426 N LYS A 41 34.431 -5.518 0.697 1.00 42.02 N ATOM 427 CA LYS A 41 33.358 -4.625 0.277 1.00 33.00 C ATOM 428 C LYS A 41 32.135 -5.418 -0.174 1.00 64.23 C ATOM 429 O LYS A 41 32.263 -6.477 -0.790 1.00 74.40 O ATOM 430 CB LYS A 41 33.837 -3.716 -0.857 1.00 74.44 C ATOM 431 CG LYS A 41 35.125 -2.976 -0.541 1.00 55.11 C ATOM 432 CD LYS A 41 35.705 -2.312 -1.779 1.00 34.31 C ATOM 433 CE LYS A 41 34.791 -1.215 -2.303 1.00 0.22 C ATOM 434 NZ LYS A 41 35.528 0.059 -2.529 1.00 51.30 N ATOM 0 H LYS A 41 35.241 -5.524 0.077 1.00 42.02 H new ATOM 0 HA LYS A 41 33.075 -4.010 1.132 1.00 33.00 H new ATOM 0 HB2 LYS A 41 33.984 -4.316 -1.755 1.00 74.44 H new ATOM 0 HB3 LYS A 41 33.057 -2.989 -1.083 1.00 74.44 H new ATOM 0 HG2 LYS A 41 34.934 -2.221 0.222 1.00 55.11 H new ATOM 0 HG3 LYS A 41 35.853 -3.672 -0.126 1.00 55.11 H new ATOM 0 HD2 LYS A 41 36.682 -1.891 -1.543 1.00 34.31 H new ATOM 0 HD3 LYS A 41 35.859 -3.061 -2.556 1.00 34.31 H new ATOM 0 HE2 LYS A 41 34.332 -1.540 -3.237 1.00 0.22 H new ATOM 0 HE3 LYS A 41 33.982 -1.046 -1.592 1.00 0.22 H new ATOM 0 HZ1 LYS A 41 34.871 0.782 -2.886 1.00 51.30 H new ATOM 0 HZ2 LYS A 41 35.945 0.383 -1.633 1.00 51.30 H new ATOM 0 HZ3 LYS A 41 36.284 -0.096 -3.226 1.00 51.30 H new ATOM 448 N LEU A 42 30.952 -4.899 0.134 1.00 22.02 N ATOM 449 CA LEU A 42 29.706 -5.558 -0.241 1.00 61.23 C ATOM 450 C LEU A 42 29.367 -5.290 -1.704 1.00 44.21 C ATOM 451 O LEU A 42 29.777 -4.286 -2.288 1.00 24.23 O ATOM 452 CB LEU A 42 28.563 -5.079 0.655 1.00 73.51 C ATOM 453 CG LEU A 42 28.713 -5.371 2.148 1.00 5.24 C ATOM 454 CD1 LEU A 42 29.240 -6.781 2.367 1.00 53.22 C ATOM 455 CD2 LEU A 42 29.633 -4.349 2.801 1.00 65.11 C ATOM 0 H LEU A 42 30.829 -4.023 0.643 1.00 22.02 H new ATOM 0 HA LEU A 42 29.838 -6.632 -0.109 1.00 61.23 H new ATOM 0 HB2 LEU A 42 28.453 -4.002 0.525 1.00 73.51 H new ATOM 0 HB3 LEU A 42 27.638 -5.538 0.307 1.00 73.51 H new ATOM 0 HG LEU A 42 27.730 -5.297 2.613 1.00 5.24 H new ATOM 0 HD11 LEU A 42 29.340 -6.970 3.436 1.00 53.22 H new ATOM 0 HD12 LEU A 42 28.545 -7.501 1.935 1.00 53.22 H new ATOM 0 HD13 LEU A 42 30.213 -6.884 1.888 1.00 53.22 H new ATOM 0 HD21 LEU A 42 29.728 -4.572 3.864 1.00 65.11 H new ATOM 0 HD22 LEU A 42 30.616 -4.392 2.332 1.00 65.11 H new ATOM 0 HD23 LEU A 42 29.214 -3.350 2.676 1.00 65.11 H new ATOM 467 N PRO A 43 28.599 -6.206 -2.312 1.00 21.13 N ATOM 468 CA PRO A 43 28.186 -6.089 -3.713 1.00 53.12 C ATOM 469 C PRO A 43 27.182 -4.961 -3.929 1.00 61.42 C ATOM 470 O PRO A 43 26.830 -4.639 -5.064 1.00 63.43 O ATOM 471 CB PRO A 43 27.538 -7.445 -4.007 1.00 2.44 C ATOM 472 CG PRO A 43 27.077 -7.939 -2.679 1.00 62.41 C ATOM 473 CD PRO A 43 28.074 -7.427 -1.677 1.00 44.11 C ATOM 0 HA PRO A 43 29.025 -5.852 -4.367 1.00 53.12 H new ATOM 0 HB2 PRO A 43 26.705 -7.343 -4.703 1.00 2.44 H new ATOM 0 HB3 PRO A 43 28.250 -8.134 -4.461 1.00 2.44 H new ATOM 0 HG2 PRO A 43 26.075 -7.574 -2.454 1.00 62.41 H new ATOM 0 HG3 PRO A 43 27.031 -9.028 -2.662 1.00 62.41 H new ATOM 0 HD2 PRO A 43 27.605 -7.211 -0.717 1.00 44.11 H new ATOM 0 HD3 PRO A 43 28.864 -8.154 -1.489 1.00 44.11 H new ATOM 481 N TYR A 44 26.725 -4.365 -2.834 1.00 1.30 N ATOM 482 CA TYR A 44 25.760 -3.274 -2.904 1.00 1.11 C ATOM 483 C TYR A 44 26.327 -2.004 -2.277 1.00 0.11 C ATOM 484 O TYR A 44 27.185 -2.063 -1.397 1.00 64.53 O ATOM 485 CB TYR A 44 24.461 -3.668 -2.199 1.00 22.21 C ATOM 486 CG TYR A 44 24.665 -4.617 -1.039 1.00 45.51 C ATOM 487 CD1 TYR A 44 25.067 -4.147 0.205 1.00 31.34 C ATOM 488 CD2 TYR A 44 24.456 -5.982 -1.188 1.00 20.11 C ATOM 489 CE1 TYR A 44 25.255 -5.010 1.267 1.00 25.34 C ATOM 490 CE2 TYR A 44 24.641 -6.852 -0.131 1.00 33.40 C ATOM 491 CZ TYR A 44 25.041 -6.362 1.094 1.00 11.24 C ATOM 492 OH TYR A 44 25.226 -7.225 2.150 1.00 3.42 O ATOM 0 H TYR A 44 27.007 -4.619 -1.887 1.00 1.30 H new ATOM 0 HA TYR A 44 25.550 -3.076 -3.955 1.00 1.11 H new ATOM 0 HB2 TYR A 44 23.966 -2.767 -1.837 1.00 22.21 H new ATOM 0 HB3 TYR A 44 23.791 -4.131 -2.923 1.00 22.21 H new ATOM 0 HD1 TYR A 44 25.235 -3.089 0.344 1.00 31.34 H new ATOM 0 HD2 TYR A 44 24.144 -6.370 -2.146 1.00 20.11 H new ATOM 0 HE1 TYR A 44 25.568 -4.628 2.228 1.00 25.34 H new ATOM 0 HE2 TYR A 44 24.473 -7.911 -0.264 1.00 33.40 H new ATOM 0 HH TYR A 44 24.885 -6.814 2.972 1.00 3.42 H new ATOM 502 N GLU A 45 25.839 -0.856 -2.737 1.00 1.03 N ATOM 503 CA GLU A 45 26.297 0.429 -2.221 1.00 60.13 C ATOM 504 C GLU A 45 25.139 1.214 -1.612 1.00 3.43 C ATOM 505 O GLU A 45 25.259 2.410 -1.342 1.00 42.43 O ATOM 506 CB GLU A 45 26.952 1.247 -3.336 1.00 75.05 C ATOM 507 CG GLU A 45 25.959 1.813 -4.338 1.00 44.43 C ATOM 508 CD GLU A 45 26.602 2.146 -5.671 1.00 74.21 C ATOM 509 OE1 GLU A 45 27.596 2.901 -5.679 1.00 53.35 O ATOM 510 OE2 GLU A 45 26.110 1.649 -6.706 1.00 55.42 O ATOM 0 H GLU A 45 25.128 -0.789 -3.465 1.00 1.03 H new ATOM 0 HA GLU A 45 27.033 0.237 -1.441 1.00 60.13 H new ATOM 0 HB2 GLU A 45 27.514 2.068 -2.891 1.00 75.05 H new ATOM 0 HB3 GLU A 45 27.669 0.618 -3.863 1.00 75.05 H new ATOM 0 HG2 GLU A 45 25.157 1.092 -4.496 1.00 44.43 H new ATOM 0 HG3 GLU A 45 25.503 2.712 -3.924 1.00 44.43 H new ATOM 517 N LEU A 46 24.019 0.534 -1.398 1.00 13.15 N ATOM 518 CA LEU A 46 22.838 1.167 -0.820 1.00 51.02 C ATOM 519 C LEU A 46 22.417 0.463 0.466 1.00 53.31 C ATOM 520 O LEU A 46 22.951 -0.590 0.813 1.00 43.23 O ATOM 521 CB LEU A 46 21.684 1.152 -1.825 1.00 23.23 C ATOM 522 CG LEU A 46 21.927 1.898 -3.137 1.00 41.00 C ATOM 523 CD1 LEU A 46 20.734 1.744 -4.067 1.00 52.32 C ATOM 524 CD2 LEU A 46 22.211 3.369 -2.869 1.00 61.15 C ATOM 0 H LEU A 46 23.903 -0.456 -1.616 1.00 13.15 H new ATOM 0 HA LEU A 46 23.090 2.200 -0.581 1.00 51.02 H new ATOM 0 HB2 LEU A 46 21.446 0.114 -2.059 1.00 23.23 H new ATOM 0 HB3 LEU A 46 20.804 1.580 -1.344 1.00 23.23 H new ATOM 0 HG LEU A 46 22.800 1.463 -3.624 1.00 41.00 H new ATOM 0 HD11 LEU A 46 20.925 2.282 -4.996 1.00 52.32 H new ATOM 0 HD12 LEU A 46 20.577 0.688 -4.285 1.00 52.32 H new ATOM 0 HD13 LEU A 46 19.844 2.152 -3.588 1.00 52.32 H new ATOM 0 HD21 LEU A 46 22.382 3.885 -3.814 1.00 61.15 H new ATOM 0 HD22 LEU A 46 21.358 3.817 -2.360 1.00 61.15 H new ATOM 0 HD23 LEU A 46 23.097 3.460 -2.241 1.00 61.15 H new ATOM 536 N SER A 47 21.454 1.052 1.168 1.00 34.41 N ATOM 537 CA SER A 47 20.961 0.482 2.417 1.00 62.11 C ATOM 538 C SER A 47 19.548 0.972 2.717 1.00 31.44 C ATOM 539 O SER A 47 19.116 2.006 2.208 1.00 20.14 O ATOM 540 CB SER A 47 21.896 0.847 3.572 1.00 71.31 C ATOM 541 OG SER A 47 21.169 1.054 4.770 1.00 33.34 O ATOM 0 H SER A 47 21.000 1.923 0.893 1.00 34.41 H new ATOM 0 HA SER A 47 20.935 -0.602 2.308 1.00 62.11 H new ATOM 0 HB2 SER A 47 22.626 0.051 3.719 1.00 71.31 H new ATOM 0 HB3 SER A 47 22.454 1.749 3.321 1.00 71.31 H new ATOM 0 HG SER A 47 20.610 1.854 4.679 1.00 33.34 H new ATOM 547 N SER A 48 18.832 0.220 3.548 1.00 2.21 N ATOM 548 CA SER A 48 17.466 0.574 3.914 1.00 11.44 C ATOM 549 C SER A 48 17.290 0.565 5.430 1.00 41.41 C ATOM 550 O SER A 48 17.271 -0.494 6.058 1.00 0.12 O ATOM 551 CB SER A 48 16.475 -0.396 3.269 1.00 55.42 C ATOM 552 OG SER A 48 15.162 -0.186 3.760 1.00 0.41 O ATOM 0 H SER A 48 19.176 -0.638 3.980 1.00 2.21 H new ATOM 0 HA SER A 48 17.268 1.582 3.548 1.00 11.44 H new ATOM 0 HB2 SER A 48 16.487 -0.267 2.187 1.00 55.42 H new ATOM 0 HB3 SER A 48 16.782 -1.422 3.471 1.00 55.42 H new ATOM 0 HG SER A 48 14.778 0.610 3.337 1.00 0.41 H new ATOM 558 N LEU A 49 17.162 1.753 6.011 1.00 30.01 N ATOM 559 CA LEU A 49 16.987 1.884 7.454 1.00 65.04 C ATOM 560 C LEU A 49 15.760 1.112 7.926 1.00 54.11 C ATOM 561 O LEU A 49 15.655 0.749 9.098 1.00 41.14 O ATOM 562 CB LEU A 49 16.857 3.358 7.839 1.00 13.45 C ATOM 563 CG LEU A 49 17.895 3.888 8.830 1.00 73.33 C ATOM 564 CD1 LEU A 49 17.620 3.354 10.227 1.00 0.21 C ATOM 565 CD2 LEU A 49 19.300 3.513 8.381 1.00 53.35 C ATOM 0 H LEU A 49 17.176 2.639 5.506 1.00 30.01 H new ATOM 0 HA LEU A 49 17.866 1.464 7.942 1.00 65.04 H new ATOM 0 HB2 LEU A 49 16.914 3.957 6.930 1.00 13.45 H new ATOM 0 HB3 LEU A 49 15.865 3.516 8.263 1.00 13.45 H new ATOM 0 HG LEU A 49 17.821 4.975 8.858 1.00 73.33 H new ATOM 0 HD11 LEU A 49 18.368 3.741 10.918 1.00 0.21 H new ATOM 0 HD12 LEU A 49 16.629 3.672 10.550 1.00 0.21 H new ATOM 0 HD13 LEU A 49 17.666 2.265 10.216 1.00 0.21 H new ATOM 0 HD21 LEU A 49 20.026 3.898 9.097 1.00 53.35 H new ATOM 0 HD22 LEU A 49 19.386 2.428 8.324 1.00 53.35 H new ATOM 0 HD23 LEU A 49 19.495 3.944 7.399 1.00 53.35 H new ATOM 577 N ASP A 50 14.834 0.863 7.006 1.00 21.01 N ATOM 578 CA ASP A 50 13.614 0.131 7.327 1.00 24.13 C ATOM 579 C ASP A 50 13.941 -1.253 7.880 1.00 11.24 C ATOM 580 O ASP A 50 13.249 -1.759 8.765 1.00 3.54 O ATOM 581 CB ASP A 50 12.730 0.002 6.086 1.00 13.14 C ATOM 582 CG ASP A 50 11.342 -0.513 6.415 1.00 24.44 C ATOM 583 OD1 ASP A 50 10.949 -0.446 7.599 1.00 1.30 O ATOM 584 OD2 ASP A 50 10.650 -0.984 5.489 1.00 13.22 O ATOM 0 H ASP A 50 14.905 1.157 6.032 1.00 21.01 H new ATOM 0 HA ASP A 50 13.074 0.690 8.091 1.00 24.13 H new ATOM 0 HB2 ASP A 50 12.648 0.974 5.599 1.00 13.14 H new ATOM 0 HB3 ASP A 50 13.205 -0.672 5.373 1.00 13.14 H new ATOM 589 N LEU A 51 14.998 -1.861 7.353 1.00 54.23 N ATOM 590 CA LEU A 51 15.416 -3.187 7.793 1.00 72.44 C ATOM 591 C LEU A 51 15.623 -3.220 9.303 1.00 3.24 C ATOM 592 O LEU A 51 15.497 -4.268 9.937 1.00 73.53 O ATOM 593 CB LEU A 51 16.705 -3.599 7.080 1.00 23.54 C ATOM 594 CG LEU A 51 16.909 -5.101 6.877 1.00 23.21 C ATOM 595 CD1 LEU A 51 16.827 -5.456 5.401 1.00 63.14 C ATOM 596 CD2 LEU A 51 18.244 -5.542 7.460 1.00 2.21 C ATOM 0 H LEU A 51 15.581 -1.457 6.620 1.00 54.23 H new ATOM 0 HA LEU A 51 14.626 -3.893 7.539 1.00 72.44 H new ATOM 0 HB2 LEU A 51 16.727 -3.114 6.104 1.00 23.54 H new ATOM 0 HB3 LEU A 51 17.551 -3.211 7.648 1.00 23.54 H new ATOM 0 HG LEU A 51 16.114 -5.630 7.402 1.00 23.21 H new ATOM 0 HD11 LEU A 51 16.975 -6.529 5.276 1.00 63.14 H new ATOM 0 HD12 LEU A 51 15.847 -5.177 5.014 1.00 63.14 H new ATOM 0 HD13 LEU A 51 17.600 -4.917 4.854 1.00 63.14 H new ATOM 0 HD21 LEU A 51 18.372 -6.614 7.306 1.00 2.21 H new ATOM 0 HD22 LEU A 51 19.053 -5.005 6.964 1.00 2.21 H new ATOM 0 HD23 LEU A 51 18.265 -5.324 8.528 1.00 2.21 H new ATOM 608 N THR A 52 15.941 -2.063 9.877 1.00 20.31 N ATOM 609 CA THR A 52 16.165 -1.959 11.313 1.00 11.53 C ATOM 610 C THR A 52 15.128 -1.052 11.967 1.00 71.13 C ATOM 611 O THR A 52 14.248 -0.514 11.294 1.00 5.53 O ATOM 612 CB THR A 52 17.573 -1.416 11.624 1.00 33.54 C ATOM 613 OG1 THR A 52 17.924 -0.397 10.683 1.00 41.52 O ATOM 614 CG2 THR A 52 18.605 -2.533 11.579 1.00 72.11 C ATOM 0 H THR A 52 16.049 -1.185 9.369 1.00 20.31 H new ATOM 0 HA THR A 52 16.073 -2.966 11.721 1.00 11.53 H new ATOM 0 HB THR A 52 17.562 -0.993 12.629 1.00 33.54 H new ATOM 0 HG1 THR A 52 18.511 -0.775 9.995 1.00 41.52 H new ATOM 0 HG21 THR A 52 19.591 -2.126 11.802 1.00 72.11 H new ATOM 0 HG22 THR A 52 18.351 -3.293 12.318 1.00 72.11 H new ATOM 0 HG23 THR A 52 18.613 -2.981 10.585 1.00 72.11 H new ATOM 622 N ASP A 53 15.237 -0.887 13.280 1.00 20.33 N ATOM 623 CA ASP A 53 14.309 -0.044 14.025 1.00 41.22 C ATOM 624 C ASP A 53 14.981 1.258 14.452 1.00 72.41 C ATOM 625 O ASP A 53 14.558 1.900 15.413 1.00 1.13 O ATOM 626 CB ASP A 53 13.783 -0.788 15.253 1.00 3.12 C ATOM 627 CG ASP A 53 12.333 -0.463 15.550 1.00 14.20 C ATOM 628 OD1 ASP A 53 11.876 0.631 15.155 1.00 64.20 O ATOM 629 OD2 ASP A 53 11.653 -1.302 16.177 1.00 61.35 O ATOM 0 H ASP A 53 15.959 -1.326 13.851 1.00 20.33 H new ATOM 0 HA ASP A 53 13.471 0.198 13.371 1.00 41.22 H new ATOM 0 HB2 ASP A 53 13.887 -1.862 15.096 1.00 3.12 H new ATOM 0 HB3 ASP A 53 14.394 -0.532 16.118 1.00 3.12 H new ATOM 634 N PHE A 54 16.030 1.640 13.732 1.00 50.14 N ATOM 635 CA PHE A 54 16.762 2.864 14.037 1.00 31.10 C ATOM 636 C PHE A 54 16.141 4.061 13.323 1.00 2.34 C ATOM 637 O PHE A 54 15.335 3.902 12.406 1.00 43.40 O ATOM 638 CB PHE A 54 18.230 2.720 13.632 1.00 24.42 C ATOM 639 CG PHE A 54 18.898 1.509 14.219 1.00 31.04 C ATOM 640 CD1 PHE A 54 18.992 1.351 15.593 1.00 52.13 C ATOM 641 CD2 PHE A 54 19.431 0.529 13.398 1.00 31.41 C ATOM 642 CE1 PHE A 54 19.606 0.238 16.135 1.00 3.44 C ATOM 643 CE2 PHE A 54 20.046 -0.587 13.935 1.00 1.51 C ATOM 644 CZ PHE A 54 20.133 -0.732 15.306 1.00 71.23 C ATOM 0 H PHE A 54 16.393 1.120 12.933 1.00 50.14 H new ATOM 0 HA PHE A 54 16.704 3.034 15.112 1.00 31.10 H new ATOM 0 HB2 PHE A 54 18.296 2.670 12.545 1.00 24.42 H new ATOM 0 HB3 PHE A 54 18.774 3.612 13.944 1.00 24.42 H new ATOM 0 HD1 PHE A 54 18.581 2.106 16.247 1.00 52.13 H new ATOM 0 HD2 PHE A 54 19.365 0.638 12.325 1.00 31.41 H new ATOM 0 HE1 PHE A 54 19.674 0.127 17.207 1.00 3.44 H new ATOM 0 HE2 PHE A 54 20.458 -1.344 13.284 1.00 1.51 H new ATOM 0 HZ PHE A 54 20.612 -1.603 15.729 1.00 71.23 H new ATOM 654 N HIS A 55 16.522 5.261 13.752 1.00 60.30 N ATOM 655 CA HIS A 55 16.003 6.486 13.155 1.00 44.14 C ATOM 656 C HIS A 55 17.122 7.282 12.489 1.00 61.54 C ATOM 657 O HIS A 55 16.983 8.479 12.238 1.00 40.24 O ATOM 658 CB HIS A 55 15.314 7.344 14.216 1.00 22.12 C ATOM 659 CG HIS A 55 13.875 6.989 14.431 1.00 1.13 C ATOM 660 ND1 HIS A 55 13.471 5.904 15.180 1.00 63.44 N ATOM 661 CD2 HIS A 55 12.741 7.584 13.992 1.00 4.44 C ATOM 662 CE1 HIS A 55 12.152 5.845 15.190 1.00 14.43 C ATOM 663 NE2 HIS A 55 11.684 6.854 14.478 1.00 42.54 N ATOM 0 H HIS A 55 17.188 5.410 14.510 1.00 60.30 H new ATOM 0 HA HIS A 55 15.274 6.209 12.393 1.00 44.14 H new ATOM 0 HB2 HIS A 55 15.850 7.241 15.159 1.00 22.12 H new ATOM 0 HB3 HIS A 55 15.382 8.392 13.924 1.00 22.12 H new ATOM 0 HD2 HIS A 55 12.679 8.468 13.375 1.00 4.44 H new ATOM 0 HE1 HIS A 55 11.557 5.098 15.695 1.00 14.43 H new ATOM 0 HE2 HIS A 55 10.698 7.058 14.315 1.00 42.54 H new ATOM 671 N THR A 56 18.233 6.608 12.205 1.00 52.12 N ATOM 672 CA THR A 56 19.376 7.252 11.570 1.00 32.20 C ATOM 673 C THR A 56 20.527 6.270 11.386 1.00 45.20 C ATOM 674 O THR A 56 20.606 5.256 12.078 1.00 23.21 O ATOM 675 CB THR A 56 19.870 8.457 12.392 1.00 30.02 C ATOM 676 OG1 THR A 56 21.187 8.830 11.971 1.00 13.53 O ATOM 677 CG2 THR A 56 19.881 8.131 13.878 1.00 34.40 C ATOM 0 H THR A 56 18.365 5.617 12.405 1.00 52.12 H new ATOM 0 HA THR A 56 19.040 7.601 10.594 1.00 32.20 H new ATOM 0 HB THR A 56 19.186 9.288 12.224 1.00 30.02 H new ATOM 0 HG1 THR A 56 21.176 9.754 11.644 1.00 13.53 H new ATOM 0 HG21 THR A 56 20.234 8.997 14.438 1.00 34.40 H new ATOM 0 HG22 THR A 56 18.872 7.876 14.202 1.00 34.40 H new ATOM 0 HG23 THR A 56 20.545 7.286 14.060 1.00 34.40 H new ATOM 685 N GLU A 57 21.419 6.579 10.449 1.00 13.43 N ATOM 686 CA GLU A 57 22.566 5.723 10.175 1.00 24.44 C ATOM 687 C GLU A 57 23.464 5.606 11.404 1.00 33.32 C ATOM 688 O GLU A 57 23.932 4.519 11.744 1.00 11.05 O ATOM 689 CB GLU A 57 23.370 6.271 8.994 1.00 32.21 C ATOM 690 CG GLU A 57 22.509 6.682 7.811 1.00 2.13 C ATOM 691 CD GLU A 57 22.557 8.174 7.546 1.00 11.30 C ATOM 692 OE1 GLU A 57 21.858 8.926 8.256 1.00 11.54 O ATOM 693 OE2 GLU A 57 23.294 8.590 6.627 1.00 22.44 O ATOM 0 H GLU A 57 21.368 7.416 9.868 1.00 13.43 H new ATOM 0 HA GLU A 57 22.193 4.730 9.922 1.00 24.44 H new ATOM 0 HB2 GLU A 57 23.949 7.132 9.328 1.00 32.21 H new ATOM 0 HB3 GLU A 57 24.083 5.514 8.668 1.00 32.21 H new ATOM 0 HG2 GLU A 57 22.842 6.148 6.921 1.00 2.13 H new ATOM 0 HG3 GLU A 57 21.477 6.382 7.996 1.00 2.13 H new ATOM 700 N LYS A 58 23.700 6.733 12.066 1.00 12.24 N ATOM 701 CA LYS A 58 24.540 6.760 13.258 1.00 71.31 C ATOM 702 C LYS A 58 24.052 5.748 14.290 1.00 63.11 C ATOM 703 O LYS A 58 24.850 5.157 15.017 1.00 11.12 O ATOM 704 CB LYS A 58 24.550 8.163 13.869 1.00 72.22 C ATOM 705 CG LYS A 58 23.250 8.534 14.560 1.00 14.33 C ATOM 706 CD LYS A 58 22.945 10.016 14.417 1.00 4.20 C ATOM 707 CE LYS A 58 22.470 10.617 15.731 1.00 42.21 C ATOM 708 NZ LYS A 58 23.583 10.761 16.710 1.00 42.44 N ATOM 0 H LYS A 58 23.321 7.641 11.797 1.00 12.24 H new ATOM 0 HA LYS A 58 25.555 6.492 12.963 1.00 71.31 H new ATOM 0 HB2 LYS A 58 25.366 8.231 14.588 1.00 72.22 H new ATOM 0 HB3 LYS A 58 24.755 8.891 13.084 1.00 72.22 H new ATOM 0 HG2 LYS A 58 22.432 7.951 14.136 1.00 14.33 H new ATOM 0 HG3 LYS A 58 23.312 8.275 15.617 1.00 14.33 H new ATOM 0 HD2 LYS A 58 23.838 10.541 14.077 1.00 4.20 H new ATOM 0 HD3 LYS A 58 22.181 10.159 13.653 1.00 4.20 H new ATOM 0 HE2 LYS A 58 22.023 11.593 15.543 1.00 42.21 H new ATOM 0 HE3 LYS A 58 21.690 9.986 16.158 1.00 42.21 H new ATOM 0 HZ1 LYS A 58 23.237 11.251 17.560 1.00 42.44 H new ATOM 0 HZ2 LYS A 58 23.938 9.819 16.973 1.00 42.44 H new ATOM 0 HZ3 LYS A 58 24.353 11.313 16.281 1.00 42.44 H new ATOM 722 N GLU A 59 22.739 5.553 14.346 1.00 35.22 N ATOM 723 CA GLU A 59 22.146 4.611 15.289 1.00 5.33 C ATOM 724 C GLU A 59 22.544 3.178 14.949 1.00 25.14 C ATOM 725 O GLU A 59 22.898 2.394 15.831 1.00 22.13 O ATOM 726 CB GLU A 59 20.622 4.743 15.287 1.00 41.23 C ATOM 727 CG GLU A 59 20.082 5.589 16.428 1.00 44.34 C ATOM 728 CD GLU A 59 19.448 4.755 17.523 1.00 34.21 C ATOM 729 OE1 GLU A 59 20.195 4.191 18.349 1.00 3.32 O ATOM 730 OE2 GLU A 59 18.202 4.666 17.554 1.00 62.20 O ATOM 0 H GLU A 59 22.065 6.034 13.750 1.00 35.22 H new ATOM 0 HA GLU A 59 22.522 4.848 16.284 1.00 5.33 H new ATOM 0 HB2 GLU A 59 20.305 5.180 14.340 1.00 41.23 H new ATOM 0 HB3 GLU A 59 20.180 3.748 15.343 1.00 41.23 H new ATOM 0 HG2 GLU A 59 20.893 6.182 16.851 1.00 44.34 H new ATOM 0 HG3 GLU A 59 19.345 6.291 16.038 1.00 44.34 H new ATOM 737 N LEU A 60 22.484 2.842 13.666 1.00 53.04 N ATOM 738 CA LEU A 60 22.837 1.503 13.208 1.00 61.24 C ATOM 739 C LEU A 60 24.310 1.207 13.473 1.00 52.51 C ATOM 740 O LEU A 60 24.659 0.135 13.964 1.00 61.25 O ATOM 741 CB LEU A 60 22.537 1.357 11.715 1.00 51.33 C ATOM 742 CG LEU A 60 22.402 -0.074 11.194 1.00 52.14 C ATOM 743 CD1 LEU A 60 21.439 -0.125 10.018 1.00 70.14 C ATOM 744 CD2 LEU A 60 23.762 -0.627 10.796 1.00 64.22 C ATOM 0 H LEU A 60 22.194 3.479 12.924 1.00 53.04 H new ATOM 0 HA LEU A 60 22.235 0.785 13.765 1.00 61.24 H new ATOM 0 HB2 LEU A 60 21.612 1.890 11.497 1.00 51.33 H new ATOM 0 HB3 LEU A 60 23.330 1.853 11.155 1.00 51.33 H new ATOM 0 HG LEU A 60 22.000 -0.695 11.994 1.00 52.14 H new ATOM 0 HD11 LEU A 60 21.355 -1.151 9.660 1.00 70.14 H new ATOM 0 HD12 LEU A 60 20.458 0.230 10.335 1.00 70.14 H new ATOM 0 HD13 LEU A 60 21.812 0.510 9.214 1.00 70.14 H new ATOM 0 HD21 LEU A 60 23.647 -1.646 10.428 1.00 64.22 H new ATOM 0 HD22 LEU A 60 24.193 -0.004 10.012 1.00 64.22 H new ATOM 0 HD23 LEU A 60 24.423 -0.627 11.663 1.00 64.22 H new ATOM 756 N ASN A 61 25.169 2.168 13.147 1.00 73.12 N ATOM 757 CA ASN A 61 26.604 2.011 13.352 1.00 42.35 C ATOM 758 C ASN A 61 26.942 1.985 14.839 1.00 11.41 C ATOM 759 O ASN A 61 27.632 1.083 15.314 1.00 44.42 O ATOM 760 CB ASN A 61 27.365 3.147 12.664 1.00 23.31 C ATOM 761 CG ASN A 61 27.574 2.890 11.184 1.00 22.32 C ATOM 762 OD1 ASN A 61 27.277 3.742 10.347 1.00 70.32 O ATOM 763 ND2 ASN A 61 28.088 1.710 10.855 1.00 11.15 N ATOM 0 H ASN A 61 24.896 3.063 12.740 1.00 73.12 H new ATOM 0 HA ASN A 61 26.907 1.061 12.913 1.00 42.35 H new ATOM 0 HB2 ASN A 61 26.816 4.079 12.794 1.00 23.31 H new ATOM 0 HB3 ASN A 61 28.333 3.277 13.148 1.00 23.31 H new ATOM 0 HD21 ASN A 61 28.251 1.480 9.875 1.00 11.15 H new ATOM 0 HD22 ASN A 61 28.319 1.034 11.583 1.00 11.15 H new ATOM 770 N ASP A 62 26.450 2.980 15.569 1.00 12.22 N ATOM 771 CA ASP A 62 26.697 3.071 17.003 1.00 5.24 C ATOM 772 C ASP A 62 26.145 1.848 17.729 1.00 54.40 C ATOM 773 O ASP A 62 26.675 1.432 18.759 1.00 32.21 O ATOM 774 CB ASP A 62 26.068 4.344 17.571 1.00 5.44 C ATOM 775 CG ASP A 62 26.778 5.599 17.102 1.00 13.54 C ATOM 776 OD1 ASP A 62 27.856 5.476 16.484 1.00 52.23 O ATOM 777 OD2 ASP A 62 26.254 6.705 17.353 1.00 4.03 O ATOM 0 H ASP A 62 25.878 3.735 15.191 1.00 12.22 H new ATOM 0 HA ASP A 62 27.775 3.107 17.159 1.00 5.24 H new ATOM 0 HB2 ASP A 62 25.020 4.391 17.276 1.00 5.44 H new ATOM 0 HB3 ASP A 62 26.091 4.302 18.660 1.00 5.44 H new ATOM 782 N LYS A 63 25.075 1.278 17.185 1.00 31.33 N ATOM 783 CA LYS A 63 24.449 0.103 17.780 1.00 70.55 C ATOM 784 C LYS A 63 25.412 -1.080 17.789 1.00 31.45 C ATOM 785 O LYS A 63 25.430 -1.871 18.734 1.00 63.23 O ATOM 786 CB LYS A 63 23.178 -0.267 17.011 1.00 21.23 C ATOM 787 CG LYS A 63 22.678 -1.671 17.303 1.00 35.14 C ATOM 788 CD LYS A 63 22.943 -2.611 16.139 1.00 21.25 C ATOM 789 CE LYS A 63 23.860 -3.755 16.545 1.00 71.11 C ATOM 790 NZ LYS A 63 23.093 -4.931 17.043 1.00 42.25 N ATOM 0 H LYS A 63 24.623 1.611 16.333 1.00 31.33 H new ATOM 0 HA LYS A 63 24.187 0.344 18.810 1.00 70.55 H new ATOM 0 HB2 LYS A 63 22.393 0.448 17.258 1.00 21.23 H new ATOM 0 HB3 LYS A 63 23.370 -0.174 15.942 1.00 21.23 H new ATOM 0 HG2 LYS A 63 23.167 -2.053 18.199 1.00 35.14 H new ATOM 0 HG3 LYS A 63 21.609 -1.641 17.512 1.00 35.14 H new ATOM 0 HD2 LYS A 63 21.999 -3.013 15.772 1.00 21.25 H new ATOM 0 HD3 LYS A 63 23.394 -2.056 15.317 1.00 21.25 H new ATOM 0 HE2 LYS A 63 24.468 -4.053 15.691 1.00 71.11 H new ATOM 0 HE3 LYS A 63 24.545 -3.413 17.321 1.00 71.11 H new ATOM 0 HZ1 LYS A 63 23.634 -5.406 17.794 1.00 42.25 H new ATOM 0 HZ2 LYS A 63 22.179 -4.613 17.423 1.00 42.25 H new ATOM 0 HZ3 LYS A 63 22.930 -5.596 16.260 1.00 42.25 H new ATOM 804 N LEU A 64 26.211 -1.195 16.735 1.00 65.31 N ATOM 805 CA LEU A 64 27.179 -2.281 16.623 1.00 70.41 C ATOM 806 C LEU A 64 28.047 -2.368 17.874 1.00 30.51 C ATOM 807 O LEU A 64 28.392 -3.459 18.327 1.00 3.21 O ATOM 808 CB LEU A 64 28.061 -2.080 15.389 1.00 11.14 C ATOM 809 CG LEU A 64 27.329 -1.965 14.052 1.00 15.31 C ATOM 810 CD1 LEU A 64 28.169 -2.555 12.931 1.00 42.45 C ATOM 811 CD2 LEU A 64 25.974 -2.654 14.125 1.00 52.01 C ATOM 0 H LEU A 64 26.208 -0.550 15.945 1.00 65.31 H new ATOM 0 HA LEU A 64 26.628 -3.216 16.520 1.00 70.41 H new ATOM 0 HB2 LEU A 64 28.654 -1.177 15.534 1.00 11.14 H new ATOM 0 HB3 LEU A 64 28.760 -2.914 15.327 1.00 11.14 H new ATOM 0 HG LEU A 64 27.166 -0.909 13.839 1.00 15.31 H new ATOM 0 HD11 LEU A 64 27.632 -2.464 11.987 1.00 42.45 H new ATOM 0 HD12 LEU A 64 29.115 -2.017 12.863 1.00 42.45 H new ATOM 0 HD13 LEU A 64 28.364 -3.607 13.138 1.00 42.45 H new ATOM 0 HD21 LEU A 64 25.467 -2.562 13.165 1.00 52.01 H new ATOM 0 HD22 LEU A 64 26.114 -3.709 14.362 1.00 52.01 H new ATOM 0 HD23 LEU A 64 25.369 -2.185 14.901 1.00 52.01 H new ATOM 823 N ASN A 65 28.394 -1.212 18.429 1.00 43.32 N ATOM 824 CA ASN A 65 29.221 -1.157 19.629 1.00 33.33 C ATOM 825 C ASN A 65 28.634 -2.031 20.734 1.00 54.41 C ATOM 826 O ASN A 65 29.366 -2.654 21.502 1.00 64.42 O ATOM 827 CB ASN A 65 29.350 0.286 20.120 1.00 42.25 C ATOM 828 CG ASN A 65 29.005 0.431 21.589 1.00 33.00 C ATOM 829 OD1 ASN A 65 29.827 0.153 22.462 1.00 44.32 O ATOM 830 ND2 ASN A 65 27.782 0.867 21.869 1.00 2.40 N ATOM 0 H ASN A 65 28.115 -0.300 18.067 1.00 43.32 H new ATOM 0 HA ASN A 65 30.211 -1.537 19.376 1.00 33.33 H new ATOM 0 HB2 ASN A 65 30.370 0.634 19.953 1.00 42.25 H new ATOM 0 HB3 ASN A 65 28.694 0.927 19.531 1.00 42.25 H new ATOM 0 HD21 ASN A 65 27.492 0.983 22.840 1.00 2.40 H new ATOM 0 HD22 ASN A 65 27.133 1.086 21.113 1.00 2.40 H new ATOM 837 N ASP A 66 27.308 -2.070 20.807 1.00 32.32 N ATOM 838 CA ASP A 66 26.621 -2.868 21.816 1.00 23.35 C ATOM 839 C ASP A 66 26.943 -4.350 21.649 1.00 61.01 C ATOM 840 O ASP A 66 27.275 -5.037 22.615 1.00 11.35 O ATOM 841 CB ASP A 66 25.110 -2.649 21.730 1.00 41.22 C ATOM 842 CG ASP A 66 24.529 -2.103 23.019 1.00 24.15 C ATOM 843 OD1 ASP A 66 25.069 -1.102 23.537 1.00 71.32 O ATOM 844 OD2 ASP A 66 23.535 -2.676 23.511 1.00 21.21 O ATOM 0 H ASP A 66 26.687 -1.558 20.180 1.00 32.32 H new ATOM 0 HA ASP A 66 26.971 -2.547 22.797 1.00 23.35 H new ATOM 0 HB2 ASP A 66 24.892 -1.958 20.916 1.00 41.22 H new ATOM 0 HB3 ASP A 66 24.622 -3.593 21.487 1.00 41.22 H new ATOM 849 N TYR A 67 26.842 -4.836 20.417 1.00 34.40 N ATOM 850 CA TYR A 67 27.118 -6.238 20.123 1.00 3.53 C ATOM 851 C TYR A 67 28.619 -6.512 20.144 1.00 71.42 C ATOM 852 O TYR A 67 29.054 -7.626 20.437 1.00 74.52 O ATOM 853 CB TYR A 67 26.537 -6.619 18.761 1.00 62.21 C ATOM 854 CG TYR A 67 27.588 -6.865 17.702 1.00 51.23 C ATOM 855 CD1 TYR A 67 28.226 -8.095 17.600 1.00 35.23 C ATOM 856 CD2 TYR A 67 27.944 -5.867 16.803 1.00 13.32 C ATOM 857 CE1 TYR A 67 29.187 -8.324 16.635 1.00 73.24 C ATOM 858 CE2 TYR A 67 28.903 -6.087 15.834 1.00 75.25 C ATOM 859 CZ TYR A 67 29.521 -7.317 15.753 1.00 23.34 C ATOM 860 OH TYR A 67 30.478 -7.540 14.790 1.00 71.43 O ATOM 0 H TYR A 67 26.571 -4.280 19.606 1.00 34.40 H new ATOM 0 HA TYR A 67 26.645 -6.846 20.894 1.00 3.53 H new ATOM 0 HB2 TYR A 67 25.929 -7.517 18.873 1.00 62.21 H new ATOM 0 HB3 TYR A 67 25.872 -5.824 18.424 1.00 62.21 H new ATOM 0 HD1 TYR A 67 27.966 -8.886 18.288 1.00 35.23 H new ATOM 0 HD2 TYR A 67 27.462 -4.902 16.863 1.00 13.32 H new ATOM 0 HE1 TYR A 67 29.674 -9.286 16.571 1.00 73.24 H new ATOM 0 HE2 TYR A 67 29.168 -5.300 15.143 1.00 75.25 H new ATOM 0 HH TYR A 67 31.135 -6.813 14.807 1.00 71.43 H new ATOM 870 N TYR A 68 29.405 -5.489 19.831 1.00 43.40 N ATOM 871 CA TYR A 68 30.857 -5.618 19.811 1.00 24.52 C ATOM 872 C TYR A 68 31.362 -6.286 21.087 1.00 2.51 C ATOM 873 O TYR A 68 32.283 -7.101 21.052 1.00 44.40 O ATOM 874 CB TYR A 68 31.511 -4.245 19.647 1.00 20.34 C ATOM 875 CG TYR A 68 32.057 -3.996 18.260 1.00 64.43 C ATOM 876 CD1 TYR A 68 33.256 -4.568 17.851 1.00 70.30 C ATOM 877 CD2 TYR A 68 31.376 -3.189 17.358 1.00 51.22 C ATOM 878 CE1 TYR A 68 33.760 -4.343 16.584 1.00 35.23 C ATOM 879 CE2 TYR A 68 31.871 -2.959 16.089 1.00 61.43 C ATOM 880 CZ TYR A 68 33.063 -3.539 15.707 1.00 42.42 C ATOM 881 OH TYR A 68 33.561 -3.311 14.444 1.00 34.30 O ATOM 0 H TYR A 68 29.061 -4.560 19.587 1.00 43.40 H new ATOM 0 HA TYR A 68 31.129 -6.245 18.962 1.00 24.52 H new ATOM 0 HB2 TYR A 68 30.779 -3.473 19.884 1.00 20.34 H new ATOM 0 HB3 TYR A 68 32.321 -4.149 20.370 1.00 20.34 H new ATOM 0 HD1 TYR A 68 33.803 -5.199 18.535 1.00 70.30 H new ATOM 0 HD2 TYR A 68 30.443 -2.733 17.654 1.00 51.22 H new ATOM 0 HE1 TYR A 68 34.694 -4.794 16.283 1.00 35.23 H new ATOM 0 HE2 TYR A 68 31.328 -2.329 15.400 1.00 61.43 H new ATOM 0 HH TYR A 68 32.949 -2.725 13.952 1.00 34.30 H new ATOM 891 N ALA A 69 30.751 -5.933 22.213 1.00 15.11 N ATOM 892 CA ALA A 69 31.135 -6.498 23.500 1.00 33.35 C ATOM 893 C ALA A 69 31.108 -8.022 23.461 1.00 61.44 C ATOM 894 O ALA A 69 31.879 -8.685 24.156 1.00 60.52 O ATOM 895 CB ALA A 69 30.218 -5.981 24.599 1.00 53.12 C ATOM 0 H ALA A 69 29.988 -5.258 22.260 1.00 15.11 H new ATOM 0 HA ALA A 69 32.156 -6.184 23.716 1.00 33.35 H new ATOM 0 HB1 ALA A 69 30.517 -6.412 25.555 1.00 53.12 H new ATOM 0 HB2 ALA A 69 30.290 -4.895 24.652 1.00 53.12 H new ATOM 0 HB3 ALA A 69 29.189 -6.266 24.379 1.00 53.12 H new ATOM 901 N LEU A 70 30.216 -8.573 22.644 1.00 4.41 N ATOM 902 CA LEU A 70 30.089 -10.020 22.514 1.00 33.00 C ATOM 903 C LEU A 70 31.380 -10.635 21.985 1.00 25.35 C ATOM 904 O LEU A 70 31.590 -11.845 22.081 1.00 13.22 O ATOM 905 CB LEU A 70 28.926 -10.368 21.582 1.00 3.44 C ATOM 906 CG LEU A 70 28.585 -11.853 21.460 1.00 22.22 C ATOM 907 CD1 LEU A 70 27.130 -12.099 21.828 1.00 3.15 C ATOM 908 CD2 LEU A 70 28.872 -12.352 20.051 1.00 23.15 C ATOM 0 H LEU A 70 29.570 -8.039 22.062 1.00 4.41 H new ATOM 0 HA LEU A 70 29.891 -10.433 23.503 1.00 33.00 H new ATOM 0 HB2 LEU A 70 28.038 -9.839 21.929 1.00 3.44 H new ATOM 0 HB3 LEU A 70 29.157 -9.986 20.588 1.00 3.44 H new ATOM 0 HG LEU A 70 29.213 -12.409 22.156 1.00 22.22 H new ATOM 0 HD11 LEU A 70 26.906 -13.162 21.735 1.00 3.15 H new ATOM 0 HD12 LEU A 70 26.956 -11.780 22.856 1.00 3.15 H new ATOM 0 HD13 LEU A 70 26.484 -11.532 21.157 1.00 3.15 H new ATOM 0 HD21 LEU A 70 28.623 -13.411 19.982 1.00 23.15 H new ATOM 0 HD22 LEU A 70 28.270 -11.791 19.337 1.00 23.15 H new ATOM 0 HD23 LEU A 70 29.929 -12.212 19.824 1.00 23.15 H new ATOM 920 N LYS A 71 32.246 -9.794 21.429 1.00 32.41 N ATOM 921 CA LYS A 71 33.520 -10.253 20.888 1.00 34.41 C ATOM 922 C LYS A 71 34.229 -11.175 21.875 1.00 44.11 C ATOM 923 O LYS A 71 34.937 -12.100 21.476 1.00 24.54 O ATOM 924 CB LYS A 71 34.416 -9.059 20.555 1.00 52.45 C ATOM 925 CG LYS A 71 34.873 -8.282 21.777 1.00 43.53 C ATOM 926 CD LYS A 71 35.855 -7.183 21.404 1.00 60.30 C ATOM 927 CE LYS A 71 35.268 -6.240 20.366 1.00 53.52 C ATOM 928 NZ LYS A 71 36.045 -4.974 20.264 1.00 2.41 N ATOM 0 H LYS A 71 32.088 -8.790 21.341 1.00 32.41 H new ATOM 0 HA LYS A 71 33.318 -10.813 19.975 1.00 34.41 H new ATOM 0 HB2 LYS A 71 35.292 -9.413 20.012 1.00 52.45 H new ATOM 0 HB3 LYS A 71 33.877 -8.386 19.888 1.00 52.45 H new ATOM 0 HG2 LYS A 71 34.008 -7.845 22.276 1.00 43.53 H new ATOM 0 HG3 LYS A 71 35.340 -8.963 22.488 1.00 43.53 H new ATOM 0 HD2 LYS A 71 36.128 -6.619 22.296 1.00 60.30 H new ATOM 0 HD3 LYS A 71 36.771 -7.628 21.016 1.00 60.30 H new ATOM 0 HE2 LYS A 71 35.251 -6.735 19.395 1.00 53.52 H new ATOM 0 HE3 LYS A 71 34.234 -6.012 20.626 1.00 53.52 H new ATOM 0 HZ1 LYS A 71 35.613 -4.358 19.546 1.00 2.41 H new ATOM 0 HZ2 LYS A 71 36.041 -4.489 21.184 1.00 2.41 H new ATOM 0 HZ3 LYS A 71 37.025 -5.189 19.991 1.00 2.41 H new ATOM 942 N HIS A 72 34.034 -10.917 23.164 1.00 4.32 N ATOM 943 CA HIS A 72 34.655 -11.725 24.208 1.00 13.10 C ATOM 944 C HIS A 72 34.398 -13.210 23.970 1.00 43.12 C ATOM 945 O HIS A 72 35.279 -14.044 24.181 1.00 73.13 O ATOM 946 CB HIS A 72 34.122 -11.317 25.582 1.00 30.51 C ATOM 947 CG HIS A 72 35.138 -11.432 26.676 1.00 1.34 C ATOM 948 ND1 HIS A 72 36.326 -10.731 26.677 1.00 54.20 N ATOM 949 CD2 HIS A 72 35.138 -12.170 27.811 1.00 41.10 C ATOM 950 CE1 HIS A 72 37.013 -11.034 27.764 1.00 71.24 C ATOM 951 NE2 HIS A 72 36.314 -11.905 28.469 1.00 60.31 N ATOM 0 H HIS A 72 33.451 -10.155 23.511 1.00 4.32 H new ATOM 0 HA HIS A 72 35.731 -11.551 24.177 1.00 13.10 H new ATOM 0 HB2 HIS A 72 33.767 -10.288 25.534 1.00 30.51 H new ATOM 0 HB3 HIS A 72 33.262 -11.940 25.829 1.00 30.51 H new ATOM 0 HD2 HIS A 72 34.358 -12.842 28.138 1.00 41.10 H new ATOM 0 HE1 HIS A 72 37.981 -10.637 28.031 1.00 71.24 H new ATOM 0 HE2 HIS A 72 36.601 -12.314 29.358 1.00 60.31 H new ATOM 959 N VAL A 73 33.186 -13.533 23.530 1.00 63.22 N ATOM 960 CA VAL A 73 32.814 -14.917 23.263 1.00 71.33 C ATOM 961 C VAL A 73 32.985 -15.257 21.786 1.00 33.23 C ATOM 962 O VAL A 73 32.215 -14.820 20.930 1.00 24.41 O ATOM 963 CB VAL A 73 31.357 -15.197 23.677 1.00 1.33 C ATOM 964 CG1 VAL A 73 30.947 -16.604 23.272 1.00 30.32 C ATOM 965 CG2 VAL A 73 31.181 -14.991 25.174 1.00 31.12 C ATOM 0 H VAL A 73 32.445 -12.855 23.351 1.00 63.22 H new ATOM 0 HA VAL A 73 33.479 -15.543 23.857 1.00 71.33 H new ATOM 0 HB VAL A 73 30.708 -14.493 23.157 1.00 1.33 H new ATOM 0 HG11 VAL A 73 29.915 -16.783 23.573 1.00 30.32 H new ATOM 0 HG12 VAL A 73 31.034 -16.711 22.191 1.00 30.32 H new ATOM 0 HG13 VAL A 73 31.598 -17.328 23.762 1.00 30.32 H new ATOM 0 HG21 VAL A 73 30.146 -15.193 25.450 1.00 31.12 H new ATOM 0 HG22 VAL A 73 31.840 -15.670 25.715 1.00 31.12 H new ATOM 0 HG23 VAL A 73 31.431 -13.962 25.432 1.00 31.12 H new ATOM 975 N PRO A 74 34.017 -16.056 21.479 1.00 61.42 N ATOM 976 CA PRO A 74 34.313 -16.474 20.105 1.00 21.12 C ATOM 977 C PRO A 74 33.272 -17.444 19.557 1.00 21.33 C ATOM 978 O PRO A 74 33.103 -17.570 18.344 1.00 13.03 O ATOM 979 CB PRO A 74 35.674 -17.164 20.230 1.00 52.04 C ATOM 980 CG PRO A 74 35.733 -17.632 21.643 1.00 64.14 C ATOM 981 CD PRO A 74 34.975 -16.614 22.448 1.00 32.25 C ATOM 0 HA PRO A 74 34.308 -15.632 19.413 1.00 21.12 H new ATOM 0 HB2 PRO A 74 35.761 -17.997 19.533 1.00 52.04 H new ATOM 0 HB3 PRO A 74 36.489 -16.475 20.007 1.00 52.04 H new ATOM 0 HG2 PRO A 74 35.287 -18.621 21.745 1.00 64.14 H new ATOM 0 HG3 PRO A 74 36.765 -17.711 21.985 1.00 64.14 H new ATOM 0 HD2 PRO A 74 34.467 -17.071 23.297 1.00 32.25 H new ATOM 0 HD3 PRO A 74 35.636 -15.845 22.848 1.00 32.25 H new ATOM 989 N LYS A 75 32.576 -18.129 20.459 1.00 51.25 N ATOM 990 CA LYS A 75 31.549 -19.087 20.066 1.00 23.24 C ATOM 991 C LYS A 75 30.478 -18.418 19.211 1.00 3.22 C ATOM 992 O LYS A 75 30.208 -18.846 18.089 1.00 60.32 O ATOM 993 CB LYS A 75 30.908 -19.715 21.306 1.00 24.02 C ATOM 994 CG LYS A 75 31.848 -20.619 22.085 1.00 61.21 C ATOM 995 CD LYS A 75 32.210 -21.863 21.291 1.00 23.21 C ATOM 996 CE LYS A 75 33.643 -21.803 20.783 1.00 32.05 C ATOM 997 NZ LYS A 75 34.066 -23.089 20.164 1.00 24.43 N ATOM 0 H LYS A 75 32.705 -18.038 21.467 1.00 51.25 H new ATOM 0 HA LYS A 75 32.025 -19.869 19.474 1.00 23.24 H new ATOM 0 HB2 LYS A 75 30.554 -18.921 21.963 1.00 24.02 H new ATOM 0 HB3 LYS A 75 30.034 -20.290 21.001 1.00 24.02 H new ATOM 0 HG2 LYS A 75 32.755 -20.071 22.338 1.00 61.21 H new ATOM 0 HG3 LYS A 75 31.379 -20.910 23.025 1.00 61.21 H new ATOM 0 HD2 LYS A 75 32.082 -22.746 21.917 1.00 23.21 H new ATOM 0 HD3 LYS A 75 31.528 -21.969 20.447 1.00 23.21 H new ATOM 0 HE2 LYS A 75 33.736 -21.000 20.052 1.00 32.05 H new ATOM 0 HE3 LYS A 75 34.311 -21.560 21.609 1.00 32.05 H new ATOM 0 HZ1 LYS A 75 35.048 -23.007 19.831 1.00 24.43 H new ATOM 0 HZ2 LYS A 75 34.002 -23.851 20.869 1.00 24.43 H new ATOM 0 HZ3 LYS A 75 33.444 -23.308 19.360 1.00 24.43 H new ATOM 1011 N CYS A 76 29.872 -17.364 19.748 1.00 62.02 N ATOM 1012 CA CYS A 76 28.831 -16.634 19.034 1.00 24.20 C ATOM 1013 C CYS A 76 29.439 -15.569 18.126 1.00 62.23 C ATOM 1014 O CYS A 76 28.882 -15.241 17.078 1.00 1.02 O ATOM 1015 CB CYS A 76 27.864 -15.983 20.025 1.00 24.52 C ATOM 1016 SG CYS A 76 26.106 -16.203 19.602 1.00 63.31 S ATOM 0 H CYS A 76 30.084 -16.996 20.675 1.00 62.02 H new ATOM 0 HA CYS A 76 28.283 -17.345 18.415 1.00 24.20 H new ATOM 0 HB2 CYS A 76 28.043 -16.398 21.017 1.00 24.52 H new ATOM 0 HB3 CYS A 76 28.082 -14.917 20.082 1.00 24.52 H new ATOM 1021 N TRP A 77 30.584 -15.034 18.535 1.00 71.53 N ATOM 1022 CA TRP A 77 31.268 -14.007 17.758 1.00 52.31 C ATOM 1023 C TRP A 77 31.509 -14.476 16.327 1.00 12.13 C ATOM 1024 O TRP A 77 31.069 -13.837 15.372 1.00 14.34 O ATOM 1025 CB TRP A 77 32.598 -13.640 18.418 1.00 14.33 C ATOM 1026 CG TRP A 77 33.606 -13.087 17.457 1.00 72.13 C ATOM 1027 CD1 TRP A 77 34.860 -13.570 17.217 1.00 25.40 C ATOM 1028 CD2 TRP A 77 33.445 -11.945 16.608 1.00 35.40 C ATOM 1029 NE1 TRP A 77 35.489 -12.798 16.270 1.00 11.33 N ATOM 1030 CE2 TRP A 77 34.641 -11.795 15.880 1.00 22.02 C ATOM 1031 CE3 TRP A 77 32.405 -11.037 16.390 1.00 3.14 C ATOM 1032 CZ2 TRP A 77 34.825 -10.773 14.953 1.00 13.51 C ATOM 1033 CZ3 TRP A 77 32.589 -10.022 15.470 1.00 22.43 C ATOM 1034 CH2 TRP A 77 33.791 -9.897 14.760 1.00 33.23 C ATOM 0 H TRP A 77 31.058 -15.294 19.400 1.00 71.53 H new ATOM 0 HA TRP A 77 30.629 -13.124 17.728 1.00 52.31 H new ATOM 0 HB2 TRP A 77 32.415 -12.907 19.203 1.00 14.33 H new ATOM 0 HB3 TRP A 77 33.013 -14.526 18.899 1.00 14.33 H new ATOM 0 HD1 TRP A 77 35.294 -14.433 17.701 1.00 25.40 H new ATOM 0 HE1 TRP A 77 36.434 -12.947 15.915 1.00 11.33 H new ATOM 0 HE3 TRP A 77 31.474 -11.127 16.931 1.00 3.14 H new ATOM 0 HZ2 TRP A 77 35.751 -10.675 14.405 1.00 13.51 H new ATOM 0 HZ3 TRP A 77 31.793 -9.313 15.295 1.00 22.43 H new ATOM 0 HH2 TRP A 77 33.904 -9.094 14.047 1.00 33.23 H new ATOM 1045 N ALA A 78 32.210 -15.596 16.187 1.00 42.03 N ATOM 1046 CA ALA A 78 32.507 -16.151 14.872 1.00 23.22 C ATOM 1047 C ALA A 78 31.236 -16.627 14.177 1.00 21.22 C ATOM 1048 O ALA A 78 31.235 -16.887 12.974 1.00 22.14 O ATOM 1049 CB ALA A 78 33.504 -17.295 14.995 1.00 14.51 C ATOM 0 H ALA A 78 32.583 -16.137 16.967 1.00 42.03 H new ATOM 0 HA ALA A 78 32.949 -15.362 14.263 1.00 23.22 H new ATOM 0 HB1 ALA A 78 33.717 -17.700 14.006 1.00 14.51 H new ATOM 0 HB2 ALA A 78 34.427 -16.927 15.443 1.00 14.51 H new ATOM 0 HB3 ALA A 78 33.083 -18.078 15.625 1.00 14.51 H new ATOM 1055 N ALA A 79 30.156 -16.740 14.943 1.00 55.14 N ATOM 1056 CA ALA A 79 28.878 -17.183 14.400 1.00 74.54 C ATOM 1057 C ALA A 79 28.190 -16.062 13.629 1.00 72.04 C ATOM 1058 O ALA A 79 27.470 -16.312 12.661 1.00 22.02 O ATOM 1059 CB ALA A 79 27.976 -17.689 15.517 1.00 44.34 C ATOM 0 H ALA A 79 30.141 -16.531 15.941 1.00 55.14 H new ATOM 0 HA ALA A 79 29.071 -18.000 13.705 1.00 74.54 H new ATOM 0 HB1 ALA A 79 27.025 -18.016 15.097 1.00 44.34 H new ATOM 0 HB2 ALA A 79 28.457 -18.527 16.022 1.00 44.34 H new ATOM 0 HB3 ALA A 79 27.799 -16.887 16.233 1.00 44.34 H new ATOM 1065 N ILE A 80 28.415 -14.827 14.063 1.00 10.24 N ATOM 1066 CA ILE A 80 27.817 -13.668 13.413 1.00 13.41 C ATOM 1067 C ILE A 80 28.812 -12.986 12.480 1.00 31.11 C ATOM 1068 O ILE A 80 28.579 -11.870 12.017 1.00 12.03 O ATOM 1069 CB ILE A 80 27.312 -12.642 14.445 1.00 52.43 C ATOM 1070 CG1 ILE A 80 26.257 -11.729 13.815 1.00 64.01 C ATOM 1071 CG2 ILE A 80 28.473 -11.822 14.989 1.00 74.24 C ATOM 1072 CD1 ILE A 80 25.832 -10.588 14.712 1.00 33.35 C ATOM 0 H ILE A 80 29.007 -14.603 14.863 1.00 10.24 H new ATOM 0 HA ILE A 80 26.970 -14.034 12.832 1.00 13.41 H new ATOM 0 HB ILE A 80 26.852 -13.179 15.274 1.00 52.43 H new ATOM 0 HG12 ILE A 80 26.650 -11.321 12.884 1.00 64.01 H new ATOM 0 HG13 ILE A 80 25.381 -12.324 13.557 1.00 64.01 H new ATOM 0 HG21 ILE A 80 28.100 -11.102 15.717 1.00 74.24 H new ATOM 0 HG22 ILE A 80 29.193 -12.485 15.470 1.00 74.24 H new ATOM 0 HG23 ILE A 80 28.959 -11.292 14.170 1.00 74.24 H new ATOM 0 HD11 ILE A 80 25.083 -9.983 14.201 1.00 33.35 H new ATOM 0 HD12 ILE A 80 25.408 -10.988 15.633 1.00 33.35 H new ATOM 0 HD13 ILE A 80 26.698 -9.970 14.949 1.00 33.35 H new ATOM 1084 N GLN A 81 29.921 -13.667 12.207 1.00 14.44 N ATOM 1085 CA GLN A 81 30.951 -13.127 11.328 1.00 11.32 C ATOM 1086 C GLN A 81 30.385 -12.834 9.942 1.00 3.25 C ATOM 1087 O GLN A 81 30.397 -11.698 9.468 1.00 41.12 O ATOM 1088 CB GLN A 81 32.121 -14.105 11.218 1.00 23.50 C ATOM 1089 CG GLN A 81 33.441 -13.534 11.710 1.00 0.31 C ATOM 1090 CD GLN A 81 34.369 -14.598 12.261 1.00 21.30 C ATOM 1091 OE1 GLN A 81 34.543 -15.658 11.659 1.00 30.43 O ATOM 1092 NE2 GLN A 81 34.972 -14.321 13.411 1.00 34.04 N ATOM 0 H GLN A 81 30.129 -14.593 12.582 1.00 14.44 H new ATOM 0 HA GLN A 81 31.308 -12.192 11.760 1.00 11.32 H new ATOM 0 HB2 GLN A 81 31.888 -15.003 11.790 1.00 23.50 H new ATOM 0 HB3 GLN A 81 32.232 -14.410 10.177 1.00 23.50 H new ATOM 0 HG2 GLN A 81 33.936 -13.015 10.889 1.00 0.31 H new ATOM 0 HG3 GLN A 81 33.245 -12.792 12.484 1.00 0.31 H new ATOM 0 HE21 GLN A 81 34.799 -13.430 13.876 1.00 34.04 H new ATOM 0 HE22 GLN A 81 35.608 -14.999 13.829 1.00 34.04 H new ATOM 1101 N PRO A 82 29.878 -13.882 9.276 1.00 1.43 N ATOM 1102 CA PRO A 82 29.298 -13.762 7.935 1.00 2.43 C ATOM 1103 C PRO A 82 27.977 -13.001 7.941 1.00 12.30 C ATOM 1104 O PRO A 82 27.642 -12.311 6.977 1.00 33.45 O ATOM 1105 CB PRO A 82 29.076 -15.216 7.514 1.00 72.25 C ATOM 1106 CG PRO A 82 28.939 -15.965 8.794 1.00 21.20 C ATOM 1107 CD PRO A 82 29.831 -15.264 9.781 1.00 20.21 C ATOM 0 HA PRO A 82 29.945 -13.202 7.259 1.00 2.43 H new ATOM 0 HB2 PRO A 82 28.182 -15.318 6.898 1.00 72.25 H new ATOM 0 HB3 PRO A 82 29.913 -15.590 6.925 1.00 72.25 H new ATOM 0 HG2 PRO A 82 27.904 -15.967 9.136 1.00 21.20 H new ATOM 0 HG3 PRO A 82 29.236 -17.006 8.671 1.00 21.20 H new ATOM 0 HD2 PRO A 82 29.425 -15.309 10.792 1.00 20.21 H new ATOM 0 HD3 PRO A 82 30.823 -15.713 9.815 1.00 20.21 H new ATOM 1115 N PHE A 83 27.230 -13.130 9.033 1.00 51.44 N ATOM 1116 CA PHE A 83 25.944 -12.454 9.163 1.00 22.02 C ATOM 1117 C PHE A 83 26.137 -10.983 9.518 1.00 15.45 C ATOM 1118 O PHE A 83 25.226 -10.169 9.356 1.00 3.34 O ATOM 1119 CB PHE A 83 25.090 -13.141 10.231 1.00 55.43 C ATOM 1120 CG PHE A 83 23.727 -12.530 10.392 1.00 52.14 C ATOM 1121 CD1 PHE A 83 22.995 -12.134 9.284 1.00 44.43 C ATOM 1122 CD2 PHE A 83 23.177 -12.352 11.651 1.00 4.42 C ATOM 1123 CE1 PHE A 83 21.741 -11.572 9.428 1.00 12.42 C ATOM 1124 CE2 PHE A 83 21.923 -11.791 11.802 1.00 43.42 C ATOM 1125 CZ PHE A 83 21.205 -11.399 10.689 1.00 33.02 C ATOM 0 H PHE A 83 27.493 -13.696 9.840 1.00 51.44 H new ATOM 0 HA PHE A 83 25.431 -12.513 8.203 1.00 22.02 H new ATOM 0 HB2 PHE A 83 24.979 -14.195 9.974 1.00 55.43 H new ATOM 0 HB3 PHE A 83 25.614 -13.099 11.186 1.00 55.43 H new ATOM 0 HD1 PHE A 83 23.410 -12.266 8.296 1.00 44.43 H new ATOM 0 HD2 PHE A 83 23.735 -12.655 12.525 1.00 4.42 H new ATOM 0 HE1 PHE A 83 21.181 -11.269 8.556 1.00 12.42 H new ATOM 0 HE2 PHE A 83 21.505 -11.659 12.789 1.00 43.42 H new ATOM 0 HZ PHE A 83 20.226 -10.958 10.805 1.00 33.02 H new ATOM 1135 N LEU A 84 27.327 -10.648 10.004 1.00 31.43 N ATOM 1136 CA LEU A 84 27.640 -9.275 10.384 1.00 63.13 C ATOM 1137 C LEU A 84 27.353 -8.314 9.235 1.00 13.40 C ATOM 1138 O LEU A 84 27.152 -7.117 9.448 1.00 61.52 O ATOM 1139 CB LEU A 84 29.107 -9.163 10.803 1.00 43.05 C ATOM 1140 CG LEU A 84 29.377 -8.414 12.108 1.00 43.21 C ATOM 1141 CD1 LEU A 84 29.150 -6.921 11.924 1.00 70.53 C ATOM 1142 CD2 LEU A 84 28.498 -8.955 13.225 1.00 35.23 C ATOM 0 H LEU A 84 28.091 -11.309 10.144 1.00 31.43 H new ATOM 0 HA LEU A 84 27.006 -9.004 11.228 1.00 63.13 H new ATOM 0 HB2 LEU A 84 29.516 -10.169 10.894 1.00 43.05 H new ATOM 0 HB3 LEU A 84 29.656 -8.667 10.003 1.00 43.05 H new ATOM 0 HG LEU A 84 30.420 -8.571 12.385 1.00 43.21 H new ATOM 0 HD11 LEU A 84 29.347 -6.405 12.863 1.00 70.53 H new ATOM 0 HD12 LEU A 84 29.823 -6.543 11.154 1.00 70.53 H new ATOM 0 HD13 LEU A 84 28.118 -6.744 11.622 1.00 70.53 H new ATOM 0 HD21 LEU A 84 28.704 -8.410 14.146 1.00 35.23 H new ATOM 0 HD22 LEU A 84 27.449 -8.830 12.956 1.00 35.23 H new ATOM 0 HD23 LEU A 84 28.710 -10.014 13.375 1.00 35.23 H new ATOM 1154 N CYS A 85 27.332 -8.845 8.017 1.00 11.41 N ATOM 1155 CA CYS A 85 27.067 -8.035 6.834 1.00 70.11 C ATOM 1156 C CYS A 85 25.599 -8.130 6.428 1.00 41.24 C ATOM 1157 O CYS A 85 25.003 -7.149 5.984 1.00 14.14 O ATOM 1158 CB CYS A 85 27.959 -8.483 5.674 1.00 55.31 C ATOM 1159 SG CYS A 85 29.675 -8.854 6.156 1.00 25.33 S ATOM 0 H CYS A 85 27.495 -9.833 7.823 1.00 11.41 H new ATOM 0 HA CYS A 85 27.292 -6.996 7.077 1.00 70.11 H new ATOM 0 HB2 CYS A 85 27.522 -9.370 5.215 1.00 55.31 H new ATOM 0 HB3 CYS A 85 27.967 -7.702 4.914 1.00 55.31 H new ATOM 1164 N ALA A 86 25.024 -9.318 6.582 1.00 14.33 N ATOM 1165 CA ALA A 86 23.626 -9.540 6.234 1.00 32.52 C ATOM 1166 C ALA A 86 22.705 -9.163 7.390 1.00 43.02 C ATOM 1167 O ALA A 86 21.493 -9.368 7.324 1.00 62.12 O ATOM 1168 CB ALA A 86 23.406 -10.992 5.835 1.00 64.14 C ATOM 0 H ALA A 86 25.504 -10.141 6.945 1.00 14.33 H new ATOM 0 HA ALA A 86 23.383 -8.900 5.386 1.00 32.52 H new ATOM 0 HB1 ALA A 86 22.358 -11.144 5.578 1.00 64.14 H new ATOM 0 HB2 ALA A 86 24.029 -11.231 4.973 1.00 64.14 H new ATOM 0 HB3 ALA A 86 23.673 -11.643 6.668 1.00 64.14 H new ATOM 1174 N VAL A 87 23.289 -8.611 8.449 1.00 54.31 N ATOM 1175 CA VAL A 87 22.520 -8.204 9.620 1.00 64.15 C ATOM 1176 C VAL A 87 22.427 -6.685 9.715 1.00 24.45 C ATOM 1177 O VAL A 87 21.398 -6.140 10.113 1.00 11.41 O ATOM 1178 CB VAL A 87 23.143 -8.752 10.917 1.00 32.34 C ATOM 1179 CG1 VAL A 87 24.503 -8.119 11.166 1.00 23.23 C ATOM 1180 CG2 VAL A 87 22.211 -8.515 12.096 1.00 2.43 C ATOM 0 H VAL A 87 24.291 -8.435 8.520 1.00 54.31 H new ATOM 0 HA VAL A 87 21.519 -8.619 9.503 1.00 64.15 H new ATOM 0 HB VAL A 87 23.285 -9.827 10.805 1.00 32.34 H new ATOM 0 HG11 VAL A 87 24.927 -8.519 12.087 1.00 23.23 H new ATOM 0 HG12 VAL A 87 25.168 -8.345 10.332 1.00 23.23 H new ATOM 0 HG13 VAL A 87 24.390 -7.039 11.258 1.00 23.23 H new ATOM 0 HG21 VAL A 87 22.667 -8.908 13.005 1.00 2.43 H new ATOM 0 HG22 VAL A 87 22.035 -7.445 12.212 1.00 2.43 H new ATOM 0 HG23 VAL A 87 21.262 -9.021 11.917 1.00 2.43 H new ATOM 1190 N PHE A 88 23.510 -6.007 9.348 1.00 34.40 N ATOM 1191 CA PHE A 88 23.551 -4.550 9.393 1.00 72.51 C ATOM 1192 C PHE A 88 23.603 -3.964 7.985 1.00 24.21 C ATOM 1193 O PHE A 88 23.108 -2.864 7.739 1.00 64.11 O ATOM 1194 CB PHE A 88 24.762 -4.078 10.200 1.00 51.02 C ATOM 1195 CG PHE A 88 24.897 -4.758 11.532 1.00 31.02 C ATOM 1196 CD1 PHE A 88 23.813 -4.852 12.390 1.00 11.41 C ATOM 1197 CD2 PHE A 88 26.108 -5.303 11.927 1.00 70.30 C ATOM 1198 CE1 PHE A 88 23.934 -5.477 13.617 1.00 75.12 C ATOM 1199 CE2 PHE A 88 26.234 -5.930 13.152 1.00 24.31 C ATOM 1200 CZ PHE A 88 25.146 -6.016 13.999 1.00 63.24 C ATOM 0 H PHE A 88 24.370 -6.443 9.016 1.00 34.40 H new ATOM 0 HA PHE A 88 22.641 -4.200 9.879 1.00 72.51 H new ATOM 0 HB2 PHE A 88 25.667 -4.253 9.618 1.00 51.02 H new ATOM 0 HB3 PHE A 88 24.687 -3.002 10.356 1.00 51.02 H new ATOM 0 HD1 PHE A 88 22.862 -4.432 12.097 1.00 11.41 H new ATOM 0 HD2 PHE A 88 26.963 -5.237 11.270 1.00 70.30 H new ATOM 0 HE1 PHE A 88 23.081 -5.544 14.276 1.00 75.12 H new ATOM 0 HE2 PHE A 88 27.183 -6.353 13.447 1.00 24.31 H new ATOM 0 HZ PHE A 88 25.243 -6.504 14.958 1.00 63.24 H new ATOM 1210 N LYS A 89 24.208 -4.707 7.064 1.00 52.22 N ATOM 1211 CA LYS A 89 24.326 -4.263 5.680 1.00 71.42 C ATOM 1212 C LYS A 89 23.470 -5.126 4.757 1.00 3.23 C ATOM 1213 O LYS A 89 23.968 -5.999 4.046 1.00 11.01 O ATOM 1214 CB LYS A 89 25.788 -4.312 5.230 1.00 31.11 C ATOM 1215 CG LYS A 89 26.768 -3.862 6.299 1.00 4.02 C ATOM 1216 CD LYS A 89 26.566 -2.400 6.662 1.00 72.41 C ATOM 1217 CE LYS A 89 27.356 -2.020 7.904 1.00 1.35 C ATOM 1218 NZ LYS A 89 28.772 -2.475 7.823 1.00 54.24 N ATOM 0 H LYS A 89 24.624 -5.619 7.251 1.00 52.22 H new ATOM 0 HA LYS A 89 23.969 -3.235 5.623 1.00 71.42 H new ATOM 0 HB2 LYS A 89 26.033 -5.331 4.930 1.00 31.11 H new ATOM 0 HB3 LYS A 89 25.910 -3.682 4.349 1.00 31.11 H new ATOM 0 HG2 LYS A 89 26.645 -4.479 7.189 1.00 4.02 H new ATOM 0 HG3 LYS A 89 27.788 -4.012 5.945 1.00 4.02 H new ATOM 0 HD2 LYS A 89 26.874 -1.771 5.827 1.00 72.41 H new ATOM 0 HD3 LYS A 89 25.506 -2.209 6.831 1.00 72.41 H new ATOM 0 HE2 LYS A 89 27.329 -0.938 8.034 1.00 1.35 H new ATOM 0 HE3 LYS A 89 26.884 -2.459 8.783 1.00 1.35 H new ATOM 0 HZ1 LYS A 89 29.390 -1.770 8.274 1.00 54.24 H new ATOM 0 HZ2 LYS A 89 28.872 -3.387 8.313 1.00 54.24 H new ATOM 0 HZ3 LYS A 89 29.044 -2.586 6.825 1.00 54.24 H new ATOM 1232 N PRO A 90 22.152 -4.876 4.766 1.00 25.33 N ATOM 1233 CA PRO A 90 21.201 -5.618 3.934 1.00 34.22 C ATOM 1234 C PRO A 90 21.351 -5.294 2.452 1.00 61.12 C ATOM 1235 O PRO A 90 21.667 -4.163 2.082 1.00 63.23 O ATOM 1236 CB PRO A 90 19.838 -5.148 4.449 1.00 51.22 C ATOM 1237 CG PRO A 90 20.096 -3.800 5.027 1.00 3.55 C ATOM 1238 CD PRO A 90 21.490 -3.850 5.589 1.00 22.22 C ATOM 0 HA PRO A 90 21.351 -6.695 4.005 1.00 34.22 H new ATOM 0 HB2 PRO A 90 19.106 -5.100 3.643 1.00 51.22 H new ATOM 0 HB3 PRO A 90 19.441 -5.831 5.200 1.00 51.22 H new ATOM 0 HG2 PRO A 90 20.010 -3.026 4.265 1.00 3.55 H new ATOM 0 HG3 PRO A 90 19.370 -3.563 5.805 1.00 3.55 H new ATOM 0 HD2 PRO A 90 21.991 -2.885 5.508 1.00 22.22 H new ATOM 0 HD3 PRO A 90 21.488 -4.121 6.645 1.00 22.22 H new ATOM 1246 N LYS A 91 21.122 -6.293 1.606 1.00 22.24 N ATOM 1247 CA LYS A 91 21.230 -6.115 0.163 1.00 4.03 C ATOM 1248 C LYS A 91 19.986 -5.432 -0.395 1.00 71.54 C ATOM 1249 O LYS A 91 19.145 -6.073 -1.026 1.00 55.04 O ATOM 1250 CB LYS A 91 21.436 -7.467 -0.524 1.00 52.43 C ATOM 1251 CG LYS A 91 21.566 -7.367 -2.034 1.00 71.44 C ATOM 1252 CD LYS A 91 22.224 -8.606 -2.620 1.00 13.40 C ATOM 1253 CE LYS A 91 21.711 -8.899 -4.022 1.00 5.41 C ATOM 1254 NZ LYS A 91 22.301 -10.148 -4.578 1.00 32.12 N ATOM 0 H LYS A 91 20.860 -7.235 1.896 1.00 22.24 H new ATOM 0 HA LYS A 91 22.092 -5.479 -0.037 1.00 4.03 H new ATOM 0 HB2 LYS A 91 22.333 -7.937 -0.121 1.00 52.43 H new ATOM 0 HB3 LYS A 91 20.597 -8.120 -0.282 1.00 52.43 H new ATOM 0 HG2 LYS A 91 20.579 -7.234 -2.477 1.00 71.44 H new ATOM 0 HG3 LYS A 91 22.153 -6.486 -2.292 1.00 71.44 H new ATOM 0 HD2 LYS A 91 23.305 -8.466 -2.649 1.00 13.40 H new ATOM 0 HD3 LYS A 91 22.030 -9.462 -1.974 1.00 13.40 H new ATOM 0 HE2 LYS A 91 20.625 -8.989 -4.000 1.00 5.41 H new ATOM 0 HE3 LYS A 91 21.948 -8.062 -4.678 1.00 5.41 H new ATOM 0 HZ1 LYS A 91 21.927 -10.313 -5.534 1.00 32.12 H new ATOM 0 HZ2 LYS A 91 23.336 -10.053 -4.623 1.00 32.12 H new ATOM 0 HZ3 LYS A 91 22.053 -10.951 -3.966 1.00 32.12 H new ATOM 1268 N CYS A 92 19.876 -4.129 -0.161 1.00 33.21 N ATOM 1269 CA CYS A 92 18.735 -3.359 -0.641 1.00 51.03 C ATOM 1270 C CYS A 92 18.933 -2.943 -2.096 1.00 3.10 C ATOM 1271 O CYS A 92 19.718 -2.043 -2.392 1.00 65.14 O ATOM 1272 CB CYS A 92 18.526 -2.120 0.231 1.00 11.32 C ATOM 1273 SG CYS A 92 17.245 -0.982 -0.388 1.00 41.21 S ATOM 0 H CYS A 92 20.564 -3.584 0.359 1.00 33.21 H new ATOM 0 HA CYS A 92 17.850 -3.992 -0.579 1.00 51.03 H new ATOM 0 HB2 CYS A 92 18.258 -2.439 1.238 1.00 11.32 H new ATOM 0 HB3 CYS A 92 19.470 -1.580 0.309 1.00 11.32 H new ATOM 1278 N GLU A 93 18.215 -3.605 -2.998 1.00 44.32 N ATOM 1279 CA GLU A 93 18.313 -3.304 -4.422 1.00 4.54 C ATOM 1280 C GLU A 93 16.945 -2.953 -4.999 1.00 70.30 C ATOM 1281 O GLU A 93 15.937 -2.972 -4.293 1.00 33.03 O ATOM 1282 CB GLU A 93 18.909 -4.493 -5.177 1.00 72.25 C ATOM 1283 CG GLU A 93 18.040 -5.739 -5.133 1.00 24.24 C ATOM 1284 CD GLU A 93 18.096 -6.536 -6.421 1.00 64.15 C ATOM 1285 OE1 GLU A 93 19.156 -7.133 -6.705 1.00 33.31 O ATOM 1286 OE2 GLU A 93 17.080 -6.562 -7.147 1.00 31.34 O ATOM 0 H GLU A 93 17.560 -4.352 -2.769 1.00 44.32 H new ATOM 0 HA GLU A 93 18.970 -2.442 -4.541 1.00 4.54 H new ATOM 0 HB2 GLU A 93 19.070 -4.209 -6.217 1.00 72.25 H new ATOM 0 HB3 GLU A 93 19.887 -4.727 -4.756 1.00 72.25 H new ATOM 0 HG2 GLU A 93 18.360 -6.371 -4.305 1.00 24.24 H new ATOM 0 HG3 GLU A 93 17.008 -5.451 -4.933 1.00 24.24 H new ATOM 1293 N LYS A 94 16.918 -2.633 -6.288 1.00 72.33 N ATOM 1294 CA LYS A 94 15.675 -2.279 -6.963 1.00 72.12 C ATOM 1295 C LYS A 94 15.161 -3.444 -7.803 1.00 52.13 C ATOM 1296 O LYS A 94 15.710 -3.746 -8.863 1.00 72.42 O ATOM 1297 CB LYS A 94 15.885 -1.050 -7.851 1.00 14.05 C ATOM 1298 CG LYS A 94 15.147 0.185 -7.363 1.00 51.02 C ATOM 1299 CD LYS A 94 15.259 1.330 -8.356 1.00 63.20 C ATOM 1300 CE LYS A 94 16.708 1.741 -8.571 1.00 71.32 C ATOM 1301 NZ LYS A 94 16.815 3.083 -9.207 1.00 0.12 N ATOM 0 H LYS A 94 17.743 -2.611 -6.887 1.00 72.33 H new ATOM 0 HA LYS A 94 14.931 -2.047 -6.201 1.00 72.12 H new ATOM 0 HB2 LYS A 94 16.951 -0.829 -7.905 1.00 14.05 H new ATOM 0 HB3 LYS A 94 15.556 -1.283 -8.864 1.00 14.05 H new ATOM 0 HG2 LYS A 94 14.096 -0.057 -7.203 1.00 51.02 H new ATOM 0 HG3 LYS A 94 15.553 0.496 -6.400 1.00 51.02 H new ATOM 0 HD2 LYS A 94 14.819 1.032 -9.308 1.00 63.20 H new ATOM 0 HD3 LYS A 94 14.687 2.184 -7.994 1.00 63.20 H new ATOM 0 HE2 LYS A 94 17.229 1.750 -7.614 1.00 71.32 H new ATOM 0 HE3 LYS A 94 17.206 1.001 -9.198 1.00 71.32 H new ATOM 0 HZ1 LYS A 94 17.818 3.327 -9.337 1.00 0.12 H new ATOM 0 HZ2 LYS A 94 16.340 3.068 -10.132 1.00 0.12 H new ATOM 0 HZ3 LYS A 94 16.362 3.793 -8.597 1.00 0.12 H new ATOM 1315 N ILE A 95 14.105 -4.092 -7.324 1.00 73.21 N ATOM 1316 CA ILE A 95 13.516 -5.222 -8.033 1.00 11.40 C ATOM 1317 C ILE A 95 12.440 -4.758 -9.008 1.00 54.35 C ATOM 1318 O ILE A 95 11.418 -4.204 -8.604 1.00 60.30 O ATOM 1319 CB ILE A 95 12.902 -6.242 -7.056 1.00 1.52 C ATOM 1320 CG1 ILE A 95 13.976 -6.787 -6.113 1.00 23.33 C ATOM 1321 CG2 ILE A 95 12.237 -7.375 -7.822 1.00 53.01 C ATOM 1322 CD1 ILE A 95 13.440 -7.196 -4.759 1.00 24.15 C ATOM 0 H ILE A 95 13.639 -3.854 -6.448 1.00 73.21 H new ATOM 0 HA ILE A 95 14.323 -5.702 -8.587 1.00 11.40 H new ATOM 0 HB ILE A 95 12.142 -5.739 -6.458 1.00 1.52 H new ATOM 0 HG12 ILE A 95 14.455 -7.647 -6.580 1.00 23.33 H new ATOM 0 HG13 ILE A 95 14.746 -6.028 -5.976 1.00 23.33 H new ATOM 0 HG21 ILE A 95 11.808 -8.088 -7.118 1.00 53.01 H new ATOM 0 HG22 ILE A 95 11.448 -6.971 -8.456 1.00 53.01 H new ATOM 0 HG23 ILE A 95 12.978 -7.879 -8.442 1.00 53.01 H new ATOM 0 HD11 ILE A 95 14.257 -7.573 -4.143 1.00 24.15 H new ATOM 0 HD12 ILE A 95 12.986 -6.333 -4.272 1.00 24.15 H new ATOM 0 HD13 ILE A 95 12.691 -7.977 -4.885 1.00 24.15 H new ATOM 1334 N ASN A 96 12.676 -4.989 -10.296 1.00 32.23 N ATOM 1335 CA ASN A 96 11.726 -4.596 -11.330 1.00 34.10 C ATOM 1336 C ASN A 96 11.552 -3.081 -11.362 1.00 10.35 C ATOM 1337 O ASN A 96 10.554 -2.570 -11.869 1.00 24.00 O ATOM 1338 CB ASN A 96 10.373 -5.271 -11.092 1.00 42.22 C ATOM 1339 CG ASN A 96 9.434 -5.114 -12.272 1.00 74.22 C ATOM 1340 OD1 ASN A 96 9.619 -5.742 -13.315 1.00 35.11 O ATOM 1341 ND2 ASN A 96 8.419 -4.273 -12.112 1.00 54.15 N ATOM 0 H ASN A 96 13.517 -5.446 -10.648 1.00 32.23 H new ATOM 0 HA ASN A 96 12.122 -4.919 -12.293 1.00 34.10 H new ATOM 0 HB2 ASN A 96 10.529 -6.331 -10.894 1.00 42.22 H new ATOM 0 HB3 ASN A 96 9.909 -4.845 -10.202 1.00 42.22 H new ATOM 0 HD21 ASN A 96 7.754 -4.126 -12.871 1.00 54.15 H new ATOM 0 HD22 ASN A 96 8.305 -3.774 -11.230 1.00 54.15 H new ATOM 1348 N GLY A 97 12.532 -2.366 -10.815 1.00 73.54 N ATOM 1349 CA GLY A 97 12.469 -0.917 -10.792 1.00 15.23 C ATOM 1350 C GLY A 97 11.853 -0.384 -9.513 1.00 70.10 C ATOM 1351 O GLY A 97 11.467 0.782 -9.442 1.00 73.02 O ATOM 0 H GLY A 97 13.368 -2.765 -10.388 1.00 73.54 H new ATOM 0 HA2 GLY A 97 13.474 -0.511 -10.904 1.00 15.23 H new ATOM 0 HA3 GLY A 97 11.887 -0.568 -11.645 1.00 15.23 H new ATOM 1355 N GLU A 98 11.760 -1.241 -8.501 1.00 22.01 N ATOM 1356 CA GLU A 98 11.184 -0.849 -7.220 1.00 24.43 C ATOM 1357 C GLU A 98 12.161 -1.121 -6.079 1.00 13.22 C ATOM 1358 O GLU A 98 12.587 -2.257 -5.869 1.00 14.31 O ATOM 1359 CB GLU A 98 9.874 -1.600 -6.974 1.00 11.04 C ATOM 1360 CG GLU A 98 8.854 -1.425 -8.086 1.00 50.12 C ATOM 1361 CD GLU A 98 7.603 -2.254 -7.867 1.00 4.11 C ATOM 1362 OE1 GLU A 98 7.517 -2.933 -6.823 1.00 34.22 O ATOM 1363 OE2 GLU A 98 6.711 -2.223 -8.740 1.00 40.42 O ATOM 0 H GLU A 98 12.076 -2.210 -8.543 1.00 22.01 H new ATOM 0 HA GLU A 98 10.980 0.221 -7.254 1.00 24.43 H new ATOM 0 HB2 GLU A 98 10.091 -2.662 -6.855 1.00 11.04 H new ATOM 0 HB3 GLU A 98 9.439 -1.256 -6.036 1.00 11.04 H new ATOM 0 HG2 GLU A 98 8.580 -0.373 -8.160 1.00 50.12 H new ATOM 0 HG3 GLU A 98 9.308 -1.703 -9.037 1.00 50.12 H new ATOM 1370 N ASP A 99 12.511 -0.070 -5.346 1.00 1.15 N ATOM 1371 CA ASP A 99 13.437 -0.194 -4.225 1.00 53.44 C ATOM 1372 C ASP A 99 12.902 -1.172 -3.184 1.00 62.13 C ATOM 1373 O ASP A 99 11.892 -0.910 -2.533 1.00 13.52 O ATOM 1374 CB ASP A 99 13.678 1.173 -3.582 1.00 62.04 C ATOM 1375 CG ASP A 99 13.857 2.273 -4.610 1.00 72.03 C ATOM 1376 OD1 ASP A 99 12.839 2.741 -5.162 1.00 15.32 O ATOM 1377 OD2 ASP A 99 15.015 2.666 -4.863 1.00 14.33 O ATOM 0 H ASP A 99 12.168 0.877 -5.507 1.00 1.15 H new ATOM 0 HA ASP A 99 14.382 -0.579 -4.607 1.00 53.44 H new ATOM 0 HB2 ASP A 99 12.837 1.419 -2.933 1.00 62.04 H new ATOM 0 HB3 ASP A 99 14.565 1.123 -2.950 1.00 62.04 H new ATOM 1382 N MET A 100 13.587 -2.301 -3.034 1.00 71.34 N ATOM 1383 CA MET A 100 13.180 -3.319 -2.072 1.00 45.03 C ATOM 1384 C MET A 100 14.374 -3.802 -1.255 1.00 3.44 C ATOM 1385 O MET A 100 15.526 -3.595 -1.637 1.00 50.14 O ATOM 1386 CB MET A 100 12.529 -4.501 -2.793 1.00 24.34 C ATOM 1387 CG MET A 100 11.373 -4.101 -3.695 1.00 65.21 C ATOM 1388 SD MET A 100 9.830 -4.921 -3.252 1.00 21.32 S ATOM 1389 CE MET A 100 9.928 -6.397 -4.262 1.00 43.24 C ATOM 0 H MET A 100 14.426 -2.534 -3.566 1.00 71.34 H new ATOM 0 HA MET A 100 12.454 -2.872 -1.393 1.00 45.03 H new ATOM 0 HB2 MET A 100 13.284 -5.013 -3.390 1.00 24.34 H new ATOM 0 HB3 MET A 100 12.170 -5.215 -2.052 1.00 24.34 H new ATOM 0 HG2 MET A 100 11.234 -3.021 -3.643 1.00 65.21 H new ATOM 0 HG3 MET A 100 11.624 -4.341 -4.728 1.00 65.21 H new ATOM 0 HE1 MET A 100 8.991 -6.531 -4.802 1.00 43.24 H new ATOM 0 HE2 MET A 100 10.746 -6.296 -4.975 1.00 43.24 H new ATOM 0 HE3 MET A 100 10.107 -7.263 -3.625 1.00 43.24 H new ATOM 1399 N VAL A 101 14.092 -4.445 -0.126 1.00 71.44 N ATOM 1400 CA VAL A 101 15.143 -4.958 0.745 1.00 74.11 C ATOM 1401 C VAL A 101 15.213 -6.480 0.684 1.00 2.31 C ATOM 1402 O VAL A 101 14.221 -7.146 0.389 1.00 31.40 O ATOM 1403 CB VAL A 101 14.922 -4.523 2.206 1.00 70.31 C ATOM 1404 CG1 VAL A 101 14.993 -3.009 2.329 1.00 13.11 C ATOM 1405 CG2 VAL A 101 13.590 -5.047 2.722 1.00 41.22 C ATOM 0 H VAL A 101 13.144 -4.623 0.207 1.00 71.44 H new ATOM 0 HA VAL A 101 16.084 -4.540 0.387 1.00 74.11 H new ATOM 0 HB VAL A 101 15.716 -4.950 2.818 1.00 70.31 H new ATOM 0 HG11 VAL A 101 14.835 -2.721 3.368 1.00 13.11 H new ATOM 0 HG12 VAL A 101 15.973 -2.663 2.002 1.00 13.11 H new ATOM 0 HG13 VAL A 101 14.222 -2.557 1.705 1.00 13.11 H new ATOM 0 HG21 VAL A 101 13.450 -4.730 3.756 1.00 41.22 H new ATOM 0 HG22 VAL A 101 12.781 -4.651 2.108 1.00 41.22 H new ATOM 0 HG23 VAL A 101 13.583 -6.136 2.672 1.00 41.22 H new ATOM 1415 N TYR A 102 16.392 -7.023 0.965 1.00 20.35 N ATOM 1416 CA TYR A 102 16.593 -8.467 0.941 1.00 23.21 C ATOM 1417 C TYR A 102 16.938 -8.993 2.331 1.00 13.13 C ATOM 1418 O TYR A 102 18.083 -8.904 2.775 1.00 22.54 O ATOM 1419 CB TYR A 102 17.705 -8.832 -0.044 1.00 42.31 C ATOM 1420 CG TYR A 102 17.210 -9.080 -1.451 1.00 62.10 C ATOM 1421 CD1 TYR A 102 16.105 -9.888 -1.688 1.00 23.45 C ATOM 1422 CD2 TYR A 102 17.847 -8.505 -2.544 1.00 23.20 C ATOM 1423 CE1 TYR A 102 15.650 -10.119 -2.971 1.00 43.43 C ATOM 1424 CE2 TYR A 102 17.398 -8.729 -3.831 1.00 43.43 C ATOM 1425 CZ TYR A 102 16.300 -9.536 -4.040 1.00 31.42 C ATOM 1426 OH TYR A 102 15.849 -9.762 -5.320 1.00 71.01 O ATOM 0 H TYR A 102 17.223 -6.485 1.212 1.00 20.35 H new ATOM 0 HA TYR A 102 15.662 -8.932 0.617 1.00 23.21 H new ATOM 0 HB2 TYR A 102 18.440 -8.028 -0.063 1.00 42.31 H new ATOM 0 HB3 TYR A 102 18.218 -9.725 0.314 1.00 42.31 H new ATOM 0 HD1 TYR A 102 15.593 -10.344 -0.854 1.00 23.45 H new ATOM 0 HD2 TYR A 102 18.708 -7.872 -2.385 1.00 23.20 H new ATOM 0 HE1 TYR A 102 14.791 -10.752 -3.137 1.00 43.43 H new ATOM 0 HE2 TYR A 102 17.905 -8.274 -4.669 1.00 43.43 H new ATOM 0 HH TYR A 102 16.416 -9.278 -5.957 1.00 71.01 H new ATOM 1436 N LEU A 103 15.938 -9.541 3.014 1.00 42.25 N ATOM 1437 CA LEU A 103 16.133 -10.083 4.354 1.00 43.51 C ATOM 1438 C LEU A 103 17.125 -11.241 4.334 1.00 71.41 C ATOM 1439 O LEU A 103 17.365 -11.867 3.301 1.00 22.32 O ATOM 1440 CB LEU A 103 14.798 -10.549 4.936 1.00 32.01 C ATOM 1441 CG LEU A 103 13.900 -9.456 5.516 1.00 53.43 C ATOM 1442 CD1 LEU A 103 12.962 -8.913 4.448 1.00 24.10 C ATOM 1443 CD2 LEU A 103 13.109 -9.988 6.702 1.00 71.02 C ATOM 0 H LEU A 103 14.984 -9.621 2.661 1.00 42.25 H new ATOM 0 HA LEU A 103 16.540 -9.292 4.984 1.00 43.51 H new ATOM 0 HB2 LEU A 103 14.245 -11.068 4.153 1.00 32.01 H new ATOM 0 HB3 LEU A 103 15.001 -11.278 5.720 1.00 32.01 H new ATOM 0 HG LEU A 103 14.533 -8.640 5.864 1.00 53.43 H new ATOM 0 HD11 LEU A 103 12.331 -8.136 4.879 1.00 24.10 H new ATOM 0 HD12 LEU A 103 13.547 -8.493 3.630 1.00 24.10 H new ATOM 0 HD13 LEU A 103 12.336 -9.721 4.069 1.00 24.10 H new ATOM 0 HD21 LEU A 103 12.476 -9.196 7.102 1.00 71.02 H new ATOM 0 HD22 LEU A 103 12.486 -10.822 6.379 1.00 71.02 H new ATOM 0 HD23 LEU A 103 13.798 -10.327 7.476 1.00 71.02 H new ATOM 1455 N PRO A 104 17.714 -11.537 5.502 1.00 12.12 N ATOM 1456 CA PRO A 104 18.687 -12.624 5.646 1.00 53.03 C ATOM 1457 C PRO A 104 18.043 -14.000 5.510 1.00 11.42 C ATOM 1458 O PRO A 104 16.873 -14.184 5.845 1.00 53.51 O ATOM 1459 CB PRO A 104 19.233 -12.426 7.062 1.00 61.42 C ATOM 1460 CG PRO A 104 18.147 -11.712 7.791 1.00 64.54 C ATOM 1461 CD PRO A 104 17.475 -10.833 6.773 1.00 12.23 C ATOM 0 HA PRO A 104 19.453 -12.591 4.871 1.00 53.03 H new ATOM 0 HB2 PRO A 104 19.465 -13.381 7.534 1.00 61.42 H new ATOM 0 HB3 PRO A 104 20.154 -11.843 7.053 1.00 61.42 H new ATOM 0 HG2 PRO A 104 17.439 -12.418 8.226 1.00 64.54 H new ATOM 0 HG3 PRO A 104 18.552 -11.120 8.612 1.00 64.54 H new ATOM 0 HD2 PRO A 104 16.410 -10.724 6.977 1.00 12.23 H new ATOM 0 HD3 PRO A 104 17.902 -9.830 6.763 1.00 12.23 H new ATOM 1469 N SER A 105 18.815 -14.963 5.018 1.00 72.31 N ATOM 1470 CA SER A 105 18.318 -16.322 4.835 1.00 22.12 C ATOM 1471 C SER A 105 18.476 -17.135 6.116 1.00 24.15 C ATOM 1472 O SER A 105 19.369 -16.875 6.924 1.00 15.21 O ATOM 1473 CB SER A 105 19.060 -17.009 3.687 1.00 3.11 C ATOM 1474 OG SER A 105 18.548 -16.598 2.431 1.00 25.31 O ATOM 0 H SER A 105 19.787 -14.828 4.739 1.00 72.31 H new ATOM 0 HA SER A 105 17.257 -16.265 4.590 1.00 22.12 H new ATOM 0 HB2 SER A 105 20.123 -16.774 3.745 1.00 3.11 H new ATOM 0 HB3 SER A 105 18.967 -18.091 3.785 1.00 3.11 H new ATOM 0 HG SER A 105 19.040 -17.050 1.714 1.00 25.31 H new ATOM 1480 N TYR A 106 17.604 -18.121 6.295 1.00 0.34 N ATOM 1481 CA TYR A 106 17.644 -18.971 7.479 1.00 30.31 C ATOM 1482 C TYR A 106 19.045 -19.535 7.698 1.00 53.21 C ATOM 1483 O TYR A 106 19.465 -19.758 8.833 1.00 73.43 O ATOM 1484 CB TYR A 106 16.637 -20.115 7.345 1.00 22.02 C ATOM 1485 CG TYR A 106 17.094 -21.218 6.418 1.00 61.41 C ATOM 1486 CD1 TYR A 106 17.332 -20.968 5.072 1.00 22.12 C ATOM 1487 CD2 TYR A 106 17.289 -22.512 6.888 1.00 15.51 C ATOM 1488 CE1 TYR A 106 17.749 -21.974 4.221 1.00 11.55 C ATOM 1489 CE2 TYR A 106 17.707 -23.523 6.045 1.00 54.22 C ATOM 1490 CZ TYR A 106 17.935 -23.249 4.712 1.00 11.04 C ATOM 1491 OH TYR A 106 18.351 -24.253 3.868 1.00 3.15 O ATOM 0 H TYR A 106 16.861 -18.351 5.635 1.00 0.34 H new ATOM 0 HA TYR A 106 17.379 -18.361 8.342 1.00 30.31 H new ATOM 0 HB2 TYR A 106 16.446 -20.537 8.332 1.00 22.02 H new ATOM 0 HB3 TYR A 106 15.691 -19.714 6.981 1.00 22.02 H new ATOM 0 HD1 TYR A 106 17.189 -19.970 4.684 1.00 22.12 H new ATOM 0 HD2 TYR A 106 17.110 -22.730 7.931 1.00 15.51 H new ATOM 0 HE1 TYR A 106 17.928 -21.763 3.177 1.00 11.55 H new ATOM 0 HE2 TYR A 106 17.855 -24.522 6.427 1.00 54.22 H new ATOM 0 HH TYR A 106 18.435 -25.090 4.371 1.00 3.15 H new ATOM 1501 N GLU A 107 19.762 -19.761 6.602 1.00 64.20 N ATOM 1502 CA GLU A 107 21.116 -20.299 6.674 1.00 51.24 C ATOM 1503 C GLU A 107 22.053 -19.321 7.377 1.00 42.04 C ATOM 1504 O GLU A 107 22.698 -19.666 8.366 1.00 2.01 O ATOM 1505 CB GLU A 107 21.641 -20.606 5.270 1.00 64.22 C ATOM 1506 CG GLU A 107 21.549 -22.075 4.894 1.00 62.44 C ATOM 1507 CD GLU A 107 22.886 -22.654 4.471 1.00 75.31 C ATOM 1508 OE1 GLU A 107 23.635 -21.957 3.756 1.00 63.30 O ATOM 1509 OE2 GLU A 107 23.181 -23.805 4.856 1.00 62.11 O ATOM 0 H GLU A 107 19.429 -19.580 5.655 1.00 64.20 H new ATOM 0 HA GLU A 107 21.083 -21.223 7.252 1.00 51.24 H new ATOM 0 HB2 GLU A 107 21.079 -20.018 4.544 1.00 64.22 H new ATOM 0 HB3 GLU A 107 22.681 -20.287 5.202 1.00 64.22 H new ATOM 0 HG2 GLU A 107 21.165 -22.640 5.743 1.00 62.44 H new ATOM 0 HG3 GLU A 107 20.832 -22.194 4.081 1.00 62.44 H new ATOM 1516 N MET A 108 22.123 -18.100 6.857 1.00 53.21 N ATOM 1517 CA MET A 108 22.980 -17.072 7.435 1.00 43.53 C ATOM 1518 C MET A 108 22.725 -16.929 8.932 1.00 50.22 C ATOM 1519 O MET A 108 23.658 -16.761 9.718 1.00 51.02 O ATOM 1520 CB MET A 108 22.747 -15.731 6.736 1.00 43.24 C ATOM 1521 CG MET A 108 23.688 -15.483 5.567 1.00 12.15 C ATOM 1522 SD MET A 108 25.365 -15.087 6.098 1.00 10.01 S ATOM 1523 CE MET A 108 25.611 -13.507 5.291 1.00 63.22 C ATOM 0 H MET A 108 21.597 -17.799 6.037 1.00 53.21 H new ATOM 0 HA MET A 108 24.017 -17.375 7.289 1.00 43.53 H new ATOM 0 HB2 MET A 108 21.718 -15.691 6.378 1.00 43.24 H new ATOM 0 HB3 MET A 108 22.863 -14.927 7.463 1.00 43.24 H new ATOM 0 HG2 MET A 108 23.712 -16.368 4.931 1.00 12.15 H new ATOM 0 HG3 MET A 108 23.300 -14.665 4.961 1.00 12.15 H new ATOM 0 HE1 MET A 108 26.602 -13.480 4.838 1.00 63.22 H new ATOM 0 HE2 MET A 108 24.855 -13.372 4.518 1.00 63.22 H new ATOM 0 HE3 MET A 108 25.526 -12.706 6.025 1.00 63.22 H new ATOM 1533 N CYS A 109 21.456 -16.996 9.320 1.00 31.11 N ATOM 1534 CA CYS A 109 21.077 -16.874 10.723 1.00 43.44 C ATOM 1535 C CYS A 109 21.300 -18.189 11.463 1.00 74.41 C ATOM 1536 O CYS A 109 21.452 -18.208 12.684 1.00 35.24 O ATOM 1537 CB CYS A 109 19.612 -16.450 10.842 1.00 41.22 C ATOM 1538 SG CYS A 109 19.214 -15.580 12.392 1.00 54.42 S ATOM 0 H CYS A 109 20.672 -17.134 8.682 1.00 31.11 H new ATOM 0 HA CYS A 109 21.707 -16.110 11.179 1.00 43.44 H new ATOM 0 HB2 CYS A 109 19.362 -15.804 10.001 1.00 41.22 H new ATOM 0 HB3 CYS A 109 18.981 -17.335 10.762 1.00 41.22 H new ATOM 1543 N ARG A 110 21.317 -19.287 10.714 1.00 24.43 N ATOM 1544 CA ARG A 110 21.520 -20.607 11.299 1.00 60.41 C ATOM 1545 C ARG A 110 22.974 -20.798 11.719 1.00 24.53 C ATOM 1546 O ARG A 110 23.275 -21.601 12.603 1.00 32.51 O ATOM 1547 CB ARG A 110 21.119 -21.697 10.303 1.00 54.12 C ATOM 1548 CG ARG A 110 19.772 -22.334 10.607 1.00 44.24 C ATOM 1549 CD ARG A 110 19.859 -23.281 11.793 1.00 2.55 C ATOM 1550 NE ARG A 110 18.717 -23.138 12.692 1.00 73.01 N ATOM 1551 CZ ARG A 110 17.527 -23.682 12.460 1.00 1.30 C ATOM 1552 NH1 ARG A 110 17.325 -24.401 11.364 1.00 3.35 N ATOM 1553 NH2 ARG A 110 16.536 -23.507 13.325 1.00 24.13 N ATOM 0 H ARG A 110 21.193 -19.289 9.702 1.00 24.43 H new ATOM 0 HA ARG A 110 20.890 -20.684 12.185 1.00 60.41 H new ATOM 0 HB2 ARG A 110 21.091 -21.269 9.301 1.00 54.12 H new ATOM 0 HB3 ARG A 110 21.885 -22.472 10.298 1.00 54.12 H new ATOM 0 HG2 ARG A 110 19.039 -21.555 10.815 1.00 44.24 H new ATOM 0 HG3 ARG A 110 19.419 -22.878 9.731 1.00 44.24 H new ATOM 0 HD2 ARG A 110 19.911 -24.309 11.433 1.00 2.55 H new ATOM 0 HD3 ARG A 110 20.780 -23.089 12.343 1.00 2.55 H new ATOM 0 HE ARG A 110 18.839 -22.591 13.544 1.00 73.01 H new ATOM 0 HH11 ARG A 110 18.084 -24.538 10.697 1.00 3.35 H new ATOM 0 HH12 ARG A 110 16.411 -24.817 11.189 1.00 3.35 H new ATOM 0 HH21 ARG A 110 16.687 -22.954 14.169 1.00 24.13 H new ATOM 0 HH22 ARG A 110 15.623 -23.925 13.146 1.00 24.13 H new ATOM 1567 N ILE A 111 23.872 -20.056 11.080 1.00 70.11 N ATOM 1568 CA ILE A 111 25.294 -20.144 11.388 1.00 11.31 C ATOM 1569 C ILE A 111 25.546 -19.954 12.880 1.00 52.40 C ATOM 1570 O ILE A 111 26.547 -20.428 13.418 1.00 71.10 O ATOM 1571 CB ILE A 111 26.105 -19.095 10.604 1.00 24.32 C ATOM 1572 CG1 ILE A 111 25.826 -19.219 9.105 1.00 64.21 C ATOM 1573 CG2 ILE A 111 27.592 -19.256 10.887 1.00 74.20 C ATOM 1574 CD1 ILE A 111 26.130 -20.591 8.545 1.00 22.21 C ATOM 0 H ILE A 111 23.640 -19.387 10.346 1.00 70.11 H new ATOM 0 HA ILE A 111 25.621 -21.141 11.091 1.00 11.31 H new ATOM 0 HB ILE A 111 25.798 -18.101 10.930 1.00 24.32 H new ATOM 0 HG12 ILE A 111 24.778 -18.983 8.918 1.00 64.21 H new ATOM 0 HG13 ILE A 111 26.420 -18.478 8.571 1.00 64.21 H new ATOM 0 HG21 ILE A 111 28.152 -18.508 10.326 1.00 74.20 H new ATOM 0 HG22 ILE A 111 27.776 -19.123 11.953 1.00 74.20 H new ATOM 0 HG23 ILE A 111 27.914 -20.252 10.585 1.00 74.20 H new ATOM 0 HD11 ILE A 111 25.909 -20.606 7.478 1.00 22.21 H new ATOM 0 HD12 ILE A 111 27.184 -20.822 8.700 1.00 22.21 H new ATOM 0 HD13 ILE A 111 25.517 -21.335 9.053 1.00 22.21 H new ATOM 1586 N THR A 112 24.629 -19.257 13.545 1.00 25.14 N ATOM 1587 CA THR A 112 24.751 -19.004 14.976 1.00 61.54 C ATOM 1588 C THR A 112 24.002 -20.056 15.785 1.00 31.44 C ATOM 1589 O THR A 112 23.663 -19.833 16.947 1.00 22.43 O ATOM 1590 CB THR A 112 24.215 -17.609 15.347 1.00 30.11 C ATOM 1591 OG1 THR A 112 22.784 -17.627 15.379 1.00 55.31 O ATOM 1592 CG2 THR A 112 24.692 -16.563 14.351 1.00 23.10 C ATOM 0 H THR A 112 23.794 -18.858 13.116 1.00 25.14 H new ATOM 0 HA THR A 112 25.813 -19.052 15.217 1.00 61.54 H new ATOM 0 HB THR A 112 24.597 -17.348 16.334 1.00 30.11 H new ATOM 0 HG1 THR A 112 22.439 -17.817 14.482 1.00 55.31 H new ATOM 0 HG21 THR A 112 24.301 -15.586 14.634 1.00 23.10 H new ATOM 0 HG22 THR A 112 25.782 -16.531 14.351 1.00 23.10 H new ATOM 0 HG23 THR A 112 24.336 -16.821 13.354 1.00 23.10 H new ATOM 1600 N MET A 113 23.747 -21.203 15.165 1.00 71.54 N ATOM 1601 CA MET A 113 23.039 -22.291 15.830 1.00 72.12 C ATOM 1602 C MET A 113 23.987 -23.097 16.712 1.00 34.23 C ATOM 1603 O MET A 113 23.598 -23.583 17.774 1.00 55.40 O ATOM 1604 CB MET A 113 22.382 -23.208 14.796 1.00 12.13 C ATOM 1605 CG MET A 113 23.365 -24.118 14.078 1.00 5.34 C ATOM 1606 SD MET A 113 22.555 -25.253 12.936 1.00 20.32 S ATOM 1607 CE MET A 113 23.126 -24.616 11.363 1.00 41.32 C ATOM 0 H MET A 113 24.020 -21.404 14.203 1.00 71.54 H new ATOM 0 HA MET A 113 22.265 -21.855 16.462 1.00 72.12 H new ATOM 0 HB2 MET A 113 21.629 -23.820 15.292 1.00 12.13 H new ATOM 0 HB3 MET A 113 21.861 -22.596 14.059 1.00 12.13 H new ATOM 0 HG2 MET A 113 24.084 -23.509 13.530 1.00 5.34 H new ATOM 0 HG3 MET A 113 23.928 -24.691 14.815 1.00 5.34 H new ATOM 0 HE1 MET A 113 22.300 -24.611 10.651 1.00 41.32 H new ATOM 0 HE2 MET A 113 23.498 -23.600 11.495 1.00 41.32 H new ATOM 0 HE3 MET A 113 23.928 -25.249 10.984 1.00 41.32 H new ATOM 1617 N GLU A 114 25.231 -23.235 16.265 1.00 31.42 N ATOM 1618 CA GLU A 114 26.233 -23.984 17.015 1.00 35.12 C ATOM 1619 C GLU A 114 26.406 -23.407 18.417 1.00 31.43 C ATOM 1620 O GLU A 114 26.154 -24.070 19.424 1.00 63.10 O ATOM 1621 CB GLU A 114 27.572 -23.968 16.276 1.00 23.41 C ATOM 1622 CG GLU A 114 27.922 -25.294 15.621 1.00 34.10 C ATOM 1623 CD GLU A 114 27.271 -25.463 14.262 1.00 54.30 C ATOM 1624 OE1 GLU A 114 26.163 -24.922 14.063 1.00 50.22 O ATOM 1625 OE2 GLU A 114 27.870 -26.136 13.397 1.00 12.13 O ATOM 0 H GLU A 114 25.569 -22.838 15.388 1.00 31.42 H new ATOM 0 HA GLU A 114 25.888 -25.014 17.105 1.00 35.12 H new ATOM 0 HB2 GLU A 114 27.547 -23.191 15.512 1.00 23.41 H new ATOM 0 HB3 GLU A 114 28.362 -23.700 16.978 1.00 23.41 H new ATOM 0 HG2 GLU A 114 29.004 -25.367 15.513 1.00 34.10 H new ATOM 0 HG3 GLU A 114 27.611 -26.110 16.273 1.00 34.10 H new ATOM 1632 N PRO A 115 26.847 -22.143 18.486 1.00 52.40 N ATOM 1633 CA PRO A 115 27.064 -21.448 19.758 1.00 1.05 C ATOM 1634 C PRO A 115 25.757 -21.135 20.479 1.00 51.25 C ATOM 1635 O PRO A 115 25.292 -21.915 21.311 1.00 43.43 O ATOM 1636 CB PRO A 115 27.768 -20.154 19.341 1.00 73.32 C ATOM 1637 CG PRO A 115 27.338 -19.927 17.932 1.00 25.34 C ATOM 1638 CD PRO A 115 27.167 -21.293 17.327 1.00 52.13 C ATOM 0 HA PRO A 115 27.637 -22.054 20.460 1.00 1.05 H new ATOM 0 HB2 PRO A 115 27.479 -19.321 19.982 1.00 73.32 H new ATOM 0 HB3 PRO A 115 28.851 -20.251 19.414 1.00 73.32 H new ATOM 0 HG2 PRO A 115 26.406 -19.364 17.894 1.00 25.34 H new ATOM 0 HG3 PRO A 115 28.082 -19.348 17.385 1.00 25.34 H new ATOM 0 HD2 PRO A 115 26.368 -21.307 16.586 1.00 52.13 H new ATOM 0 HD3 PRO A 115 28.075 -21.626 16.823 1.00 52.13 H new ATOM 1646 N CYS A 116 25.167 -19.989 20.153 1.00 23.32 N ATOM 1647 CA CYS A 116 23.913 -19.572 20.769 1.00 62.44 C ATOM 1648 C CYS A 116 22.746 -20.400 20.239 1.00 32.41 C ATOM 1649 O CYS A 116 21.973 -19.937 19.400 1.00 11.04 O ATOM 1650 CB CYS A 116 23.660 -18.087 20.504 1.00 3.25 C ATOM 1651 SG CYS A 116 25.027 -16.997 21.018 1.00 31.20 S ATOM 0 H CYS A 116 25.538 -19.333 19.466 1.00 23.32 H new ATOM 0 HA CYS A 116 23.993 -19.734 21.844 1.00 62.44 H new ATOM 0 HB2 CYS A 116 23.477 -17.945 19.439 1.00 3.25 H new ATOM 0 HB3 CYS A 116 22.752 -17.785 21.027 1.00 3.25 H new ATOM 1656 N ARG A 117 22.625 -21.627 20.735 1.00 32.32 N ATOM 1657 CA ARG A 117 21.553 -22.520 20.312 1.00 70.32 C ATOM 1658 C ARG A 117 20.267 -22.227 21.078 1.00 35.23 C ATOM 1659 O ARG A 117 19.167 -22.371 20.543 1.00 41.44 O ATOM 1660 CB ARG A 117 21.963 -23.979 20.521 1.00 20.24 C ATOM 1661 CG ARG A 117 20.790 -24.945 20.536 1.00 31.51 C ATOM 1662 CD ARG A 117 21.257 -26.386 20.672 1.00 73.44 C ATOM 1663 NE ARG A 117 20.141 -27.328 20.643 1.00 71.22 N ATOM 1664 CZ ARG A 117 20.267 -28.625 20.900 1.00 63.34 C ATOM 1665 NH1 ARG A 117 21.454 -29.132 21.203 1.00 4.22 N ATOM 1666 NH2 ARG A 117 19.205 -29.419 20.854 1.00 54.35 N ATOM 0 H ARG A 117 23.256 -22.025 21.430 1.00 32.32 H new ATOM 0 HA ARG A 117 21.370 -22.350 19.251 1.00 70.32 H new ATOM 0 HB2 ARG A 117 22.653 -24.271 19.729 1.00 20.24 H new ATOM 0 HB3 ARG A 117 22.505 -24.064 21.463 1.00 20.24 H new ATOM 0 HG2 ARG A 117 20.124 -24.698 21.363 1.00 31.51 H new ATOM 0 HG3 ARG A 117 20.213 -24.833 19.618 1.00 31.51 H new ATOM 0 HD2 ARG A 117 21.950 -26.620 19.864 1.00 73.44 H new ATOM 0 HD3 ARG A 117 21.806 -26.503 21.607 1.00 73.44 H new ATOM 0 HE ARG A 117 19.214 -26.970 20.413 1.00 71.22 H new ATOM 0 HH11 ARG A 117 22.273 -28.526 21.239 1.00 4.22 H new ATOM 0 HH12 ARG A 117 21.548 -30.128 21.400 1.00 4.22 H new ATOM 0 HH21 ARG A 117 18.290 -29.034 20.621 1.00 54.35 H new ATOM 0 HH22 ARG A 117 19.304 -30.415 21.052 1.00 54.35 H new ATOM 1680 N ILE A 118 20.412 -21.817 22.334 1.00 63.14 N ATOM 1681 CA ILE A 118 19.262 -21.504 23.173 1.00 45.42 C ATOM 1682 C ILE A 118 18.553 -20.245 22.685 1.00 32.10 C ATOM 1683 O ILE A 118 17.458 -19.918 23.146 1.00 4.12 O ATOM 1684 CB ILE A 118 19.675 -21.309 24.644 1.00 63.23 C ATOM 1685 CG1 ILE A 118 20.569 -22.464 25.102 1.00 15.33 C ATOM 1686 CG2 ILE A 118 18.443 -21.201 25.530 1.00 63.22 C ATOM 1687 CD1 ILE A 118 19.952 -23.828 24.886 1.00 52.23 C ATOM 0 H ILE A 118 21.315 -21.694 22.793 1.00 63.14 H new ATOM 0 HA ILE A 118 18.581 -22.352 23.105 1.00 45.42 H new ATOM 0 HB ILE A 118 20.241 -20.381 24.728 1.00 63.23 H new ATOM 0 HG12 ILE A 118 21.517 -22.414 24.566 1.00 15.33 H new ATOM 0 HG13 ILE A 118 20.795 -22.340 26.161 1.00 15.33 H new ATOM 0 HG21 ILE A 118 18.751 -21.064 26.566 1.00 63.22 H new ATOM 0 HG22 ILE A 118 17.841 -20.349 25.214 1.00 63.22 H new ATOM 0 HG23 ILE A 118 17.853 -22.113 25.445 1.00 63.22 H new ATOM 0 HD11 ILE A 118 20.641 -24.598 25.233 1.00 52.23 H new ATOM 0 HD12 ILE A 118 19.018 -23.898 25.444 1.00 52.23 H new ATOM 0 HD13 ILE A 118 19.751 -23.973 23.824 1.00 52.23 H new ATOM 1699 N LEU A 119 19.182 -19.543 21.749 1.00 75.44 N ATOM 1700 CA LEU A 119 18.610 -18.321 21.195 1.00 14.45 C ATOM 1701 C LEU A 119 17.805 -18.618 19.934 1.00 2.21 C ATOM 1702 O LEU A 119 17.703 -17.779 19.039 1.00 53.31 O ATOM 1703 CB LEU A 119 19.717 -17.313 20.882 1.00 12.44 C ATOM 1704 CG LEU A 119 20.259 -16.520 22.072 1.00 11.03 C ATOM 1705 CD1 LEU A 119 21.369 -15.581 21.627 1.00 65.20 C ATOM 1706 CD2 LEU A 119 19.140 -15.742 22.749 1.00 11.03 C ATOM 0 H LEU A 119 20.088 -19.799 21.358 1.00 75.44 H new ATOM 0 HA LEU A 119 17.938 -17.894 21.940 1.00 14.45 H new ATOM 0 HB2 LEU A 119 20.547 -17.847 20.419 1.00 12.44 H new ATOM 0 HB3 LEU A 119 19.339 -16.607 20.142 1.00 12.44 H new ATOM 0 HG LEU A 119 20.674 -17.224 22.794 1.00 11.03 H new ATOM 0 HD11 LEU A 119 21.742 -15.025 22.487 1.00 65.20 H new ATOM 0 HD12 LEU A 119 22.182 -16.160 21.189 1.00 65.20 H new ATOM 0 HD13 LEU A 119 20.980 -14.883 20.885 1.00 65.20 H new ATOM 0 HD21 LEU A 119 19.544 -15.184 23.593 1.00 11.03 H new ATOM 0 HD22 LEU A 119 18.695 -15.049 22.035 1.00 11.03 H new ATOM 0 HD23 LEU A 119 18.378 -16.436 23.104 1.00 11.03 H new ATOM 1718 N TYR A 120 17.235 -19.816 19.871 1.00 12.31 N ATOM 1719 CA TYR A 120 16.439 -20.224 18.719 1.00 2.14 C ATOM 1720 C TYR A 120 15.398 -19.164 18.374 1.00 73.05 C ATOM 1721 O TYR A 120 15.341 -18.679 17.244 1.00 33.33 O ATOM 1722 CB TYR A 120 15.750 -21.561 18.997 1.00 12.32 C ATOM 1723 CG TYR A 120 16.603 -22.763 18.663 1.00 24.20 C ATOM 1724 CD1 TYR A 120 17.192 -22.896 17.411 1.00 35.34 C ATOM 1725 CD2 TYR A 120 16.823 -23.766 19.600 1.00 54.22 C ATOM 1726 CE1 TYR A 120 17.971 -23.994 17.102 1.00 44.43 C ATOM 1727 CE2 TYR A 120 17.602 -24.866 19.299 1.00 3.03 C ATOM 1728 CZ TYR A 120 18.174 -24.976 18.049 1.00 41.41 C ATOM 1729 OH TYR A 120 18.952 -26.069 17.745 1.00 75.53 O ATOM 0 H TYR A 120 17.309 -20.522 20.604 1.00 12.31 H new ATOM 0 HA TYR A 120 17.110 -20.339 17.868 1.00 2.14 H new ATOM 0 HB2 TYR A 120 15.472 -21.605 20.050 1.00 12.32 H new ATOM 0 HB3 TYR A 120 14.826 -21.611 18.421 1.00 12.32 H new ATOM 0 HD1 TYR A 120 17.038 -22.128 16.667 1.00 35.34 H new ATOM 0 HD2 TYR A 120 16.377 -23.684 20.580 1.00 54.22 H new ATOM 0 HE1 TYR A 120 18.419 -24.083 16.123 1.00 44.43 H new ATOM 0 HE2 TYR A 120 17.762 -25.636 20.039 1.00 3.03 H new ATOM 0 HH TYR A 120 19.634 -25.813 17.090 1.00 75.53 H new ATOM 1739 N ASN A 121 14.576 -18.809 19.356 1.00 52.13 N ATOM 1740 CA ASN A 121 13.535 -17.806 19.157 1.00 64.31 C ATOM 1741 C ASN A 121 14.035 -16.419 19.550 1.00 73.15 C ATOM 1742 O ASN A 121 13.481 -15.404 19.125 1.00 64.12 O ATOM 1743 CB ASN A 121 12.292 -18.163 19.973 1.00 14.04 C ATOM 1744 CG ASN A 121 12.535 -18.070 21.467 1.00 34.24 C ATOM 1745 OD1 ASN A 121 12.668 -19.086 22.150 1.00 32.01 O ATOM 1746 ND2 ASN A 121 12.593 -16.848 21.982 1.00 1.44 N ATOM 0 H ASN A 121 14.610 -19.200 20.297 1.00 52.13 H new ATOM 0 HA ASN A 121 13.275 -17.793 18.099 1.00 64.31 H new ATOM 0 HB2 ASN A 121 11.476 -17.495 19.698 1.00 14.04 H new ATOM 0 HB3 ASN A 121 11.974 -19.175 19.722 1.00 14.04 H new ATOM 0 HD21 ASN A 121 12.753 -16.723 22.982 1.00 1.44 H new ATOM 0 HD22 ASN A 121 12.477 -16.034 21.378 1.00 1.44 H new ATOM 1753 N THR A 122 15.085 -16.383 20.363 1.00 3.43 N ATOM 1754 CA THR A 122 15.659 -15.121 20.814 1.00 25.11 C ATOM 1755 C THR A 122 14.687 -14.363 21.710 1.00 33.44 C ATOM 1756 O THR A 122 13.696 -13.806 21.238 1.00 53.53 O ATOM 1757 CB THR A 122 16.049 -14.224 19.624 1.00 15.10 C ATOM 1758 OG1 THR A 122 16.881 -14.951 18.714 1.00 71.33 O ATOM 1759 CG2 THR A 122 16.779 -12.978 20.102 1.00 52.12 C ATOM 0 H THR A 122 15.556 -17.213 20.723 1.00 3.43 H new ATOM 0 HA THR A 122 16.555 -15.368 21.383 1.00 25.11 H new ATOM 0 HB THR A 122 15.136 -13.918 19.114 1.00 15.10 H new ATOM 0 HG1 THR A 122 17.112 -15.819 19.105 1.00 71.33 H new ATOM 0 HG21 THR A 122 17.044 -12.360 19.244 1.00 52.12 H new ATOM 0 HG22 THR A 122 16.132 -12.411 20.771 1.00 52.12 H new ATOM 0 HG23 THR A 122 17.685 -13.269 20.634 1.00 52.12 H new ATOM 1767 N THR A 123 14.975 -14.346 23.008 1.00 24.10 N ATOM 1768 CA THR A 123 14.126 -13.657 23.971 1.00 52.11 C ATOM 1769 C THR A 123 14.956 -13.021 25.080 1.00 13.21 C ATOM 1770 O THR A 123 14.422 -12.610 26.111 1.00 60.12 O ATOM 1771 CB THR A 123 13.098 -14.616 24.600 1.00 15.22 C ATOM 1772 OG1 THR A 123 12.255 -13.901 25.511 1.00 74.21 O ATOM 1773 CG2 THR A 123 13.795 -15.752 25.332 1.00 31.52 C ATOM 0 H THR A 123 15.791 -14.802 23.416 1.00 24.10 H new ATOM 0 HA THR A 123 13.597 -12.876 23.424 1.00 52.11 H new ATOM 0 HB THR A 123 12.491 -15.039 23.799 1.00 15.22 H new ATOM 0 HG1 THR A 123 12.799 -13.288 26.048 1.00 74.21 H new ATOM 0 HG21 THR A 123 13.049 -16.416 25.768 1.00 31.52 H new ATOM 0 HG22 THR A 123 14.413 -16.312 24.630 1.00 31.52 H new ATOM 0 HG23 THR A 123 14.423 -15.343 26.123 1.00 31.52 H new ATOM 1781 N PHE A 124 16.264 -12.942 24.862 1.00 2.54 N ATOM 1782 CA PHE A 124 17.169 -12.355 25.845 1.00 75.04 C ATOM 1783 C PHE A 124 17.845 -11.108 25.284 1.00 4.30 C ATOM 1784 O PHE A 124 17.735 -10.020 25.851 1.00 65.23 O ATOM 1785 CB PHE A 124 18.226 -13.376 26.269 1.00 43.01 C ATOM 1786 CG PHE A 124 17.646 -14.675 26.751 1.00 3.35 C ATOM 1787 CD1 PHE A 124 16.704 -14.693 27.767 1.00 23.13 C ATOM 1788 CD2 PHE A 124 18.044 -15.877 26.189 1.00 34.34 C ATOM 1789 CE1 PHE A 124 16.168 -15.886 28.213 1.00 23.55 C ATOM 1790 CE2 PHE A 124 17.511 -17.074 26.631 1.00 12.41 C ATOM 1791 CZ PHE A 124 16.573 -17.078 27.645 1.00 20.42 C ATOM 0 H PHE A 124 16.722 -13.277 24.014 1.00 2.54 H new ATOM 0 HA PHE A 124 16.582 -12.067 26.717 1.00 75.04 H new ATOM 0 HB2 PHE A 124 18.888 -13.574 25.426 1.00 43.01 H new ATOM 0 HB3 PHE A 124 18.839 -12.945 27.061 1.00 43.01 H new ATOM 0 HD1 PHE A 124 16.385 -13.764 28.216 1.00 23.13 H new ATOM 0 HD2 PHE A 124 18.778 -15.879 25.397 1.00 34.34 H new ATOM 0 HE1 PHE A 124 15.433 -15.886 29.005 1.00 23.55 H new ATOM 0 HE2 PHE A 124 17.828 -18.005 26.184 1.00 12.41 H new ATOM 0 HZ PHE A 124 16.157 -18.012 27.993 1.00 20.42 H new ATOM 1801 N PHE A 125 18.546 -11.273 24.167 1.00 25.53 N ATOM 1802 CA PHE A 125 19.243 -10.162 23.530 1.00 61.21 C ATOM 1803 C PHE A 125 18.904 -10.088 22.044 1.00 61.40 C ATOM 1804 O PHE A 125 19.720 -10.407 21.179 1.00 50.24 O ATOM 1805 CB PHE A 125 20.755 -10.308 23.713 1.00 62.21 C ATOM 1806 CG PHE A 125 21.258 -9.750 25.013 1.00 3.33 C ATOM 1807 CD1 PHE A 125 21.531 -8.397 25.142 1.00 22.32 C ATOM 1808 CD2 PHE A 125 21.458 -10.577 26.107 1.00 52.32 C ATOM 1809 CE1 PHE A 125 21.995 -7.881 26.337 1.00 31.14 C ATOM 1810 CE2 PHE A 125 21.921 -10.066 27.305 1.00 70.12 C ATOM 1811 CZ PHE A 125 22.189 -8.716 27.420 1.00 31.24 C ATOM 0 H PHE A 125 18.646 -12.166 23.684 1.00 25.53 H new ATOM 0 HA PHE A 125 18.914 -9.238 24.006 1.00 61.21 H new ATOM 0 HB2 PHE A 125 21.020 -11.364 23.653 1.00 62.21 H new ATOM 0 HB3 PHE A 125 21.263 -9.805 22.890 1.00 62.21 H new ATOM 0 HD1 PHE A 125 21.379 -7.739 24.299 1.00 22.32 H new ATOM 0 HD2 PHE A 125 21.250 -11.633 26.022 1.00 52.32 H new ATOM 0 HE1 PHE A 125 22.206 -6.825 26.424 1.00 31.14 H new ATOM 0 HE2 PHE A 125 22.073 -10.721 28.150 1.00 70.12 H new ATOM 0 HZ PHE A 125 22.550 -8.314 28.355 1.00 31.24 H new ATOM 1821 N PRO A 126 17.671 -9.659 21.740 1.00 55.43 N ATOM 1822 CA PRO A 126 17.194 -9.533 20.359 1.00 2.41 C ATOM 1823 C PRO A 126 17.881 -8.396 19.610 1.00 0.54 C ATOM 1824 O PRO A 126 18.014 -8.435 18.387 1.00 1.30 O ATOM 1825 CB PRO A 126 15.701 -9.239 20.524 1.00 0.14 C ATOM 1826 CG PRO A 126 15.584 -8.617 21.873 1.00 44.41 C ATOM 1827 CD PRO A 126 16.646 -9.262 22.720 1.00 32.11 C ATOM 0 HA PRO A 126 17.404 -10.428 19.773 1.00 2.41 H new ATOM 0 HB2 PRO A 126 15.342 -8.566 19.745 1.00 0.14 H new ATOM 0 HB3 PRO A 126 15.108 -10.151 20.456 1.00 0.14 H new ATOM 0 HG2 PRO A 126 15.730 -7.538 21.819 1.00 44.41 H new ATOM 0 HG3 PRO A 126 14.593 -8.784 22.295 1.00 44.41 H new ATOM 0 HD2 PRO A 126 17.045 -8.569 23.460 1.00 32.11 H new ATOM 0 HD3 PRO A 126 16.257 -10.122 23.266 1.00 32.11 H new ATOM 1835 N LYS A 127 18.317 -7.383 20.352 1.00 14.13 N ATOM 1836 CA LYS A 127 18.992 -6.235 19.760 1.00 51.43 C ATOM 1837 C LYS A 127 20.375 -6.622 19.247 1.00 41.04 C ATOM 1838 O LYS A 127 20.853 -6.079 18.250 1.00 72.41 O ATOM 1839 CB LYS A 127 19.114 -5.104 20.784 1.00 24.32 C ATOM 1840 CG LYS A 127 19.787 -5.527 22.079 1.00 73.22 C ATOM 1841 CD LYS A 127 20.916 -4.583 22.455 1.00 13.53 C ATOM 1842 CE LYS A 127 22.021 -4.590 21.410 1.00 32.32 C ATOM 1843 NZ LYS A 127 21.982 -3.373 20.553 1.00 60.31 N ATOM 0 H LYS A 127 18.214 -7.334 21.366 1.00 14.13 H new ATOM 0 HA LYS A 127 18.394 -5.890 18.916 1.00 51.43 H new ATOM 0 HB2 LYS A 127 19.679 -4.284 20.342 1.00 24.32 H new ATOM 0 HB3 LYS A 127 18.119 -4.720 21.010 1.00 24.32 H new ATOM 0 HG2 LYS A 127 19.050 -5.552 22.882 1.00 73.22 H new ATOM 0 HG3 LYS A 127 20.178 -6.539 21.973 1.00 73.22 H new ATOM 0 HD2 LYS A 127 20.524 -3.572 22.565 1.00 13.53 H new ATOM 0 HD3 LYS A 127 21.327 -4.873 23.422 1.00 13.53 H new ATOM 0 HE2 LYS A 127 22.989 -4.654 21.906 1.00 32.32 H new ATOM 0 HE3 LYS A 127 21.924 -5.478 20.785 1.00 32.32 H new ATOM 0 HZ1 LYS A 127 22.947 -3.132 20.248 1.00 60.31 H new ATOM 0 HZ2 LYS A 127 21.390 -3.556 19.717 1.00 60.31 H new ATOM 0 HZ3 LYS A 127 21.582 -2.580 21.094 1.00 60.31 H new ATOM 1857 N PHE A 128 21.013 -7.564 19.933 1.00 62.33 N ATOM 1858 CA PHE A 128 22.342 -8.025 19.546 1.00 54.34 C ATOM 1859 C PHE A 128 22.262 -8.980 18.359 1.00 73.15 C ATOM 1860 O PHE A 128 23.153 -9.009 17.509 1.00 51.33 O ATOM 1861 CB PHE A 128 23.029 -8.715 20.725 1.00 20.43 C ATOM 1862 CG PHE A 128 23.578 -10.072 20.389 1.00 73.45 C ATOM 1863 CD1 PHE A 128 24.745 -10.199 19.653 1.00 60.21 C ATOM 1864 CD2 PHE A 128 22.926 -11.221 20.808 1.00 25.20 C ATOM 1865 CE1 PHE A 128 25.251 -11.447 19.341 1.00 4.21 C ATOM 1866 CE2 PHE A 128 23.428 -12.472 20.500 1.00 44.45 C ATOM 1867 CZ PHE A 128 24.593 -12.584 19.766 1.00 61.30 C ATOM 0 H PHE A 128 20.632 -8.024 20.760 1.00 62.33 H new ATOM 0 HA PHE A 128 22.929 -7.155 19.251 1.00 54.34 H new ATOM 0 HB2 PHE A 128 23.841 -8.082 21.083 1.00 20.43 H new ATOM 0 HB3 PHE A 128 22.316 -8.813 21.544 1.00 20.43 H new ATOM 0 HD1 PHE A 128 25.265 -9.313 19.319 1.00 60.21 H new ATOM 0 HD2 PHE A 128 22.015 -11.138 21.382 1.00 25.20 H new ATOM 0 HE1 PHE A 128 26.161 -11.533 18.765 1.00 4.21 H new ATOM 0 HE2 PHE A 128 22.910 -13.360 20.833 1.00 44.45 H new ATOM 0 HZ PHE A 128 24.989 -13.560 19.525 1.00 61.30 H new ATOM 1877 N LEU A 129 21.189 -9.762 18.307 1.00 13.52 N ATOM 1878 CA LEU A 129 20.991 -10.720 17.225 1.00 40.30 C ATOM 1879 C LEU A 129 20.438 -10.030 15.982 1.00 61.43 C ATOM 1880 O LEU A 129 20.906 -10.269 14.868 1.00 14.30 O ATOM 1881 CB LEU A 129 20.041 -11.833 17.670 1.00 11.21 C ATOM 1882 CG LEU A 129 20.694 -13.053 18.321 1.00 42.43 C ATOM 1883 CD1 LEU A 129 19.640 -14.074 18.718 1.00 62.40 C ATOM 1884 CD2 LEU A 129 21.716 -13.676 17.380 1.00 13.44 C ATOM 0 H LEU A 129 20.442 -9.751 19.002 1.00 13.52 H new ATOM 0 HA LEU A 129 21.959 -11.155 16.976 1.00 40.30 H new ATOM 0 HB2 LEU A 129 19.324 -11.411 18.374 1.00 11.21 H new ATOM 0 HB3 LEU A 129 19.475 -12.169 16.801 1.00 11.21 H new ATOM 0 HG LEU A 129 21.212 -12.727 19.223 1.00 42.43 H new ATOM 0 HD11 LEU A 129 20.123 -14.935 19.180 1.00 62.40 H new ATOM 0 HD12 LEU A 129 18.946 -13.624 19.428 1.00 62.40 H new ATOM 0 HD13 LEU A 129 19.094 -14.396 17.832 1.00 62.40 H new ATOM 0 HD21 LEU A 129 22.171 -14.543 17.859 1.00 13.44 H new ATOM 0 HD22 LEU A 129 21.221 -13.988 16.460 1.00 13.44 H new ATOM 0 HD23 LEU A 129 22.489 -12.944 17.146 1.00 13.44 H new ATOM 1896 N ARG A 130 19.442 -9.174 16.180 1.00 14.32 N ATOM 1897 CA ARG A 130 18.826 -8.449 15.075 1.00 12.23 C ATOM 1898 C ARG A 130 18.415 -9.405 13.959 1.00 25.12 C ATOM 1899 O ARG A 130 18.412 -9.039 12.783 1.00 23.34 O ATOM 1900 CB ARG A 130 19.790 -7.394 14.529 1.00 72.11 C ATOM 1901 CG ARG A 130 19.830 -6.119 15.356 1.00 70.24 C ATOM 1902 CD ARG A 130 18.925 -5.047 14.770 1.00 43.43 C ATOM 1903 NE ARG A 130 17.565 -5.534 14.556 1.00 24.20 N ATOM 1904 CZ ARG A 130 16.675 -5.680 15.531 1.00 1.41 C ATOM 1905 NH1 ARG A 130 17.000 -5.376 16.780 1.00 14.12 N ATOM 1906 NH2 ARG A 130 15.457 -6.129 15.257 1.00 21.24 N ATOM 0 H ARG A 130 19.044 -8.965 17.096 1.00 14.32 H new ATOM 0 HA ARG A 130 17.932 -7.953 15.452 1.00 12.23 H new ATOM 0 HB2 ARG A 130 20.793 -7.819 14.484 1.00 72.11 H new ATOM 0 HB3 ARG A 130 19.503 -7.145 13.507 1.00 72.11 H new ATOM 0 HG2 ARG A 130 19.522 -6.337 16.379 1.00 70.24 H new ATOM 0 HG3 ARG A 130 20.853 -5.747 15.404 1.00 70.24 H new ATOM 0 HD2 ARG A 130 18.901 -4.188 15.440 1.00 43.43 H new ATOM 0 HD3 ARG A 130 19.339 -4.701 13.823 1.00 43.43 H new ATOM 0 HE ARG A 130 17.283 -5.775 13.606 1.00 24.20 H new ATOM 0 HH11 ARG A 130 17.935 -5.029 16.994 1.00 14.12 H new ATOM 0 HH12 ARG A 130 16.315 -5.489 17.527 1.00 14.12 H new ATOM 0 HH21 ARG A 130 15.203 -6.362 14.297 1.00 21.24 H new ATOM 0 HH22 ARG A 130 14.774 -6.241 16.006 1.00 21.24 H new ATOM 1920 N CYS A 131 18.070 -10.632 14.335 1.00 3.15 N ATOM 1921 CA CYS A 131 17.659 -11.642 13.368 1.00 43.22 C ATOM 1922 C CYS A 131 16.308 -12.241 13.747 1.00 1.24 C ATOM 1923 O CYS A 131 15.871 -12.136 14.893 1.00 62.43 O ATOM 1924 CB CYS A 131 18.712 -12.748 13.275 1.00 21.14 C ATOM 1925 SG CYS A 131 18.685 -13.671 11.705 1.00 44.43 S ATOM 0 H CYS A 131 18.067 -10.951 15.304 1.00 3.15 H new ATOM 0 HA CYS A 131 17.562 -11.159 12.396 1.00 43.22 H new ATOM 0 HB2 CYS A 131 19.700 -12.306 13.407 1.00 21.14 H new ATOM 0 HB3 CYS A 131 18.563 -13.447 14.098 1.00 21.14 H new ATOM 1930 N ASN A 132 15.652 -12.869 12.777 1.00 12.31 N ATOM 1931 CA ASN A 132 14.350 -13.484 13.009 1.00 22.50 C ATOM 1932 C ASN A 132 14.424 -14.997 12.827 1.00 21.55 C ATOM 1933 O ASN A 132 15.177 -15.496 11.992 1.00 42.44 O ATOM 1934 CB ASN A 132 13.307 -12.896 12.057 1.00 43.41 C ATOM 1935 CG ASN A 132 13.622 -13.188 10.602 1.00 0.24 C ATOM 1936 OD1 ASN A 132 13.701 -14.346 10.194 1.00 61.35 O ATOM 1937 ND2 ASN A 132 13.804 -12.135 9.814 1.00 74.15 N ATOM 0 H ASN A 132 16.000 -12.966 11.823 1.00 12.31 H new ATOM 0 HA ASN A 132 14.054 -13.272 14.036 1.00 22.50 H new ATOM 0 HB2 ASN A 132 12.326 -13.302 12.302 1.00 43.41 H new ATOM 0 HB3 ASN A 132 13.252 -11.817 12.205 1.00 43.41 H new ATOM 0 HD21 ASN A 132 14.019 -12.269 8.826 1.00 74.15 H new ATOM 0 HD22 ASN A 132 13.729 -11.193 10.197 1.00 74.15 H new ATOM 1944 N GLU A 133 13.636 -15.722 13.616 1.00 4.12 N ATOM 1945 CA GLU A 133 13.613 -17.178 13.542 1.00 23.00 C ATOM 1946 C GLU A 133 12.192 -17.709 13.709 1.00 43.21 C ATOM 1947 O GLU A 133 11.784 -18.650 13.028 1.00 24.51 O ATOM 1948 CB GLU A 133 14.524 -17.780 14.615 1.00 55.04 C ATOM 1949 CG GLU A 133 14.713 -19.282 14.479 1.00 11.54 C ATOM 1950 CD GLU A 133 15.067 -19.700 13.066 1.00 43.13 C ATOM 1951 OE1 GLU A 133 16.123 -19.260 12.565 1.00 42.25 O ATOM 1952 OE2 GLU A 133 14.289 -20.467 12.461 1.00 44.44 O ATOM 0 H GLU A 133 13.006 -15.325 14.313 1.00 4.12 H new ATOM 0 HA GLU A 133 13.979 -17.472 12.558 1.00 23.00 H new ATOM 0 HB2 GLU A 133 15.498 -17.294 14.567 1.00 55.04 H new ATOM 0 HB3 GLU A 133 14.107 -17.562 15.598 1.00 55.04 H new ATOM 0 HG2 GLU A 133 15.501 -19.608 15.158 1.00 11.54 H new ATOM 0 HG3 GLU A 133 13.798 -19.789 14.785 1.00 11.54 H new ATOM 1959 N THR A 134 11.442 -17.098 14.621 1.00 51.14 N ATOM 1960 CA THR A 134 10.068 -17.509 14.879 1.00 13.33 C ATOM 1961 C THR A 134 9.272 -17.614 13.583 1.00 21.13 C ATOM 1962 O THR A 134 8.516 -18.566 13.382 1.00 3.23 O ATOM 1963 CB THR A 134 9.356 -16.525 15.827 1.00 40.53 C ATOM 1964 OG1 THR A 134 9.380 -15.205 15.271 1.00 61.23 O ATOM 1965 CG2 THR A 134 10.019 -16.516 17.196 1.00 43.34 C ATOM 0 H THR A 134 11.763 -16.317 15.193 1.00 51.14 H new ATOM 0 HA THR A 134 10.116 -18.489 15.353 1.00 13.33 H new ATOM 0 HB THR A 134 8.323 -16.851 15.944 1.00 40.53 H new ATOM 0 HG1 THR A 134 8.924 -14.586 15.879 1.00 61.23 H new ATOM 0 HG21 THR A 134 9.499 -15.814 17.848 1.00 43.34 H new ATOM 0 HG22 THR A 134 9.973 -17.515 17.629 1.00 43.34 H new ATOM 0 HG23 THR A 134 11.061 -16.212 17.094 1.00 43.34 H new ATOM 1973 N LEU A 135 9.447 -16.632 12.706 1.00 13.00 N ATOM 1974 CA LEU A 135 8.745 -16.615 11.427 1.00 11.32 C ATOM 1975 C LEU A 135 9.292 -17.687 10.491 1.00 24.30 C ATOM 1976 O LEU A 135 10.123 -18.506 10.886 1.00 0.20 O ATOM 1977 CB LEU A 135 8.871 -15.238 10.773 1.00 53.24 C ATOM 1978 CG LEU A 135 10.295 -14.737 10.531 1.00 21.11 C ATOM 1979 CD1 LEU A 135 10.792 -15.179 9.163 1.00 33.44 C ATOM 1980 CD2 LEU A 135 10.357 -13.222 10.658 1.00 15.14 C ATOM 0 H LEU A 135 10.069 -15.837 12.857 1.00 13.00 H new ATOM 0 HA LEU A 135 7.692 -16.827 11.615 1.00 11.32 H new ATOM 0 HB2 LEU A 135 8.349 -15.263 9.817 1.00 53.24 H new ATOM 0 HB3 LEU A 135 8.353 -14.512 11.400 1.00 53.24 H new ATOM 0 HG LEU A 135 10.946 -15.172 11.290 1.00 21.11 H new ATOM 0 HD11 LEU A 135 11.807 -14.813 9.009 1.00 33.44 H new ATOM 0 HD12 LEU A 135 10.787 -16.268 9.108 1.00 33.44 H new ATOM 0 HD13 LEU A 135 10.139 -14.774 8.390 1.00 33.44 H new ATOM 0 HD21 LEU A 135 11.378 -12.884 10.483 1.00 15.14 H new ATOM 0 HD22 LEU A 135 9.693 -12.768 9.923 1.00 15.14 H new ATOM 0 HD23 LEU A 135 10.044 -12.928 11.660 1.00 15.14 H new ATOM 1992 N PHE A 136 8.823 -17.676 9.248 1.00 41.12 N ATOM 1993 CA PHE A 136 9.266 -18.647 8.254 1.00 5.04 C ATOM 1994 C PHE A 136 10.159 -17.986 7.208 1.00 3.13 C ATOM 1995 O PHE A 136 9.697 -17.514 6.169 1.00 32.42 O ATOM 1996 CB PHE A 136 8.061 -19.299 7.574 1.00 50.21 C ATOM 1997 CG PHE A 136 7.775 -20.690 8.064 1.00 4.51 C ATOM 1998 CD1 PHE A 136 7.508 -20.925 9.403 1.00 61.20 C ATOM 1999 CD2 PHE A 136 7.775 -21.761 7.186 1.00 71.31 C ATOM 2000 CE1 PHE A 136 7.245 -22.204 9.857 1.00 15.33 C ATOM 2001 CE2 PHE A 136 7.512 -23.042 7.634 1.00 14.23 C ATOM 2002 CZ PHE A 136 7.247 -23.264 8.972 1.00 44.52 C ATOM 0 H PHE A 136 8.136 -17.005 8.905 1.00 41.12 H new ATOM 0 HA PHE A 136 9.845 -19.416 8.766 1.00 5.04 H new ATOM 0 HB2 PHE A 136 7.181 -18.677 7.738 1.00 50.21 H new ATOM 0 HB3 PHE A 136 8.234 -19.330 6.498 1.00 50.21 H new ATOM 0 HD1 PHE A 136 7.505 -20.100 10.100 1.00 61.20 H new ATOM 0 HD2 PHE A 136 7.983 -21.593 6.140 1.00 71.31 H new ATOM 0 HE1 PHE A 136 7.038 -22.374 10.903 1.00 15.33 H new ATOM 0 HE2 PHE A 136 7.514 -23.869 6.939 1.00 14.23 H new ATOM 0 HZ PHE A 136 7.042 -24.264 9.325 1.00 44.52 H new ATOM 2012 N PRO A 137 11.471 -17.949 7.488 1.00 35.32 N ATOM 2013 CA PRO A 137 12.456 -17.349 6.585 1.00 44.32 C ATOM 2014 C PRO A 137 12.651 -18.167 5.313 1.00 50.33 C ATOM 2015 O PRO A 137 12.626 -17.628 4.205 1.00 33.34 O ATOM 2016 CB PRO A 137 13.741 -17.340 7.417 1.00 62.31 C ATOM 2017 CG PRO A 137 13.563 -18.445 8.400 1.00 32.03 C ATOM 2018 CD PRO A 137 12.092 -18.492 8.708 1.00 13.01 C ATOM 0 HA PRO A 137 12.146 -16.362 6.243 1.00 44.32 H new ATOM 0 HB2 PRO A 137 14.619 -17.504 6.792 1.00 62.31 H new ATOM 0 HB3 PRO A 137 13.881 -16.383 7.919 1.00 62.31 H new ATOM 0 HG2 PRO A 137 13.906 -19.394 7.987 1.00 32.03 H new ATOM 0 HG3 PRO A 137 14.145 -18.262 9.303 1.00 32.03 H new ATOM 0 HD2 PRO A 137 11.756 -19.509 8.911 1.00 13.01 H new ATOM 0 HD3 PRO A 137 11.846 -17.893 9.585 1.00 13.01 H new ATOM 2026 N THR A 138 12.845 -19.472 5.477 1.00 11.44 N ATOM 2027 CA THR A 138 13.044 -20.364 4.342 1.00 5.25 C ATOM 2028 C THR A 138 11.953 -20.174 3.295 1.00 4.31 C ATOM 2029 O THR A 138 12.188 -19.587 2.238 1.00 12.35 O ATOM 2030 CB THR A 138 13.064 -21.839 4.785 1.00 64.34 C ATOM 2031 OG1 THR A 138 12.561 -21.957 6.120 1.00 70.41 O ATOM 2032 CG2 THR A 138 14.475 -22.405 4.717 1.00 73.51 C ATOM 0 H THR A 138 12.868 -19.935 6.386 1.00 11.44 H new ATOM 0 HA THR A 138 14.010 -20.110 3.905 1.00 5.25 H new ATOM 0 HB THR A 138 12.428 -22.408 4.107 1.00 64.34 H new ATOM 0 HG1 THR A 138 12.576 -22.898 6.393 1.00 70.41 H new ATOM 0 HG21 THR A 138 14.464 -23.448 5.034 1.00 73.51 H new ATOM 0 HG22 THR A 138 14.844 -22.341 3.693 1.00 73.51 H new ATOM 0 HG23 THR A 138 15.129 -21.832 5.375 1.00 73.51 H new ATOM 2040 N LYS A 139 10.759 -20.673 3.594 1.00 10.04 N ATOM 2041 CA LYS A 139 9.629 -20.557 2.680 1.00 44.33 C ATOM 2042 C LYS A 139 8.380 -21.200 3.273 1.00 22.03 C ATOM 2043 O LYS A 139 7.260 -20.898 2.862 1.00 14.02 O ATOM 2044 CB LYS A 139 9.964 -21.211 1.337 1.00 3.04 C ATOM 2045 CG LYS A 139 10.550 -22.606 1.470 1.00 22.01 C ATOM 2046 CD LYS A 139 10.290 -23.441 0.227 1.00 4.51 C ATOM 2047 CE LYS A 139 10.335 -24.929 0.536 1.00 63.22 C ATOM 2048 NZ LYS A 139 9.710 -25.739 -0.546 1.00 33.11 N ATOM 0 H LYS A 139 10.548 -21.163 4.464 1.00 10.04 H new ATOM 0 HA LYS A 139 9.430 -19.497 2.522 1.00 44.33 H new ATOM 0 HB2 LYS A 139 9.059 -21.262 0.731 1.00 3.04 H new ATOM 0 HB3 LYS A 139 10.671 -20.578 0.801 1.00 3.04 H new ATOM 0 HG2 LYS A 139 11.624 -22.536 1.644 1.00 22.01 H new ATOM 0 HG3 LYS A 139 10.118 -23.102 2.339 1.00 22.01 H new ATOM 0 HD2 LYS A 139 9.315 -23.184 -0.188 1.00 4.51 H new ATOM 0 HD3 LYS A 139 11.033 -23.204 -0.534 1.00 4.51 H new ATOM 0 HE2 LYS A 139 11.371 -25.241 0.671 1.00 63.22 H new ATOM 0 HE3 LYS A 139 9.819 -25.120 1.477 1.00 63.22 H new ATOM 0 HZ1 LYS A 139 9.761 -26.748 -0.298 1.00 33.11 H new ATOM 0 HZ2 LYS A 139 8.715 -25.459 -0.658 1.00 33.11 H new ATOM 0 HZ3 LYS A 139 10.218 -25.576 -1.439 1.00 33.11 H new TER 2062 LYS A 139