USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1011 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 26 LYS NZ :NH3+ 172:sc= 0.779 (180deg=0) USER MOD Set 1.2: A 31 ASN : amide:sc= 0.799 K(o=1.6,f=-6.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 143:sc= 0.0544 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -171:sc= 1.25 (180deg=1.07) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 112:sc= 0.219 USER MOD Single : A 17 MET CE :methyl -174:sc= -0.979 (180deg=-1.12) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= -0.0682 X(o=-0.068,f=-0.32) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 173:sc= 1.2 (180deg=1.16) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 TYR OH : rot 150:sc= 1.29 USER MOD Single : A 56 SER OG : rot -140:sc= -0.0838 USER MOD Single : A 59 ASN : amide:sc= 0.362 X(o=0.36,f=0) USER MOD Single : A 60 MET CE :methyl -156:sc= -3.24 (180deg=-5.62!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 63 MET CE :methyl -170:sc= -0.544 (180deg=-0.726) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 78 MET CE :methyl -178:sc= 0 (180deg=-0.0044) USER MOD Single : A 79 SER OG : rot 180:sc=0.000563 USER MOD Single : A 85 MET CE :methyl -120:sc= 0 (180deg=-0.716) USER MOD Single : A 87 THR OG1 : rot 92:sc= 1.3 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -163:sc= -0.0415 (180deg=-0.315) USER MOD Single : A 94 ASN : amide:sc= -0.138 K(o=-0.14,f=-1.5) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 SER OG : rot -52:sc= 1.21 USER MOD Single : A 106 TYR OH : rot 139:sc= 0.973 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -141:sc= -1.14 (180deg=-5.5!) USER MOD Single : A 121 ASN : amide:sc= 0.657 K(o=0.66,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl 165:sc= -0.109 (180deg=-0.573) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.302 -19.391 1.313 1.00 0.00 N ATOM 2 CA MET A 1 18.206 -18.858 2.677 1.00 0.00 C ATOM 3 C MET A 1 16.770 -18.448 2.963 1.00 0.00 C ATOM 4 O MET A 1 16.078 -17.945 2.075 1.00 0.00 O ATOM 5 CB MET A 1 19.177 -17.691 2.891 1.00 0.00 C ATOM 6 CG MET A 1 20.556 -18.217 3.303 1.00 0.00 C ATOM 7 SD MET A 1 21.907 -17.014 3.235 1.00 0.00 S ATOM 8 CE MET A 1 21.386 -15.848 4.518 1.00 0.00 C ATOM 0 H1 MET A 1 19.205 -19.098 0.889 1.00 0.00 H new ATOM 0 H2 MET A 1 18.253 -20.429 1.342 1.00 0.00 H new ATOM 0 H3 MET A 1 17.515 -19.023 0.740 1.00 0.00 H new ATOM 0 HA MET A 1 18.493 -19.639 3.381 1.00 0.00 H new ATOM 0 HB2 MET A 1 19.262 -17.107 1.975 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.790 -17.023 3.661 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.488 -18.603 4.320 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.811 -19.059 2.659 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.118 -15.044 4.598 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.414 -15.429 4.256 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.311 -16.368 5.473 1.00 0.00 H new ATOM 20 N ALA A 2 16.310 -18.687 4.193 1.00 0.00 N ATOM 21 CA ALA A 2 15.069 -18.127 4.708 1.00 0.00 C ATOM 22 C ALA A 2 15.224 -16.611 4.892 1.00 0.00 C ATOM 23 O ALA A 2 16.344 -16.098 4.991 1.00 0.00 O ATOM 24 CB ALA A 2 14.707 -18.817 6.029 1.00 0.00 C ATOM 0 H ALA A 2 16.798 -19.282 4.863 1.00 0.00 H new ATOM 0 HA ALA A 2 14.259 -18.300 4.000 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.778 -18.398 6.415 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.580 -19.886 5.858 1.00 0.00 H new ATOM 0 HB3 ALA A 2 15.506 -18.658 6.753 1.00 0.00 H new ATOM 30 N ASP A 3 14.084 -15.933 5.017 1.00 0.00 N ATOM 31 CA ASP A 3 13.847 -14.508 4.791 1.00 0.00 C ATOM 32 C ASP A 3 14.217 -14.179 3.356 1.00 0.00 C ATOM 33 O ASP A 3 15.340 -13.781 3.059 1.00 0.00 O ATOM 34 CB ASP A 3 14.536 -13.556 5.776 1.00 0.00 C ATOM 35 CG ASP A 3 14.145 -13.799 7.222 1.00 0.00 C ATOM 36 OD1 ASP A 3 12.941 -13.705 7.561 1.00 0.00 O ATOM 37 OD2 ASP A 3 15.055 -14.010 8.056 1.00 0.00 O ATOM 0 H ASP A 3 13.228 -16.408 5.304 1.00 0.00 H new ATOM 0 HA ASP A 3 12.786 -14.338 4.975 1.00 0.00 H new ATOM 0 HB2 ASP A 3 15.616 -13.662 5.677 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.290 -12.528 5.509 1.00 0.00 H new ATOM 42 N LYS A 4 13.267 -14.355 2.440 1.00 0.00 N ATOM 43 CA LYS A 4 13.444 -14.149 1.000 1.00 0.00 C ATOM 44 C LYS A 4 13.437 -12.657 0.628 1.00 0.00 C ATOM 45 O LYS A 4 12.985 -12.313 -0.468 1.00 0.00 O ATOM 46 CB LYS A 4 12.380 -14.983 0.259 1.00 0.00 C ATOM 47 CG LYS A 4 12.662 -16.498 0.375 1.00 0.00 C ATOM 48 CD LYS A 4 11.407 -17.333 0.650 1.00 0.00 C ATOM 49 CE LYS A 4 10.334 -17.146 -0.428 1.00 0.00 C ATOM 50 NZ LYS A 4 9.138 -17.947 -0.115 1.00 0.00 N ATOM 0 H LYS A 4 12.323 -14.654 2.685 1.00 0.00 H new ATOM 0 HA LYS A 4 14.428 -14.497 0.686 1.00 0.00 H new ATOM 0 HB2 LYS A 4 11.394 -14.763 0.669 1.00 0.00 H new ATOM 0 HB3 LYS A 4 12.359 -14.696 -0.792 1.00 0.00 H new ATOM 0 HG2 LYS A 4 13.125 -16.845 -0.549 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.383 -16.665 1.175 1.00 0.00 H new ATOM 0 HD2 LYS A 4 11.680 -18.387 0.708 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.995 -17.057 1.621 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.064 -16.093 -0.501 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.732 -17.441 -1.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.423 -17.807 -0.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 9.396 -18.953 -0.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 8.749 -17.647 0.802 1.00 0.00 H new ATOM 64 N GLU A 5 13.933 -11.792 1.518 1.00 0.00 N ATOM 65 CA GLU A 5 13.989 -10.337 1.439 1.00 0.00 C ATOM 66 C GLU A 5 12.664 -9.810 0.900 1.00 0.00 C ATOM 67 O GLU A 5 12.604 -9.227 -0.182 1.00 0.00 O ATOM 68 CB GLU A 5 15.239 -9.875 0.663 1.00 0.00 C ATOM 69 CG GLU A 5 15.493 -8.367 0.814 1.00 0.00 C ATOM 70 CD GLU A 5 16.986 -8.030 0.867 1.00 0.00 C ATOM 71 OE1 GLU A 5 17.575 -8.029 1.976 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.598 -7.727 -0.181 1.00 0.00 O ATOM 0 H GLU A 5 14.342 -12.128 2.390 1.00 0.00 H new ATOM 0 HA GLU A 5 14.109 -9.901 2.431 1.00 0.00 H new ATOM 0 HB2 GLU A 5 16.110 -10.426 1.019 1.00 0.00 H new ATOM 0 HB3 GLU A 5 15.119 -10.117 -0.393 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.033 -7.838 -0.021 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.010 -8.009 1.723 1.00 0.00 H new ATOM 79 N LEU A 6 11.585 -10.125 1.618 1.00 0.00 N ATOM 80 CA LEU A 6 10.219 -9.804 1.202 1.00 0.00 C ATOM 81 C LEU A 6 10.065 -8.302 0.922 1.00 0.00 C ATOM 82 O LEU A 6 10.079 -7.497 1.849 1.00 0.00 O ATOM 83 CB LEU A 6 9.225 -10.302 2.254 1.00 0.00 C ATOM 84 CG LEU A 6 7.774 -9.973 1.842 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.938 -11.242 1.713 1.00 0.00 C ATOM 86 CD2 LEU A 6 7.148 -9.014 2.852 1.00 0.00 C ATOM 0 H LEU A 6 11.635 -10.614 2.512 1.00 0.00 H new ATOM 0 HA LEU A 6 10.001 -10.318 0.266 1.00 0.00 H new ATOM 0 HB2 LEU A 6 9.335 -11.379 2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.447 -9.841 3.217 1.00 0.00 H new ATOM 0 HG LEU A 6 7.795 -9.490 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.921 -10.980 1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.376 -11.891 0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.918 -11.764 2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.125 -8.788 2.553 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.144 -9.477 3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.728 -8.092 2.886 1.00 0.00 H new ATOM 98 N LYS A 7 9.934 -7.929 -0.359 1.00 0.00 N ATOM 99 CA LYS A 7 9.885 -6.518 -0.747 1.00 0.00 C ATOM 100 C LYS A 7 8.516 -5.904 -0.476 1.00 0.00 C ATOM 101 O LYS A 7 7.509 -6.603 -0.325 1.00 0.00 O ATOM 102 CB LYS A 7 10.274 -6.271 -2.213 1.00 0.00 C ATOM 103 CG LYS A 7 9.312 -6.719 -3.300 1.00 0.00 C ATOM 104 CD LYS A 7 9.575 -8.155 -3.752 1.00 0.00 C ATOM 105 CE LYS A 7 9.366 -8.271 -5.267 1.00 0.00 C ATOM 106 NZ LYS A 7 9.406 -9.678 -5.715 1.00 0.00 N ATOM 0 H LYS A 7 9.861 -8.583 -1.138 1.00 0.00 H new ATOM 0 HA LYS A 7 10.632 -6.029 -0.122 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.440 -5.201 -2.337 1.00 0.00 H new ATOM 0 HB3 LYS A 7 11.229 -6.765 -2.391 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.289 -6.638 -2.933 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.397 -6.050 -4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.593 -8.447 -3.493 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.905 -8.838 -3.230 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.407 -7.830 -5.537 1.00 0.00 H new ATOM 0 HE3 LYS A 7 10.137 -7.701 -5.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 9.415 -9.711 -6.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 10.264 -10.135 -5.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 8.567 -10.179 -5.360 1.00 0.00 H new ATOM 120 N PHE A 8 8.459 -4.583 -0.605 1.00 0.00 N ATOM 121 CA PHE A 8 7.311 -3.741 -0.294 1.00 0.00 C ATOM 122 C PHE A 8 7.156 -2.712 -1.411 1.00 0.00 C ATOM 123 O PHE A 8 7.918 -1.745 -1.456 1.00 0.00 O ATOM 124 CB PHE A 8 7.527 -3.057 1.073 1.00 0.00 C ATOM 125 CG PHE A 8 6.866 -3.733 2.256 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.321 -4.977 2.730 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.786 -3.098 2.900 1.00 0.00 C ATOM 128 CE1 PHE A 8 6.685 -5.583 3.827 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.157 -3.706 4.001 1.00 0.00 C ATOM 130 CZ PHE A 8 5.611 -4.947 4.470 1.00 0.00 C ATOM 0 H PHE A 8 9.254 -4.043 -0.947 1.00 0.00 H new ATOM 0 HA PHE A 8 6.400 -4.336 -0.228 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.599 -2.997 1.264 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.157 -2.034 1.009 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.157 -5.465 2.252 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.439 -2.138 2.546 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.025 -6.546 4.178 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.324 -3.217 4.485 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.137 -5.411 5.322 1.00 0.00 H new ATOM 140 N LEU A 9 6.216 -2.903 -2.341 1.00 0.00 N ATOM 141 CA LEU A 9 5.915 -1.845 -3.299 1.00 0.00 C ATOM 142 C LEU A 9 5.197 -0.729 -2.542 1.00 0.00 C ATOM 143 O LEU A 9 4.255 -1.005 -1.794 1.00 0.00 O ATOM 144 CB LEU A 9 5.050 -2.359 -4.456 1.00 0.00 C ATOM 145 CG LEU A 9 4.992 -1.338 -5.604 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.322 -1.228 -6.359 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.891 -1.723 -6.583 1.00 0.00 C ATOM 0 H LEU A 9 5.666 -3.756 -2.448 1.00 0.00 H new ATOM 0 HA LEU A 9 6.840 -1.476 -3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.454 -3.302 -4.825 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.042 -2.563 -4.096 1.00 0.00 H new ATOM 0 HG LEU A 9 4.783 -0.366 -5.157 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.227 -0.494 -7.159 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.106 -0.914 -5.670 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.580 -2.198 -6.785 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.855 -0.996 -7.394 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.097 -2.712 -6.991 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.932 -1.737 -6.065 1.00 0.00 H new ATOM 159 N VAL A 10 5.647 0.512 -2.723 1.00 0.00 N ATOM 160 CA VAL A 10 5.132 1.672 -2.001 1.00 0.00 C ATOM 161 C VAL A 10 5.016 2.804 -3.036 1.00 0.00 C ATOM 162 O VAL A 10 6.035 3.397 -3.411 1.00 0.00 O ATOM 163 CB VAL A 10 6.045 1.957 -0.775 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.782 3.313 -0.116 1.00 0.00 C ATOM 165 CG2 VAL A 10 5.978 0.893 0.333 1.00 0.00 C ATOM 0 H VAL A 10 6.389 0.742 -3.384 1.00 0.00 H new ATOM 0 HA VAL A 10 4.142 1.529 -1.567 1.00 0.00 H new ATOM 0 HB VAL A 10 7.038 1.944 -1.224 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.455 3.442 0.731 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.953 4.109 -0.841 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.750 3.355 0.231 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.646 1.173 1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 10 4.957 0.823 0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.283 -0.072 -0.071 1.00 0.00 H new ATOM 175 N VAL A 11 3.798 3.038 -3.546 1.00 0.00 N ATOM 176 CA VAL A 11 3.474 3.951 -4.649 1.00 0.00 C ATOM 177 C VAL A 11 2.609 5.100 -4.097 1.00 0.00 C ATOM 178 O VAL A 11 1.400 5.181 -4.341 1.00 0.00 O ATOM 179 CB VAL A 11 2.780 3.224 -5.831 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.903 4.061 -7.111 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.370 1.832 -6.085 1.00 0.00 C ATOM 0 H VAL A 11 2.969 2.570 -3.180 1.00 0.00 H new ATOM 0 HA VAL A 11 4.400 4.356 -5.058 1.00 0.00 H new ATOM 0 HB VAL A 11 1.732 3.102 -5.557 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.413 3.541 -7.934 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.428 5.030 -6.959 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.956 4.207 -7.350 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.851 1.364 -6.921 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.430 1.924 -6.321 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.249 1.217 -5.193 1.00 0.00 H new ATOM 191 N ASP A 12 3.204 5.976 -3.297 1.00 0.00 N ATOM 192 CA ASP A 12 2.537 7.191 -2.839 1.00 0.00 C ATOM 193 C ASP A 12 2.466 8.168 -4.017 1.00 0.00 C ATOM 194 O ASP A 12 3.360 8.179 -4.869 1.00 0.00 O ATOM 195 CB ASP A 12 3.314 7.848 -1.692 1.00 0.00 C ATOM 196 CG ASP A 12 3.460 6.968 -0.449 1.00 0.00 C ATOM 197 OD1 ASP A 12 4.149 5.927 -0.560 1.00 0.00 O ATOM 198 OD2 ASP A 12 2.946 7.363 0.616 1.00 0.00 O ATOM 0 H ASP A 12 4.156 5.867 -2.949 1.00 0.00 H new ATOM 0 HA ASP A 12 1.541 6.937 -2.476 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.307 8.120 -2.050 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.812 8.774 -1.411 1.00 0.00 H new ATOM 203 N ASP A 13 1.464 9.050 -4.056 1.00 0.00 N ATOM 204 CA ASP A 13 1.432 10.172 -5.005 1.00 0.00 C ATOM 205 C ASP A 13 2.447 11.238 -4.616 1.00 0.00 C ATOM 206 O ASP A 13 3.121 11.814 -5.465 1.00 0.00 O ATOM 207 CB ASP A 13 0.061 10.847 -5.030 1.00 0.00 C ATOM 208 CG ASP A 13 0.080 12.048 -5.983 1.00 0.00 C ATOM 209 OD1 ASP A 13 -0.160 11.843 -7.193 1.00 0.00 O ATOM 210 OD2 ASP A 13 0.372 13.196 -5.558 1.00 0.00 O ATOM 0 H ASP A 13 0.655 9.010 -3.436 1.00 0.00 H new ATOM 0 HA ASP A 13 1.663 9.753 -5.984 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.698 10.133 -5.348 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.210 11.174 -4.026 1.00 0.00 H new ATOM 215 N PHE A 14 2.522 11.519 -3.318 1.00 0.00 N ATOM 216 CA PHE A 14 3.308 12.582 -2.730 1.00 0.00 C ATOM 217 C PHE A 14 4.674 11.994 -2.395 1.00 0.00 C ATOM 218 O PHE A 14 4.761 11.087 -1.570 1.00 0.00 O ATOM 219 CB PHE A 14 2.536 13.090 -1.500 1.00 0.00 C ATOM 220 CG PHE A 14 3.207 14.122 -0.609 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.173 15.012 -1.114 1.00 0.00 C ATOM 222 CD2 PHE A 14 2.803 14.241 0.737 1.00 0.00 C ATOM 223 CE1 PHE A 14 4.692 16.024 -0.295 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.332 15.251 1.556 1.00 0.00 C ATOM 225 CZ PHE A 14 4.256 16.163 1.033 1.00 0.00 C ATOM 0 H PHE A 14 2.009 10.981 -2.620 1.00 0.00 H new ATOM 0 HA PHE A 14 3.469 13.434 -3.391 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.594 13.513 -1.849 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.288 12.227 -0.882 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.515 14.915 -2.134 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.080 13.548 1.142 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.434 16.703 -0.689 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.026 15.324 2.589 1.00 0.00 H new ATOM 0 HZ PHE A 14 4.631 16.969 1.647 1.00 0.00 H new ATOM 235 N SER A 15 5.743 12.477 -3.031 1.00 0.00 N ATOM 236 CA SER A 15 7.067 11.878 -2.894 1.00 0.00 C ATOM 237 C SER A 15 7.488 11.865 -1.423 1.00 0.00 C ATOM 238 O SER A 15 7.877 10.815 -0.913 1.00 0.00 O ATOM 239 CB SER A 15 8.079 12.624 -3.766 1.00 0.00 C ATOM 240 OG SER A 15 9.227 11.842 -4.029 1.00 0.00 O ATOM 0 H SER A 15 5.714 13.287 -3.650 1.00 0.00 H new ATOM 0 HA SER A 15 7.033 10.845 -3.240 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.608 12.906 -4.708 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.375 13.548 -3.269 1.00 0.00 H new ATOM 0 HG SER A 15 9.849 12.352 -4.590 1.00 0.00 H new ATOM 246 N THR A 16 7.344 12.984 -0.702 1.00 0.00 N ATOM 247 CA THR A 16 7.660 13.039 0.720 1.00 0.00 C ATOM 248 C THR A 16 6.923 11.940 1.494 1.00 0.00 C ATOM 249 O THR A 16 7.527 11.296 2.346 1.00 0.00 O ATOM 250 CB THR A 16 7.317 14.424 1.279 1.00 0.00 C ATOM 251 OG1 THR A 16 7.890 15.441 0.482 1.00 0.00 O ATOM 252 CG2 THR A 16 7.805 14.580 2.718 1.00 0.00 C ATOM 0 H THR A 16 7.008 13.866 -1.089 1.00 0.00 H new ATOM 0 HA THR A 16 8.729 12.866 0.843 1.00 0.00 H new ATOM 0 HB THR A 16 6.231 14.518 1.264 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.180 15.936 0.023 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.546 15.573 3.084 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.331 13.826 3.347 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.887 14.452 2.751 1.00 0.00 H new ATOM 260 N MET A 17 5.655 11.678 1.174 1.00 0.00 N ATOM 261 CA MET A 17 4.877 10.602 1.778 1.00 0.00 C ATOM 262 C MET A 17 5.569 9.257 1.546 1.00 0.00 C ATOM 263 O MET A 17 5.697 8.483 2.487 1.00 0.00 O ATOM 264 CB MET A 17 3.462 10.628 1.193 1.00 0.00 C ATOM 265 CG MET A 17 2.362 10.150 2.130 1.00 0.00 C ATOM 266 SD MET A 17 0.718 10.309 1.386 1.00 0.00 S ATOM 267 CE MET A 17 -0.302 10.054 2.856 1.00 0.00 C ATOM 0 H MET A 17 5.136 12.215 0.480 1.00 0.00 H new ATOM 0 HA MET A 17 4.807 10.743 2.857 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.234 11.647 0.882 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.446 10.010 0.295 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.540 9.108 2.396 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.398 10.726 3.055 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.352 10.012 2.567 1.00 0.00 H new ATOM 0 HE2 MET A 17 -0.020 9.117 3.336 1.00 0.00 H new ATOM 0 HE3 MET A 17 -0.150 10.879 3.552 1.00 0.00 H new ATOM 277 N ARG A 18 6.136 9.031 0.354 1.00 0.00 N ATOM 278 CA ARG A 18 6.866 7.818 -0.011 1.00 0.00 C ATOM 279 C ARG A 18 8.094 7.662 0.888 1.00 0.00 C ATOM 280 O ARG A 18 8.346 6.574 1.418 1.00 0.00 O ATOM 281 CB ARG A 18 7.225 7.915 -1.512 1.00 0.00 C ATOM 282 CG ARG A 18 7.136 6.591 -2.281 1.00 0.00 C ATOM 283 CD ARG A 18 7.310 6.793 -3.792 1.00 0.00 C ATOM 284 NE ARG A 18 8.586 7.439 -4.148 1.00 0.00 N ATOM 285 CZ ARG A 18 8.908 7.946 -5.345 1.00 0.00 C ATOM 286 NH1 ARG A 18 8.086 7.840 -6.385 1.00 0.00 N ATOM 287 NH2 ARG A 18 10.081 8.548 -5.482 1.00 0.00 N ATOM 0 H ARG A 18 6.096 9.712 -0.405 1.00 0.00 H new ATOM 0 HA ARG A 18 6.261 6.924 0.140 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.561 8.639 -1.984 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.239 8.305 -1.604 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.902 5.907 -1.916 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.171 6.122 -2.086 1.00 0.00 H new ATOM 0 HD2 ARG A 18 7.248 5.826 -4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.486 7.399 -4.168 1.00 0.00 H new ATOM 0 HE ARG A 18 9.290 7.506 -3.413 1.00 0.00 H new ATOM 0 HH11 ARG A 18 7.190 7.365 -6.280 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.352 8.234 -7.288 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.715 8.617 -4.686 1.00 0.00 H new ATOM 0 HH22 ARG A 18 10.350 8.942 -6.384 1.00 0.00 H new ATOM 301 N ARG A 19 8.860 8.751 1.066 1.00 0.00 N ATOM 302 CA ARG A 19 10.011 8.798 1.974 1.00 0.00 C ATOM 303 C ARG A 19 9.552 8.397 3.376 1.00 0.00 C ATOM 304 O ARG A 19 10.150 7.512 3.988 1.00 0.00 O ATOM 305 CB ARG A 19 10.663 10.198 2.041 1.00 0.00 C ATOM 306 CG ARG A 19 10.985 10.933 0.732 1.00 0.00 C ATOM 307 CD ARG A 19 12.129 10.346 -0.097 1.00 0.00 C ATOM 308 NE ARG A 19 12.615 11.361 -1.055 1.00 0.00 N ATOM 309 CZ ARG A 19 13.728 12.100 -0.965 1.00 0.00 C ATOM 310 NH1 ARG A 19 14.642 11.845 -0.037 1.00 0.00 N ATOM 311 NH2 ARG A 19 13.907 13.103 -1.815 1.00 0.00 N ATOM 0 H ARG A 19 8.693 9.631 0.577 1.00 0.00 H new ATOM 0 HA ARG A 19 10.761 8.107 1.588 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.004 10.840 2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.593 10.101 2.601 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.086 10.949 0.116 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.228 11.969 0.969 1.00 0.00 H new ATOM 0 HD2 ARG A 19 12.941 10.030 0.557 1.00 0.00 H new ATOM 0 HD3 ARG A 19 11.787 9.460 -0.632 1.00 0.00 H new ATOM 0 HE ARG A 19 12.036 11.517 -1.880 1.00 0.00 H new ATOM 0 HH11 ARG A 19 14.502 11.077 0.620 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.485 12.417 0.019 1.00 0.00 H new ATOM 0 HH21 ARG A 19 13.202 13.302 -2.525 1.00 0.00 H new ATOM 0 HH22 ARG A 19 14.750 13.675 -1.759 1.00 0.00 H new ATOM 325 N ILE A 20 8.495 9.051 3.866 1.00 0.00 N ATOM 326 CA ILE A 20 7.915 8.815 5.174 1.00 0.00 C ATOM 327 C ILE A 20 7.559 7.335 5.279 1.00 0.00 C ATOM 328 O ILE A 20 8.162 6.672 6.112 1.00 0.00 O ATOM 329 CB ILE A 20 6.780 9.830 5.476 1.00 0.00 C ATOM 330 CG1 ILE A 20 7.316 11.086 6.208 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.683 9.251 6.381 1.00 0.00 C ATOM 332 CD1 ILE A 20 8.337 11.937 5.449 1.00 0.00 C ATOM 0 H ILE A 20 8.011 9.779 3.341 1.00 0.00 H new ATOM 0 HA ILE A 20 8.626 9.008 5.978 1.00 0.00 H new ATOM 0 HB ILE A 20 6.371 10.079 4.497 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.467 11.720 6.464 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.769 10.766 7.146 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.918 10.008 6.556 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.232 8.385 5.897 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.119 8.949 7.333 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.634 12.785 6.066 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.214 11.332 5.216 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.891 12.301 4.523 1.00 0.00 H new ATOM 344 N VAL A 21 6.648 6.789 4.464 1.00 0.00 N ATOM 345 CA VAL A 21 6.204 5.396 4.533 1.00 0.00 C ATOM 346 C VAL A 21 7.406 4.448 4.605 1.00 0.00 C ATOM 347 O VAL A 21 7.393 3.542 5.436 1.00 0.00 O ATOM 348 CB VAL A 21 5.267 5.052 3.349 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.903 3.557 3.307 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.934 5.802 3.450 1.00 0.00 C ATOM 0 H VAL A 21 6.190 7.318 3.722 1.00 0.00 H new ATOM 0 HA VAL A 21 5.627 5.263 5.448 1.00 0.00 H new ATOM 0 HB VAL A 21 5.823 5.341 2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.245 3.366 2.459 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.812 2.964 3.201 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.395 3.280 4.231 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.302 5.536 2.603 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.432 5.528 4.378 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.119 6.876 3.442 1.00 0.00 H new ATOM 360 N ARG A 22 8.456 4.647 3.799 1.00 0.00 N ATOM 361 CA ARG A 22 9.649 3.821 3.852 1.00 0.00 C ATOM 362 C ARG A 22 10.327 3.897 5.218 1.00 0.00 C ATOM 363 O ARG A 22 10.694 2.857 5.764 1.00 0.00 O ATOM 364 CB ARG A 22 10.564 4.302 2.729 1.00 0.00 C ATOM 365 CG ARG A 22 10.034 3.827 1.376 1.00 0.00 C ATOM 366 CD ARG A 22 10.617 4.635 0.217 1.00 0.00 C ATOM 367 NE ARG A 22 9.762 4.434 -0.953 1.00 0.00 N ATOM 368 CZ ARG A 22 9.830 3.404 -1.792 1.00 0.00 C ATOM 369 NH1 ARG A 22 10.962 2.719 -1.941 1.00 0.00 N ATOM 370 NH2 ARG A 22 8.747 3.050 -2.467 1.00 0.00 N ATOM 0 H ARG A 22 8.494 5.385 3.096 1.00 0.00 H new ATOM 0 HA ARG A 22 9.399 2.769 3.714 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.626 5.390 2.742 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.574 3.923 2.885 1.00 0.00 H new ATOM 0 HG2 ARG A 22 10.277 2.773 1.241 1.00 0.00 H new ATOM 0 HG3 ARG A 22 8.947 3.908 1.364 1.00 0.00 H new ATOM 0 HD2 ARG A 22 10.665 5.693 0.476 1.00 0.00 H new ATOM 0 HD3 ARG A 22 11.636 4.313 0.003 1.00 0.00 H new ATOM 0 HE ARG A 22 9.054 5.144 -1.141 1.00 0.00 H new ATOM 0 HH11 ARG A 22 11.791 2.982 -1.408 1.00 0.00 H new ATOM 0 HH12 ARG A 22 11.000 1.931 -2.588 1.00 0.00 H new ATOM 0 HH21 ARG A 22 7.876 3.565 -2.340 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.784 2.262 -3.114 1.00 0.00 H new ATOM 384 N ASN A 23 10.489 5.091 5.788 1.00 0.00 N ATOM 385 CA ASN A 23 11.018 5.225 7.143 1.00 0.00 C ATOM 386 C ASN A 23 10.087 4.591 8.181 1.00 0.00 C ATOM 387 O ASN A 23 10.561 3.910 9.084 1.00 0.00 O ATOM 388 CB ASN A 23 11.268 6.692 7.492 1.00 0.00 C ATOM 389 CG ASN A 23 12.046 6.789 8.798 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.228 6.454 8.830 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.436 7.267 9.870 1.00 0.00 N ATOM 0 H ASN A 23 10.262 5.976 5.334 1.00 0.00 H new ATOM 0 HA ASN A 23 11.968 4.690 7.168 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.825 7.176 6.690 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.319 7.220 7.584 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.948 7.364 10.747 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.454 7.539 9.819 1.00 0.00 H new ATOM 398 N LEU A 24 8.769 4.790 8.063 1.00 0.00 N ATOM 399 CA LEU A 24 7.774 4.251 8.994 1.00 0.00 C ATOM 400 C LEU A 24 7.758 2.728 8.973 1.00 0.00 C ATOM 401 O LEU A 24 7.446 2.110 9.986 1.00 0.00 O ATOM 402 CB LEU A 24 6.346 4.709 8.658 1.00 0.00 C ATOM 403 CG LEU A 24 6.070 6.217 8.630 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.577 6.417 8.368 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.580 6.959 9.867 1.00 0.00 C ATOM 0 H LEU A 24 8.359 5.338 7.307 1.00 0.00 H new ATOM 0 HA LEU A 24 8.068 4.628 9.973 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.084 4.302 7.681 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.669 4.257 9.384 1.00 0.00 H new ATOM 0 HG LEU A 24 6.642 6.671 7.821 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.352 7.483 8.343 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.312 5.967 7.411 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.001 5.943 9.163 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.349 8.020 9.776 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.096 6.557 10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.659 6.829 9.950 1.00 0.00 H new ATOM 417 N LEU A 25 8.040 2.128 7.817 1.00 0.00 N ATOM 418 CA LEU A 25 8.267 0.701 7.688 1.00 0.00 C ATOM 419 C LEU A 25 9.529 0.355 8.459 1.00 0.00 C ATOM 420 O LEU A 25 9.460 -0.456 9.375 1.00 0.00 O ATOM 421 CB LEU A 25 8.360 0.301 6.204 1.00 0.00 C ATOM 422 CG LEU A 25 6.953 0.107 5.614 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.922 0.364 4.107 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.438 -1.307 5.888 1.00 0.00 C ATOM 0 H LEU A 25 8.117 2.633 6.934 1.00 0.00 H new ATOM 0 HA LEU A 25 7.432 0.138 8.105 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.893 1.071 5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.934 -0.620 6.104 1.00 0.00 H new ATOM 0 HG LEU A 25 6.307 0.836 6.103 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.909 0.215 3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.236 1.388 3.906 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.599 -0.328 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.441 -1.420 5.461 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.112 -2.034 5.434 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.393 -1.476 6.964 1.00 0.00 H new ATOM 436 N LYS A 26 10.661 0.989 8.138 1.00 0.00 N ATOM 437 CA LYS A 26 11.960 0.652 8.720 1.00 0.00 C ATOM 438 C LYS A 26 12.074 0.905 10.219 1.00 0.00 C ATOM 439 O LYS A 26 12.908 0.248 10.842 1.00 0.00 O ATOM 440 CB LYS A 26 13.082 1.339 7.937 1.00 0.00 C ATOM 441 CG LYS A 26 13.271 0.598 6.607 1.00 0.00 C ATOM 442 CD LYS A 26 14.557 1.021 5.900 1.00 0.00 C ATOM 443 CE LYS A 26 14.959 -0.099 4.938 1.00 0.00 C ATOM 444 NZ LYS A 26 16.406 -0.106 4.674 1.00 0.00 N ATOM 0 H LYS A 26 10.700 1.754 7.464 1.00 0.00 H new ATOM 0 HA LYS A 26 12.063 -0.429 8.625 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.833 2.385 7.756 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.008 1.327 8.512 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.293 -0.476 6.789 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.418 0.794 5.957 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.404 1.953 5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.349 1.202 6.626 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.662 -1.061 5.357 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.420 0.019 3.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.655 -0.956 4.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.664 0.742 4.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.923 -0.108 5.576 1.00 0.00 H new ATOM 458 N GLU A 27 11.221 1.732 10.819 1.00 0.00 N ATOM 459 CA GLU A 27 11.033 1.795 12.270 1.00 0.00 C ATOM 460 C GLU A 27 10.764 0.398 12.846 1.00 0.00 C ATOM 461 O GLU A 27 11.161 0.088 13.971 1.00 0.00 O ATOM 462 CB GLU A 27 9.830 2.701 12.581 1.00 0.00 C ATOM 463 CG GLU A 27 10.159 4.195 12.535 1.00 0.00 C ATOM 464 CD GLU A 27 10.815 4.626 13.841 1.00 0.00 C ATOM 465 OE1 GLU A 27 10.079 4.930 14.812 1.00 0.00 O ATOM 466 OE2 GLU A 27 12.063 4.600 13.928 1.00 0.00 O ATOM 0 H GLU A 27 10.632 2.387 10.305 1.00 0.00 H new ATOM 0 HA GLU A 27 11.941 2.194 12.723 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.034 2.491 11.867 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.445 2.453 13.570 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.825 4.403 11.698 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.249 4.771 12.369 1.00 0.00 H new ATOM 473 N LEU A 28 10.087 -0.449 12.077 1.00 0.00 N ATOM 474 CA LEU A 28 9.577 -1.757 12.455 1.00 0.00 C ATOM 475 C LEU A 28 10.417 -2.858 11.804 1.00 0.00 C ATOM 476 O LEU A 28 10.730 -3.847 12.462 1.00 0.00 O ATOM 477 CB LEU A 28 8.105 -1.879 12.021 1.00 0.00 C ATOM 478 CG LEU A 28 7.213 -0.664 12.345 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.846 -0.869 11.701 1.00 0.00 C ATOM 480 CD2 LEU A 28 7.056 -0.436 13.848 1.00 0.00 C ATOM 0 H LEU A 28 9.867 -0.221 11.107 1.00 0.00 H new ATOM 0 HA LEU A 28 9.640 -1.870 13.537 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.075 -2.053 10.945 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.676 -2.760 12.498 1.00 0.00 H new ATOM 0 HG LEU A 28 7.697 0.225 11.941 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.207 -0.015 11.924 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.963 -0.963 10.621 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.390 -1.777 12.097 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.419 0.431 14.020 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.602 -1.316 14.304 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.035 -0.261 14.294 1.00 0.00 H new ATOM 492 N GLY A 29 10.797 -2.691 10.535 1.00 0.00 N ATOM 493 CA GLY A 29 11.515 -3.666 9.730 1.00 0.00 C ATOM 494 C GLY A 29 11.179 -3.431 8.262 1.00 0.00 C ATOM 495 O GLY A 29 11.052 -2.290 7.836 1.00 0.00 O ATOM 0 H GLY A 29 10.601 -1.831 10.023 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.589 -3.572 9.891 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.236 -4.678 10.024 1.00 0.00 H new ATOM 499 N PHE A 30 10.983 -4.501 7.501 1.00 0.00 N ATOM 500 CA PHE A 30 10.384 -4.478 6.164 1.00 0.00 C ATOM 501 C PHE A 30 11.281 -3.707 5.193 1.00 0.00 C ATOM 502 O PHE A 30 10.928 -2.670 4.627 1.00 0.00 O ATOM 503 CB PHE A 30 8.932 -3.982 6.245 1.00 0.00 C ATOM 504 CG PHE A 30 8.131 -4.658 7.345 1.00 0.00 C ATOM 505 CD1 PHE A 30 7.712 -5.993 7.198 1.00 0.00 C ATOM 506 CD2 PHE A 30 7.891 -3.982 8.558 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.040 -6.644 8.247 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.248 -4.646 9.618 1.00 0.00 C ATOM 509 CZ PHE A 30 6.816 -5.972 9.461 1.00 0.00 C ATOM 0 H PHE A 30 11.243 -5.440 7.803 1.00 0.00 H new ATOM 0 HA PHE A 30 10.322 -5.486 5.753 1.00 0.00 H new ATOM 0 HB2 PHE A 30 8.931 -2.905 6.413 1.00 0.00 H new ATOM 0 HB3 PHE A 30 8.441 -4.156 5.287 1.00 0.00 H new ATOM 0 HD1 PHE A 30 7.907 -6.520 6.276 1.00 0.00 H new ATOM 0 HD2 PHE A 30 8.201 -2.954 8.674 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.696 -7.660 8.120 1.00 0.00 H new ATOM 0 HE2 PHE A 30 7.086 -4.134 10.555 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.312 -6.476 10.272 1.00 0.00 H new ATOM 519 N ASN A 31 12.498 -4.228 5.055 1.00 0.00 N ATOM 520 CA ASN A 31 13.500 -3.729 4.129 1.00 0.00 C ATOM 521 C ASN A 31 13.094 -4.038 2.675 1.00 0.00 C ATOM 522 O ASN A 31 12.106 -4.713 2.406 1.00 0.00 O ATOM 523 CB ASN A 31 14.865 -4.334 4.516 1.00 0.00 C ATOM 524 CG ASN A 31 16.048 -3.677 3.814 1.00 0.00 C ATOM 525 OD1 ASN A 31 15.962 -2.550 3.325 1.00 0.00 O ATOM 526 ND2 ASN A 31 17.171 -4.351 3.720 1.00 0.00 N ATOM 0 H ASN A 31 12.818 -5.029 5.600 1.00 0.00 H new ATOM 0 HA ASN A 31 13.579 -2.644 4.193 1.00 0.00 H new ATOM 0 HB2 ASN A 31 14.999 -4.246 5.594 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.860 -5.398 4.281 1.00 0.00 H new ATOM 0 HD21 ASN A 31 17.973 -3.941 3.242 1.00 0.00 H new ATOM 0 HD22 ASN A 31 17.241 -5.284 4.125 1.00 0.00 H new ATOM 533 N ASN A 32 13.894 -3.561 1.724 1.00 0.00 N ATOM 534 CA ASN A 32 13.757 -3.730 0.281 1.00 0.00 C ATOM 535 C ASN A 32 12.418 -3.248 -0.262 1.00 0.00 C ATOM 536 O ASN A 32 11.776 -3.911 -1.066 1.00 0.00 O ATOM 537 CB ASN A 32 14.134 -5.149 -0.191 1.00 0.00 C ATOM 538 CG ASN A 32 14.910 -5.049 -1.502 1.00 0.00 C ATOM 539 OD1 ASN A 32 15.949 -4.398 -1.550 1.00 0.00 O ATOM 540 ND2 ASN A 32 14.456 -5.621 -2.601 1.00 0.00 N ATOM 0 H ASN A 32 14.716 -3.005 1.961 1.00 0.00 H new ATOM 0 HA ASN A 32 14.496 -3.064 -0.165 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.738 -5.649 0.566 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.236 -5.750 -0.331 1.00 0.00 H new ATOM 0 HD21 ASN A 32 14.968 -5.519 -3.478 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.593 -6.165 -2.574 1.00 0.00 H new ATOM 547 N VAL A 33 12.007 -2.048 0.119 1.00 0.00 N ATOM 548 CA VAL A 33 10.930 -1.333 -0.555 1.00 0.00 C ATOM 549 C VAL A 33 11.217 -1.176 -2.064 1.00 0.00 C ATOM 550 O VAL A 33 12.360 -1.301 -2.507 1.00 0.00 O ATOM 551 CB VAL A 33 10.706 0.018 0.152 1.00 0.00 C ATOM 552 CG1 VAL A 33 9.869 -0.179 1.425 1.00 0.00 C ATOM 553 CG2 VAL A 33 12.057 0.696 0.467 1.00 0.00 C ATOM 0 H VAL A 33 12.411 -1.540 0.906 1.00 0.00 H new ATOM 0 HA VAL A 33 10.008 -1.910 -0.488 1.00 0.00 H new ATOM 0 HB VAL A 33 10.152 0.677 -0.517 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.719 0.783 1.914 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.902 -0.607 1.162 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.392 -0.853 2.104 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.878 1.648 0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.645 0.050 1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.602 0.869 -0.461 1.00 0.00 H new ATOM 563 N GLU A 34 10.193 -0.885 -2.866 1.00 0.00 N ATOM 564 CA GLU A 34 10.244 -0.754 -4.324 1.00 0.00 C ATOM 565 C GLU A 34 9.315 0.400 -4.719 1.00 0.00 C ATOM 566 O GLU A 34 8.410 0.758 -3.952 1.00 0.00 O ATOM 567 CB GLU A 34 9.816 -2.088 -4.970 1.00 0.00 C ATOM 568 CG GLU A 34 10.786 -2.624 -6.038 1.00 0.00 C ATOM 569 CD GLU A 34 10.533 -2.021 -7.418 1.00 0.00 C ATOM 570 OE1 GLU A 34 10.846 -0.831 -7.634 1.00 0.00 O ATOM 571 OE2 GLU A 34 10.031 -2.763 -8.297 1.00 0.00 O ATOM 0 H GLU A 34 9.255 -0.726 -2.498 1.00 0.00 H new ATOM 0 HA GLU A 34 11.252 -0.533 -4.674 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.709 -2.838 -4.186 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.833 -1.958 -5.423 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.810 -2.409 -5.734 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.692 -3.708 -6.097 1.00 0.00 H new ATOM 578 N GLU A 35 9.528 1.001 -5.887 1.00 0.00 N ATOM 579 CA GLU A 35 8.898 2.244 -6.321 1.00 0.00 C ATOM 580 C GLU A 35 8.324 2.057 -7.708 1.00 0.00 C ATOM 581 O GLU A 35 9.079 1.812 -8.652 1.00 0.00 O ATOM 582 CB GLU A 35 9.920 3.401 -6.390 1.00 0.00 C ATOM 583 CG GLU A 35 10.239 3.931 -5.001 1.00 0.00 C ATOM 584 CD GLU A 35 11.305 5.020 -4.903 1.00 0.00 C ATOM 585 OE1 GLU A 35 12.187 5.137 -5.784 1.00 0.00 O ATOM 586 OE2 GLU A 35 11.366 5.683 -3.842 1.00 0.00 O ATOM 0 H GLU A 35 10.169 0.620 -6.583 1.00 0.00 H new ATOM 0 HA GLU A 35 8.121 2.491 -5.598 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.835 3.054 -6.870 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.522 4.206 -7.008 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.318 4.319 -4.566 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.555 3.091 -4.382 1.00 0.00 H new ATOM 593 N ALA A 36 7.003 2.174 -7.825 1.00 0.00 N ATOM 594 CA ALA A 36 6.422 2.481 -9.118 1.00 0.00 C ATOM 595 C ALA A 36 6.288 4.002 -9.142 1.00 0.00 C ATOM 596 O ALA A 36 6.323 4.631 -8.077 1.00 0.00 O ATOM 597 CB ALA A 36 5.065 1.809 -9.272 1.00 0.00 C ATOM 0 H ALA A 36 6.336 2.064 -7.061 1.00 0.00 H new ATOM 0 HA ALA A 36 7.037 2.117 -9.941 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.647 2.053 -10.249 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.182 0.729 -9.187 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.393 2.164 -8.491 1.00 0.00 H new ATOM 603 N GLU A 37 6.093 4.612 -10.303 1.00 0.00 N ATOM 604 CA GLU A 37 5.804 6.039 -10.351 1.00 0.00 C ATOM 605 C GLU A 37 4.348 6.305 -9.943 1.00 0.00 C ATOM 606 O GLU A 37 4.081 7.277 -9.236 1.00 0.00 O ATOM 607 CB GLU A 37 6.179 6.636 -11.716 1.00 0.00 C ATOM 608 CG GLU A 37 5.501 5.972 -12.922 1.00 0.00 C ATOM 609 CD GLU A 37 5.782 6.728 -14.219 1.00 0.00 C ATOM 610 OE1 GLU A 37 5.480 7.943 -14.290 1.00 0.00 O ATOM 611 OE2 GLU A 37 6.303 6.116 -15.182 1.00 0.00 O ATOM 0 H GLU A 37 6.129 4.150 -11.212 1.00 0.00 H new ATOM 0 HA GLU A 37 6.429 6.555 -9.622 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.926 7.696 -11.714 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.259 6.566 -11.842 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.853 4.945 -13.017 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.425 5.926 -12.754 1.00 0.00 H new ATOM 618 N ASP A 38 3.410 5.433 -10.323 1.00 0.00 N ATOM 619 CA ASP A 38 1.969 5.646 -10.212 1.00 0.00 C ATOM 620 C ASP A 38 1.256 4.293 -10.239 1.00 0.00 C ATOM 621 O ASP A 38 1.898 3.262 -10.416 1.00 0.00 O ATOM 622 CB ASP A 38 1.458 6.591 -11.327 1.00 0.00 C ATOM 623 CG ASP A 38 1.182 5.991 -12.715 1.00 0.00 C ATOM 624 OD1 ASP A 38 1.384 4.788 -12.966 1.00 0.00 O ATOM 625 OD2 ASP A 38 0.671 6.736 -13.581 1.00 0.00 O ATOM 0 H ASP A 38 3.644 4.528 -10.731 1.00 0.00 H new ATOM 0 HA ASP A 38 1.747 6.135 -9.264 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.536 7.054 -10.975 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.190 7.390 -11.449 1.00 0.00 H new ATOM 630 N GLY A 39 -0.062 4.271 -10.041 1.00 0.00 N ATOM 631 CA GLY A 39 -0.874 3.059 -10.046 1.00 0.00 C ATOM 632 C GLY A 39 -0.815 2.215 -11.330 1.00 0.00 C ATOM 633 O GLY A 39 -0.885 0.991 -11.236 1.00 0.00 O ATOM 0 H GLY A 39 -0.606 5.117 -9.869 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.563 2.434 -9.209 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.912 3.340 -9.866 1.00 0.00 H new ATOM 637 N VAL A 40 -0.702 2.797 -12.527 1.00 0.00 N ATOM 638 CA VAL A 40 -0.584 2.009 -13.759 1.00 0.00 C ATOM 639 C VAL A 40 0.755 1.275 -13.698 1.00 0.00 C ATOM 640 O VAL A 40 0.818 0.054 -13.862 1.00 0.00 O ATOM 641 CB VAL A 40 -0.752 2.925 -14.995 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.262 2.289 -16.303 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.234 3.299 -15.181 1.00 0.00 C ATOM 0 H VAL A 40 -0.690 3.807 -12.670 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.374 1.264 -13.852 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.137 3.803 -14.795 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.411 2.988 -17.126 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.798 2.051 -16.217 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -0.825 1.376 -16.497 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.340 3.944 -16.054 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.823 2.393 -15.326 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.590 3.826 -14.296 1.00 0.00 H new ATOM 653 N ASP A 41 1.812 2.018 -13.381 1.00 0.00 N ATOM 654 CA ASP A 41 3.149 1.489 -13.220 1.00 0.00 C ATOM 655 C ASP A 41 3.220 0.501 -12.047 1.00 0.00 C ATOM 656 O ASP A 41 4.008 -0.442 -12.116 1.00 0.00 O ATOM 657 CB ASP A 41 4.121 2.662 -13.063 1.00 0.00 C ATOM 658 CG ASP A 41 5.572 2.207 -13.150 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.969 1.621 -14.183 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.334 2.453 -12.194 1.00 0.00 O ATOM 0 H ASP A 41 1.754 3.025 -13.227 1.00 0.00 H new ATOM 0 HA ASP A 41 3.434 0.918 -14.104 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.925 3.403 -13.838 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.950 3.151 -12.104 1.00 0.00 H new ATOM 665 N ALA A 42 2.377 0.648 -11.010 1.00 0.00 N ATOM 666 CA ALA A 42 2.268 -0.239 -9.871 1.00 0.00 C ATOM 667 C ALA A 42 1.780 -1.593 -10.333 1.00 0.00 C ATOM 668 O ALA A 42 2.471 -2.575 -10.093 1.00 0.00 O ATOM 669 CB ALA A 42 1.317 0.331 -8.811 1.00 0.00 C ATOM 0 H ALA A 42 1.727 1.432 -10.954 1.00 0.00 H new ATOM 0 HA ALA A 42 3.253 -0.340 -9.415 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.256 -0.358 -7.968 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.692 1.294 -8.466 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.326 0.462 -9.245 1.00 0.00 H new ATOM 675 N LEU A 43 0.625 -1.648 -11.005 1.00 0.00 N ATOM 676 CA LEU A 43 0.059 -2.893 -11.518 1.00 0.00 C ATOM 677 C LEU A 43 1.085 -3.602 -12.401 1.00 0.00 C ATOM 678 O LEU A 43 1.321 -4.803 -12.262 1.00 0.00 O ATOM 679 CB LEU A 43 -1.224 -2.597 -12.307 1.00 0.00 C ATOM 680 CG LEU A 43 -1.983 -3.889 -12.672 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.875 -4.343 -11.513 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.828 -3.667 -13.929 1.00 0.00 C ATOM 0 H LEU A 43 0.057 -0.825 -11.207 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.192 -3.548 -10.684 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.872 -1.949 -11.717 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.973 -2.053 -13.218 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.250 -4.672 -12.869 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.400 -5.256 -11.794 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.260 -4.534 -10.634 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.601 -3.562 -11.285 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.359 -4.586 -14.177 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.548 -2.869 -13.747 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.179 -3.388 -14.759 1.00 0.00 H new ATOM 694 N ASN A 44 1.727 -2.838 -13.286 1.00 0.00 N ATOM 695 CA ASN A 44 2.751 -3.348 -14.180 1.00 0.00 C ATOM 696 C ASN A 44 4.002 -3.820 -13.420 1.00 0.00 C ATOM 697 O ASN A 44 4.660 -4.759 -13.868 1.00 0.00 O ATOM 698 CB ASN A 44 3.066 -2.267 -15.211 1.00 0.00 C ATOM 699 CG ASN A 44 3.949 -2.804 -16.323 1.00 0.00 C ATOM 700 OD1 ASN A 44 3.486 -3.586 -17.152 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.209 -2.412 -16.371 1.00 0.00 N ATOM 0 H ASN A 44 1.545 -1.841 -13.398 1.00 0.00 H new ATOM 0 HA ASN A 44 2.380 -4.236 -14.693 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.137 -1.884 -15.634 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.563 -1.429 -14.722 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.823 -2.759 -17.108 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.568 -1.763 -15.671 1.00 0.00 H new ATOM 708 N LYS A 45 4.313 -3.239 -12.251 1.00 0.00 N ATOM 709 CA LYS A 45 5.296 -3.772 -11.306 1.00 0.00 C ATOM 710 C LYS A 45 4.815 -5.131 -10.811 1.00 0.00 C ATOM 711 O LYS A 45 5.571 -6.085 -10.913 1.00 0.00 O ATOM 712 CB LYS A 45 5.556 -2.817 -10.113 1.00 0.00 C ATOM 713 CG LYS A 45 7.001 -2.311 -10.004 1.00 0.00 C ATOM 714 CD LYS A 45 7.335 -1.290 -11.092 1.00 0.00 C ATOM 715 CE LYS A 45 8.641 -0.524 -10.847 1.00 0.00 C ATOM 716 NZ LYS A 45 9.827 -1.395 -10.714 1.00 0.00 N ATOM 0 H LYS A 45 3.879 -2.372 -11.934 1.00 0.00 H new ATOM 0 HA LYS A 45 6.248 -3.875 -11.827 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.890 -1.959 -10.200 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.294 -3.332 -9.189 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.154 -1.859 -9.024 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.687 -3.155 -10.076 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.402 -1.804 -12.051 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.516 -0.576 -11.170 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.803 0.172 -11.670 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.537 0.073 -9.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.685 -0.809 -10.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.748 -1.959 -9.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.885 -2.031 -11.535 1.00 0.00 H new ATOM 730 N LEU A 46 3.581 -5.254 -10.303 1.00 0.00 N ATOM 731 CA LEU A 46 3.064 -6.517 -9.760 1.00 0.00 C ATOM 732 C LEU A 46 3.200 -7.649 -10.775 1.00 0.00 C ATOM 733 O LEU A 46 3.572 -8.761 -10.408 1.00 0.00 O ATOM 734 CB LEU A 46 1.589 -6.432 -9.325 1.00 0.00 C ATOM 735 CG LEU A 46 1.169 -5.177 -8.575 1.00 0.00 C ATOM 736 CD1 LEU A 46 -0.303 -5.277 -8.247 1.00 0.00 C ATOM 737 CD2 LEU A 46 1.939 -4.879 -7.296 1.00 0.00 C ATOM 0 H LEU A 46 2.915 -4.483 -10.257 1.00 0.00 H new ATOM 0 HA LEU A 46 3.670 -6.721 -8.877 1.00 0.00 H new ATOM 0 HB2 LEU A 46 0.966 -6.521 -10.215 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.370 -7.294 -8.695 1.00 0.00 H new ATOM 0 HG LEU A 46 1.398 -4.349 -9.246 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.617 -4.383 -7.709 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.876 -5.365 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.478 -6.155 -7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.556 -3.963 -6.846 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.817 -5.706 -6.597 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.997 -4.754 -7.529 1.00 0.00 H new ATOM 749 N GLN A 47 2.910 -7.375 -12.049 1.00 0.00 N ATOM 750 CA GLN A 47 3.021 -8.372 -13.108 1.00 0.00 C ATOM 751 C GLN A 47 4.471 -8.726 -13.483 1.00 0.00 C ATOM 752 O GLN A 47 4.676 -9.678 -14.242 1.00 0.00 O ATOM 753 CB GLN A 47 2.202 -7.931 -14.330 1.00 0.00 C ATOM 754 CG GLN A 47 0.689 -7.970 -14.051 1.00 0.00 C ATOM 755 CD GLN A 47 -0.106 -8.180 -15.337 1.00 0.00 C ATOM 756 OE1 GLN A 47 -0.714 -7.266 -15.886 1.00 0.00 O ATOM 757 NE2 GLN A 47 -0.082 -9.379 -15.892 1.00 0.00 N ATOM 0 H GLN A 47 2.594 -6.460 -12.371 1.00 0.00 H new ATOM 0 HA GLN A 47 2.604 -9.300 -12.716 1.00 0.00 H new ATOM 0 HB2 GLN A 47 2.492 -6.920 -14.616 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.432 -8.580 -15.175 1.00 0.00 H new ATOM 0 HG2 GLN A 47 0.467 -8.773 -13.348 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.380 -7.038 -13.578 1.00 0.00 H new ATOM 0 HE21 GLN A 47 0.422 -10.141 -15.439 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -0.568 -9.543 -16.774 1.00 0.00 H new ATOM 766 N ALA A 48 5.476 -8.028 -12.950 1.00 0.00 N ATOM 767 CA ALA A 48 6.876 -8.435 -13.034 1.00 0.00 C ATOM 768 C ALA A 48 7.198 -9.560 -12.045 1.00 0.00 C ATOM 769 O ALA A 48 8.213 -10.237 -12.227 1.00 0.00 O ATOM 770 CB ALA A 48 7.809 -7.251 -12.764 1.00 0.00 C ATOM 0 H ALA A 48 5.337 -7.154 -12.442 1.00 0.00 H new ATOM 0 HA ALA A 48 7.037 -8.801 -14.048 1.00 0.00 H new ATOM 0 HB1 ALA A 48 8.845 -7.581 -12.833 1.00 0.00 H new ATOM 0 HB2 ALA A 48 7.628 -6.469 -13.502 1.00 0.00 H new ATOM 0 HB3 ALA A 48 7.619 -6.858 -11.765 1.00 0.00 H new ATOM 776 N GLY A 49 6.370 -9.796 -11.023 1.00 0.00 N ATOM 777 CA GLY A 49 6.509 -10.904 -10.086 1.00 0.00 C ATOM 778 C GLY A 49 5.959 -10.546 -8.710 1.00 0.00 C ATOM 779 O GLY A 49 5.633 -9.393 -8.438 1.00 0.00 O ATOM 0 H GLY A 49 5.564 -9.203 -10.823 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.983 -11.777 -10.473 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.560 -11.178 -9.999 1.00 0.00 H new ATOM 783 N GLY A 50 5.844 -11.543 -7.835 1.00 0.00 N ATOM 784 CA GLY A 50 5.170 -11.431 -6.549 1.00 0.00 C ATOM 785 C GLY A 50 5.889 -10.509 -5.570 1.00 0.00 C ATOM 786 O GLY A 50 6.954 -10.875 -5.064 1.00 0.00 O ATOM 0 H GLY A 50 6.227 -12.472 -8.008 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.157 -11.061 -6.708 1.00 0.00 H new ATOM 0 HA3 GLY A 50 5.081 -12.423 -6.105 1.00 0.00 H new ATOM 790 N TYR A 51 5.337 -9.326 -5.299 1.00 0.00 N ATOM 791 CA TYR A 51 5.740 -8.458 -4.189 1.00 0.00 C ATOM 792 C TYR A 51 5.188 -9.038 -2.886 1.00 0.00 C ATOM 793 O TYR A 51 4.267 -9.854 -2.905 1.00 0.00 O ATOM 794 CB TYR A 51 5.224 -7.026 -4.431 1.00 0.00 C ATOM 795 CG TYR A 51 6.002 -6.327 -5.530 1.00 0.00 C ATOM 796 CD1 TYR A 51 5.834 -6.728 -6.864 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.983 -5.372 -5.222 1.00 0.00 C ATOM 798 CE1 TYR A 51 6.708 -6.284 -7.865 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.825 -4.878 -6.232 1.00 0.00 C ATOM 800 CZ TYR A 51 7.715 -5.353 -7.556 1.00 0.00 C ATOM 801 OH TYR A 51 8.587 -4.961 -8.523 1.00 0.00 O ATOM 0 H TYR A 51 4.579 -8.934 -5.858 1.00 0.00 H new ATOM 0 HA TYR A 51 6.827 -8.411 -4.119 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.168 -7.060 -4.698 1.00 0.00 H new ATOM 0 HB3 TYR A 51 5.301 -6.451 -3.508 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.019 -7.388 -7.123 1.00 0.00 H new ATOM 0 HD2 TYR A 51 7.091 -5.017 -4.208 1.00 0.00 H new ATOM 0 HE1 TYR A 51 6.608 -6.657 -8.874 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.564 -4.127 -5.993 1.00 0.00 H new ATOM 0 HH TYR A 51 8.877 -4.041 -8.349 1.00 0.00 H new ATOM 811 N GLY A 52 5.710 -8.604 -1.737 1.00 0.00 N ATOM 812 CA GLY A 52 5.050 -8.879 -0.468 1.00 0.00 C ATOM 813 C GLY A 52 3.837 -7.973 -0.309 1.00 0.00 C ATOM 814 O GLY A 52 2.761 -8.427 0.067 1.00 0.00 O ATOM 0 H GLY A 52 6.575 -8.069 -1.663 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.742 -9.924 -0.427 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.745 -8.719 0.356 1.00 0.00 H new ATOM 818 N PHE A 53 4.013 -6.685 -0.620 1.00 0.00 N ATOM 819 CA PHE A 53 3.071 -5.636 -0.266 1.00 0.00 C ATOM 820 C PHE A 53 2.817 -4.675 -1.412 1.00 0.00 C ATOM 821 O PHE A 53 3.715 -4.438 -2.222 1.00 0.00 O ATOM 822 CB PHE A 53 3.617 -4.882 0.950 1.00 0.00 C ATOM 823 CG PHE A 53 2.984 -5.309 2.249 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.352 -6.519 2.864 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.017 -4.486 2.842 1.00 0.00 C ATOM 826 CE1 PHE A 53 2.748 -6.904 4.072 1.00 0.00 C ATOM 827 CE2 PHE A 53 1.431 -4.862 4.057 1.00 0.00 C ATOM 828 CZ PHE A 53 1.783 -6.078 4.670 1.00 0.00 C ATOM 0 H PHE A 53 4.827 -6.344 -1.132 1.00 0.00 H new ATOM 0 HA PHE A 53 2.112 -6.099 -0.031 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.694 -5.036 1.011 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.455 -3.813 0.809 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.099 -7.152 2.408 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.724 -3.563 2.363 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.026 -7.836 4.541 1.00 0.00 H new ATOM 0 HE2 PHE A 53 0.705 -4.215 4.526 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.313 -6.375 5.596 1.00 0.00 H new ATOM 838 N VAL A 54 1.607 -4.104 -1.428 1.00 0.00 N ATOM 839 CA VAL A 54 1.120 -3.197 -2.465 1.00 0.00 C ATOM 840 C VAL A 54 0.507 -1.962 -1.790 1.00 0.00 C ATOM 841 O VAL A 54 -0.707 -1.761 -1.755 1.00 0.00 O ATOM 842 CB VAL A 54 0.131 -3.933 -3.397 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.011 -3.216 -4.744 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.552 -5.366 -3.696 1.00 0.00 C ATOM 0 H VAL A 54 0.919 -4.268 -0.693 1.00 0.00 H new ATOM 0 HA VAL A 54 1.939 -2.858 -3.099 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.818 -3.937 -2.861 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.691 -3.754 -5.381 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.349 -2.200 -4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.988 -3.183 -5.227 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.181 -5.831 -4.355 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.527 -5.365 -4.182 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.612 -5.929 -2.765 1.00 0.00 H new ATOM 854 N ILE A 55 1.374 -1.144 -1.195 1.00 0.00 N ATOM 855 CA ILE A 55 0.995 0.096 -0.531 1.00 0.00 C ATOM 856 C ILE A 55 0.886 1.171 -1.606 1.00 0.00 C ATOM 857 O ILE A 55 1.776 1.282 -2.454 1.00 0.00 O ATOM 858 CB ILE A 55 1.996 0.427 0.604 1.00 0.00 C ATOM 859 CG1 ILE A 55 2.360 -0.865 1.386 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.445 1.539 1.507 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.982 -0.704 2.777 1.00 0.00 C ATOM 0 H ILE A 55 2.376 -1.330 -1.162 1.00 0.00 H new ATOM 0 HA ILE A 55 0.028 0.017 -0.035 1.00 0.00 H new ATOM 0 HB ILE A 55 2.920 0.812 0.173 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.453 -1.460 1.491 1.00 0.00 H new ATOM 0 HG13 ILE A 55 3.052 -1.444 0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.164 1.756 2.297 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.275 2.438 0.915 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.504 1.214 1.951 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.183 -1.688 3.202 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.915 -0.146 2.696 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.291 -0.163 3.424 1.00 0.00 H new ATOM 873 N SER A 56 -0.205 1.936 -1.634 1.00 0.00 N ATOM 874 CA SER A 56 -0.366 3.016 -2.601 1.00 0.00 C ATOM 875 C SER A 56 -1.235 4.137 -2.030 1.00 0.00 C ATOM 876 O SER A 56 -2.015 3.926 -1.090 1.00 0.00 O ATOM 877 CB SER A 56 -0.974 2.464 -3.902 1.00 0.00 C ATOM 878 OG SER A 56 -0.196 1.387 -4.410 1.00 0.00 O ATOM 0 H SER A 56 -0.992 1.825 -0.995 1.00 0.00 H new ATOM 0 HA SER A 56 0.615 3.437 -2.820 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.993 2.125 -3.717 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.032 3.258 -4.646 1.00 0.00 H new ATOM 0 HG SER A 56 -0.140 1.455 -5.386 1.00 0.00 H new ATOM 884 N ASP A 57 -1.093 5.325 -2.614 1.00 0.00 N ATOM 885 CA ASP A 57 -2.035 6.426 -2.405 1.00 0.00 C ATOM 886 C ASP A 57 -3.322 6.196 -3.221 1.00 0.00 C ATOM 887 O ASP A 57 -3.410 5.279 -4.043 1.00 0.00 O ATOM 888 CB ASP A 57 -1.352 7.769 -2.718 1.00 0.00 C ATOM 889 CG ASP A 57 -2.320 8.952 -2.649 1.00 0.00 C ATOM 890 OD1 ASP A 57 -2.952 9.199 -1.596 1.00 0.00 O ATOM 891 OD2 ASP A 57 -2.528 9.620 -3.678 1.00 0.00 O ATOM 0 H ASP A 57 -0.324 5.553 -3.244 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.337 6.460 -1.358 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.536 7.930 -2.013 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -0.909 7.724 -3.713 1.00 0.00 H new ATOM 896 N TRP A 58 -4.353 7.000 -2.955 1.00 0.00 N ATOM 897 CA TRP A 58 -5.629 6.999 -3.647 1.00 0.00 C ATOM 898 C TRP A 58 -5.591 7.818 -4.942 1.00 0.00 C ATOM 899 O TRP A 58 -6.132 7.393 -5.968 1.00 0.00 O ATOM 900 CB TRP A 58 -6.675 7.610 -2.704 1.00 0.00 C ATOM 901 CG TRP A 58 -8.074 7.545 -3.223 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.628 8.358 -4.153 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.077 6.546 -2.915 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.890 7.902 -4.465 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.219 6.780 -3.733 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.108 5.440 -2.045 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.339 5.941 -3.700 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.229 4.604 -1.996 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.335 4.850 -2.820 1.00 0.00 C ATOM 0 H TRP A 58 -4.312 7.700 -2.215 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.874 5.972 -3.918 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.630 7.094 -1.745 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.416 8.652 -2.517 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.155 9.228 -4.583 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.504 8.339 -5.152 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.259 5.235 -1.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.189 6.130 -4.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.242 3.763 -1.318 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.192 4.194 -2.777 1.00 0.00 H new ATOM 920 N ASN A 59 -5.068 9.047 -4.850 1.00 0.00 N ATOM 921 CA ASN A 59 -5.296 10.140 -5.785 1.00 0.00 C ATOM 922 C ASN A 59 -4.410 9.956 -7.012 1.00 0.00 C ATOM 923 O ASN A 59 -3.344 10.569 -7.114 1.00 0.00 O ATOM 924 CB ASN A 59 -5.023 11.469 -5.060 1.00 0.00 C ATOM 925 CG ASN A 59 -5.384 12.691 -5.896 1.00 0.00 C ATOM 926 OD1 ASN A 59 -6.411 13.324 -5.657 1.00 0.00 O ATOM 927 ND2 ASN A 59 -4.551 13.082 -6.842 1.00 0.00 N ATOM 0 H ASN A 59 -4.447 9.312 -4.085 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.329 10.148 -6.133 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.591 11.492 -4.130 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.968 11.519 -4.791 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.755 13.920 -7.387 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.703 12.546 -7.028 1.00 0.00 H new ATOM 934 N MET A 60 -4.816 9.083 -7.929 1.00 0.00 N ATOM 935 CA MET A 60 -4.054 8.762 -9.123 1.00 0.00 C ATOM 936 C MET A 60 -4.912 9.192 -10.320 1.00 0.00 C ATOM 937 O MET A 60 -6.079 8.805 -10.385 1.00 0.00 O ATOM 938 CB MET A 60 -3.698 7.271 -9.103 1.00 0.00 C ATOM 939 CG MET A 60 -2.559 6.873 -10.042 1.00 0.00 C ATOM 940 SD MET A 60 -2.822 7.177 -11.808 1.00 0.00 S ATOM 941 CE MET A 60 -2.127 5.657 -12.470 1.00 0.00 C ATOM 0 H MET A 60 -5.697 8.573 -7.859 1.00 0.00 H new ATOM 0 HA MET A 60 -3.102 9.289 -9.184 1.00 0.00 H new ATOM 0 HB2 MET A 60 -3.427 6.990 -8.085 1.00 0.00 H new ATOM 0 HB3 MET A 60 -4.586 6.696 -9.367 1.00 0.00 H new ATOM 0 HG2 MET A 60 -1.661 7.408 -9.734 1.00 0.00 H new ATOM 0 HG3 MET A 60 -2.360 5.810 -9.905 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.808 5.821 -13.499 1.00 0.00 H new ATOM 0 HE2 MET A 60 -1.269 5.357 -11.868 1.00 0.00 H new ATOM 0 HE3 MET A 60 -2.881 4.871 -12.445 1.00 0.00 H new ATOM 951 N PRO A 61 -4.396 10.033 -11.237 1.00 0.00 N ATOM 952 CA PRO A 61 -5.191 10.636 -12.304 1.00 0.00 C ATOM 953 C PRO A 61 -5.769 9.619 -13.290 1.00 0.00 C ATOM 954 O PRO A 61 -6.908 9.786 -13.733 1.00 0.00 O ATOM 955 CB PRO A 61 -4.266 11.637 -12.999 1.00 0.00 C ATOM 956 CG PRO A 61 -2.866 11.155 -12.647 1.00 0.00 C ATOM 957 CD PRO A 61 -3.050 10.584 -11.249 1.00 0.00 C ATOM 0 HA PRO A 61 -6.072 11.120 -11.883 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -4.425 11.645 -14.077 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.439 12.653 -12.644 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -2.509 10.401 -13.349 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -2.142 11.970 -12.659 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -2.308 9.815 -11.037 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -2.934 11.357 -10.489 1.00 0.00 H new ATOM 965 N ASN A 62 -5.002 8.598 -13.672 1.00 0.00 N ATOM 966 CA ASN A 62 -5.443 7.599 -14.637 1.00 0.00 C ATOM 967 C ASN A 62 -6.263 6.547 -13.895 1.00 0.00 C ATOM 968 O ASN A 62 -7.432 6.773 -13.590 1.00 0.00 O ATOM 969 CB ASN A 62 -4.248 7.017 -15.420 1.00 0.00 C ATOM 970 CG ASN A 62 -3.675 8.034 -16.390 1.00 0.00 C ATOM 971 OD1 ASN A 62 -4.386 8.512 -17.269 1.00 0.00 O ATOM 972 ND2 ASN A 62 -2.411 8.387 -16.269 1.00 0.00 N ATOM 0 H ASN A 62 -4.058 8.443 -13.319 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.082 8.050 -15.396 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.473 6.700 -14.722 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.567 6.129 -15.967 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.008 9.068 -16.912 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -1.836 7.979 -15.532 1.00 0.00 H new ATOM 979 N MET A 63 -5.670 5.389 -13.609 1.00 0.00 N ATOM 980 CA MET A 63 -6.276 4.332 -12.822 1.00 0.00 C ATOM 981 C MET A 63 -6.121 4.739 -11.357 1.00 0.00 C ATOM 982 O MET A 63 -4.995 4.710 -10.863 1.00 0.00 O ATOM 983 CB MET A 63 -5.559 3.013 -13.162 1.00 0.00 C ATOM 984 CG MET A 63 -6.150 1.810 -12.428 1.00 0.00 C ATOM 985 SD MET A 63 -5.489 0.190 -12.907 1.00 0.00 S ATOM 986 CE MET A 63 -3.752 0.382 -12.446 1.00 0.00 C ATOM 0 H MET A 63 -4.729 5.160 -13.930 1.00 0.00 H new ATOM 0 HA MET A 63 -7.335 4.183 -13.032 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.616 2.841 -14.237 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.503 3.104 -12.909 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.988 1.945 -11.359 1.00 0.00 H new ATOM 0 HG3 MET A 63 -7.228 1.804 -12.589 1.00 0.00 H new ATOM 0 HE1 MET A 63 -3.177 -0.457 -12.838 1.00 0.00 H new ATOM 0 HE2 MET A 63 -3.366 1.313 -12.862 1.00 0.00 H new ATOM 0 HE3 MET A 63 -3.664 0.406 -11.360 1.00 0.00 H new ATOM 996 N ASP A 64 -7.212 5.156 -10.695 1.00 0.00 N ATOM 997 CA ASP A 64 -7.186 5.574 -9.287 1.00 0.00 C ATOM 998 C ASP A 64 -6.559 4.466 -8.439 1.00 0.00 C ATOM 999 O ASP A 64 -6.624 3.289 -8.810 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.579 5.857 -8.697 1.00 0.00 C ATOM 1001 CG ASP A 64 -9.470 6.806 -9.491 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -10.255 6.290 -10.322 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.473 8.028 -9.199 1.00 0.00 O ATOM 0 H ASP A 64 -8.136 5.212 -11.122 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.611 6.499 -9.264 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -9.103 4.908 -8.587 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.449 6.267 -7.696 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.086 4.783 -7.231 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.629 3.768 -6.287 1.00 0.00 C ATOM 1010 C GLY A 65 -6.715 2.724 -5.990 1.00 0.00 C ATOM 1011 O GLY A 65 -6.399 1.561 -5.717 1.00 0.00 O ATOM 0 H GLY A 65 -6.011 5.740 -6.885 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.748 3.269 -6.690 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.325 4.249 -5.357 1.00 0.00 H new ATOM 1015 N LEU A 66 -7.995 3.117 -6.060 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.125 2.208 -5.902 1.00 0.00 C ATOM 1017 C LEU A 66 -9.192 1.219 -7.061 1.00 0.00 C ATOM 1018 O LEU A 66 -9.403 0.028 -6.848 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.439 3.011 -5.752 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.637 2.266 -5.133 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.452 1.368 -6.063 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.220 1.427 -3.931 1.00 0.00 C ATOM 0 H LEU A 66 -8.271 4.084 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.985 1.625 -4.992 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.233 3.890 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.734 3.369 -6.738 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.291 3.092 -4.853 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.263 0.904 -5.502 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.867 1.966 -6.874 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.808 0.592 -6.477 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.093 0.917 -3.523 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.481 0.689 -4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.788 2.074 -3.168 1.00 0.00 H new ATOM 1034 N GLU A 67 -8.986 1.700 -8.282 1.00 0.00 N ATOM 1035 CA GLU A 67 -9.048 0.889 -9.488 1.00 0.00 C ATOM 1036 C GLU A 67 -7.840 -0.047 -9.561 1.00 0.00 C ATOM 1037 O GLU A 67 -7.998 -1.206 -9.943 1.00 0.00 O ATOM 1038 CB GLU A 67 -9.118 1.806 -10.718 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.359 2.709 -10.758 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.659 1.978 -11.107 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.731 0.737 -10.981 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.617 2.657 -11.555 1.00 0.00 O ATOM 0 H GLU A 67 -8.768 2.680 -8.462 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.945 0.270 -9.466 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.226 2.432 -10.742 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.101 1.191 -11.618 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.476 3.190 -9.787 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.194 3.501 -11.488 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.655 0.414 -9.138 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.469 -0.421 -8.944 1.00 0.00 C ATOM 1051 C LEU A 68 -5.838 -1.592 -8.038 1.00 0.00 C ATOM 1052 O LEU A 68 -5.747 -2.747 -8.460 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.319 0.421 -8.354 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.105 -0.393 -7.850 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.352 -1.091 -8.989 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.151 0.540 -7.102 1.00 0.00 C ATOM 0 H LEU A 68 -6.494 1.397 -8.918 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.122 -0.816 -9.899 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.976 1.123 -9.114 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.710 1.013 -7.526 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.482 -1.172 -7.187 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.509 -1.648 -8.580 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.025 -1.777 -9.504 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.986 -0.345 -9.694 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.293 -0.028 -6.744 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.810 1.327 -7.775 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.670 0.987 -6.254 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.312 -1.287 -6.823 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.777 -2.270 -5.851 1.00 0.00 C ATOM 1070 C LEU A 69 -7.720 -3.241 -6.539 1.00 0.00 C ATOM 1071 O LEU A 69 -7.438 -4.431 -6.532 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.403 -1.539 -4.639 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.561 -2.228 -3.899 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.249 -3.613 -3.361 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -8.955 -1.445 -2.638 1.00 0.00 C ATOM 0 H LEU A 69 -6.382 -0.327 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.951 -2.862 -5.458 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.609 -1.352 -3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.757 -0.567 -4.982 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.335 -2.279 -4.664 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.128 -4.014 -2.857 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.973 -4.270 -4.186 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.422 -3.551 -2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.776 -1.955 -2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.099 -1.384 -1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.270 -0.439 -2.918 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.803 -2.788 -7.162 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.789 -3.722 -7.710 1.00 0.00 C ATOM 1089 C LYS A 70 -9.276 -4.547 -8.888 1.00 0.00 C ATOM 1090 O LYS A 70 -9.817 -5.626 -9.145 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.029 -2.976 -8.168 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.856 -2.419 -7.012 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.187 -1.894 -7.575 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.274 -1.808 -6.504 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.614 -1.736 -7.106 1.00 0.00 N ATOM 0 H LYS A 70 -9.021 -1.801 -7.300 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.013 -4.409 -6.894 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.731 -2.156 -8.822 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.651 -3.647 -8.761 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.039 -3.195 -6.268 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.314 -1.617 -6.510 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.031 -0.908 -8.012 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.523 -2.549 -8.379 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.213 -2.678 -5.850 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.105 -0.929 -5.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.330 -1.679 -6.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.678 -0.892 -7.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.783 -2.587 -7.680 1.00 0.00 H new ATOM 1109 N THR A 71 -8.277 -4.059 -9.615 1.00 0.00 N ATOM 1110 CA THR A 71 -7.616 -4.819 -10.663 1.00 0.00 C ATOM 1111 C THR A 71 -6.881 -5.995 -10.012 1.00 0.00 C ATOM 1112 O THR A 71 -7.074 -7.142 -10.404 1.00 0.00 O ATOM 1113 CB THR A 71 -6.733 -3.866 -11.486 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.538 -2.804 -11.978 1.00 0.00 O ATOM 1115 CG2 THR A 71 -6.104 -4.540 -12.700 1.00 0.00 C ATOM 0 H THR A 71 -7.903 -3.118 -9.491 1.00 0.00 H new ATOM 0 HA THR A 71 -8.315 -5.256 -11.376 1.00 0.00 H new ATOM 0 HB THR A 71 -5.939 -3.523 -10.823 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.605 -2.102 -11.297 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.493 -3.818 -13.241 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.479 -5.371 -12.372 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.890 -4.914 -13.356 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.116 -5.738 -8.951 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.558 -6.763 -8.072 1.00 0.00 C ATOM 1125 C ILE A 72 -6.610 -7.703 -7.472 1.00 0.00 C ATOM 1126 O ILE A 72 -6.523 -8.919 -7.639 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.559 -6.130 -7.070 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.619 -5.069 -7.687 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -3.806 -7.145 -6.220 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -3.006 -4.111 -6.663 1.00 0.00 C ATOM 0 H ILE A 72 -5.862 -4.790 -8.673 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.970 -7.453 -8.678 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.204 -5.583 -6.383 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.816 -5.577 -8.221 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -4.175 -4.490 -8.424 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.128 -6.623 -5.545 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.517 -7.731 -5.638 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.234 -7.809 -6.868 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.359 -3.397 -7.174 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.801 -3.574 -6.145 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.420 -4.678 -5.939 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.589 -7.157 -6.754 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.494 -7.889 -5.872 1.00 0.00 C ATOM 1144 C ARG A 73 -9.378 -8.882 -6.616 1.00 0.00 C ATOM 1145 O ARG A 73 -9.842 -9.820 -5.975 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.349 -6.892 -5.060 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.381 -7.197 -3.542 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.499 -8.115 -3.018 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.266 -9.543 -3.276 1.00 0.00 N ATOM 1150 CZ ARG A 73 -9.724 -10.457 -2.463 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -9.279 -10.157 -1.249 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -9.622 -11.712 -2.868 1.00 0.00 N ATOM 0 H ARG A 73 -7.781 -6.155 -6.771 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.879 -8.481 -5.194 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.960 -5.885 -5.212 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.368 -6.902 -5.446 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.425 -7.645 -3.270 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.451 -6.248 -3.011 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.607 -7.963 -1.944 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.442 -7.822 -3.478 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.555 -9.881 -4.194 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.344 -9.199 -0.904 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -8.872 -10.884 -0.661 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -9.955 -11.978 -3.795 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -9.210 -12.414 -2.254 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.632 -8.693 -7.912 1.00 0.00 N ATOM 1167 CA ALA A 74 -10.500 -9.581 -8.666 1.00 0.00 C ATOM 1168 C ALA A 74 -9.954 -11.013 -8.631 1.00 0.00 C ATOM 1169 O ALA A 74 -10.474 -11.845 -7.881 1.00 0.00 O ATOM 1170 CB ALA A 74 -10.706 -9.046 -10.087 1.00 0.00 C ATOM 0 H ALA A 74 -9.243 -7.925 -8.459 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.486 -9.613 -8.202 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -11.358 -9.722 -10.639 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -11.163 -8.058 -10.041 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -9.743 -8.977 -10.593 1.00 0.00 H new ATOM 1176 N ASP A 75 -8.948 -11.329 -9.450 1.00 0.00 N ATOM 1177 CA ASP A 75 -8.642 -12.728 -9.774 1.00 0.00 C ATOM 1178 C ASP A 75 -7.311 -12.960 -10.502 1.00 0.00 C ATOM 1179 O ASP A 75 -7.046 -14.087 -10.923 1.00 0.00 O ATOM 1180 CB ASP A 75 -9.795 -13.354 -10.586 1.00 0.00 C ATOM 1181 CG ASP A 75 -10.022 -12.769 -11.978 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -9.202 -11.983 -12.496 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -11.065 -13.118 -12.575 1.00 0.00 O ATOM 0 H ASP A 75 -8.337 -10.646 -9.897 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.532 -13.219 -8.807 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -9.604 -14.422 -10.688 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -10.717 -13.248 -10.013 1.00 0.00 H new ATOM 1188 N GLY A 76 -6.450 -11.948 -10.645 1.00 0.00 N ATOM 1189 CA GLY A 76 -5.236 -11.987 -11.465 1.00 0.00 C ATOM 1190 C GLY A 76 -4.084 -12.812 -10.884 1.00 0.00 C ATOM 1191 O GLY A 76 -2.928 -12.534 -11.189 1.00 0.00 O ATOM 0 H GLY A 76 -6.583 -11.051 -10.178 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.492 -12.389 -12.445 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.888 -10.966 -11.620 1.00 0.00 H new ATOM 1195 N ALA A 77 -4.374 -13.780 -10.008 1.00 0.00 N ATOM 1196 CA ALA A 77 -3.452 -14.549 -9.178 1.00 0.00 C ATOM 1197 C ALA A 77 -2.744 -13.678 -8.139 1.00 0.00 C ATOM 1198 O ALA A 77 -1.749 -14.096 -7.553 1.00 0.00 O ATOM 1199 CB ALA A 77 -2.493 -15.384 -10.028 1.00 0.00 C ATOM 0 H ALA A 77 -5.340 -14.066 -9.852 1.00 0.00 H new ATOM 0 HA ALA A 77 -4.044 -15.260 -8.603 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.822 -15.943 -9.376 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -3.064 -16.079 -10.643 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.909 -14.725 -10.671 1.00 0.00 H new ATOM 1205 N MET A 78 -3.241 -12.463 -7.907 1.00 0.00 N ATOM 1206 CA MET A 78 -2.673 -11.463 -7.007 1.00 0.00 C ATOM 1207 C MET A 78 -3.720 -10.974 -6.008 1.00 0.00 C ATOM 1208 O MET A 78 -3.428 -10.095 -5.201 1.00 0.00 O ATOM 1209 CB MET A 78 -2.072 -10.317 -7.837 1.00 0.00 C ATOM 1210 CG MET A 78 -1.029 -10.851 -8.828 1.00 0.00 C ATOM 1211 SD MET A 78 0.071 -9.618 -9.566 1.00 0.00 S ATOM 1212 CE MET A 78 -1.116 -8.745 -10.624 1.00 0.00 C ATOM 0 H MET A 78 -4.092 -12.135 -8.364 1.00 0.00 H new ATOM 0 HA MET A 78 -1.872 -11.909 -6.418 1.00 0.00 H new ATOM 0 HB2 MET A 78 -2.864 -9.800 -8.379 1.00 0.00 H new ATOM 0 HB3 MET A 78 -1.610 -9.586 -7.174 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.417 -11.594 -8.316 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.553 -11.369 -9.632 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.599 -7.967 -11.186 1.00 0.00 H new ATOM 0 HE2 MET A 78 -1.573 -9.451 -11.318 1.00 0.00 H new ATOM 0 HE3 MET A 78 -1.890 -8.292 -10.005 1.00 0.00 H new ATOM 1222 N SER A 79 -4.930 -11.540 -6.029 1.00 0.00 N ATOM 1223 CA SER A 79 -6.060 -11.075 -5.244 1.00 0.00 C ATOM 1224 C SER A 79 -5.798 -11.096 -3.732 1.00 0.00 C ATOM 1225 O SER A 79 -6.415 -10.313 -3.006 1.00 0.00 O ATOM 1226 CB SER A 79 -7.293 -11.896 -5.630 1.00 0.00 C ATOM 1227 OG SER A 79 -7.060 -13.292 -5.518 1.00 0.00 O ATOM 0 H SER A 79 -5.148 -12.351 -6.607 1.00 0.00 H new ATOM 0 HA SER A 79 -6.233 -10.024 -5.477 1.00 0.00 H new ATOM 0 HB2 SER A 79 -8.130 -11.616 -4.990 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.581 -11.658 -6.654 1.00 0.00 H new ATOM 0 HG SER A 79 -7.871 -13.780 -5.771 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.883 -11.947 -3.251 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.541 -12.068 -1.839 1.00 0.00 C ATOM 1235 C ALA A 80 -3.534 -11.015 -1.358 1.00 0.00 C ATOM 1236 O ALA A 80 -3.315 -10.918 -0.149 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.990 -13.471 -1.566 1.00 0.00 C ATOM 0 H ALA A 80 -4.353 -12.581 -3.849 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.460 -11.896 -1.278 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.734 -13.562 -0.510 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.745 -14.215 -1.822 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.099 -13.636 -2.171 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.924 -10.232 -2.261 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.927 -9.223 -1.893 1.00 0.00 C ATOM 1245 C LEU A 81 -2.529 -8.243 -0.876 1.00 0.00 C ATOM 1246 O LEU A 81 -3.710 -7.898 -1.008 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.446 -8.444 -3.138 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.263 -9.067 -3.903 1.00 0.00 C ATOM 1249 CD1 LEU A 81 0.029 -8.305 -5.213 1.00 0.00 C ATOM 1250 CD2 LEU A 81 1.019 -9.065 -3.055 1.00 0.00 C ATOM 0 H LEU A 81 -3.109 -10.282 -3.263 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.072 -9.733 -1.450 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.285 -8.342 -3.826 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.164 -7.438 -2.827 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.554 -10.093 -4.130 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.869 -8.772 -5.726 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.851 -8.336 -5.856 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.275 -7.268 -4.984 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.833 -9.512 -3.626 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.280 -8.040 -2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.854 -9.642 -2.145 1.00 0.00 H new ATOM 1262 N PRO A 82 -1.758 -7.739 0.105 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.198 -6.682 1.002 1.00 0.00 C ATOM 1264 C PRO A 82 -2.181 -5.343 0.246 1.00 0.00 C ATOM 1265 O PRO A 82 -1.245 -4.547 0.336 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.269 -6.750 2.214 1.00 0.00 C ATOM 1267 CG PRO A 82 0.031 -7.281 1.625 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.383 -8.105 0.404 1.00 0.00 C ATOM 0 HA PRO A 82 -3.224 -6.793 1.353 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.133 -5.771 2.673 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.662 -7.412 2.986 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.696 -6.465 1.341 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.569 -7.894 2.349 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.268 -7.894 -0.445 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.302 -9.172 0.611 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.234 -5.142 -0.540 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.650 -3.918 -1.204 1.00 0.00 C ATOM 1278 C VAL A 83 -3.974 -2.889 -0.123 1.00 0.00 C ATOM 1279 O VAL A 83 -4.916 -3.097 0.653 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.862 -4.231 -2.110 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -4.393 -4.884 -3.410 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.937 -5.134 -1.459 1.00 0.00 C ATOM 0 H VAL A 83 -3.877 -5.907 -0.746 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.867 -3.509 -1.842 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.335 -3.267 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -5.256 -5.100 -4.040 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.720 -4.206 -3.935 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.868 -5.812 -3.182 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.749 -5.301 -2.167 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.492 -6.091 -1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.328 -4.648 -0.565 1.00 0.00 H new ATOM 1292 N LEU A 84 -3.171 -1.841 0.032 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.123 -1.082 1.276 1.00 0.00 C ATOM 1294 C LEU A 84 -3.111 0.419 1.026 1.00 0.00 C ATOM 1295 O LEU A 84 -2.139 0.952 0.489 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.896 -1.587 2.039 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.625 -0.883 3.371 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -2.871 -0.856 4.271 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.470 -1.632 4.049 1.00 0.00 C ATOM 0 H LEU A 84 -2.542 -1.497 -0.693 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.020 -1.239 1.875 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.018 -2.654 2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.019 -1.475 1.401 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.362 0.160 3.195 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.634 -0.347 5.205 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.676 -0.325 3.763 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.188 -1.877 4.484 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.243 -1.161 5.006 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.757 -2.670 4.214 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.412 -1.597 3.409 1.00 0.00 H new ATOM 1311 N MET A 85 -4.191 1.093 1.428 1.00 0.00 N ATOM 1312 CA MET A 85 -4.364 2.522 1.182 1.00 0.00 C ATOM 1313 C MET A 85 -3.583 3.320 2.227 1.00 0.00 C ATOM 1314 O MET A 85 -3.750 3.086 3.431 1.00 0.00 O ATOM 1315 CB MET A 85 -5.853 2.900 1.242 1.00 0.00 C ATOM 1316 CG MET A 85 -6.684 2.258 0.131 1.00 0.00 C ATOM 1317 SD MET A 85 -6.353 2.941 -1.513 1.00 0.00 S ATOM 1318 CE MET A 85 -7.519 1.941 -2.461 1.00 0.00 C ATOM 0 H MET A 85 -4.967 0.663 1.932 1.00 0.00 H new ATOM 0 HA MET A 85 -3.985 2.757 0.187 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.258 2.601 2.209 1.00 0.00 H new ATOM 0 HB3 MET A 85 -5.949 3.984 1.178 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.487 1.186 0.116 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.742 2.385 0.361 1.00 0.00 H new ATOM 0 HE1 MET A 85 -6.978 1.364 -3.211 1.00 0.00 H new ATOM 0 HE2 MET A 85 -8.045 1.261 -1.790 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.240 2.593 -2.955 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.772 4.280 1.783 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.090 5.260 2.623 1.00 0.00 C ATOM 1330 C VAL A 86 -2.264 6.606 1.927 1.00 0.00 C ATOM 1331 O VAL A 86 -1.673 6.823 0.875 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.613 4.869 2.839 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.104 5.881 3.746 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.520 3.489 3.508 1.00 0.00 C ATOM 0 H VAL A 86 -2.565 4.400 0.791 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.513 5.308 3.626 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.137 4.854 1.859 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.143 5.578 3.879 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.070 6.869 3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.391 5.915 4.716 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.527 3.226 3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.025 3.518 4.473 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.996 2.743 2.871 1.00 0.00 H new ATOM 1344 N THR A 87 -3.136 7.474 2.439 1.00 0.00 N ATOM 1345 CA THR A 87 -3.575 8.647 1.693 1.00 0.00 C ATOM 1346 C THR A 87 -3.975 9.779 2.644 1.00 0.00 C ATOM 1347 O THR A 87 -4.142 9.564 3.843 1.00 0.00 O ATOM 1348 CB THR A 87 -4.714 8.205 0.754 1.00 0.00 C ATOM 1349 OG1 THR A 87 -5.065 9.263 -0.104 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.959 7.686 1.485 1.00 0.00 C ATOM 0 H THR A 87 -3.551 7.385 3.367 1.00 0.00 H new ATOM 0 HA THR A 87 -2.766 9.055 1.087 1.00 0.00 H new ATOM 0 HB THR A 87 -4.327 7.362 0.182 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.545 9.199 -0.932 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.715 7.395 0.755 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.690 6.822 2.093 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.358 8.472 2.127 1.00 0.00 H new ATOM 1358 N ALA A 88 -4.141 10.999 2.129 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.773 12.098 2.853 1.00 0.00 C ATOM 1360 C ALA A 88 -6.299 12.022 2.800 1.00 0.00 C ATOM 1361 O ALA A 88 -6.972 12.750 3.530 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.340 13.420 2.224 1.00 0.00 C ATOM 0 H ALA A 88 -3.837 11.252 1.189 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.462 12.028 3.895 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.807 14.247 2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.256 13.514 2.286 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.647 13.443 1.179 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.841 11.202 1.902 1.00 0.00 N ATOM 1369 CA GLU A 89 -8.244 11.169 1.535 1.00 0.00 C ATOM 1370 C GLU A 89 -9.068 10.546 2.664 1.00 0.00 C ATOM 1371 O GLU A 89 -9.161 9.328 2.783 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.377 10.398 0.214 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.768 11.177 -0.970 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.792 12.056 -1.685 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.884 11.544 -2.027 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -8.514 13.255 -1.930 1.00 0.00 O ATOM 0 H GLU A 89 -6.286 10.515 1.392 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.633 12.176 1.387 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.881 9.432 0.306 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.430 10.199 0.014 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.950 11.800 -0.608 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.340 10.472 -1.682 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.660 11.384 3.519 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.571 10.939 4.567 1.00 0.00 C ATOM 1385 C ALA A 90 -11.995 10.752 4.042 1.00 0.00 C ATOM 1386 O ALA A 90 -12.877 10.436 4.841 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.595 11.952 5.718 1.00 0.00 C ATOM 0 H ALA A 90 -9.518 12.394 3.500 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.203 9.976 4.922 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.279 11.606 6.493 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.593 12.051 6.136 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.929 12.920 5.344 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.265 11.013 2.755 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.612 10.984 2.190 1.00 0.00 C ATOM 1395 C LYS A 91 -14.297 9.678 2.558 1.00 0.00 C ATOM 1396 O LYS A 91 -13.868 8.598 2.147 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.573 11.229 0.675 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.912 10.911 -0.016 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.954 11.370 -1.473 1.00 0.00 C ATOM 1400 CE LYS A 91 -15.057 12.892 -1.553 1.00 0.00 C ATOM 1401 NZ LYS A 91 -15.324 13.357 -2.923 1.00 0.00 N ATOM 0 H LYS A 91 -11.544 11.252 2.074 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.204 11.794 2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -13.310 12.270 0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.787 10.617 0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -15.091 9.837 0.026 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.722 11.391 0.534 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.057 11.033 -1.992 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -15.805 10.915 -1.979 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.853 13.236 -0.892 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -14.129 13.337 -1.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -15.386 14.395 -2.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -14.553 13.051 -3.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.222 12.954 -3.258 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.397 9.792 3.298 1.00 0.00 N ATOM 1416 CA LYS A 92 -16.169 8.664 3.778 1.00 0.00 C ATOM 1417 C LYS A 92 -16.486 7.718 2.626 1.00 0.00 C ATOM 1418 O LYS A 92 -16.152 6.544 2.721 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.407 9.188 4.521 1.00 0.00 C ATOM 1420 CG LYS A 92 -18.239 8.057 5.132 1.00 0.00 C ATOM 1421 CD LYS A 92 -19.570 7.833 4.407 1.00 0.00 C ATOM 1422 CE LYS A 92 -20.694 8.797 4.821 1.00 0.00 C ATOM 1423 NZ LYS A 92 -21.047 8.641 6.246 1.00 0.00 N ATOM 0 H LYS A 92 -15.779 10.694 3.583 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.598 8.072 4.494 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.093 9.872 5.309 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -18.027 9.761 3.831 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -17.660 7.134 5.109 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -18.436 8.284 6.180 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -19.405 7.928 3.334 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -19.901 6.810 4.589 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -20.381 9.824 4.634 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -21.575 8.615 4.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -21.974 9.078 6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -21.090 7.630 6.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -20.327 9.105 6.835 1.00 0.00 H new ATOM 1437 N GLU A 93 -17.064 8.199 1.522 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.413 7.313 0.414 1.00 0.00 C ATOM 1439 C GLU A 93 -16.191 6.593 -0.174 1.00 0.00 C ATOM 1440 O GLU A 93 -16.344 5.476 -0.661 1.00 0.00 O ATOM 1441 CB GLU A 93 -18.142 8.079 -0.712 1.00 0.00 C ATOM 1442 CG GLU A 93 -19.502 7.439 -1.025 1.00 0.00 C ATOM 1443 CD GLU A 93 -20.119 7.930 -2.342 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -20.305 9.155 -2.540 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -20.446 7.094 -3.214 1.00 0.00 O ATOM 0 H GLU A 93 -17.296 9.181 1.374 1.00 0.00 H new ATOM 0 HA GLU A 93 -18.081 6.561 0.834 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -18.285 9.118 -0.416 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.525 8.086 -1.610 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.384 6.356 -1.069 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -20.192 7.651 -0.208 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.996 7.192 -0.128 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.758 6.573 -0.610 1.00 0.00 C ATOM 1454 C ASN A 94 -13.324 5.464 0.341 1.00 0.00 C ATOM 1455 O ASN A 94 -12.849 4.420 -0.105 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.613 7.591 -0.804 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.799 8.464 -2.040 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -13.762 8.296 -2.785 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -11.917 9.409 -2.312 1.00 0.00 N ATOM 0 H ASN A 94 -14.861 8.130 0.249 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.974 6.153 -1.592 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.547 8.228 0.078 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.667 7.056 -0.882 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -12.037 9.996 -3.138 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -11.116 9.552 -1.696 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.525 5.640 1.648 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.277 4.580 2.618 1.00 0.00 C ATOM 1468 C ILE A 95 -14.256 3.429 2.336 1.00 0.00 C ATOM 1469 O ILE A 95 -13.818 2.274 2.325 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.370 5.141 4.056 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.064 5.905 4.387 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.581 4.007 5.077 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.319 7.159 5.233 1.00 0.00 C ATOM 0 H ILE A 95 -13.860 6.512 2.057 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.266 4.183 2.523 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.224 5.816 4.116 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.384 5.242 4.921 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.568 6.190 3.459 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -13.643 4.428 6.081 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.506 3.478 4.847 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -12.743 3.311 5.026 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.372 7.659 5.438 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.977 7.837 4.689 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.789 6.874 6.174 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.548 3.715 2.090 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.519 2.688 1.701 1.00 0.00 C ATOM 1487 C ILE A 96 -16.020 2.028 0.418 1.00 0.00 C ATOM 1488 O ILE A 96 -15.967 0.809 0.376 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.977 3.219 1.560 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.688 3.382 2.923 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.878 2.248 0.766 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.299 4.661 3.648 1.00 0.00 C ATOM 0 H ILE A 96 -15.940 4.654 2.155 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.583 1.953 2.504 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.858 4.176 1.053 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.767 3.373 2.767 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.450 2.526 3.555 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.884 2.661 0.694 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.470 2.110 -0.235 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -18.917 1.286 1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -18.831 4.717 4.598 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.225 4.662 3.833 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.562 5.522 3.033 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.629 2.793 -0.604 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.197 2.244 -1.881 1.00 0.00 C ATOM 1506 C ALA A 97 -14.029 1.287 -1.673 1.00 0.00 C ATOM 1507 O ALA A 97 -14.049 0.196 -2.229 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.833 3.360 -2.863 1.00 0.00 C ATOM 0 H ALA A 97 -15.605 3.812 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.025 1.684 -2.316 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.514 2.922 -3.809 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.703 3.994 -3.032 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.022 3.959 -2.448 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.033 1.641 -0.855 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.954 0.723 -0.505 1.00 0.00 C ATOM 1516 C ALA A 98 -12.491 -0.518 0.195 1.00 0.00 C ATOM 1517 O ALA A 98 -12.071 -1.623 -0.136 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.934 1.403 0.404 1.00 0.00 C ATOM 0 H ALA A 98 -12.955 2.562 -0.423 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.470 0.427 -1.436 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.140 0.698 0.651 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.508 2.265 -0.109 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.425 1.732 1.320 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.372 -0.355 1.180 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.920 -1.466 1.940 1.00 0.00 C ATOM 1526 C ALA A 99 -14.651 -2.439 0.993 1.00 0.00 C ATOM 1527 O ALA A 99 -14.403 -3.645 1.040 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.795 -0.902 3.072 1.00 0.00 C ATOM 0 H ALA A 99 -13.724 0.557 1.471 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.135 -2.056 2.413 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.214 -1.724 3.652 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.188 -0.272 3.722 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.604 -0.310 2.645 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.456 -1.899 0.074 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.192 -2.581 -0.986 1.00 0.00 C ATOM 1536 C GLN A 100 -15.245 -3.277 -1.958 1.00 0.00 C ATOM 1537 O GLN A 100 -15.425 -4.461 -2.251 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.043 -1.552 -1.749 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.216 -0.987 -0.939 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.389 -1.949 -0.907 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.256 -1.905 -1.777 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.455 -2.832 0.067 1.00 0.00 N ATOM 0 H GLN A 100 -15.621 -0.893 0.053 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.830 -3.339 -0.532 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.402 -0.728 -2.064 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.432 -2.018 -2.655 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.888 -0.778 0.079 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.534 -0.039 -1.372 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.728 -2.857 0.782 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.233 -3.491 0.106 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.228 -2.569 -2.458 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.187 -3.111 -3.305 1.00 0.00 C ATOM 1553 C ALA A 101 -12.404 -4.219 -2.606 1.00 0.00 C ATOM 1554 O ALA A 101 -11.802 -5.050 -3.284 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.257 -1.965 -3.679 1.00 0.00 C ATOM 0 H ALA A 101 -14.112 -1.573 -2.273 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.637 -3.557 -4.192 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.458 -2.339 -4.319 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.820 -1.199 -4.212 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.826 -1.536 -2.774 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.423 -4.245 -1.275 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.703 -5.194 -0.462 1.00 0.00 C ATOM 1563 C GLY A 102 -10.255 -4.767 -0.311 1.00 0.00 C ATOM 1564 O GLY A 102 -9.358 -5.587 -0.491 1.00 0.00 O ATOM 0 H GLY A 102 -12.963 -3.578 -0.724 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.171 -5.271 0.520 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.752 -6.183 -0.917 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.005 -3.502 0.028 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.681 -3.105 0.460 1.00 0.00 C ATOM 1570 C ALA A 103 -8.380 -3.809 1.779 1.00 0.00 C ATOM 1571 O ALA A 103 -9.255 -3.926 2.648 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.531 -1.593 0.601 1.00 0.00 C ATOM 0 H ALA A 103 -10.695 -2.751 0.010 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.963 -3.401 -0.305 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.518 -1.357 0.927 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.723 -1.117 -0.361 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.245 -1.224 1.337 1.00 0.00 H new ATOM 1578 N SER A 104 -7.131 -4.221 1.947 1.00 0.00 N ATOM 1579 CA SER A 104 -6.674 -4.891 3.146 1.00 0.00 C ATOM 1580 C SER A 104 -6.715 -3.948 4.355 1.00 0.00 C ATOM 1581 O SER A 104 -6.877 -4.410 5.484 1.00 0.00 O ATOM 1582 CB SER A 104 -5.286 -5.484 2.881 1.00 0.00 C ATOM 1583 OG SER A 104 -4.272 -4.504 2.781 1.00 0.00 O ATOM 0 H SER A 104 -6.402 -4.096 1.244 1.00 0.00 H new ATOM 0 HA SER A 104 -7.344 -5.713 3.399 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.035 -6.177 3.684 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.315 -6.063 1.958 1.00 0.00 H new ATOM 0 HG SER A 104 -4.538 -3.823 2.128 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.651 -2.629 4.134 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.754 -1.641 5.189 1.00 0.00 C ATOM 1591 C GLY A 105 -6.573 -0.233 4.635 1.00 0.00 C ATOM 1592 O GLY A 105 -6.166 -0.047 3.478 1.00 0.00 O ATOM 0 H GLY A 105 -6.525 -2.225 3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.726 -1.723 5.675 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.999 -1.836 5.951 1.00 0.00 H new ATOM 1596 N TYR A 106 -6.868 0.751 5.485 1.00 0.00 N ATOM 1597 CA TYR A 106 -6.896 2.164 5.153 1.00 0.00 C ATOM 1598 C TYR A 106 -6.180 2.935 6.254 1.00 0.00 C ATOM 1599 O TYR A 106 -6.513 2.797 7.434 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.358 2.627 4.995 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.600 3.674 3.922 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.161 5.003 4.082 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.323 3.318 2.769 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.439 5.963 3.088 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.607 4.275 1.778 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.157 5.602 1.927 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.421 6.522 0.960 1.00 0.00 O ATOM 0 H TYR A 106 -7.102 0.571 6.461 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.385 2.350 4.208 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -8.975 1.756 4.774 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.700 3.025 5.950 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.611 5.287 4.967 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.663 2.301 2.644 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.101 6.981 3.215 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.171 3.992 0.901 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.302 6.113 0.078 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.195 3.745 5.883 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.539 4.708 6.751 1.00 0.00 C ATOM 1619 C VAL A 107 -4.746 6.064 6.097 1.00 0.00 C ATOM 1620 O VAL A 107 -4.168 6.348 5.048 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.080 4.298 6.996 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.197 5.456 7.462 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -3.033 3.203 8.074 1.00 0.00 C ATOM 0 H VAL A 107 -4.820 3.747 4.934 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.959 4.751 7.756 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.693 3.945 6.040 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.179 5.098 7.617 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.195 6.240 6.704 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.587 5.857 8.398 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.998 2.910 8.250 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.464 3.585 8.999 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.603 2.337 7.738 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.616 6.869 6.699 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.693 8.280 6.372 1.00 0.00 C ATOM 1635 C VAL A 108 -4.537 8.986 7.103 1.00 0.00 C ATOM 1636 O VAL A 108 -4.096 8.534 8.163 1.00 0.00 O ATOM 1637 CB VAL A 108 -7.066 8.864 6.768 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -7.317 10.171 6.007 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -8.247 7.932 6.443 1.00 0.00 C ATOM 0 H VAL A 108 -6.275 6.564 7.415 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.597 8.433 5.297 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.019 9.011 7.847 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.288 10.577 6.292 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.536 10.891 6.253 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.306 9.976 4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.180 8.407 6.748 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.273 7.738 5.371 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.126 6.991 6.980 1.00 0.00 H new ATOM 1649 N LYS A 109 -4.074 10.113 6.571 1.00 0.00 N ATOM 1650 CA LYS A 109 -3.296 11.129 7.277 1.00 0.00 C ATOM 1651 C LYS A 109 -4.091 11.609 8.506 1.00 0.00 C ATOM 1652 O LYS A 109 -5.316 11.678 8.401 1.00 0.00 O ATOM 1653 CB LYS A 109 -3.066 12.269 6.266 1.00 0.00 C ATOM 1654 CG LYS A 109 -2.288 13.479 6.790 1.00 0.00 C ATOM 1655 CD LYS A 109 -2.141 14.549 5.701 1.00 0.00 C ATOM 1656 CE LYS A 109 -1.556 15.802 6.353 1.00 0.00 C ATOM 1657 NZ LYS A 109 -1.075 16.798 5.381 1.00 0.00 N ATOM 0 H LYS A 109 -4.237 10.355 5.594 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.340 10.750 7.640 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -2.534 11.864 5.405 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -4.036 12.612 5.908 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -2.803 13.901 7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.302 13.163 7.130 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -1.489 14.194 4.902 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.108 14.770 5.249 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.315 16.261 6.986 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -0.731 15.512 7.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -0.692 17.621 5.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -0.329 16.376 4.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.864 17.101 4.775 1.00 0.00 H new ATOM 1671 N PRO A 110 -3.463 12.048 9.612 1.00 0.00 N ATOM 1672 CA PRO A 110 -2.044 11.912 9.929 1.00 0.00 C ATOM 1673 C PRO A 110 -1.703 10.444 10.165 1.00 0.00 C ATOM 1674 O PRO A 110 -2.533 9.676 10.650 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.828 12.733 11.201 1.00 0.00 C ATOM 1676 CG PRO A 110 -3.187 12.682 11.889 1.00 0.00 C ATOM 1677 CD PRO A 110 -4.178 12.639 10.732 1.00 0.00 C ATOM 0 HA PRO A 110 -1.405 12.262 9.119 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -1.044 12.306 11.827 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -1.531 13.757 10.973 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.279 11.804 12.528 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.348 13.555 12.522 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -5.055 12.046 10.992 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.532 13.640 10.484 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.480 10.048 9.817 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.056 8.664 9.904 1.00 0.00 C ATOM 1687 C PHE A 111 1.429 8.622 10.250 1.00 0.00 C ATOM 1688 O PHE A 111 2.216 9.397 9.702 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.366 7.950 8.577 1.00 0.00 C ATOM 1690 CG PHE A 111 0.533 8.314 7.412 1.00 0.00 C ATOM 1691 CD1 PHE A 111 0.425 9.563 6.771 1.00 0.00 C ATOM 1692 CD2 PHE A 111 1.544 7.418 7.020 1.00 0.00 C ATOM 1693 CE1 PHE A 111 1.342 9.926 5.771 1.00 0.00 C ATOM 1694 CE2 PHE A 111 2.447 7.779 6.011 1.00 0.00 C ATOM 1695 CZ PHE A 111 2.355 9.032 5.392 1.00 0.00 C ATOM 0 H PHE A 111 0.239 10.681 9.468 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.599 8.140 10.691 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.302 6.874 8.740 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.397 8.169 8.299 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.366 10.244 7.049 1.00 0.00 H new ATOM 0 HD2 PHE A 111 1.624 6.452 7.496 1.00 0.00 H new ATOM 0 HE1 PHE A 111 1.268 10.892 5.294 1.00 0.00 H new ATOM 0 HE2 PHE A 111 3.219 7.087 5.709 1.00 0.00 H new ATOM 0 HZ PHE A 111 3.062 9.310 4.625 1.00 0.00 H new ATOM 1705 N THR A 112 1.804 7.708 11.142 1.00 0.00 N ATOM 1706 CA THR A 112 3.177 7.457 11.576 1.00 0.00 C ATOM 1707 C THR A 112 3.395 5.950 11.747 1.00 0.00 C ATOM 1708 O THR A 112 2.511 5.156 11.406 1.00 0.00 O ATOM 1709 CB THR A 112 3.488 8.266 12.851 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.386 8.302 13.740 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.900 9.688 12.498 1.00 0.00 C ATOM 0 H THR A 112 1.131 7.096 11.602 1.00 0.00 H new ATOM 0 HA THR A 112 3.881 7.797 10.817 1.00 0.00 H new ATOM 0 HB THR A 112 4.313 7.760 13.353 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.624 8.822 14.536 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.115 10.242 13.412 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.791 9.664 11.870 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.090 10.178 11.959 1.00 0.00 H new ATOM 1719 N ALA A 113 4.561 5.521 12.243 1.00 0.00 N ATOM 1720 CA ALA A 113 4.811 4.110 12.500 1.00 0.00 C ATOM 1721 C ALA A 113 3.801 3.572 13.518 1.00 0.00 C ATOM 1722 O ALA A 113 3.425 2.410 13.414 1.00 0.00 O ATOM 1723 CB ALA A 113 6.258 3.863 12.925 1.00 0.00 C ATOM 0 H ALA A 113 5.342 6.135 12.472 1.00 0.00 H new ATOM 0 HA ALA A 113 4.671 3.557 11.571 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.407 2.799 13.108 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.931 4.193 12.133 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.470 4.421 13.837 1.00 0.00 H new ATOM 1729 N ALA A 114 3.252 4.443 14.376 1.00 0.00 N ATOM 1730 CA ALA A 114 2.153 4.122 15.279 1.00 0.00 C ATOM 1731 C ALA A 114 0.958 3.488 14.556 1.00 0.00 C ATOM 1732 O ALA A 114 0.323 2.598 15.113 1.00 0.00 O ATOM 1733 CB ALA A 114 1.696 5.396 15.997 1.00 0.00 C ATOM 0 H ALA A 114 3.571 5.408 14.459 1.00 0.00 H new ATOM 0 HA ALA A 114 2.525 3.388 15.994 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.874 5.158 16.673 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.527 5.810 16.568 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.361 6.128 15.262 1.00 0.00 H new ATOM 1739 N THR A 115 0.638 3.925 13.332 1.00 0.00 N ATOM 1740 CA THR A 115 -0.454 3.341 12.557 1.00 0.00 C ATOM 1741 C THR A 115 0.083 2.328 11.540 1.00 0.00 C ATOM 1742 O THR A 115 -0.632 1.397 11.185 1.00 0.00 O ATOM 1743 CB THR A 115 -1.329 4.454 11.945 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.576 3.952 11.523 1.00 0.00 O ATOM 1745 CG2 THR A 115 -0.742 5.132 10.715 1.00 0.00 C ATOM 0 H THR A 115 1.125 4.686 12.858 1.00 0.00 H new ATOM 0 HA THR A 115 -1.111 2.771 13.213 1.00 0.00 H new ATOM 0 HB THR A 115 -1.407 5.177 12.757 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.109 4.680 11.141 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.430 5.899 10.359 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.212 5.592 10.974 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.587 4.391 9.931 1.00 0.00 H new ATOM 1753 N LEU A 116 1.334 2.466 11.073 1.00 0.00 N ATOM 1754 CA LEU A 116 1.982 1.502 10.179 1.00 0.00 C ATOM 1755 C LEU A 116 2.009 0.128 10.868 1.00 0.00 C ATOM 1756 O LEU A 116 1.627 -0.875 10.266 1.00 0.00 O ATOM 1757 CB LEU A 116 3.396 2.000 9.805 1.00 0.00 C ATOM 1758 CG LEU A 116 4.052 1.482 8.509 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.946 -0.027 8.356 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.509 2.133 7.229 1.00 0.00 C ATOM 0 H LEU A 116 1.928 3.260 11.310 1.00 0.00 H new ATOM 0 HA LEU A 116 1.423 1.404 9.249 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.356 3.087 9.742 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.061 1.753 10.632 1.00 0.00 H new ATOM 0 HG LEU A 116 5.097 1.768 8.625 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.425 -0.333 7.426 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.441 -0.514 9.196 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.896 -0.318 8.336 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.021 1.715 6.363 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.440 1.938 7.147 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.680 3.209 7.267 1.00 0.00 H new ATOM 1772 N GLU A 117 2.410 0.087 12.138 1.00 0.00 N ATOM 1773 CA GLU A 117 2.462 -1.143 12.908 1.00 0.00 C ATOM 1774 C GLU A 117 1.058 -1.720 13.102 1.00 0.00 C ATOM 1775 O GLU A 117 0.889 -2.931 12.970 1.00 0.00 O ATOM 1776 CB GLU A 117 3.239 -0.922 14.218 1.00 0.00 C ATOM 1777 CG GLU A 117 2.526 -0.102 15.301 1.00 0.00 C ATOM 1778 CD GLU A 117 1.999 -0.995 16.421 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.771 -1.261 17.372 1.00 0.00 O ATOM 1780 OE2 GLU A 117 0.839 -1.463 16.361 1.00 0.00 O ATOM 0 H GLU A 117 2.708 0.912 12.659 1.00 0.00 H new ATOM 0 HA GLU A 117 3.016 -1.901 12.355 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.489 -1.897 14.636 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.180 -0.427 13.978 1.00 0.00 H new ATOM 0 HG2 GLU A 117 3.215 0.634 15.715 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.699 0.451 14.855 1.00 0.00 H new ATOM 1787 N GLU A 118 0.042 -0.879 13.325 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.319 -1.360 13.498 1.00 0.00 C ATOM 1789 C GLU A 118 -1.845 -1.946 12.191 1.00 0.00 C ATOM 1790 O GLU A 118 -2.324 -3.071 12.190 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.266 -0.284 14.050 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.705 -0.830 14.025 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.635 -0.222 15.062 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.873 1.008 15.038 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -5.223 -1.009 15.840 1.00 0.00 O ATOM 0 H GLU A 118 0.143 0.134 13.389 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.288 -2.149 14.249 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.981 -0.017 15.068 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.196 0.624 13.451 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.127 -0.659 13.034 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.672 -1.909 14.175 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.812 -1.215 11.075 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.341 -1.747 9.815 1.00 0.00 C ATOM 1804 C LYS A 119 -1.619 -3.040 9.417 1.00 0.00 C ATOM 1805 O LYS A 119 -2.298 -3.966 8.971 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.399 -0.677 8.706 1.00 0.00 C ATOM 1807 CG LYS A 119 -1.094 0.112 8.507 1.00 0.00 C ATOM 1808 CD LYS A 119 -0.437 0.002 7.131 1.00 0.00 C ATOM 1809 CE LYS A 119 -0.807 1.179 6.214 1.00 0.00 C ATOM 1810 NZ LYS A 119 -0.162 2.445 6.634 1.00 0.00 N ATOM 0 H LYS A 119 -1.432 -0.270 11.016 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.383 -2.027 9.972 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.662 -1.161 7.766 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -3.200 0.025 8.938 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -1.297 1.164 8.706 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -0.376 -0.221 9.256 1.00 0.00 H new ATOM 0 HD2 LYS A 119 0.646 -0.037 7.250 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -0.740 -0.933 6.659 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -0.512 0.946 5.191 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -1.889 1.309 6.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -0.830 3.232 6.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 0.115 2.378 7.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.683 2.614 6.051 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.299 -3.143 9.638 1.00 0.00 N ATOM 1825 CA LEU A 120 0.434 -4.404 9.496 1.00 0.00 C ATOM 1826 C LEU A 120 -0.170 -5.482 10.395 1.00 0.00 C ATOM 1827 O LEU A 120 -0.551 -6.542 9.912 1.00 0.00 O ATOM 1828 CB LEU A 120 1.919 -4.228 9.851 1.00 0.00 C ATOM 1829 CG LEU A 120 2.796 -3.600 8.759 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.174 -3.335 9.363 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.953 -4.509 7.537 1.00 0.00 C ATOM 0 H LEU A 120 0.285 -2.356 9.919 1.00 0.00 H new ATOM 0 HA LEU A 120 0.353 -4.711 8.453 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.989 -3.610 10.746 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.331 -5.205 10.105 1.00 0.00 H new ATOM 0 HG LEU A 120 2.317 -2.682 8.418 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.822 -2.888 8.609 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.076 -2.653 10.208 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.609 -4.275 9.703 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.582 -4.017 6.796 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.416 -5.448 7.839 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.973 -4.710 7.105 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.291 -5.212 11.694 1.00 0.00 N ATOM 1844 CA ASN A 121 -0.873 -6.134 12.660 1.00 0.00 C ATOM 1845 C ASN A 121 -2.282 -6.581 12.246 1.00 0.00 C ATOM 1846 O ASN A 121 -2.625 -7.758 12.357 1.00 0.00 O ATOM 1847 CB ASN A 121 -0.852 -5.486 14.049 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.694 -6.269 15.034 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -2.769 -5.823 15.421 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -1.249 -7.448 15.424 1.00 0.00 N ATOM 0 H ASN A 121 0.018 -4.333 12.108 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.273 -7.043 12.692 1.00 0.00 H new ATOM 0 HB2 ASN A 121 0.175 -5.428 14.410 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.224 -4.464 13.981 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -1.803 -8.016 16.065 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -0.351 -7.792 15.085 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.092 -5.670 11.708 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.430 -5.982 11.235 1.00 0.00 C ATOM 1859 C LYS A 122 -4.390 -6.939 10.053 1.00 0.00 C ATOM 1860 O LYS A 122 -5.182 -7.873 10.069 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.231 -4.710 10.915 1.00 0.00 C ATOM 1862 CG LYS A 122 -5.589 -3.956 12.205 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.681 -2.899 12.018 1.00 0.00 C ATOM 1864 CE LYS A 122 -6.268 -1.756 11.084 1.00 0.00 C ATOM 1865 NZ LYS A 122 -7.364 -0.782 10.891 1.00 0.00 N ATOM 0 H LYS A 122 -2.832 -4.691 11.590 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.953 -6.490 12.045 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.649 -4.063 10.259 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -6.142 -4.973 10.377 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -5.916 -4.675 12.956 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.692 -3.474 12.594 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -7.576 -3.378 11.620 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -6.946 -2.485 12.991 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.397 -1.246 11.496 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.971 -2.165 10.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.047 -0.024 10.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.187 -1.263 10.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.631 -0.373 11.809 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.537 -6.750 9.042 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.488 -7.664 7.883 1.00 0.00 C ATOM 1881 C ILE A 123 -2.711 -8.960 8.160 1.00 0.00 C ATOM 1882 O ILE A 123 -2.959 -9.980 7.499 1.00 0.00 O ATOM 1883 CB ILE A 123 -3.022 -6.928 6.608 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.644 -6.247 6.755 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.166 -5.979 6.217 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.436 -4.950 5.968 1.00 0.00 C ATOM 0 H ILE A 123 -2.872 -5.978 8.997 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.510 -7.996 7.699 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.835 -7.634 5.799 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.479 -6.035 7.811 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.877 -6.959 6.449 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.891 -5.429 5.317 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.070 -6.558 6.027 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.350 -5.276 7.030 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.432 -4.569 6.153 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.559 -5.147 4.903 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.170 -4.209 6.287 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.857 -8.974 9.185 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.431 -10.226 9.780 1.00 0.00 C ATOM 1900 C PHE A 124 -2.693 -10.965 10.220 1.00 0.00 C ATOM 1901 O PHE A 124 -3.030 -11.995 9.652 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.436 -10.016 10.931 1.00 0.00 C ATOM 1903 CG PHE A 124 0.873 -9.290 10.627 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.455 -9.285 9.345 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.542 -8.617 11.665 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.652 -8.591 9.095 1.00 0.00 C ATOM 1907 CE2 PHE A 124 2.727 -7.901 11.420 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.283 -7.886 10.131 1.00 0.00 C ATOM 0 H PHE A 124 -1.455 -8.139 9.611 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.883 -10.825 9.052 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.949 -9.463 11.718 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.187 -10.995 11.339 1.00 0.00 H new ATOM 0 HD1 PHE A 124 0.974 -9.823 8.541 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.139 -8.651 12.666 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.086 -8.601 8.106 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.209 -7.363 12.223 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.191 -7.335 9.938 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.461 -10.408 11.153 1.00 0.00 N ATOM 1919 CA GLU A 125 -4.528 -11.159 11.808 1.00 0.00 C ATOM 1920 C GLU A 125 -5.729 -11.403 10.886 1.00 0.00 C ATOM 1921 O GLU A 125 -6.420 -12.417 11.017 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.943 -10.410 13.085 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.819 -10.495 14.130 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.974 -9.572 15.340 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -4.994 -8.868 15.510 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.022 -9.540 16.161 1.00 0.00 O ATOM 0 H GLU A 125 -3.365 -9.444 11.471 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.150 -12.148 12.065 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.157 -9.367 12.852 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.860 -10.841 13.488 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -3.754 -11.523 14.485 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -2.873 -10.267 13.640 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.995 -10.496 9.945 1.00 0.00 N ATOM 1934 CA LYS A 126 -7.124 -10.600 9.021 1.00 0.00 C ATOM 1935 C LYS A 126 -6.740 -11.561 7.912 1.00 0.00 C ATOM 1936 O LYS A 126 -7.330 -12.637 7.811 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.556 -9.222 8.486 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.991 -9.144 7.921 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.352 -10.099 6.762 1.00 0.00 C ATOM 1940 CE LYS A 126 -10.236 -9.421 5.701 1.00 0.00 C ATOM 1941 NZ LYS A 126 -11.671 -9.398 6.056 1.00 0.00 N ATOM 0 H LYS A 126 -5.427 -9.661 9.802 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.997 -10.990 9.545 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.462 -8.494 9.292 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.860 -8.922 7.703 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.686 -9.331 8.740 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.164 -8.123 7.582 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.437 -10.460 6.293 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -9.871 -10.971 7.161 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.890 -8.398 5.551 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.113 -9.941 4.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -12.208 -8.928 5.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -12.016 -10.372 6.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.800 -8.877 6.947 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.793 -11.168 7.055 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.477 -11.927 5.851 1.00 0.00 C ATOM 1957 C LEU A 127 -4.745 -13.223 6.200 1.00 0.00 C ATOM 1958 O LEU A 127 -4.761 -14.171 5.411 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.599 -11.135 4.865 1.00 0.00 C ATOM 1960 CG LEU A 127 -4.898 -9.646 4.605 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.083 -9.193 3.388 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.378 -9.331 4.399 1.00 0.00 C ATOM 0 H LEU A 127 -5.232 -10.325 7.177 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.434 -12.142 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.570 -11.204 5.217 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.643 -11.649 3.905 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.611 -9.098 5.502 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.282 -8.140 3.188 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.021 -9.330 3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.366 -9.787 2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.501 -8.263 4.222 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.752 -9.887 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.938 -9.619 5.289 1.00 0.00 H new ATOM 1974 N GLY A 128 -4.089 -13.265 7.361 1.00 0.00 N ATOM 1975 CA GLY A 128 -3.119 -14.280 7.707 1.00 0.00 C ATOM 1976 C GLY A 128 -1.741 -13.888 7.181 1.00 0.00 C ATOM 1977 O GLY A 128 -0.996 -14.797 6.797 1.00 0.00 O ATOM 0 H GLY A 128 -4.228 -12.573 8.098 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -3.082 -14.405 8.789 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.419 -15.239 7.285 1.00 0.00 H new ATOM 1981 N MET A 129 -1.408 -12.586 7.076 1.00 0.00 N ATOM 1982 CA MET A 129 -0.028 -12.206 6.731 1.00 0.00 C ATOM 1983 C MET A 129 0.911 -12.465 7.914 1.00 0.00 C ATOM 1984 O MET A 129 2.120 -12.179 7.784 1.00 0.00 O ATOM 1985 CB MET A 129 0.043 -10.755 6.220 1.00 0.00 C ATOM 1986 CG MET A 129 -0.579 -10.586 4.833 1.00 0.00 C ATOM 1987 SD MET A 129 0.379 -11.286 3.463 1.00 0.00 S ATOM 1988 CE MET A 129 -0.924 -11.345 2.204 1.00 0.00 C ATOM 1989 OXT MET A 129 0.471 -12.997 8.961 1.00 0.00 O ATOM 0 H MET A 129 -2.051 -11.807 7.219 1.00 0.00 H new ATOM 0 HA MET A 129 0.312 -12.835 5.908 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.469 -10.100 6.925 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.085 -10.436 6.188 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.566 -11.048 4.837 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.725 -9.522 4.646 1.00 0.00 H new ATOM 0 HE1 MET A 129 -0.475 -11.495 1.222 1.00 0.00 H new ATOM 0 HE2 MET A 129 -1.603 -12.169 2.422 1.00 0.00 H new ATOM 0 HE3 MET A 129 -1.478 -10.407 2.210 1.00 0.00 H new TER 1999 MET A 129