USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 775 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 69 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 71 SER OG : rot 180:sc= 0.0108 USER MOD Set 2.1: A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 74 SER OG : rot -140:sc= 0 USER MOD Single : A 1 GLN : amide:sc= -0.0711 X(o=-0.071,f=0) USER MOD Single : A 1 GLN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0455 USER MOD Single : A 10 HIS : no HE2:sc= -0.161 K(o=-0.16,f=-0.79) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot -167:sc= 0.706 USER MOD Single : A 30 HIS : no HE2:sc= 0.796 K(o=0.8,f=-2.8!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 76:sc= 1.07 USER MOD Single : A 34 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 38 GLN : amide:sc= -2.43! C(o=-2.4!,f=-6.7!) USER MOD Single : A 43 HIS : no HD1:sc= -1.62! C(o=-1.6!,f=-2.8!) USER MOD Single : A 44 TYR OH : rot 30:sc= -0.133 USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 47 ASN : amide:sc= -0.262 X(o=-0.26,f=-0.26) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -137:sc= -0.385 (180deg=-2.14!) USER MOD Single : A 55 ASN : amide:sc= 0.00797 K(o=0.008,f=-1.3) USER MOD Single : A 56 GLN : amide:sc= -0.0333 X(o=-0.033,f=-0.13) USER MOD Single : A 61 LYS NZ :NH3+ 148:sc= -0.852 (180deg=-0.87) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= -0.451 (180deg=-0.451) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 14:sc= 0.0512 USER MOD Single : A 82 GLN : amide:sc= -1.07 K(o=-1.1,f=-5.4!) USER MOD Single : A 85 ASN : amide:sc= -0.474 X(o=-0.47,f=-0.013) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.302 K(o=-0.3,f=-0.82) USER MOD Single : A 90 HIS : no HD1:sc= -0.398 X(o=-0.4,f=-0.043) USER MOD Single : A 91 HIS : no HD1:sc= -0.026 X(o=-0.026,f=-0.12) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 93 HIS : no HD1:sc= -0.0648 X(o=-0.065,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 133.729 4.416 0.913 1.00 0.00 N ATOM 2 CA GLN A 1 135.116 4.948 0.795 1.00 0.00 C ATOM 3 C GLN A 1 136.154 3.913 1.241 1.00 0.00 C ATOM 4 O GLN A 1 136.930 4.155 2.168 1.00 0.00 O ATOM 5 CB GLN A 1 135.227 6.219 1.648 1.00 0.00 C ATOM 6 CG GLN A 1 136.057 7.319 1.001 1.00 0.00 C ATOM 7 CD GLN A 1 135.929 8.653 1.717 1.00 0.00 C ATOM 8 OE1 GLN A 1 136.920 9.219 2.176 1.00 0.00 O ATOM 9 NE2 GLN A 1 134.705 9.166 1.813 1.00 0.00 N ATOM 0 H1 GLN A 1 133.051 5.142 0.603 1.00 0.00 H new ATOM 0 H2 GLN A 1 133.629 3.571 0.315 1.00 0.00 H new ATOM 0 H3 GLN A 1 133.537 4.164 1.903 1.00 0.00 H new ATOM 0 HA GLN A 1 135.320 5.179 -0.251 1.00 0.00 H new ATOM 0 HB2 GLN A 1 134.226 6.601 1.847 1.00 0.00 H new ATOM 0 HB3 GLN A 1 135.668 5.962 2.611 1.00 0.00 H new ATOM 0 HG2 GLN A 1 137.104 7.018 0.989 1.00 0.00 H new ATOM 0 HG3 GLN A 1 135.747 7.438 -0.037 1.00 0.00 H new ATOM 0 HE21 GLN A 1 133.909 8.664 1.419 1.00 0.00 H new ATOM 0 HE22 GLN A 1 134.562 10.061 2.281 1.00 0.00 H new ATOM 17 N SER A 2 136.166 2.760 0.572 1.00 0.00 N ATOM 18 CA SER A 2 137.112 1.695 0.895 1.00 0.00 C ATOM 19 C SER A 2 138.355 1.794 0.009 1.00 0.00 C ATOM 20 O SER A 2 138.447 2.683 -0.839 1.00 0.00 O ATOM 21 CB SER A 2 136.446 0.328 0.726 1.00 0.00 C ATOM 22 OG SER A 2 137.208 -0.691 1.351 1.00 0.00 O ATOM 0 H SER A 2 135.531 2.541 -0.196 1.00 0.00 H new ATOM 0 HA SER A 2 137.420 1.809 1.934 1.00 0.00 H new ATOM 0 HB2 SER A 2 135.444 0.352 1.155 1.00 0.00 H new ATOM 0 HB3 SER A 2 136.333 0.103 -0.335 1.00 0.00 H new ATOM 0 HG SER A 2 136.761 -1.555 1.230 1.00 0.00 H new ATOM 28 N ASP A 3 139.308 0.879 0.219 1.00 0.00 N ATOM 29 CA ASP A 3 140.556 0.850 -0.551 1.00 0.00 C ATOM 30 C ASP A 3 141.472 2.011 -0.158 1.00 0.00 C ATOM 31 O ASP A 3 141.052 3.169 -0.148 1.00 0.00 O ATOM 32 CB ASP A 3 140.273 0.893 -2.059 1.00 0.00 C ATOM 33 CG ASP A 3 140.163 -0.491 -2.667 1.00 0.00 C ATOM 34 OD1 ASP A 3 139.051 -1.061 -2.645 1.00 0.00 O ATOM 35 OD2 ASP A 3 141.188 -1.006 -3.162 1.00 0.00 O ATOM 0 H ASP A 3 139.237 0.143 0.922 1.00 0.00 H new ATOM 0 HA ASP A 3 141.063 -0.086 -0.318 1.00 0.00 H new ATOM 0 HB2 ASP A 3 139.347 1.439 -2.236 1.00 0.00 H new ATOM 0 HB3 ASP A 3 141.069 1.444 -2.560 1.00 0.00 H new ATOM 40 N VAL A 4 142.727 1.689 0.165 1.00 0.00 N ATOM 41 CA VAL A 4 143.707 2.703 0.559 1.00 0.00 C ATOM 42 C VAL A 4 144.763 2.904 -0.529 1.00 0.00 C ATOM 43 O VAL A 4 145.220 1.942 -1.149 1.00 0.00 O ATOM 44 CB VAL A 4 144.413 2.332 1.884 1.00 0.00 C ATOM 45 CG1 VAL A 4 145.252 3.497 2.391 1.00 0.00 C ATOM 46 CG2 VAL A 4 143.396 1.906 2.934 1.00 0.00 C ATOM 0 H VAL A 4 143.088 0.735 0.161 1.00 0.00 H new ATOM 0 HA VAL A 4 143.154 3.631 0.702 1.00 0.00 H new ATOM 0 HB VAL A 4 145.078 1.490 1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 4 145.740 3.215 3.324 1.00 0.00 H new ATOM 0 HG12 VAL A 4 146.008 3.751 1.648 1.00 0.00 H new ATOM 0 HG13 VAL A 4 144.609 4.360 2.564 1.00 0.00 H new ATOM 0 HG21 VAL A 4 143.913 1.649 3.858 1.00 0.00 H new ATOM 0 HG22 VAL A 4 142.702 2.725 3.122 1.00 0.00 H new ATOM 0 HG23 VAL A 4 142.843 1.038 2.574 1.00 0.00 H new ATOM 56 N ARG A 5 145.143 4.163 -0.754 1.00 0.00 N ATOM 57 CA ARG A 5 146.143 4.500 -1.767 1.00 0.00 C ATOM 58 C ARG A 5 147.544 4.577 -1.158 1.00 0.00 C ATOM 59 O ARG A 5 147.831 5.463 -0.352 1.00 0.00 O ATOM 60 CB ARG A 5 145.792 5.834 -2.436 1.00 0.00 C ATOM 61 CG ARG A 5 144.885 5.691 -3.647 1.00 0.00 C ATOM 62 CD ARG A 5 143.433 5.982 -3.298 1.00 0.00 C ATOM 63 NE ARG A 5 142.836 6.957 -4.209 1.00 0.00 N ATOM 64 CZ ARG A 5 142.416 6.667 -5.444 1.00 0.00 C ATOM 65 NH1 ARG A 5 142.518 5.427 -5.919 1.00 0.00 N ATOM 66 NH2 ARG A 5 141.893 7.622 -6.207 1.00 0.00 N ATOM 0 H ARG A 5 144.772 4.967 -0.247 1.00 0.00 H new ATOM 0 HA ARG A 5 146.139 3.709 -2.517 1.00 0.00 H new ATOM 0 HB2 ARG A 5 145.307 6.480 -1.705 1.00 0.00 H new ATOM 0 HB3 ARG A 5 146.713 6.331 -2.740 1.00 0.00 H new ATOM 0 HG2 ARG A 5 145.215 6.372 -4.431 1.00 0.00 H new ATOM 0 HG3 ARG A 5 144.968 4.680 -4.047 1.00 0.00 H new ATOM 0 HD2 ARG A 5 142.859 5.056 -3.332 1.00 0.00 H new ATOM 0 HD3 ARG A 5 143.374 6.357 -2.276 1.00 0.00 H new ATOM 0 HE ARG A 5 142.734 7.918 -3.882 1.00 0.00 H new ATOM 0 HH11 ARG A 5 142.919 4.690 -5.339 1.00 0.00 H new ATOM 0 HH12 ARG A 5 142.195 5.214 -6.863 1.00 0.00 H new ATOM 0 HH21 ARG A 5 141.813 8.574 -5.849 1.00 0.00 H new ATOM 0 HH22 ARG A 5 141.572 7.403 -7.150 1.00 0.00 H new ATOM 80 N ILE A 6 148.413 3.647 -1.555 1.00 0.00 N ATOM 81 CA ILE A 6 149.787 3.612 -1.055 1.00 0.00 C ATOM 82 C ILE A 6 150.776 3.996 -2.156 1.00 0.00 C ATOM 83 O ILE A 6 150.799 3.381 -3.225 1.00 0.00 O ATOM 84 CB ILE A 6 150.155 2.213 -0.508 1.00 0.00 C ATOM 85 CG1 ILE A 6 149.084 1.722 0.473 1.00 0.00 C ATOM 86 CG2 ILE A 6 151.524 2.243 0.164 1.00 0.00 C ATOM 87 CD1 ILE A 6 149.129 0.230 0.725 1.00 0.00 C ATOM 0 H ILE A 6 148.189 2.908 -2.221 1.00 0.00 H new ATOM 0 HA ILE A 6 149.850 4.335 -0.242 1.00 0.00 H new ATOM 0 HB ILE A 6 150.200 1.517 -1.346 1.00 0.00 H new ATOM 0 HG12 ILE A 6 149.205 2.246 1.421 1.00 0.00 H new ATOM 0 HG13 ILE A 6 148.100 1.987 0.086 1.00 0.00 H new ATOM 0 HG21 ILE A 6 151.765 1.250 0.543 1.00 0.00 H new ATOM 0 HG22 ILE A 6 152.279 2.548 -0.561 1.00 0.00 H new ATOM 0 HG23 ILE A 6 151.508 2.952 0.991 1.00 0.00 H new ATOM 0 HD11 ILE A 6 148.343 -0.044 1.428 1.00 0.00 H new ATOM 0 HD12 ILE A 6 148.977 -0.302 -0.214 1.00 0.00 H new ATOM 0 HD13 ILE A 6 150.099 -0.039 1.142 1.00 0.00 H new ATOM 99 N LYS A 7 151.592 5.016 -1.888 1.00 0.00 N ATOM 100 CA LYS A 7 152.585 5.480 -2.854 1.00 0.00 C ATOM 101 C LYS A 7 153.948 4.850 -2.571 1.00 0.00 C ATOM 102 O LYS A 7 154.512 5.031 -1.490 1.00 0.00 O ATOM 103 CB LYS A 7 152.697 7.008 -2.821 1.00 0.00 C ATOM 104 CG LYS A 7 151.494 7.724 -3.417 1.00 0.00 C ATOM 105 CD LYS A 7 151.910 8.952 -4.214 1.00 0.00 C ATOM 106 CE LYS A 7 151.014 10.147 -3.918 1.00 0.00 C ATOM 107 NZ LYS A 7 149.757 10.120 -4.719 1.00 0.00 N ATOM 0 H LYS A 7 151.584 5.536 -1.010 1.00 0.00 H new ATOM 0 HA LYS A 7 152.258 5.174 -3.848 1.00 0.00 H new ATOM 0 HB2 LYS A 7 152.826 7.331 -1.788 1.00 0.00 H new ATOM 0 HB3 LYS A 7 153.593 7.309 -3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 7 150.946 7.039 -4.063 1.00 0.00 H new ATOM 0 HG3 LYS A 7 150.814 8.021 -2.618 1.00 0.00 H new ATOM 0 HD2 LYS A 7 152.944 9.205 -3.979 1.00 0.00 H new ATOM 0 HD3 LYS A 7 151.872 8.724 -5.279 1.00 0.00 H new ATOM 0 HE2 LYS A 7 150.766 10.159 -2.857 1.00 0.00 H new ATOM 0 HE3 LYS A 7 151.558 11.068 -4.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 149.178 10.952 -4.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 149.991 10.135 -5.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 149.224 9.254 -4.499 1.00 0.00 H new ATOM 121 N PHE A 8 154.469 4.110 -3.550 1.00 0.00 N ATOM 122 CA PHE A 8 155.766 3.448 -3.413 1.00 0.00 C ATOM 123 C PHE A 8 156.835 4.155 -4.245 1.00 0.00 C ATOM 124 O PHE A 8 156.568 4.606 -5.362 1.00 0.00 O ATOM 125 CB PHE A 8 155.660 1.981 -3.843 1.00 0.00 C ATOM 126 CG PHE A 8 154.760 1.154 -2.965 1.00 0.00 C ATOM 127 CD1 PHE A 8 155.256 0.535 -1.828 1.00 0.00 C ATOM 128 CD2 PHE A 8 153.419 0.996 -3.278 1.00 0.00 C ATOM 129 CE1 PHE A 8 154.432 -0.225 -1.021 1.00 0.00 C ATOM 130 CE2 PHE A 8 152.590 0.236 -2.474 1.00 0.00 C ATOM 131 CZ PHE A 8 153.098 -0.376 -1.344 1.00 0.00 C ATOM 0 H PHE A 8 154.011 3.954 -4.448 1.00 0.00 H new ATOM 0 HA PHE A 8 156.059 3.496 -2.364 1.00 0.00 H new ATOM 0 HB2 PHE A 8 155.291 1.938 -4.868 1.00 0.00 H new ATOM 0 HB3 PHE A 8 156.657 1.540 -3.844 1.00 0.00 H new ATOM 0 HD1 PHE A 8 156.299 0.648 -1.570 1.00 0.00 H new ATOM 0 HD2 PHE A 8 153.017 1.472 -4.160 1.00 0.00 H new ATOM 0 HE1 PHE A 8 154.831 -0.701 -0.138 1.00 0.00 H new ATOM 0 HE2 PHE A 8 151.547 0.121 -2.729 1.00 0.00 H new ATOM 0 HZ PHE A 8 152.453 -0.971 -0.715 1.00 0.00 H new ATOM 141 N GLU A 9 158.045 4.248 -3.692 1.00 0.00 N ATOM 142 CA GLU A 9 159.158 4.901 -4.377 1.00 0.00 C ATOM 143 C GLU A 9 160.327 3.935 -4.574 1.00 0.00 C ATOM 144 O GLU A 9 160.815 3.333 -3.615 1.00 0.00 O ATOM 145 CB GLU A 9 159.623 6.127 -3.584 1.00 0.00 C ATOM 146 CG GLU A 9 159.306 7.448 -4.267 1.00 0.00 C ATOM 147 CD GLU A 9 159.968 8.633 -3.588 1.00 0.00 C ATOM 148 OE1 GLU A 9 161.205 8.765 -3.698 1.00 0.00 O ATOM 149 OE2 GLU A 9 159.248 9.430 -2.950 1.00 0.00 O ATOM 0 H GLU A 9 158.278 3.878 -2.770 1.00 0.00 H new ATOM 0 HA GLU A 9 158.808 5.220 -5.359 1.00 0.00 H new ATOM 0 HB2 GLU A 9 159.153 6.114 -2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 9 160.699 6.059 -3.424 1.00 0.00 H new ATOM 0 HG2 GLU A 9 159.631 7.402 -5.306 1.00 0.00 H new ATOM 0 HG3 GLU A 9 158.226 7.597 -4.277 1.00 0.00 H new ATOM 156 N HIS A 10 160.773 3.798 -5.823 1.00 0.00 N ATOM 157 CA HIS A 10 161.887 2.914 -6.152 1.00 0.00 C ATOM 158 C HIS A 10 162.789 3.555 -7.206 1.00 0.00 C ATOM 159 O HIS A 10 162.354 3.812 -8.329 1.00 0.00 O ATOM 160 CB HIS A 10 161.365 1.564 -6.657 1.00 0.00 C ATOM 161 CG HIS A 10 162.379 0.464 -6.593 1.00 0.00 C ATOM 162 ND1 HIS A 10 162.468 -0.534 -7.540 1.00 0.00 N ATOM 163 CD2 HIS A 10 163.354 0.207 -5.689 1.00 0.00 C ATOM 164 CE1 HIS A 10 163.452 -1.356 -7.221 1.00 0.00 C ATOM 165 NE2 HIS A 10 164.007 -0.928 -6.102 1.00 0.00 N ATOM 0 H HIS A 10 160.377 4.290 -6.624 1.00 0.00 H new ATOM 0 HA HIS A 10 162.472 2.749 -5.247 1.00 0.00 H new ATOM 0 HB2 HIS A 10 160.494 1.278 -6.068 1.00 0.00 H new ATOM 0 HB3 HIS A 10 161.029 1.677 -7.688 1.00 0.00 H new ATOM 0 HD1 HIS A 10 161.867 -0.624 -8.360 1.00 0.00 H new ATOM 0 HD2 HIS A 10 163.577 0.788 -4.806 1.00 0.00 H new ATOM 0 HE1 HIS A 10 163.752 -2.230 -7.781 1.00 0.00 H new ATOM 174 N ASN A 11 164.043 3.818 -6.828 1.00 0.00 N ATOM 175 CA ASN A 11 165.019 4.440 -7.730 1.00 0.00 C ATOM 176 C ASN A 11 164.515 5.793 -8.241 1.00 0.00 C ATOM 177 O ASN A 11 164.803 6.188 -9.373 1.00 0.00 O ATOM 178 CB ASN A 11 165.332 3.513 -8.912 1.00 0.00 C ATOM 179 CG ASN A 11 166.142 2.296 -8.500 1.00 0.00 C ATOM 180 OD1 ASN A 11 167.295 2.416 -8.084 1.00 0.00 O ATOM 181 ND2 ASN A 11 165.542 1.115 -8.612 1.00 0.00 N ATOM 0 H ASN A 11 164.408 3.609 -5.899 1.00 0.00 H new ATOM 0 HA ASN A 11 165.935 4.608 -7.163 1.00 0.00 H new ATOM 0 HB2 ASN A 11 164.398 3.186 -9.370 1.00 0.00 H new ATOM 0 HB3 ASN A 11 165.881 4.070 -9.671 1.00 0.00 H new ATOM 0 HD21 ASN A 11 166.038 0.264 -8.349 1.00 0.00 H new ATOM 0 HD22 ASN A 11 164.585 1.060 -8.961 1.00 0.00 H new ATOM 188 N GLY A 12 163.755 6.501 -7.400 1.00 0.00 N ATOM 189 CA GLY A 12 163.220 7.796 -7.788 1.00 0.00 C ATOM 190 C GLY A 12 161.866 7.701 -8.484 1.00 0.00 C ATOM 191 O GLY A 12 161.172 8.709 -8.634 1.00 0.00 O ATOM 0 H GLY A 12 163.502 6.199 -6.459 1.00 0.00 H new ATOM 0 HA2 GLY A 12 163.123 8.422 -6.901 1.00 0.00 H new ATOM 0 HA3 GLY A 12 163.929 8.291 -8.452 1.00 0.00 H new ATOM 195 N GLU A 13 161.487 6.492 -8.910 1.00 0.00 N ATOM 196 CA GLU A 13 160.211 6.279 -9.586 1.00 0.00 C ATOM 197 C GLU A 13 159.064 6.228 -8.579 1.00 0.00 C ATOM 198 O GLU A 13 159.125 5.487 -7.595 1.00 0.00 O ATOM 199 CB GLU A 13 160.254 4.980 -10.399 1.00 0.00 C ATOM 200 CG GLU A 13 159.728 5.126 -11.820 1.00 0.00 C ATOM 201 CD GLU A 13 160.776 5.626 -12.801 1.00 0.00 C ATOM 202 OE1 GLU A 13 161.974 5.320 -12.610 1.00 0.00 O ATOM 203 OE2 GLU A 13 160.397 6.321 -13.766 1.00 0.00 O ATOM 0 H GLU A 13 162.048 5.648 -8.797 1.00 0.00 H new ATOM 0 HA GLU A 13 160.039 7.117 -10.261 1.00 0.00 H new ATOM 0 HB2 GLU A 13 161.282 4.620 -10.437 1.00 0.00 H new ATOM 0 HB3 GLU A 13 159.669 4.219 -9.882 1.00 0.00 H new ATOM 0 HG2 GLU A 13 159.352 4.162 -12.161 1.00 0.00 H new ATOM 0 HG3 GLU A 13 158.884 5.815 -11.818 1.00 0.00 H new ATOM 210 N ARG A 14 158.020 7.019 -8.831 1.00 0.00 N ATOM 211 CA ARG A 14 156.858 7.063 -7.944 1.00 0.00 C ATOM 212 C ARG A 14 155.692 6.268 -8.531 1.00 0.00 C ATOM 213 O ARG A 14 155.386 6.388 -9.719 1.00 0.00 O ATOM 214 CB ARG A 14 156.424 8.512 -7.696 1.00 0.00 C ATOM 215 CG ARG A 14 157.103 9.155 -6.495 1.00 0.00 C ATOM 216 CD ARG A 14 157.736 10.492 -6.855 1.00 0.00 C ATOM 217 NE ARG A 14 157.141 11.601 -6.109 1.00 0.00 N ATOM 218 CZ ARG A 14 155.986 12.188 -6.436 1.00 0.00 C ATOM 219 NH1 ARG A 14 155.291 11.771 -7.493 1.00 0.00 N ATOM 220 NH2 ARG A 14 155.522 13.195 -5.703 1.00 0.00 N ATOM 0 H ARG A 14 157.956 7.636 -9.640 1.00 0.00 H new ATOM 0 HA ARG A 14 157.146 6.611 -6.995 1.00 0.00 H new ATOM 0 HB2 ARG A 14 156.640 9.104 -8.585 1.00 0.00 H new ATOM 0 HB3 ARG A 14 155.344 8.539 -7.550 1.00 0.00 H new ATOM 0 HG2 ARG A 14 156.373 9.301 -5.699 1.00 0.00 H new ATOM 0 HG3 ARG A 14 157.868 8.483 -6.107 1.00 0.00 H new ATOM 0 HD2 ARG A 14 158.806 10.452 -6.652 1.00 0.00 H new ATOM 0 HD3 ARG A 14 157.620 10.671 -7.924 1.00 0.00 H new ATOM 0 HE ARG A 14 157.638 11.947 -5.289 1.00 0.00 H new ATOM 0 HH11 ARG A 14 155.640 10.998 -8.060 1.00 0.00 H new ATOM 0 HH12 ARG A 14 154.410 12.225 -7.736 1.00 0.00 H new ATOM 0 HH21 ARG A 14 156.048 13.519 -4.891 1.00 0.00 H new ATOM 0 HH22 ARG A 14 154.640 13.643 -5.952 1.00 0.00 H new ATOM 234 N ARG A 15 155.045 5.462 -7.689 1.00 0.00 N ATOM 235 CA ARG A 15 153.910 4.647 -8.123 1.00 0.00 C ATOM 236 C ARG A 15 152.806 4.633 -7.066 1.00 0.00 C ATOM 237 O ARG A 15 153.085 4.632 -5.866 1.00 0.00 O ATOM 238 CB ARG A 15 154.368 3.216 -8.420 1.00 0.00 C ATOM 239 CG ARG A 15 155.143 3.082 -9.722 1.00 0.00 C ATOM 240 CD ARG A 15 155.685 1.673 -9.909 1.00 0.00 C ATOM 241 NE ARG A 15 155.668 1.260 -11.313 1.00 0.00 N ATOM 242 CZ ARG A 15 154.564 0.891 -11.970 1.00 0.00 C ATOM 243 NH1 ARG A 15 153.382 0.892 -11.357 1.00 0.00 N ATOM 244 NH2 ARG A 15 154.642 0.527 -13.246 1.00 0.00 N ATOM 0 H ARG A 15 155.287 5.356 -6.704 1.00 0.00 H new ATOM 0 HA ARG A 15 153.506 5.090 -9.033 1.00 0.00 H new ATOM 0 HB2 ARG A 15 154.992 2.865 -7.598 1.00 0.00 H new ATOM 0 HB3 ARG A 15 153.495 2.565 -8.458 1.00 0.00 H new ATOM 0 HG2 ARG A 15 154.494 3.337 -10.560 1.00 0.00 H new ATOM 0 HG3 ARG A 15 155.968 3.794 -9.730 1.00 0.00 H new ATOM 0 HD2 ARG A 15 156.706 1.624 -9.529 1.00 0.00 H new ATOM 0 HD3 ARG A 15 155.091 0.975 -9.319 1.00 0.00 H new ATOM 0 HE ARG A 15 156.552 1.253 -11.821 1.00 0.00 H new ATOM 0 HH11 ARG A 15 153.315 1.176 -10.380 1.00 0.00 H new ATOM 0 HH12 ARG A 15 152.544 0.609 -11.865 1.00 0.00 H new ATOM 0 HH21 ARG A 15 155.544 0.529 -13.723 1.00 0.00 H new ATOM 0 HH22 ARG A 15 153.800 0.245 -13.748 1.00 0.00 H new ATOM 258 N ILE A 16 151.553 4.620 -7.522 1.00 0.00 N ATOM 259 CA ILE A 16 150.402 4.606 -6.622 1.00 0.00 C ATOM 260 C ILE A 16 149.595 3.318 -6.787 1.00 0.00 C ATOM 261 O ILE A 16 149.113 3.015 -7.881 1.00 0.00 O ATOM 262 CB ILE A 16 149.472 5.817 -6.869 1.00 0.00 C ATOM 263 CG1 ILE A 16 150.279 7.119 -6.921 1.00 0.00 C ATOM 264 CG2 ILE A 16 148.403 5.899 -5.787 1.00 0.00 C ATOM 265 CD1 ILE A 16 150.833 7.439 -8.293 1.00 0.00 C ATOM 0 H ILE A 16 151.310 4.619 -8.513 1.00 0.00 H new ATOM 0 HA ILE A 16 150.794 4.663 -5.607 1.00 0.00 H new ATOM 0 HB ILE A 16 148.981 5.678 -7.832 1.00 0.00 H new ATOM 0 HG12 ILE A 16 149.644 7.943 -6.594 1.00 0.00 H new ATOM 0 HG13 ILE A 16 151.104 7.053 -6.212 1.00 0.00 H new ATOM 0 HG21 ILE A 16 147.758 6.757 -5.977 1.00 0.00 H new ATOM 0 HG22 ILE A 16 147.806 4.987 -5.796 1.00 0.00 H new ATOM 0 HG23 ILE A 16 148.879 6.012 -4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 16 151.392 8.374 -8.251 1.00 0.00 H new ATOM 0 HD12 ILE A 16 151.495 6.635 -8.615 1.00 0.00 H new ATOM 0 HD13 ILE A 16 150.012 7.539 -9.003 1.00 0.00 H new ATOM 277 N ILE A 17 149.453 2.563 -5.696 1.00 0.00 N ATOM 278 CA ILE A 17 148.705 1.306 -5.720 1.00 0.00 C ATOM 279 C ILE A 17 147.575 1.311 -4.690 1.00 0.00 C ATOM 280 O ILE A 17 147.766 1.734 -3.548 1.00 0.00 O ATOM 281 CB ILE A 17 149.623 0.092 -5.450 1.00 0.00 C ATOM 282 CG1 ILE A 17 150.892 0.169 -6.308 1.00 0.00 C ATOM 283 CG2 ILE A 17 148.876 -1.211 -5.714 1.00 0.00 C ATOM 284 CD1 ILE A 17 150.628 0.092 -7.798 1.00 0.00 C ATOM 0 H ILE A 17 149.846 2.801 -4.785 1.00 0.00 H new ATOM 0 HA ILE A 17 148.281 1.217 -6.720 1.00 0.00 H new ATOM 0 HB ILE A 17 149.919 0.114 -4.401 1.00 0.00 H new ATOM 0 HG12 ILE A 17 151.412 1.101 -6.088 1.00 0.00 H new ATOM 0 HG13 ILE A 17 151.561 -0.643 -6.024 1.00 0.00 H new ATOM 0 HG21 ILE A 17 149.537 -2.055 -5.519 1.00 0.00 H new ATOM 0 HG22 ILE A 17 148.007 -1.272 -5.059 1.00 0.00 H new ATOM 0 HG23 ILE A 17 148.549 -1.239 -6.753 1.00 0.00 H new ATOM 0 HD11 ILE A 17 151.573 0.153 -8.339 1.00 0.00 H new ATOM 0 HD12 ILE A 17 150.136 -0.852 -8.032 1.00 0.00 H new ATOM 0 HD13 ILE A 17 149.985 0.920 -8.097 1.00 0.00 H new ATOM 296 N ALA A 18 146.401 0.829 -5.102 1.00 0.00 N ATOM 297 CA ALA A 18 145.239 0.768 -4.217 1.00 0.00 C ATOM 298 C ALA A 18 145.049 -0.641 -3.659 1.00 0.00 C ATOM 299 O ALA A 18 145.120 -1.625 -4.399 1.00 0.00 O ATOM 300 CB ALA A 18 143.984 1.218 -4.954 1.00 0.00 C ATOM 0 H ALA A 18 146.231 0.475 -6.043 1.00 0.00 H new ATOM 0 HA ALA A 18 145.416 1.444 -3.381 1.00 0.00 H new ATOM 0 HB1 ALA A 18 143.128 1.166 -4.281 1.00 0.00 H new ATOM 0 HB2 ALA A 18 144.113 2.244 -5.299 1.00 0.00 H new ATOM 0 HB3 ALA A 18 143.811 0.566 -5.810 1.00 0.00 H new ATOM 306 N PHE A 19 144.806 -0.732 -2.351 1.00 0.00 N ATOM 307 CA PHE A 19 144.606 -2.021 -1.692 1.00 0.00 C ATOM 308 C PHE A 19 143.313 -2.027 -0.876 1.00 0.00 C ATOM 309 O PHE A 19 143.104 -1.162 -0.023 1.00 0.00 O ATOM 310 CB PHE A 19 145.795 -2.347 -0.782 1.00 0.00 C ATOM 311 CG PHE A 19 147.059 -2.681 -1.527 1.00 0.00 C ATOM 312 CD1 PHE A 19 147.259 -3.952 -2.046 1.00 0.00 C ATOM 313 CD2 PHE A 19 148.046 -1.725 -1.709 1.00 0.00 C ATOM 314 CE1 PHE A 19 148.419 -4.261 -2.730 1.00 0.00 C ATOM 315 CE2 PHE A 19 149.208 -2.030 -2.392 1.00 0.00 C ATOM 316 CZ PHE A 19 149.395 -3.299 -2.904 1.00 0.00 C ATOM 0 H PHE A 19 144.743 0.073 -1.727 1.00 0.00 H new ATOM 0 HA PHE A 19 144.529 -2.783 -2.467 1.00 0.00 H new ATOM 0 HB2 PHE A 19 145.984 -1.495 -0.129 1.00 0.00 H new ATOM 0 HB3 PHE A 19 145.530 -3.188 -0.141 1.00 0.00 H new ATOM 0 HD1 PHE A 19 146.499 -4.708 -1.914 1.00 0.00 H new ATOM 0 HD2 PHE A 19 147.905 -0.730 -1.312 1.00 0.00 H new ATOM 0 HE1 PHE A 19 148.563 -5.254 -3.129 1.00 0.00 H new ATOM 0 HE2 PHE A 19 149.970 -1.276 -2.525 1.00 0.00 H new ATOM 0 HZ PHE A 19 150.302 -3.539 -3.439 1.00 0.00 H new ATOM 326 N SER A 20 142.453 -3.011 -1.141 1.00 0.00 N ATOM 327 CA SER A 20 141.182 -3.138 -0.430 1.00 0.00 C ATOM 328 C SER A 20 141.361 -3.911 0.877 1.00 0.00 C ATOM 329 O SER A 20 142.237 -4.772 0.984 1.00 0.00 O ATOM 330 CB SER A 20 140.147 -3.844 -1.312 1.00 0.00 C ATOM 331 OG SER A 20 138.906 -3.986 -0.638 1.00 0.00 O ATOM 0 H SER A 20 142.615 -3.732 -1.844 1.00 0.00 H new ATOM 0 HA SER A 20 140.827 -2.135 -0.194 1.00 0.00 H new ATOM 0 HB2 SER A 20 140.001 -3.276 -2.231 1.00 0.00 H new ATOM 0 HB3 SER A 20 140.521 -4.826 -1.600 1.00 0.00 H new ATOM 0 HG SER A 20 138.265 -4.438 -1.225 1.00 0.00 H new ATOM 337 N ARG A 21 140.517 -3.607 1.862 1.00 0.00 N ATOM 338 CA ARG A 21 140.571 -4.279 3.158 1.00 0.00 C ATOM 339 C ARG A 21 139.742 -5.564 3.128 1.00 0.00 C ATOM 340 O ARG A 21 138.766 -5.658 2.383 1.00 0.00 O ATOM 341 CB ARG A 21 140.055 -3.351 4.264 1.00 0.00 C ATOM 342 CG ARG A 21 140.774 -2.010 4.326 1.00 0.00 C ATOM 343 CD ARG A 21 139.953 -0.907 3.673 1.00 0.00 C ATOM 344 NE ARG A 21 140.368 0.424 4.112 1.00 0.00 N ATOM 345 CZ ARG A 21 140.044 0.959 5.294 1.00 0.00 C ATOM 346 NH1 ARG A 21 139.322 0.266 6.173 1.00 0.00 N ATOM 347 NH2 ARG A 21 140.448 2.188 5.599 1.00 0.00 N ATOM 0 H ARG A 21 139.787 -2.899 1.786 1.00 0.00 H new ATOM 0 HA ARG A 21 141.610 -4.534 3.368 1.00 0.00 H new ATOM 0 HB2 ARG A 21 138.990 -3.175 4.111 1.00 0.00 H new ATOM 0 HB3 ARG A 21 140.160 -3.854 5.225 1.00 0.00 H new ATOM 0 HG2 ARG A 21 140.973 -1.750 5.366 1.00 0.00 H new ATOM 0 HG3 ARG A 21 141.740 -2.090 3.827 1.00 0.00 H new ATOM 0 HD2 ARG A 21 140.050 -0.977 2.590 1.00 0.00 H new ATOM 0 HD3 ARG A 21 138.899 -1.053 3.909 1.00 0.00 H new ATOM 0 HE ARG A 21 140.941 0.980 3.477 1.00 0.00 H new ATOM 0 HH11 ARG A 21 139.013 -0.679 5.946 1.00 0.00 H new ATOM 0 HH12 ARG A 21 139.079 0.680 7.073 1.00 0.00 H new ATOM 0 HH21 ARG A 21 141.005 2.722 4.932 1.00 0.00 H new ATOM 0 HH22 ARG A 21 140.201 2.597 6.500 1.00 0.00 H new ATOM 361 N PRO A 22 140.119 -6.578 3.934 1.00 0.00 N ATOM 362 CA PRO A 22 141.276 -6.511 4.837 1.00 0.00 C ATOM 363 C PRO A 22 142.607 -6.683 4.106 1.00 0.00 C ATOM 364 O PRO A 22 142.803 -7.653 3.371 1.00 0.00 O ATOM 365 CB PRO A 22 141.036 -7.682 5.791 1.00 0.00 C ATOM 366 CG PRO A 22 140.272 -8.674 4.984 1.00 0.00 C ATOM 367 CD PRO A 22 139.428 -7.879 4.023 1.00 0.00 C ATOM 0 HA PRO A 22 141.353 -5.542 5.329 1.00 0.00 H new ATOM 0 HB2 PRO A 22 141.977 -8.102 6.148 1.00 0.00 H new ATOM 0 HB3 PRO A 22 140.473 -7.368 6.670 1.00 0.00 H new ATOM 0 HG2 PRO A 22 140.947 -9.341 4.448 1.00 0.00 H new ATOM 0 HG3 PRO A 22 139.649 -9.298 5.624 1.00 0.00 H new ATOM 0 HD2 PRO A 22 139.366 -8.365 3.050 1.00 0.00 H new ATOM 0 HD3 PRO A 22 138.407 -7.765 4.388 1.00 0.00 H new ATOM 375 N VAL A 23 143.521 -5.737 4.320 1.00 0.00 N ATOM 376 CA VAL A 23 144.837 -5.782 3.688 1.00 0.00 C ATOM 377 C VAL A 23 145.858 -6.474 4.593 1.00 0.00 C ATOM 378 O VAL A 23 145.980 -6.147 5.776 1.00 0.00 O ATOM 379 CB VAL A 23 145.336 -4.364 3.320 1.00 0.00 C ATOM 380 CG1 VAL A 23 145.526 -3.509 4.566 1.00 0.00 C ATOM 381 CG2 VAL A 23 146.625 -4.437 2.512 1.00 0.00 C ATOM 0 H VAL A 23 143.373 -4.930 4.927 1.00 0.00 H new ATOM 0 HA VAL A 23 144.733 -6.360 2.770 1.00 0.00 H new ATOM 0 HB VAL A 23 144.573 -3.890 2.702 1.00 0.00 H new ATOM 0 HG11 VAL A 23 145.877 -2.518 4.277 1.00 0.00 H new ATOM 0 HG12 VAL A 23 144.576 -3.418 5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 23 146.261 -3.978 5.220 1.00 0.00 H new ATOM 0 HG21 VAL A 23 146.957 -3.429 2.265 1.00 0.00 H new ATOM 0 HG22 VAL A 23 147.394 -4.939 3.099 1.00 0.00 H new ATOM 0 HG23 VAL A 23 146.447 -4.996 1.593 1.00 0.00 H new ATOM 391 N LYS A 24 146.582 -7.439 4.029 1.00 0.00 N ATOM 392 CA LYS A 24 147.589 -8.188 4.776 1.00 0.00 C ATOM 393 C LYS A 24 148.995 -7.668 4.478 1.00 0.00 C ATOM 394 O LYS A 24 149.296 -7.286 3.346 1.00 0.00 O ATOM 395 CB LYS A 24 147.498 -9.677 4.430 1.00 0.00 C ATOM 396 CG LYS A 24 147.154 -10.561 5.618 1.00 0.00 C ATOM 397 CD LYS A 24 145.653 -10.778 5.736 1.00 0.00 C ATOM 398 CE LYS A 24 145.283 -11.385 7.081 1.00 0.00 C ATOM 399 NZ LYS A 24 144.085 -12.267 6.984 1.00 0.00 N ATOM 0 H LYS A 24 146.489 -7.721 3.053 1.00 0.00 H new ATOM 0 HA LYS A 24 147.394 -8.052 5.840 1.00 0.00 H new ATOM 0 HB2 LYS A 24 146.744 -9.815 3.655 1.00 0.00 H new ATOM 0 HB3 LYS A 24 148.450 -10.002 4.010 1.00 0.00 H new ATOM 0 HG2 LYS A 24 147.655 -11.524 5.513 1.00 0.00 H new ATOM 0 HG3 LYS A 24 147.530 -10.104 6.534 1.00 0.00 H new ATOM 0 HD2 LYS A 24 145.136 -9.827 5.610 1.00 0.00 H new ATOM 0 HD3 LYS A 24 145.315 -11.434 4.934 1.00 0.00 H new ATOM 0 HE2 LYS A 24 146.126 -11.960 7.464 1.00 0.00 H new ATOM 0 HE3 LYS A 24 145.089 -10.587 7.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 143.867 -12.660 7.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 143.273 -11.714 6.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 144.278 -13.043 6.320 1.00 0.00 H new ATOM 413 N TYR A 25 149.853 -7.663 5.502 1.00 0.00 N ATOM 414 CA TYR A 25 151.232 -7.195 5.352 1.00 0.00 C ATOM 415 C TYR A 25 151.961 -7.987 4.266 1.00 0.00 C ATOM 416 O TYR A 25 152.537 -7.405 3.344 1.00 0.00 O ATOM 417 CB TYR A 25 151.989 -7.314 6.681 1.00 0.00 C ATOM 418 CG TYR A 25 153.455 -6.948 6.582 1.00 0.00 C ATOM 419 CD1 TYR A 25 154.399 -7.884 6.175 1.00 0.00 C ATOM 420 CD2 TYR A 25 153.893 -5.666 6.890 1.00 0.00 C ATOM 421 CE1 TYR A 25 155.735 -7.553 6.077 1.00 0.00 C ATOM 422 CE2 TYR A 25 155.230 -5.328 6.795 1.00 0.00 C ATOM 423 CZ TYR A 25 156.146 -6.275 6.388 1.00 0.00 C ATOM 424 OH TYR A 25 157.477 -5.941 6.290 1.00 0.00 O ATOM 0 H TYR A 25 149.616 -7.978 6.443 1.00 0.00 H new ATOM 0 HA TYR A 25 151.200 -6.147 5.056 1.00 0.00 H new ATOM 0 HB2 TYR A 25 151.512 -6.670 7.420 1.00 0.00 H new ATOM 0 HB3 TYR A 25 151.903 -8.337 7.047 1.00 0.00 H new ATOM 0 HD1 TYR A 25 154.081 -8.887 5.931 1.00 0.00 H new ATOM 0 HD2 TYR A 25 153.178 -4.922 7.209 1.00 0.00 H new ATOM 0 HE1 TYR A 25 156.455 -8.292 5.758 1.00 0.00 H new ATOM 0 HE2 TYR A 25 155.555 -4.327 7.038 1.00 0.00 H new ATOM 0 HH TYR A 25 157.632 -5.081 6.734 1.00 0.00 H new ATOM 434 N GLU A 26 151.927 -9.316 4.380 1.00 0.00 N ATOM 435 CA GLU A 26 152.580 -10.191 3.406 1.00 0.00 C ATOM 436 C GLU A 26 152.005 -9.979 2.006 1.00 0.00 C ATOM 437 O GLU A 26 152.730 -10.066 1.018 1.00 0.00 O ATOM 438 CB GLU A 26 152.440 -11.665 3.809 1.00 0.00 C ATOM 439 CG GLU A 26 151.008 -12.090 4.107 1.00 0.00 C ATOM 440 CD GLU A 26 150.390 -12.953 3.017 1.00 0.00 C ATOM 441 OE1 GLU A 26 150.790 -12.818 1.840 1.00 0.00 O ATOM 442 OE2 GLU A 26 149.498 -13.764 3.343 1.00 0.00 O ATOM 0 H GLU A 26 151.454 -9.809 5.137 1.00 0.00 H new ATOM 0 HA GLU A 26 153.639 -9.932 3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 26 152.835 -12.290 3.008 1.00 0.00 H new ATOM 0 HB3 GLU A 26 153.054 -11.851 4.690 1.00 0.00 H new ATOM 0 HG2 GLU A 26 150.989 -12.639 5.048 1.00 0.00 H new ATOM 0 HG3 GLU A 26 150.395 -11.200 4.245 1.00 0.00 H new ATOM 449 N ASP A 27 150.698 -9.706 1.929 1.00 0.00 N ATOM 450 CA ASP A 27 150.033 -9.482 0.644 1.00 0.00 C ATOM 451 C ASP A 27 150.611 -8.260 -0.065 1.00 0.00 C ATOM 452 O ASP A 27 150.885 -8.300 -1.265 1.00 0.00 O ATOM 453 CB ASP A 27 148.522 -9.303 0.839 1.00 0.00 C ATOM 454 CG ASP A 27 147.766 -9.316 -0.476 1.00 0.00 C ATOM 455 OD1 ASP A 27 147.767 -8.278 -1.173 1.00 0.00 O ATOM 456 OD2 ASP A 27 147.174 -10.363 -0.810 1.00 0.00 O ATOM 0 H ASP A 27 150.083 -9.635 2.739 1.00 0.00 H new ATOM 0 HA ASP A 27 150.208 -10.361 0.023 1.00 0.00 H new ATOM 0 HB2 ASP A 27 148.144 -10.099 1.481 1.00 0.00 H new ATOM 0 HB3 ASP A 27 148.334 -8.361 1.355 1.00 0.00 H new ATOM 461 N VAL A 28 150.801 -7.177 0.687 1.00 0.00 N ATOM 462 CA VAL A 28 151.356 -5.944 0.132 1.00 0.00 C ATOM 463 C VAL A 28 152.817 -6.146 -0.266 1.00 0.00 C ATOM 464 O VAL A 28 153.224 -5.793 -1.374 1.00 0.00 O ATOM 465 CB VAL A 28 151.257 -4.771 1.136 1.00 0.00 C ATOM 466 CG1 VAL A 28 151.724 -3.470 0.498 1.00 0.00 C ATOM 467 CG2 VAL A 28 149.835 -4.626 1.665 1.00 0.00 C ATOM 0 H VAL A 28 150.579 -7.129 1.681 1.00 0.00 H new ATOM 0 HA VAL A 28 150.767 -5.694 -0.750 1.00 0.00 H new ATOM 0 HB VAL A 28 151.913 -4.995 1.977 1.00 0.00 H new ATOM 0 HG11 VAL A 28 151.645 -2.660 1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 28 152.762 -3.573 0.180 1.00 0.00 H new ATOM 0 HG13 VAL A 28 151.100 -3.244 -0.367 1.00 0.00 H new ATOM 0 HG21 VAL A 28 149.792 -3.795 2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 28 149.156 -4.434 0.834 1.00 0.00 H new ATOM 0 HG23 VAL A 28 149.539 -5.545 2.171 1.00 0.00 H new ATOM 477 N GLU A 29 153.597 -6.726 0.647 1.00 0.00 N ATOM 478 CA GLU A 29 155.012 -6.987 0.403 1.00 0.00 C ATOM 479 C GLU A 29 155.209 -7.963 -0.759 1.00 0.00 C ATOM 480 O GLU A 29 156.151 -7.821 -1.539 1.00 0.00 O ATOM 481 CB GLU A 29 155.668 -7.544 1.670 1.00 0.00 C ATOM 482 CG GLU A 29 157.175 -7.705 1.558 1.00 0.00 C ATOM 483 CD GLU A 29 157.924 -6.449 1.958 1.00 0.00 C ATOM 484 OE1 GLU A 29 158.141 -6.250 3.173 1.00 0.00 O ATOM 485 OE2 GLU A 29 158.286 -5.660 1.059 1.00 0.00 O ATOM 0 H GLU A 29 153.269 -7.024 1.566 1.00 0.00 H new ATOM 0 HA GLU A 29 155.485 -6.043 0.133 1.00 0.00 H new ATOM 0 HB2 GLU A 29 155.444 -6.881 2.506 1.00 0.00 H new ATOM 0 HB3 GLU A 29 155.224 -8.512 1.903 1.00 0.00 H new ATOM 0 HG2 GLU A 29 157.497 -8.533 2.190 1.00 0.00 H new ATOM 0 HG3 GLU A 29 157.434 -7.968 0.532 1.00 0.00 H new ATOM 492 N HIS A 30 154.317 -8.951 -0.870 1.00 0.00 N ATOM 493 CA HIS A 30 154.406 -9.947 -1.937 1.00 0.00 C ATOM 494 C HIS A 30 154.382 -9.282 -3.310 1.00 0.00 C ATOM 495 O HIS A 30 155.178 -9.626 -4.183 1.00 0.00 O ATOM 496 CB HIS A 30 153.255 -10.954 -1.836 1.00 0.00 C ATOM 497 CG HIS A 30 153.649 -12.265 -1.228 1.00 0.00 C ATOM 498 ND1 HIS A 30 153.546 -12.529 0.121 1.00 0.00 N ATOM 499 CD2 HIS A 30 154.135 -13.396 -1.794 1.00 0.00 C ATOM 500 CE1 HIS A 30 153.949 -13.763 0.359 1.00 0.00 C ATOM 501 NE2 HIS A 30 154.312 -14.312 -0.785 1.00 0.00 N ATOM 0 H HIS A 30 153.529 -9.081 -0.236 1.00 0.00 H new ATOM 0 HA HIS A 30 155.353 -10.473 -1.818 1.00 0.00 H new ATOM 0 HB2 HIS A 30 152.452 -10.516 -1.243 1.00 0.00 H new ATOM 0 HB3 HIS A 30 152.853 -11.133 -2.833 1.00 0.00 H new ATOM 0 HD1 HIS A 30 153.210 -11.873 0.826 1.00 0.00 H new ATOM 0 HD2 HIS A 30 154.344 -13.549 -2.842 1.00 0.00 H new ATOM 0 HE1 HIS A 30 153.977 -14.242 1.326 1.00 0.00 H new ATOM 510 N LYS A 31 153.472 -8.326 -3.495 1.00 0.00 N ATOM 511 CA LYS A 31 153.362 -7.619 -4.768 1.00 0.00 C ATOM 512 C LYS A 31 154.657 -6.877 -5.089 1.00 0.00 C ATOM 513 O LYS A 31 155.162 -6.957 -6.208 1.00 0.00 O ATOM 514 CB LYS A 31 152.186 -6.637 -4.745 1.00 0.00 C ATOM 515 CG LYS A 31 151.886 -6.020 -6.103 1.00 0.00 C ATOM 516 CD LYS A 31 150.500 -5.397 -6.145 1.00 0.00 C ATOM 517 CE LYS A 31 149.586 -6.125 -7.120 1.00 0.00 C ATOM 518 NZ LYS A 31 148.163 -6.102 -6.677 1.00 0.00 N ATOM 0 H LYS A 31 152.805 -8.026 -2.784 1.00 0.00 H new ATOM 0 HA LYS A 31 153.182 -8.360 -5.547 1.00 0.00 H new ATOM 0 HB2 LYS A 31 151.297 -7.155 -4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 31 152.401 -5.841 -4.032 1.00 0.00 H new ATOM 0 HG2 LYS A 31 152.633 -5.260 -6.330 1.00 0.00 H new ATOM 0 HG3 LYS A 31 151.964 -6.785 -6.875 1.00 0.00 H new ATOM 0 HD2 LYS A 31 150.060 -5.419 -5.148 1.00 0.00 H new ATOM 0 HD3 LYS A 31 150.580 -4.349 -6.434 1.00 0.00 H new ATOM 0 HE2 LYS A 31 149.666 -5.664 -8.105 1.00 0.00 H new ATOM 0 HE3 LYS A 31 149.917 -7.159 -7.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 147.576 -6.609 -7.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 148.081 -6.564 -5.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 147.838 -5.117 -6.603 1.00 0.00 H new ATOM 532 N VAL A 32 155.195 -6.163 -4.101 1.00 0.00 N ATOM 533 CA VAL A 32 156.435 -5.412 -4.290 1.00 0.00 C ATOM 534 C VAL A 32 157.597 -6.342 -4.640 1.00 0.00 C ATOM 535 O VAL A 32 158.349 -6.080 -5.579 1.00 0.00 O ATOM 536 CB VAL A 32 156.806 -4.591 -3.037 1.00 0.00 C ATOM 537 CG1 VAL A 32 158.017 -3.712 -3.315 1.00 0.00 C ATOM 538 CG2 VAL A 32 155.624 -3.747 -2.575 1.00 0.00 C ATOM 0 H VAL A 32 154.794 -6.089 -3.166 1.00 0.00 H new ATOM 0 HA VAL A 32 156.258 -4.726 -5.118 1.00 0.00 H new ATOM 0 HB VAL A 32 157.061 -5.285 -2.236 1.00 0.00 H new ATOM 0 HG11 VAL A 32 158.265 -3.140 -2.421 1.00 0.00 H new ATOM 0 HG12 VAL A 32 158.865 -4.338 -3.592 1.00 0.00 H new ATOM 0 HG13 VAL A 32 157.790 -3.027 -4.132 1.00 0.00 H new ATOM 0 HG21 VAL A 32 155.908 -3.177 -1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 32 155.333 -3.062 -3.371 1.00 0.00 H new ATOM 0 HG23 VAL A 32 154.784 -4.398 -2.332 1.00 0.00 H new ATOM 548 N THR A 33 157.736 -7.430 -3.879 1.00 0.00 N ATOM 549 CA THR A 33 158.807 -8.398 -4.112 1.00 0.00 C ATOM 550 C THR A 33 158.635 -9.108 -5.458 1.00 0.00 C ATOM 551 O THR A 33 159.616 -9.368 -6.151 1.00 0.00 O ATOM 552 CB THR A 33 158.867 -9.431 -2.980 1.00 0.00 C ATOM 553 OG1 THR A 33 158.666 -8.817 -1.716 1.00 0.00 O ATOM 554 CG2 THR A 33 160.186 -10.173 -2.917 1.00 0.00 C ATOM 0 H THR A 33 157.121 -7.661 -3.098 1.00 0.00 H new ATOM 0 HA THR A 33 159.746 -7.844 -4.134 1.00 0.00 H new ATOM 0 HB THR A 33 158.071 -10.142 -3.204 1.00 0.00 H new ATOM 0 HG1 THR A 33 157.716 -8.603 -1.603 1.00 0.00 H new ATOM 0 HG21 THR A 33 160.162 -10.888 -2.095 1.00 0.00 H new ATOM 0 HG22 THR A 33 160.350 -10.704 -3.855 1.00 0.00 H new ATOM 0 HG23 THR A 33 160.996 -9.462 -2.756 1.00 0.00 H new ATOM 562 N THR A 34 157.390 -9.427 -5.821 1.00 0.00 N ATOM 563 CA THR A 34 157.114 -10.113 -7.085 1.00 0.00 C ATOM 564 C THR A 34 157.325 -9.186 -8.286 1.00 0.00 C ATOM 565 O THR A 34 157.985 -9.565 -9.254 1.00 0.00 O ATOM 566 CB THR A 34 155.687 -10.679 -7.101 1.00 0.00 C ATOM 567 OG1 THR A 34 155.488 -11.583 -6.027 1.00 0.00 O ATOM 568 CG2 THR A 34 155.347 -11.417 -8.379 1.00 0.00 C ATOM 0 H THR A 34 156.562 -9.223 -5.261 1.00 0.00 H new ATOM 0 HA THR A 34 157.821 -10.939 -7.165 1.00 0.00 H new ATOM 0 HB THR A 34 155.037 -9.808 -7.014 1.00 0.00 H new ATOM 0 HG1 THR A 34 155.315 -11.080 -5.204 1.00 0.00 H new ATOM 0 HG21 THR A 34 154.325 -11.790 -8.323 1.00 0.00 H new ATOM 0 HG22 THR A 34 155.439 -10.738 -9.227 1.00 0.00 H new ATOM 0 HG23 THR A 34 156.032 -12.255 -8.509 1.00 0.00 H new ATOM 576 N VAL A 35 156.760 -7.979 -8.227 1.00 0.00 N ATOM 577 CA VAL A 35 156.891 -7.019 -9.326 1.00 0.00 C ATOM 578 C VAL A 35 158.355 -6.644 -9.567 1.00 0.00 C ATOM 579 O VAL A 35 158.833 -6.689 -10.702 1.00 0.00 O ATOM 580 CB VAL A 35 156.070 -5.732 -9.076 1.00 0.00 C ATOM 581 CG1 VAL A 35 156.207 -4.767 -10.247 1.00 0.00 C ATOM 582 CG2 VAL A 35 154.603 -6.065 -8.828 1.00 0.00 C ATOM 0 H VAL A 35 156.211 -7.644 -7.436 1.00 0.00 H new ATOM 0 HA VAL A 35 156.496 -7.515 -10.213 1.00 0.00 H new ATOM 0 HB VAL A 35 156.467 -5.247 -8.184 1.00 0.00 H new ATOM 0 HG11 VAL A 35 155.621 -3.869 -10.049 1.00 0.00 H new ATOM 0 HG12 VAL A 35 157.255 -4.496 -10.374 1.00 0.00 H new ATOM 0 HG13 VAL A 35 155.843 -5.245 -11.157 1.00 0.00 H new ATOM 0 HG21 VAL A 35 154.045 -5.145 -8.655 1.00 0.00 H new ATOM 0 HG22 VAL A 35 154.194 -6.579 -9.698 1.00 0.00 H new ATOM 0 HG23 VAL A 35 154.519 -6.710 -7.953 1.00 0.00 H new ATOM 592 N PHE A 36 159.062 -6.272 -8.499 1.00 0.00 N ATOM 593 CA PHE A 36 160.472 -5.888 -8.608 1.00 0.00 C ATOM 594 C PHE A 36 161.397 -7.106 -8.663 1.00 0.00 C ATOM 595 O PHE A 36 162.542 -6.997 -9.106 1.00 0.00 O ATOM 596 CB PHE A 36 160.877 -4.991 -7.435 1.00 0.00 C ATOM 597 CG PHE A 36 160.172 -3.663 -7.413 1.00 0.00 C ATOM 598 CD1 PHE A 36 160.042 -2.905 -8.568 1.00 0.00 C ATOM 599 CD2 PHE A 36 159.641 -3.172 -6.233 1.00 0.00 C ATOM 600 CE1 PHE A 36 159.395 -1.685 -8.543 1.00 0.00 C ATOM 601 CE2 PHE A 36 158.994 -1.953 -6.202 1.00 0.00 C ATOM 602 CZ PHE A 36 158.871 -1.208 -7.358 1.00 0.00 C ATOM 0 H PHE A 36 158.685 -6.228 -7.552 1.00 0.00 H new ATOM 0 HA PHE A 36 160.580 -5.339 -9.543 1.00 0.00 H new ATOM 0 HB2 PHE A 36 160.673 -5.515 -6.502 1.00 0.00 H new ATOM 0 HB3 PHE A 36 161.953 -4.820 -7.476 1.00 0.00 H new ATOM 0 HD1 PHE A 36 160.451 -3.273 -9.497 1.00 0.00 H new ATOM 0 HD2 PHE A 36 159.734 -3.750 -5.325 1.00 0.00 H new ATOM 0 HE1 PHE A 36 159.299 -1.105 -9.449 1.00 0.00 H new ATOM 0 HE2 PHE A 36 158.584 -1.582 -5.274 1.00 0.00 H new ATOM 0 HZ PHE A 36 158.366 -0.254 -7.335 1.00 0.00 H new ATOM 612 N GLY A 37 160.906 -8.258 -8.203 1.00 0.00 N ATOM 613 CA GLY A 37 161.713 -9.467 -8.205 1.00 0.00 C ATOM 614 C GLY A 37 162.855 -9.415 -7.202 1.00 0.00 C ATOM 615 O GLY A 37 163.933 -9.955 -7.457 1.00 0.00 O ATOM 0 H GLY A 37 159.964 -8.374 -7.830 1.00 0.00 H new ATOM 0 HA2 GLY A 37 161.077 -10.323 -7.980 1.00 0.00 H new ATOM 0 HA3 GLY A 37 162.120 -9.625 -9.204 1.00 0.00 H new ATOM 619 N GLN A 38 162.623 -8.761 -6.061 1.00 0.00 N ATOM 620 CA GLN A 38 163.647 -8.640 -5.022 1.00 0.00 C ATOM 621 C GLN A 38 163.049 -8.123 -3.712 1.00 0.00 C ATOM 622 O GLN A 38 162.074 -7.368 -3.721 1.00 0.00 O ATOM 623 CB GLN A 38 164.766 -7.704 -5.487 1.00 0.00 C ATOM 624 CG GLN A 38 164.257 -6.421 -6.128 1.00 0.00 C ATOM 625 CD GLN A 38 164.921 -5.178 -5.569 1.00 0.00 C ATOM 626 OE1 GLN A 38 165.280 -5.125 -4.394 1.00 0.00 O ATOM 627 NE2 GLN A 38 165.085 -4.165 -6.412 1.00 0.00 N ATOM 0 H GLN A 38 161.737 -8.309 -5.834 1.00 0.00 H new ATOM 0 HA GLN A 38 164.059 -9.633 -4.842 1.00 0.00 H new ATOM 0 HB2 GLN A 38 165.394 -7.450 -4.633 1.00 0.00 H new ATOM 0 HB3 GLN A 38 165.397 -8.232 -6.202 1.00 0.00 H new ATOM 0 HG2 GLN A 38 164.428 -6.466 -7.204 1.00 0.00 H new ATOM 0 HG3 GLN A 38 163.180 -6.349 -5.979 1.00 0.00 H new ATOM 0 HE21 GLN A 38 164.773 -4.251 -7.379 1.00 0.00 H new ATOM 0 HE22 GLN A 38 165.523 -3.301 -6.092 1.00 0.00 H new ATOM 636 N PRO A 39 163.629 -8.526 -2.563 1.00 0.00 N ATOM 637 CA PRO A 39 163.151 -8.104 -1.242 1.00 0.00 C ATOM 638 C PRO A 39 163.584 -6.680 -0.884 1.00 0.00 C ATOM 639 O PRO A 39 164.771 -6.350 -0.936 1.00 0.00 O ATOM 640 CB PRO A 39 163.803 -9.118 -0.301 1.00 0.00 C ATOM 641 CG PRO A 39 165.070 -9.506 -0.984 1.00 0.00 C ATOM 642 CD PRO A 39 164.794 -9.430 -2.464 1.00 0.00 C ATOM 0 HA PRO A 39 162.063 -8.082 -1.188 1.00 0.00 H new ATOM 0 HB2 PRO A 39 163.999 -8.681 0.678 1.00 0.00 H new ATOM 0 HB3 PRO A 39 163.158 -9.982 -0.141 1.00 0.00 H new ATOM 0 HG2 PRO A 39 165.883 -8.835 -0.705 1.00 0.00 H new ATOM 0 HG3 PRO A 39 165.374 -10.512 -0.696 1.00 0.00 H new ATOM 0 HD2 PRO A 39 165.652 -9.038 -3.011 1.00 0.00 H new ATOM 0 HD3 PRO A 39 164.573 -10.413 -2.880 1.00 0.00 H new ATOM 650 N LEU A 40 162.611 -5.844 -0.515 1.00 0.00 N ATOM 651 CA LEU A 40 162.881 -4.457 -0.141 1.00 0.00 C ATOM 652 C LEU A 40 162.143 -4.085 1.143 1.00 0.00 C ATOM 653 O LEU A 40 161.022 -4.539 1.380 1.00 0.00 O ATOM 654 CB LEU A 40 162.467 -3.499 -1.263 1.00 0.00 C ATOM 655 CG LEU A 40 163.065 -3.801 -2.639 1.00 0.00 C ATOM 656 CD1 LEU A 40 162.019 -4.429 -3.547 1.00 0.00 C ATOM 657 CD2 LEU A 40 163.623 -2.533 -3.266 1.00 0.00 C ATOM 0 H LEU A 40 161.626 -6.106 -0.468 1.00 0.00 H new ATOM 0 HA LEU A 40 163.954 -4.365 0.027 1.00 0.00 H new ATOM 0 HB2 LEU A 40 161.380 -3.513 -1.347 1.00 0.00 H new ATOM 0 HB3 LEU A 40 162.751 -2.487 -0.976 1.00 0.00 H new ATOM 0 HG LEU A 40 163.882 -4.511 -2.512 1.00 0.00 H new ATOM 0 HD11 LEU A 40 162.461 -4.637 -4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 40 161.663 -5.359 -3.103 1.00 0.00 H new ATOM 0 HD13 LEU A 40 161.182 -3.741 -3.668 1.00 0.00 H new ATOM 0 HD21 LEU A 40 164.044 -2.766 -4.244 1.00 0.00 H new ATOM 0 HD22 LEU A 40 162.823 -1.801 -3.380 1.00 0.00 H new ATOM 0 HD23 LEU A 40 164.402 -2.122 -2.624 1.00 0.00 H new ATOM 669 N ASP A 41 162.779 -3.251 1.964 1.00 0.00 N ATOM 670 CA ASP A 41 162.186 -2.807 3.222 1.00 0.00 C ATOM 671 C ASP A 41 161.402 -1.511 3.020 1.00 0.00 C ATOM 672 O ASP A 41 161.908 -0.553 2.432 1.00 0.00 O ATOM 673 CB ASP A 41 163.278 -2.600 4.279 1.00 0.00 C ATOM 674 CG ASP A 41 163.168 -3.562 5.452 1.00 0.00 C ATOM 675 OD1 ASP A 41 162.488 -4.604 5.318 1.00 0.00 O ATOM 676 OD2 ASP A 41 163.767 -3.272 6.507 1.00 0.00 O ATOM 0 H ASP A 41 163.707 -2.869 1.779 1.00 0.00 H new ATOM 0 HA ASP A 41 161.498 -3.579 3.568 1.00 0.00 H new ATOM 0 HB2 ASP A 41 164.255 -2.719 3.811 1.00 0.00 H new ATOM 0 HB3 ASP A 41 163.225 -1.577 4.651 1.00 0.00 H new ATOM 681 N LEU A 42 160.161 -1.494 3.508 1.00 0.00 N ATOM 682 CA LEU A 42 159.297 -0.319 3.380 1.00 0.00 C ATOM 683 C LEU A 42 159.614 0.717 4.459 1.00 0.00 C ATOM 684 O LEU A 42 159.450 0.453 5.652 1.00 0.00 O ATOM 685 CB LEU A 42 157.821 -0.728 3.471 1.00 0.00 C ATOM 686 CG LEU A 42 157.442 -2.002 2.709 1.00 0.00 C ATOM 687 CD1 LEU A 42 157.263 -3.168 3.670 1.00 0.00 C ATOM 688 CD2 LEU A 42 156.174 -1.780 1.896 1.00 0.00 C ATOM 0 H LEU A 42 159.731 -2.280 3.995 1.00 0.00 H new ATOM 0 HA LEU A 42 159.485 0.129 2.404 1.00 0.00 H new ATOM 0 HB2 LEU A 42 157.564 -0.864 4.521 1.00 0.00 H new ATOM 0 HB3 LEU A 42 157.210 0.094 3.097 1.00 0.00 H new ATOM 0 HG LEU A 42 158.253 -2.245 2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 42 156.994 -4.063 3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 42 158.195 -3.343 4.208 1.00 0.00 H new ATOM 0 HD13 LEU A 42 156.472 -2.934 4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 42 155.920 -2.695 1.361 1.00 0.00 H new ATOM 0 HD22 LEU A 42 155.356 -1.511 2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 42 156.337 -0.975 1.180 1.00 0.00 H new ATOM 700 N HIS A 43 160.069 1.895 4.031 1.00 0.00 N ATOM 701 CA HIS A 43 160.410 2.970 4.960 1.00 0.00 C ATOM 702 C HIS A 43 159.308 4.028 5.009 1.00 0.00 C ATOM 703 O HIS A 43 158.967 4.632 3.990 1.00 0.00 O ATOM 704 CB HIS A 43 161.738 3.616 4.558 1.00 0.00 C ATOM 705 CG HIS A 43 162.928 3.004 5.231 1.00 0.00 C ATOM 706 ND1 HIS A 43 163.227 1.659 5.156 1.00 0.00 N ATOM 707 CD2 HIS A 43 163.896 3.561 5.997 1.00 0.00 C ATOM 708 CE1 HIS A 43 164.326 1.416 5.848 1.00 0.00 C ATOM 709 NE2 HIS A 43 164.752 2.553 6.367 1.00 0.00 N ATOM 0 H HIS A 43 160.209 2.128 3.048 1.00 0.00 H new ATOM 0 HA HIS A 43 160.510 2.535 5.955 1.00 0.00 H new ATOM 0 HB2 HIS A 43 161.860 3.535 3.478 1.00 0.00 H new ATOM 0 HB3 HIS A 43 161.703 4.679 4.796 1.00 0.00 H new ATOM 0 HD2 HIS A 43 163.979 4.603 6.267 1.00 0.00 H new ATOM 0 HE1 HIS A 43 164.796 0.451 5.969 1.00 0.00 H new ATOM 0 HE2 HIS A 43 165.582 2.665 6.949 1.00 0.00 H new ATOM 718 N TYR A 44 158.759 4.244 6.204 1.00 0.00 N ATOM 719 CA TYR A 44 157.698 5.228 6.401 1.00 0.00 C ATOM 720 C TYR A 44 158.277 6.566 6.854 1.00 0.00 C ATOM 721 O TYR A 44 159.051 6.624 7.811 1.00 0.00 O ATOM 722 CB TYR A 44 156.693 4.721 7.440 1.00 0.00 C ATOM 723 CG TYR A 44 155.246 4.918 7.044 1.00 0.00 C ATOM 724 CD1 TYR A 44 154.586 6.112 7.313 1.00 0.00 C ATOM 725 CD2 TYR A 44 154.540 3.909 6.404 1.00 0.00 C ATOM 726 CE1 TYR A 44 153.264 6.292 6.955 1.00 0.00 C ATOM 727 CE2 TYR A 44 153.218 4.081 6.042 1.00 0.00 C ATOM 728 CZ TYR A 44 152.584 5.274 6.319 1.00 0.00 C ATOM 729 OH TYR A 44 151.265 5.447 5.961 1.00 0.00 O ATOM 0 H TYR A 44 159.033 3.748 7.052 1.00 0.00 H new ATOM 0 HA TYR A 44 157.188 5.373 5.449 1.00 0.00 H new ATOM 0 HB2 TYR A 44 156.870 3.660 7.614 1.00 0.00 H new ATOM 0 HB3 TYR A 44 156.873 5.233 8.385 1.00 0.00 H new ATOM 0 HD1 TYR A 44 155.115 6.912 7.810 1.00 0.00 H new ATOM 0 HD2 TYR A 44 155.033 2.973 6.185 1.00 0.00 H new ATOM 0 HE1 TYR A 44 152.765 7.225 7.172 1.00 0.00 H new ATOM 0 HE2 TYR A 44 152.684 3.285 5.545 1.00 0.00 H new ATOM 0 HH TYR A 44 151.099 6.394 5.773 1.00 0.00 H new ATOM 739 N MET A 45 157.894 7.640 6.165 1.00 0.00 N ATOM 740 CA MET A 45 158.372 8.981 6.500 1.00 0.00 C ATOM 741 C MET A 45 157.207 9.968 6.575 1.00 0.00 C ATOM 742 O MET A 45 156.553 10.246 5.568 1.00 0.00 O ATOM 743 CB MET A 45 159.408 9.458 5.474 1.00 0.00 C ATOM 744 CG MET A 45 159.001 9.234 4.024 1.00 0.00 C ATOM 745 SD MET A 45 160.388 9.393 2.882 1.00 0.00 S ATOM 746 CE MET A 45 159.790 10.683 1.793 1.00 0.00 C ATOM 0 H MET A 45 157.254 7.608 5.371 1.00 0.00 H new ATOM 0 HA MET A 45 158.849 8.935 7.479 1.00 0.00 H new ATOM 0 HB2 MET A 45 159.592 10.521 5.628 1.00 0.00 H new ATOM 0 HB3 MET A 45 160.350 8.942 5.659 1.00 0.00 H new ATOM 0 HG2 MET A 45 158.564 8.241 3.923 1.00 0.00 H new ATOM 0 HG3 MET A 45 158.227 9.952 3.752 1.00 0.00 H new ATOM 0 HE1 MET A 45 160.541 10.893 1.031 1.00 0.00 H new ATOM 0 HE2 MET A 45 158.868 10.356 1.313 1.00 0.00 H new ATOM 0 HE3 MET A 45 159.597 11.587 2.371 1.00 0.00 H new ATOM 756 N ASN A 46 156.951 10.496 7.774 1.00 0.00 N ATOM 757 CA ASN A 46 155.862 11.451 7.973 1.00 0.00 C ATOM 758 C ASN A 46 156.357 12.885 7.776 1.00 0.00 C ATOM 759 O ASN A 46 155.953 13.564 6.830 1.00 0.00 O ATOM 760 CB ASN A 46 155.250 11.280 9.371 1.00 0.00 C ATOM 761 CG ASN A 46 153.757 11.557 9.390 1.00 0.00 C ATOM 762 OD1 ASN A 46 153.282 12.504 8.765 1.00 0.00 O ATOM 763 ND2 ASN A 46 153.006 10.729 10.112 1.00 0.00 N ATOM 0 H ASN A 46 157.481 10.279 8.618 1.00 0.00 H new ATOM 0 HA ASN A 46 155.090 11.252 7.229 1.00 0.00 H new ATOM 0 HB2 ASN A 46 155.432 10.264 9.722 1.00 0.00 H new ATOM 0 HB3 ASN A 46 155.750 11.953 10.068 1.00 0.00 H new ATOM 0 HD21 ASN A 46 151.997 10.868 10.162 1.00 0.00 H new ATOM 0 HD22 ASN A 46 153.440 9.955 10.616 1.00 0.00 H new ATOM 770 N ASN A 47 157.242 13.332 8.668 1.00 0.00 N ATOM 771 CA ASN A 47 157.807 14.679 8.589 1.00 0.00 C ATOM 772 C ASN A 47 159.252 14.680 9.082 1.00 0.00 C ATOM 773 O ASN A 47 160.186 14.834 8.295 1.00 0.00 O ATOM 774 CB ASN A 47 156.973 15.672 9.409 1.00 0.00 C ATOM 775 CG ASN A 47 155.540 15.781 8.921 1.00 0.00 C ATOM 776 OD1 ASN A 47 154.648 15.100 9.427 1.00 0.00 O ATOM 777 ND2 ASN A 47 155.309 16.641 7.934 1.00 0.00 N ATOM 0 H ASN A 47 157.583 12.780 9.455 1.00 0.00 H new ATOM 0 HA ASN A 47 157.788 14.992 7.545 1.00 0.00 H new ATOM 0 HB2 ASN A 47 156.973 15.363 10.454 1.00 0.00 H new ATOM 0 HB3 ASN A 47 157.442 16.655 9.367 1.00 0.00 H new ATOM 0 HD21 ASN A 47 154.364 16.756 7.568 1.00 0.00 H new ATOM 0 HD22 ASN A 47 156.077 17.186 7.543 1.00 0.00 H new ATOM 784 N GLU A 48 159.425 14.498 10.390 1.00 0.00 N ATOM 785 CA GLU A 48 160.753 14.471 10.996 1.00 0.00 C ATOM 786 C GLU A 48 161.102 13.076 11.531 1.00 0.00 C ATOM 787 O GLU A 48 162.270 12.791 11.806 1.00 0.00 O ATOM 788 CB GLU A 48 160.836 15.500 12.127 1.00 0.00 C ATOM 789 CG GLU A 48 162.065 16.391 12.051 1.00 0.00 C ATOM 790 CD GLU A 48 163.317 15.701 12.554 1.00 0.00 C ATOM 791 OE1 GLU A 48 163.478 15.585 13.788 1.00 0.00 O ATOM 792 OE2 GLU A 48 164.137 15.274 11.714 1.00 0.00 O ATOM 0 H GLU A 48 158.659 14.367 11.051 1.00 0.00 H new ATOM 0 HA GLU A 48 161.477 14.723 10.221 1.00 0.00 H new ATOM 0 HB2 GLU A 48 159.943 16.125 12.105 1.00 0.00 H new ATOM 0 HB3 GLU A 48 160.835 14.977 13.083 1.00 0.00 H new ATOM 0 HG2 GLU A 48 162.218 16.706 11.019 1.00 0.00 H new ATOM 0 HG3 GLU A 48 161.892 17.294 12.637 1.00 0.00 H new ATOM 799 N LEU A 49 160.094 12.209 11.682 1.00 0.00 N ATOM 800 CA LEU A 49 160.317 10.858 12.189 1.00 0.00 C ATOM 801 C LEU A 49 160.098 9.814 11.097 1.00 0.00 C ATOM 802 O LEU A 49 159.166 9.923 10.297 1.00 0.00 O ATOM 803 CB LEU A 49 159.391 10.575 13.375 1.00 0.00 C ATOM 804 CG LEU A 49 160.068 9.935 14.590 1.00 0.00 C ATOM 805 CD1 LEU A 49 160.810 10.984 15.405 1.00 0.00 C ATOM 806 CD2 LEU A 49 159.041 9.213 15.450 1.00 0.00 C ATOM 0 H LEU A 49 159.121 12.421 11.460 1.00 0.00 H new ATOM 0 HA LEU A 49 161.353 10.793 12.520 1.00 0.00 H new ATOM 0 HB2 LEU A 49 158.930 11.512 13.687 1.00 0.00 H new ATOM 0 HB3 LEU A 49 158.587 9.920 13.040 1.00 0.00 H new ATOM 0 HG LEU A 49 160.795 9.204 14.235 1.00 0.00 H new ATOM 0 HD11 LEU A 49 161.284 10.509 16.264 1.00 0.00 H new ATOM 0 HD12 LEU A 49 161.572 11.455 14.784 1.00 0.00 H new ATOM 0 HD13 LEU A 49 160.106 11.740 15.752 1.00 0.00 H new ATOM 0 HD21 LEU A 49 159.538 8.763 16.310 1.00 0.00 H new ATOM 0 HD22 LEU A 49 158.291 9.925 15.796 1.00 0.00 H new ATOM 0 HD23 LEU A 49 158.557 8.433 14.862 1.00 0.00 H new ATOM 818 N SER A 50 160.962 8.799 11.078 1.00 0.00 N ATOM 819 CA SER A 50 160.871 7.725 10.095 1.00 0.00 C ATOM 820 C SER A 50 160.697 6.376 10.788 1.00 0.00 C ATOM 821 O SER A 50 161.502 5.999 11.641 1.00 0.00 O ATOM 822 CB SER A 50 162.120 7.703 9.209 1.00 0.00 C ATOM 823 OG SER A 50 162.311 8.950 8.563 1.00 0.00 O ATOM 0 H SER A 50 161.735 8.700 11.736 1.00 0.00 H new ATOM 0 HA SER A 50 159.999 7.910 9.468 1.00 0.00 H new ATOM 0 HB2 SER A 50 162.995 7.466 9.815 1.00 0.00 H new ATOM 0 HB3 SER A 50 162.026 6.914 8.463 1.00 0.00 H new ATOM 0 HG SER A 50 163.116 8.910 8.005 1.00 0.00 H new ATOM 829 N ILE A 51 159.637 5.657 10.419 1.00 0.00 N ATOM 830 CA ILE A 51 159.348 4.352 11.009 1.00 0.00 C ATOM 831 C ILE A 51 159.458 3.242 9.965 1.00 0.00 C ATOM 832 O ILE A 51 158.952 3.374 8.849 1.00 0.00 O ATOM 833 CB ILE A 51 157.941 4.319 11.647 1.00 0.00 C ATOM 834 CG1 ILE A 51 157.718 5.565 12.513 1.00 0.00 C ATOM 835 CG2 ILE A 51 157.764 3.055 12.477 1.00 0.00 C ATOM 836 CD1 ILE A 51 156.297 5.715 13.010 1.00 0.00 C ATOM 0 H ILE A 51 158.964 5.957 9.714 1.00 0.00 H new ATOM 0 HA ILE A 51 160.090 4.184 11.790 1.00 0.00 H new ATOM 0 HB ILE A 51 157.198 4.315 10.849 1.00 0.00 H new ATOM 0 HG12 ILE A 51 158.391 5.526 13.370 1.00 0.00 H new ATOM 0 HG13 ILE A 51 157.987 6.450 11.936 1.00 0.00 H new ATOM 0 HG21 ILE A 51 156.768 3.047 12.920 1.00 0.00 H new ATOM 0 HG22 ILE A 51 157.884 2.180 11.838 1.00 0.00 H new ATOM 0 HG23 ILE A 51 158.513 3.032 13.269 1.00 0.00 H new ATOM 0 HD11 ILE A 51 156.217 6.618 13.615 1.00 0.00 H new ATOM 0 HD12 ILE A 51 155.620 5.787 12.159 1.00 0.00 H new ATOM 0 HD13 ILE A 51 156.030 4.848 13.615 1.00 0.00 H new ATOM 848 N LEU A 52 160.126 2.150 10.334 1.00 0.00 N ATOM 849 CA LEU A 52 160.309 1.018 9.429 1.00 0.00 C ATOM 850 C LEU A 52 159.193 -0.013 9.601 1.00 0.00 C ATOM 851 O LEU A 52 158.896 -0.444 10.717 1.00 0.00 O ATOM 852 CB LEU A 52 161.672 0.365 9.671 1.00 0.00 C ATOM 853 CG LEU A 52 162.245 -0.408 8.481 1.00 0.00 C ATOM 854 CD1 LEU A 52 163.750 -0.583 8.633 1.00 0.00 C ATOM 855 CD2 LEU A 52 161.558 -1.761 8.343 1.00 0.00 C ATOM 0 H LEU A 52 160.549 2.026 11.254 1.00 0.00 H new ATOM 0 HA LEU A 52 160.268 1.393 8.406 1.00 0.00 H new ATOM 0 HB2 LEU A 52 162.383 1.140 9.956 1.00 0.00 H new ATOM 0 HB3 LEU A 52 161.586 -0.315 10.518 1.00 0.00 H new ATOM 0 HG LEU A 52 162.057 0.166 7.574 1.00 0.00 H new ATOM 0 HD11 LEU A 52 164.140 -1.135 7.778 1.00 0.00 H new ATOM 0 HD12 LEU A 52 164.227 0.396 8.682 1.00 0.00 H new ATOM 0 HD13 LEU A 52 163.961 -1.136 9.548 1.00 0.00 H new ATOM 0 HD21 LEU A 52 161.978 -2.297 7.492 1.00 0.00 H new ATOM 0 HD22 LEU A 52 161.714 -2.343 9.251 1.00 0.00 H new ATOM 0 HD23 LEU A 52 160.490 -1.612 8.187 1.00 0.00 H new ATOM 867 N LEU A 53 158.582 -0.405 8.483 1.00 0.00 N ATOM 868 CA LEU A 53 157.499 -1.388 8.494 1.00 0.00 C ATOM 869 C LEU A 53 158.051 -2.813 8.536 1.00 0.00 C ATOM 870 O LEU A 53 158.297 -3.427 7.496 1.00 0.00 O ATOM 871 CB LEU A 53 156.612 -1.209 7.256 1.00 0.00 C ATOM 872 CG LEU A 53 155.678 0.004 7.295 1.00 0.00 C ATOM 873 CD1 LEU A 53 155.451 0.551 5.892 1.00 0.00 C ATOM 874 CD2 LEU A 53 154.353 -0.364 7.945 1.00 0.00 C ATOM 0 H LEU A 53 158.820 -0.055 7.555 1.00 0.00 H new ATOM 0 HA LEU A 53 156.903 -1.225 9.392 1.00 0.00 H new ATOM 0 HB2 LEU A 53 157.253 -1.126 6.378 1.00 0.00 H new ATOM 0 HB3 LEU A 53 156.009 -2.108 7.127 1.00 0.00 H new ATOM 0 HG LEU A 53 156.151 0.782 7.894 1.00 0.00 H new ATOM 0 HD11 LEU A 53 154.785 1.412 5.941 1.00 0.00 H new ATOM 0 HD12 LEU A 53 156.405 0.854 5.461 1.00 0.00 H new ATOM 0 HD13 LEU A 53 155.000 -0.221 5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 53 153.702 0.510 7.964 1.00 0.00 H new ATOM 0 HD22 LEU A 53 153.876 -1.160 7.373 1.00 0.00 H new ATOM 0 HD23 LEU A 53 154.531 -0.706 8.964 1.00 0.00 H new ATOM 886 N LYS A 54 158.239 -3.332 9.748 1.00 0.00 N ATOM 887 CA LYS A 54 158.756 -4.686 9.937 1.00 0.00 C ATOM 888 C LYS A 54 157.652 -5.639 10.405 1.00 0.00 C ATOM 889 O LYS A 54 157.657 -6.822 10.057 1.00 0.00 O ATOM 890 CB LYS A 54 159.903 -4.679 10.953 1.00 0.00 C ATOM 891 CG LYS A 54 161.036 -5.633 10.603 1.00 0.00 C ATOM 892 CD LYS A 54 162.153 -5.580 11.635 1.00 0.00 C ATOM 893 CE LYS A 54 161.822 -6.410 12.868 1.00 0.00 C ATOM 894 NZ LYS A 54 160.980 -5.659 13.845 1.00 0.00 N ATOM 0 H LYS A 54 158.040 -2.834 10.616 1.00 0.00 H new ATOM 0 HA LYS A 54 159.129 -5.040 8.976 1.00 0.00 H new ATOM 0 HB2 LYS A 54 160.302 -3.668 11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 54 159.509 -4.942 11.935 1.00 0.00 H new ATOM 0 HG2 LYS A 54 160.649 -6.650 10.537 1.00 0.00 H new ATOM 0 HG3 LYS A 54 161.435 -5.380 9.621 1.00 0.00 H new ATOM 0 HD2 LYS A 54 163.078 -5.945 11.189 1.00 0.00 H new ATOM 0 HD3 LYS A 54 162.327 -4.545 11.929 1.00 0.00 H new ATOM 0 HE2 LYS A 54 161.300 -7.317 12.564 1.00 0.00 H new ATOM 0 HE3 LYS A 54 162.747 -6.722 13.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 161.333 -5.827 14.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 161.025 -4.642 13.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 159.995 -5.984 13.776 1.00 0.00 H new ATOM 908 N ASN A 55 156.712 -5.116 11.198 1.00 0.00 N ATOM 909 CA ASN A 55 155.604 -5.914 11.721 1.00 0.00 C ATOM 910 C ASN A 55 154.260 -5.394 11.205 1.00 0.00 C ATOM 911 O ASN A 55 154.180 -4.294 10.655 1.00 0.00 O ATOM 912 CB ASN A 55 155.620 -5.889 13.253 1.00 0.00 C ATOM 913 CG ASN A 55 155.407 -7.264 13.859 1.00 0.00 C ATOM 914 OD1 ASN A 55 154.299 -7.799 13.837 1.00 0.00 O ATOM 915 ND2 ASN A 55 156.471 -7.845 14.403 1.00 0.00 N ATOM 0 H ASN A 55 156.698 -4.139 11.492 1.00 0.00 H new ATOM 0 HA ASN A 55 155.729 -6.940 11.374 1.00 0.00 H new ATOM 0 HB2 ASN A 55 156.573 -5.488 13.597 1.00 0.00 H new ATOM 0 HB3 ASN A 55 154.843 -5.214 13.610 1.00 0.00 H new ATOM 0 HD21 ASN A 55 156.387 -8.770 14.824 1.00 0.00 H new ATOM 0 HD22 ASN A 55 157.371 -7.366 14.400 1.00 0.00 H new ATOM 922 N GLN A 56 153.204 -6.192 11.393 1.00 0.00 N ATOM 923 CA GLN A 56 151.862 -5.807 10.951 1.00 0.00 C ATOM 924 C GLN A 56 151.357 -4.591 11.725 1.00 0.00 C ATOM 925 O GLN A 56 150.685 -3.728 11.161 1.00 0.00 O ATOM 926 CB GLN A 56 150.878 -6.970 11.115 1.00 0.00 C ATOM 927 CG GLN A 56 150.069 -7.256 9.860 1.00 0.00 C ATOM 928 CD GLN A 56 148.588 -6.984 10.041 1.00 0.00 C ATOM 929 OE1 GLN A 56 147.980 -7.413 11.022 1.00 0.00 O ATOM 930 NE2 GLN A 56 147.997 -6.269 9.090 1.00 0.00 N ATOM 0 H GLN A 56 153.253 -7.104 11.846 1.00 0.00 H new ATOM 0 HA GLN A 56 151.927 -5.547 9.895 1.00 0.00 H new ATOM 0 HB2 GLN A 56 151.430 -7.867 11.395 1.00 0.00 H new ATOM 0 HB3 GLN A 56 150.196 -6.747 11.935 1.00 0.00 H new ATOM 0 HG2 GLN A 56 150.449 -6.645 9.041 1.00 0.00 H new ATOM 0 HG3 GLN A 56 150.210 -8.298 9.572 1.00 0.00 H new ATOM 0 HE21 GLN A 56 148.539 -5.933 8.294 1.00 0.00 H new ATOM 0 HE22 GLN A 56 147.002 -6.056 9.156 1.00 0.00 H new ATOM 939 N ASP A 57 151.688 -4.530 13.019 1.00 0.00 N ATOM 940 CA ASP A 57 151.272 -3.415 13.870 1.00 0.00 C ATOM 941 C ASP A 57 151.719 -2.075 13.285 1.00 0.00 C ATOM 942 O ASP A 57 150.988 -1.087 13.362 1.00 0.00 O ATOM 943 CB ASP A 57 151.814 -3.582 15.297 1.00 0.00 C ATOM 944 CG ASP A 57 153.288 -3.941 15.336 1.00 0.00 C ATOM 945 OD1 ASP A 57 154.126 -3.032 15.164 1.00 0.00 O ATOM 946 OD2 ASP A 57 153.602 -5.131 15.537 1.00 0.00 O ATOM 0 H ASP A 57 152.242 -5.240 13.498 1.00 0.00 H new ATOM 0 HA ASP A 57 150.183 -3.422 13.911 1.00 0.00 H new ATOM 0 HB2 ASP A 57 151.657 -2.656 15.850 1.00 0.00 H new ATOM 0 HB3 ASP A 57 151.244 -4.358 15.807 1.00 0.00 H new ATOM 951 N ASP A 58 152.914 -2.043 12.693 1.00 0.00 N ATOM 952 CA ASP A 58 153.431 -0.816 12.095 1.00 0.00 C ATOM 953 C ASP A 58 152.578 -0.393 10.900 1.00 0.00 C ATOM 954 O ASP A 58 152.277 0.789 10.730 1.00 0.00 O ATOM 955 CB ASP A 58 154.888 -0.994 11.664 1.00 0.00 C ATOM 956 CG ASP A 58 155.664 0.306 11.732 1.00 0.00 C ATOM 957 OD1 ASP A 58 155.915 0.785 12.857 1.00 0.00 O ATOM 958 OD2 ASP A 58 156.012 0.848 10.662 1.00 0.00 O ATOM 0 H ASP A 58 153.536 -2.847 12.616 1.00 0.00 H new ATOM 0 HA ASP A 58 153.385 -0.031 12.850 1.00 0.00 H new ATOM 0 HB2 ASP A 58 155.367 -1.736 12.303 1.00 0.00 H new ATOM 0 HB3 ASP A 58 154.920 -1.382 10.646 1.00 0.00 H new ATOM 963 N LEU A 59 152.185 -1.369 10.082 1.00 0.00 N ATOM 964 CA LEU A 59 151.360 -1.104 8.904 1.00 0.00 C ATOM 965 C LEU A 59 149.965 -0.624 9.309 1.00 0.00 C ATOM 966 O LEU A 59 149.424 0.307 8.710 1.00 0.00 O ATOM 967 CB LEU A 59 151.247 -2.363 8.039 1.00 0.00 C ATOM 968 CG LEU A 59 150.840 -2.116 6.582 1.00 0.00 C ATOM 969 CD1 LEU A 59 152.013 -2.368 5.645 1.00 0.00 C ATOM 970 CD2 LEU A 59 149.652 -2.989 6.200 1.00 0.00 C ATOM 0 H LEU A 59 152.425 -2.352 10.214 1.00 0.00 H new ATOM 0 HA LEU A 59 151.842 -0.316 8.326 1.00 0.00 H new ATOM 0 HB2 LEU A 59 152.207 -2.880 8.049 1.00 0.00 H new ATOM 0 HB3 LEU A 59 150.519 -3.034 8.495 1.00 0.00 H new ATOM 0 HG LEU A 59 150.543 -1.072 6.484 1.00 0.00 H new ATOM 0 HD11 LEU A 59 151.702 -2.187 4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 59 152.833 -1.697 5.900 1.00 0.00 H new ATOM 0 HD13 LEU A 59 152.345 -3.401 5.747 1.00 0.00 H new ATOM 0 HD21 LEU A 59 149.379 -2.798 5.162 1.00 0.00 H new ATOM 0 HD22 LEU A 59 149.919 -4.039 6.318 1.00 0.00 H new ATOM 0 HD23 LEU A 59 148.806 -2.755 6.846 1.00 0.00 H new ATOM 982 N ASP A 60 149.392 -1.266 10.329 1.00 0.00 N ATOM 983 CA ASP A 60 148.060 -0.906 10.817 1.00 0.00 C ATOM 984 C ASP A 60 148.076 0.463 11.492 1.00 0.00 C ATOM 985 O ASP A 60 147.167 1.271 11.295 1.00 0.00 O ATOM 986 CB ASP A 60 147.539 -1.963 11.799 1.00 0.00 C ATOM 987 CG ASP A 60 147.312 -3.313 11.144 1.00 0.00 C ATOM 988 OD1 ASP A 60 146.662 -3.359 10.078 1.00 0.00 O ATOM 989 OD2 ASP A 60 147.782 -4.328 11.700 1.00 0.00 O ATOM 0 H ASP A 60 149.830 -2.037 10.833 1.00 0.00 H new ATOM 0 HA ASP A 60 147.392 -0.862 9.956 1.00 0.00 H new ATOM 0 HB2 ASP A 60 148.252 -2.076 12.616 1.00 0.00 H new ATOM 0 HB3 ASP A 60 146.604 -1.615 12.238 1.00 0.00 H new ATOM 994 N LYS A 61 149.119 0.720 12.283 1.00 0.00 N ATOM 995 CA LYS A 61 149.255 1.993 12.987 1.00 0.00 C ATOM 996 C LYS A 61 149.359 3.154 11.996 1.00 0.00 C ATOM 997 O LYS A 61 148.831 4.238 12.245 1.00 0.00 O ATOM 998 CB LYS A 61 150.496 1.968 13.886 1.00 0.00 C ATOM 999 CG LYS A 61 150.555 3.119 14.877 1.00 0.00 C ATOM 1000 CD LYS A 61 151.531 4.199 14.428 1.00 0.00 C ATOM 1001 CE LYS A 61 152.619 4.436 15.464 1.00 0.00 C ATOM 1002 NZ LYS A 61 153.960 4.606 14.837 1.00 0.00 N ATOM 0 H LYS A 61 149.881 0.063 12.451 1.00 0.00 H new ATOM 0 HA LYS A 61 148.367 2.139 13.602 1.00 0.00 H new ATOM 0 HB2 LYS A 61 150.518 1.026 14.434 1.00 0.00 H new ATOM 0 HB3 LYS A 61 151.388 1.993 13.260 1.00 0.00 H new ATOM 0 HG2 LYS A 61 149.561 3.552 14.992 1.00 0.00 H new ATOM 0 HG3 LYS A 61 150.854 2.742 15.855 1.00 0.00 H new ATOM 0 HD2 LYS A 61 151.986 3.908 13.481 1.00 0.00 H new ATOM 0 HD3 LYS A 61 150.990 5.128 14.249 1.00 0.00 H new ATOM 0 HE2 LYS A 61 152.377 5.324 16.048 1.00 0.00 H new ATOM 0 HE3 LYS A 61 152.647 3.596 16.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 154.531 5.259 15.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 154.438 3.684 14.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 153.848 4.994 13.879 1.00 0.00 H new ATOM 1016 N ALA A 62 150.035 2.917 10.871 1.00 0.00 N ATOM 1017 CA ALA A 62 150.197 3.944 9.843 1.00 0.00 C ATOM 1018 C ALA A 62 148.853 4.326 9.220 1.00 0.00 C ATOM 1019 O ALA A 62 148.594 5.502 8.962 1.00 0.00 O ATOM 1020 CB ALA A 62 151.160 3.471 8.766 1.00 0.00 C ATOM 0 H ALA A 62 150.478 2.025 10.650 1.00 0.00 H new ATOM 0 HA ALA A 62 150.610 4.831 10.322 1.00 0.00 H new ATOM 0 HB1 ALA A 62 151.269 4.248 8.009 1.00 0.00 H new ATOM 0 HB2 ALA A 62 152.132 3.261 9.213 1.00 0.00 H new ATOM 0 HB3 ALA A 62 150.771 2.564 8.303 1.00 0.00 H new ATOM 1026 N ILE A 63 148.002 3.327 8.983 1.00 0.00 N ATOM 1027 CA ILE A 63 146.685 3.566 8.392 1.00 0.00 C ATOM 1028 C ILE A 63 145.806 4.393 9.328 1.00 0.00 C ATOM 1029 O ILE A 63 145.095 5.292 8.881 1.00 0.00 O ATOM 1030 CB ILE A 63 145.955 2.247 8.051 1.00 0.00 C ATOM 1031 CG1 ILE A 63 146.833 1.359 7.165 1.00 0.00 C ATOM 1032 CG2 ILE A 63 144.626 2.539 7.363 1.00 0.00 C ATOM 1033 CD1 ILE A 63 146.446 -0.104 7.201 1.00 0.00 C ATOM 0 H ILE A 63 148.200 2.348 9.190 1.00 0.00 H new ATOM 0 HA ILE A 63 146.857 4.118 7.468 1.00 0.00 H new ATOM 0 HB ILE A 63 145.755 1.713 8.980 1.00 0.00 H new ATOM 0 HG12 ILE A 63 146.776 1.716 6.137 1.00 0.00 H new ATOM 0 HG13 ILE A 63 147.872 1.459 7.480 1.00 0.00 H new ATOM 0 HG21 ILE A 63 144.123 1.600 7.129 1.00 0.00 H new ATOM 0 HG22 ILE A 63 143.996 3.133 8.025 1.00 0.00 H new ATOM 0 HG23 ILE A 63 144.807 3.093 6.442 1.00 0.00 H new ATOM 0 HD11 ILE A 63 147.111 -0.672 6.550 1.00 0.00 H new ATOM 0 HD12 ILE A 63 146.531 -0.478 8.221 1.00 0.00 H new ATOM 0 HD13 ILE A 63 145.418 -0.217 6.857 1.00 0.00 H new ATOM 1045 N ASP A 64 145.857 4.083 10.624 1.00 0.00 N ATOM 1046 CA ASP A 64 145.062 4.802 11.619 1.00 0.00 C ATOM 1047 C ASP A 64 145.294 6.311 11.526 1.00 0.00 C ATOM 1048 O ASP A 64 144.345 7.096 11.568 1.00 0.00 O ATOM 1049 CB ASP A 64 145.397 4.309 13.030 1.00 0.00 C ATOM 1050 CG ASP A 64 144.347 4.713 14.047 1.00 0.00 C ATOM 1051 OD1 ASP A 64 143.286 4.057 14.098 1.00 0.00 O ATOM 1052 OD2 ASP A 64 144.586 5.687 14.792 1.00 0.00 O ATOM 0 H ASP A 64 146.440 3.340 11.009 1.00 0.00 H new ATOM 0 HA ASP A 64 144.011 4.603 11.412 1.00 0.00 H new ATOM 0 HB2 ASP A 64 145.491 3.223 13.020 1.00 0.00 H new ATOM 0 HB3 ASP A 64 146.365 4.710 13.332 1.00 0.00 H new ATOM 1057 N ILE A 65 146.560 6.709 11.395 1.00 0.00 N ATOM 1058 CA ILE A 65 146.913 8.125 11.292 1.00 0.00 C ATOM 1059 C ILE A 65 146.432 8.716 9.966 1.00 0.00 C ATOM 1060 O ILE A 65 145.876 9.816 9.934 1.00 0.00 O ATOM 1061 CB ILE A 65 148.438 8.348 11.425 1.00 0.00 C ATOM 1062 CG1 ILE A 65 148.982 7.630 12.666 1.00 0.00 C ATOM 1063 CG2 ILE A 65 148.755 9.838 11.491 1.00 0.00 C ATOM 1064 CD1 ILE A 65 150.481 7.764 12.839 1.00 0.00 C ATOM 0 H ILE A 65 147.356 6.072 11.358 1.00 0.00 H new ATOM 0 HA ILE A 65 146.414 8.633 12.117 1.00 0.00 H new ATOM 0 HB ILE A 65 148.924 7.929 10.544 1.00 0.00 H new ATOM 0 HG12 ILE A 65 148.486 8.028 13.551 1.00 0.00 H new ATOM 0 HG13 ILE A 65 148.725 6.572 12.605 1.00 0.00 H new ATOM 0 HG21 ILE A 65 149.832 9.977 11.584 1.00 0.00 H new ATOM 0 HG22 ILE A 65 148.404 10.325 10.581 1.00 0.00 H new ATOM 0 HG23 ILE A 65 148.256 10.278 12.354 1.00 0.00 H new ATOM 0 HD11 ILE A 65 150.793 7.231 13.737 1.00 0.00 H new ATOM 0 HD12 ILE A 65 150.987 7.340 11.971 1.00 0.00 H new ATOM 0 HD13 ILE A 65 150.744 8.818 12.933 1.00 0.00 H new ATOM 1076 N LEU A 66 146.645 7.978 8.876 1.00 0.00 N ATOM 1077 CA LEU A 66 146.230 8.426 7.547 1.00 0.00 C ATOM 1078 C LEU A 66 144.708 8.563 7.467 1.00 0.00 C ATOM 1079 O LEU A 66 144.196 9.539 6.920 1.00 0.00 O ATOM 1080 CB LEU A 66 146.723 7.449 6.473 1.00 0.00 C ATOM 1081 CG LEU A 66 146.783 8.018 5.050 1.00 0.00 C ATOM 1082 CD1 LEU A 66 148.162 8.592 4.759 1.00 0.00 C ATOM 1083 CD2 LEU A 66 146.426 6.944 4.032 1.00 0.00 C ATOM 0 H LEU A 66 147.103 7.067 8.888 1.00 0.00 H new ATOM 0 HA LEU A 66 146.676 9.404 7.368 1.00 0.00 H new ATOM 0 HB2 LEU A 66 147.718 7.101 6.750 1.00 0.00 H new ATOM 0 HB3 LEU A 66 146.070 6.577 6.471 1.00 0.00 H new ATOM 0 HG LEU A 66 146.054 8.824 4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 66 148.184 8.990 3.745 1.00 0.00 H new ATOM 0 HD12 LEU A 66 148.380 9.391 5.467 1.00 0.00 H new ATOM 0 HD13 LEU A 66 148.911 7.806 4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 66 146.473 7.365 3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 66 147.132 6.117 4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 66 145.417 6.580 4.226 1.00 0.00 H new ATOM 1095 N ASP A 67 143.992 7.579 8.018 1.00 0.00 N ATOM 1096 CA ASP A 67 142.527 7.590 8.011 1.00 0.00 C ATOM 1097 C ASP A 67 141.981 8.815 8.749 1.00 0.00 C ATOM 1098 O ASP A 67 141.014 9.433 8.306 1.00 0.00 O ATOM 1099 CB ASP A 67 141.976 6.303 8.642 1.00 0.00 C ATOM 1100 CG ASP A 67 140.748 5.770 7.922 1.00 0.00 C ATOM 1101 OD1 ASP A 67 140.724 5.801 6.672 1.00 0.00 O ATOM 1102 OD2 ASP A 67 139.809 5.316 8.608 1.00 0.00 O ATOM 0 H ASP A 67 144.403 6.765 8.474 1.00 0.00 H new ATOM 0 HA ASP A 67 142.198 7.642 6.973 1.00 0.00 H new ATOM 0 HB2 ASP A 67 142.754 5.540 8.636 1.00 0.00 H new ATOM 0 HB3 ASP A 67 141.725 6.495 9.685 1.00 0.00 H new ATOM 1107 N ARG A 68 142.614 9.161 9.873 1.00 0.00 N ATOM 1108 CA ARG A 68 142.201 10.317 10.671 1.00 0.00 C ATOM 1109 C ARG A 68 142.477 11.628 9.929 1.00 0.00 C ATOM 1110 O ARG A 68 141.738 12.602 10.080 1.00 0.00 O ATOM 1111 CB ARG A 68 142.937 10.321 12.016 1.00 0.00 C ATOM 1112 CG ARG A 68 142.191 11.047 13.127 1.00 0.00 C ATOM 1113 CD ARG A 68 143.146 11.827 14.023 1.00 0.00 C ATOM 1114 NE ARG A 68 142.777 11.739 15.437 1.00 0.00 N ATOM 1115 CZ ARG A 68 143.543 12.180 16.441 1.00 0.00 C ATOM 1116 NH1 ARG A 68 144.721 12.749 16.195 1.00 0.00 N ATOM 1117 NH2 ARG A 68 143.128 12.053 17.697 1.00 0.00 N ATOM 0 H ARG A 68 143.416 8.656 10.251 1.00 0.00 H new ATOM 0 HA ARG A 68 141.128 10.238 10.844 1.00 0.00 H new ATOM 0 HB2 ARG A 68 143.115 9.291 12.324 1.00 0.00 H new ATOM 0 HB3 ARG A 68 143.913 10.787 11.883 1.00 0.00 H new ATOM 0 HG2 ARG A 68 141.461 11.729 12.691 1.00 0.00 H new ATOM 0 HG3 ARG A 68 141.636 10.325 13.726 1.00 0.00 H new ATOM 0 HD2 ARG A 68 144.159 11.446 13.890 1.00 0.00 H new ATOM 0 HD3 ARG A 68 143.156 12.873 13.717 1.00 0.00 H new ATOM 0 HE ARG A 68 141.879 11.315 15.671 1.00 0.00 H new ATOM 0 HH11 ARG A 68 145.047 12.852 15.234 1.00 0.00 H new ATOM 0 HH12 ARG A 68 145.298 13.082 16.968 1.00 0.00 H new ATOM 0 HH21 ARG A 68 142.226 11.620 17.895 1.00 0.00 H new ATOM 0 HH22 ARG A 68 143.711 12.389 18.463 1.00 0.00 H new ATOM 1131 N SER A 69 143.548 11.645 9.133 1.00 0.00 N ATOM 1132 CA SER A 69 143.928 12.835 8.374 1.00 0.00 C ATOM 1133 C SER A 69 143.255 12.856 7.000 1.00 0.00 C ATOM 1134 O SER A 69 143.620 12.090 6.108 1.00 0.00 O ATOM 1135 CB SER A 69 145.449 12.889 8.211 1.00 0.00 C ATOM 1136 OG SER A 69 145.871 14.152 7.728 1.00 0.00 O ATOM 0 H SER A 69 144.168 10.846 8.998 1.00 0.00 H new ATOM 0 HA SER A 69 143.592 13.711 8.929 1.00 0.00 H new ATOM 0 HB2 SER A 69 145.927 12.686 9.169 1.00 0.00 H new ATOM 0 HB3 SER A 69 145.771 12.108 7.522 1.00 0.00 H new ATOM 0 HG SER A 69 146.847 14.157 7.635 1.00 0.00 H new ATOM 1142 N SER A 70 142.273 13.743 6.836 1.00 0.00 N ATOM 1143 CA SER A 70 141.547 13.867 5.569 1.00 0.00 C ATOM 1144 C SER A 70 142.423 14.480 4.473 1.00 0.00 C ATOM 1145 O SER A 70 142.220 14.206 3.288 1.00 0.00 O ATOM 1146 CB SER A 70 140.290 14.722 5.758 1.00 0.00 C ATOM 1147 OG SER A 70 139.445 14.656 4.619 1.00 0.00 O ATOM 0 H SER A 70 141.961 14.386 7.563 1.00 0.00 H new ATOM 0 HA SER A 70 141.263 12.862 5.256 1.00 0.00 H new ATOM 0 HB2 SER A 70 139.745 14.381 6.638 1.00 0.00 H new ATOM 0 HB3 SER A 70 140.576 15.758 5.942 1.00 0.00 H new ATOM 0 HG SER A 70 138.650 15.210 4.769 1.00 0.00 H new ATOM 1153 N SER A 71 143.383 15.321 4.868 1.00 0.00 N ATOM 1154 CA SER A 71 144.273 15.980 3.910 1.00 0.00 C ATOM 1155 C SER A 71 145.085 14.966 3.103 1.00 0.00 C ATOM 1156 O SER A 71 144.970 14.906 1.879 1.00 0.00 O ATOM 1157 CB SER A 71 145.217 16.950 4.629 1.00 0.00 C ATOM 1158 OG SER A 71 145.742 16.374 5.814 1.00 0.00 O ATOM 0 H SER A 71 143.563 15.561 5.843 1.00 0.00 H new ATOM 0 HA SER A 71 143.645 16.539 3.216 1.00 0.00 H new ATOM 0 HB2 SER A 71 146.035 17.226 3.963 1.00 0.00 H new ATOM 0 HB3 SER A 71 144.682 17.867 4.874 1.00 0.00 H new ATOM 0 HG SER A 71 146.342 17.014 6.251 1.00 0.00 H new ATOM 1164 N MET A 72 145.910 14.178 3.793 1.00 0.00 N ATOM 1165 CA MET A 72 146.742 13.176 3.130 1.00 0.00 C ATOM 1166 C MET A 72 145.919 11.954 2.723 1.00 0.00 C ATOM 1167 O MET A 72 145.387 11.240 3.575 1.00 0.00 O ATOM 1168 CB MET A 72 147.897 12.751 4.042 1.00 0.00 C ATOM 1169 CG MET A 72 149.168 12.401 3.286 1.00 0.00 C ATOM 1170 SD MET A 72 150.523 11.936 4.381 1.00 0.00 S ATOM 1171 CE MET A 72 151.936 12.448 3.407 1.00 0.00 C ATOM 0 H MET A 72 146.019 14.214 4.806 1.00 0.00 H new ATOM 0 HA MET A 72 147.150 13.628 2.226 1.00 0.00 H new ATOM 0 HB2 MET A 72 148.111 13.557 4.744 1.00 0.00 H new ATOM 0 HB3 MET A 72 147.585 11.889 4.632 1.00 0.00 H new ATOM 0 HG2 MET A 72 148.963 11.580 2.599 1.00 0.00 H new ATOM 0 HG3 MET A 72 149.472 13.255 2.680 1.00 0.00 H new ATOM 0 HE1 MET A 72 152.853 12.226 3.952 1.00 0.00 H new ATOM 0 HE2 MET A 72 151.938 11.911 2.459 1.00 0.00 H new ATOM 0 HE3 MET A 72 151.878 13.520 3.217 1.00 0.00 H new ATOM 1181 N LYS A 73 145.821 11.721 1.413 1.00 0.00 N ATOM 1182 CA LYS A 73 145.064 10.586 0.885 1.00 0.00 C ATOM 1183 C LYS A 73 145.964 9.366 0.667 1.00 0.00 C ATOM 1184 O LYS A 73 145.541 8.230 0.890 1.00 0.00 O ATOM 1185 CB LYS A 73 144.374 10.973 -0.428 1.00 0.00 C ATOM 1186 CG LYS A 73 142.977 11.544 -0.234 1.00 0.00 C ATOM 1187 CD LYS A 73 142.385 12.042 -1.545 1.00 0.00 C ATOM 1188 CE LYS A 73 140.906 11.697 -1.659 1.00 0.00 C ATOM 1189 NZ LYS A 73 140.688 10.261 -1.999 1.00 0.00 N ATOM 0 H LYS A 73 146.257 12.304 0.698 1.00 0.00 H new ATOM 0 HA LYS A 73 144.307 10.318 1.622 1.00 0.00 H new ATOM 0 HB2 LYS A 73 144.989 11.707 -0.950 1.00 0.00 H new ATOM 0 HB3 LYS A 73 144.313 10.094 -1.070 1.00 0.00 H new ATOM 0 HG2 LYS A 73 142.327 10.779 0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 73 143.015 12.364 0.483 1.00 0.00 H new ATOM 0 HD2 LYS A 73 142.514 13.122 -1.616 1.00 0.00 H new ATOM 0 HD3 LYS A 73 142.928 11.601 -2.381 1.00 0.00 H new ATOM 0 HE2 LYS A 73 140.408 11.925 -0.717 1.00 0.00 H new ATOM 0 HE3 LYS A 73 140.446 12.324 -2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 139.668 10.071 -2.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 141.141 10.047 -2.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 141.103 9.662 -1.257 1.00 0.00 H new ATOM 1203 N SER A 74 147.202 9.604 0.228 1.00 0.00 N ATOM 1204 CA SER A 74 148.153 8.518 -0.018 1.00 0.00 C ATOM 1205 C SER A 74 149.289 8.537 1.008 1.00 0.00 C ATOM 1206 O SER A 74 149.470 9.522 1.726 1.00 0.00 O ATOM 1207 CB SER A 74 148.735 8.621 -1.434 1.00 0.00 C ATOM 1208 OG SER A 74 147.749 9.011 -2.378 1.00 0.00 O ATOM 0 H SER A 74 147.569 10.536 0.036 1.00 0.00 H new ATOM 0 HA SER A 74 147.612 7.577 0.079 1.00 0.00 H new ATOM 0 HB2 SER A 74 149.551 9.343 -1.441 1.00 0.00 H new ATOM 0 HB3 SER A 74 149.158 7.659 -1.725 1.00 0.00 H new ATOM 0 HG SER A 74 147.873 8.506 -3.208 1.00 0.00 H new ATOM 1214 N LEU A 75 150.055 7.443 1.068 1.00 0.00 N ATOM 1215 CA LEU A 75 151.177 7.342 2.004 1.00 0.00 C ATOM 1216 C LEU A 75 152.505 7.208 1.259 1.00 0.00 C ATOM 1217 O LEU A 75 152.604 6.467 0.280 1.00 0.00 O ATOM 1218 CB LEU A 75 150.984 6.158 2.963 1.00 0.00 C ATOM 1219 CG LEU A 75 150.527 4.842 2.324 1.00 0.00 C ATOM 1220 CD1 LEU A 75 151.117 3.654 3.071 1.00 0.00 C ATOM 1221 CD2 LEU A 75 149.007 4.756 2.309 1.00 0.00 C ATOM 0 H LEU A 75 149.919 6.619 0.482 1.00 0.00 H new ATOM 0 HA LEU A 75 151.204 8.262 2.589 1.00 0.00 H new ATOM 0 HB2 LEU A 75 151.926 5.979 3.481 1.00 0.00 H new ATOM 0 HB3 LEU A 75 150.253 6.444 3.719 1.00 0.00 H new ATOM 0 HG LEU A 75 150.885 4.817 1.295 1.00 0.00 H new ATOM 0 HD11 LEU A 75 150.782 2.728 2.604 1.00 0.00 H new ATOM 0 HD12 LEU A 75 152.205 3.706 3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 75 150.787 3.677 4.109 1.00 0.00 H new ATOM 0 HD21 LEU A 75 148.700 3.815 1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 75 148.630 4.803 3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 75 148.601 5.588 1.734 1.00 0.00 H new ATOM 1233 N ARG A 76 153.522 7.938 1.724 1.00 0.00 N ATOM 1234 CA ARG A 76 154.845 7.909 1.095 1.00 0.00 C ATOM 1235 C ARG A 76 155.694 6.764 1.648 1.00 0.00 C ATOM 1236 O ARG A 76 156.019 6.736 2.837 1.00 0.00 O ATOM 1237 CB ARG A 76 155.574 9.242 1.311 1.00 0.00 C ATOM 1238 CG ARG A 76 154.793 10.460 0.838 1.00 0.00 C ATOM 1239 CD ARG A 76 154.775 11.558 1.893 1.00 0.00 C ATOM 1240 NE ARG A 76 156.049 12.275 1.968 1.00 0.00 N ATOM 1241 CZ ARG A 76 156.424 13.231 1.110 1.00 0.00 C ATOM 1242 NH1 ARG A 76 155.627 13.587 0.104 1.00 0.00 N ATOM 1243 NH2 ARG A 76 157.599 13.834 1.261 1.00 0.00 N ATOM 0 H ARG A 76 153.455 8.556 2.533 1.00 0.00 H new ATOM 0 HA ARG A 76 154.699 7.749 0.027 1.00 0.00 H new ATOM 0 HB2 ARG A 76 155.795 9.355 2.372 1.00 0.00 H new ATOM 0 HB3 ARG A 76 156.530 9.210 0.788 1.00 0.00 H new ATOM 0 HG2 ARG A 76 155.237 10.844 -0.080 1.00 0.00 H new ATOM 0 HG3 ARG A 76 153.771 10.167 0.599 1.00 0.00 H new ATOM 0 HD2 ARG A 76 153.976 12.264 1.667 1.00 0.00 H new ATOM 0 HD3 ARG A 76 154.548 11.121 2.866 1.00 0.00 H new ATOM 0 HE ARG A 76 156.691 12.031 2.722 1.00 0.00 H new ATOM 0 HH11 ARG A 76 154.723 13.130 -0.017 1.00 0.00 H new ATOM 0 HH12 ARG A 76 155.920 14.317 -0.546 1.00 0.00 H new ATOM 0 HH21 ARG A 76 158.214 13.568 2.030 1.00 0.00 H new ATOM 0 HH22 ARG A 76 157.886 14.563 0.608 1.00 0.00 H new ATOM 1257 N ILE A 77 156.046 5.820 0.774 1.00 0.00 N ATOM 1258 CA ILE A 77 156.855 4.667 1.165 1.00 0.00 C ATOM 1259 C ILE A 77 158.084 4.523 0.267 1.00 0.00 C ATOM 1260 O ILE A 77 157.969 4.534 -0.959 1.00 0.00 O ATOM 1261 CB ILE A 77 156.038 3.357 1.102 1.00 0.00 C ATOM 1262 CG1 ILE A 77 154.680 3.529 1.791 1.00 0.00 C ATOM 1263 CG2 ILE A 77 156.818 2.210 1.732 1.00 0.00 C ATOM 1264 CD1 ILE A 77 154.778 3.862 3.264 1.00 0.00 C ATOM 0 H ILE A 77 155.782 5.832 -0.211 1.00 0.00 H new ATOM 0 HA ILE A 77 157.174 4.843 2.192 1.00 0.00 H new ATOM 0 HB ILE A 77 155.859 3.117 0.054 1.00 0.00 H new ATOM 0 HG12 ILE A 77 154.125 4.319 1.286 1.00 0.00 H new ATOM 0 HG13 ILE A 77 154.105 2.610 1.674 1.00 0.00 H new ATOM 0 HG21 ILE A 77 156.227 1.296 1.679 1.00 0.00 H new ATOM 0 HG22 ILE A 77 157.755 2.068 1.194 1.00 0.00 H new ATOM 0 HG23 ILE A 77 157.031 2.444 2.775 1.00 0.00 H new ATOM 0 HD11 ILE A 77 153.776 3.968 3.680 1.00 0.00 H new ATOM 0 HD12 ILE A 77 155.304 3.061 3.784 1.00 0.00 H new ATOM 0 HD13 ILE A 77 155.324 4.797 3.390 1.00 0.00 H new ATOM 1276 N LEU A 78 159.256 4.379 0.886 1.00 0.00 N ATOM 1277 CA LEU A 78 160.503 4.223 0.140 1.00 0.00 C ATOM 1278 C LEU A 78 160.942 2.761 0.127 1.00 0.00 C ATOM 1279 O LEU A 78 161.071 2.133 1.180 1.00 0.00 O ATOM 1280 CB LEU A 78 161.607 5.101 0.742 1.00 0.00 C ATOM 1281 CG LEU A 78 161.925 6.377 -0.044 1.00 0.00 C ATOM 1282 CD1 LEU A 78 160.709 7.293 -0.096 1.00 0.00 C ATOM 1283 CD2 LEU A 78 163.116 7.101 0.569 1.00 0.00 C ATOM 0 H LEU A 78 159.367 4.367 1.900 1.00 0.00 H new ATOM 0 HA LEU A 78 160.326 4.543 -0.887 1.00 0.00 H new ATOM 0 HB2 LEU A 78 161.316 5.380 1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 78 162.517 4.507 0.824 1.00 0.00 H new ATOM 0 HG LEU A 78 162.184 6.095 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 78 160.956 8.193 -0.659 1.00 0.00 H new ATOM 0 HD12 LEU A 78 159.884 6.775 -0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 78 160.416 7.567 0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 78 163.326 8.005 -0.003 1.00 0.00 H new ATOM 0 HD22 LEU A 78 162.887 7.370 1.600 1.00 0.00 H new ATOM 0 HD23 LEU A 78 163.988 6.448 0.549 1.00 0.00 H new ATOM 1295 N LEU A 79 161.164 2.228 -1.074 1.00 0.00 N ATOM 1296 CA LEU A 79 161.583 0.837 -1.237 1.00 0.00 C ATOM 1297 C LEU A 79 163.095 0.737 -1.424 1.00 0.00 C ATOM 1298 O LEU A 79 163.673 1.428 -2.265 1.00 0.00 O ATOM 1299 CB LEU A 79 160.876 0.201 -2.438 1.00 0.00 C ATOM 1300 CG LEU A 79 159.374 0.478 -2.536 1.00 0.00 C ATOM 1301 CD1 LEU A 79 158.937 0.552 -3.993 1.00 0.00 C ATOM 1302 CD2 LEU A 79 158.586 -0.590 -1.792 1.00 0.00 C ATOM 0 H LEU A 79 161.060 2.740 -1.950 1.00 0.00 H new ATOM 0 HA LEU A 79 161.307 0.300 -0.330 1.00 0.00 H new ATOM 0 HB2 LEU A 79 161.354 0.557 -3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 79 161.028 -0.878 -2.398 1.00 0.00 H new ATOM 0 HG LEU A 79 159.170 1.442 -2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 79 157.866 0.750 -4.042 1.00 0.00 H new ATOM 0 HD12 LEU A 79 159.477 1.355 -4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 79 159.154 -0.395 -4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 79 157.520 -0.377 -1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 79 158.795 -1.567 -2.228 1.00 0.00 H new ATOM 0 HD23 LEU A 79 158.878 -0.592 -0.742 1.00 0.00 H new ATOM 1314 N LEU A 80 163.727 -0.132 -0.636 1.00 0.00 N ATOM 1315 CA LEU A 80 165.172 -0.332 -0.711 1.00 0.00 C ATOM 1316 C LEU A 80 165.553 -1.763 -0.337 1.00 0.00 C ATOM 1317 O LEU A 80 165.056 -2.311 0.649 1.00 0.00 O ATOM 1318 CB LEU A 80 165.899 0.656 0.207 1.00 0.00 C ATOM 1319 CG LEU A 80 165.517 0.576 1.688 1.00 0.00 C ATOM 1320 CD1 LEU A 80 166.756 0.687 2.563 1.00 0.00 C ATOM 1321 CD2 LEU A 80 164.509 1.661 2.041 1.00 0.00 C ATOM 0 H LEU A 80 163.259 -0.709 0.063 1.00 0.00 H new ATOM 0 HA LEU A 80 165.477 -0.153 -1.742 1.00 0.00 H new ATOM 0 HB2 LEU A 80 166.972 0.489 0.116 1.00 0.00 H new ATOM 0 HB3 LEU A 80 165.703 1.668 -0.148 1.00 0.00 H new ATOM 0 HG LEU A 80 165.052 -0.393 1.873 1.00 0.00 H new ATOM 0 HD11 LEU A 80 166.467 0.628 3.612 1.00 0.00 H new ATOM 0 HD12 LEU A 80 167.441 -0.128 2.329 1.00 0.00 H new ATOM 0 HD13 LEU A 80 167.250 1.641 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 80 164.250 1.587 3.097 1.00 0.00 H new ATOM 0 HD22 LEU A 80 164.944 2.640 1.841 1.00 0.00 H new ATOM 0 HD23 LEU A 80 163.610 1.533 1.438 1.00 0.00 H new ATOM 1333 N SER A 81 166.448 -2.358 -1.126 1.00 0.00 N ATOM 1334 CA SER A 81 166.909 -3.721 -0.874 1.00 0.00 C ATOM 1335 C SER A 81 168.068 -3.717 0.118 1.00 0.00 C ATOM 1336 O SER A 81 169.030 -2.960 -0.036 1.00 0.00 O ATOM 1337 CB SER A 81 167.335 -4.396 -2.181 1.00 0.00 C ATOM 1338 OG SER A 81 168.525 -3.822 -2.694 1.00 0.00 O ATOM 0 H SER A 81 166.867 -1.917 -1.944 1.00 0.00 H new ATOM 0 HA SER A 81 166.083 -4.287 -0.444 1.00 0.00 H new ATOM 0 HB2 SER A 81 167.488 -5.462 -2.009 1.00 0.00 H new ATOM 0 HB3 SER A 81 166.537 -4.303 -2.918 1.00 0.00 H new ATOM 0 HG SER A 81 168.950 -3.276 -2.000 1.00 0.00 H new ATOM 1344 N GLN A 82 167.970 -4.569 1.134 1.00 0.00 N ATOM 1345 CA GLN A 82 169.010 -4.674 2.157 1.00 0.00 C ATOM 1346 C GLN A 82 169.937 -5.854 1.867 1.00 0.00 C ATOM 1347 O GLN A 82 170.407 -6.529 2.788 1.00 0.00 O ATOM 1348 CB GLN A 82 168.381 -4.827 3.547 1.00 0.00 C ATOM 1349 CG GLN A 82 167.421 -6.002 3.656 1.00 0.00 C ATOM 1350 CD GLN A 82 165.968 -5.577 3.561 1.00 0.00 C ATOM 1351 OE1 GLN A 82 165.463 -4.872 4.431 1.00 0.00 O ATOM 1352 NE2 GLN A 82 165.288 -5.999 2.500 1.00 0.00 N ATOM 0 H GLN A 82 167.180 -5.199 1.273 1.00 0.00 H new ATOM 0 HA GLN A 82 169.600 -3.757 2.137 1.00 0.00 H new ATOM 0 HB2 GLN A 82 169.175 -4.948 4.284 1.00 0.00 H new ATOM 0 HB3 GLN A 82 167.849 -3.910 3.799 1.00 0.00 H new ATOM 0 HG2 GLN A 82 167.639 -6.719 2.865 1.00 0.00 H new ATOM 0 HG3 GLN A 82 167.585 -6.514 4.604 1.00 0.00 H new ATOM 0 HE21 GLN A 82 165.746 -6.583 1.800 1.00 0.00 H new ATOM 0 HE22 GLN A 82 164.309 -5.739 2.385 1.00 0.00 H new ATOM 1361 N ASP A 83 170.195 -6.099 0.583 1.00 0.00 N ATOM 1362 CA ASP A 83 171.060 -7.198 0.168 1.00 0.00 C ATOM 1363 C ASP A 83 171.635 -6.948 -1.222 1.00 0.00 C ATOM 1364 O ASP A 83 171.090 -7.407 -2.227 1.00 0.00 O ATOM 1365 CB ASP A 83 170.299 -8.533 0.200 1.00 0.00 C ATOM 1366 CG ASP A 83 169.020 -8.533 -0.631 1.00 0.00 C ATOM 1367 OD1 ASP A 83 168.357 -7.478 -0.726 1.00 0.00 O ATOM 1368 OD2 ASP A 83 168.679 -9.599 -1.184 1.00 0.00 O ATOM 0 H ASP A 83 169.816 -5.549 -0.188 1.00 0.00 H new ATOM 0 HA ASP A 83 171.888 -7.255 0.874 1.00 0.00 H new ATOM 0 HB2 ASP A 83 170.956 -9.324 -0.162 1.00 0.00 H new ATOM 0 HB3 ASP A 83 170.050 -8.774 1.233 1.00 0.00 H new ATOM 1373 N ARG A 84 172.750 -6.220 -1.266 1.00 0.00 N ATOM 1374 CA ARG A 84 173.424 -5.904 -2.528 1.00 0.00 C ATOM 1375 C ARG A 84 174.168 -7.121 -3.091 1.00 0.00 C ATOM 1376 O ARG A 84 174.709 -7.061 -4.197 1.00 0.00 O ATOM 1377 CB ARG A 84 174.414 -4.751 -2.329 1.00 0.00 C ATOM 1378 CG ARG A 84 173.759 -3.379 -2.279 1.00 0.00 C ATOM 1379 CD ARG A 84 173.235 -3.051 -0.888 1.00 0.00 C ATOM 1380 NE ARG A 84 174.307 -2.968 0.107 1.00 0.00 N ATOM 1381 CZ ARG A 84 174.152 -2.448 1.329 1.00 0.00 C ATOM 1382 NH1 ARG A 84 172.976 -1.954 1.709 1.00 0.00 N ATOM 1383 NH2 ARG A 84 175.178 -2.421 2.174 1.00 0.00 N ATOM 0 H ARG A 84 173.208 -5.836 -0.440 1.00 0.00 H new ATOM 0 HA ARG A 84 172.655 -5.610 -3.243 1.00 0.00 H new ATOM 0 HB2 ARG A 84 174.965 -4.914 -1.403 1.00 0.00 H new ATOM 0 HB3 ARG A 84 175.142 -4.766 -3.140 1.00 0.00 H new ATOM 0 HG2 ARG A 84 174.481 -2.621 -2.583 1.00 0.00 H new ATOM 0 HG3 ARG A 84 172.937 -3.343 -2.994 1.00 0.00 H new ATOM 0 HD2 ARG A 84 172.698 -2.103 -0.919 1.00 0.00 H new ATOM 0 HD3 ARG A 84 172.518 -3.814 -0.583 1.00 0.00 H new ATOM 0 HE ARG A 84 175.227 -3.328 -0.148 1.00 0.00 H new ATOM 0 HH11 ARG A 84 172.184 -1.970 1.066 1.00 0.00 H new ATOM 0 HH12 ARG A 84 172.866 -1.559 2.643 1.00 0.00 H new ATOM 0 HH21 ARG A 84 176.083 -2.797 1.890 1.00 0.00 H new ATOM 0 HH22 ARG A 84 175.060 -2.024 3.106 1.00 0.00 H new ATOM 1397 N ASN A 85 174.205 -8.217 -2.325 1.00 0.00 N ATOM 1398 CA ASN A 85 174.895 -9.432 -2.753 1.00 0.00 C ATOM 1399 C ASN A 85 174.207 -10.064 -3.965 1.00 0.00 C ATOM 1400 O ASN A 85 173.420 -11.002 -3.832 1.00 0.00 O ATOM 1401 CB ASN A 85 174.985 -10.439 -1.595 1.00 0.00 C ATOM 1402 CG ASN A 85 173.682 -10.583 -0.820 1.00 0.00 C ATOM 1403 OD1 ASN A 85 172.777 -11.307 -1.233 1.00 0.00 O ATOM 1404 ND2 ASN A 85 173.583 -9.896 0.316 1.00 0.00 N ATOM 0 H ASN A 85 173.765 -8.284 -1.407 1.00 0.00 H new ATOM 0 HA ASN A 85 175.906 -9.155 -3.051 1.00 0.00 H new ATOM 0 HB2 ASN A 85 175.274 -11.413 -1.991 1.00 0.00 H new ATOM 0 HB3 ASN A 85 175.774 -10.126 -0.911 1.00 0.00 H new ATOM 0 HD21 ASN A 85 172.734 -9.959 0.878 1.00 0.00 H new ATOM 0 HD22 ASN A 85 174.356 -9.306 0.624 1.00 0.00 H new ATOM 1411 N LEU A 86 174.512 -9.533 -5.152 1.00 0.00 N ATOM 1412 CA LEU A 86 173.928 -10.028 -6.396 1.00 0.00 C ATOM 1413 C LEU A 86 174.559 -9.346 -7.613 1.00 0.00 C ATOM 1414 O LEU A 86 175.297 -8.368 -7.474 1.00 0.00 O ATOM 1415 CB LEU A 86 172.415 -9.791 -6.395 1.00 0.00 C ATOM 1416 CG LEU A 86 171.578 -10.928 -6.982 1.00 0.00 C ATOM 1417 CD1 LEU A 86 171.252 -11.961 -5.913 1.00 0.00 C ATOM 1418 CD2 LEU A 86 170.301 -10.383 -7.605 1.00 0.00 C ATOM 0 H LEU A 86 175.163 -8.757 -5.275 1.00 0.00 H new ATOM 0 HA LEU A 86 174.128 -11.097 -6.461 1.00 0.00 H new ATOM 0 HB2 LEU A 86 172.092 -9.615 -5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 86 172.206 -8.880 -6.956 1.00 0.00 H new ATOM 0 HG LEU A 86 172.162 -11.416 -7.763 1.00 0.00 H new ATOM 0 HD11 LEU A 86 170.656 -12.762 -6.351 1.00 0.00 H new ATOM 0 HD12 LEU A 86 172.178 -12.375 -5.513 1.00 0.00 H new ATOM 0 HD13 LEU A 86 170.689 -11.487 -5.109 1.00 0.00 H new ATOM 0 HD21 LEU A 86 169.718 -11.206 -8.018 1.00 0.00 H new ATOM 0 HD22 LEU A 86 169.715 -9.869 -6.843 1.00 0.00 H new ATOM 0 HD23 LEU A 86 170.555 -9.683 -8.401 1.00 0.00 H new ATOM 1430 N GLU A 87 174.256 -9.864 -8.805 1.00 0.00 N ATOM 1431 CA GLU A 87 174.784 -9.302 -10.048 1.00 0.00 C ATOM 1432 C GLU A 87 173.650 -8.876 -10.980 1.00 0.00 C ATOM 1433 O GLU A 87 172.616 -9.541 -11.059 1.00 0.00 O ATOM 1434 CB GLU A 87 175.694 -10.315 -10.756 1.00 0.00 C ATOM 1435 CG GLU A 87 174.970 -11.571 -11.229 1.00 0.00 C ATOM 1436 CD GLU A 87 175.418 -12.038 -12.604 1.00 0.00 C ATOM 1437 OE1 GLU A 87 175.570 -11.185 -13.507 1.00 0.00 O ATOM 1438 OE2 GLU A 87 175.614 -13.259 -12.779 1.00 0.00 O ATOM 0 H GLU A 87 173.647 -10.672 -8.935 1.00 0.00 H new ATOM 0 HA GLU A 87 175.372 -8.420 -9.793 1.00 0.00 H new ATOM 0 HB2 GLU A 87 176.161 -9.832 -11.614 1.00 0.00 H new ATOM 0 HB3 GLU A 87 176.497 -10.604 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 87 175.136 -12.372 -10.508 1.00 0.00 H new ATOM 0 HG3 GLU A 87 173.897 -11.378 -11.249 1.00 0.00 H new ATOM 1445 N HIS A 88 173.857 -7.766 -11.689 1.00 0.00 N ATOM 1446 CA HIS A 88 172.857 -7.252 -12.624 1.00 0.00 C ATOM 1447 C HIS A 88 173.292 -7.481 -14.074 1.00 0.00 C ATOM 1448 O HIS A 88 172.455 -7.730 -14.944 1.00 0.00 O ATOM 1449 CB HIS A 88 172.609 -5.759 -12.381 1.00 0.00 C ATOM 1450 CG HIS A 88 171.161 -5.373 -12.426 1.00 0.00 C ATOM 1451 ND1 HIS A 88 170.412 -5.124 -11.294 1.00 0.00 N ATOM 1452 CD2 HIS A 88 170.324 -5.182 -13.476 1.00 0.00 C ATOM 1453 CE1 HIS A 88 169.181 -4.796 -11.644 1.00 0.00 C ATOM 1454 NE2 HIS A 88 169.102 -4.823 -12.961 1.00 0.00 N ATOM 0 H HIS A 88 174.708 -7.206 -11.633 1.00 0.00 H new ATOM 0 HA HIS A 88 171.929 -7.797 -12.452 1.00 0.00 H new ATOM 0 HB2 HIS A 88 173.019 -5.485 -11.409 1.00 0.00 H new ATOM 0 HB3 HIS A 88 173.153 -5.183 -13.130 1.00 0.00 H new ATOM 0 HD2 HIS A 88 170.572 -5.292 -14.521 1.00 0.00 H new ATOM 0 HE1 HIS A 88 168.376 -4.548 -10.968 1.00 0.00 H new ATOM 0 HE2 HIS A 88 168.268 -4.611 -13.509 1.00 0.00 H new ATOM 1463 N HIS A 89 174.603 -7.392 -14.328 1.00 0.00 N ATOM 1464 CA HIS A 89 175.151 -7.588 -15.671 1.00 0.00 C ATOM 1465 C HIS A 89 174.684 -6.485 -16.626 1.00 0.00 C ATOM 1466 O HIS A 89 173.986 -5.554 -16.219 1.00 0.00 O ATOM 1467 CB HIS A 89 174.753 -8.968 -16.214 1.00 0.00 C ATOM 1468 CG HIS A 89 175.898 -9.744 -16.795 1.00 0.00 C ATOM 1469 ND1 HIS A 89 177.084 -9.160 -17.198 1.00 0.00 N ATOM 1470 CD2 HIS A 89 176.034 -11.070 -17.041 1.00 0.00 C ATOM 1471 CE1 HIS A 89 177.894 -10.091 -17.666 1.00 0.00 C ATOM 1472 NE2 HIS A 89 177.282 -11.257 -17.581 1.00 0.00 N ATOM 0 H HIS A 89 175.304 -7.185 -13.617 1.00 0.00 H new ATOM 0 HA HIS A 89 176.238 -7.536 -15.602 1.00 0.00 H new ATOM 0 HB2 HIS A 89 174.304 -9.549 -15.409 1.00 0.00 H new ATOM 0 HB3 HIS A 89 173.988 -8.840 -16.979 1.00 0.00 H new ATOM 0 HD2 HIS A 89 175.298 -11.836 -16.848 1.00 0.00 H new ATOM 0 HE1 HIS A 89 178.889 -9.926 -18.053 1.00 0.00 H new ATOM 0 HE2 HIS A 89 177.674 -12.153 -17.870 1.00 0.00 H new ATOM 1481 N HIS A 90 175.077 -6.595 -17.897 1.00 0.00 N ATOM 1482 CA HIS A 90 174.702 -5.606 -18.903 1.00 0.00 C ATOM 1483 C HIS A 90 173.285 -5.868 -19.410 1.00 0.00 C ATOM 1484 O HIS A 90 173.080 -6.648 -20.343 1.00 0.00 O ATOM 1485 CB HIS A 90 175.699 -5.617 -20.068 1.00 0.00 C ATOM 1486 CG HIS A 90 177.085 -5.196 -19.678 1.00 0.00 C ATOM 1487 ND1 HIS A 90 177.948 -4.554 -20.541 1.00 0.00 N ATOM 1488 CD2 HIS A 90 177.757 -5.328 -18.508 1.00 0.00 C ATOM 1489 CE1 HIS A 90 179.089 -4.310 -19.919 1.00 0.00 C ATOM 1490 NE2 HIS A 90 178.998 -4.770 -18.685 1.00 0.00 N ATOM 0 H HIS A 90 175.654 -7.358 -18.251 1.00 0.00 H new ATOM 0 HA HIS A 90 174.726 -4.620 -18.439 1.00 0.00 H new ATOM 0 HB2 HIS A 90 175.739 -6.621 -20.491 1.00 0.00 H new ATOM 0 HB3 HIS A 90 175.335 -4.954 -20.853 1.00 0.00 H new ATOM 0 HD2 HIS A 90 177.385 -5.787 -17.604 1.00 0.00 H new ATOM 0 HE1 HIS A 90 179.949 -3.818 -20.348 1.00 0.00 H new ATOM 0 HE2 HIS A 90 179.731 -4.719 -17.978 1.00 0.00 H new ATOM 1499 N HIS A 91 172.310 -5.217 -18.777 1.00 0.00 N ATOM 1500 CA HIS A 91 170.904 -5.376 -19.145 1.00 0.00 C ATOM 1501 C HIS A 91 170.359 -4.113 -19.814 1.00 0.00 C ATOM 1502 O HIS A 91 171.083 -3.130 -19.990 1.00 0.00 O ATOM 1503 CB HIS A 91 170.075 -5.713 -17.900 1.00 0.00 C ATOM 1504 CG HIS A 91 169.684 -7.157 -17.806 1.00 0.00 C ATOM 1505 ND1 HIS A 91 170.511 -8.191 -18.195 1.00 0.00 N ATOM 1506 CD2 HIS A 91 168.546 -7.736 -17.358 1.00 0.00 C ATOM 1507 CE1 HIS A 91 169.896 -9.343 -17.992 1.00 0.00 C ATOM 1508 NE2 HIS A 91 168.704 -9.095 -17.484 1.00 0.00 N ATOM 0 H HIS A 91 172.469 -4.572 -18.003 1.00 0.00 H new ATOM 0 HA HIS A 91 170.830 -6.194 -19.862 1.00 0.00 H new ATOM 0 HB2 HIS A 91 170.645 -5.442 -17.011 1.00 0.00 H new ATOM 0 HB3 HIS A 91 169.173 -5.101 -17.899 1.00 0.00 H new ATOM 0 HD2 HIS A 91 167.676 -7.225 -16.973 1.00 0.00 H new ATOM 0 HE1 HIS A 91 170.301 -10.321 -18.206 1.00 0.00 H new ATOM 0 HE2 HIS A 91 168.012 -9.798 -17.226 1.00 0.00 H new ATOM 1517 N HIS A 92 169.076 -4.147 -20.185 1.00 0.00 N ATOM 1518 CA HIS A 92 168.432 -3.006 -20.834 1.00 0.00 C ATOM 1519 C HIS A 92 167.507 -2.269 -19.866 1.00 0.00 C ATOM 1520 O HIS A 92 166.832 -2.890 -19.042 1.00 0.00 O ATOM 1521 CB HIS A 92 167.638 -3.469 -22.060 1.00 0.00 C ATOM 1522 CG HIS A 92 167.461 -2.402 -23.097 1.00 0.00 C ATOM 1523 ND1 HIS A 92 166.232 -1.878 -23.439 1.00 0.00 N ATOM 1524 CD2 HIS A 92 168.369 -1.760 -23.872 1.00 0.00 C ATOM 1525 CE1 HIS A 92 166.391 -0.962 -24.379 1.00 0.00 C ATOM 1526 NE2 HIS A 92 167.678 -0.871 -24.658 1.00 0.00 N ATOM 0 H HIS A 92 168.465 -4.952 -20.046 1.00 0.00 H new ATOM 0 HA HIS A 92 169.215 -2.318 -21.152 1.00 0.00 H new ATOM 0 HB2 HIS A 92 168.146 -4.322 -22.511 1.00 0.00 H new ATOM 0 HB3 HIS A 92 166.657 -3.817 -21.737 1.00 0.00 H new ATOM 0 HD2 HIS A 92 169.437 -1.918 -23.871 1.00 0.00 H new ATOM 0 HE1 HIS A 92 165.602 -0.386 -24.840 1.00 0.00 H new ATOM 0 HE2 HIS A 92 168.092 -0.242 -25.346 1.00 0.00 H new ATOM 1535 N HIS A 93 167.478 -0.940 -19.981 1.00 0.00 N ATOM 1536 CA HIS A 93 166.634 -0.103 -19.128 1.00 0.00 C ATOM 1537 C HIS A 93 165.529 0.573 -19.941 1.00 0.00 C ATOM 1538 O HIS A 93 165.664 0.654 -21.181 1.00 0.00 O ATOM 1539 CB HIS A 93 167.482 0.961 -18.420 1.00 0.00 C ATOM 1540 CG HIS A 93 168.206 0.458 -17.205 1.00 0.00 C ATOM 1541 ND1 HIS A 93 168.136 -0.849 -16.763 1.00 0.00 N ATOM 1542 CD2 HIS A 93 169.024 1.100 -16.337 1.00 0.00 C ATOM 1543 CE1 HIS A 93 168.877 -0.986 -15.678 1.00 0.00 C ATOM 1544 NE2 HIS A 93 169.427 0.181 -15.400 1.00 0.00 N ATOM 1545 OXT HIS A 93 164.535 1.017 -19.328 1.00 0.00 O ATOM 0 H HIS A 93 168.032 -0.419 -20.660 1.00 0.00 H new ATOM 0 HA HIS A 93 166.169 -0.747 -18.382 1.00 0.00 H new ATOM 0 HB2 HIS A 93 168.211 1.358 -19.126 1.00 0.00 H new ATOM 0 HB3 HIS A 93 166.837 1.790 -18.128 1.00 0.00 H new ATOM 0 HD2 HIS A 93 169.307 2.142 -16.375 1.00 0.00 H new ATOM 0 HE1 HIS A 93 169.010 -1.898 -15.114 1.00 0.00 H new ATOM 0 HE2 HIS A 93 170.051 0.370 -14.615 1.00 0.00 H new TER 1554 HIS A 93