USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1090 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 23 TYR OH : rot -30:sc= 0.663 USER MOD Set 1.2: A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 114 THR OG1 : rot 180:sc= -0.32 USER MOD Set 2.2: A 117 GLN : amide:sc= 0.848 K(o=0.53,f=1.5) USER MOD Set 3.1: A 25 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 115 MET CE :methyl -149:sc= -0.332 (180deg=-0.561) USER MOD Set 4.1: A 97 GLN : amide:sc= 0.0689 K(o=0.7,f=-1.5) USER MOD Set 4.2: A 110 LYS NZ :NH3+ 173:sc= 0.636 (180deg=0.0385) USER MOD Set 5.1: A 76 THR OG1 : rot 156:sc= 0.76 USER MOD Set 5.2: A 79 TYR OH : rot 180:sc= 0.14 USER MOD Set 6.1: A 38 LYS NZ :NH3+ -119:sc= 1.14 (180deg=0.897) USER MOD Set 6.2: A 40 GLN : amide:sc= -4.19! C(o=-3.1!,f=-3.2!) USER MOD Set 7.1: A 33 GLN : amide:sc= 0.822 K(o=-1,f=-5.1) USER MOD Set 7.2: A 35 SER OG : rot 150:sc= 0.227 USER MOD Set 7.3: A 88 MET CE :methyl 167:sc= -0.048 (180deg=-0.544) USER MOD Set 7.4: A 118 MET CE :methyl 140:sc= -2.03! (180deg=-3.26!) USER MOD Set 8.1: A 9 LYS NZ :NH3+ -169:sc= 1.18 (180deg=-0.128) USER MOD Set 8.2: A 22 THR OG1 : rot 110:sc= 1.16 USER MOD Single : A 1 MET CE :methyl 161:sc= -0.128 (180deg=-0.655) USER MOD Single : A 1 MET N :NH3+ -147:sc= 1.18 (180deg=1.02) USER MOD Single : A 4 LYS NZ :NH3+ -165:sc= 1.31 (180deg=0.894) USER MOD Single : A 7 SER OG : rot -140:sc=-0.00447 USER MOD Single : A 8 LYS NZ :NH3+ -175:sc= 0.891 (180deg=0.64) USER MOD Single : A 11 SER OG : rot 18:sc= -2.18! USER MOD Single : A 13 ASN : amide:sc= -0.59! X(o=-0.59!,f=-0.41) USER MOD Single : A 15 ASN : amide:sc=-0.00724 X(o=-0.0072,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0282 USER MOD Single : A 26 LYS NZ :NH3+ -159:sc= 0.0219 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 168:sc= 1.29 (180deg=1.05) USER MOD Single : A 32 LYS NZ :NH3+ -133:sc= 1.27 (180deg=0.65) USER MOD Single : A 34 SER OG : rot -108:sc= 0.96 USER MOD Single : A 37 THR OG1 : rot 128:sc= 1.29 USER MOD Single : A 43 SER OG : rot -145:sc= 0.468 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -4:sc= 1.02 USER MOD Single : A 49 LYS NZ :NH3+ 173:sc= -0.0039 (180deg=-0.0958) USER MOD Single : A 54 LYS NZ :NH3+ -116:sc= 1.15 (180deg=-0.344) USER MOD Single : A 55 THR OG1 : rot 80:sc= 1.28 USER MOD Single : A 60 SER OG : rot -35:sc= 1.24 USER MOD Single : A 62 LYS NZ :NH3+ -115:sc= 0.0105 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.26) USER MOD Single : A 72 LYS NZ :NH3+ -167:sc= -0.0242 (180deg=-0.243) USER MOD Single : A 74 THR OG1 : rot 171:sc= -1.82! USER MOD Single : A 75 TYR OH : rot -175:sc= -2.62! USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -1.44! C(o=-1.4!,f=-1.5!) USER MOD Single : A 83 ASN : amide:sc= -2.13 K(o=-2.1,f=-0.68) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 53:sc= 0.0192 USER MOD Single : A 103 ASN : amide:sc= -0.0701 K(o=-0.07,f=-1.2!) USER MOD Single : A 105 SER OG : rot 45:sc= 0.0311 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 159:sc= 0.984 (180deg=0.625) USER MOD Single : A 128 LYS NZ :NH3+ 168:sc= -0.0441 (180deg=-0.266) USER MOD Single : A 131 LYS NZ :NH3+ 167:sc= 0.322 (180deg=0.232) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 135 HIS : no HD1:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 136 HIS : no HD1:sc= -0.289 X(o=-0.29,f=-0.29) USER MOD Single : A 137 HIS : no HE2:sc= -0.0622 K(o=-0.062,f=-0.6) USER MOD Single : A 138 HIS : no HD1:sc= -0.419 K(o=-0.42,f=-5.5!) USER MOD Single : A 139 HIS : no HE2:sc= 0.00924! C(o=0.0092!,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.533 4.616 14.142 1.00 0.00 N ATOM 2 CA MET A 1 18.099 4.993 14.138 1.00 0.00 C ATOM 3 C MET A 1 17.334 4.128 13.147 1.00 0.00 C ATOM 4 O MET A 1 16.443 3.376 13.538 1.00 0.00 O ATOM 5 CB MET A 1 17.925 6.476 13.788 1.00 0.00 C ATOM 6 CG MET A 1 18.470 7.422 14.848 1.00 0.00 C ATOM 7 SD MET A 1 18.314 9.161 14.388 1.00 0.00 S ATOM 8 CE MET A 1 16.538 9.310 14.195 1.00 0.00 C ATOM 0 H1 MET A 1 19.923 4.744 15.097 1.00 0.00 H new ATOM 0 H2 MET A 1 19.631 3.620 13.859 1.00 0.00 H new ATOM 0 H3 MET A 1 20.052 5.219 13.472 1.00 0.00 H new ATOM 0 HA MET A 1 17.699 4.828 15.138 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.426 6.678 12.841 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.865 6.683 13.639 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.942 7.251 15.786 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.520 7.192 15.027 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.253 10.361 14.247 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.241 8.901 13.229 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.038 8.759 14.991 1.00 0.00 H new ATOM 20 N GLY A 2 17.706 4.208 11.873 1.00 0.00 N ATOM 21 CA GLY A 2 17.071 3.384 10.856 1.00 0.00 C ATOM 22 C GLY A 2 17.641 1.980 10.838 1.00 0.00 C ATOM 23 O GLY A 2 17.944 1.429 9.780 1.00 0.00 O ATOM 0 H GLY A 2 18.437 4.829 11.525 1.00 0.00 H new ATOM 0 HA2 GLY A 2 15.998 3.339 11.042 1.00 0.00 H new ATOM 0 HA3 GLY A 2 17.206 3.845 9.877 1.00 0.00 H new ATOM 27 N ASP A 3 17.805 1.419 12.025 1.00 0.00 N ATOM 28 CA ASP A 3 18.388 0.098 12.192 1.00 0.00 C ATOM 29 C ASP A 3 17.528 -0.732 13.134 1.00 0.00 C ATOM 30 O ASP A 3 17.378 -1.939 12.959 1.00 0.00 O ATOM 31 CB ASP A 3 19.819 0.212 12.746 1.00 0.00 C ATOM 32 CG ASP A 3 19.872 0.815 14.144 1.00 0.00 C ATOM 33 OD1 ASP A 3 19.481 1.993 14.308 1.00 0.00 O ATOM 34 OD2 ASP A 3 20.304 0.116 15.084 1.00 0.00 O ATOM 0 H ASP A 3 17.537 1.868 12.901 1.00 0.00 H new ATOM 0 HA ASP A 3 18.429 -0.394 11.220 1.00 0.00 H new ATOM 0 HB2 ASP A 3 20.274 -0.778 12.766 1.00 0.00 H new ATOM 0 HB3 ASP A 3 20.416 0.824 12.070 1.00 0.00 H new ATOM 39 N LYS A 4 16.945 -0.063 14.121 1.00 0.00 N ATOM 40 CA LYS A 4 16.111 -0.724 15.117 1.00 0.00 C ATOM 41 C LYS A 4 14.669 -0.757 14.637 1.00 0.00 C ATOM 42 O LYS A 4 13.862 -1.551 15.111 1.00 0.00 O ATOM 43 CB LYS A 4 16.232 0.013 16.450 1.00 0.00 C ATOM 44 CG LYS A 4 17.665 0.418 16.739 1.00 0.00 C ATOM 45 CD LYS A 4 17.830 1.110 18.074 1.00 0.00 C ATOM 46 CE LYS A 4 19.176 1.813 18.147 1.00 0.00 C ATOM 47 NZ LYS A 4 20.293 0.941 17.688 1.00 0.00 N ATOM 0 H LYS A 4 17.036 0.944 14.253 1.00 0.00 H new ATOM 0 HA LYS A 4 16.445 -1.752 15.259 1.00 0.00 H new ATOM 0 HB2 LYS A 4 15.599 0.900 16.434 1.00 0.00 H new ATOM 0 HB3 LYS A 4 15.865 -0.626 17.254 1.00 0.00 H new ATOM 0 HG2 LYS A 4 18.298 -0.469 16.716 1.00 0.00 H new ATOM 0 HG3 LYS A 4 18.015 1.081 15.948 1.00 0.00 H new ATOM 0 HD2 LYS A 4 17.027 1.833 18.217 1.00 0.00 H new ATOM 0 HD3 LYS A 4 17.750 0.381 18.880 1.00 0.00 H new ATOM 0 HE2 LYS A 4 19.146 2.715 17.535 1.00 0.00 H new ATOM 0 HE3 LYS A 4 19.363 2.130 19.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 21.200 1.353 17.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 20.188 -0.006 18.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 20.271 0.866 16.651 1.00 0.00 H new ATOM 61 N GLU A 5 14.374 0.133 13.698 1.00 0.00 N ATOM 62 CA GLU A 5 13.114 0.147 12.973 1.00 0.00 C ATOM 63 C GLU A 5 13.154 1.311 11.991 1.00 0.00 C ATOM 64 O GLU A 5 13.721 2.359 12.302 1.00 0.00 O ATOM 65 CB GLU A 5 11.912 0.275 13.918 1.00 0.00 C ATOM 66 CG GLU A 5 10.599 -0.149 13.278 1.00 0.00 C ATOM 67 CD GLU A 5 9.447 -0.190 14.263 1.00 0.00 C ATOM 68 OE1 GLU A 5 8.859 0.868 14.567 1.00 0.00 O ATOM 69 OE2 GLU A 5 9.112 -1.289 14.749 1.00 0.00 O ATOM 0 H GLU A 5 15.014 0.875 13.416 1.00 0.00 H new ATOM 0 HA GLU A 5 12.990 -0.798 12.443 1.00 0.00 H new ATOM 0 HB2 GLU A 5 12.089 -0.333 14.805 1.00 0.00 H new ATOM 0 HB3 GLU A 5 11.829 1.309 14.252 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.355 0.541 12.470 1.00 0.00 H new ATOM 0 HG3 GLU A 5 10.721 -1.135 12.829 1.00 0.00 H new ATOM 76 N GLU A 6 12.589 1.126 10.811 1.00 0.00 N ATOM 77 CA GLU A 6 12.697 2.122 9.761 1.00 0.00 C ATOM 78 C GLU A 6 11.422 2.148 8.932 1.00 0.00 C ATOM 79 O GLU A 6 10.733 1.135 8.804 1.00 0.00 O ATOM 80 CB GLU A 6 13.918 1.821 8.881 1.00 0.00 C ATOM 81 CG GLU A 6 14.101 2.772 7.706 1.00 0.00 C ATOM 82 CD GLU A 6 14.311 4.214 8.121 1.00 0.00 C ATOM 83 OE1 GLU A 6 13.318 4.891 8.465 1.00 0.00 O ATOM 84 OE2 GLU A 6 15.459 4.694 8.052 1.00 0.00 O ATOM 0 H GLU A 6 12.052 0.297 10.557 1.00 0.00 H new ATOM 0 HA GLU A 6 12.830 3.106 10.210 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.814 1.854 9.501 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.832 0.804 8.499 1.00 0.00 H new ATOM 0 HG2 GLU A 6 14.956 2.445 7.114 1.00 0.00 H new ATOM 0 HG3 GLU A 6 13.225 2.712 7.061 1.00 0.00 H new ATOM 91 N SER A 7 11.118 3.304 8.371 1.00 0.00 N ATOM 92 CA SER A 7 9.895 3.481 7.620 1.00 0.00 C ATOM 93 C SER A 7 10.145 4.273 6.337 1.00 0.00 C ATOM 94 O SER A 7 10.877 5.268 6.332 1.00 0.00 O ATOM 95 CB SER A 7 8.851 4.175 8.494 1.00 0.00 C ATOM 96 OG SER A 7 9.401 5.313 9.139 1.00 0.00 O ATOM 0 H SER A 7 11.706 4.136 8.423 1.00 0.00 H new ATOM 0 HA SER A 7 9.519 2.500 7.329 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.001 4.475 7.882 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.475 3.476 9.241 1.00 0.00 H new ATOM 0 HG SER A 7 9.063 5.364 10.058 1.00 0.00 H new ATOM 102 N LYS A 8 9.557 3.805 5.248 1.00 0.00 N ATOM 103 CA LYS A 8 9.654 4.491 3.972 1.00 0.00 C ATOM 104 C LYS A 8 8.281 4.570 3.315 1.00 0.00 C ATOM 105 O LYS A 8 7.815 3.603 2.720 1.00 0.00 O ATOM 106 CB LYS A 8 10.629 3.767 3.039 1.00 0.00 C ATOM 107 CG LYS A 8 11.703 4.665 2.443 1.00 0.00 C ATOM 108 CD LYS A 8 12.669 3.861 1.585 1.00 0.00 C ATOM 109 CE LYS A 8 13.714 4.739 0.916 1.00 0.00 C ATOM 110 NZ LYS A 8 14.695 3.936 0.137 1.00 0.00 N ATOM 0 H LYS A 8 9.005 2.948 5.224 1.00 0.00 H new ATOM 0 HA LYS A 8 10.027 5.499 4.154 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.111 2.960 3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.065 3.307 2.228 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.237 5.445 1.840 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.250 5.164 3.243 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.167 3.115 2.204 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.110 3.320 0.822 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.221 5.451 0.255 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.240 5.319 1.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.439 4.561 -0.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 15.123 3.217 0.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.210 3.468 -0.655 1.00 0.00 H new ATOM 124 N LYS A 9 7.620 5.703 3.467 1.00 0.00 N ATOM 125 CA LYS A 9 6.365 5.945 2.771 1.00 0.00 C ATOM 126 C LYS A 9 6.648 6.574 1.428 1.00 0.00 C ATOM 127 O LYS A 9 7.233 7.639 1.372 1.00 0.00 O ATOM 128 CB LYS A 9 5.452 6.874 3.583 1.00 0.00 C ATOM 129 CG LYS A 9 4.125 7.174 2.895 1.00 0.00 C ATOM 130 CD LYS A 9 3.345 8.269 3.613 1.00 0.00 C ATOM 131 CE LYS A 9 2.812 7.808 4.964 1.00 0.00 C ATOM 132 NZ LYS A 9 1.760 6.764 4.826 1.00 0.00 N ATOM 0 H LYS A 9 7.929 6.470 4.064 1.00 0.00 H new ATOM 0 HA LYS A 9 5.857 4.990 2.640 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.255 6.419 4.554 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.975 7.812 3.771 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.311 7.477 1.865 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.523 6.266 2.856 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.989 9.137 3.756 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.513 8.589 2.987 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.634 7.416 5.563 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.404 8.663 5.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.297 6.614 5.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.053 7.073 4.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.194 5.874 4.508 1.00 0.00 H new ATOM 146 N PHE A 10 6.279 5.904 0.355 1.00 0.00 N ATOM 147 CA PHE A 10 6.329 6.530 -0.953 1.00 0.00 C ATOM 148 C PHE A 10 4.909 6.868 -1.365 1.00 0.00 C ATOM 149 O PHE A 10 3.976 6.137 -1.034 1.00 0.00 O ATOM 150 CB PHE A 10 7.027 5.639 -1.999 1.00 0.00 C ATOM 151 CG PHE A 10 6.162 4.586 -2.636 1.00 0.00 C ATOM 152 CD1 PHE A 10 5.319 4.906 -3.692 1.00 0.00 C ATOM 153 CD2 PHE A 10 6.202 3.276 -2.195 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.533 3.944 -4.288 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.420 2.309 -2.792 1.00 0.00 C ATOM 156 CZ PHE A 10 4.582 2.643 -3.837 1.00 0.00 C ATOM 0 H PHE A 10 5.946 4.940 0.360 1.00 0.00 H new ATOM 0 HA PHE A 10 6.927 7.439 -0.897 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.428 6.279 -2.785 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.876 5.148 -1.523 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.279 5.924 -4.051 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.852 3.007 -1.375 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.880 4.209 -5.107 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.463 1.289 -2.441 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.966 1.886 -4.300 1.00 0.00 H new ATOM 166 N SER A 11 4.735 7.971 -2.061 1.00 0.00 N ATOM 167 CA SER A 11 3.402 8.424 -2.405 1.00 0.00 C ATOM 168 C SER A 11 3.363 8.861 -3.864 1.00 0.00 C ATOM 169 O SER A 11 4.061 9.796 -4.258 1.00 0.00 O ATOM 170 CB SER A 11 2.984 9.565 -1.463 1.00 0.00 C ATOM 171 OG SER A 11 3.546 10.809 -1.846 1.00 0.00 O ATOM 0 H SER A 11 5.491 8.567 -2.398 1.00 0.00 H new ATOM 0 HA SER A 11 2.692 7.606 -2.282 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.897 9.647 -1.454 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.294 9.326 -0.446 1.00 0.00 H new ATOM 0 HG SER A 11 3.846 10.760 -2.778 1.00 0.00 H new ATOM 177 N ALA A 12 2.572 8.170 -4.667 1.00 0.00 N ATOM 178 CA ALA A 12 2.513 8.460 -6.089 1.00 0.00 C ATOM 179 C ALA A 12 1.081 8.506 -6.594 1.00 0.00 C ATOM 180 O ALA A 12 0.296 7.586 -6.359 1.00 0.00 O ATOM 181 CB ALA A 12 3.306 7.424 -6.866 1.00 0.00 C ATOM 0 H ALA A 12 1.965 7.409 -4.361 1.00 0.00 H new ATOM 0 HA ALA A 12 2.952 9.445 -6.245 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.255 7.651 -7.931 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.346 7.442 -6.540 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.887 6.434 -6.685 1.00 0.00 H new ATOM 187 N ASN A 13 0.742 9.588 -7.276 1.00 0.00 N ATOM 188 CA ASN A 13 -0.545 9.696 -7.947 1.00 0.00 C ATOM 189 C ASN A 13 -0.429 9.121 -9.349 1.00 0.00 C ATOM 190 O ASN A 13 0.092 9.775 -10.253 1.00 0.00 O ATOM 191 CB ASN A 13 -0.999 11.161 -8.023 1.00 0.00 C ATOM 192 CG ASN A 13 -2.278 11.347 -8.830 1.00 0.00 C ATOM 193 OD1 ASN A 13 -2.249 11.409 -10.059 1.00 0.00 O ATOM 194 ND2 ASN A 13 -3.399 11.497 -8.149 1.00 0.00 N ATOM 0 H ASN A 13 1.342 10.407 -7.380 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.287 9.137 -7.377 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.155 11.540 -7.013 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.204 11.759 -8.469 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.275 11.670 -8.641 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.389 11.440 -7.131 1.00 0.00 H new ATOM 201 N LEU A 14 -0.875 7.892 -9.529 1.00 0.00 N ATOM 202 CA LEU A 14 -0.852 7.284 -10.848 1.00 0.00 C ATOM 203 C LEU A 14 -2.186 7.495 -11.550 1.00 0.00 C ATOM 204 O LEU A 14 -3.092 6.664 -11.455 1.00 0.00 O ATOM 205 CB LEU A 14 -0.481 5.792 -10.797 1.00 0.00 C ATOM 206 CG LEU A 14 -1.057 4.985 -9.628 1.00 0.00 C ATOM 207 CD1 LEU A 14 -1.325 3.552 -10.058 1.00 0.00 C ATOM 208 CD2 LEU A 14 -0.092 4.997 -8.449 1.00 0.00 C ATOM 0 H LEU A 14 -1.253 7.300 -8.789 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.071 7.779 -11.424 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.808 5.327 -11.727 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.606 5.711 -10.765 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.996 5.446 -9.322 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.734 2.990 -9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.040 3.547 -10.880 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.393 3.090 -10.384 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.515 4.420 -7.627 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.858 4.555 -8.752 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.073 6.024 -8.124 1.00 0.00 H new ATOM 220 N ASN A 15 -2.301 8.661 -12.190 1.00 0.00 N ATOM 221 CA ASN A 15 -3.452 9.028 -13.023 1.00 0.00 C ATOM 222 C ASN A 15 -4.679 9.376 -12.190 1.00 0.00 C ATOM 223 O ASN A 15 -5.233 10.471 -12.300 1.00 0.00 O ATOM 224 CB ASN A 15 -3.778 7.917 -14.031 1.00 0.00 C ATOM 225 CG ASN A 15 -5.011 8.218 -14.862 1.00 0.00 C ATOM 226 OD1 ASN A 15 -4.936 8.906 -15.880 1.00 0.00 O ATOM 227 ND2 ASN A 15 -6.148 7.679 -14.457 1.00 0.00 N ATOM 0 H ASN A 15 -1.587 9.388 -12.144 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.171 9.925 -13.574 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.925 7.773 -14.694 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.927 6.979 -13.495 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.003 7.828 -14.994 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.171 7.115 -13.608 1.00 0.00 H new ATOM 234 N GLY A 16 -5.086 8.450 -11.355 1.00 0.00 N ATOM 235 CA GLY A 16 -6.291 8.632 -10.571 1.00 0.00 C ATOM 236 C GLY A 16 -6.154 8.110 -9.156 1.00 0.00 C ATOM 237 O GLY A 16 -6.730 8.671 -8.223 1.00 0.00 O ATOM 0 H GLY A 16 -4.605 7.564 -11.199 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.542 9.692 -10.540 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.120 8.123 -11.063 1.00 0.00 H new ATOM 241 N THR A 17 -5.408 7.031 -8.993 1.00 0.00 N ATOM 242 CA THR A 17 -5.186 6.453 -7.681 1.00 0.00 C ATOM 243 C THR A 17 -3.876 6.946 -7.078 1.00 0.00 C ATOM 244 O THR A 17 -2.814 6.811 -7.688 1.00 0.00 O ATOM 245 CB THR A 17 -5.173 4.917 -7.757 1.00 0.00 C ATOM 246 OG1 THR A 17 -4.522 4.495 -8.963 1.00 0.00 O ATOM 247 CG2 THR A 17 -6.587 4.360 -7.708 1.00 0.00 C ATOM 0 H THR A 17 -4.945 6.537 -9.756 1.00 0.00 H new ATOM 0 HA THR A 17 -6.008 6.771 -7.040 1.00 0.00 H new ATOM 0 HB THR A 17 -4.624 4.534 -6.897 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.515 3.516 -9.006 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.552 3.272 -7.763 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.064 4.661 -6.775 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.160 4.748 -8.550 1.00 0.00 H new ATOM 255 N GLU A 18 -3.957 7.532 -5.892 1.00 0.00 N ATOM 256 CA GLU A 18 -2.767 7.984 -5.190 1.00 0.00 C ATOM 257 C GLU A 18 -2.350 6.932 -4.177 1.00 0.00 C ATOM 258 O GLU A 18 -2.893 6.868 -3.077 1.00 0.00 O ATOM 259 CB GLU A 18 -3.024 9.316 -4.481 1.00 0.00 C ATOM 260 CG GLU A 18 -4.085 10.169 -5.156 1.00 0.00 C ATOM 261 CD GLU A 18 -3.977 11.634 -4.792 1.00 0.00 C ATOM 262 OE1 GLU A 18 -4.390 12.012 -3.678 1.00 0.00 O ATOM 263 OE2 GLU A 18 -3.487 12.417 -5.628 1.00 0.00 O ATOM 0 H GLU A 18 -4.832 7.705 -5.398 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.968 8.134 -5.916 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.328 9.118 -3.453 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.092 9.879 -4.435 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.999 10.060 -6.237 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.072 9.801 -4.877 1.00 0.00 H new ATOM 270 N ILE A 19 -1.411 6.088 -4.561 1.00 0.00 N ATOM 271 CA ILE A 19 -1.002 4.985 -3.712 1.00 0.00 C ATOM 272 C ILE A 19 0.189 5.377 -2.849 1.00 0.00 C ATOM 273 O ILE A 19 1.240 5.780 -3.355 1.00 0.00 O ATOM 274 CB ILE A 19 -0.666 3.725 -4.539 1.00 0.00 C ATOM 275 CG1 ILE A 19 -1.890 3.302 -5.361 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.216 2.589 -3.627 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.672 2.059 -6.197 1.00 0.00 C ATOM 0 H ILE A 19 -0.918 6.144 -5.452 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.845 4.748 -3.062 1.00 0.00 H new ATOM 0 HB ILE A 19 0.153 3.958 -5.219 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.727 3.130 -4.684 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.175 4.124 -6.018 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.016 1.710 -4.228 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.672 2.896 -3.075 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.014 2.348 -2.925 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.583 1.826 -6.748 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.857 2.232 -6.900 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.418 1.223 -5.546 1.00 0.00 H new ATOM 289 N ALA A 20 -0.001 5.282 -1.544 1.00 0.00 N ATOM 290 CA ALA A 20 1.043 5.588 -0.587 1.00 0.00 C ATOM 291 C ALA A 20 1.410 4.346 0.206 1.00 0.00 C ATOM 292 O ALA A 20 0.671 3.929 1.098 1.00 0.00 O ATOM 293 CB ALA A 20 0.594 6.700 0.349 1.00 0.00 C ATOM 0 H ALA A 20 -0.882 4.991 -1.121 1.00 0.00 H new ATOM 0 HA ALA A 20 1.925 5.928 -1.130 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.389 6.919 1.062 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.370 7.595 -0.231 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.299 6.384 0.887 1.00 0.00 H new ATOM 299 N ILE A 21 2.536 3.745 -0.126 1.00 0.00 N ATOM 300 CA ILE A 21 2.978 2.552 0.568 1.00 0.00 C ATOM 301 C ILE A 21 4.059 2.897 1.582 1.00 0.00 C ATOM 302 O ILE A 21 5.078 3.497 1.246 1.00 0.00 O ATOM 303 CB ILE A 21 3.491 1.473 -0.407 1.00 0.00 C ATOM 304 CG1 ILE A 21 2.360 1.021 -1.337 1.00 0.00 C ATOM 305 CG2 ILE A 21 4.059 0.288 0.359 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.760 -0.068 -2.311 1.00 0.00 C ATOM 0 H ILE A 21 3.159 4.062 -0.869 1.00 0.00 H new ATOM 0 HA ILE A 21 2.113 2.142 1.089 1.00 0.00 H new ATOM 0 HB ILE A 21 4.289 1.902 -1.013 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.527 0.664 -0.732 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.000 1.883 -1.899 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.416 -0.463 -0.345 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.887 0.622 0.984 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.281 -0.145 0.988 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.905 -0.332 -2.933 1.00 0.00 H new ATOM 0 HD12 ILE A 21 3.572 0.290 -2.944 1.00 0.00 H new ATOM 0 HD13 ILE A 21 3.091 -0.947 -1.758 1.00 0.00 H new ATOM 318 N THR A 22 3.811 2.520 2.821 1.00 0.00 N ATOM 319 CA THR A 22 4.704 2.812 3.919 1.00 0.00 C ATOM 320 C THR A 22 5.399 1.537 4.377 1.00 0.00 C ATOM 321 O THR A 22 4.779 0.673 4.998 1.00 0.00 O ATOM 322 CB THR A 22 3.920 3.412 5.098 1.00 0.00 C ATOM 323 OG1 THR A 22 2.965 4.361 4.604 1.00 0.00 O ATOM 324 CG2 THR A 22 4.852 4.090 6.088 1.00 0.00 C ATOM 0 H THR A 22 2.978 1.999 3.093 1.00 0.00 H new ATOM 0 HA THR A 22 5.448 3.532 3.578 1.00 0.00 H new ATOM 0 HB THR A 22 3.405 2.603 5.616 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.060 4.002 4.714 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.270 4.505 6.911 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.562 3.360 6.478 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.394 4.892 5.587 1.00 0.00 H new ATOM 332 N TYR A 23 6.672 1.407 4.041 1.00 0.00 N ATOM 333 CA TYR A 23 7.436 0.235 4.428 1.00 0.00 C ATOM 334 C TYR A 23 7.965 0.385 5.843 1.00 0.00 C ATOM 335 O TYR A 23 8.887 1.161 6.080 1.00 0.00 O ATOM 336 CB TYR A 23 8.628 0.014 3.495 1.00 0.00 C ATOM 337 CG TYR A 23 8.285 0.002 2.027 1.00 0.00 C ATOM 338 CD1 TYR A 23 7.601 -1.061 1.456 1.00 0.00 C ATOM 339 CD2 TYR A 23 8.663 1.055 1.211 1.00 0.00 C ATOM 340 CE1 TYR A 23 7.302 -1.067 0.109 1.00 0.00 C ATOM 341 CE2 TYR A 23 8.372 1.057 -0.132 1.00 0.00 C ATOM 342 CZ TYR A 23 7.689 -0.006 -0.681 1.00 0.00 C ATOM 343 OH TYR A 23 7.405 -0.014 -2.024 1.00 0.00 O ATOM 0 H TYR A 23 7.196 2.097 3.503 1.00 0.00 H new ATOM 0 HA TYR A 23 6.762 -0.619 4.366 1.00 0.00 H new ATOM 0 HB2 TYR A 23 9.364 0.798 3.676 1.00 0.00 H new ATOM 0 HB3 TYR A 23 9.102 -0.934 3.751 1.00 0.00 H new ATOM 0 HD1 TYR A 23 7.299 -1.894 2.073 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.197 1.891 1.638 1.00 0.00 H new ATOM 0 HE1 TYR A 23 6.767 -1.899 -0.324 1.00 0.00 H new ATOM 0 HE2 TYR A 23 8.677 1.886 -0.753 1.00 0.00 H new ATOM 0 HH TYR A 23 7.387 -0.938 -2.349 1.00 0.00 H new ATOM 353 N VAL A 24 7.369 -0.325 6.782 1.00 0.00 N ATOM 354 CA VAL A 24 7.964 -0.463 8.097 1.00 0.00 C ATOM 355 C VAL A 24 8.821 -1.713 8.099 1.00 0.00 C ATOM 356 O VAL A 24 8.319 -2.838 8.214 1.00 0.00 O ATOM 357 CB VAL A 24 6.913 -0.517 9.228 1.00 0.00 C ATOM 358 CG1 VAL A 24 7.560 -0.886 10.558 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.210 0.823 9.347 1.00 0.00 C ATOM 0 H VAL A 24 6.481 -0.811 6.660 1.00 0.00 H new ATOM 0 HA VAL A 24 8.571 0.420 8.297 1.00 0.00 H new ATOM 0 HB VAL A 24 6.182 -1.286 8.979 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.798 -0.917 11.337 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.033 -1.865 10.474 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.312 -0.141 10.816 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.471 0.776 10.147 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.941 1.599 9.574 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.712 1.058 8.406 1.00 0.00 H new ATOM 369 N TYR A 25 10.110 -1.516 7.913 1.00 0.00 N ATOM 370 CA TYR A 25 11.020 -2.622 7.734 1.00 0.00 C ATOM 371 C TYR A 25 12.160 -2.553 8.726 1.00 0.00 C ATOM 372 O TYR A 25 12.415 -1.511 9.332 1.00 0.00 O ATOM 373 CB TYR A 25 11.556 -2.663 6.296 1.00 0.00 C ATOM 374 CG TYR A 25 12.387 -1.468 5.871 1.00 0.00 C ATOM 375 CD1 TYR A 25 11.789 -0.259 5.539 1.00 0.00 C ATOM 376 CD2 TYR A 25 13.769 -1.563 5.780 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.546 0.822 5.131 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.534 -0.487 5.369 1.00 0.00 C ATOM 379 CZ TYR A 25 13.918 0.702 5.046 1.00 0.00 C ATOM 380 OH TYR A 25 14.677 1.778 4.638 1.00 0.00 O ATOM 0 H TYR A 25 10.550 -0.596 7.882 1.00 0.00 H new ATOM 0 HA TYR A 25 10.466 -3.543 7.918 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.160 -3.563 6.178 1.00 0.00 H new ATOM 0 HB3 TYR A 25 10.710 -2.755 5.615 1.00 0.00 H new ATOM 0 HD1 TYR A 25 10.715 -0.163 5.601 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.255 -2.493 6.035 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.066 1.756 4.880 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.608 -0.578 5.302 1.00 0.00 H new ATOM 0 HH TYR A 25 15.624 1.527 4.634 1.00 0.00 H new ATOM 390 N LYS A 26 12.829 -3.671 8.892 1.00 0.00 N ATOM 391 CA LYS A 26 13.973 -3.747 9.775 1.00 0.00 C ATOM 392 C LYS A 26 15.025 -4.635 9.137 1.00 0.00 C ATOM 393 O LYS A 26 14.786 -5.820 8.902 1.00 0.00 O ATOM 394 CB LYS A 26 13.559 -4.294 11.142 1.00 0.00 C ATOM 395 CG LYS A 26 14.434 -3.793 12.276 1.00 0.00 C ATOM 396 CD LYS A 26 14.024 -4.385 13.614 1.00 0.00 C ATOM 397 CE LYS A 26 12.609 -3.981 13.993 1.00 0.00 C ATOM 398 NZ LYS A 26 12.347 -4.186 15.441 1.00 0.00 N ATOM 0 H LYS A 26 12.599 -4.547 8.424 1.00 0.00 H new ATOM 0 HA LYS A 26 14.385 -2.750 9.928 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.524 -4.015 11.340 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.596 -5.383 11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.474 -4.046 12.071 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.375 -2.706 12.327 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.093 -5.472 13.568 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.717 -4.054 14.387 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.450 -2.933 13.739 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.896 -4.562 13.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.322 -4.248 15.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.801 -5.067 15.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.735 -3.386 15.981 1.00 0.00 H new ATOM 412 N GLY A 27 16.176 -4.058 8.837 1.00 0.00 N ATOM 413 CA GLY A 27 17.172 -4.772 8.071 1.00 0.00 C ATOM 414 C GLY A 27 16.879 -4.669 6.590 1.00 0.00 C ATOM 415 O GLY A 27 16.901 -3.576 6.025 1.00 0.00 O ATOM 0 H GLY A 27 16.438 -3.111 9.109 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.161 -4.365 8.281 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.188 -5.819 8.372 1.00 0.00 H new ATOM 419 N ASP A 28 16.594 -5.798 5.958 1.00 0.00 N ATOM 420 CA ASP A 28 16.221 -5.803 4.548 1.00 0.00 C ATOM 421 C ASP A 28 14.784 -6.279 4.371 1.00 0.00 C ATOM 422 O ASP A 28 14.194 -6.136 3.299 1.00 0.00 O ATOM 423 CB ASP A 28 17.171 -6.686 3.733 1.00 0.00 C ATOM 424 CG ASP A 28 16.857 -6.660 2.245 1.00 0.00 C ATOM 425 OD1 ASP A 28 17.131 -5.629 1.591 1.00 0.00 O ATOM 426 OD2 ASP A 28 16.341 -7.668 1.722 1.00 0.00 O ATOM 0 H ASP A 28 16.613 -6.719 6.395 1.00 0.00 H new ATOM 0 HA ASP A 28 16.298 -4.780 4.180 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.197 -6.353 3.891 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.110 -7.712 4.096 1.00 0.00 H new ATOM 431 N LYS A 29 14.199 -6.835 5.420 1.00 0.00 N ATOM 432 CA LYS A 29 12.841 -7.329 5.319 1.00 0.00 C ATOM 433 C LYS A 29 11.845 -6.280 5.772 1.00 0.00 C ATOM 434 O LYS A 29 11.922 -5.783 6.899 1.00 0.00 O ATOM 435 CB LYS A 29 12.620 -8.594 6.146 1.00 0.00 C ATOM 436 CG LYS A 29 11.819 -9.645 5.393 1.00 0.00 C ATOM 437 CD LYS A 29 10.872 -10.411 6.301 1.00 0.00 C ATOM 438 CE LYS A 29 11.612 -11.212 7.354 1.00 0.00 C ATOM 439 NZ LYS A 29 10.680 -12.029 8.170 1.00 0.00 N ATOM 0 H LYS A 29 14.636 -6.953 6.334 1.00 0.00 H new ATOM 0 HA LYS A 29 12.684 -7.566 4.267 1.00 0.00 H new ATOM 0 HB2 LYS A 29 13.585 -9.012 6.431 1.00 0.00 H new ATOM 0 HB3 LYS A 29 12.099 -8.336 7.068 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.247 -9.163 4.600 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.503 -10.345 4.913 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.194 -9.711 6.789 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.259 -11.083 5.700 1.00 0.00 H new ATOM 0 HE2 LYS A 29 12.341 -11.863 6.872 1.00 0.00 H new ATOM 0 HE3 LYS A 29 12.168 -10.536 8.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.222 -12.711 8.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.136 -11.408 8.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.028 -12.542 7.543 1.00 0.00 H new ATOM 453 N VAL A 30 10.921 -5.940 4.894 1.00 0.00 N ATOM 454 CA VAL A 30 9.787 -5.131 5.288 1.00 0.00 C ATOM 455 C VAL A 30 8.842 -6.010 6.084 1.00 0.00 C ATOM 456 O VAL A 30 8.441 -7.064 5.612 1.00 0.00 O ATOM 457 CB VAL A 30 9.042 -4.528 4.079 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.011 -3.520 4.552 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.020 -3.887 3.105 1.00 0.00 C ATOM 0 H VAL A 30 10.934 -6.210 3.910 1.00 0.00 H new ATOM 0 HA VAL A 30 10.149 -4.293 5.883 1.00 0.00 H new ATOM 0 HB VAL A 30 8.526 -5.331 3.553 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.491 -3.100 3.691 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.292 -4.014 5.205 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.509 -2.720 5.100 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.472 -3.469 2.261 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.569 -3.092 3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.721 -4.640 2.745 1.00 0.00 H new ATOM 469 N LEU A 31 8.516 -5.601 7.296 1.00 0.00 N ATOM 470 CA LEU A 31 7.765 -6.462 8.196 1.00 0.00 C ATOM 471 C LEU A 31 6.290 -6.080 8.226 1.00 0.00 C ATOM 472 O LEU A 31 5.417 -6.944 8.313 1.00 0.00 O ATOM 473 CB LEU A 31 8.391 -6.412 9.591 1.00 0.00 C ATOM 474 CG LEU A 31 9.864 -6.835 9.620 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.443 -6.742 11.021 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.021 -8.247 9.084 1.00 0.00 C ATOM 0 H LEU A 31 8.756 -4.687 7.679 1.00 0.00 H new ATOM 0 HA LEU A 31 7.815 -7.487 7.830 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.305 -5.398 9.982 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.823 -7.060 10.258 1.00 0.00 H new ATOM 0 HG LEU A 31 10.417 -6.147 8.981 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.489 -7.049 11.004 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.373 -5.714 11.376 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.884 -7.396 11.690 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.073 -8.532 9.111 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.442 -8.936 9.699 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.661 -8.288 8.056 1.00 0.00 H new ATOM 488 N LYS A 32 6.015 -4.788 8.137 1.00 0.00 N ATOM 489 CA LYS A 32 4.645 -4.308 8.030 1.00 0.00 C ATOM 490 C LYS A 32 4.554 -3.243 6.948 1.00 0.00 C ATOM 491 O LYS A 32 5.180 -2.187 7.042 1.00 0.00 O ATOM 492 CB LYS A 32 4.138 -3.765 9.370 1.00 0.00 C ATOM 493 CG LYS A 32 3.834 -4.852 10.392 1.00 0.00 C ATOM 494 CD LYS A 32 3.330 -4.266 11.701 1.00 0.00 C ATOM 495 CE LYS A 32 2.977 -5.354 12.707 1.00 0.00 C ATOM 496 NZ LYS A 32 1.793 -6.152 12.288 1.00 0.00 N ATOM 0 H LYS A 32 6.722 -4.053 8.137 1.00 0.00 H new ATOM 0 HA LYS A 32 4.007 -5.148 7.756 1.00 0.00 H new ATOM 0 HB2 LYS A 32 4.885 -3.087 9.784 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.236 -3.178 9.197 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.087 -5.534 9.987 1.00 0.00 H new ATOM 0 HG3 LYS A 32 4.734 -5.439 10.578 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.093 -3.612 12.125 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.452 -3.649 11.509 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.832 -6.018 12.835 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.779 -4.898 13.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 1.138 -6.249 13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.310 -5.671 11.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.102 -7.095 11.978 1.00 0.00 H new ATOM 510 N GLN A 33 3.786 -3.536 5.914 1.00 0.00 N ATOM 511 CA GLN A 33 3.668 -2.646 4.774 1.00 0.00 C ATOM 512 C GLN A 33 2.280 -2.019 4.718 1.00 0.00 C ATOM 513 O GLN A 33 1.288 -2.704 4.467 1.00 0.00 O ATOM 514 CB GLN A 33 3.963 -3.416 3.484 1.00 0.00 C ATOM 515 CG GLN A 33 3.742 -2.605 2.220 1.00 0.00 C ATOM 516 CD GLN A 33 4.123 -3.360 0.963 1.00 0.00 C ATOM 517 OE1 GLN A 33 5.039 -4.177 0.965 1.00 0.00 O ATOM 518 NE2 GLN A 33 3.406 -3.104 -0.119 1.00 0.00 N ATOM 0 H GLN A 33 3.232 -4.389 5.841 1.00 0.00 H new ATOM 0 HA GLN A 33 4.395 -1.841 4.881 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.997 -3.761 3.507 1.00 0.00 H new ATOM 0 HB3 GLN A 33 3.331 -4.304 3.450 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.693 -2.314 2.159 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.325 -1.686 2.277 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.652 -2.418 -0.081 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.607 -3.593 -0.991 1.00 0.00 H new ATOM 527 N SER A 34 2.217 -0.719 4.964 1.00 0.00 N ATOM 528 CA SER A 34 0.960 0.010 4.899 1.00 0.00 C ATOM 529 C SER A 34 0.764 0.588 3.503 1.00 0.00 C ATOM 530 O SER A 34 1.253 1.671 3.194 1.00 0.00 O ATOM 531 CB SER A 34 0.936 1.128 5.952 1.00 0.00 C ATOM 532 OG SER A 34 -0.307 1.814 5.959 1.00 0.00 O ATOM 0 H SER A 34 3.024 -0.146 5.211 1.00 0.00 H new ATOM 0 HA SER A 34 0.142 -0.679 5.110 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.123 0.703 6.938 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.741 1.835 5.751 1.00 0.00 H new ATOM 0 HG SER A 34 -0.191 2.706 5.569 1.00 0.00 H new ATOM 538 N SER A 35 0.056 -0.142 2.663 1.00 0.00 N ATOM 539 CA SER A 35 -0.179 0.274 1.292 1.00 0.00 C ATOM 540 C SER A 35 -1.541 0.943 1.196 1.00 0.00 C ATOM 541 O SER A 35 -2.568 0.279 1.197 1.00 0.00 O ATOM 542 CB SER A 35 -0.121 -0.940 0.365 1.00 0.00 C ATOM 543 OG SER A 35 1.034 -1.724 0.628 1.00 0.00 O ATOM 0 H SER A 35 -0.371 -1.035 2.909 1.00 0.00 H new ATOM 0 HA SER A 35 0.591 0.983 0.988 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.016 -1.548 0.499 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.112 -0.609 -0.674 1.00 0.00 H new ATOM 0 HG SER A 35 0.845 -2.664 0.423 1.00 0.00 H new ATOM 549 N GLU A 36 -1.540 2.259 1.149 1.00 0.00 N ATOM 550 CA GLU A 36 -2.770 3.019 1.239 1.00 0.00 C ATOM 551 C GLU A 36 -3.140 3.637 -0.102 1.00 0.00 C ATOM 552 O GLU A 36 -2.500 4.584 -0.560 1.00 0.00 O ATOM 553 CB GLU A 36 -2.592 4.100 2.294 1.00 0.00 C ATOM 554 CG GLU A 36 -2.240 3.556 3.665 1.00 0.00 C ATOM 555 CD GLU A 36 -1.595 4.595 4.563 1.00 0.00 C ATOM 556 OE1 GLU A 36 -2.277 5.572 4.940 1.00 0.00 O ATOM 557 OE2 GLU A 36 -0.403 4.432 4.912 1.00 0.00 O ATOM 0 H GLU A 36 -0.698 2.826 1.049 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.585 2.352 1.520 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.808 4.785 1.972 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.512 4.680 2.367 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.144 3.179 4.144 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.563 2.710 3.552 1.00 0.00 H new ATOM 564 N THR A 37 -4.163 3.096 -0.735 1.00 0.00 N ATOM 565 CA THR A 37 -4.645 3.618 -1.999 1.00 0.00 C ATOM 566 C THR A 37 -5.664 4.728 -1.755 1.00 0.00 C ATOM 567 O THR A 37 -6.784 4.469 -1.310 1.00 0.00 O ATOM 568 CB THR A 37 -5.284 2.508 -2.854 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.434 1.356 -2.880 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.533 2.988 -4.275 1.00 0.00 C ATOM 0 H THR A 37 -4.681 2.287 -0.390 1.00 0.00 H new ATOM 0 HA THR A 37 -3.790 4.021 -2.542 1.00 0.00 H new ATOM 0 HB THR A 37 -6.241 2.245 -2.404 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.949 0.563 -2.622 1.00 0.00 H new ATOM 0 HG21 THR A 37 -5.985 2.184 -4.857 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.206 3.845 -4.257 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.587 3.279 -4.732 1.00 0.00 H new ATOM 578 N LYS A 38 -5.272 5.962 -2.021 1.00 0.00 N ATOM 579 CA LYS A 38 -6.156 7.098 -1.822 1.00 0.00 C ATOM 580 C LYS A 38 -7.077 7.254 -3.027 1.00 0.00 C ATOM 581 O LYS A 38 -6.725 7.870 -4.032 1.00 0.00 O ATOM 582 CB LYS A 38 -5.339 8.371 -1.574 1.00 0.00 C ATOM 583 CG LYS A 38 -6.176 9.617 -1.320 1.00 0.00 C ATOM 584 CD LYS A 38 -5.325 10.734 -0.742 1.00 0.00 C ATOM 585 CE LYS A 38 -6.062 12.065 -0.676 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.266 12.661 -2.023 1.00 0.00 N ATOM 0 H LYS A 38 -4.347 6.203 -2.376 1.00 0.00 H new ATOM 0 HA LYS A 38 -6.774 6.924 -0.941 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.685 8.207 -0.718 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.697 8.549 -2.436 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -6.634 9.948 -2.252 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -6.988 9.380 -0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.999 10.455 0.260 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.427 10.851 -1.348 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.029 11.919 -0.195 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.498 12.760 -0.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.786 13.582 -2.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.871 12.027 -2.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.283 12.791 -2.195 1.00 0.00 H new ATOM 600 N ILE A 39 -8.254 6.658 -2.914 1.00 0.00 N ATOM 601 CA ILE A 39 -9.222 6.653 -3.996 1.00 0.00 C ATOM 602 C ILE A 39 -10.141 7.858 -3.888 1.00 0.00 C ATOM 603 O ILE A 39 -10.829 8.043 -2.887 1.00 0.00 O ATOM 604 CB ILE A 39 -10.070 5.361 -3.975 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.161 4.129 -4.017 1.00 0.00 C ATOM 606 CG2 ILE A 39 -11.045 5.346 -5.148 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.906 2.818 -3.884 1.00 0.00 C ATOM 0 H ILE A 39 -8.562 6.167 -2.075 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.671 6.698 -4.935 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.645 5.336 -3.049 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.608 4.129 -4.956 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.427 4.203 -3.215 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.635 4.430 -5.119 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.709 6.208 -5.080 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.489 5.390 -6.084 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.197 1.991 -3.922 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.437 2.796 -2.933 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.621 2.721 -4.701 1.00 0.00 H new ATOM 619 N GLN A 40 -10.126 8.696 -4.908 1.00 0.00 N ATOM 620 CA GLN A 40 -11.009 9.845 -4.946 1.00 0.00 C ATOM 621 C GLN A 40 -12.326 9.434 -5.591 1.00 0.00 C ATOM 622 O GLN A 40 -12.363 8.480 -6.370 1.00 0.00 O ATOM 623 CB GLN A 40 -10.359 10.992 -5.726 1.00 0.00 C ATOM 624 CG GLN A 40 -8.933 11.313 -5.284 1.00 0.00 C ATOM 625 CD GLN A 40 -8.824 11.625 -3.802 1.00 0.00 C ATOM 626 OE1 GLN A 40 -8.963 12.769 -3.381 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.527 10.614 -3.001 1.00 0.00 N ATOM 0 H GLN A 40 -9.514 8.602 -5.718 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.198 10.196 -3.932 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.352 10.739 -6.786 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -10.973 11.886 -5.616 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.287 10.467 -5.519 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -8.565 12.164 -5.856 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.418 9.675 -3.384 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.407 10.774 -2.001 1.00 0.00 H new ATOM 636 N PHE A 41 -13.405 10.135 -5.269 1.00 0.00 N ATOM 637 CA PHE A 41 -14.722 9.786 -5.799 1.00 0.00 C ATOM 638 C PHE A 41 -14.757 9.883 -7.319 1.00 0.00 C ATOM 639 O PHE A 41 -15.461 9.120 -7.980 1.00 0.00 O ATOM 640 CB PHE A 41 -15.810 10.665 -5.179 1.00 0.00 C ATOM 641 CG PHE A 41 -16.295 10.168 -3.843 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.475 9.402 -3.027 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.578 10.456 -3.411 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.925 8.939 -1.805 1.00 0.00 C ATOM 645 CE2 PHE A 41 -18.034 9.995 -2.190 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.206 9.234 -1.387 1.00 0.00 C ATOM 0 H PHE A 41 -13.398 10.944 -4.648 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.919 8.749 -5.527 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.425 11.678 -5.063 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.655 10.722 -5.865 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.472 9.165 -3.351 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.231 11.048 -4.035 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.275 8.347 -1.178 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -19.037 10.229 -1.864 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.561 8.871 -0.434 1.00 0.00 H new ATOM 656 N ALA A 42 -13.971 10.797 -7.873 1.00 0.00 N ATOM 657 CA ALA A 42 -13.894 10.961 -9.318 1.00 0.00 C ATOM 658 C ALA A 42 -13.060 9.849 -9.951 1.00 0.00 C ATOM 659 O ALA A 42 -13.149 9.599 -11.152 1.00 0.00 O ATOM 660 CB ALA A 42 -13.316 12.324 -9.667 1.00 0.00 C ATOM 0 H ALA A 42 -13.378 11.436 -7.343 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.905 10.897 -9.721 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.265 12.431 -10.751 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.954 13.106 -9.255 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.314 12.413 -9.246 1.00 0.00 H new ATOM 666 N SER A 43 -12.253 9.182 -9.136 1.00 0.00 N ATOM 667 CA SER A 43 -11.411 8.095 -9.611 1.00 0.00 C ATOM 668 C SER A 43 -12.204 6.791 -9.670 1.00 0.00 C ATOM 669 O SER A 43 -12.025 5.982 -10.578 1.00 0.00 O ATOM 670 CB SER A 43 -10.200 7.927 -8.690 1.00 0.00 C ATOM 671 OG SER A 43 -9.582 9.176 -8.428 1.00 0.00 O ATOM 0 H SER A 43 -12.165 9.377 -8.139 1.00 0.00 H new ATOM 0 HA SER A 43 -11.065 8.339 -10.615 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.513 7.469 -7.752 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.480 7.251 -9.150 1.00 0.00 H new ATOM 0 HG SER A 43 -8.613 9.051 -8.349 1.00 0.00 H new ATOM 677 N ILE A 44 -13.081 6.598 -8.692 1.00 0.00 N ATOM 678 CA ILE A 44 -13.891 5.389 -8.623 1.00 0.00 C ATOM 679 C ILE A 44 -15.178 5.540 -9.435 1.00 0.00 C ATOM 680 O ILE A 44 -15.663 4.576 -10.029 1.00 0.00 O ATOM 681 CB ILE A 44 -14.224 5.014 -7.155 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.146 3.789 -7.096 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.849 6.195 -6.422 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.465 3.331 -5.687 1.00 0.00 C ATOM 0 H ILE A 44 -13.249 7.263 -7.937 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.302 4.580 -9.056 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.290 4.758 -6.654 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.077 4.022 -7.612 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.678 2.967 -7.638 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.074 5.908 -5.395 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.152 7.033 -6.420 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.769 6.490 -6.926 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.121 2.461 -5.727 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.541 3.065 -5.173 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -15.962 4.136 -5.147 1.00 0.00 H new ATOM 696 N GLY A 45 -15.707 6.755 -9.490 1.00 0.00 N ATOM 697 CA GLY A 45 -16.958 6.985 -10.186 1.00 0.00 C ATOM 698 C GLY A 45 -18.150 6.827 -9.264 1.00 0.00 C ATOM 699 O GLY A 45 -19.220 6.373 -9.676 1.00 0.00 O ATOM 0 H GLY A 45 -15.293 7.585 -9.066 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -16.958 7.988 -10.612 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.046 6.286 -11.017 1.00 0.00 H new ATOM 703 N ALA A 46 -17.961 7.201 -8.007 1.00 0.00 N ATOM 704 CA ALA A 46 -19.007 7.079 -7.006 1.00 0.00 C ATOM 705 C ALA A 46 -19.625 8.436 -6.709 1.00 0.00 C ATOM 706 O ALA A 46 -18.934 9.455 -6.729 1.00 0.00 O ATOM 707 CB ALA A 46 -18.449 6.459 -5.735 1.00 0.00 C ATOM 0 H ALA A 46 -17.087 7.593 -7.656 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.787 6.427 -7.399 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.243 6.373 -4.993 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.052 5.469 -5.957 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.652 7.090 -5.342 1.00 0.00 H new ATOM 713 N THR A 47 -20.922 8.448 -6.443 1.00 0.00 N ATOM 714 CA THR A 47 -21.625 9.684 -6.140 1.00 0.00 C ATOM 715 C THR A 47 -21.480 10.029 -4.662 1.00 0.00 C ATOM 716 O THR A 47 -21.116 11.148 -4.298 1.00 0.00 O ATOM 717 CB THR A 47 -23.122 9.563 -6.480 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.302 8.691 -7.607 1.00 0.00 O ATOM 719 CG2 THR A 47 -23.714 10.929 -6.796 1.00 0.00 C ATOM 0 H THR A 47 -21.509 7.614 -6.431 1.00 0.00 H new ATOM 0 HA THR A 47 -21.183 10.474 -6.747 1.00 0.00 H new ATOM 0 HB THR A 47 -23.636 9.148 -5.613 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.257 8.618 -7.815 1.00 0.00 H new ATOM 0 HG21 THR A 47 -24.772 10.821 -7.033 1.00 0.00 H new ATOM 0 HG22 THR A 47 -23.601 11.583 -5.932 1.00 0.00 H new ATOM 0 HG23 THR A 47 -23.193 11.363 -7.650 1.00 0.00 H new ATOM 727 N THR A 48 -21.767 9.049 -3.816 1.00 0.00 N ATOM 728 CA THR A 48 -21.679 9.217 -2.378 1.00 0.00 C ATOM 729 C THR A 48 -20.829 8.109 -1.766 1.00 0.00 C ATOM 730 O THR A 48 -20.393 7.193 -2.470 1.00 0.00 O ATOM 731 CB THR A 48 -23.079 9.200 -1.735 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.793 8.022 -2.145 1.00 0.00 O ATOM 733 CG2 THR A 48 -23.875 10.439 -2.118 1.00 0.00 C ATOM 0 H THR A 48 -22.066 8.119 -4.109 1.00 0.00 H new ATOM 0 HA THR A 48 -21.213 10.183 -2.183 1.00 0.00 H new ATOM 0 HB THR A 48 -22.953 9.194 -0.652 1.00 0.00 H new ATOM 0 HG1 THR A 48 -23.256 7.524 -2.796 1.00 0.00 H new ATOM 0 HG21 THR A 48 -24.858 10.399 -1.650 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.347 11.330 -1.778 1.00 0.00 H new ATOM 0 HG23 THR A 48 -23.990 10.477 -3.201 1.00 0.00 H new ATOM 741 N LYS A 49 -20.599 8.191 -0.460 1.00 0.00 N ATOM 742 CA LYS A 49 -19.835 7.166 0.248 1.00 0.00 C ATOM 743 C LYS A 49 -20.570 5.827 0.230 1.00 0.00 C ATOM 744 O LYS A 49 -19.961 4.776 0.428 1.00 0.00 O ATOM 745 CB LYS A 49 -19.550 7.597 1.691 1.00 0.00 C ATOM 746 CG LYS A 49 -20.792 7.970 2.480 1.00 0.00 C ATOM 747 CD LYS A 49 -20.461 8.298 3.927 1.00 0.00 C ATOM 748 CE LYS A 49 -21.679 8.817 4.674 1.00 0.00 C ATOM 749 NZ LYS A 49 -22.793 7.830 4.695 1.00 0.00 N ATOM 0 H LYS A 49 -20.929 8.954 0.130 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.884 7.043 -0.270 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -19.034 6.787 2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -18.871 8.449 1.677 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.275 8.828 2.014 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.505 7.146 2.447 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.080 7.406 4.425 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.668 9.045 3.959 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -21.396 9.064 5.697 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -22.023 9.740 4.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -23.554 8.178 5.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.161 7.702 3.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -22.443 6.919 5.056 1.00 0.00 H new ATOM 763 N GLU A 50 -21.878 5.872 -0.007 1.00 0.00 N ATOM 764 CA GLU A 50 -22.677 4.658 -0.139 1.00 0.00 C ATOM 765 C GLU A 50 -22.211 3.886 -1.367 1.00 0.00 C ATOM 766 O GLU A 50 -21.886 2.700 -1.286 1.00 0.00 O ATOM 767 CB GLU A 50 -24.165 5.024 -0.251 1.00 0.00 C ATOM 768 CG GLU A 50 -25.135 3.875 0.021 1.00 0.00 C ATOM 769 CD GLU A 50 -25.212 2.859 -1.102 1.00 0.00 C ATOM 770 OE1 GLU A 50 -25.711 3.207 -2.193 1.00 0.00 O ATOM 771 OE2 GLU A 50 -24.785 1.705 -0.900 1.00 0.00 O ATOM 0 H GLU A 50 -22.408 6.737 -0.112 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.548 4.029 0.742 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.378 5.833 0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.354 5.410 -1.253 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.834 3.367 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -26.130 4.285 0.196 1.00 0.00 H new ATOM 778 N ASP A 51 -22.143 4.590 -2.496 1.00 0.00 N ATOM 779 CA ASP A 51 -21.699 4.001 -3.757 1.00 0.00 C ATOM 780 C ASP A 51 -20.280 3.471 -3.622 1.00 0.00 C ATOM 781 O ASP A 51 -19.954 2.395 -4.122 1.00 0.00 O ATOM 782 CB ASP A 51 -21.730 5.035 -4.888 1.00 0.00 C ATOM 783 CG ASP A 51 -23.057 5.748 -5.018 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.958 5.221 -5.696 1.00 0.00 O ATOM 785 OD2 ASP A 51 -23.193 6.854 -4.454 1.00 0.00 O ATOM 0 H ASP A 51 -22.392 5.577 -2.562 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.381 3.185 -3.997 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -20.946 5.772 -4.717 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.500 4.538 -5.830 1.00 0.00 H new ATOM 790 N ALA A 52 -19.441 4.243 -2.940 1.00 0.00 N ATOM 791 CA ALA A 52 -18.041 3.890 -2.761 1.00 0.00 C ATOM 792 C ALA A 52 -17.891 2.624 -1.925 1.00 0.00 C ATOM 793 O ALA A 52 -17.242 1.668 -2.349 1.00 0.00 O ATOM 794 CB ALA A 52 -17.285 5.045 -2.121 1.00 0.00 C ATOM 0 H ALA A 52 -19.711 5.123 -2.500 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.614 3.691 -3.744 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.239 4.768 -1.992 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.352 5.924 -2.763 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.722 5.272 -1.149 1.00 0.00 H new ATOM 800 N ALA A 53 -18.515 2.611 -0.750 1.00 0.00 N ATOM 801 CA ALA A 53 -18.400 1.480 0.164 1.00 0.00 C ATOM 802 C ALA A 53 -18.942 0.207 -0.467 1.00 0.00 C ATOM 803 O ALA A 53 -18.309 -0.842 -0.404 1.00 0.00 O ATOM 804 CB ALA A 53 -19.118 1.769 1.471 1.00 0.00 C ATOM 0 H ALA A 53 -19.105 3.370 -0.409 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.341 1.330 0.375 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.019 0.912 2.138 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.677 2.648 1.942 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.174 1.955 1.273 1.00 0.00 H new ATOM 810 N LYS A 54 -20.096 0.319 -1.109 1.00 0.00 N ATOM 811 CA LYS A 54 -20.744 -0.824 -1.745 1.00 0.00 C ATOM 812 C LYS A 54 -19.863 -1.414 -2.851 1.00 0.00 C ATOM 813 O LYS A 54 -20.058 -2.551 -3.279 1.00 0.00 O ATOM 814 CB LYS A 54 -22.104 -0.389 -2.298 1.00 0.00 C ATOM 815 CG LYS A 54 -22.930 -1.508 -2.912 1.00 0.00 C ATOM 816 CD LYS A 54 -24.387 -1.095 -3.044 1.00 0.00 C ATOM 817 CE LYS A 54 -24.544 0.177 -3.863 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.865 0.820 -3.635 1.00 0.00 N ATOM 0 H LYS A 54 -20.608 1.196 -1.205 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.894 -1.607 -1.002 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.679 0.068 -1.492 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -21.944 0.382 -3.052 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -22.530 -1.765 -3.893 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.856 -2.402 -2.293 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.952 -1.901 -3.513 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.813 -0.943 -2.052 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.749 0.877 -3.604 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.431 -0.056 -4.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -26.411 0.814 -4.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -26.385 0.295 -2.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.724 1.802 -3.322 1.00 0.00 H new ATOM 832 N THR A 55 -18.884 -0.641 -3.297 1.00 0.00 N ATOM 833 CA THR A 55 -17.959 -1.095 -4.323 1.00 0.00 C ATOM 834 C THR A 55 -16.673 -1.657 -3.703 1.00 0.00 C ATOM 835 O THR A 55 -16.119 -2.640 -4.191 1.00 0.00 O ATOM 836 CB THR A 55 -17.602 0.061 -5.282 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.802 0.661 -5.794 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.745 -0.428 -6.441 1.00 0.00 C ATOM 0 H THR A 55 -18.710 0.307 -2.963 1.00 0.00 H new ATOM 0 HA THR A 55 -18.454 -1.889 -4.881 1.00 0.00 H new ATOM 0 HB THR A 55 -17.031 0.800 -4.719 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.167 1.281 -5.129 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.510 0.409 -7.098 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.820 -0.856 -6.054 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.290 -1.188 -7.001 1.00 0.00 H new ATOM 846 N LEU A 56 -16.218 -1.046 -2.614 1.00 0.00 N ATOM 847 CA LEU A 56 -14.910 -1.373 -2.046 1.00 0.00 C ATOM 848 C LEU A 56 -14.989 -2.446 -0.957 1.00 0.00 C ATOM 849 O LEU A 56 -14.102 -3.291 -0.860 1.00 0.00 O ATOM 850 CB LEU A 56 -14.254 -0.112 -1.481 1.00 0.00 C ATOM 851 CG LEU A 56 -14.019 1.011 -2.495 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.378 2.213 -1.819 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.152 0.521 -3.645 1.00 0.00 C ATOM 0 H LEU A 56 -16.731 -0.325 -2.107 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.305 -1.779 -2.857 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.878 0.273 -0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.296 -0.387 -1.039 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.984 1.316 -2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.218 3.002 -2.554 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.035 2.580 -1.030 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.421 1.920 -1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.996 1.333 -4.355 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.189 0.188 -3.258 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.649 -0.309 -4.147 1.00 0.00 H new ATOM 865 N GLU A 57 -16.054 -2.419 -0.156 1.00 0.00 N ATOM 866 CA GLU A 57 -16.188 -3.328 0.992 1.00 0.00 C ATOM 867 C GLU A 57 -15.977 -4.808 0.620 1.00 0.00 C ATOM 868 O GLU A 57 -15.301 -5.530 1.357 1.00 0.00 O ATOM 869 CB GLU A 57 -17.541 -3.144 1.682 1.00 0.00 C ATOM 870 CG GLU A 57 -17.659 -1.826 2.426 1.00 0.00 C ATOM 871 CD GLU A 57 -18.833 -1.793 3.383 1.00 0.00 C ATOM 872 OE1 GLU A 57 -18.770 -2.479 4.424 1.00 0.00 O ATOM 873 OE2 GLU A 57 -19.816 -1.075 3.113 1.00 0.00 O ATOM 0 H GLU A 57 -16.839 -1.779 -0.277 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.391 -3.058 1.685 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.333 -3.205 0.936 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.699 -3.964 2.382 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.739 -1.644 2.981 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.762 -1.015 1.705 1.00 0.00 H new ATOM 880 N PRO A 58 -16.588 -5.296 -0.486 1.00 0.00 N ATOM 881 CA PRO A 58 -16.332 -6.641 -1.020 1.00 0.00 C ATOM 882 C PRO A 58 -14.852 -7.053 -0.998 1.00 0.00 C ATOM 883 O PRO A 58 -14.525 -8.194 -0.670 1.00 0.00 O ATOM 884 CB PRO A 58 -16.812 -6.529 -2.466 1.00 0.00 C ATOM 885 CG PRO A 58 -17.898 -5.508 -2.443 1.00 0.00 C ATOM 886 CD PRO A 58 -17.640 -4.606 -1.261 1.00 0.00 C ATOM 0 HA PRO A 58 -16.833 -7.401 -0.420 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.001 -6.225 -3.127 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.181 -7.487 -2.833 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.906 -4.934 -3.370 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.874 -5.986 -2.356 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.312 -3.617 -1.581 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.542 -4.465 -0.666 1.00 0.00 H new ATOM 894 N LEU A 59 -13.964 -6.121 -1.336 1.00 0.00 N ATOM 895 CA LEU A 59 -12.537 -6.423 -1.442 1.00 0.00 C ATOM 896 C LEU A 59 -11.923 -6.678 -0.070 1.00 0.00 C ATOM 897 O LEU A 59 -11.131 -7.608 0.101 1.00 0.00 O ATOM 898 CB LEU A 59 -11.782 -5.289 -2.149 1.00 0.00 C ATOM 899 CG LEU A 59 -11.959 -5.213 -3.673 1.00 0.00 C ATOM 900 CD1 LEU A 59 -13.378 -4.812 -4.049 1.00 0.00 C ATOM 901 CD2 LEU A 59 -10.955 -4.238 -4.271 1.00 0.00 C ATOM 0 H LEU A 59 -14.206 -5.152 -1.541 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.442 -7.330 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.103 -4.341 -1.718 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -10.719 -5.395 -1.931 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.776 -6.206 -4.082 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -13.468 -4.768 -5.134 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.080 -5.547 -3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.604 -3.833 -3.626 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.091 -4.193 -5.352 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.111 -3.247 -3.844 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -9.943 -4.574 -4.046 1.00 0.00 H new ATOM 913 N SER A 60 -12.317 -5.872 0.907 1.00 0.00 N ATOM 914 CA SER A 60 -11.783 -5.975 2.262 1.00 0.00 C ATOM 915 C SER A 60 -12.082 -7.344 2.884 1.00 0.00 C ATOM 916 O SER A 60 -11.408 -7.778 3.821 1.00 0.00 O ATOM 917 CB SER A 60 -12.375 -4.866 3.132 1.00 0.00 C ATOM 918 OG SER A 60 -12.230 -3.598 2.514 1.00 0.00 O ATOM 0 H SER A 60 -13.010 -5.133 0.786 1.00 0.00 H new ATOM 0 HA SER A 60 -10.700 -5.864 2.209 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.431 -5.067 3.313 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.881 -4.859 4.103 1.00 0.00 H new ATOM 0 HG SER A 60 -11.383 -3.568 2.023 1.00 0.00 H new ATOM 924 N ALA A 61 -13.083 -8.032 2.342 1.00 0.00 N ATOM 925 CA ALA A 61 -13.499 -9.327 2.866 1.00 0.00 C ATOM 926 C ALA A 61 -12.486 -10.424 2.537 1.00 0.00 C ATOM 927 O ALA A 61 -12.487 -11.487 3.160 1.00 0.00 O ATOM 928 CB ALA A 61 -14.871 -9.693 2.323 1.00 0.00 C ATOM 0 H ALA A 61 -13.622 -7.712 1.537 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.552 -9.246 3.952 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -15.173 -10.662 2.720 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.595 -8.936 2.624 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.830 -9.744 1.235 1.00 0.00 H new ATOM 934 N LYS A 62 -11.614 -10.160 1.570 1.00 0.00 N ATOM 935 CA LYS A 62 -10.621 -11.145 1.147 1.00 0.00 C ATOM 936 C LYS A 62 -9.485 -11.245 2.162 1.00 0.00 C ATOM 937 O LYS A 62 -8.936 -12.318 2.401 1.00 0.00 O ATOM 938 CB LYS A 62 -10.033 -10.773 -0.218 1.00 0.00 C ATOM 939 CG LYS A 62 -11.056 -10.642 -1.336 1.00 0.00 C ATOM 940 CD LYS A 62 -10.375 -10.340 -2.664 1.00 0.00 C ATOM 941 CE LYS A 62 -11.378 -10.187 -3.795 1.00 0.00 C ATOM 942 NZ LYS A 62 -10.709 -10.068 -5.119 1.00 0.00 N ATOM 0 H LYS A 62 -11.573 -9.275 1.064 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.128 -12.107 1.075 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.497 -9.829 -0.122 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.300 -11.529 -0.501 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.630 -11.565 -1.419 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.763 -9.847 -1.096 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.790 -9.425 -2.572 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.677 -11.142 -2.904 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.049 -11.046 -3.803 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -11.992 -9.304 -3.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -10.894 -9.126 -5.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -9.684 -10.200 -5.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.081 -10.795 -5.763 1.00 0.00 H new ATOM 956 N TYR A 63 -9.156 -10.114 2.769 1.00 0.00 N ATOM 957 CA TYR A 63 -7.972 -10.006 3.615 1.00 0.00 C ATOM 958 C TYR A 63 -8.167 -10.660 4.976 1.00 0.00 C ATOM 959 O TYR A 63 -7.199 -11.032 5.635 1.00 0.00 O ATOM 960 CB TYR A 63 -7.600 -8.538 3.796 1.00 0.00 C ATOM 961 CG TYR A 63 -7.172 -7.870 2.515 1.00 0.00 C ATOM 962 CD1 TYR A 63 -8.102 -7.297 1.662 1.00 0.00 C ATOM 963 CD2 TYR A 63 -5.833 -7.818 2.160 1.00 0.00 C ATOM 964 CE1 TYR A 63 -7.709 -6.687 0.491 1.00 0.00 C ATOM 965 CE2 TYR A 63 -5.429 -7.210 0.990 1.00 0.00 C ATOM 966 CZ TYR A 63 -6.374 -6.644 0.157 1.00 0.00 C ATOM 967 OH TYR A 63 -5.985 -6.031 -1.008 1.00 0.00 O ATOM 0 H TYR A 63 -9.695 -9.252 2.692 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.165 -10.539 3.113 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.454 -8.002 4.209 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.793 -8.462 4.525 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.150 -7.329 1.919 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.094 -8.261 2.811 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.446 -6.244 -0.163 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.382 -7.177 0.727 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.011 -6.086 -1.097 1.00 0.00 H new ATOM 977 N LYS A 64 -9.416 -10.839 5.378 1.00 0.00 N ATOM 978 CA LYS A 64 -9.723 -11.358 6.711 1.00 0.00 C ATOM 979 C LYS A 64 -9.543 -12.874 6.784 1.00 0.00 C ATOM 980 O LYS A 64 -10.103 -13.540 7.657 1.00 0.00 O ATOM 981 CB LYS A 64 -11.142 -10.960 7.121 1.00 0.00 C ATOM 982 CG LYS A 64 -11.278 -9.475 7.422 1.00 0.00 C ATOM 983 CD LYS A 64 -10.362 -9.060 8.565 1.00 0.00 C ATOM 984 CE LYS A 64 -10.366 -7.556 8.773 1.00 0.00 C ATOM 985 NZ LYS A 64 -9.426 -7.144 9.849 1.00 0.00 N ATOM 0 H LYS A 64 -10.235 -10.634 4.805 1.00 0.00 H new ATOM 0 HA LYS A 64 -9.016 -10.914 7.412 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.834 -11.228 6.323 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.434 -11.532 8.002 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.036 -8.897 6.530 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.312 -9.246 7.680 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -10.679 -9.555 9.483 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -9.346 -9.395 8.357 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -10.092 -7.060 7.842 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -11.374 -7.227 9.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.458 -6.110 9.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -9.702 -7.597 10.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -8.460 -7.435 9.597 1.00 0.00 H new ATOM 999 N ASN A 65 -8.749 -13.409 5.875 1.00 0.00 N ATOM 1000 CA ASN A 65 -8.396 -14.819 5.891 1.00 0.00 C ATOM 1001 C ASN A 65 -6.898 -14.967 5.640 1.00 0.00 C ATOM 1002 O ASN A 65 -6.373 -16.075 5.520 1.00 0.00 O ATOM 1003 CB ASN A 65 -9.191 -15.575 4.818 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.033 -17.084 4.911 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -8.972 -17.775 3.896 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -9.002 -17.611 6.127 1.00 0.00 N ATOM 0 H ASN A 65 -8.332 -12.882 5.108 1.00 0.00 H new ATOM 0 HA ASN A 65 -8.642 -15.242 6.865 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.247 -15.320 4.910 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.867 -15.242 3.832 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -8.925 -18.621 6.243 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -9.055 -17.006 6.947 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.205 -13.836 5.585 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.804 -13.818 5.196 1.00 0.00 C ATOM 1015 C ILE A 66 -3.948 -13.114 6.248 1.00 0.00 C ATOM 1016 O ILE A 66 -3.825 -11.888 6.235 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.633 -13.118 3.828 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.484 -13.824 2.769 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.168 -13.096 3.410 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -5.574 -13.077 1.458 1.00 0.00 C ATOM 0 H ILE A 66 -6.593 -12.919 5.806 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.468 -14.852 5.114 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.972 -12.086 3.921 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.068 -14.814 2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.490 -13.969 3.163 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.072 -12.599 2.445 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.585 -12.556 4.156 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.797 -14.118 3.330 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -6.193 -13.640 0.760 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -6.019 -12.096 1.628 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.575 -12.955 1.040 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.389 -13.900 7.172 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.480 -13.391 8.205 1.00 0.00 C ATOM 1034 C ALA A 67 -3.045 -12.146 8.891 1.00 0.00 C ATOM 1035 O ALA A 67 -4.259 -12.018 9.074 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.118 -13.087 7.590 1.00 0.00 C ATOM 0 H ALA A 67 -3.553 -14.905 7.226 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.369 -14.162 8.967 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.447 -12.709 8.361 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.701 -13.998 7.160 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.231 -12.336 6.808 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.157 -11.238 9.272 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.577 -9.962 9.814 1.00 0.00 C ATOM 1044 C GLY A 68 -2.674 -8.908 8.732 1.00 0.00 C ATOM 1045 O GLY A 68 -2.456 -7.722 8.983 1.00 0.00 O ATOM 0 H GLY A 68 -1.146 -11.364 9.215 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.545 -10.073 10.303 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.869 -9.638 10.577 1.00 0.00 H new ATOM 1049 N VAL A 69 -2.976 -9.352 7.517 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.152 -8.455 6.388 1.00 0.00 C ATOM 1051 C VAL A 69 -4.587 -7.947 6.376 1.00 0.00 C ATOM 1052 O VAL A 69 -5.520 -8.717 6.154 1.00 0.00 O ATOM 1053 CB VAL A 69 -2.849 -9.162 5.046 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.799 -8.173 3.898 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -1.549 -9.943 5.119 1.00 0.00 C ATOM 0 H VAL A 69 -3.104 -10.338 7.291 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.452 -7.626 6.498 1.00 0.00 H new ATOM 0 HB VAL A 69 -3.664 -9.861 4.860 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.584 -8.703 2.970 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.760 -7.666 3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.017 -7.437 4.085 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.362 -10.429 4.161 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -0.728 -9.263 5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -1.622 -10.699 5.901 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.766 -6.664 6.637 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.100 -6.095 6.739 1.00 0.00 C ATOM 1067 C GLU A 70 -6.259 -4.885 5.829 1.00 0.00 C ATOM 1068 O GLU A 70 -5.328 -4.098 5.649 1.00 0.00 O ATOM 1069 CB GLU A 70 -6.405 -5.709 8.191 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.385 -4.763 8.805 1.00 0.00 C ATOM 1071 CD GLU A 70 -5.763 -4.333 10.206 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -6.521 -3.349 10.344 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -5.310 -4.978 11.175 1.00 0.00 O ATOM 0 H GLU A 70 -4.008 -5.998 6.782 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.812 -6.854 6.415 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.390 -5.243 8.234 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.455 -6.615 8.795 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.410 -5.250 8.829 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.285 -3.881 8.172 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.444 -4.749 5.255 1.00 0.00 N ATOM 1081 CA GLU A 71 -7.759 -3.615 4.405 1.00 0.00 C ATOM 1082 C GLU A 71 -8.715 -2.684 5.142 1.00 0.00 C ATOM 1083 O GLU A 71 -9.887 -3.008 5.345 1.00 0.00 O ATOM 1084 CB GLU A 71 -8.374 -4.092 3.088 1.00 0.00 C ATOM 1085 CG GLU A 71 -8.583 -2.988 2.065 1.00 0.00 C ATOM 1086 CD GLU A 71 -9.159 -3.511 0.767 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -10.400 -3.611 0.670 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -8.373 -3.837 -0.147 1.00 0.00 O ATOM 0 H GLU A 71 -8.208 -5.416 5.365 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.844 -3.072 4.171 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -7.730 -4.857 2.655 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.334 -4.565 3.298 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.252 -2.234 2.479 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -7.631 -2.495 1.866 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.196 -1.552 5.571 1.00 0.00 N ATOM 1096 CA LYS A 72 -8.964 -0.601 6.353 1.00 0.00 C ATOM 1097 C LYS A 72 -9.461 0.538 5.475 1.00 0.00 C ATOM 1098 O LYS A 72 -8.687 1.392 5.040 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.110 -0.056 7.502 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.811 0.999 8.344 1.00 0.00 C ATOM 1101 CD LYS A 72 -10.051 0.448 9.025 1.00 0.00 C ATOM 1102 CE LYS A 72 -10.737 1.513 9.859 1.00 0.00 C ATOM 1103 NZ LYS A 72 -9.871 1.997 10.967 1.00 0.00 N ATOM 0 H LYS A 72 -7.234 -1.265 5.389 1.00 0.00 H new ATOM 0 HA LYS A 72 -9.831 -1.113 6.770 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.815 -0.884 8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.195 0.370 7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.121 1.379 9.098 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.089 1.842 7.712 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -10.744 0.068 8.274 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -9.777 -0.394 9.660 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -11.012 2.353 9.220 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -11.662 1.110 10.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -10.442 2.551 11.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.451 1.183 11.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.114 2.595 10.580 1.00 0.00 H new ATOM 1117 N LEU A 73 -10.753 0.536 5.208 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.363 1.584 4.411 1.00 0.00 C ATOM 1119 C LEU A 73 -11.708 2.783 5.284 1.00 0.00 C ATOM 1120 O LEU A 73 -12.401 2.651 6.292 1.00 0.00 O ATOM 1121 CB LEU A 73 -12.621 1.056 3.720 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.395 -0.124 2.774 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.705 -0.560 2.146 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.390 0.242 1.695 1.00 0.00 C ATOM 0 H LEU A 73 -11.402 -0.181 5.532 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.650 1.902 3.650 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.338 0.757 4.484 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.077 1.871 3.157 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.994 -0.955 3.354 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.525 -1.401 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.401 -0.862 2.929 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.132 0.269 1.582 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.242 -0.610 1.031 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.765 1.089 1.120 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.440 0.510 2.158 1.00 0.00 H new ATOM 1136 N THR A 74 -11.206 3.946 4.904 1.00 0.00 N ATOM 1137 CA THR A 74 -11.489 5.173 5.629 1.00 0.00 C ATOM 1138 C THR A 74 -12.190 6.179 4.721 1.00 0.00 C ATOM 1139 O THR A 74 -11.666 6.560 3.674 1.00 0.00 O ATOM 1140 CB THR A 74 -10.203 5.788 6.214 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.130 5.668 5.273 1.00 0.00 O ATOM 1142 CG2 THR A 74 -9.819 5.105 7.519 1.00 0.00 C ATOM 0 H THR A 74 -10.598 4.066 4.094 1.00 0.00 H new ATOM 0 HA THR A 74 -12.151 4.924 6.459 1.00 0.00 H new ATOM 0 HB THR A 74 -10.392 6.842 6.417 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.360 6.185 5.588 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.908 5.557 7.912 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.625 5.224 8.243 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.648 4.044 7.338 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.384 6.589 5.120 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.210 7.469 4.306 1.00 0.00 C ATOM 1152 C TYR A 75 -14.383 8.824 4.980 1.00 0.00 C ATOM 1153 O TYR A 75 -14.749 8.901 6.155 1.00 0.00 O ATOM 1154 CB TYR A 75 -15.587 6.835 4.070 1.00 0.00 C ATOM 1155 CG TYR A 75 -15.557 5.569 3.238 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.105 4.366 3.772 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -15.986 5.577 1.918 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.081 3.215 3.014 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -15.966 4.426 1.154 1.00 0.00 C ATOM 1160 CZ TYR A 75 -15.511 3.249 1.707 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.485 2.101 0.952 1.00 0.00 O ATOM 0 H TYR A 75 -13.806 6.324 6.010 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.709 7.614 3.349 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.041 6.611 5.035 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.230 7.564 3.577 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -14.767 4.334 4.797 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.341 6.498 1.481 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -14.726 2.290 3.444 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.305 4.449 0.129 1.00 0.00 H new ATOM 0 HH TYR A 75 -15.746 2.309 0.031 1.00 0.00 H new ATOM 1171 N THR A 76 -14.113 9.888 4.238 1.00 0.00 N ATOM 1172 CA THR A 76 -14.320 11.233 4.743 1.00 0.00 C ATOM 1173 C THR A 76 -15.511 11.885 4.055 1.00 0.00 C ATOM 1174 O THR A 76 -16.615 11.914 4.599 1.00 0.00 O ATOM 1175 CB THR A 76 -13.063 12.106 4.557 1.00 0.00 C ATOM 1176 OG1 THR A 76 -11.927 11.450 5.133 1.00 0.00 O ATOM 1177 CG2 THR A 76 -13.242 13.470 5.209 1.00 0.00 C ATOM 0 H THR A 76 -13.751 9.844 3.286 1.00 0.00 H new ATOM 0 HA THR A 76 -14.524 11.154 5.811 1.00 0.00 H new ATOM 0 HB THR A 76 -12.906 12.250 3.488 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.109 11.774 4.702 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.340 14.065 5.062 1.00 0.00 H new ATOM 0 HG22 THR A 76 -14.091 13.981 4.756 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.423 13.342 6.276 1.00 0.00 H new ATOM 1185 N ASP A 77 -15.286 12.377 2.850 1.00 0.00 N ATOM 1186 CA ASP A 77 -16.341 13.028 2.081 1.00 0.00 C ATOM 1187 C ASP A 77 -16.169 12.810 0.587 1.00 0.00 C ATOM 1188 O ASP A 77 -16.972 12.129 -0.040 1.00 0.00 O ATOM 1189 CB ASP A 77 -16.397 14.528 2.379 1.00 0.00 C ATOM 1190 CG ASP A 77 -17.400 14.864 3.460 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -18.613 14.659 3.228 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -16.990 15.329 4.541 1.00 0.00 O ATOM 0 H ASP A 77 -14.382 12.340 2.379 1.00 0.00 H new ATOM 0 HA ASP A 77 -17.281 12.569 2.388 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -15.409 14.872 2.684 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.655 15.067 1.468 1.00 0.00 H new ATOM 1197 N THR A 78 -15.123 13.394 0.021 1.00 0.00 N ATOM 1198 CA THR A 78 -14.913 13.348 -1.420 1.00 0.00 C ATOM 1199 C THR A 78 -13.875 12.287 -1.789 1.00 0.00 C ATOM 1200 O THR A 78 -13.558 12.081 -2.965 1.00 0.00 O ATOM 1201 CB THR A 78 -14.456 14.727 -1.942 1.00 0.00 C ATOM 1202 OG1 THR A 78 -15.193 15.767 -1.275 1.00 0.00 O ATOM 1203 CG2 THR A 78 -14.673 14.848 -3.445 1.00 0.00 C ATOM 0 H THR A 78 -14.406 13.905 0.536 1.00 0.00 H new ATOM 0 HA THR A 78 -15.861 13.084 -1.888 1.00 0.00 H new ATOM 0 HB THR A 78 -13.391 14.829 -1.735 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.899 16.641 -1.607 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.342 15.830 -3.783 1.00 0.00 H new ATOM 0 HG22 THR A 78 -14.101 14.075 -3.959 1.00 0.00 H new ATOM 0 HG23 THR A 78 -15.732 14.725 -3.671 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.360 11.597 -0.783 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.327 10.601 -1.006 1.00 0.00 C ATOM 1213 C TYR A 79 -12.411 9.490 0.032 1.00 0.00 C ATOM 1214 O TYR A 79 -12.960 9.680 1.123 1.00 0.00 O ATOM 1215 CB TYR A 79 -10.939 11.253 -0.960 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.506 11.696 0.422 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -11.097 12.789 1.042 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -9.511 11.011 1.110 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -10.711 13.186 2.307 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.119 11.404 2.374 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.723 12.490 2.968 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.342 12.880 4.229 1.00 0.00 O ATOM 0 H TYR A 79 -13.640 11.709 0.191 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.485 10.166 -1.993 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.205 10.547 -1.349 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -10.934 12.117 -1.624 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -11.871 13.338 0.526 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -9.037 10.158 0.648 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -11.181 14.038 2.776 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -8.343 10.863 2.894 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.635 12.285 4.556 1.00 0.00 H new ATOM 1232 N ALA A 80 -11.870 8.337 -0.322 1.00 0.00 N ATOM 1233 CA ALA A 80 -11.777 7.209 0.585 1.00 0.00 C ATOM 1234 C ALA A 80 -10.378 6.615 0.519 1.00 0.00 C ATOM 1235 O ALA A 80 -9.849 6.374 -0.567 1.00 0.00 O ATOM 1236 CB ALA A 80 -12.821 6.159 0.235 1.00 0.00 C ATOM 0 H ALA A 80 -11.483 8.158 -1.248 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.969 7.552 1.602 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.738 5.319 0.925 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.817 6.596 0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.657 5.809 -0.784 1.00 0.00 H new ATOM 1242 N GLN A 81 -9.766 6.399 1.669 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.426 5.847 1.706 1.00 0.00 C ATOM 1244 C GLN A 81 -8.461 4.355 1.991 1.00 0.00 C ATOM 1245 O GLN A 81 -8.964 3.910 3.028 1.00 0.00 O ATOM 1246 CB GLN A 81 -7.555 6.563 2.737 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.205 7.991 2.355 1.00 0.00 C ATOM 1248 CD GLN A 81 -6.203 8.623 3.304 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -6.205 9.835 3.506 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -5.335 7.807 3.887 1.00 0.00 N ATOM 0 H GLN A 81 -10.173 6.596 2.583 1.00 0.00 H new ATOM 0 HA GLN A 81 -7.983 6.003 0.723 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.074 6.570 3.696 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -6.634 5.997 2.877 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.799 8.003 1.344 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.114 8.592 2.340 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -5.366 6.806 3.693 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.636 8.180 4.529 1.00 0.00 H new ATOM 1259 N GLU A 82 -7.941 3.599 1.045 1.00 0.00 N ATOM 1260 CA GLU A 82 -7.807 2.160 1.166 1.00 0.00 C ATOM 1261 C GLU A 82 -6.498 1.834 1.886 1.00 0.00 C ATOM 1262 O GLU A 82 -5.450 1.692 1.263 1.00 0.00 O ATOM 1263 CB GLU A 82 -7.847 1.550 -0.240 1.00 0.00 C ATOM 1264 CG GLU A 82 -7.588 0.058 -0.312 1.00 0.00 C ATOM 1265 CD GLU A 82 -7.351 -0.395 -1.740 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -8.337 -0.611 -2.474 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -6.172 -0.508 -2.146 1.00 0.00 O ATOM 0 H GLU A 82 -7.595 3.970 0.160 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.623 1.738 1.752 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -8.825 1.753 -0.677 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.109 2.060 -0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.721 -0.192 0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.438 -0.481 0.106 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.559 1.779 3.209 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.374 1.546 4.030 1.00 0.00 C ATOM 1276 C ASN A 83 -5.092 0.054 4.137 1.00 0.00 C ATOM 1277 O ASN A 83 -5.671 -0.636 4.968 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.576 2.156 5.427 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.434 1.859 6.389 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.443 0.852 7.095 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.456 2.747 6.446 1.00 0.00 N ATOM 0 H ASN A 83 -7.421 1.893 3.742 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.516 2.026 3.558 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.688 3.236 5.331 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.506 1.775 5.850 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.677 2.608 7.090 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.480 3.571 5.846 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.215 -0.452 3.289 1.00 0.00 N ATOM 1289 CA VAL A 84 -3.954 -1.890 3.267 1.00 0.00 C ATOM 1290 C VAL A 84 -2.724 -2.238 4.096 1.00 0.00 C ATOM 1291 O VAL A 84 -1.594 -2.061 3.653 1.00 0.00 O ATOM 1292 CB VAL A 84 -3.775 -2.429 1.829 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -3.568 -3.937 1.839 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -4.972 -2.064 0.966 1.00 0.00 C ATOM 0 H VAL A 84 -3.678 0.095 2.616 1.00 0.00 H new ATOM 0 HA VAL A 84 -4.830 -2.369 3.704 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.887 -1.964 1.402 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.444 -4.294 0.817 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.676 -4.178 2.418 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.435 -4.420 2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -4.826 -2.453 -0.042 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -5.875 -2.498 1.395 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.074 -0.980 0.925 1.00 0.00 H new ATOM 1304 N THR A 85 -2.947 -2.737 5.298 1.00 0.00 N ATOM 1305 CA THR A 85 -1.854 -3.104 6.182 1.00 0.00 C ATOM 1306 C THR A 85 -1.473 -4.567 5.978 1.00 0.00 C ATOM 1307 O THR A 85 -2.202 -5.471 6.384 1.00 0.00 O ATOM 1308 CB THR A 85 -2.229 -2.872 7.655 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.774 -1.557 7.811 1.00 0.00 O ATOM 1310 CG2 THR A 85 -1.009 -3.026 8.554 1.00 0.00 C ATOM 0 H THR A 85 -3.877 -2.898 5.686 1.00 0.00 H new ATOM 0 HA THR A 85 -1.002 -2.470 5.936 1.00 0.00 H new ATOM 0 HB THR A 85 -2.971 -3.616 7.944 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.014 -1.412 8.750 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.298 -2.858 9.591 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.604 -4.033 8.449 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.251 -2.298 8.266 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.342 -4.792 5.328 1.00 0.00 N ATOM 1319 CA ILE A 86 0.117 -6.142 5.041 1.00 0.00 C ATOM 1320 C ILE A 86 1.173 -6.579 6.050 1.00 0.00 C ATOM 1321 O ILE A 86 2.187 -5.898 6.231 1.00 0.00 O ATOM 1322 CB ILE A 86 0.710 -6.243 3.619 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.262 -5.658 2.591 1.00 0.00 C ATOM 1324 CG2 ILE A 86 1.031 -7.694 3.283 1.00 0.00 C ATOM 1325 CD1 ILE A 86 0.288 -5.621 1.181 1.00 0.00 C ATOM 0 H ILE A 86 0.276 -4.055 4.988 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.750 -6.798 5.111 1.00 0.00 H new ATOM 0 HB ILE A 86 1.634 -5.666 3.586 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.180 -6.246 2.597 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -0.530 -4.645 2.893 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.448 -7.751 2.278 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.756 -8.082 3.999 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.119 -8.289 3.331 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.458 -5.194 0.511 1.00 0.00 H new ATOM 0 HD12 ILE A 86 1.189 -5.009 1.158 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.529 -6.634 0.858 1.00 0.00 H new ATOM 1337 N ASP A 87 0.927 -7.702 6.713 1.00 0.00 N ATOM 1338 CA ASP A 87 1.901 -8.265 7.641 1.00 0.00 C ATOM 1339 C ASP A 87 2.803 -9.246 6.911 1.00 0.00 C ATOM 1340 O ASP A 87 2.347 -10.298 6.461 1.00 0.00 O ATOM 1341 CB ASP A 87 1.213 -8.984 8.801 1.00 0.00 C ATOM 1342 CG ASP A 87 2.170 -9.240 9.943 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.876 -10.262 9.912 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.221 -8.408 10.875 1.00 0.00 O ATOM 0 H ASP A 87 0.065 -8.240 6.626 1.00 0.00 H new ATOM 0 HA ASP A 87 2.492 -7.443 8.044 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.375 -8.384 9.156 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.802 -9.931 8.451 1.00 0.00 H new ATOM 1349 N MET A 88 4.077 -8.906 6.806 1.00 0.00 N ATOM 1350 CA MET A 88 5.018 -9.709 6.034 1.00 0.00 C ATOM 1351 C MET A 88 5.681 -10.776 6.897 1.00 0.00 C ATOM 1352 O MET A 88 6.582 -11.486 6.444 1.00 0.00 O ATOM 1353 CB MET A 88 6.086 -8.822 5.400 1.00 0.00 C ATOM 1354 CG MET A 88 5.545 -7.823 4.389 1.00 0.00 C ATOM 1355 SD MET A 88 4.769 -8.616 2.968 1.00 0.00 S ATOM 1356 CE MET A 88 4.367 -7.186 1.971 1.00 0.00 C ATOM 0 H MET A 88 4.486 -8.081 7.244 1.00 0.00 H new ATOM 0 HA MET A 88 4.452 -10.208 5.247 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.606 -8.279 6.189 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.824 -9.456 4.909 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.818 -7.175 4.879 1.00 0.00 H new ATOM 0 HG3 MET A 88 6.359 -7.186 4.044 1.00 0.00 H new ATOM 0 HE1 MET A 88 4.095 -7.508 0.966 1.00 0.00 H new ATOM 0 HE2 MET A 88 3.529 -6.653 2.421 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.232 -6.524 1.918 1.00 0.00 H new ATOM 1366 N GLU A 89 5.227 -10.905 8.138 1.00 0.00 N ATOM 1367 CA GLU A 89 5.738 -11.947 9.012 1.00 0.00 C ATOM 1368 C GLU A 89 4.992 -13.243 8.754 1.00 0.00 C ATOM 1369 O GLU A 89 5.279 -14.276 9.358 1.00 0.00 O ATOM 1370 CB GLU A 89 5.644 -11.541 10.481 1.00 0.00 C ATOM 1371 CG GLU A 89 6.803 -10.668 10.930 1.00 0.00 C ATOM 1372 CD GLU A 89 8.136 -11.376 10.787 1.00 0.00 C ATOM 1373 OE1 GLU A 89 8.461 -12.223 11.649 1.00 0.00 O ATOM 1374 OE2 GLU A 89 8.863 -11.104 9.813 1.00 0.00 O ATOM 0 H GLU A 89 4.514 -10.307 8.556 1.00 0.00 H new ATOM 0 HA GLU A 89 6.794 -12.098 8.790 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.708 -11.006 10.645 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.611 -12.438 11.099 1.00 0.00 H new ATOM 0 HG2 GLU A 89 6.815 -9.750 10.342 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.656 -10.378 11.970 1.00 0.00 H new ATOM 1381 N LYS A 90 4.020 -13.170 7.854 1.00 0.00 N ATOM 1382 CA LYS A 90 3.376 -14.357 7.329 1.00 0.00 C ATOM 1383 C LYS A 90 2.888 -14.108 5.912 1.00 0.00 C ATOM 1384 O LYS A 90 3.354 -14.746 4.966 1.00 0.00 O ATOM 1385 CB LYS A 90 2.176 -14.798 8.170 1.00 0.00 C ATOM 1386 CG LYS A 90 1.706 -16.192 7.774 1.00 0.00 C ATOM 1387 CD LYS A 90 0.272 -16.484 8.182 1.00 0.00 C ATOM 1388 CE LYS A 90 -0.250 -17.708 7.438 1.00 0.00 C ATOM 1389 NZ LYS A 90 -1.622 -18.096 7.858 1.00 0.00 N ATOM 0 H LYS A 90 3.662 -12.294 7.473 1.00 0.00 H new ATOM 0 HA LYS A 90 4.127 -15.147 7.353 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.446 -14.789 9.226 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.360 -14.087 8.044 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.799 -16.305 6.694 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.364 -16.932 8.230 1.00 0.00 H new ATOM 0 HD2 LYS A 90 0.220 -16.654 9.257 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.358 -15.622 7.965 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.247 -17.505 6.367 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.427 -18.546 7.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.926 -18.933 7.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.624 -18.317 8.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.277 -17.309 7.674 1.00 0.00 H new ATOM 1403 N VAL A 91 1.968 -13.146 5.782 1.00 0.00 N ATOM 1404 CA VAL A 91 1.176 -12.966 4.564 1.00 0.00 C ATOM 1405 C VAL A 91 0.532 -14.296 4.179 1.00 0.00 C ATOM 1406 O VAL A 91 0.471 -15.233 4.976 1.00 0.00 O ATOM 1407 CB VAL A 91 2.007 -12.471 3.342 1.00 0.00 C ATOM 1408 CG1 VAL A 91 1.169 -11.565 2.450 1.00 0.00 C ATOM 1409 CG2 VAL A 91 3.288 -11.768 3.748 1.00 0.00 C ATOM 0 H VAL A 91 1.753 -12.473 6.517 1.00 0.00 H new ATOM 0 HA VAL A 91 0.436 -12.199 4.795 1.00 0.00 H new ATOM 0 HB VAL A 91 2.294 -13.361 2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.769 -11.231 1.604 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.302 -12.115 2.085 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.835 -10.699 3.022 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.825 -11.446 2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.048 -10.899 4.361 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.914 -12.453 4.320 1.00 0.00 H new ATOM 1419 N ASP A 92 0.008 -14.350 2.980 1.00 0.00 N ATOM 1420 CA ASP A 92 -0.236 -15.613 2.318 1.00 0.00 C ATOM 1421 C ASP A 92 0.025 -15.407 0.849 1.00 0.00 C ATOM 1422 O ASP A 92 -0.835 -14.926 0.117 1.00 0.00 O ATOM 1423 CB ASP A 92 -1.649 -16.145 2.544 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.786 -17.571 2.048 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -2.040 -17.768 0.843 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -1.619 -18.505 2.860 1.00 0.00 O ATOM 0 H ASP A 92 -0.260 -13.529 2.437 1.00 0.00 H new ATOM 0 HA ASP A 92 0.429 -16.367 2.739 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.891 -16.102 3.606 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.367 -15.508 2.028 1.00 0.00 H new ATOM 1431 N PHE A 93 1.236 -15.735 0.434 1.00 0.00 N ATOM 1432 CA PHE A 93 1.703 -15.408 -0.903 1.00 0.00 C ATOM 1433 C PHE A 93 0.978 -16.238 -1.960 1.00 0.00 C ATOM 1434 O PHE A 93 1.084 -15.969 -3.157 1.00 0.00 O ATOM 1435 CB PHE A 93 3.216 -15.619 -1.005 1.00 0.00 C ATOM 1436 CG PHE A 93 4.034 -14.757 -0.083 1.00 0.00 C ATOM 1437 CD1 PHE A 93 4.398 -13.474 -0.458 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.462 -15.237 1.144 1.00 0.00 C ATOM 1439 CE1 PHE A 93 5.170 -12.686 0.373 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.232 -14.453 1.981 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.587 -13.176 1.593 1.00 0.00 C ATOM 0 H PHE A 93 1.918 -16.231 1.008 1.00 0.00 H new ATOM 0 HA PHE A 93 1.480 -14.357 -1.090 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.438 -16.665 -0.795 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.528 -15.427 -2.032 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.074 -13.085 -1.412 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.190 -16.236 1.450 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.447 -11.688 0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.556 -14.838 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.191 -12.561 2.244 1.00 0.00 H new ATOM 1451 N LYS A 94 0.228 -17.236 -1.512 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.537 -18.082 -2.412 1.00 0.00 C ATOM 1453 C LYS A 94 -1.899 -17.453 -2.701 1.00 0.00 C ATOM 1454 O LYS A 94 -2.278 -17.275 -3.860 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.690 -19.483 -1.814 1.00 0.00 C ATOM 1456 CG LYS A 94 0.644 -20.193 -1.628 1.00 0.00 C ATOM 1457 CD LYS A 94 0.488 -21.565 -0.990 1.00 0.00 C ATOM 1458 CE LYS A 94 0.008 -21.470 0.451 1.00 0.00 C ATOM 1459 NZ LYS A 94 0.065 -22.787 1.138 1.00 0.00 N ATOM 0 H LYS A 94 0.134 -17.479 -0.526 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.002 -18.173 -3.357 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.195 -19.409 -0.851 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.328 -20.083 -2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.134 -20.299 -2.596 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.296 -19.579 -1.007 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -0.220 -22.157 -1.570 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.443 -22.090 -1.021 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.622 -20.750 0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.015 -21.094 0.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.270 -22.683 2.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.541 -23.467 0.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.045 -23.134 1.142 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.621 -17.087 -1.646 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.899 -16.396 -1.794 1.00 0.00 C ATOM 1475 C ALA A 95 -3.675 -14.940 -2.194 1.00 0.00 C ATOM 1476 O ALA A 95 -4.609 -14.234 -2.580 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.703 -16.478 -0.504 1.00 0.00 C ATOM 0 H ALA A 95 -2.343 -17.257 -0.679 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.467 -16.887 -2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.652 -15.958 -0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.893 -17.523 -0.259 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.141 -16.012 0.305 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.418 -14.514 -2.110 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.007 -13.167 -2.499 1.00 0.00 C ATOM 1485 C LEU A 96 -2.286 -12.925 -3.980 1.00 0.00 C ATOM 1486 O LEU A 96 -2.328 -11.787 -4.440 1.00 0.00 O ATOM 1487 CB LEU A 96 -0.511 -12.989 -2.221 1.00 0.00 C ATOM 1488 CG LEU A 96 0.007 -11.551 -2.241 1.00 0.00 C ATOM 1489 CD1 LEU A 96 -0.545 -10.770 -1.062 1.00 0.00 C ATOM 1490 CD2 LEU A 96 1.526 -11.539 -2.218 1.00 0.00 C ATOM 0 H LEU A 96 -1.652 -15.095 -1.769 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.579 -12.445 -1.916 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.289 -13.421 -1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.047 -13.566 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.333 -11.073 -3.160 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.166 -9.749 -1.092 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.634 -10.754 -1.114 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.233 -11.245 -0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.882 -10.509 -2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.880 -12.033 -1.313 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.907 -12.067 -3.092 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.485 -14.013 -4.719 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.755 -13.945 -6.148 1.00 0.00 C ATOM 1504 C GLN A 97 -4.063 -13.199 -6.431 1.00 0.00 C ATOM 1505 O GLN A 97 -4.259 -12.665 -7.524 1.00 0.00 O ATOM 1506 CB GLN A 97 -2.828 -15.362 -6.727 1.00 0.00 C ATOM 1507 CG GLN A 97 -2.900 -15.398 -8.244 1.00 0.00 C ATOM 1508 CD GLN A 97 -1.600 -14.975 -8.898 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -1.357 -13.787 -9.121 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -0.753 -15.942 -9.214 1.00 0.00 N ATOM 0 H GLN A 97 -2.463 -14.961 -4.344 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.943 -13.395 -6.623 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -1.953 -15.924 -6.400 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -3.703 -15.868 -6.318 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -3.154 -16.407 -8.568 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.703 -14.743 -8.582 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -0.990 -16.914 -9.013 1.00 0.00 H new ATOM 0 HE22 GLN A 97 0.137 -15.716 -9.658 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.952 -13.161 -5.445 1.00 0.00 N ATOM 1520 CA GLY A 98 -6.245 -12.533 -5.643 1.00 0.00 C ATOM 1521 C GLY A 98 -6.321 -11.131 -5.069 1.00 0.00 C ATOM 1522 O GLY A 98 -7.359 -10.473 -5.166 1.00 0.00 O ATOM 0 H GLY A 98 -4.801 -13.552 -4.515 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -6.464 -12.494 -6.710 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.016 -13.150 -5.182 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.231 -10.668 -4.470 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.210 -9.347 -3.847 1.00 0.00 C ATOM 1528 C ILE A 99 -3.959 -8.567 -4.240 1.00 0.00 C ATOM 1529 O ILE A 99 -3.616 -7.564 -3.615 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.278 -9.438 -2.304 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -4.146 -10.319 -1.766 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.634 -9.968 -1.856 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -4.074 -10.363 -0.255 1.00 0.00 C ATOM 0 H ILE A 99 -4.353 -11.183 -4.401 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.094 -8.823 -4.210 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.153 -8.435 -1.895 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -4.276 -11.333 -2.144 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.196 -9.953 -2.156 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.661 -10.024 -0.768 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.420 -9.298 -2.204 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.793 -10.962 -2.275 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -3.249 -11.006 0.051 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.912 -9.357 0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.009 -10.758 0.142 1.00 0.00 H new ATOM 1545 N SER A 100 -3.281 -9.015 -5.284 1.00 0.00 N ATOM 1546 CA SER A 100 -2.064 -8.356 -5.721 1.00 0.00 C ATOM 1547 C SER A 100 -2.376 -7.130 -6.577 1.00 0.00 C ATOM 1548 O SER A 100 -2.514 -7.218 -7.799 1.00 0.00 O ATOM 1549 CB SER A 100 -1.160 -9.338 -6.470 1.00 0.00 C ATOM 1550 OG SER A 100 -1.907 -10.151 -7.362 1.00 0.00 O ATOM 0 H SER A 100 -3.551 -9.826 -5.840 1.00 0.00 H new ATOM 0 HA SER A 100 -1.530 -8.010 -4.836 1.00 0.00 H new ATOM 0 HB2 SER A 100 -0.402 -8.786 -7.026 1.00 0.00 H new ATOM 0 HB3 SER A 100 -0.633 -9.969 -5.754 1.00 0.00 H new ATOM 0 HG SER A 100 -2.454 -9.582 -7.943 1.00 0.00 H new ATOM 1556 N GLY A 101 -2.508 -5.983 -5.919 1.00 0.00 N ATOM 1557 CA GLY A 101 -2.758 -4.739 -6.622 1.00 0.00 C ATOM 1558 C GLY A 101 -1.475 -4.066 -7.067 1.00 0.00 C ATOM 1559 O GLY A 101 -1.471 -2.893 -7.438 1.00 0.00 O ATOM 0 H GLY A 101 -2.446 -5.893 -4.905 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -3.384 -4.935 -7.492 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -3.315 -4.063 -5.974 1.00 0.00 H new ATOM 1563 N ILE A 102 -0.380 -4.811 -7.024 1.00 0.00 N ATOM 1564 CA ILE A 102 0.913 -4.296 -7.443 1.00 0.00 C ATOM 1565 C ILE A 102 0.979 -4.248 -8.964 1.00 0.00 C ATOM 1566 O ILE A 102 1.204 -5.269 -9.615 1.00 0.00 O ATOM 1567 CB ILE A 102 2.070 -5.171 -6.913 1.00 0.00 C ATOM 1568 CG1 ILE A 102 1.889 -5.446 -5.417 1.00 0.00 C ATOM 1569 CG2 ILE A 102 3.410 -4.492 -7.174 1.00 0.00 C ATOM 1570 CD1 ILE A 102 2.968 -6.326 -4.819 1.00 0.00 C ATOM 0 H ILE A 102 -0.363 -5.778 -6.701 1.00 0.00 H new ATOM 0 HA ILE A 102 1.022 -3.294 -7.029 1.00 0.00 H new ATOM 0 HB ILE A 102 2.057 -6.124 -7.442 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.871 -4.496 -4.883 1.00 0.00 H new ATOM 0 HG13 ILE A 102 0.920 -5.919 -5.259 1.00 0.00 H new ATOM 0 HG21 ILE A 102 4.216 -5.120 -6.795 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.540 -4.343 -8.246 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.434 -3.527 -6.668 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.770 -6.474 -3.758 1.00 0.00 H new ATOM 0 HD12 ILE A 102 2.973 -7.291 -5.326 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.939 -5.846 -4.943 1.00 0.00 H new ATOM 1582 N ASN A 103 0.776 -3.064 -9.528 1.00 0.00 N ATOM 1583 CA ASN A 103 0.727 -2.911 -10.979 1.00 0.00 C ATOM 1584 C ASN A 103 2.133 -2.796 -11.564 1.00 0.00 C ATOM 1585 O ASN A 103 2.462 -1.842 -12.269 1.00 0.00 O ATOM 1586 CB ASN A 103 -0.113 -1.690 -11.363 1.00 0.00 C ATOM 1587 CG ASN A 103 -0.501 -1.699 -12.830 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -0.664 -2.761 -13.437 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -0.648 -0.521 -13.413 1.00 0.00 N ATOM 0 H ASN A 103 0.643 -2.198 -9.006 1.00 0.00 H new ATOM 0 HA ASN A 103 0.257 -3.801 -11.396 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -1.014 -1.664 -10.751 1.00 0.00 H new ATOM 0 HB3 ASN A 103 0.448 -0.782 -11.143 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -0.905 -0.468 -14.399 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -0.504 0.335 -12.877 1.00 0.00 H new ATOM 1596 N VAL A 104 2.964 -3.773 -11.243 1.00 0.00 N ATOM 1597 CA VAL A 104 4.306 -3.872 -11.793 1.00 0.00 C ATOM 1598 C VAL A 104 4.502 -5.281 -12.323 1.00 0.00 C ATOM 1599 O VAL A 104 4.508 -5.518 -13.531 1.00 0.00 O ATOM 1600 CB VAL A 104 5.390 -3.559 -10.733 1.00 0.00 C ATOM 1601 CG1 VAL A 104 6.783 -3.616 -11.346 1.00 0.00 C ATOM 1602 CG2 VAL A 104 5.150 -2.200 -10.091 1.00 0.00 C ATOM 0 H VAL A 104 2.727 -4.522 -10.592 1.00 0.00 H new ATOM 0 HA VAL A 104 4.411 -3.137 -12.591 1.00 0.00 H new ATOM 0 HB VAL A 104 5.324 -4.321 -9.957 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.527 -3.392 -10.581 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.963 -4.613 -11.747 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.857 -2.883 -12.149 1.00 0.00 H new ATOM 0 HG21 VAL A 104 5.926 -2.005 -9.350 1.00 0.00 H new ATOM 0 HG22 VAL A 104 5.178 -1.426 -10.858 1.00 0.00 H new ATOM 0 HG23 VAL A 104 4.175 -2.195 -9.605 1.00 0.00 H new ATOM 1612 N SER A 105 4.636 -6.209 -11.396 1.00 0.00 N ATOM 1613 CA SER A 105 4.664 -7.625 -11.706 1.00 0.00 C ATOM 1614 C SER A 105 4.250 -8.422 -10.473 1.00 0.00 C ATOM 1615 O SER A 105 4.875 -8.326 -9.418 1.00 0.00 O ATOM 1616 CB SER A 105 6.053 -8.045 -12.194 1.00 0.00 C ATOM 1617 OG SER A 105 7.071 -7.512 -11.368 1.00 0.00 O ATOM 0 H SER A 105 4.729 -6.001 -10.402 1.00 0.00 H new ATOM 0 HA SER A 105 3.958 -7.831 -12.511 1.00 0.00 H new ATOM 0 HB2 SER A 105 6.123 -9.133 -12.205 1.00 0.00 H new ATOM 0 HB3 SER A 105 6.199 -7.705 -13.219 1.00 0.00 H new ATOM 0 HG SER A 105 6.822 -7.626 -10.427 1.00 0.00 H new ATOM 1623 N ALA A 106 3.182 -9.195 -10.602 1.00 0.00 N ATOM 1624 CA ALA A 106 2.654 -9.959 -9.479 1.00 0.00 C ATOM 1625 C ALA A 106 3.563 -11.131 -9.123 1.00 0.00 C ATOM 1626 O ALA A 106 3.305 -11.848 -8.156 1.00 0.00 O ATOM 1627 CB ALA A 106 1.247 -10.449 -9.785 1.00 0.00 C ATOM 0 H ALA A 106 2.663 -9.311 -11.473 1.00 0.00 H new ATOM 0 HA ALA A 106 2.615 -9.296 -8.615 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.867 -11.018 -8.936 1.00 0.00 H new ATOM 0 HB2 ALA A 106 0.596 -9.594 -9.970 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.268 -11.087 -10.669 1.00 0.00 H new ATOM 1633 N GLU A 107 4.619 -11.322 -9.907 1.00 0.00 N ATOM 1634 CA GLU A 107 5.573 -12.395 -9.659 1.00 0.00 C ATOM 1635 C GLU A 107 6.496 -12.048 -8.502 1.00 0.00 C ATOM 1636 O GLU A 107 6.921 -12.930 -7.760 1.00 0.00 O ATOM 1637 CB GLU A 107 6.415 -12.681 -10.899 1.00 0.00 C ATOM 1638 CG GLU A 107 5.612 -13.132 -12.102 1.00 0.00 C ATOM 1639 CD GLU A 107 6.487 -13.774 -13.155 1.00 0.00 C ATOM 1640 OE1 GLU A 107 7.310 -13.064 -13.763 1.00 0.00 O ATOM 1641 OE2 GLU A 107 6.355 -14.998 -13.372 1.00 0.00 O ATOM 0 H GLU A 107 4.835 -10.746 -10.721 1.00 0.00 H new ATOM 0 HA GLU A 107 4.996 -13.284 -9.405 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.971 -11.781 -11.163 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.149 -13.449 -10.657 1.00 0.00 H new ATOM 0 HG2 GLU A 107 4.848 -13.841 -11.783 1.00 0.00 H new ATOM 0 HG3 GLU A 107 5.093 -12.276 -12.534 1.00 0.00 H new ATOM 1648 N ASP A 108 6.792 -10.764 -8.344 1.00 0.00 N ATOM 1649 CA ASP A 108 7.691 -10.308 -7.288 1.00 0.00 C ATOM 1650 C ASP A 108 7.103 -10.673 -5.932 1.00 0.00 C ATOM 1651 O ASP A 108 7.795 -11.166 -5.037 1.00 0.00 O ATOM 1652 CB ASP A 108 7.893 -8.795 -7.387 1.00 0.00 C ATOM 1653 CG ASP A 108 9.034 -8.303 -6.523 1.00 0.00 C ATOM 1654 OD1 ASP A 108 8.799 -7.998 -5.335 1.00 0.00 O ATOM 1655 OD2 ASP A 108 10.168 -8.219 -7.038 1.00 0.00 O ATOM 0 H ASP A 108 6.423 -10.018 -8.934 1.00 0.00 H new ATOM 0 HA ASP A 108 8.660 -10.795 -7.402 1.00 0.00 H new ATOM 0 HB2 ASP A 108 8.086 -8.525 -8.425 1.00 0.00 H new ATOM 0 HB3 ASP A 108 6.974 -8.289 -7.091 1.00 0.00 H new ATOM 1660 N ALA A 109 5.794 -10.485 -5.826 1.00 0.00 N ATOM 1661 CA ALA A 109 5.057 -10.801 -4.613 1.00 0.00 C ATOM 1662 C ALA A 109 4.976 -12.307 -4.384 1.00 0.00 C ATOM 1663 O ALA A 109 4.534 -12.755 -3.329 1.00 0.00 O ATOM 1664 CB ALA A 109 3.662 -10.198 -4.685 1.00 0.00 C ATOM 0 H ALA A 109 5.216 -10.110 -6.578 1.00 0.00 H new ATOM 0 HA ALA A 109 5.592 -10.369 -3.767 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.114 -10.438 -3.774 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.738 -9.116 -4.788 1.00 0.00 H new ATOM 0 HB3 ALA A 109 3.132 -10.608 -5.545 1.00 0.00 H new ATOM 1670 N LYS A 110 5.376 -13.089 -5.373 1.00 0.00 N ATOM 1671 CA LYS A 110 5.393 -14.538 -5.243 1.00 0.00 C ATOM 1672 C LYS A 110 6.785 -15.022 -4.858 1.00 0.00 C ATOM 1673 O LYS A 110 6.943 -15.997 -4.129 1.00 0.00 O ATOM 1674 CB LYS A 110 4.965 -15.217 -6.545 1.00 0.00 C ATOM 1675 CG LYS A 110 3.620 -14.760 -7.089 1.00 0.00 C ATOM 1676 CD LYS A 110 2.499 -14.956 -6.084 1.00 0.00 C ATOM 1677 CE LYS A 110 1.137 -14.758 -6.729 1.00 0.00 C ATOM 1678 NZ LYS A 110 1.024 -13.444 -7.425 1.00 0.00 N ATOM 0 H LYS A 110 5.695 -12.744 -6.278 1.00 0.00 H new ATOM 0 HA LYS A 110 4.684 -14.805 -4.459 1.00 0.00 H new ATOM 0 HB2 LYS A 110 5.728 -15.035 -7.302 1.00 0.00 H new ATOM 0 HB3 LYS A 110 4.928 -16.294 -6.382 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.680 -13.707 -7.363 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.391 -15.314 -7.999 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.560 -15.958 -5.659 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.619 -14.252 -5.260 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.956 -15.561 -7.443 1.00 0.00 H new ATOM 0 HE3 LYS A 110 0.362 -14.830 -5.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.126 -13.404 -7.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 1.051 -12.676 -6.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.816 -13.334 -8.090 1.00 0.00 H new ATOM 1692 N LYS A 111 7.797 -14.321 -5.361 1.00 0.00 N ATOM 1693 CA LYS A 111 9.181 -14.741 -5.187 1.00 0.00 C ATOM 1694 C LYS A 111 9.727 -14.336 -3.822 1.00 0.00 C ATOM 1695 O LYS A 111 10.583 -15.024 -3.262 1.00 0.00 O ATOM 1696 CB LYS A 111 10.044 -14.162 -6.312 1.00 0.00 C ATOM 1697 CG LYS A 111 9.634 -14.659 -7.691 1.00 0.00 C ATOM 1698 CD LYS A 111 10.452 -14.019 -8.800 1.00 0.00 C ATOM 1699 CE LYS A 111 10.022 -14.535 -10.166 1.00 0.00 C ATOM 1700 NZ LYS A 111 10.826 -13.948 -11.270 1.00 0.00 N ATOM 0 H LYS A 111 7.683 -13.458 -5.893 1.00 0.00 H new ATOM 0 HA LYS A 111 9.214 -15.829 -5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.979 -13.074 -6.290 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.087 -14.422 -6.133 1.00 0.00 H new ATOM 0 HG2 LYS A 111 9.751 -15.742 -7.734 1.00 0.00 H new ATOM 0 HG3 LYS A 111 8.577 -14.446 -7.852 1.00 0.00 H new ATOM 0 HD2 LYS A 111 10.335 -12.936 -8.764 1.00 0.00 H new ATOM 0 HD3 LYS A 111 11.510 -14.231 -8.644 1.00 0.00 H new ATOM 0 HE2 LYS A 111 10.117 -15.621 -10.188 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.969 -14.304 -10.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.497 -14.329 -12.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.716 -12.914 -11.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.829 -14.190 -11.136 1.00 0.00 H new ATOM 1714 N GLY A 112 9.237 -13.228 -3.283 1.00 0.00 N ATOM 1715 CA GLY A 112 9.666 -12.809 -1.965 1.00 0.00 C ATOM 1716 C GLY A 112 9.817 -11.308 -1.849 1.00 0.00 C ATOM 1717 O GLY A 112 10.757 -10.727 -2.393 1.00 0.00 O ATOM 0 H GLY A 112 8.555 -12.616 -3.731 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.944 -13.156 -1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.618 -13.285 -1.729 1.00 0.00 H new ATOM 1721 N ILE A 113 8.899 -10.684 -1.129 1.00 0.00 N ATOM 1722 CA ILE A 113 8.924 -9.242 -0.944 1.00 0.00 C ATOM 1723 C ILE A 113 9.998 -8.838 0.064 1.00 0.00 C ATOM 1724 O ILE A 113 9.909 -9.162 1.250 1.00 0.00 O ATOM 1725 CB ILE A 113 7.550 -8.710 -0.472 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.474 -8.988 -1.529 1.00 0.00 C ATOM 1727 CG2 ILE A 113 7.624 -7.221 -0.160 1.00 0.00 C ATOM 1728 CD1 ILE A 113 6.751 -8.341 -2.872 1.00 0.00 C ATOM 0 H ILE A 113 8.125 -11.155 -0.662 1.00 0.00 H new ATOM 0 HA ILE A 113 9.158 -8.799 -1.912 1.00 0.00 H new ATOM 0 HB ILE A 113 7.277 -9.235 0.444 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.384 -10.065 -1.667 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.513 -8.633 -1.157 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.646 -6.869 0.170 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.356 -7.051 0.629 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.922 -6.676 -1.056 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.946 -8.584 -3.566 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.811 -7.260 -2.749 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.696 -8.714 -3.268 1.00 0.00 H new ATOM 1740 N THR A 114 11.019 -8.151 -0.420 1.00 0.00 N ATOM 1741 CA THR A 114 12.063 -7.617 0.440 1.00 0.00 C ATOM 1742 C THR A 114 12.242 -6.135 0.150 1.00 0.00 C ATOM 1743 O THR A 114 11.561 -5.589 -0.723 1.00 0.00 O ATOM 1744 CB THR A 114 13.411 -8.339 0.230 1.00 0.00 C ATOM 1745 OG1 THR A 114 13.854 -8.168 -1.123 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.297 -9.822 0.548 1.00 0.00 C ATOM 0 H THR A 114 11.148 -7.949 -1.411 1.00 0.00 H new ATOM 0 HA THR A 114 11.755 -7.774 1.474 1.00 0.00 H new ATOM 0 HB THR A 114 14.139 -7.897 0.911 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.710 -8.628 -1.247 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.262 -10.303 0.391 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.993 -9.949 1.587 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.553 -10.278 -0.106 1.00 0.00 H new ATOM 1754 N MET A 115 13.146 -5.483 0.863 1.00 0.00 N ATOM 1755 CA MET A 115 13.401 -4.073 0.625 1.00 0.00 C ATOM 1756 C MET A 115 14.136 -3.893 -0.697 1.00 0.00 C ATOM 1757 O MET A 115 13.845 -2.969 -1.451 1.00 0.00 O ATOM 1758 CB MET A 115 14.209 -3.454 1.764 1.00 0.00 C ATOM 1759 CG MET A 115 14.234 -1.939 1.708 1.00 0.00 C ATOM 1760 SD MET A 115 12.577 -1.237 1.815 1.00 0.00 S ATOM 1761 CE MET A 115 12.915 0.476 1.435 1.00 0.00 C ATOM 0 H MET A 115 13.709 -5.902 1.603 1.00 0.00 H new ATOM 0 HA MET A 115 12.441 -3.559 0.577 1.00 0.00 H new ATOM 0 HB2 MET A 115 13.787 -3.771 2.718 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.231 -3.832 1.726 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.845 -1.555 2.525 1.00 0.00 H new ATOM 0 HG3 MET A 115 14.706 -1.617 0.779 1.00 0.00 H new ATOM 0 HE1 MET A 115 12.203 1.113 1.961 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.928 0.726 1.751 1.00 0.00 H new ATOM 0 HE3 MET A 115 12.820 0.636 0.361 1.00 0.00 H new ATOM 1771 N ALA A 116 15.074 -4.798 -0.977 1.00 0.00 N ATOM 1772 CA ALA A 116 15.827 -4.767 -2.228 1.00 0.00 C ATOM 1773 C ALA A 116 14.888 -4.762 -3.433 1.00 0.00 C ATOM 1774 O ALA A 116 15.069 -3.978 -4.366 1.00 0.00 O ATOM 1775 CB ALA A 116 16.780 -5.950 -2.302 1.00 0.00 C ATOM 0 H ALA A 116 15.330 -5.562 -0.352 1.00 0.00 H new ATOM 0 HA ALA A 116 16.410 -3.846 -2.250 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.334 -5.913 -3.240 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.478 -5.907 -1.466 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.212 -6.879 -2.253 1.00 0.00 H new ATOM 1781 N GLN A 117 13.888 -5.639 -3.399 1.00 0.00 N ATOM 1782 CA GLN A 117 12.856 -5.663 -4.431 1.00 0.00 C ATOM 1783 C GLN A 117 12.135 -4.329 -4.492 1.00 0.00 C ATOM 1784 O GLN A 117 12.291 -3.609 -5.461 1.00 0.00 O ATOM 1785 CB GLN A 117 11.869 -6.813 -4.200 1.00 0.00 C ATOM 1786 CG GLN A 117 12.301 -8.120 -4.856 1.00 0.00 C ATOM 1787 CD GLN A 117 13.473 -8.791 -4.167 1.00 0.00 C ATOM 1788 OE1 GLN A 117 14.632 -8.479 -4.434 1.00 0.00 O ATOM 1789 NE2 GLN A 117 13.182 -9.751 -3.301 1.00 0.00 N ATOM 0 H GLN A 117 13.771 -6.341 -2.669 1.00 0.00 H new ATOM 0 HA GLN A 117 13.340 -5.834 -5.392 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.753 -6.973 -3.128 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.891 -6.526 -4.587 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.455 -8.808 -4.866 1.00 0.00 H new ATOM 0 HG3 GLN A 117 12.566 -7.924 -5.895 1.00 0.00 H new ATOM 0 HE21 GLN A 117 12.208 -9.983 -3.104 1.00 0.00 H new ATOM 0 HE22 GLN A 117 13.932 -10.258 -2.831 1.00 0.00 H new ATOM 1798 N MET A 118 11.399 -3.985 -3.444 1.00 0.00 N ATOM 1799 CA MET A 118 10.614 -2.747 -3.414 1.00 0.00 C ATOM 1800 C MET A 118 11.409 -1.523 -3.884 1.00 0.00 C ATOM 1801 O MET A 118 10.877 -0.684 -4.608 1.00 0.00 O ATOM 1802 CB MET A 118 10.055 -2.512 -2.013 1.00 0.00 C ATOM 1803 CG MET A 118 8.923 -3.461 -1.659 1.00 0.00 C ATOM 1804 SD MET A 118 7.488 -3.242 -2.731 1.00 0.00 S ATOM 1805 CE MET A 118 6.418 -4.552 -2.150 1.00 0.00 C ATOM 0 H MET A 118 11.326 -4.546 -2.596 1.00 0.00 H new ATOM 0 HA MET A 118 9.793 -2.876 -4.119 1.00 0.00 H new ATOM 0 HB2 MET A 118 10.857 -2.624 -1.284 1.00 0.00 H new ATOM 0 HB3 MET A 118 9.698 -1.485 -1.938 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.277 -4.489 -1.734 1.00 0.00 H new ATOM 0 HG3 MET A 118 8.628 -3.300 -0.622 1.00 0.00 H new ATOM 0 HE1 MET A 118 5.389 -4.194 -2.118 1.00 0.00 H new ATOM 0 HE2 MET A 118 6.485 -5.404 -2.827 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.727 -4.858 -1.150 1.00 0.00 H new ATOM 1815 N GLU A 119 12.675 -1.427 -3.491 1.00 0.00 N ATOM 1816 CA GLU A 119 13.536 -0.328 -3.936 1.00 0.00 C ATOM 1817 C GLU A 119 13.625 -0.273 -5.463 1.00 0.00 C ATOM 1818 O GLU A 119 13.132 0.667 -6.087 1.00 0.00 O ATOM 1819 CB GLU A 119 14.940 -0.470 -3.342 1.00 0.00 C ATOM 1820 CG GLU A 119 15.033 -0.100 -1.870 1.00 0.00 C ATOM 1821 CD GLU A 119 14.993 1.397 -1.636 1.00 0.00 C ATOM 1822 OE1 GLU A 119 16.071 2.029 -1.650 1.00 0.00 O ATOM 1823 OE2 GLU A 119 13.898 1.951 -1.419 1.00 0.00 O ATOM 0 H GLU A 119 13.130 -2.093 -2.867 1.00 0.00 H new ATOM 0 HA GLU A 119 13.089 0.602 -3.583 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.274 -1.500 -3.468 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.627 0.159 -3.908 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.211 -0.569 -1.330 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.958 -0.503 -1.457 1.00 0.00 H new ATOM 1830 N LEU A 120 14.232 -1.293 -6.061 1.00 0.00 N ATOM 1831 CA LEU A 120 14.444 -1.327 -7.511 1.00 0.00 C ATOM 1832 C LEU A 120 13.117 -1.371 -8.262 1.00 0.00 C ATOM 1833 O LEU A 120 12.964 -0.769 -9.322 1.00 0.00 O ATOM 1834 CB LEU A 120 15.286 -2.550 -7.901 1.00 0.00 C ATOM 1835 CG LEU A 120 16.802 -2.418 -7.708 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.165 -2.273 -6.237 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.510 -3.621 -8.313 1.00 0.00 C ATOM 0 H LEU A 120 14.588 -2.111 -5.566 1.00 0.00 H new ATOM 0 HA LEU A 120 14.974 -0.415 -7.787 1.00 0.00 H new ATOM 0 HB2 LEU A 120 14.940 -3.404 -7.319 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.093 -2.779 -8.949 1.00 0.00 H new ATOM 0 HG LEU A 120 17.131 -1.514 -8.220 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.247 -2.182 -6.136 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.686 -1.382 -5.830 1.00 0.00 H new ATOM 0 HD13 LEU A 120 16.822 -3.151 -5.689 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.586 -3.519 -8.172 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.164 -4.531 -7.823 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.288 -3.676 -9.379 1.00 0.00 H new ATOM 1849 N VAL A 121 12.165 -2.063 -7.674 1.00 0.00 N ATOM 1850 CA VAL A 121 10.871 -2.318 -8.282 1.00 0.00 C ATOM 1851 C VAL A 121 10.021 -1.045 -8.349 1.00 0.00 C ATOM 1852 O VAL A 121 9.423 -0.742 -9.384 1.00 0.00 O ATOM 1853 CB VAL A 121 10.148 -3.440 -7.492 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.674 -3.514 -7.806 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.794 -4.788 -7.778 1.00 0.00 C ATOM 0 H VAL A 121 12.267 -2.472 -6.745 1.00 0.00 H new ATOM 0 HA VAL A 121 11.022 -2.647 -9.310 1.00 0.00 H new ATOM 0 HB VAL A 121 10.249 -3.193 -6.435 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.218 -4.316 -7.226 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.200 -2.566 -7.551 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.538 -3.713 -8.869 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.276 -5.566 -7.217 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.728 -5.004 -8.844 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.842 -4.760 -7.478 1.00 0.00 H new ATOM 1865 N MET A 122 9.998 -0.281 -7.264 1.00 0.00 N ATOM 1866 CA MET A 122 9.233 0.964 -7.229 1.00 0.00 C ATOM 1867 C MET A 122 9.942 2.070 -7.999 1.00 0.00 C ATOM 1868 O MET A 122 9.297 2.948 -8.576 1.00 0.00 O ATOM 1869 CB MET A 122 8.966 1.394 -5.787 1.00 0.00 C ATOM 1870 CG MET A 122 7.618 0.922 -5.263 1.00 0.00 C ATOM 1871 SD MET A 122 7.311 -0.826 -5.584 1.00 0.00 S ATOM 1872 CE MET A 122 5.649 -1.000 -4.945 1.00 0.00 C ATOM 0 H MET A 122 10.496 -0.498 -6.401 1.00 0.00 H new ATOM 0 HA MET A 122 8.275 0.781 -7.716 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.756 1.003 -5.145 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.013 2.481 -5.724 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.568 1.103 -4.189 1.00 0.00 H new ATOM 0 HG3 MET A 122 6.827 1.515 -5.723 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.316 -2.030 -5.072 1.00 0.00 H new ATOM 0 HE2 MET A 122 5.638 -0.743 -3.886 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.979 -0.333 -5.488 1.00 0.00 H new ATOM 1882 N LYS A 123 11.268 2.022 -8.027 1.00 0.00 N ATOM 1883 CA LYS A 123 12.040 2.970 -8.820 1.00 0.00 C ATOM 1884 C LYS A 123 11.929 2.630 -10.305 1.00 0.00 C ATOM 1885 O LYS A 123 12.179 3.471 -11.170 1.00 0.00 O ATOM 1886 CB LYS A 123 13.504 2.989 -8.369 1.00 0.00 C ATOM 1887 CG LYS A 123 13.688 3.527 -6.957 1.00 0.00 C ATOM 1888 CD LYS A 123 15.120 3.361 -6.469 1.00 0.00 C ATOM 1889 CE LYS A 123 15.256 3.755 -5.005 1.00 0.00 C ATOM 1890 NZ LYS A 123 15.065 5.216 -4.792 1.00 0.00 N ATOM 0 H LYS A 123 11.828 1.342 -7.513 1.00 0.00 H new ATOM 0 HA LYS A 123 11.630 3.968 -8.665 1.00 0.00 H new ATOM 0 HB2 LYS A 123 13.907 1.978 -8.421 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.083 3.599 -9.062 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.416 4.582 -6.932 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.011 3.007 -6.279 1.00 0.00 H new ATOM 0 HD2 LYS A 123 15.433 2.325 -6.599 1.00 0.00 H new ATOM 0 HD3 LYS A 123 15.786 3.974 -7.076 1.00 0.00 H new ATOM 0 HE2 LYS A 123 14.524 3.205 -4.414 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.242 3.463 -4.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.813 5.392 -3.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.947 5.718 -5.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.302 5.560 -5.409 1.00 0.00 H new ATOM 1904 N ALA A 124 11.542 1.391 -10.593 1.00 0.00 N ATOM 1905 CA ALA A 124 11.266 0.971 -11.960 1.00 0.00 C ATOM 1906 C ALA A 124 9.891 1.464 -12.391 1.00 0.00 C ATOM 1907 O ALA A 124 9.669 1.795 -13.553 1.00 0.00 O ATOM 1908 CB ALA A 124 11.352 -0.544 -12.085 1.00 0.00 C ATOM 0 H ALA A 124 11.413 0.659 -9.894 1.00 0.00 H new ATOM 0 HA ALA A 124 12.018 1.409 -12.616 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.142 -0.837 -13.114 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.353 -0.875 -11.810 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.622 -1.006 -11.421 1.00 0.00 H new ATOM 1914 N ALA A 125 8.968 1.516 -11.439 1.00 0.00 N ATOM 1915 CA ALA A 125 7.628 2.023 -11.702 1.00 0.00 C ATOM 1916 C ALA A 125 7.627 3.547 -11.757 1.00 0.00 C ATOM 1917 O ALA A 125 6.695 4.162 -12.275 1.00 0.00 O ATOM 1918 CB ALA A 125 6.658 1.530 -10.642 1.00 0.00 C ATOM 0 H ALA A 125 9.123 1.213 -10.477 1.00 0.00 H new ATOM 0 HA ALA A 125 7.305 1.647 -12.672 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.661 1.917 -10.853 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.633 0.440 -10.650 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.983 1.878 -9.661 1.00 0.00 H new ATOM 1924 N GLY A 126 8.675 4.148 -11.214 1.00 0.00 N ATOM 1925 CA GLY A 126 8.804 5.589 -11.248 1.00 0.00 C ATOM 1926 C GLY A 126 8.142 6.256 -10.061 1.00 0.00 C ATOM 1927 O GLY A 126 7.512 7.303 -10.200 1.00 0.00 O ATOM 0 H GLY A 126 9.441 3.661 -10.749 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.861 5.856 -11.269 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.361 5.969 -12.169 1.00 0.00 H new ATOM 1931 N PHE A 127 8.266 5.639 -8.896 1.00 0.00 N ATOM 1932 CA PHE A 127 7.699 6.195 -7.676 1.00 0.00 C ATOM 1933 C PHE A 127 8.792 6.862 -6.846 1.00 0.00 C ATOM 1934 O PHE A 127 9.974 6.565 -7.021 1.00 0.00 O ATOM 1935 CB PHE A 127 7.007 5.099 -6.861 1.00 0.00 C ATOM 1936 CG PHE A 127 5.892 4.402 -7.595 1.00 0.00 C ATOM 1937 CD1 PHE A 127 5.092 5.091 -8.495 1.00 0.00 C ATOM 1938 CD2 PHE A 127 5.635 3.059 -7.373 1.00 0.00 C ATOM 1939 CE1 PHE A 127 4.061 4.454 -9.159 1.00 0.00 C ATOM 1940 CE2 PHE A 127 4.605 2.416 -8.035 1.00 0.00 C ATOM 1941 CZ PHE A 127 3.817 3.115 -8.929 1.00 0.00 C ATOM 0 H PHE A 127 8.754 4.753 -8.769 1.00 0.00 H new ATOM 0 HA PHE A 127 6.956 6.945 -7.947 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.750 4.359 -6.562 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.608 5.538 -5.947 1.00 0.00 H new ATOM 0 HD1 PHE A 127 5.277 6.139 -8.679 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.247 2.507 -6.674 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.447 5.003 -9.857 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.417 1.368 -7.853 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.012 2.615 -9.447 1.00 0.00 H new ATOM 1951 N LYS A 128 8.402 7.761 -5.950 1.00 0.00 N ATOM 1952 CA LYS A 128 9.369 8.486 -5.134 1.00 0.00 C ATOM 1953 C LYS A 128 9.059 8.329 -3.653 1.00 0.00 C ATOM 1954 O LYS A 128 7.899 8.403 -3.239 1.00 0.00 O ATOM 1955 CB LYS A 128 9.386 9.972 -5.503 1.00 0.00 C ATOM 1956 CG LYS A 128 10.324 10.792 -4.631 1.00 0.00 C ATOM 1957 CD LYS A 128 10.323 12.263 -5.010 1.00 0.00 C ATOM 1958 CE LYS A 128 11.180 13.078 -4.051 1.00 0.00 C ATOM 1959 NZ LYS A 128 12.572 12.558 -3.971 1.00 0.00 N ATOM 0 H LYS A 128 7.428 8.005 -5.770 1.00 0.00 H new ATOM 0 HA LYS A 128 10.353 8.061 -5.333 1.00 0.00 H new ATOM 0 HB2 LYS A 128 9.684 10.078 -6.546 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.376 10.373 -5.417 1.00 0.00 H new ATOM 0 HG2 LYS A 128 10.030 10.688 -3.587 1.00 0.00 H new ATOM 0 HG3 LYS A 128 11.336 10.397 -4.718 1.00 0.00 H new ATOM 0 HD2 LYS A 128 10.698 12.380 -6.027 1.00 0.00 H new ATOM 0 HD3 LYS A 128 9.301 12.643 -5.002 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.199 14.118 -4.376 1.00 0.00 H new ATOM 0 HE3 LYS A 128 10.729 13.062 -3.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 13.172 13.248 -3.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 12.577 11.658 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 12.941 12.405 -4.931 1.00 0.00 H new ATOM 1973 N GLU A 129 10.104 8.102 -2.867 1.00 0.00 N ATOM 1974 CA GLU A 129 9.979 7.989 -1.424 1.00 0.00 C ATOM 1975 C GLU A 129 9.639 9.346 -0.806 1.00 0.00 C ATOM 1976 O GLU A 129 10.177 10.379 -1.206 1.00 0.00 O ATOM 1977 CB GLU A 129 11.275 7.439 -0.815 1.00 0.00 C ATOM 1978 CG GLU A 129 11.800 6.182 -1.500 1.00 0.00 C ATOM 1979 CD GLU A 129 12.812 6.478 -2.597 1.00 0.00 C ATOM 1980 OE1 GLU A 129 12.418 7.020 -3.651 1.00 0.00 O ATOM 1981 OE2 GLU A 129 14.012 6.175 -2.404 1.00 0.00 O ATOM 0 H GLU A 129 11.057 7.992 -3.213 1.00 0.00 H new ATOM 0 HA GLU A 129 9.168 7.295 -1.204 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.042 8.212 -0.861 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.105 7.221 0.239 1.00 0.00 H new ATOM 0 HG2 GLU A 129 12.261 5.535 -0.754 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.962 5.631 -1.926 1.00 0.00 H new ATOM 1988 N VAL A 130 8.743 9.321 0.170 1.00 0.00 N ATOM 1989 CA VAL A 130 8.219 10.533 0.794 1.00 0.00 C ATOM 1990 C VAL A 130 8.557 10.584 2.288 1.00 0.00 C ATOM 1991 O VAL A 130 8.607 11.662 2.885 1.00 0.00 O ATOM 1992 CB VAL A 130 6.684 10.601 0.600 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.100 11.888 1.153 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.350 10.435 -0.864 1.00 0.00 C ATOM 0 H VAL A 130 8.356 8.459 0.554 1.00 0.00 H new ATOM 0 HA VAL A 130 8.688 11.391 0.313 1.00 0.00 H new ATOM 0 HB VAL A 130 6.231 9.785 1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.021 11.895 0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 130 6.312 11.955 2.220 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.547 12.740 0.640 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.269 10.483 -0.998 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.823 11.232 -1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.716 9.470 -1.214 1.00 0.00 H new ATOM 2004 N LYS A 131 8.791 9.406 2.875 1.00 0.00 N ATOM 2005 CA LYS A 131 9.110 9.280 4.302 1.00 0.00 C ATOM 2006 C LYS A 131 7.901 9.610 5.172 1.00 0.00 C ATOM 2007 O LYS A 131 6.782 9.749 4.676 1.00 0.00 O ATOM 2008 CB LYS A 131 10.308 10.159 4.687 1.00 0.00 C ATOM 2009 CG LYS A 131 11.655 9.493 4.460 1.00 0.00 C ATOM 2010 CD LYS A 131 11.885 8.370 5.460 1.00 0.00 C ATOM 2011 CE LYS A 131 13.227 7.691 5.243 1.00 0.00 C ATOM 2012 NZ LYS A 131 13.518 6.694 6.304 1.00 0.00 N ATOM 0 H LYS A 131 8.765 8.516 2.377 1.00 0.00 H new ATOM 0 HA LYS A 131 9.383 8.240 4.482 1.00 0.00 H new ATOM 0 HB2 LYS A 131 10.269 11.083 4.111 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.222 10.434 5.738 1.00 0.00 H new ATOM 0 HG2 LYS A 131 11.702 9.096 3.446 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.450 10.233 4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 131 11.839 8.770 6.473 1.00 0.00 H new ATOM 0 HD3 LYS A 131 11.086 7.634 5.371 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.232 7.199 4.270 1.00 0.00 H new ATOM 0 HE3 LYS A 131 14.016 8.443 5.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 14.321 6.101 6.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 13.755 7.187 7.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 12.682 6.094 6.456 1.00 0.00 H new ATOM 2026 N LEU A 132 8.122 9.702 6.476 1.00 0.00 N ATOM 2027 CA LEU A 132 7.042 9.964 7.412 1.00 0.00 C ATOM 2028 C LEU A 132 7.130 11.379 7.959 1.00 0.00 C ATOM 2029 O LEU A 132 7.993 11.695 8.775 1.00 0.00 O ATOM 2030 CB LEU A 132 7.043 8.949 8.562 1.00 0.00 C ATOM 2031 CG LEU A 132 6.332 7.621 8.271 1.00 0.00 C ATOM 2032 CD1 LEU A 132 7.022 6.856 7.151 1.00 0.00 C ATOM 2033 CD2 LEU A 132 6.258 6.772 9.530 1.00 0.00 C ATOM 0 H LEU A 132 9.040 9.599 6.908 1.00 0.00 H new ATOM 0 HA LEU A 132 6.104 9.860 6.867 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.077 8.736 8.834 1.00 0.00 H new ATOM 0 HB3 LEU A 132 6.573 9.410 9.431 1.00 0.00 H new ATOM 0 HG LEU A 132 5.318 7.849 7.942 1.00 0.00 H new ATOM 0 HD11 LEU A 132 6.493 5.920 6.970 1.00 0.00 H new ATOM 0 HD12 LEU A 132 7.016 7.458 6.242 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.052 6.641 7.437 1.00 0.00 H new ATOM 0 HD21 LEU A 132 5.751 5.833 9.307 1.00 0.00 H new ATOM 0 HD22 LEU A 132 7.266 6.563 9.888 1.00 0.00 H new ATOM 0 HD23 LEU A 132 5.704 7.310 10.299 1.00 0.00 H new ATOM 2045 N GLU A 133 6.237 12.228 7.479 1.00 0.00 N ATOM 2046 CA GLU A 133 6.144 13.600 7.951 1.00 0.00 C ATOM 2047 C GLU A 133 5.394 13.657 9.282 1.00 0.00 C ATOM 2048 O GLU A 133 5.618 14.549 10.101 1.00 0.00 O ATOM 2049 CB GLU A 133 5.410 14.448 6.912 1.00 0.00 C ATOM 2050 CG GLU A 133 5.252 15.905 7.306 1.00 0.00 C ATOM 2051 CD GLU A 133 4.157 16.592 6.524 1.00 0.00 C ATOM 2052 OE1 GLU A 133 2.982 16.483 6.930 1.00 0.00 O ATOM 2053 OE2 GLU A 133 4.458 17.237 5.501 1.00 0.00 O ATOM 0 H GLU A 133 5.559 11.988 6.755 1.00 0.00 H new ATOM 0 HA GLU A 133 7.151 13.991 8.099 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.950 14.394 5.967 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.423 14.019 6.740 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.031 15.970 8.371 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.195 16.428 7.144 1.00 0.00 H new ATOM 2060 N HIS A 134 4.528 12.673 9.502 1.00 0.00 N ATOM 2061 CA HIS A 134 3.622 12.680 10.648 1.00 0.00 C ATOM 2062 C HIS A 134 4.280 12.081 11.888 1.00 0.00 C ATOM 2063 O HIS A 134 3.675 11.275 12.593 1.00 0.00 O ATOM 2064 CB HIS A 134 2.332 11.922 10.313 1.00 0.00 C ATOM 2065 CG HIS A 134 1.476 12.614 9.294 1.00 0.00 C ATOM 2066 ND1 HIS A 134 0.311 13.271 9.611 1.00 0.00 N ATOM 2067 CD2 HIS A 134 1.628 12.752 7.957 1.00 0.00 C ATOM 2068 CE1 HIS A 134 -0.218 13.782 8.517 1.00 0.00 C ATOM 2069 NE2 HIS A 134 0.562 13.484 7.495 1.00 0.00 N ATOM 0 H HIS A 134 4.434 11.856 8.899 1.00 0.00 H new ATOM 0 HA HIS A 134 3.377 13.719 10.870 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.589 10.929 9.945 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.754 11.783 11.227 1.00 0.00 H new ATOM 0 HD2 HIS A 134 2.439 12.359 7.362 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -1.136 14.349 8.466 1.00 0.00 H new ATOM 0 HE2 HIS A 134 0.400 13.752 6.524 1.00 0.00 H new ATOM 2078 N HIS A 135 5.520 12.498 12.142 1.00 0.00 N ATOM 2079 CA HIS A 135 6.261 12.122 13.351 1.00 0.00 C ATOM 2080 C HIS A 135 6.584 10.629 13.380 1.00 0.00 C ATOM 2081 O HIS A 135 7.672 10.218 12.983 1.00 0.00 O ATOM 2082 CB HIS A 135 5.492 12.524 14.622 1.00 0.00 C ATOM 2083 CG HIS A 135 5.267 14.001 14.761 1.00 0.00 C ATOM 2084 ND1 HIS A 135 5.722 14.735 15.832 1.00 0.00 N ATOM 2085 CD2 HIS A 135 4.613 14.878 13.963 1.00 0.00 C ATOM 2086 CE1 HIS A 135 5.357 15.994 15.686 1.00 0.00 C ATOM 2087 NE2 HIS A 135 4.682 16.109 14.560 1.00 0.00 N ATOM 0 H HIS A 135 6.043 13.109 11.514 1.00 0.00 H new ATOM 0 HA HIS A 135 7.204 12.668 13.326 1.00 0.00 H new ATOM 0 HB2 HIS A 135 4.526 12.019 14.624 1.00 0.00 H new ATOM 0 HB3 HIS A 135 6.041 12.167 15.494 1.00 0.00 H new ATOM 0 HD2 HIS A 135 4.126 14.649 13.027 1.00 0.00 H new ATOM 0 HE1 HIS A 135 5.575 16.797 16.375 1.00 0.00 H new ATOM 0 HE2 HIS A 135 4.278 16.971 14.194 1.00 0.00 H new ATOM 2096 N HIS A 136 5.636 9.822 13.838 1.00 0.00 N ATOM 2097 CA HIS A 136 5.829 8.381 13.959 1.00 0.00 C ATOM 2098 C HIS A 136 4.506 7.659 13.743 1.00 0.00 C ATOM 2099 O HIS A 136 3.442 8.271 13.824 1.00 0.00 O ATOM 2100 CB HIS A 136 6.393 8.011 15.339 1.00 0.00 C ATOM 2101 CG HIS A 136 7.846 8.338 15.528 1.00 0.00 C ATOM 2102 ND1 HIS A 136 8.326 9.039 16.614 1.00 0.00 N ATOM 2103 CD2 HIS A 136 8.930 8.020 14.782 1.00 0.00 C ATOM 2104 CE1 HIS A 136 9.639 9.141 16.524 1.00 0.00 C ATOM 2105 NE2 HIS A 136 10.034 8.529 15.422 1.00 0.00 N ATOM 0 H HIS A 136 4.715 10.145 14.135 1.00 0.00 H new ATOM 0 HA HIS A 136 6.546 8.073 13.198 1.00 0.00 H new ATOM 0 HB2 HIS A 136 5.815 8.529 16.104 1.00 0.00 H new ATOM 0 HB3 HIS A 136 6.250 6.943 15.501 1.00 0.00 H new ATOM 0 HD2 HIS A 136 8.927 7.468 13.854 1.00 0.00 H new ATOM 0 HE1 HIS A 136 10.283 9.641 17.233 1.00 0.00 H new ATOM 0 HE2 HIS A 136 10.998 8.448 15.100 1.00 0.00 H new ATOM 2114 N HIS A 137 4.568 6.365 13.460 1.00 0.00 N ATOM 2115 CA HIS A 137 3.357 5.578 13.268 1.00 0.00 C ATOM 2116 C HIS A 137 3.539 4.182 13.859 1.00 0.00 C ATOM 2117 O HIS A 137 2.920 3.220 13.409 1.00 0.00 O ATOM 2118 CB HIS A 137 3.013 5.484 11.775 1.00 0.00 C ATOM 2119 CG HIS A 137 1.557 5.234 11.504 1.00 0.00 C ATOM 2120 ND1 HIS A 137 1.003 3.975 11.409 1.00 0.00 N ATOM 2121 CD2 HIS A 137 0.537 6.102 11.303 1.00 0.00 C ATOM 2122 CE1 HIS A 137 -0.288 4.082 11.156 1.00 0.00 C ATOM 2123 NE2 HIS A 137 -0.599 5.362 11.089 1.00 0.00 N ATOM 0 H HIS A 137 5.437 5.841 13.359 1.00 0.00 H new ATOM 0 HA HIS A 137 2.533 6.072 13.783 1.00 0.00 H new ATOM 0 HB2 HIS A 137 3.311 6.410 11.284 1.00 0.00 H new ATOM 0 HB3 HIS A 137 3.600 4.682 11.326 1.00 0.00 H new ATOM 0 HD1 HIS A 137 1.512 3.098 11.517 1.00 0.00 H new ATOM 0 HD2 HIS A 137 0.605 7.180 11.310 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -0.975 3.259 11.026 1.00 0.00 H new ATOM 2132 N HIS A 138 4.388 4.080 14.876 1.00 0.00 N ATOM 2133 CA HIS A 138 4.646 2.805 15.537 1.00 0.00 C ATOM 2134 C HIS A 138 5.467 3.034 16.800 1.00 0.00 C ATOM 2135 O HIS A 138 4.993 2.801 17.911 1.00 0.00 O ATOM 2136 CB HIS A 138 5.374 1.837 14.596 1.00 0.00 C ATOM 2137 CG HIS A 138 5.312 0.408 15.042 1.00 0.00 C ATOM 2138 ND1 HIS A 138 6.415 -0.413 15.118 1.00 0.00 N ATOM 2139 CD2 HIS A 138 4.255 -0.353 15.412 1.00 0.00 C ATOM 2140 CE1 HIS A 138 6.041 -1.615 15.517 1.00 0.00 C ATOM 2141 NE2 HIS A 138 4.735 -1.605 15.702 1.00 0.00 N ATOM 0 H HIS A 138 4.910 4.867 15.261 1.00 0.00 H new ATOM 0 HA HIS A 138 3.690 2.356 15.808 1.00 0.00 H new ATOM 0 HB2 HIS A 138 4.940 1.917 13.599 1.00 0.00 H new ATOM 0 HB3 HIS A 138 6.418 2.139 14.515 1.00 0.00 H new ATOM 0 HD2 HIS A 138 3.225 -0.034 15.468 1.00 0.00 H new ATOM 0 HE1 HIS A 138 6.694 -2.462 15.666 1.00 0.00 H new ATOM 0 HE2 HIS A 138 4.174 -2.399 16.010 1.00 0.00 H new ATOM 2150 N HIS A 139 6.698 3.490 16.618 1.00 0.00 N ATOM 2151 CA HIS A 139 7.552 3.872 17.736 1.00 0.00 C ATOM 2152 C HIS A 139 7.608 5.385 17.845 1.00 0.00 C ATOM 2153 O HIS A 139 8.468 5.987 17.181 1.00 0.00 O ATOM 2154 CB HIS A 139 8.970 3.316 17.566 1.00 0.00 C ATOM 2155 CG HIS A 139 9.142 1.915 18.058 1.00 0.00 C ATOM 2156 ND1 HIS A 139 9.181 0.822 17.224 1.00 0.00 N ATOM 2157 CD2 HIS A 139 9.314 1.435 19.311 1.00 0.00 C ATOM 2158 CE1 HIS A 139 9.371 -0.269 17.942 1.00 0.00 C ATOM 2159 NE2 HIS A 139 9.456 0.075 19.213 1.00 0.00 N ATOM 2160 OXT HIS A 139 6.774 5.966 18.570 1.00 0.00 O ATOM 0 H HIS A 139 7.131 3.605 15.702 1.00 0.00 H new ATOM 0 HA HIS A 139 7.127 3.452 18.647 1.00 0.00 H new ATOM 0 HB2 HIS A 139 9.239 3.354 16.510 1.00 0.00 H new ATOM 0 HB3 HIS A 139 9.668 3.964 18.096 1.00 0.00 H new ATOM 0 HD1 HIS A 139 9.079 0.850 16.209 1.00 0.00 H new ATOM 0 HD2 HIS A 139 9.335 2.016 20.221 1.00 0.00 H new ATOM 0 HE1 HIS A 139 9.445 -1.274 17.554 1.00 0.00 H new TER 2169 HIS A 139