USER MOD reduce.3.24.130724 H: found=0, std=0, add=1409, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1057 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 115 THR OG1 : rot 107:sc= 0.33 USER MOD Set 1.2: A 158 SER OG : rot 51:sc= -1.71! USER MOD Set 2.1: A 83 SER OG : rot 102:sc= 1.2 USER MOD Set 2.2: A 116 GLN : amide:sc= 1.04 K(o=2.2,f=0.041) USER MOD Set 3.1: A 17 THR OG1 : rot 180:sc= -0.043 USER MOD Set 3.2: A 18 CYS SG : rot 9:sc= -5.56! USER MOD Set 4.1: A 3 THR OG1 : rot 139:sc= 0.521 USER MOD Set 4.2: A 52 THR OG1 : rot 180:sc= -0.468 USER MOD Single : A 1 MET CE :methyl -151:sc= -0.248 (180deg=-1.62!) USER MOD Single : A 1 MET N :NH3+ -130:sc= 0.0363 (180deg=-0.557) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 CYS SG : rot -48:sc= -3.07! USER MOD Single : A 16 LYS NZ :NH3+ -155:sc= -1.73 (180deg=-2.48) USER MOD Single : A 22 SER OG : rot -90:sc= -2.2 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -156:sc= -0.797 USER MOD Single : A 25 THR OG1 : rot 102:sc= 0.194! USER MOD Single : A 26 ASN : amide:sc= -7.48! C(o=-7.5!,f=-11!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.267 K(o=-0.27,f=-5.4!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl 149:sc= -0.185 (180deg=-1.07) USER MOD Single : A 51 TYR OH : rot -112:sc= -1.57! USER MOD Single : A 58 THR OG1 : rot -74:sc= 0.681 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 TYR OH : rot 180:sc=-0.00553 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 75 THR OG1 : rot 12:sc= -0.296 USER MOD Single : A 81 CYS SG : rot 80:sc= -11.1! USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -61:sc= -0.739 USER MOD Single : A 92 ASN : amide:sc= -1.11 K(o=-1.1,f=-1.6!) USER MOD Single : A 94 LYS NZ :NH3+ 142:sc= -0.855 (180deg=-2.83!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 21:sc= -0.243 USER MOD Single : A 103 HIS : no HD1:sc= -0.084 X(o=-0.084,f=-0.17) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 105 CYS SG : rot 19:sc= -1.36! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 154:sc= 0.215 USER MOD Single : A 124 SER OG : rot 117:sc= 0.547 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.00746) USER MOD Single : A 131 LYS NZ :NH3+ 156:sc= -0.21 (180deg=-1.23!) USER MOD Single : A 132 ASN : amide:sc= -0.964 K(o=-0.96,f=-1.9!) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 GLN :FLIP amide:sc= -2.33! C(o=-5.1!,f=-2.3!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.172 USER MOD Single : A 141 THR OG1 : rot 128:sc= 0.0275 USER MOD Single : A 144 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.003) USER MOD Single : A 150 LYS NZ :NH3+ 166:sc=-0.000247 (180deg=-0.112) USER MOD Single : A 153 LYS NZ :NH3+ -154:sc= -1.67 (180deg=-3.51!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 CYS SG : rot 120:sc= -7.76! USER MOD Single : A 161 THR OG1 : rot 158:sc= -0.358! USER MOD Single : A 162 GLN : amide:sc= -8.57! C(o=-8.6!,f=-9!) USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 ASN : amide:sc= -4.22! C(o=-4.2!,f=-8.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 123.166 -0.006 15.247 1.00 0.00 N ATOM 2 CA MET A 1 122.377 -0.642 14.154 1.00 0.00 C ATOM 3 C MET A 1 123.079 -1.915 13.697 1.00 0.00 C ATOM 4 O MET A 1 124.179 -2.228 14.151 1.00 0.00 O ATOM 5 CB MET A 1 122.255 0.333 12.980 1.00 0.00 C ATOM 6 CG MET A 1 121.502 1.590 13.426 1.00 0.00 C ATOM 7 SD MET A 1 119.838 1.139 13.978 1.00 0.00 S ATOM 8 CE MET A 1 119.246 0.481 12.398 1.00 0.00 C ATOM 0 H1 MET A 1 122.538 0.210 16.048 1.00 0.00 H new ATOM 0 H2 MET A 1 123.914 -0.657 15.559 1.00 0.00 H new ATOM 0 H3 MET A 1 123.597 0.874 14.898 1.00 0.00 H new ATOM 0 HA MET A 1 121.381 -0.892 14.519 1.00 0.00 H new ATOM 0 HB2 MET A 1 123.246 0.602 12.614 1.00 0.00 H new ATOM 0 HB3 MET A 1 121.728 -0.143 12.153 1.00 0.00 H new ATOM 0 HG2 MET A 1 122.043 2.082 14.234 1.00 0.00 H new ATOM 0 HG3 MET A 1 121.442 2.302 12.602 1.00 0.00 H new ATOM 0 HE1 MET A 1 118.167 0.617 12.329 1.00 0.00 H new ATOM 0 HE2 MET A 1 119.732 1.010 11.578 1.00 0.00 H new ATOM 0 HE3 MET A 1 119.483 -0.581 12.335 1.00 0.00 H new ATOM 20 N GLN A 2 122.440 -2.636 12.781 1.00 0.00 N ATOM 21 CA GLN A 2 123.014 -3.865 12.249 1.00 0.00 C ATOM 22 C GLN A 2 124.007 -3.540 11.134 1.00 0.00 C ATOM 23 O GLN A 2 125.130 -4.044 11.111 1.00 0.00 O ATOM 24 CB GLN A 2 121.900 -4.766 11.709 1.00 0.00 C ATOM 25 CG GLN A 2 121.017 -5.233 12.868 1.00 0.00 C ATOM 26 CD GLN A 2 119.873 -6.092 12.340 1.00 0.00 C ATOM 27 OE1 GLN A 2 119.574 -6.064 11.146 1.00 0.00 O ATOM 28 NE2 GLN A 2 119.212 -6.861 13.162 1.00 0.00 N ATOM 0 H GLN A 2 121.529 -2.391 12.394 1.00 0.00 H new ATOM 0 HA GLN A 2 123.540 -4.387 13.049 1.00 0.00 H new ATOM 0 HB2 GLN A 2 121.301 -4.224 10.977 1.00 0.00 H new ATOM 0 HB3 GLN A 2 122.330 -5.626 11.195 1.00 0.00 H new ATOM 0 HG2 GLN A 2 121.611 -5.803 13.582 1.00 0.00 H new ATOM 0 HG3 GLN A 2 120.618 -4.371 13.402 1.00 0.00 H new ATOM 0 HE21 GLN A 2 119.461 -6.883 14.151 1.00 0.00 H new ATOM 0 HE22 GLN A 2 118.447 -7.440 12.815 1.00 0.00 H new ATOM 35 N THR A 3 123.576 -2.686 10.215 1.00 0.00 N ATOM 36 CA THR A 3 124.416 -2.284 9.098 1.00 0.00 C ATOM 37 C THR A 3 124.887 -0.846 9.272 1.00 0.00 C ATOM 38 O THR A 3 124.202 -0.027 9.886 1.00 0.00 O ATOM 39 CB THR A 3 123.634 -2.411 7.791 1.00 0.00 C ATOM 40 OG1 THR A 3 123.852 -1.254 6.996 1.00 0.00 O ATOM 41 CG2 THR A 3 122.143 -2.548 8.098 1.00 0.00 C ATOM 0 H THR A 3 122.650 -2.259 10.222 1.00 0.00 H new ATOM 0 HA THR A 3 125.288 -2.937 9.068 1.00 0.00 H new ATOM 0 HB THR A 3 123.973 -3.294 7.249 1.00 0.00 H new ATOM 0 HG1 THR A 3 123.959 -1.517 6.058 1.00 0.00 H new ATOM 0 HG21 THR A 3 121.586 -2.638 7.165 1.00 0.00 H new ATOM 0 HG22 THR A 3 121.977 -3.436 8.707 1.00 0.00 H new ATOM 0 HG23 THR A 3 121.801 -1.667 8.641 1.00 0.00 H new ATOM 46 N ILE A 4 126.063 -0.551 8.735 1.00 0.00 N ATOM 47 CA ILE A 4 126.626 0.788 8.840 1.00 0.00 C ATOM 48 C ILE A 4 127.013 1.315 7.462 1.00 0.00 C ATOM 49 O ILE A 4 127.418 0.549 6.588 1.00 0.00 O ATOM 50 CB ILE A 4 127.856 0.750 9.746 1.00 0.00 C ATOM 51 CG1 ILE A 4 128.247 2.175 10.145 1.00 0.00 C ATOM 52 CG2 ILE A 4 129.020 0.096 8.998 1.00 0.00 C ATOM 53 CD1 ILE A 4 127.154 2.784 11.027 1.00 0.00 C ATOM 0 H ILE A 4 126.643 -1.217 8.225 1.00 0.00 H new ATOM 0 HA ILE A 4 125.877 1.455 9.266 1.00 0.00 H new ATOM 0 HB ILE A 4 127.626 0.173 10.642 1.00 0.00 H new ATOM 0 HG12 ILE A 4 129.196 2.165 10.681 1.00 0.00 H new ATOM 0 HG13 ILE A 4 128.390 2.786 9.254 1.00 0.00 H new ATOM 0 HG21 ILE A 4 129.898 0.069 9.644 1.00 0.00 H new ATOM 0 HG22 ILE A 4 128.746 -0.920 8.715 1.00 0.00 H new ATOM 0 HG23 ILE A 4 129.247 0.673 8.102 1.00 0.00 H new ATOM 0 HD11 ILE A 4 127.437 3.798 11.309 1.00 0.00 H new ATOM 0 HD12 ILE A 4 126.214 2.809 10.476 1.00 0.00 H new ATOM 0 HD13 ILE A 4 127.032 2.179 11.925 1.00 0.00 H new ATOM 57 N LYS A 5 126.893 2.627 7.274 1.00 0.00 N ATOM 58 CA LYS A 5 127.239 3.232 5.995 1.00 0.00 C ATOM 59 C LYS A 5 128.727 3.551 5.940 1.00 0.00 C ATOM 60 O LYS A 5 129.293 4.089 6.891 1.00 0.00 O ATOM 61 CB LYS A 5 126.438 4.519 5.781 1.00 0.00 C ATOM 62 CG LYS A 5 124.957 4.182 5.593 1.00 0.00 C ATOM 63 CD LYS A 5 124.184 5.460 5.258 1.00 0.00 C ATOM 64 CE LYS A 5 122.695 5.137 5.117 1.00 0.00 C ATOM 65 NZ LYS A 5 122.193 5.676 3.821 1.00 0.00 N ATOM 0 H LYS A 5 126.563 3.283 7.982 1.00 0.00 H new ATOM 0 HA LYS A 5 126.996 2.519 5.207 1.00 0.00 H new ATOM 0 HB2 LYS A 5 126.564 5.183 6.636 1.00 0.00 H new ATOM 0 HB3 LYS A 5 126.813 5.051 4.907 1.00 0.00 H new ATOM 0 HG2 LYS A 5 124.838 3.451 4.793 1.00 0.00 H new ATOM 0 HG3 LYS A 5 124.558 3.729 6.501 1.00 0.00 H new ATOM 0 HD2 LYS A 5 124.333 6.203 6.042 1.00 0.00 H new ATOM 0 HD3 LYS A 5 124.562 5.893 4.332 1.00 0.00 H new ATOM 0 HE2 LYS A 5 122.540 4.059 5.160 1.00 0.00 H new ATOM 0 HE3 LYS A 5 122.137 5.573 5.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 121.181 5.458 3.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 122.329 6.707 3.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 122.719 5.240 3.037 1.00 0.00 H new ATOM 79 N CYS A 6 129.351 3.223 4.816 1.00 0.00 N ATOM 80 CA CYS A 6 130.771 3.485 4.640 1.00 0.00 C ATOM 81 C CYS A 6 131.033 4.065 3.258 1.00 0.00 C ATOM 82 O CYS A 6 130.576 3.525 2.249 1.00 0.00 O ATOM 83 CB CYS A 6 131.574 2.193 4.818 1.00 0.00 C ATOM 84 SG CYS A 6 132.704 1.985 3.419 1.00 0.00 S ATOM 0 H CYS A 6 128.898 2.778 4.018 1.00 0.00 H new ATOM 0 HA CYS A 6 131.085 4.207 5.394 1.00 0.00 H new ATOM 0 HB2 CYS A 6 132.136 2.228 5.751 1.00 0.00 H new ATOM 0 HB3 CYS A 6 130.899 1.339 4.884 1.00 0.00 H new ATOM 0 HG CYS A 6 132.057 2.174 2.307 1.00 0.00 H new ATOM 90 N VAL A 7 131.783 5.159 3.215 1.00 0.00 N ATOM 91 CA VAL A 7 132.109 5.793 1.945 1.00 0.00 C ATOM 92 C VAL A 7 133.545 5.464 1.576 1.00 0.00 C ATOM 93 O VAL A 7 134.434 5.528 2.425 1.00 0.00 O ATOM 94 CB VAL A 7 131.931 7.311 2.044 1.00 0.00 C ATOM 95 CG1 VAL A 7 132.256 7.957 0.696 1.00 0.00 C ATOM 96 CG2 VAL A 7 130.482 7.631 2.415 1.00 0.00 C ATOM 0 H VAL A 7 132.173 5.622 4.036 1.00 0.00 H new ATOM 0 HA VAL A 7 131.436 5.416 1.174 1.00 0.00 H new ATOM 0 HB VAL A 7 132.603 7.702 2.808 1.00 0.00 H new ATOM 0 HG11 VAL A 7 132.128 9.037 0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 7 133.287 7.731 0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 7 131.585 7.564 -0.067 1.00 0.00 H new ATOM 0 HG21 VAL A 7 130.355 8.711 2.486 1.00 0.00 H new ATOM 0 HG22 VAL A 7 129.815 7.236 1.649 1.00 0.00 H new ATOM 0 HG23 VAL A 7 130.243 7.174 3.375 1.00 0.00 H new ATOM 100 N VAL A 8 133.773 5.095 0.320 1.00 0.00 N ATOM 101 CA VAL A 8 135.116 4.746 -0.106 1.00 0.00 C ATOM 102 C VAL A 8 135.650 5.744 -1.127 1.00 0.00 C ATOM 103 O VAL A 8 135.026 5.999 -2.157 1.00 0.00 O ATOM 104 CB VAL A 8 135.113 3.339 -0.697 1.00 0.00 C ATOM 105 CG1 VAL A 8 136.522 2.975 -1.163 1.00 0.00 C ATOM 106 CG2 VAL A 8 134.658 2.341 0.371 1.00 0.00 C ATOM 0 H VAL A 8 133.059 5.032 -0.405 1.00 0.00 H new ATOM 0 HA VAL A 8 135.773 4.777 0.763 1.00 0.00 H new ATOM 0 HB VAL A 8 134.431 3.304 -1.546 1.00 0.00 H new ATOM 0 HG11 VAL A 8 136.517 1.970 -1.585 1.00 0.00 H new ATOM 0 HG12 VAL A 8 136.849 3.686 -1.922 1.00 0.00 H new ATOM 0 HG13 VAL A 8 137.206 3.010 -0.315 1.00 0.00 H new ATOM 0 HG21 VAL A 8 134.655 1.335 -0.049 1.00 0.00 H new ATOM 0 HG22 VAL A 8 135.342 2.378 1.219 1.00 0.00 H new ATOM 0 HG23 VAL A 8 133.653 2.598 0.704 1.00 0.00 H new ATOM 110 N VAL A 9 136.819 6.295 -0.825 1.00 0.00 N ATOM 111 CA VAL A 9 137.466 7.261 -1.701 1.00 0.00 C ATOM 112 C VAL A 9 138.953 6.947 -1.793 1.00 0.00 C ATOM 113 O VAL A 9 139.547 6.474 -0.829 1.00 0.00 O ATOM 114 CB VAL A 9 137.269 8.677 -1.160 1.00 0.00 C ATOM 115 CG1 VAL A 9 137.941 8.799 0.208 1.00 0.00 C ATOM 116 CG2 VAL A 9 137.899 9.680 -2.127 1.00 0.00 C ATOM 0 H VAL A 9 137.341 6.087 0.026 1.00 0.00 H new ATOM 0 HA VAL A 9 137.019 7.198 -2.693 1.00 0.00 H new ATOM 0 HB VAL A 9 136.204 8.884 -1.060 1.00 0.00 H new ATOM 0 HG11 VAL A 9 137.800 9.809 0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 9 137.495 8.082 0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 9 139.007 8.593 0.109 1.00 0.00 H new ATOM 0 HG21 VAL A 9 137.760 10.691 -1.744 1.00 0.00 H new ATOM 0 HG22 VAL A 9 138.965 9.472 -2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 9 137.422 9.593 -3.103 1.00 0.00 H new ATOM 120 N GLY A 10 139.549 7.198 -2.952 1.00 0.00 N ATOM 121 CA GLY A 10 140.969 6.919 -3.134 1.00 0.00 C ATOM 122 C GLY A 10 141.756 8.190 -3.429 1.00 0.00 C ATOM 123 O GLY A 10 141.323 9.295 -3.103 1.00 0.00 O ATOM 0 H GLY A 10 139.080 7.588 -3.769 1.00 0.00 H new ATOM 0 HA2 GLY A 10 141.365 6.445 -2.236 1.00 0.00 H new ATOM 0 HA3 GLY A 10 141.100 6.211 -3.952 1.00 0.00 H new ATOM 127 N ASP A 11 142.915 8.016 -4.054 1.00 0.00 N ATOM 128 CA ASP A 11 143.769 9.147 -4.400 1.00 0.00 C ATOM 129 C ASP A 11 143.175 9.908 -5.579 1.00 0.00 C ATOM 130 O ASP A 11 143.886 10.585 -6.321 1.00 0.00 O ATOM 131 CB ASP A 11 145.175 8.656 -4.757 1.00 0.00 C ATOM 132 CG ASP A 11 145.127 7.794 -6.015 1.00 0.00 C ATOM 133 OD1 ASP A 11 144.107 7.810 -6.684 1.00 0.00 O ATOM 134 OD2 ASP A 11 146.112 7.130 -6.292 1.00 0.00 O ATOM 0 H ASP A 11 143.284 7.106 -4.331 1.00 0.00 H new ATOM 0 HA ASP A 11 143.833 9.814 -3.540 1.00 0.00 H new ATOM 0 HB2 ASP A 11 145.836 9.508 -4.916 1.00 0.00 H new ATOM 0 HB3 ASP A 11 145.589 8.081 -3.929 1.00 0.00 H new ATOM 139 N GLY A 12 141.864 9.781 -5.744 1.00 0.00 N ATOM 140 CA GLY A 12 141.167 10.445 -6.837 1.00 0.00 C ATOM 141 C GLY A 12 140.372 9.435 -7.657 1.00 0.00 C ATOM 142 O GLY A 12 139.152 9.333 -7.521 1.00 0.00 O ATOM 0 H GLY A 12 141.263 9.225 -5.135 1.00 0.00 H new ATOM 0 HA2 GLY A 12 140.497 11.207 -6.439 1.00 0.00 H new ATOM 0 HA3 GLY A 12 141.886 10.956 -7.477 1.00 0.00 H new ATOM 146 N ALA A 13 141.070 8.687 -8.505 1.00 0.00 N ATOM 147 CA ALA A 13 140.419 7.683 -9.339 1.00 0.00 C ATOM 148 C ALA A 13 141.285 6.431 -9.441 1.00 0.00 C ATOM 149 O ALA A 13 142.183 6.352 -10.279 1.00 0.00 O ATOM 150 CB ALA A 13 140.168 8.247 -10.739 1.00 0.00 C ATOM 0 H ALA A 13 142.080 8.756 -8.633 1.00 0.00 H new ATOM 0 HA ALA A 13 139.467 7.418 -8.880 1.00 0.00 H new ATOM 0 HB1 ALA A 13 139.682 7.490 -11.354 1.00 0.00 H new ATOM 0 HB2 ALA A 13 139.525 9.125 -10.668 1.00 0.00 H new ATOM 0 HB3 ALA A 13 141.118 8.529 -11.193 1.00 0.00 H new ATOM 156 N VAL A 14 141.011 5.457 -8.580 1.00 0.00 N ATOM 157 CA VAL A 14 141.773 4.213 -8.578 1.00 0.00 C ATOM 158 C VAL A 14 140.850 3.022 -8.845 1.00 0.00 C ATOM 159 O VAL A 14 139.627 3.163 -8.851 1.00 0.00 O ATOM 160 CB VAL A 14 142.487 4.044 -7.232 1.00 0.00 C ATOM 161 CG1 VAL A 14 143.994 3.873 -7.463 1.00 0.00 C ATOM 162 CG2 VAL A 14 142.252 5.290 -6.375 1.00 0.00 C ATOM 0 H VAL A 14 140.272 5.504 -7.879 1.00 0.00 H new ATOM 0 HA VAL A 14 142.519 4.253 -9.372 1.00 0.00 H new ATOM 0 HB VAL A 14 142.094 3.163 -6.724 1.00 0.00 H new ATOM 0 HG11 VAL A 14 144.498 3.753 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 14 144.170 2.990 -8.078 1.00 0.00 H new ATOM 0 HG13 VAL A 14 144.386 4.754 -7.971 1.00 0.00 H new ATOM 0 HG21 VAL A 14 142.758 5.173 -5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 14 142.647 6.166 -6.890 1.00 0.00 H new ATOM 0 HG23 VAL A 14 141.183 5.420 -6.207 1.00 0.00 H new ATOM 166 N GLY A 15 141.442 1.854 -9.083 1.00 0.00 N ATOM 167 CA GLY A 15 140.665 0.646 -9.370 1.00 0.00 C ATOM 168 C GLY A 15 139.894 0.157 -8.143 1.00 0.00 C ATOM 169 O GLY A 15 140.045 -0.991 -7.718 1.00 0.00 O ATOM 0 H GLY A 15 142.453 1.716 -9.083 1.00 0.00 H new ATOM 0 HA2 GLY A 15 139.965 0.849 -10.181 1.00 0.00 H new ATOM 0 HA3 GLY A 15 141.334 -0.142 -9.716 1.00 0.00 H new ATOM 173 N LYS A 16 139.065 1.025 -7.580 1.00 0.00 N ATOM 174 CA LYS A 16 138.284 0.657 -6.410 1.00 0.00 C ATOM 175 C LYS A 16 137.046 -0.134 -6.828 1.00 0.00 C ATOM 176 O LYS A 16 136.233 -0.523 -5.991 1.00 0.00 O ATOM 177 CB LYS A 16 137.863 1.921 -5.663 1.00 0.00 C ATOM 178 CG LYS A 16 139.104 2.765 -5.369 1.00 0.00 C ATOM 179 CD LYS A 16 138.721 3.950 -4.482 1.00 0.00 C ATOM 180 CE LYS A 16 137.672 4.804 -5.196 1.00 0.00 C ATOM 181 NZ LYS A 16 137.982 4.861 -6.652 1.00 0.00 N ATOM 0 H LYS A 16 138.917 1.979 -7.911 1.00 0.00 H new ATOM 0 HA LYS A 16 138.893 0.033 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 16 137.153 2.492 -6.261 1.00 0.00 H new ATOM 0 HB3 LYS A 16 137.358 1.658 -4.733 1.00 0.00 H new ATOM 0 HG2 LYS A 16 139.861 2.157 -4.874 1.00 0.00 H new ATOM 0 HG3 LYS A 16 139.542 3.122 -6.301 1.00 0.00 H new ATOM 0 HD2 LYS A 16 138.328 3.593 -3.530 1.00 0.00 H new ATOM 0 HD3 LYS A 16 139.603 4.550 -4.258 1.00 0.00 H new ATOM 0 HE2 LYS A 16 136.679 4.383 -5.041 1.00 0.00 H new ATOM 0 HE3 LYS A 16 137.660 5.810 -4.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 137.574 5.726 -7.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 139.013 4.867 -6.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 137.576 4.029 -7.126 1.00 0.00 H new ATOM 195 N THR A 17 136.908 -0.357 -8.134 1.00 0.00 N ATOM 196 CA THR A 17 135.763 -1.093 -8.662 1.00 0.00 C ATOM 197 C THR A 17 135.819 -2.569 -8.272 1.00 0.00 C ATOM 198 O THR A 17 134.791 -3.173 -7.967 1.00 0.00 O ATOM 199 CB THR A 17 135.730 -0.976 -10.187 1.00 0.00 C ATOM 200 OG1 THR A 17 136.841 -1.670 -10.737 1.00 0.00 O ATOM 201 CG2 THR A 17 135.798 0.497 -10.587 1.00 0.00 C ATOM 0 H THR A 17 137.571 -0.040 -8.841 1.00 0.00 H new ATOM 0 HA THR A 17 134.860 -0.658 -8.233 1.00 0.00 H new ATOM 0 HB THR A 17 134.805 -1.411 -10.566 1.00 0.00 H new ATOM 0 HG1 THR A 17 136.821 -1.598 -11.714 1.00 0.00 H new ATOM 0 HG21 THR A 17 135.775 0.580 -11.674 1.00 0.00 H new ATOM 0 HG22 THR A 17 134.946 1.029 -10.164 1.00 0.00 H new ATOM 0 HG23 THR A 17 136.722 0.934 -10.209 1.00 0.00 H new ATOM 206 N CYS A 18 137.017 -3.147 -8.288 1.00 0.00 N ATOM 207 CA CYS A 18 137.180 -4.556 -7.937 1.00 0.00 C ATOM 208 C CYS A 18 137.454 -4.709 -6.445 1.00 0.00 C ATOM 209 O CYS A 18 137.354 -5.803 -5.888 1.00 0.00 O ATOM 210 CB CYS A 18 138.335 -5.165 -8.735 1.00 0.00 C ATOM 211 SG CYS A 18 137.910 -5.183 -10.493 1.00 0.00 S ATOM 0 H CYS A 18 137.882 -2.668 -8.538 1.00 0.00 H new ATOM 0 HA CYS A 18 136.255 -5.079 -8.181 1.00 0.00 H new ATOM 0 HB2 CYS A 18 139.245 -4.587 -8.576 1.00 0.00 H new ATOM 0 HB3 CYS A 18 138.536 -6.179 -8.388 1.00 0.00 H new ATOM 0 HG CYS A 18 136.815 -4.508 -10.682 1.00 0.00 H new ATOM 217 N LEU A 19 137.792 -3.597 -5.808 1.00 0.00 N ATOM 218 CA LEU A 19 138.075 -3.594 -4.375 1.00 0.00 C ATOM 219 C LEU A 19 136.865 -4.071 -3.566 1.00 0.00 C ATOM 220 O LEU A 19 137.005 -4.873 -2.643 1.00 0.00 O ATOM 221 CB LEU A 19 138.454 -2.172 -3.937 1.00 0.00 C ATOM 222 CG LEU A 19 138.799 -2.137 -2.441 1.00 0.00 C ATOM 223 CD1 LEU A 19 140.183 -2.743 -2.203 1.00 0.00 C ATOM 224 CD2 LEU A 19 138.801 -0.684 -1.962 1.00 0.00 C ATOM 0 H LEU A 19 137.878 -2.685 -6.258 1.00 0.00 H new ATOM 0 HA LEU A 19 138.901 -4.280 -4.187 1.00 0.00 H new ATOM 0 HB2 LEU A 19 139.306 -1.822 -4.520 1.00 0.00 H new ATOM 0 HB3 LEU A 19 137.627 -1.491 -4.140 1.00 0.00 H new ATOM 0 HG LEU A 19 138.057 -2.715 -1.890 1.00 0.00 H new ATOM 0 HD11 LEU A 19 140.416 -2.712 -1.139 1.00 0.00 H new ATOM 0 HD12 LEU A 19 140.191 -3.777 -2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 19 140.930 -2.172 -2.754 1.00 0.00 H new ATOM 0 HD21 LEU A 19 139.045 -0.651 -0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 19 139.544 -0.117 -2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 19 137.815 -0.247 -2.121 1.00 0.00 H new ATOM 230 N LEU A 20 135.682 -3.564 -3.904 1.00 0.00 N ATOM 231 CA LEU A 20 134.466 -3.937 -3.185 1.00 0.00 C ATOM 232 C LEU A 20 134.017 -5.349 -3.549 1.00 0.00 C ATOM 233 O LEU A 20 133.465 -6.069 -2.717 1.00 0.00 O ATOM 234 CB LEU A 20 133.344 -2.950 -3.503 1.00 0.00 C ATOM 235 CG LEU A 20 133.087 -2.938 -5.011 1.00 0.00 C ATOM 236 CD1 LEU A 20 131.748 -3.616 -5.309 1.00 0.00 C ATOM 237 CD2 LEU A 20 133.043 -1.494 -5.512 1.00 0.00 C ATOM 0 H LEU A 20 135.539 -2.899 -4.664 1.00 0.00 H new ATOM 0 HA LEU A 20 134.689 -3.910 -2.118 1.00 0.00 H new ATOM 0 HB2 LEU A 20 132.436 -3.232 -2.971 1.00 0.00 H new ATOM 0 HB3 LEU A 20 133.616 -1.951 -3.162 1.00 0.00 H new ATOM 0 HG LEU A 20 133.889 -3.476 -5.516 1.00 0.00 H new ATOM 0 HD11 LEU A 20 131.567 -3.606 -6.384 1.00 0.00 H new ATOM 0 HD12 LEU A 20 131.775 -4.646 -4.955 1.00 0.00 H new ATOM 0 HD13 LEU A 20 130.947 -3.079 -4.801 1.00 0.00 H new ATOM 0 HD21 LEU A 20 132.860 -1.487 -6.586 1.00 0.00 H new ATOM 0 HD22 LEU A 20 132.242 -0.957 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 20 133.996 -1.007 -5.303 1.00 0.00 H new ATOM 243 N ILE A 21 134.248 -5.733 -4.796 1.00 0.00 N ATOM 244 CA ILE A 21 133.853 -7.055 -5.263 1.00 0.00 C ATOM 245 C ILE A 21 134.584 -8.141 -4.468 1.00 0.00 C ATOM 246 O ILE A 21 134.332 -9.332 -4.645 1.00 0.00 O ATOM 247 CB ILE A 21 134.175 -7.190 -6.762 1.00 0.00 C ATOM 248 CG1 ILE A 21 133.555 -6.011 -7.513 1.00 0.00 C ATOM 249 CG2 ILE A 21 133.585 -8.490 -7.321 1.00 0.00 C ATOM 250 CD1 ILE A 21 133.951 -6.074 -8.990 1.00 0.00 C ATOM 0 H ILE A 21 134.704 -5.152 -5.500 1.00 0.00 H new ATOM 0 HA ILE A 21 132.781 -7.179 -5.113 1.00 0.00 H new ATOM 0 HB ILE A 21 135.257 -7.202 -6.890 1.00 0.00 H new ATOM 0 HG12 ILE A 21 132.470 -6.036 -7.416 1.00 0.00 H new ATOM 0 HG13 ILE A 21 133.892 -5.071 -7.076 1.00 0.00 H new ATOM 0 HG21 ILE A 21 133.822 -8.570 -8.382 1.00 0.00 H new ATOM 0 HG22 ILE A 21 134.010 -9.341 -6.789 1.00 0.00 H new ATOM 0 HG23 ILE A 21 132.503 -8.484 -7.190 1.00 0.00 H new ATOM 0 HD11 ILE A 21 133.507 -5.232 -9.522 1.00 0.00 H new ATOM 0 HD12 ILE A 21 135.036 -6.027 -9.078 1.00 0.00 H new ATOM 0 HD13 ILE A 21 133.592 -7.007 -9.424 1.00 0.00 H new ATOM 254 N SER A 22 135.509 -7.726 -3.605 1.00 0.00 N ATOM 255 CA SER A 22 136.284 -8.694 -2.826 1.00 0.00 C ATOM 256 C SER A 22 135.387 -9.787 -2.248 1.00 0.00 C ATOM 257 O SER A 22 135.317 -10.881 -2.813 1.00 0.00 O ATOM 258 CB SER A 22 136.983 -7.974 -1.684 1.00 0.00 C ATOM 259 OG SER A 22 137.701 -8.918 -0.904 1.00 0.00 O ATOM 0 H SER A 22 135.738 -6.748 -3.428 1.00 0.00 H new ATOM 0 HA SER A 22 137.013 -9.159 -3.489 1.00 0.00 H new ATOM 0 HB2 SER A 22 137.663 -7.218 -2.077 1.00 0.00 H new ATOM 0 HB3 SER A 22 136.252 -7.454 -1.065 1.00 0.00 H new ATOM 0 HG SER A 22 137.123 -9.259 -0.189 1.00 0.00 H new ATOM 265 N TYR A 23 134.693 -9.515 -1.132 1.00 0.00 N ATOM 266 CA TYR A 23 133.819 -10.527 -0.540 1.00 0.00 C ATOM 267 C TYR A 23 132.803 -11.016 -1.559 1.00 0.00 C ATOM 268 O TYR A 23 132.466 -12.199 -1.606 1.00 0.00 O ATOM 269 CB TYR A 23 133.075 -9.933 0.658 1.00 0.00 C ATOM 270 CG TYR A 23 132.207 -10.996 1.290 1.00 0.00 C ATOM 271 CD1 TYR A 23 130.925 -11.239 0.786 1.00 0.00 C ATOM 272 CD2 TYR A 23 132.685 -11.735 2.377 1.00 0.00 C ATOM 273 CE1 TYR A 23 130.118 -12.223 1.370 1.00 0.00 C ATOM 274 CE2 TYR A 23 131.878 -12.720 2.962 1.00 0.00 C ATOM 275 CZ TYR A 23 130.595 -12.964 2.457 1.00 0.00 C ATOM 276 OH TYR A 23 129.800 -13.935 3.032 1.00 0.00 O ATOM 0 H TYR A 23 134.721 -8.625 -0.635 1.00 0.00 H new ATOM 0 HA TYR A 23 134.435 -11.366 -0.217 1.00 0.00 H new ATOM 0 HB2 TYR A 23 133.788 -9.549 1.388 1.00 0.00 H new ATOM 0 HB3 TYR A 23 132.462 -9.091 0.338 1.00 0.00 H new ATOM 0 HD1 TYR A 23 130.558 -10.668 -0.054 1.00 0.00 H new ATOM 0 HD2 TYR A 23 133.675 -11.547 2.765 1.00 0.00 H new ATOM 0 HE1 TYR A 23 129.128 -12.410 0.982 1.00 0.00 H new ATOM 0 HE2 TYR A 23 132.245 -13.291 3.802 1.00 0.00 H new ATOM 0 HH TYR A 23 130.283 -14.356 3.774 1.00 0.00 H new ATOM 286 N THR A 24 132.316 -10.088 -2.367 1.00 0.00 N ATOM 287 CA THR A 24 131.332 -10.411 -3.384 1.00 0.00 C ATOM 288 C THR A 24 131.730 -11.688 -4.115 1.00 0.00 C ATOM 289 O THR A 24 130.867 -12.463 -4.524 1.00 0.00 O ATOM 290 CB THR A 24 131.243 -9.259 -4.379 1.00 0.00 C ATOM 291 OG1 THR A 24 131.286 -8.026 -3.671 1.00 0.00 O ATOM 292 CG2 THR A 24 129.933 -9.356 -5.163 1.00 0.00 C ATOM 0 H THR A 24 132.587 -9.105 -2.337 1.00 0.00 H new ATOM 0 HA THR A 24 130.363 -10.565 -2.909 1.00 0.00 H new ATOM 0 HB THR A 24 132.080 -9.311 -5.075 1.00 0.00 H new ATOM 0 HG1 THR A 24 130.862 -7.325 -4.209 1.00 0.00 H new ATOM 0 HG21 THR A 24 129.872 -8.531 -5.873 1.00 0.00 H new ATOM 0 HG22 THR A 24 129.901 -10.303 -5.702 1.00 0.00 H new ATOM 0 HG23 THR A 24 129.091 -9.303 -4.473 1.00 0.00 H new ATOM 297 N THR A 25 133.045 -11.873 -4.272 1.00 0.00 N ATOM 298 CA THR A 25 133.620 -13.037 -4.955 1.00 0.00 C ATOM 299 C THR A 25 134.177 -12.619 -6.307 1.00 0.00 C ATOM 300 O THR A 25 133.465 -12.613 -7.310 1.00 0.00 O ATOM 301 CB THR A 25 132.595 -14.160 -5.150 1.00 0.00 C ATOM 302 OG1 THR A 25 131.906 -14.395 -3.930 1.00 0.00 O ATOM 303 CG2 THR A 25 133.321 -15.438 -5.577 1.00 0.00 C ATOM 0 H THR A 25 133.744 -11.216 -3.927 1.00 0.00 H new ATOM 0 HA THR A 25 134.419 -13.423 -4.322 1.00 0.00 H new ATOM 0 HB THR A 25 131.879 -13.869 -5.919 1.00 0.00 H new ATOM 0 HG1 THR A 25 131.019 -13.981 -3.970 1.00 0.00 H new ATOM 0 HG21 THR A 25 132.595 -16.239 -5.717 1.00 0.00 H new ATOM 0 HG22 THR A 25 133.850 -15.260 -6.513 1.00 0.00 H new ATOM 0 HG23 THR A 25 134.035 -15.726 -4.806 1.00 0.00 H new ATOM 308 N ASN A 26 135.460 -12.276 -6.324 1.00 0.00 N ATOM 309 CA ASN A 26 136.111 -11.864 -7.561 1.00 0.00 C ATOM 310 C ASN A 26 137.109 -12.924 -8.012 1.00 0.00 C ATOM 311 O ASN A 26 136.844 -13.688 -8.940 1.00 0.00 O ATOM 312 CB ASN A 26 136.831 -10.529 -7.352 1.00 0.00 C ATOM 313 CG ASN A 26 136.998 -9.812 -8.687 1.00 0.00 C ATOM 314 OD1 ASN A 26 136.414 -10.222 -9.691 1.00 0.00 O ATOM 315 ND2 ASN A 26 137.761 -8.756 -8.759 1.00 0.00 N ATOM 0 H ASN A 26 136.065 -12.275 -5.503 1.00 0.00 H new ATOM 0 HA ASN A 26 135.351 -11.745 -8.333 1.00 0.00 H new ATOM 0 HB2 ASN A 26 136.263 -9.904 -6.663 1.00 0.00 H new ATOM 0 HB3 ASN A 26 137.807 -10.700 -6.897 1.00 0.00 H new ATOM 0 HD21 ASN A 26 137.875 -8.269 -9.648 1.00 0.00 H new ATOM 0 HD22 ASN A 26 138.244 -8.418 -7.927 1.00 0.00 H new ATOM 320 N LYS A 27 138.255 -12.968 -7.341 1.00 0.00 N ATOM 321 CA LYS A 27 139.292 -13.941 -7.670 1.00 0.00 C ATOM 322 C LYS A 27 139.736 -13.806 -9.125 1.00 0.00 C ATOM 323 O LYS A 27 139.908 -14.805 -9.822 1.00 0.00 O ATOM 324 CB LYS A 27 138.773 -15.358 -7.426 1.00 0.00 C ATOM 325 CG LYS A 27 138.476 -15.548 -5.936 1.00 0.00 C ATOM 326 CD LYS A 27 137.870 -16.934 -5.700 1.00 0.00 C ATOM 327 CE LYS A 27 138.983 -17.982 -5.617 1.00 0.00 C ATOM 328 NZ LYS A 27 138.378 -19.333 -5.445 1.00 0.00 N ATOM 0 H LYS A 27 138.489 -12.344 -6.569 1.00 0.00 H new ATOM 0 HA LYS A 27 140.151 -13.746 -7.028 1.00 0.00 H new ATOM 0 HB2 LYS A 27 137.870 -15.531 -8.012 1.00 0.00 H new ATOM 0 HB3 LYS A 27 139.512 -16.088 -7.756 1.00 0.00 H new ATOM 0 HG2 LYS A 27 139.393 -15.438 -5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 27 137.787 -14.777 -5.592 1.00 0.00 H new ATOM 0 HD2 LYS A 27 137.289 -16.934 -4.778 1.00 0.00 H new ATOM 0 HD3 LYS A 27 137.184 -17.183 -6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 27 139.591 -17.956 -6.522 1.00 0.00 H new ATOM 0 HE3 LYS A 27 139.646 -17.759 -4.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 139.132 -20.047 -5.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 137.816 -19.353 -4.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 137.763 -19.544 -6.256 1.00 0.00 H new ATOM 342 N LEU A 28 139.923 -12.570 -9.579 1.00 0.00 N ATOM 343 CA LEU A 28 140.349 -12.336 -10.956 1.00 0.00 C ATOM 344 C LEU A 28 139.610 -13.275 -11.904 1.00 0.00 C ATOM 345 O LEU A 28 140.204 -14.188 -12.480 1.00 0.00 O ATOM 346 CB LEU A 28 141.857 -12.562 -11.083 1.00 0.00 C ATOM 347 CG LEU A 28 142.368 -11.882 -12.353 1.00 0.00 C ATOM 348 CD1 LEU A 28 142.823 -10.459 -12.023 1.00 0.00 C ATOM 349 CD2 LEU A 28 143.551 -12.675 -12.915 1.00 0.00 C ATOM 0 H LEU A 28 139.789 -11.725 -9.023 1.00 0.00 H new ATOM 0 HA LEU A 28 140.115 -11.305 -11.222 1.00 0.00 H new ATOM 0 HB2 LEU A 28 142.371 -12.159 -10.210 1.00 0.00 H new ATOM 0 HB3 LEU A 28 142.074 -13.630 -11.117 1.00 0.00 H new ATOM 0 HG LEU A 28 141.568 -11.846 -13.092 1.00 0.00 H new ATOM 0 HD11 LEU A 28 143.187 -9.974 -12.929 1.00 0.00 H new ATOM 0 HD12 LEU A 28 141.983 -9.892 -11.621 1.00 0.00 H new ATOM 0 HD13 LEU A 28 143.623 -10.495 -11.284 1.00 0.00 H new ATOM 0 HD21 LEU A 28 143.916 -12.191 -13.821 1.00 0.00 H new ATOM 0 HD22 LEU A 28 144.350 -12.710 -12.175 1.00 0.00 H new ATOM 0 HD23 LEU A 28 143.230 -13.690 -13.150 1.00 0.00 H new ATOM 355 N PRO A 29 138.333 -13.068 -12.062 1.00 0.00 N ATOM 356 CA PRO A 29 137.477 -13.910 -12.945 1.00 0.00 C ATOM 357 C PRO A 29 137.595 -13.524 -14.418 1.00 0.00 C ATOM 358 O PRO A 29 137.964 -12.398 -14.750 1.00 0.00 O ATOM 359 CB PRO A 29 136.067 -13.642 -12.422 1.00 0.00 C ATOM 360 CG PRO A 29 136.111 -12.264 -11.842 1.00 0.00 C ATOM 361 CD PRO A 29 137.559 -12.000 -11.413 1.00 0.00 C ATOM 0 HA PRO A 29 137.764 -14.961 -12.914 1.00 0.00 H new ATOM 0 HB2 PRO A 29 135.332 -13.707 -13.224 1.00 0.00 H new ATOM 0 HB3 PRO A 29 135.782 -14.376 -11.668 1.00 0.00 H new ATOM 0 HG2 PRO A 29 135.787 -11.527 -12.576 1.00 0.00 H new ATOM 0 HG3 PRO A 29 135.436 -12.183 -10.990 1.00 0.00 H new ATOM 0 HD2 PRO A 29 137.895 -11.014 -11.734 1.00 0.00 H new ATOM 0 HD3 PRO A 29 137.665 -12.035 -10.329 1.00 0.00 H new ATOM 369 N SER A 30 137.268 -14.470 -15.294 1.00 0.00 N ATOM 370 CA SER A 30 137.329 -14.228 -16.731 1.00 0.00 C ATOM 371 C SER A 30 136.459 -13.032 -17.104 1.00 0.00 C ATOM 372 O SER A 30 136.723 -12.343 -18.089 1.00 0.00 O ATOM 373 CB SER A 30 136.850 -15.465 -17.491 1.00 0.00 C ATOM 374 OG SER A 30 137.600 -16.596 -17.066 1.00 0.00 O ATOM 0 H SER A 30 136.959 -15.407 -15.035 1.00 0.00 H new ATOM 0 HA SER A 30 138.363 -14.015 -17.003 1.00 0.00 H new ATOM 0 HB2 SER A 30 135.788 -15.629 -17.309 1.00 0.00 H new ATOM 0 HB3 SER A 30 136.971 -15.316 -18.564 1.00 0.00 H new ATOM 0 HG SER A 30 137.295 -17.392 -17.550 1.00 0.00 H new ATOM 380 N GLU A 31 135.420 -12.797 -16.310 1.00 0.00 N ATOM 381 CA GLU A 31 134.513 -11.684 -16.562 1.00 0.00 C ATOM 382 C GLU A 31 135.283 -10.368 -16.576 1.00 0.00 C ATOM 383 O GLU A 31 134.711 -9.307 -16.822 1.00 0.00 O ATOM 384 CB GLU A 31 133.433 -11.637 -15.477 1.00 0.00 C ATOM 385 CG GLU A 31 132.643 -12.948 -15.483 1.00 0.00 C ATOM 386 CD GLU A 31 131.906 -13.112 -16.808 1.00 0.00 C ATOM 387 OE1 GLU A 31 131.764 -12.125 -17.511 1.00 0.00 O ATOM 388 OE2 GLU A 31 131.491 -14.222 -17.098 1.00 0.00 O ATOM 0 H GLU A 31 135.186 -13.359 -15.491 1.00 0.00 H new ATOM 0 HA GLU A 31 134.042 -11.829 -17.534 1.00 0.00 H new ATOM 0 HB2 GLU A 31 133.891 -11.481 -14.500 1.00 0.00 H new ATOM 0 HB3 GLU A 31 132.763 -10.796 -15.653 1.00 0.00 H new ATOM 0 HG2 GLU A 31 133.319 -13.789 -15.328 1.00 0.00 H new ATOM 0 HG3 GLU A 31 131.930 -12.955 -14.658 1.00 0.00 H new ATOM 395 N TYR A 32 136.585 -10.456 -16.308 1.00 0.00 N ATOM 396 CA TYR A 32 137.457 -9.283 -16.289 1.00 0.00 C ATOM 397 C TYR A 32 137.157 -8.394 -15.087 1.00 0.00 C ATOM 398 O TYR A 32 137.353 -8.802 -13.941 1.00 0.00 O ATOM 399 CB TYR A 32 137.310 -8.481 -17.587 1.00 0.00 C ATOM 400 CG TYR A 32 137.434 -9.414 -18.766 1.00 0.00 C ATOM 401 CD1 TYR A 32 138.690 -9.909 -19.137 1.00 0.00 C ATOM 402 CD2 TYR A 32 136.293 -9.787 -19.488 1.00 0.00 C ATOM 403 CE1 TYR A 32 138.806 -10.777 -20.230 1.00 0.00 C ATOM 404 CE2 TYR A 32 136.409 -10.655 -20.581 1.00 0.00 C ATOM 405 CZ TYR A 32 137.665 -11.149 -20.951 1.00 0.00 C ATOM 406 OH TYR A 32 137.779 -12.006 -22.027 1.00 0.00 O ATOM 0 H TYR A 32 137.061 -11.334 -16.100 1.00 0.00 H new ATOM 0 HA TYR A 32 138.486 -9.634 -16.206 1.00 0.00 H new ATOM 0 HB2 TYR A 32 136.344 -7.976 -17.608 1.00 0.00 H new ATOM 0 HB3 TYR A 32 138.076 -7.707 -17.639 1.00 0.00 H new ATOM 0 HD1 TYR A 32 139.570 -9.621 -18.580 1.00 0.00 H new ATOM 0 HD2 TYR A 32 135.324 -9.405 -19.202 1.00 0.00 H new ATOM 0 HE1 TYR A 32 139.775 -11.159 -20.516 1.00 0.00 H new ATOM 0 HE2 TYR A 32 135.530 -10.943 -21.138 1.00 0.00 H new ATOM 0 HH TYR A 32 136.893 -12.163 -22.416 1.00 0.00 H new ATOM 416 N VAL A 33 136.697 -7.174 -15.347 1.00 0.00 N ATOM 417 CA VAL A 33 136.395 -6.242 -14.266 1.00 0.00 C ATOM 418 C VAL A 33 134.963 -5.722 -14.360 1.00 0.00 C ATOM 419 O VAL A 33 134.729 -4.602 -14.815 1.00 0.00 O ATOM 420 CB VAL A 33 137.367 -5.062 -14.317 1.00 0.00 C ATOM 421 CG1 VAL A 33 137.299 -4.405 -15.697 1.00 0.00 C ATOM 422 CG2 VAL A 33 136.980 -4.036 -13.250 1.00 0.00 C ATOM 0 H VAL A 33 136.527 -6.811 -16.285 1.00 0.00 H new ATOM 0 HA VAL A 33 136.503 -6.776 -13.322 1.00 0.00 H new ATOM 0 HB VAL A 33 138.380 -5.419 -14.131 1.00 0.00 H new ATOM 0 HG11 VAL A 33 137.991 -3.564 -15.734 1.00 0.00 H new ATOM 0 HG12 VAL A 33 137.572 -5.133 -16.461 1.00 0.00 H new ATOM 0 HG13 VAL A 33 136.285 -4.049 -15.881 1.00 0.00 H new ATOM 0 HG21 VAL A 33 137.672 -3.195 -13.286 1.00 0.00 H new ATOM 0 HG22 VAL A 33 135.967 -3.680 -13.438 1.00 0.00 H new ATOM 0 HG23 VAL A 33 137.025 -4.501 -12.265 1.00 0.00 H new ATOM 426 N PRO A 34 134.012 -6.503 -13.923 1.00 0.00 N ATOM 427 CA PRO A 34 132.574 -6.107 -13.939 1.00 0.00 C ATOM 428 C PRO A 34 132.341 -4.830 -13.136 1.00 0.00 C ATOM 429 O PRO A 34 133.101 -4.522 -12.219 1.00 0.00 O ATOM 430 CB PRO A 34 131.846 -7.293 -13.297 1.00 0.00 C ATOM 431 CG PRO A 34 132.796 -8.443 -13.368 1.00 0.00 C ATOM 432 CD PRO A 34 134.204 -7.849 -13.367 1.00 0.00 C ATOM 0 HA PRO A 34 132.219 -5.893 -14.947 1.00 0.00 H new ATOM 0 HB2 PRO A 34 131.576 -7.073 -12.264 1.00 0.00 H new ATOM 0 HB3 PRO A 34 130.921 -7.517 -13.828 1.00 0.00 H new ATOM 0 HG2 PRO A 34 132.658 -9.112 -12.519 1.00 0.00 H new ATOM 0 HG3 PRO A 34 132.625 -9.032 -14.269 1.00 0.00 H new ATOM 0 HD2 PRO A 34 134.622 -7.811 -12.361 1.00 0.00 H new ATOM 0 HD3 PRO A 34 134.889 -8.440 -13.975 1.00 0.00 H new ATOM 440 N THR A 35 131.292 -4.092 -13.480 1.00 0.00 N ATOM 441 CA THR A 35 130.992 -2.853 -12.769 1.00 0.00 C ATOM 442 C THR A 35 129.530 -2.812 -12.337 1.00 0.00 C ATOM 443 O THR A 35 128.651 -3.337 -13.020 1.00 0.00 O ATOM 444 CB THR A 35 131.291 -1.651 -13.667 1.00 0.00 C ATOM 445 OG1 THR A 35 131.325 -0.470 -12.879 1.00 0.00 O ATOM 446 CG2 THR A 35 130.202 -1.524 -14.736 1.00 0.00 C ATOM 0 H THR A 35 130.644 -4.323 -14.233 1.00 0.00 H new ATOM 0 HA THR A 35 131.620 -2.812 -11.879 1.00 0.00 H new ATOM 0 HB THR A 35 132.257 -1.792 -14.152 1.00 0.00 H new ATOM 0 HG1 THR A 35 131.518 0.301 -13.453 1.00 0.00 H new ATOM 0 HG21 THR A 35 130.417 -0.667 -15.374 1.00 0.00 H new ATOM 0 HG22 THR A 35 130.178 -2.430 -15.341 1.00 0.00 H new ATOM 0 HG23 THR A 35 129.234 -1.384 -14.255 1.00 0.00 H new ATOM 451 N VAL A 36 129.284 -2.173 -11.198 1.00 0.00 N ATOM 452 CA VAL A 36 127.931 -2.049 -10.671 1.00 0.00 C ATOM 453 C VAL A 36 127.651 -0.598 -10.292 1.00 0.00 C ATOM 454 O VAL A 36 128.520 0.089 -9.754 1.00 0.00 O ATOM 455 CB VAL A 36 127.759 -2.950 -9.446 1.00 0.00 C ATOM 456 CG1 VAL A 36 126.299 -2.930 -8.990 1.00 0.00 C ATOM 457 CG2 VAL A 36 128.155 -4.383 -9.811 1.00 0.00 C ATOM 0 H VAL A 36 130.003 -1.734 -10.623 1.00 0.00 H new ATOM 0 HA VAL A 36 127.223 -2.359 -11.440 1.00 0.00 H new ATOM 0 HB VAL A 36 128.395 -2.586 -8.639 1.00 0.00 H new ATOM 0 HG11 VAL A 36 126.181 -3.573 -8.118 1.00 0.00 H new ATOM 0 HG12 VAL A 36 126.013 -1.911 -8.731 1.00 0.00 H new ATOM 0 HG13 VAL A 36 125.661 -3.292 -9.796 1.00 0.00 H new ATOM 0 HG21 VAL A 36 128.033 -5.027 -8.940 1.00 0.00 H new ATOM 0 HG22 VAL A 36 127.518 -4.742 -10.619 1.00 0.00 H new ATOM 0 HG23 VAL A 36 129.196 -4.402 -10.134 1.00 0.00 H new ATOM 461 N PHE A 37 126.440 -0.133 -10.578 1.00 0.00 N ATOM 462 CA PHE A 37 126.076 1.244 -10.262 1.00 0.00 C ATOM 463 C PHE A 37 125.352 1.319 -8.920 1.00 0.00 C ATOM 464 O PHE A 37 124.465 0.513 -8.634 1.00 0.00 O ATOM 465 CB PHE A 37 125.186 1.818 -11.367 1.00 0.00 C ATOM 466 CG PHE A 37 124.973 3.293 -11.125 1.00 0.00 C ATOM 467 CD1 PHE A 37 126.002 4.202 -11.404 1.00 0.00 C ATOM 468 CD2 PHE A 37 123.749 3.753 -10.627 1.00 0.00 C ATOM 469 CE1 PHE A 37 125.806 5.570 -11.181 1.00 0.00 C ATOM 470 CE2 PHE A 37 123.553 5.120 -10.407 1.00 0.00 C ATOM 471 CZ PHE A 37 124.582 6.030 -10.683 1.00 0.00 C ATOM 0 H PHE A 37 125.702 -0.680 -11.022 1.00 0.00 H new ATOM 0 HA PHE A 37 126.990 1.833 -10.194 1.00 0.00 H new ATOM 0 HB2 PHE A 37 125.650 1.661 -12.341 1.00 0.00 H new ATOM 0 HB3 PHE A 37 124.228 1.299 -11.383 1.00 0.00 H new ATOM 0 HD1 PHE A 37 126.946 3.847 -11.791 1.00 0.00 H new ATOM 0 HD2 PHE A 37 122.956 3.052 -10.413 1.00 0.00 H new ATOM 0 HE1 PHE A 37 126.600 6.271 -11.393 1.00 0.00 H new ATOM 0 HE2 PHE A 37 122.608 5.475 -10.024 1.00 0.00 H new ATOM 0 HZ PHE A 37 124.431 7.085 -10.512 1.00 0.00 H new ATOM 481 N ASP A 38 125.746 2.290 -8.100 1.00 0.00 N ATOM 482 CA ASP A 38 125.142 2.476 -6.783 1.00 0.00 C ATOM 483 C ASP A 38 125.309 1.230 -5.918 1.00 0.00 C ATOM 484 O ASP A 38 124.364 0.789 -5.263 1.00 0.00 O ATOM 485 CB ASP A 38 123.653 2.800 -6.924 1.00 0.00 C ATOM 486 CG ASP A 38 123.472 4.147 -7.615 1.00 0.00 C ATOM 487 OD1 ASP A 38 124.456 4.855 -7.757 1.00 0.00 O ATOM 488 OD2 ASP A 38 122.352 4.451 -7.990 1.00 0.00 O ATOM 0 H ASP A 38 126.481 2.961 -8.324 1.00 0.00 H new ATOM 0 HA ASP A 38 125.653 3.308 -6.298 1.00 0.00 H new ATOM 0 HB2 ASP A 38 123.156 2.018 -7.498 1.00 0.00 H new ATOM 0 HB3 ASP A 38 123.183 2.821 -5.941 1.00 0.00 H new ATOM 493 N ASN A 39 126.513 0.665 -5.913 1.00 0.00 N ATOM 494 CA ASN A 39 126.780 -0.528 -5.115 1.00 0.00 C ATOM 495 C ASN A 39 127.440 -0.150 -3.791 1.00 0.00 C ATOM 496 O ASN A 39 128.483 0.504 -3.770 1.00 0.00 O ATOM 497 CB ASN A 39 127.689 -1.484 -5.888 1.00 0.00 C ATOM 498 CG ASN A 39 127.709 -2.850 -5.211 1.00 0.00 C ATOM 499 OD1 ASN A 39 127.170 -3.010 -4.115 1.00 0.00 O ATOM 500 ND2 ASN A 39 128.298 -3.855 -5.802 1.00 0.00 N ATOM 0 H ASN A 39 127.312 1.009 -6.446 1.00 0.00 H new ATOM 0 HA ASN A 39 125.831 -1.022 -4.907 1.00 0.00 H new ATOM 0 HB2 ASN A 39 127.336 -1.583 -6.915 1.00 0.00 H new ATOM 0 HB3 ASN A 39 128.700 -1.078 -5.936 1.00 0.00 H new ATOM 0 HD21 ASN A 39 128.312 -4.772 -5.356 1.00 0.00 H new ATOM 0 HD22 ASN A 39 128.744 -3.723 -6.710 1.00 0.00 H new ATOM 505 N TYR A 40 126.822 -0.569 -2.693 1.00 0.00 N ATOM 506 CA TYR A 40 127.342 -0.278 -1.368 1.00 0.00 C ATOM 507 C TYR A 40 126.652 -1.172 -0.343 1.00 0.00 C ATOM 508 O TYR A 40 127.305 -1.809 0.484 1.00 0.00 O ATOM 509 CB TYR A 40 127.096 1.197 -1.028 1.00 0.00 C ATOM 510 CG TYR A 40 125.641 1.400 -0.671 1.00 0.00 C ATOM 511 CD1 TYR A 40 124.673 1.436 -1.682 1.00 0.00 C ATOM 512 CD2 TYR A 40 125.257 1.548 0.669 1.00 0.00 C ATOM 513 CE1 TYR A 40 123.324 1.620 -1.356 1.00 0.00 C ATOM 514 CE2 TYR A 40 123.907 1.731 0.995 1.00 0.00 C ATOM 515 CZ TYR A 40 122.941 1.768 -0.017 1.00 0.00 C ATOM 516 OH TYR A 40 121.610 1.949 0.304 1.00 0.00 O ATOM 0 H TYR A 40 125.959 -1.112 -2.697 1.00 0.00 H new ATOM 0 HA TYR A 40 128.414 -0.472 -1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 40 127.731 1.499 -0.195 1.00 0.00 H new ATOM 0 HB3 TYR A 40 127.364 1.826 -1.877 1.00 0.00 H new ATOM 0 HD1 TYR A 40 124.967 1.322 -2.715 1.00 0.00 H new ATOM 0 HD2 TYR A 40 126.002 1.521 1.450 1.00 0.00 H new ATOM 0 HE1 TYR A 40 122.579 1.648 -2.137 1.00 0.00 H new ATOM 0 HE2 TYR A 40 123.612 1.844 2.028 1.00 0.00 H new ATOM 0 HH TYR A 40 121.516 2.034 1.276 1.00 0.00 H new ATOM 526 N ALA A 41 125.326 -1.219 -0.417 1.00 0.00 N ATOM 527 CA ALA A 41 124.543 -2.035 0.493 1.00 0.00 C ATOM 528 C ALA A 41 124.590 -3.498 0.077 1.00 0.00 C ATOM 529 O ALA A 41 123.926 -3.914 -0.873 1.00 0.00 O ATOM 530 CB ALA A 41 123.091 -1.554 0.505 1.00 0.00 C ATOM 0 H ALA A 41 124.774 -0.700 -1.100 1.00 0.00 H new ATOM 0 HA ALA A 41 124.967 -1.940 1.492 1.00 0.00 H new ATOM 0 HB1 ALA A 41 122.509 -2.171 1.190 1.00 0.00 H new ATOM 0 HB2 ALA A 41 123.055 -0.515 0.832 1.00 0.00 H new ATOM 0 HB3 ALA A 41 122.673 -1.633 -0.499 1.00 0.00 H new ATOM 536 N VAL A 42 125.368 -4.269 0.814 1.00 0.00 N ATOM 537 CA VAL A 42 125.499 -5.694 0.556 1.00 0.00 C ATOM 538 C VAL A 42 125.285 -6.461 1.850 1.00 0.00 C ATOM 539 O VAL A 42 125.928 -6.183 2.863 1.00 0.00 O ATOM 540 CB VAL A 42 126.884 -6.013 -0.004 1.00 0.00 C ATOM 541 CG1 VAL A 42 126.930 -7.477 -0.445 1.00 0.00 C ATOM 542 CG2 VAL A 42 127.173 -5.109 -1.205 1.00 0.00 C ATOM 0 H VAL A 42 125.922 -3.931 1.601 1.00 0.00 H new ATOM 0 HA VAL A 42 124.750 -5.989 -0.179 1.00 0.00 H new ATOM 0 HB VAL A 42 127.635 -5.841 0.767 1.00 0.00 H new ATOM 0 HG11 VAL A 42 127.918 -7.706 -0.845 1.00 0.00 H new ATOM 0 HG12 VAL A 42 126.727 -8.121 0.410 1.00 0.00 H new ATOM 0 HG13 VAL A 42 126.178 -7.649 -1.215 1.00 0.00 H new ATOM 0 HG21 VAL A 42 128.161 -5.338 -1.603 1.00 0.00 H new ATOM 0 HG22 VAL A 42 126.423 -5.279 -1.977 1.00 0.00 H new ATOM 0 HG23 VAL A 42 127.141 -4.066 -0.891 1.00 0.00 H new ATOM 546 N THR A 43 124.368 -7.409 1.817 1.00 0.00 N ATOM 547 CA THR A 43 124.055 -8.191 3.003 1.00 0.00 C ATOM 548 C THR A 43 125.043 -9.338 3.196 1.00 0.00 C ATOM 549 O THR A 43 125.278 -10.137 2.291 1.00 0.00 O ATOM 550 CB THR A 43 122.632 -8.728 2.890 1.00 0.00 C ATOM 551 OG1 THR A 43 122.227 -9.270 4.138 1.00 0.00 O ATOM 552 CG2 THR A 43 122.571 -9.811 1.813 1.00 0.00 C ATOM 0 H THR A 43 123.828 -7.657 0.988 1.00 0.00 H new ATOM 0 HA THR A 43 124.136 -7.543 3.876 1.00 0.00 H new ATOM 0 HB THR A 43 121.961 -7.914 2.616 1.00 0.00 H new ATOM 0 HG1 THR A 43 121.312 -9.613 4.064 1.00 0.00 H new ATOM 0 HG21 THR A 43 121.552 -10.191 1.737 1.00 0.00 H new ATOM 0 HG22 THR A 43 122.874 -9.389 0.855 1.00 0.00 H new ATOM 0 HG23 THR A 43 123.244 -10.627 2.079 1.00 0.00 H new ATOM 557 N VAL A 44 125.615 -9.400 4.395 1.00 0.00 N ATOM 558 CA VAL A 44 126.580 -10.440 4.731 1.00 0.00 C ATOM 559 C VAL A 44 126.327 -10.971 6.140 1.00 0.00 C ATOM 560 O VAL A 44 125.983 -10.212 7.046 1.00 0.00 O ATOM 561 CB VAL A 44 127.997 -9.876 4.646 1.00 0.00 C ATOM 562 CG1 VAL A 44 128.157 -8.753 5.674 1.00 0.00 C ATOM 563 CG2 VAL A 44 129.006 -10.987 4.945 1.00 0.00 C ATOM 0 H VAL A 44 125.426 -8.741 5.150 1.00 0.00 H new ATOM 0 HA VAL A 44 126.468 -11.259 4.021 1.00 0.00 H new ATOM 0 HB VAL A 44 128.175 -9.484 3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 44 129.167 -8.348 5.616 1.00 0.00 H new ATOM 0 HG12 VAL A 44 127.437 -7.962 5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 44 127.981 -9.148 6.675 1.00 0.00 H new ATOM 0 HG21 VAL A 44 130.018 -10.586 4.885 1.00 0.00 H new ATOM 0 HG22 VAL A 44 128.830 -11.378 5.947 1.00 0.00 H new ATOM 0 HG23 VAL A 44 128.890 -11.790 4.217 1.00 0.00 H new ATOM 567 N MET A 45 126.507 -12.275 6.318 1.00 0.00 N ATOM 568 CA MET A 45 126.304 -12.900 7.623 1.00 0.00 C ATOM 569 C MET A 45 127.326 -14.011 7.835 1.00 0.00 C ATOM 570 O MET A 45 127.624 -14.770 6.915 1.00 0.00 O ATOM 571 CB MET A 45 124.876 -13.462 7.712 1.00 0.00 C ATOM 572 CG MET A 45 124.874 -14.970 7.437 1.00 0.00 C ATOM 573 SD MET A 45 123.165 -15.548 7.278 1.00 0.00 S ATOM 574 CE MET A 45 122.801 -14.782 5.678 1.00 0.00 C ATOM 0 H MET A 45 126.792 -12.919 5.580 1.00 0.00 H new ATOM 0 HA MET A 45 126.438 -12.152 8.404 1.00 0.00 H new ATOM 0 HB2 MET A 45 124.463 -13.266 8.702 1.00 0.00 H new ATOM 0 HB3 MET A 45 124.234 -12.954 6.992 1.00 0.00 H new ATOM 0 HG2 MET A 45 125.429 -15.185 6.524 1.00 0.00 H new ATOM 0 HG3 MET A 45 125.375 -15.500 8.247 1.00 0.00 H new ATOM 0 HE1 MET A 45 122.083 -15.397 5.135 1.00 0.00 H new ATOM 0 HE2 MET A 45 122.381 -13.789 5.837 1.00 0.00 H new ATOM 0 HE3 MET A 45 123.720 -14.698 5.097 1.00 0.00 H new ATOM 584 N ILE A 46 127.841 -14.123 9.058 1.00 0.00 N ATOM 585 CA ILE A 46 128.808 -15.173 9.368 1.00 0.00 C ATOM 586 C ILE A 46 128.270 -16.076 10.470 1.00 0.00 C ATOM 587 O ILE A 46 128.303 -15.706 11.643 1.00 0.00 O ATOM 588 CB ILE A 46 130.133 -14.560 9.829 1.00 0.00 C ATOM 589 CG1 ILE A 46 130.679 -13.612 8.756 1.00 0.00 C ATOM 590 CG2 ILE A 46 131.151 -15.674 10.089 1.00 0.00 C ATOM 591 CD1 ILE A 46 130.785 -14.339 7.412 1.00 0.00 C ATOM 0 H ILE A 46 127.609 -13.510 9.839 1.00 0.00 H new ATOM 0 HA ILE A 46 128.975 -15.759 8.464 1.00 0.00 H new ATOM 0 HB ILE A 46 129.961 -13.998 10.747 1.00 0.00 H new ATOM 0 HG12 ILE A 46 130.024 -12.746 8.659 1.00 0.00 H new ATOM 0 HG13 ILE A 46 131.659 -13.239 9.054 1.00 0.00 H new ATOM 0 HG21 ILE A 46 132.094 -15.236 10.417 1.00 0.00 H new ATOM 0 HG22 ILE A 46 130.771 -16.340 10.864 1.00 0.00 H new ATOM 0 HG23 ILE A 46 131.314 -16.240 9.172 1.00 0.00 H new ATOM 0 HD11 ILE A 46 131.174 -13.655 6.658 1.00 0.00 H new ATOM 0 HD12 ILE A 46 131.458 -15.191 7.511 1.00 0.00 H new ATOM 0 HD13 ILE A 46 129.798 -14.690 7.109 1.00 0.00 H new ATOM 595 N GLY A 47 127.794 -17.261 10.078 1.00 0.00 N ATOM 596 CA GLY A 47 127.252 -18.236 11.028 1.00 0.00 C ATOM 597 C GLY A 47 126.830 -17.578 12.338 1.00 0.00 C ATOM 598 O GLY A 47 127.112 -18.092 13.420 1.00 0.00 O ATOM 0 H GLY A 47 127.773 -17.569 9.106 1.00 0.00 H new ATOM 0 HA2 GLY A 47 126.395 -18.740 10.582 1.00 0.00 H new ATOM 0 HA3 GLY A 47 128.001 -19.001 11.231 1.00 0.00 H new ATOM 602 N GLY A 48 126.162 -16.433 12.235 1.00 0.00 N ATOM 603 CA GLY A 48 125.721 -15.713 13.424 1.00 0.00 C ATOM 604 C GLY A 48 124.459 -14.905 13.148 1.00 0.00 C ATOM 605 O GLY A 48 123.362 -15.301 13.542 1.00 0.00 O ATOM 0 H GLY A 48 125.916 -15.988 11.351 1.00 0.00 H new ATOM 0 HA2 GLY A 48 125.532 -16.421 14.231 1.00 0.00 H new ATOM 0 HA3 GLY A 48 126.514 -15.047 13.763 1.00 0.00 H new ATOM 609 N GLU A 49 124.619 -13.770 12.470 1.00 0.00 N ATOM 610 CA GLU A 49 123.479 -12.918 12.152 1.00 0.00 C ATOM 611 C GLU A 49 123.765 -12.093 10.897 1.00 0.00 C ATOM 612 O GLU A 49 124.924 -11.946 10.498 1.00 0.00 O ATOM 613 CB GLU A 49 123.183 -11.984 13.328 1.00 0.00 C ATOM 614 CG GLU A 49 121.978 -12.510 14.111 1.00 0.00 C ATOM 615 CD GLU A 49 121.807 -11.712 15.398 1.00 0.00 C ATOM 616 OE1 GLU A 49 122.703 -10.950 15.725 1.00 0.00 O ATOM 617 OE2 GLU A 49 120.782 -11.874 16.040 1.00 0.00 O ATOM 0 H GLU A 49 125.517 -13.423 12.134 1.00 0.00 H new ATOM 0 HA GLU A 49 122.611 -13.551 11.967 1.00 0.00 H new ATOM 0 HB2 GLU A 49 124.053 -11.918 13.981 1.00 0.00 H new ATOM 0 HB3 GLU A 49 122.981 -10.977 12.964 1.00 0.00 H new ATOM 0 HG2 GLU A 49 121.077 -12.433 13.503 1.00 0.00 H new ATOM 0 HG3 GLU A 49 122.117 -13.566 14.343 1.00 0.00 H new ATOM 624 N PRO A 50 122.743 -11.559 10.268 1.00 0.00 N ATOM 625 CA PRO A 50 122.894 -10.738 9.035 1.00 0.00 C ATOM 626 C PRO A 50 123.211 -9.269 9.324 1.00 0.00 C ATOM 627 O PRO A 50 122.634 -8.658 10.224 1.00 0.00 O ATOM 628 CB PRO A 50 121.526 -10.866 8.376 1.00 0.00 C ATOM 629 CG PRO A 50 120.570 -10.971 9.518 1.00 0.00 C ATOM 630 CD PRO A 50 121.321 -11.677 10.652 1.00 0.00 C ATOM 0 HA PRO A 50 123.727 -11.079 8.420 1.00 0.00 H new ATOM 0 HB2 PRO A 50 121.304 -10.001 7.751 1.00 0.00 H new ATOM 0 HB3 PRO A 50 121.475 -11.745 7.734 1.00 0.00 H new ATOM 0 HG2 PRO A 50 120.232 -9.984 9.833 1.00 0.00 H new ATOM 0 HG3 PRO A 50 119.683 -11.535 9.230 1.00 0.00 H new ATOM 0 HD2 PRO A 50 121.127 -11.203 11.614 1.00 0.00 H new ATOM 0 HD3 PRO A 50 121.017 -12.720 10.743 1.00 0.00 H new ATOM 638 N TYR A 51 124.113 -8.712 8.527 1.00 0.00 N ATOM 639 CA TYR A 51 124.504 -7.311 8.651 1.00 0.00 C ATOM 640 C TYR A 51 124.959 -6.825 7.280 1.00 0.00 C ATOM 641 O TYR A 51 125.295 -7.646 6.429 1.00 0.00 O ATOM 642 CB TYR A 51 125.646 -7.162 9.657 1.00 0.00 C ATOM 643 CG TYR A 51 125.284 -7.848 10.955 1.00 0.00 C ATOM 644 CD1 TYR A 51 125.562 -9.208 11.132 1.00 0.00 C ATOM 645 CD2 TYR A 51 124.673 -7.122 11.983 1.00 0.00 C ATOM 646 CE1 TYR A 51 125.230 -9.840 12.336 1.00 0.00 C ATOM 647 CE2 TYR A 51 124.340 -7.753 13.187 1.00 0.00 C ATOM 648 CZ TYR A 51 124.619 -9.112 13.363 1.00 0.00 C ATOM 649 OH TYR A 51 124.291 -9.732 14.552 1.00 0.00 O ATOM 0 H TYR A 51 124.593 -9.214 7.780 1.00 0.00 H new ATOM 0 HA TYR A 51 123.659 -6.721 9.006 1.00 0.00 H new ATOM 0 HB2 TYR A 51 126.559 -7.595 9.250 1.00 0.00 H new ATOM 0 HB3 TYR A 51 125.847 -6.106 9.838 1.00 0.00 H new ATOM 0 HD1 TYR A 51 126.033 -9.770 10.339 1.00 0.00 H new ATOM 0 HD2 TYR A 51 124.458 -6.072 11.847 1.00 0.00 H new ATOM 0 HE1 TYR A 51 125.445 -10.889 12.472 1.00 0.00 H new ATOM 0 HE2 TYR A 51 123.868 -7.191 13.979 1.00 0.00 H new ATOM 0 HH TYR A 51 123.316 -9.775 14.640 1.00 0.00 H new ATOM 659 N THR A 52 124.976 -5.513 7.037 1.00 0.00 N ATOM 660 CA THR A 52 125.406 -5.027 5.725 1.00 0.00 C ATOM 661 C THR A 52 126.359 -3.837 5.846 1.00 0.00 C ATOM 662 O THR A 52 126.160 -2.951 6.677 1.00 0.00 O ATOM 663 CB THR A 52 124.183 -4.614 4.894 1.00 0.00 C ATOM 664 OG1 THR A 52 123.998 -3.210 4.985 1.00 0.00 O ATOM 665 CG2 THR A 52 122.933 -5.329 5.416 1.00 0.00 C ATOM 0 H THR A 52 124.707 -4.790 7.705 1.00 0.00 H new ATOM 0 HA THR A 52 125.938 -5.840 5.231 1.00 0.00 H new ATOM 0 HB THR A 52 124.348 -4.893 3.853 1.00 0.00 H new ATOM 0 HG1 THR A 52 123.218 -2.948 4.453 1.00 0.00 H new ATOM 0 HG21 THR A 52 122.069 -5.031 4.822 1.00 0.00 H new ATOM 0 HG22 THR A 52 123.072 -6.407 5.339 1.00 0.00 H new ATOM 0 HG23 THR A 52 122.767 -5.058 6.459 1.00 0.00 H new ATOM 670 N LEU A 53 127.381 -3.816 4.991 1.00 0.00 N ATOM 671 CA LEU A 53 128.345 -2.720 4.988 1.00 0.00 C ATOM 672 C LEU A 53 128.162 -1.881 3.724 1.00 0.00 C ATOM 673 O LEU A 53 127.930 -2.420 2.642 1.00 0.00 O ATOM 674 CB LEU A 53 129.775 -3.266 5.046 1.00 0.00 C ATOM 675 CG LEU A 53 129.947 -4.376 4.007 1.00 0.00 C ATOM 676 CD1 LEU A 53 131.404 -4.410 3.539 1.00 0.00 C ATOM 677 CD2 LEU A 53 129.585 -5.726 4.633 1.00 0.00 C ATOM 0 H LEU A 53 127.561 -4.541 4.296 1.00 0.00 H new ATOM 0 HA LEU A 53 128.174 -2.097 5.866 1.00 0.00 H new ATOM 0 HB2 LEU A 53 130.488 -2.464 4.857 1.00 0.00 H new ATOM 0 HB3 LEU A 53 129.987 -3.652 6.043 1.00 0.00 H new ATOM 0 HG LEU A 53 129.292 -4.182 3.158 1.00 0.00 H new ATOM 0 HD11 LEU A 53 131.530 -5.200 2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 53 131.666 -3.450 3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 53 132.055 -4.604 4.391 1.00 0.00 H new ATOM 0 HD21 LEU A 53 129.708 -6.516 3.892 1.00 0.00 H new ATOM 0 HD22 LEU A 53 130.240 -5.921 5.482 1.00 0.00 H new ATOM 0 HD23 LEU A 53 128.549 -5.704 4.971 1.00 0.00 H new ATOM 683 N GLY A 54 128.248 -0.561 3.865 1.00 0.00 N ATOM 684 CA GLY A 54 128.070 0.329 2.720 1.00 0.00 C ATOM 685 C GLY A 54 129.399 0.668 2.049 1.00 0.00 C ATOM 686 O GLY A 54 130.286 1.249 2.672 1.00 0.00 O ATOM 0 H GLY A 54 128.437 -0.088 4.749 1.00 0.00 H new ATOM 0 HA2 GLY A 54 127.407 -0.142 1.994 1.00 0.00 H new ATOM 0 HA3 GLY A 54 127.584 1.248 3.047 1.00 0.00 H new ATOM 690 N LEU A 55 129.526 0.322 0.767 1.00 0.00 N ATOM 691 CA LEU A 55 130.754 0.623 0.029 1.00 0.00 C ATOM 692 C LEU A 55 130.459 1.622 -1.086 1.00 0.00 C ATOM 693 O LEU A 55 129.577 1.395 -1.912 1.00 0.00 O ATOM 694 CB LEU A 55 131.342 -0.661 -0.561 1.00 0.00 C ATOM 695 CG LEU A 55 131.562 -1.684 0.556 1.00 0.00 C ATOM 696 CD1 LEU A 55 132.244 -2.928 -0.016 1.00 0.00 C ATOM 697 CD2 LEU A 55 132.450 -1.074 1.646 1.00 0.00 C ATOM 0 H LEU A 55 128.807 -0.159 0.226 1.00 0.00 H new ATOM 0 HA LEU A 55 131.480 1.060 0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 55 130.668 -1.069 -1.314 1.00 0.00 H new ATOM 0 HB3 LEU A 55 132.286 -0.445 -1.061 1.00 0.00 H new ATOM 0 HG LEU A 55 130.599 -1.961 0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 55 132.400 -3.656 0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 55 131.613 -3.366 -0.789 1.00 0.00 H new ATOM 0 HD13 LEU A 55 133.206 -2.650 -0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 55 132.605 -1.804 2.440 1.00 0.00 H new ATOM 0 HD22 LEU A 55 133.412 -0.794 1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 55 131.965 -0.189 2.057 1.00 0.00 H new ATOM 703 N PHE A 56 131.184 2.739 -1.099 1.00 0.00 N ATOM 704 CA PHE A 56 130.951 3.763 -2.113 1.00 0.00 C ATOM 705 C PHE A 56 132.148 3.956 -3.044 1.00 0.00 C ATOM 706 O PHE A 56 132.417 5.076 -3.470 1.00 0.00 O ATOM 707 CB PHE A 56 130.619 5.095 -1.436 1.00 0.00 C ATOM 708 CG PHE A 56 129.948 6.013 -2.430 1.00 0.00 C ATOM 709 CD1 PHE A 56 128.593 5.836 -2.738 1.00 0.00 C ATOM 710 CD2 PHE A 56 130.676 7.039 -3.042 1.00 0.00 C ATOM 711 CE1 PHE A 56 127.967 6.684 -3.659 1.00 0.00 C ATOM 712 CE2 PHE A 56 130.051 7.888 -3.963 1.00 0.00 C ATOM 713 CZ PHE A 56 128.696 7.710 -4.272 1.00 0.00 C ATOM 0 H PHE A 56 131.924 2.955 -0.432 1.00 0.00 H new ATOM 0 HA PHE A 56 130.114 3.423 -2.722 1.00 0.00 H new ATOM 0 HB2 PHE A 56 129.964 4.927 -0.581 1.00 0.00 H new ATOM 0 HB3 PHE A 56 131.529 5.558 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 56 128.031 5.045 -2.264 1.00 0.00 H new ATOM 0 HD2 PHE A 56 131.720 7.176 -2.804 1.00 0.00 H new ATOM 0 HE1 PHE A 56 126.922 6.547 -3.897 1.00 0.00 H new ATOM 0 HE2 PHE A 56 130.613 8.680 -4.435 1.00 0.00 H new ATOM 0 HZ PHE A 56 128.214 8.364 -4.983 1.00 0.00 H new ATOM 723 N ASP A 57 132.876 2.880 -3.349 1.00 0.00 N ATOM 724 CA ASP A 57 134.043 2.970 -4.236 1.00 0.00 C ATOM 725 C ASP A 57 133.738 3.802 -5.479 1.00 0.00 C ATOM 726 O ASP A 57 132.644 4.342 -5.630 1.00 0.00 O ATOM 727 CB ASP A 57 134.451 1.565 -4.686 1.00 0.00 C ATOM 728 CG ASP A 57 134.965 0.748 -3.505 1.00 0.00 C ATOM 729 OD1 ASP A 57 135.068 1.301 -2.425 1.00 0.00 O ATOM 730 OD2 ASP A 57 135.250 -0.421 -3.701 1.00 0.00 O ATOM 0 H ASP A 57 132.682 1.942 -2.999 1.00 0.00 H new ATOM 0 HA ASP A 57 134.848 3.450 -3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 57 133.597 1.061 -5.139 1.00 0.00 H new ATOM 0 HB3 ASP A 57 135.224 1.633 -5.451 1.00 0.00 H new ATOM 735 N THR A 58 134.726 3.886 -6.371 1.00 0.00 N ATOM 736 CA THR A 58 134.577 4.640 -7.613 1.00 0.00 C ATOM 737 C THR A 58 134.688 6.139 -7.357 1.00 0.00 C ATOM 738 O THR A 58 134.297 6.631 -6.299 1.00 0.00 O ATOM 739 CB THR A 58 133.228 4.328 -8.272 1.00 0.00 C ATOM 740 OG1 THR A 58 132.227 5.179 -7.729 1.00 0.00 O ATOM 741 CG2 THR A 58 132.847 2.865 -8.029 1.00 0.00 C ATOM 0 H THR A 58 135.637 3.441 -6.255 1.00 0.00 H new ATOM 0 HA THR A 58 135.381 4.339 -8.284 1.00 0.00 H new ATOM 0 HB THR A 58 133.309 4.498 -9.346 1.00 0.00 H new ATOM 0 HG1 THR A 58 131.996 4.877 -6.826 1.00 0.00 H new ATOM 0 HG21 THR A 58 131.887 2.656 -8.502 1.00 0.00 H new ATOM 0 HG22 THR A 58 133.611 2.215 -8.455 1.00 0.00 H new ATOM 0 HG23 THR A 58 132.771 2.682 -6.957 1.00 0.00 H new ATOM 746 N ALA A 59 135.218 6.859 -8.342 1.00 0.00 N ATOM 747 CA ALA A 59 135.372 8.305 -8.224 1.00 0.00 C ATOM 748 C ALA A 59 136.226 8.670 -7.013 1.00 0.00 C ATOM 749 O ALA A 59 136.789 7.798 -6.350 1.00 0.00 O ATOM 750 CB ALA A 59 133.998 8.961 -8.096 1.00 0.00 C ATOM 0 H ALA A 59 135.546 6.468 -9.225 1.00 0.00 H new ATOM 0 HA ALA A 59 135.873 8.668 -9.121 1.00 0.00 H new ATOM 0 HB1 ALA A 59 134.117 10.041 -8.008 1.00 0.00 H new ATOM 0 HB2 ALA A 59 133.402 8.732 -8.980 1.00 0.00 H new ATOM 0 HB3 ALA A 59 133.493 8.578 -7.209 1.00 0.00 H new ATOM 756 N GLY A 60 136.316 9.967 -6.733 1.00 0.00 N ATOM 757 CA GLY A 60 137.103 10.445 -5.601 1.00 0.00 C ATOM 758 C GLY A 60 137.696 11.820 -5.894 1.00 0.00 C ATOM 759 O GLY A 60 138.333 12.424 -5.032 1.00 0.00 O ATOM 0 H GLY A 60 135.857 10.702 -7.271 1.00 0.00 H new ATOM 0 HA2 GLY A 60 136.475 10.497 -4.712 1.00 0.00 H new ATOM 0 HA3 GLY A 60 137.903 9.738 -5.385 1.00 0.00 H new ATOM 763 N GLN A 61 137.469 12.309 -7.110 1.00 0.00 N ATOM 764 CA GLN A 61 137.976 13.620 -7.513 1.00 0.00 C ATOM 765 C GLN A 61 137.555 13.931 -8.944 1.00 0.00 C ATOM 766 O GLN A 61 138.363 13.836 -9.862 1.00 0.00 O ATOM 767 CB GLN A 61 139.507 13.653 -7.424 1.00 0.00 C ATOM 768 CG GLN A 61 140.005 15.066 -7.734 1.00 0.00 C ATOM 769 CD GLN A 61 141.530 15.090 -7.742 1.00 0.00 C ATOM 770 OE1 GLN A 61 142.157 14.533 -8.642 1.00 0.00 O ATOM 771 NE2 GLN A 61 142.167 15.707 -6.784 1.00 0.00 N ATOM 0 H GLN A 61 136.939 11.820 -7.832 1.00 0.00 H new ATOM 0 HA GLN A 61 137.558 14.367 -6.838 1.00 0.00 H new ATOM 0 HB2 GLN A 61 139.831 13.352 -6.428 1.00 0.00 H new ATOM 0 HB3 GLN A 61 139.938 12.941 -8.128 1.00 0.00 H new ATOM 0 HG2 GLN A 61 139.623 15.391 -8.701 1.00 0.00 H new ATOM 0 HG3 GLN A 61 139.626 15.766 -6.990 1.00 0.00 H new ATOM 0 HE21 GLN A 61 141.645 16.168 -6.039 1.00 0.00 H new ATOM 0 HE22 GLN A 61 143.187 15.728 -6.781 1.00 0.00 H new ATOM 778 N GLU A 62 136.284 14.307 -9.108 1.00 0.00 N ATOM 779 CA GLU A 62 135.707 14.646 -10.411 1.00 0.00 C ATOM 780 C GLU A 62 134.223 14.301 -10.399 1.00 0.00 C ATOM 781 O GLU A 62 133.466 14.802 -9.568 1.00 0.00 O ATOM 782 CB GLU A 62 136.384 13.885 -11.560 1.00 0.00 C ATOM 783 CG GLU A 62 136.472 12.391 -11.224 1.00 0.00 C ATOM 784 CD GLU A 62 137.898 11.890 -11.431 1.00 0.00 C ATOM 785 OE1 GLU A 62 138.442 12.134 -12.494 1.00 0.00 O ATOM 786 OE2 GLU A 62 138.423 11.270 -10.521 1.00 0.00 O ATOM 0 H GLU A 62 135.622 14.385 -8.336 1.00 0.00 H new ATOM 0 HA GLU A 62 135.863 15.712 -10.578 1.00 0.00 H new ATOM 0 HB2 GLU A 62 135.820 14.026 -12.482 1.00 0.00 H new ATOM 0 HB3 GLU A 62 137.383 14.286 -11.733 1.00 0.00 H new ATOM 0 HG2 GLU A 62 136.166 12.224 -10.191 1.00 0.00 H new ATOM 0 HG3 GLU A 62 135.785 11.827 -11.855 1.00 0.00 H new ATOM 793 N ASP A 63 133.818 13.433 -11.316 1.00 0.00 N ATOM 794 CA ASP A 63 132.428 13.015 -11.395 1.00 0.00 C ATOM 795 C ASP A 63 132.091 12.140 -10.198 1.00 0.00 C ATOM 796 O ASP A 63 131.674 10.992 -10.347 1.00 0.00 O ATOM 797 CB ASP A 63 132.186 12.237 -12.689 1.00 0.00 C ATOM 798 CG ASP A 63 133.023 10.962 -12.697 1.00 0.00 C ATOM 799 OD1 ASP A 63 133.539 10.609 -11.651 1.00 0.00 O ATOM 800 OD2 ASP A 63 133.136 10.357 -13.751 1.00 0.00 O ATOM 0 H ASP A 63 134.430 13.007 -12.012 1.00 0.00 H new ATOM 0 HA ASP A 63 131.789 13.898 -11.390 1.00 0.00 H new ATOM 0 HB2 ASP A 63 131.129 11.988 -12.781 1.00 0.00 H new ATOM 0 HB3 ASP A 63 132.443 12.856 -13.548 1.00 0.00 H new ATOM 805 N TYR A 64 132.290 12.695 -9.008 1.00 0.00 N ATOM 806 CA TYR A 64 132.020 11.963 -7.776 1.00 0.00 C ATOM 807 C TYR A 64 130.798 11.065 -7.951 1.00 0.00 C ATOM 808 O TYR A 64 130.812 9.896 -7.567 1.00 0.00 O ATOM 809 CB TYR A 64 131.763 12.945 -6.630 1.00 0.00 C ATOM 810 CG TYR A 64 132.956 13.855 -6.460 1.00 0.00 C ATOM 811 CD1 TYR A 64 134.044 13.444 -5.682 1.00 0.00 C ATOM 812 CD2 TYR A 64 132.971 15.112 -7.078 1.00 0.00 C ATOM 813 CE1 TYR A 64 135.150 14.290 -5.522 1.00 0.00 C ATOM 814 CE2 TYR A 64 134.076 15.957 -6.919 1.00 0.00 C ATOM 815 CZ TYR A 64 135.165 15.546 -6.140 1.00 0.00 C ATOM 816 OH TYR A 64 136.254 16.380 -5.983 1.00 0.00 O ATOM 0 H TYR A 64 132.636 13.645 -8.870 1.00 0.00 H new ATOM 0 HA TYR A 64 132.889 11.347 -7.542 1.00 0.00 H new ATOM 0 HB2 TYR A 64 130.870 13.535 -6.838 1.00 0.00 H new ATOM 0 HB3 TYR A 64 131.576 12.399 -5.706 1.00 0.00 H new ATOM 0 HD1 TYR A 64 134.032 12.475 -5.205 1.00 0.00 H new ATOM 0 HD2 TYR A 64 132.130 15.429 -7.677 1.00 0.00 H new ATOM 0 HE1 TYR A 64 135.990 13.973 -4.922 1.00 0.00 H new ATOM 0 HE2 TYR A 64 134.089 16.925 -7.397 1.00 0.00 H new ATOM 0 HH TYR A 64 136.103 17.212 -6.478 1.00 0.00 H new ATOM 826 N ASP A 65 129.743 11.622 -8.539 1.00 0.00 N ATOM 827 CA ASP A 65 128.516 10.867 -8.770 1.00 0.00 C ATOM 828 C ASP A 65 127.553 11.666 -9.645 1.00 0.00 C ATOM 829 O ASP A 65 127.743 12.863 -9.858 1.00 0.00 O ATOM 830 CB ASP A 65 127.847 10.532 -7.435 1.00 0.00 C ATOM 831 CG ASP A 65 127.528 11.813 -6.676 1.00 0.00 C ATOM 832 OD1 ASP A 65 127.700 12.874 -7.249 1.00 0.00 O ATOM 833 OD2 ASP A 65 127.125 11.714 -5.528 1.00 0.00 O ATOM 0 H ASP A 65 129.713 12.589 -8.863 1.00 0.00 H new ATOM 0 HA ASP A 65 128.772 9.941 -9.285 1.00 0.00 H new ATOM 0 HB2 ASP A 65 126.932 9.966 -7.609 1.00 0.00 H new ATOM 0 HB3 ASP A 65 128.504 9.900 -6.838 1.00 0.00 H new ATOM 838 N ARG A 66 126.523 10.995 -10.153 1.00 0.00 N ATOM 839 CA ARG A 66 125.540 11.655 -11.007 1.00 0.00 C ATOM 840 C ARG A 66 124.878 12.818 -10.273 1.00 0.00 C ATOM 841 O ARG A 66 124.500 13.816 -10.887 1.00 0.00 O ATOM 842 CB ARG A 66 124.473 10.653 -11.455 1.00 0.00 C ATOM 843 CG ARG A 66 125.120 9.574 -12.326 1.00 0.00 C ATOM 844 CD ARG A 66 124.035 8.669 -12.915 1.00 0.00 C ATOM 845 NE ARG A 66 124.644 7.520 -13.577 1.00 0.00 N ATOM 846 CZ ARG A 66 123.951 6.768 -14.427 1.00 0.00 C ATOM 847 NH1 ARG A 66 122.700 7.048 -14.675 1.00 0.00 N ATOM 848 NH2 ARG A 66 124.522 5.750 -15.010 1.00 0.00 N ATOM 0 H ARG A 66 126.348 10.003 -9.990 1.00 0.00 H new ATOM 0 HA ARG A 66 126.058 12.045 -11.883 1.00 0.00 H new ATOM 0 HB2 ARG A 66 123.999 10.198 -10.586 1.00 0.00 H new ATOM 0 HB3 ARG A 66 123.690 11.165 -12.014 1.00 0.00 H new ATOM 0 HG2 ARG A 66 125.696 10.037 -13.127 1.00 0.00 H new ATOM 0 HG3 ARG A 66 125.817 8.983 -11.732 1.00 0.00 H new ATOM 0 HD2 ARG A 66 123.365 8.330 -12.125 1.00 0.00 H new ATOM 0 HD3 ARG A 66 123.430 9.230 -13.627 1.00 0.00 H new ATOM 0 HE ARG A 66 125.619 7.290 -13.384 1.00 0.00 H new ATOM 0 HH11 ARG A 66 122.255 7.843 -14.217 1.00 0.00 H new ATOM 0 HH12 ARG A 66 122.168 6.472 -15.327 1.00 0.00 H new ATOM 0 HH21 ARG A 66 125.499 5.532 -14.814 1.00 0.00 H new ATOM 0 HH22 ARG A 66 123.992 5.172 -15.662 1.00 0.00 H new ATOM 862 N LEU A 67 124.737 12.682 -8.957 1.00 0.00 N ATOM 863 CA LEU A 67 124.117 13.730 -8.152 1.00 0.00 C ATOM 864 C LEU A 67 125.111 14.854 -7.875 1.00 0.00 C ATOM 865 O LEU A 67 126.312 14.619 -7.767 1.00 0.00 O ATOM 866 CB LEU A 67 123.622 13.147 -6.826 1.00 0.00 C ATOM 867 CG LEU A 67 122.668 11.982 -7.101 1.00 0.00 C ATOM 868 CD1 LEU A 67 122.138 11.433 -5.775 1.00 0.00 C ATOM 869 CD2 LEU A 67 121.493 12.476 -7.950 1.00 0.00 C ATOM 0 H LEU A 67 125.041 11.864 -8.429 1.00 0.00 H new ATOM 0 HA LEU A 67 123.273 14.136 -8.709 1.00 0.00 H new ATOM 0 HB2 LEU A 67 124.468 12.805 -6.230 1.00 0.00 H new ATOM 0 HB3 LEU A 67 123.114 13.917 -6.246 1.00 0.00 H new ATOM 0 HG LEU A 67 123.200 11.195 -7.635 1.00 0.00 H new ATOM 0 HD11 LEU A 67 121.459 10.603 -5.970 1.00 0.00 H new ATOM 0 HD12 LEU A 67 122.972 11.083 -5.167 1.00 0.00 H new ATOM 0 HD13 LEU A 67 121.605 12.221 -5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 67 120.813 11.647 -8.147 1.00 0.00 H new ATOM 0 HD22 LEU A 67 120.962 13.262 -7.414 1.00 0.00 H new ATOM 0 HD23 LEU A 67 121.867 12.870 -8.895 1.00 0.00 H new ATOM 875 N ARG A 68 124.601 16.076 -7.767 1.00 0.00 N ATOM 876 CA ARG A 68 125.458 17.228 -7.506 1.00 0.00 C ATOM 877 C ARG A 68 126.088 17.128 -6.117 1.00 0.00 C ATOM 878 O ARG A 68 125.566 16.445 -5.237 1.00 0.00 O ATOM 879 CB ARG A 68 124.642 18.518 -7.608 1.00 0.00 C ATOM 880 CG ARG A 68 123.197 18.180 -7.982 1.00 0.00 C ATOM 881 CD ARG A 68 122.407 19.471 -8.201 1.00 0.00 C ATOM 882 NE ARG A 68 121.868 19.510 -9.556 1.00 0.00 N ATOM 883 CZ ARG A 68 120.843 18.741 -9.912 1.00 0.00 C ATOM 884 NH1 ARG A 68 120.303 17.929 -9.044 1.00 0.00 N ATOM 885 NH2 ARG A 68 120.377 18.798 -11.130 1.00 0.00 N ATOM 0 H ARG A 68 123.608 16.294 -7.855 1.00 0.00 H new ATOM 0 HA ARG A 68 126.254 17.241 -8.251 1.00 0.00 H new ATOM 0 HB2 ARG A 68 124.667 19.053 -6.659 1.00 0.00 H new ATOM 0 HB3 ARG A 68 125.078 19.178 -8.358 1.00 0.00 H new ATOM 0 HG2 ARG A 68 123.178 17.572 -8.887 1.00 0.00 H new ATOM 0 HG3 ARG A 68 122.735 17.589 -7.191 1.00 0.00 H new ATOM 0 HD2 ARG A 68 121.595 19.536 -7.477 1.00 0.00 H new ATOM 0 HD3 ARG A 68 123.052 20.333 -8.034 1.00 0.00 H new ATOM 0 HE ARG A 68 122.285 20.138 -10.243 1.00 0.00 H new ATOM 0 HH11 ARG A 68 120.667 17.884 -8.092 1.00 0.00 H new ATOM 0 HH12 ARG A 68 119.517 17.339 -9.318 1.00 0.00 H new ATOM 0 HH21 ARG A 68 120.799 19.432 -11.808 1.00 0.00 H new ATOM 0 HH22 ARG A 68 119.591 18.208 -11.403 1.00 0.00 H new ATOM 899 N PRO A 69 127.192 17.796 -5.914 1.00 0.00 N ATOM 900 CA PRO A 69 127.914 17.790 -4.606 1.00 0.00 C ATOM 901 C PRO A 69 127.058 18.351 -3.475 1.00 0.00 C ATOM 902 O PRO A 69 127.409 18.235 -2.301 1.00 0.00 O ATOM 903 CB PRO A 69 129.144 18.675 -4.850 1.00 0.00 C ATOM 904 CG PRO A 69 128.831 19.477 -6.070 1.00 0.00 C ATOM 905 CD PRO A 69 127.875 18.635 -6.908 1.00 0.00 C ATOM 0 HA PRO A 69 128.173 16.778 -4.294 1.00 0.00 H new ATOM 0 HB2 PRO A 69 129.336 19.323 -3.995 1.00 0.00 H new ATOM 0 HB3 PRO A 69 130.038 18.070 -4.998 1.00 0.00 H new ATOM 0 HG2 PRO A 69 128.375 20.430 -5.801 1.00 0.00 H new ATOM 0 HG3 PRO A 69 129.739 19.704 -6.628 1.00 0.00 H new ATOM 0 HD2 PRO A 69 127.170 19.258 -7.459 1.00 0.00 H new ATOM 0 HD3 PRO A 69 128.410 18.032 -7.642 1.00 0.00 H new ATOM 913 N LEU A 70 125.940 18.968 -3.839 1.00 0.00 N ATOM 914 CA LEU A 70 125.041 19.556 -2.851 1.00 0.00 C ATOM 915 C LEU A 70 124.653 18.531 -1.788 1.00 0.00 C ATOM 916 O LEU A 70 124.500 18.873 -0.615 1.00 0.00 O ATOM 917 CB LEU A 70 123.784 20.090 -3.540 1.00 0.00 C ATOM 918 CG LEU A 70 122.908 20.820 -2.518 1.00 0.00 C ATOM 919 CD1 LEU A 70 123.631 22.075 -2.023 1.00 0.00 C ATOM 920 CD2 LEU A 70 121.589 21.224 -3.180 1.00 0.00 C ATOM 0 H LEU A 70 125.634 19.074 -4.806 1.00 0.00 H new ATOM 0 HA LEU A 70 125.563 20.379 -2.362 1.00 0.00 H new ATOM 0 HB2 LEU A 70 124.060 20.768 -4.347 1.00 0.00 H new ATOM 0 HB3 LEU A 70 123.227 19.268 -3.990 1.00 0.00 H new ATOM 0 HG LEU A 70 122.710 20.160 -1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 70 123.005 22.592 -1.296 1.00 0.00 H new ATOM 0 HD12 LEU A 70 124.573 21.791 -1.554 1.00 0.00 H new ATOM 0 HD13 LEU A 70 123.830 22.736 -2.866 1.00 0.00 H new ATOM 0 HD21 LEU A 70 120.963 21.744 -2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 70 121.792 21.884 -4.024 1.00 0.00 H new ATOM 0 HD23 LEU A 70 121.071 20.332 -3.533 1.00 0.00 H new ATOM 926 N SER A 71 124.494 17.277 -2.198 1.00 0.00 N ATOM 927 CA SER A 71 124.123 16.225 -1.256 1.00 0.00 C ATOM 928 C SER A 71 125.205 16.065 -0.193 1.00 0.00 C ATOM 929 O SER A 71 126.364 16.412 -0.418 1.00 0.00 O ATOM 930 CB SER A 71 123.934 14.901 -1.997 1.00 0.00 C ATOM 931 OG SER A 71 125.208 14.373 -2.347 1.00 0.00 O ATOM 0 H SER A 71 124.614 16.966 -3.162 1.00 0.00 H new ATOM 0 HA SER A 71 123.186 16.504 -0.773 1.00 0.00 H new ATOM 0 HB2 SER A 71 123.394 14.193 -1.368 1.00 0.00 H new ATOM 0 HB3 SER A 71 123.333 15.055 -2.893 1.00 0.00 H new ATOM 0 HG SER A 71 125.091 13.523 -2.821 1.00 0.00 H new ATOM 937 N TYR A 72 124.820 15.543 0.968 1.00 0.00 N ATOM 938 CA TYR A 72 125.772 15.351 2.055 1.00 0.00 C ATOM 939 C TYR A 72 125.655 13.947 2.644 1.00 0.00 C ATOM 940 O TYR A 72 125.068 13.752 3.710 1.00 0.00 O ATOM 941 CB TYR A 72 125.529 16.394 3.149 1.00 0.00 C ATOM 942 CG TYR A 72 126.579 17.475 3.057 1.00 0.00 C ATOM 943 CD1 TYR A 72 126.509 18.437 2.042 1.00 0.00 C ATOM 944 CD2 TYR A 72 127.622 17.516 3.990 1.00 0.00 C ATOM 945 CE1 TYR A 72 127.483 19.439 1.960 1.00 0.00 C ATOM 946 CE2 TYR A 72 128.595 18.519 3.909 1.00 0.00 C ATOM 947 CZ TYR A 72 128.526 19.481 2.894 1.00 0.00 C ATOM 948 OH TYR A 72 129.485 20.470 2.814 1.00 0.00 O ATOM 0 H TYR A 72 123.866 15.249 1.178 1.00 0.00 H new ATOM 0 HA TYR A 72 126.778 15.472 1.653 1.00 0.00 H new ATOM 0 HB2 TYR A 72 124.535 16.827 3.039 1.00 0.00 H new ATOM 0 HB3 TYR A 72 125.563 15.922 4.131 1.00 0.00 H new ATOM 0 HD1 TYR A 72 125.704 18.406 1.323 1.00 0.00 H new ATOM 0 HD2 TYR A 72 127.676 16.774 4.772 1.00 0.00 H new ATOM 0 HE1 TYR A 72 127.430 20.180 1.176 1.00 0.00 H new ATOM 0 HE2 TYR A 72 129.399 18.551 4.629 1.00 0.00 H new ATOM 0 HH TYR A 72 130.135 20.355 3.538 1.00 0.00 H new ATOM 958 N PRO A 73 126.206 12.973 1.976 1.00 0.00 N ATOM 959 CA PRO A 73 126.172 11.559 2.445 1.00 0.00 C ATOM 960 C PRO A 73 126.742 11.424 3.855 1.00 0.00 C ATOM 961 O PRO A 73 127.702 12.107 4.211 1.00 0.00 O ATOM 962 CB PRO A 73 127.042 10.807 1.431 1.00 0.00 C ATOM 963 CG PRO A 73 127.094 11.676 0.218 1.00 0.00 C ATOM 964 CD PRO A 73 126.918 13.115 0.699 1.00 0.00 C ATOM 0 HA PRO A 73 125.156 11.169 2.501 1.00 0.00 H new ATOM 0 HB2 PRO A 73 128.041 10.630 1.828 1.00 0.00 H new ATOM 0 HB3 PRO A 73 126.615 9.832 1.196 1.00 0.00 H new ATOM 0 HG2 PRO A 73 128.044 11.556 -0.303 1.00 0.00 H new ATOM 0 HG3 PRO A 73 126.307 11.405 -0.486 1.00 0.00 H new ATOM 0 HD2 PRO A 73 127.879 13.613 0.830 1.00 0.00 H new ATOM 0 HD3 PRO A 73 126.346 13.708 -0.014 1.00 0.00 H new ATOM 972 N GLN A 74 126.145 10.549 4.656 1.00 0.00 N ATOM 973 CA GLN A 74 126.610 10.351 6.024 1.00 0.00 C ATOM 974 C GLN A 74 127.299 8.998 6.170 1.00 0.00 C ATOM 975 O GLN A 74 126.794 7.978 5.698 1.00 0.00 O ATOM 976 CB GLN A 74 125.430 10.436 6.993 1.00 0.00 C ATOM 977 CG GLN A 74 124.830 11.843 6.945 1.00 0.00 C ATOM 978 CD GLN A 74 123.623 11.929 7.873 1.00 0.00 C ATOM 979 OE1 GLN A 74 123.128 10.907 8.348 1.00 0.00 O ATOM 980 NE2 GLN A 74 123.115 13.097 8.157 1.00 0.00 N ATOM 0 H GLN A 74 125.348 9.972 4.387 1.00 0.00 H new ATOM 0 HA GLN A 74 127.330 11.135 6.259 1.00 0.00 H new ATOM 0 HB2 GLN A 74 124.674 9.697 6.727 1.00 0.00 H new ATOM 0 HB3 GLN A 74 125.760 10.204 8.006 1.00 0.00 H new ATOM 0 HG2 GLN A 74 125.580 12.577 7.241 1.00 0.00 H new ATOM 0 HG3 GLN A 74 124.532 12.085 5.925 1.00 0.00 H new ATOM 0 HE21 GLN A 74 123.527 13.942 7.762 1.00 0.00 H new ATOM 0 HE22 GLN A 74 122.306 13.165 8.774 1.00 0.00 H new ATOM 987 N THR A 75 128.457 8.998 6.823 1.00 0.00 N ATOM 988 CA THR A 75 129.210 7.765 7.019 1.00 0.00 C ATOM 989 C THR A 75 129.735 7.667 8.448 1.00 0.00 C ATOM 990 O THR A 75 129.956 8.682 9.108 1.00 0.00 O ATOM 991 CB THR A 75 130.389 7.724 6.046 1.00 0.00 C ATOM 992 OG1 THR A 75 130.900 6.401 5.979 1.00 0.00 O ATOM 993 CG2 THR A 75 131.485 8.674 6.530 1.00 0.00 C ATOM 0 H THR A 75 128.891 9.830 7.222 1.00 0.00 H new ATOM 0 HA THR A 75 128.542 6.923 6.834 1.00 0.00 H new ATOM 0 HB THR A 75 130.055 8.034 5.056 1.00 0.00 H new ATOM 0 HG1 THR A 75 130.272 5.785 6.411 1.00 0.00 H new ATOM 0 HG21 THR A 75 132.325 8.644 5.836 1.00 0.00 H new ATOM 0 HG22 THR A 75 131.091 9.689 6.579 1.00 0.00 H new ATOM 0 HG23 THR A 75 131.821 8.367 7.520 1.00 0.00 H new ATOM 998 N ASP A 76 129.939 6.439 8.917 1.00 0.00 N ATOM 999 CA ASP A 76 130.447 6.225 10.265 1.00 0.00 C ATOM 1000 C ASP A 76 131.798 5.517 10.220 1.00 0.00 C ATOM 1001 O ASP A 76 132.557 5.548 11.187 1.00 0.00 O ATOM 1002 CB ASP A 76 129.451 5.389 11.069 1.00 0.00 C ATOM 1003 CG ASP A 76 128.166 6.180 11.290 1.00 0.00 C ATOM 1004 OD1 ASP A 76 128.165 7.365 10.999 1.00 0.00 O ATOM 1005 OD2 ASP A 76 127.201 5.590 11.748 1.00 0.00 O ATOM 0 H ASP A 76 129.762 5.585 8.388 1.00 0.00 H new ATOM 0 HA ASP A 76 130.576 7.194 10.747 1.00 0.00 H new ATOM 0 HB2 ASP A 76 129.231 4.462 10.540 1.00 0.00 H new ATOM 0 HB3 ASP A 76 129.887 5.112 12.029 1.00 0.00 H new ATOM 1010 N VAL A 77 132.090 4.876 9.090 1.00 0.00 N ATOM 1011 CA VAL A 77 133.355 4.165 8.937 1.00 0.00 C ATOM 1012 C VAL A 77 134.074 4.617 7.668 1.00 0.00 C ATOM 1013 O VAL A 77 133.572 4.435 6.556 1.00 0.00 O ATOM 1014 CB VAL A 77 133.086 2.663 8.871 1.00 0.00 C ATOM 1015 CG1 VAL A 77 134.411 1.898 8.893 1.00 0.00 C ATOM 1016 CG2 VAL A 77 132.235 2.252 10.074 1.00 0.00 C ATOM 0 H VAL A 77 131.476 4.835 8.277 1.00 0.00 H new ATOM 0 HA VAL A 77 133.992 4.388 9.793 1.00 0.00 H new ATOM 0 HB VAL A 77 132.555 2.428 7.948 1.00 0.00 H new ATOM 0 HG11 VAL A 77 134.214 0.827 8.846 1.00 0.00 H new ATOM 0 HG12 VAL A 77 135.016 2.194 8.036 1.00 0.00 H new ATOM 0 HG13 VAL A 77 134.948 2.128 9.813 1.00 0.00 H new ATOM 0 HG21 VAL A 77 132.040 1.180 10.032 1.00 0.00 H new ATOM 0 HG22 VAL A 77 132.768 2.488 10.995 1.00 0.00 H new ATOM 0 HG23 VAL A 77 131.290 2.794 10.053 1.00 0.00 H new ATOM 1020 N PHE A 78 135.227 5.255 7.848 1.00 0.00 N ATOM 1021 CA PHE A 78 135.976 5.780 6.711 1.00 0.00 C ATOM 1022 C PHE A 78 136.932 4.749 6.127 1.00 0.00 C ATOM 1023 O PHE A 78 137.768 4.182 6.830 1.00 0.00 O ATOM 1024 CB PHE A 78 136.754 7.024 7.140 1.00 0.00 C ATOM 1025 CG PHE A 78 135.777 8.114 7.505 1.00 0.00 C ATOM 1026 CD1 PHE A 78 135.274 8.963 6.512 1.00 0.00 C ATOM 1027 CD2 PHE A 78 135.370 8.273 8.835 1.00 0.00 C ATOM 1028 CE1 PHE A 78 134.362 9.970 6.848 1.00 0.00 C ATOM 1029 CE2 PHE A 78 134.458 9.282 9.171 1.00 0.00 C ATOM 1030 CZ PHE A 78 133.954 10.130 8.179 1.00 0.00 C ATOM 0 H PHE A 78 135.658 5.419 8.758 1.00 0.00 H new ATOM 0 HA PHE A 78 135.258 6.037 5.932 1.00 0.00 H new ATOM 0 HB2 PHE A 78 137.394 6.792 7.991 1.00 0.00 H new ATOM 0 HB3 PHE A 78 137.405 7.358 6.332 1.00 0.00 H new ATOM 0 HD1 PHE A 78 135.590 8.841 5.486 1.00 0.00 H new ATOM 0 HD2 PHE A 78 135.759 7.619 9.601 1.00 0.00 H new ATOM 0 HE1 PHE A 78 133.973 10.624 6.082 1.00 0.00 H new ATOM 0 HE2 PHE A 78 134.144 9.405 10.197 1.00 0.00 H new ATOM 0 HZ PHE A 78 133.251 10.907 8.439 1.00 0.00 H new ATOM 1040 N LEU A 79 136.798 4.529 4.823 1.00 0.00 N ATOM 1041 CA LEU A 79 137.644 3.580 4.112 1.00 0.00 C ATOM 1042 C LEU A 79 138.331 4.277 2.939 1.00 0.00 C ATOM 1043 O LEU A 79 137.671 4.899 2.105 1.00 0.00 O ATOM 1044 CB LEU A 79 136.791 2.417 3.598 1.00 0.00 C ATOM 1045 CG LEU A 79 137.696 1.284 3.101 1.00 0.00 C ATOM 1046 CD1 LEU A 79 136.869 0.006 2.955 1.00 0.00 C ATOM 1047 CD2 LEU A 79 138.314 1.648 1.744 1.00 0.00 C ATOM 0 H LEU A 79 136.108 4.998 4.236 1.00 0.00 H new ATOM 0 HA LEU A 79 138.404 3.195 4.792 1.00 0.00 H new ATOM 0 HB2 LEU A 79 136.141 2.052 4.393 1.00 0.00 H new ATOM 0 HB3 LEU A 79 136.145 2.759 2.790 1.00 0.00 H new ATOM 0 HG LEU A 79 138.498 1.129 3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 79 137.509 -0.803 2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 79 136.443 -0.264 3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 79 136.065 0.173 2.238 1.00 0.00 H new ATOM 0 HD21 LEU A 79 138.954 0.833 1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 79 137.520 1.813 1.015 1.00 0.00 H new ATOM 0 HD23 LEU A 79 138.907 2.557 1.846 1.00 0.00 H new ATOM 1053 N VAL A 80 139.654 4.174 2.879 1.00 0.00 N ATOM 1054 CA VAL A 80 140.411 4.803 1.800 1.00 0.00 C ATOM 1055 C VAL A 80 141.137 3.742 0.976 1.00 0.00 C ATOM 1056 O VAL A 80 141.715 2.808 1.531 1.00 0.00 O ATOM 1057 CB VAL A 80 141.425 5.789 2.384 1.00 0.00 C ATOM 1058 CG1 VAL A 80 142.086 6.577 1.254 1.00 0.00 C ATOM 1059 CG2 VAL A 80 140.709 6.757 3.327 1.00 0.00 C ATOM 0 H VAL A 80 140.221 3.666 3.558 1.00 0.00 H new ATOM 0 HA VAL A 80 139.719 5.340 1.151 1.00 0.00 H new ATOM 0 HB VAL A 80 142.187 5.238 2.935 1.00 0.00 H new ATOM 0 HG11 VAL A 80 142.808 7.278 1.673 1.00 0.00 H new ATOM 0 HG12 VAL A 80 142.598 5.889 0.581 1.00 0.00 H new ATOM 0 HG13 VAL A 80 141.325 7.127 0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 80 141.431 7.460 3.744 1.00 0.00 H new ATOM 0 HG22 VAL A 80 139.946 7.305 2.775 1.00 0.00 H new ATOM 0 HG23 VAL A 80 140.240 6.197 4.136 1.00 0.00 H new ATOM 1063 N CYS A 81 141.096 3.879 -0.348 1.00 0.00 N ATOM 1064 CA CYS A 81 141.748 2.902 -1.215 1.00 0.00 C ATOM 1065 C CYS A 81 142.635 3.573 -2.265 1.00 0.00 C ATOM 1066 O CYS A 81 142.208 4.483 -2.979 1.00 0.00 O ATOM 1067 CB CYS A 81 140.693 2.046 -1.911 1.00 0.00 C ATOM 1068 SG CYS A 81 141.490 0.621 -2.690 1.00 0.00 S ATOM 0 H CYS A 81 140.627 4.642 -0.836 1.00 0.00 H new ATOM 0 HA CYS A 81 142.385 2.277 -0.589 1.00 0.00 H new ATOM 0 HB2 CYS A 81 139.948 1.710 -1.190 1.00 0.00 H new ATOM 0 HB3 CYS A 81 140.167 2.637 -2.661 1.00 0.00 H new ATOM 0 HG CYS A 81 141.723 -0.290 -1.793 1.00 0.00 H new ATOM 1074 N PHE A 82 143.872 3.099 -2.354 1.00 0.00 N ATOM 1075 CA PHE A 82 144.835 3.623 -3.314 1.00 0.00 C ATOM 1076 C PHE A 82 145.639 2.475 -3.930 1.00 0.00 C ATOM 1077 O PHE A 82 145.801 1.425 -3.314 1.00 0.00 O ATOM 1078 CB PHE A 82 145.783 4.583 -2.600 1.00 0.00 C ATOM 1079 CG PHE A 82 146.589 3.810 -1.583 1.00 0.00 C ATOM 1080 CD1 PHE A 82 146.042 3.524 -0.326 1.00 0.00 C ATOM 1081 CD2 PHE A 82 147.879 3.373 -1.901 1.00 0.00 C ATOM 1082 CE1 PHE A 82 146.787 2.802 0.613 1.00 0.00 C ATOM 1083 CE2 PHE A 82 148.624 2.649 -0.962 1.00 0.00 C ATOM 1084 CZ PHE A 82 148.078 2.364 0.296 1.00 0.00 C ATOM 0 H PHE A 82 144.233 2.347 -1.768 1.00 0.00 H new ATOM 0 HA PHE A 82 144.304 4.149 -4.107 1.00 0.00 H new ATOM 0 HB2 PHE A 82 146.446 5.063 -3.320 1.00 0.00 H new ATOM 0 HB3 PHE A 82 145.218 5.375 -2.109 1.00 0.00 H new ATOM 0 HD1 PHE A 82 145.045 3.861 -0.081 1.00 0.00 H new ATOM 0 HD2 PHE A 82 148.300 3.594 -2.871 1.00 0.00 H new ATOM 0 HE1 PHE A 82 146.366 2.583 1.583 1.00 0.00 H new ATOM 0 HE2 PHE A 82 149.620 2.310 -1.208 1.00 0.00 H new ATOM 0 HZ PHE A 82 148.653 1.807 1.021 1.00 0.00 H new ATOM 1094 N SER A 83 146.151 2.676 -5.140 1.00 0.00 N ATOM 1095 CA SER A 83 146.937 1.632 -5.798 1.00 0.00 C ATOM 1096 C SER A 83 148.253 1.423 -5.063 1.00 0.00 C ATOM 1097 O SER A 83 148.927 2.384 -4.705 1.00 0.00 O ATOM 1098 CB SER A 83 147.210 2.018 -7.252 1.00 0.00 C ATOM 1099 OG SER A 83 147.883 0.949 -7.903 1.00 0.00 O ATOM 0 H SER A 83 146.040 3.535 -5.679 1.00 0.00 H new ATOM 0 HA SER A 83 146.369 0.702 -5.777 1.00 0.00 H new ATOM 0 HB2 SER A 83 146.273 2.239 -7.764 1.00 0.00 H new ATOM 0 HB3 SER A 83 147.816 2.923 -7.292 1.00 0.00 H new ATOM 0 HG SER A 83 147.245 0.447 -8.452 1.00 0.00 H new ATOM 1105 N VAL A 84 148.611 0.166 -4.821 1.00 0.00 N ATOM 1106 CA VAL A 84 149.849 -0.114 -4.103 1.00 0.00 C ATOM 1107 C VAL A 84 151.002 -0.410 -5.059 1.00 0.00 C ATOM 1108 O VAL A 84 151.956 -1.107 -4.702 1.00 0.00 O ATOM 1109 CB VAL A 84 149.644 -1.296 -3.164 1.00 0.00 C ATOM 1110 CG1 VAL A 84 150.928 -1.528 -2.376 1.00 0.00 C ATOM 1111 CG2 VAL A 84 148.506 -0.977 -2.198 1.00 0.00 C ATOM 0 H VAL A 84 148.077 -0.656 -5.103 1.00 0.00 H new ATOM 0 HA VAL A 84 150.110 0.775 -3.529 1.00 0.00 H new ATOM 0 HB VAL A 84 149.396 -2.190 -3.737 1.00 0.00 H new ATOM 0 HG11 VAL A 84 150.793 -2.372 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 84 151.744 -1.742 -3.066 1.00 0.00 H new ATOM 0 HG13 VAL A 84 151.166 -0.635 -1.798 1.00 0.00 H new ATOM 0 HG21 VAL A 84 148.355 -1.820 -1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 84 148.759 -0.089 -1.619 1.00 0.00 H new ATOM 0 HG23 VAL A 84 147.591 -0.794 -2.761 1.00 0.00 H new ATOM 1115 N VAL A 85 150.917 0.123 -6.272 1.00 0.00 N ATOM 1116 CA VAL A 85 151.963 -0.097 -7.259 1.00 0.00 C ATOM 1117 C VAL A 85 152.542 1.227 -7.744 1.00 0.00 C ATOM 1118 O VAL A 85 153.272 1.274 -8.734 1.00 0.00 O ATOM 1119 CB VAL A 85 151.395 -0.889 -8.433 1.00 0.00 C ATOM 1120 CG1 VAL A 85 152.489 -1.124 -9.476 1.00 0.00 C ATOM 1121 CG2 VAL A 85 150.883 -2.234 -7.913 1.00 0.00 C ATOM 0 H VAL A 85 150.143 0.704 -6.592 1.00 0.00 H new ATOM 0 HA VAL A 85 152.770 -0.665 -6.795 1.00 0.00 H new ATOM 0 HB VAL A 85 150.580 -0.333 -8.896 1.00 0.00 H new ATOM 0 HG11 VAL A 85 152.079 -1.690 -10.312 1.00 0.00 H new ATOM 0 HG12 VAL A 85 152.862 -0.165 -9.835 1.00 0.00 H new ATOM 0 HG13 VAL A 85 153.307 -1.685 -9.025 1.00 0.00 H new ATOM 0 HG21 VAL A 85 150.473 -2.812 -8.741 1.00 0.00 H new ATOM 0 HG22 VAL A 85 151.706 -2.785 -7.458 1.00 0.00 H new ATOM 0 HG23 VAL A 85 150.104 -2.064 -7.169 1.00 0.00 H new ATOM 1125 N SER A 86 152.218 2.302 -7.031 1.00 0.00 N ATOM 1126 CA SER A 86 152.721 3.623 -7.388 1.00 0.00 C ATOM 1127 C SER A 86 153.159 4.375 -6.128 1.00 0.00 C ATOM 1128 O SER A 86 152.549 4.219 -5.069 1.00 0.00 O ATOM 1129 CB SER A 86 151.632 4.418 -8.108 1.00 0.00 C ATOM 1130 OG SER A 86 151.109 3.637 -9.176 1.00 0.00 O ATOM 0 H SER A 86 151.614 2.284 -6.209 1.00 0.00 H new ATOM 0 HA SER A 86 153.578 3.506 -8.051 1.00 0.00 H new ATOM 0 HB2 SER A 86 150.836 4.681 -7.411 1.00 0.00 H new ATOM 0 HB3 SER A 86 152.041 5.352 -8.492 1.00 0.00 H new ATOM 0 HG SER A 86 150.409 4.143 -9.639 1.00 0.00 H new ATOM 1136 N PRO A 87 154.191 5.178 -6.211 1.00 0.00 N ATOM 1137 CA PRO A 87 154.694 5.952 -5.039 1.00 0.00 C ATOM 1138 C PRO A 87 153.788 7.125 -4.673 1.00 0.00 C ATOM 1139 O PRO A 87 153.838 7.628 -3.552 1.00 0.00 O ATOM 1140 CB PRO A 87 156.064 6.453 -5.499 1.00 0.00 C ATOM 1141 CG PRO A 87 155.964 6.542 -6.984 1.00 0.00 C ATOM 1142 CD PRO A 87 154.994 5.442 -7.420 1.00 0.00 C ATOM 0 HA PRO A 87 154.731 5.338 -4.139 1.00 0.00 H new ATOM 0 HB2 PRO A 87 156.297 7.423 -5.060 1.00 0.00 H new ATOM 0 HB3 PRO A 87 156.856 5.768 -5.197 1.00 0.00 H new ATOM 0 HG2 PRO A 87 155.601 7.523 -7.290 1.00 0.00 H new ATOM 0 HG3 PRO A 87 156.941 6.404 -7.448 1.00 0.00 H new ATOM 0 HD2 PRO A 87 154.369 5.767 -8.252 1.00 0.00 H new ATOM 0 HD3 PRO A 87 155.525 4.549 -7.750 1.00 0.00 H new ATOM 1150 N SER A 88 152.971 7.566 -5.624 1.00 0.00 N ATOM 1151 CA SER A 88 152.075 8.691 -5.380 1.00 0.00 C ATOM 1152 C SER A 88 150.711 8.229 -4.874 1.00 0.00 C ATOM 1153 O SER A 88 150.004 8.985 -4.206 1.00 0.00 O ATOM 1154 CB SER A 88 151.890 9.495 -6.668 1.00 0.00 C ATOM 1155 OG SER A 88 153.151 9.992 -7.096 1.00 0.00 O ATOM 0 H SER A 88 152.910 7.167 -6.561 1.00 0.00 H new ATOM 0 HA SER A 88 152.530 9.314 -4.610 1.00 0.00 H new ATOM 0 HB2 SER A 88 151.452 8.866 -7.443 1.00 0.00 H new ATOM 0 HB3 SER A 88 151.199 10.321 -6.499 1.00 0.00 H new ATOM 0 HG SER A 88 153.037 10.506 -7.922 1.00 0.00 H new ATOM 1161 N SER A 89 150.333 6.996 -5.202 1.00 0.00 N ATOM 1162 CA SER A 89 149.042 6.473 -4.779 1.00 0.00 C ATOM 1163 C SER A 89 148.949 6.360 -3.261 1.00 0.00 C ATOM 1164 O SER A 89 147.915 6.671 -2.674 1.00 0.00 O ATOM 1165 CB SER A 89 148.819 5.101 -5.414 1.00 0.00 C ATOM 1166 OG SER A 89 148.705 5.248 -6.823 1.00 0.00 O ATOM 0 H SER A 89 150.897 6.349 -5.753 1.00 0.00 H new ATOM 0 HA SER A 89 148.270 7.169 -5.108 1.00 0.00 H new ATOM 0 HB2 SER A 89 149.649 4.437 -5.172 1.00 0.00 H new ATOM 0 HB3 SER A 89 147.916 4.643 -5.010 1.00 0.00 H new ATOM 0 HG SER A 89 147.937 5.820 -7.031 1.00 0.00 H new ATOM 1172 N PHE A 90 150.029 5.911 -2.631 1.00 0.00 N ATOM 1173 CA PHE A 90 150.047 5.754 -1.179 1.00 0.00 C ATOM 1174 C PHE A 90 150.412 7.065 -0.498 1.00 0.00 C ATOM 1175 O PHE A 90 150.006 7.328 0.633 1.00 0.00 O ATOM 1176 CB PHE A 90 151.062 4.679 -0.783 1.00 0.00 C ATOM 1177 CG PHE A 90 152.408 5.321 -0.538 1.00 0.00 C ATOM 1178 CD1 PHE A 90 153.276 5.567 -1.608 1.00 0.00 C ATOM 1179 CD2 PHE A 90 152.786 5.670 0.764 1.00 0.00 C ATOM 1180 CE1 PHE A 90 154.522 6.162 -1.377 1.00 0.00 C ATOM 1181 CE2 PHE A 90 154.032 6.264 0.995 1.00 0.00 C ATOM 1182 CZ PHE A 90 154.901 6.511 -0.074 1.00 0.00 C ATOM 0 H PHE A 90 150.898 5.651 -3.098 1.00 0.00 H new ATOM 0 HA PHE A 90 149.050 5.455 -0.857 1.00 0.00 H new ATOM 0 HB2 PHE A 90 150.726 4.160 0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 90 151.142 3.931 -1.572 1.00 0.00 H new ATOM 0 HD1 PHE A 90 152.984 5.298 -2.612 1.00 0.00 H new ATOM 0 HD2 PHE A 90 152.116 5.481 1.590 1.00 0.00 H new ATOM 0 HE1 PHE A 90 155.191 6.352 -2.203 1.00 0.00 H new ATOM 0 HE2 PHE A 90 154.323 6.532 2.000 1.00 0.00 H new ATOM 0 HZ PHE A 90 155.862 6.970 0.105 1.00 0.00 H new ATOM 1192 N GLU A 91 151.197 7.874 -1.193 1.00 0.00 N ATOM 1193 CA GLU A 91 151.637 9.153 -0.653 1.00 0.00 C ATOM 1194 C GLU A 91 150.455 10.043 -0.285 1.00 0.00 C ATOM 1195 O GLU A 91 150.574 10.898 0.588 1.00 0.00 O ATOM 1196 CB GLU A 91 152.513 9.871 -1.678 1.00 0.00 C ATOM 1197 CG GLU A 91 153.108 11.134 -1.049 1.00 0.00 C ATOM 1198 CD GLU A 91 153.902 11.908 -2.096 1.00 0.00 C ATOM 1199 OE1 GLU A 91 153.911 11.482 -3.239 1.00 0.00 O ATOM 1200 OE2 GLU A 91 154.490 12.916 -1.739 1.00 0.00 O ATOM 0 H GLU A 91 151.542 7.669 -2.131 1.00 0.00 H new ATOM 0 HA GLU A 91 152.208 8.954 0.254 1.00 0.00 H new ATOM 0 HB2 GLU A 91 153.311 9.210 -2.016 1.00 0.00 H new ATOM 0 HB3 GLU A 91 151.923 10.133 -2.556 1.00 0.00 H new ATOM 0 HG2 GLU A 91 152.312 11.761 -0.647 1.00 0.00 H new ATOM 0 HG3 GLU A 91 153.755 10.865 -0.214 1.00 0.00 H new ATOM 1207 N ASN A 92 149.327 9.871 -0.968 1.00 0.00 N ATOM 1208 CA ASN A 92 148.168 10.711 -0.695 1.00 0.00 C ATOM 1209 C ASN A 92 147.288 10.152 0.425 1.00 0.00 C ATOM 1210 O ASN A 92 147.209 10.725 1.511 1.00 0.00 O ATOM 1211 CB ASN A 92 147.332 10.863 -1.968 1.00 0.00 C ATOM 1212 CG ASN A 92 148.203 11.391 -3.103 1.00 0.00 C ATOM 1213 OD1 ASN A 92 147.978 11.058 -4.266 1.00 0.00 O ATOM 1214 ND2 ASN A 92 149.194 12.197 -2.833 1.00 0.00 N ATOM 0 H ASN A 92 149.192 9.173 -1.699 1.00 0.00 H new ATOM 0 HA ASN A 92 148.543 11.680 -0.365 1.00 0.00 H new ATOM 0 HB2 ASN A 92 146.900 9.902 -2.247 1.00 0.00 H new ATOM 0 HB3 ASN A 92 146.501 11.545 -1.788 1.00 0.00 H new ATOM 0 HD21 ASN A 92 149.783 12.552 -3.587 1.00 0.00 H new ATOM 0 HD22 ASN A 92 149.379 12.472 -1.868 1.00 0.00 H new ATOM 1219 N VAL A 93 146.609 9.049 0.137 1.00 0.00 N ATOM 1220 CA VAL A 93 145.704 8.427 1.098 1.00 0.00 C ATOM 1221 C VAL A 93 146.162 8.617 2.537 1.00 0.00 C ATOM 1222 O VAL A 93 145.472 9.233 3.346 1.00 0.00 O ATOM 1223 CB VAL A 93 145.594 6.925 0.812 1.00 0.00 C ATOM 1224 CG1 VAL A 93 146.945 6.373 0.343 1.00 0.00 C ATOM 1225 CG2 VAL A 93 145.174 6.189 2.088 1.00 0.00 C ATOM 0 H VAL A 93 146.668 8.564 -0.758 1.00 0.00 H new ATOM 0 HA VAL A 93 144.736 8.915 0.984 1.00 0.00 H new ATOM 0 HB VAL A 93 144.850 6.772 0.030 1.00 0.00 H new ATOM 0 HG11 VAL A 93 146.852 5.305 0.144 1.00 0.00 H new ATOM 0 HG12 VAL A 93 147.252 6.887 -0.568 1.00 0.00 H new ATOM 0 HG13 VAL A 93 147.693 6.533 1.119 1.00 0.00 H new ATOM 0 HG21 VAL A 93 145.096 5.121 1.883 1.00 0.00 H new ATOM 0 HG22 VAL A 93 145.919 6.356 2.866 1.00 0.00 H new ATOM 0 HG23 VAL A 93 144.208 6.565 2.424 1.00 0.00 H new ATOM 1229 N LYS A 94 147.300 8.037 2.857 1.00 0.00 N ATOM 1230 CA LYS A 94 147.821 8.091 4.208 1.00 0.00 C ATOM 1231 C LYS A 94 148.185 9.508 4.668 1.00 0.00 C ATOM 1232 O LYS A 94 148.081 9.809 5.857 1.00 0.00 O ATOM 1233 CB LYS A 94 149.046 7.180 4.309 1.00 0.00 C ATOM 1234 CG LYS A 94 148.635 5.736 3.990 1.00 0.00 C ATOM 1235 CD LYS A 94 149.844 4.815 4.170 1.00 0.00 C ATOM 1236 CE LYS A 94 149.504 3.413 3.661 1.00 0.00 C ATOM 1237 NZ LYS A 94 150.345 3.099 2.473 1.00 0.00 N ATOM 0 H LYS A 94 147.884 7.521 2.198 1.00 0.00 H new ATOM 0 HA LYS A 94 147.026 7.750 4.871 1.00 0.00 H new ATOM 0 HB2 LYS A 94 149.818 7.512 3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 94 149.473 7.236 5.310 1.00 0.00 H new ATOM 0 HG2 LYS A 94 147.824 5.423 4.647 1.00 0.00 H new ATOM 0 HG3 LYS A 94 148.261 5.669 2.968 1.00 0.00 H new ATOM 0 HD2 LYS A 94 150.700 5.212 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 94 150.127 4.772 5.222 1.00 0.00 H new ATOM 0 HE2 LYS A 94 149.676 2.677 4.447 1.00 0.00 H new ATOM 0 HE3 LYS A 94 148.448 3.356 3.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 150.628 2.099 2.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 149.801 3.279 1.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 151.194 3.699 2.480 1.00 0.00 H new ATOM 1251 N GLU A 95 148.649 10.365 3.756 1.00 0.00 N ATOM 1252 CA GLU A 95 149.055 11.716 4.160 1.00 0.00 C ATOM 1253 C GLU A 95 148.091 12.819 3.709 1.00 0.00 C ATOM 1254 O GLU A 95 147.538 13.531 4.540 1.00 0.00 O ATOM 1255 CB GLU A 95 150.446 12.026 3.606 1.00 0.00 C ATOM 1256 CG GLU A 95 151.441 10.967 4.088 1.00 0.00 C ATOM 1257 CD GLU A 95 152.844 11.319 3.607 1.00 0.00 C ATOM 1258 OE1 GLU A 95 152.963 12.231 2.804 1.00 0.00 O ATOM 1259 OE2 GLU A 95 153.780 10.671 4.045 1.00 0.00 O ATOM 0 H GLU A 95 148.752 10.159 2.762 1.00 0.00 H new ATOM 0 HA GLU A 95 149.050 11.714 5.250 1.00 0.00 H new ATOM 0 HB2 GLU A 95 150.418 12.044 2.516 1.00 0.00 H new ATOM 0 HB3 GLU A 95 150.766 13.015 3.933 1.00 0.00 H new ATOM 0 HG2 GLU A 95 151.424 10.908 5.176 1.00 0.00 H new ATOM 0 HG3 GLU A 95 151.153 9.986 3.711 1.00 0.00 H new ATOM 1266 N LYS A 96 147.948 12.999 2.397 1.00 0.00 N ATOM 1267 CA LYS A 96 147.102 14.074 1.856 1.00 0.00 C ATOM 1268 C LYS A 96 145.622 13.958 2.237 1.00 0.00 C ATOM 1269 O LYS A 96 144.972 14.970 2.510 1.00 0.00 O ATOM 1270 CB LYS A 96 147.223 14.112 0.331 1.00 0.00 C ATOM 1271 CG LYS A 96 148.689 14.325 -0.074 1.00 0.00 C ATOM 1272 CD LYS A 96 149.131 15.748 0.282 1.00 0.00 C ATOM 1273 CE LYS A 96 150.373 16.110 -0.534 1.00 0.00 C ATOM 1274 NZ LYS A 96 149.970 16.917 -1.718 1.00 0.00 N ATOM 0 H LYS A 96 148.401 12.421 1.689 1.00 0.00 H new ATOM 0 HA LYS A 96 147.470 14.997 2.305 1.00 0.00 H new ATOM 0 HB2 LYS A 96 146.851 13.180 -0.095 1.00 0.00 H new ATOM 0 HB3 LYS A 96 146.606 14.915 -0.071 1.00 0.00 H new ATOM 0 HG2 LYS A 96 149.324 13.600 0.435 1.00 0.00 H new ATOM 0 HG3 LYS A 96 148.807 14.156 -1.144 1.00 0.00 H new ATOM 0 HD2 LYS A 96 148.327 16.454 0.074 1.00 0.00 H new ATOM 0 HD3 LYS A 96 149.349 15.818 1.348 1.00 0.00 H new ATOM 0 HE2 LYS A 96 151.075 16.673 0.082 1.00 0.00 H new ATOM 0 HE3 LYS A 96 150.887 15.204 -0.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 150.814 17.164 -2.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 149.316 16.364 -2.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 149.498 17.788 -1.400 1.00 0.00 H new ATOM 1288 N TRP A 97 145.074 12.749 2.257 1.00 0.00 N ATOM 1289 CA TRP A 97 143.662 12.592 2.605 1.00 0.00 C ATOM 1290 C TRP A 97 143.443 12.715 4.111 1.00 0.00 C ATOM 1291 O TRP A 97 142.385 13.161 4.556 1.00 0.00 O ATOM 1292 CB TRP A 97 143.138 11.245 2.103 1.00 0.00 C ATOM 1293 CG TRP A 97 142.954 11.305 0.618 1.00 0.00 C ATOM 1294 CD1 TRP A 97 143.927 11.083 -0.295 1.00 0.00 C ATOM 1295 CD2 TRP A 97 141.746 11.602 -0.141 1.00 0.00 C ATOM 1296 NE1 TRP A 97 143.396 11.217 -1.562 1.00 0.00 N ATOM 1297 CE2 TRP A 97 142.053 11.539 -1.521 1.00 0.00 C ATOM 1298 CE3 TRP A 97 140.427 11.916 0.232 1.00 0.00 C ATOM 1299 CZ2 TRP A 97 141.085 11.779 -2.497 1.00 0.00 C ATOM 1300 CZ3 TRP A 97 139.450 12.158 -0.748 1.00 0.00 C ATOM 1301 CH2 TRP A 97 139.779 12.091 -2.109 1.00 0.00 C ATOM 0 H TRP A 97 145.568 11.882 2.043 1.00 0.00 H new ATOM 0 HA TRP A 97 143.107 13.394 2.118 1.00 0.00 H new ATOM 0 HB2 TRP A 97 143.838 10.451 2.362 1.00 0.00 H new ATOM 0 HB3 TRP A 97 142.192 11.007 2.588 1.00 0.00 H new ATOM 0 HD1 TRP A 97 144.955 10.840 -0.069 1.00 0.00 H new ATOM 0 HE1 TRP A 97 143.929 11.094 -2.423 1.00 0.00 H new ATOM 0 HE3 TRP A 97 140.164 11.971 1.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 141.343 11.724 -3.544 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 138.440 12.397 -0.451 1.00 0.00 H new ATOM 0 HH2 TRP A 97 139.024 12.280 -2.857 1.00 0.00 H new ATOM 1312 N VAL A 98 144.442 12.317 4.891 1.00 0.00 N ATOM 1313 CA VAL A 98 144.338 12.389 6.348 1.00 0.00 C ATOM 1314 C VAL A 98 143.771 13.737 6.815 1.00 0.00 C ATOM 1315 O VAL A 98 142.778 13.764 7.542 1.00 0.00 O ATOM 1316 CB VAL A 98 145.705 12.143 6.992 1.00 0.00 C ATOM 1317 CG1 VAL A 98 145.777 12.866 8.339 1.00 0.00 C ATOM 1318 CG2 VAL A 98 145.892 10.642 7.220 1.00 0.00 C ATOM 0 H VAL A 98 145.326 11.944 4.545 1.00 0.00 H new ATOM 0 HA VAL A 98 143.645 11.610 6.664 1.00 0.00 H new ATOM 0 HB VAL A 98 146.488 12.520 6.334 1.00 0.00 H new ATOM 0 HG11 VAL A 98 146.751 12.689 8.795 1.00 0.00 H new ATOM 0 HG12 VAL A 98 145.637 13.936 8.186 1.00 0.00 H new ATOM 0 HG13 VAL A 98 144.994 12.488 8.997 1.00 0.00 H new ATOM 0 HG21 VAL A 98 146.864 10.462 7.679 1.00 0.00 H new ATOM 0 HG22 VAL A 98 145.106 10.273 7.879 1.00 0.00 H new ATOM 0 HG23 VAL A 98 145.839 10.120 6.265 1.00 0.00 H new ATOM 1322 N PRO A 99 144.362 14.849 6.434 1.00 0.00 N ATOM 1323 CA PRO A 99 143.863 16.187 6.859 1.00 0.00 C ATOM 1324 C PRO A 99 142.433 16.428 6.396 1.00 0.00 C ATOM 1325 O PRO A 99 141.634 17.034 7.111 1.00 0.00 O ATOM 1326 CB PRO A 99 144.826 17.185 6.208 1.00 0.00 C ATOM 1327 CG PRO A 99 145.527 16.427 5.133 1.00 0.00 C ATOM 1328 CD PRO A 99 145.542 14.967 5.571 1.00 0.00 C ATOM 0 HA PRO A 99 143.837 16.282 7.945 1.00 0.00 H new ATOM 0 HB2 PRO A 99 144.287 18.038 5.797 1.00 0.00 H new ATOM 0 HB3 PRO A 99 145.535 17.577 6.937 1.00 0.00 H new ATOM 0 HG2 PRO A 99 145.012 16.540 4.179 1.00 0.00 H new ATOM 0 HG3 PRO A 99 146.541 16.800 4.994 1.00 0.00 H new ATOM 0 HD2 PRO A 99 145.482 14.292 4.717 1.00 0.00 H new ATOM 0 HD3 PRO A 99 146.457 14.720 6.109 1.00 0.00 H new ATOM 1336 N GLU A 100 142.109 15.946 5.198 1.00 0.00 N ATOM 1337 CA GLU A 100 140.759 16.122 4.677 1.00 0.00 C ATOM 1338 C GLU A 100 139.755 15.471 5.620 1.00 0.00 C ATOM 1339 O GLU A 100 138.719 16.054 5.941 1.00 0.00 O ATOM 1340 CB GLU A 100 140.640 15.497 3.287 1.00 0.00 C ATOM 1341 CG GLU A 100 139.263 15.819 2.704 1.00 0.00 C ATOM 1342 CD GLU A 100 139.095 15.135 1.351 1.00 0.00 C ATOM 1343 OE1 GLU A 100 140.014 14.445 0.941 1.00 0.00 O ATOM 1344 OE2 GLU A 100 138.052 15.314 0.746 1.00 0.00 O ATOM 0 H GLU A 100 142.748 15.442 4.583 1.00 0.00 H new ATOM 0 HA GLU A 100 140.548 17.189 4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 100 141.423 15.882 2.634 1.00 0.00 H new ATOM 0 HB3 GLU A 100 140.778 14.418 3.348 1.00 0.00 H new ATOM 0 HG2 GLU A 100 138.483 15.486 3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 100 139.150 16.897 2.592 1.00 0.00 H new ATOM 1351 N ILE A 101 140.080 14.264 6.074 1.00 0.00 N ATOM 1352 CA ILE A 101 139.213 13.545 6.998 1.00 0.00 C ATOM 1353 C ILE A 101 139.344 14.125 8.403 1.00 0.00 C ATOM 1354 O ILE A 101 138.394 14.113 9.185 1.00 0.00 O ATOM 1355 CB ILE A 101 139.580 12.062 7.018 1.00 0.00 C ATOM 1356 CG1 ILE A 101 139.419 11.482 5.609 1.00 0.00 C ATOM 1357 CG2 ILE A 101 138.655 11.322 7.988 1.00 0.00 C ATOM 1358 CD1 ILE A 101 139.939 10.043 5.580 1.00 0.00 C ATOM 0 H ILE A 101 140.933 13.767 5.818 1.00 0.00 H new ATOM 0 HA ILE A 101 138.182 13.654 6.662 1.00 0.00 H new ATOM 0 HB ILE A 101 140.613 11.944 7.344 1.00 0.00 H new ATOM 0 HG12 ILE A 101 138.370 11.506 5.313 1.00 0.00 H new ATOM 0 HG13 ILE A 101 139.967 12.091 4.890 1.00 0.00 H new ATOM 0 HG21 ILE A 101 138.916 10.264 8.003 1.00 0.00 H new ATOM 0 HG22 ILE A 101 138.769 11.738 8.989 1.00 0.00 H new ATOM 0 HG23 ILE A 101 137.621 11.436 7.663 1.00 0.00 H new ATOM 0 HD11 ILE A 101 139.823 9.634 4.576 1.00 0.00 H new ATOM 0 HD12 ILE A 101 140.993 10.031 5.857 1.00 0.00 H new ATOM 0 HD13 ILE A 101 139.372 9.437 6.287 1.00 0.00 H new ATOM 1362 N THR A 102 140.537 14.625 8.712 1.00 0.00 N ATOM 1363 CA THR A 102 140.805 15.203 10.026 1.00 0.00 C ATOM 1364 C THR A 102 139.769 16.267 10.377 1.00 0.00 C ATOM 1365 O THR A 102 139.358 16.384 11.531 1.00 0.00 O ATOM 1366 CB THR A 102 142.201 15.830 10.042 1.00 0.00 C ATOM 1367 OG1 THR A 102 143.156 14.865 9.624 1.00 0.00 O ATOM 1368 CG2 THR A 102 142.539 16.308 11.455 1.00 0.00 C ATOM 0 H THR A 102 141.332 14.642 8.073 1.00 0.00 H new ATOM 0 HA THR A 102 140.749 14.405 10.766 1.00 0.00 H new ATOM 0 HB THR A 102 142.222 16.682 9.363 1.00 0.00 H new ATOM 0 HG1 THR A 102 142.705 14.154 9.123 1.00 0.00 H new ATOM 0 HG21 THR A 102 143.534 16.753 11.460 1.00 0.00 H new ATOM 0 HG22 THR A 102 141.807 17.051 11.773 1.00 0.00 H new ATOM 0 HG23 THR A 102 142.517 15.461 12.141 1.00 0.00 H new ATOM 1373 N HIS A 103 139.351 17.043 9.382 1.00 0.00 N ATOM 1374 CA HIS A 103 138.366 18.092 9.619 1.00 0.00 C ATOM 1375 C HIS A 103 137.175 17.532 10.389 1.00 0.00 C ATOM 1376 O HIS A 103 136.649 18.180 11.295 1.00 0.00 O ATOM 1377 CB HIS A 103 137.894 18.680 8.289 1.00 0.00 C ATOM 1378 CG HIS A 103 139.062 19.303 7.577 1.00 0.00 C ATOM 1379 ND1 HIS A 103 139.952 20.152 8.219 1.00 0.00 N ATOM 1380 CD2 HIS A 103 139.502 19.211 6.280 1.00 0.00 C ATOM 1381 CE1 HIS A 103 140.873 20.533 7.315 1.00 0.00 C ATOM 1382 NE2 HIS A 103 140.644 19.989 6.117 1.00 0.00 N ATOM 0 H HIS A 103 139.673 16.968 8.417 1.00 0.00 H new ATOM 0 HA HIS A 103 138.831 18.880 10.211 1.00 0.00 H new ATOM 0 HB2 HIS A 103 137.451 17.900 7.670 1.00 0.00 H new ATOM 0 HB3 HIS A 103 137.119 19.427 8.463 1.00 0.00 H new ATOM 0 HD2 HIS A 103 139.033 18.624 5.504 1.00 0.00 H new ATOM 0 HE1 HIS A 103 141.696 21.197 7.532 1.00 0.00 H new ATOM 0 HE2 HIS A 103 141.190 20.117 5.265 1.00 0.00 H new ATOM 1390 N HIS A 104 136.765 16.319 10.035 1.00 0.00 N ATOM 1391 CA HIS A 104 135.646 15.674 10.711 1.00 0.00 C ATOM 1392 C HIS A 104 136.104 15.098 12.048 1.00 0.00 C ATOM 1393 O HIS A 104 135.294 14.848 12.940 1.00 0.00 O ATOM 1394 CB HIS A 104 135.080 14.552 9.835 1.00 0.00 C ATOM 1395 CG HIS A 104 134.430 15.142 8.614 1.00 0.00 C ATOM 1396 ND1 HIS A 104 135.150 15.450 7.471 1.00 0.00 N ATOM 1397 CD2 HIS A 104 133.128 15.478 8.338 1.00 0.00 C ATOM 1398 CE1 HIS A 104 134.285 15.946 6.568 1.00 0.00 C ATOM 1399 NE2 HIS A 104 133.039 15.985 7.046 1.00 0.00 N ATOM 0 H HIS A 104 137.187 15.766 9.289 1.00 0.00 H new ATOM 0 HA HIS A 104 134.869 16.417 10.889 1.00 0.00 H new ATOM 0 HB2 HIS A 104 135.878 13.870 9.541 1.00 0.00 H new ATOM 0 HB3 HIS A 104 134.353 13.968 10.400 1.00 0.00 H new ATOM 0 HD2 HIS A 104 132.299 15.366 9.021 1.00 0.00 H new ATOM 0 HE1 HIS A 104 134.564 16.273 5.577 1.00 0.00 H new ATOM 0 HE2 HIS A 104 132.202 16.316 6.567 1.00 0.00 H new ATOM 1407 N CYS A 105 137.412 14.889 12.174 1.00 0.00 N ATOM 1408 CA CYS A 105 137.980 14.341 13.400 1.00 0.00 C ATOM 1409 C CYS A 105 137.078 13.254 13.976 1.00 0.00 C ATOM 1410 O CYS A 105 136.619 13.353 15.114 1.00 0.00 O ATOM 1411 CB CYS A 105 138.167 15.452 14.435 1.00 0.00 C ATOM 1412 SG CYS A 105 136.643 16.419 14.569 1.00 0.00 S ATOM 0 H CYS A 105 138.096 15.090 11.444 1.00 0.00 H new ATOM 0 HA CYS A 105 138.948 13.902 13.159 1.00 0.00 H new ATOM 0 HB2 CYS A 105 138.423 15.022 15.403 1.00 0.00 H new ATOM 0 HB3 CYS A 105 138.995 16.098 14.144 1.00 0.00 H new ATOM 0 HG CYS A 105 135.650 15.732 14.087 1.00 0.00 H new ATOM 1418 N PRO A 106 136.823 12.226 13.213 1.00 0.00 N ATOM 1419 CA PRO A 106 135.963 11.092 13.649 1.00 0.00 C ATOM 1420 C PRO A 106 136.699 10.139 14.584 1.00 0.00 C ATOM 1421 O PRO A 106 137.832 9.740 14.309 1.00 0.00 O ATOM 1422 CB PRO A 106 135.606 10.396 12.337 1.00 0.00 C ATOM 1423 CG PRO A 106 136.752 10.680 11.422 1.00 0.00 C ATOM 1424 CD PRO A 106 137.332 12.032 11.846 1.00 0.00 C ATOM 0 HA PRO A 106 135.094 11.427 14.215 1.00 0.00 H new ATOM 0 HB2 PRO A 106 135.474 9.324 12.483 1.00 0.00 H new ATOM 0 HB3 PRO A 106 134.671 10.780 11.929 1.00 0.00 H new ATOM 0 HG2 PRO A 106 137.506 9.896 11.493 1.00 0.00 H new ATOM 0 HG3 PRO A 106 136.420 10.710 10.384 1.00 0.00 H new ATOM 0 HD2 PRO A 106 138.422 12.023 11.824 1.00 0.00 H new ATOM 0 HD3 PRO A 106 137.006 12.832 11.182 1.00 0.00 H new ATOM 1432 N LYS A 107 136.051 9.768 15.681 1.00 0.00 N ATOM 1433 CA LYS A 107 136.660 8.851 16.636 1.00 0.00 C ATOM 1434 C LYS A 107 136.328 7.410 16.266 1.00 0.00 C ATOM 1435 O LYS A 107 136.760 6.469 16.933 1.00 0.00 O ATOM 1436 CB LYS A 107 136.154 9.152 18.048 1.00 0.00 C ATOM 1437 CG LYS A 107 136.594 10.559 18.459 1.00 0.00 C ATOM 1438 CD LYS A 107 136.212 10.810 19.919 1.00 0.00 C ATOM 1439 CE LYS A 107 136.534 12.257 20.293 1.00 0.00 C ATOM 1440 NZ LYS A 107 137.956 12.354 20.729 1.00 0.00 N ATOM 0 H LYS A 107 135.114 10.084 15.930 1.00 0.00 H new ATOM 0 HA LYS A 107 137.741 8.985 16.608 1.00 0.00 H new ATOM 0 HB2 LYS A 107 135.067 9.075 18.080 1.00 0.00 H new ATOM 0 HB3 LYS A 107 136.546 8.417 18.751 1.00 0.00 H new ATOM 0 HG2 LYS A 107 137.671 10.666 18.331 1.00 0.00 H new ATOM 0 HG3 LYS A 107 136.121 11.301 17.816 1.00 0.00 H new ATOM 0 HD2 LYS A 107 135.150 10.614 20.066 1.00 0.00 H new ATOM 0 HD3 LYS A 107 136.756 10.126 20.570 1.00 0.00 H new ATOM 0 HE2 LYS A 107 136.359 12.912 19.439 1.00 0.00 H new ATOM 0 HE3 LYS A 107 135.874 12.592 21.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 138.175 13.338 20.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 138.108 11.741 21.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 138.578 12.050 19.953 1.00 0.00 H new ATOM 1454 N THR A 108 135.554 7.248 15.197 1.00 0.00 N ATOM 1455 CA THR A 108 135.161 5.921 14.738 1.00 0.00 C ATOM 1456 C THR A 108 136.321 5.230 14.024 1.00 0.00 C ATOM 1457 O THR A 108 137.219 5.889 13.500 1.00 0.00 O ATOM 1458 CB THR A 108 133.972 6.035 13.782 1.00 0.00 C ATOM 1459 OG1 THR A 108 133.999 7.310 13.153 1.00 0.00 O ATOM 1460 CG2 THR A 108 132.666 5.875 14.561 1.00 0.00 C ATOM 0 H THR A 108 135.188 8.016 14.635 1.00 0.00 H new ATOM 0 HA THR A 108 134.880 5.326 15.607 1.00 0.00 H new ATOM 0 HB THR A 108 134.035 5.252 13.027 1.00 0.00 H new ATOM 0 HG1 THR A 108 133.540 7.258 12.288 1.00 0.00 H new ATOM 0 HG21 THR A 108 131.822 5.957 13.876 1.00 0.00 H new ATOM 0 HG22 THR A 108 132.648 4.898 15.044 1.00 0.00 H new ATOM 0 HG23 THR A 108 132.596 6.656 15.318 1.00 0.00 H new ATOM 1465 N PRO A 109 136.312 3.923 13.988 1.00 0.00 N ATOM 1466 CA PRO A 109 137.380 3.126 13.315 1.00 0.00 C ATOM 1467 C PRO A 109 137.535 3.505 11.846 1.00 0.00 C ATOM 1468 O PRO A 109 136.571 3.911 11.195 1.00 0.00 O ATOM 1469 CB PRO A 109 136.915 1.671 13.446 1.00 0.00 C ATOM 1470 CG PRO A 109 135.484 1.725 13.873 1.00 0.00 C ATOM 1471 CD PRO A 109 135.286 3.059 14.584 1.00 0.00 C ATOM 0 HA PRO A 109 138.355 3.303 13.769 1.00 0.00 H new ATOM 0 HB2 PRO A 109 137.018 1.143 12.498 1.00 0.00 H new ATOM 0 HB3 PRO A 109 137.519 1.134 14.177 1.00 0.00 H new ATOM 0 HG2 PRO A 109 134.820 1.644 13.012 1.00 0.00 H new ATOM 0 HG3 PRO A 109 135.247 0.894 14.537 1.00 0.00 H new ATOM 0 HD2 PRO A 109 134.284 3.455 14.421 1.00 0.00 H new ATOM 0 HD3 PRO A 109 135.419 2.963 15.662 1.00 0.00 H new ATOM 1479 N PHE A 110 138.750 3.367 11.325 1.00 0.00 N ATOM 1480 CA PHE A 110 139.002 3.697 9.927 1.00 0.00 C ATOM 1481 C PHE A 110 139.727 2.546 9.246 1.00 0.00 C ATOM 1482 O PHE A 110 140.710 2.024 9.770 1.00 0.00 O ATOM 1483 CB PHE A 110 139.835 4.978 9.822 1.00 0.00 C ATOM 1484 CG PHE A 110 140.004 5.584 11.195 1.00 0.00 C ATOM 1485 CD1 PHE A 110 140.609 4.846 12.220 1.00 0.00 C ATOM 1486 CD2 PHE A 110 139.549 6.883 11.444 1.00 0.00 C ATOM 1487 CE1 PHE A 110 140.754 5.408 13.496 1.00 0.00 C ATOM 1488 CE2 PHE A 110 139.695 7.446 12.718 1.00 0.00 C ATOM 1489 CZ PHE A 110 140.297 6.708 13.743 1.00 0.00 C ATOM 0 H PHE A 110 139.565 3.034 11.841 1.00 0.00 H new ATOM 0 HA PHE A 110 138.047 3.862 9.428 1.00 0.00 H new ATOM 0 HB2 PHE A 110 140.810 4.756 9.389 1.00 0.00 H new ATOM 0 HB3 PHE A 110 139.345 5.689 9.157 1.00 0.00 H new ATOM 0 HD1 PHE A 110 140.964 3.844 12.027 1.00 0.00 H new ATOM 0 HD2 PHE A 110 139.084 7.453 10.653 1.00 0.00 H new ATOM 0 HE1 PHE A 110 141.218 4.839 14.288 1.00 0.00 H new ATOM 0 HE2 PHE A 110 139.343 8.449 12.909 1.00 0.00 H new ATOM 0 HZ PHE A 110 140.409 7.142 14.726 1.00 0.00 H new ATOM 1499 N LEU A 111 139.230 2.141 8.084 1.00 0.00 N ATOM 1500 CA LEU A 111 139.844 1.030 7.361 1.00 0.00 C ATOM 1501 C LEU A 111 140.860 1.514 6.332 1.00 0.00 C ATOM 1502 O LEU A 111 140.568 2.382 5.509 1.00 0.00 O ATOM 1503 CB LEU A 111 138.765 0.206 6.656 1.00 0.00 C ATOM 1504 CG LEU A 111 137.951 -0.570 7.695 1.00 0.00 C ATOM 1505 CD1 LEU A 111 137.143 0.407 8.552 1.00 0.00 C ATOM 1506 CD2 LEU A 111 136.997 -1.531 6.980 1.00 0.00 C ATOM 0 H LEU A 111 138.418 2.555 7.627 1.00 0.00 H new ATOM 0 HA LEU A 111 140.368 0.415 8.092 1.00 0.00 H new ATOM 0 HB2 LEU A 111 138.110 0.861 6.081 1.00 0.00 H new ATOM 0 HB3 LEU A 111 139.225 -0.485 5.949 1.00 0.00 H new ATOM 0 HG LEU A 111 138.628 -1.136 8.335 1.00 0.00 H new ATOM 0 HD11 LEU A 111 136.565 -0.149 9.290 1.00 0.00 H new ATOM 0 HD12 LEU A 111 137.822 1.091 9.062 1.00 0.00 H new ATOM 0 HD13 LEU A 111 136.466 0.976 7.915 1.00 0.00 H new ATOM 0 HD21 LEU A 111 136.417 -2.084 7.719 1.00 0.00 H new ATOM 0 HD22 LEU A 111 136.322 -0.964 6.339 1.00 0.00 H new ATOM 0 HD23 LEU A 111 137.572 -2.230 6.373 1.00 0.00 H new ATOM 1512 N LEU A 112 142.048 0.913 6.367 1.00 0.00 N ATOM 1513 CA LEU A 112 143.099 1.252 5.415 1.00 0.00 C ATOM 1514 C LEU A 112 143.158 0.171 4.347 1.00 0.00 C ATOM 1515 O LEU A 112 143.182 -1.018 4.663 1.00 0.00 O ATOM 1516 CB LEU A 112 144.453 1.356 6.124 1.00 0.00 C ATOM 1517 CG LEU A 112 145.525 1.779 5.116 1.00 0.00 C ATOM 1518 CD1 LEU A 112 145.241 3.200 4.625 1.00 0.00 C ATOM 1519 CD2 LEU A 112 146.898 1.738 5.789 1.00 0.00 C ATOM 0 H LEU A 112 142.304 0.192 7.042 1.00 0.00 H new ATOM 0 HA LEU A 112 142.877 2.217 4.959 1.00 0.00 H new ATOM 0 HB2 LEU A 112 144.396 2.081 6.936 1.00 0.00 H new ATOM 0 HB3 LEU A 112 144.716 0.397 6.571 1.00 0.00 H new ATOM 0 HG LEU A 112 145.512 1.096 4.267 1.00 0.00 H new ATOM 0 HD11 LEU A 112 146.006 3.497 3.908 1.00 0.00 H new ATOM 0 HD12 LEU A 112 144.263 3.230 4.145 1.00 0.00 H new ATOM 0 HD13 LEU A 112 145.251 3.886 5.472 1.00 0.00 H new ATOM 0 HD21 LEU A 112 147.663 2.039 5.073 1.00 0.00 H new ATOM 0 HD22 LEU A 112 146.907 2.421 6.639 1.00 0.00 H new ATOM 0 HD23 LEU A 112 147.103 0.725 6.135 1.00 0.00 H new ATOM 1525 N VAL A 113 143.158 0.574 3.084 1.00 0.00 N ATOM 1526 CA VAL A 113 143.188 -0.407 2.003 1.00 0.00 C ATOM 1527 C VAL A 113 143.861 0.154 0.758 1.00 0.00 C ATOM 1528 O VAL A 113 144.280 1.312 0.728 1.00 0.00 O ATOM 1529 CB VAL A 113 141.765 -0.853 1.642 1.00 0.00 C ATOM 1530 CG1 VAL A 113 141.716 -2.381 1.565 1.00 0.00 C ATOM 1531 CG2 VAL A 113 140.771 -0.373 2.704 1.00 0.00 C ATOM 0 H VAL A 113 143.138 1.549 2.785 1.00 0.00 H new ATOM 0 HA VAL A 113 143.764 -1.261 2.359 1.00 0.00 H new ATOM 0 HB VAL A 113 141.495 -0.421 0.679 1.00 0.00 H new ATOM 0 HG11 VAL A 113 140.706 -2.700 1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 113 142.411 -2.729 0.801 1.00 0.00 H new ATOM 0 HG13 VAL A 113 141.996 -2.803 2.530 1.00 0.00 H new ATOM 0 HG21 VAL A 113 139.766 -0.697 2.434 1.00 0.00 H new ATOM 0 HG22 VAL A 113 141.041 -0.795 3.672 1.00 0.00 H new ATOM 0 HG23 VAL A 113 140.798 0.715 2.762 1.00 0.00 H new ATOM 1535 N GLY A 114 143.944 -0.681 -0.274 1.00 0.00 N ATOM 1536 CA GLY A 114 144.550 -0.273 -1.532 1.00 0.00 C ATOM 1537 C GLY A 114 143.902 -0.997 -2.705 1.00 0.00 C ATOM 1538 O GLY A 114 143.014 -1.828 -2.516 1.00 0.00 O ATOM 0 H GLY A 114 143.600 -1.641 -0.262 1.00 0.00 H new ATOM 0 HA2 GLY A 114 144.443 0.804 -1.660 1.00 0.00 H new ATOM 0 HA3 GLY A 114 145.619 -0.487 -1.512 1.00 0.00 H new ATOM 1542 N THR A 115 144.356 -0.691 -3.916 1.00 0.00 N ATOM 1543 CA THR A 115 143.814 -1.334 -5.103 1.00 0.00 C ATOM 1544 C THR A 115 144.940 -1.904 -5.956 1.00 0.00 C ATOM 1545 O THR A 115 146.109 -1.564 -5.767 1.00 0.00 O ATOM 1546 CB THR A 115 142.955 -0.353 -5.918 1.00 0.00 C ATOM 1547 OG1 THR A 115 142.248 -1.073 -6.917 1.00 0.00 O ATOM 1548 CG2 THR A 115 143.823 0.720 -6.585 1.00 0.00 C ATOM 0 H THR A 115 145.091 -0.008 -4.099 1.00 0.00 H new ATOM 0 HA THR A 115 143.171 -2.154 -4.784 1.00 0.00 H new ATOM 0 HB THR A 115 142.258 0.142 -5.241 1.00 0.00 H new ATOM 0 HG1 THR A 115 141.301 -1.128 -6.672 1.00 0.00 H new ATOM 0 HG21 THR A 115 143.188 1.399 -7.154 1.00 0.00 H new ATOM 0 HG22 THR A 115 144.360 1.281 -5.820 1.00 0.00 H new ATOM 0 HG23 THR A 115 144.538 0.244 -7.256 1.00 0.00 H new ATOM 1553 N GLN A 116 144.583 -2.789 -6.872 1.00 0.00 N ATOM 1554 CA GLN A 116 145.572 -3.426 -7.728 1.00 0.00 C ATOM 1555 C GLN A 116 146.632 -4.127 -6.881 1.00 0.00 C ATOM 1556 O GLN A 116 147.717 -4.450 -7.378 1.00 0.00 O ATOM 1557 CB GLN A 116 146.237 -2.379 -8.623 1.00 0.00 C ATOM 1558 CG GLN A 116 145.197 -1.773 -9.566 1.00 0.00 C ATOM 1559 CD GLN A 116 145.848 -0.709 -10.442 1.00 0.00 C ATOM 1560 OE1 GLN A 116 146.694 0.051 -9.971 1.00 0.00 O ATOM 1561 NE2 GLN A 116 145.508 -0.614 -11.697 1.00 0.00 N ATOM 0 H GLN A 116 143.621 -3.082 -7.042 1.00 0.00 H new ATOM 0 HA GLN A 116 145.071 -4.167 -8.351 1.00 0.00 H new ATOM 0 HB2 GLN A 116 146.687 -1.597 -8.012 1.00 0.00 H new ATOM 0 HB3 GLN A 116 147.041 -2.837 -9.199 1.00 0.00 H new ATOM 0 HG2 GLN A 116 144.761 -2.553 -10.190 1.00 0.00 H new ATOM 0 HG3 GLN A 116 144.383 -1.334 -8.989 1.00 0.00 H new ATOM 0 HE21 GLN A 116 144.807 -1.245 -12.085 1.00 0.00 H new ATOM 0 HE22 GLN A 116 145.943 0.091 -12.291 1.00 0.00 H new ATOM 1568 N ILE A 117 146.310 -4.377 -5.604 1.00 0.00 N ATOM 1569 CA ILE A 117 147.245 -5.039 -4.714 1.00 0.00 C ATOM 1570 C ILE A 117 148.674 -4.640 -5.055 1.00 0.00 C ATOM 1571 O ILE A 117 148.911 -3.538 -5.551 1.00 0.00 O ATOM 1572 CB ILE A 117 147.066 -6.554 -4.817 1.00 0.00 C ATOM 1573 CG1 ILE A 117 147.412 -7.048 -6.231 1.00 0.00 C ATOM 1574 CG2 ILE A 117 145.609 -6.890 -4.534 1.00 0.00 C ATOM 1575 CD1 ILE A 117 147.761 -8.536 -6.175 1.00 0.00 C ATOM 0 H ILE A 117 145.417 -4.130 -5.178 1.00 0.00 H new ATOM 0 HA ILE A 117 147.044 -4.730 -3.688 1.00 0.00 H new ATOM 0 HB ILE A 117 147.729 -7.037 -4.099 1.00 0.00 H new ATOM 0 HG12 ILE A 117 146.569 -6.886 -6.902 1.00 0.00 H new ATOM 0 HG13 ILE A 117 148.252 -6.480 -6.632 1.00 0.00 H new ATOM 0 HG21 ILE A 117 145.464 -7.968 -4.604 1.00 0.00 H new ATOM 0 HG22 ILE A 117 145.346 -6.552 -3.532 1.00 0.00 H new ATOM 0 HG23 ILE A 117 144.972 -6.390 -5.264 1.00 0.00 H new ATOM 0 HD11 ILE A 117 148.007 -8.890 -7.176 1.00 0.00 H new ATOM 0 HD12 ILE A 117 148.617 -8.684 -5.517 1.00 0.00 H new ATOM 0 HD13 ILE A 117 146.908 -9.096 -5.792 1.00 0.00 H new ATOM 1579 N ASP A 118 149.622 -5.533 -4.802 1.00 0.00 N ATOM 1580 CA ASP A 118 151.014 -5.245 -5.107 1.00 0.00 C ATOM 1581 C ASP A 118 151.550 -6.238 -6.135 1.00 0.00 C ATOM 1582 O ASP A 118 152.761 -6.395 -6.288 1.00 0.00 O ATOM 1583 CB ASP A 118 151.854 -5.321 -3.828 1.00 0.00 C ATOM 1584 CG ASP A 118 151.857 -6.747 -3.286 1.00 0.00 C ATOM 1585 OD1 ASP A 118 151.448 -7.639 -4.010 1.00 0.00 O ATOM 1586 OD2 ASP A 118 152.268 -6.926 -2.151 1.00 0.00 O ATOM 0 H ASP A 118 149.454 -6.452 -4.391 1.00 0.00 H new ATOM 0 HA ASP A 118 151.079 -4.239 -5.523 1.00 0.00 H new ATOM 0 HB2 ASP A 118 152.875 -5.000 -4.035 1.00 0.00 H new ATOM 0 HB3 ASP A 118 151.451 -4.640 -3.078 1.00 0.00 H new ATOM 1591 N LEU A 119 150.637 -6.920 -6.822 1.00 0.00 N ATOM 1592 CA LEU A 119 151.030 -7.916 -7.814 1.00 0.00 C ATOM 1593 C LEU A 119 150.074 -7.950 -9.013 1.00 0.00 C ATOM 1594 O LEU A 119 150.514 -8.171 -10.141 1.00 0.00 O ATOM 1595 CB LEU A 119 151.069 -9.301 -7.161 1.00 0.00 C ATOM 1596 CG LEU A 119 152.372 -10.025 -7.522 1.00 0.00 C ATOM 1597 CD1 LEU A 119 152.525 -10.101 -9.043 1.00 0.00 C ATOM 1598 CD2 LEU A 119 153.564 -9.270 -6.928 1.00 0.00 C ATOM 0 H LEU A 119 149.630 -6.803 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 119 152.017 -7.638 -8.183 1.00 0.00 H new ATOM 0 HB2 LEU A 119 150.988 -9.202 -6.079 1.00 0.00 H new ATOM 0 HB3 LEU A 119 150.214 -9.891 -7.492 1.00 0.00 H new ATOM 0 HG LEU A 119 152.340 -11.035 -7.113 1.00 0.00 H new ATOM 0 HD11 LEU A 119 153.453 -10.617 -9.290 1.00 0.00 H new ATOM 0 HD12 LEU A 119 151.682 -10.647 -9.467 1.00 0.00 H new ATOM 0 HD13 LEU A 119 152.549 -9.093 -9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 119 154.488 -9.787 -7.187 1.00 0.00 H new ATOM 0 HD22 LEU A 119 153.590 -8.257 -7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 119 153.464 -9.227 -5.843 1.00 0.00 H new ATOM 1604 N ARG A 120 148.771 -7.747 -8.788 1.00 0.00 N ATOM 1605 CA ARG A 120 147.830 -7.792 -9.908 1.00 0.00 C ATOM 1606 C ARG A 120 148.250 -6.798 -10.972 1.00 0.00 C ATOM 1607 O ARG A 120 148.339 -7.143 -12.150 1.00 0.00 O ATOM 1608 CB ARG A 120 146.401 -7.486 -9.456 1.00 0.00 C ATOM 1609 CG ARG A 120 145.457 -7.650 -10.650 1.00 0.00 C ATOM 1610 CD ARG A 120 144.009 -7.484 -10.187 1.00 0.00 C ATOM 1611 NE ARG A 120 143.725 -6.084 -9.896 1.00 0.00 N ATOM 1612 CZ ARG A 120 143.249 -5.269 -10.833 1.00 0.00 C ATOM 1613 NH1 ARG A 120 143.050 -5.711 -12.045 1.00 0.00 N ATOM 1614 NH2 ARG A 120 142.987 -4.023 -10.544 1.00 0.00 N ATOM 0 H ARG A 120 148.357 -7.557 -7.875 1.00 0.00 H new ATOM 0 HA ARG A 120 147.846 -8.802 -10.317 1.00 0.00 H new ATOM 0 HB2 ARG A 120 146.109 -8.158 -8.649 1.00 0.00 H new ATOM 0 HB3 ARG A 120 146.339 -6.471 -9.063 1.00 0.00 H new ATOM 0 HG2 ARG A 120 145.691 -6.911 -11.416 1.00 0.00 H new ATOM 0 HG3 ARG A 120 145.594 -8.632 -11.103 1.00 0.00 H new ATOM 0 HD2 ARG A 120 143.330 -7.846 -10.959 1.00 0.00 H new ATOM 0 HD3 ARG A 120 143.833 -8.090 -9.298 1.00 0.00 H new ATOM 0 HE ARG A 120 143.894 -5.723 -8.957 1.00 0.00 H new ATOM 0 HH11 ARG A 120 143.260 -6.683 -12.274 1.00 0.00 H new ATOM 0 HH12 ARG A 120 142.685 -5.085 -12.763 1.00 0.00 H new ATOM 0 HH21 ARG A 120 143.147 -3.674 -9.599 1.00 0.00 H new ATOM 0 HH22 ARG A 120 142.622 -3.399 -11.263 1.00 0.00 H new ATOM 1628 N ASP A 121 148.527 -5.566 -10.558 1.00 0.00 N ATOM 1629 CA ASP A 121 148.959 -4.553 -11.504 1.00 0.00 C ATOM 1630 C ASP A 121 149.977 -5.167 -12.443 1.00 0.00 C ATOM 1631 O ASP A 121 150.253 -4.620 -13.511 1.00 0.00 O ATOM 1632 CB ASP A 121 149.600 -3.379 -10.771 1.00 0.00 C ATOM 1633 CG ASP A 121 149.393 -2.091 -11.561 1.00 0.00 C ATOM 1634 OD1 ASP A 121 148.994 -2.180 -12.710 1.00 0.00 O ATOM 1635 OD2 ASP A 121 149.638 -1.033 -11.004 1.00 0.00 O ATOM 0 H ASP A 121 148.461 -5.252 -9.590 1.00 0.00 H new ATOM 0 HA ASP A 121 148.095 -4.191 -12.061 1.00 0.00 H new ATOM 0 HB2 ASP A 121 149.164 -3.279 -9.777 1.00 0.00 H new ATOM 0 HB3 ASP A 121 150.666 -3.564 -10.634 1.00 0.00 H new ATOM 1640 N ASP A 122 150.532 -6.307 -12.015 1.00 0.00 N ATOM 1641 CA ASP A 122 151.532 -7.038 -12.784 1.00 0.00 C ATOM 1642 C ASP A 122 152.099 -6.211 -13.936 1.00 0.00 C ATOM 1643 O ASP A 122 153.204 -5.701 -13.821 1.00 0.00 O ATOM 1644 CB ASP A 122 150.969 -8.373 -13.287 1.00 0.00 C ATOM 1645 CG ASP A 122 151.203 -9.456 -12.239 1.00 0.00 C ATOM 1646 OD1 ASP A 122 152.320 -9.559 -11.760 1.00 0.00 O ATOM 1647 OD2 ASP A 122 150.261 -10.168 -11.930 1.00 0.00 O ATOM 0 H ASP A 122 150.297 -6.745 -11.124 1.00 0.00 H new ATOM 0 HA ASP A 122 152.362 -7.248 -12.109 1.00 0.00 H new ATOM 0 HB2 ASP A 122 149.903 -8.275 -13.491 1.00 0.00 H new ATOM 0 HB3 ASP A 122 151.449 -8.651 -14.225 1.00 0.00 H new ATOM 1652 N PRO A 123 151.398 -6.039 -15.035 1.00 0.00 N ATOM 1653 CA PRO A 123 151.930 -5.234 -16.157 1.00 0.00 C ATOM 1654 C PRO A 123 152.792 -4.074 -15.658 1.00 0.00 C ATOM 1655 O PRO A 123 153.732 -3.655 -16.330 1.00 0.00 O ATOM 1656 CB PRO A 123 150.668 -4.724 -16.848 1.00 0.00 C ATOM 1657 CG PRO A 123 149.609 -5.746 -16.571 1.00 0.00 C ATOM 1658 CD PRO A 123 150.056 -6.567 -15.353 1.00 0.00 C ATOM 0 HA PRO A 123 152.580 -5.808 -16.817 1.00 0.00 H new ATOM 0 HB2 PRO A 123 150.379 -3.747 -16.462 1.00 0.00 H new ATOM 0 HB3 PRO A 123 150.829 -4.608 -17.920 1.00 0.00 H new ATOM 0 HG2 PRO A 123 148.653 -5.261 -16.375 1.00 0.00 H new ATOM 0 HG3 PRO A 123 149.467 -6.393 -17.437 1.00 0.00 H new ATOM 0 HD2 PRO A 123 149.370 -6.443 -14.515 1.00 0.00 H new ATOM 0 HD3 PRO A 123 150.091 -7.632 -15.581 1.00 0.00 H new ATOM 1666 N SER A 124 152.461 -3.563 -14.472 1.00 0.00 N ATOM 1667 CA SER A 124 153.212 -2.449 -13.899 1.00 0.00 C ATOM 1668 C SER A 124 154.220 -2.895 -12.833 1.00 0.00 C ATOM 1669 O SER A 124 155.276 -2.279 -12.691 1.00 0.00 O ATOM 1670 CB SER A 124 152.247 -1.434 -13.289 1.00 0.00 C ATOM 1671 OG SER A 124 151.247 -1.106 -14.244 1.00 0.00 O ATOM 0 H SER A 124 151.688 -3.898 -13.897 1.00 0.00 H new ATOM 0 HA SER A 124 153.779 -1.998 -14.713 1.00 0.00 H new ATOM 0 HB2 SER A 124 151.787 -1.846 -12.391 1.00 0.00 H new ATOM 0 HB3 SER A 124 152.787 -0.536 -12.988 1.00 0.00 H new ATOM 0 HG SER A 124 150.369 -1.381 -13.906 1.00 0.00 H new ATOM 1677 N THR A 125 153.901 -3.943 -12.070 1.00 0.00 N ATOM 1678 CA THR A 125 154.823 -4.394 -11.024 1.00 0.00 C ATOM 1679 C THR A 125 155.623 -5.608 -11.480 1.00 0.00 C ATOM 1680 O THR A 125 156.725 -5.852 -10.994 1.00 0.00 O ATOM 1681 CB THR A 125 154.066 -4.716 -9.729 1.00 0.00 C ATOM 1682 OG1 THR A 125 154.956 -5.327 -8.805 1.00 0.00 O ATOM 1683 CG2 THR A 125 152.903 -5.663 -10.014 1.00 0.00 C ATOM 0 H THR A 125 153.039 -4.482 -12.151 1.00 0.00 H new ATOM 0 HA THR A 125 155.520 -3.579 -10.827 1.00 0.00 H new ATOM 0 HB THR A 125 153.672 -3.790 -9.310 1.00 0.00 H new ATOM 0 HG1 THR A 125 154.476 -5.533 -7.976 1.00 0.00 H new ATOM 0 HG21 THR A 125 152.376 -5.882 -9.085 1.00 0.00 H new ATOM 0 HG22 THR A 125 152.216 -5.194 -10.719 1.00 0.00 H new ATOM 0 HG23 THR A 125 153.285 -6.590 -10.441 1.00 0.00 H new ATOM 1688 N ILE A 126 155.089 -6.339 -12.445 1.00 0.00 N ATOM 1689 CA ILE A 126 155.800 -7.492 -12.981 1.00 0.00 C ATOM 1690 C ILE A 126 156.815 -7.035 -14.029 1.00 0.00 C ATOM 1691 O ILE A 126 157.906 -7.593 -14.126 1.00 0.00 O ATOM 1692 CB ILE A 126 154.826 -8.494 -13.604 1.00 0.00 C ATOM 1693 CG1 ILE A 126 155.422 -9.901 -13.520 1.00 0.00 C ATOM 1694 CG2 ILE A 126 154.577 -8.142 -15.071 1.00 0.00 C ATOM 1695 CD1 ILE A 126 154.428 -10.913 -14.090 1.00 0.00 C ATOM 0 H ILE A 126 154.179 -6.160 -12.869 1.00 0.00 H new ATOM 0 HA ILE A 126 156.322 -7.985 -12.161 1.00 0.00 H new ATOM 0 HB ILE A 126 153.882 -8.457 -13.060 1.00 0.00 H new ATOM 0 HG12 ILE A 126 156.359 -9.944 -14.075 1.00 0.00 H new ATOM 0 HG13 ILE A 126 155.654 -10.148 -12.484 1.00 0.00 H new ATOM 0 HG21 ILE A 126 153.882 -8.861 -15.505 1.00 0.00 H new ATOM 0 HG22 ILE A 126 154.151 -7.141 -15.138 1.00 0.00 H new ATOM 0 HG23 ILE A 126 155.520 -8.173 -15.618 1.00 0.00 H new ATOM 0 HD11 ILE A 126 154.854 -11.915 -14.030 1.00 0.00 H new ATOM 0 HD12 ILE A 126 153.502 -10.877 -13.516 1.00 0.00 H new ATOM 0 HD13 ILE A 126 154.218 -10.670 -15.132 1.00 0.00 H new ATOM 1699 N GLU A 127 156.450 -6.016 -14.814 1.00 0.00 N ATOM 1700 CA GLU A 127 157.348 -5.502 -15.845 1.00 0.00 C ATOM 1701 C GLU A 127 158.450 -4.647 -15.235 1.00 0.00 C ATOM 1702 O GLU A 127 159.584 -4.648 -15.713 1.00 0.00 O ATOM 1703 CB GLU A 127 156.577 -4.657 -16.862 1.00 0.00 C ATOM 1704 CG GLU A 127 155.645 -5.546 -17.688 1.00 0.00 C ATOM 1705 CD GLU A 127 154.958 -4.714 -18.767 1.00 0.00 C ATOM 1706 OE1 GLU A 127 155.097 -3.503 -18.733 1.00 0.00 O ATOM 1707 OE2 GLU A 127 154.302 -5.302 -19.612 1.00 0.00 O ATOM 0 H GLU A 127 155.551 -5.538 -14.755 1.00 0.00 H new ATOM 0 HA GLU A 127 157.794 -6.362 -16.344 1.00 0.00 H new ATOM 0 HB2 GLU A 127 155.998 -3.891 -16.345 1.00 0.00 H new ATOM 0 HB3 GLU A 127 157.275 -4.139 -17.520 1.00 0.00 H new ATOM 0 HG2 GLU A 127 156.212 -6.356 -18.147 1.00 0.00 H new ATOM 0 HG3 GLU A 127 154.899 -6.006 -17.041 1.00 0.00 H new ATOM 1714 N LYS A 128 158.112 -3.902 -14.185 1.00 0.00 N ATOM 1715 CA LYS A 128 159.086 -3.034 -13.538 1.00 0.00 C ATOM 1716 C LYS A 128 159.701 -3.703 -12.314 1.00 0.00 C ATOM 1717 O LYS A 128 160.898 -3.988 -12.291 1.00 0.00 O ATOM 1718 CB LYS A 128 158.419 -1.720 -13.129 1.00 0.00 C ATOM 1719 CG LYS A 128 159.491 -0.723 -12.683 1.00 0.00 C ATOM 1720 CD LYS A 128 158.820 0.508 -12.067 1.00 0.00 C ATOM 1721 CE LYS A 128 158.052 1.275 -13.148 1.00 0.00 C ATOM 1722 NZ LYS A 128 156.590 1.039 -12.978 1.00 0.00 N ATOM 0 H LYS A 128 157.181 -3.883 -13.769 1.00 0.00 H new ATOM 0 HA LYS A 128 159.885 -2.834 -14.251 1.00 0.00 H new ATOM 0 HB2 LYS A 128 157.852 -1.311 -13.966 1.00 0.00 H new ATOM 0 HB3 LYS A 128 157.711 -1.896 -12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 128 160.156 -1.189 -11.956 1.00 0.00 H new ATOM 0 HG3 LYS A 128 160.105 -0.428 -13.534 1.00 0.00 H new ATOM 0 HD2 LYS A 128 158.140 0.203 -11.272 1.00 0.00 H new ATOM 0 HD3 LYS A 128 159.571 1.155 -11.614 1.00 0.00 H new ATOM 0 HE2 LYS A 128 158.270 2.341 -13.078 1.00 0.00 H new ATOM 0 HE3 LYS A 128 158.372 0.949 -14.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 156.097 1.258 -13.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 156.426 0.043 -12.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 156.225 1.651 -12.220 1.00 0.00 H new ATOM 1736 N LEU A 129 158.884 -3.945 -11.290 1.00 0.00 N ATOM 1737 CA LEU A 129 159.377 -4.573 -10.068 1.00 0.00 C ATOM 1738 C LEU A 129 159.542 -6.076 -10.258 1.00 0.00 C ATOM 1739 O LEU A 129 159.137 -6.864 -9.404 1.00 0.00 O ATOM 1740 CB LEU A 129 158.400 -4.315 -8.917 1.00 0.00 C ATOM 1741 CG LEU A 129 158.068 -2.825 -8.845 1.00 0.00 C ATOM 1742 CD1 LEU A 129 157.114 -2.572 -7.676 1.00 0.00 C ATOM 1743 CD2 LEU A 129 159.356 -2.028 -8.632 1.00 0.00 C ATOM 0 H LEU A 129 157.889 -3.718 -11.282 1.00 0.00 H new ATOM 0 HA LEU A 129 160.349 -4.139 -9.832 1.00 0.00 H new ATOM 0 HB2 LEU A 129 157.488 -4.894 -9.065 1.00 0.00 H new ATOM 0 HB3 LEU A 129 158.838 -4.645 -7.975 1.00 0.00 H new ATOM 0 HG LEU A 129 157.595 -2.511 -9.775 1.00 0.00 H new ATOM 0 HD11 LEU A 129 156.876 -1.509 -7.624 1.00 0.00 H new ATOM 0 HD12 LEU A 129 156.197 -3.142 -7.825 1.00 0.00 H new ATOM 0 HD13 LEU A 129 157.588 -2.884 -6.745 1.00 0.00 H new ATOM 0 HD21 LEU A 129 159.122 -0.965 -8.580 1.00 0.00 H new ATOM 0 HD22 LEU A 129 159.828 -2.341 -7.701 1.00 0.00 H new ATOM 0 HD23 LEU A 129 160.038 -2.209 -9.463 1.00 0.00 H new ATOM 1749 N ALA A 130 160.147 -6.470 -11.373 1.00 0.00 N ATOM 1750 CA ALA A 130 160.368 -7.884 -11.649 1.00 0.00 C ATOM 1751 C ALA A 130 161.623 -8.370 -10.924 1.00 0.00 C ATOM 1752 O ALA A 130 162.516 -8.961 -11.530 1.00 0.00 O ATOM 1753 CB ALA A 130 160.519 -8.097 -13.159 1.00 0.00 C ATOM 0 H ALA A 130 160.490 -5.836 -12.095 1.00 0.00 H new ATOM 0 HA ALA A 130 159.512 -8.456 -11.290 1.00 0.00 H new ATOM 0 HB1 ALA A 130 160.684 -9.155 -13.362 1.00 0.00 H new ATOM 0 HB2 ALA A 130 159.612 -7.767 -13.665 1.00 0.00 H new ATOM 0 HB3 ALA A 130 161.369 -7.520 -13.525 1.00 0.00 H new ATOM 1759 N LYS A 131 161.686 -8.098 -9.621 1.00 0.00 N ATOM 1760 CA LYS A 131 162.839 -8.494 -8.814 1.00 0.00 C ATOM 1761 C LYS A 131 164.088 -7.768 -9.298 1.00 0.00 C ATOM 1762 O LYS A 131 164.980 -8.361 -9.901 1.00 0.00 O ATOM 1763 CB LYS A 131 163.052 -10.011 -8.873 1.00 0.00 C ATOM 1764 CG LYS A 131 161.806 -10.721 -8.340 1.00 0.00 C ATOM 1765 CD LYS A 131 162.054 -12.230 -8.296 1.00 0.00 C ATOM 1766 CE LYS A 131 160.769 -12.948 -7.876 1.00 0.00 C ATOM 1767 NZ LYS A 131 159.614 -12.388 -8.632 1.00 0.00 N ATOM 0 H LYS A 131 160.956 -7.608 -9.104 1.00 0.00 H new ATOM 0 HA LYS A 131 162.645 -8.218 -7.778 1.00 0.00 H new ATOM 0 HB2 LYS A 131 163.250 -10.322 -9.899 1.00 0.00 H new ATOM 0 HB3 LYS A 131 163.924 -10.290 -8.281 1.00 0.00 H new ATOM 0 HG2 LYS A 131 161.564 -10.353 -7.343 1.00 0.00 H new ATOM 0 HG3 LYS A 131 160.949 -10.502 -8.977 1.00 0.00 H new ATOM 0 HD2 LYS A 131 162.378 -12.584 -9.275 1.00 0.00 H new ATOM 0 HD3 LYS A 131 162.856 -12.457 -7.593 1.00 0.00 H new ATOM 0 HE2 LYS A 131 160.858 -14.017 -8.068 1.00 0.00 H new ATOM 0 HE3 LYS A 131 160.607 -12.829 -6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 158.851 -13.094 -8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 159.268 -11.532 -8.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 159.915 -12.147 -9.598 1.00 0.00 H new ATOM 1781 N ASN A 132 164.135 -6.477 -9.003 1.00 0.00 N ATOM 1782 CA ASN A 132 165.269 -5.643 -9.377 1.00 0.00 C ATOM 1783 C ASN A 132 165.914 -5.091 -8.115 1.00 0.00 C ATOM 1784 O ASN A 132 166.199 -3.897 -8.021 1.00 0.00 O ATOM 1785 CB ASN A 132 164.810 -4.492 -10.273 1.00 0.00 C ATOM 1786 CG ASN A 132 164.296 -5.040 -11.600 1.00 0.00 C ATOM 1787 OD1 ASN A 132 164.604 -6.174 -11.966 1.00 0.00 O ATOM 1788 ND2 ASN A 132 163.524 -4.298 -12.347 1.00 0.00 N ATOM 0 H ASN A 132 163.397 -5.982 -8.503 1.00 0.00 H new ATOM 0 HA ASN A 132 165.992 -6.243 -9.930 1.00 0.00 H new ATOM 0 HB2 ASN A 132 164.024 -3.924 -9.776 1.00 0.00 H new ATOM 0 HB3 ASN A 132 165.637 -3.805 -10.449 1.00 0.00 H new ATOM 0 HD21 ASN A 132 163.175 -4.658 -13.235 1.00 0.00 H new ATOM 0 HD22 ASN A 132 163.270 -3.358 -12.042 1.00 0.00 H new ATOM 1793 N LYS A 133 166.111 -5.975 -7.141 1.00 0.00 N ATOM 1794 CA LYS A 133 166.694 -5.595 -5.862 1.00 0.00 C ATOM 1795 C LYS A 133 165.781 -4.607 -5.146 1.00 0.00 C ATOM 1796 O LYS A 133 166.249 -3.683 -4.480 1.00 0.00 O ATOM 1797 CB LYS A 133 168.082 -4.975 -6.058 1.00 0.00 C ATOM 1798 CG LYS A 133 169.020 -6.012 -6.679 1.00 0.00 C ATOM 1799 CD LYS A 133 170.433 -5.433 -6.773 1.00 0.00 C ATOM 1800 CE LYS A 133 171.348 -6.432 -7.485 1.00 0.00 C ATOM 1801 NZ LYS A 133 172.765 -6.161 -7.111 1.00 0.00 N ATOM 0 H LYS A 133 165.873 -6.964 -7.216 1.00 0.00 H new ATOM 0 HA LYS A 133 166.801 -6.493 -5.254 1.00 0.00 H new ATOM 0 HB2 LYS A 133 168.013 -4.099 -6.703 1.00 0.00 H new ATOM 0 HB3 LYS A 133 168.479 -4.636 -5.101 1.00 0.00 H new ATOM 0 HG2 LYS A 133 169.027 -6.919 -6.075 1.00 0.00 H new ATOM 0 HG3 LYS A 133 168.664 -6.292 -7.670 1.00 0.00 H new ATOM 0 HD2 LYS A 133 170.415 -4.489 -7.317 1.00 0.00 H new ATOM 0 HD3 LYS A 133 170.817 -5.219 -5.776 1.00 0.00 H new ATOM 0 HE2 LYS A 133 171.076 -7.451 -7.209 1.00 0.00 H new ATOM 0 HE3 LYS A 133 171.224 -6.350 -8.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 173.387 -6.840 -7.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 173.020 -5.194 -7.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 172.878 -6.260 -6.082 1.00 0.00 H new ATOM 1815 N GLN A 134 164.472 -4.817 -5.277 1.00 0.00 N ATOM 1816 CA GLN A 134 163.504 -3.942 -4.623 1.00 0.00 C ATOM 1817 C GLN A 134 162.162 -4.654 -4.479 1.00 0.00 C ATOM 1818 O GLN A 134 161.912 -5.660 -5.143 1.00 0.00 O ATOM 1819 CB GLN A 134 163.332 -2.648 -5.423 1.00 0.00 C ATOM 1820 CG GLN A 134 162.638 -2.945 -6.753 1.00 0.00 C ATOM 1821 CD GLN A 134 162.578 -1.676 -7.598 1.00 0.00 C ATOM 1822 OE1 GLN A 134 161.529 -0.902 -7.525 1.00 0.00 O flip ATOM 1823 NE2 GLN A 134 163.516 -1.375 -8.335 1.00 0.00 N flip ATOM 0 H GLN A 134 164.063 -5.575 -5.823 1.00 0.00 H new ATOM 0 HA GLN A 134 163.876 -3.692 -3.630 1.00 0.00 H new ATOM 0 HB2 GLN A 134 162.745 -1.931 -4.849 1.00 0.00 H new ATOM 0 HB3 GLN A 134 164.305 -2.191 -5.605 1.00 0.00 H new ATOM 0 HG2 GLN A 134 163.178 -3.725 -7.289 1.00 0.00 H new ATOM 0 HG3 GLN A 134 161.631 -3.321 -6.572 1.00 0.00 H new ATOM 0 HE21 GLN A 134 164.335 -1.980 -8.391 1.00 0.00 H new ATOM 0 HE22 GLN A 134 163.475 -0.520 -8.890 1.00 0.00 H new ATOM 1830 N LYS A 135 161.302 -4.136 -3.606 1.00 0.00 N ATOM 1831 CA LYS A 135 159.996 -4.750 -3.392 1.00 0.00 C ATOM 1832 C LYS A 135 158.877 -3.708 -3.488 1.00 0.00 C ATOM 1833 O LYS A 135 159.106 -2.521 -3.253 1.00 0.00 O ATOM 1834 CB LYS A 135 159.959 -5.411 -2.013 1.00 0.00 C ATOM 1835 CG LYS A 135 161.290 -5.168 -1.299 1.00 0.00 C ATOM 1836 CD LYS A 135 161.252 -5.808 0.090 1.00 0.00 C ATOM 1837 CE LYS A 135 161.787 -7.239 0.009 1.00 0.00 C ATOM 1838 NZ LYS A 135 161.524 -7.942 1.296 1.00 0.00 N ATOM 0 H LYS A 135 161.482 -3.305 -3.043 1.00 0.00 H new ATOM 0 HA LYS A 135 159.838 -5.500 -4.168 1.00 0.00 H new ATOM 0 HB2 LYS A 135 159.138 -5.003 -1.424 1.00 0.00 H new ATOM 0 HB3 LYS A 135 159.778 -6.481 -2.115 1.00 0.00 H new ATOM 0 HG2 LYS A 135 162.109 -5.589 -1.882 1.00 0.00 H new ATOM 0 HG3 LYS A 135 161.478 -4.098 -1.212 1.00 0.00 H new ATOM 0 HD2 LYS A 135 161.852 -5.223 0.788 1.00 0.00 H new ATOM 0 HD3 LYS A 135 160.231 -5.811 0.472 1.00 0.00 H new ATOM 0 HE2 LYS A 135 161.308 -7.771 -0.813 1.00 0.00 H new ATOM 0 HE3 LYS A 135 162.857 -7.227 -0.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 161.888 -8.915 1.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 162.000 -7.438 2.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 160.500 -7.965 1.476 1.00 0.00 H new ATOM 1852 N PRO A 136 157.674 -4.129 -3.811 1.00 0.00 N ATOM 1853 CA PRO A 136 156.506 -3.208 -3.916 1.00 0.00 C ATOM 1854 C PRO A 136 156.367 -2.314 -2.685 1.00 0.00 C ATOM 1855 O PRO A 136 157.089 -2.482 -1.701 1.00 0.00 O ATOM 1856 CB PRO A 136 155.293 -4.133 -4.031 1.00 0.00 C ATOM 1857 CG PRO A 136 155.809 -5.481 -4.419 1.00 0.00 C ATOM 1858 CD PRO A 136 157.308 -5.522 -4.116 1.00 0.00 C ATOM 0 HA PRO A 136 156.613 -2.533 -4.765 1.00 0.00 H new ATOM 0 HB2 PRO A 136 154.755 -4.183 -3.084 1.00 0.00 H new ATOM 0 HB3 PRO A 136 154.592 -3.759 -4.777 1.00 0.00 H new ATOM 0 HG2 PRO A 136 155.287 -6.262 -3.866 1.00 0.00 H new ATOM 0 HG3 PRO A 136 155.630 -5.667 -5.478 1.00 0.00 H new ATOM 0 HD2 PRO A 136 157.522 -6.180 -3.274 1.00 0.00 H new ATOM 0 HD3 PRO A 136 157.873 -5.901 -4.968 1.00 0.00 H new ATOM 1866 N ILE A 137 155.429 -1.373 -2.743 1.00 0.00 N ATOM 1867 CA ILE A 137 155.194 -0.469 -1.620 1.00 0.00 C ATOM 1868 C ILE A 137 154.127 -1.059 -0.704 1.00 0.00 C ATOM 1869 O ILE A 137 152.968 -0.657 -0.752 1.00 0.00 O ATOM 1870 CB ILE A 137 154.728 0.891 -2.146 1.00 0.00 C ATOM 1871 CG1 ILE A 137 155.794 1.462 -3.084 1.00 0.00 C ATOM 1872 CG2 ILE A 137 154.508 1.854 -0.977 1.00 0.00 C ATOM 1873 CD1 ILE A 137 155.259 2.726 -3.757 1.00 0.00 C ATOM 0 H ILE A 137 154.823 -1.217 -3.549 1.00 0.00 H new ATOM 0 HA ILE A 137 156.119 -0.340 -1.058 1.00 0.00 H new ATOM 0 HB ILE A 137 153.790 0.766 -2.687 1.00 0.00 H new ATOM 0 HG12 ILE A 137 156.701 1.692 -2.524 1.00 0.00 H new ATOM 0 HG13 ILE A 137 156.064 0.722 -3.838 1.00 0.00 H new ATOM 0 HG21 ILE A 137 154.177 2.820 -1.359 1.00 0.00 H new ATOM 0 HG22 ILE A 137 153.749 1.448 -0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 137 155.442 1.981 -0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 137 156.019 3.132 -4.425 1.00 0.00 H new ATOM 0 HD12 ILE A 137 154.365 2.482 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE A 137 155.012 3.466 -2.996 1.00 0.00 H new ATOM 1877 N THR A 138 154.516 -2.022 0.120 1.00 0.00 N ATOM 1878 CA THR A 138 153.561 -2.666 1.018 1.00 0.00 C ATOM 1879 C THR A 138 154.064 -2.712 2.466 1.00 0.00 C ATOM 1880 O THR A 138 153.323 -2.393 3.394 1.00 0.00 O ATOM 1881 CB THR A 138 153.287 -4.095 0.539 1.00 0.00 C ATOM 1882 OG1 THR A 138 153.982 -4.329 -0.678 1.00 0.00 O ATOM 1883 CG2 THR A 138 151.785 -4.283 0.315 1.00 0.00 C ATOM 0 H THR A 138 155.472 -2.372 0.187 1.00 0.00 H new ATOM 0 HA THR A 138 152.647 -2.072 0.999 1.00 0.00 H new ATOM 0 HB THR A 138 153.630 -4.802 1.295 1.00 0.00 H new ATOM 0 HG1 THR A 138 153.808 -5.244 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 138 151.592 -5.300 -0.026 1.00 0.00 H new ATOM 0 HG22 THR A 138 151.253 -4.107 1.250 1.00 0.00 H new ATOM 0 HG23 THR A 138 151.438 -3.576 -0.439 1.00 0.00 H new ATOM 1888 N PRO A 139 155.282 -3.134 2.685 1.00 0.00 N ATOM 1889 CA PRO A 139 155.848 -3.258 4.053 1.00 0.00 C ATOM 1890 C PRO A 139 156.508 -1.985 4.587 1.00 0.00 C ATOM 1891 O PRO A 139 156.034 -1.392 5.555 1.00 0.00 O ATOM 1892 CB PRO A 139 156.879 -4.374 3.891 1.00 0.00 C ATOM 1893 CG PRO A 139 157.310 -4.335 2.453 1.00 0.00 C ATOM 1894 CD PRO A 139 156.259 -3.539 1.668 1.00 0.00 C ATOM 0 HA PRO A 139 155.065 -3.458 4.785 1.00 0.00 H new ATOM 0 HB2 PRO A 139 157.728 -4.220 4.557 1.00 0.00 H new ATOM 0 HB3 PRO A 139 156.448 -5.343 4.143 1.00 0.00 H new ATOM 0 HG2 PRO A 139 158.290 -3.867 2.361 1.00 0.00 H new ATOM 0 HG3 PRO A 139 157.400 -5.345 2.054 1.00 0.00 H new ATOM 0 HD2 PRO A 139 156.701 -2.674 1.174 1.00 0.00 H new ATOM 0 HD3 PRO A 139 155.796 -4.148 0.891 1.00 0.00 H new ATOM 1902 N GLU A 140 157.624 -1.597 3.983 1.00 0.00 N ATOM 1903 CA GLU A 140 158.370 -0.425 4.436 1.00 0.00 C ATOM 1904 C GLU A 140 157.473 0.659 5.036 1.00 0.00 C ATOM 1905 O GLU A 140 157.500 0.890 6.245 1.00 0.00 O ATOM 1906 CB GLU A 140 159.156 0.169 3.264 1.00 0.00 C ATOM 1907 CG GLU A 140 160.180 -0.851 2.761 1.00 0.00 C ATOM 1908 CD GLU A 140 161.201 -1.157 3.853 1.00 0.00 C ATOM 1909 OE1 GLU A 140 161.299 -0.374 4.784 1.00 0.00 O ATOM 1910 OE2 GLU A 140 161.870 -2.171 3.743 1.00 0.00 O ATOM 0 H GLU A 140 158.034 -2.074 3.180 1.00 0.00 H new ATOM 0 HA GLU A 140 159.043 -0.765 5.224 1.00 0.00 H new ATOM 0 HB2 GLU A 140 158.475 0.443 2.458 1.00 0.00 H new ATOM 0 HB3 GLU A 140 159.662 1.082 3.578 1.00 0.00 H new ATOM 0 HG2 GLU A 140 159.673 -1.768 2.460 1.00 0.00 H new ATOM 0 HG3 GLU A 140 160.687 -0.463 1.878 1.00 0.00 H new ATOM 1917 N THR A 141 156.724 1.355 4.186 1.00 0.00 N ATOM 1918 CA THR A 141 155.879 2.450 4.670 1.00 0.00 C ATOM 1919 C THR A 141 154.388 2.218 4.459 1.00 0.00 C ATOM 1920 O THR A 141 153.586 3.102 4.750 1.00 0.00 O ATOM 1921 CB THR A 141 156.286 3.753 3.980 1.00 0.00 C ATOM 1922 OG1 THR A 141 155.975 3.670 2.597 1.00 0.00 O ATOM 1923 CG2 THR A 141 157.790 3.975 4.155 1.00 0.00 C ATOM 0 H THR A 141 156.682 1.189 3.181 1.00 0.00 H new ATOM 0 HA THR A 141 156.038 2.506 5.747 1.00 0.00 H new ATOM 0 HB THR A 141 155.744 4.587 4.425 1.00 0.00 H new ATOM 0 HG1 THR A 141 155.445 4.451 2.333 1.00 0.00 H new ATOM 0 HG21 THR A 141 158.080 4.903 3.663 1.00 0.00 H new ATOM 0 HG22 THR A 141 158.027 4.037 5.217 1.00 0.00 H new ATOM 0 HG23 THR A 141 158.335 3.143 3.709 1.00 0.00 H new ATOM 1928 N ALA A 142 154.000 1.058 3.962 1.00 0.00 N ATOM 1929 CA ALA A 142 152.582 0.807 3.752 1.00 0.00 C ATOM 1930 C ALA A 142 151.982 0.088 4.957 1.00 0.00 C ATOM 1931 O ALA A 142 151.131 0.638 5.656 1.00 0.00 O ATOM 1932 CB ALA A 142 152.378 -0.015 2.484 1.00 0.00 C ATOM 0 H ALA A 142 154.624 0.294 3.702 1.00 0.00 H new ATOM 0 HA ALA A 142 152.071 1.763 3.635 1.00 0.00 H new ATOM 0 HB1 ALA A 142 151.314 -0.197 2.336 1.00 0.00 H new ATOM 0 HB2 ALA A 142 152.775 0.531 1.628 1.00 0.00 H new ATOM 0 HB3 ALA A 142 152.899 -0.967 2.580 1.00 0.00 H new ATOM 1938 N GLU A 143 152.430 -1.138 5.197 1.00 0.00 N ATOM 1939 CA GLU A 143 151.927 -1.913 6.327 1.00 0.00 C ATOM 1940 C GLU A 143 152.406 -1.329 7.655 1.00 0.00 C ATOM 1941 O GLU A 143 151.646 -1.264 8.621 1.00 0.00 O ATOM 1942 CB GLU A 143 152.398 -3.364 6.217 1.00 0.00 C ATOM 1943 CG GLU A 143 151.752 -4.199 7.326 1.00 0.00 C ATOM 1944 CD GLU A 143 152.296 -5.623 7.290 1.00 0.00 C ATOM 1945 OE1 GLU A 143 153.145 -5.890 6.456 1.00 0.00 O ATOM 1946 OE2 GLU A 143 151.857 -6.425 8.099 1.00 0.00 O ATOM 0 H GLU A 143 153.133 -1.614 4.632 1.00 0.00 H new ATOM 0 HA GLU A 143 150.838 -1.873 6.301 1.00 0.00 H new ATOM 0 HB2 GLU A 143 152.133 -3.770 5.241 1.00 0.00 H new ATOM 0 HB3 GLU A 143 153.484 -3.412 6.298 1.00 0.00 H new ATOM 0 HG2 GLU A 143 151.955 -3.748 8.297 1.00 0.00 H new ATOM 0 HG3 GLU A 143 150.669 -4.211 7.200 1.00 0.00 H new ATOM 1953 N LYS A 144 153.673 -0.919 7.705 1.00 0.00 N ATOM 1954 CA LYS A 144 154.232 -0.360 8.932 1.00 0.00 C ATOM 1955 C LYS A 144 153.581 0.973 9.285 1.00 0.00 C ATOM 1956 O LYS A 144 153.346 1.270 10.457 1.00 0.00 O ATOM 1957 CB LYS A 144 155.742 -0.169 8.776 1.00 0.00 C ATOM 1958 CG LYS A 144 156.422 -1.536 8.647 1.00 0.00 C ATOM 1959 CD LYS A 144 157.941 -1.350 8.583 1.00 0.00 C ATOM 1960 CE LYS A 144 158.612 -2.692 8.284 1.00 0.00 C ATOM 1961 NZ LYS A 144 158.618 -3.531 9.515 1.00 0.00 N ATOM 0 H LYS A 144 154.323 -0.963 6.920 1.00 0.00 H new ATOM 0 HA LYS A 144 154.030 -1.061 9.742 1.00 0.00 H new ATOM 0 HB2 LYS A 144 155.953 0.438 7.896 1.00 0.00 H new ATOM 0 HB3 LYS A 144 156.142 0.368 9.636 1.00 0.00 H new ATOM 0 HG2 LYS A 144 156.158 -2.166 9.496 1.00 0.00 H new ATOM 0 HG3 LYS A 144 156.070 -2.046 7.750 1.00 0.00 H new ATOM 0 HD2 LYS A 144 158.196 -0.625 7.810 1.00 0.00 H new ATOM 0 HD3 LYS A 144 158.309 -0.951 9.529 1.00 0.00 H new ATOM 0 HE2 LYS A 144 158.080 -3.206 7.484 1.00 0.00 H new ATOM 0 HE3 LYS A 144 159.632 -2.531 7.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 159.104 -4.429 9.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 159.115 -3.026 10.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 157.639 -3.724 9.809 1.00 0.00 H new ATOM 1975 N LEU A 145 153.299 1.776 8.267 1.00 0.00 N ATOM 1976 CA LEU A 145 152.688 3.081 8.482 1.00 0.00 C ATOM 1977 C LEU A 145 151.208 2.957 8.832 1.00 0.00 C ATOM 1978 O LEU A 145 150.631 3.874 9.406 1.00 0.00 O ATOM 1979 CB LEU A 145 152.842 3.941 7.227 1.00 0.00 C ATOM 1980 CG LEU A 145 152.477 5.396 7.545 1.00 0.00 C ATOM 1981 CD1 LEU A 145 153.490 5.975 8.537 1.00 0.00 C ATOM 1982 CD2 LEU A 145 152.504 6.225 6.257 1.00 0.00 C ATOM 0 H LEU A 145 153.482 1.548 7.290 1.00 0.00 H new ATOM 0 HA LEU A 145 153.199 3.552 9.322 1.00 0.00 H new ATOM 0 HB2 LEU A 145 153.867 3.886 6.861 1.00 0.00 H new ATOM 0 HB3 LEU A 145 152.199 3.560 6.433 1.00 0.00 H new ATOM 0 HG LEU A 145 151.478 5.428 7.981 1.00 0.00 H new ATOM 0 HD11 LEU A 145 153.229 7.009 8.762 1.00 0.00 H new ATOM 0 HD12 LEU A 145 153.475 5.389 9.456 1.00 0.00 H new ATOM 0 HD13 LEU A 145 154.488 5.939 8.100 1.00 0.00 H new ATOM 0 HD21 LEU A 145 152.244 7.259 6.484 1.00 0.00 H new ATOM 0 HD22 LEU A 145 153.503 6.189 5.822 1.00 0.00 H new ATOM 0 HD23 LEU A 145 151.784 5.818 5.547 1.00 0.00 H new ATOM 1988 N ALA A 146 150.597 1.819 8.503 1.00 0.00 N ATOM 1989 CA ALA A 146 149.180 1.608 8.803 1.00 0.00 C ATOM 1990 C ALA A 146 148.958 1.474 10.305 1.00 0.00 C ATOM 1991 O ALA A 146 147.953 1.941 10.846 1.00 0.00 O ATOM 1992 CB ALA A 146 148.687 0.340 8.102 1.00 0.00 C ATOM 0 H ALA A 146 151.054 1.037 8.034 1.00 0.00 H new ATOM 0 HA ALA A 146 148.621 2.471 8.443 1.00 0.00 H new ATOM 0 HB1 ALA A 146 147.632 0.186 8.328 1.00 0.00 H new ATOM 0 HB2 ALA A 146 148.816 0.446 7.025 1.00 0.00 H new ATOM 0 HB3 ALA A 146 149.262 -0.517 8.453 1.00 0.00 H new ATOM 1998 N ARG A 147 149.909 0.833 10.968 1.00 0.00 N ATOM 1999 CA ARG A 147 149.824 0.633 12.409 1.00 0.00 C ATOM 2000 C ARG A 147 149.732 1.976 13.123 1.00 0.00 C ATOM 2001 O ARG A 147 148.966 2.134 14.073 1.00 0.00 O ATOM 2002 CB ARG A 147 151.053 -0.130 12.908 1.00 0.00 C ATOM 2003 CG ARG A 147 151.078 -1.526 12.281 1.00 0.00 C ATOM 2004 CD ARG A 147 152.209 -2.348 12.901 1.00 0.00 C ATOM 2005 NE ARG A 147 153.483 -1.656 12.751 1.00 0.00 N ATOM 2006 CZ ARG A 147 154.634 -2.323 12.766 1.00 0.00 C ATOM 2007 NH1 ARG A 147 154.634 -3.618 12.915 1.00 0.00 N ATOM 2008 NH2 ARG A 147 155.762 -1.680 12.633 1.00 0.00 N ATOM 0 H ARG A 147 150.746 0.443 10.534 1.00 0.00 H new ATOM 0 HA ARG A 147 148.928 0.051 12.626 1.00 0.00 H new ATOM 0 HB2 ARG A 147 151.962 0.413 12.648 1.00 0.00 H new ATOM 0 HB3 ARG A 147 151.029 -0.209 13.995 1.00 0.00 H new ATOM 0 HG2 ARG A 147 150.122 -2.025 12.442 1.00 0.00 H new ATOM 0 HG3 ARG A 147 151.220 -1.449 11.203 1.00 0.00 H new ATOM 0 HD2 ARG A 147 152.004 -2.521 13.958 1.00 0.00 H new ATOM 0 HD3 ARG A 147 152.261 -3.326 12.422 1.00 0.00 H new ATOM 0 HE ARG A 147 153.492 -0.643 12.632 1.00 0.00 H new ATOM 0 HH11 ARG A 147 153.752 -4.119 13.020 1.00 0.00 H new ATOM 0 HH12 ARG A 147 155.516 -4.130 12.927 1.00 0.00 H new ATOM 0 HH21 ARG A 147 155.761 -0.667 12.518 1.00 0.00 H new ATOM 0 HH22 ARG A 147 156.645 -2.191 12.644 1.00 0.00 H new ATOM 2022 N ASP A 148 150.516 2.941 12.655 1.00 0.00 N ATOM 2023 CA ASP A 148 150.512 4.272 13.252 1.00 0.00 C ATOM 2024 C ASP A 148 149.477 5.165 12.571 1.00 0.00 C ATOM 2025 O ASP A 148 148.975 6.116 13.169 1.00 0.00 O ATOM 2026 CB ASP A 148 151.899 4.902 13.124 1.00 0.00 C ATOM 2027 CG ASP A 148 152.910 4.106 13.942 1.00 0.00 C ATOM 2028 OD1 ASP A 148 152.482 3.318 14.769 1.00 0.00 O ATOM 2029 OD2 ASP A 148 154.096 4.297 13.729 1.00 0.00 O ATOM 0 H ASP A 148 151.158 2.829 11.870 1.00 0.00 H new ATOM 0 HA ASP A 148 150.251 4.177 14.306 1.00 0.00 H new ATOM 0 HB2 ASP A 148 152.202 4.924 12.077 1.00 0.00 H new ATOM 0 HB3 ASP A 148 151.872 5.935 13.470 1.00 0.00 H new ATOM 2034 N LEU A 149 149.185 4.868 11.307 1.00 0.00 N ATOM 2035 CA LEU A 149 148.236 5.666 10.535 1.00 0.00 C ATOM 2036 C LEU A 149 146.983 5.998 11.334 1.00 0.00 C ATOM 2037 O LEU A 149 146.336 6.998 11.042 1.00 0.00 O ATOM 2038 CB LEU A 149 147.834 4.932 9.248 1.00 0.00 C ATOM 2039 CG LEU A 149 146.883 5.806 8.424 1.00 0.00 C ATOM 2040 CD1 LEU A 149 147.577 7.120 8.060 1.00 0.00 C ATOM 2041 CD2 LEU A 149 146.505 5.069 7.137 1.00 0.00 C ATOM 0 H LEU A 149 149.590 4.083 10.797 1.00 0.00 H new ATOM 0 HA LEU A 149 148.740 6.600 10.286 1.00 0.00 H new ATOM 0 HB2 LEU A 149 148.722 4.694 8.663 1.00 0.00 H new ATOM 0 HB3 LEU A 149 147.351 3.986 9.494 1.00 0.00 H new ATOM 0 HG LEU A 149 145.988 6.015 9.009 1.00 0.00 H new ATOM 0 HD11 LEU A 149 146.898 7.740 7.474 1.00 0.00 H new ATOM 0 HD12 LEU A 149 147.856 7.649 8.971 1.00 0.00 H new ATOM 0 HD13 LEU A 149 148.472 6.909 7.475 1.00 0.00 H new ATOM 0 HD21 LEU A 149 145.828 5.688 6.548 1.00 0.00 H new ATOM 0 HD22 LEU A 149 147.405 4.863 6.558 1.00 0.00 H new ATOM 0 HD23 LEU A 149 146.012 4.130 7.387 1.00 0.00 H new ATOM 2047 N LYS A 150 146.637 5.162 12.325 1.00 0.00 N ATOM 2048 CA LYS A 150 145.445 5.366 13.163 1.00 0.00 C ATOM 2049 C LYS A 150 144.245 4.640 12.566 1.00 0.00 C ATOM 2050 O LYS A 150 143.155 4.676 13.125 1.00 0.00 O ATOM 2051 CB LYS A 150 145.085 6.849 13.367 1.00 0.00 C ATOM 2052 CG LYS A 150 146.279 7.607 13.958 1.00 0.00 C ATOM 2053 CD LYS A 150 145.850 9.036 14.299 1.00 0.00 C ATOM 2054 CE LYS A 150 147.068 9.837 14.765 1.00 0.00 C ATOM 2055 NZ LYS A 150 147.906 10.198 13.587 1.00 0.00 N ATOM 0 H LYS A 150 147.173 4.329 12.567 1.00 0.00 H new ATOM 0 HA LYS A 150 145.694 4.955 14.141 1.00 0.00 H new ATOM 0 HB2 LYS A 150 144.797 7.295 12.415 1.00 0.00 H new ATOM 0 HB3 LYS A 150 144.226 6.934 14.032 1.00 0.00 H new ATOM 0 HG2 LYS A 150 146.640 7.100 14.853 1.00 0.00 H new ATOM 0 HG3 LYS A 150 147.104 7.623 13.246 1.00 0.00 H new ATOM 0 HD2 LYS A 150 145.402 9.511 13.426 1.00 0.00 H new ATOM 0 HD3 LYS A 150 145.090 9.022 15.080 1.00 0.00 H new ATOM 0 HE2 LYS A 150 146.746 10.739 15.286 1.00 0.00 H new ATOM 0 HE3 LYS A 150 147.652 9.251 15.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 148.592 10.930 13.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 148.414 9.355 13.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 147.297 10.561 12.826 1.00 0.00 H new ATOM 2069 N ALA A 151 144.447 3.985 11.428 1.00 0.00 N ATOM 2070 CA ALA A 151 143.368 3.261 10.763 1.00 0.00 C ATOM 2071 C ALA A 151 142.773 2.176 11.663 1.00 0.00 C ATOM 2072 O ALA A 151 142.513 2.397 12.845 1.00 0.00 O ATOM 2073 CB ALA A 151 143.916 2.612 9.489 1.00 0.00 C ATOM 0 H ALA A 151 145.345 3.940 10.947 1.00 0.00 H new ATOM 0 HA ALA A 151 142.577 3.973 10.526 1.00 0.00 H new ATOM 0 HB1 ALA A 151 143.117 2.068 8.985 1.00 0.00 H new ATOM 0 HB2 ALA A 151 144.304 3.384 8.825 1.00 0.00 H new ATOM 0 HB3 ALA A 151 144.717 1.920 9.749 1.00 0.00 H new ATOM 2079 N VAL A 152 142.546 1.012 11.074 1.00 0.00 N ATOM 2080 CA VAL A 152 141.983 -0.127 11.794 1.00 0.00 C ATOM 2081 C VAL A 152 142.289 -1.438 11.043 1.00 0.00 C ATOM 2082 O VAL A 152 142.583 -2.460 11.666 1.00 0.00 O ATOM 2083 CB VAL A 152 140.477 0.068 12.002 1.00 0.00 C ATOM 2084 CG1 VAL A 152 139.689 -0.831 11.057 1.00 0.00 C ATOM 2085 CG2 VAL A 152 140.121 -0.285 13.447 1.00 0.00 C ATOM 0 H VAL A 152 142.744 0.828 10.091 1.00 0.00 H new ATOM 0 HA VAL A 152 142.447 -0.193 12.778 1.00 0.00 H new ATOM 0 HB VAL A 152 140.222 1.107 11.795 1.00 0.00 H new ATOM 0 HG11 VAL A 152 138.621 -0.681 11.217 1.00 0.00 H new ATOM 0 HG12 VAL A 152 139.940 -0.583 10.026 1.00 0.00 H new ATOM 0 HG13 VAL A 152 139.942 -1.873 11.251 1.00 0.00 H new ATOM 0 HG21 VAL A 152 139.051 -0.148 13.602 1.00 0.00 H new ATOM 0 HG22 VAL A 152 140.386 -1.324 13.644 1.00 0.00 H new ATOM 0 HG23 VAL A 152 140.672 0.365 14.127 1.00 0.00 H new ATOM 2089 N LYS A 153 142.262 -1.391 9.705 1.00 0.00 N ATOM 2090 CA LYS A 153 142.586 -2.570 8.882 1.00 0.00 C ATOM 2091 C LYS A 153 143.918 -2.339 8.172 1.00 0.00 C ATOM 2092 O LYS A 153 144.535 -1.288 8.351 1.00 0.00 O ATOM 2093 CB LYS A 153 141.494 -2.843 7.836 1.00 0.00 C ATOM 2094 CG LYS A 153 140.232 -3.416 8.498 1.00 0.00 C ATOM 2095 CD LYS A 153 140.461 -4.879 8.899 1.00 0.00 C ATOM 2096 CE LYS A 153 139.116 -5.540 9.213 1.00 0.00 C ATOM 2097 NZ LYS A 153 139.297 -7.017 9.283 1.00 0.00 N ATOM 0 H LYS A 153 142.021 -0.557 9.169 1.00 0.00 H new ATOM 0 HA LYS A 153 142.651 -3.437 9.540 1.00 0.00 H new ATOM 0 HB2 LYS A 153 141.247 -1.919 7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 153 141.867 -3.543 7.089 1.00 0.00 H new ATOM 0 HG2 LYS A 153 139.974 -2.826 9.378 1.00 0.00 H new ATOM 0 HG3 LYS A 153 139.389 -3.348 7.810 1.00 0.00 H new ATOM 0 HD2 LYS A 153 140.961 -5.414 8.092 1.00 0.00 H new ATOM 0 HD3 LYS A 153 141.115 -4.930 9.769 1.00 0.00 H new ATOM 0 HE2 LYS A 153 138.726 -5.165 10.159 1.00 0.00 H new ATOM 0 HE3 LYS A 153 138.386 -5.288 8.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 138.398 -7.488 9.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 140.024 -7.310 8.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 139.595 -7.285 10.243 1.00 0.00 H new ATOM 2111 N TYR A 154 144.370 -3.300 7.359 1.00 0.00 N ATOM 2112 CA TYR A 154 145.628 -3.121 6.662 1.00 0.00 C ATOM 2113 C TYR A 154 145.800 -4.211 5.627 1.00 0.00 C ATOM 2114 O TYR A 154 146.219 -5.325 5.933 1.00 0.00 O ATOM 2115 CB TYR A 154 146.789 -3.141 7.662 1.00 0.00 C ATOM 2116 CG TYR A 154 146.930 -4.520 8.264 1.00 0.00 C ATOM 2117 CD1 TYR A 154 146.075 -4.920 9.299 1.00 0.00 C ATOM 2118 CD2 TYR A 154 147.921 -5.394 7.799 1.00 0.00 C ATOM 2119 CE1 TYR A 154 146.208 -6.192 9.865 1.00 0.00 C ATOM 2120 CE2 TYR A 154 148.052 -6.668 8.364 1.00 0.00 C ATOM 2121 CZ TYR A 154 147.197 -7.067 9.399 1.00 0.00 C ATOM 2122 OH TYR A 154 147.329 -8.321 9.960 1.00 0.00 O ATOM 0 H TYR A 154 143.892 -4.183 7.177 1.00 0.00 H new ATOM 0 HA TYR A 154 145.624 -2.156 6.156 1.00 0.00 H new ATOM 0 HB2 TYR A 154 147.715 -2.857 7.162 1.00 0.00 H new ATOM 0 HB3 TYR A 154 146.614 -2.408 8.449 1.00 0.00 H new ATOM 0 HD1 TYR A 154 145.313 -4.246 9.660 1.00 0.00 H new ATOM 0 HD2 TYR A 154 148.584 -5.085 7.005 1.00 0.00 H new ATOM 0 HE1 TYR A 154 145.547 -6.500 10.662 1.00 0.00 H new ATOM 0 HE2 TYR A 154 148.813 -7.344 8.002 1.00 0.00 H new ATOM 0 HH TYR A 154 148.062 -8.801 9.520 1.00 0.00 H new ATOM 2132 N VAL A 155 145.458 -3.878 4.397 1.00 0.00 N ATOM 2133 CA VAL A 155 145.558 -4.820 3.313 1.00 0.00 C ATOM 2134 C VAL A 155 145.559 -4.085 1.986 1.00 0.00 C ATOM 2135 O VAL A 155 145.310 -2.881 1.924 1.00 0.00 O ATOM 2136 CB VAL A 155 144.381 -5.793 3.354 1.00 0.00 C ATOM 2137 CG1 VAL A 155 144.855 -7.159 3.856 1.00 0.00 C ATOM 2138 CG2 VAL A 155 143.298 -5.257 4.295 1.00 0.00 C ATOM 0 H VAL A 155 145.108 -2.958 4.129 1.00 0.00 H new ATOM 0 HA VAL A 155 146.489 -5.377 3.418 1.00 0.00 H new ATOM 0 HB VAL A 155 143.972 -5.897 2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 155 144.012 -7.849 3.883 1.00 0.00 H new ATOM 0 HG12 VAL A 155 145.621 -7.548 3.185 1.00 0.00 H new ATOM 0 HG13 VAL A 155 145.271 -7.054 4.858 1.00 0.00 H new ATOM 0 HG21 VAL A 155 142.461 -5.954 4.321 1.00 0.00 H new ATOM 0 HG22 VAL A 155 143.710 -5.147 5.298 1.00 0.00 H new ATOM 0 HG23 VAL A 155 142.952 -4.288 3.937 1.00 0.00 H new ATOM 2142 N GLU A 156 145.812 -4.829 0.934 1.00 0.00 N ATOM 2143 CA GLU A 156 145.821 -4.265 -0.405 1.00 0.00 C ATOM 2144 C GLU A 156 145.140 -5.255 -1.316 1.00 0.00 C ATOM 2145 O GLU A 156 145.762 -6.198 -1.772 1.00 0.00 O ATOM 2146 CB GLU A 156 147.261 -4.042 -0.864 1.00 0.00 C ATOM 2147 CG GLU A 156 148.097 -3.526 0.311 1.00 0.00 C ATOM 2148 CD GLU A 156 147.509 -2.226 0.847 1.00 0.00 C ATOM 2149 OE1 GLU A 156 146.722 -1.619 0.142 1.00 0.00 O ATOM 2150 OE2 GLU A 156 147.854 -1.857 1.958 1.00 0.00 O ATOM 0 H GLU A 156 146.015 -5.828 0.975 1.00 0.00 H new ATOM 0 HA GLU A 156 145.304 -3.306 -0.423 1.00 0.00 H new ATOM 0 HB2 GLU A 156 147.682 -4.974 -1.242 1.00 0.00 H new ATOM 0 HB3 GLU A 156 147.286 -3.325 -1.684 1.00 0.00 H new ATOM 0 HG2 GLU A 156 148.125 -4.274 1.103 1.00 0.00 H new ATOM 0 HG3 GLU A 156 149.126 -3.363 -0.010 1.00 0.00 H new ATOM 2157 N CYS A 157 143.860 -5.038 -1.562 1.00 0.00 N ATOM 2158 CA CYS A 157 143.090 -5.938 -2.383 1.00 0.00 C ATOM 2159 C CYS A 157 142.781 -5.362 -3.732 1.00 0.00 C ATOM 2160 O CYS A 157 142.576 -4.166 -3.921 1.00 0.00 O ATOM 2161 CB CYS A 157 141.776 -6.315 -1.683 1.00 0.00 C ATOM 2162 SG CYS A 157 140.381 -5.830 -2.726 1.00 0.00 S ATOM 0 H CYS A 157 143.336 -4.241 -1.200 1.00 0.00 H new ATOM 0 HA CYS A 157 143.704 -6.827 -2.529 1.00 0.00 H new ATOM 0 HB2 CYS A 157 141.747 -7.388 -1.493 1.00 0.00 H new ATOM 0 HB3 CYS A 157 141.711 -5.818 -0.715 1.00 0.00 H new ATOM 0 HG CYS A 157 139.679 -6.882 -3.029 1.00 0.00 H new ATOM 2168 N SER A 158 142.724 -6.284 -4.642 1.00 0.00 N ATOM 2169 CA SER A 158 142.398 -6.025 -6.011 1.00 0.00 C ATOM 2170 C SER A 158 142.197 -7.359 -6.652 1.00 0.00 C ATOM 2171 O SER A 158 143.128 -8.010 -7.126 1.00 0.00 O ATOM 2172 CB SER A 158 143.509 -5.269 -6.702 1.00 0.00 C ATOM 2173 OG SER A 158 142.943 -4.310 -7.585 1.00 0.00 O ATOM 0 H SER A 158 142.909 -7.268 -4.447 1.00 0.00 H new ATOM 0 HA SER A 158 141.504 -5.406 -6.087 1.00 0.00 H new ATOM 0 HB2 SER A 158 144.141 -4.774 -5.965 1.00 0.00 H new ATOM 0 HB3 SER A 158 144.145 -5.959 -7.255 1.00 0.00 H new ATOM 0 HG SER A 158 142.277 -3.776 -7.104 1.00 0.00 H new ATOM 2179 N ALA A 159 140.965 -7.761 -6.620 1.00 0.00 N ATOM 2180 CA ALA A 159 140.578 -9.041 -7.159 1.00 0.00 C ATOM 2181 C ALA A 159 141.593 -10.098 -6.739 1.00 0.00 C ATOM 2182 O ALA A 159 141.706 -11.157 -7.358 1.00 0.00 O ATOM 2183 CB ALA A 159 140.486 -8.942 -8.675 1.00 0.00 C ATOM 0 H ALA A 159 140.197 -7.219 -6.223 1.00 0.00 H new ATOM 0 HA ALA A 159 139.601 -9.331 -6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 159 140.194 -9.908 -9.086 1.00 0.00 H new ATOM 0 HB2 ALA A 159 139.743 -8.192 -8.946 1.00 0.00 H new ATOM 0 HB3 ALA A 159 141.456 -8.654 -9.080 1.00 0.00 H new ATOM 2189 N LEU A 160 142.317 -9.793 -5.663 1.00 0.00 N ATOM 2190 CA LEU A 160 143.318 -10.705 -5.122 1.00 0.00 C ATOM 2191 C LEU A 160 143.157 -10.801 -3.604 1.00 0.00 C ATOM 2192 O LEU A 160 142.557 -11.751 -3.112 1.00 0.00 O ATOM 2193 CB LEU A 160 144.729 -10.215 -5.472 1.00 0.00 C ATOM 2194 CG LEU A 160 145.410 -11.226 -6.397 1.00 0.00 C ATOM 2195 CD1 LEU A 160 145.550 -12.568 -5.676 1.00 0.00 C ATOM 2196 CD2 LEU A 160 144.568 -11.412 -7.662 1.00 0.00 C ATOM 0 H LEU A 160 142.227 -8.917 -5.148 1.00 0.00 H new ATOM 0 HA LEU A 160 143.175 -11.692 -5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 160 144.676 -9.241 -5.958 1.00 0.00 H new ATOM 0 HB3 LEU A 160 145.316 -10.086 -4.563 1.00 0.00 H new ATOM 0 HG LEU A 160 146.398 -10.856 -6.670 1.00 0.00 H new ATOM 0 HD11 LEU A 160 146.035 -13.287 -6.336 1.00 0.00 H new ATOM 0 HD12 LEU A 160 146.152 -12.437 -4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 160 144.562 -12.938 -5.400 1.00 0.00 H new ATOM 0 HD21 LEU A 160 145.054 -12.132 -8.320 1.00 0.00 H new ATOM 0 HD22 LEU A 160 143.579 -11.779 -7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 160 144.471 -10.457 -8.178 1.00 0.00 H new ATOM 2202 N THR A 161 143.758 -9.843 -2.880 1.00 0.00 N ATOM 2203 CA THR A 161 143.727 -9.841 -1.399 1.00 0.00 C ATOM 2204 C THR A 161 142.308 -9.928 -0.864 1.00 0.00 C ATOM 2205 O THR A 161 141.940 -9.235 0.085 1.00 0.00 O ATOM 2206 CB THR A 161 144.416 -8.598 -0.818 1.00 0.00 C ATOM 2207 OG1 THR A 161 145.485 -8.239 -1.677 1.00 0.00 O ATOM 2208 CG2 THR A 161 144.946 -8.872 0.605 1.00 0.00 C ATOM 0 H THR A 161 144.270 -9.061 -3.289 1.00 0.00 H new ATOM 0 HA THR A 161 144.275 -10.728 -1.081 1.00 0.00 H new ATOM 0 HB THR A 161 143.695 -7.783 -0.749 1.00 0.00 H new ATOM 0 HG1 THR A 161 145.704 -7.292 -1.549 1.00 0.00 H new ATOM 0 HG21 THR A 161 145.429 -7.975 0.992 1.00 0.00 H new ATOM 0 HG22 THR A 161 144.116 -9.147 1.256 1.00 0.00 H new ATOM 0 HG23 THR A 161 145.668 -9.688 0.574 1.00 0.00 H new ATOM 2213 N GLN A 162 141.550 -10.849 -1.427 1.00 0.00 N ATOM 2214 CA GLN A 162 140.211 -11.128 -0.975 1.00 0.00 C ATOM 2215 C GLN A 162 140.393 -12.017 0.235 1.00 0.00 C ATOM 2216 O GLN A 162 139.458 -12.577 0.798 1.00 0.00 O ATOM 2217 CB GLN A 162 139.435 -11.841 -2.092 1.00 0.00 C ATOM 2218 CG GLN A 162 138.013 -12.179 -1.639 1.00 0.00 C ATOM 2219 CD GLN A 162 137.183 -12.632 -2.834 1.00 0.00 C ATOM 2220 OE1 GLN A 162 136.042 -13.065 -2.670 1.00 0.00 O ATOM 2221 NE2 GLN A 162 137.689 -12.560 -4.035 1.00 0.00 N ATOM 0 H GLN A 162 141.852 -11.424 -2.214 1.00 0.00 H new ATOM 0 HA GLN A 162 139.643 -10.232 -0.723 1.00 0.00 H new ATOM 0 HB2 GLN A 162 139.398 -11.206 -2.977 1.00 0.00 H new ATOM 0 HB3 GLN A 162 139.957 -12.754 -2.377 1.00 0.00 H new ATOM 0 HG2 GLN A 162 138.039 -12.965 -0.884 1.00 0.00 H new ATOM 0 HG3 GLN A 162 137.553 -11.307 -1.175 1.00 0.00 H new ATOM 0 HE21 GLN A 162 138.634 -12.201 -4.169 1.00 0.00 H new ATOM 0 HE22 GLN A 162 137.139 -12.863 -4.839 1.00 0.00 H new ATOM 2228 N LYS A 163 141.663 -12.102 0.626 1.00 0.00 N ATOM 2229 CA LYS A 163 142.066 -12.886 1.777 1.00 0.00 C ATOM 2230 C LYS A 163 141.888 -12.040 3.018 1.00 0.00 C ATOM 2231 O LYS A 163 142.018 -12.516 4.145 1.00 0.00 O ATOM 2232 CB LYS A 163 143.528 -13.326 1.628 1.00 0.00 C ATOM 2233 CG LYS A 163 143.880 -14.355 2.707 1.00 0.00 C ATOM 2234 CD LYS A 163 145.347 -14.766 2.561 1.00 0.00 C ATOM 2235 CE LYS A 163 145.685 -15.837 3.601 1.00 0.00 C ATOM 2236 NZ LYS A 163 145.888 -17.147 2.921 1.00 0.00 N ATOM 0 H LYS A 163 142.433 -11.630 0.153 1.00 0.00 H new ATOM 0 HA LYS A 163 141.451 -13.783 1.855 1.00 0.00 H new ATOM 0 HB2 LYS A 163 143.688 -13.755 0.639 1.00 0.00 H new ATOM 0 HB3 LYS A 163 144.186 -12.461 1.710 1.00 0.00 H new ATOM 0 HG2 LYS A 163 143.706 -13.934 3.697 1.00 0.00 H new ATOM 0 HG3 LYS A 163 143.235 -15.229 2.615 1.00 0.00 H new ATOM 0 HD2 LYS A 163 145.530 -15.149 1.557 1.00 0.00 H new ATOM 0 HD3 LYS A 163 145.993 -13.898 2.694 1.00 0.00 H new ATOM 0 HE2 LYS A 163 146.585 -15.556 4.148 1.00 0.00 H new ATOM 0 HE3 LYS A 163 144.880 -15.916 4.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 146.118 -17.874 3.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 145.018 -17.416 2.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 146.670 -17.067 2.240 1.00 0.00 H new ATOM 2250 N GLY A 164 141.531 -10.785 2.792 1.00 0.00 N ATOM 2251 CA GLY A 164 141.267 -9.862 3.876 1.00 0.00 C ATOM 2252 C GLY A 164 139.933 -9.205 3.609 1.00 0.00 C ATOM 2253 O GLY A 164 138.954 -9.489 4.298 1.00 0.00 O ATOM 0 H GLY A 164 141.418 -10.384 1.861 1.00 0.00 H new ATOM 0 HA2 GLY A 164 141.249 -10.389 4.830 1.00 0.00 H new ATOM 0 HA3 GLY A 164 142.056 -9.113 3.940 1.00 0.00 H new ATOM 2257 N LEU A 165 139.890 -8.313 2.616 1.00 0.00 N ATOM 2258 CA LEU A 165 138.642 -7.617 2.286 1.00 0.00 C ATOM 2259 C LEU A 165 137.439 -8.553 2.400 1.00 0.00 C ATOM 2260 O LEU A 165 136.299 -8.099 2.497 1.00 0.00 O ATOM 2261 CB LEU A 165 138.717 -7.030 0.877 1.00 0.00 C ATOM 2262 CG LEU A 165 139.414 -5.666 0.920 1.00 0.00 C ATOM 2263 CD1 LEU A 165 138.528 -4.650 1.648 1.00 0.00 C ATOM 2264 CD2 LEU A 165 140.750 -5.791 1.655 1.00 0.00 C ATOM 0 H LEU A 165 140.689 -8.058 2.035 1.00 0.00 H new ATOM 0 HA LEU A 165 138.512 -6.807 3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 165 139.263 -7.707 0.220 1.00 0.00 H new ATOM 0 HB3 LEU A 165 137.714 -6.923 0.464 1.00 0.00 H new ATOM 0 HG LEU A 165 139.590 -5.326 -0.101 1.00 0.00 H new ATOM 0 HD11 LEU A 165 139.030 -3.683 1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 165 137.579 -4.552 1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 165 138.344 -4.992 2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 165 141.242 -4.819 1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 165 140.574 -6.138 2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 165 141.387 -6.505 1.133 1.00 0.00 H new ATOM 2270 N LYS A 166 137.699 -9.854 2.439 1.00 0.00 N ATOM 2271 CA LYS A 166 136.631 -10.836 2.601 1.00 0.00 C ATOM 2272 C LYS A 166 136.321 -10.986 4.085 1.00 0.00 C ATOM 2273 O LYS A 166 135.164 -10.942 4.503 1.00 0.00 O ATOM 2274 CB LYS A 166 137.055 -12.183 2.017 1.00 0.00 C ATOM 2275 CG LYS A 166 135.929 -13.208 2.183 1.00 0.00 C ATOM 2276 CD LYS A 166 136.409 -14.574 1.689 1.00 0.00 C ATOM 2277 CE LYS A 166 135.253 -15.575 1.750 1.00 0.00 C ATOM 2278 NZ LYS A 166 135.762 -16.892 2.226 1.00 0.00 N ATOM 0 H LYS A 166 138.634 -10.253 2.361 1.00 0.00 H new ATOM 0 HA LYS A 166 135.742 -10.497 2.070 1.00 0.00 H new ATOM 0 HB2 LYS A 166 137.300 -12.069 0.961 1.00 0.00 H new ATOM 0 HB3 LYS A 166 137.956 -12.537 2.517 1.00 0.00 H new ATOM 0 HG2 LYS A 166 135.631 -13.271 3.230 1.00 0.00 H new ATOM 0 HG3 LYS A 166 135.050 -12.894 1.620 1.00 0.00 H new ATOM 0 HD2 LYS A 166 136.780 -14.493 0.667 1.00 0.00 H new ATOM 0 HD3 LYS A 166 137.239 -14.923 2.303 1.00 0.00 H new ATOM 0 HE2 LYS A 166 134.476 -15.209 2.421 1.00 0.00 H new ATOM 0 HE3 LYS A 166 134.799 -15.683 0.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 134.977 -17.573 2.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 136.489 -17.241 1.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 136.176 -16.782 3.174 1.00 0.00 H new ATOM 2292 N ASN A 167 137.380 -11.142 4.874 1.00 0.00 N ATOM 2293 CA ASN A 167 137.232 -11.276 6.314 1.00 0.00 C ATOM 2294 C ASN A 167 137.021 -9.898 6.921 1.00 0.00 C ATOM 2295 O ASN A 167 136.930 -9.745 8.140 1.00 0.00 O ATOM 2296 CB ASN A 167 138.476 -11.929 6.925 1.00 0.00 C ATOM 2297 CG ASN A 167 139.585 -10.896 7.099 1.00 0.00 C ATOM 2298 OD1 ASN A 167 139.541 -9.827 6.492 1.00 0.00 O ATOM 2299 ND2 ASN A 167 140.581 -11.151 7.904 1.00 0.00 N ATOM 0 H ASN A 167 138.343 -11.178 4.540 1.00 0.00 H new ATOM 0 HA ASN A 167 136.372 -11.911 6.528 1.00 0.00 H new ATOM 0 HB2 ASN A 167 138.226 -12.371 7.890 1.00 0.00 H new ATOM 0 HB3 ASN A 167 138.822 -12.739 6.283 1.00 0.00 H new ATOM 0 HD21 ASN A 167 141.324 -10.463 8.030 1.00 0.00 H new ATOM 0 HD22 ASN A 167 140.616 -12.038 8.407 1.00 0.00 H new ATOM 2304 N VAL A 168 136.910 -8.899 6.047 1.00 0.00 N ATOM 2305 CA VAL A 168 136.668 -7.528 6.478 1.00 0.00 C ATOM 2306 C VAL A 168 135.180 -7.309 6.694 1.00 0.00 C ATOM 2307 O VAL A 168 134.751 -6.848 7.748 1.00 0.00 O ATOM 2308 CB VAL A 168 137.153 -6.556 5.408 1.00 0.00 C ATOM 2309 CG1 VAL A 168 136.548 -5.175 5.660 1.00 0.00 C ATOM 2310 CG2 VAL A 168 138.679 -6.457 5.460 1.00 0.00 C ATOM 0 H VAL A 168 136.984 -9.016 5.036 1.00 0.00 H new ATOM 0 HA VAL A 168 137.207 -7.355 7.409 1.00 0.00 H new ATOM 0 HB VAL A 168 136.844 -6.916 4.427 1.00 0.00 H new ATOM 0 HG11 VAL A 168 136.895 -4.481 4.895 1.00 0.00 H new ATOM 0 HG12 VAL A 168 135.461 -5.242 5.623 1.00 0.00 H new ATOM 0 HG13 VAL A 168 136.856 -4.816 6.642 1.00 0.00 H new ATOM 0 HG21 VAL A 168 139.025 -5.762 4.695 1.00 0.00 H new ATOM 0 HG22 VAL A 168 138.987 -6.098 6.442 1.00 0.00 H new ATOM 0 HG23 VAL A 168 139.114 -7.440 5.280 1.00 0.00 H new ATOM 2314 N PHE A 169 134.403 -7.649 5.670 1.00 0.00 N ATOM 2315 CA PHE A 169 132.951 -7.491 5.729 1.00 0.00 C ATOM 2316 C PHE A 169 132.432 -7.827 7.128 1.00 0.00 C ATOM 2317 O PHE A 169 131.652 -7.071 7.708 1.00 0.00 O ATOM 2318 CB PHE A 169 132.295 -8.427 4.710 1.00 0.00 C ATOM 2319 CG PHE A 169 132.261 -7.775 3.345 1.00 0.00 C ATOM 2320 CD1 PHE A 169 133.413 -7.179 2.816 1.00 0.00 C ATOM 2321 CD2 PHE A 169 131.072 -7.776 2.604 1.00 0.00 C ATOM 2322 CE1 PHE A 169 133.376 -6.585 1.548 1.00 0.00 C ATOM 2323 CE2 PHE A 169 131.035 -7.181 1.336 1.00 0.00 C ATOM 2324 CZ PHE A 169 132.187 -6.585 0.810 1.00 0.00 C ATOM 0 H PHE A 169 134.751 -8.034 4.792 1.00 0.00 H new ATOM 0 HA PHE A 169 132.702 -6.455 5.499 1.00 0.00 H new ATOM 0 HB2 PHE A 169 132.848 -9.365 4.659 1.00 0.00 H new ATOM 0 HB3 PHE A 169 131.282 -8.671 5.029 1.00 0.00 H new ATOM 0 HD1 PHE A 169 134.330 -7.177 3.386 1.00 0.00 H new ATOM 0 HD2 PHE A 169 130.183 -8.236 3.010 1.00 0.00 H new ATOM 0 HE1 PHE A 169 134.265 -6.127 1.140 1.00 0.00 H new ATOM 0 HE2 PHE A 169 130.118 -7.182 0.765 1.00 0.00 H new ATOM 0 HZ PHE A 169 132.158 -6.125 -0.167 1.00 0.00 H new ATOM 2334 N ASP A 170 132.872 -8.961 7.662 1.00 0.00 N ATOM 2335 CA ASP A 170 132.450 -9.386 8.995 1.00 0.00 C ATOM 2336 C ASP A 170 132.910 -8.386 10.056 1.00 0.00 C ATOM 2337 O ASP A 170 132.202 -8.125 11.027 1.00 0.00 O ATOM 2338 CB ASP A 170 133.036 -10.763 9.306 1.00 0.00 C ATOM 2339 CG ASP A 170 132.409 -11.321 10.578 1.00 0.00 C ATOM 2340 OD1 ASP A 170 131.498 -10.692 11.092 1.00 0.00 O ATOM 2341 OD2 ASP A 170 132.847 -12.369 11.021 1.00 0.00 O ATOM 0 H ASP A 170 133.517 -9.600 7.197 1.00 0.00 H new ATOM 0 HA ASP A 170 131.361 -9.435 9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 170 132.853 -11.442 8.473 1.00 0.00 H new ATOM 0 HB3 ASP A 170 134.117 -10.689 9.426 1.00 0.00 H new ATOM 2346 N GLU A 171 134.107 -7.841 9.870 1.00 0.00 N ATOM 2347 CA GLU A 171 134.657 -6.879 10.821 1.00 0.00 C ATOM 2348 C GLU A 171 134.022 -5.500 10.642 1.00 0.00 C ATOM 2349 O GLU A 171 133.907 -4.732 11.598 1.00 0.00 O ATOM 2350 CB GLU A 171 136.173 -6.778 10.641 1.00 0.00 C ATOM 2351 CG GLU A 171 136.827 -8.109 11.025 1.00 0.00 C ATOM 2352 CD GLU A 171 136.585 -8.409 12.501 1.00 0.00 C ATOM 2353 OE1 GLU A 171 136.249 -7.486 13.225 1.00 0.00 O ATOM 2354 OE2 GLU A 171 136.742 -9.556 12.886 1.00 0.00 O ATOM 0 H GLU A 171 134.713 -8.046 9.075 1.00 0.00 H new ATOM 0 HA GLU A 171 134.431 -7.230 11.828 1.00 0.00 H new ATOM 0 HB2 GLU A 171 136.411 -6.530 9.607 1.00 0.00 H new ATOM 0 HB3 GLU A 171 136.570 -5.974 11.261 1.00 0.00 H new ATOM 0 HG2 GLU A 171 136.420 -8.913 10.412 1.00 0.00 H new ATOM 0 HG3 GLU A 171 137.898 -8.067 10.826 1.00 0.00 H new ATOM 2361 N ALA A 172 133.620 -5.191 9.413 1.00 0.00 N ATOM 2362 CA ALA A 172 133.007 -3.899 9.121 1.00 0.00 C ATOM 2363 C ALA A 172 131.659 -3.766 9.817 1.00 0.00 C ATOM 2364 O ALA A 172 131.316 -2.702 10.334 1.00 0.00 O ATOM 2365 CB ALA A 172 132.819 -3.741 7.612 1.00 0.00 C ATOM 0 H ALA A 172 133.706 -5.812 8.609 1.00 0.00 H new ATOM 0 HA ALA A 172 133.669 -3.117 9.492 1.00 0.00 H new ATOM 0 HB1 ALA A 172 132.361 -2.775 7.402 1.00 0.00 H new ATOM 0 HB2 ALA A 172 133.788 -3.799 7.117 1.00 0.00 H new ATOM 0 HB3 ALA A 172 132.174 -4.537 7.240 1.00 0.00 H new ATOM 2371 N ILE A 173 130.896 -4.852 9.827 1.00 0.00 N ATOM 2372 CA ILE A 173 129.587 -4.840 10.462 1.00 0.00 C ATOM 2373 C ILE A 173 129.723 -4.685 11.972 1.00 0.00 C ATOM 2374 O ILE A 173 128.849 -4.120 12.629 1.00 0.00 O ATOM 2375 CB ILE A 173 128.836 -6.127 10.129 1.00 0.00 C ATOM 2376 CG1 ILE A 173 129.695 -7.334 10.503 1.00 0.00 C ATOM 2377 CG2 ILE A 173 128.541 -6.164 8.629 1.00 0.00 C ATOM 2378 CD1 ILE A 173 128.817 -8.586 10.568 1.00 0.00 C ATOM 0 H ILE A 173 131.159 -5.743 9.407 1.00 0.00 H new ATOM 0 HA ILE A 173 129.023 -3.989 10.080 1.00 0.00 H new ATOM 0 HB ILE A 173 127.902 -6.158 10.691 1.00 0.00 H new ATOM 0 HG12 ILE A 173 130.488 -7.471 9.768 1.00 0.00 H new ATOM 0 HG13 ILE A 173 130.178 -7.166 11.465 1.00 0.00 H new ATOM 0 HG21 ILE A 173 128.005 -7.081 8.386 1.00 0.00 H new ATOM 0 HG22 ILE A 173 127.930 -5.303 8.357 1.00 0.00 H new ATOM 0 HG23 ILE A 173 129.478 -6.134 8.073 1.00 0.00 H new ATOM 0 HD11 ILE A 173 129.430 -9.447 10.835 1.00 0.00 H new ATOM 0 HD12 ILE A 173 128.040 -8.447 11.320 1.00 0.00 H new ATOM 0 HD13 ILE A 173 128.355 -8.757 9.596 1.00 0.00 H new ATOM 2382 N LEU A 174 130.828 -5.182 12.518 1.00 0.00 N ATOM 2383 CA LEU A 174 131.065 -5.077 13.951 1.00 0.00 C ATOM 2384 C LEU A 174 131.093 -3.611 14.370 1.00 0.00 C ATOM 2385 O LEU A 174 130.618 -3.252 15.448 1.00 0.00 O ATOM 2386 CB LEU A 174 132.395 -5.743 14.313 1.00 0.00 C ATOM 2387 CG LEU A 174 132.577 -5.737 15.833 1.00 0.00 C ATOM 2388 CD1 LEU A 174 131.534 -6.649 16.482 1.00 0.00 C ATOM 2389 CD2 LEU A 174 133.978 -6.247 16.175 1.00 0.00 C ATOM 0 H LEU A 174 131.565 -5.656 11.996 1.00 0.00 H new ATOM 0 HA LEU A 174 130.257 -5.584 14.478 1.00 0.00 H new ATOM 0 HB2 LEU A 174 132.414 -6.767 13.939 1.00 0.00 H new ATOM 0 HB3 LEU A 174 133.220 -5.214 13.836 1.00 0.00 H new ATOM 0 HG LEU A 174 132.452 -4.721 16.209 1.00 0.00 H new ATOM 0 HD11 LEU A 174 131.667 -6.642 17.564 1.00 0.00 H new ATOM 0 HD12 LEU A 174 130.534 -6.290 16.237 1.00 0.00 H new ATOM 0 HD13 LEU A 174 131.656 -7.666 16.108 1.00 0.00 H new ATOM 0 HD21 LEU A 174 134.112 -6.244 17.257 1.00 0.00 H new ATOM 0 HD22 LEU A 174 134.098 -7.262 15.797 1.00 0.00 H new ATOM 0 HD23 LEU A 174 134.724 -5.598 15.715 1.00 0.00 H new ATOM 2395 N ALA A 175 131.649 -2.770 13.504 1.00 0.00 N ATOM 2396 CA ALA A 175 131.736 -1.341 13.781 1.00 0.00 C ATOM 2397 C ALA A 175 130.343 -0.723 13.850 1.00 0.00 C ATOM 2398 O ALA A 175 130.155 0.340 14.442 1.00 0.00 O ATOM 2399 CB ALA A 175 132.554 -0.647 12.691 1.00 0.00 C ATOM 0 H ALA A 175 132.045 -3.052 12.607 1.00 0.00 H new ATOM 0 HA ALA A 175 132.228 -1.205 14.744 1.00 0.00 H new ATOM 0 HB1 ALA A 175 132.614 0.420 12.905 1.00 0.00 H new ATOM 0 HB2 ALA A 175 133.559 -1.069 12.665 1.00 0.00 H new ATOM 0 HB3 ALA A 175 132.073 -0.796 11.724 1.00 0.00 H new ATOM 2405 N ALA A 176 129.369 -1.396 13.246 1.00 0.00 N ATOM 2406 CA ALA A 176 127.997 -0.904 13.253 1.00 0.00 C ATOM 2407 C ALA A 176 127.437 -0.895 14.672 1.00 0.00 C ATOM 2408 O ALA A 176 126.625 -0.040 15.024 1.00 0.00 O ATOM 2409 CB ALA A 176 127.121 -1.784 12.361 1.00 0.00 C ATOM 0 H ALA A 176 129.503 -2.277 12.749 1.00 0.00 H new ATOM 0 HA ALA A 176 127.996 0.116 12.869 1.00 0.00 H new ATOM 0 HB1 ALA A 176 126.098 -1.409 12.372 1.00 0.00 H new ATOM 0 HB2 ALA A 176 127.504 -1.763 11.341 1.00 0.00 H new ATOM 0 HB3 ALA A 176 127.136 -2.808 12.733 1.00 0.00 H new ATOM 2415 N LEU A 177 127.879 -1.851 15.483 1.00 0.00 N ATOM 2416 CA LEU A 177 127.416 -1.944 16.862 1.00 0.00 C ATOM 2417 C LEU A 177 127.693 -0.641 17.605 1.00 0.00 C ATOM 2418 O LEU A 177 126.903 -0.215 18.446 1.00 0.00 O ATOM 2419 CB LEU A 177 128.119 -3.102 17.574 1.00 0.00 C ATOM 2420 CG LEU A 177 127.536 -3.271 18.979 1.00 0.00 C ATOM 2421 CD1 LEU A 177 126.077 -3.723 18.882 1.00 0.00 C ATOM 2422 CD2 LEU A 177 128.345 -4.324 19.740 1.00 0.00 C ATOM 0 H LEU A 177 128.552 -2.567 15.211 1.00 0.00 H new ATOM 0 HA LEU A 177 126.341 -2.125 16.855 1.00 0.00 H new ATOM 0 HB2 LEU A 177 127.993 -4.023 17.004 1.00 0.00 H new ATOM 0 HB3 LEU A 177 129.190 -2.908 17.635 1.00 0.00 H new ATOM 0 HG LEU A 177 127.584 -2.319 19.507 1.00 0.00 H new ATOM 0 HD11 LEU A 177 125.666 -3.842 19.884 1.00 0.00 H new ATOM 0 HD12 LEU A 177 125.500 -2.975 18.339 1.00 0.00 H new ATOM 0 HD13 LEU A 177 126.025 -4.675 18.353 1.00 0.00 H new ATOM 0 HD21 LEU A 177 127.932 -4.447 20.741 1.00 0.00 H new ATOM 0 HD22 LEU A 177 128.296 -5.274 19.209 1.00 0.00 H new ATOM 0 HD23 LEU A 177 129.384 -4.002 19.813 1.00 0.00 H new ATOM 2428 N GLU A 178 128.820 -0.012 17.287 1.00 0.00 N ATOM 2429 CA GLU A 178 129.190 1.244 17.929 1.00 0.00 C ATOM 2430 C GLU A 178 129.250 1.074 19.444 1.00 0.00 C ATOM 2431 O GLU A 178 130.233 1.456 20.074 1.00 99.99 O ATOM 2432 CB GLU A 178 128.172 2.329 17.575 1.00 0.00 C ATOM 2433 CG GLU A 178 128.642 3.675 18.128 1.00 0.00 C ATOM 2434 CD GLU A 178 127.585 4.743 17.869 1.00 0.00 C ATOM 2435 OE1 GLU A 178 126.547 4.401 17.326 1.00 0.00 O ATOM 2436 OE2 GLU A 178 127.828 5.887 18.215 1.00 0.00 O ATOM 0 H GLU A 178 129.488 -0.348 16.594 1.00 0.00 H new ATOM 0 HA GLU A 178 130.176 1.539 17.569 1.00 0.00 H new ATOM 0 HB2 GLU A 178 128.053 2.391 16.493 1.00 0.00 H new ATOM 0 HB3 GLU A 178 127.196 2.075 17.989 1.00 0.00 H new ATOM 0 HG2 GLU A 178 128.832 3.592 19.198 1.00 0.00 H new ATOM 0 HG3 GLU A 178 129.583 3.962 17.659 1.00 0.00 H new TER 2443 GLU A 178