USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 932 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 88 SER OG : rot -46:sc= 1.16 USER MOD Set 1.2: A 91 ASN : amide:sc= 0.985 K(o=2.1,f=0.28) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -13:sc= 0.51 USER MOD Single : A 3 SER OG : rot 28:sc= 0.227 USER MOD Single : A 5 SER OG : rot 37:sc= 1.08 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot -98:sc= -0.0285 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 HIS : no HD1:sc= -0.521 X(o=-0.52,f=-0.47) USER MOD Single : A 33 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.192) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -0.054 K(o=-0.054,f=-1.4!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0.056 K(o=0.056,f=-4.7!) USER MOD Single : A 46 LYS NZ :NH3+ 150:sc= -0.201 (180deg=-0.755) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 156:sc= -0.0796 (180deg=-0.518) USER MOD Single : A 52 SER OG : rot 60:sc= 1.26 USER MOD Single : A 59 ASN : amide:sc= -0.317 K(o=-0.32,f=-4.9!) USER MOD Single : A 70 MET CE :methyl 148:sc= -6.31! (180deg=-7.44!) USER MOD Single : A 80 ASN : amide:sc= -0.678 X(o=-0.68,f=-0.66) USER MOD Single : A 81 ASN : amide:sc= -0.175 K(o=-0.17,f=-1.8) USER MOD Single : A 82 GLN : amide:sc= -0.0563 X(o=-0.056,f=-0.08) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.327 X(o=-0.33,f=-0.36) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 SER OG : rot 180:sc= -0.0177 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -11:sc= 1.16 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.816 K(o=-0.82,f=-13!) USER MOD Single : A 115 ASN :FLIP amide:sc= -0.198 F(o=-0.86,f=-0.2) USER MOD Single : A 116 GLN : amide:sc= -0.0465 K(o=-0.047,f=-1.1) USER MOD Single : A 117 MET CE :methyl -124:sc= -3.52! (180deg=-11!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.196 -33.099 19.029 1.00 0.00 N ATOM 2 CA GLY A 1 8.544 -31.861 19.414 1.00 0.00 C ATOM 3 C GLY A 1 8.013 -31.090 18.221 1.00 0.00 C ATOM 4 O GLY A 1 6.885 -31.314 17.781 1.00 0.00 O ATOM 0 H1 GLY A 1 9.541 -33.589 19.879 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.517 -33.709 18.530 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.998 -32.888 18.401 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.722 -32.083 20.094 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.250 -31.237 19.961 1.00 0.00 H new ATOM 8 N SER A 2 8.827 -30.180 17.696 1.00 0.00 N ATOM 9 CA SER A 2 8.430 -29.370 16.551 1.00 0.00 C ATOM 10 C SER A 2 6.974 -28.931 16.673 1.00 0.00 C ATOM 11 O SER A 2 6.220 -28.966 15.701 1.00 0.00 O ATOM 12 CB SER A 2 8.631 -30.152 15.252 1.00 0.00 C ATOM 13 OG SER A 2 7.683 -31.198 15.135 1.00 0.00 O ATOM 0 H SER A 2 9.765 -29.985 18.045 1.00 0.00 H new ATOM 0 HA SER A 2 9.059 -28.480 16.533 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.540 -29.478 14.400 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.639 -30.566 15.225 1.00 0.00 H new ATOM 0 HG SER A 2 7.241 -31.337 15.998 1.00 0.00 H new ATOM 19 N SER A 3 6.586 -28.519 17.876 1.00 0.00 N ATOM 20 CA SER A 3 5.219 -28.077 18.128 1.00 0.00 C ATOM 21 C SER A 3 5.165 -26.565 18.322 1.00 0.00 C ATOM 22 O SER A 3 5.907 -26.003 19.126 1.00 0.00 O ATOM 23 CB SER A 3 4.653 -28.782 19.362 1.00 0.00 C ATOM 24 OG SER A 3 5.363 -28.413 20.531 1.00 0.00 O ATOM 0 H SER A 3 7.198 -28.482 18.691 1.00 0.00 H new ATOM 0 HA SER A 3 4.613 -28.336 17.260 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.599 -28.529 19.478 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.708 -29.862 19.225 1.00 0.00 H new ATOM 0 HG SER A 3 5.735 -27.513 20.418 1.00 0.00 H new ATOM 30 N GLY A 4 4.278 -25.910 17.578 1.00 0.00 N ATOM 31 CA GLY A 4 4.141 -24.469 17.682 1.00 0.00 C ATOM 32 C GLY A 4 3.701 -23.833 16.379 1.00 0.00 C ATOM 33 O GLY A 4 4.531 -23.460 15.550 1.00 0.00 O ATOM 0 H GLY A 4 3.652 -26.352 16.905 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.417 -24.231 18.461 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.094 -24.038 17.990 1.00 0.00 H new ATOM 37 N SER A 5 2.390 -23.711 16.195 1.00 0.00 N ATOM 38 CA SER A 5 1.840 -23.120 14.980 1.00 0.00 C ATOM 39 C SER A 5 1.967 -21.600 15.009 1.00 0.00 C ATOM 40 O SER A 5 1.174 -20.912 15.652 1.00 0.00 O ATOM 41 CB SER A 5 0.372 -23.518 14.814 1.00 0.00 C ATOM 42 OG SER A 5 -0.417 -23.011 15.877 1.00 0.00 O ATOM 0 H SER A 5 1.689 -24.013 16.872 1.00 0.00 H new ATOM 0 HA SER A 5 2.410 -23.498 14.131 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.006 -23.140 13.864 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.288 -24.604 14.780 1.00 0.00 H new ATOM 0 HG SER A 5 -0.088 -22.125 16.135 1.00 0.00 H new ATOM 48 N SER A 6 2.971 -21.083 14.309 1.00 0.00 N ATOM 49 CA SER A 6 3.206 -19.645 14.257 1.00 0.00 C ATOM 50 C SER A 6 1.999 -18.918 13.670 1.00 0.00 C ATOM 51 O SER A 6 1.606 -19.164 12.531 1.00 0.00 O ATOM 52 CB SER A 6 4.453 -19.340 13.424 1.00 0.00 C ATOM 53 OG SER A 6 5.627 -19.777 14.086 1.00 0.00 O ATOM 0 H SER A 6 3.635 -21.639 13.770 1.00 0.00 H new ATOM 0 HA SER A 6 3.362 -19.291 15.276 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.375 -19.830 12.454 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.515 -18.268 13.236 1.00 0.00 H new ATOM 0 HG SER A 6 6.410 -19.572 13.533 1.00 0.00 H new ATOM 59 N GLY A 7 1.415 -18.022 14.459 1.00 0.00 N ATOM 60 CA GLY A 7 0.259 -17.273 14.002 1.00 0.00 C ATOM 61 C GLY A 7 0.466 -15.774 14.093 1.00 0.00 C ATOM 62 O GLY A 7 -0.168 -15.008 13.367 1.00 0.00 O ATOM 0 H GLY A 7 1.722 -17.801 15.406 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.039 -17.544 12.969 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.610 -17.553 14.597 1.00 0.00 H new ATOM 66 N ASP A 8 1.354 -15.354 14.987 1.00 0.00 N ATOM 67 CA ASP A 8 1.643 -13.937 15.171 1.00 0.00 C ATOM 68 C ASP A 8 2.683 -13.459 14.162 1.00 0.00 C ATOM 69 O ASP A 8 3.562 -12.663 14.492 1.00 0.00 O ATOM 70 CB ASP A 8 2.137 -13.675 16.594 1.00 0.00 C ATOM 71 CG ASP A 8 1.395 -14.502 17.626 1.00 0.00 C ATOM 72 OD1 ASP A 8 1.684 -15.712 17.735 1.00 0.00 O ATOM 73 OD2 ASP A 8 0.525 -13.940 18.323 1.00 0.00 O ATOM 0 H ASP A 8 1.886 -15.975 15.596 1.00 0.00 H new ATOM 0 HA ASP A 8 0.721 -13.380 15.007 1.00 0.00 H new ATOM 0 HB2 ASP A 8 3.202 -13.897 16.652 1.00 0.00 H new ATOM 0 HB3 ASP A 8 2.019 -12.617 16.827 1.00 0.00 H new ATOM 78 N ALA A 9 2.578 -13.951 12.932 1.00 0.00 N ATOM 79 CA ALA A 9 3.508 -13.574 11.876 1.00 0.00 C ATOM 80 C ALA A 9 3.018 -12.338 11.128 1.00 0.00 C ATOM 81 O ALA A 9 3.687 -11.844 10.221 1.00 0.00 O ATOM 82 CB ALA A 9 3.708 -14.733 10.910 1.00 0.00 C ATOM 0 H ALA A 9 1.857 -14.612 12.643 1.00 0.00 H new ATOM 0 HA ALA A 9 4.465 -13.331 12.338 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.405 -14.437 10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.111 -15.591 11.449 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.752 -15.002 10.462 1.00 0.00 H new ATOM 88 N PHE A 10 1.847 -11.845 11.515 1.00 0.00 N ATOM 89 CA PHE A 10 1.266 -10.667 10.879 1.00 0.00 C ATOM 90 C PHE A 10 1.276 -9.475 11.832 1.00 0.00 C ATOM 91 O PHE A 10 0.551 -8.500 11.633 1.00 0.00 O ATOM 92 CB PHE A 10 -0.165 -10.960 10.426 1.00 0.00 C ATOM 93 CG PHE A 10 -0.241 -11.857 9.224 1.00 0.00 C ATOM 94 CD1 PHE A 10 -0.286 -13.234 9.372 1.00 0.00 C ATOM 95 CD2 PHE A 10 -0.268 -11.324 7.945 1.00 0.00 C ATOM 96 CE1 PHE A 10 -0.357 -14.063 8.268 1.00 0.00 C ATOM 97 CE2 PHE A 10 -0.338 -12.148 6.837 1.00 0.00 C ATOM 98 CZ PHE A 10 -0.382 -13.519 6.999 1.00 0.00 C ATOM 0 H PHE A 10 1.281 -12.242 12.265 1.00 0.00 H new ATOM 0 HA PHE A 10 1.872 -10.419 10.008 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.711 -11.421 11.249 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -0.666 -10.019 10.199 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -0.265 -13.665 10.362 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.234 -10.253 7.812 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -0.393 -15.135 8.398 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.358 -11.720 5.846 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.436 -14.164 6.135 1.00 0.00 H new ATOM 108 N THR A 11 2.103 -9.560 12.869 1.00 0.00 N ATOM 109 CA THR A 11 2.208 -8.491 13.854 1.00 0.00 C ATOM 110 C THR A 11 3.244 -7.455 13.433 1.00 0.00 C ATOM 111 O THR A 11 4.296 -7.799 12.894 1.00 0.00 O ATOM 112 CB THR A 11 2.583 -9.041 15.243 1.00 0.00 C ATOM 113 OG1 THR A 11 3.915 -9.566 15.218 1.00 0.00 O ATOM 114 CG2 THR A 11 1.611 -10.129 15.675 1.00 0.00 C ATOM 0 H THR A 11 2.711 -10.359 13.049 1.00 0.00 H new ATOM 0 HA THR A 11 1.228 -8.018 13.912 1.00 0.00 H new ATOM 0 HB THR A 11 2.529 -8.222 15.961 1.00 0.00 H new ATOM 0 HG1 THR A 11 3.881 -10.538 15.096 1.00 0.00 H new ATOM 0 HG21 THR A 11 1.896 -10.502 16.659 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.602 -9.718 15.721 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.637 -10.947 14.955 1.00 0.00 H new ATOM 122 N ASP A 12 2.940 -6.186 13.682 1.00 0.00 N ATOM 123 CA ASP A 12 3.846 -5.099 13.330 1.00 0.00 C ATOM 124 C ASP A 12 5.300 -5.529 13.498 1.00 0.00 C ATOM 125 O ASP A 12 6.048 -5.613 12.525 1.00 0.00 O ATOM 126 CB ASP A 12 3.561 -3.869 14.193 1.00 0.00 C ATOM 127 CG ASP A 12 3.183 -4.235 15.615 1.00 0.00 C ATOM 128 OD1 ASP A 12 2.071 -4.768 15.816 1.00 0.00 O ATOM 129 OD2 ASP A 12 3.999 -3.989 16.528 1.00 0.00 O ATOM 0 H ASP A 12 2.073 -5.885 14.126 1.00 0.00 H new ATOM 0 HA ASP A 12 3.680 -4.844 12.283 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.442 -3.227 14.208 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.754 -3.292 13.743 1.00 0.00 H new ATOM 134 N GLN A 13 5.693 -5.797 14.740 1.00 0.00 N ATOM 135 CA GLN A 13 7.058 -6.216 15.035 1.00 0.00 C ATOM 136 C GLN A 13 7.584 -7.156 13.955 1.00 0.00 C ATOM 137 O GLN A 13 8.732 -7.042 13.523 1.00 0.00 O ATOM 138 CB GLN A 13 7.119 -6.903 16.400 1.00 0.00 C ATOM 139 CG GLN A 13 6.200 -8.108 16.517 1.00 0.00 C ATOM 140 CD GLN A 13 6.471 -8.931 17.761 1.00 0.00 C ATOM 141 OE1 GLN A 13 5.651 -8.979 18.678 1.00 0.00 O ATOM 142 NE2 GLN A 13 7.627 -9.583 17.799 1.00 0.00 N ATOM 0 H GLN A 13 5.086 -5.731 15.557 1.00 0.00 H new ATOM 0 HA GLN A 13 7.688 -5.327 15.055 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.144 -7.219 16.593 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.857 -6.181 17.173 1.00 0.00 H new ATOM 0 HG2 GLN A 13 5.164 -7.770 16.528 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.320 -8.738 15.636 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.277 -9.515 17.016 1.00 0.00 H new ATOM 0 HE22 GLN A 13 7.865 -10.152 18.611 1.00 0.00 H new ATOM 151 N LYS A 14 6.739 -8.086 13.524 1.00 0.00 N ATOM 152 CA LYS A 14 7.118 -9.046 12.494 1.00 0.00 C ATOM 153 C LYS A 14 7.110 -8.396 11.114 1.00 0.00 C ATOM 154 O LYS A 14 7.985 -8.660 10.289 1.00 0.00 O ATOM 155 CB LYS A 14 6.165 -10.244 12.510 1.00 0.00 C ATOM 156 CG LYS A 14 6.362 -11.162 13.704 1.00 0.00 C ATOM 157 CD LYS A 14 7.300 -12.311 13.375 1.00 0.00 C ATOM 158 CE LYS A 14 8.730 -11.998 13.787 1.00 0.00 C ATOM 159 NZ LYS A 14 9.712 -12.881 13.097 1.00 0.00 N ATOM 0 H LYS A 14 5.787 -8.195 13.872 1.00 0.00 H new ATOM 0 HA LYS A 14 8.130 -9.390 12.708 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.137 -9.880 12.508 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.302 -10.819 11.594 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.764 -10.591 14.541 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.398 -11.558 14.023 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.963 -13.214 13.884 1.00 0.00 H new ATOM 0 HD3 LYS A 14 7.265 -12.516 12.305 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.954 -10.956 13.558 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.831 -12.116 14.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 10.675 -12.636 13.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 9.514 -13.874 13.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.633 -12.750 12.068 1.00 0.00 H new ATOM 173 N ILE A 15 6.120 -7.544 10.872 1.00 0.00 N ATOM 174 CA ILE A 15 6.002 -6.854 9.593 1.00 0.00 C ATOM 175 C ILE A 15 7.248 -6.026 9.298 1.00 0.00 C ATOM 176 O ILE A 15 7.817 -6.108 8.210 1.00 0.00 O ATOM 177 CB ILE A 15 4.768 -5.933 9.562 1.00 0.00 C ATOM 178 CG1 ILE A 15 3.485 -6.760 9.678 1.00 0.00 C ATOM 179 CG2 ILE A 15 4.757 -5.105 8.286 1.00 0.00 C ATOM 180 CD1 ILE A 15 2.233 -5.919 9.789 1.00 0.00 C ATOM 0 H ILE A 15 5.388 -7.315 11.544 1.00 0.00 H new ATOM 0 HA ILE A 15 5.890 -7.623 8.829 1.00 0.00 H new ATOM 0 HB ILE A 15 4.818 -5.253 10.412 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.401 -7.409 8.807 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.557 -7.407 10.552 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.879 -4.459 8.279 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.658 -4.493 8.242 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.726 -5.769 7.422 1.00 0.00 H new ATOM 0 HD11 ILE A 15 1.363 -6.571 9.868 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.296 -5.288 10.676 1.00 0.00 H new ATOM 0 HD13 ILE A 15 2.137 -5.291 8.903 1.00 0.00 H new ATOM 192 N ARG A 16 7.667 -5.229 10.276 1.00 0.00 N ATOM 193 CA ARG A 16 8.846 -4.386 10.122 1.00 0.00 C ATOM 194 C ARG A 16 10.100 -5.234 9.933 1.00 0.00 C ATOM 195 O ARG A 16 10.972 -4.899 9.132 1.00 0.00 O ATOM 196 CB ARG A 16 9.011 -3.475 11.340 1.00 0.00 C ATOM 197 CG ARG A 16 9.222 -4.232 12.641 1.00 0.00 C ATOM 198 CD ARG A 16 9.472 -3.283 13.803 1.00 0.00 C ATOM 199 NE ARG A 16 10.215 -3.925 14.884 1.00 0.00 N ATOM 200 CZ ARG A 16 10.841 -3.255 15.845 1.00 0.00 C ATOM 201 NH1 ARG A 16 10.815 -1.929 15.858 1.00 0.00 N ATOM 202 NH2 ARG A 16 11.496 -3.910 16.795 1.00 0.00 N ATOM 0 H ARG A 16 7.207 -5.150 11.183 1.00 0.00 H new ATOM 0 HA ARG A 16 8.708 -3.770 9.233 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.859 -2.811 11.174 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.126 -2.845 11.435 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.346 -4.845 12.853 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.068 -4.911 12.535 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.026 -2.414 13.448 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.518 -2.919 14.185 1.00 0.00 H new ATOM 0 HE ARG A 16 10.255 -4.944 14.902 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.314 -1.422 15.129 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.296 -1.417 16.597 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.519 -4.930 16.788 1.00 0.00 H new ATOM 0 HH22 ARG A 16 11.976 -3.394 17.532 1.00 0.00 H new ATOM 216 N GLN A 17 10.183 -6.332 10.678 1.00 0.00 N ATOM 217 CA GLN A 17 11.331 -7.227 10.593 1.00 0.00 C ATOM 218 C GLN A 17 11.301 -8.030 9.297 1.00 0.00 C ATOM 219 O GLN A 17 12.343 -8.440 8.785 1.00 0.00 O ATOM 220 CB GLN A 17 11.355 -8.175 11.794 1.00 0.00 C ATOM 221 CG GLN A 17 12.133 -7.632 12.981 1.00 0.00 C ATOM 222 CD GLN A 17 12.598 -8.726 13.923 1.00 0.00 C ATOM 223 OE1 GLN A 17 13.600 -9.395 13.670 1.00 0.00 O ATOM 224 NE2 GLN A 17 11.870 -8.913 15.018 1.00 0.00 N ATOM 0 H GLN A 17 9.470 -6.623 11.347 1.00 0.00 H new ATOM 0 HA GLN A 17 12.235 -6.619 10.601 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.331 -8.381 12.105 1.00 0.00 H new ATOM 0 HB3 GLN A 17 11.792 -9.125 11.488 1.00 0.00 H new ATOM 0 HG2 GLN A 17 12.998 -7.076 12.620 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.508 -6.927 13.529 1.00 0.00 H new ATOM 0 HE21 GLN A 17 11.047 -8.335 15.188 1.00 0.00 H new ATOM 0 HE22 GLN A 17 12.134 -9.634 15.689 1.00 0.00 H new ATOM 233 N ARG A 18 10.101 -8.251 8.771 1.00 0.00 N ATOM 234 CA ARG A 18 9.935 -9.006 7.535 1.00 0.00 C ATOM 235 C ARG A 18 10.352 -8.171 6.328 1.00 0.00 C ATOM 236 O ARG A 18 10.971 -8.679 5.393 1.00 0.00 O ATOM 237 CB ARG A 18 8.482 -9.458 7.379 1.00 0.00 C ATOM 238 CG ARG A 18 8.156 -9.994 5.995 1.00 0.00 C ATOM 239 CD ARG A 18 7.037 -11.023 6.045 1.00 0.00 C ATOM 240 NE ARG A 18 7.394 -12.180 6.862 1.00 0.00 N ATOM 241 CZ ARG A 18 6.718 -13.324 6.851 1.00 0.00 C ATOM 242 NH1 ARG A 18 5.658 -13.463 6.068 1.00 0.00 N ATOM 243 NH2 ARG A 18 7.105 -14.331 7.623 1.00 0.00 N ATOM 0 H ARG A 18 9.229 -7.918 9.182 1.00 0.00 H new ATOM 0 HA ARG A 18 10.578 -9.885 7.587 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.269 -10.231 8.118 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.823 -8.618 7.598 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.865 -9.170 5.344 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.047 -10.445 5.559 1.00 0.00 H new ATOM 0 HD2 ARG A 18 6.136 -10.560 6.447 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.802 -11.352 5.033 1.00 0.00 H new ATOM 0 HE ARG A 18 8.206 -12.106 7.474 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.359 -12.691 5.472 1.00 0.00 H new ATOM 0 HH12 ARG A 18 5.141 -14.342 6.061 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.922 -14.227 8.225 1.00 0.00 H new ATOM 0 HH22 ARG A 18 6.586 -15.209 7.614 1.00 0.00 H new ATOM 257 N TYR A 19 10.008 -6.888 6.355 1.00 0.00 N ATOM 258 CA TYR A 19 10.344 -5.984 5.262 1.00 0.00 C ATOM 259 C TYR A 19 11.454 -5.022 5.672 1.00 0.00 C ATOM 260 O TYR A 19 11.703 -4.021 5.001 1.00 0.00 O ATOM 261 CB TYR A 19 9.107 -5.196 4.826 1.00 0.00 C ATOM 262 CG TYR A 19 8.019 -6.060 4.229 1.00 0.00 C ATOM 263 CD1 TYR A 19 8.156 -6.606 2.959 1.00 0.00 C ATOM 264 CD2 TYR A 19 6.853 -6.329 4.936 1.00 0.00 C ATOM 265 CE1 TYR A 19 7.164 -7.395 2.410 1.00 0.00 C ATOM 266 CE2 TYR A 19 5.856 -7.118 4.395 1.00 0.00 C ATOM 267 CZ TYR A 19 6.016 -7.648 3.131 1.00 0.00 C ATOM 268 OH TYR A 19 5.026 -8.435 2.588 1.00 0.00 O ATOM 0 H TYR A 19 9.497 -6.451 7.122 1.00 0.00 H new ATOM 0 HA TYR A 19 10.699 -6.584 4.424 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.704 -4.662 5.687 1.00 0.00 H new ATOM 0 HB3 TYR A 19 9.404 -4.444 4.095 1.00 0.00 H new ATOM 0 HD1 TYR A 19 9.054 -6.410 2.391 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.724 -5.914 5.925 1.00 0.00 H new ATOM 0 HE1 TYR A 19 7.287 -7.812 1.421 1.00 0.00 H new ATOM 0 HE2 TYR A 19 4.957 -7.319 4.958 1.00 0.00 H new ATOM 0 HH TYR A 19 4.286 -8.515 3.225 1.00 0.00 H new ATOM 278 N ALA A 20 12.119 -5.334 6.780 1.00 0.00 N ATOM 279 CA ALA A 20 13.205 -4.500 7.280 1.00 0.00 C ATOM 280 C ALA A 20 14.382 -4.491 6.309 1.00 0.00 C ATOM 281 O ALA A 20 15.232 -3.602 6.359 1.00 0.00 O ATOM 282 CB ALA A 20 13.654 -4.984 8.651 1.00 0.00 C ATOM 0 H ALA A 20 11.924 -6.158 7.348 1.00 0.00 H new ATOM 0 HA ALA A 20 12.834 -3.479 7.370 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.465 -4.352 9.012 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.817 -4.933 9.347 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.002 -6.014 8.577 1.00 0.00 H new ATOM 288 N ASP A 21 14.423 -5.484 5.428 1.00 0.00 N ATOM 289 CA ASP A 21 15.496 -5.589 4.445 1.00 0.00 C ATOM 290 C ASP A 21 15.341 -4.532 3.356 1.00 0.00 C ATOM 291 O ASP A 21 16.322 -4.104 2.747 1.00 0.00 O ATOM 292 CB ASP A 21 15.508 -6.985 3.820 1.00 0.00 C ATOM 293 CG ASP A 21 16.829 -7.308 3.150 1.00 0.00 C ATOM 294 OD1 ASP A 21 17.445 -6.384 2.578 1.00 0.00 O ATOM 295 OD2 ASP A 21 17.246 -8.484 3.196 1.00 0.00 O ATOM 0 H ASP A 21 13.727 -6.227 5.374 1.00 0.00 H new ATOM 0 HA ASP A 21 16.443 -5.420 4.957 1.00 0.00 H new ATOM 0 HB2 ASP A 21 15.304 -7.727 4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 21 14.705 -7.059 3.087 1.00 0.00 H new ATOM 300 N LEU A 22 14.102 -4.116 3.115 1.00 0.00 N ATOM 301 CA LEU A 22 13.818 -3.109 2.098 1.00 0.00 C ATOM 302 C LEU A 22 14.636 -1.845 2.340 1.00 0.00 C ATOM 303 O LEU A 22 15.001 -1.519 3.470 1.00 0.00 O ATOM 304 CB LEU A 22 12.326 -2.772 2.090 1.00 0.00 C ATOM 305 CG LEU A 22 11.370 -3.957 1.951 1.00 0.00 C ATOM 306 CD1 LEU A 22 9.950 -3.472 1.706 1.00 0.00 C ATOM 307 CD2 LEU A 22 11.822 -4.878 0.826 1.00 0.00 C ATOM 0 H LEU A 22 13.279 -4.460 3.609 1.00 0.00 H new ATOM 0 HA LEU A 22 14.097 -3.519 1.127 1.00 0.00 H new ATOM 0 HB2 LEU A 22 12.088 -2.246 3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 22 12.135 -2.079 1.271 1.00 0.00 H new ATOM 0 HG LEU A 22 11.384 -4.521 2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.284 -4.330 1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.627 -2.854 2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.919 -2.884 0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 22 11.130 -5.716 0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.838 -4.325 -0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 22 12.822 -5.254 1.043 1.00 0.00 H new ATOM 319 N PRO A 23 14.929 -1.113 1.255 1.00 0.00 N ATOM 320 CA PRO A 23 15.704 0.130 1.324 1.00 0.00 C ATOM 321 C PRO A 23 14.931 1.258 1.998 1.00 0.00 C ATOM 322 O PRO A 23 15.441 1.920 2.902 1.00 0.00 O ATOM 323 CB PRO A 23 15.968 0.465 -0.146 1.00 0.00 C ATOM 324 CG PRO A 23 14.857 -0.191 -0.889 1.00 0.00 C ATOM 325 CD PRO A 23 14.526 -1.441 -0.122 1.00 0.00 C ATOM 0 HA PRO A 23 16.611 0.013 1.918 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.973 1.542 -0.312 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.938 0.088 -0.470 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.990 0.467 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 23 15.157 -0.428 -1.910 1.00 0.00 H new ATOM 0 HD2 PRO A 23 13.465 -1.681 -0.184 1.00 0.00 H new ATOM 0 HD3 PRO A 23 15.071 -2.304 -0.505 1.00 0.00 H new ATOM 333 N GLY A 24 13.697 1.473 1.551 1.00 0.00 N ATOM 334 CA GLY A 24 12.874 2.523 2.123 1.00 0.00 C ATOM 335 C GLY A 24 12.496 2.244 3.564 1.00 0.00 C ATOM 336 O GLY A 24 12.949 1.262 4.151 1.00 0.00 O ATOM 0 H GLY A 24 13.253 0.939 0.804 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.410 3.471 2.068 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.968 2.635 1.528 1.00 0.00 H new ATOM 340 N GLU A 25 11.665 3.110 4.135 1.00 0.00 N ATOM 341 CA GLU A 25 11.229 2.952 5.517 1.00 0.00 C ATOM 342 C GLU A 25 9.749 2.584 5.582 1.00 0.00 C ATOM 343 O GLU A 25 8.901 3.275 5.018 1.00 0.00 O ATOM 344 CB GLU A 25 11.481 4.239 6.305 1.00 0.00 C ATOM 345 CG GLU A 25 11.756 4.006 7.781 1.00 0.00 C ATOM 346 CD GLU A 25 13.217 3.713 8.063 1.00 0.00 C ATOM 347 OE1 GLU A 25 13.746 2.733 7.498 1.00 0.00 O ATOM 348 OE2 GLU A 25 13.831 4.465 8.849 1.00 0.00 O ATOM 0 H GLU A 25 11.280 3.928 3.662 1.00 0.00 H new ATOM 0 HA GLU A 25 11.807 2.143 5.963 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.329 4.764 5.865 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.614 4.892 6.204 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.450 4.886 8.347 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.148 3.173 8.133 1.00 0.00 H new ATOM 355 N LEU A 26 9.448 1.491 6.275 1.00 0.00 N ATOM 356 CA LEU A 26 8.071 1.030 6.414 1.00 0.00 C ATOM 357 C LEU A 26 7.202 2.098 7.070 1.00 0.00 C ATOM 358 O LEU A 26 7.591 2.700 8.072 1.00 0.00 O ATOM 359 CB LEU A 26 8.025 -0.258 7.238 1.00 0.00 C ATOM 360 CG LEU A 26 6.822 -1.170 6.993 1.00 0.00 C ATOM 361 CD1 LEU A 26 7.015 -1.977 5.719 1.00 0.00 C ATOM 362 CD2 LEU A 26 6.600 -2.092 8.183 1.00 0.00 C ATOM 0 H LEU A 26 10.138 0.908 6.749 1.00 0.00 H new ATOM 0 HA LEU A 26 7.678 0.831 5.417 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.933 -0.826 7.037 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.043 0.010 8.294 1.00 0.00 H new ATOM 0 HG LEU A 26 5.936 -0.546 6.873 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.149 -2.620 5.561 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.123 -1.299 4.872 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.911 -2.591 5.809 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.740 -2.734 7.991 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.486 -2.709 8.336 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.415 -1.495 9.076 1.00 0.00 H new ATOM 374 N HIS A 27 6.024 2.327 6.500 1.00 0.00 N ATOM 375 CA HIS A 27 5.098 3.322 7.031 1.00 0.00 C ATOM 376 C HIS A 27 3.691 2.743 7.155 1.00 0.00 C ATOM 377 O HIS A 27 2.932 2.720 6.185 1.00 0.00 O ATOM 378 CB HIS A 27 5.076 4.559 6.134 1.00 0.00 C ATOM 379 CG HIS A 27 6.081 5.599 6.523 1.00 0.00 C ATOM 380 ND1 HIS A 27 5.740 6.901 6.821 1.00 0.00 N ATOM 381 CD2 HIS A 27 7.426 5.522 6.663 1.00 0.00 C ATOM 382 CE1 HIS A 27 6.832 7.581 7.127 1.00 0.00 C ATOM 383 NE2 HIS A 27 7.868 6.766 7.039 1.00 0.00 N ATOM 0 H HIS A 27 5.687 1.838 5.671 1.00 0.00 H new ATOM 0 HA HIS A 27 5.442 3.609 8.024 1.00 0.00 H new ATOM 0 HB2 HIS A 27 5.261 4.254 5.104 1.00 0.00 H new ATOM 0 HB3 HIS A 27 4.080 5.000 6.162 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.037 4.645 6.508 1.00 0.00 H new ATOM 0 HE1 HIS A 27 6.870 8.625 7.402 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.839 7.020 7.221 1.00 0.00 H new ATOM 392 N ILE A 28 3.352 2.277 8.352 1.00 0.00 N ATOM 393 CA ILE A 28 2.037 1.699 8.601 1.00 0.00 C ATOM 394 C ILE A 28 1.054 2.759 9.088 1.00 0.00 C ATOM 395 O ILE A 28 1.120 3.201 10.235 1.00 0.00 O ATOM 396 CB ILE A 28 2.108 0.565 9.640 1.00 0.00 C ATOM 397 CG1 ILE A 28 3.121 -0.494 9.202 1.00 0.00 C ATOM 398 CG2 ILE A 28 0.734 -0.058 9.839 1.00 0.00 C ATOM 399 CD1 ILE A 28 3.634 -1.347 10.341 1.00 0.00 C ATOM 0 H ILE A 28 3.969 2.288 9.164 1.00 0.00 H new ATOM 0 HA ILE A 28 1.687 1.290 7.653 1.00 0.00 H new ATOM 0 HB ILE A 28 2.437 0.983 10.591 1.00 0.00 H new ATOM 0 HG12 ILE A 28 2.660 -1.139 8.455 1.00 0.00 H new ATOM 0 HG13 ILE A 28 3.965 -0.001 8.720 1.00 0.00 H new ATOM 0 HG21 ILE A 28 0.801 -0.858 10.576 1.00 0.00 H new ATOM 0 HG22 ILE A 28 0.037 0.703 10.191 1.00 0.00 H new ATOM 0 HG23 ILE A 28 0.379 -0.466 8.893 1.00 0.00 H new ATOM 0 HD11 ILE A 28 4.348 -2.076 9.957 1.00 0.00 H new ATOM 0 HD12 ILE A 28 4.125 -0.712 11.079 1.00 0.00 H new ATOM 0 HD13 ILE A 28 2.799 -1.869 10.809 1.00 0.00 H new ATOM 411 N ILE A 29 0.142 3.161 8.209 1.00 0.00 N ATOM 412 CA ILE A 29 -0.856 4.166 8.550 1.00 0.00 C ATOM 413 C ILE A 29 -2.269 3.639 8.317 1.00 0.00 C ATOM 414 O ILE A 29 -2.542 2.997 7.304 1.00 0.00 O ATOM 415 CB ILE A 29 -0.660 5.456 7.731 1.00 0.00 C ATOM 416 CG1 ILE A 29 -0.890 5.181 6.244 1.00 0.00 C ATOM 417 CG2 ILE A 29 0.733 6.022 7.962 1.00 0.00 C ATOM 418 CD1 ILE A 29 -0.766 6.414 5.376 1.00 0.00 C ATOM 0 H ILE A 29 0.074 2.806 7.255 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.725 4.394 9.608 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.390 6.194 8.061 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.172 4.434 5.905 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.883 4.751 6.111 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.857 6.933 7.377 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.862 6.250 9.020 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.479 5.289 7.655 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.941 6.145 4.334 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.502 7.154 5.688 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.235 6.832 5.479 1.00 0.00 H new ATOM 430 N GLU A 30 -3.162 3.918 9.262 1.00 0.00 N ATOM 431 CA GLU A 30 -4.546 3.473 9.158 1.00 0.00 C ATOM 432 C GLU A 30 -5.428 4.571 8.571 1.00 0.00 C ATOM 433 O GLU A 30 -5.478 5.687 9.090 1.00 0.00 O ATOM 434 CB GLU A 30 -5.076 3.058 10.532 1.00 0.00 C ATOM 435 CG GLU A 30 -4.852 1.590 10.853 1.00 0.00 C ATOM 436 CD GLU A 30 -4.683 1.337 12.339 1.00 0.00 C ATOM 437 OE1 GLU A 30 -5.707 1.152 13.029 1.00 0.00 O ATOM 438 OE2 GLU A 30 -3.527 1.323 12.811 1.00 0.00 O ATOM 0 H GLU A 30 -2.951 4.449 10.107 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.575 2.612 8.490 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.593 3.666 11.297 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -6.143 3.273 10.580 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.696 1.008 10.483 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.966 1.238 10.325 1.00 0.00 H new ATOM 445 N LEU A 31 -6.123 4.247 7.486 1.00 0.00 N ATOM 446 CA LEU A 31 -7.003 5.206 6.827 1.00 0.00 C ATOM 447 C LEU A 31 -8.431 4.674 6.756 1.00 0.00 C ATOM 448 O LEU A 31 -8.670 3.575 6.256 1.00 0.00 O ATOM 449 CB LEU A 31 -6.491 5.513 5.418 1.00 0.00 C ATOM 450 CG LEU A 31 -4.993 5.793 5.295 1.00 0.00 C ATOM 451 CD1 LEU A 31 -4.564 5.770 3.836 1.00 0.00 C ATOM 452 CD2 LEU A 31 -4.646 7.130 5.934 1.00 0.00 C ATOM 0 H LEU A 31 -6.094 3.328 7.044 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.005 6.124 7.415 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.737 4.670 4.772 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.034 6.377 5.036 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.451 5.009 5.824 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.495 5.971 3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.777 4.790 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.113 6.533 3.283 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.576 7.313 5.837 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.197 7.926 5.434 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.916 7.110 6.990 1.00 0.00 H new ATOM 464 N GLU A 32 -9.376 5.462 7.258 1.00 0.00 N ATOM 465 CA GLU A 32 -10.781 5.070 7.250 1.00 0.00 C ATOM 466 C GLU A 32 -11.422 5.370 5.898 1.00 0.00 C ATOM 467 O GLU A 32 -11.587 6.530 5.520 1.00 0.00 O ATOM 468 CB GLU A 32 -11.542 5.797 8.361 1.00 0.00 C ATOM 469 CG GLU A 32 -12.718 5.007 8.911 1.00 0.00 C ATOM 470 CD GLU A 32 -13.612 5.840 9.809 1.00 0.00 C ATOM 471 OE1 GLU A 32 -14.443 6.603 9.274 1.00 0.00 O ATOM 472 OE2 GLU A 32 -13.481 5.729 11.045 1.00 0.00 O ATOM 0 H GLU A 32 -9.195 6.375 7.675 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.833 3.996 7.427 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.853 6.021 9.175 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -11.904 6.751 7.978 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.307 4.615 8.082 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.345 4.150 9.471 1.00 0.00 H new ATOM 479 N LYS A 33 -11.780 4.316 5.174 1.00 0.00 N ATOM 480 CA LYS A 33 -12.404 4.464 3.864 1.00 0.00 C ATOM 481 C LYS A 33 -13.404 5.616 3.864 1.00 0.00 C ATOM 482 O LYS A 33 -14.246 5.719 4.756 1.00 0.00 O ATOM 483 CB LYS A 33 -13.106 3.165 3.461 1.00 0.00 C ATOM 484 CG LYS A 33 -12.149 2.034 3.129 1.00 0.00 C ATOM 485 CD LYS A 33 -12.754 1.067 2.125 1.00 0.00 C ATOM 486 CE LYS A 33 -13.699 0.083 2.798 1.00 0.00 C ATOM 487 NZ LYS A 33 -15.086 0.617 2.886 1.00 0.00 N ATOM 0 H LYS A 33 -11.649 3.349 5.472 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.621 4.687 3.139 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.761 2.849 4.273 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -13.741 3.358 2.596 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.224 2.446 2.726 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -11.889 1.497 4.041 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.293 1.625 1.360 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -11.958 0.521 1.619 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.705 -0.854 2.240 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -13.333 -0.145 3.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.751 -0.167 3.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.150 1.288 3.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.328 1.104 1.999 1.00 0.00 H new ATOM 501 N ASP A 34 -13.305 6.479 2.859 1.00 0.00 N ATOM 502 CA ASP A 34 -14.203 7.622 2.742 1.00 0.00 C ATOM 503 C ASP A 34 -15.419 7.273 1.890 1.00 0.00 C ATOM 504 O ASP A 34 -15.563 6.141 1.428 1.00 0.00 O ATOM 505 CB ASP A 34 -13.466 8.817 2.135 1.00 0.00 C ATOM 506 CG ASP A 34 -14.127 10.138 2.474 1.00 0.00 C ATOM 507 OD1 ASP A 34 -14.745 10.233 3.555 1.00 0.00 O ATOM 508 OD2 ASP A 34 -14.026 11.078 1.658 1.00 0.00 O ATOM 0 H ASP A 34 -12.612 6.409 2.114 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.546 7.886 3.742 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.437 8.826 2.494 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.424 8.702 1.052 1.00 0.00 H new ATOM 513 N LYS A 35 -16.293 8.253 1.686 1.00 0.00 N ATOM 514 CA LYS A 35 -17.498 8.051 0.889 1.00 0.00 C ATOM 515 C LYS A 35 -17.229 7.099 -0.271 1.00 0.00 C ATOM 516 O LYS A 35 -18.112 6.350 -0.689 1.00 0.00 O ATOM 517 CB LYS A 35 -18.012 9.390 0.356 1.00 0.00 C ATOM 518 CG LYS A 35 -19.283 9.269 -0.466 1.00 0.00 C ATOM 519 CD LYS A 35 -19.922 10.627 -0.708 1.00 0.00 C ATOM 520 CE LYS A 35 -20.742 11.078 0.491 1.00 0.00 C ATOM 521 NZ LYS A 35 -20.964 12.551 0.488 1.00 0.00 N ATOM 0 H LYS A 35 -16.189 9.196 2.062 1.00 0.00 H new ATOM 0 HA LYS A 35 -18.259 7.607 1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.195 10.060 1.196 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.236 9.850 -0.256 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -19.056 8.797 -1.422 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -19.990 8.620 0.050 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.146 11.363 -0.917 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -20.561 10.578 -1.590 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -21.704 10.566 0.487 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.231 10.789 1.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.527 12.819 1.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -20.047 13.040 0.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.474 12.823 -0.377 1.00 0.00 H new ATOM 535 N ASN A 36 -16.005 7.132 -0.787 1.00 0.00 N ATOM 536 CA ASN A 36 -15.620 6.271 -1.900 1.00 0.00 C ATOM 537 C ASN A 36 -14.559 5.265 -1.467 1.00 0.00 C ATOM 538 O ASN A 36 -14.388 4.219 -2.092 1.00 0.00 O ATOM 539 CB ASN A 36 -15.096 7.112 -3.066 1.00 0.00 C ATOM 540 CG ASN A 36 -16.208 7.824 -3.811 1.00 0.00 C ATOM 541 OD1 ASN A 36 -17.355 7.377 -3.812 1.00 0.00 O ATOM 542 ND2 ASN A 36 -15.873 8.939 -4.450 1.00 0.00 N ATOM 0 H ASN A 36 -15.262 7.746 -0.452 1.00 0.00 H new ATOM 0 HA ASN A 36 -16.504 5.723 -2.225 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -14.386 7.848 -2.689 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -14.552 6.469 -3.758 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -16.579 9.461 -4.969 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -14.910 9.273 -4.422 1.00 0.00 H new ATOM 549 N GLY A 37 -13.849 5.588 -0.390 1.00 0.00 N ATOM 550 CA GLY A 37 -12.813 4.702 0.109 1.00 0.00 C ATOM 551 C GLY A 37 -11.420 5.258 -0.108 1.00 0.00 C ATOM 552 O GLY A 37 -11.256 6.437 -0.425 1.00 0.00 O ATOM 0 H GLY A 37 -13.973 6.447 0.146 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -12.970 4.528 1.174 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -12.896 3.735 -0.387 1.00 0.00 H new ATOM 556 N LEU A 38 -10.413 4.409 0.063 1.00 0.00 N ATOM 557 CA LEU A 38 -9.025 4.822 -0.115 1.00 0.00 C ATOM 558 C LEU A 38 -8.715 5.070 -1.587 1.00 0.00 C ATOM 559 O LEU A 38 -8.455 4.135 -2.344 1.00 0.00 O ATOM 560 CB LEU A 38 -8.080 3.758 0.445 1.00 0.00 C ATOM 561 CG LEU A 38 -8.516 3.091 1.750 1.00 0.00 C ATOM 562 CD1 LEU A 38 -7.549 1.982 2.133 1.00 0.00 C ATOM 563 CD2 LEU A 38 -8.619 4.121 2.866 1.00 0.00 C ATOM 0 H LEU A 38 -10.531 3.430 0.325 1.00 0.00 H new ATOM 0 HA LEU A 38 -8.876 5.754 0.430 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.950 2.983 -0.310 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -7.103 4.215 0.603 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.501 2.649 1.598 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.876 1.519 3.064 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.526 1.231 1.343 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.551 2.399 2.266 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -8.930 3.629 3.787 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.648 4.593 3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.353 4.880 2.594 1.00 0.00 H new ATOM 575 N GLY A 39 -8.743 6.338 -1.988 1.00 0.00 N ATOM 576 CA GLY A 39 -8.461 6.686 -3.368 1.00 0.00 C ATOM 577 C GLY A 39 -6.976 6.827 -3.639 1.00 0.00 C ATOM 578 O GLY A 39 -6.379 7.862 -3.341 1.00 0.00 O ATOM 0 H GLY A 39 -8.956 7.130 -1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.876 5.921 -4.024 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.962 7.622 -3.613 1.00 0.00 H new ATOM 582 N LEU A 40 -6.378 5.784 -4.203 1.00 0.00 N ATOM 583 CA LEU A 40 -4.953 5.794 -4.513 1.00 0.00 C ATOM 584 C LEU A 40 -4.694 5.226 -5.905 1.00 0.00 C ATOM 585 O LEU A 40 -5.277 4.213 -6.291 1.00 0.00 O ATOM 586 CB LEU A 40 -4.178 4.989 -3.469 1.00 0.00 C ATOM 587 CG LEU A 40 -4.328 5.451 -2.019 1.00 0.00 C ATOM 588 CD1 LEU A 40 -4.130 4.284 -1.064 1.00 0.00 C ATOM 589 CD2 LEU A 40 -3.341 6.568 -1.710 1.00 0.00 C ATOM 0 H LEU A 40 -6.858 4.920 -4.455 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.610 6.828 -4.493 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.496 3.948 -3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.120 5.016 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.338 5.838 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.240 4.632 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.875 3.516 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.132 3.867 -1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.462 6.884 -0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.324 6.207 -1.863 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.529 7.413 -2.372 1.00 0.00 H new ATOM 601 N SER A 41 -3.814 5.884 -6.653 1.00 0.00 N ATOM 602 CA SER A 41 -3.478 5.446 -8.002 1.00 0.00 C ATOM 603 C SER A 41 -2.410 4.357 -7.970 1.00 0.00 C ATOM 604 O SER A 41 -1.222 4.640 -7.808 1.00 0.00 O ATOM 605 CB SER A 41 -2.990 6.630 -8.839 1.00 0.00 C ATOM 606 OG SER A 41 -3.982 7.638 -8.923 1.00 0.00 O ATOM 0 H SER A 41 -3.321 6.723 -6.347 1.00 0.00 H new ATOM 0 HA SER A 41 -4.378 5.034 -8.458 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.084 7.043 -8.396 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.729 6.288 -9.840 1.00 0.00 H new ATOM 0 HG SER A 41 -3.645 8.384 -9.461 1.00 0.00 H new ATOM 612 N LEU A 42 -2.841 3.110 -8.125 1.00 0.00 N ATOM 613 CA LEU A 42 -1.923 1.976 -8.114 1.00 0.00 C ATOM 614 C LEU A 42 -1.478 1.622 -9.529 1.00 0.00 C ATOM 615 O LEU A 42 -2.257 1.718 -10.477 1.00 0.00 O ATOM 616 CB LEU A 42 -2.586 0.764 -7.457 1.00 0.00 C ATOM 617 CG LEU A 42 -3.366 1.041 -6.171 1.00 0.00 C ATOM 618 CD1 LEU A 42 -4.179 -0.179 -5.767 1.00 0.00 C ATOM 619 CD2 LEU A 42 -2.421 1.450 -5.051 1.00 0.00 C ATOM 0 H LEU A 42 -3.820 2.858 -8.260 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.043 2.258 -7.536 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.265 0.310 -8.179 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.814 0.027 -7.238 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.054 1.866 -6.357 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.727 0.037 -4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.883 -0.426 -6.561 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.510 -1.023 -5.600 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.994 1.643 -4.144 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.707 0.647 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.884 2.353 -5.340 1.00 0.00 H new ATOM 631 N ALA A 43 -0.222 1.210 -9.663 1.00 0.00 N ATOM 632 CA ALA A 43 0.325 0.837 -10.962 1.00 0.00 C ATOM 633 C ALA A 43 1.364 -0.271 -10.822 1.00 0.00 C ATOM 634 O ALA A 43 2.345 -0.127 -10.095 1.00 0.00 O ATOM 635 CB ALA A 43 0.935 2.051 -11.646 1.00 0.00 C ATOM 0 H ALA A 43 0.436 1.126 -8.888 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.491 0.459 -11.577 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.340 1.758 -12.615 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.168 2.812 -11.788 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.735 2.454 -11.026 1.00 0.00 H new ATOM 641 N GLY A 44 1.140 -1.378 -11.524 1.00 0.00 N ATOM 642 CA GLY A 44 2.065 -2.495 -11.463 1.00 0.00 C ATOM 643 C GLY A 44 3.488 -2.087 -11.787 1.00 0.00 C ATOM 644 O GLY A 44 3.715 -1.090 -12.471 1.00 0.00 O ATOM 0 H GLY A 44 0.335 -1.521 -12.134 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.034 -2.934 -10.466 1.00 0.00 H new ATOM 0 HA3 GLY A 44 1.744 -3.267 -12.162 1.00 0.00 H new ATOM 648 N ASN A 45 4.450 -2.859 -11.292 1.00 0.00 N ATOM 649 CA ASN A 45 5.860 -2.571 -11.530 1.00 0.00 C ATOM 650 C ASN A 45 6.138 -2.414 -13.022 1.00 0.00 C ATOM 651 O ASN A 45 5.616 -3.166 -13.845 1.00 0.00 O ATOM 652 CB ASN A 45 6.734 -3.685 -10.951 1.00 0.00 C ATOM 653 CG ASN A 45 8.195 -3.529 -11.329 1.00 0.00 C ATOM 654 OD1 ASN A 45 8.710 -4.260 -12.175 1.00 0.00 O ATOM 655 ND2 ASN A 45 8.869 -2.573 -10.702 1.00 0.00 N ATOM 0 H ASN A 45 4.279 -3.689 -10.724 1.00 0.00 H new ATOM 0 HA ASN A 45 6.103 -1.632 -11.032 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.641 -3.689 -9.865 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.371 -4.650 -11.306 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.855 -2.421 -10.915 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.401 -1.991 -10.008 1.00 0.00 H new ATOM 662 N LYS A 46 6.965 -1.431 -13.363 1.00 0.00 N ATOM 663 CA LYS A 46 7.316 -1.175 -14.755 1.00 0.00 C ATOM 664 C LYS A 46 7.685 -2.470 -15.471 1.00 0.00 C ATOM 665 O LYS A 46 7.398 -2.640 -16.656 1.00 0.00 O ATOM 666 CB LYS A 46 8.481 -0.186 -14.835 1.00 0.00 C ATOM 667 CG LYS A 46 8.146 1.194 -14.296 1.00 0.00 C ATOM 668 CD LYS A 46 9.384 1.907 -13.779 1.00 0.00 C ATOM 669 CE LYS A 46 10.055 2.721 -14.874 1.00 0.00 C ATOM 670 NZ LYS A 46 9.165 3.798 -15.390 1.00 0.00 N ATOM 0 H LYS A 46 7.405 -0.799 -12.694 1.00 0.00 H new ATOM 0 HA LYS A 46 6.446 -0.743 -15.249 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.327 -0.589 -14.278 1.00 0.00 H new ATOM 0 HB3 LYS A 46 8.798 -0.094 -15.874 1.00 0.00 H new ATOM 0 HG2 LYS A 46 7.684 1.790 -15.083 1.00 0.00 H new ATOM 0 HG3 LYS A 46 7.415 1.104 -13.493 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.109 2.563 -12.953 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.089 1.175 -13.384 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.973 3.163 -14.487 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.340 2.062 -15.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 9.742 4.600 -15.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 8.603 3.433 -16.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.527 4.114 -14.632 1.00 0.00 H new ATOM 684 N ASP A 47 8.321 -3.382 -14.743 1.00 0.00 N ATOM 685 CA ASP A 47 8.727 -4.664 -15.308 1.00 0.00 C ATOM 686 C ASP A 47 7.678 -5.736 -15.032 1.00 0.00 C ATOM 687 O ASP A 47 7.471 -6.135 -13.886 1.00 0.00 O ATOM 688 CB ASP A 47 10.078 -5.094 -14.733 1.00 0.00 C ATOM 689 CG ASP A 47 10.863 -5.968 -15.691 1.00 0.00 C ATOM 690 OD1 ASP A 47 10.302 -6.976 -16.170 1.00 0.00 O ATOM 691 OD2 ASP A 47 12.039 -5.646 -15.961 1.00 0.00 O ATOM 0 H ASP A 47 8.566 -3.257 -13.761 1.00 0.00 H new ATOM 0 HA ASP A 47 8.822 -4.544 -16.387 1.00 0.00 H new ATOM 0 HB2 ASP A 47 10.665 -4.208 -14.490 1.00 0.00 H new ATOM 0 HB3 ASP A 47 9.917 -5.635 -13.801 1.00 0.00 H new ATOM 696 N ARG A 48 7.019 -6.197 -16.089 1.00 0.00 N ATOM 697 CA ARG A 48 5.989 -7.222 -15.960 1.00 0.00 C ATOM 698 C ARG A 48 6.484 -8.386 -15.108 1.00 0.00 C ATOM 699 O ARG A 48 5.924 -8.677 -14.051 1.00 0.00 O ATOM 700 CB ARG A 48 5.569 -7.729 -17.341 1.00 0.00 C ATOM 701 CG ARG A 48 4.189 -8.367 -17.362 1.00 0.00 C ATOM 702 CD ARG A 48 3.784 -8.773 -18.770 1.00 0.00 C ATOM 703 NE ARG A 48 2.728 -9.782 -18.766 1.00 0.00 N ATOM 704 CZ ARG A 48 1.903 -9.985 -19.787 1.00 0.00 C ATOM 705 NH1 ARG A 48 2.012 -9.255 -20.888 1.00 0.00 N ATOM 706 NH2 ARG A 48 0.966 -10.922 -19.708 1.00 0.00 N ATOM 0 H ARG A 48 7.179 -5.878 -17.044 1.00 0.00 H new ATOM 0 HA ARG A 48 5.126 -6.775 -15.467 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.586 -6.897 -18.045 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.302 -8.457 -17.690 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.182 -9.243 -16.713 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.457 -7.667 -16.959 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.443 -7.894 -19.317 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.654 -9.161 -19.300 1.00 0.00 H new ATOM 0 HE ARG A 48 2.618 -10.362 -17.934 1.00 0.00 H new ATOM 0 HH11 ARG A 48 2.731 -8.535 -20.953 1.00 0.00 H new ATOM 0 HH12 ARG A 48 1.377 -9.414 -21.670 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.879 -11.487 -18.863 1.00 0.00 H new ATOM 0 HH22 ARG A 48 0.333 -11.077 -20.492 1.00 0.00 H new ATOM 720 N SER A 49 7.538 -9.049 -15.575 1.00 0.00 N ATOM 721 CA SER A 49 8.106 -10.184 -14.857 1.00 0.00 C ATOM 722 C SER A 49 8.046 -9.959 -13.350 1.00 0.00 C ATOM 723 O SER A 49 7.878 -10.902 -12.577 1.00 0.00 O ATOM 724 CB SER A 49 9.554 -10.416 -15.293 1.00 0.00 C ATOM 725 OG SER A 49 9.622 -10.800 -16.655 1.00 0.00 O ATOM 0 H SER A 49 8.015 -8.820 -16.447 1.00 0.00 H new ATOM 0 HA SER A 49 7.515 -11.068 -15.098 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.133 -9.506 -15.139 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.005 -11.189 -14.671 1.00 0.00 H new ATOM 0 HG SER A 49 10.558 -10.940 -16.909 1.00 0.00 H new ATOM 731 N ARG A 50 8.185 -8.703 -12.939 1.00 0.00 N ATOM 732 CA ARG A 50 8.148 -8.353 -11.524 1.00 0.00 C ATOM 733 C ARG A 50 6.744 -7.925 -11.107 1.00 0.00 C ATOM 734 O ARG A 50 6.052 -7.227 -11.847 1.00 0.00 O ATOM 735 CB ARG A 50 9.144 -7.230 -11.228 1.00 0.00 C ATOM 736 CG ARG A 50 10.526 -7.729 -10.838 1.00 0.00 C ATOM 737 CD ARG A 50 11.232 -6.748 -9.915 1.00 0.00 C ATOM 738 NE ARG A 50 12.264 -7.398 -9.111 1.00 0.00 N ATOM 739 CZ ARG A 50 13.405 -7.858 -9.613 1.00 0.00 C ATOM 740 NH1 ARG A 50 13.659 -7.739 -10.909 1.00 0.00 N ATOM 741 NH2 ARG A 50 14.295 -8.438 -8.817 1.00 0.00 N ATOM 0 H ARG A 50 8.324 -7.911 -13.566 1.00 0.00 H new ATOM 0 HA ARG A 50 8.426 -9.237 -10.949 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.232 -6.593 -12.108 1.00 0.00 H new ATOM 0 HB3 ARG A 50 8.750 -6.610 -10.423 1.00 0.00 H new ATOM 0 HG2 ARG A 50 10.439 -8.697 -10.344 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.126 -7.882 -11.735 1.00 0.00 H new ATOM 0 HD2 ARG A 50 11.682 -5.952 -10.508 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.501 -6.280 -9.256 1.00 0.00 H new ATOM 0 HE ARG A 50 12.100 -7.505 -8.110 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.978 -7.293 -11.523 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.536 -8.093 -11.291 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.103 -8.531 -7.820 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.171 -8.791 -9.203 1.00 0.00 H new ATOM 755 N MET A 51 6.332 -8.349 -9.916 1.00 0.00 N ATOM 756 CA MET A 51 5.011 -8.008 -9.400 1.00 0.00 C ATOM 757 C MET A 51 5.122 -7.135 -8.155 1.00 0.00 C ATOM 758 O MET A 51 5.865 -7.454 -7.226 1.00 0.00 O ATOM 759 CB MET A 51 4.223 -9.279 -9.078 1.00 0.00 C ATOM 760 CG MET A 51 3.373 -9.778 -10.236 1.00 0.00 C ATOM 761 SD MET A 51 1.788 -8.926 -10.351 1.00 0.00 S ATOM 762 CE MET A 51 2.083 -7.851 -11.753 1.00 0.00 C ATOM 0 H MET A 51 6.893 -8.928 -9.291 1.00 0.00 H new ATOM 0 HA MET A 51 4.482 -7.446 -10.169 1.00 0.00 H new ATOM 0 HB2 MET A 51 4.920 -10.064 -8.785 1.00 0.00 H new ATOM 0 HB3 MET A 51 3.578 -9.089 -8.220 1.00 0.00 H new ATOM 0 HG2 MET A 51 3.922 -9.644 -11.168 1.00 0.00 H new ATOM 0 HG3 MET A 51 3.199 -10.848 -10.119 1.00 0.00 H new ATOM 0 HE1 MET A 51 1.132 -7.587 -12.215 1.00 0.00 H new ATOM 0 HE2 MET A 51 2.588 -6.945 -11.417 1.00 0.00 H new ATOM 0 HE3 MET A 51 2.709 -8.366 -12.481 1.00 0.00 H new ATOM 772 N SER A 52 4.380 -6.033 -8.141 1.00 0.00 N ATOM 773 CA SER A 52 4.399 -5.112 -7.011 1.00 0.00 C ATOM 774 C SER A 52 3.381 -3.992 -7.205 1.00 0.00 C ATOM 775 O SER A 52 3.060 -3.619 -8.334 1.00 0.00 O ATOM 776 CB SER A 52 5.798 -4.519 -6.832 1.00 0.00 C ATOM 777 OG SER A 52 6.592 -5.331 -5.985 1.00 0.00 O ATOM 0 H SER A 52 3.758 -5.756 -8.900 1.00 0.00 H new ATOM 0 HA SER A 52 4.132 -5.671 -6.114 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.281 -4.420 -7.804 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.720 -3.516 -6.411 1.00 0.00 H new ATOM 0 HG SER A 52 6.679 -6.225 -6.377 1.00 0.00 H new ATOM 783 N ILE A 53 2.876 -3.461 -6.097 1.00 0.00 N ATOM 784 CA ILE A 53 1.895 -2.384 -6.144 1.00 0.00 C ATOM 785 C ILE A 53 2.453 -1.105 -5.529 1.00 0.00 C ATOM 786 O ILE A 53 2.877 -1.093 -4.373 1.00 0.00 O ATOM 787 CB ILE A 53 0.598 -2.771 -5.409 1.00 0.00 C ATOM 788 CG1 ILE A 53 0.134 -4.162 -5.846 1.00 0.00 C ATOM 789 CG2 ILE A 53 -0.487 -1.738 -5.671 1.00 0.00 C ATOM 790 CD1 ILE A 53 -0.807 -4.821 -4.862 1.00 0.00 C ATOM 0 H ILE A 53 3.130 -3.759 -5.155 1.00 0.00 H new ATOM 0 HA ILE A 53 1.668 -2.209 -7.196 1.00 0.00 H new ATOM 0 HB ILE A 53 0.798 -2.796 -4.338 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.361 -4.084 -6.814 1.00 0.00 H new ATOM 0 HG13 ILE A 53 1.007 -4.800 -5.985 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.397 -2.025 -5.145 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -0.155 -0.763 -5.315 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.688 -1.685 -6.741 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.095 -5.803 -5.236 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.308 -4.931 -3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.697 -4.204 -4.741 1.00 0.00 H new ATOM 802 N PHE A 54 2.449 -0.029 -6.308 1.00 0.00 N ATOM 803 CA PHE A 54 2.953 1.256 -5.840 1.00 0.00 C ATOM 804 C PHE A 54 1.854 2.314 -5.864 1.00 0.00 C ATOM 805 O PHE A 54 0.723 2.041 -6.266 1.00 0.00 O ATOM 806 CB PHE A 54 4.133 1.710 -6.703 1.00 0.00 C ATOM 807 CG PHE A 54 5.287 0.749 -6.694 1.00 0.00 C ATOM 808 CD1 PHE A 54 6.131 0.669 -5.598 1.00 0.00 C ATOM 809 CD2 PHE A 54 5.528 -0.074 -7.782 1.00 0.00 C ATOM 810 CE1 PHE A 54 7.193 -0.215 -5.586 1.00 0.00 C ATOM 811 CE2 PHE A 54 6.589 -0.960 -7.776 1.00 0.00 C ATOM 812 CZ PHE A 54 7.423 -1.030 -6.677 1.00 0.00 C ATOM 0 H PHE A 54 2.102 -0.022 -7.267 1.00 0.00 H new ATOM 0 HA PHE A 54 3.290 1.132 -4.811 1.00 0.00 H new ATOM 0 HB2 PHE A 54 3.791 1.845 -7.729 1.00 0.00 H new ATOM 0 HB3 PHE A 54 4.477 2.682 -6.351 1.00 0.00 H new ATOM 0 HD1 PHE A 54 5.957 1.305 -4.743 1.00 0.00 H new ATOM 0 HD2 PHE A 54 4.880 -0.023 -8.644 1.00 0.00 H new ATOM 0 HE1 PHE A 54 7.842 -0.269 -4.725 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.766 -1.597 -8.630 1.00 0.00 H new ATOM 0 HZ PHE A 54 8.253 -1.721 -6.671 1.00 0.00 H new ATOM 822 N VAL A 55 2.195 3.524 -5.431 1.00 0.00 N ATOM 823 CA VAL A 55 1.238 4.623 -5.403 1.00 0.00 C ATOM 824 C VAL A 55 1.706 5.781 -6.277 1.00 0.00 C ATOM 825 O VAL A 55 2.492 6.624 -5.843 1.00 0.00 O ATOM 826 CB VAL A 55 1.014 5.136 -3.968 1.00 0.00 C ATOM 827 CG1 VAL A 55 0.103 6.354 -3.972 1.00 0.00 C ATOM 828 CG2 VAL A 55 0.439 4.033 -3.093 1.00 0.00 C ATOM 0 H VAL A 55 3.127 3.767 -5.095 1.00 0.00 H new ATOM 0 HA VAL A 55 0.297 4.234 -5.793 1.00 0.00 H new ATOM 0 HB VAL A 55 1.977 5.434 -3.553 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.044 6.702 -2.950 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.559 7.148 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.860 6.086 -4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.287 4.412 -2.082 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.515 3.703 -3.504 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.132 3.192 -3.064 1.00 0.00 H new ATOM 838 N VAL A 56 1.218 5.818 -7.513 1.00 0.00 N ATOM 839 CA VAL A 56 1.585 6.874 -8.449 1.00 0.00 C ATOM 840 C VAL A 56 0.577 8.017 -8.411 1.00 0.00 C ATOM 841 O VAL A 56 0.481 8.806 -9.350 1.00 0.00 O ATOM 842 CB VAL A 56 1.682 6.338 -9.890 1.00 0.00 C ATOM 843 CG1 VAL A 56 2.640 5.158 -9.958 1.00 0.00 C ATOM 844 CG2 VAL A 56 0.305 5.948 -10.406 1.00 0.00 C ATOM 0 H VAL A 56 0.567 5.129 -7.889 1.00 0.00 H new ATOM 0 HA VAL A 56 2.562 7.245 -8.140 1.00 0.00 H new ATOM 0 HB VAL A 56 2.074 7.130 -10.528 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.695 4.793 -10.984 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.631 5.474 -9.631 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.281 4.360 -9.308 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.392 5.571 -11.425 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.117 5.172 -9.767 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.348 6.821 -10.396 1.00 0.00 H new ATOM 854 N GLY A 57 -0.173 8.101 -7.316 1.00 0.00 N ATOM 855 CA GLY A 57 -1.164 9.151 -7.175 1.00 0.00 C ATOM 856 C GLY A 57 -2.010 8.986 -5.928 1.00 0.00 C ATOM 857 O GLY A 57 -2.227 7.868 -5.460 1.00 0.00 O ATOM 0 H GLY A 57 -0.112 7.461 -6.525 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.662 10.118 -7.145 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.812 9.155 -8.052 1.00 0.00 H new ATOM 861 N ILE A 58 -2.487 10.102 -5.386 1.00 0.00 N ATOM 862 CA ILE A 58 -3.312 10.076 -4.185 1.00 0.00 C ATOM 863 C ILE A 58 -4.523 10.992 -4.330 1.00 0.00 C ATOM 864 O ILE A 58 -4.427 12.201 -4.123 1.00 0.00 O ATOM 865 CB ILE A 58 -2.509 10.498 -2.941 1.00 0.00 C ATOM 866 CG1 ILE A 58 -1.319 9.560 -2.733 1.00 0.00 C ATOM 867 CG2 ILE A 58 -3.405 10.508 -1.711 1.00 0.00 C ATOM 868 CD1 ILE A 58 -0.358 10.031 -1.664 1.00 0.00 C ATOM 0 H ILE A 58 -2.316 11.035 -5.760 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.650 9.048 -4.057 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.128 11.507 -3.097 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.689 8.570 -2.467 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.780 9.456 -3.675 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.823 10.808 -0.840 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.222 11.213 -1.862 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.812 9.510 -1.549 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.461 9.318 -1.571 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.041 11.008 -1.938 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.882 10.108 -0.712 1.00 0.00 H new ATOM 880 N ASN A 59 -5.662 10.407 -4.686 1.00 0.00 N ATOM 881 CA ASN A 59 -6.892 11.171 -4.857 1.00 0.00 C ATOM 882 C ASN A 59 -7.074 12.172 -3.720 1.00 0.00 C ATOM 883 O ASN A 59 -7.120 11.811 -2.544 1.00 0.00 O ATOM 884 CB ASN A 59 -8.097 10.229 -4.921 1.00 0.00 C ATOM 885 CG ASN A 59 -9.223 10.787 -5.769 1.00 0.00 C ATOM 886 OD1 ASN A 59 -9.925 11.711 -5.359 1.00 0.00 O ATOM 887 ND2 ASN A 59 -9.400 10.227 -6.960 1.00 0.00 N ATOM 0 H ASN A 59 -5.759 9.407 -4.862 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.820 11.723 -5.794 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.782 9.268 -5.327 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.464 10.044 -3.911 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.142 10.561 -7.575 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.794 9.463 -7.259 1.00 0.00 H new ATOM 894 N PRO A 60 -7.182 13.460 -4.078 1.00 0.00 N ATOM 895 CA PRO A 60 -7.362 14.540 -3.103 1.00 0.00 C ATOM 896 C PRO A 60 -8.738 14.505 -2.447 1.00 0.00 C ATOM 897 O PRO A 60 -8.970 15.167 -1.436 1.00 0.00 O ATOM 898 CB PRO A 60 -7.202 15.808 -3.944 1.00 0.00 C ATOM 899 CG PRO A 60 -7.573 15.395 -5.327 1.00 0.00 C ATOM 900 CD PRO A 60 -7.136 13.962 -5.461 1.00 0.00 C ATOM 0 HA PRO A 60 -6.653 14.467 -2.279 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -7.849 16.607 -3.582 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -6.179 16.183 -3.904 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.646 15.493 -5.489 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.080 16.024 -6.068 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.801 13.399 -6.115 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -6.134 13.885 -5.883 1.00 0.00 H new ATOM 908 N GLU A 61 -9.647 13.729 -3.030 1.00 0.00 N ATOM 909 CA GLU A 61 -11.001 13.610 -2.501 1.00 0.00 C ATOM 910 C GLU A 61 -11.102 12.443 -1.523 1.00 0.00 C ATOM 911 O GLU A 61 -11.988 12.408 -0.670 1.00 0.00 O ATOM 912 CB GLU A 61 -12.003 13.422 -3.641 1.00 0.00 C ATOM 913 CG GLU A 61 -12.026 14.577 -4.628 1.00 0.00 C ATOM 914 CD GLU A 61 -13.212 14.515 -5.571 1.00 0.00 C ATOM 915 OE1 GLU A 61 -13.112 13.827 -6.608 1.00 0.00 O ATOM 916 OE2 GLU A 61 -14.241 15.156 -5.271 1.00 0.00 O ATOM 0 H GLU A 61 -9.471 13.174 -3.868 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.237 14.531 -1.967 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.764 12.503 -4.176 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.000 13.295 -3.220 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.052 15.518 -4.079 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -11.104 14.572 -5.209 1.00 0.00 H new ATOM 923 N GLY A 62 -10.186 11.488 -1.653 1.00 0.00 N ATOM 924 CA GLY A 62 -10.189 10.332 -0.776 1.00 0.00 C ATOM 925 C GLY A 62 -9.602 10.638 0.588 1.00 0.00 C ATOM 926 O GLY A 62 -9.207 11.767 0.879 1.00 0.00 O ATOM 0 H GLY A 62 -9.442 11.495 -2.350 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.211 9.973 -0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.621 9.526 -1.240 1.00 0.00 H new ATOM 930 N PRO A 63 -9.542 9.615 1.454 1.00 0.00 N ATOM 931 CA PRO A 63 -9.002 9.756 2.809 1.00 0.00 C ATOM 932 C PRO A 63 -7.493 9.975 2.812 1.00 0.00 C ATOM 933 O PRO A 63 -6.993 10.902 3.449 1.00 0.00 O ATOM 934 CB PRO A 63 -9.349 8.419 3.470 1.00 0.00 C ATOM 935 CG PRO A 63 -9.460 7.455 2.339 1.00 0.00 C ATOM 936 CD PRO A 63 -9.996 8.242 1.175 1.00 0.00 C ATOM 0 HA PRO A 63 -9.416 10.623 3.324 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.576 8.114 4.176 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.283 8.484 4.028 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -8.490 7.019 2.101 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -10.127 6.631 2.593 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -9.604 7.874 0.227 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.083 8.182 1.116 1.00 0.00 H new ATOM 944 N ALA A 64 -6.774 9.117 2.097 1.00 0.00 N ATOM 945 CA ALA A 64 -5.322 9.219 2.016 1.00 0.00 C ATOM 946 C ALA A 64 -4.877 10.676 1.949 1.00 0.00 C ATOM 947 O ALA A 64 -3.932 11.079 2.627 1.00 0.00 O ATOM 948 CB ALA A 64 -4.805 8.452 0.808 1.00 0.00 C ATOM 0 H ALA A 64 -7.173 8.343 1.565 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.901 8.778 2.920 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.719 8.537 0.760 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.083 7.402 0.897 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.242 8.867 -0.101 1.00 0.00 H new ATOM 954 N ALA A 65 -5.564 11.463 1.127 1.00 0.00 N ATOM 955 CA ALA A 65 -5.240 12.876 0.973 1.00 0.00 C ATOM 956 C ALA A 65 -5.577 13.657 2.238 1.00 0.00 C ATOM 957 O ALA A 65 -4.863 14.587 2.613 1.00 0.00 O ATOM 958 CB ALA A 65 -5.978 13.459 -0.223 1.00 0.00 C ATOM 0 H ALA A 65 -6.348 11.146 0.558 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.167 12.961 0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.727 14.515 -0.326 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -5.684 12.926 -1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.053 13.355 -0.074 1.00 0.00 H new ATOM 964 N ALA A 66 -6.669 13.274 2.891 1.00 0.00 N ATOM 965 CA ALA A 66 -7.099 13.938 4.115 1.00 0.00 C ATOM 966 C ALA A 66 -6.084 13.738 5.235 1.00 0.00 C ATOM 967 O ALA A 66 -5.642 14.699 5.865 1.00 0.00 O ATOM 968 CB ALA A 66 -8.466 13.425 4.542 1.00 0.00 C ATOM 0 H ALA A 66 -7.272 12.507 2.593 1.00 0.00 H new ATOM 0 HA ALA A 66 -7.171 15.007 3.912 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.774 13.930 5.458 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.192 13.626 3.755 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.412 12.351 4.720 1.00 0.00 H new ATOM 974 N ASP A 67 -5.719 12.484 5.478 1.00 0.00 N ATOM 975 CA ASP A 67 -4.755 12.157 6.523 1.00 0.00 C ATOM 976 C ASP A 67 -3.420 12.851 6.267 1.00 0.00 C ATOM 977 O ASP A 67 -2.714 13.224 7.202 1.00 0.00 O ATOM 978 CB ASP A 67 -4.550 10.643 6.601 1.00 0.00 C ATOM 979 CG ASP A 67 -4.198 10.179 8.001 1.00 0.00 C ATOM 980 OD1 ASP A 67 -3.528 10.942 8.728 1.00 0.00 O ATOM 981 OD2 ASP A 67 -4.591 9.052 8.369 1.00 0.00 O ATOM 0 H ASP A 67 -6.076 11.677 4.966 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.152 12.512 7.474 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.458 10.139 6.272 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.756 10.351 5.914 1.00 0.00 H new ATOM 986 N GLY A 68 -3.081 13.019 4.992 1.00 0.00 N ATOM 987 CA GLY A 68 -1.832 13.667 4.637 1.00 0.00 C ATOM 988 C GLY A 68 -0.621 12.896 5.122 1.00 0.00 C ATOM 989 O GLY A 68 0.301 13.474 5.700 1.00 0.00 O ATOM 0 H GLY A 68 -3.649 12.718 4.200 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.779 13.778 3.554 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.814 14.671 5.061 1.00 0.00 H new ATOM 993 N ARG A 69 -0.622 11.587 4.890 1.00 0.00 N ATOM 994 CA ARG A 69 0.485 10.736 5.311 1.00 0.00 C ATOM 995 C ARG A 69 1.088 9.999 4.118 1.00 0.00 C ATOM 996 O ARG A 69 2.300 10.021 3.911 1.00 0.00 O ATOM 997 CB ARG A 69 0.010 9.728 6.359 1.00 0.00 C ATOM 998 CG ARG A 69 -0.404 10.368 7.675 1.00 0.00 C ATOM 999 CD ARG A 69 0.772 10.485 8.632 1.00 0.00 C ATOM 1000 NE ARG A 69 1.659 11.589 8.276 1.00 0.00 N ATOM 1001 CZ ARG A 69 2.895 11.719 8.745 1.00 0.00 C ATOM 1002 NH1 ARG A 69 3.388 10.818 9.584 1.00 0.00 N ATOM 1003 NH2 ARG A 69 3.641 12.752 8.375 1.00 0.00 N ATOM 0 H ARG A 69 -1.376 11.093 4.413 1.00 0.00 H new ATOM 0 HA ARG A 69 1.254 11.372 5.750 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.833 9.168 5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.808 9.010 6.549 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.819 11.358 7.485 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -1.193 9.775 8.137 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.401 10.631 9.646 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.335 9.552 8.630 1.00 0.00 H new ATOM 0 HE ARG A 69 1.310 12.299 7.632 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.818 10.022 9.871 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.337 10.921 9.942 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.266 13.447 7.730 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.590 12.851 8.736 1.00 0.00 H new ATOM 1017 N MET A 70 0.232 9.347 3.338 1.00 0.00 N ATOM 1018 CA MET A 70 0.681 8.604 2.166 1.00 0.00 C ATOM 1019 C MET A 70 1.278 9.544 1.123 1.00 0.00 C ATOM 1020 O MET A 70 0.835 10.683 0.974 1.00 0.00 O ATOM 1021 CB MET A 70 -0.483 7.820 1.556 1.00 0.00 C ATOM 1022 CG MET A 70 -0.633 6.417 2.123 1.00 0.00 C ATOM 1023 SD MET A 70 -1.327 5.257 0.930 1.00 0.00 S ATOM 1024 CE MET A 70 0.165 4.528 0.259 1.00 0.00 C ATOM 0 H MET A 70 -0.775 9.318 3.496 1.00 0.00 H new ATOM 0 HA MET A 70 1.454 7.904 2.484 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.409 8.371 1.722 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.341 7.754 0.477 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.342 6.056 2.451 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.273 6.452 3.005 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.029 3.492 -0.018 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.478 5.087 -0.623 1.00 0.00 H new ATOM 0 HE3 MET A 70 0.955 4.562 1.009 1.00 0.00 H new ATOM 1034 N ARG A 71 2.285 9.059 0.403 1.00 0.00 N ATOM 1035 CA ARG A 71 2.943 9.856 -0.625 1.00 0.00 C ATOM 1036 C ARG A 71 3.050 9.076 -1.932 1.00 0.00 C ATOM 1037 O ARG A 71 2.658 7.911 -2.005 1.00 0.00 O ATOM 1038 CB ARG A 71 4.336 10.281 -0.156 1.00 0.00 C ATOM 1039 CG ARG A 71 4.315 11.238 1.024 1.00 0.00 C ATOM 1040 CD ARG A 71 4.274 12.688 0.566 1.00 0.00 C ATOM 1041 NE ARG A 71 3.598 13.548 1.532 1.00 0.00 N ATOM 1042 CZ ARG A 71 2.280 13.712 1.574 1.00 0.00 C ATOM 1043 NH1 ARG A 71 1.502 13.077 0.708 1.00 0.00 N ATOM 1044 NH2 ARG A 71 1.738 14.513 2.483 1.00 0.00 N ATOM 0 H ARG A 71 2.663 8.118 0.513 1.00 0.00 H new ATOM 0 HA ARG A 71 2.339 10.746 -0.802 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.905 9.392 0.118 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.862 10.753 -0.986 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.447 11.028 1.648 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.198 11.075 1.641 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.291 13.048 0.410 1.00 0.00 H new ATOM 0 HD3 ARG A 71 3.763 12.750 -0.395 1.00 0.00 H new ATOM 0 HE ARG A 71 4.168 14.051 2.212 1.00 0.00 H new ATOM 0 HH11 ARG A 71 1.915 12.461 0.008 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.491 13.204 0.742 1.00 0.00 H new ATOM 0 HH21 ARG A 71 2.333 15.004 3.150 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.726 14.638 2.514 1.00 0.00 H new ATOM 1058 N ILE A 72 3.582 9.727 -2.961 1.00 0.00 N ATOM 1059 CA ILE A 72 3.740 9.094 -4.265 1.00 0.00 C ATOM 1060 C ILE A 72 5.004 8.242 -4.312 1.00 0.00 C ATOM 1061 O ILE A 72 6.112 8.746 -4.130 1.00 0.00 O ATOM 1062 CB ILE A 72 3.797 10.140 -5.394 1.00 0.00 C ATOM 1063 CG1 ILE A 72 2.662 11.154 -5.237 1.00 0.00 C ATOM 1064 CG2 ILE A 72 3.720 9.457 -6.752 1.00 0.00 C ATOM 1065 CD1 ILE A 72 1.310 10.517 -5.004 1.00 0.00 C ATOM 0 H ILE A 72 3.911 10.692 -2.917 1.00 0.00 H new ATOM 0 HA ILE A 72 2.869 8.456 -4.415 1.00 0.00 H new ATOM 0 HB ILE A 72 4.746 10.672 -5.329 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.891 11.817 -4.403 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.613 11.774 -6.132 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.761 10.209 -7.540 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.559 8.770 -6.862 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.785 8.903 -6.828 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.554 11.295 -4.902 1.00 0.00 H new ATOM 0 HD12 ILE A 72 1.059 9.876 -5.849 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.341 9.920 -4.093 1.00 0.00 H new ATOM 1077 N GLY A 73 4.830 6.948 -4.560 1.00 0.00 N ATOM 1078 CA GLY A 73 5.965 6.046 -4.629 1.00 0.00 C ATOM 1079 C GLY A 73 5.849 4.892 -3.653 1.00 0.00 C ATOM 1080 O GLY A 73 6.503 3.862 -3.819 1.00 0.00 O ATOM 0 H GLY A 73 3.923 6.508 -4.714 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.052 5.653 -5.642 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.880 6.602 -4.423 1.00 0.00 H new ATOM 1084 N ASP A 74 5.015 5.063 -2.634 1.00 0.00 N ATOM 1085 CA ASP A 74 4.815 4.027 -1.627 1.00 0.00 C ATOM 1086 C ASP A 74 4.487 2.689 -2.282 1.00 0.00 C ATOM 1087 O ASP A 74 3.814 2.640 -3.311 1.00 0.00 O ATOM 1088 CB ASP A 74 3.693 4.427 -0.667 1.00 0.00 C ATOM 1089 CG ASP A 74 3.993 5.720 0.066 1.00 0.00 C ATOM 1090 OD1 ASP A 74 5.187 6.048 0.228 1.00 0.00 O ATOM 1091 OD2 ASP A 74 3.033 6.405 0.476 1.00 0.00 O ATOM 0 H ASP A 74 4.466 5.909 -2.483 1.00 0.00 H new ATOM 0 HA ASP A 74 5.742 3.919 -1.064 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.763 4.536 -1.225 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.538 3.629 0.059 1.00 0.00 H new ATOM 1096 N GLU A 75 4.969 1.606 -1.679 1.00 0.00 N ATOM 1097 CA GLU A 75 4.728 0.268 -2.206 1.00 0.00 C ATOM 1098 C GLU A 75 3.921 -0.568 -1.218 1.00 0.00 C ATOM 1099 O GLU A 75 4.444 -1.026 -0.201 1.00 0.00 O ATOM 1100 CB GLU A 75 6.055 -0.429 -2.516 1.00 0.00 C ATOM 1101 CG GLU A 75 5.889 -1.798 -3.153 1.00 0.00 C ATOM 1102 CD GLU A 75 7.216 -2.446 -3.497 1.00 0.00 C ATOM 1103 OE1 GLU A 75 7.998 -2.729 -2.565 1.00 0.00 O ATOM 1104 OE2 GLU A 75 7.472 -2.671 -4.698 1.00 0.00 O ATOM 0 H GLU A 75 5.528 1.629 -0.826 1.00 0.00 H new ATOM 0 HA GLU A 75 4.153 0.366 -3.127 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.641 0.204 -3.182 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.625 -0.534 -1.593 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.338 -2.447 -2.472 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.290 -1.703 -4.058 1.00 0.00 H new ATOM 1111 N LEU A 76 2.643 -0.764 -1.524 1.00 0.00 N ATOM 1112 CA LEU A 76 1.761 -1.545 -0.663 1.00 0.00 C ATOM 1113 C LEU A 76 2.299 -2.960 -0.473 1.00 0.00 C ATOM 1114 O LEU A 76 2.607 -3.654 -1.443 1.00 0.00 O ATOM 1115 CB LEU A 76 0.352 -1.598 -1.256 1.00 0.00 C ATOM 1116 CG LEU A 76 -0.443 -0.292 -1.215 1.00 0.00 C ATOM 1117 CD1 LEU A 76 -1.807 -0.477 -1.862 1.00 0.00 C ATOM 1118 CD2 LEU A 76 -0.592 0.196 0.218 1.00 0.00 C ATOM 0 H LEU A 76 2.194 -0.393 -2.362 1.00 0.00 H new ATOM 0 HA LEU A 76 1.720 -1.058 0.311 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.428 -1.921 -2.294 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.216 -2.362 -0.725 1.00 0.00 H new ATOM 0 HG LEU A 76 0.104 0.463 -1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.358 0.462 -1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.679 -0.780 -2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.363 -1.246 -1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.160 1.126 0.228 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.117 -0.557 0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.395 0.369 0.648 1.00 0.00 H new ATOM 1130 N LEU A 77 2.407 -3.383 0.782 1.00 0.00 N ATOM 1131 CA LEU A 77 2.905 -4.717 1.099 1.00 0.00 C ATOM 1132 C LEU A 77 1.793 -5.591 1.670 1.00 0.00 C ATOM 1133 O LEU A 77 1.639 -6.748 1.280 1.00 0.00 O ATOM 1134 CB LEU A 77 4.061 -4.626 2.096 1.00 0.00 C ATOM 1135 CG LEU A 77 5.228 -3.724 1.691 1.00 0.00 C ATOM 1136 CD1 LEU A 77 6.120 -3.436 2.888 1.00 0.00 C ATOM 1137 CD2 LEU A 77 6.030 -4.362 0.567 1.00 0.00 C ATOM 0 H LEU A 77 2.157 -2.822 1.596 1.00 0.00 H new ATOM 0 HA LEU A 77 3.264 -5.174 0.177 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.666 -4.270 3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.447 -5.631 2.267 1.00 0.00 H new ATOM 0 HG LEU A 77 4.823 -2.779 1.330 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.945 -2.793 2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.539 -2.936 3.663 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.517 -4.373 3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.856 -3.706 0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.424 -5.322 0.901 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.385 -4.516 -0.298 1.00 0.00 H new ATOM 1149 N GLU A 78 1.021 -5.029 2.595 1.00 0.00 N ATOM 1150 CA GLU A 78 -0.078 -5.758 3.218 1.00 0.00 C ATOM 1151 C GLU A 78 -1.291 -4.853 3.412 1.00 0.00 C ATOM 1152 O GLU A 78 -1.156 -3.636 3.537 1.00 0.00 O ATOM 1153 CB GLU A 78 0.363 -6.335 4.565 1.00 0.00 C ATOM 1154 CG GLU A 78 1.684 -7.083 4.504 1.00 0.00 C ATOM 1155 CD GLU A 78 2.139 -7.576 5.864 1.00 0.00 C ATOM 1156 OE1 GLU A 78 2.227 -6.750 6.796 1.00 0.00 O ATOM 1157 OE2 GLU A 78 2.405 -8.789 5.995 1.00 0.00 O ATOM 0 H GLU A 78 1.136 -4.072 2.929 1.00 0.00 H new ATOM 0 HA GLU A 78 -0.360 -6.576 2.555 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.448 -5.524 5.288 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.410 -7.010 4.932 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.585 -7.933 3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.448 -6.429 4.084 1.00 0.00 H new ATOM 1164 N ILE A 79 -2.474 -5.457 3.436 1.00 0.00 N ATOM 1165 CA ILE A 79 -3.711 -4.706 3.615 1.00 0.00 C ATOM 1166 C ILE A 79 -4.799 -5.579 4.231 1.00 0.00 C ATOM 1167 O ILE A 79 -5.037 -6.700 3.784 1.00 0.00 O ATOM 1168 CB ILE A 79 -4.222 -4.136 2.279 1.00 0.00 C ATOM 1169 CG1 ILE A 79 -3.198 -3.163 1.690 1.00 0.00 C ATOM 1170 CG2 ILE A 79 -5.563 -3.446 2.476 1.00 0.00 C ATOM 1171 CD1 ILE A 79 -3.610 -2.589 0.352 1.00 0.00 C ATOM 0 H ILE A 79 -2.602 -6.464 3.334 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.484 -3.881 4.290 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.359 -4.959 1.578 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.039 -2.346 2.393 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.243 -3.677 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -5.911 -3.048 1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.289 -4.164 2.856 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.451 -2.630 3.190 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.837 -1.908 -0.005 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.741 -3.398 -0.366 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.549 -2.046 0.462 1.00 0.00 H new ATOM 1183 N ASN A 80 -5.457 -5.055 5.260 1.00 0.00 N ATOM 1184 CA ASN A 80 -6.522 -5.786 5.938 1.00 0.00 C ATOM 1185 C ASN A 80 -6.075 -7.203 6.284 1.00 0.00 C ATOM 1186 O ASN A 80 -6.874 -8.138 6.266 1.00 0.00 O ATOM 1187 CB ASN A 80 -7.775 -5.834 5.061 1.00 0.00 C ATOM 1188 CG ASN A 80 -8.992 -6.330 5.817 1.00 0.00 C ATOM 1189 OD1 ASN A 80 -9.478 -7.435 5.575 1.00 0.00 O ATOM 1190 ND2 ASN A 80 -9.489 -5.514 6.739 1.00 0.00 N ATOM 0 H ASN A 80 -5.272 -4.128 5.643 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.755 -5.261 6.865 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -7.977 -4.838 4.666 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.592 -6.485 4.206 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -10.307 -5.794 7.281 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -9.053 -4.607 6.906 1.00 0.00 H new ATOM 1197 N ASN A 81 -4.792 -7.353 6.598 1.00 0.00 N ATOM 1198 CA ASN A 81 -4.238 -8.656 6.947 1.00 0.00 C ATOM 1199 C ASN A 81 -4.137 -9.552 5.717 1.00 0.00 C ATOM 1200 O ASN A 81 -4.639 -10.676 5.714 1.00 0.00 O ATOM 1201 CB ASN A 81 -5.102 -9.330 8.015 1.00 0.00 C ATOM 1202 CG ASN A 81 -4.322 -10.338 8.837 1.00 0.00 C ATOM 1203 OD1 ASN A 81 -3.175 -10.657 8.524 1.00 0.00 O ATOM 1204 ND2 ASN A 81 -4.943 -10.846 9.895 1.00 0.00 N ATOM 0 H ASN A 81 -4.117 -6.589 6.618 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.235 -8.502 7.344 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -5.517 -8.569 8.676 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -5.944 -9.830 7.536 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -4.469 -11.529 10.485 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -5.894 -10.553 10.117 1.00 0.00 H new ATOM 1211 N GLN A 82 -3.486 -9.046 4.675 1.00 0.00 N ATOM 1212 CA GLN A 82 -3.320 -9.801 3.438 1.00 0.00 C ATOM 1213 C GLN A 82 -2.087 -9.331 2.674 1.00 0.00 C ATOM 1214 O GLN A 82 -1.948 -8.145 2.371 1.00 0.00 O ATOM 1215 CB GLN A 82 -4.564 -9.661 2.559 1.00 0.00 C ATOM 1216 CG GLN A 82 -5.732 -10.520 3.015 1.00 0.00 C ATOM 1217 CD GLN A 82 -6.707 -10.822 1.895 1.00 0.00 C ATOM 1218 OE1 GLN A 82 -7.865 -10.406 1.936 1.00 0.00 O ATOM 1219 NE2 GLN A 82 -6.243 -11.548 0.885 1.00 0.00 N ATOM 0 H GLN A 82 -3.065 -8.117 4.662 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.185 -10.851 3.699 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -4.875 -8.616 2.548 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -4.306 -9.928 1.534 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.352 -11.457 3.423 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.259 -10.011 3.823 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -5.276 -11.872 0.892 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.854 -11.782 0.102 1.00 0.00 H new ATOM 1228 N ILE A 83 -1.195 -10.266 2.367 1.00 0.00 N ATOM 1229 CA ILE A 83 0.026 -9.946 1.638 1.00 0.00 C ATOM 1230 C ILE A 83 -0.251 -9.777 0.148 1.00 0.00 C ATOM 1231 O ILE A 83 -0.844 -10.650 -0.488 1.00 0.00 O ATOM 1232 CB ILE A 83 1.098 -11.036 1.828 1.00 0.00 C ATOM 1233 CG1 ILE A 83 1.412 -11.219 3.314 1.00 0.00 C ATOM 1234 CG2 ILE A 83 2.358 -10.681 1.054 1.00 0.00 C ATOM 1235 CD1 ILE A 83 2.531 -12.202 3.579 1.00 0.00 C ATOM 0 H ILE A 83 -1.295 -11.251 2.612 1.00 0.00 H new ATOM 0 HA ILE A 83 0.398 -9.006 2.045 1.00 0.00 H new ATOM 0 HB ILE A 83 0.711 -11.978 1.439 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.679 -10.253 3.742 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.512 -11.558 3.828 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.106 -11.461 1.199 1.00 0.00 H new ATOM 0 HG22 ILE A 83 2.122 -10.597 -0.007 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.751 -9.730 1.415 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.699 -12.281 4.653 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.258 -13.179 3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.443 -11.854 3.094 1.00 0.00 H new ATOM 1247 N LEU A 84 0.182 -8.649 -0.405 1.00 0.00 N ATOM 1248 CA LEU A 84 -0.018 -8.365 -1.821 1.00 0.00 C ATOM 1249 C LEU A 84 1.244 -8.671 -2.621 1.00 0.00 C ATOM 1250 O LEU A 84 1.174 -9.031 -3.797 1.00 0.00 O ATOM 1251 CB LEU A 84 -0.418 -6.902 -2.017 1.00 0.00 C ATOM 1252 CG LEU A 84 -1.411 -6.336 -1.001 1.00 0.00 C ATOM 1253 CD1 LEU A 84 -1.518 -4.826 -1.143 1.00 0.00 C ATOM 1254 CD2 LEU A 84 -2.777 -6.987 -1.171 1.00 0.00 C ATOM 0 H LEU A 84 0.674 -7.916 0.106 1.00 0.00 H new ATOM 0 HA LEU A 84 -0.821 -9.006 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.485 -6.293 -1.991 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.847 -6.794 -3.013 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.045 -6.561 0.001 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.229 -4.441 -0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.541 -4.374 -0.971 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.861 -4.578 -2.148 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.471 -6.572 -0.440 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.150 -6.793 -2.177 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.689 -8.063 -1.018 1.00 0.00 H new ATOM 1266 N TYR A 85 2.396 -8.526 -1.976 1.00 0.00 N ATOM 1267 CA TYR A 85 3.675 -8.786 -2.628 1.00 0.00 C ATOM 1268 C TYR A 85 3.571 -9.977 -3.576 1.00 0.00 C ATOM 1269 O TYR A 85 3.443 -11.121 -3.143 1.00 0.00 O ATOM 1270 CB TYR A 85 4.760 -9.047 -1.582 1.00 0.00 C ATOM 1271 CG TYR A 85 6.129 -9.287 -2.177 1.00 0.00 C ATOM 1272 CD1 TYR A 85 6.530 -10.563 -2.553 1.00 0.00 C ATOM 1273 CD2 TYR A 85 7.022 -8.239 -2.362 1.00 0.00 C ATOM 1274 CE1 TYR A 85 7.780 -10.788 -3.096 1.00 0.00 C ATOM 1275 CE2 TYR A 85 8.273 -8.454 -2.906 1.00 0.00 C ATOM 1276 CZ TYR A 85 8.648 -9.731 -3.271 1.00 0.00 C ATOM 1277 OH TYR A 85 9.894 -9.949 -3.812 1.00 0.00 O ATOM 0 H TYR A 85 2.471 -8.230 -1.003 1.00 0.00 H new ATOM 0 HA TYR A 85 3.944 -7.904 -3.209 1.00 0.00 H new ATOM 0 HB2 TYR A 85 4.812 -8.195 -0.904 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.476 -9.913 -0.984 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.853 -11.393 -2.418 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.733 -7.239 -2.075 1.00 0.00 H new ATOM 0 HE1 TYR A 85 8.076 -11.787 -3.382 1.00 0.00 H new ATOM 0 HE2 TYR A 85 8.954 -7.627 -3.045 1.00 0.00 H new ATOM 0 HH TYR A 85 10.379 -9.100 -3.868 1.00 0.00 H new ATOM 1287 N GLY A 86 3.627 -9.697 -4.875 1.00 0.00 N ATOM 1288 CA GLY A 86 3.538 -10.753 -5.866 1.00 0.00 C ATOM 1289 C GLY A 86 2.166 -10.835 -6.505 1.00 0.00 C ATOM 1290 O GLY A 86 1.756 -11.896 -6.977 1.00 0.00 O ATOM 0 H GLY A 86 3.732 -8.758 -5.258 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.286 -10.584 -6.640 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.774 -11.708 -5.397 1.00 0.00 H new ATOM 1294 N ARG A 87 1.454 -9.713 -6.520 1.00 0.00 N ATOM 1295 CA ARG A 87 0.119 -9.663 -7.103 1.00 0.00 C ATOM 1296 C ARG A 87 -0.099 -8.351 -7.852 1.00 0.00 C ATOM 1297 O ARG A 87 0.701 -7.422 -7.741 1.00 0.00 O ATOM 1298 CB ARG A 87 -0.943 -9.823 -6.014 1.00 0.00 C ATOM 1299 CG ARG A 87 -0.948 -11.198 -5.365 1.00 0.00 C ATOM 1300 CD ARG A 87 -1.860 -11.237 -4.149 1.00 0.00 C ATOM 1301 NE ARG A 87 -1.767 -12.508 -3.436 1.00 0.00 N ATOM 1302 CZ ARG A 87 -2.425 -13.604 -3.798 1.00 0.00 C ATOM 1303 NH1 ARG A 87 -3.219 -13.584 -4.860 1.00 0.00 N ATOM 1304 NH2 ARG A 87 -2.288 -14.723 -3.098 1.00 0.00 N ATOM 0 H ARG A 87 1.780 -8.826 -6.135 1.00 0.00 H new ATOM 0 HA ARG A 87 0.029 -10.486 -7.812 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -0.779 -9.068 -5.245 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.925 -9.631 -6.445 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -1.275 -11.943 -6.091 1.00 0.00 H new ATOM 0 HG3 ARG A 87 0.066 -11.465 -5.069 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.599 -10.422 -3.474 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -2.891 -11.072 -4.463 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.164 -12.557 -2.615 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -3.326 -12.726 -5.401 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -3.723 -14.427 -5.136 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -1.677 -14.742 -2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -2.794 -15.564 -3.377 1.00 0.00 H new ATOM 1318 N SER A 88 -1.186 -8.283 -8.613 1.00 0.00 N ATOM 1319 CA SER A 88 -1.506 -7.087 -9.383 1.00 0.00 C ATOM 1320 C SER A 88 -2.338 -6.113 -8.554 1.00 0.00 C ATOM 1321 O SER A 88 -3.059 -6.517 -7.640 1.00 0.00 O ATOM 1322 CB SER A 88 -2.262 -7.463 -10.659 1.00 0.00 C ATOM 1323 OG SER A 88 -3.600 -7.832 -10.369 1.00 0.00 O ATOM 0 H SER A 88 -1.860 -9.042 -8.713 1.00 0.00 H new ATOM 0 HA SER A 88 -0.570 -6.599 -9.654 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.255 -6.621 -11.351 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.753 -8.289 -11.157 1.00 0.00 H new ATOM 0 HG SER A 88 -3.611 -8.452 -9.610 1.00 0.00 H new ATOM 1329 N HIS A 89 -2.233 -4.829 -8.879 1.00 0.00 N ATOM 1330 CA HIS A 89 -2.975 -3.796 -8.165 1.00 0.00 C ATOM 1331 C HIS A 89 -4.469 -4.108 -8.157 1.00 0.00 C ATOM 1332 O HIS A 89 -5.151 -3.893 -7.155 1.00 0.00 O ATOM 1333 CB HIS A 89 -2.732 -2.429 -8.804 1.00 0.00 C ATOM 1334 CG HIS A 89 -3.225 -2.331 -10.215 1.00 0.00 C ATOM 1335 ND1 HIS A 89 -4.351 -1.618 -10.570 1.00 0.00 N ATOM 1336 CD2 HIS A 89 -2.738 -2.858 -11.362 1.00 0.00 C ATOM 1337 CE1 HIS A 89 -4.537 -1.714 -11.874 1.00 0.00 C ATOM 1338 NE2 HIS A 89 -3.571 -2.461 -12.379 1.00 0.00 N ATOM 0 H HIS A 89 -1.641 -4.479 -9.632 1.00 0.00 H new ATOM 0 HA HIS A 89 -2.620 -3.775 -7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -3.222 -1.664 -8.203 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -1.664 -2.213 -8.785 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -1.858 -3.476 -11.460 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -5.342 -1.259 -12.433 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -3.462 -2.703 -13.364 1.00 0.00 H new ATOM 1347 N GLN A 90 -4.969 -4.615 -9.279 1.00 0.00 N ATOM 1348 CA GLN A 90 -6.381 -4.955 -9.401 1.00 0.00 C ATOM 1349 C GLN A 90 -6.837 -5.818 -8.228 1.00 0.00 C ATOM 1350 O GLN A 90 -8.010 -5.812 -7.861 1.00 0.00 O ATOM 1351 CB GLN A 90 -6.640 -5.687 -10.719 1.00 0.00 C ATOM 1352 CG GLN A 90 -6.321 -4.854 -11.950 1.00 0.00 C ATOM 1353 CD GLN A 90 -6.666 -5.567 -13.242 1.00 0.00 C ATOM 1354 OE1 GLN A 90 -5.790 -6.101 -13.923 1.00 0.00 O ATOM 1355 NE2 GLN A 90 -7.948 -5.579 -13.588 1.00 0.00 N ATOM 0 H GLN A 90 -4.417 -4.799 -10.117 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.954 -4.028 -9.390 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.043 -6.598 -10.742 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.686 -5.991 -10.757 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -6.870 -3.914 -11.900 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.260 -4.604 -11.950 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.641 -5.124 -12.994 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -8.240 -6.043 -14.448 1.00 0.00 H new ATOM 1364 N ASN A 91 -5.899 -6.558 -7.646 1.00 0.00 N ATOM 1365 CA ASN A 91 -6.204 -7.428 -6.516 1.00 0.00 C ATOM 1366 C ASN A 91 -6.336 -6.620 -5.228 1.00 0.00 C ATOM 1367 O ASN A 91 -7.222 -6.873 -4.413 1.00 0.00 O ATOM 1368 CB ASN A 91 -5.116 -8.491 -6.355 1.00 0.00 C ATOM 1369 CG ASN A 91 -5.197 -9.568 -7.420 1.00 0.00 C ATOM 1370 OD1 ASN A 91 -4.546 -9.477 -8.461 1.00 0.00 O ATOM 1371 ND2 ASN A 91 -6.001 -10.593 -7.164 1.00 0.00 N ATOM 0 H ASN A 91 -4.922 -6.573 -7.938 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.156 -7.920 -6.715 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.137 -8.014 -6.398 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -5.204 -8.950 -5.370 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -6.098 -11.347 -7.844 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.521 -10.626 -6.287 1.00 0.00 H new ATOM 1378 N ALA A 92 -5.449 -5.646 -5.054 1.00 0.00 N ATOM 1379 CA ALA A 92 -5.467 -4.799 -3.868 1.00 0.00 C ATOM 1380 C ALA A 92 -6.833 -4.148 -3.679 1.00 0.00 C ATOM 1381 O ALA A 92 -7.541 -4.437 -2.715 1.00 0.00 O ATOM 1382 CB ALA A 92 -4.382 -3.737 -3.961 1.00 0.00 C ATOM 0 H ALA A 92 -4.709 -5.424 -5.720 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.270 -5.428 -3.000 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.407 -3.112 -3.068 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.407 -4.219 -4.039 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.553 -3.119 -4.842 1.00 0.00 H new ATOM 1388 N SER A 93 -7.197 -3.268 -4.606 1.00 0.00 N ATOM 1389 CA SER A 93 -8.477 -2.572 -4.540 1.00 0.00 C ATOM 1390 C SER A 93 -9.585 -3.516 -4.084 1.00 0.00 C ATOM 1391 O SER A 93 -10.430 -3.151 -3.268 1.00 0.00 O ATOM 1392 CB SER A 93 -8.828 -1.974 -5.903 1.00 0.00 C ATOM 1393 OG SER A 93 -9.009 -2.991 -6.874 1.00 0.00 O ATOM 0 H SER A 93 -6.623 -3.020 -5.412 1.00 0.00 H new ATOM 0 HA SER A 93 -8.388 -1.766 -3.811 1.00 0.00 H new ATOM 0 HB2 SER A 93 -9.738 -1.380 -5.820 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.035 -1.298 -6.223 1.00 0.00 H new ATOM 0 HG SER A 93 -9.234 -2.584 -7.736 1.00 0.00 H new ATOM 1399 N ALA A 94 -9.574 -4.733 -4.619 1.00 0.00 N ATOM 1400 CA ALA A 94 -10.577 -5.731 -4.268 1.00 0.00 C ATOM 1401 C ALA A 94 -10.586 -5.993 -2.766 1.00 0.00 C ATOM 1402 O ALA A 94 -11.638 -5.952 -2.126 1.00 0.00 O ATOM 1403 CB ALA A 94 -10.325 -7.023 -5.030 1.00 0.00 C ATOM 0 H ALA A 94 -8.882 -5.051 -5.297 1.00 0.00 H new ATOM 0 HA ALA A 94 -11.556 -5.342 -4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.081 -7.759 -4.758 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.376 -6.829 -6.101 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.337 -7.408 -4.777 1.00 0.00 H new ATOM 1409 N ILE A 95 -9.410 -6.264 -2.210 1.00 0.00 N ATOM 1410 CA ILE A 95 -9.285 -6.533 -0.782 1.00 0.00 C ATOM 1411 C ILE A 95 -9.871 -5.395 0.045 1.00 0.00 C ATOM 1412 O ILE A 95 -10.635 -5.625 0.983 1.00 0.00 O ATOM 1413 CB ILE A 95 -7.814 -6.743 -0.377 1.00 0.00 C ATOM 1414 CG1 ILE A 95 -7.211 -7.917 -1.151 1.00 0.00 C ATOM 1415 CG2 ILE A 95 -7.707 -6.979 1.122 1.00 0.00 C ATOM 1416 CD1 ILE A 95 -5.704 -7.995 -1.053 1.00 0.00 C ATOM 0 H ILE A 95 -8.531 -6.303 -2.726 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.843 -7.448 -0.582 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.252 -5.843 -0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -7.640 -8.847 -0.777 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -7.495 -7.834 -2.200 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.662 -7.126 1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.103 -6.115 1.656 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.280 -7.866 1.393 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.346 -8.851 -1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -5.266 -7.081 -1.454 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.413 -8.109 -0.009 1.00 0.00 H new ATOM 1428 N ILE A 96 -9.510 -4.166 -0.309 1.00 0.00 N ATOM 1429 CA ILE A 96 -10.003 -2.991 0.400 1.00 0.00 C ATOM 1430 C ILE A 96 -11.523 -2.901 0.323 1.00 0.00 C ATOM 1431 O ILE A 96 -12.191 -2.625 1.320 1.00 0.00 O ATOM 1432 CB ILE A 96 -9.394 -1.695 -0.167 1.00 0.00 C ATOM 1433 CG1 ILE A 96 -7.876 -1.691 0.028 1.00 0.00 C ATOM 1434 CG2 ILE A 96 -10.022 -0.480 0.498 1.00 0.00 C ATOM 1435 CD1 ILE A 96 -7.165 -0.637 -0.791 1.00 0.00 C ATOM 0 H ILE A 96 -8.878 -3.958 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 96 -9.700 -3.100 1.441 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.604 -1.649 -1.236 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.654 -1.531 1.083 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.481 -2.672 -0.236 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.581 0.428 0.087 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.096 -0.478 0.313 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.839 -0.518 1.572 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.093 -0.692 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.357 -0.808 -1.850 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.532 0.350 -0.511 1.00 0.00 H new ATOM 1447 N LYS A 97 -12.065 -3.137 -0.867 1.00 0.00 N ATOM 1448 CA LYS A 97 -13.508 -3.086 -1.075 1.00 0.00 C ATOM 1449 C LYS A 97 -14.235 -3.966 -0.063 1.00 0.00 C ATOM 1450 O LYS A 97 -15.252 -3.567 0.504 1.00 0.00 O ATOM 1451 CB LYS A 97 -13.855 -3.532 -2.497 1.00 0.00 C ATOM 1452 CG LYS A 97 -15.109 -2.878 -3.051 1.00 0.00 C ATOM 1453 CD LYS A 97 -15.244 -3.109 -4.547 1.00 0.00 C ATOM 1454 CE LYS A 97 -14.269 -2.247 -5.334 1.00 0.00 C ATOM 1455 NZ LYS A 97 -13.991 -2.815 -6.683 1.00 0.00 N ATOM 0 H LYS A 97 -11.527 -3.366 -1.703 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.834 -2.055 -0.934 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.016 -3.305 -3.155 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -13.985 -4.614 -2.508 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.985 -3.277 -2.540 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.082 -1.807 -2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.065 -4.160 -4.772 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -16.264 -2.885 -4.860 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -14.677 -1.242 -5.440 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -13.335 -2.155 -4.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -13.322 -2.199 -7.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -13.578 -3.764 -6.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -14.878 -2.879 -7.222 1.00 0.00 H new ATOM 1469 N THR A 98 -13.706 -5.165 0.159 1.00 0.00 N ATOM 1470 CA THR A 98 -14.304 -6.101 1.103 1.00 0.00 C ATOM 1471 C THR A 98 -13.983 -5.712 2.542 1.00 0.00 C ATOM 1472 O THR A 98 -14.717 -6.059 3.467 1.00 0.00 O ATOM 1473 CB THR A 98 -13.818 -7.541 0.851 1.00 0.00 C ATOM 1474 OG1 THR A 98 -12.398 -7.615 1.020 1.00 0.00 O ATOM 1475 CG2 THR A 98 -14.192 -8.001 -0.550 1.00 0.00 C ATOM 0 H THR A 98 -12.864 -5.511 -0.302 1.00 0.00 H new ATOM 0 HA THR A 98 -15.382 -6.058 0.950 1.00 0.00 H new ATOM 0 HB THR A 98 -14.304 -8.197 1.573 1.00 0.00 H new ATOM 0 HG1 THR A 98 -12.028 -6.710 1.083 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.838 -9.020 -0.705 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.275 -7.971 -0.666 1.00 0.00 H new ATOM 0 HG23 THR A 98 -13.730 -7.341 -1.285 1.00 0.00 H new ATOM 1483 N ALA A 99 -12.882 -4.991 2.723 1.00 0.00 N ATOM 1484 CA ALA A 99 -12.465 -4.553 4.049 1.00 0.00 C ATOM 1485 C ALA A 99 -13.412 -3.493 4.600 1.00 0.00 C ATOM 1486 O ALA A 99 -14.007 -2.711 3.858 1.00 0.00 O ATOM 1487 CB ALA A 99 -11.041 -4.020 4.005 1.00 0.00 C ATOM 0 H ALA A 99 -12.262 -4.698 1.968 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.498 -5.414 4.716 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -10.743 -3.696 5.002 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.369 -4.806 3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -10.990 -3.175 3.319 1.00 0.00 H new ATOM 1493 N PRO A 100 -13.558 -3.463 5.933 1.00 0.00 N ATOM 1494 CA PRO A 100 -14.433 -2.503 6.613 1.00 0.00 C ATOM 1495 C PRO A 100 -13.895 -1.078 6.542 1.00 0.00 C ATOM 1496 O PRO A 100 -12.763 -0.852 6.113 1.00 0.00 O ATOM 1497 CB PRO A 100 -14.446 -2.999 8.061 1.00 0.00 C ATOM 1498 CG PRO A 100 -13.165 -3.743 8.218 1.00 0.00 C ATOM 1499 CD PRO A 100 -12.880 -4.365 6.879 1.00 0.00 C ATOM 0 HA PRO A 100 -15.421 -2.456 6.156 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -14.510 -2.168 8.764 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -15.304 -3.644 8.251 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -12.359 -3.073 8.516 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -13.249 -4.505 8.992 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.809 -4.423 6.682 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.271 -5.381 6.816 1.00 0.00 H new ATOM 1507 N SER A 101 -14.712 -0.120 6.967 1.00 0.00 N ATOM 1508 CA SER A 101 -14.319 1.284 6.949 1.00 0.00 C ATOM 1509 C SER A 101 -12.849 1.441 7.328 1.00 0.00 C ATOM 1510 O SER A 101 -12.063 2.027 6.583 1.00 0.00 O ATOM 1511 CB SER A 101 -15.194 2.093 7.908 1.00 0.00 C ATOM 1512 OG SER A 101 -16.550 2.080 7.496 1.00 0.00 O ATOM 0 H SER A 101 -15.651 -0.290 7.328 1.00 0.00 H new ATOM 0 HA SER A 101 -14.458 1.662 5.936 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.113 1.682 8.914 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.834 3.121 7.954 1.00 0.00 H new ATOM 0 HG SER A 101 -17.088 2.603 8.126 1.00 0.00 H new ATOM 1518 N LYS A 102 -12.485 0.914 8.492 1.00 0.00 N ATOM 1519 CA LYS A 102 -11.111 0.994 8.972 1.00 0.00 C ATOM 1520 C LYS A 102 -10.252 -0.100 8.346 1.00 0.00 C ATOM 1521 O LYS A 102 -10.494 -1.289 8.555 1.00 0.00 O ATOM 1522 CB LYS A 102 -11.074 0.875 10.497 1.00 0.00 C ATOM 1523 CG LYS A 102 -9.780 1.377 11.115 1.00 0.00 C ATOM 1524 CD LYS A 102 -10.007 1.929 12.513 1.00 0.00 C ATOM 1525 CE LYS A 102 -10.438 3.387 12.473 1.00 0.00 C ATOM 1526 NZ LYS A 102 -10.640 3.943 13.840 1.00 0.00 N ATOM 0 H LYS A 102 -13.123 0.426 9.121 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.706 1.963 8.679 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.909 1.436 10.917 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -11.219 -0.169 10.775 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.056 0.563 11.157 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.350 2.153 10.482 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.769 1.337 13.020 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -9.091 1.835 13.096 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.684 3.975 11.950 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -11.363 3.477 11.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.933 4.938 13.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -11.378 3.398 14.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -9.750 3.881 14.375 1.00 0.00 H new ATOM 1540 N VAL A 103 -9.247 0.309 7.578 1.00 0.00 N ATOM 1541 CA VAL A 103 -8.350 -0.636 6.924 1.00 0.00 C ATOM 1542 C VAL A 103 -6.892 -0.306 7.222 1.00 0.00 C ATOM 1543 O VAL A 103 -6.501 0.861 7.254 1.00 0.00 O ATOM 1544 CB VAL A 103 -8.562 -0.647 5.399 1.00 0.00 C ATOM 1545 CG1 VAL A 103 -7.598 -1.617 4.732 1.00 0.00 C ATOM 1546 CG2 VAL A 103 -10.003 -1.000 5.064 1.00 0.00 C ATOM 0 H VAL A 103 -9.034 1.289 7.394 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.584 -1.623 7.323 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.358 0.352 5.015 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.763 -1.611 3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.573 -1.314 4.944 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.767 -2.622 5.119 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.135 -1.003 3.982 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.237 -1.988 5.461 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.671 -0.262 5.509 1.00 0.00 H new ATOM 1556 N LYS A 104 -6.089 -1.343 7.438 1.00 0.00 N ATOM 1557 CA LYS A 104 -4.671 -1.165 7.731 1.00 0.00 C ATOM 1558 C LYS A 104 -3.833 -1.293 6.463 1.00 0.00 C ATOM 1559 O LYS A 104 -3.912 -2.296 5.754 1.00 0.00 O ATOM 1560 CB LYS A 104 -4.211 -2.194 8.766 1.00 0.00 C ATOM 1561 CG LYS A 104 -2.853 -1.882 9.371 1.00 0.00 C ATOM 1562 CD LYS A 104 -2.390 -2.990 10.302 1.00 0.00 C ATOM 1563 CE LYS A 104 -0.892 -2.915 10.556 1.00 0.00 C ATOM 1564 NZ LYS A 104 -0.390 -4.119 11.274 1.00 0.00 N ATOM 0 H LYS A 104 -6.396 -2.315 7.416 1.00 0.00 H new ATOM 0 HA LYS A 104 -4.532 -0.163 8.137 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.951 -2.250 9.564 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -4.173 -3.177 8.297 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.122 -1.745 8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -2.906 -0.942 9.920 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -2.925 -2.918 11.249 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -2.639 -3.959 9.868 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.367 -2.814 9.606 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -0.667 -2.023 11.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.635 -4.029 11.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.872 -4.202 12.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -0.581 -4.968 10.704 1.00 0.00 H new ATOM 1578 N LEU A 105 -3.031 -0.272 6.185 1.00 0.00 N ATOM 1579 CA LEU A 105 -2.176 -0.271 5.003 1.00 0.00 C ATOM 1580 C LEU A 105 -0.702 -0.293 5.396 1.00 0.00 C ATOM 1581 O LEU A 105 -0.207 0.631 6.042 1.00 0.00 O ATOM 1582 CB LEU A 105 -2.467 0.959 4.140 1.00 0.00 C ATOM 1583 CG LEU A 105 -3.937 1.211 3.806 1.00 0.00 C ATOM 1584 CD1 LEU A 105 -4.197 2.700 3.633 1.00 0.00 C ATOM 1585 CD2 LEU A 105 -4.338 0.449 2.551 1.00 0.00 C ATOM 0 H LEU A 105 -2.954 0.566 6.762 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.393 -1.171 4.428 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.075 1.838 4.652 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.914 0.862 3.206 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.545 0.850 4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.249 2.861 3.396 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.950 3.222 4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.579 3.085 2.822 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.388 0.641 2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.724 0.779 1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.190 -0.619 2.711 1.00 0.00 H new ATOM 1597 N VAL A 106 -0.005 -1.353 5.001 1.00 0.00 N ATOM 1598 CA VAL A 106 1.413 -1.494 5.309 1.00 0.00 C ATOM 1599 C VAL A 106 2.264 -1.371 4.050 1.00 0.00 C ATOM 1600 O VAL A 106 2.400 -2.325 3.284 1.00 0.00 O ATOM 1601 CB VAL A 106 1.708 -2.847 5.984 1.00 0.00 C ATOM 1602 CG1 VAL A 106 3.204 -3.018 6.206 1.00 0.00 C ATOM 1603 CG2 VAL A 106 0.950 -2.963 7.298 1.00 0.00 C ATOM 0 H VAL A 106 -0.399 -2.127 4.467 1.00 0.00 H new ATOM 0 HA VAL A 106 1.669 -0.689 5.997 1.00 0.00 H new ATOM 0 HB VAL A 106 1.369 -3.645 5.323 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.393 -3.979 6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 106 3.721 -2.981 5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.571 -2.216 6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.170 -3.925 7.761 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.257 -2.159 7.967 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.121 -2.888 7.108 1.00 0.00 H new ATOM 1613 N PHE A 107 2.835 -0.189 3.842 1.00 0.00 N ATOM 1614 CA PHE A 107 3.674 0.060 2.676 1.00 0.00 C ATOM 1615 C PHE A 107 5.048 0.574 3.093 1.00 0.00 C ATOM 1616 O PHE A 107 5.352 0.670 4.283 1.00 0.00 O ATOM 1617 CB PHE A 107 3.000 1.070 1.744 1.00 0.00 C ATOM 1618 CG PHE A 107 2.895 2.449 2.330 1.00 0.00 C ATOM 1619 CD1 PHE A 107 3.993 3.294 2.349 1.00 0.00 C ATOM 1620 CD2 PHE A 107 1.698 2.900 2.862 1.00 0.00 C ATOM 1621 CE1 PHE A 107 3.899 4.562 2.888 1.00 0.00 C ATOM 1622 CE2 PHE A 107 1.598 4.168 3.403 1.00 0.00 C ATOM 1623 CZ PHE A 107 2.700 5.001 3.415 1.00 0.00 C ATOM 0 H PHE A 107 2.732 0.611 4.466 1.00 0.00 H new ATOM 0 HA PHE A 107 3.805 -0.883 2.146 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.561 1.122 0.811 1.00 0.00 H new ATOM 0 HB3 PHE A 107 2.001 0.712 1.495 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.933 2.957 1.938 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.833 2.253 2.854 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.763 5.210 2.897 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.659 4.507 3.816 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.624 5.993 3.835 1.00 0.00 H new ATOM 1633 N ILE A 108 5.875 0.903 2.106 1.00 0.00 N ATOM 1634 CA ILE A 108 7.217 1.407 2.371 1.00 0.00 C ATOM 1635 C ILE A 108 7.425 2.776 1.732 1.00 0.00 C ATOM 1636 O ILE A 108 6.890 3.060 0.660 1.00 0.00 O ATOM 1637 CB ILE A 108 8.295 0.440 1.848 1.00 0.00 C ATOM 1638 CG1 ILE A 108 9.691 0.956 2.207 1.00 0.00 C ATOM 1639 CG2 ILE A 108 8.161 0.261 0.344 1.00 0.00 C ATOM 1640 CD1 ILE A 108 10.708 -0.145 2.408 1.00 0.00 C ATOM 0 H ILE A 108 5.639 0.830 1.116 1.00 0.00 H new ATOM 0 HA ILE A 108 7.314 1.495 3.453 1.00 0.00 H new ATOM 0 HB ILE A 108 8.153 -0.531 2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.038 1.621 1.416 1.00 0.00 H new ATOM 0 HG13 ILE A 108 9.627 1.551 3.118 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.930 -0.425 -0.011 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.177 -0.146 0.112 1.00 0.00 H new ATOM 0 HG23 ILE A 108 8.280 1.226 -0.149 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.674 0.293 2.660 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.383 -0.797 3.219 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.801 -0.726 1.491 1.00 0.00 H new ATOM 1652 N ARG A 109 8.207 3.620 2.397 1.00 0.00 N ATOM 1653 CA ARG A 109 8.487 4.960 1.893 1.00 0.00 C ATOM 1654 C ARG A 109 9.861 5.015 1.230 1.00 0.00 C ATOM 1655 O ARG A 109 10.869 5.262 1.889 1.00 0.00 O ATOM 1656 CB ARG A 109 8.417 5.980 3.031 1.00 0.00 C ATOM 1657 CG ARG A 109 7.983 7.365 2.581 1.00 0.00 C ATOM 1658 CD ARG A 109 8.137 8.387 3.697 1.00 0.00 C ATOM 1659 NE ARG A 109 7.165 9.471 3.584 1.00 0.00 N ATOM 1660 CZ ARG A 109 7.217 10.583 4.308 1.00 0.00 C ATOM 1661 NH1 ARG A 109 8.189 10.758 5.193 1.00 0.00 N ATOM 1662 NH2 ARG A 109 6.295 11.525 4.149 1.00 0.00 N ATOM 0 H ARG A 109 8.658 3.400 3.285 1.00 0.00 H new ATOM 0 HA ARG A 109 7.732 5.206 1.146 1.00 0.00 H new ATOM 0 HB2 ARG A 109 7.722 5.619 3.789 1.00 0.00 H new ATOM 0 HB3 ARG A 109 9.396 6.051 3.505 1.00 0.00 H new ATOM 0 HG2 ARG A 109 8.577 7.672 1.720 1.00 0.00 H new ATOM 0 HG3 ARG A 109 6.943 7.334 2.256 1.00 0.00 H new ATOM 0 HD2 ARG A 109 8.018 7.892 4.661 1.00 0.00 H new ATOM 0 HD3 ARG A 109 9.145 8.800 3.674 1.00 0.00 H new ATOM 0 HE ARG A 109 6.404 9.368 2.912 1.00 0.00 H new ATOM 0 HH11 ARG A 109 8.900 10.037 5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 109 8.226 11.613 5.747 1.00 0.00 H new ATOM 0 HH21 ARG A 109 5.545 11.395 3.470 1.00 0.00 H new ATOM 0 HH22 ARG A 109 6.337 12.378 4.706 1.00 0.00 H new ATOM 1676 N ASN A 110 9.890 4.784 -0.078 1.00 0.00 N ATOM 1677 CA ASN A 110 11.139 4.806 -0.831 1.00 0.00 C ATOM 1678 C ASN A 110 11.043 5.763 -2.015 1.00 0.00 C ATOM 1679 O ASN A 110 10.122 5.671 -2.826 1.00 0.00 O ATOM 1680 CB ASN A 110 11.488 3.400 -1.323 1.00 0.00 C ATOM 1681 CG ASN A 110 12.764 3.374 -2.141 1.00 0.00 C ATOM 1682 OD1 ASN A 110 13.422 4.400 -2.319 1.00 0.00 O ATOM 1683 ND2 ASN A 110 13.121 2.198 -2.643 1.00 0.00 N ATOM 0 H ASN A 110 9.063 4.579 -0.639 1.00 0.00 H new ATOM 0 HA ASN A 110 11.929 5.156 -0.167 1.00 0.00 H new ATOM 0 HB2 ASN A 110 11.595 2.735 -0.466 1.00 0.00 H new ATOM 0 HB3 ASN A 110 10.666 3.014 -1.925 1.00 0.00 H new ATOM 0 HD21 ASN A 110 13.971 2.119 -3.201 1.00 0.00 H new ATOM 0 HD22 ASN A 110 12.545 1.374 -2.470 1.00 0.00 H new ATOM 1690 N GLU A 111 12.001 6.680 -2.108 1.00 0.00 N ATOM 1691 CA GLU A 111 12.024 7.653 -3.194 1.00 0.00 C ATOM 1692 C GLU A 111 12.343 6.977 -4.524 1.00 0.00 C ATOM 1693 O GLU A 111 11.850 7.387 -5.575 1.00 0.00 O ATOM 1694 CB GLU A 111 13.054 8.747 -2.906 1.00 0.00 C ATOM 1695 CG GLU A 111 14.492 8.259 -2.960 1.00 0.00 C ATOM 1696 CD GLU A 111 15.492 9.352 -2.635 1.00 0.00 C ATOM 1697 OE1 GLU A 111 15.338 10.472 -3.166 1.00 0.00 O ATOM 1698 OE2 GLU A 111 16.427 9.088 -1.852 1.00 0.00 O ATOM 0 H GLU A 111 12.771 6.769 -1.445 1.00 0.00 H new ATOM 0 HA GLU A 111 11.034 8.104 -3.264 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.926 9.554 -3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.859 9.167 -1.919 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.619 7.435 -2.258 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.701 7.865 -3.955 1.00 0.00 H new ATOM 1705 N ASP A 112 13.170 5.938 -4.470 1.00 0.00 N ATOM 1706 CA ASP A 112 13.555 5.204 -5.670 1.00 0.00 C ATOM 1707 C ASP A 112 12.358 4.467 -6.263 1.00 0.00 C ATOM 1708 O ASP A 112 12.295 4.236 -7.470 1.00 0.00 O ATOM 1709 CB ASP A 112 14.673 4.211 -5.349 1.00 0.00 C ATOM 1710 CG ASP A 112 16.044 4.859 -5.365 1.00 0.00 C ATOM 1711 OD1 ASP A 112 16.664 4.907 -6.448 1.00 0.00 O ATOM 1712 OD2 ASP A 112 16.497 5.317 -4.295 1.00 0.00 O ATOM 0 H ASP A 112 13.586 5.585 -3.608 1.00 0.00 H new ATOM 0 HA ASP A 112 13.918 5.922 -6.405 1.00 0.00 H new ATOM 0 HB2 ASP A 112 14.494 3.771 -4.368 1.00 0.00 H new ATOM 0 HB3 ASP A 112 14.651 3.396 -6.073 1.00 0.00 H new ATOM 1717 N ALA A 113 11.412 4.100 -5.405 1.00 0.00 N ATOM 1718 CA ALA A 113 10.217 3.389 -5.845 1.00 0.00 C ATOM 1719 C ALA A 113 9.499 4.155 -6.951 1.00 0.00 C ATOM 1720 O ALA A 113 9.050 3.567 -7.935 1.00 0.00 O ATOM 1721 CB ALA A 113 9.280 3.155 -4.669 1.00 0.00 C ATOM 0 H ALA A 113 11.449 4.283 -4.402 1.00 0.00 H new ATOM 0 HA ALA A 113 10.525 2.424 -6.248 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.392 2.623 -5.011 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.789 2.560 -3.911 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.987 4.114 -4.241 1.00 0.00 H new ATOM 1727 N VAL A 114 9.394 5.469 -6.783 1.00 0.00 N ATOM 1728 CA VAL A 114 8.731 6.315 -7.768 1.00 0.00 C ATOM 1729 C VAL A 114 9.296 6.079 -9.164 1.00 0.00 C ATOM 1730 O VAL A 114 8.639 6.361 -10.166 1.00 0.00 O ATOM 1731 CB VAL A 114 8.874 7.807 -7.414 1.00 0.00 C ATOM 1732 CG1 VAL A 114 8.373 8.072 -6.002 1.00 0.00 C ATOM 1733 CG2 VAL A 114 10.320 8.255 -7.567 1.00 0.00 C ATOM 0 H VAL A 114 9.760 5.971 -5.974 1.00 0.00 H new ATOM 0 HA VAL A 114 7.675 6.046 -7.756 1.00 0.00 H new ATOM 0 HB VAL A 114 8.262 8.386 -8.106 1.00 0.00 H new ATOM 0 HG11 VAL A 114 8.482 9.131 -5.770 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.322 7.791 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL A 114 8.955 7.484 -5.293 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.402 9.312 -7.313 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.954 7.671 -6.900 1.00 0.00 H new ATOM 0 HG23 VAL A 114 10.641 8.104 -8.598 1.00 0.00 H new ATOM 1743 N ASN A 115 10.518 5.561 -9.223 1.00 0.00 N ATOM 1744 CA ASN A 115 11.172 5.286 -10.497 1.00 0.00 C ATOM 1745 C ASN A 115 10.913 3.851 -10.943 1.00 0.00 C ATOM 1746 O ASN A 115 11.066 3.519 -12.118 1.00 0.00 O ATOM 1747 CB ASN A 115 12.677 5.534 -10.385 1.00 0.00 C ATOM 1748 CG ASN A 115 12.997 6.893 -9.792 1.00 0.00 C ATOM 1749 OD1 ASN A 115 13.744 6.898 -8.694 1.00 0.00 O flip ATOM 1750 ND2 ASN A 115 12.578 7.925 -10.316 1.00 0.00 N flip ATOM 0 H ASN A 115 11.076 5.323 -8.403 1.00 0.00 H new ATOM 0 HA ASN A 115 10.754 5.960 -11.245 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.126 4.756 -9.767 1.00 0.00 H new ATOM 0 HB3 ASN A 115 13.130 5.456 -11.373 1.00 0.00 H new ATOM 0 HD21 ASN A 115 12.007 7.873 -11.160 1.00 0.00 H new ATOM 0 HD22 ASN A 115 12.802 8.832 -9.907 1.00 0.00 H new ATOM 1757 N GLN A 116 10.519 3.004 -9.997 1.00 0.00 N ATOM 1758 CA GLN A 116 10.239 1.604 -10.293 1.00 0.00 C ATOM 1759 C GLN A 116 8.782 1.415 -10.702 1.00 0.00 C ATOM 1760 O GLN A 116 8.476 0.627 -11.596 1.00 0.00 O ATOM 1761 CB GLN A 116 10.558 0.731 -9.079 1.00 0.00 C ATOM 1762 CG GLN A 116 12.047 0.541 -8.840 1.00 0.00 C ATOM 1763 CD GLN A 116 12.344 -0.589 -7.874 1.00 0.00 C ATOM 1764 OE1 GLN A 116 11.631 -1.593 -7.836 1.00 0.00 O ATOM 1765 NE2 GLN A 116 13.401 -0.432 -7.085 1.00 0.00 N ATOM 0 H GLN A 116 10.387 3.263 -9.019 1.00 0.00 H new ATOM 0 HA GLN A 116 10.873 1.301 -11.126 1.00 0.00 H new ATOM 0 HB2 GLN A 116 10.111 1.179 -8.192 1.00 0.00 H new ATOM 0 HB3 GLN A 116 10.092 -0.246 -9.212 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.541 0.340 -9.791 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.470 1.467 -8.451 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.964 0.416 -7.150 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.649 -1.159 -6.414 1.00 0.00 H new ATOM 1774 N MET A 117 7.888 2.143 -10.041 1.00 0.00 N ATOM 1775 CA MET A 117 6.463 2.055 -10.337 1.00 0.00 C ATOM 1776 C MET A 117 6.165 2.584 -11.737 1.00 0.00 C ATOM 1777 O MET A 117 6.706 3.608 -12.152 1.00 0.00 O ATOM 1778 CB MET A 117 5.656 2.840 -9.301 1.00 0.00 C ATOM 1779 CG MET A 117 6.004 4.318 -9.251 1.00 0.00 C ATOM 1780 SD MET A 117 5.023 5.223 -8.039 1.00 0.00 S ATOM 1781 CE MET A 117 5.518 6.908 -8.392 1.00 0.00 C ATOM 0 H MET A 117 8.125 2.800 -9.297 1.00 0.00 H new ATOM 0 HA MET A 117 6.173 1.005 -10.294 1.00 0.00 H new ATOM 0 HB2 MET A 117 4.594 2.733 -9.523 1.00 0.00 H new ATOM 0 HB3 MET A 117 5.822 2.403 -8.316 1.00 0.00 H new ATOM 0 HG2 MET A 117 7.062 4.430 -9.013 1.00 0.00 H new ATOM 0 HG3 MET A 117 5.851 4.757 -10.237 1.00 0.00 H new ATOM 0 HE1 MET A 117 5.904 7.372 -7.484 1.00 0.00 H new ATOM 0 HE2 MET A 117 6.294 6.906 -9.157 1.00 0.00 H new ATOM 0 HE3 MET A 117 4.657 7.473 -8.750 1.00 0.00 H new ATOM 1791 N ALA A 118 5.301 1.878 -12.459 1.00 0.00 N ATOM 1792 CA ALA A 118 4.931 2.277 -13.811 1.00 0.00 C ATOM 1793 C ALA A 118 3.830 3.333 -13.790 1.00 0.00 C ATOM 1794 O ALA A 118 2.644 3.007 -13.819 1.00 0.00 O ATOM 1795 CB ALA A 118 4.486 1.065 -14.616 1.00 0.00 C ATOM 0 H ALA A 118 4.844 1.027 -12.130 1.00 0.00 H new ATOM 0 HA ALA A 118 5.809 2.714 -14.287 1.00 0.00 H new ATOM 0 HB1 ALA A 118 4.213 1.378 -15.624 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.302 0.344 -14.669 1.00 0.00 H new ATOM 0 HB3 ALA A 118 3.625 0.604 -14.133 1.00 0.00 H new ATOM 1801 N SER A 119 4.232 4.599 -13.737 1.00 0.00 N ATOM 1802 CA SER A 119 3.279 5.702 -13.707 1.00 0.00 C ATOM 1803 C SER A 119 2.175 5.495 -14.738 1.00 0.00 C ATOM 1804 O SER A 119 2.409 4.944 -15.813 1.00 0.00 O ATOM 1805 CB SER A 119 3.995 7.029 -13.969 1.00 0.00 C ATOM 1806 OG SER A 119 3.122 8.127 -13.769 1.00 0.00 O ATOM 0 H SER A 119 5.211 4.886 -13.714 1.00 0.00 H new ATOM 0 HA SER A 119 2.825 5.731 -12.716 1.00 0.00 H new ATOM 0 HB2 SER A 119 4.855 7.119 -13.306 1.00 0.00 H new ATOM 0 HB3 SER A 119 4.376 7.045 -14.990 1.00 0.00 H new ATOM 0 HG SER A 119 3.603 8.963 -13.941 1.00 0.00 H new ATOM 1812 N GLY A 120 0.968 5.941 -14.402 1.00 0.00 N ATOM 1813 CA GLY A 120 -0.156 5.796 -15.309 1.00 0.00 C ATOM 1814 C GLY A 120 -0.926 4.511 -15.076 1.00 0.00 C ATOM 1815 O GLY A 120 -0.694 3.496 -15.732 1.00 0.00 O ATOM 0 H GLY A 120 0.749 6.400 -13.518 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.828 6.646 -15.189 1.00 0.00 H new ATOM 0 HA3 GLY A 120 0.205 5.818 -16.337 1.00 0.00 H new ATOM 1819 N PRO A 121 -1.866 4.545 -14.120 1.00 0.00 N ATOM 1820 CA PRO A 121 -2.691 3.382 -13.779 1.00 0.00 C ATOM 1821 C PRO A 121 -3.685 3.034 -14.882 1.00 0.00 C ATOM 1822 O PRO A 121 -3.925 1.861 -15.167 1.00 0.00 O ATOM 1823 CB PRO A 121 -3.429 3.829 -12.515 1.00 0.00 C ATOM 1824 CG PRO A 121 -3.467 5.315 -12.604 1.00 0.00 C ATOM 1825 CD PRO A 121 -2.196 5.721 -13.298 1.00 0.00 C ATOM 0 HA PRO A 121 -2.091 2.482 -13.643 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.434 3.409 -12.474 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.909 3.499 -11.616 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.341 5.650 -13.163 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.531 5.764 -11.613 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.339 6.612 -13.910 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.404 5.948 -12.585 1.00 0.00 H new ATOM 1833 N SER A 122 -4.261 4.061 -15.499 1.00 0.00 N ATOM 1834 CA SER A 122 -5.232 3.863 -16.568 1.00 0.00 C ATOM 1835 C SER A 122 -4.534 3.729 -17.919 1.00 0.00 C ATOM 1836 O SER A 122 -3.921 4.677 -18.409 1.00 0.00 O ATOM 1837 CB SER A 122 -6.224 5.027 -16.607 1.00 0.00 C ATOM 1838 OG SER A 122 -7.010 5.067 -15.429 1.00 0.00 O ATOM 0 H SER A 122 -4.072 5.038 -15.277 1.00 0.00 H new ATOM 0 HA SER A 122 -5.774 2.939 -16.366 1.00 0.00 H new ATOM 0 HB2 SER A 122 -5.683 5.967 -16.719 1.00 0.00 H new ATOM 0 HB3 SER A 122 -6.873 4.927 -17.477 1.00 0.00 H new ATOM 0 HG SER A 122 -7.635 5.821 -15.478 1.00 0.00 H new ATOM 1844 N SER A 123 -4.632 2.545 -18.514 1.00 0.00 N ATOM 1845 CA SER A 123 -4.008 2.285 -19.805 1.00 0.00 C ATOM 1846 C SER A 123 -4.743 1.175 -20.551 1.00 0.00 C ATOM 1847 O SER A 123 -5.421 0.347 -19.943 1.00 0.00 O ATOM 1848 CB SER A 123 -2.538 1.901 -19.617 1.00 0.00 C ATOM 1849 OG SER A 123 -1.812 2.057 -20.824 1.00 0.00 O ATOM 0 H SER A 123 -5.138 1.751 -18.122 1.00 0.00 H new ATOM 0 HA SER A 123 -4.065 3.198 -20.398 1.00 0.00 H new ATOM 0 HB2 SER A 123 -2.093 2.521 -18.839 1.00 0.00 H new ATOM 0 HB3 SER A 123 -2.469 0.867 -19.279 1.00 0.00 H new ATOM 0 HG SER A 123 -0.876 1.807 -20.677 1.00 0.00 H new ATOM 1855 N GLY A 124 -4.604 1.166 -21.873 1.00 0.00 N ATOM 1856 CA GLY A 124 -5.260 0.155 -22.681 1.00 0.00 C ATOM 1857 C GLY A 124 -4.353 -0.406 -23.758 1.00 0.00 C ATOM 1858 O GLY A 124 -3.351 0.212 -24.119 1.00 0.00 O ATOM 0 H GLY A 124 -4.049 1.841 -22.399 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -5.599 -0.656 -22.037 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -6.147 0.585 -23.146 1.00 0.00 H new TER 1862 GLY A 124