USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 946 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 37 THR OG1 : rot -76:sc= 0.0143 USER MOD Set 1.2: A 69 THR OG1 : rot 180:sc= 0.0148 USER MOD Set 2.1: A 12 MET CE :methyl 159:sc= -0.189 (180deg=-0.951) USER MOD Set 2.2: A 67 SER OG : rot -68:sc= 0.208 USER MOD Set 2.3: A 68 THR OG1 : rot 29:sc= 0.434 USER MOD Set 3.1: A 63 LYS NZ :NH3+ -153:sc= 0.376 (180deg=0) USER MOD Set 3.2: A 65 THR OG1 : rot 100:sc= 0.271 USER MOD Single : A 1 GLY N :NH3+ 134:sc= 0.109 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 130:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.263 USER MOD Single : A 19 GLN : amide:sc= 0.572 K(o=0.57,f=-2.7!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.171 USER MOD Single : A 28 LYS NZ :NH3+ 177:sc= 0.926 (180deg=0.92) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.548 K(o=-0.55,f=-3.9!) USER MOD Single : A 38 GLN : amide:sc= 0.438 X(o=0.44,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0.0879 USER MOD Single : A 50 SER OG : rot 130:sc= 0.0256 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 168:sc= -1.24 (180deg=-1.59!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.399 K(o=-0.4,f=-3.6) USER MOD Single : A 93 MET CE :methyl -167:sc= -3.12 (180deg=-3.84!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.487 F(o=-2.2!,f=-0.49) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0347) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 30:sc= 0.0343 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 141:sc= 1.29 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.0215 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 130:sc= -0.269 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 32.051 -16.507 -7.772 1.00 0.00 N ATOM 2 CA GLY A 1 32.971 -15.650 -7.014 1.00 0.00 C ATOM 3 C GLY A 1 32.278 -14.323 -6.849 1.00 0.00 C ATOM 4 O GLY A 1 31.651 -13.882 -7.805 1.00 0.00 O ATOM 0 H1 GLY A 1 32.573 -16.993 -8.529 1.00 0.00 H new ATOM 0 H2 GLY A 1 31.629 -17.212 -7.135 1.00 0.00 H new ATOM 0 H3 GLY A 1 31.298 -15.924 -8.190 1.00 0.00 H new ATOM 0 HA2 GLY A 1 33.202 -16.091 -6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 1 33.916 -15.531 -7.544 1.00 0.00 H new ATOM 8 N ASP A 2 32.332 -13.746 -5.655 1.00 0.00 N ATOM 9 CA ASP A 2 31.547 -12.589 -5.262 1.00 0.00 C ATOM 10 C ASP A 2 32.457 -11.803 -4.335 1.00 0.00 C ATOM 11 O ASP A 2 32.931 -12.376 -3.351 1.00 0.00 O ATOM 12 CB ASP A 2 30.274 -13.067 -4.556 1.00 0.00 C ATOM 13 CG ASP A 2 29.405 -11.922 -4.042 1.00 0.00 C ATOM 14 OD1 ASP A 2 29.344 -10.861 -4.704 1.00 0.00 O ATOM 15 OD2 ASP A 2 28.684 -12.143 -3.047 1.00 0.00 O ATOM 0 H ASP A 2 32.944 -14.083 -4.912 1.00 0.00 H new ATOM 0 HA ASP A 2 31.224 -11.971 -6.100 1.00 0.00 H new ATOM 0 HB2 ASP A 2 29.690 -13.676 -5.246 1.00 0.00 H new ATOM 0 HB3 ASP A 2 30.550 -13.709 -3.719 1.00 0.00 H new ATOM 20 N ASP A 3 32.824 -10.594 -4.746 1.00 0.00 N ATOM 21 CA ASP A 3 33.928 -9.806 -4.205 1.00 0.00 C ATOM 22 C ASP A 3 33.543 -8.350 -4.477 1.00 0.00 C ATOM 23 O ASP A 3 33.833 -7.796 -5.537 1.00 0.00 O ATOM 24 CB ASP A 3 35.237 -10.239 -4.897 1.00 0.00 C ATOM 25 CG ASP A 3 36.502 -9.629 -4.285 1.00 0.00 C ATOM 26 OD1 ASP A 3 36.433 -9.134 -3.139 1.00 0.00 O ATOM 27 OD2 ASP A 3 37.562 -9.765 -4.942 1.00 0.00 O ATOM 0 H ASP A 3 32.337 -10.113 -5.502 1.00 0.00 H new ATOM 0 HA ASP A 3 34.098 -9.946 -3.138 1.00 0.00 H new ATOM 0 HB2 ASP A 3 35.314 -11.325 -4.856 1.00 0.00 H new ATOM 0 HB3 ASP A 3 35.187 -9.963 -5.950 1.00 0.00 H new ATOM 32 N ASP A 4 32.677 -7.810 -3.615 1.00 0.00 N ATOM 33 CA ASP A 4 31.839 -6.641 -3.873 1.00 0.00 C ATOM 34 C ASP A 4 31.414 -6.064 -2.515 1.00 0.00 C ATOM 35 O ASP A 4 31.134 -6.837 -1.592 1.00 0.00 O ATOM 36 CB ASP A 4 30.553 -7.085 -4.606 1.00 0.00 C ATOM 37 CG ASP A 4 30.580 -7.041 -6.137 1.00 0.00 C ATOM 38 OD1 ASP A 4 30.504 -5.926 -6.703 1.00 0.00 O ATOM 39 OD2 ASP A 4 30.455 -8.112 -6.783 1.00 0.00 O ATOM 0 H ASP A 4 32.537 -8.193 -2.680 1.00 0.00 H new ATOM 0 HA ASP A 4 32.386 -5.914 -4.473 1.00 0.00 H new ATOM 0 HB2 ASP A 4 30.322 -8.105 -4.300 1.00 0.00 H new ATOM 0 HB3 ASP A 4 29.732 -6.456 -4.263 1.00 0.00 H new ATOM 44 N GLU A 5 31.246 -4.741 -2.408 1.00 0.00 N ATOM 45 CA GLU A 5 30.606 -4.081 -1.262 1.00 0.00 C ATOM 46 C GLU A 5 30.005 -2.731 -1.705 1.00 0.00 C ATOM 47 O GLU A 5 30.500 -1.660 -1.353 1.00 0.00 O ATOM 48 CB GLU A 5 31.547 -3.943 -0.039 1.00 0.00 C ATOM 49 CG GLU A 5 32.937 -3.304 -0.269 1.00 0.00 C ATOM 50 CD GLU A 5 33.547 -2.721 1.016 1.00 0.00 C ATOM 51 OE1 GLU A 5 33.204 -3.216 2.116 1.00 0.00 O ATOM 52 OE2 GLU A 5 34.349 -1.764 0.897 1.00 0.00 O ATOM 0 H GLU A 5 31.556 -4.087 -3.127 1.00 0.00 H new ATOM 0 HA GLU A 5 29.794 -4.721 -0.917 1.00 0.00 H new ATOM 0 HB2 GLU A 5 31.029 -3.355 0.718 1.00 0.00 H new ATOM 0 HB3 GLU A 5 31.700 -4.938 0.380 1.00 0.00 H new ATOM 0 HG2 GLU A 5 33.613 -4.055 -0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 5 32.849 -2.514 -1.015 1.00 0.00 H new ATOM 59 N PRO A 6 28.934 -2.736 -2.521 1.00 0.00 N ATOM 60 CA PRO A 6 28.381 -1.506 -3.069 1.00 0.00 C ATOM 61 C PRO A 6 27.789 -0.587 -1.991 1.00 0.00 C ATOM 62 O PRO A 6 26.992 -1.005 -1.141 1.00 0.00 O ATOM 63 CB PRO A 6 27.359 -1.946 -4.110 1.00 0.00 C ATOM 64 CG PRO A 6 26.964 -3.363 -3.700 1.00 0.00 C ATOM 65 CD PRO A 6 28.245 -3.898 -3.067 1.00 0.00 C ATOM 0 HA PRO A 6 29.158 -0.891 -3.523 1.00 0.00 H new ATOM 0 HB2 PRO A 6 26.494 -1.282 -4.120 1.00 0.00 H new ATOM 0 HB3 PRO A 6 27.785 -1.929 -5.113 1.00 0.00 H new ATOM 0 HG2 PRO A 6 26.133 -3.364 -2.995 1.00 0.00 H new ATOM 0 HG3 PRO A 6 26.655 -3.961 -4.557 1.00 0.00 H new ATOM 0 HD2 PRO A 6 28.021 -4.623 -2.285 1.00 0.00 H new ATOM 0 HD3 PRO A 6 28.863 -4.407 -3.806 1.00 0.00 H new ATOM 73 N GLY A 7 28.154 0.695 -2.075 1.00 0.00 N ATOM 74 CA GLY A 7 27.713 1.762 -1.194 1.00 0.00 C ATOM 75 C GLY A 7 26.287 2.182 -1.541 1.00 0.00 C ATOM 76 O GLY A 7 25.329 1.515 -1.158 1.00 0.00 O ATOM 0 H GLY A 7 28.796 1.025 -2.796 1.00 0.00 H new ATOM 0 HA2 GLY A 7 27.759 1.429 -0.157 1.00 0.00 H new ATOM 0 HA3 GLY A 7 28.383 2.617 -1.284 1.00 0.00 H new ATOM 80 N GLY A 8 26.129 3.266 -2.303 1.00 0.00 N ATOM 81 CA GLY A 8 24.890 3.647 -2.957 1.00 0.00 C ATOM 82 C GLY A 8 24.197 4.784 -2.221 1.00 0.00 C ATOM 83 O GLY A 8 24.387 5.000 -1.021 1.00 0.00 O ATOM 0 H GLY A 8 26.890 3.921 -2.484 1.00 0.00 H new ATOM 0 HA2 GLY A 8 25.097 3.950 -3.983 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.224 2.786 -3.007 1.00 0.00 H new ATOM 87 N LYS A 9 23.348 5.520 -2.939 1.00 0.00 N ATOM 88 CA LYS A 9 22.635 6.681 -2.447 1.00 0.00 C ATOM 89 C LYS A 9 21.177 6.518 -2.856 1.00 0.00 C ATOM 90 O LYS A 9 20.884 6.028 -3.952 1.00 0.00 O ATOM 91 CB LYS A 9 23.240 7.975 -3.009 1.00 0.00 C ATOM 92 CG LYS A 9 24.719 8.132 -2.641 1.00 0.00 C ATOM 93 CD LYS A 9 25.337 9.415 -3.198 1.00 0.00 C ATOM 94 CE LYS A 9 26.845 9.353 -2.938 1.00 0.00 C ATOM 95 NZ LYS A 9 27.564 10.560 -3.388 1.00 0.00 N ATOM 0 H LYS A 9 23.136 5.309 -3.914 1.00 0.00 H new ATOM 0 HA LYS A 9 22.714 6.754 -1.362 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.135 7.981 -4.094 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.681 8.830 -2.629 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.821 8.127 -1.556 1.00 0.00 H new ATOM 0 HG3 LYS A 9 25.275 7.273 -3.017 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.136 9.505 -4.265 1.00 0.00 H new ATOM 0 HD3 LYS A 9 24.901 10.290 -2.717 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.017 9.212 -1.871 1.00 0.00 H new ATOM 0 HE3 LYS A 9 27.259 8.482 -3.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 28.579 10.456 -3.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 27.427 10.684 -4.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 27.194 11.392 -2.886 1.00 0.00 H new ATOM 109 N GLY A 10 20.290 6.831 -1.925 1.00 0.00 N ATOM 110 CA GLY A 10 18.842 6.708 -1.987 1.00 0.00 C ATOM 111 C GLY A 10 18.289 6.873 -0.574 1.00 0.00 C ATOM 112 O GLY A 10 18.657 7.831 0.116 1.00 0.00 O ATOM 0 H GLY A 10 20.592 7.211 -1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 10 18.424 7.466 -2.650 1.00 0.00 H new ATOM 0 HA3 GLY A 10 18.560 5.737 -2.395 1.00 0.00 H new ATOM 116 N ALA A 11 17.419 5.962 -0.139 1.00 0.00 N ATOM 117 CA ALA A 11 16.839 5.938 1.207 1.00 0.00 C ATOM 118 C ALA A 11 16.436 4.494 1.573 1.00 0.00 C ATOM 119 O ALA A 11 17.013 3.536 1.067 1.00 0.00 O ATOM 120 CB ALA A 11 15.661 6.935 1.289 1.00 0.00 C ATOM 0 H ALA A 11 17.088 5.198 -0.728 1.00 0.00 H new ATOM 0 HA ALA A 11 17.575 6.260 1.944 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.234 6.912 2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.020 7.941 1.070 1.00 0.00 H new ATOM 0 HB3 ALA A 11 14.897 6.656 0.563 1.00 0.00 H new ATOM 126 N MET A 12 15.502 4.342 2.507 1.00 0.00 N ATOM 127 CA MET A 12 14.606 3.210 2.678 1.00 0.00 C ATOM 128 C MET A 12 13.208 3.799 2.586 1.00 0.00 C ATOM 129 O MET A 12 13.060 5.001 2.847 1.00 0.00 O ATOM 130 CB MET A 12 14.773 2.577 4.068 1.00 0.00 C ATOM 131 CG MET A 12 16.207 2.097 4.269 1.00 0.00 C ATOM 132 SD MET A 12 16.509 0.866 5.561 1.00 0.00 S ATOM 133 CE MET A 12 15.408 -0.450 4.987 1.00 0.00 C ATOM 0 H MET A 12 15.343 5.060 3.214 1.00 0.00 H new ATOM 0 HA MET A 12 14.805 2.438 1.935 1.00 0.00 H new ATOM 0 HB2 MET A 12 14.516 3.304 4.838 1.00 0.00 H new ATOM 0 HB3 MET A 12 14.084 1.739 4.177 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.558 1.684 3.323 1.00 0.00 H new ATOM 0 HG3 MET A 12 16.825 2.968 4.485 1.00 0.00 H new ATOM 0 HE1 MET A 12 15.722 -1.401 5.418 1.00 0.00 H new ATOM 0 HE2 MET A 12 14.386 -0.231 5.297 1.00 0.00 H new ATOM 0 HE3 MET A 12 15.451 -0.512 3.900 1.00 0.00 H new ATOM 143 N TYR A 13 12.201 2.966 2.333 1.00 0.00 N ATOM 144 CA TYR A 13 10.807 3.349 2.472 1.00 0.00 C ATOM 145 C TYR A 13 10.053 2.258 3.219 1.00 0.00 C ATOM 146 O TYR A 13 10.415 1.081 3.163 1.00 0.00 O ATOM 147 CB TYR A 13 10.167 3.627 1.111 1.00 0.00 C ATOM 148 CG TYR A 13 10.698 4.841 0.377 1.00 0.00 C ATOM 149 CD1 TYR A 13 10.604 6.118 0.957 1.00 0.00 C ATOM 150 CD2 TYR A 13 11.252 4.699 -0.907 1.00 0.00 C ATOM 151 CE1 TYR A 13 11.094 7.235 0.266 1.00 0.00 C ATOM 152 CE2 TYR A 13 11.701 5.818 -1.632 1.00 0.00 C ATOM 153 CZ TYR A 13 11.634 7.097 -1.033 1.00 0.00 C ATOM 154 OH TYR A 13 12.090 8.210 -1.671 1.00 0.00 O ATOM 0 H TYR A 13 12.335 2.003 2.025 1.00 0.00 H new ATOM 0 HA TYR A 13 10.754 4.274 3.045 1.00 0.00 H new ATOM 0 HB2 TYR A 13 10.307 2.751 0.477 1.00 0.00 H new ATOM 0 HB3 TYR A 13 9.093 3.750 1.252 1.00 0.00 H new ATOM 0 HD1 TYR A 13 10.156 6.238 1.932 1.00 0.00 H new ATOM 0 HD2 TYR A 13 11.334 3.715 -1.344 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.059 8.209 0.730 1.00 0.00 H new ATOM 0 HE2 TYR A 13 12.091 5.702 -2.632 1.00 0.00 H new ATOM 0 HH TYR A 13 12.992 8.043 -2.015 1.00 0.00 H new ATOM 164 N GLU A 14 8.996 2.662 3.912 1.00 0.00 N ATOM 165 CA GLU A 14 8.149 1.826 4.741 1.00 0.00 C ATOM 166 C GLU A 14 6.754 2.428 4.643 1.00 0.00 C ATOM 167 O GLU A 14 6.573 3.620 4.889 1.00 0.00 O ATOM 168 CB GLU A 14 8.761 1.790 6.150 1.00 0.00 C ATOM 169 CG GLU A 14 7.878 1.311 7.314 1.00 0.00 C ATOM 170 CD GLU A 14 8.678 1.343 8.625 1.00 0.00 C ATOM 171 OE1 GLU A 14 9.849 0.890 8.645 1.00 0.00 O ATOM 172 OE2 GLU A 14 8.175 1.874 9.647 1.00 0.00 O ATOM 0 H GLU A 14 8.693 3.636 3.908 1.00 0.00 H new ATOM 0 HA GLU A 14 8.076 0.783 4.432 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.641 1.148 6.114 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.109 2.795 6.388 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.997 1.948 7.400 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.522 0.299 7.120 1.00 0.00 H new ATOM 179 N VAL A 15 5.788 1.638 4.186 1.00 0.00 N ATOM 180 CA VAL A 15 4.458 2.086 3.807 1.00 0.00 C ATOM 181 C VAL A 15 3.427 1.315 4.623 1.00 0.00 C ATOM 182 O VAL A 15 3.630 0.133 4.921 1.00 0.00 O ATOM 183 CB VAL A 15 4.300 1.938 2.276 1.00 0.00 C ATOM 184 CG1 VAL A 15 4.420 0.495 1.763 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.977 2.517 1.784 1.00 0.00 C ATOM 0 H VAL A 15 5.917 0.633 4.066 1.00 0.00 H new ATOM 0 HA VAL A 15 4.300 3.141 4.032 1.00 0.00 H new ATOM 0 HB VAL A 15 5.138 2.504 1.869 1.00 0.00 H new ATOM 0 HG11 VAL A 15 4.297 0.482 0.680 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.402 0.098 2.021 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.647 -0.120 2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 15 2.905 2.393 0.703 1.00 0.00 H new ATOM 0 HG22 VAL A 15 2.150 1.995 2.265 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.929 3.577 2.032 1.00 0.00 H new ATOM 195 N THR A 16 2.317 1.966 4.968 1.00 0.00 N ATOM 196 CA THR A 16 1.205 1.326 5.648 1.00 0.00 C ATOM 197 C THR A 16 -0.044 1.382 4.797 1.00 0.00 C ATOM 198 O THR A 16 -0.157 2.162 3.842 1.00 0.00 O ATOM 199 CB THR A 16 0.983 1.952 7.043 1.00 0.00 C ATOM 200 OG1 THR A 16 0.696 3.334 6.970 1.00 0.00 O ATOM 201 CG2 THR A 16 2.184 1.779 7.977 1.00 0.00 C ATOM 0 H THR A 16 2.169 2.957 4.780 1.00 0.00 H new ATOM 0 HA THR A 16 1.448 0.274 5.801 1.00 0.00 H new ATOM 0 HB THR A 16 0.129 1.410 7.449 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.561 3.688 7.874 1.00 0.00 H new ATOM 0 HG21 THR A 16 1.965 2.240 8.940 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.384 0.717 8.120 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.059 2.257 7.537 1.00 0.00 H new ATOM 209 N ILE A 17 -0.987 0.526 5.166 1.00 0.00 N ATOM 210 CA ILE A 17 -2.351 0.600 4.723 1.00 0.00 C ATOM 211 C ILE A 17 -3.211 0.149 5.885 1.00 0.00 C ATOM 212 O ILE A 17 -3.423 -1.044 6.058 1.00 0.00 O ATOM 213 CB ILE A 17 -2.503 -0.190 3.406 1.00 0.00 C ATOM 214 CG1 ILE A 17 -3.961 -0.379 2.946 1.00 0.00 C ATOM 215 CG2 ILE A 17 -1.844 -1.572 3.368 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.787 0.900 2.868 1.00 0.00 C ATOM 0 H ILE A 17 -0.809 -0.255 5.798 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.682 1.606 4.463 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.966 0.470 2.725 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -3.957 -0.851 1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.454 -1.070 3.629 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.017 -2.031 2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -0.772 -1.469 3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.273 -2.201 4.148 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.797 0.661 2.535 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.830 1.366 3.852 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.325 1.589 2.161 1.00 0.00 H new ATOM 228 N GLU A 18 -3.640 1.084 6.731 1.00 0.00 N ATOM 229 CA GLU A 18 -4.745 0.825 7.643 1.00 0.00 C ATOM 230 C GLU A 18 -6.034 0.869 6.822 1.00 0.00 C ATOM 231 O GLU A 18 -6.234 1.777 6.004 1.00 0.00 O ATOM 232 CB GLU A 18 -4.780 1.859 8.780 1.00 0.00 C ATOM 233 CG GLU A 18 -3.863 1.479 9.951 1.00 0.00 C ATOM 234 CD GLU A 18 -4.166 2.225 11.257 1.00 0.00 C ATOM 235 OE1 GLU A 18 -4.867 3.265 11.262 1.00 0.00 O ATOM 236 OE2 GLU A 18 -3.703 1.736 12.312 1.00 0.00 O ATOM 0 H GLU A 18 -3.241 2.020 6.802 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.626 -0.151 8.113 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.482 2.832 8.390 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.803 1.961 9.142 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.947 0.407 10.130 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.829 1.674 9.666 1.00 0.00 H new ATOM 243 N GLN A 19 -6.880 -0.137 7.032 1.00 0.00 N ATOM 244 CA GLN A 19 -8.156 -0.342 6.385 1.00 0.00 C ATOM 245 C GLN A 19 -9.221 -0.159 7.446 1.00 0.00 C ATOM 246 O GLN A 19 -9.304 -0.933 8.405 1.00 0.00 O ATOM 247 CB GLN A 19 -8.216 -1.746 5.783 1.00 0.00 C ATOM 248 CG GLN A 19 -7.451 -1.773 4.452 1.00 0.00 C ATOM 249 CD GLN A 19 -6.999 -3.150 3.955 1.00 0.00 C ATOM 250 OE1 GLN A 19 -5.979 -3.242 3.283 1.00 0.00 O ATOM 251 NE2 GLN A 19 -7.736 -4.217 4.179 1.00 0.00 N ATOM 0 H GLN A 19 -6.670 -0.874 7.705 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.308 0.366 5.570 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.784 -2.468 6.476 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.254 -2.039 5.623 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.082 -1.323 3.686 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.570 -1.139 4.551 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.586 -4.142 4.738 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.458 -5.119 3.793 1.00 0.00 H new ATOM 260 N SER A 20 -9.988 0.912 7.321 1.00 0.00 N ATOM 261 CA SER A 20 -11.056 1.221 8.251 1.00 0.00 C ATOM 262 C SER A 20 -12.349 0.526 7.808 1.00 0.00 C ATOM 263 O SER A 20 -12.387 -0.101 6.744 1.00 0.00 O ATOM 264 CB SER A 20 -11.228 2.752 8.300 1.00 0.00 C ATOM 265 OG SER A 20 -9.983 3.441 8.228 1.00 0.00 O ATOM 0 H SER A 20 -9.885 1.592 6.568 1.00 0.00 H new ATOM 0 HA SER A 20 -10.814 0.858 9.250 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.864 3.070 7.474 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.740 3.028 9.222 1.00 0.00 H new ATOM 0 HG SER A 20 -10.142 4.408 8.261 1.00 0.00 H new ATOM 271 N GLY A 21 -13.417 0.683 8.593 1.00 0.00 N ATOM 272 CA GLY A 21 -14.776 0.399 8.156 1.00 0.00 C ATOM 273 C GLY A 21 -14.949 -1.029 7.663 1.00 0.00 C ATOM 274 O GLY A 21 -14.542 -1.976 8.342 1.00 0.00 O ATOM 0 H GLY A 21 -13.357 1.013 9.556 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.464 0.579 8.982 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.048 1.090 7.358 1.00 0.00 H new ATOM 278 N ASP A 22 -15.616 -1.189 6.520 1.00 0.00 N ATOM 279 CA ASP A 22 -16.200 -2.456 6.086 1.00 0.00 C ATOM 280 C ASP A 22 -15.300 -3.256 5.135 1.00 0.00 C ATOM 281 O ASP A 22 -15.772 -3.885 4.192 1.00 0.00 O ATOM 282 CB ASP A 22 -17.622 -2.204 5.561 1.00 0.00 C ATOM 283 CG ASP A 22 -18.577 -3.314 5.989 1.00 0.00 C ATOM 284 OD1 ASP A 22 -18.686 -3.452 7.229 1.00 0.00 O ATOM 285 OD2 ASP A 22 -19.217 -4.062 5.215 1.00 0.00 O ATOM 0 H ASP A 22 -15.768 -0.427 5.859 1.00 0.00 H new ATOM 0 HA ASP A 22 -16.279 -3.118 6.948 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -17.985 -1.246 5.933 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.604 -2.137 4.473 1.00 0.00 H new ATOM 290 N PHE A 23 -13.989 -3.244 5.399 1.00 0.00 N ATOM 291 CA PHE A 23 -12.879 -3.603 4.506 1.00 0.00 C ATOM 292 C PHE A 23 -12.853 -4.987 3.844 1.00 0.00 C ATOM 293 O PHE A 23 -11.883 -5.326 3.160 1.00 0.00 O ATOM 294 CB PHE A 23 -11.555 -3.342 5.238 1.00 0.00 C ATOM 295 CG PHE A 23 -11.292 -4.159 6.491 1.00 0.00 C ATOM 296 CD1 PHE A 23 -10.871 -5.501 6.404 1.00 0.00 C ATOM 297 CD2 PHE A 23 -11.407 -3.545 7.754 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.565 -6.217 7.574 1.00 0.00 C ATOM 299 CE2 PHE A 23 -11.082 -4.257 8.919 1.00 0.00 C ATOM 300 CZ PHE A 23 -10.653 -5.592 8.828 1.00 0.00 C ATOM 0 H PHE A 23 -13.648 -2.960 6.317 1.00 0.00 H new ATOM 0 HA PHE A 23 -13.043 -2.958 3.642 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -10.739 -3.521 4.538 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.518 -2.286 5.507 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.784 -5.979 5.439 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.747 -2.522 7.826 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.261 -7.251 7.508 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -11.162 -3.779 9.884 1.00 0.00 H new ATOM 0 HZ PHE A 23 -10.391 -6.137 9.723 1.00 0.00 H new ATOM 310 N ARG A 24 -13.880 -5.802 4.027 1.00 0.00 N ATOM 311 CA ARG A 24 -13.854 -7.248 3.944 1.00 0.00 C ATOM 312 C ARG A 24 -14.694 -7.801 2.785 1.00 0.00 C ATOM 313 O ARG A 24 -15.037 -8.985 2.805 1.00 0.00 O ATOM 314 CB ARG A 24 -14.209 -7.793 5.332 1.00 0.00 C ATOM 315 CG ARG A 24 -15.396 -7.145 6.047 1.00 0.00 C ATOM 316 CD ARG A 24 -16.704 -7.187 5.248 1.00 0.00 C ATOM 317 NE ARG A 24 -17.791 -6.477 5.928 1.00 0.00 N ATOM 318 CZ ARG A 24 -18.551 -6.921 6.928 1.00 0.00 C ATOM 319 NH1 ARG A 24 -18.439 -8.156 7.393 1.00 0.00 N ATOM 320 NH2 ARG A 24 -19.428 -6.099 7.481 1.00 0.00 N ATOM 0 H ARG A 24 -14.809 -5.446 4.251 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.856 -7.601 3.684 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -14.412 -8.860 5.236 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -13.332 -7.692 5.971 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.550 -7.647 7.002 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.151 -6.106 6.268 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -16.542 -6.744 4.265 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -16.996 -8.225 5.086 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.989 -5.533 5.597 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -17.757 -8.795 6.984 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -19.035 -8.468 8.160 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.514 -5.141 7.141 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -20.018 -6.423 8.248 1.00 0.00 H new ATOM 334 N SER A 25 -15.111 -6.953 1.841 1.00 0.00 N ATOM 335 CA SER A 25 -16.088 -7.307 0.812 1.00 0.00 C ATOM 336 C SER A 25 -15.898 -6.523 -0.498 1.00 0.00 C ATOM 337 O SER A 25 -16.861 -6.381 -1.254 1.00 0.00 O ATOM 338 CB SER A 25 -17.497 -7.087 1.388 1.00 0.00 C ATOM 339 OG SER A 25 -17.735 -7.945 2.487 1.00 0.00 O ATOM 0 H SER A 25 -14.776 -5.992 1.770 1.00 0.00 H new ATOM 0 HA SER A 25 -15.942 -8.354 0.547 1.00 0.00 H new ATOM 0 HB2 SER A 25 -17.607 -6.049 1.702 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.243 -7.267 0.613 1.00 0.00 H new ATOM 0 HG SER A 25 -18.636 -7.786 2.837 1.00 0.00 H new ATOM 345 N PHE A 26 -14.696 -6.002 -0.777 1.00 0.00 N ATOM 346 CA PHE A 26 -14.404 -5.182 -1.957 1.00 0.00 C ATOM 347 C PHE A 26 -13.085 -5.661 -2.565 1.00 0.00 C ATOM 348 O PHE A 26 -12.115 -5.804 -1.821 1.00 0.00 O ATOM 349 CB PHE A 26 -14.308 -3.701 -1.562 1.00 0.00 C ATOM 350 CG PHE A 26 -15.490 -3.161 -0.777 1.00 0.00 C ATOM 351 CD1 PHE A 26 -16.783 -3.162 -1.335 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.299 -2.692 0.537 1.00 0.00 C ATOM 353 CE1 PHE A 26 -17.877 -2.712 -0.573 1.00 0.00 C ATOM 354 CE2 PHE A 26 -16.391 -2.223 1.291 1.00 0.00 C ATOM 355 CZ PHE A 26 -17.682 -2.239 0.736 1.00 0.00 C ATOM 0 H PHE A 26 -13.884 -6.142 -0.176 1.00 0.00 H new ATOM 0 HA PHE A 26 -15.205 -5.283 -2.690 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.404 -3.558 -0.970 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -14.193 -3.107 -2.469 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.935 -3.508 -2.347 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.309 -2.692 0.969 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.871 -2.730 -0.996 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.237 -1.852 2.293 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.524 -1.888 1.315 1.00 0.00 H new ATOM 365 N ILE A 27 -13.017 -5.930 -3.877 1.00 0.00 N ATOM 366 CA ILE A 27 -11.797 -6.455 -4.514 1.00 0.00 C ATOM 367 C ILE A 27 -10.691 -5.390 -4.520 1.00 0.00 C ATOM 368 O ILE A 27 -10.638 -4.560 -5.436 1.00 0.00 O ATOM 369 CB ILE A 27 -12.019 -7.017 -5.947 1.00 0.00 C ATOM 370 CG1 ILE A 27 -13.393 -7.666 -6.211 1.00 0.00 C ATOM 371 CG2 ILE A 27 -10.907 -8.044 -6.238 1.00 0.00 C ATOM 372 CD1 ILE A 27 -14.351 -6.699 -6.918 1.00 0.00 C ATOM 0 H ILE A 27 -13.796 -5.792 -4.521 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.488 -7.305 -3.906 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.987 -6.155 -6.614 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -13.262 -8.560 -6.821 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.832 -7.987 -5.266 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -11.042 -8.453 -7.239 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.935 -7.556 -6.173 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.957 -8.851 -5.507 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -15.308 -7.193 -7.086 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -14.503 -5.817 -6.296 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -13.924 -6.399 -7.875 1.00 0.00 H new ATOM 384 N LYS A 28 -9.812 -5.375 -3.515 1.00 0.00 N ATOM 385 CA LYS A 28 -8.642 -4.494 -3.516 1.00 0.00 C ATOM 386 C LYS A 28 -7.468 -5.166 -4.217 1.00 0.00 C ATOM 387 O LYS A 28 -7.330 -6.386 -4.169 1.00 0.00 O ATOM 388 CB LYS A 28 -8.253 -4.033 -2.102 1.00 0.00 C ATOM 389 CG LYS A 28 -8.034 -5.159 -1.085 1.00 0.00 C ATOM 390 CD LYS A 28 -9.199 -5.269 -0.095 1.00 0.00 C ATOM 391 CE LYS A 28 -9.187 -6.600 0.661 1.00 0.00 C ATOM 392 NZ LYS A 28 -10.515 -6.901 1.227 1.00 0.00 N ATOM 0 H LYS A 28 -9.889 -5.966 -2.687 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.914 -3.597 -4.072 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.339 -3.442 -2.168 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.033 -3.372 -1.725 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.914 -6.106 -1.612 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.108 -4.979 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.147 -4.447 0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -10.142 -5.166 -0.632 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.885 -7.402 -0.013 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.448 -6.561 1.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.492 -7.832 1.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.768 -6.173 1.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.223 -6.911 0.465 1.00 0.00 H new ATOM 406 N SER A 29 -6.598 -4.350 -4.803 1.00 0.00 N ATOM 407 CA SER A 29 -5.318 -4.722 -5.358 1.00 0.00 C ATOM 408 C SER A 29 -4.332 -3.610 -4.997 1.00 0.00 C ATOM 409 O SER A 29 -4.747 -2.450 -4.892 1.00 0.00 O ATOM 410 CB SER A 29 -5.460 -4.814 -6.875 1.00 0.00 C ATOM 411 OG SER A 29 -6.459 -5.740 -7.267 1.00 0.00 O ATOM 0 H SER A 29 -6.787 -3.353 -4.905 1.00 0.00 H new ATOM 0 HA SER A 29 -4.971 -5.680 -4.971 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.703 -3.830 -7.275 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.505 -5.108 -7.310 1.00 0.00 H new ATOM 0 HG SER A 29 -6.516 -5.765 -8.245 1.00 0.00 H new ATOM 417 N VAL A 30 -3.047 -3.934 -4.843 1.00 0.00 N ATOM 418 CA VAL A 30 -1.983 -2.987 -4.525 1.00 0.00 C ATOM 419 C VAL A 30 -0.750 -3.387 -5.338 1.00 0.00 C ATOM 420 O VAL A 30 -0.209 -4.473 -5.126 1.00 0.00 O ATOM 421 CB VAL A 30 -1.699 -2.987 -3.002 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.577 -2.003 -2.652 1.00 0.00 C ATOM 423 CG2 VAL A 30 -2.934 -2.615 -2.161 1.00 0.00 C ATOM 0 H VAL A 30 -2.710 -4.892 -4.940 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.274 -1.970 -4.786 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.406 -4.009 -2.761 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.398 -2.023 -1.577 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.334 -2.289 -3.177 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.869 -0.997 -2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.672 -2.632 -1.103 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.273 -1.616 -2.435 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.732 -3.333 -2.349 1.00 0.00 H new ATOM 433 N VAL A 31 -0.301 -2.548 -6.277 1.00 0.00 N ATOM 434 CA VAL A 31 1.041 -2.698 -6.844 1.00 0.00 C ATOM 435 C VAL A 31 2.052 -2.226 -5.788 1.00 0.00 C ATOM 436 O VAL A 31 1.769 -1.307 -5.011 1.00 0.00 O ATOM 437 CB VAL A 31 1.178 -1.938 -8.190 1.00 0.00 C ATOM 438 CG1 VAL A 31 0.880 -0.440 -8.109 1.00 0.00 C ATOM 439 CG2 VAL A 31 2.573 -2.096 -8.827 1.00 0.00 C ATOM 0 H VAL A 31 -0.839 -1.769 -6.656 1.00 0.00 H new ATOM 0 HA VAL A 31 1.238 -3.743 -7.085 1.00 0.00 H new ATOM 0 HB VAL A 31 0.417 -2.412 -8.811 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.001 0.009 -9.095 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.143 -0.291 -7.765 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.570 0.031 -7.409 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.609 -1.543 -9.766 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.330 -1.706 -8.147 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.768 -3.151 -9.020 1.00 0.00 H new ATOM 449 N VAL A 32 3.259 -2.785 -5.805 1.00 0.00 N ATOM 450 CA VAL A 32 4.429 -2.157 -5.215 1.00 0.00 C ATOM 451 C VAL A 32 5.593 -2.316 -6.192 1.00 0.00 C ATOM 452 O VAL A 32 5.814 -3.405 -6.734 1.00 0.00 O ATOM 453 CB VAL A 32 4.666 -2.674 -3.787 1.00 0.00 C ATOM 454 CG1 VAL A 32 4.965 -4.169 -3.749 1.00 0.00 C ATOM 455 CG2 VAL A 32 5.772 -1.881 -3.075 1.00 0.00 C ATOM 0 H VAL A 32 3.450 -3.692 -6.232 1.00 0.00 H new ATOM 0 HA VAL A 32 4.293 -1.085 -5.072 1.00 0.00 H new ATOM 0 HB VAL A 32 3.732 -2.518 -3.247 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.124 -4.482 -2.717 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.123 -4.719 -4.169 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.862 -4.376 -4.333 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.912 -2.275 -2.068 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.703 -1.974 -3.633 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.487 -0.831 -3.017 1.00 0.00 H new ATOM 465 N VAL A 33 6.329 -1.231 -6.431 1.00 0.00 N ATOM 466 CA VAL A 33 7.590 -1.229 -7.164 1.00 0.00 C ATOM 467 C VAL A 33 8.671 -0.825 -6.163 1.00 0.00 C ATOM 468 O VAL A 33 8.396 -0.128 -5.182 1.00 0.00 O ATOM 469 CB VAL A 33 7.533 -0.270 -8.378 1.00 0.00 C ATOM 470 CG1 VAL A 33 8.811 -0.366 -9.229 1.00 0.00 C ATOM 471 CG2 VAL A 33 6.319 -0.566 -9.279 1.00 0.00 C ATOM 0 H VAL A 33 6.054 -0.303 -6.109 1.00 0.00 H new ATOM 0 HA VAL A 33 7.806 -2.213 -7.581 1.00 0.00 H new ATOM 0 HB VAL A 33 7.441 0.737 -7.970 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.738 0.320 -10.073 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.675 -0.101 -8.619 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.926 -1.385 -9.598 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.313 0.127 -10.120 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.383 -1.588 -9.652 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.401 -0.446 -8.704 1.00 0.00 H new ATOM 481 N ALA A 34 9.901 -1.266 -6.408 1.00 0.00 N ATOM 482 CA ALA A 34 11.078 -0.820 -5.698 1.00 0.00 C ATOM 483 C ALA A 34 12.276 -0.917 -6.636 1.00 0.00 C ATOM 484 O ALA A 34 12.260 -1.694 -7.593 1.00 0.00 O ATOM 485 CB ALA A 34 11.286 -1.704 -4.466 1.00 0.00 C ATOM 0 H ALA A 34 10.104 -1.961 -7.126 1.00 0.00 H new ATOM 0 HA ALA A 34 10.961 0.213 -5.370 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.173 -1.373 -3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.415 -1.630 -3.814 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.418 -2.740 -4.779 1.00 0.00 H new ATOM 491 N ASN A 35 13.327 -0.173 -6.307 1.00 0.00 N ATOM 492 CA ASN A 35 14.579 -0.051 -7.038 1.00 0.00 C ATOM 493 C ASN A 35 15.700 -0.392 -6.065 1.00 0.00 C ATOM 494 O ASN A 35 15.878 0.307 -5.067 1.00 0.00 O ATOM 495 CB ASN A 35 14.724 1.385 -7.570 1.00 0.00 C ATOM 496 CG ASN A 35 16.014 1.624 -8.368 1.00 0.00 C ATOM 497 OD1 ASN A 35 17.071 1.045 -8.135 1.00 0.00 O ATOM 498 ND2 ASN A 35 15.990 2.538 -9.318 1.00 0.00 N ATOM 0 H ASN A 35 13.324 0.400 -5.463 1.00 0.00 H new ATOM 0 HA ASN A 35 14.612 -0.725 -7.894 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.868 1.616 -8.204 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.694 2.078 -6.730 1.00 0.00 H new ATOM 0 HD21 ASN A 35 16.839 2.751 -9.842 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.123 3.032 -9.529 1.00 0.00 H new ATOM 505 N GLY A 36 16.447 -1.455 -6.342 1.00 0.00 N ATOM 506 CA GLY A 36 17.747 -1.734 -5.753 1.00 0.00 C ATOM 507 C GLY A 36 17.707 -2.636 -4.525 1.00 0.00 C ATOM 508 O GLY A 36 18.771 -2.922 -3.974 1.00 0.00 O ATOM 0 H GLY A 36 16.151 -2.170 -7.007 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.381 -2.198 -6.508 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.217 -0.790 -5.479 1.00 0.00 H new ATOM 512 N THR A 37 16.535 -3.077 -4.064 1.00 0.00 N ATOM 513 CA THR A 37 16.413 -4.025 -2.965 1.00 0.00 C ATOM 514 C THR A 37 15.030 -4.700 -3.031 1.00 0.00 C ATOM 515 O THR A 37 14.194 -4.327 -3.861 1.00 0.00 O ATOM 516 CB THR A 37 16.707 -3.282 -1.647 1.00 0.00 C ATOM 517 OG1 THR A 37 17.167 -4.163 -0.653 1.00 0.00 O ATOM 518 CG2 THR A 37 15.495 -2.543 -1.104 1.00 0.00 C ATOM 0 H THR A 37 15.638 -2.781 -4.449 1.00 0.00 H new ATOM 0 HA THR A 37 17.140 -4.835 -3.032 1.00 0.00 H new ATOM 0 HB THR A 37 17.480 -2.554 -1.892 1.00 0.00 H new ATOM 0 HG1 THR A 37 16.412 -4.676 -0.296 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.762 -2.039 -0.175 1.00 0.00 H new ATOM 0 HG22 THR A 37 15.161 -1.806 -1.834 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.691 -3.254 -0.913 1.00 0.00 H new ATOM 526 N GLN A 38 14.766 -5.681 -2.164 1.00 0.00 N ATOM 527 CA GLN A 38 13.521 -6.450 -2.144 1.00 0.00 C ATOM 528 C GLN A 38 12.551 -5.903 -1.097 1.00 0.00 C ATOM 529 O GLN A 38 12.851 -4.925 -0.406 1.00 0.00 O ATOM 530 CB GLN A 38 13.839 -7.943 -1.947 1.00 0.00 C ATOM 531 CG GLN A 38 13.824 -8.645 -3.310 1.00 0.00 C ATOM 532 CD GLN A 38 14.213 -10.111 -3.186 1.00 0.00 C ATOM 533 OE1 GLN A 38 15.362 -10.479 -3.399 1.00 0.00 O ATOM 534 NE2 GLN A 38 13.277 -10.967 -2.816 1.00 0.00 N ATOM 0 H GLN A 38 15.426 -5.968 -1.442 1.00 0.00 H new ATOM 0 HA GLN A 38 13.014 -6.346 -3.103 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.814 -8.060 -1.475 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.106 -8.399 -1.282 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.830 -8.567 -3.750 1.00 0.00 H new ATOM 0 HG3 GLN A 38 14.513 -8.141 -3.988 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.326 -10.640 -2.644 1.00 0.00 H new ATOM 0 HE22 GLN A 38 13.505 -11.955 -2.703 1.00 0.00 H new ATOM 543 N LEU A 39 11.348 -6.473 -1.041 1.00 0.00 N ATOM 544 CA LEU A 39 10.298 -6.089 -0.103 1.00 0.00 C ATOM 545 C LEU A 39 10.338 -7.022 1.101 1.00 0.00 C ATOM 546 O LEU A 39 10.917 -8.111 1.039 1.00 0.00 O ATOM 547 CB LEU A 39 8.931 -6.137 -0.824 1.00 0.00 C ATOM 548 CG LEU A 39 8.301 -4.780 -1.198 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.541 -4.189 -0.012 1.00 0.00 C ATOM 550 CD2 LEU A 39 9.311 -3.744 -1.706 1.00 0.00 C ATOM 0 H LEU A 39 11.071 -7.233 -1.663 1.00 0.00 H new ATOM 0 HA LEU A 39 10.453 -5.071 0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.047 -6.722 -1.736 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.229 -6.675 -0.188 1.00 0.00 H new ATOM 0 HG LEU A 39 7.620 -4.998 -2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.105 -3.232 -0.299 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.748 -4.873 0.289 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.227 -4.039 0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.791 -2.817 -1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.055 -3.551 -0.933 1.00 0.00 H new ATOM 0 HD23 LEU A 39 9.806 -4.126 -2.599 1.00 0.00 H new ATOM 562 N LYS A 40 9.720 -6.579 2.194 1.00 0.00 N ATOM 563 CA LYS A 40 9.521 -7.335 3.424 1.00 0.00 C ATOM 564 C LYS A 40 8.075 -7.149 3.836 1.00 0.00 C ATOM 565 O LYS A 40 7.606 -6.008 3.894 1.00 0.00 O ATOM 566 CB LYS A 40 10.437 -6.808 4.530 1.00 0.00 C ATOM 567 CG LYS A 40 10.395 -7.722 5.758 1.00 0.00 C ATOM 568 CD LYS A 40 11.111 -7.063 6.935 1.00 0.00 C ATOM 569 CE LYS A 40 11.118 -8.062 8.088 1.00 0.00 C ATOM 570 NZ LYS A 40 11.528 -7.450 9.365 1.00 0.00 N ATOM 0 H LYS A 40 9.327 -5.639 2.246 1.00 0.00 H new ATOM 0 HA LYS A 40 9.755 -8.387 3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.459 -6.739 4.158 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.131 -5.800 4.811 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.360 -7.935 6.026 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.867 -8.677 5.525 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.129 -6.789 6.659 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.602 -6.144 7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.122 -8.491 8.198 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.794 -8.883 7.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.516 -8.170 10.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.489 -7.063 9.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.869 -6.684 9.610 1.00 0.00 H new ATOM 584 N ASP A 41 7.395 -8.249 4.154 1.00 0.00 N ATOM 585 CA ASP A 41 5.978 -8.251 4.467 1.00 0.00 C ATOM 586 C ASP A 41 5.780 -8.320 5.970 1.00 0.00 C ATOM 587 O ASP A 41 6.198 -9.281 6.622 1.00 0.00 O ATOM 588 CB ASP A 41 5.176 -9.348 3.743 1.00 0.00 C ATOM 589 CG ASP A 41 3.753 -8.809 3.544 1.00 0.00 C ATOM 590 OD1 ASP A 41 3.120 -8.444 4.566 1.00 0.00 O ATOM 591 OD2 ASP A 41 3.349 -8.610 2.375 1.00 0.00 O ATOM 0 H ASP A 41 7.824 -9.173 4.200 1.00 0.00 H new ATOM 0 HA ASP A 41 5.574 -7.312 4.089 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.634 -9.590 2.784 1.00 0.00 H new ATOM 0 HB3 ASP A 41 5.162 -10.266 4.330 1.00 0.00 H new ATOM 596 N GLY A 42 5.130 -7.303 6.534 1.00 0.00 N ATOM 597 CA GLY A 42 4.690 -7.289 7.920 1.00 0.00 C ATOM 598 C GLY A 42 3.736 -8.428 8.287 1.00 0.00 C ATOM 599 O GLY A 42 3.453 -8.585 9.474 1.00 0.00 O ATOM 0 H GLY A 42 4.892 -6.451 6.026 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.565 -7.340 8.568 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.198 -6.338 8.124 1.00 0.00 H new ATOM 603 N ALA A 43 3.247 -9.235 7.339 1.00 0.00 N ATOM 604 CA ALA A 43 2.417 -10.398 7.619 1.00 0.00 C ATOM 605 C ALA A 43 3.122 -11.377 8.563 1.00 0.00 C ATOM 606 O ALA A 43 2.510 -11.863 9.517 1.00 0.00 O ATOM 607 CB ALA A 43 2.034 -11.085 6.301 1.00 0.00 C ATOM 0 H ALA A 43 3.422 -9.092 6.345 1.00 0.00 H new ATOM 0 HA ALA A 43 1.511 -10.064 8.124 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.413 -11.955 6.512 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.480 -10.386 5.674 1.00 0.00 H new ATOM 0 HB3 ALA A 43 2.937 -11.402 5.780 1.00 0.00 H new ATOM 613 N THR A 44 4.396 -11.656 8.288 1.00 0.00 N ATOM 614 CA THR A 44 5.163 -12.745 8.895 1.00 0.00 C ATOM 615 C THR A 44 6.675 -12.479 8.879 1.00 0.00 C ATOM 616 O THR A 44 7.421 -13.184 9.558 1.00 0.00 O ATOM 617 CB THR A 44 4.851 -14.065 8.146 1.00 0.00 C ATOM 618 OG1 THR A 44 4.428 -13.796 6.822 1.00 0.00 O ATOM 619 CG2 THR A 44 3.785 -14.870 8.896 1.00 0.00 C ATOM 0 H THR A 44 4.940 -11.114 7.616 1.00 0.00 H new ATOM 0 HA THR A 44 4.864 -12.820 9.941 1.00 0.00 H new ATOM 0 HB THR A 44 5.764 -14.659 8.103 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.237 -14.640 6.362 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.579 -15.794 8.355 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.146 -15.108 9.896 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.870 -14.282 8.971 1.00 0.00 H new ATOM 627 N GLY A 45 7.143 -11.464 8.146 1.00 0.00 N ATOM 628 CA GLY A 45 8.548 -11.268 7.808 1.00 0.00 C ATOM 629 C GLY A 45 8.872 -11.737 6.387 1.00 0.00 C ATOM 630 O GLY A 45 10.034 -11.667 5.988 1.00 0.00 O ATOM 0 H GLY A 45 6.536 -10.739 7.763 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.800 -10.212 7.906 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.170 -11.812 8.519 1.00 0.00 H new ATOM 634 N GLU A 46 7.881 -12.214 5.622 1.00 0.00 N ATOM 635 CA GLU A 46 8.093 -12.803 4.309 1.00 0.00 C ATOM 636 C GLU A 46 8.665 -11.768 3.356 1.00 0.00 C ATOM 637 O GLU A 46 8.067 -10.726 3.087 1.00 0.00 O ATOM 638 CB GLU A 46 6.790 -13.356 3.739 1.00 0.00 C ATOM 639 CG GLU A 46 6.535 -14.798 4.206 1.00 0.00 C ATOM 640 CD GLU A 46 6.749 -15.767 3.047 1.00 0.00 C ATOM 641 OE1 GLU A 46 7.875 -15.833 2.500 1.00 0.00 O ATOM 642 OE2 GLU A 46 5.758 -16.411 2.633 1.00 0.00 O ATOM 0 H GLU A 46 6.902 -12.198 5.908 1.00 0.00 H new ATOM 0 HA GLU A 46 8.800 -13.625 4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.959 -12.721 4.047 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.827 -13.327 2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.206 -15.047 5.028 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.518 -14.892 4.586 1.00 0.00 H new ATOM 649 N SER A 47 9.851 -12.057 2.855 1.00 0.00 N ATOM 650 CA SER A 47 10.528 -11.317 1.835 1.00 0.00 C ATOM 651 C SER A 47 9.981 -11.742 0.473 1.00 0.00 C ATOM 652 O SER A 47 9.769 -12.939 0.238 1.00 0.00 O ATOM 653 CB SER A 47 12.032 -11.563 2.015 1.00 0.00 C ATOM 654 OG SER A 47 12.385 -12.376 3.139 1.00 0.00 O ATOM 0 H SER A 47 10.389 -12.862 3.175 1.00 0.00 H new ATOM 0 HA SER A 47 10.361 -10.242 1.904 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.418 -12.034 1.111 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.533 -10.600 2.112 1.00 0.00 H new ATOM 0 HG SER A 47 13.359 -12.481 3.174 1.00 0.00 H new ATOM 660 N LEU A 48 9.701 -10.760 -0.389 1.00 0.00 N ATOM 661 CA LEU A 48 9.056 -10.946 -1.687 1.00 0.00 C ATOM 662 C LEU A 48 9.876 -10.235 -2.769 1.00 0.00 C ATOM 663 O LEU A 48 10.792 -9.464 -2.462 1.00 0.00 O ATOM 664 CB LEU A 48 7.611 -10.409 -1.647 1.00 0.00 C ATOM 665 CG LEU A 48 6.722 -10.974 -0.517 1.00 0.00 C ATOM 666 CD1 LEU A 48 5.414 -10.192 -0.446 1.00 0.00 C ATOM 667 CD2 LEU A 48 6.411 -12.453 -0.633 1.00 0.00 C ATOM 0 H LEU A 48 9.925 -9.784 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 48 9.011 -12.009 -1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.648 -9.324 -1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.135 -10.626 -2.603 1.00 0.00 H new ATOM 0 HG LEU A 48 7.306 -10.857 0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.792 -10.595 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.628 -9.142 -0.244 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.886 -10.279 -1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.782 -12.759 0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.886 -12.642 -1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.340 -13.023 -0.616 1.00 0.00 H new ATOM 679 N ALA A 49 9.547 -10.476 -4.038 1.00 0.00 N ATOM 680 CA ALA A 49 10.337 -10.135 -5.216 1.00 0.00 C ATOM 681 C ALA A 49 9.499 -9.217 -6.102 1.00 0.00 C ATOM 682 O ALA A 49 8.562 -9.672 -6.763 1.00 0.00 O ATOM 683 CB ALA A 49 10.725 -11.426 -5.947 1.00 0.00 C ATOM 0 H ALA A 49 8.673 -10.941 -4.283 1.00 0.00 H new ATOM 0 HA ALA A 49 11.255 -9.615 -4.942 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.316 -11.181 -6.829 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.312 -12.059 -5.281 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.823 -11.957 -6.251 1.00 0.00 H new ATOM 689 N SER A 50 9.784 -7.921 -6.053 1.00 0.00 N ATOM 690 CA SER A 50 9.050 -6.866 -6.753 1.00 0.00 C ATOM 691 C SER A 50 9.479 -6.732 -8.242 1.00 0.00 C ATOM 692 O SER A 50 10.515 -7.283 -8.633 1.00 0.00 O ATOM 693 CB SER A 50 9.243 -5.539 -5.986 1.00 0.00 C ATOM 694 OG SER A 50 9.741 -5.706 -4.659 1.00 0.00 O ATOM 0 H SER A 50 10.563 -7.559 -5.503 1.00 0.00 H new ATOM 0 HA SER A 50 7.992 -7.129 -6.773 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.931 -4.904 -6.545 1.00 0.00 H new ATOM 0 HB3 SER A 50 8.289 -5.014 -5.942 1.00 0.00 H new ATOM 0 HG SER A 50 10.509 -5.113 -4.521 1.00 0.00 H new ATOM 700 N PRO A 51 8.742 -5.971 -9.079 1.00 0.00 N ATOM 701 CA PRO A 51 7.448 -5.363 -8.793 1.00 0.00 C ATOM 702 C PRO A 51 6.369 -6.448 -8.756 1.00 0.00 C ATOM 703 O PRO A 51 6.414 -7.423 -9.509 1.00 0.00 O ATOM 704 CB PRO A 51 7.212 -4.376 -9.933 1.00 0.00 C ATOM 705 CG PRO A 51 7.882 -5.062 -11.120 1.00 0.00 C ATOM 706 CD PRO A 51 9.096 -5.727 -10.471 1.00 0.00 C ATOM 0 HA PRO A 51 7.419 -4.859 -7.827 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.149 -4.209 -10.110 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.657 -3.403 -9.724 1.00 0.00 H new ATOM 0 HG2 PRO A 51 7.224 -5.791 -11.593 1.00 0.00 H new ATOM 0 HG3 PRO A 51 8.173 -4.348 -11.891 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.343 -6.660 -10.977 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.973 -5.084 -10.541 1.00 0.00 H new ATOM 714 N VAL A 52 5.419 -6.326 -7.838 1.00 0.00 N ATOM 715 CA VAL A 52 4.400 -7.335 -7.626 1.00 0.00 C ATOM 716 C VAL A 52 3.088 -6.679 -7.244 1.00 0.00 C ATOM 717 O VAL A 52 3.058 -5.509 -6.856 1.00 0.00 O ATOM 718 CB VAL A 52 4.925 -8.386 -6.637 1.00 0.00 C ATOM 719 CG1 VAL A 52 5.146 -7.829 -5.229 1.00 0.00 C ATOM 720 CG2 VAL A 52 4.008 -9.615 -6.603 1.00 0.00 C ATOM 0 H VAL A 52 5.337 -5.519 -7.219 1.00 0.00 H new ATOM 0 HA VAL A 52 4.180 -7.879 -8.544 1.00 0.00 H new ATOM 0 HB VAL A 52 5.905 -8.690 -7.005 1.00 0.00 H new ATOM 0 HG11 VAL A 52 5.517 -8.621 -4.579 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.875 -7.020 -5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.203 -7.449 -4.836 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.402 -10.344 -5.895 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.007 -9.314 -6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.962 -10.062 -7.596 1.00 0.00 H new ATOM 730 N ILE A 53 2.006 -7.440 -7.397 1.00 0.00 N ATOM 731 CA ILE A 53 0.648 -7.021 -7.150 1.00 0.00 C ATOM 732 C ILE A 53 0.111 -7.920 -6.042 1.00 0.00 C ATOM 733 O ILE A 53 0.000 -9.138 -6.202 1.00 0.00 O ATOM 734 CB ILE A 53 -0.203 -7.102 -8.422 1.00 0.00 C ATOM 735 CG1 ILE A 53 0.501 -6.589 -9.693 1.00 0.00 C ATOM 736 CG2 ILE A 53 -1.534 -6.368 -8.188 1.00 0.00 C ATOM 737 CD1 ILE A 53 0.927 -5.124 -9.698 1.00 0.00 C ATOM 0 H ILE A 53 2.066 -8.408 -7.711 1.00 0.00 H new ATOM 0 HA ILE A 53 0.610 -5.976 -6.843 1.00 0.00 H new ATOM 0 HB ILE A 53 -0.383 -8.160 -8.615 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.387 -7.201 -9.862 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.165 -6.752 -10.540 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.143 -6.423 -9.090 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.067 -6.837 -7.361 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.336 -5.324 -7.947 1.00 0.00 H new ATOM 0 HD11 ILE A 53 1.410 -4.889 -10.647 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.050 -4.490 -9.570 1.00 0.00 H new ATOM 0 HD13 ILE A 53 1.626 -4.946 -8.881 1.00 0.00 H new ATOM 749 N LEU A 54 -0.177 -7.326 -4.897 1.00 0.00 N ATOM 750 CA LEU A 54 -0.900 -7.954 -3.809 1.00 0.00 C ATOM 751 C LEU A 54 -2.374 -7.868 -4.183 1.00 0.00 C ATOM 752 O LEU A 54 -2.848 -6.825 -4.640 1.00 0.00 O ATOM 753 CB LEU A 54 -0.608 -7.233 -2.490 1.00 0.00 C ATOM 754 CG LEU A 54 0.817 -7.337 -1.917 1.00 0.00 C ATOM 755 CD1 LEU A 54 1.167 -8.780 -1.549 1.00 0.00 C ATOM 756 CD2 LEU A 54 1.898 -6.750 -2.826 1.00 0.00 C ATOM 0 H LEU A 54 0.095 -6.364 -4.694 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.599 -8.992 -3.663 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.838 -6.176 -2.628 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.300 -7.614 -1.739 1.00 0.00 H new ATOM 0 HG LEU A 54 0.805 -6.726 -1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.180 -8.818 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.465 -9.145 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.106 -9.407 -2.438 1.00 0.00 H new ATOM 0 HD21 LEU A 54 2.873 -6.862 -2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.896 -7.277 -3.780 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.696 -5.692 -2.995 1.00 0.00 H new ATOM 768 N SER A 55 -3.063 -8.989 -4.021 1.00 0.00 N ATOM 769 CA SER A 55 -4.449 -9.199 -4.397 1.00 0.00 C ATOM 770 C SER A 55 -5.352 -9.116 -3.154 1.00 0.00 C ATOM 771 O SER A 55 -4.873 -8.893 -2.041 1.00 0.00 O ATOM 772 CB SER A 55 -4.547 -10.568 -5.085 1.00 0.00 C ATOM 773 OG SER A 55 -3.530 -10.751 -6.065 1.00 0.00 O ATOM 0 H SER A 55 -2.645 -9.819 -3.601 1.00 0.00 H new ATOM 0 HA SER A 55 -4.788 -8.426 -5.087 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.473 -11.356 -4.335 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.525 -10.667 -5.556 1.00 0.00 H new ATOM 0 HG SER A 55 -3.628 -11.635 -6.477 1.00 0.00 H new ATOM 779 N ASP A 56 -6.655 -9.332 -3.335 1.00 0.00 N ATOM 780 CA ASP A 56 -7.695 -9.172 -2.310 1.00 0.00 C ATOM 781 C ASP A 56 -7.359 -9.950 -1.039 1.00 0.00 C ATOM 782 O ASP A 56 -7.406 -9.405 0.065 1.00 0.00 O ATOM 783 CB ASP A 56 -9.046 -9.602 -2.919 1.00 0.00 C ATOM 784 CG ASP A 56 -10.305 -9.365 -2.069 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.233 -9.176 -0.835 1.00 0.00 O ATOM 786 OD2 ASP A 56 -11.410 -9.346 -2.656 1.00 0.00 O ATOM 0 H ASP A 56 -7.033 -9.635 -4.233 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.756 -8.127 -2.007 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.173 -9.076 -3.865 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -8.989 -10.666 -3.150 1.00 0.00 H new ATOM 791 N GLU A 57 -6.942 -11.206 -1.204 1.00 0.00 N ATOM 792 CA GLU A 57 -6.752 -12.134 -0.100 1.00 0.00 C ATOM 793 C GLU A 57 -5.503 -11.827 0.715 1.00 0.00 C ATOM 794 O GLU A 57 -5.492 -12.075 1.922 1.00 0.00 O ATOM 795 CB GLU A 57 -6.702 -13.565 -0.635 1.00 0.00 C ATOM 796 CG GLU A 57 -8.099 -13.941 -1.161 1.00 0.00 C ATOM 797 CD GLU A 57 -8.475 -15.418 -1.099 1.00 0.00 C ATOM 798 OE1 GLU A 57 -8.340 -16.062 -0.033 1.00 0.00 O ATOM 799 OE2 GLU A 57 -9.088 -15.897 -2.082 1.00 0.00 O ATOM 0 H GLU A 57 -6.726 -11.606 -2.117 1.00 0.00 H new ATOM 0 HA GLU A 57 -7.601 -12.020 0.574 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -5.963 -13.645 -1.432 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.396 -14.253 0.153 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.840 -13.376 -0.595 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -8.173 -13.613 -2.198 1.00 0.00 H new ATOM 806 N GLU A 58 -4.476 -11.269 0.080 1.00 0.00 N ATOM 807 CA GLU A 58 -3.276 -10.798 0.760 1.00 0.00 C ATOM 808 C GLU A 58 -3.614 -9.577 1.642 1.00 0.00 C ATOM 809 O GLU A 58 -2.995 -9.362 2.689 1.00 0.00 O ATOM 810 CB GLU A 58 -2.167 -10.410 -0.244 1.00 0.00 C ATOM 811 CG GLU A 58 -2.181 -11.047 -1.644 1.00 0.00 C ATOM 812 CD GLU A 58 -2.124 -12.570 -1.695 1.00 0.00 C ATOM 813 OE1 GLU A 58 -1.163 -13.173 -1.165 1.00 0.00 O ATOM 814 OE2 GLU A 58 -3.006 -13.151 -2.364 1.00 0.00 O ATOM 0 H GLU A 58 -4.454 -11.130 -0.930 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.907 -11.615 1.379 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.202 -9.328 -0.373 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.207 -10.645 0.216 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.085 -10.721 -2.159 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.334 -10.654 -2.207 1.00 0.00 H new ATOM 821 N LEU A 59 -4.578 -8.750 1.210 1.00 0.00 N ATOM 822 CA LEU A 59 -5.015 -7.516 1.867 1.00 0.00 C ATOM 823 C LEU A 59 -6.200 -7.749 2.824 1.00 0.00 C ATOM 824 O LEU A 59 -6.785 -6.785 3.324 1.00 0.00 O ATOM 825 CB LEU A 59 -5.412 -6.508 0.771 1.00 0.00 C ATOM 826 CG LEU A 59 -4.302 -5.627 0.170 1.00 0.00 C ATOM 827 CD1 LEU A 59 -3.826 -4.516 1.119 1.00 0.00 C ATOM 828 CD2 LEU A 59 -3.092 -6.395 -0.350 1.00 0.00 C ATOM 0 H LEU A 59 -5.097 -8.935 0.352 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.194 -7.133 2.474 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.876 -7.064 -0.044 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.176 -5.849 1.183 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.795 -5.172 -0.689 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.044 -3.933 0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.664 -3.864 1.366 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.432 -4.962 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.362 -5.694 -0.755 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.640 -6.958 0.467 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.407 -7.083 -1.134 1.00 0.00 H new ATOM 840 N ALA A 60 -6.597 -8.999 3.071 1.00 0.00 N ATOM 841 CA ALA A 60 -7.807 -9.386 3.794 1.00 0.00 C ATOM 842 C ALA A 60 -7.637 -9.290 5.318 1.00 0.00 C ATOM 843 O ALA A 60 -8.044 -10.191 6.060 1.00 0.00 O ATOM 844 CB ALA A 60 -8.214 -10.796 3.358 1.00 0.00 C ATOM 0 H ALA A 60 -6.057 -9.806 2.757 1.00 0.00 H new ATOM 0 HA ALA A 60 -8.602 -8.684 3.543 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.116 -11.096 3.891 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.407 -10.804 2.285 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.409 -11.494 3.587 1.00 0.00 H new ATOM 850 N VAL A 61 -7.050 -8.200 5.789 1.00 0.00 N ATOM 851 CA VAL A 61 -6.683 -7.903 7.170 1.00 0.00 C ATOM 852 C VAL A 61 -7.016 -6.438 7.486 1.00 0.00 C ATOM 853 O VAL A 61 -7.335 -5.661 6.589 1.00 0.00 O ATOM 854 CB VAL A 61 -5.183 -8.213 7.366 1.00 0.00 C ATOM 855 CG1 VAL A 61 -4.940 -9.716 7.523 1.00 0.00 C ATOM 856 CG2 VAL A 61 -4.316 -7.681 6.218 1.00 0.00 C ATOM 0 H VAL A 61 -6.796 -7.435 5.164 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.251 -8.524 7.863 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.890 -7.699 8.281 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.874 -9.900 7.659 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.486 -10.084 8.392 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -5.287 -10.236 6.630 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.271 -7.927 6.407 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.632 -8.139 5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.428 -6.599 6.149 1.00 0.00 H new ATOM 866 N GLU A 62 -6.941 -6.035 8.755 1.00 0.00 N ATOM 867 CA GLU A 62 -7.236 -4.659 9.162 1.00 0.00 C ATOM 868 C GLU A 62 -6.147 -3.666 8.745 1.00 0.00 C ATOM 869 O GLU A 62 -6.397 -2.463 8.644 1.00 0.00 O ATOM 870 CB GLU A 62 -7.435 -4.608 10.680 1.00 0.00 C ATOM 871 CG GLU A 62 -6.122 -4.728 11.466 1.00 0.00 C ATOM 872 CD GLU A 62 -6.354 -4.787 12.970 1.00 0.00 C ATOM 873 OE1 GLU A 62 -7.067 -3.908 13.511 1.00 0.00 O ATOM 874 OE2 GLU A 62 -5.801 -5.694 13.625 1.00 0.00 O ATOM 0 H GLU A 62 -6.676 -6.648 9.526 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.149 -4.358 8.648 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.925 -3.671 10.944 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.105 -5.414 10.979 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.590 -5.624 11.147 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.482 -3.877 11.232 1.00 0.00 H new ATOM 881 N LYS A 63 -4.916 -4.148 8.561 1.00 0.00 N ATOM 882 CA LYS A 63 -3.783 -3.332 8.175 1.00 0.00 C ATOM 883 C LYS A 63 -2.808 -4.215 7.424 1.00 0.00 C ATOM 884 O LYS A 63 -2.646 -5.378 7.806 1.00 0.00 O ATOM 885 CB LYS A 63 -3.123 -2.716 9.425 1.00 0.00 C ATOM 886 CG LYS A 63 -2.012 -1.703 9.096 1.00 0.00 C ATOM 887 CD LYS A 63 -1.173 -1.372 10.328 1.00 0.00 C ATOM 888 CE LYS A 63 -0.250 -0.169 10.092 1.00 0.00 C ATOM 889 NZ LYS A 63 1.030 -0.306 10.821 1.00 0.00 N ATOM 0 H LYS A 63 -4.684 -5.134 8.680 1.00 0.00 H new ATOM 0 HA LYS A 63 -4.102 -2.510 7.535 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.888 -2.222 10.024 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -2.705 -3.515 10.037 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -1.369 -2.108 8.315 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.457 -0.789 8.701 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -1.833 -1.162 11.170 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.573 -2.240 10.602 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.051 -0.067 9.025 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.754 0.743 10.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.415 0.638 11.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.869 -0.816 11.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 1.707 -0.836 10.237 1.00 0.00 H new ATOM 903 N VAL A 64 -2.116 -3.656 6.434 1.00 0.00 N ATOM 904 CA VAL A 64 -0.886 -4.232 5.915 1.00 0.00 C ATOM 905 C VAL A 64 0.205 -3.170 6.107 1.00 0.00 C ATOM 906 O VAL A 64 -0.066 -1.969 6.227 1.00 0.00 O ATOM 907 CB VAL A 64 -1.068 -4.745 4.462 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.039 -5.804 4.079 1.00 0.00 C ATOM 909 CG2 VAL A 64 -2.439 -5.389 4.214 1.00 0.00 C ATOM 0 H VAL A 64 -2.395 -2.791 5.971 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.587 -5.131 6.454 1.00 0.00 H new ATOM 0 HB VAL A 64 -0.951 -3.844 3.860 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.214 -6.127 3.053 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.963 -5.384 4.162 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.130 -6.659 4.749 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -2.501 -5.726 3.179 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.567 -6.241 4.882 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.224 -4.658 4.405 1.00 0.00 H new ATOM 919 N THR A 65 1.456 -3.586 6.237 1.00 0.00 N ATOM 920 CA THR A 65 2.623 -2.720 6.381 1.00 0.00 C ATOM 921 C THR A 65 3.823 -3.417 5.757 1.00 0.00 C ATOM 922 O THR A 65 3.994 -4.626 5.949 1.00 0.00 O ATOM 923 CB THR A 65 2.868 -2.385 7.860 1.00 0.00 C ATOM 924 OG1 THR A 65 1.727 -1.727 8.375 1.00 0.00 O ATOM 925 CG2 THR A 65 4.097 -1.484 8.036 1.00 0.00 C ATOM 0 H THR A 65 1.699 -4.577 6.246 1.00 0.00 H new ATOM 0 HA THR A 65 2.454 -1.775 5.866 1.00 0.00 H new ATOM 0 HB THR A 65 3.052 -3.314 8.399 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.179 -2.366 8.877 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.241 -1.267 9.095 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.979 -1.992 7.647 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.946 -0.552 7.492 1.00 0.00 H new ATOM 933 N LEU A 66 4.616 -2.670 4.988 1.00 0.00 N ATOM 934 CA LEU A 66 5.724 -3.172 4.184 1.00 0.00 C ATOM 935 C LEU A 66 6.925 -2.266 4.377 1.00 0.00 C ATOM 936 O LEU A 66 6.779 -1.120 4.803 1.00 0.00 O ATOM 937 CB LEU A 66 5.377 -3.162 2.684 1.00 0.00 C ATOM 938 CG LEU A 66 4.268 -4.100 2.196 1.00 0.00 C ATOM 939 CD1 LEU A 66 4.467 -5.527 2.670 1.00 0.00 C ATOM 940 CD2 LEU A 66 2.861 -3.625 2.562 1.00 0.00 C ATOM 0 H LEU A 66 4.497 -1.660 4.907 1.00 0.00 H new ATOM 0 HA LEU A 66 5.932 -4.193 4.502 1.00 0.00 H new ATOM 0 HB2 LEU A 66 5.097 -2.144 2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.285 -3.401 2.130 1.00 0.00 H new ATOM 0 HG LEU A 66 4.349 -4.077 1.109 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.655 -6.151 2.297 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.417 -5.906 2.294 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.472 -5.551 3.760 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.127 -4.337 2.185 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.772 -3.552 3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.680 -2.647 2.116 1.00 0.00 H new ATOM 952 N SER A 67 8.102 -2.746 3.987 1.00 0.00 N ATOM 953 CA SER A 67 9.323 -1.966 3.965 1.00 0.00 C ATOM 954 C SER A 67 10.254 -2.536 2.898 1.00 0.00 C ATOM 955 O SER A 67 10.142 -3.694 2.494 1.00 0.00 O ATOM 956 CB SER A 67 9.944 -1.984 5.372 1.00 0.00 C ATOM 957 OG SER A 67 11.179 -1.302 5.446 1.00 0.00 O ATOM 0 H SER A 67 8.230 -3.708 3.672 1.00 0.00 H new ATOM 0 HA SER A 67 9.130 -0.925 3.705 1.00 0.00 H new ATOM 0 HB2 SER A 67 9.245 -1.533 6.076 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.089 -3.018 5.685 1.00 0.00 H new ATOM 0 HG SER A 67 11.854 -1.791 4.931 1.00 0.00 H new ATOM 963 N THR A 68 11.182 -1.703 2.453 1.00 0.00 N ATOM 964 CA THR A 68 12.366 -2.081 1.705 1.00 0.00 C ATOM 965 C THR A 68 13.279 -2.920 2.599 1.00 0.00 C ATOM 966 O THR A 68 13.494 -2.507 3.741 1.00 0.00 O ATOM 967 CB THR A 68 13.120 -0.794 1.348 1.00 0.00 C ATOM 968 OG1 THR A 68 13.247 0.048 2.478 1.00 0.00 O ATOM 969 CG2 THR A 68 12.425 0.063 0.285 1.00 0.00 C ATOM 0 H THR A 68 11.125 -0.697 2.613 1.00 0.00 H new ATOM 0 HA THR A 68 12.087 -2.646 0.816 1.00 0.00 H new ATOM 0 HB THR A 68 14.079 -1.148 0.970 1.00 0.00 H new ATOM 0 HG1 THR A 68 13.258 -0.497 3.292 1.00 0.00 H new ATOM 0 HG21 THR A 68 13.021 0.954 0.089 1.00 0.00 H new ATOM 0 HG22 THR A 68 12.320 -0.513 -0.635 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.439 0.358 0.643 1.00 0.00 H new ATOM 977 N THR A 69 13.895 -4.004 2.110 1.00 0.00 N ATOM 978 CA THR A 69 14.821 -4.753 2.955 1.00 0.00 C ATOM 979 C THR A 69 16.177 -4.057 3.142 1.00 0.00 C ATOM 980 O THR A 69 16.938 -4.393 4.058 1.00 0.00 O ATOM 981 CB THR A 69 15.007 -6.200 2.456 1.00 0.00 C ATOM 982 OG1 THR A 69 15.481 -6.279 1.125 1.00 0.00 O ATOM 983 CG2 THR A 69 13.728 -7.032 2.532 1.00 0.00 C ATOM 0 H THR A 69 13.773 -4.369 1.166 1.00 0.00 H new ATOM 0 HA THR A 69 14.355 -4.788 3.940 1.00 0.00 H new ATOM 0 HB THR A 69 15.755 -6.606 3.137 1.00 0.00 H new ATOM 0 HG1 THR A 69 15.580 -7.220 0.868 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.927 -8.039 2.166 1.00 0.00 H new ATOM 0 HG22 THR A 69 13.387 -7.082 3.566 1.00 0.00 H new ATOM 0 HG23 THR A 69 12.956 -6.569 1.918 1.00 0.00 H new ATOM 991 N GLY A 70 16.510 -3.083 2.300 1.00 0.00 N ATOM 992 CA GLY A 70 17.799 -2.420 2.285 1.00 0.00 C ATOM 993 C GLY A 70 17.674 -1.046 1.648 1.00 0.00 C ATOM 994 O GLY A 70 16.583 -0.486 1.530 1.00 0.00 O ATOM 0 H GLY A 70 15.868 -2.727 1.591 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.179 -2.324 3.302 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.519 -3.022 1.731 1.00 0.00 H new ATOM 998 N LYS A 71 18.815 -0.483 1.273 1.00 0.00 N ATOM 999 CA LYS A 71 18.904 0.830 0.666 1.00 0.00 C ATOM 1000 C LYS A 71 18.256 0.775 -0.712 1.00 0.00 C ATOM 1001 O LYS A 71 18.793 0.126 -1.614 1.00 0.00 O ATOM 1002 CB LYS A 71 20.378 1.249 0.613 1.00 0.00 C ATOM 1003 CG LYS A 71 20.601 2.762 0.681 1.00 0.00 C ATOM 1004 CD LYS A 71 19.912 3.587 -0.408 1.00 0.00 C ATOM 1005 CE LYS A 71 20.580 3.590 -1.778 1.00 0.00 C ATOM 1006 NZ LYS A 71 20.734 2.260 -2.411 1.00 0.00 N ATOM 0 H LYS A 71 19.720 -0.939 1.386 1.00 0.00 H new ATOM 0 HA LYS A 71 18.371 1.581 1.250 1.00 0.00 H new ATOM 0 HB2 LYS A 71 20.909 0.777 1.440 1.00 0.00 H new ATOM 0 HB3 LYS A 71 20.820 0.869 -0.308 1.00 0.00 H new ATOM 0 HG2 LYS A 71 20.257 3.118 1.652 1.00 0.00 H new ATOM 0 HG3 LYS A 71 21.673 2.955 0.633 1.00 0.00 H new ATOM 0 HD2 LYS A 71 18.894 3.216 -0.525 1.00 0.00 H new ATOM 0 HD3 LYS A 71 19.838 4.618 -0.061 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.999 4.227 -2.446 1.00 0.00 H new ATOM 0 HE3 LYS A 71 21.566 4.045 -1.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 21.006 2.379 -3.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 21.472 1.722 -1.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 19.833 1.744 -2.357 1.00 0.00 H new ATOM 1020 N ALA A 72 17.168 1.507 -0.911 1.00 0.00 N ATOM 1021 CA ALA A 72 16.354 1.473 -2.111 1.00 0.00 C ATOM 1022 C ALA A 72 16.210 2.871 -2.727 1.00 0.00 C ATOM 1023 O ALA A 72 16.789 3.826 -2.192 1.00 0.00 O ATOM 1024 CB ALA A 72 15.010 0.860 -1.743 1.00 0.00 C ATOM 0 H ALA A 72 16.818 2.164 -0.213 1.00 0.00 H new ATOM 0 HA ALA A 72 16.831 0.862 -2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.374 0.821 -2.627 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.163 -0.149 -1.361 1.00 0.00 H new ATOM 0 HB3 ALA A 72 14.530 1.469 -0.977 1.00 0.00 H new ATOM 1030 N ILE A 73 15.547 2.977 -3.892 1.00 0.00 N ATOM 1031 CA ILE A 73 15.487 4.228 -4.656 1.00 0.00 C ATOM 1032 C ILE A 73 14.071 4.517 -5.221 1.00 0.00 C ATOM 1033 O ILE A 73 13.925 5.450 -6.008 1.00 0.00 O ATOM 1034 CB ILE A 73 16.519 4.207 -5.816 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.729 3.256 -5.658 1.00 0.00 C ATOM 1036 CG2 ILE A 73 17.044 5.634 -6.105 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.750 3.521 -4.553 1.00 0.00 C ATOM 0 H ILE A 73 15.043 2.203 -4.325 1.00 0.00 H new ATOM 0 HA ILE A 73 15.731 5.030 -3.960 1.00 0.00 H new ATOM 0 HB ILE A 73 15.944 3.803 -6.650 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.337 2.250 -5.507 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.267 3.250 -6.606 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.766 5.598 -6.921 1.00 0.00 H new ATOM 0 HG22 ILE A 73 16.211 6.278 -6.386 1.00 0.00 H new ATOM 0 HG23 ILE A 73 17.526 6.032 -5.212 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.529 2.759 -4.587 1.00 0.00 H new ATOM 0 HD12 ILE A 73 19.197 4.504 -4.699 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.253 3.489 -3.583 1.00 0.00 H new ATOM 1049 N GLU A 74 13.030 3.735 -4.914 1.00 0.00 N ATOM 1050 CA GLU A 74 11.649 4.014 -5.351 1.00 0.00 C ATOM 1051 C GLU A 74 10.619 3.542 -4.327 1.00 0.00 C ATOM 1052 O GLU A 74 10.937 2.697 -3.495 1.00 0.00 O ATOM 1053 CB GLU A 74 11.336 3.318 -6.689 1.00 0.00 C ATOM 1054 CG GLU A 74 11.585 4.256 -7.875 1.00 0.00 C ATOM 1055 CD GLU A 74 10.807 3.908 -9.150 1.00 0.00 C ATOM 1056 OE1 GLU A 74 9.741 3.260 -9.099 1.00 0.00 O ATOM 1057 OE2 GLU A 74 11.301 4.313 -10.232 1.00 0.00 O ATOM 0 H GLU A 74 13.117 2.887 -4.354 1.00 0.00 H new ATOM 0 HA GLU A 74 11.582 5.096 -5.463 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.955 2.426 -6.791 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.297 2.988 -6.695 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.327 5.272 -7.576 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.650 4.252 -8.105 1.00 0.00 H new ATOM 1064 N PHE A 75 9.371 4.005 -4.440 1.00 0.00 N ATOM 1065 CA PHE A 75 8.169 3.332 -3.940 1.00 0.00 C ATOM 1066 C PHE A 75 6.972 3.846 -4.757 1.00 0.00 C ATOM 1067 O PHE A 75 6.315 4.819 -4.365 1.00 0.00 O ATOM 1068 CB PHE A 75 7.987 3.522 -2.405 1.00 0.00 C ATOM 1069 CG PHE A 75 8.050 2.292 -1.501 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.741 1.113 -1.855 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.462 2.370 -0.221 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.852 0.050 -0.942 1.00 0.00 C ATOM 1073 CE2 PHE A 75 7.606 1.321 0.704 1.00 0.00 C ATOM 1074 CZ PHE A 75 8.293 0.153 0.342 1.00 0.00 C ATOM 0 H PHE A 75 9.162 4.892 -4.899 1.00 0.00 H new ATOM 0 HA PHE A 75 8.257 2.254 -4.073 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.751 4.221 -2.066 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.022 4.002 -2.243 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.188 1.027 -2.835 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.894 3.247 0.052 1.00 0.00 H new ATOM 0 HE1 PHE A 75 9.371 -0.852 -1.230 1.00 0.00 H new ATOM 0 HE2 PHE A 75 7.187 1.415 1.695 1.00 0.00 H new ATOM 0 HZ PHE A 75 8.391 -0.661 1.045 1.00 0.00 H new ATOM 1084 N ALA A 76 6.689 3.231 -5.911 1.00 0.00 N ATOM 1085 CA ALA A 76 5.414 3.450 -6.592 1.00 0.00 C ATOM 1086 C ALA A 76 4.349 2.562 -5.960 1.00 0.00 C ATOM 1087 O ALA A 76 4.613 1.390 -5.678 1.00 0.00 O ATOM 1088 CB ALA A 76 5.504 3.169 -8.098 1.00 0.00 C ATOM 0 H ALA A 76 7.320 2.585 -6.386 1.00 0.00 H new ATOM 0 HA ALA A 76 5.148 4.501 -6.476 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.533 3.346 -8.560 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.245 3.830 -8.548 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.798 2.132 -8.258 1.00 0.00 H new ATOM 1094 N VAL A 77 3.148 3.113 -5.778 1.00 0.00 N ATOM 1095 CA VAL A 77 1.990 2.455 -5.211 1.00 0.00 C ATOM 1096 C VAL A 77 0.784 2.979 -5.979 1.00 0.00 C ATOM 1097 O VAL A 77 0.586 4.190 -6.102 1.00 0.00 O ATOM 1098 CB VAL A 77 1.841 2.742 -3.698 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.664 1.924 -3.143 1.00 0.00 C ATOM 1100 CG2 VAL A 77 3.138 2.503 -2.905 1.00 0.00 C ATOM 0 H VAL A 77 2.956 4.080 -6.038 1.00 0.00 H new ATOM 0 HA VAL A 77 2.087 1.373 -5.301 1.00 0.00 H new ATOM 0 HB VAL A 77 1.630 3.804 -3.574 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.554 2.122 -2.077 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.252 2.207 -3.661 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.854 0.862 -3.297 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.966 2.722 -1.851 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.445 1.463 -3.014 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.924 3.155 -3.288 1.00 0.00 H new ATOM 1110 N SER A 78 -0.058 2.063 -6.437 1.00 0.00 N ATOM 1111 CA SER A 78 -1.388 2.334 -6.941 1.00 0.00 C ATOM 1112 C SER A 78 -2.301 1.175 -6.521 1.00 0.00 C ATOM 1113 O SER A 78 -1.819 0.143 -6.032 1.00 0.00 O ATOM 1114 CB SER A 78 -1.316 2.504 -8.451 1.00 0.00 C ATOM 1115 OG SER A 78 -0.412 3.516 -8.834 1.00 0.00 O ATOM 0 H SER A 78 0.181 1.072 -6.467 1.00 0.00 H new ATOM 0 HA SER A 78 -1.799 3.256 -6.530 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.016 1.560 -8.907 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.308 2.742 -8.835 1.00 0.00 H new ATOM 0 HG SER A 78 -0.397 3.589 -9.811 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.612 1.336 -6.696 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.604 0.379 -6.234 1.00 0.00 C ATOM 1123 C GLY A 79 -5.983 1.023 -6.247 1.00 0.00 C ATOM 1124 O GLY A 79 -6.128 2.164 -6.696 1.00 0.00 O ATOM 0 H GLY A 79 -4.015 2.145 -7.168 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.598 -0.503 -6.874 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.358 0.044 -5.226 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.993 0.310 -5.757 1.00 0.00 N ATOM 1129 CA GLY A 80 -8.354 0.810 -5.631 1.00 0.00 C ATOM 1130 C GLY A 80 -9.312 -0.347 -5.373 1.00 0.00 C ATOM 1131 O GLY A 80 -8.867 -1.479 -5.173 1.00 0.00 O ATOM 0 H GLY A 80 -6.884 -0.650 -5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.412 1.530 -4.815 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.643 1.336 -6.541 1.00 0.00 H new ATOM 1135 N VAL A 81 -10.611 -0.052 -5.332 1.00 0.00 N ATOM 1136 CA VAL A 81 -11.713 -0.983 -5.114 1.00 0.00 C ATOM 1137 C VAL A 81 -12.936 -0.475 -5.886 1.00 0.00 C ATOM 1138 O VAL A 81 -13.021 0.703 -6.242 1.00 0.00 O ATOM 1139 CB VAL A 81 -12.062 -1.116 -3.607 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -11.196 -2.141 -2.881 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -11.956 0.183 -2.810 1.00 0.00 C ATOM 0 H VAL A 81 -10.940 0.905 -5.458 1.00 0.00 H new ATOM 0 HA VAL A 81 -11.415 -1.970 -5.469 1.00 0.00 H new ATOM 0 HB VAL A 81 -13.104 -1.435 -3.640 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -11.489 -2.187 -1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -11.331 -3.121 -3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -10.148 -1.848 -2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -12.218 -0.006 -1.769 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -10.935 0.561 -2.864 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -12.639 0.923 -3.227 1.00 0.00 H new ATOM 1151 N VAL A 82 -13.906 -1.358 -6.088 1.00 0.00 N ATOM 1152 CA VAL A 82 -15.297 -1.059 -6.375 1.00 0.00 C ATOM 1153 C VAL A 82 -16.127 -1.648 -5.271 1.00 0.00 C ATOM 1154 O VAL A 82 -15.701 -2.541 -4.532 1.00 0.00 O ATOM 1155 CB VAL A 82 -15.755 -1.678 -7.721 1.00 0.00 C ATOM 1156 CG1 VAL A 82 -15.233 -0.939 -8.939 1.00 0.00 C ATOM 1157 CG2 VAL A 82 -15.446 -3.180 -7.811 1.00 0.00 C ATOM 0 H VAL A 82 -13.728 -2.362 -6.053 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.416 0.022 -6.445 1.00 0.00 H new ATOM 0 HB VAL A 82 -16.839 -1.560 -7.730 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -15.594 -1.428 -9.844 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -15.587 0.092 -8.918 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -14.143 -0.949 -8.931 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -15.787 -3.565 -8.772 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.371 -3.337 -7.718 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.961 -3.706 -7.007 1.00 0.00 H new ATOM 1167 N ASP A 83 -17.375 -1.210 -5.286 1.00 0.00 N ATOM 1168 CA ASP A 83 -18.472 -2.090 -5.039 1.00 0.00 C ATOM 1169 C ASP A 83 -19.253 -2.155 -6.352 1.00 0.00 C ATOM 1170 O ASP A 83 -19.221 -1.211 -7.155 1.00 0.00 O ATOM 1171 CB ASP A 83 -19.235 -1.465 -3.900 1.00 0.00 C ATOM 1172 CG ASP A 83 -20.303 -2.402 -3.318 1.00 0.00 C ATOM 1173 OD1 ASP A 83 -20.549 -3.481 -3.912 1.00 0.00 O ATOM 1174 OD2 ASP A 83 -20.863 -2.012 -2.274 1.00 0.00 O ATOM 0 H ASP A 83 -17.640 -0.242 -5.469 1.00 0.00 H new ATOM 0 HA ASP A 83 -18.215 -3.110 -4.754 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -18.537 -1.183 -3.112 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.712 -0.548 -4.247 1.00 0.00 H new ATOM 1179 N GLY A 84 -19.873 -3.286 -6.622 1.00 0.00 N ATOM 1180 CA GLY A 84 -20.718 -3.529 -7.776 1.00 0.00 C ATOM 1181 C GLY A 84 -21.885 -4.428 -7.423 1.00 0.00 C ATOM 1182 O GLY A 84 -22.249 -5.291 -8.225 1.00 0.00 O ATOM 0 H GLY A 84 -19.798 -4.101 -6.013 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -21.091 -2.581 -8.163 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -20.130 -3.988 -8.570 1.00 0.00 H new ATOM 1186 N GLU A 85 -22.438 -4.268 -6.223 1.00 0.00 N ATOM 1187 CA GLU A 85 -23.595 -5.035 -5.777 1.00 0.00 C ATOM 1188 C GLU A 85 -24.817 -4.125 -5.721 1.00 0.00 C ATOM 1189 O GLU A 85 -24.706 -2.908 -5.540 1.00 0.00 O ATOM 1190 CB GLU A 85 -23.277 -5.705 -4.441 1.00 0.00 C ATOM 1191 CG GLU A 85 -22.242 -6.812 -4.664 1.00 0.00 C ATOM 1192 CD GLU A 85 -21.536 -7.261 -3.396 1.00 0.00 C ATOM 1193 OE1 GLU A 85 -22.156 -7.419 -2.322 1.00 0.00 O ATOM 1194 OE2 GLU A 85 -20.353 -7.666 -3.510 1.00 0.00 O ATOM 0 H GLU A 85 -22.094 -3.601 -5.532 1.00 0.00 H new ATOM 0 HA GLU A 85 -23.828 -5.833 -6.482 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -22.893 -4.969 -3.734 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -24.185 -6.122 -4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -22.736 -7.672 -5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -21.497 -6.460 -5.378 1.00 0.00 H new ATOM 1201 N ASP A 86 -25.993 -4.700 -5.949 1.00 0.00 N ATOM 1202 CA ASP A 86 -27.218 -3.956 -6.217 1.00 0.00 C ATOM 1203 C ASP A 86 -28.374 -4.765 -5.654 1.00 0.00 C ATOM 1204 O ASP A 86 -28.812 -5.739 -6.274 1.00 0.00 O ATOM 1205 CB ASP A 86 -27.368 -3.681 -7.720 1.00 0.00 C ATOM 1206 CG ASP A 86 -28.520 -2.725 -8.024 1.00 0.00 C ATOM 1207 OD1 ASP A 86 -28.850 -1.890 -7.154 1.00 0.00 O ATOM 1208 OD2 ASP A 86 -28.956 -2.708 -9.198 1.00 0.00 O ATOM 0 H ASP A 86 -26.124 -5.712 -5.953 1.00 0.00 H new ATOM 0 HA ASP A 86 -27.197 -2.978 -5.736 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -26.439 -3.260 -8.104 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -27.532 -4.622 -8.244 1.00 0.00 H new ATOM 1213 N GLY A 87 -28.775 -4.436 -4.424 1.00 0.00 N ATOM 1214 CA GLY A 87 -29.741 -5.213 -3.650 1.00 0.00 C ATOM 1215 C GLY A 87 -29.186 -5.713 -2.315 1.00 0.00 C ATOM 1216 O GLY A 87 -29.694 -6.695 -1.769 1.00 0.00 O ATOM 0 H GLY A 87 -28.432 -3.611 -3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -30.623 -4.600 -3.462 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -30.067 -6.068 -4.243 1.00 0.00 H new ATOM 1220 N VAL A 88 -28.145 -5.073 -1.782 1.00 0.00 N ATOM 1221 CA VAL A 88 -27.512 -5.382 -0.512 1.00 0.00 C ATOM 1222 C VAL A 88 -27.498 -4.119 0.362 1.00 0.00 C ATOM 1223 O VAL A 88 -28.027 -3.084 -0.046 1.00 0.00 O ATOM 1224 CB VAL A 88 -26.115 -5.959 -0.796 1.00 0.00 C ATOM 1225 CG1 VAL A 88 -26.203 -7.380 -1.370 1.00 0.00 C ATOM 1226 CG2 VAL A 88 -25.303 -5.079 -1.746 1.00 0.00 C ATOM 0 H VAL A 88 -27.702 -4.285 -2.254 1.00 0.00 H new ATOM 0 HA VAL A 88 -28.063 -6.137 0.049 1.00 0.00 H new ATOM 0 HB VAL A 88 -25.600 -5.989 0.164 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -25.199 -7.759 -1.560 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -26.707 -8.030 -0.655 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -26.766 -7.361 -2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -24.325 -5.531 -1.914 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -25.829 -4.988 -2.696 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -25.175 -4.090 -1.306 1.00 0.00 H new ATOM 1236 N VAL A 89 -26.947 -4.193 1.579 1.00 0.00 N ATOM 1237 CA VAL A 89 -26.759 -3.037 2.454 1.00 0.00 C ATOM 1238 C VAL A 89 -25.366 -3.184 3.069 1.00 0.00 C ATOM 1239 O VAL A 89 -25.199 -3.804 4.124 1.00 0.00 O ATOM 1240 CB VAL A 89 -27.883 -2.906 3.513 1.00 0.00 C ATOM 1241 CG1 VAL A 89 -27.800 -1.531 4.196 1.00 0.00 C ATOM 1242 CG2 VAL A 89 -29.305 -3.060 2.943 1.00 0.00 C ATOM 0 H VAL A 89 -26.617 -5.068 1.986 1.00 0.00 H new ATOM 0 HA VAL A 89 -26.825 -2.107 1.890 1.00 0.00 H new ATOM 0 HB VAL A 89 -27.717 -3.723 4.215 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -28.593 -1.445 4.939 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -26.831 -1.425 4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -27.917 -0.746 3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -30.033 -2.955 3.748 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -29.481 -2.290 2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -29.409 -4.044 2.485 1.00 0.00 H new ATOM 1252 N ASN A 90 -24.358 -2.684 2.362 1.00 0.00 N ATOM 1253 CA ASN A 90 -22.971 -2.628 2.817 1.00 0.00 C ATOM 1254 C ASN A 90 -22.801 -1.462 3.798 1.00 0.00 C ATOM 1255 O ASN A 90 -23.748 -0.720 4.071 1.00 0.00 O ATOM 1256 CB ASN A 90 -22.030 -2.424 1.613 1.00 0.00 C ATOM 1257 CG ASN A 90 -22.269 -3.420 0.493 1.00 0.00 C ATOM 1258 OD1 ASN A 90 -23.242 -3.266 -0.240 1.00 0.00 O ATOM 1259 ND2 ASN A 90 -21.464 -4.459 0.361 1.00 0.00 N ATOM 0 H ASN A 90 -24.486 -2.294 1.428 1.00 0.00 H new ATOM 0 HA ASN A 90 -22.721 -3.565 3.314 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -22.160 -1.413 1.226 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -20.997 -2.506 1.950 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -21.644 -5.155 -0.362 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -20.662 -4.565 0.982 1.00 0.00 H new ATOM 1266 N GLU A 91 -21.572 -1.266 4.275 1.00 0.00 N ATOM 1267 CA GLU A 91 -21.076 -0.012 4.823 1.00 0.00 C ATOM 1268 C GLU A 91 -19.866 0.418 3.987 1.00 0.00 C ATOM 1269 O GLU A 91 -19.257 -0.436 3.339 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.664 -0.224 6.278 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.875 -0.146 7.199 1.00 0.00 C ATOM 1272 CD GLU A 91 -22.048 1.219 7.862 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -21.106 1.709 8.536 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -23.182 1.743 7.850 1.00 0.00 O ATOM 0 H GLU A 91 -20.871 -2.007 4.289 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.846 0.759 4.790 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -20.181 -1.195 6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.932 0.530 6.567 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.773 -0.380 6.627 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -21.783 -0.908 7.973 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.463 1.700 4.020 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.254 2.148 3.344 1.00 0.00 C ATOM 1283 C PRO A 92 -16.986 1.861 4.160 1.00 0.00 C ATOM 1284 O PRO A 92 -17.043 1.363 5.295 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.464 3.655 3.136 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.279 4.052 4.369 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.168 2.829 4.609 1.00 0.00 C ATOM 0 HA PRO A 92 -18.100 1.617 2.405 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.517 4.193 3.085 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.000 3.866 2.211 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.638 4.258 5.226 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.870 4.950 4.189 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.336 2.672 5.674 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -21.147 2.961 4.148 1.00 0.00 H new ATOM 1295 N MET A 93 -15.827 2.218 3.604 1.00 0.00 N ATOM 1296 CA MET A 93 -14.549 2.143 4.282 1.00 0.00 C ATOM 1297 C MET A 93 -13.623 3.276 3.840 1.00 0.00 C ATOM 1298 O MET A 93 -13.791 3.881 2.779 1.00 0.00 O ATOM 1299 CB MET A 93 -13.906 0.778 4.020 1.00 0.00 C ATOM 1300 CG MET A 93 -13.652 0.501 2.534 1.00 0.00 C ATOM 1301 SD MET A 93 -12.618 -0.939 2.171 1.00 0.00 S ATOM 1302 CE MET A 93 -11.173 -0.559 3.181 1.00 0.00 C ATOM 0 H MET A 93 -15.758 2.573 2.650 1.00 0.00 H new ATOM 0 HA MET A 93 -14.715 2.256 5.353 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.961 0.720 4.560 1.00 0.00 H new ATOM 0 HB3 MET A 93 -14.551 -0.003 4.423 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.614 0.369 2.038 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.184 1.382 2.094 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.350 -1.217 2.901 1.00 0.00 H new ATOM 0 HE2 MET A 93 -10.879 0.478 3.020 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.415 -0.708 4.233 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.584 3.503 4.635 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.539 4.484 4.395 1.00 0.00 C ATOM 1314 C GLN A 94 -10.198 3.743 4.382 1.00 0.00 C ATOM 1315 O GLN A 94 -10.087 2.623 4.891 1.00 0.00 O ATOM 1316 CB GLN A 94 -11.641 5.577 5.478 1.00 0.00 C ATOM 1317 CG GLN A 94 -12.911 6.432 5.284 1.00 0.00 C ATOM 1318 CD GLN A 94 -13.341 7.164 6.550 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -14.379 6.879 7.135 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -12.587 8.149 7.002 1.00 0.00 N ATOM 0 H GLN A 94 -12.443 2.984 5.502 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.640 4.988 3.434 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.657 5.115 6.465 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.759 6.216 5.439 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -12.733 7.161 4.493 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.726 5.790 4.949 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.722 8.391 6.520 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.870 8.668 7.834 1.00 0.00 H new ATOM 1329 N TRP A 95 -9.185 4.348 3.763 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.813 3.854 3.697 1.00 0.00 C ATOM 1331 C TRP A 95 -6.951 4.993 4.194 1.00 0.00 C ATOM 1332 O TRP A 95 -7.099 6.121 3.716 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.378 3.523 2.258 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.726 2.191 1.671 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.534 1.262 2.220 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -7.188 1.565 0.462 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.652 0.186 1.364 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.852 0.323 0.260 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -6.160 1.879 -0.451 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -7.607 -0.499 -0.847 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -5.843 1.017 -1.524 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -6.585 -0.155 -1.744 1.00 0.00 C ATOM 0 H TRP A 95 -9.305 5.234 3.273 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.722 2.939 4.283 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -7.799 4.288 1.605 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.294 3.627 2.212 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -9.016 1.347 3.183 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -9.261 -0.615 1.533 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.604 2.797 -0.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -8.199 -1.388 -1.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -5.022 1.261 -2.182 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -6.371 -0.785 -2.595 1.00 0.00 H new ATOM 1353 N VAL A 96 -6.016 4.714 5.088 1.00 0.00 N ATOM 1354 CA VAL A 96 -5.107 5.707 5.634 1.00 0.00 C ATOM 1355 C VAL A 96 -3.700 5.132 5.501 1.00 0.00 C ATOM 1356 O VAL A 96 -3.350 4.125 6.119 1.00 0.00 O ATOM 1357 CB VAL A 96 -5.607 6.205 7.006 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -6.061 5.128 7.996 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -4.615 7.155 7.691 1.00 0.00 C ATOM 0 H VAL A 96 -5.866 3.776 5.460 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.072 6.650 5.089 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.510 6.751 6.733 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.390 5.600 8.922 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.887 4.562 7.565 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.230 4.454 8.207 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.020 7.473 8.652 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.668 6.640 7.849 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.452 8.028 7.059 1.00 0.00 H new ATOM 1369 N VAL A 97 -2.955 5.701 4.552 1.00 0.00 N ATOM 1370 CA VAL A 97 -1.711 5.181 4.028 1.00 0.00 C ATOM 1371 C VAL A 97 -0.627 6.207 4.352 1.00 0.00 C ATOM 1372 O VAL A 97 -0.626 7.330 3.834 1.00 0.00 O ATOM 1373 CB VAL A 97 -1.884 4.828 2.528 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -3.031 3.830 2.322 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -2.083 6.000 1.542 1.00 0.00 C ATOM 0 H VAL A 97 -3.225 6.581 4.112 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.405 4.241 4.488 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.912 4.401 2.281 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.128 3.602 1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -2.819 2.913 2.873 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.962 4.265 2.686 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.190 5.610 0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.980 6.556 1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.219 6.663 1.585 1.00 0.00 H new ATOM 1385 N THR A 98 0.228 5.910 5.323 1.00 0.00 N ATOM 1386 CA THR A 98 1.368 6.758 5.647 1.00 0.00 C ATOM 1387 C THR A 98 2.537 6.301 4.761 1.00 0.00 C ATOM 1388 O THR A 98 2.513 5.186 4.219 1.00 0.00 O ATOM 1389 CB THR A 98 1.611 6.661 7.168 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.417 6.976 7.877 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.663 7.618 7.718 1.00 0.00 C ATOM 0 H THR A 98 0.151 5.077 5.906 1.00 0.00 H new ATOM 0 HA THR A 98 1.215 7.817 5.437 1.00 0.00 H new ATOM 0 HB THR A 98 1.955 5.637 7.311 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.582 6.910 8.841 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.760 7.473 8.794 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.621 7.421 7.237 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.361 8.646 7.517 1.00 0.00 H new ATOM 1399 N VAL A 99 3.547 7.150 4.579 1.00 0.00 N ATOM 1400 CA VAL A 99 4.878 6.700 4.150 1.00 0.00 C ATOM 1401 C VAL A 99 5.915 7.211 5.146 1.00 0.00 C ATOM 1402 O VAL A 99 5.875 8.365 5.589 1.00 0.00 O ATOM 1403 CB VAL A 99 5.231 7.088 2.691 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.521 6.396 2.219 1.00 0.00 C ATOM 1405 CG2 VAL A 99 4.122 6.683 1.711 1.00 0.00 C ATOM 0 H VAL A 99 3.472 8.157 4.721 1.00 0.00 H new ATOM 0 HA VAL A 99 4.876 5.610 4.145 1.00 0.00 H new ATOM 0 HB VAL A 99 5.357 8.171 2.696 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.738 6.691 1.192 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.349 6.691 2.864 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.392 5.315 2.266 1.00 0.00 H new ATOM 0 HG21 VAL A 99 4.407 6.972 0.699 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.976 5.604 1.753 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.194 7.185 1.984 1.00 0.00 H new ATOM 1415 N TYR A 100 6.860 6.335 5.463 1.00 0.00 N ATOM 1416 CA TYR A 100 8.059 6.591 6.226 1.00 0.00 C ATOM 1417 C TYR A 100 9.257 6.353 5.309 1.00 0.00 C ATOM 1418 O TYR A 100 9.202 5.557 4.371 1.00 0.00 O ATOM 1419 CB TYR A 100 8.115 5.667 7.451 1.00 0.00 C ATOM 1420 CG TYR A 100 6.970 5.838 8.429 1.00 0.00 C ATOM 1421 CD1 TYR A 100 5.747 5.178 8.201 1.00 0.00 C ATOM 1422 CD2 TYR A 100 7.131 6.638 9.576 1.00 0.00 C ATOM 1423 CE1 TYR A 100 4.674 5.354 9.089 1.00 0.00 C ATOM 1424 CE2 TYR A 100 6.056 6.828 10.462 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.816 6.203 10.210 1.00 0.00 C ATOM 1426 OH TYR A 100 3.767 6.397 11.055 1.00 0.00 O ATOM 0 H TYR A 100 6.797 5.360 5.169 1.00 0.00 H new ATOM 0 HA TYR A 100 8.069 7.618 6.590 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.130 4.633 7.108 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.053 5.842 7.978 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.634 4.535 7.341 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.083 7.107 9.776 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.740 4.841 8.916 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.179 7.452 11.335 1.00 0.00 H new ATOM 0 HH TYR A 100 4.034 7.008 11.773 1.00 0.00 H new ATOM 1436 N LYS A 101 10.337 7.064 5.596 1.00 0.00 N ATOM 1437 CA LYS A 101 11.654 7.005 4.994 1.00 0.00 C ATOM 1438 C LYS A 101 12.557 6.171 5.915 1.00 0.00 C ATOM 1439 O LYS A 101 12.079 5.615 6.906 1.00 0.00 O ATOM 1440 CB LYS A 101 12.080 8.476 4.844 1.00 0.00 C ATOM 1441 CG LYS A 101 13.256 8.707 3.898 1.00 0.00 C ATOM 1442 CD LYS A 101 13.357 10.185 3.494 1.00 0.00 C ATOM 1443 CE LYS A 101 14.797 10.643 3.239 1.00 0.00 C ATOM 1444 NZ LYS A 101 15.449 11.089 4.489 1.00 0.00 N ATOM 0 H LYS A 101 10.305 7.768 6.333 1.00 0.00 H new ATOM 0 HA LYS A 101 11.701 6.522 4.018 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.226 9.053 4.488 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.341 8.867 5.828 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.182 8.394 4.381 1.00 0.00 H new ATOM 0 HG3 LYS A 101 13.137 8.090 3.007 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.765 10.350 2.594 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.920 10.801 4.280 1.00 0.00 H new ATOM 0 HE2 LYS A 101 15.369 9.825 2.800 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.799 11.458 2.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 16.422 11.393 4.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 14.916 11.885 4.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 15.468 10.303 5.170 1.00 0.00 H new ATOM 1458 N ASN A 102 13.866 6.109 5.633 1.00 0.00 N ATOM 1459 CA ASN A 102 14.912 5.589 6.526 1.00 0.00 C ATOM 1460 C ASN A 102 14.986 6.425 7.815 1.00 0.00 C ATOM 1461 O ASN A 102 15.865 7.274 7.986 1.00 0.00 O ATOM 1462 CB ASN A 102 16.291 5.416 5.844 1.00 0.00 C ATOM 1463 CG ASN A 102 17.191 6.616 5.574 1.00 0.00 C ATOM 1464 OD1 ASN A 102 16.677 7.674 4.977 1.00 0.00 O flip ATOM 1465 ND2 ASN A 102 18.399 6.546 5.802 1.00 0.00 N flip ATOM 0 H ASN A 102 14.240 6.433 4.741 1.00 0.00 H new ATOM 0 HA ASN A 102 14.618 4.575 6.797 1.00 0.00 H new ATOM 0 HB2 ASN A 102 16.864 4.719 6.455 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.114 4.928 4.885 1.00 0.00 H new ATOM 0 HD21 ASN A 102 18.784 5.722 6.264 1.00 0.00 H new ATOM 0 HD22 ASN A 102 19.015 7.312 5.529 1.00 0.00 H new ATOM 1472 N GLY A 103 14.027 6.231 8.710 1.00 0.00 N ATOM 1473 CA GLY A 103 13.962 6.839 10.031 1.00 0.00 C ATOM 1474 C GLY A 103 13.319 8.228 10.054 1.00 0.00 C ATOM 1475 O GLY A 103 13.847 9.106 10.732 1.00 0.00 O ATOM 0 H GLY A 103 13.235 5.615 8.525 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.401 6.181 10.694 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.972 6.912 10.435 1.00 0.00 H new ATOM 1479 N LYS A 104 12.215 8.453 9.328 1.00 0.00 N ATOM 1480 CA LYS A 104 11.332 9.615 9.485 1.00 0.00 C ATOM 1481 C LYS A 104 9.967 9.270 8.887 1.00 0.00 C ATOM 1482 O LYS A 104 9.921 8.518 7.918 1.00 0.00 O ATOM 1483 CB LYS A 104 11.912 10.850 8.754 1.00 0.00 C ATOM 1484 CG LYS A 104 12.490 11.939 9.681 1.00 0.00 C ATOM 1485 CD LYS A 104 11.437 12.604 10.575 1.00 0.00 C ATOM 1486 CE LYS A 104 10.449 13.424 9.739 1.00 0.00 C ATOM 1487 NZ LYS A 104 9.241 13.777 10.498 1.00 0.00 N ATOM 0 H LYS A 104 11.904 7.814 8.596 1.00 0.00 H new ATOM 0 HA LYS A 104 11.240 9.854 10.544 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.697 10.517 8.075 1.00 0.00 H new ATOM 0 HB3 LYS A 104 11.127 11.294 8.141 1.00 0.00 H new ATOM 0 HG2 LYS A 104 13.262 11.497 10.310 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.974 12.703 9.073 1.00 0.00 H new ATOM 0 HD2 LYS A 104 10.898 11.842 11.138 1.00 0.00 H new ATOM 0 HD3 LYS A 104 11.928 13.250 11.303 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.937 14.335 9.392 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.166 12.856 8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.601 14.331 9.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.760 12.909 10.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.506 14.341 11.330 1.00 0.00 H new ATOM 1501 N GLU A 105 8.874 9.862 9.371 1.00 0.00 N ATOM 1502 CA GLU A 105 7.612 9.945 8.626 1.00 0.00 C ATOM 1503 C GLU A 105 7.787 11.031 7.563 1.00 0.00 C ATOM 1504 O GLU A 105 8.354 12.084 7.866 1.00 0.00 O ATOM 1505 CB GLU A 105 6.462 10.303 9.585 1.00 0.00 C ATOM 1506 CG GLU A 105 5.062 10.177 8.953 1.00 0.00 C ATOM 1507 CD GLU A 105 3.939 10.679 9.882 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.086 11.781 10.466 1.00 0.00 O ATOM 1509 OE2 GLU A 105 2.893 9.999 9.999 1.00 0.00 O ATOM 0 H GLU A 105 8.837 10.299 10.292 1.00 0.00 H new ATOM 0 HA GLU A 105 7.368 8.992 8.157 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.515 9.654 10.459 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.600 11.325 9.938 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.037 10.743 8.022 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.876 9.134 8.697 1.00 0.00 H new ATOM 1516 N ILE A 106 7.311 10.799 6.335 1.00 0.00 N ATOM 1517 CA ILE A 106 7.420 11.764 5.241 1.00 0.00 C ATOM 1518 C ILE A 106 6.094 12.015 4.523 1.00 0.00 C ATOM 1519 O ILE A 106 5.980 13.039 3.849 1.00 0.00 O ATOM 1520 CB ILE A 106 8.506 11.336 4.230 1.00 0.00 C ATOM 1521 CG1 ILE A 106 8.261 9.905 3.697 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.902 11.488 4.858 1.00 0.00 C ATOM 1523 CD1 ILE A 106 9.017 9.608 2.404 1.00 0.00 C ATOM 0 H ILE A 106 6.838 9.934 6.073 1.00 0.00 H new ATOM 0 HA ILE A 106 7.712 12.708 5.701 1.00 0.00 H new ATOM 0 HB ILE A 106 8.451 11.997 3.365 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.559 9.184 4.459 1.00 0.00 H new ATOM 0 HG13 ILE A 106 7.193 9.765 3.527 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.660 11.184 4.137 1.00 0.00 H new ATOM 0 HG22 ILE A 106 10.064 12.529 5.137 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.972 10.859 5.746 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.802 8.589 2.083 1.00 0.00 H new ATOM 0 HD12 ILE A 106 8.701 10.307 1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 106 10.088 9.717 2.576 1.00 0.00 H new ATOM 1535 N GLU A 107 5.088 11.144 4.647 1.00 0.00 N ATOM 1536 CA GLU A 107 3.808 11.380 3.991 1.00 0.00 C ATOM 1537 C GLU A 107 2.679 10.896 4.869 1.00 0.00 C ATOM 1538 O GLU A 107 2.771 9.825 5.461 1.00 0.00 O ATOM 1539 CB GLU A 107 3.754 10.680 2.627 1.00 0.00 C ATOM 1540 CG GLU A 107 2.549 11.105 1.773 1.00 0.00 C ATOM 1541 CD GLU A 107 2.426 12.622 1.698 1.00 0.00 C ATOM 1542 OE1 GLU A 107 3.194 13.259 0.939 1.00 0.00 O ATOM 1543 OE2 GLU A 107 1.621 13.176 2.485 1.00 0.00 O ATOM 0 H GLU A 107 5.138 10.281 5.189 1.00 0.00 H new ATOM 0 HA GLU A 107 3.699 12.452 3.828 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.672 10.894 2.080 1.00 0.00 H new ATOM 0 HB3 GLU A 107 3.719 9.601 2.781 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.652 10.697 0.768 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.636 10.685 2.195 1.00 0.00 H new ATOM 1550 N LYS A 108 1.607 11.677 4.913 1.00 0.00 N ATOM 1551 CA LYS A 108 0.469 11.460 5.781 1.00 0.00 C ATOM 1552 C LYS A 108 -0.767 11.900 5.017 1.00 0.00 C ATOM 1553 O LYS A 108 -0.986 13.101 4.811 1.00 0.00 O ATOM 1554 CB LYS A 108 0.703 12.229 7.087 1.00 0.00 C ATOM 1555 CG LYS A 108 -0.464 12.054 8.059 1.00 0.00 C ATOM 1556 CD LYS A 108 -0.102 12.659 9.420 1.00 0.00 C ATOM 1557 CE LYS A 108 -1.161 12.325 10.469 1.00 0.00 C ATOM 1558 NZ LYS A 108 -2.485 12.878 10.129 1.00 0.00 N ATOM 0 H LYS A 108 1.508 12.504 4.324 1.00 0.00 H new ATOM 0 HA LYS A 108 0.331 10.415 6.060 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.623 11.880 7.556 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.839 13.288 6.867 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.356 12.538 7.661 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.699 10.996 8.172 1.00 0.00 H new ATOM 0 HD2 LYS A 108 0.867 12.280 9.744 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -0.006 13.741 9.327 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.238 11.243 10.571 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.845 12.715 11.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -3.143 12.712 10.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -2.401 13.900 9.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.846 12.412 9.272 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.539 10.935 4.521 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.835 11.203 3.884 1.00 0.00 C ATOM 1574 C LYS A 109 -3.878 10.146 4.222 1.00 0.00 C ATOM 1575 O LYS A 109 -3.545 9.163 4.887 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.642 11.406 2.383 1.00 0.00 C ATOM 1577 CG LYS A 109 -2.337 10.113 1.623 1.00 0.00 C ATOM 1578 CD LYS A 109 -2.015 10.483 0.170 1.00 0.00 C ATOM 1579 CE LYS A 109 -2.547 9.422 -0.794 1.00 0.00 C ATOM 1580 NZ LYS A 109 -2.798 10.036 -2.106 1.00 0.00 N ATOM 0 H LYS A 109 -1.288 9.947 4.547 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.239 12.130 4.292 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.543 11.858 1.967 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.828 12.113 2.222 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.495 9.592 2.079 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -3.191 9.436 1.664 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.455 11.451 -0.069 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -0.937 10.584 0.047 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.827 8.610 -0.892 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.466 8.987 -0.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.160 9.316 -2.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.500 10.796 -2.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.912 10.431 -2.480 1.00 0.00 H new ATOM 1594 N SER A 110 -5.121 10.353 3.785 1.00 0.00 N ATOM 1595 CA SER A 110 -6.219 9.411 3.912 1.00 0.00 C ATOM 1596 C SER A 110 -7.166 9.573 2.716 1.00 0.00 C ATOM 1597 O SER A 110 -7.155 10.608 2.039 1.00 0.00 O ATOM 1598 CB SER A 110 -6.881 9.619 5.271 1.00 0.00 C ATOM 1599 OG SER A 110 -7.948 8.726 5.500 1.00 0.00 O ATOM 0 H SER A 110 -5.395 11.216 3.316 1.00 0.00 H new ATOM 0 HA SER A 110 -5.876 8.377 3.885 1.00 0.00 H new ATOM 0 HB2 SER A 110 -6.135 9.496 6.056 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.249 10.643 5.338 1.00 0.00 H new ATOM 0 HG SER A 110 -7.778 7.885 5.027 1.00 0.00 H new ATOM 1605 N LEU A 111 -7.967 8.535 2.456 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.904 8.415 1.341 1.00 0.00 C ATOM 1607 C LEU A 111 -10.294 8.105 1.891 1.00 0.00 C ATOM 1608 O LEU A 111 -10.435 7.639 3.029 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.534 7.286 0.358 1.00 0.00 C ATOM 1610 CG LEU A 111 -7.057 7.029 0.061 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.860 5.816 -0.852 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -6.337 8.233 -0.537 1.00 0.00 C ATOM 0 H LEU A 111 -7.977 7.709 3.055 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.871 9.362 0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.960 6.359 0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.030 7.496 -0.589 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.609 6.826 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.796 5.669 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.270 4.928 -0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.373 5.986 -1.798 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.293 7.978 -0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.814 8.513 -1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.388 9.070 0.159 1.00 0.00 H new ATOM 1624 N VAL A 112 -11.321 8.264 1.068 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.714 7.994 1.387 1.00 0.00 C ATOM 1626 C VAL A 112 -13.386 7.348 0.166 1.00 0.00 C ATOM 1627 O VAL A 112 -13.979 8.019 -0.682 1.00 0.00 O ATOM 1628 CB VAL A 112 -13.353 9.289 1.935 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -13.312 10.505 0.993 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -14.778 9.050 2.446 1.00 0.00 C ATOM 0 H VAL A 112 -11.198 8.601 0.113 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.843 7.263 2.185 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.707 9.558 2.771 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -13.787 11.357 1.478 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -12.276 10.751 0.761 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.844 10.269 0.071 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -15.191 9.986 2.823 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.400 8.681 1.630 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.758 8.313 3.249 1.00 0.00 H new ATOM 1640 N PHE A 113 -13.274 6.021 0.061 1.00 0.00 N ATOM 1641 CA PHE A 113 -14.066 5.263 -0.895 1.00 0.00 C ATOM 1642 C PHE A 113 -15.514 5.228 -0.405 1.00 0.00 C ATOM 1643 O PHE A 113 -15.827 5.692 0.695 1.00 0.00 O ATOM 1644 CB PHE A 113 -13.487 3.850 -1.050 1.00 0.00 C ATOM 1645 CG PHE A 113 -12.473 3.693 -2.166 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -12.922 3.635 -3.498 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -11.100 3.557 -1.894 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -12.020 3.408 -4.549 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -10.197 3.308 -2.943 1.00 0.00 C ATOM 1650 CZ PHE A 113 -10.658 3.230 -4.269 1.00 0.00 C ATOM 0 H PHE A 113 -12.642 5.456 0.628 1.00 0.00 H new ATOM 0 HA PHE A 113 -14.038 5.736 -1.877 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -13.018 3.560 -0.110 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -14.308 3.154 -1.224 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -13.972 3.767 -3.714 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -10.739 3.644 -0.880 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -12.374 3.371 -5.569 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -9.147 3.176 -2.729 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.963 3.033 -5.072 1.00 0.00 H new ATOM 1660 N ARG A 114 -16.411 4.693 -1.234 1.00 0.00 N ATOM 1661 CA ARG A 114 -17.806 4.513 -0.890 1.00 0.00 C ATOM 1662 C ARG A 114 -18.312 3.168 -1.405 1.00 0.00 C ATOM 1663 O ARG A 114 -17.635 2.423 -2.119 1.00 0.00 O ATOM 1664 CB ARG A 114 -18.626 5.711 -1.403 1.00 0.00 C ATOM 1665 CG ARG A 114 -18.597 6.892 -0.422 1.00 0.00 C ATOM 1666 CD ARG A 114 -19.586 7.978 -0.857 1.00 0.00 C ATOM 1667 NE ARG A 114 -20.972 7.479 -0.840 1.00 0.00 N ATOM 1668 CZ ARG A 114 -22.083 8.196 -1.011 1.00 0.00 C ATOM 1669 NH1 ARG A 114 -22.014 9.467 -1.380 1.00 0.00 N ATOM 1670 NH2 ARG A 114 -23.262 7.615 -0.812 1.00 0.00 N ATOM 0 H ARG A 114 -16.178 4.371 -2.173 1.00 0.00 H new ATOM 0 HA ARG A 114 -17.925 4.488 0.193 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -18.234 6.032 -2.368 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.658 5.400 -1.566 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -18.847 6.545 0.581 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -17.590 7.307 -0.374 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -19.499 8.839 -0.194 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -19.334 8.322 -1.860 1.00 0.00 H new ATOM 0 HE ARG A 114 -21.095 6.479 -0.681 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -21.106 9.904 -1.536 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -22.869 10.008 -1.508 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -23.307 6.635 -0.533 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -24.122 8.149 -0.938 1.00 0.00 H new ATOM 1684 N ASP A 115 -19.526 2.867 -0.980 1.00 0.00 N ATOM 1685 CA ASP A 115 -20.247 1.610 -1.024 1.00 0.00 C ATOM 1686 C ASP A 115 -21.397 1.678 -2.033 1.00 0.00 C ATOM 1687 O ASP A 115 -21.805 2.751 -2.500 1.00 0.00 O ATOM 1688 CB ASP A 115 -20.753 1.285 0.401 1.00 0.00 C ATOM 1689 CG ASP A 115 -21.608 2.377 1.080 1.00 0.00 C ATOM 1690 OD1 ASP A 115 -21.256 3.585 0.988 1.00 0.00 O ATOM 1691 OD2 ASP A 115 -22.608 2.071 1.753 1.00 0.00 O ATOM 0 H ASP A 115 -20.099 3.589 -0.542 1.00 0.00 H new ATOM 0 HA ASP A 115 -19.585 0.811 -1.358 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -21.339 0.367 0.357 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -19.890 1.081 1.034 1.00 0.00 H new ATOM 1696 N GLY A 116 -21.915 0.503 -2.383 1.00 0.00 N ATOM 1697 CA GLY A 116 -22.862 0.258 -3.452 1.00 0.00 C ATOM 1698 C GLY A 116 -22.193 0.391 -4.807 1.00 0.00 C ATOM 1699 O GLY A 116 -21.958 -0.600 -5.489 1.00 0.00 O ATOM 0 H GLY A 116 -21.664 -0.355 -1.891 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -23.285 -0.741 -3.347 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -23.690 0.964 -3.379 1.00 0.00 H new ATOM 1703 N LYS A 117 -21.946 1.627 -5.239 1.00 0.00 N ATOM 1704 CA LYS A 117 -21.857 1.992 -6.632 1.00 0.00 C ATOM 1705 C LYS A 117 -21.221 3.346 -6.921 1.00 0.00 C ATOM 1706 O LYS A 117 -21.326 3.870 -8.033 1.00 0.00 O ATOM 1707 CB LYS A 117 -23.194 1.679 -7.306 1.00 0.00 C ATOM 1708 CG LYS A 117 -24.459 2.204 -6.622 1.00 0.00 C ATOM 1709 CD LYS A 117 -24.231 3.679 -6.367 1.00 0.00 C ATOM 1710 CE LYS A 117 -25.547 4.418 -6.123 1.00 0.00 C ATOM 1711 NZ LYS A 117 -25.367 5.883 -6.166 1.00 0.00 N ATOM 0 H LYS A 117 -21.800 2.414 -4.606 1.00 0.00 H new ATOM 0 HA LYS A 117 -21.107 1.368 -7.117 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -23.165 2.082 -8.319 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -23.282 0.596 -7.396 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -25.334 2.051 -7.254 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -24.644 1.673 -5.688 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -23.578 3.803 -5.503 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -23.718 4.121 -7.221 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -26.277 4.119 -6.875 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -25.952 4.129 -5.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -26.281 6.350 -5.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -24.689 6.171 -5.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -25.004 6.161 -7.100 1.00 0.00 H new ATOM 1725 N GLU A 118 -20.520 3.911 -5.950 1.00 0.00 N ATOM 1726 CA GLU A 118 -19.914 5.219 -6.019 1.00 0.00 C ATOM 1727 C GLU A 118 -18.472 5.053 -5.549 1.00 0.00 C ATOM 1728 O GLU A 118 -18.247 4.775 -4.378 1.00 0.00 O ATOM 1729 CB GLU A 118 -20.774 6.149 -5.140 1.00 0.00 C ATOM 1730 CG GLU A 118 -20.110 7.511 -4.963 1.00 0.00 C ATOM 1731 CD GLU A 118 -20.973 8.552 -4.233 1.00 0.00 C ATOM 1732 OE1 GLU A 118 -22.214 8.386 -4.198 1.00 0.00 O ATOM 1733 OE2 GLU A 118 -20.424 9.526 -3.664 1.00 0.00 O ATOM 0 H GLU A 118 -20.355 3.446 -5.058 1.00 0.00 H new ATOM 0 HA GLU A 118 -19.879 5.662 -7.014 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -21.757 6.277 -5.594 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -20.931 5.689 -4.165 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -19.179 7.378 -4.411 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.845 7.902 -5.945 1.00 0.00 H new ATOM 1740 N ILE A 119 -17.522 5.146 -6.480 1.00 0.00 N ATOM 1741 CA ILE A 119 -16.073 5.041 -6.298 1.00 0.00 C ATOM 1742 C ILE A 119 -15.375 5.867 -7.387 1.00 0.00 C ATOM 1743 O ILE A 119 -16.006 6.239 -8.390 1.00 0.00 O ATOM 1744 CB ILE A 119 -15.624 3.564 -6.316 1.00 0.00 C ATOM 1745 CG1 ILE A 119 -15.926 2.874 -7.658 1.00 0.00 C ATOM 1746 CG2 ILE A 119 -16.240 2.747 -5.169 1.00 0.00 C ATOM 1747 CD1 ILE A 119 -14.691 2.809 -8.548 1.00 0.00 C ATOM 0 H ILE A 119 -17.764 5.309 -7.457 1.00 0.00 H new ATOM 0 HA ILE A 119 -15.792 5.441 -5.324 1.00 0.00 H new ATOM 0 HB ILE A 119 -14.543 3.592 -6.177 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -16.295 1.865 -7.474 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -16.719 3.414 -8.175 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.891 1.716 -5.229 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -15.939 3.177 -4.214 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -17.327 2.768 -5.250 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -14.944 2.315 -9.486 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.337 3.819 -8.754 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -13.907 2.246 -8.042 1.00 0.00 H new ATOM 1759 N SER A 120 -14.072 6.100 -7.256 1.00 0.00 N ATOM 1760 CA SER A 120 -13.222 6.540 -8.349 1.00 0.00 C ATOM 1761 C SER A 120 -12.206 5.443 -8.659 1.00 0.00 C ATOM 1762 O SER A 120 -11.929 4.554 -7.848 1.00 0.00 O ATOM 1763 CB SER A 120 -12.571 7.897 -8.045 1.00 0.00 C ATOM 1764 OG SER A 120 -11.466 7.772 -7.184 1.00 0.00 O ATOM 0 H SER A 120 -13.574 5.986 -6.373 1.00 0.00 H new ATOM 0 HA SER A 120 -13.825 6.704 -9.242 1.00 0.00 H new ATOM 0 HB2 SER A 120 -12.253 8.363 -8.978 1.00 0.00 H new ATOM 0 HB3 SER A 120 -13.309 8.560 -7.593 1.00 0.00 H new ATOM 0 HG SER A 120 -10.758 8.387 -7.469 1.00 0.00 H new ATOM 1770 N THR A 121 -11.646 5.511 -9.857 1.00 0.00 N ATOM 1771 CA THR A 121 -10.530 4.680 -10.290 1.00 0.00 C ATOM 1772 C THR A 121 -9.193 5.234 -9.850 1.00 0.00 C ATOM 1773 O THR A 121 -8.182 4.534 -9.950 1.00 0.00 O ATOM 1774 CB THR A 121 -10.606 4.461 -11.809 1.00 0.00 C ATOM 1775 OG1 THR A 121 -10.847 5.670 -12.519 1.00 0.00 O ATOM 1776 CG2 THR A 121 -11.707 3.447 -12.135 1.00 0.00 C ATOM 0 H THR A 121 -11.963 6.163 -10.575 1.00 0.00 H new ATOM 0 HA THR A 121 -10.614 3.710 -9.801 1.00 0.00 H new ATOM 0 HB THR A 121 -9.637 4.079 -12.129 1.00 0.00 H new ATOM 0 HG1 THR A 121 -10.886 5.483 -13.480 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.755 3.297 -13.213 1.00 0.00 H new ATOM 0 HG22 THR A 121 -11.485 2.499 -11.646 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.666 3.823 -11.778 1.00 0.00 H new ATOM 1784 N ASP A 122 -9.187 6.442 -9.295 1.00 0.00 N ATOM 1785 CA ASP A 122 -8.001 7.270 -9.226 1.00 0.00 C ATOM 1786 C ASP A 122 -7.528 7.498 -7.792 1.00 0.00 C ATOM 1787 O ASP A 122 -6.709 8.377 -7.537 1.00 0.00 O ATOM 1788 CB ASP A 122 -8.194 8.575 -10.024 1.00 0.00 C ATOM 1789 CG ASP A 122 -9.203 9.584 -9.463 1.00 0.00 C ATOM 1790 OD1 ASP A 122 -9.753 9.413 -8.355 1.00 0.00 O ATOM 1791 OD2 ASP A 122 -9.467 10.590 -10.168 1.00 0.00 O ATOM 0 H ASP A 122 -10.014 6.871 -8.879 1.00 0.00 H new ATOM 0 HA ASP A 122 -7.187 6.726 -9.706 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -7.227 9.071 -10.104 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -8.503 8.312 -11.036 1.00 0.00 H new ATOM 1796 N ASP A 123 -8.023 6.701 -6.849 1.00 0.00 N ATOM 1797 CA ASP A 123 -7.806 6.887 -5.419 1.00 0.00 C ATOM 1798 C ASP A 123 -6.334 6.762 -4.988 1.00 0.00 C ATOM 1799 O ASP A 123 -5.990 7.261 -3.915 1.00 0.00 O ATOM 1800 CB ASP A 123 -8.708 5.914 -4.636 1.00 0.00 C ATOM 1801 CG ASP A 123 -9.696 6.654 -3.732 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -10.437 7.533 -4.219 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -9.741 6.373 -2.516 1.00 0.00 O ATOM 0 H ASP A 123 -8.600 5.888 -7.064 1.00 0.00 H new ATOM 0 HA ASP A 123 -8.078 7.916 -5.184 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.258 5.285 -5.336 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -8.089 5.252 -4.031 1.00 0.00 H new ATOM 1808 N LEU A 124 -5.433 6.147 -5.779 1.00 0.00 N ATOM 1809 CA LEU A 124 -3.985 6.125 -5.508 1.00 0.00 C ATOM 1810 C LEU A 124 -3.193 6.490 -6.758 1.00 0.00 C ATOM 1811 O LEU A 124 -3.367 5.889 -7.819 1.00 0.00 O ATOM 1812 CB LEU A 124 -3.450 4.759 -5.054 1.00 0.00 C ATOM 1813 CG LEU A 124 -3.727 4.250 -3.632 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -3.234 5.230 -2.560 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -5.187 3.875 -3.402 1.00 0.00 C ATOM 0 H LEU A 124 -5.693 5.648 -6.630 1.00 0.00 H new ATOM 0 HA LEU A 124 -3.854 6.847 -4.702 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -3.842 4.013 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.368 4.777 -5.185 1.00 0.00 H new ATOM 0 HG LEU A 124 -3.149 3.331 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -3.452 4.827 -1.571 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -2.159 5.373 -2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -3.741 6.187 -2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -5.315 3.523 -2.378 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.817 4.749 -3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.473 3.085 -4.096 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.204 7.359 -6.584 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.061 7.505 -7.482 1.00 0.00 C ATOM 1829 C ASN A 125 0.115 7.988 -6.637 1.00 0.00 C ATOM 1830 O ASN A 125 0.283 9.196 -6.450 1.00 0.00 O ATOM 1831 CB ASN A 125 -1.369 8.469 -8.646 1.00 0.00 C ATOM 1832 CG ASN A 125 -0.505 8.214 -9.878 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -1.002 7.654 -10.850 1.00 0.00 O ATOM 1834 ND2 ASN A 125 0.753 8.616 -9.937 1.00 0.00 N ATOM 0 H ASN A 125 -2.173 8.001 -5.792 1.00 0.00 H new ATOM 0 HA ASN A 125 -0.821 6.551 -7.951 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -2.420 8.374 -8.920 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -1.219 9.495 -8.310 1.00 0.00 H new ATOM 0 HD21 ASN A 125 1.299 8.459 -10.784 1.00 0.00 H new ATOM 0 HD22 ASN A 125 1.177 9.083 -9.135 1.00 0.00 H new ATOM 1841 N LEU A 126 0.903 7.080 -6.058 1.00 0.00 N ATOM 1842 CA LEU A 126 2.124 7.412 -5.317 1.00 0.00 C ATOM 1843 C LEU A 126 3.315 6.928 -6.140 1.00 0.00 C ATOM 1844 O LEU A 126 3.240 5.841 -6.719 1.00 0.00 O ATOM 1845 CB LEU A 126 2.155 6.759 -3.925 1.00 0.00 C ATOM 1846 CG LEU A 126 0.885 6.919 -3.072 1.00 0.00 C ATOM 1847 CD1 LEU A 126 1.088 6.280 -1.694 1.00 0.00 C ATOM 1848 CD2 LEU A 126 0.502 8.388 -2.875 1.00 0.00 C ATOM 0 H LEU A 126 0.709 6.079 -6.090 1.00 0.00 H new ATOM 0 HA LEU A 126 2.160 8.490 -5.162 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.352 5.694 -4.050 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.995 7.175 -3.370 1.00 0.00 H new ATOM 0 HG LEU A 126 0.079 6.420 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.182 6.400 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.305 5.219 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.921 6.766 -1.187 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.400 8.450 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.315 8.912 -2.373 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.318 8.849 -3.845 1.00 0.00 H new ATOM 1860 N TYR A 127 4.395 7.705 -6.182 1.00 0.00 N ATOM 1861 CA TYR A 127 5.600 7.449 -6.967 1.00 0.00 C ATOM 1862 C TYR A 127 6.781 8.141 -6.275 1.00 0.00 C ATOM 1863 O TYR A 127 7.243 9.203 -6.701 1.00 0.00 O ATOM 1864 CB TYR A 127 5.375 7.924 -8.413 1.00 0.00 C ATOM 1865 CG TYR A 127 6.390 7.428 -9.428 1.00 0.00 C ATOM 1866 CD1 TYR A 127 7.563 8.160 -9.706 1.00 0.00 C ATOM 1867 CD2 TYR A 127 6.121 6.251 -10.149 1.00 0.00 C ATOM 1868 CE1 TYR A 127 8.449 7.732 -10.713 1.00 0.00 C ATOM 1869 CE2 TYR A 127 7.001 5.821 -11.155 1.00 0.00 C ATOM 1870 CZ TYR A 127 8.172 6.552 -11.440 1.00 0.00 C ATOM 1871 OH TYR A 127 8.999 6.148 -12.444 1.00 0.00 O ATOM 0 H TYR A 127 4.456 8.570 -5.645 1.00 0.00 H new ATOM 0 HA TYR A 127 5.829 6.385 -7.022 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.383 7.605 -8.732 1.00 0.00 H new ATOM 0 HB3 TYR A 127 5.379 9.014 -8.424 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.783 9.055 -9.143 1.00 0.00 H new ATOM 0 HD2 TYR A 127 5.234 5.676 -9.928 1.00 0.00 H new ATOM 0 HE1 TYR A 127 9.339 8.304 -10.930 1.00 0.00 H new ATOM 0 HE2 TYR A 127 6.779 4.924 -11.714 1.00 0.00 H new ATOM 0 HH TYR A 127 8.657 5.317 -12.835 1.00 0.00 H new ATOM 1881 N TYR A 128 7.240 7.576 -5.156 1.00 0.00 N ATOM 1882 CA TYR A 128 8.474 8.052 -4.547 1.00 0.00 C ATOM 1883 C TYR A 128 9.664 7.601 -5.374 1.00 0.00 C ATOM 1884 O TYR A 128 9.653 6.491 -5.909 1.00 0.00 O ATOM 1885 CB TYR A 128 8.639 7.552 -3.104 1.00 0.00 C ATOM 1886 CG TYR A 128 8.030 8.503 -2.103 1.00 0.00 C ATOM 1887 CD1 TYR A 128 8.502 9.829 -2.040 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.936 8.102 -1.322 1.00 0.00 C ATOM 1889 CE1 TYR A 128 7.824 10.786 -1.273 1.00 0.00 C ATOM 1890 CE2 TYR A 128 6.246 9.058 -0.562 1.00 0.00 C ATOM 1891 CZ TYR A 128 6.672 10.405 -0.559 1.00 0.00 C ATOM 1892 OH TYR A 128 5.921 11.330 0.079 1.00 0.00 O ATOM 0 H TYR A 128 6.785 6.806 -4.666 1.00 0.00 H new ATOM 0 HA TYR A 128 8.424 9.140 -4.520 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.172 6.572 -3.004 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.699 7.424 -2.884 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.391 10.109 -2.586 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.628 7.067 -1.306 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.181 11.804 -1.230 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.387 8.764 0.022 1.00 0.00 H new ATOM 0 HH TYR A 128 4.980 11.214 -0.167 1.00 0.00 H new ATOM 1902 N ASN A 129 10.705 8.430 -5.367 1.00 0.00 N ATOM 1903 CA ASN A 129 12.091 8.097 -5.636 1.00 0.00 C ATOM 1904 C ASN A 129 12.909 8.856 -4.616 1.00 0.00 C ATOM 1905 O ASN A 129 12.644 10.054 -4.387 1.00 0.00 O ATOM 1906 CB ASN A 129 12.521 8.336 -7.096 1.00 0.00 C ATOM 1907 CG ASN A 129 11.857 9.512 -7.810 1.00 0.00 C ATOM 1908 OD1 ASN A 129 11.645 10.587 -7.256 1.00 0.00 O ATOM 1909 ND2 ASN A 129 11.470 9.322 -9.062 1.00 0.00 N ATOM 0 H ASN A 129 10.588 9.421 -5.158 1.00 0.00 H new ATOM 0 HA ASN A 129 12.255 7.025 -5.530 1.00 0.00 H new ATOM 0 HB2 ASN A 129 13.600 8.489 -7.115 1.00 0.00 H new ATOM 0 HB3 ASN A 129 12.317 7.430 -7.666 1.00 0.00 H new ATOM 0 HD21 ASN A 129 10.995 10.069 -9.568 1.00 0.00 H new ATOM 0 HD22 ASN A 129 11.647 8.428 -9.520 1.00 0.00 H new TER 1916 ASN A 129