USER MOD reduce.3.24.130724 H: found=0, std=0, add=873, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 871 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 33 SER OG : rot 160:sc= -0.0699 USER MOD Set 1.2: A 35 ASN : amide:sc= 0.393 K(o=0.32,f=-5.8!) USER MOD Single : A 1 MET CE :methyl -151:sc=-0.000771 (180deg=-1.37) USER MOD Single : A 1 MET N :NH3+ 163:sc= -0.47 (180deg=-1.16) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.00866 USER MOD Single : A 10 GLN : amide:sc= -1.77! C(o=-1.8!,f=-4.6!) USER MOD Single : A 12 ASN : amide:sc= -0.208 K(o=-0.21,f=-3.8!) USER MOD Single : A 13 SER OG : rot -76:sc= 1.38 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 166:sc= -0.851 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= -0.0412 X(o=-0.041,f=-4.3e-06) USER MOD Single : A 39 THR OG1 : rot -17:sc= 0.0522 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 143:sc= -0.258 (180deg=-2.34!) USER MOD Single : A 48 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.15) USER MOD Single : A 50 SER OG : rot -25:sc= 0.141 USER MOD Single : A 53 ASN : amide:sc= -7.75! C(o=-7.7!,f=-3.2!) USER MOD Single : A 56 GLN : amide:sc= 0.025 X(o=0.025,f=0) USER MOD Single : A 60 THR OG1 : rot -149:sc= 0.00829 USER MOD Single : A 62 THR OG1 : rot 24:sc= 0.62 USER MOD Single : A 65 LYS NZ :NH3+ 168:sc= -0.0168 (180deg=-0.191) USER MOD Single : A 68 LYS NZ :NH3+ 169:sc= -0.0344 (180deg=-0.246) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot -120:sc= -0.104 USER MOD Single : A 73 SER OG : rot 180:sc= 0.014 USER MOD Single : A 77 LYS NZ :NH3+ -158:sc= -0.105 (180deg=-0.512) USER MOD Single : A 80 THR OG1 : rot 65:sc= 1.29 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -173:sc= -0.0117 (180deg=-0.095) USER MOD Single : A 84 ASN : amide:sc= -1.38! K(o=-1.4!,f=0) USER MOD Single : A 92 HIS : no HD1:sc= 0.973 K(o=0.97,f=-4.9!) USER MOD Single : A 96 CYS SG : rot -24:sc= 0.938 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 166:sc= -1.37 (180deg=-1.53) USER MOD Single : A 105 LYS NZ :NH3+ 170:sc= -0.0137 (180deg=-0.134) USER MOD Single : A 107 LYS NZ :NH3+ 160:sc= 0.824 (180deg=0.612) USER MOD Single : A 108 SER OG : rot 22:sc= 0.411 USER MOD Single : A 113 LYS NZ :NH3+ -158:sc= 1.02 (180deg=0.678) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.922 29.477 22.815 1.00 0.00 N ATOM 2 CA MET A 1 8.571 29.236 22.260 1.00 0.00 C ATOM 3 C MET A 1 8.632 28.491 20.934 1.00 0.00 C ATOM 4 O MET A 1 7.627 28.364 20.232 1.00 0.00 O ATOM 5 CB MET A 1 7.811 30.559 22.091 1.00 0.00 C ATOM 6 CG MET A 1 8.647 31.682 21.491 1.00 0.00 C ATOM 7 SD MET A 1 7.875 32.460 20.058 1.00 0.00 S ATOM 8 CE MET A 1 8.056 31.168 18.828 1.00 0.00 C ATOM 0 H1 MET A 1 9.871 30.217 23.544 1.00 0.00 H new ATOM 0 H2 MET A 1 10.286 28.599 23.237 1.00 0.00 H new ATOM 0 H3 MET A 1 10.560 29.785 22.054 1.00 0.00 H new ATOM 0 HA MET A 1 8.034 28.608 22.971 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.942 30.388 21.456 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.437 30.878 23.064 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.826 32.439 22.254 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.620 31.286 21.200 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.124 31.616 17.837 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.962 30.597 19.031 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.192 30.504 18.868 1.00 0.00 H new ATOM 18 N VAL A 2 9.804 27.987 20.602 1.00 0.00 N ATOM 19 CA VAL A 2 9.984 27.225 19.380 1.00 0.00 C ATOM 20 C VAL A 2 10.431 25.797 19.698 1.00 0.00 C ATOM 21 O VAL A 2 11.538 25.565 20.187 1.00 0.00 O ATOM 22 CB VAL A 2 10.986 27.912 18.416 1.00 0.00 C ATOM 23 CG1 VAL A 2 12.323 28.188 19.091 1.00 0.00 C ATOM 24 CG2 VAL A 2 11.183 27.074 17.166 1.00 0.00 C ATOM 0 H VAL A 2 10.649 28.091 21.163 1.00 0.00 H new ATOM 0 HA VAL A 2 9.020 27.184 18.873 1.00 0.00 H new ATOM 0 HB VAL A 2 10.559 28.873 18.131 1.00 0.00 H new ATOM 0 HG11 VAL A 2 12.996 28.670 18.382 1.00 0.00 H new ATOM 0 HG12 VAL A 2 12.169 28.844 19.948 1.00 0.00 H new ATOM 0 HG13 VAL A 2 12.762 27.248 19.427 1.00 0.00 H new ATOM 0 HG21 VAL A 2 11.889 27.572 16.502 1.00 0.00 H new ATOM 0 HG22 VAL A 2 11.574 26.095 17.442 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.228 26.953 16.655 1.00 0.00 H new ATOM 34 N SER A 3 9.551 24.845 19.441 1.00 0.00 N ATOM 35 CA SER A 3 9.838 23.452 19.727 1.00 0.00 C ATOM 36 C SER A 3 10.795 22.870 18.692 1.00 0.00 C ATOM 37 O SER A 3 10.706 23.177 17.502 1.00 0.00 O ATOM 38 CB SER A 3 8.546 22.654 19.749 1.00 0.00 C ATOM 39 OG SER A 3 7.576 23.290 20.567 1.00 0.00 O ATOM 0 H SER A 3 8.631 25.013 19.034 1.00 0.00 H new ATOM 0 HA SER A 3 10.316 23.392 20.705 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.161 22.549 18.735 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.740 21.648 20.122 1.00 0.00 H new ATOM 0 HG SER A 3 6.751 22.762 20.567 1.00 0.00 H new ATOM 45 N THR A 4 11.695 22.021 19.153 1.00 0.00 N ATOM 46 CA THR A 4 12.730 21.458 18.306 1.00 0.00 C ATOM 47 C THR A 4 12.347 20.070 17.811 1.00 0.00 C ATOM 48 O THR A 4 13.102 19.418 17.087 1.00 0.00 O ATOM 49 CB THR A 4 14.051 21.399 19.083 1.00 0.00 C ATOM 50 OG1 THR A 4 13.849 20.712 20.328 1.00 0.00 O ATOM 51 CG2 THR A 4 14.546 22.807 19.358 1.00 0.00 C ATOM 0 H THR A 4 11.729 21.703 20.122 1.00 0.00 H new ATOM 0 HA THR A 4 12.848 22.099 17.433 1.00 0.00 H new ATOM 0 HB THR A 4 14.792 20.864 18.489 1.00 0.00 H new ATOM 0 HG1 THR A 4 14.695 20.674 20.822 1.00 0.00 H new ATOM 0 HG21 THR A 4 15.485 22.761 19.910 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.705 23.328 18.414 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.804 23.345 19.948 1.00 0.00 H new ATOM 59 N LEU A 5 11.168 19.623 18.208 1.00 0.00 N ATOM 60 CA LEU A 5 10.658 18.332 17.784 1.00 0.00 C ATOM 61 C LEU A 5 9.487 18.523 16.834 1.00 0.00 C ATOM 62 O LEU A 5 8.868 19.589 16.817 1.00 0.00 O ATOM 63 CB LEU A 5 10.214 17.515 18.999 1.00 0.00 C ATOM 64 CG LEU A 5 11.289 17.302 20.059 1.00 0.00 C ATOM 65 CD1 LEU A 5 10.680 16.681 21.300 1.00 0.00 C ATOM 66 CD2 LEU A 5 12.407 16.424 19.517 1.00 0.00 C ATOM 0 H LEU A 5 10.543 20.139 18.827 1.00 0.00 H new ATOM 0 HA LEU A 5 11.452 17.793 17.267 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.362 18.013 19.462 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.865 16.541 18.656 1.00 0.00 H new ATOM 0 HG LEU A 5 11.714 18.270 20.325 1.00 0.00 H new ATOM 0 HD11 LEU A 5 11.456 16.533 22.051 1.00 0.00 H new ATOM 0 HD12 LEU A 5 9.911 17.343 21.698 1.00 0.00 H new ATOM 0 HD13 LEU A 5 10.234 15.720 21.045 1.00 0.00 H new ATOM 0 HD21 LEU A 5 13.165 16.283 20.288 1.00 0.00 H new ATOM 0 HD22 LEU A 5 12.000 15.455 19.226 1.00 0.00 H new ATOM 0 HD23 LEU A 5 12.858 16.904 18.648 1.00 0.00 H new ATOM 78 N PRO A 6 9.176 17.506 16.020 1.00 0.00 N ATOM 79 CA PRO A 6 7.999 17.534 15.160 1.00 0.00 C ATOM 80 C PRO A 6 6.726 17.391 15.985 1.00 0.00 C ATOM 81 O PRO A 6 6.766 16.890 17.114 1.00 0.00 O ATOM 82 CB PRO A 6 8.195 16.324 14.245 1.00 0.00 C ATOM 83 CG PRO A 6 9.023 15.387 15.047 1.00 0.00 C ATOM 84 CD PRO A 6 9.935 16.252 15.877 1.00 0.00 C ATOM 0 HA PRO A 6 7.896 18.469 14.609 1.00 0.00 H new ATOM 0 HB2 PRO A 6 7.241 15.875 13.969 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.696 16.603 13.318 1.00 0.00 H new ATOM 0 HG2 PRO A 6 8.398 14.757 15.680 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.596 14.721 14.402 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.148 15.798 16.845 1.00 0.00 H new ATOM 0 HD3 PRO A 6 10.893 16.416 15.384 1.00 0.00 H new ATOM 92 N PRO A 7 5.588 17.845 15.453 1.00 0.00 N ATOM 93 CA PRO A 7 4.313 17.777 16.158 1.00 0.00 C ATOM 94 C PRO A 7 3.818 16.353 16.369 1.00 0.00 C ATOM 95 O PRO A 7 4.486 15.371 16.040 1.00 0.00 O ATOM 96 CB PRO A 7 3.336 18.522 15.246 1.00 0.00 C ATOM 97 CG PRO A 7 4.183 19.271 14.281 1.00 0.00 C ATOM 98 CD PRO A 7 5.449 18.476 14.137 1.00 0.00 C ATOM 0 HA PRO A 7 4.408 18.204 17.157 1.00 0.00 H new ATOM 0 HB2 PRO A 7 2.674 17.827 14.729 1.00 0.00 H new ATOM 0 HB3 PRO A 7 2.703 19.199 15.819 1.00 0.00 H new ATOM 0 HG2 PRO A 7 3.679 19.379 13.321 1.00 0.00 H new ATOM 0 HG3 PRO A 7 4.393 20.277 14.645 1.00 0.00 H new ATOM 0 HD2 PRO A 7 5.374 17.736 13.340 1.00 0.00 H new ATOM 0 HD3 PRO A 7 6.302 19.113 13.902 1.00 0.00 H new ATOM 106 N CYS A 8 2.621 16.268 16.902 1.00 0.00 N ATOM 107 CA CYS A 8 1.980 15.004 17.180 1.00 0.00 C ATOM 108 C CYS A 8 0.990 14.685 16.073 1.00 0.00 C ATOM 109 O CYS A 8 0.094 15.472 15.808 1.00 0.00 O ATOM 110 CB CYS A 8 1.263 15.117 18.524 1.00 0.00 C ATOM 111 SG CYS A 8 0.224 13.702 19.006 1.00 0.00 S ATOM 0 H CYS A 8 2.060 17.081 17.157 1.00 0.00 H new ATOM 0 HA CYS A 8 2.716 14.201 17.225 1.00 0.00 H new ATOM 0 HB2 CYS A 8 2.013 15.271 19.300 1.00 0.00 H new ATOM 0 HB3 CYS A 8 0.638 16.009 18.504 1.00 0.00 H new ATOM 116 N PRO A 9 1.126 13.533 15.407 1.00 0.00 N ATOM 117 CA PRO A 9 0.200 13.141 14.342 1.00 0.00 C ATOM 118 C PRO A 9 -1.182 12.789 14.885 1.00 0.00 C ATOM 119 O PRO A 9 -2.054 12.316 14.155 1.00 0.00 O ATOM 120 CB PRO A 9 0.869 11.923 13.706 1.00 0.00 C ATOM 121 CG PRO A 9 1.762 11.371 14.764 1.00 0.00 C ATOM 122 CD PRO A 9 2.188 12.535 15.620 1.00 0.00 C ATOM 0 HA PRO A 9 0.025 13.950 13.632 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.129 11.187 13.391 1.00 0.00 H new ATOM 0 HB3 PRO A 9 1.436 12.204 12.819 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.240 10.623 15.360 1.00 0.00 H new ATOM 0 HG3 PRO A 9 2.628 10.878 14.322 1.00 0.00 H new ATOM 0 HD2 PRO A 9 2.267 12.252 16.670 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.163 12.918 15.319 1.00 0.00 H new ATOM 130 N GLN A 10 -1.366 13.034 16.174 1.00 0.00 N ATOM 131 CA GLN A 10 -2.644 12.847 16.824 1.00 0.00 C ATOM 132 C GLN A 10 -3.325 14.184 17.040 1.00 0.00 C ATOM 133 O GLN A 10 -4.466 14.376 16.630 1.00 0.00 O ATOM 134 CB GLN A 10 -2.481 12.154 18.171 1.00 0.00 C ATOM 135 CG GLN A 10 -2.220 10.675 18.088 1.00 0.00 C ATOM 136 CD GLN A 10 -0.786 10.345 17.761 1.00 0.00 C ATOM 137 OE1 GLN A 10 -0.420 10.175 16.601 1.00 0.00 O ATOM 138 NE2 GLN A 10 0.041 10.278 18.785 1.00 0.00 N ATOM 0 H GLN A 10 -0.629 13.368 16.795 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.254 12.220 16.174 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -1.659 12.625 18.710 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -3.383 12.318 18.760 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.486 10.211 19.038 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.869 10.240 17.328 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -0.307 10.426 19.732 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.029 10.078 18.630 1.00 0.00 H new ATOM 147 N CYS A 11 -2.629 15.114 17.691 1.00 0.00 N ATOM 148 CA CYS A 11 -3.229 16.406 18.038 1.00 0.00 C ATOM 149 C CYS A 11 -2.507 17.572 17.362 1.00 0.00 C ATOM 150 O CYS A 11 -3.113 18.621 17.136 1.00 0.00 O ATOM 151 CB CYS A 11 -3.249 16.618 19.562 1.00 0.00 C ATOM 152 SG CYS A 11 -1.609 16.641 20.368 1.00 0.00 S ATOM 0 H CYS A 11 -1.659 15.002 17.987 1.00 0.00 H new ATOM 0 HA CYS A 11 -4.255 16.383 17.670 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -3.753 17.561 19.775 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -3.847 15.827 20.015 1.00 0.00 H new ATOM 157 N ASN A 12 -1.206 17.398 17.083 1.00 0.00 N ATOM 158 CA ASN A 12 -0.407 18.366 16.300 1.00 0.00 C ATOM 159 C ASN A 12 -0.035 19.608 17.117 1.00 0.00 C ATOM 160 O ASN A 12 0.996 20.225 16.870 1.00 0.00 O ATOM 161 CB ASN A 12 -1.187 18.758 15.041 1.00 0.00 C ATOM 162 CG ASN A 12 -0.364 19.540 14.034 1.00 0.00 C ATOM 163 OD1 ASN A 12 0.824 19.296 13.856 1.00 0.00 O ATOM 164 ND2 ASN A 12 -0.997 20.494 13.371 1.00 0.00 N ATOM 0 H ASN A 12 -0.674 16.584 17.392 1.00 0.00 H new ATOM 0 HA ASN A 12 0.531 17.887 16.020 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -1.567 17.855 14.564 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -2.053 19.354 15.331 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -0.495 21.056 12.684 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -1.987 20.667 13.547 1.00 0.00 H new ATOM 171 N SER A 13 -0.893 19.928 18.080 1.00 0.00 N ATOM 172 CA SER A 13 -0.768 21.108 18.947 1.00 0.00 C ATOM 173 C SER A 13 0.691 21.500 19.239 1.00 0.00 C ATOM 174 O SER A 13 1.202 22.450 18.639 1.00 0.00 O ATOM 175 CB SER A 13 -1.525 20.860 20.253 1.00 0.00 C ATOM 176 OG SER A 13 -1.060 19.690 20.910 1.00 0.00 O ATOM 0 H SER A 13 -1.717 19.364 18.289 1.00 0.00 H new ATOM 0 HA SER A 13 -1.204 21.950 18.409 1.00 0.00 H new ATOM 0 HB2 SER A 13 -1.407 21.720 20.912 1.00 0.00 H new ATOM 0 HB3 SER A 13 -2.590 20.762 20.044 1.00 0.00 H new ATOM 0 HG SER A 13 -1.411 18.897 20.453 1.00 0.00 H new ATOM 182 N GLU A 14 1.349 20.754 20.134 1.00 0.00 N ATOM 183 CA GLU A 14 2.761 20.999 20.492 1.00 0.00 C ATOM 184 C GLU A 14 3.207 20.188 21.716 1.00 0.00 C ATOM 185 O GLU A 14 4.385 20.204 22.072 1.00 0.00 O ATOM 186 CB GLU A 14 3.026 22.486 20.784 1.00 0.00 C ATOM 187 CG GLU A 14 2.227 23.043 21.952 1.00 0.00 C ATOM 188 CD GLU A 14 2.699 24.419 22.373 1.00 0.00 C ATOM 189 OE1 GLU A 14 3.605 24.500 23.228 1.00 0.00 O ATOM 190 OE2 GLU A 14 2.167 25.425 21.855 1.00 0.00 O ATOM 0 H GLU A 14 0.927 19.969 20.630 1.00 0.00 H new ATOM 0 HA GLU A 14 3.336 20.681 19.622 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.088 22.621 20.987 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.796 23.067 19.891 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.173 23.092 21.677 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.304 22.361 22.799 1.00 0.00 H new ATOM 197 N TYR A 15 2.285 19.467 22.353 1.00 0.00 N ATOM 198 CA TYR A 15 2.571 18.801 23.625 1.00 0.00 C ATOM 199 C TYR A 15 3.299 17.481 23.419 1.00 0.00 C ATOM 200 O TYR A 15 2.994 16.479 24.058 1.00 0.00 O ATOM 201 CB TYR A 15 1.274 18.574 24.402 1.00 0.00 C ATOM 202 CG TYR A 15 0.673 19.852 24.940 1.00 0.00 C ATOM 203 CD1 TYR A 15 -0.121 20.662 24.139 1.00 0.00 C ATOM 204 CD2 TYR A 15 0.914 20.253 26.247 1.00 0.00 C ATOM 205 CE1 TYR A 15 -0.660 21.835 24.627 1.00 0.00 C ATOM 206 CE2 TYR A 15 0.380 21.426 26.741 1.00 0.00 C ATOM 207 CZ TYR A 15 -0.406 22.212 25.927 1.00 0.00 C ATOM 208 OH TYR A 15 -0.939 23.383 26.412 1.00 0.00 O ATOM 0 H TYR A 15 1.334 19.329 22.010 1.00 0.00 H new ATOM 0 HA TYR A 15 3.228 19.453 24.201 1.00 0.00 H new ATOM 0 HB2 TYR A 15 0.549 18.084 23.752 1.00 0.00 H new ATOM 0 HB3 TYR A 15 1.469 17.894 25.231 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -0.320 20.370 23.119 1.00 0.00 H new ATOM 0 HD2 TYR A 15 1.529 19.638 26.887 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -1.278 22.454 23.993 1.00 0.00 H new ATOM 0 HE2 TYR A 15 0.577 21.726 27.760 1.00 0.00 H new ATOM 0 HH TYR A 15 -0.667 23.504 27.346 1.00 0.00 H new ATOM 218 N THR A 16 4.257 17.490 22.518 1.00 0.00 N ATOM 219 CA THR A 16 5.086 16.337 22.269 1.00 0.00 C ATOM 220 C THR A 16 6.504 16.594 22.788 1.00 0.00 C ATOM 221 O THR A 16 6.976 17.731 22.772 1.00 0.00 O ATOM 222 CB THR A 16 5.109 16.047 20.761 1.00 0.00 C ATOM 223 OG1 THR A 16 3.803 16.295 20.220 1.00 0.00 O ATOM 224 CG2 THR A 16 5.490 14.606 20.493 1.00 0.00 C ATOM 0 H THR A 16 4.481 18.299 21.938 1.00 0.00 H new ATOM 0 HA THR A 16 4.679 15.471 22.792 1.00 0.00 H new ATOM 0 HB THR A 16 5.849 16.695 20.291 1.00 0.00 H new ATOM 0 HG1 THR A 16 3.856 16.334 19.242 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.499 14.426 19.418 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.481 14.410 20.902 1.00 0.00 H new ATOM 0 HG23 THR A 16 4.764 13.944 20.966 1.00 0.00 H new ATOM 232 N TYR A 17 7.179 15.543 23.231 1.00 0.00 N ATOM 233 CA TYR A 17 8.505 15.676 23.814 1.00 0.00 C ATOM 234 C TYR A 17 9.306 14.414 23.554 1.00 0.00 C ATOM 235 O TYR A 17 8.776 13.434 23.030 1.00 0.00 O ATOM 236 CB TYR A 17 8.451 15.976 25.324 1.00 0.00 C ATOM 237 CG TYR A 17 8.049 14.809 26.211 1.00 0.00 C ATOM 238 CD1 TYR A 17 9.009 13.932 26.703 1.00 0.00 C ATOM 239 CD2 TYR A 17 6.724 14.594 26.574 1.00 0.00 C ATOM 240 CE1 TYR A 17 8.667 12.876 27.521 1.00 0.00 C ATOM 241 CE2 TYR A 17 6.373 13.539 27.397 1.00 0.00 C ATOM 242 CZ TYR A 17 7.347 12.683 27.867 1.00 0.00 C ATOM 243 OH TYR A 17 6.996 11.630 28.683 1.00 0.00 O ATOM 0 H TYR A 17 6.828 14.586 23.197 1.00 0.00 H new ATOM 0 HA TYR A 17 8.994 16.526 23.338 1.00 0.00 H new ATOM 0 HB2 TYR A 17 9.432 16.329 25.641 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.749 16.793 25.489 1.00 0.00 H new ATOM 0 HD1 TYR A 17 10.045 14.081 26.439 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.957 15.261 26.208 1.00 0.00 H new ATOM 0 HE1 TYR A 17 9.429 12.204 27.888 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.339 13.386 27.671 1.00 0.00 H new ATOM 0 HH TYR A 17 6.027 11.639 28.830 1.00 0.00 H new ATOM 253 N GLU A 18 10.571 14.434 23.920 1.00 0.00 N ATOM 254 CA GLU A 18 11.464 13.325 23.666 1.00 0.00 C ATOM 255 C GLU A 18 11.696 12.499 24.931 1.00 0.00 C ATOM 256 O GLU A 18 12.247 12.984 25.923 1.00 0.00 O ATOM 257 CB GLU A 18 12.802 13.850 23.124 1.00 0.00 C ATOM 258 CG GLU A 18 13.484 14.886 24.021 1.00 0.00 C ATOM 259 CD GLU A 18 12.961 16.303 23.848 1.00 0.00 C ATOM 260 OE1 GLU A 18 11.911 16.636 24.437 1.00 0.00 O ATOM 261 OE2 GLU A 18 13.618 17.100 23.143 1.00 0.00 O ATOM 0 H GLU A 18 11.008 15.220 24.402 1.00 0.00 H new ATOM 0 HA GLU A 18 11.001 12.676 22.923 1.00 0.00 H new ATOM 0 HB2 GLU A 18 13.479 13.007 22.983 1.00 0.00 H new ATOM 0 HB3 GLU A 18 12.634 14.292 22.142 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.357 14.589 25.062 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.555 14.879 23.816 1.00 0.00 H new ATOM 268 N ASP A 19 11.257 11.253 24.903 1.00 0.00 N ATOM 269 CA ASP A 19 11.528 10.333 25.992 1.00 0.00 C ATOM 270 C ASP A 19 12.249 9.103 25.461 1.00 0.00 C ATOM 271 O ASP A 19 11.624 8.094 25.145 1.00 0.00 O ATOM 272 CB ASP A 19 10.243 9.908 26.696 1.00 0.00 C ATOM 273 CG ASP A 19 10.526 9.292 28.052 1.00 0.00 C ATOM 274 OD1 ASP A 19 10.657 10.051 29.035 1.00 0.00 O ATOM 275 OD2 ASP A 19 10.630 8.051 28.144 1.00 0.00 O ATOM 0 H ASP A 19 10.712 10.856 24.138 1.00 0.00 H new ATOM 0 HA ASP A 19 12.159 10.848 26.717 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.591 10.773 26.818 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.707 9.190 26.075 1.00 0.00 H new ATOM 280 N GLY A 20 13.560 9.205 25.322 1.00 0.00 N ATOM 281 CA GLY A 20 14.336 8.096 24.811 1.00 0.00 C ATOM 282 C GLY A 20 14.592 8.210 23.321 1.00 0.00 C ATOM 283 O GLY A 20 15.069 9.238 22.842 1.00 0.00 O ATOM 0 H GLY A 20 14.102 10.037 25.554 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.289 8.049 25.338 1.00 0.00 H new ATOM 0 HA3 GLY A 20 13.811 7.163 25.017 1.00 0.00 H new ATOM 287 N ALA A 21 14.243 7.163 22.588 1.00 0.00 N ATOM 288 CA ALA A 21 14.527 7.091 21.160 1.00 0.00 C ATOM 289 C ALA A 21 13.283 7.385 20.331 1.00 0.00 C ATOM 290 O ALA A 21 13.231 7.084 19.137 1.00 0.00 O ATOM 291 CB ALA A 21 15.078 5.720 20.813 1.00 0.00 C ATOM 0 H ALA A 21 13.759 6.346 22.961 1.00 0.00 H new ATOM 0 HA ALA A 21 15.272 7.850 20.922 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.288 5.672 19.745 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.997 5.545 21.372 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.345 4.957 21.073 1.00 0.00 H new ATOM 297 N LEU A 22 12.292 7.992 20.961 1.00 0.00 N ATOM 298 CA LEU A 22 11.061 8.328 20.276 1.00 0.00 C ATOM 299 C LEU A 22 10.499 9.614 20.844 1.00 0.00 C ATOM 300 O LEU A 22 11.157 10.285 21.632 1.00 0.00 O ATOM 301 CB LEU A 22 10.021 7.206 20.383 1.00 0.00 C ATOM 302 CG LEU A 22 9.258 7.115 21.709 1.00 0.00 C ATOM 303 CD1 LEU A 22 8.056 6.204 21.554 1.00 0.00 C ATOM 304 CD2 LEU A 22 10.154 6.616 22.832 1.00 0.00 C ATOM 0 H LEU A 22 12.318 8.261 21.945 1.00 0.00 H new ATOM 0 HA LEU A 22 11.291 8.460 19.219 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.296 7.333 19.579 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.524 6.255 20.211 1.00 0.00 H new ATOM 0 HG LEU A 22 8.919 8.117 21.973 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.520 6.145 22.501 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.394 6.603 20.786 1.00 0.00 H new ATOM 0 HD13 LEU A 22 8.390 5.208 21.263 1.00 0.00 H new ATOM 0 HD21 LEU A 22 9.582 6.563 23.758 1.00 0.00 H new ATOM 0 HD22 LEU A 22 10.532 5.625 22.582 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.991 7.302 22.962 1.00 0.00 H new ATOM 316 N LEU A 23 9.314 9.975 20.395 1.00 0.00 N ATOM 317 CA LEU A 23 8.588 11.105 20.940 1.00 0.00 C ATOM 318 C LEU A 23 7.259 10.609 21.488 1.00 0.00 C ATOM 319 O LEU A 23 6.593 9.798 20.854 1.00 0.00 O ATOM 320 CB LEU A 23 8.336 12.146 19.851 1.00 0.00 C ATOM 321 CG LEU A 23 9.536 12.465 18.962 1.00 0.00 C ATOM 322 CD1 LEU A 23 9.135 13.440 17.874 1.00 0.00 C ATOM 323 CD2 LEU A 23 10.686 13.022 19.783 1.00 0.00 C ATOM 0 H LEU A 23 8.826 9.492 19.640 1.00 0.00 H new ATOM 0 HA LEU A 23 9.174 11.567 21.734 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.520 11.796 19.219 1.00 0.00 H new ATOM 0 HB3 LEU A 23 8.000 13.069 20.324 1.00 0.00 H new ATOM 0 HG LEU A 23 9.875 11.540 18.495 1.00 0.00 H new ATOM 0 HD11 LEU A 23 9.999 13.660 17.246 1.00 0.00 H new ATOM 0 HD12 LEU A 23 8.346 13.000 17.264 1.00 0.00 H new ATOM 0 HD13 LEU A 23 8.772 14.362 18.328 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.529 13.241 19.127 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.367 13.937 20.282 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.989 12.288 20.530 1.00 0.00 H new ATOM 335 N VAL A 24 6.856 11.071 22.652 1.00 0.00 N ATOM 336 CA VAL A 24 5.596 10.617 23.210 1.00 0.00 C ATOM 337 C VAL A 24 4.724 11.819 23.520 1.00 0.00 C ATOM 338 O VAL A 24 5.226 12.876 23.905 1.00 0.00 O ATOM 339 CB VAL A 24 5.773 9.734 24.480 1.00 0.00 C ATOM 340 CG1 VAL A 24 7.099 8.991 24.454 1.00 0.00 C ATOM 341 CG2 VAL A 24 5.630 10.535 25.765 1.00 0.00 C ATOM 0 H VAL A 24 7.367 11.745 23.221 1.00 0.00 H new ATOM 0 HA VAL A 24 5.117 9.984 22.463 1.00 0.00 H new ATOM 0 HB VAL A 24 4.967 9.000 24.465 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.193 8.383 25.354 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.138 8.347 23.575 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.918 9.709 24.414 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.762 9.875 26.622 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.387 11.319 25.791 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.639 10.986 25.804 1.00 0.00 H new ATOM 351 N CYS A 25 3.434 11.679 23.317 1.00 0.00 N ATOM 352 CA CYS A 25 2.517 12.761 23.604 1.00 0.00 C ATOM 353 C CYS A 25 1.769 12.478 24.892 1.00 0.00 C ATOM 354 O CYS A 25 0.849 11.656 24.919 1.00 0.00 O ATOM 355 CB CYS A 25 1.531 12.958 22.455 1.00 0.00 C ATOM 356 SG CYS A 25 0.345 14.324 22.703 1.00 0.00 S ATOM 0 H CYS A 25 2.996 10.831 22.956 1.00 0.00 H new ATOM 0 HA CYS A 25 3.093 13.679 23.719 1.00 0.00 H new ATOM 0 HB2 CYS A 25 2.092 13.142 21.539 1.00 0.00 H new ATOM 0 HB3 CYS A 25 0.975 12.032 22.307 1.00 0.00 H new ATOM 361 N PRO A 26 2.155 13.162 25.977 1.00 0.00 N ATOM 362 CA PRO A 26 1.510 13.012 27.279 1.00 0.00 C ATOM 363 C PRO A 26 0.043 13.411 27.215 1.00 0.00 C ATOM 364 O PRO A 26 -0.772 12.988 28.037 1.00 0.00 O ATOM 365 CB PRO A 26 2.289 13.970 28.187 1.00 0.00 C ATOM 366 CG PRO A 26 2.961 14.922 27.261 1.00 0.00 C ATOM 367 CD PRO A 26 3.252 14.139 26.017 1.00 0.00 C ATOM 0 HA PRO A 26 1.525 11.982 27.634 1.00 0.00 H new ATOM 0 HB2 PRO A 26 1.622 14.492 28.873 1.00 0.00 H new ATOM 0 HB3 PRO A 26 3.016 13.432 28.796 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.320 15.777 27.045 1.00 0.00 H new ATOM 0 HG3 PRO A 26 3.878 15.314 27.700 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.258 14.775 25.132 1.00 0.00 H new ATOM 0 HD3 PRO A 26 4.225 13.651 26.066 1.00 0.00 H new ATOM 375 N GLU A 27 -0.286 14.220 26.216 1.00 0.00 N ATOM 376 CA GLU A 27 -1.643 14.687 26.034 1.00 0.00 C ATOM 377 C GLU A 27 -2.528 13.572 25.488 1.00 0.00 C ATOM 378 O GLU A 27 -3.503 13.188 26.135 1.00 0.00 O ATOM 379 CB GLU A 27 -1.679 15.911 25.116 1.00 0.00 C ATOM 380 CG GLU A 27 -3.060 16.534 24.992 1.00 0.00 C ATOM 381 CD GLU A 27 -3.740 16.702 26.337 1.00 0.00 C ATOM 382 OE1 GLU A 27 -3.102 17.236 27.269 1.00 0.00 O ATOM 383 OE2 GLU A 27 -4.905 16.263 26.476 1.00 0.00 O ATOM 0 H GLU A 27 0.375 14.564 25.520 1.00 0.00 H new ATOM 0 HA GLU A 27 -2.034 14.984 27.007 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.984 16.660 25.495 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.329 15.623 24.125 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.975 17.506 24.507 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.681 15.910 24.349 1.00 0.00 H new ATOM 390 N CYS A 28 -2.201 13.030 24.314 1.00 0.00 N ATOM 391 CA CYS A 28 -3.012 11.986 23.705 1.00 0.00 C ATOM 392 C CYS A 28 -2.841 10.644 24.390 1.00 0.00 C ATOM 393 O CYS A 28 -3.595 9.714 24.097 1.00 0.00 O ATOM 394 CB CYS A 28 -2.619 11.804 22.235 1.00 0.00 C ATOM 395 SG CYS A 28 -2.953 13.230 21.156 1.00 0.00 S ATOM 0 H CYS A 28 -1.381 13.299 23.770 1.00 0.00 H new ATOM 0 HA CYS A 28 -4.049 12.307 23.805 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -1.554 11.575 22.187 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -3.150 10.938 21.839 1.00 0.00 H new ATOM 400 N ALA A 29 -1.862 10.526 25.289 1.00 0.00 N ATOM 401 CA ALA A 29 -1.489 9.230 25.838 1.00 0.00 C ATOM 402 C ALA A 29 -1.135 8.258 24.716 1.00 0.00 C ATOM 403 O ALA A 29 -1.553 7.100 24.717 1.00 0.00 O ATOM 404 CB ALA A 29 -2.605 8.680 26.715 1.00 0.00 C ATOM 0 H ALA A 29 -1.318 11.311 25.648 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.605 9.356 26.464 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -2.308 7.711 27.116 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.796 9.370 27.537 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.511 8.564 26.121 1.00 0.00 H new ATOM 410 N HIS A 30 -0.356 8.743 23.759 1.00 0.00 N ATOM 411 CA HIS A 30 0.049 7.940 22.612 1.00 0.00 C ATOM 412 C HIS A 30 1.461 8.296 22.177 1.00 0.00 C ATOM 413 O HIS A 30 1.756 9.456 21.877 1.00 0.00 O ATOM 414 CB HIS A 30 -0.920 8.120 21.437 1.00 0.00 C ATOM 415 CG HIS A 30 -2.137 7.251 21.523 1.00 0.00 C ATOM 416 ND1 HIS A 30 -3.427 7.736 21.450 1.00 0.00 N ATOM 417 CD2 HIS A 30 -2.251 5.910 21.671 1.00 0.00 C ATOM 418 CE1 HIS A 30 -4.277 6.732 21.553 1.00 0.00 C ATOM 419 NE2 HIS A 30 -3.590 5.615 21.686 1.00 0.00 N ATOM 0 H HIS A 30 0.010 9.695 23.754 1.00 0.00 H new ATOM 0 HA HIS A 30 0.027 6.895 22.919 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.232 9.163 21.391 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.394 7.903 20.507 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -1.439 5.204 21.761 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -5.354 6.812 21.532 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -3.990 4.682 21.784 1.00 0.00 H new ATOM 428 N GLU A 31 2.327 7.295 22.154 1.00 0.00 N ATOM 429 CA GLU A 31 3.717 7.482 21.771 1.00 0.00 C ATOM 430 C GLU A 31 3.876 7.245 20.274 1.00 0.00 C ATOM 431 O GLU A 31 3.049 6.568 19.660 1.00 0.00 O ATOM 432 CB GLU A 31 4.629 6.515 22.540 1.00 0.00 C ATOM 433 CG GLU A 31 4.473 6.554 24.057 1.00 0.00 C ATOM 434 CD GLU A 31 3.277 5.765 24.556 1.00 0.00 C ATOM 435 OE1 GLU A 31 3.328 4.516 24.520 1.00 0.00 O ATOM 436 OE2 GLU A 31 2.281 6.384 24.983 1.00 0.00 O ATOM 0 H GLU A 31 2.087 6.334 22.399 1.00 0.00 H new ATOM 0 HA GLU A 31 4.005 8.504 22.015 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.431 5.500 22.195 1.00 0.00 H new ATOM 0 HB3 GLU A 31 5.666 6.740 22.290 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.378 6.160 24.519 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.376 7.591 24.379 1.00 0.00 H new ATOM 443 N TRP A 32 4.932 7.794 19.690 1.00 0.00 N ATOM 444 CA TRP A 32 5.186 7.628 18.266 1.00 0.00 C ATOM 445 C TRP A 32 6.658 7.872 17.973 1.00 0.00 C ATOM 446 O TRP A 32 7.370 8.420 18.796 1.00 0.00 O ATOM 447 CB TRP A 32 4.300 8.576 17.443 1.00 0.00 C ATOM 448 CG TRP A 32 4.945 9.885 17.074 1.00 0.00 C ATOM 449 CD1 TRP A 32 5.400 10.851 17.923 1.00 0.00 C ATOM 450 CD2 TRP A 32 5.186 10.373 15.750 1.00 0.00 C ATOM 451 NE1 TRP A 32 5.920 11.903 17.207 1.00 0.00 N ATOM 452 CE2 TRP A 32 5.796 11.634 15.872 1.00 0.00 C ATOM 453 CE3 TRP A 32 4.948 9.862 14.472 1.00 0.00 C ATOM 454 CZ2 TRP A 32 6.170 12.391 14.765 1.00 0.00 C ATOM 455 CZ3 TRP A 32 5.316 10.616 13.374 1.00 0.00 C ATOM 456 CH2 TRP A 32 5.923 11.868 13.527 1.00 0.00 C ATOM 0 H TRP A 32 5.626 8.358 20.180 1.00 0.00 H new ATOM 0 HA TRP A 32 4.937 6.606 17.980 1.00 0.00 H new ATOM 0 HB2 TRP A 32 3.998 8.066 16.528 1.00 0.00 H new ATOM 0 HB3 TRP A 32 3.391 8.782 18.008 1.00 0.00 H new ATOM 0 HD1 TRP A 32 5.358 10.797 19.001 1.00 0.00 H new ATOM 0 HE1 TRP A 32 6.331 12.747 17.606 1.00 0.00 H new ATOM 0 HE3 TRP A 32 4.485 8.895 14.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 6.639 13.357 14.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 5.132 10.233 12.381 1.00 0.00 H new ATOM 0 HH2 TRP A 32 6.202 12.432 12.649 1.00 0.00 H new ATOM 467 N SER A 33 7.122 7.441 16.826 1.00 0.00 N ATOM 468 CA SER A 33 8.502 7.680 16.451 1.00 0.00 C ATOM 469 C SER A 33 8.554 8.371 15.095 1.00 0.00 C ATOM 470 O SER A 33 8.006 7.870 14.119 1.00 0.00 O ATOM 471 CB SER A 33 9.285 6.368 16.432 1.00 0.00 C ATOM 472 OG SER A 33 10.671 6.601 16.242 1.00 0.00 O ATOM 0 H SER A 33 6.573 6.926 16.138 1.00 0.00 H new ATOM 0 HA SER A 33 8.967 8.333 17.190 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.128 5.834 17.369 1.00 0.00 H new ATOM 0 HB3 SER A 33 8.908 5.728 15.634 1.00 0.00 H new ATOM 0 HG SER A 33 11.179 5.820 16.546 1.00 0.00 H new ATOM 478 N PRO A 34 9.217 9.536 15.019 1.00 0.00 N ATOM 479 CA PRO A 34 9.227 10.376 13.813 1.00 0.00 C ATOM 480 C PRO A 34 9.752 9.645 12.581 1.00 0.00 C ATOM 481 O PRO A 34 9.335 9.921 11.458 1.00 0.00 O ATOM 482 CB PRO A 34 10.159 11.537 14.182 1.00 0.00 C ATOM 483 CG PRO A 34 10.931 11.064 15.366 1.00 0.00 C ATOM 484 CD PRO A 34 10.022 10.124 16.099 1.00 0.00 C ATOM 0 HA PRO A 34 8.219 10.689 13.542 1.00 0.00 H new ATOM 0 HB2 PRO A 34 10.823 11.786 13.354 1.00 0.00 H new ATOM 0 HB3 PRO A 34 9.591 12.437 14.417 1.00 0.00 H new ATOM 0 HG2 PRO A 34 11.848 10.561 15.059 1.00 0.00 H new ATOM 0 HG3 PRO A 34 11.223 11.900 16.001 1.00 0.00 H new ATOM 0 HD2 PRO A 34 10.582 9.365 16.645 1.00 0.00 H new ATOM 0 HD3 PRO A 34 9.401 10.647 16.826 1.00 0.00 H new ATOM 492 N ASN A 35 10.661 8.710 12.801 1.00 0.00 N ATOM 493 CA ASN A 35 11.279 7.973 11.707 1.00 0.00 C ATOM 494 C ASN A 35 10.855 6.508 11.706 1.00 0.00 C ATOM 495 O ASN A 35 10.785 5.871 10.657 1.00 0.00 O ATOM 496 CB ASN A 35 12.808 8.067 11.798 1.00 0.00 C ATOM 497 CG ASN A 35 13.368 7.500 13.096 1.00 0.00 C ATOM 498 OD1 ASN A 35 12.718 7.542 14.143 1.00 0.00 O ATOM 499 ND2 ASN A 35 14.581 6.972 13.038 1.00 0.00 N ATOM 0 H ASN A 35 10.989 8.442 13.729 1.00 0.00 H new ATOM 0 HA ASN A 35 10.940 8.426 10.775 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.249 7.534 10.956 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.107 9.111 11.706 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.008 6.582 13.878 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.088 6.955 12.153 1.00 0.00 H new ATOM 506 N GLU A 36 10.568 5.980 12.884 1.00 0.00 N ATOM 507 CA GLU A 36 10.277 4.560 13.038 1.00 0.00 C ATOM 508 C GLU A 36 8.778 4.273 12.877 1.00 0.00 C ATOM 509 O GLU A 36 8.351 3.117 12.875 1.00 0.00 O ATOM 510 CB GLU A 36 10.786 4.099 14.404 1.00 0.00 C ATOM 511 CG GLU A 36 10.900 2.597 14.572 1.00 0.00 C ATOM 512 CD GLU A 36 11.594 2.233 15.867 1.00 0.00 C ATOM 513 OE1 GLU A 36 12.842 2.202 15.886 1.00 0.00 O ATOM 514 OE2 GLU A 36 10.900 1.990 16.874 1.00 0.00 O ATOM 0 H GLU A 36 10.530 6.514 13.752 1.00 0.00 H new ATOM 0 HA GLU A 36 10.788 4.002 12.253 1.00 0.00 H new ATOM 0 HB2 GLU A 36 11.765 4.544 14.579 1.00 0.00 H new ATOM 0 HB3 GLU A 36 10.118 4.486 15.173 1.00 0.00 H new ATOM 0 HG2 GLU A 36 9.905 2.152 14.554 1.00 0.00 H new ATOM 0 HG3 GLU A 36 11.453 2.177 13.732 1.00 0.00 H new ATOM 521 N ALA A 37 7.982 5.329 12.725 1.00 0.00 N ATOM 522 CA ALA A 37 6.542 5.176 12.526 1.00 0.00 C ATOM 523 C ALA A 37 6.241 4.524 11.183 1.00 0.00 C ATOM 524 O ALA A 37 5.273 3.778 11.051 1.00 0.00 O ATOM 525 CB ALA A 37 5.838 6.521 12.617 1.00 0.00 C ATOM 0 H ALA A 37 8.307 6.296 12.736 1.00 0.00 H new ATOM 0 HA ALA A 37 6.167 4.528 13.318 1.00 0.00 H new ATOM 0 HB1 ALA A 37 4.767 6.382 12.466 1.00 0.00 H new ATOM 0 HB2 ALA A 37 6.012 6.957 13.601 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.229 7.189 11.850 1.00 0.00 H new ATOM 531 N ALA A 38 7.083 4.805 10.193 1.00 0.00 N ATOM 532 CA ALA A 38 6.902 4.261 8.854 1.00 0.00 C ATOM 533 C ALA A 38 6.955 2.739 8.877 1.00 0.00 C ATOM 534 O ALA A 38 6.062 2.074 8.348 1.00 0.00 O ATOM 535 CB ALA A 38 7.953 4.818 7.907 1.00 0.00 C ATOM 0 H ALA A 38 7.899 5.408 10.295 1.00 0.00 H new ATOM 0 HA ALA A 38 5.918 4.561 8.494 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.803 4.401 6.911 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.864 5.904 7.863 1.00 0.00 H new ATOM 0 HB3 ALA A 38 8.946 4.549 8.267 1.00 0.00 H new ATOM 541 N THR A 39 8.009 2.204 9.494 1.00 0.00 N ATOM 542 CA THR A 39 8.189 0.767 9.656 1.00 0.00 C ATOM 543 C THR A 39 8.494 0.092 8.316 1.00 0.00 C ATOM 544 O THR A 39 9.635 -0.284 8.045 1.00 0.00 O ATOM 545 CB THR A 39 6.954 0.114 10.311 1.00 0.00 C ATOM 546 OG1 THR A 39 6.606 0.824 11.510 1.00 0.00 O ATOM 547 CG2 THR A 39 7.230 -1.339 10.649 1.00 0.00 C ATOM 0 H THR A 39 8.763 2.760 9.896 1.00 0.00 H new ATOM 0 HA THR A 39 9.043 0.623 10.318 1.00 0.00 H new ATOM 0 HB THR A 39 6.126 0.159 9.603 1.00 0.00 H new ATOM 0 HG1 THR A 39 7.361 1.382 11.791 1.00 0.00 H new ATOM 0 HG21 THR A 39 6.346 -1.780 11.110 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.474 -1.885 9.737 1.00 0.00 H new ATOM 0 HG23 THR A 39 8.068 -1.398 11.343 1.00 0.00 H new ATOM 555 N ALA A 40 7.478 -0.034 7.476 1.00 0.00 N ATOM 556 CA ALA A 40 7.626 -0.656 6.171 1.00 0.00 C ATOM 557 C ALA A 40 6.529 -0.176 5.232 1.00 0.00 C ATOM 558 O ALA A 40 5.349 -0.451 5.451 1.00 0.00 O ATOM 559 CB ALA A 40 7.589 -2.173 6.295 1.00 0.00 C ATOM 0 H ALA A 40 6.533 0.291 7.679 1.00 0.00 H new ATOM 0 HA ALA A 40 8.592 -0.367 5.758 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.701 -2.622 5.308 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.403 -2.505 6.939 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.636 -2.480 6.727 1.00 0.00 H new ATOM 565 N SER A 41 6.916 0.562 4.204 1.00 0.00 N ATOM 566 CA SER A 41 5.965 1.039 3.216 1.00 0.00 C ATOM 567 C SER A 41 5.690 -0.044 2.185 1.00 0.00 C ATOM 568 O SER A 41 6.391 -0.163 1.177 1.00 0.00 O ATOM 569 CB SER A 41 6.487 2.299 2.536 1.00 0.00 C ATOM 570 OG SER A 41 6.803 3.298 3.494 1.00 0.00 O ATOM 0 H SER A 41 7.882 0.843 4.033 1.00 0.00 H new ATOM 0 HA SER A 41 5.032 1.284 3.723 1.00 0.00 H new ATOM 0 HB2 SER A 41 7.373 2.059 1.949 1.00 0.00 H new ATOM 0 HB3 SER A 41 5.738 2.679 1.842 1.00 0.00 H new ATOM 0 HG SER A 41 7.138 4.097 3.035 1.00 0.00 H new ATOM 576 N ASP A 42 4.686 -0.851 2.471 1.00 0.00 N ATOM 577 CA ASP A 42 4.301 -1.949 1.607 1.00 0.00 C ATOM 578 C ASP A 42 3.688 -1.422 0.319 1.00 0.00 C ATOM 579 O ASP A 42 3.090 -0.347 0.298 1.00 0.00 O ATOM 580 CB ASP A 42 3.308 -2.839 2.347 1.00 0.00 C ATOM 581 CG ASP A 42 2.840 -4.031 1.533 1.00 0.00 C ATOM 582 OD1 ASP A 42 3.604 -5.012 1.412 1.00 0.00 O ATOM 583 OD2 ASP A 42 1.698 -3.999 1.026 1.00 0.00 O ATOM 0 H ASP A 42 4.114 -0.763 3.311 1.00 0.00 H new ATOM 0 HA ASP A 42 5.184 -2.532 1.345 1.00 0.00 H new ATOM 0 HB2 ASP A 42 3.769 -3.196 3.268 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.442 -2.243 2.634 1.00 0.00 H new ATOM 588 N ASP A 43 3.845 -2.179 -0.749 1.00 0.00 N ATOM 589 CA ASP A 43 3.324 -1.778 -2.044 1.00 0.00 C ATOM 590 C ASP A 43 2.310 -2.787 -2.544 1.00 0.00 C ATOM 591 O ASP A 43 2.632 -3.696 -3.311 1.00 0.00 O ATOM 592 CB ASP A 43 4.441 -1.598 -3.075 1.00 0.00 C ATOM 593 CG ASP A 43 3.910 -1.221 -4.449 1.00 0.00 C ATOM 594 OD1 ASP A 43 2.825 -0.605 -4.532 1.00 0.00 O ATOM 595 OD2 ASP A 43 4.581 -1.540 -5.455 1.00 0.00 O ATOM 0 H ASP A 43 4.330 -3.077 -0.747 1.00 0.00 H new ATOM 0 HA ASP A 43 2.833 -0.813 -1.913 1.00 0.00 H new ATOM 0 HB2 ASP A 43 5.128 -0.825 -2.730 1.00 0.00 H new ATOM 0 HB3 ASP A 43 5.013 -2.523 -3.151 1.00 0.00 H new ATOM 600 N GLY A 44 1.101 -2.649 -2.046 1.00 0.00 N ATOM 601 CA GLY A 44 -0.014 -3.402 -2.566 1.00 0.00 C ATOM 602 C GLY A 44 -0.849 -2.542 -3.484 1.00 0.00 C ATOM 603 O GLY A 44 -2.079 -2.557 -3.423 1.00 0.00 O ATOM 0 H GLY A 44 0.867 -2.019 -1.279 1.00 0.00 H new ATOM 0 HA2 GLY A 44 0.350 -4.275 -3.107 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -0.628 -3.769 -1.744 1.00 0.00 H new ATOM 607 N LYS A 45 -0.172 -1.760 -4.314 1.00 0.00 N ATOM 608 CA LYS A 45 -0.845 -0.866 -5.243 1.00 0.00 C ATOM 609 C LYS A 45 -0.800 -1.419 -6.662 1.00 0.00 C ATOM 610 O LYS A 45 -1.607 -1.038 -7.512 1.00 0.00 O ATOM 611 CB LYS A 45 -0.206 0.524 -5.198 1.00 0.00 C ATOM 612 CG LYS A 45 -0.349 1.218 -3.850 1.00 0.00 C ATOM 613 CD LYS A 45 0.293 2.603 -3.840 1.00 0.00 C ATOM 614 CE LYS A 45 1.806 2.548 -3.645 1.00 0.00 C ATOM 615 NZ LYS A 45 2.521 1.960 -4.810 1.00 0.00 N ATOM 0 H LYS A 45 0.846 -1.728 -4.362 1.00 0.00 H new ATOM 0 HA LYS A 45 -1.889 -0.786 -4.941 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.853 0.436 -5.441 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -0.659 1.148 -5.968 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.406 1.308 -3.601 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.109 0.602 -3.076 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.070 3.110 -4.779 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -0.151 3.199 -3.043 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.181 3.556 -3.467 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.031 1.962 -2.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 3.422 2.460 -4.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.709 0.953 -4.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.933 2.055 -5.662 1.00 0.00 H new ATOM 629 N VAL A 46 0.137 -2.323 -6.908 1.00 0.00 N ATOM 630 CA VAL A 46 0.291 -2.935 -8.215 1.00 0.00 C ATOM 631 C VAL A 46 0.754 -4.389 -8.079 1.00 0.00 C ATOM 632 O VAL A 46 1.590 -4.706 -7.231 1.00 0.00 O ATOM 633 CB VAL A 46 1.282 -2.126 -9.075 1.00 0.00 C ATOM 634 CG1 VAL A 46 2.670 -2.104 -8.448 1.00 0.00 C ATOM 635 CG2 VAL A 46 1.325 -2.664 -10.492 1.00 0.00 C ATOM 0 H VAL A 46 0.806 -2.650 -6.211 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.678 -2.932 -8.713 1.00 0.00 H new ATOM 0 HB VAL A 46 0.929 -1.096 -9.117 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.345 -1.526 -9.079 1.00 0.00 H new ATOM 0 HG12 VAL A 46 2.616 -1.647 -7.460 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.044 -3.124 -8.356 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.030 -2.079 -11.082 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.643 -3.707 -10.476 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.333 -2.594 -10.938 1.00 0.00 H new ATOM 645 N ILE A 47 0.199 -5.267 -8.912 1.00 0.00 N ATOM 646 CA ILE A 47 0.455 -6.703 -8.799 1.00 0.00 C ATOM 647 C ILE A 47 1.813 -7.052 -9.406 1.00 0.00 C ATOM 648 O ILE A 47 2.044 -6.840 -10.593 1.00 0.00 O ATOM 649 CB ILE A 47 -0.636 -7.554 -9.509 1.00 0.00 C ATOM 650 CG1 ILE A 47 -1.995 -6.848 -9.489 1.00 0.00 C ATOM 651 CG2 ILE A 47 -0.755 -8.930 -8.847 1.00 0.00 C ATOM 652 CD1 ILE A 47 -2.626 -6.763 -8.121 1.00 0.00 C ATOM 0 H ILE A 47 -0.431 -5.010 -9.672 1.00 0.00 H new ATOM 0 HA ILE A 47 0.441 -6.938 -7.735 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.332 -7.680 -10.548 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.874 -5.840 -9.885 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -2.675 -7.374 -10.159 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.523 -9.513 -9.356 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.200 -9.450 -8.915 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.028 -8.807 -7.799 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -3.585 -6.249 -8.194 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.782 -7.768 -7.729 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.968 -6.210 -7.451 1.00 0.00 H new ATOM 664 N LYS A 48 2.714 -7.548 -8.575 1.00 0.00 N ATOM 665 CA LYS A 48 4.022 -8.001 -9.030 1.00 0.00 C ATOM 666 C LYS A 48 4.057 -9.519 -9.176 1.00 0.00 C ATOM 667 O LYS A 48 3.364 -10.235 -8.457 1.00 0.00 O ATOM 668 CB LYS A 48 5.094 -7.538 -8.048 1.00 0.00 C ATOM 669 CG LYS A 48 6.038 -6.503 -8.630 1.00 0.00 C ATOM 670 CD LYS A 48 6.544 -5.553 -7.562 1.00 0.00 C ATOM 671 CE LYS A 48 5.430 -4.642 -7.066 1.00 0.00 C ATOM 672 NZ LYS A 48 5.912 -3.701 -6.024 1.00 0.00 N ATOM 0 H LYS A 48 2.563 -7.649 -7.571 1.00 0.00 H new ATOM 0 HA LYS A 48 4.218 -7.567 -10.010 1.00 0.00 H new ATOM 0 HB2 LYS A 48 4.611 -7.122 -7.164 1.00 0.00 H new ATOM 0 HB3 LYS A 48 5.672 -8.402 -7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 48 6.883 -7.004 -9.103 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.526 -5.938 -9.409 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.951 -6.123 -6.727 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.359 -4.951 -7.963 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.021 -4.078 -7.904 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.618 -5.247 -6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.134 -3.075 -5.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.248 -4.238 -5.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.692 -3.130 -6.406 1.00 0.00 H new ATOM 686 N ASP A 49 4.878 -9.994 -10.105 1.00 0.00 N ATOM 687 CA ASP A 49 4.966 -11.417 -10.415 1.00 0.00 C ATOM 688 C ASP A 49 6.031 -12.086 -9.555 1.00 0.00 C ATOM 689 O ASP A 49 6.757 -11.418 -8.819 1.00 0.00 O ATOM 690 CB ASP A 49 5.330 -11.622 -11.885 1.00 0.00 C ATOM 691 CG ASP A 49 4.399 -10.940 -12.847 1.00 0.00 C ATOM 692 OD1 ASP A 49 4.686 -9.781 -13.206 1.00 0.00 O ATOM 693 OD2 ASP A 49 3.429 -11.574 -13.287 1.00 0.00 O ATOM 0 H ASP A 49 5.499 -9.407 -10.663 1.00 0.00 H new ATOM 0 HA ASP A 49 3.993 -11.863 -10.210 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.342 -11.254 -12.053 1.00 0.00 H new ATOM 0 HB3 ASP A 49 5.340 -12.690 -12.101 1.00 0.00 H new ATOM 698 N SER A 50 6.161 -13.402 -9.694 1.00 0.00 N ATOM 699 CA SER A 50 7.124 -14.160 -8.902 1.00 0.00 C ATOM 700 C SER A 50 8.541 -13.973 -9.447 1.00 0.00 C ATOM 701 O SER A 50 9.527 -14.393 -8.843 1.00 0.00 O ATOM 702 CB SER A 50 6.747 -15.641 -8.902 1.00 0.00 C ATOM 703 OG SER A 50 7.546 -16.382 -7.997 1.00 0.00 O ATOM 0 H SER A 50 5.613 -13.964 -10.346 1.00 0.00 H new ATOM 0 HA SER A 50 7.102 -13.787 -7.878 1.00 0.00 H new ATOM 0 HB2 SER A 50 5.696 -15.750 -8.634 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.863 -16.047 -9.907 1.00 0.00 H new ATOM 0 HG SER A 50 8.403 -15.925 -7.867 1.00 0.00 H new ATOM 709 N VAL A 51 8.617 -13.325 -10.589 1.00 0.00 N ATOM 710 CA VAL A 51 9.885 -13.055 -11.239 1.00 0.00 C ATOM 711 C VAL A 51 10.337 -11.634 -10.890 1.00 0.00 C ATOM 712 O VAL A 51 11.429 -11.190 -11.239 1.00 0.00 O ATOM 713 CB VAL A 51 9.771 -13.302 -12.764 1.00 0.00 C ATOM 714 CG1 VAL A 51 8.520 -12.669 -13.306 1.00 0.00 C ATOM 715 CG2 VAL A 51 11.001 -12.827 -13.526 1.00 0.00 C ATOM 0 H VAL A 51 7.805 -12.970 -11.094 1.00 0.00 H new ATOM 0 HA VAL A 51 10.652 -13.739 -10.877 1.00 0.00 H new ATOM 0 HB VAL A 51 9.712 -14.380 -12.913 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.455 -12.852 -14.379 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.650 -13.101 -12.811 1.00 0.00 H new ATOM 0 HG13 VAL A 51 8.547 -11.595 -13.122 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.868 -13.024 -14.590 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.135 -11.757 -13.369 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.881 -13.360 -13.165 1.00 0.00 H new ATOM 725 N GLY A 52 9.490 -10.948 -10.135 1.00 0.00 N ATOM 726 CA GLY A 52 9.854 -9.658 -9.590 1.00 0.00 C ATOM 727 C GLY A 52 9.548 -8.496 -10.506 1.00 0.00 C ATOM 728 O GLY A 52 9.880 -7.355 -10.180 1.00 0.00 O ATOM 0 H GLY A 52 8.552 -11.265 -9.890 1.00 0.00 H new ATOM 0 HA2 GLY A 52 9.328 -9.512 -8.647 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.920 -9.658 -9.364 1.00 0.00 H new ATOM 732 N ASN A 53 8.922 -8.758 -11.646 1.00 0.00 N ATOM 733 CA ASN A 53 8.560 -7.668 -12.544 1.00 0.00 C ATOM 734 C ASN A 53 7.148 -7.182 -12.269 1.00 0.00 C ATOM 735 O ASN A 53 6.320 -7.914 -11.730 1.00 0.00 O ATOM 736 CB ASN A 53 8.750 -8.017 -14.030 1.00 0.00 C ATOM 737 CG ASN A 53 8.400 -9.443 -14.407 1.00 0.00 C ATOM 738 OD1 ASN A 53 9.057 -10.043 -15.259 1.00 0.00 O ATOM 739 ND2 ASN A 53 7.359 -9.993 -13.818 1.00 0.00 N ATOM 0 H ASN A 53 8.660 -9.690 -11.966 1.00 0.00 H new ATOM 0 HA ASN A 53 9.254 -6.854 -12.334 1.00 0.00 H new ATOM 0 HB2 ASN A 53 8.139 -7.340 -14.627 1.00 0.00 H new ATOM 0 HB3 ASN A 53 9.789 -7.831 -14.301 1.00 0.00 H new ATOM 0 HD21 ASN A 53 7.076 -10.942 -14.064 1.00 0.00 H new ATOM 0 HD22 ASN A 53 6.835 -9.470 -13.116 1.00 0.00 H new ATOM 746 N VAL A 54 6.905 -5.930 -12.620 1.00 0.00 N ATOM 747 CA VAL A 54 5.658 -5.268 -12.266 1.00 0.00 C ATOM 748 C VAL A 54 4.647 -5.277 -13.404 1.00 0.00 C ATOM 749 O VAL A 54 4.818 -4.614 -14.431 1.00 0.00 O ATOM 750 CB VAL A 54 5.881 -3.820 -11.822 1.00 0.00 C ATOM 751 CG1 VAL A 54 4.617 -3.263 -11.193 1.00 0.00 C ATOM 752 CG2 VAL A 54 7.049 -3.720 -10.855 1.00 0.00 C ATOM 0 H VAL A 54 7.555 -5.350 -13.151 1.00 0.00 H new ATOM 0 HA VAL A 54 5.256 -5.845 -11.433 1.00 0.00 H new ATOM 0 HB VAL A 54 6.124 -3.226 -12.703 1.00 0.00 H new ATOM 0 HG11 VAL A 54 4.789 -2.233 -10.882 1.00 0.00 H new ATOM 0 HG12 VAL A 54 3.806 -3.292 -11.920 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.347 -3.864 -10.325 1.00 0.00 H new ATOM 0 HG21 VAL A 54 7.185 -2.681 -10.556 1.00 0.00 H new ATOM 0 HG22 VAL A 54 6.845 -4.328 -9.974 1.00 0.00 H new ATOM 0 HG23 VAL A 54 7.956 -4.079 -11.341 1.00 0.00 H new ATOM 762 N LEU A 55 3.611 -6.058 -13.193 1.00 0.00 N ATOM 763 CA LEU A 55 2.485 -6.127 -14.108 1.00 0.00 C ATOM 764 C LEU A 55 1.814 -4.780 -14.301 1.00 0.00 C ATOM 765 O LEU A 55 1.736 -3.954 -13.390 1.00 0.00 O ATOM 766 CB LEU A 55 1.471 -7.151 -13.628 1.00 0.00 C ATOM 767 CG LEU A 55 1.991 -8.569 -13.689 1.00 0.00 C ATOM 768 CD1 LEU A 55 1.007 -9.556 -13.108 1.00 0.00 C ATOM 769 CD2 LEU A 55 2.350 -8.920 -15.115 1.00 0.00 C ATOM 0 H LEU A 55 3.522 -6.667 -12.380 1.00 0.00 H new ATOM 0 HA LEU A 55 2.881 -6.436 -15.076 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.185 -6.918 -12.602 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.569 -7.074 -14.235 1.00 0.00 H new ATOM 0 HG LEU A 55 2.890 -8.631 -13.075 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.421 -10.562 -13.172 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.816 -9.308 -12.064 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.073 -9.511 -13.668 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.724 -9.943 -15.155 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.465 -8.833 -15.745 1.00 0.00 H new ATOM 0 HD23 LEU A 55 3.120 -8.238 -15.475 1.00 0.00 H new ATOM 781 N GLN A 56 1.337 -4.578 -15.509 1.00 0.00 N ATOM 782 CA GLN A 56 0.585 -3.395 -15.864 1.00 0.00 C ATOM 783 C GLN A 56 -0.780 -3.843 -16.341 1.00 0.00 C ATOM 784 O GLN A 56 -0.909 -4.939 -16.889 1.00 0.00 O ATOM 785 CB GLN A 56 1.296 -2.622 -16.976 1.00 0.00 C ATOM 786 CG GLN A 56 0.560 -1.366 -17.413 1.00 0.00 C ATOM 787 CD GLN A 56 0.936 -0.932 -18.812 1.00 0.00 C ATOM 788 OE1 GLN A 56 1.864 -0.150 -19.010 1.00 0.00 O ATOM 789 NE2 GLN A 56 0.209 -1.436 -19.793 1.00 0.00 N ATOM 0 H GLN A 56 1.461 -5.235 -16.279 1.00 0.00 H new ATOM 0 HA GLN A 56 0.495 -2.735 -15.001 1.00 0.00 H new ATOM 0 HB2 GLN A 56 2.294 -2.348 -16.635 1.00 0.00 H new ATOM 0 HB3 GLN A 56 1.423 -3.277 -17.838 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -0.514 -1.544 -17.368 1.00 0.00 H new ATOM 0 HG3 GLN A 56 0.779 -0.559 -16.714 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -0.552 -2.082 -19.584 1.00 0.00 H new ATOM 0 HE22 GLN A 56 0.409 -1.179 -20.760 1.00 0.00 H new ATOM 798 N ASP A 57 -1.804 -3.038 -16.130 1.00 0.00 N ATOM 799 CA ASP A 57 -3.125 -3.371 -16.610 1.00 0.00 C ATOM 800 C ASP A 57 -3.119 -3.417 -18.129 1.00 0.00 C ATOM 801 O ASP A 57 -2.689 -2.467 -18.788 1.00 0.00 O ATOM 802 CB ASP A 57 -4.125 -2.327 -16.117 1.00 0.00 C ATOM 803 CG ASP A 57 -5.501 -2.904 -15.895 1.00 0.00 C ATOM 804 OD1 ASP A 57 -5.724 -3.505 -14.826 1.00 0.00 O ATOM 805 OD2 ASP A 57 -6.374 -2.750 -16.773 1.00 0.00 O ATOM 0 H ASP A 57 -1.743 -2.151 -15.630 1.00 0.00 H new ATOM 0 HA ASP A 57 -3.417 -4.349 -16.229 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -3.762 -1.893 -15.185 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -4.187 -1.517 -16.844 1.00 0.00 H new ATOM 810 N GLY A 58 -3.576 -4.525 -18.675 1.00 0.00 N ATOM 811 CA GLY A 58 -3.574 -4.699 -20.111 1.00 0.00 C ATOM 812 C GLY A 58 -2.281 -5.302 -20.629 1.00 0.00 C ATOM 813 O GLY A 58 -2.111 -5.463 -21.837 1.00 0.00 O ATOM 0 H GLY A 58 -3.951 -5.314 -18.149 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -4.408 -5.340 -20.396 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -3.736 -3.733 -20.590 1.00 0.00 H new ATOM 817 N ASP A 59 -1.361 -5.623 -19.725 1.00 0.00 N ATOM 818 CA ASP A 59 -0.106 -6.251 -20.124 1.00 0.00 C ATOM 819 C ASP A 59 -0.298 -7.745 -20.319 1.00 0.00 C ATOM 820 O ASP A 59 -1.355 -8.293 -20.005 1.00 0.00 O ATOM 821 CB ASP A 59 0.987 -6.027 -19.083 1.00 0.00 C ATOM 822 CG ASP A 59 2.369 -5.968 -19.711 1.00 0.00 C ATOM 823 OD1 ASP A 59 2.936 -7.034 -20.026 1.00 0.00 O ATOM 824 OD2 ASP A 59 2.884 -4.850 -19.909 1.00 0.00 O ATOM 0 H ASP A 59 -1.458 -5.461 -18.723 1.00 0.00 H new ATOM 0 HA ASP A 59 0.201 -5.790 -21.063 1.00 0.00 H new ATOM 0 HB2 ASP A 59 0.792 -5.098 -18.548 1.00 0.00 H new ATOM 0 HB3 ASP A 59 0.957 -6.831 -18.348 1.00 0.00 H new ATOM 829 N THR A 60 0.736 -8.397 -20.806 1.00 0.00 N ATOM 830 CA THR A 60 0.692 -9.817 -21.067 1.00 0.00 C ATOM 831 C THR A 60 1.403 -10.563 -19.948 1.00 0.00 C ATOM 832 O THR A 60 2.430 -10.102 -19.461 1.00 0.00 O ATOM 833 CB THR A 60 1.350 -10.131 -22.426 1.00 0.00 C ATOM 834 OG1 THR A 60 0.851 -9.226 -23.421 1.00 0.00 O ATOM 835 CG2 THR A 60 1.070 -11.559 -22.862 1.00 0.00 C ATOM 0 H THR A 60 1.628 -7.957 -21.031 1.00 0.00 H new ATOM 0 HA THR A 60 -0.348 -10.142 -21.106 1.00 0.00 H new ATOM 0 HB THR A 60 2.428 -10.012 -22.314 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.843 -9.671 -24.294 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.548 -11.746 -23.823 1.00 0.00 H new ATOM 0 HG22 THR A 60 1.466 -12.251 -22.119 1.00 0.00 H new ATOM 0 HG23 THR A 60 -0.006 -11.706 -22.957 1.00 0.00 H new ATOM 843 N ILE A 61 0.855 -11.696 -19.523 1.00 0.00 N ATOM 844 CA ILE A 61 1.468 -12.471 -18.453 1.00 0.00 C ATOM 845 C ILE A 61 1.725 -13.899 -18.911 1.00 0.00 C ATOM 846 O ILE A 61 1.227 -14.329 -19.950 1.00 0.00 O ATOM 847 CB ILE A 61 0.605 -12.480 -17.161 1.00 0.00 C ATOM 848 CG1 ILE A 61 -0.673 -13.313 -17.325 1.00 0.00 C ATOM 849 CG2 ILE A 61 0.248 -11.064 -16.758 1.00 0.00 C ATOM 850 CD1 ILE A 61 -0.510 -14.764 -16.925 1.00 0.00 C ATOM 0 H ILE A 61 -0.005 -12.095 -19.900 1.00 0.00 H new ATOM 0 HA ILE A 61 2.415 -11.987 -18.214 1.00 0.00 H new ATOM 0 HB ILE A 61 1.203 -12.944 -16.377 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.466 -12.867 -16.725 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.995 -13.266 -18.365 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -0.357 -11.085 -15.851 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.161 -10.498 -16.572 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.317 -10.589 -17.560 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.454 -15.289 -17.068 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.260 -15.227 -17.542 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.218 -14.822 -15.876 1.00 0.00 H new ATOM 862 N THR A 62 2.535 -14.612 -18.157 1.00 0.00 N ATOM 863 CA THR A 62 2.796 -16.013 -18.408 1.00 0.00 C ATOM 864 C THR A 62 3.119 -16.738 -17.102 1.00 0.00 C ATOM 865 O THR A 62 4.101 -16.420 -16.435 1.00 0.00 O ATOM 866 CB THR A 62 3.953 -16.155 -19.415 1.00 0.00 C ATOM 867 OG1 THR A 62 3.468 -15.910 -20.741 1.00 0.00 O ATOM 868 CG2 THR A 62 4.614 -17.523 -19.347 1.00 0.00 C ATOM 0 H THR A 62 3.032 -14.235 -17.350 1.00 0.00 H new ATOM 0 HA THR A 62 1.904 -16.471 -18.835 1.00 0.00 H new ATOM 0 HB THR A 62 4.712 -15.418 -19.152 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.660 -15.358 -20.697 1.00 0.00 H new ATOM 0 HG21 THR A 62 5.423 -17.573 -20.076 1.00 0.00 H new ATOM 0 HG22 THR A 62 5.016 -17.683 -18.347 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.877 -18.295 -19.570 1.00 0.00 H new ATOM 876 N VAL A 63 2.257 -17.676 -16.725 1.00 0.00 N ATOM 877 CA VAL A 63 2.471 -18.505 -15.555 1.00 0.00 C ATOM 878 C VAL A 63 3.793 -19.255 -15.697 1.00 0.00 C ATOM 879 O VAL A 63 4.089 -19.823 -16.749 1.00 0.00 O ATOM 880 CB VAL A 63 1.294 -19.503 -15.352 1.00 0.00 C ATOM 881 CG1 VAL A 63 1.552 -20.825 -16.037 1.00 0.00 C ATOM 882 CG2 VAL A 63 1.012 -19.723 -13.877 1.00 0.00 C ATOM 0 H VAL A 63 1.392 -17.879 -17.225 1.00 0.00 H new ATOM 0 HA VAL A 63 2.514 -17.864 -14.675 1.00 0.00 H new ATOM 0 HB VAL A 63 0.414 -19.054 -15.813 1.00 0.00 H new ATOM 0 HG11 VAL A 63 0.706 -21.492 -15.870 1.00 0.00 H new ATOM 0 HG12 VAL A 63 1.680 -20.661 -17.107 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.456 -21.276 -15.628 1.00 0.00 H new ATOM 0 HG21 VAL A 63 0.185 -20.424 -13.765 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.900 -20.129 -13.393 1.00 0.00 H new ATOM 0 HG23 VAL A 63 0.748 -18.773 -13.412 1.00 0.00 H new ATOM 892 N ILE A 64 4.622 -19.192 -14.678 1.00 0.00 N ATOM 893 CA ILE A 64 5.885 -19.901 -14.710 1.00 0.00 C ATOM 894 C ILE A 64 5.834 -21.166 -13.870 1.00 0.00 C ATOM 895 O ILE A 64 6.878 -21.736 -13.546 1.00 0.00 O ATOM 896 CB ILE A 64 7.077 -19.023 -14.237 1.00 0.00 C ATOM 897 CG1 ILE A 64 6.993 -18.698 -12.734 1.00 0.00 C ATOM 898 CG2 ILE A 64 7.142 -17.743 -15.054 1.00 0.00 C ATOM 899 CD1 ILE A 64 6.207 -17.453 -12.399 1.00 0.00 C ATOM 0 H ILE A 64 4.448 -18.663 -13.824 1.00 0.00 H new ATOM 0 HA ILE A 64 6.049 -20.164 -15.755 1.00 0.00 H new ATOM 0 HB ILE A 64 7.991 -19.596 -14.394 1.00 0.00 H new ATOM 0 HG12 ILE A 64 6.542 -19.545 -12.218 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.005 -18.588 -12.343 1.00 0.00 H new ATOM 0 HG21 ILE A 64 7.981 -17.136 -14.713 1.00 0.00 H new ATOM 0 HG22 ILE A 64 7.277 -17.990 -16.107 1.00 0.00 H new ATOM 0 HG23 ILE A 64 6.215 -17.184 -14.928 1.00 0.00 H new ATOM 0 HD11 ILE A 64 6.203 -17.305 -11.319 1.00 0.00 H new ATOM 0 HD12 ILE A 64 6.668 -16.591 -12.881 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.182 -17.563 -12.754 1.00 0.00 H new ATOM 911 N LYS A 65 4.638 -21.643 -13.538 1.00 0.00 N ATOM 912 CA LYS A 65 4.488 -22.820 -12.701 1.00 0.00 C ATOM 913 C LYS A 65 3.440 -23.742 -13.320 1.00 0.00 C ATOM 914 O LYS A 65 2.679 -23.325 -14.195 1.00 0.00 O ATOM 915 CB LYS A 65 4.021 -22.428 -11.289 1.00 0.00 C ATOM 916 CG LYS A 65 5.118 -22.330 -10.237 1.00 0.00 C ATOM 917 CD LYS A 65 6.083 -21.189 -10.503 1.00 0.00 C ATOM 918 CE LYS A 65 7.055 -20.998 -9.347 1.00 0.00 C ATOM 919 NZ LYS A 65 7.716 -22.271 -8.952 1.00 0.00 N ATOM 0 H LYS A 65 3.757 -21.227 -13.840 1.00 0.00 H new ATOM 0 HA LYS A 65 5.453 -23.322 -12.632 1.00 0.00 H new ATOM 0 HB2 LYS A 65 3.512 -21.466 -11.348 1.00 0.00 H new ATOM 0 HB3 LYS A 65 3.285 -23.158 -10.953 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.664 -22.195 -9.255 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.671 -23.269 -10.206 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.640 -21.388 -11.419 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.523 -20.268 -10.665 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.814 -20.269 -9.630 1.00 0.00 H new ATOM 0 HE3 LYS A 65 6.521 -20.587 -8.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.508 -22.066 -8.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.028 -22.884 -8.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.074 -22.754 -9.801 1.00 0.00 H new ATOM 933 N ASP A 66 3.443 -25.001 -12.919 1.00 0.00 N ATOM 934 CA ASP A 66 2.342 -25.893 -13.267 1.00 0.00 C ATOM 935 C ASP A 66 1.198 -25.771 -12.267 1.00 0.00 C ATOM 936 O ASP A 66 1.315 -26.134 -11.095 1.00 0.00 O ATOM 937 CB ASP A 66 2.805 -27.352 -13.397 1.00 0.00 C ATOM 938 CG ASP A 66 3.215 -27.984 -12.082 1.00 0.00 C ATOM 939 OD1 ASP A 66 4.359 -27.754 -11.639 1.00 0.00 O ATOM 940 OD2 ASP A 66 2.404 -28.734 -11.495 1.00 0.00 O ATOM 0 H ASP A 66 4.182 -25.428 -12.360 1.00 0.00 H new ATOM 0 HA ASP A 66 1.973 -25.581 -14.244 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.000 -27.941 -13.837 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.647 -27.396 -14.088 1.00 0.00 H new ATOM 945 N LEU A 67 0.098 -25.219 -12.745 1.00 0.00 N ATOM 946 CA LEU A 67 -1.120 -25.083 -11.962 1.00 0.00 C ATOM 947 C LEU A 67 -2.269 -25.741 -12.709 1.00 0.00 C ATOM 948 O LEU A 67 -2.422 -25.549 -13.897 1.00 0.00 O ATOM 949 CB LEU A 67 -1.472 -23.608 -11.733 1.00 0.00 C ATOM 950 CG LEU A 67 -0.335 -22.700 -11.264 1.00 0.00 C ATOM 951 CD1 LEU A 67 -0.871 -21.311 -10.952 1.00 0.00 C ATOM 952 CD2 LEU A 67 0.364 -23.290 -10.052 1.00 0.00 C ATOM 0 H LEU A 67 0.022 -24.850 -13.693 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.958 -25.561 -10.996 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.870 -23.204 -12.664 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.274 -23.559 -10.996 1.00 0.00 H new ATOM 0 HG LEU A 67 0.398 -22.620 -12.067 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.053 -20.672 -10.619 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.322 -20.885 -11.848 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.622 -21.379 -10.165 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.169 -22.626 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.352 -23.403 -9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.778 -24.265 -10.309 1.00 0.00 H new ATOM 964 N LYS A 68 -3.063 -26.526 -12.032 1.00 0.00 N ATOM 965 CA LYS A 68 -4.235 -27.115 -12.659 1.00 0.00 C ATOM 966 C LYS A 68 -5.423 -26.176 -12.524 1.00 0.00 C ATOM 967 O LYS A 68 -5.341 -25.160 -11.832 1.00 0.00 O ATOM 968 CB LYS A 68 -4.555 -28.471 -12.037 1.00 0.00 C ATOM 969 CG LYS A 68 -4.705 -28.426 -10.528 1.00 0.00 C ATOM 970 CD LYS A 68 -5.155 -29.766 -9.977 1.00 0.00 C ATOM 971 CE LYS A 68 -4.148 -30.872 -10.268 1.00 0.00 C ATOM 972 NZ LYS A 68 -2.786 -30.545 -9.764 1.00 0.00 N ATOM 0 H LYS A 68 -2.929 -26.777 -11.052 1.00 0.00 H new ATOM 0 HA LYS A 68 -4.024 -27.268 -13.717 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.477 -28.854 -12.474 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.764 -29.175 -12.294 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -3.755 -28.145 -10.074 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -5.428 -27.657 -10.255 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.302 -29.684 -8.900 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.119 -30.031 -10.411 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -4.489 -31.800 -9.810 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -4.103 -31.045 -11.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.184 -31.392 -9.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -2.372 -29.790 -10.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.849 -30.225 -8.777 1.00 0.00 H new ATOM 986 N VAL A 69 -6.530 -26.514 -13.168 1.00 0.00 N ATOM 987 CA VAL A 69 -7.747 -25.724 -13.065 1.00 0.00 C ATOM 988 C VAL A 69 -8.882 -26.671 -12.708 1.00 0.00 C ATOM 989 O VAL A 69 -9.167 -27.602 -13.458 1.00 0.00 O ATOM 990 CB VAL A 69 -8.101 -25.012 -14.389 1.00 0.00 C ATOM 991 CG1 VAL A 69 -9.256 -24.051 -14.195 1.00 0.00 C ATOM 992 CG2 VAL A 69 -6.905 -24.283 -14.974 1.00 0.00 C ATOM 0 H VAL A 69 -6.610 -27.334 -13.770 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.595 -24.954 -12.308 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.402 -25.784 -15.097 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -9.486 -23.562 -15.142 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.132 -24.600 -13.848 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -8.983 -23.298 -13.455 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -7.196 -23.795 -15.905 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -6.554 -23.533 -14.265 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.105 -24.997 -15.173 1.00 0.00 H new ATOM 1002 N LYS A 70 -9.536 -26.450 -11.580 1.00 0.00 N ATOM 1003 CA LYS A 70 -10.496 -27.424 -11.082 1.00 0.00 C ATOM 1004 C LYS A 70 -11.914 -27.102 -11.551 1.00 0.00 C ATOM 1005 O LYS A 70 -12.855 -27.849 -11.275 1.00 0.00 O ATOM 1006 CB LYS A 70 -10.420 -27.507 -9.554 1.00 0.00 C ATOM 1007 CG LYS A 70 -10.771 -26.214 -8.822 1.00 0.00 C ATOM 1008 CD LYS A 70 -12.255 -26.134 -8.489 1.00 0.00 C ATOM 1009 CE LYS A 70 -12.678 -27.279 -7.579 1.00 0.00 C ATOM 1010 NZ LYS A 70 -14.123 -27.229 -7.234 1.00 0.00 N ATOM 0 H LYS A 70 -9.424 -25.619 -10.999 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.237 -28.400 -11.493 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.093 -28.294 -9.214 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.411 -27.805 -9.271 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.189 -26.148 -7.903 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -10.491 -25.360 -9.439 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.471 -25.182 -8.004 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -12.839 -26.163 -9.409 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.457 -28.228 -8.068 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.088 -27.248 -6.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -14.360 -28.029 -6.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.332 -26.336 -6.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.690 -27.286 -8.104 1.00 0.00 H new ATOM 1024 N GLY A 71 -12.055 -25.994 -12.262 1.00 0.00 N ATOM 1025 CA GLY A 71 -13.344 -25.612 -12.809 1.00 0.00 C ATOM 1026 C GLY A 71 -13.271 -25.465 -14.311 1.00 0.00 C ATOM 1027 O GLY A 71 -14.023 -24.706 -14.918 1.00 0.00 O ATOM 0 H GLY A 71 -11.295 -25.347 -12.472 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -14.091 -26.362 -12.549 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -13.668 -24.672 -12.363 1.00 0.00 H new ATOM 1031 N SER A 72 -12.332 -26.184 -14.903 1.00 0.00 N ATOM 1032 CA SER A 72 -12.102 -26.110 -16.326 1.00 0.00 C ATOM 1033 C SER A 72 -11.662 -27.471 -16.837 1.00 0.00 C ATOM 1034 O SER A 72 -11.589 -28.432 -16.071 1.00 0.00 O ATOM 1035 CB SER A 72 -11.073 -25.045 -16.656 1.00 0.00 C ATOM 1036 OG SER A 72 -11.587 -23.748 -16.406 1.00 0.00 O ATOM 0 H SER A 72 -11.715 -26.829 -14.410 1.00 0.00 H new ATOM 0 HA SER A 72 -13.031 -25.828 -16.822 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.175 -25.205 -16.060 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.780 -25.129 -17.703 1.00 0.00 H new ATOM 0 HG SER A 72 -11.581 -23.228 -17.237 1.00 0.00 H new ATOM 1042 N SER A 73 -11.367 -27.552 -18.119 1.00 0.00 N ATOM 1043 CA SER A 73 -10.656 -28.696 -18.654 1.00 0.00 C ATOM 1044 C SER A 73 -9.186 -28.331 -18.846 1.00 0.00 C ATOM 1045 O SER A 73 -8.333 -29.194 -19.052 1.00 0.00 O ATOM 1046 CB SER A 73 -11.289 -29.136 -19.972 1.00 0.00 C ATOM 1047 OG SER A 73 -11.623 -28.015 -20.772 1.00 0.00 O ATOM 0 H SER A 73 -11.608 -26.840 -18.809 1.00 0.00 H new ATOM 0 HA SER A 73 -10.721 -29.530 -17.955 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.598 -29.782 -20.514 1.00 0.00 H new ATOM 0 HB3 SER A 73 -12.184 -29.724 -19.771 1.00 0.00 H new ATOM 0 HG SER A 73 -12.025 -28.321 -21.612 1.00 0.00 H new ATOM 1053 N LEU A 74 -8.906 -27.037 -18.744 1.00 0.00 N ATOM 1054 CA LEU A 74 -7.572 -26.523 -18.979 1.00 0.00 C ATOM 1055 C LEU A 74 -6.668 -26.738 -17.783 1.00 0.00 C ATOM 1056 O LEU A 74 -7.108 -26.701 -16.643 1.00 0.00 O ATOM 1057 CB LEU A 74 -7.626 -25.035 -19.326 1.00 0.00 C ATOM 1058 CG LEU A 74 -7.742 -24.713 -20.820 1.00 0.00 C ATOM 1059 CD1 LEU A 74 -9.037 -25.264 -21.399 1.00 0.00 C ATOM 1060 CD2 LEU A 74 -7.646 -23.213 -21.047 1.00 0.00 C ATOM 0 H LEU A 74 -9.593 -26.325 -18.498 1.00 0.00 H new ATOM 0 HA LEU A 74 -7.155 -27.076 -19.821 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -8.475 -24.589 -18.808 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.728 -24.556 -18.937 1.00 0.00 H new ATOM 0 HG LEU A 74 -6.913 -25.196 -21.338 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -9.093 -25.021 -22.460 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -9.061 -26.346 -21.273 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -9.886 -24.820 -20.880 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -7.730 -23.000 -22.113 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.453 -22.712 -20.512 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -6.686 -22.850 -20.679 1.00 0.00 H new ATOM 1072 N VAL A 75 -5.423 -27.047 -18.074 1.00 0.00 N ATOM 1073 CA VAL A 75 -4.365 -27.038 -17.087 1.00 0.00 C ATOM 1074 C VAL A 75 -3.417 -25.876 -17.372 1.00 0.00 C ATOM 1075 O VAL A 75 -2.923 -25.722 -18.493 1.00 0.00 O ATOM 1076 CB VAL A 75 -3.574 -28.367 -17.083 1.00 0.00 C ATOM 1077 CG1 VAL A 75 -2.480 -28.345 -16.024 1.00 0.00 C ATOM 1078 CG2 VAL A 75 -4.509 -29.548 -16.863 1.00 0.00 C ATOM 0 H VAL A 75 -5.114 -27.313 -19.009 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.820 -26.920 -16.104 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.100 -28.481 -18.058 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.938 -29.291 -16.041 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.790 -27.527 -16.231 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.928 -28.201 -15.041 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.933 -30.473 -16.864 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.016 -29.437 -15.905 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.248 -29.581 -17.663 1.00 0.00 H new ATOM 1088 N VAL A 76 -3.191 -25.057 -16.361 1.00 0.00 N ATOM 1089 CA VAL A 76 -2.310 -23.903 -16.463 1.00 0.00 C ATOM 1090 C VAL A 76 -0.844 -24.343 -16.392 1.00 0.00 C ATOM 1091 O VAL A 76 -0.329 -24.686 -15.336 1.00 0.00 O ATOM 1092 CB VAL A 76 -2.624 -22.884 -15.339 1.00 0.00 C ATOM 1093 CG1 VAL A 76 -1.615 -21.758 -15.311 1.00 0.00 C ATOM 1094 CG2 VAL A 76 -4.030 -22.334 -15.501 1.00 0.00 C ATOM 0 H VAL A 76 -3.615 -25.172 -15.440 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.480 -23.420 -17.425 1.00 0.00 H new ATOM 0 HB VAL A 76 -2.558 -23.410 -14.386 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.867 -21.063 -14.510 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -0.619 -22.166 -15.137 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.630 -21.232 -16.266 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.235 -21.620 -14.704 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.117 -21.835 -16.466 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.749 -23.152 -15.449 1.00 0.00 H new ATOM 1104 N LYS A 77 -0.184 -24.335 -17.528 1.00 0.00 N ATOM 1105 CA LYS A 77 1.178 -24.843 -17.613 1.00 0.00 C ATOM 1106 C LYS A 77 2.186 -23.712 -17.749 1.00 0.00 C ATOM 1107 O LYS A 77 1.862 -22.656 -18.290 1.00 0.00 O ATOM 1108 CB LYS A 77 1.307 -25.865 -18.756 1.00 0.00 C ATOM 1109 CG LYS A 77 0.646 -25.460 -20.069 1.00 0.00 C ATOM 1110 CD LYS A 77 1.419 -24.371 -20.790 1.00 0.00 C ATOM 1111 CE LYS A 77 0.943 -24.208 -22.223 1.00 0.00 C ATOM 1112 NZ LYS A 77 1.215 -25.422 -23.038 1.00 0.00 N ATOM 0 H LYS A 77 -0.562 -23.984 -18.408 1.00 0.00 H new ATOM 0 HA LYS A 77 1.406 -25.359 -16.680 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.366 -26.046 -18.942 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.875 -26.810 -18.427 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.563 -26.333 -20.716 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.368 -25.113 -19.871 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.303 -23.427 -20.257 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.482 -24.612 -20.784 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.127 -23.999 -22.229 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.438 -23.349 -22.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.233 -25.167 -24.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.135 -25.824 -22.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.467 -26.126 -22.873 1.00 0.00 H new ATOM 1126 N VAL A 78 3.395 -23.946 -17.240 1.00 0.00 N ATOM 1127 CA VAL A 78 4.473 -22.954 -17.289 1.00 0.00 C ATOM 1128 C VAL A 78 4.676 -22.447 -18.733 1.00 0.00 C ATOM 1129 O VAL A 78 5.329 -23.086 -19.559 1.00 0.00 O ATOM 1130 CB VAL A 78 5.798 -23.536 -16.725 1.00 0.00 C ATOM 1131 CG1 VAL A 78 6.105 -24.901 -17.327 1.00 0.00 C ATOM 1132 CG2 VAL A 78 6.963 -22.580 -16.956 1.00 0.00 C ATOM 0 H VAL A 78 3.656 -24.821 -16.785 1.00 0.00 H new ATOM 0 HA VAL A 78 4.183 -22.112 -16.661 1.00 0.00 H new ATOM 0 HB VAL A 78 5.665 -23.661 -15.650 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.039 -25.280 -16.911 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.296 -25.593 -17.092 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.201 -24.808 -18.409 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.876 -23.015 -16.550 1.00 0.00 H new ATOM 0 HG22 VAL A 78 7.086 -22.408 -18.025 1.00 0.00 H new ATOM 0 HG23 VAL A 78 6.760 -21.632 -16.458 1.00 0.00 H new ATOM 1142 N GLY A 79 4.056 -21.313 -19.032 1.00 0.00 N ATOM 1143 CA GLY A 79 4.135 -20.725 -20.362 1.00 0.00 C ATOM 1144 C GLY A 79 2.753 -20.321 -20.871 1.00 0.00 C ATOM 1145 O GLY A 79 2.591 -19.904 -22.019 1.00 0.00 O ATOM 0 H GLY A 79 3.492 -20.781 -18.369 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.786 -19.851 -20.338 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.585 -21.439 -21.052 1.00 0.00 H new ATOM 1149 N THR A 80 1.761 -20.491 -20.000 1.00 0.00 N ATOM 1150 CA THR A 80 0.393 -20.083 -20.293 1.00 0.00 C ATOM 1151 C THR A 80 0.313 -18.569 -20.497 1.00 0.00 C ATOM 1152 O THR A 80 0.349 -17.795 -19.552 1.00 0.00 O ATOM 1153 CB THR A 80 -0.582 -20.502 -19.176 1.00 0.00 C ATOM 1154 OG1 THR A 80 -0.550 -21.924 -19.015 1.00 0.00 O ATOM 1155 CG2 THR A 80 -2.000 -20.057 -19.503 1.00 0.00 C ATOM 0 H THR A 80 1.883 -20.912 -19.079 1.00 0.00 H new ATOM 0 HA THR A 80 0.099 -20.590 -21.212 1.00 0.00 H new ATOM 0 HB THR A 80 -0.272 -20.021 -18.248 1.00 0.00 H new ATOM 0 HG1 THR A 80 0.337 -22.198 -18.700 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.672 -20.363 -18.701 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.027 -18.972 -19.604 1.00 0.00 H new ATOM 0 HG23 THR A 80 -2.319 -20.517 -20.439 1.00 0.00 H new ATOM 1163 N LYS A 81 0.177 -18.157 -21.740 1.00 0.00 N ATOM 1164 CA LYS A 81 0.180 -16.737 -22.040 1.00 0.00 C ATOM 1165 C LYS A 81 -1.223 -16.159 -22.015 1.00 0.00 C ATOM 1166 O LYS A 81 -2.103 -16.596 -22.758 1.00 0.00 O ATOM 1167 CB LYS A 81 0.848 -16.421 -23.378 1.00 0.00 C ATOM 1168 CG LYS A 81 0.983 -14.923 -23.590 1.00 0.00 C ATOM 1169 CD LYS A 81 1.807 -14.563 -24.811 1.00 0.00 C ATOM 1170 CE LYS A 81 1.103 -14.918 -26.107 1.00 0.00 C ATOM 1171 NZ LYS A 81 1.766 -14.283 -27.278 1.00 0.00 N ATOM 0 H LYS A 81 0.065 -18.771 -22.547 1.00 0.00 H new ATOM 0 HA LYS A 81 0.770 -16.266 -21.254 1.00 0.00 H new ATOM 0 HB2 LYS A 81 1.834 -16.885 -23.413 1.00 0.00 H new ATOM 0 HB3 LYS A 81 0.263 -16.854 -24.190 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.011 -14.486 -23.689 1.00 0.00 H new ATOM 0 HG3 LYS A 81 1.441 -14.478 -22.707 1.00 0.00 H new ATOM 0 HD2 LYS A 81 2.023 -13.495 -24.798 1.00 0.00 H new ATOM 0 HD3 LYS A 81 2.764 -15.082 -24.766 1.00 0.00 H new ATOM 0 HE2 LYS A 81 1.096 -16.001 -26.234 1.00 0.00 H new ATOM 0 HE3 LYS A 81 0.063 -14.596 -26.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 1.260 -14.546 -28.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 1.750 -13.249 -27.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 2.751 -14.610 -27.338 1.00 0.00 H new ATOM 1185 N VAL A 82 -1.424 -15.183 -21.143 1.00 0.00 N ATOM 1186 CA VAL A 82 -2.672 -14.444 -21.085 1.00 0.00 C ATOM 1187 C VAL A 82 -2.385 -12.946 -21.100 1.00 0.00 C ATOM 1188 O VAL A 82 -1.726 -12.418 -20.206 1.00 0.00 O ATOM 1189 CB VAL A 82 -3.490 -14.793 -19.825 1.00 0.00 C ATOM 1190 CG1 VAL A 82 -4.796 -14.022 -19.811 1.00 0.00 C ATOM 1191 CG2 VAL A 82 -3.754 -16.288 -19.740 1.00 0.00 C ATOM 0 H VAL A 82 -0.729 -14.883 -20.459 1.00 0.00 H new ATOM 0 HA VAL A 82 -3.261 -14.725 -21.958 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.904 -14.504 -18.952 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -5.361 -14.280 -18.915 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -4.587 -12.952 -19.813 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -5.380 -14.279 -20.695 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -4.332 -16.505 -18.842 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -4.314 -16.609 -20.618 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.805 -16.823 -19.699 1.00 0.00 H new ATOM 1201 N LYS A 83 -2.847 -12.281 -22.139 1.00 0.00 N ATOM 1202 CA LYS A 83 -2.559 -10.873 -22.327 1.00 0.00 C ATOM 1203 C LYS A 83 -3.734 -9.994 -21.960 1.00 0.00 C ATOM 1204 O LYS A 83 -4.876 -10.450 -21.914 1.00 0.00 O ATOM 1205 CB LYS A 83 -2.123 -10.603 -23.768 1.00 0.00 C ATOM 1206 CG LYS A 83 -3.104 -11.080 -24.822 1.00 0.00 C ATOM 1207 CD LYS A 83 -2.500 -10.935 -26.205 1.00 0.00 C ATOM 1208 CE LYS A 83 -3.471 -11.319 -27.304 1.00 0.00 C ATOM 1209 NZ LYS A 83 -3.973 -12.713 -27.162 1.00 0.00 N ATOM 0 H LYS A 83 -3.426 -12.695 -22.870 1.00 0.00 H new ATOM 0 HA LYS A 83 -1.741 -10.620 -21.652 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -1.968 -9.531 -23.893 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -1.161 -11.086 -23.940 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.367 -12.122 -24.640 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -4.027 -10.503 -24.758 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -2.179 -9.904 -26.352 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.609 -11.559 -26.277 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -4.315 -10.630 -27.295 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.981 -11.210 -28.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -4.538 -12.966 -27.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.167 -13.365 -27.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.565 -12.784 -26.310 1.00 0.00 H new ATOM 1223 N ASN A 84 -3.427 -8.725 -21.697 1.00 0.00 N ATOM 1224 CA ASN A 84 -4.424 -7.718 -21.389 1.00 0.00 C ATOM 1225 C ASN A 84 -5.132 -8.020 -20.083 1.00 0.00 C ATOM 1226 O ASN A 84 -6.361 -7.968 -20.011 1.00 0.00 O ATOM 1227 CB ASN A 84 -5.431 -7.578 -22.534 1.00 0.00 C ATOM 1228 CG ASN A 84 -4.803 -6.965 -23.769 1.00 0.00 C ATOM 1229 OD1 ASN A 84 -4.783 -5.746 -23.929 1.00 0.00 O ATOM 1230 ND2 ASN A 84 -4.296 -7.807 -24.655 1.00 0.00 N ATOM 0 H ASN A 84 -2.471 -8.371 -21.693 1.00 0.00 H new ATOM 0 HA ASN A 84 -3.905 -6.766 -21.272 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.837 -8.559 -22.782 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -6.268 -6.960 -22.208 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -3.868 -7.451 -25.510 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.333 -8.812 -24.483 1.00 0.00 H new ATOM 1237 N ILE A 85 -4.364 -8.318 -19.032 1.00 0.00 N ATOM 1238 CA ILE A 85 -4.910 -8.562 -17.701 1.00 0.00 C ATOM 1239 C ILE A 85 -5.515 -7.314 -17.049 1.00 0.00 C ATOM 1240 O ILE A 85 -5.522 -6.219 -17.615 1.00 0.00 O ATOM 1241 CB ILE A 85 -3.780 -9.077 -16.774 1.00 0.00 C ATOM 1242 CG1 ILE A 85 -2.674 -8.010 -16.632 1.00 0.00 C ATOM 1243 CG2 ILE A 85 -3.200 -10.367 -17.337 1.00 0.00 C ATOM 1244 CD1 ILE A 85 -1.632 -8.305 -15.558 1.00 0.00 C ATOM 0 H ILE A 85 -3.348 -8.396 -19.083 1.00 0.00 H new ATOM 0 HA ILE A 85 -5.708 -9.293 -17.827 1.00 0.00 H new ATOM 0 HB ILE A 85 -4.195 -9.276 -15.786 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -2.166 -7.904 -17.591 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -3.141 -7.050 -16.411 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.406 -10.725 -16.682 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.985 -11.121 -17.402 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.794 -10.180 -18.331 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.897 -7.500 -15.533 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.121 -8.380 -14.587 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.132 -9.246 -15.785 1.00 0.00 H new ATOM 1256 N ARG A 86 -5.995 -7.516 -15.831 1.00 0.00 N ATOM 1257 CA ARG A 86 -6.576 -6.471 -14.999 1.00 0.00 C ATOM 1258 C ARG A 86 -6.048 -6.631 -13.578 1.00 0.00 C ATOM 1259 O ARG A 86 -6.170 -7.706 -12.993 1.00 0.00 O ATOM 1260 CB ARG A 86 -8.110 -6.597 -15.033 1.00 0.00 C ATOM 1261 CG ARG A 86 -8.862 -5.902 -13.896 1.00 0.00 C ATOM 1262 CD ARG A 86 -8.593 -4.405 -13.841 1.00 0.00 C ATOM 1263 NE ARG A 86 -8.445 -3.817 -15.170 1.00 0.00 N ATOM 1264 CZ ARG A 86 -9.452 -3.417 -15.941 1.00 0.00 C ATOM 1265 NH1 ARG A 86 -10.705 -3.518 -15.520 1.00 0.00 N ATOM 1266 NH2 ARG A 86 -9.191 -2.903 -17.133 1.00 0.00 N ATOM 0 H ARG A 86 -5.992 -8.432 -15.383 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.302 -5.483 -15.369 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.468 -6.193 -15.980 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -8.369 -7.656 -15.020 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -9.932 -6.070 -14.018 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -8.574 -6.354 -12.947 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -9.411 -3.911 -13.317 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -7.687 -4.222 -13.263 1.00 0.00 H new ATOM 0 HE ARG A 86 -7.499 -3.705 -15.534 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.903 -3.905 -14.597 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.471 -3.208 -16.119 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -8.226 -2.817 -17.451 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -9.955 -2.593 -17.733 1.00 0.00 H new ATOM 1280 N LEU A 87 -5.445 -5.590 -13.019 1.00 0.00 N ATOM 1281 CA LEU A 87 -4.859 -5.688 -11.691 1.00 0.00 C ATOM 1282 C LEU A 87 -5.944 -5.562 -10.630 1.00 0.00 C ATOM 1283 O LEU A 87 -6.711 -4.599 -10.632 1.00 0.00 O ATOM 1284 CB LEU A 87 -3.812 -4.585 -11.502 1.00 0.00 C ATOM 1285 CG LEU A 87 -2.790 -4.457 -12.636 1.00 0.00 C ATOM 1286 CD1 LEU A 87 -1.855 -3.287 -12.383 1.00 0.00 C ATOM 1287 CD2 LEU A 87 -2.000 -5.746 -12.807 1.00 0.00 C ATOM 0 H LEU A 87 -5.350 -4.676 -13.461 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.376 -6.660 -11.587 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.328 -3.631 -11.390 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.277 -4.770 -10.571 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.335 -4.270 -13.561 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.136 -3.212 -13.199 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.434 -2.365 -12.324 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.323 -3.443 -11.444 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -1.282 -5.628 -13.618 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.469 -5.973 -11.882 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.683 -6.562 -13.043 1.00 0.00 H new ATOM 1299 N VAL A 88 -6.024 -6.537 -9.738 1.00 0.00 N ATOM 1300 CA VAL A 88 -7.064 -6.539 -8.715 1.00 0.00 C ATOM 1301 C VAL A 88 -6.494 -6.172 -7.354 1.00 0.00 C ATOM 1302 O VAL A 88 -5.570 -6.822 -6.867 1.00 0.00 O ATOM 1303 CB VAL A 88 -7.755 -7.911 -8.597 1.00 0.00 C ATOM 1304 CG1 VAL A 88 -9.241 -7.739 -8.330 1.00 0.00 C ATOM 1305 CG2 VAL A 88 -7.511 -8.760 -9.833 1.00 0.00 C ATOM 0 H VAL A 88 -5.387 -7.333 -9.699 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.798 -5.795 -9.025 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.318 -8.439 -7.750 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -9.712 -8.719 -8.250 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -9.382 -7.191 -7.398 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -9.696 -7.184 -9.150 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -8.012 -9.722 -9.719 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -7.906 -8.247 -10.710 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -6.440 -8.921 -9.958 1.00 0.00 H new ATOM 1315 N ASP A 89 -7.036 -5.105 -6.766 1.00 0.00 N ATOM 1316 CA ASP A 89 -6.665 -4.657 -5.415 1.00 0.00 C ATOM 1317 C ASP A 89 -5.253 -4.095 -5.380 1.00 0.00 C ATOM 1318 O ASP A 89 -4.784 -3.637 -4.339 1.00 0.00 O ATOM 1319 CB ASP A 89 -6.764 -5.797 -4.393 1.00 0.00 C ATOM 1320 CG ASP A 89 -8.162 -6.356 -4.245 1.00 0.00 C ATOM 1321 OD1 ASP A 89 -9.117 -5.559 -4.141 1.00 0.00 O ATOM 1322 OD2 ASP A 89 -8.308 -7.597 -4.207 1.00 0.00 O ATOM 0 H ASP A 89 -7.746 -4.523 -7.210 1.00 0.00 H new ATOM 0 HA ASP A 89 -7.373 -3.872 -5.150 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -6.090 -6.600 -4.690 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -6.421 -5.436 -3.423 1.00 0.00 H new ATOM 1327 N GLY A 90 -4.597 -4.112 -6.529 1.00 0.00 N ATOM 1328 CA GLY A 90 -3.174 -3.827 -6.599 1.00 0.00 C ATOM 1329 C GLY A 90 -2.331 -4.763 -5.738 1.00 0.00 C ATOM 1330 O GLY A 90 -1.112 -4.636 -5.688 1.00 0.00 O ATOM 0 H GLY A 90 -5.030 -4.321 -7.429 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.845 -3.903 -7.636 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.000 -2.798 -6.284 1.00 0.00 H new ATOM 1334 N ASP A 91 -2.976 -5.707 -5.067 1.00 0.00 N ATOM 1335 CA ASP A 91 -2.293 -6.556 -4.107 1.00 0.00 C ATOM 1336 C ASP A 91 -2.031 -7.969 -4.649 1.00 0.00 C ATOM 1337 O ASP A 91 -1.081 -8.202 -5.394 1.00 0.00 O ATOM 1338 CB ASP A 91 -3.095 -6.606 -2.798 1.00 0.00 C ATOM 1339 CG ASP A 91 -2.386 -7.355 -1.685 1.00 0.00 C ATOM 1340 OD1 ASP A 91 -1.399 -6.827 -1.130 1.00 0.00 O ATOM 1341 OD2 ASP A 91 -2.822 -8.473 -1.347 1.00 0.00 O ATOM 0 H ASP A 91 -3.972 -5.903 -5.171 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.314 -6.118 -3.914 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.300 -5.588 -2.467 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.058 -7.080 -2.988 1.00 0.00 H new ATOM 1346 N HIS A 92 -2.902 -8.898 -4.275 1.00 0.00 N ATOM 1347 CA HIS A 92 -2.654 -10.326 -4.443 1.00 0.00 C ATOM 1348 C HIS A 92 -3.534 -10.970 -5.518 1.00 0.00 C ATOM 1349 O HIS A 92 -4.139 -12.009 -5.254 1.00 0.00 O ATOM 1350 CB HIS A 92 -2.851 -11.043 -3.107 1.00 0.00 C ATOM 1351 CG HIS A 92 -1.826 -12.103 -2.850 1.00 0.00 C ATOM 1352 ND1 HIS A 92 -0.681 -11.874 -2.122 1.00 0.00 N ATOM 1353 CD2 HIS A 92 -1.773 -13.399 -3.233 1.00 0.00 C ATOM 1354 CE1 HIS A 92 0.032 -12.980 -2.069 1.00 0.00 C ATOM 1355 NE2 HIS A 92 -0.607 -13.924 -2.736 1.00 0.00 N ATOM 0 H HIS A 92 -3.802 -8.683 -3.846 1.00 0.00 H new ATOM 0 HA HIS A 92 -1.623 -10.431 -4.782 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -2.817 -10.311 -2.300 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -3.843 -11.494 -3.087 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -2.512 -13.923 -3.821 1.00 0.00 H new ATOM 0 HE1 HIS A 92 0.980 -13.096 -1.565 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -0.287 -14.884 -2.861 1.00 0.00 H new ATOM 1364 N ASP A 93 -3.546 -10.432 -6.743 1.00 0.00 N ATOM 1365 CA ASP A 93 -4.604 -10.827 -7.684 1.00 0.00 C ATOM 1366 C ASP A 93 -4.423 -10.279 -9.083 1.00 0.00 C ATOM 1367 O ASP A 93 -4.009 -9.145 -9.285 1.00 0.00 O ATOM 1368 CB ASP A 93 -5.998 -10.444 -7.180 1.00 0.00 C ATOM 1369 CG ASP A 93 -6.696 -11.567 -6.435 1.00 0.00 C ATOM 1370 OD1 ASP A 93 -6.771 -12.696 -6.972 1.00 0.00 O ATOM 1371 OD2 ASP A 93 -7.168 -11.327 -5.303 1.00 0.00 O ATOM 0 H ASP A 93 -2.871 -9.754 -7.096 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.516 -11.912 -7.739 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -5.914 -9.578 -6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -6.613 -10.142 -8.028 1.00 0.00 H new ATOM 1376 N ILE A 94 -4.789 -11.106 -10.051 1.00 0.00 N ATOM 1377 CA ILE A 94 -4.701 -10.752 -11.457 1.00 0.00 C ATOM 1378 C ILE A 94 -5.922 -11.249 -12.194 1.00 0.00 C ATOM 1379 O ILE A 94 -6.154 -12.445 -12.296 1.00 0.00 O ATOM 1380 CB ILE A 94 -3.455 -11.364 -12.106 1.00 0.00 C ATOM 1381 CG1 ILE A 94 -2.214 -10.978 -11.311 1.00 0.00 C ATOM 1382 CG2 ILE A 94 -3.329 -10.913 -13.553 1.00 0.00 C ATOM 1383 CD1 ILE A 94 -1.054 -11.902 -11.535 1.00 0.00 C ATOM 0 H ILE A 94 -5.156 -12.043 -9.882 1.00 0.00 H new ATOM 0 HA ILE A 94 -4.639 -9.666 -11.520 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.551 -12.450 -12.099 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -1.919 -9.964 -11.581 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -2.460 -10.966 -10.249 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -2.438 -11.358 -13.997 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -4.210 -11.231 -14.111 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -3.249 -9.827 -13.590 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -0.204 -11.570 -10.939 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.332 -12.913 -11.238 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.782 -11.895 -12.591 1.00 0.00 H new ATOM 1395 N ASP A 95 -6.704 -10.334 -12.701 1.00 0.00 N ATOM 1396 CA ASP A 95 -7.899 -10.708 -13.410 1.00 0.00 C ATOM 1397 C ASP A 95 -7.618 -10.824 -14.886 1.00 0.00 C ATOM 1398 O ASP A 95 -6.961 -9.972 -15.480 1.00 0.00 O ATOM 1399 CB ASP A 95 -8.996 -9.680 -13.163 1.00 0.00 C ATOM 1400 CG ASP A 95 -10.302 -10.058 -13.831 1.00 0.00 C ATOM 1401 OD1 ASP A 95 -11.103 -10.786 -13.210 1.00 0.00 O ATOM 1402 OD2 ASP A 95 -10.533 -9.632 -14.982 1.00 0.00 O ATOM 0 H ASP A 95 -6.537 -9.330 -12.637 1.00 0.00 H new ATOM 0 HA ASP A 95 -8.235 -11.678 -13.043 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -9.157 -9.575 -12.090 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -8.670 -8.708 -13.533 1.00 0.00 H new ATOM 1407 N CYS A 96 -8.104 -11.897 -15.464 1.00 0.00 N ATOM 1408 CA CYS A 96 -7.918 -12.147 -16.869 1.00 0.00 C ATOM 1409 C CYS A 96 -9.168 -12.781 -17.442 1.00 0.00 C ATOM 1410 O CYS A 96 -9.940 -13.420 -16.722 1.00 0.00 O ATOM 1411 CB CYS A 96 -6.713 -13.059 -17.089 1.00 0.00 C ATOM 1412 SG CYS A 96 -6.844 -14.658 -16.259 1.00 0.00 S ATOM 0 H CYS A 96 -8.636 -12.616 -14.975 1.00 0.00 H new ATOM 0 HA CYS A 96 -7.732 -11.202 -17.378 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -6.586 -13.225 -18.159 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -5.816 -12.550 -16.737 1.00 0.00 H new ATOM 0 HG CYS A 96 -7.661 -14.559 -15.253 1.00 0.00 H new ATOM 1418 N LYS A 97 -9.372 -12.596 -18.726 1.00 0.00 N ATOM 1419 CA LYS A 97 -10.494 -13.198 -19.403 1.00 0.00 C ATOM 1420 C LYS A 97 -9.988 -13.994 -20.585 1.00 0.00 C ATOM 1421 O LYS A 97 -9.182 -13.506 -21.383 1.00 0.00 O ATOM 1422 CB LYS A 97 -11.518 -12.136 -19.807 1.00 0.00 C ATOM 1423 CG LYS A 97 -12.241 -11.558 -18.600 1.00 0.00 C ATOM 1424 CD LYS A 97 -13.281 -10.518 -18.971 1.00 0.00 C ATOM 1425 CE LYS A 97 -14.097 -10.128 -17.748 1.00 0.00 C ATOM 1426 NZ LYS A 97 -15.050 -9.023 -18.020 1.00 0.00 N ATOM 0 H LYS A 97 -8.771 -12.030 -19.324 1.00 0.00 H new ATOM 0 HA LYS A 97 -11.012 -13.882 -18.730 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -11.015 -11.334 -20.348 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -12.245 -12.574 -20.490 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -12.724 -12.367 -18.052 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -11.511 -11.109 -17.927 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -12.792 -9.637 -19.386 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -13.939 -10.912 -19.745 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -14.649 -10.998 -17.393 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -13.421 -9.830 -16.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -15.579 -8.799 -17.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -14.525 -8.181 -18.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -15.715 -9.313 -18.765 1.00 0.00 H new ATOM 1440 N ILE A 98 -10.475 -15.213 -20.697 1.00 0.00 N ATOM 1441 CA ILE A 98 -9.901 -16.183 -21.602 1.00 0.00 C ATOM 1442 C ILE A 98 -10.958 -16.663 -22.573 1.00 0.00 C ATOM 1443 O ILE A 98 -11.930 -17.312 -22.181 1.00 0.00 O ATOM 1444 CB ILE A 98 -9.319 -17.382 -20.837 1.00 0.00 C ATOM 1445 CG1 ILE A 98 -8.312 -16.892 -19.797 1.00 0.00 C ATOM 1446 CG2 ILE A 98 -8.659 -18.358 -21.802 1.00 0.00 C ATOM 1447 CD1 ILE A 98 -8.095 -17.865 -18.669 1.00 0.00 C ATOM 0 H ILE A 98 -11.275 -15.556 -20.166 1.00 0.00 H new ATOM 0 HA ILE A 98 -9.090 -15.701 -22.148 1.00 0.00 H new ATOM 0 HB ILE A 98 -10.128 -17.904 -20.326 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -7.358 -16.699 -20.288 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.657 -15.943 -19.387 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -8.252 -19.202 -21.245 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.398 -18.719 -22.517 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -7.854 -17.853 -22.336 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -7.369 -17.453 -17.968 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -9.039 -18.040 -18.153 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -7.720 -18.807 -19.068 1.00 0.00 H new ATOM 1459 N ASP A 99 -10.766 -16.328 -23.832 1.00 0.00 N ATOM 1460 CA ASP A 99 -11.724 -16.655 -24.869 1.00 0.00 C ATOM 1461 C ASP A 99 -11.768 -18.157 -25.088 1.00 0.00 C ATOM 1462 O ASP A 99 -10.886 -18.736 -25.724 1.00 0.00 O ATOM 1463 CB ASP A 99 -11.367 -15.924 -26.162 1.00 0.00 C ATOM 1464 CG ASP A 99 -11.305 -14.422 -25.964 1.00 0.00 C ATOM 1465 OD1 ASP A 99 -12.355 -13.755 -26.070 1.00 0.00 O ATOM 1466 OD2 ASP A 99 -10.208 -13.901 -25.675 1.00 0.00 O ATOM 0 H ASP A 99 -9.945 -15.823 -24.165 1.00 0.00 H new ATOM 0 HA ASP A 99 -12.715 -16.329 -24.554 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.405 -16.282 -26.527 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.106 -16.159 -26.928 1.00 0.00 H new ATOM 1471 N GLY A 100 -12.783 -18.783 -24.517 1.00 0.00 N ATOM 1472 CA GLY A 100 -12.923 -20.218 -24.604 1.00 0.00 C ATOM 1473 C GLY A 100 -13.595 -20.786 -23.375 1.00 0.00 C ATOM 1474 O GLY A 100 -14.686 -21.350 -23.455 1.00 0.00 O ATOM 0 H GLY A 100 -13.520 -18.316 -23.989 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -13.505 -20.475 -25.489 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -11.940 -20.674 -24.726 1.00 0.00 H new ATOM 1478 N ILE A 101 -12.949 -20.628 -22.231 1.00 0.00 N ATOM 1479 CA ILE A 101 -13.519 -21.084 -20.973 1.00 0.00 C ATOM 1480 C ILE A 101 -14.232 -19.937 -20.263 1.00 0.00 C ATOM 1481 O ILE A 101 -15.355 -20.089 -19.784 1.00 0.00 O ATOM 1482 CB ILE A 101 -12.451 -21.704 -20.038 1.00 0.00 C ATOM 1483 CG1 ILE A 101 -11.242 -20.770 -19.882 1.00 0.00 C ATOM 1484 CG2 ILE A 101 -12.016 -23.063 -20.568 1.00 0.00 C ATOM 1485 CD1 ILE A 101 -10.198 -21.276 -18.908 1.00 0.00 C ATOM 0 H ILE A 101 -12.032 -20.189 -22.147 1.00 0.00 H new ATOM 0 HA ILE A 101 -14.240 -21.865 -21.213 1.00 0.00 H new ATOM 0 HB ILE A 101 -12.896 -21.838 -19.052 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -10.776 -20.628 -20.857 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -11.591 -19.792 -19.550 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -11.265 -23.490 -19.903 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -12.878 -23.728 -20.616 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -11.593 -22.946 -21.566 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.376 -20.562 -18.852 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -10.646 -21.391 -17.921 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.819 -22.240 -19.249 1.00 0.00 H new ATOM 1497 N GLY A 102 -13.573 -18.791 -20.206 1.00 0.00 N ATOM 1498 CA GLY A 102 -14.162 -17.623 -19.588 1.00 0.00 C ATOM 1499 C GLY A 102 -13.137 -16.827 -18.812 1.00 0.00 C ATOM 1500 O GLY A 102 -11.945 -16.903 -19.099 1.00 0.00 O ATOM 0 H GLY A 102 -12.635 -18.649 -20.579 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -14.609 -16.991 -20.355 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.966 -17.931 -18.920 1.00 0.00 H new ATOM 1504 N ALA A 103 -13.593 -16.062 -17.834 1.00 0.00 N ATOM 1505 CA ALA A 103 -12.697 -15.256 -17.015 1.00 0.00 C ATOM 1506 C ALA A 103 -12.066 -16.100 -15.910 1.00 0.00 C ATOM 1507 O ALA A 103 -12.706 -17.003 -15.369 1.00 0.00 O ATOM 1508 CB ALA A 103 -13.449 -14.075 -16.422 1.00 0.00 C ATOM 0 H ALA A 103 -14.579 -15.981 -17.586 1.00 0.00 H new ATOM 0 HA ALA A 103 -11.896 -14.877 -17.650 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -12.769 -13.480 -15.812 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -13.849 -13.458 -17.226 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -14.268 -14.439 -15.802 1.00 0.00 H new ATOM 1514 N MET A 104 -10.813 -15.809 -15.578 1.00 0.00 N ATOM 1515 CA MET A 104 -10.093 -16.583 -14.575 1.00 0.00 C ATOM 1516 C MET A 104 -9.279 -15.666 -13.662 1.00 0.00 C ATOM 1517 O MET A 104 -8.966 -14.529 -14.024 1.00 0.00 O ATOM 1518 CB MET A 104 -9.174 -17.604 -15.262 1.00 0.00 C ATOM 1519 CG MET A 104 -8.484 -18.563 -14.302 1.00 0.00 C ATOM 1520 SD MET A 104 -7.398 -19.734 -15.135 1.00 0.00 S ATOM 1521 CE MET A 104 -6.783 -20.664 -13.734 1.00 0.00 C ATOM 0 H MET A 104 -10.276 -15.045 -15.988 1.00 0.00 H new ATOM 0 HA MET A 104 -10.819 -17.115 -13.961 1.00 0.00 H new ATOM 0 HB2 MET A 104 -9.760 -18.181 -15.977 1.00 0.00 H new ATOM 0 HB3 MET A 104 -8.415 -17.068 -15.832 1.00 0.00 H new ATOM 0 HG2 MET A 104 -7.904 -17.990 -13.579 1.00 0.00 H new ATOM 0 HG3 MET A 104 -9.240 -19.113 -13.741 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.300 -21.575 -14.086 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.061 -20.060 -13.185 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.613 -20.924 -13.077 1.00 0.00 H new ATOM 1531 N LYS A 105 -8.946 -16.175 -12.483 1.00 0.00 N ATOM 1532 CA LYS A 105 -8.153 -15.440 -11.509 1.00 0.00 C ATOM 1533 C LYS A 105 -6.776 -16.084 -11.371 1.00 0.00 C ATOM 1534 O LYS A 105 -6.658 -17.308 -11.320 1.00 0.00 O ATOM 1535 CB LYS A 105 -8.865 -15.373 -10.144 1.00 0.00 C ATOM 1536 CG LYS A 105 -9.446 -16.697 -9.651 1.00 0.00 C ATOM 1537 CD LYS A 105 -10.819 -16.973 -10.255 1.00 0.00 C ATOM 1538 CE LYS A 105 -11.413 -18.281 -9.752 1.00 0.00 C ATOM 1539 NZ LYS A 105 -11.677 -18.250 -8.290 1.00 0.00 N ATOM 0 H LYS A 105 -9.218 -17.109 -12.176 1.00 0.00 H new ATOM 0 HA LYS A 105 -8.032 -14.417 -11.864 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -8.158 -15.005 -9.400 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -9.671 -14.642 -10.207 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -8.766 -17.510 -9.907 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -9.524 -16.677 -8.564 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -11.493 -16.152 -10.012 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -10.737 -17.007 -11.341 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -12.343 -18.484 -10.283 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -10.730 -19.100 -9.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -12.232 -19.087 -8.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -10.774 -18.252 -7.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -12.210 -17.389 -8.052 1.00 0.00 H new ATOM 1553 N LEU A 106 -5.744 -15.257 -11.315 1.00 0.00 N ATOM 1554 CA LEU A 106 -4.372 -15.734 -11.345 1.00 0.00 C ATOM 1555 C LEU A 106 -3.588 -15.251 -10.133 1.00 0.00 C ATOM 1556 O LEU A 106 -3.761 -14.126 -9.661 1.00 0.00 O ATOM 1557 CB LEU A 106 -3.674 -15.263 -12.620 1.00 0.00 C ATOM 1558 CG LEU A 106 -4.318 -15.717 -13.930 1.00 0.00 C ATOM 1559 CD1 LEU A 106 -3.590 -15.095 -15.108 1.00 0.00 C ATOM 1560 CD2 LEU A 106 -4.311 -17.237 -14.039 1.00 0.00 C ATOM 0 H LEU A 106 -5.833 -14.243 -11.248 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.403 -16.823 -11.325 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.638 -14.174 -12.612 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.643 -15.617 -12.601 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.356 -15.384 -13.941 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.055 -15.423 -16.038 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.646 -14.009 -15.038 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.545 -15.406 -15.095 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.774 -17.537 -14.979 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.283 -17.599 -14.009 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -4.870 -17.664 -13.207 1.00 0.00 H new ATOM 1572 N LYS A 107 -2.739 -16.131 -9.639 1.00 0.00 N ATOM 1573 CA LYS A 107 -1.907 -15.811 -8.504 1.00 0.00 C ATOM 1574 C LYS A 107 -0.560 -15.276 -8.944 1.00 0.00 C ATOM 1575 O LYS A 107 0.186 -15.929 -9.673 1.00 0.00 O ATOM 1576 CB LYS A 107 -1.787 -16.993 -7.549 1.00 0.00 C ATOM 1577 CG LYS A 107 -2.586 -16.776 -6.273 1.00 0.00 C ATOM 1578 CD LYS A 107 -4.004 -16.312 -6.578 1.00 0.00 C ATOM 1579 CE LYS A 107 -4.646 -15.636 -5.375 1.00 0.00 C ATOM 1580 NZ LYS A 107 -5.998 -15.101 -5.692 1.00 0.00 N ATOM 0 H LYS A 107 -2.610 -17.073 -10.009 1.00 0.00 H new ATOM 0 HA LYS A 107 -2.393 -15.012 -7.945 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -2.136 -17.898 -8.046 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.738 -17.152 -7.298 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.620 -17.703 -5.701 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.085 -16.035 -5.650 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -3.987 -15.619 -7.419 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -4.609 -17.166 -6.881 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.722 -16.350 -4.555 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.006 -14.823 -5.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.531 -14.961 -4.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -5.904 -14.192 -6.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.505 -15.776 -6.300 1.00 0.00 H new ATOM 1594 N SER A 108 -0.289 -14.058 -8.492 1.00 0.00 N ATOM 1595 CA SER A 108 0.901 -13.303 -8.857 1.00 0.00 C ATOM 1596 C SER A 108 2.177 -14.104 -8.644 1.00 0.00 C ATOM 1597 O SER A 108 3.115 -14.038 -9.439 1.00 0.00 O ATOM 1598 CB SER A 108 0.931 -12.032 -8.018 1.00 0.00 C ATOM 1599 OG SER A 108 0.522 -12.306 -6.681 1.00 0.00 O ATOM 0 H SER A 108 -0.903 -13.558 -7.849 1.00 0.00 H new ATOM 0 HA SER A 108 0.855 -13.065 -9.920 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.937 -11.613 -8.018 1.00 0.00 H new ATOM 0 HB3 SER A 108 0.274 -11.283 -8.459 1.00 0.00 H new ATOM 0 HG SER A 108 0.642 -13.260 -6.491 1.00 0.00 H new ATOM 1605 N GLU A 109 2.193 -14.880 -7.579 1.00 0.00 N ATOM 1606 CA GLU A 109 3.358 -15.653 -7.215 1.00 0.00 C ATOM 1607 C GLU A 109 3.577 -16.825 -8.159 1.00 0.00 C ATOM 1608 O GLU A 109 4.582 -17.527 -8.053 1.00 0.00 O ATOM 1609 CB GLU A 109 3.243 -16.145 -5.785 1.00 0.00 C ATOM 1610 CG GLU A 109 1.938 -16.838 -5.502 1.00 0.00 C ATOM 1611 CD GLU A 109 0.876 -15.905 -4.952 1.00 0.00 C ATOM 1612 OE1 GLU A 109 0.352 -15.065 -5.715 1.00 0.00 O ATOM 1613 OE2 GLU A 109 0.564 -16.007 -3.746 1.00 0.00 O ATOM 0 H GLU A 109 1.401 -14.991 -6.945 1.00 0.00 H new ATOM 0 HA GLU A 109 4.224 -14.996 -7.297 1.00 0.00 H new ATOM 0 HB2 GLU A 109 4.064 -16.830 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 109 3.353 -15.299 -5.106 1.00 0.00 H new ATOM 0 HG2 GLU A 109 1.570 -17.296 -6.420 1.00 0.00 H new ATOM 0 HG3 GLU A 109 2.109 -17.645 -4.789 1.00 0.00 H new ATOM 1620 N PHE A 110 2.642 -17.071 -9.070 1.00 0.00 N ATOM 1621 CA PHE A 110 2.816 -18.140 -10.031 1.00 0.00 C ATOM 1622 C PHE A 110 3.005 -17.609 -11.448 1.00 0.00 C ATOM 1623 O PHE A 110 3.258 -18.382 -12.368 1.00 0.00 O ATOM 1624 CB PHE A 110 1.594 -19.054 -9.986 1.00 0.00 C ATOM 1625 CG PHE A 110 1.426 -19.775 -8.678 1.00 0.00 C ATOM 1626 CD1 PHE A 110 2.373 -20.687 -8.241 1.00 0.00 C ATOM 1627 CD2 PHE A 110 0.317 -19.539 -7.888 1.00 0.00 C ATOM 1628 CE1 PHE A 110 2.213 -21.348 -7.037 1.00 0.00 C ATOM 1629 CE2 PHE A 110 0.150 -20.194 -6.684 1.00 0.00 C ATOM 1630 CZ PHE A 110 1.100 -21.100 -6.257 1.00 0.00 C ATOM 0 H PHE A 110 1.770 -16.550 -9.159 1.00 0.00 H new ATOM 0 HA PHE A 110 3.717 -18.692 -9.764 1.00 0.00 H new ATOM 0 HB2 PHE A 110 0.700 -18.461 -10.181 1.00 0.00 H new ATOM 0 HB3 PHE A 110 1.671 -19.788 -10.788 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.245 -20.884 -8.847 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.430 -18.832 -8.217 1.00 0.00 H new ATOM 0 HE1 PHE A 110 2.957 -22.057 -6.707 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -0.722 -19.998 -6.078 1.00 0.00 H new ATOM 0 HZ PHE A 110 0.973 -21.614 -5.315 1.00 0.00 H new ATOM 1640 N VAL A 111 2.904 -16.298 -11.632 1.00 0.00 N ATOM 1641 CA VAL A 111 2.914 -15.733 -12.980 1.00 0.00 C ATOM 1642 C VAL A 111 4.135 -14.855 -13.244 1.00 0.00 C ATOM 1643 O VAL A 111 4.959 -14.622 -12.353 1.00 0.00 O ATOM 1644 CB VAL A 111 1.639 -14.922 -13.262 1.00 0.00 C ATOM 1645 CG1 VAL A 111 0.408 -15.811 -13.174 1.00 0.00 C ATOM 1646 CG2 VAL A 111 1.531 -13.758 -12.301 1.00 0.00 C ATOM 0 H VAL A 111 2.816 -15.614 -10.880 1.00 0.00 H new ATOM 0 HA VAL A 111 2.958 -16.588 -13.655 1.00 0.00 H new ATOM 0 HB VAL A 111 1.698 -14.525 -14.276 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.484 -15.218 -13.377 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.485 -16.613 -13.908 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.339 -16.240 -12.174 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.623 -13.194 -12.514 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.494 -14.133 -11.278 1.00 0.00 H new ATOM 0 HG23 VAL A 111 2.398 -13.108 -12.418 1.00 0.00 H new ATOM 1656 N ARG A 112 4.244 -14.393 -14.487 1.00 0.00 N ATOM 1657 CA ARG A 112 5.370 -13.583 -14.928 1.00 0.00 C ATOM 1658 C ARG A 112 4.970 -12.642 -16.058 1.00 0.00 C ATOM 1659 O ARG A 112 4.357 -13.055 -17.036 1.00 0.00 O ATOM 1660 CB ARG A 112 6.517 -14.480 -15.390 1.00 0.00 C ATOM 1661 CG ARG A 112 7.480 -13.802 -16.350 1.00 0.00 C ATOM 1662 CD ARG A 112 8.806 -14.529 -16.409 1.00 0.00 C ATOM 1663 NE ARG A 112 9.809 -13.781 -17.163 1.00 0.00 N ATOM 1664 CZ ARG A 112 11.042 -14.223 -17.416 1.00 0.00 C ATOM 1665 NH1 ARG A 112 11.424 -15.431 -17.014 1.00 0.00 N ATOM 1666 NH2 ARG A 112 11.893 -13.455 -18.080 1.00 0.00 N ATOM 0 H ARG A 112 3.552 -14.571 -15.215 1.00 0.00 H new ATOM 0 HA ARG A 112 5.696 -12.981 -14.080 1.00 0.00 H new ATOM 0 HB2 ARG A 112 7.071 -14.823 -14.517 1.00 0.00 H new ATOM 0 HB3 ARG A 112 6.102 -15.365 -15.872 1.00 0.00 H new ATOM 0 HG2 ARG A 112 7.038 -13.767 -17.346 1.00 0.00 H new ATOM 0 HG3 ARG A 112 7.643 -12.771 -16.037 1.00 0.00 H new ATOM 0 HD2 ARG A 112 9.169 -14.703 -15.396 1.00 0.00 H new ATOM 0 HD3 ARG A 112 8.663 -15.507 -16.868 1.00 0.00 H new ATOM 0 HE ARG A 112 9.550 -12.861 -17.519 1.00 0.00 H new ATOM 0 HH11 ARG A 112 10.772 -16.030 -16.507 1.00 0.00 H new ATOM 0 HH12 ARG A 112 12.369 -15.759 -17.213 1.00 0.00 H new ATOM 0 HH21 ARG A 112 11.605 -12.529 -18.396 1.00 0.00 H new ATOM 0 HH22 ARG A 112 12.837 -13.790 -18.275 1.00 0.00 H new ATOM 1680 N LYS A 113 5.329 -11.379 -15.912 1.00 0.00 N ATOM 1681 CA LYS A 113 5.100 -10.385 -16.942 1.00 0.00 C ATOM 1682 C LYS A 113 5.938 -10.668 -18.181 1.00 0.00 C ATOM 1683 O LYS A 113 7.165 -10.752 -18.113 1.00 0.00 O ATOM 1684 CB LYS A 113 5.440 -8.998 -16.407 1.00 0.00 C ATOM 1685 CG LYS A 113 5.132 -7.882 -17.383 1.00 0.00 C ATOM 1686 CD LYS A 113 5.506 -6.534 -16.807 1.00 0.00 C ATOM 1687 CE LYS A 113 5.094 -5.407 -17.732 1.00 0.00 C ATOM 1688 NZ LYS A 113 5.432 -4.079 -17.163 1.00 0.00 N ATOM 0 H LYS A 113 5.787 -11.015 -15.076 1.00 0.00 H new ATOM 0 HA LYS A 113 4.047 -10.428 -17.222 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.885 -8.827 -15.485 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.499 -8.965 -16.152 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.677 -8.047 -18.312 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.070 -7.893 -17.630 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.026 -6.405 -15.837 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.582 -6.494 -16.638 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.590 -5.527 -18.695 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.021 -5.461 -17.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 4.834 -3.351 -17.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.267 -4.089 -16.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.432 -3.865 -17.351 1.00 0.00 H new ATOM 1702 N VAL A 114 5.264 -10.823 -19.304 1.00 0.00 N ATOM 1703 CA VAL A 114 5.927 -10.987 -20.587 1.00 0.00 C ATOM 1704 C VAL A 114 6.367 -9.631 -21.132 1.00 0.00 C ATOM 1705 O VAL A 114 7.488 -9.477 -21.623 1.00 0.00 O ATOM 1706 CB VAL A 114 4.999 -11.663 -21.620 1.00 0.00 C ATOM 1707 CG1 VAL A 114 5.736 -11.929 -22.924 1.00 0.00 C ATOM 1708 CG2 VAL A 114 4.424 -12.950 -21.060 1.00 0.00 C ATOM 0 H VAL A 114 4.245 -10.839 -19.355 1.00 0.00 H new ATOM 0 HA VAL A 114 6.796 -11.624 -20.425 1.00 0.00 H new ATOM 0 HB VAL A 114 4.176 -10.980 -21.831 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.060 -12.405 -23.634 1.00 0.00 H new ATOM 0 HG12 VAL A 114 6.092 -10.986 -23.339 1.00 0.00 H new ATOM 0 HG13 VAL A 114 6.585 -12.586 -22.735 1.00 0.00 H new ATOM 0 HG21 VAL A 114 3.773 -13.411 -21.803 1.00 0.00 H new ATOM 0 HG22 VAL A 114 5.236 -13.635 -20.814 1.00 0.00 H new ATOM 0 HG23 VAL A 114 3.849 -12.731 -20.160 1.00 0.00 H new ATOM 1718 N GLY A 115 5.475 -8.650 -21.036 1.00 0.00 N ATOM 1719 CA GLY A 115 5.761 -7.328 -21.560 1.00 0.00 C ATOM 1720 C GLY A 115 5.538 -7.242 -23.058 1.00 0.00 C ATOM 1721 O GLY A 115 5.903 -6.251 -23.691 1.00 0.00 O ATOM 0 H GLY A 115 4.557 -8.748 -20.603 1.00 0.00 H new ATOM 0 HA2 GLY A 115 5.128 -6.596 -21.058 1.00 0.00 H new ATOM 0 HA3 GLY A 115 6.794 -7.065 -21.333 1.00 0.00 H new ATOM 1725 N SER A 116 4.939 -8.281 -23.623 1.00 0.00 N ATOM 1726 CA SER A 116 4.695 -8.339 -25.052 1.00 0.00 C ATOM 1727 C SER A 116 3.430 -9.144 -25.329 1.00 0.00 C ATOM 1728 O SER A 116 2.388 -8.528 -25.637 1.00 0.00 O ATOM 1729 CB SER A 116 5.899 -8.961 -25.770 1.00 0.00 C ATOM 1730 OG SER A 116 5.782 -8.839 -27.180 1.00 0.00 O ATOM 1731 OXT SER A 116 3.469 -10.386 -25.208 1.00 0.00 O ATOM 0 H SER A 116 4.612 -9.098 -23.107 1.00 0.00 H new ATOM 0 HA SER A 116 4.555 -7.327 -25.432 1.00 0.00 H new ATOM 0 HB2 SER A 116 6.815 -8.474 -25.436 1.00 0.00 H new ATOM 0 HB3 SER A 116 5.981 -10.014 -25.500 1.00 0.00 H new ATOM 0 HG SER A 116 6.565 -9.243 -27.609 1.00 0.00 H new TER 1737 SER A 116 HETATM 1738 ZN ZN A 117 -1.005 14.452 20.821 1.00 0.00 ZN