USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1203 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 142 GLN : amide:sc= 0.578 X(o=0.55,f=0.73) USER MOD Set 1.2: A 145 GLN : amide:sc= -0.0262 K(o=0.55,f=-0.79) USER MOD Set 2.1: A 72 GLN : amide:sc= -0.417 K(o=-7.4,f=-10) USER MOD Set 2.2: A 105 HIS :FLIP no HE2:sc= -7.35! C(o=-8.4!,f=-7.4!) USER MOD Set 2.3: A 106 LYS NZ :NH3+ -102:sc= 0.334 (180deg=-1.2) USER MOD Set 3.1: A 53 MET CE :methyl 169:sc= -0.0324 (180deg=-0.308) USER MOD Set 3.2: A 63 MET CE :methyl -171:sc=-9.87e-05 (180deg=-0.26) USER MOD Set 4.1: A 20 GLN : amide:sc= -0.402 K(o=3.7,f=2.6) USER MOD Set 4.2: A 61 HIS : no HE2:sc= 0.761 K(o=3.7,f=-3.1!) USER MOD Set 4.3: A 62 SER OG : rot 176:sc= 1.51 USER MOD Set 4.4: A 64 ASN : amide:sc= 0.325 K(o=3.7,f=0.48) USER MOD Set 4.5: A 111 GLN : amide:sc= 1.47 K(o=3.7,f=0.48) USER MOD Set 5.1: A 4 MET CE :methyl 175:sc= -0.207 (180deg=-0.269) USER MOD Set 5.2: A 8 GLN : amide:sc= 1.46 K(o=1.3,f=-8.6!) USER MOD Single : A 1 GLY N :NH3+ -165:sc= 1.81 (180deg=1.01) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc=-0.00379 K(o=-0.0038,f=-1.8) USER MOD Single : A 7 GLN : amide:sc= 0.524 K(o=0.52,f=-0.39) USER MOD Single : A 11 SER OG : rot 58:sc= 1.23 USER MOD Single : A 13 TYR OH : rot -147:sc= 1.24 USER MOD Single : A 19 HIS : no HE2:sc= 0.417 K(o=0.42,f=-2.8!) USER MOD Single : A 35 SER OG : rot 31:sc= 0.287 USER MOD Single : A 38 LYS NZ :NH3+ -170:sc= 1.84 (180deg=1.55) USER MOD Single : A 39 MET CE :methyl -153:sc= -1.08 (180deg=-2.91!) USER MOD Single : A 43 THR OG1 : rot -41:sc= 0.727 USER MOD Single : A 44 HIS : no HD1:sc= -0.503 K(o=-0.5,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ -157:sc= 0.481 (180deg=0.314) USER MOD Single : A 50 GLN : amide:sc= 0.353 K(o=0.35,f=-0.25) USER MOD Single : A 51 GLN : amide:sc= 1.36 K(o=1.4,f=-5.6!) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 THR OG1 : rot 113:sc= 0.83 USER MOD Single : A 68 GLN : amide:sc= 0.0418 K(o=0.042,f=-4.8!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -7:sc= 0.939 USER MOD Single : A 81 SER OG : rot -148:sc= 1.18 USER MOD Single : A 84 SER OG : rot 75:sc= 1.61 USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= 1.55 (180deg=1.33) USER MOD Single : A 90 MET CE :methyl -152:sc= -1.16 (180deg=-3.47) USER MOD Single : A 94 THR OG1 : rot 18:sc= 0.0844 USER MOD Single : A 96 ASN : amide:sc= 0.249 K(o=0.25,f=-0.4) USER MOD Single : A 102 THR OG1 : rot 122:sc= 1.28 USER MOD Single : A 108 SER OG : rot 62:sc= 0.519 USER MOD Single : A 119 LYS NZ :NH3+ -174:sc= 2.17 (180deg=2.14) USER MOD Single : A 120 GLN : amide:sc= -0.0736 X(o=-0.074,f=-0.048) USER MOD Single : A 133 MET CE :methyl -175:sc= -0.773 (180deg=-0.939) USER MOD Single : A 134 ASN : amide:sc= 0.924 K(o=0.92,f=-7.1!) USER MOD Single : A 135 SER OG : rot -36:sc= 0.439 USER MOD Single : A 138 ASN : amide:sc= 0.943 K(o=0.94,f=-0.097) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0413 USER MOD Single : A 143 THR OG1 : rot 102:sc= 1.25 USER MOD Single : A 146 ASN : amide:sc= 0.301 K(o=0.3,f=-2.4) USER MOD Single : A 151 LYS NZ :NH3+ -154:sc= 2.11 (180deg=1.04) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= -0.478 X(o=-0.48,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.846 12.163 9.931 1.00 0.00 N ATOM 2 CA GLY A 1 4.134 10.824 9.389 1.00 0.00 C ATOM 3 C GLY A 1 5.524 10.398 9.802 1.00 0.00 C ATOM 4 O GLY A 1 5.845 10.488 10.985 1.00 0.00 O ATOM 0 H1 GLY A 1 2.825 12.350 9.870 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.148 12.207 10.925 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.362 12.879 9.380 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.399 10.107 9.755 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.054 10.836 8.302 1.00 0.00 H new ATOM 8 N SER A 2 6.361 9.975 8.847 1.00 0.00 N ATOM 9 CA SER A 2 7.808 9.905 9.049 1.00 0.00 C ATOM 10 C SER A 2 8.374 11.307 9.357 1.00 0.00 C ATOM 11 O SER A 2 7.629 12.290 9.359 1.00 0.00 O ATOM 12 CB SER A 2 8.466 9.236 7.833 1.00 0.00 C ATOM 13 OG SER A 2 9.747 8.736 8.163 1.00 0.00 O ATOM 0 H SER A 2 6.055 9.675 7.921 1.00 0.00 H new ATOM 0 HA SER A 2 8.038 9.286 9.916 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.835 8.423 7.475 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.551 9.956 7.019 1.00 0.00 H new ATOM 0 HG SER A 2 10.146 8.313 7.374 1.00 0.00 H new ATOM 19 N HIS A 3 9.679 11.389 9.644 1.00 0.00 N ATOM 20 CA HIS A 3 10.364 12.607 10.082 1.00 0.00 C ATOM 21 C HIS A 3 10.059 13.782 9.150 1.00 0.00 C ATOM 22 O HIS A 3 10.227 13.699 7.934 1.00 0.00 O ATOM 23 CB HIS A 3 11.877 12.373 10.201 1.00 0.00 C ATOM 24 CG HIS A 3 12.647 13.410 11.000 1.00 0.00 C ATOM 25 ND1 HIS A 3 12.318 14.733 11.252 1.00 0.00 N ATOM 26 CD2 HIS A 3 13.847 13.171 11.619 1.00 0.00 C ATOM 27 CE1 HIS A 3 13.296 15.259 12.010 1.00 0.00 C ATOM 28 NE2 HIS A 3 14.250 14.347 12.255 1.00 0.00 N ATOM 0 H HIS A 3 10.304 10.586 9.575 1.00 0.00 H new ATOM 0 HA HIS A 3 9.985 12.865 11.071 1.00 0.00 H new ATOM 0 HB2 HIS A 3 12.039 11.397 10.657 1.00 0.00 H new ATOM 0 HB3 HIS A 3 12.299 12.330 9.197 1.00 0.00 H new ATOM 0 HD2 HIS A 3 14.387 12.236 11.615 1.00 0.00 H new ATOM 0 HE1 HIS A 3 13.312 16.276 12.372 1.00 0.00 H new ATOM 0 HE2 HIS A 3 15.102 14.486 12.799 1.00 0.00 H new ATOM 36 N MET A 4 9.614 14.875 9.758 1.00 0.00 N ATOM 37 CA MET A 4 9.138 16.107 9.153 1.00 0.00 C ATOM 38 C MET A 4 9.540 17.261 10.073 1.00 0.00 C ATOM 39 O MET A 4 10.199 17.046 11.095 1.00 0.00 O ATOM 40 CB MET A 4 7.599 16.051 9.067 1.00 0.00 C ATOM 41 CG MET A 4 7.065 15.166 7.939 1.00 0.00 C ATOM 42 SD MET A 4 5.371 14.574 8.213 1.00 0.00 S ATOM 43 CE MET A 4 4.493 16.132 8.497 1.00 0.00 C ATOM 0 H MET A 4 9.575 14.923 10.776 1.00 0.00 H new ATOM 0 HA MET A 4 9.560 16.242 8.157 1.00 0.00 H new ATOM 0 HB2 MET A 4 7.206 15.686 10.016 1.00 0.00 H new ATOM 0 HB3 MET A 4 7.217 17.063 8.932 1.00 0.00 H new ATOM 0 HG2 MET A 4 7.098 15.725 7.004 1.00 0.00 H new ATOM 0 HG3 MET A 4 7.725 14.307 7.820 1.00 0.00 H new ATOM 0 HE1 MET A 4 3.425 15.936 8.592 1.00 0.00 H new ATOM 0 HE2 MET A 4 4.860 16.595 9.413 1.00 0.00 H new ATOM 0 HE3 MET A 4 4.665 16.805 7.657 1.00 0.00 H new ATOM 53 N LEU A 5 9.237 18.474 9.625 1.00 0.00 N ATOM 54 CA LEU A 5 9.354 19.745 10.319 1.00 0.00 C ATOM 55 C LEU A 5 7.859 20.055 10.415 1.00 0.00 C ATOM 56 O LEU A 5 7.183 19.961 9.386 1.00 0.00 O ATOM 57 CB LEU A 5 10.118 20.807 9.510 1.00 0.00 C ATOM 58 CG LEU A 5 11.623 20.527 9.347 1.00 0.00 C ATOM 59 CD1 LEU A 5 12.253 21.614 8.468 1.00 0.00 C ATOM 60 CD2 LEU A 5 12.368 20.481 10.688 1.00 0.00 C ATOM 0 H LEU A 5 8.870 18.601 8.682 1.00 0.00 H new ATOM 0 HA LEU A 5 9.912 19.727 11.255 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.667 20.885 8.521 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.992 21.775 9.995 1.00 0.00 H new ATOM 0 HG LEU A 5 11.716 19.545 8.883 1.00 0.00 H new ATOM 0 HD11 LEU A 5 13.319 21.416 8.352 1.00 0.00 H new ATOM 0 HD12 LEU A 5 11.775 21.612 7.488 1.00 0.00 H new ATOM 0 HD13 LEU A 5 12.114 22.588 8.938 1.00 0.00 H new ATOM 0 HD21 LEU A 5 13.425 20.280 10.511 1.00 0.00 H new ATOM 0 HD22 LEU A 5 12.261 21.439 11.197 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.948 19.691 11.311 1.00 0.00 H new ATOM 72 N ASP A 6 7.351 20.351 11.611 1.00 0.00 N ATOM 73 CA ASP A 6 5.919 20.519 11.864 1.00 0.00 C ATOM 74 C ASP A 6 5.160 21.343 10.826 1.00 0.00 C ATOM 75 O ASP A 6 5.354 22.550 10.676 1.00 0.00 O ATOM 76 CB ASP A 6 5.677 21.081 13.271 1.00 0.00 C ATOM 77 CG ASP A 6 5.643 19.952 14.293 1.00 0.00 C ATOM 78 OD1 ASP A 6 4.548 19.367 14.460 1.00 0.00 O ATOM 79 OD2 ASP A 6 6.722 19.660 14.856 1.00 0.00 O ATOM 0 H ASP A 6 7.928 20.483 12.441 1.00 0.00 H new ATOM 0 HA ASP A 6 5.508 19.513 11.782 1.00 0.00 H new ATOM 0 HB2 ASP A 6 6.465 21.789 13.528 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.735 21.630 13.294 1.00 0.00 H new ATOM 84 N GLN A 7 4.278 20.629 10.132 1.00 0.00 N ATOM 85 CA GLN A 7 3.277 21.028 9.162 1.00 0.00 C ATOM 86 C GLN A 7 2.595 19.694 8.867 1.00 0.00 C ATOM 87 O GLN A 7 3.220 18.811 8.277 1.00 0.00 O ATOM 88 CB GLN A 7 3.898 21.645 7.889 1.00 0.00 C ATOM 89 CG GLN A 7 3.486 23.114 7.697 1.00 0.00 C ATOM 90 CD GLN A 7 1.970 23.327 7.610 1.00 0.00 C ATOM 91 OE1 GLN A 7 1.437 24.222 8.255 1.00 0.00 O ATOM 92 NE2 GLN A 7 1.268 22.520 6.826 1.00 0.00 N ATOM 0 H GLN A 7 4.251 19.617 10.260 1.00 0.00 H new ATOM 0 HA GLN A 7 2.606 21.807 9.524 1.00 0.00 H new ATOM 0 HB2 GLN A 7 4.984 21.578 7.948 1.00 0.00 H new ATOM 0 HB3 GLN A 7 3.590 21.066 7.019 1.00 0.00 H new ATOM 0 HG2 GLN A 7 3.879 23.703 8.526 1.00 0.00 H new ATOM 0 HG3 GLN A 7 3.950 23.495 6.787 1.00 0.00 H new ATOM 0 HE21 GLN A 7 1.738 21.783 6.300 1.00 0.00 H new ATOM 0 HE22 GLN A 7 0.258 22.636 6.749 1.00 0.00 H new ATOM 101 N GLN A 8 1.330 19.533 9.243 1.00 0.00 N ATOM 102 CA GLN A 8 0.630 18.263 9.132 1.00 0.00 C ATOM 103 C GLN A 8 -0.578 18.481 8.233 1.00 0.00 C ATOM 104 O GLN A 8 -1.489 19.216 8.599 1.00 0.00 O ATOM 105 CB GLN A 8 0.249 17.735 10.530 1.00 0.00 C ATOM 106 CG GLN A 8 1.376 16.967 11.248 1.00 0.00 C ATOM 107 CD GLN A 8 2.531 17.821 11.786 1.00 0.00 C ATOM 108 OE1 GLN A 8 3.584 17.915 11.167 1.00 0.00 O ATOM 109 NE2 GLN A 8 2.383 18.402 12.965 1.00 0.00 N ATOM 0 H GLN A 8 0.762 20.284 9.634 1.00 0.00 H new ATOM 0 HA GLN A 8 1.266 17.497 8.687 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -0.055 18.576 11.153 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.617 17.080 10.434 1.00 0.00 H new ATOM 0 HG2 GLN A 8 0.940 16.415 12.080 1.00 0.00 H new ATOM 0 HG3 GLN A 8 1.786 16.231 10.556 1.00 0.00 H new ATOM 0 HE21 GLN A 8 1.501 18.315 13.469 1.00 0.00 H new ATOM 0 HE22 GLN A 8 3.151 18.937 13.370 1.00 0.00 H new ATOM 118 N GLU A 9 -0.554 17.836 7.070 1.00 0.00 N ATOM 119 CA GLU A 9 -1.599 17.825 6.058 1.00 0.00 C ATOM 120 C GLU A 9 -1.904 16.349 5.778 1.00 0.00 C ATOM 121 O GLU A 9 -1.063 15.482 6.051 1.00 0.00 O ATOM 122 CB GLU A 9 -1.099 18.510 4.772 1.00 0.00 C ATOM 123 CG GLU A 9 -0.624 19.965 4.934 1.00 0.00 C ATOM 124 CD GLU A 9 -1.707 20.948 5.401 1.00 0.00 C ATOM 125 OE1 GLU A 9 -2.904 20.671 5.166 1.00 0.00 O ATOM 126 OE2 GLU A 9 -1.300 22.006 5.939 1.00 0.00 O ATOM 0 H GLU A 9 0.249 17.271 6.794 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.486 18.361 6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.277 17.922 4.365 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.902 18.489 4.035 1.00 0.00 H new ATOM 0 HG2 GLU A 9 0.199 19.986 5.649 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.226 20.311 3.980 1.00 0.00 H new ATOM 133 N GLU A 10 -3.077 16.049 5.219 1.00 0.00 N ATOM 134 CA GLU A 10 -3.420 14.683 4.840 1.00 0.00 C ATOM 135 C GLU A 10 -2.679 14.252 3.560 1.00 0.00 C ATOM 136 O GLU A 10 -2.084 15.060 2.844 1.00 0.00 O ATOM 137 CB GLU A 10 -4.918 14.541 4.548 1.00 0.00 C ATOM 138 CG GLU A 10 -5.948 14.842 5.638 1.00 0.00 C ATOM 139 CD GLU A 10 -7.173 13.944 5.398 1.00 0.00 C ATOM 140 OE1 GLU A 10 -7.898 14.147 4.394 1.00 0.00 O ATOM 141 OE2 GLU A 10 -7.304 12.954 6.152 1.00 0.00 O ATOM 0 H GLU A 10 -3.804 16.736 5.020 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.130 14.057 5.684 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.145 15.189 3.702 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.087 13.516 4.218 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.525 14.653 6.624 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.235 15.893 5.611 1.00 0.00 H new ATOM 148 N SER A 11 -2.776 12.959 3.240 1.00 0.00 N ATOM 149 CA SER A 11 -2.314 12.250 2.047 1.00 0.00 C ATOM 150 C SER A 11 -2.802 10.790 2.174 1.00 0.00 C ATOM 151 O SER A 11 -3.399 10.443 3.191 1.00 0.00 O ATOM 152 CB SER A 11 -0.791 12.383 1.902 1.00 0.00 C ATOM 153 OG SER A 11 -0.449 13.633 1.343 1.00 0.00 O ATOM 0 H SER A 11 -3.232 12.313 3.884 1.00 0.00 H new ATOM 0 HA SER A 11 -2.724 12.676 1.131 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.317 12.274 2.878 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.410 11.580 1.271 1.00 0.00 H new ATOM 0 HG SER A 11 -0.804 14.352 1.907 1.00 0.00 H new ATOM 159 N LEU A 12 -2.582 9.944 1.160 1.00 0.00 N ATOM 160 CA LEU A 12 -3.071 8.555 1.063 1.00 0.00 C ATOM 161 C LEU A 12 -2.847 7.754 2.354 1.00 0.00 C ATOM 162 O LEU A 12 -1.740 7.781 2.902 1.00 0.00 O ATOM 163 CB LEU A 12 -2.349 7.893 -0.127 1.00 0.00 C ATOM 164 CG LEU A 12 -2.837 6.498 -0.587 1.00 0.00 C ATOM 165 CD1 LEU A 12 -2.116 6.177 -1.889 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.525 5.357 0.377 1.00 0.00 C ATOM 0 H LEU A 12 -2.033 10.218 0.345 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.150 8.566 0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.420 8.569 -0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.292 7.810 0.127 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.922 6.561 -0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.433 5.198 -2.249 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.358 6.934 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.040 6.169 -1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.906 4.421 -0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.446 5.281 0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.000 5.553 1.338 1.00 0.00 H new ATOM 178 N TYR A 13 -3.851 6.977 2.775 1.00 0.00 N ATOM 179 CA TYR A 13 -3.797 6.076 3.923 1.00 0.00 C ATOM 180 C TYR A 13 -4.109 4.635 3.484 1.00 0.00 C ATOM 181 O TYR A 13 -5.045 4.432 2.713 1.00 0.00 O ATOM 182 CB TYR A 13 -4.831 6.515 4.958 1.00 0.00 C ATOM 183 CG TYR A 13 -4.795 7.966 5.386 1.00 0.00 C ATOM 184 CD1 TYR A 13 -3.916 8.380 6.405 1.00 0.00 C ATOM 185 CD2 TYR A 13 -5.702 8.883 4.818 1.00 0.00 C ATOM 186 CE1 TYR A 13 -3.967 9.698 6.890 1.00 0.00 C ATOM 187 CE2 TYR A 13 -5.777 10.191 5.319 1.00 0.00 C ATOM 188 CZ TYR A 13 -4.919 10.602 6.363 1.00 0.00 C ATOM 189 OH TYR A 13 -5.022 11.857 6.875 1.00 0.00 O ATOM 0 H TYR A 13 -4.756 6.961 2.305 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.796 6.111 4.353 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.823 6.303 4.558 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.707 5.896 5.846 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.200 7.683 6.815 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -6.338 8.579 3.999 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.283 10.019 7.661 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -6.493 10.886 4.905 1.00 0.00 H new ATOM 0 HH TYR A 13 -5.954 12.156 6.822 1.00 0.00 H new ATOM 199 N LEU A 14 -3.373 3.627 3.965 1.00 0.00 N ATOM 200 CA LEU A 14 -3.539 2.208 3.622 1.00 0.00 C ATOM 201 C LEU A 14 -3.086 1.379 4.827 1.00 0.00 C ATOM 202 O LEU A 14 -1.922 1.491 5.222 1.00 0.00 O ATOM 203 CB LEU A 14 -2.666 1.881 2.389 1.00 0.00 C ATOM 204 CG LEU A 14 -2.931 0.582 1.609 1.00 0.00 C ATOM 205 CD1 LEU A 14 -1.673 0.156 0.848 1.00 0.00 C ATOM 206 CD2 LEU A 14 -3.460 -0.620 2.390 1.00 0.00 C ATOM 0 H LEU A 14 -2.615 3.782 4.630 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.578 1.981 3.384 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.763 2.711 1.689 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.627 1.861 2.718 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.752 0.861 0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.874 -0.765 0.300 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.388 0.941 0.147 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.860 -0.012 1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.599 -1.462 1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.745 -0.893 3.166 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.414 -0.363 2.850 1.00 0.00 H new ATOM 218 N TRP A 15 -3.954 0.569 5.434 1.00 0.00 N ATOM 219 CA TRP A 15 -3.624 -0.231 6.608 1.00 0.00 C ATOM 220 C TRP A 15 -4.327 -1.585 6.518 1.00 0.00 C ATOM 221 O TRP A 15 -5.385 -1.690 5.906 1.00 0.00 O ATOM 222 CB TRP A 15 -4.012 0.612 7.833 1.00 0.00 C ATOM 223 CG TRP A 15 -5.464 0.857 8.094 1.00 0.00 C ATOM 224 CD1 TRP A 15 -6.262 0.160 8.936 1.00 0.00 C ATOM 225 CD2 TRP A 15 -6.278 1.940 7.557 1.00 0.00 C ATOM 226 NE1 TRP A 15 -7.523 0.740 8.934 1.00 0.00 N ATOM 227 CE2 TRP A 15 -7.585 1.856 8.113 1.00 0.00 C ATOM 228 CE3 TRP A 15 -6.021 3.006 6.671 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -8.591 2.795 7.797 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -7.030 3.918 6.315 1.00 0.00 C ATOM 231 CH2 TRP A 15 -8.312 3.834 6.884 1.00 0.00 C ATOM 0 H TRP A 15 -4.917 0.450 5.118 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.563 -0.470 6.683 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -3.593 0.129 8.715 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.523 1.582 7.738 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -5.967 -0.704 9.513 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.313 0.386 9.474 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.030 3.124 6.258 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -9.568 2.718 8.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.817 4.694 5.594 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -9.074 4.555 6.626 1.00 0.00 H new ATOM 242 N ILE A 16 -3.730 -2.648 7.052 1.00 0.00 N ATOM 243 CA ILE A 16 -4.382 -3.950 7.132 1.00 0.00 C ATOM 244 C ILE A 16 -5.208 -3.839 8.409 1.00 0.00 C ATOM 245 O ILE A 16 -4.651 -3.554 9.471 1.00 0.00 O ATOM 246 CB ILE A 16 -3.391 -5.133 7.063 1.00 0.00 C ATOM 247 CG1 ILE A 16 -2.311 -4.969 5.961 1.00 0.00 C ATOM 248 CG2 ILE A 16 -4.184 -6.400 6.706 1.00 0.00 C ATOM 249 CD1 ILE A 16 -0.928 -4.616 6.505 1.00 0.00 C ATOM 0 H ILE A 16 -2.786 -2.630 7.439 1.00 0.00 H new ATOM 0 HA ILE A 16 -5.016 -4.182 6.276 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.893 -5.184 8.031 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -2.242 -5.896 5.391 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -2.628 -4.191 5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.505 -7.251 6.651 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.937 -6.586 7.472 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -4.673 -6.263 5.742 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -0.226 -4.518 5.677 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -0.981 -3.674 7.050 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -0.589 -5.405 7.177 1.00 0.00 H new ATOM 261 N ASP A 17 -6.532 -3.954 8.294 1.00 0.00 N ATOM 262 CA ASP A 17 -7.416 -3.717 9.426 1.00 0.00 C ATOM 263 C ASP A 17 -7.597 -4.922 10.345 1.00 0.00 C ATOM 264 O ASP A 17 -7.670 -6.087 9.941 1.00 0.00 O ATOM 265 CB ASP A 17 -8.761 -3.122 8.987 1.00 0.00 C ATOM 266 CG ASP A 17 -9.761 -4.151 8.461 1.00 0.00 C ATOM 267 OD1 ASP A 17 -10.494 -4.727 9.302 1.00 0.00 O ATOM 268 OD2 ASP A 17 -9.868 -4.264 7.221 1.00 0.00 O ATOM 0 H ASP A 17 -7.010 -4.209 7.430 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.904 -2.972 10.035 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -9.207 -2.598 9.833 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -8.580 -2.378 8.211 1.00 0.00 H new ATOM 273 N ALA A 18 -7.699 -4.581 11.628 1.00 0.00 N ATOM 274 CA ALA A 18 -7.751 -5.499 12.746 1.00 0.00 C ATOM 275 C ALA A 18 -9.078 -6.249 12.862 1.00 0.00 C ATOM 276 O ALA A 18 -9.112 -7.373 13.373 1.00 0.00 O ATOM 277 CB ALA A 18 -7.555 -4.652 14.009 1.00 0.00 C ATOM 0 H ALA A 18 -7.750 -3.606 11.923 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.982 -6.259 12.607 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -7.585 -5.296 14.888 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.590 -4.147 13.962 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.350 -3.909 14.076 1.00 0.00 H new ATOM 283 N HIS A 19 -10.168 -5.670 12.353 1.00 0.00 N ATOM 284 CA HIS A 19 -11.501 -6.214 12.522 1.00 0.00 C ATOM 285 C HIS A 19 -11.605 -7.586 11.867 1.00 0.00 C ATOM 286 O HIS A 19 -12.281 -8.475 12.401 1.00 0.00 O ATOM 287 CB HIS A 19 -12.528 -5.266 11.896 1.00 0.00 C ATOM 288 CG HIS A 19 -12.256 -3.800 12.100 1.00 0.00 C ATOM 289 ND1 HIS A 19 -11.709 -2.992 11.135 1.00 0.00 N ATOM 290 CD2 HIS A 19 -12.450 -3.047 13.226 1.00 0.00 C ATOM 291 CE1 HIS A 19 -11.599 -1.758 11.653 1.00 0.00 C ATOM 292 NE2 HIS A 19 -12.048 -1.742 12.920 1.00 0.00 N ATOM 0 H HIS A 19 -10.142 -4.807 11.811 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.703 -6.319 13.588 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -12.576 -5.464 10.825 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -13.510 -5.497 12.308 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -11.436 -3.277 10.195 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -12.840 -3.394 14.172 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -11.206 -0.901 11.127 1.00 0.00 H new ATOM 300 N GLN A 20 -10.957 -7.742 10.708 1.00 0.00 N ATOM 301 CA GLN A 20 -10.855 -9.011 10.018 1.00 0.00 C ATOM 302 C GLN A 20 -9.918 -9.943 10.771 1.00 0.00 C ATOM 303 O GLN A 20 -10.294 -11.093 10.988 1.00 0.00 O ATOM 304 CB GLN A 20 -10.384 -8.785 8.579 1.00 0.00 C ATOM 305 CG GLN A 20 -10.309 -10.075 7.743 1.00 0.00 C ATOM 306 CD GLN A 20 -11.646 -10.810 7.647 1.00 0.00 C ATOM 307 OE1 GLN A 20 -12.478 -10.533 6.791 1.00 0.00 O ATOM 308 NE2 GLN A 20 -11.893 -11.756 8.539 1.00 0.00 N ATOM 0 H GLN A 20 -10.487 -6.976 10.226 1.00 0.00 H new ATOM 0 HA GLN A 20 -11.836 -9.484 9.982 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -11.061 -8.085 8.090 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -9.400 -8.317 8.597 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -9.964 -9.830 6.739 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -9.566 -10.741 8.181 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -11.196 -11.982 9.249 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -12.780 -12.259 8.516 1.00 0.00 H new ATOM 317 N ALA A 21 -8.719 -9.481 11.145 1.00 0.00 N ATOM 318 CA ALA A 21 -7.737 -10.284 11.867 1.00 0.00 C ATOM 319 C ALA A 21 -8.362 -10.954 13.090 1.00 0.00 C ATOM 320 O ALA A 21 -8.167 -12.152 13.262 1.00 0.00 O ATOM 321 CB ALA A 21 -6.502 -9.457 12.232 1.00 0.00 C ATOM 0 H ALA A 21 -8.405 -8.530 10.951 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.401 -11.080 11.203 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -5.790 -10.084 12.769 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.037 -9.077 11.322 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.798 -8.621 12.865 1.00 0.00 H new ATOM 327 N ARG A 22 -9.190 -10.260 13.877 1.00 0.00 N ATOM 328 CA ARG A 22 -9.920 -10.883 14.972 1.00 0.00 C ATOM 329 C ARG A 22 -10.624 -12.123 14.438 1.00 0.00 C ATOM 330 O ARG A 22 -10.253 -13.236 14.790 1.00 0.00 O ATOM 331 CB ARG A 22 -10.880 -9.863 15.597 1.00 0.00 C ATOM 332 CG ARG A 22 -11.791 -10.476 16.682 1.00 0.00 C ATOM 333 CD ARG A 22 -12.868 -9.498 17.172 1.00 0.00 C ATOM 334 NE ARG A 22 -13.620 -8.920 16.040 1.00 0.00 N ATOM 335 CZ ARG A 22 -13.695 -7.615 15.742 1.00 0.00 C ATOM 336 NH1 ARG A 22 -13.438 -6.683 16.641 1.00 0.00 N ATOM 337 NH2 ARG A 22 -14.033 -7.243 14.512 1.00 0.00 N ATOM 0 H ARG A 22 -9.368 -9.261 13.770 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.248 -11.202 15.768 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.302 -9.049 16.034 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.500 -9.429 14.813 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -12.271 -11.370 16.285 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.180 -10.791 17.528 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.555 -10.015 17.842 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.402 -8.699 17.748 1.00 0.00 H new ATOM 0 HE ARG A 22 -14.124 -9.568 15.434 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.175 -6.949 17.590 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.503 -5.697 16.387 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -14.233 -7.948 13.803 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -14.092 -6.252 14.277 1.00 0.00 H new ATOM 351 N VAL A 23 -11.581 -11.953 13.530 1.00 0.00 N ATOM 352 CA VAL A 23 -12.368 -13.030 12.941 1.00 0.00 C ATOM 353 C VAL A 23 -11.470 -14.155 12.388 1.00 0.00 C ATOM 354 O VAL A 23 -11.923 -15.291 12.279 1.00 0.00 O ATOM 355 CB VAL A 23 -13.341 -12.431 11.898 1.00 0.00 C ATOM 356 CG1 VAL A 23 -14.244 -13.475 11.222 1.00 0.00 C ATOM 357 CG2 VAL A 23 -14.262 -11.379 12.546 1.00 0.00 C ATOM 0 H VAL A 23 -11.837 -11.032 13.173 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.971 -13.514 13.709 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.697 -11.986 11.139 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -14.898 -12.980 10.504 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -13.627 -14.209 10.704 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -14.848 -13.977 11.977 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -14.937 -10.973 11.793 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -14.844 -11.845 13.341 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.657 -10.574 12.964 1.00 0.00 H new ATOM 367 N LEU A 24 -10.210 -13.862 12.054 1.00 0.00 N ATOM 368 CA LEU A 24 -9.255 -14.813 11.547 1.00 0.00 C ATOM 369 C LEU A 24 -8.505 -15.599 12.623 1.00 0.00 C ATOM 370 O LEU A 24 -8.221 -16.776 12.404 1.00 0.00 O ATOM 371 CB LEU A 24 -8.209 -14.065 10.722 1.00 0.00 C ATOM 372 CG LEU A 24 -8.715 -13.559 9.363 1.00 0.00 C ATOM 373 CD1 LEU A 24 -7.652 -12.687 8.684 1.00 0.00 C ATOM 374 CD2 LEU A 24 -9.192 -14.635 8.395 1.00 0.00 C ATOM 0 H LEU A 24 -9.828 -12.920 12.137 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.833 -15.531 10.965 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.848 -13.215 11.301 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -7.356 -14.723 10.556 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.603 -12.975 9.605 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.028 -12.338 7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.425 -11.830 9.318 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.746 -13.273 8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.527 -14.168 7.469 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.372 -15.320 8.180 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.018 -15.187 8.843 1.00 0.00 H new ATOM 386 N ILE A 25 -8.157 -14.960 13.746 1.00 0.00 N ATOM 387 CA ILE A 25 -7.301 -15.567 14.793 1.00 0.00 C ATOM 388 C ILE A 25 -7.634 -15.221 16.255 1.00 0.00 C ATOM 389 O ILE A 25 -6.859 -15.478 17.173 1.00 0.00 O ATOM 390 CB ILE A 25 -5.808 -15.304 14.475 1.00 0.00 C ATOM 391 CG1 ILE A 25 -5.516 -13.798 14.326 1.00 0.00 C ATOM 392 CG2 ILE A 25 -5.316 -16.068 13.230 1.00 0.00 C ATOM 393 CD1 ILE A 25 -4.038 -13.498 14.571 1.00 0.00 C ATOM 0 H ILE A 25 -8.456 -14.009 13.962 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.526 -16.632 14.742 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.251 -15.685 15.331 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.797 -13.467 13.326 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.127 -13.234 15.031 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -4.263 -15.844 13.058 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -5.437 -17.139 13.389 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.899 -15.762 12.361 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.860 -12.428 14.459 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.766 -13.808 15.580 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.431 -14.044 13.848 1.00 0.00 H new ATOM 405 N GLY A 26 -8.807 -14.657 16.469 1.00 0.00 N ATOM 406 CA GLY A 26 -9.371 -14.106 17.705 1.00 0.00 C ATOM 407 C GLY A 26 -8.585 -12.948 18.332 1.00 0.00 C ATOM 408 O GLY A 26 -8.973 -12.435 19.377 1.00 0.00 O ATOM 0 H GLY A 26 -9.469 -14.559 15.699 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.385 -13.764 17.500 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.447 -14.909 18.438 1.00 0.00 H new ATOM 412 N PHE A 27 -7.467 -12.588 17.721 1.00 0.00 N ATOM 413 CA PHE A 27 -6.493 -11.578 18.106 1.00 0.00 C ATOM 414 C PHE A 27 -6.732 -10.337 17.245 1.00 0.00 C ATOM 415 O PHE A 27 -7.000 -10.499 16.055 1.00 0.00 O ATOM 416 CB PHE A 27 -5.128 -12.248 17.929 1.00 0.00 C ATOM 417 CG PHE A 27 -3.906 -11.380 18.063 1.00 0.00 C ATOM 418 CD1 PHE A 27 -3.549 -10.522 17.007 1.00 0.00 C ATOM 419 CD2 PHE A 27 -3.073 -11.502 19.191 1.00 0.00 C ATOM 420 CE1 PHE A 27 -2.358 -9.791 17.079 1.00 0.00 C ATOM 421 CE2 PHE A 27 -1.871 -10.778 19.254 1.00 0.00 C ATOM 422 CZ PHE A 27 -1.512 -9.935 18.190 1.00 0.00 C ATOM 0 H PHE A 27 -7.191 -13.044 16.852 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.565 -11.228 19.136 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.051 -13.053 18.660 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -5.106 -12.711 16.942 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -4.192 -10.428 16.144 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -3.357 -12.151 20.006 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -2.090 -9.116 16.280 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.227 -10.869 20.116 1.00 0.00 H new ATOM 0 HZ PHE A 27 -0.578 -9.393 18.227 1.00 0.00 H new ATOM 432 N GLU A 28 -6.580 -9.123 17.778 1.00 0.00 N ATOM 433 CA GLU A 28 -6.922 -7.894 17.066 1.00 0.00 C ATOM 434 C GLU A 28 -5.796 -6.858 17.183 1.00 0.00 C ATOM 435 O GLU A 28 -5.497 -6.400 18.283 1.00 0.00 O ATOM 436 CB GLU A 28 -8.279 -7.407 17.624 1.00 0.00 C ATOM 437 CG GLU A 28 -8.934 -6.321 16.756 1.00 0.00 C ATOM 438 CD GLU A 28 -10.455 -6.180 16.924 1.00 0.00 C ATOM 439 OE1 GLU A 28 -11.046 -6.750 17.872 1.00 0.00 O ATOM 440 OE2 GLU A 28 -11.102 -5.568 16.037 1.00 0.00 O ATOM 0 H GLU A 28 -6.215 -8.966 18.718 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.026 -8.067 15.995 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.957 -8.256 17.706 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.132 -7.018 18.632 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.468 -5.363 16.988 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.718 -6.535 15.709 1.00 0.00 H new ATOM 447 N GLU A 29 -5.159 -6.528 16.055 1.00 0.00 N ATOM 448 CA GLU A 29 -4.146 -5.491 15.852 1.00 0.00 C ATOM 449 C GLU A 29 -4.289 -5.025 14.396 1.00 0.00 C ATOM 450 O GLU A 29 -4.640 -5.843 13.539 1.00 0.00 O ATOM 451 CB GLU A 29 -2.716 -6.051 15.957 1.00 0.00 C ATOM 452 CG GLU A 29 -2.108 -6.269 17.352 1.00 0.00 C ATOM 453 CD GLU A 29 -0.671 -6.817 17.238 1.00 0.00 C ATOM 454 OE1 GLU A 29 -0.269 -7.278 16.147 1.00 0.00 O ATOM 455 OE2 GLU A 29 0.073 -6.921 18.238 1.00 0.00 O ATOM 0 H GLU A 29 -5.357 -7.024 15.186 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.291 -4.713 16.602 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.697 -7.008 15.435 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.056 -5.377 15.411 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.102 -5.329 17.903 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.725 -6.966 17.919 1.00 0.00 H new ATOM 462 N ASP A 30 -4.070 -3.737 14.118 1.00 0.00 N ATOM 463 CA ASP A 30 -4.029 -3.185 12.760 1.00 0.00 C ATOM 464 C ASP A 30 -2.543 -3.148 12.375 1.00 0.00 C ATOM 465 O ASP A 30 -1.663 -3.287 13.232 1.00 0.00 O ATOM 466 CB ASP A 30 -4.627 -1.770 12.674 1.00 0.00 C ATOM 467 CG ASP A 30 -3.656 -0.666 13.108 1.00 0.00 C ATOM 468 OD1 ASP A 30 -3.604 -0.399 14.328 1.00 0.00 O ATOM 469 OD2 ASP A 30 -3.003 -0.092 12.205 1.00 0.00 O ATOM 0 H ASP A 30 -3.913 -3.036 14.842 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.627 -3.801 12.088 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.945 -1.581 11.649 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.520 -1.723 13.298 1.00 0.00 H new ATOM 474 N ILE A 31 -2.243 -2.981 11.090 1.00 0.00 N ATOM 475 CA ILE A 31 -0.873 -2.793 10.630 1.00 0.00 C ATOM 476 C ILE A 31 -0.977 -1.645 9.633 1.00 0.00 C ATOM 477 O ILE A 31 -1.538 -1.819 8.550 1.00 0.00 O ATOM 478 CB ILE A 31 -0.298 -4.099 10.028 1.00 0.00 C ATOM 479 CG1 ILE A 31 -0.220 -5.292 11.015 1.00 0.00 C ATOM 480 CG2 ILE A 31 1.114 -3.849 9.459 1.00 0.00 C ATOM 481 CD1 ILE A 31 -1.462 -6.195 10.997 1.00 0.00 C ATOM 0 H ILE A 31 -2.938 -2.972 10.344 1.00 0.00 H new ATOM 0 HA ILE A 31 -0.173 -2.552 11.430 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.005 -4.379 9.247 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.658 -5.893 10.776 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.077 -4.907 12.025 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.506 -4.775 9.039 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.063 -3.090 8.679 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.772 -3.505 10.257 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -1.332 -7.006 11.713 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -2.341 -5.610 11.267 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.595 -6.611 9.998 1.00 0.00 H new ATOM 493 N LEU A 32 -0.391 -0.487 9.939 1.00 0.00 N ATOM 494 CA LEU A 32 -0.579 0.681 9.091 1.00 0.00 C ATOM 495 C LEU A 32 0.596 0.734 8.107 1.00 0.00 C ATOM 496 O LEU A 32 1.748 0.881 8.514 1.00 0.00 O ATOM 497 CB LEU A 32 -0.780 1.911 9.990 1.00 0.00 C ATOM 498 CG LEU A 32 -1.508 3.039 9.245 1.00 0.00 C ATOM 499 CD1 LEU A 32 -1.929 4.163 10.173 1.00 0.00 C ATOM 500 CD2 LEU A 32 -0.812 3.593 8.012 1.00 0.00 C ATOM 0 H LEU A 32 0.206 -0.337 10.752 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.476 0.643 8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.353 1.628 10.873 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.188 2.270 10.339 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.395 2.537 8.858 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.440 4.936 9.599 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.603 3.772 10.935 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.047 4.589 10.652 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.422 4.382 7.574 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.159 4.000 8.294 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.673 2.795 7.283 1.00 0.00 H new ATOM 512 N ILE A 33 0.317 0.555 6.810 1.00 0.00 N ATOM 513 CA ILE A 33 1.325 0.463 5.754 1.00 0.00 C ATOM 514 C ILE A 33 1.706 1.883 5.329 1.00 0.00 C ATOM 515 O ILE A 33 2.865 2.298 5.425 1.00 0.00 O ATOM 516 CB ILE A 33 0.796 -0.328 4.531 1.00 0.00 C ATOM 517 CG1 ILE A 33 0.227 -1.697 4.948 1.00 0.00 C ATOM 518 CG2 ILE A 33 1.906 -0.502 3.473 1.00 0.00 C ATOM 519 CD1 ILE A 33 -0.133 -2.558 3.737 1.00 0.00 C ATOM 0 H ILE A 33 -0.638 0.469 6.461 1.00 0.00 H new ATOM 0 HA ILE A 33 2.194 -0.071 6.138 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.017 0.250 4.091 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.958 -2.222 5.562 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.660 -1.549 5.565 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.514 -1.060 2.623 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.246 0.478 3.138 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.743 -1.047 3.910 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.531 -3.515 4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.884 -2.045 3.136 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.759 -2.729 3.134 1.00 0.00 H new ATOM 531 N VAL A 34 0.718 2.617 4.819 1.00 0.00 N ATOM 532 CA VAL A 34 0.880 3.930 4.235 1.00 0.00 C ATOM 533 C VAL A 34 0.087 4.886 5.089 1.00 0.00 C ATOM 534 O VAL A 34 -1.132 4.797 5.157 1.00 0.00 O ATOM 535 CB VAL A 34 0.408 3.939 2.764 1.00 0.00 C ATOM 536 CG1 VAL A 34 0.715 5.266 2.054 1.00 0.00 C ATOM 537 CG2 VAL A 34 1.052 2.777 2.001 1.00 0.00 C ATOM 0 H VAL A 34 -0.249 2.294 4.805 1.00 0.00 H new ATOM 0 HA VAL A 34 1.928 4.228 4.215 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.676 3.822 2.773 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.362 5.218 1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.210 6.081 2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.791 5.442 2.061 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.714 2.790 0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.137 2.879 2.030 1.00 0.00 H new ATOM 0 HG23 VAL A 34 0.764 1.833 2.464 1.00 0.00 H new ATOM 547 N SER A 35 0.786 5.783 5.758 1.00 0.00 N ATOM 548 CA SER A 35 0.200 6.862 6.513 1.00 0.00 C ATOM 549 C SER A 35 0.607 8.080 5.718 1.00 0.00 C ATOM 550 O SER A 35 1.809 8.223 5.470 1.00 0.00 O ATOM 551 CB SER A 35 0.777 6.893 7.938 1.00 0.00 C ATOM 552 OG SER A 35 2.190 6.734 7.922 1.00 0.00 O ATOM 0 H SER A 35 1.806 5.777 5.789 1.00 0.00 H new ATOM 0 HA SER A 35 -0.880 6.782 6.640 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.520 7.838 8.417 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.325 6.100 8.534 1.00 0.00 H new ATOM 0 HG SER A 35 2.553 7.118 7.097 1.00 0.00 H new ATOM 558 N GLU A 36 -0.350 8.921 5.322 1.00 0.00 N ATOM 559 CA GLU A 36 -0.122 10.201 4.657 1.00 0.00 C ATOM 560 C GLU A 36 0.915 10.098 3.514 1.00 0.00 C ATOM 561 O GLU A 36 1.740 10.992 3.336 1.00 0.00 O ATOM 562 CB GLU A 36 0.144 11.310 5.717 1.00 0.00 C ATOM 563 CG GLU A 36 1.269 10.933 6.695 1.00 0.00 C ATOM 564 CD GLU A 36 1.770 12.024 7.626 1.00 0.00 C ATOM 565 OE1 GLU A 36 2.807 12.644 7.293 1.00 0.00 O ATOM 566 OE2 GLU A 36 1.384 12.032 8.812 1.00 0.00 O ATOM 0 H GLU A 36 -1.340 8.720 5.462 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.027 10.506 4.132 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.405 12.238 5.209 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -0.772 11.500 6.277 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.921 10.100 7.306 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.116 10.570 6.113 1.00 0.00 H new ATOM 573 N GLY A 37 0.896 8.992 2.750 1.00 0.00 N ATOM 574 CA GLY A 37 1.819 8.721 1.628 1.00 0.00 C ATOM 575 C GLY A 37 3.307 8.800 2.014 1.00 0.00 C ATOM 576 O GLY A 37 4.188 8.899 1.167 1.00 0.00 O ATOM 0 H GLY A 37 0.222 8.241 2.898 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.609 7.729 1.229 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.623 9.435 0.828 1.00 0.00 H new ATOM 580 N LYS A 38 3.588 8.687 3.306 1.00 0.00 N ATOM 581 CA LYS A 38 4.833 8.843 4.048 1.00 0.00 C ATOM 582 C LYS A 38 5.100 7.536 4.810 1.00 0.00 C ATOM 583 O LYS A 38 5.454 7.579 5.988 1.00 0.00 O ATOM 584 CB LYS A 38 4.709 10.135 4.868 1.00 0.00 C ATOM 585 CG LYS A 38 6.054 10.743 5.283 1.00 0.00 C ATOM 586 CD LYS A 38 5.873 12.163 5.847 1.00 0.00 C ATOM 587 CE LYS A 38 5.276 13.154 4.819 1.00 0.00 C ATOM 588 NZ LYS A 38 4.088 13.877 5.331 1.00 0.00 N ATOM 0 H LYS A 38 2.835 8.448 3.951 1.00 0.00 H new ATOM 0 HA LYS A 38 5.725 8.979 3.437 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.154 10.871 4.286 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.123 9.930 5.764 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.527 10.109 6.033 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.723 10.773 4.423 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.223 12.120 6.721 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.838 12.538 6.186 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.040 13.878 4.535 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.001 12.610 3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.634 14.394 4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.414 13.195 5.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.382 14.549 6.068 1.00 0.00 H new ATOM 602 N MET A 39 4.778 6.410 4.156 1.00 0.00 N ATOM 603 CA MET A 39 4.753 5.017 4.606 1.00 0.00 C ATOM 604 C MET A 39 5.870 4.611 5.571 1.00 0.00 C ATOM 605 O MET A 39 7.012 5.071 5.509 1.00 0.00 O ATOM 606 CB MET A 39 5.063 4.105 3.386 1.00 0.00 C ATOM 607 CG MET A 39 4.481 4.455 2.015 1.00 0.00 C ATOM 608 SD MET A 39 5.167 3.449 0.670 1.00 0.00 S ATOM 609 CE MET A 39 4.257 1.893 0.849 1.00 0.00 C ATOM 0 H MET A 39 4.494 6.466 3.178 1.00 0.00 H new ATOM 0 HA MET A 39 3.778 4.914 5.082 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.147 4.061 3.279 1.00 0.00 H new ATOM 0 HB3 MET A 39 4.726 3.099 3.636 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.399 4.324 2.043 1.00 0.00 H new ATOM 0 HG3 MET A 39 4.670 5.508 1.805 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.859 1.072 0.459 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.042 1.716 1.903 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.321 1.953 0.293 1.00 0.00 H new ATOM 619 N ALA A 40 5.486 3.696 6.462 1.00 0.00 N ATOM 620 CA ALA A 40 6.350 3.029 7.419 1.00 0.00 C ATOM 621 C ALA A 40 7.201 1.981 6.690 1.00 0.00 C ATOM 622 O ALA A 40 6.828 1.522 5.610 1.00 0.00 O ATOM 623 CB ALA A 40 5.440 2.361 8.464 1.00 0.00 C ATOM 0 H ALA A 40 4.516 3.390 6.534 1.00 0.00 H new ATOM 0 HA ALA A 40 7.026 3.732 7.906 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.053 1.847 9.204 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.835 3.121 8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.787 1.641 7.971 1.00 0.00 H new ATOM 629 N PRO A 41 8.305 1.512 7.295 1.00 0.00 N ATOM 630 CA PRO A 41 9.143 0.431 6.772 1.00 0.00 C ATOM 631 C PRO A 41 8.486 -0.952 6.984 1.00 0.00 C ATOM 632 O PRO A 41 9.155 -1.924 7.347 1.00 0.00 O ATOM 633 CB PRO A 41 10.483 0.616 7.499 1.00 0.00 C ATOM 634 CG PRO A 41 10.076 1.201 8.851 1.00 0.00 C ATOM 635 CD PRO A 41 8.872 2.062 8.515 1.00 0.00 C ATOM 0 HA PRO A 41 9.282 0.471 5.692 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.012 -0.330 7.614 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.146 1.288 6.954 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.823 0.419 9.567 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.880 1.790 9.292 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.143 2.044 9.325 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.165 3.102 8.373 1.00 0.00 H new ATOM 643 N PHE A 42 7.173 -1.053 6.742 1.00 0.00 N ATOM 644 CA PHE A 42 6.327 -2.221 6.988 1.00 0.00 C ATOM 645 C PHE A 42 6.858 -3.499 6.333 1.00 0.00 C ATOM 646 O PHE A 42 6.630 -4.610 6.812 1.00 0.00 O ATOM 647 CB PHE A 42 4.938 -1.927 6.378 1.00 0.00 C ATOM 648 CG PHE A 42 4.877 -2.107 4.859 1.00 0.00 C ATOM 649 CD1 PHE A 42 5.294 -1.089 3.978 1.00 0.00 C ATOM 650 CD2 PHE A 42 4.489 -3.350 4.321 1.00 0.00 C ATOM 651 CE1 PHE A 42 5.316 -1.316 2.590 1.00 0.00 C ATOM 652 CE2 PHE A 42 4.512 -3.580 2.934 1.00 0.00 C ATOM 653 CZ PHE A 42 4.930 -2.560 2.064 1.00 0.00 C ATOM 0 H PHE A 42 6.645 -0.275 6.346 1.00 0.00 H new ATOM 0 HA PHE A 42 6.299 -2.388 8.065 1.00 0.00 H new ATOM 0 HB2 PHE A 42 4.202 -2.584 6.842 1.00 0.00 H new ATOM 0 HB3 PHE A 42 4.653 -0.904 6.625 1.00 0.00 H new ATOM 0 HD1 PHE A 42 5.598 -0.130 4.371 1.00 0.00 H new ATOM 0 HD2 PHE A 42 4.169 -4.139 4.985 1.00 0.00 H new ATOM 0 HE1 PHE A 42 5.632 -0.527 1.923 1.00 0.00 H new ATOM 0 HE2 PHE A 42 4.209 -4.538 2.539 1.00 0.00 H new ATOM 0 HZ PHE A 42 4.955 -2.731 0.998 1.00 0.00 H new ATOM 663 N THR A 43 7.611 -3.325 5.250 1.00 0.00 N ATOM 664 CA THR A 43 8.117 -4.360 4.381 1.00 0.00 C ATOM 665 C THR A 43 8.977 -5.363 5.149 1.00 0.00 C ATOM 666 O THR A 43 9.012 -6.531 4.761 1.00 0.00 O ATOM 667 CB THR A 43 8.910 -3.660 3.266 1.00 0.00 C ATOM 668 OG1 THR A 43 8.261 -2.464 2.870 1.00 0.00 O ATOM 669 CG2 THR A 43 9.067 -4.541 2.026 1.00 0.00 C ATOM 0 H THR A 43 7.897 -2.395 4.945 1.00 0.00 H new ATOM 0 HA THR A 43 7.299 -4.940 3.955 1.00 0.00 H new ATOM 0 HB THR A 43 9.896 -3.448 3.679 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.294 -2.615 2.827 1.00 0.00 H new ATOM 0 HG21 THR A 43 9.634 -4.003 1.267 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.596 -5.455 2.294 1.00 0.00 H new ATOM 0 HG23 THR A 43 8.083 -4.794 1.632 1.00 0.00 H new ATOM 677 N HIS A 44 9.648 -4.939 6.232 1.00 0.00 N ATOM 678 CA HIS A 44 10.453 -5.857 7.018 1.00 0.00 C ATOM 679 C HIS A 44 9.551 -6.932 7.621 1.00 0.00 C ATOM 680 O HIS A 44 9.645 -8.087 7.218 1.00 0.00 O ATOM 681 CB HIS A 44 11.274 -5.128 8.091 1.00 0.00 C ATOM 682 CG HIS A 44 12.223 -6.077 8.784 1.00 0.00 C ATOM 683 ND1 HIS A 44 13.472 -6.441 8.329 1.00 0.00 N ATOM 684 CD2 HIS A 44 11.963 -6.808 9.914 1.00 0.00 C ATOM 685 CE1 HIS A 44 13.951 -7.375 9.169 1.00 0.00 C ATOM 686 NE2 HIS A 44 13.060 -7.649 10.135 1.00 0.00 N ATOM 0 H HIS A 44 9.643 -3.977 6.571 1.00 0.00 H new ATOM 0 HA HIS A 44 11.179 -6.337 6.361 1.00 0.00 H new ATOM 0 HB2 HIS A 44 11.837 -4.315 7.633 1.00 0.00 H new ATOM 0 HB3 HIS A 44 10.604 -4.679 8.824 1.00 0.00 H new ATOM 0 HD2 HIS A 44 11.073 -6.746 10.523 1.00 0.00 H new ATOM 0 HE1 HIS A 44 14.921 -7.842 9.079 1.00 0.00 H new ATOM 0 HE2 HIS A 44 13.162 -8.335 10.883 1.00 0.00 H new ATOM 694 N ASP A 45 8.648 -6.590 8.539 1.00 0.00 N ATOM 695 CA ASP A 45 7.825 -7.595 9.215 1.00 0.00 C ATOM 696 C ASP A 45 6.824 -8.291 8.309 1.00 0.00 C ATOM 697 O ASP A 45 6.443 -9.420 8.615 1.00 0.00 O ATOM 698 CB ASP A 45 7.205 -7.093 10.522 1.00 0.00 C ATOM 699 CG ASP A 45 8.245 -7.204 11.633 1.00 0.00 C ATOM 700 OD1 ASP A 45 9.076 -6.290 11.763 1.00 0.00 O ATOM 701 OD2 ASP A 45 8.305 -8.296 12.253 1.00 0.00 O ATOM 0 H ASP A 45 8.467 -5.630 8.832 1.00 0.00 H new ATOM 0 HA ASP A 45 8.530 -8.376 9.502 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.879 -6.059 10.412 1.00 0.00 H new ATOM 0 HB3 ASP A 45 6.322 -7.681 10.771 1.00 0.00 H new ATOM 706 N PHE A 46 6.434 -7.655 7.205 1.00 0.00 N ATOM 707 CA PHE A 46 5.580 -8.231 6.174 1.00 0.00 C ATOM 708 C PHE A 46 6.301 -9.359 5.421 1.00 0.00 C ATOM 709 O PHE A 46 5.719 -10.422 5.219 1.00 0.00 O ATOM 710 CB PHE A 46 5.170 -7.089 5.231 1.00 0.00 C ATOM 711 CG PHE A 46 4.021 -7.327 4.265 1.00 0.00 C ATOM 712 CD1 PHE A 46 4.132 -8.247 3.202 1.00 0.00 C ATOM 713 CD2 PHE A 46 2.867 -6.523 4.362 1.00 0.00 C ATOM 714 CE1 PHE A 46 3.113 -8.334 2.238 1.00 0.00 C ATOM 715 CE2 PHE A 46 1.877 -6.573 3.369 1.00 0.00 C ATOM 716 CZ PHE A 46 2.007 -7.471 2.298 1.00 0.00 C ATOM 0 H PHE A 46 6.714 -6.696 7.000 1.00 0.00 H new ATOM 0 HA PHE A 46 4.694 -8.685 6.619 1.00 0.00 H new ATOM 0 HB2 PHE A 46 4.913 -6.226 5.846 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.046 -6.813 4.644 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.000 -8.885 3.129 1.00 0.00 H new ATOM 0 HD2 PHE A 46 2.744 -5.863 5.208 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.181 -9.067 1.448 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.017 -5.922 3.429 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.257 -7.498 1.521 1.00 0.00 H new ATOM 726 N ARG A 47 7.552 -9.145 4.981 1.00 0.00 N ATOM 727 CA ARG A 47 8.282 -10.100 4.136 1.00 0.00 C ATOM 728 C ARG A 47 9.228 -11.047 4.889 1.00 0.00 C ATOM 729 O ARG A 47 9.614 -12.090 4.346 1.00 0.00 O ATOM 730 CB ARG A 47 9.037 -9.295 3.069 1.00 0.00 C ATOM 731 CG ARG A 47 9.568 -10.189 1.941 1.00 0.00 C ATOM 732 CD ARG A 47 11.064 -10.481 2.071 1.00 0.00 C ATOM 733 NE ARG A 47 11.480 -11.380 0.992 1.00 0.00 N ATOM 734 CZ ARG A 47 11.251 -12.698 0.954 1.00 0.00 C ATOM 735 NH1 ARG A 47 10.706 -13.330 1.997 1.00 0.00 N ATOM 736 NH2 ARG A 47 11.566 -13.382 -0.144 1.00 0.00 N ATOM 0 H ARG A 47 8.085 -8.304 5.202 1.00 0.00 H new ATOM 0 HA ARG A 47 7.547 -10.771 3.691 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.374 -8.538 2.650 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.869 -8.767 3.535 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.018 -11.130 1.939 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.378 -9.707 0.982 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.632 -9.552 2.025 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.274 -10.935 3.039 1.00 0.00 H new ATOM 0 HE ARG A 47 11.985 -10.969 0.207 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.458 -12.808 2.837 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.537 -14.335 1.953 1.00 0.00 H new ATOM 0 HH21 ARG A 47 11.977 -12.901 -0.944 1.00 0.00 H new ATOM 0 HH22 ARG A 47 11.396 -14.387 -0.185 1.00 0.00 H new ATOM 750 N LYS A 48 9.722 -10.650 6.065 1.00 0.00 N ATOM 751 CA LYS A 48 10.638 -11.416 6.924 1.00 0.00 C ATOM 752 C LYS A 48 9.914 -12.653 7.458 1.00 0.00 C ATOM 753 O LYS A 48 8.745 -12.870 7.163 1.00 0.00 O ATOM 754 CB LYS A 48 11.158 -10.470 8.031 1.00 0.00 C ATOM 755 CG LYS A 48 12.218 -10.976 9.030 1.00 0.00 C ATOM 756 CD LYS A 48 11.740 -11.339 10.453 1.00 0.00 C ATOM 757 CE LYS A 48 10.928 -10.257 11.188 1.00 0.00 C ATOM 758 NZ LYS A 48 9.464 -10.424 11.034 1.00 0.00 N ATOM 0 H LYS A 48 9.484 -9.743 6.466 1.00 0.00 H new ATOM 0 HA LYS A 48 11.504 -11.785 6.375 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.568 -9.588 7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 48 10.295 -10.140 8.610 1.00 0.00 H new ATOM 0 HG2 LYS A 48 12.692 -11.858 8.599 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.989 -10.211 9.119 1.00 0.00 H new ATOM 0 HD2 LYS A 48 11.133 -12.242 10.392 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.614 -11.583 11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 48 11.181 -10.279 12.248 1.00 0.00 H new ATOM 0 HE3 LYS A 48 11.217 -9.276 10.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 8.992 -9.511 11.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 9.252 -10.761 10.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 9.119 -11.117 11.728 1.00 0.00 H new ATOM 772 N ALA A 49 10.618 -13.510 8.205 1.00 0.00 N ATOM 773 CA ALA A 49 9.994 -14.645 8.879 1.00 0.00 C ATOM 774 C ALA A 49 8.782 -14.156 9.695 1.00 0.00 C ATOM 775 O ALA A 49 8.707 -12.977 10.065 1.00 0.00 O ATOM 776 CB ALA A 49 11.020 -15.367 9.761 1.00 0.00 C ATOM 0 H ALA A 49 11.624 -13.435 8.356 1.00 0.00 H new ATOM 0 HA ALA A 49 9.638 -15.362 8.140 1.00 0.00 H new ATOM 0 HB1 ALA A 49 10.542 -16.211 10.258 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.842 -15.728 9.142 1.00 0.00 H new ATOM 0 HB3 ALA A 49 11.406 -14.676 10.510 1.00 0.00 H new ATOM 782 N GLN A 50 7.895 -15.093 10.035 1.00 0.00 N ATOM 783 CA GLN A 50 6.611 -14.857 10.681 1.00 0.00 C ATOM 784 C GLN A 50 6.675 -13.842 11.825 1.00 0.00 C ATOM 785 O GLN A 50 7.564 -13.864 12.671 1.00 0.00 O ATOM 786 CB GLN A 50 6.026 -16.216 11.117 1.00 0.00 C ATOM 787 CG GLN A 50 4.757 -16.162 11.997 1.00 0.00 C ATOM 788 CD GLN A 50 5.080 -16.159 13.496 1.00 0.00 C ATOM 789 OE1 GLN A 50 5.770 -17.043 13.983 1.00 0.00 O ATOM 790 NE2 GLN A 50 4.603 -15.196 14.271 1.00 0.00 N ATOM 0 H GLN A 50 8.065 -16.083 9.857 1.00 0.00 H new ATOM 0 HA GLN A 50 5.941 -14.389 9.959 1.00 0.00 H new ATOM 0 HB2 GLN A 50 5.797 -16.794 10.221 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.797 -16.762 11.661 1.00 0.00 H new ATOM 0 HG2 GLN A 50 4.186 -15.267 11.750 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.123 -17.018 11.767 1.00 0.00 H new ATOM 0 HE21 GLN A 50 4.027 -14.456 13.869 1.00 0.00 H new ATOM 0 HE22 GLN A 50 4.812 -15.194 15.269 1.00 0.00 H new ATOM 799 N GLN A 51 5.695 -12.940 11.795 1.00 0.00 N ATOM 800 CA GLN A 51 5.413 -11.942 12.809 1.00 0.00 C ATOM 801 C GLN A 51 3.900 -11.986 12.964 1.00 0.00 C ATOM 802 O GLN A 51 3.407 -12.532 13.950 1.00 0.00 O ATOM 803 CB GLN A 51 5.917 -10.557 12.359 1.00 0.00 C ATOM 804 CG GLN A 51 5.469 -9.410 13.285 1.00 0.00 C ATOM 805 CD GLN A 51 6.106 -9.496 14.666 1.00 0.00 C ATOM 806 OE1 GLN A 51 5.499 -10.005 15.605 1.00 0.00 O ATOM 807 NE2 GLN A 51 7.334 -9.029 14.800 1.00 0.00 N ATOM 0 H GLN A 51 5.042 -12.889 11.013 1.00 0.00 H new ATOM 0 HA GLN A 51 5.917 -12.136 13.756 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.006 -10.572 12.313 1.00 0.00 H new ATOM 0 HB3 GLN A 51 5.558 -10.359 11.349 1.00 0.00 H new ATOM 0 HG2 GLN A 51 5.728 -8.455 12.827 1.00 0.00 H new ATOM 0 HG3 GLN A 51 4.384 -9.431 13.386 1.00 0.00 H new ATOM 0 HE21 GLN A 51 7.811 -8.612 14.001 1.00 0.00 H new ATOM 0 HE22 GLN A 51 7.805 -9.085 15.703 1.00 0.00 H new ATOM 816 N ARG A 52 3.152 -11.579 11.928 1.00 0.00 N ATOM 817 CA ARG A 52 1.692 -11.594 12.014 1.00 0.00 C ATOM 818 C ARG A 52 1.040 -11.897 10.658 1.00 0.00 C ATOM 819 O ARG A 52 -0.114 -12.295 10.625 1.00 0.00 O ATOM 820 CB ARG A 52 1.254 -10.206 12.530 1.00 0.00 C ATOM 821 CG ARG A 52 -0.139 -10.212 13.176 1.00 0.00 C ATOM 822 CD ARG A 52 -0.025 -10.748 14.617 1.00 0.00 C ATOM 823 NE ARG A 52 0.571 -9.747 15.519 1.00 0.00 N ATOM 824 CZ ARG A 52 1.777 -9.652 16.088 1.00 0.00 C ATOM 825 NH1 ARG A 52 2.730 -10.554 15.859 1.00 0.00 N ATOM 826 NH2 ARG A 52 2.030 -8.621 16.885 1.00 0.00 N ATOM 0 H ARG A 52 3.527 -11.243 11.041 1.00 0.00 H new ATOM 0 HA ARG A 52 1.370 -12.386 12.690 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.983 -9.849 13.258 1.00 0.00 H new ATOM 0 HB3 ARG A 52 1.260 -9.499 11.700 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.555 -9.205 13.181 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.820 -10.835 12.596 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.014 -11.026 14.982 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.583 -11.653 14.623 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.057 -8.979 15.755 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.548 -11.341 15.236 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.642 -10.457 16.306 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.310 -7.918 17.054 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.944 -8.531 17.328 1.00 0.00 H new ATOM 840 N MET A 53 1.789 -11.777 9.557 1.00 0.00 N ATOM 841 CA MET A 53 1.300 -11.914 8.187 1.00 0.00 C ATOM 842 C MET A 53 2.175 -12.764 7.249 1.00 0.00 C ATOM 843 O MET A 53 1.584 -13.315 6.330 1.00 0.00 O ATOM 844 CB MET A 53 1.175 -10.528 7.544 1.00 0.00 C ATOM 845 CG MET A 53 0.121 -9.623 8.183 1.00 0.00 C ATOM 846 SD MET A 53 0.221 -7.919 7.587 1.00 0.00 S ATOM 847 CE MET A 53 -0.129 -8.146 5.822 1.00 0.00 C ATOM 0 H MET A 53 2.788 -11.575 9.600 1.00 0.00 H new ATOM 0 HA MET A 53 0.346 -12.431 8.293 1.00 0.00 H new ATOM 0 HB2 MET A 53 2.143 -10.029 7.596 1.00 0.00 H new ATOM 0 HB3 MET A 53 0.936 -10.652 6.488 1.00 0.00 H new ATOM 0 HG2 MET A 53 -0.872 -10.021 7.972 1.00 0.00 H new ATOM 0 HG3 MET A 53 0.245 -9.634 9.266 1.00 0.00 H new ATOM 0 HE1 MET A 53 -0.296 -7.175 5.356 1.00 0.00 H new ATOM 0 HE2 MET A 53 0.718 -8.637 5.343 1.00 0.00 H new ATOM 0 HE3 MET A 53 -1.020 -8.763 5.704 1.00 0.00 H new ATOM 857 N PRO A 54 3.517 -12.888 7.399 1.00 0.00 N ATOM 858 CA PRO A 54 4.343 -13.592 6.417 1.00 0.00 C ATOM 859 C PRO A 54 3.849 -14.994 6.056 1.00 0.00 C ATOM 860 O PRO A 54 3.459 -15.223 4.917 1.00 0.00 O ATOM 861 CB PRO A 54 5.772 -13.610 6.961 1.00 0.00 C ATOM 862 CG PRO A 54 5.821 -12.397 7.878 1.00 0.00 C ATOM 863 CD PRO A 54 4.383 -12.193 8.343 1.00 0.00 C ATOM 0 HA PRO A 54 4.286 -13.056 5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 54 5.983 -14.532 7.504 1.00 0.00 H new ATOM 0 HB3 PRO A 54 6.507 -13.537 6.160 1.00 0.00 H new ATOM 0 HG2 PRO A 54 6.488 -12.568 8.723 1.00 0.00 H new ATOM 0 HG3 PRO A 54 6.193 -11.519 7.351 1.00 0.00 H new ATOM 0 HD2 PRO A 54 4.246 -12.586 9.350 1.00 0.00 H new ATOM 0 HD3 PRO A 54 4.138 -11.131 8.379 1.00 0.00 H new ATOM 871 N ALA A 55 3.921 -15.941 6.998 1.00 0.00 N ATOM 872 CA ALA A 55 3.451 -17.295 6.820 1.00 0.00 C ATOM 873 C ALA A 55 1.963 -17.299 7.171 1.00 0.00 C ATOM 874 O ALA A 55 1.602 -17.082 8.328 1.00 0.00 O ATOM 875 CB ALA A 55 4.240 -18.252 7.722 1.00 0.00 C ATOM 0 H ALA A 55 4.319 -15.771 7.922 1.00 0.00 H new ATOM 0 HA ALA A 55 3.596 -17.634 5.794 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.877 -19.270 7.579 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.298 -18.205 7.465 1.00 0.00 H new ATOM 0 HB3 ALA A 55 4.107 -17.962 8.764 1.00 0.00 H new ATOM 881 N ILE A 56 1.122 -17.550 6.180 1.00 0.00 N ATOM 882 CA ILE A 56 -0.325 -17.605 6.256 1.00 0.00 C ATOM 883 C ILE A 56 -0.687 -19.094 6.229 1.00 0.00 C ATOM 884 O ILE A 56 -0.343 -19.770 5.258 1.00 0.00 O ATOM 885 CB ILE A 56 -0.933 -16.820 5.072 1.00 0.00 C ATOM 886 CG1 ILE A 56 -0.463 -15.349 5.088 1.00 0.00 C ATOM 887 CG2 ILE A 56 -2.465 -16.910 5.123 1.00 0.00 C ATOM 888 CD1 ILE A 56 -1.025 -14.476 3.963 1.00 0.00 C ATOM 0 H ILE A 56 1.459 -17.733 5.235 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.723 -17.145 7.160 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.587 -17.265 4.139 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.740 -14.905 6.044 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.625 -15.331 5.032 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.890 -16.355 4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -2.770 -17.954 5.058 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -2.823 -16.484 6.060 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.637 -13.462 4.061 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.726 -14.888 2.999 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.113 -14.456 4.027 1.00 0.00 H new ATOM 900 N PRO A 57 -1.334 -19.659 7.258 1.00 0.00 N ATOM 901 CA PRO A 57 -1.748 -21.050 7.218 1.00 0.00 C ATOM 902 C PRO A 57 -2.961 -21.214 6.295 1.00 0.00 C ATOM 903 O PRO A 57 -3.773 -20.298 6.162 1.00 0.00 O ATOM 904 CB PRO A 57 -2.079 -21.407 8.664 1.00 0.00 C ATOM 905 CG PRO A 57 -2.564 -20.082 9.255 1.00 0.00 C ATOM 906 CD PRO A 57 -1.776 -19.017 8.483 1.00 0.00 C ATOM 0 HA PRO A 57 -0.976 -21.709 6.820 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.848 -22.178 8.722 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.206 -21.787 9.194 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -3.639 -19.956 9.123 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.366 -20.027 10.325 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -2.400 -18.150 8.266 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -0.927 -18.661 9.066 1.00 0.00 H new ATOM 914 N VAL A 58 -3.121 -22.417 5.738 1.00 0.00 N ATOM 915 CA VAL A 58 -4.172 -22.836 4.811 1.00 0.00 C ATOM 916 C VAL A 58 -5.557 -22.275 5.168 1.00 0.00 C ATOM 917 O VAL A 58 -6.253 -21.772 4.284 1.00 0.00 O ATOM 918 CB VAL A 58 -4.117 -24.382 4.682 1.00 0.00 C ATOM 919 CG1 VAL A 58 -4.511 -25.149 5.955 1.00 0.00 C ATOM 920 CG2 VAL A 58 -4.906 -24.886 3.470 1.00 0.00 C ATOM 0 H VAL A 58 -2.472 -23.178 5.938 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.987 -22.404 3.828 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.061 -24.602 4.525 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.443 -26.221 5.770 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.836 -24.877 6.767 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.534 -24.893 6.232 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.840 -25.973 3.419 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.951 -24.590 3.567 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.490 -24.454 2.560 1.00 0.00 H new ATOM 930 N ASN A 59 -5.912 -22.325 6.459 1.00 0.00 N ATOM 931 CA ASN A 59 -7.199 -21.929 7.027 1.00 0.00 C ATOM 932 C ASN A 59 -7.563 -20.469 6.757 1.00 0.00 C ATOM 933 O ASN A 59 -8.741 -20.152 6.613 1.00 0.00 O ATOM 934 CB ASN A 59 -7.170 -22.161 8.545 1.00 0.00 C ATOM 935 CG ASN A 59 -8.524 -21.848 9.177 1.00 0.00 C ATOM 936 OD1 ASN A 59 -9.431 -22.662 9.114 1.00 0.00 O ATOM 937 ND2 ASN A 59 -8.684 -20.702 9.821 1.00 0.00 N ATOM 0 H ASN A 59 -5.267 -22.664 7.173 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.959 -22.541 6.541 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -6.900 -23.196 8.752 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.401 -21.534 8.997 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.574 -20.491 10.272 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.917 -20.031 9.866 1.00 0.00 H new ATOM 944 N ILE A 60 -6.583 -19.561 6.721 1.00 0.00 N ATOM 945 CA ILE A 60 -6.865 -18.176 6.372 1.00 0.00 C ATOM 946 C ILE A 60 -7.171 -18.217 4.883 1.00 0.00 C ATOM 947 O ILE A 60 -6.289 -18.462 4.054 1.00 0.00 O ATOM 948 CB ILE A 60 -5.637 -17.300 6.709 1.00 0.00 C ATOM 949 CG1 ILE A 60 -5.252 -17.334 8.206 1.00 0.00 C ATOM 950 CG2 ILE A 60 -5.784 -15.850 6.211 1.00 0.00 C ATOM 951 CD1 ILE A 60 -6.253 -16.679 9.159 1.00 0.00 C ATOM 0 H ILE A 60 -5.604 -19.761 6.927 1.00 0.00 H new ATOM 0 HA ILE A 60 -7.698 -17.740 6.924 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.812 -17.754 6.160 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.119 -18.374 8.505 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -4.287 -16.842 8.326 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.892 -15.282 6.476 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.907 -15.848 5.128 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.657 -15.392 6.676 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.886 -16.758 10.182 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.371 -15.628 8.896 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.216 -17.183 9.078 1.00 0.00 H new ATOM 963 N HIS A 61 -8.422 -17.930 4.536 1.00 0.00 N ATOM 964 CA HIS A 61 -8.796 -17.806 3.145 1.00 0.00 C ATOM 965 C HIS A 61 -8.373 -16.429 2.658 1.00 0.00 C ATOM 966 O HIS A 61 -7.853 -16.326 1.553 1.00 0.00 O ATOM 967 CB HIS A 61 -10.293 -18.024 2.933 1.00 0.00 C ATOM 968 CG HIS A 61 -10.638 -18.050 1.463 1.00 0.00 C ATOM 969 ND1 HIS A 61 -10.742 -16.949 0.640 1.00 0.00 N ATOM 970 CD2 HIS A 61 -10.765 -19.165 0.680 1.00 0.00 C ATOM 971 CE1 HIS A 61 -10.926 -17.394 -0.614 1.00 0.00 C ATOM 972 NE2 HIS A 61 -10.941 -18.737 -0.638 1.00 0.00 N ATOM 0 H HIS A 61 -9.183 -17.781 5.198 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.289 -18.581 2.569 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -10.596 -18.963 3.397 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -10.852 -17.229 3.427 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -10.689 -15.973 0.931 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -10.735 -20.190 1.019 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -11.045 -16.761 -1.481 1.00 0.00 H new ATOM 980 N SER A 62 -8.533 -15.400 3.492 1.00 0.00 N ATOM 981 CA SER A 62 -8.299 -14.021 3.092 1.00 0.00 C ATOM 982 C SER A 62 -7.904 -13.139 4.272 1.00 0.00 C ATOM 983 O SER A 62 -8.110 -13.521 5.423 1.00 0.00 O ATOM 984 CB SER A 62 -9.635 -13.443 2.587 1.00 0.00 C ATOM 985 OG SER A 62 -10.411 -14.264 1.724 1.00 0.00 O ATOM 0 H SER A 62 -8.829 -15.504 4.463 1.00 0.00 H new ATOM 0 HA SER A 62 -7.504 -14.027 2.347 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.245 -13.193 3.455 1.00 0.00 H new ATOM 0 HB3 SER A 62 -9.424 -12.509 2.066 1.00 0.00 H new ATOM 0 HG SER A 62 -11.259 -13.816 1.522 1.00 0.00 H new ATOM 991 N MET A 63 -7.323 -11.976 3.983 1.00 0.00 N ATOM 992 CA MET A 63 -6.993 -10.909 4.927 1.00 0.00 C ATOM 993 C MET A 63 -7.630 -9.640 4.358 1.00 0.00 C ATOM 994 O MET A 63 -7.928 -9.595 3.164 1.00 0.00 O ATOM 995 CB MET A 63 -5.486 -10.750 5.150 1.00 0.00 C ATOM 996 CG MET A 63 -4.915 -11.928 5.949 1.00 0.00 C ATOM 997 SD MET A 63 -3.217 -11.731 6.561 1.00 0.00 S ATOM 998 CE MET A 63 -2.326 -11.332 5.039 1.00 0.00 C ATOM 0 H MET A 63 -7.054 -11.739 3.028 1.00 0.00 H new ATOM 0 HA MET A 63 -7.382 -11.141 5.919 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.979 -10.680 4.188 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.291 -9.818 5.681 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.568 -12.112 6.802 1.00 0.00 H new ATOM 0 HG3 MET A 63 -4.952 -12.818 5.321 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.253 -11.342 5.232 1.00 0.00 H new ATOM 0 HE2 MET A 63 -2.564 -12.071 4.274 1.00 0.00 H new ATOM 0 HE3 MET A 63 -2.623 -10.342 4.692 1.00 0.00 H new ATOM 1008 N ASN A 64 -7.799 -8.596 5.167 1.00 0.00 N ATOM 1009 CA ASN A 64 -8.486 -7.380 4.731 1.00 0.00 C ATOM 1010 C ASN A 64 -7.557 -6.201 4.850 1.00 0.00 C ATOM 1011 O ASN A 64 -7.113 -5.859 5.944 1.00 0.00 O ATOM 1012 CB ASN A 64 -9.741 -7.043 5.543 1.00 0.00 C ATOM 1013 CG ASN A 64 -10.979 -7.848 5.193 1.00 0.00 C ATOM 1014 OD1 ASN A 64 -10.950 -8.782 4.399 1.00 0.00 O ATOM 1015 ND2 ASN A 64 -12.100 -7.517 5.805 1.00 0.00 N ATOM 0 H ASN A 64 -7.469 -8.567 6.132 1.00 0.00 H new ATOM 0 HA ASN A 64 -8.789 -7.575 3.702 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -9.519 -7.190 6.600 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -9.966 -5.985 5.409 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.956 -8.040 5.620 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -12.111 -6.738 6.463 1.00 0.00 H new ATOM 1022 N PHE A 65 -7.214 -5.636 3.706 1.00 0.00 N ATOM 1023 CA PHE A 65 -6.456 -4.414 3.635 1.00 0.00 C ATOM 1024 C PHE A 65 -7.554 -3.356 3.515 1.00 0.00 C ATOM 1025 O PHE A 65 -8.628 -3.617 2.974 1.00 0.00 O ATOM 1026 CB PHE A 65 -5.513 -4.414 2.430 1.00 0.00 C ATOM 1027 CG PHE A 65 -4.227 -5.219 2.560 1.00 0.00 C ATOM 1028 CD1 PHE A 65 -4.235 -6.565 2.979 1.00 0.00 C ATOM 1029 CD2 PHE A 65 -3.002 -4.616 2.213 1.00 0.00 C ATOM 1030 CE1 PHE A 65 -3.031 -7.280 3.096 1.00 0.00 C ATOM 1031 CE2 PHE A 65 -1.800 -5.333 2.314 1.00 0.00 C ATOM 1032 CZ PHE A 65 -1.814 -6.656 2.778 1.00 0.00 C ATOM 0 H PHE A 65 -7.460 -6.022 2.794 1.00 0.00 H new ATOM 0 HA PHE A 65 -5.799 -4.250 4.489 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -6.064 -4.792 1.569 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.245 -3.381 2.209 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.172 -7.049 3.211 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -2.988 -3.593 1.866 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -3.042 -8.307 3.430 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -0.867 -4.867 2.035 1.00 0.00 H new ATOM 0 HZ PHE A 65 -0.886 -7.197 2.891 1.00 0.00 H new ATOM 1042 N THR A 66 -7.308 -2.160 4.000 1.00 0.00 N ATOM 1043 CA THR A 66 -8.273 -1.086 4.038 1.00 0.00 C ATOM 1044 C THR A 66 -7.497 0.162 3.667 1.00 0.00 C ATOM 1045 O THR A 66 -6.382 0.366 4.138 1.00 0.00 O ATOM 1046 CB THR A 66 -8.922 -1.025 5.428 1.00 0.00 C ATOM 1047 OG1 THR A 66 -9.941 -2.005 5.532 1.00 0.00 O ATOM 1048 CG2 THR A 66 -9.567 0.343 5.658 1.00 0.00 C ATOM 0 H THR A 66 -6.402 -1.900 4.391 1.00 0.00 H new ATOM 0 HA THR A 66 -9.103 -1.217 3.343 1.00 0.00 H new ATOM 0 HB THR A 66 -8.142 -1.202 6.169 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.675 -2.686 6.185 1.00 0.00 H new ATOM 0 HG21 THR A 66 -10.022 0.369 6.648 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.806 1.120 5.588 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.333 0.516 4.902 1.00 0.00 H new ATOM 1056 N TRP A 67 -8.050 1.002 2.805 1.00 0.00 N ATOM 1057 CA TRP A 67 -7.348 2.197 2.384 1.00 0.00 C ATOM 1058 C TRP A 67 -8.326 3.304 2.075 1.00 0.00 C ATOM 1059 O TRP A 67 -9.536 3.066 1.956 1.00 0.00 O ATOM 1060 CB TRP A 67 -6.444 1.858 1.189 1.00 0.00 C ATOM 1061 CG TRP A 67 -7.053 1.385 -0.098 1.00 0.00 C ATOM 1062 CD1 TRP A 67 -8.358 1.124 -0.352 1.00 0.00 C ATOM 1063 CD2 TRP A 67 -6.337 1.049 -1.324 1.00 0.00 C ATOM 1064 NE1 TRP A 67 -8.495 0.675 -1.649 1.00 0.00 N ATOM 1065 CE2 TRP A 67 -7.272 0.533 -2.267 1.00 0.00 C ATOM 1066 CE3 TRP A 67 -4.981 1.104 -1.716 1.00 0.00 C ATOM 1067 CZ2 TRP A 67 -6.878 0.018 -3.510 1.00 0.00 C ATOM 1068 CZ3 TRP A 67 -4.570 0.558 -2.950 1.00 0.00 C ATOM 1069 CH2 TRP A 67 -5.513 0.009 -3.838 1.00 0.00 C ATOM 0 H TRP A 67 -8.973 0.878 2.389 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.713 2.561 3.191 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.857 2.748 0.963 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.744 1.090 1.519 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.167 1.248 0.353 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.390 0.473 -2.095 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.254 1.568 -1.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -7.612 -0.365 -4.203 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.523 0.561 -3.215 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -5.186 -0.420 -4.774 1.00 0.00 H new ATOM 1080 N GLN A 68 -7.792 4.516 1.967 1.00 0.00 N ATOM 1081 CA GLN A 68 -8.556 5.659 1.548 1.00 0.00 C ATOM 1082 C GLN A 68 -7.675 6.842 1.159 1.00 0.00 C ATOM 1083 O GLN A 68 -6.561 6.994 1.670 1.00 0.00 O ATOM 1084 CB GLN A 68 -9.534 6.112 2.651 1.00 0.00 C ATOM 1085 CG GLN A 68 -8.943 6.186 4.058 1.00 0.00 C ATOM 1086 CD GLN A 68 -9.796 7.055 4.978 1.00 0.00 C ATOM 1087 OE1 GLN A 68 -10.928 6.720 5.314 1.00 0.00 O ATOM 1088 NE2 GLN A 68 -9.271 8.186 5.413 1.00 0.00 N ATOM 0 H GLN A 68 -6.814 4.722 2.171 1.00 0.00 H new ATOM 0 HA GLN A 68 -9.112 5.338 0.667 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.924 7.095 2.386 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -10.381 5.426 2.666 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -8.865 5.182 4.474 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.932 6.590 4.008 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.329 8.454 5.127 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.807 8.791 6.035 1.00 0.00 H new ATOM 1097 N ALA A 69 -8.160 7.663 0.219 1.00 0.00 N ATOM 1098 CA ALA A 69 -7.486 8.904 -0.119 1.00 0.00 C ATOM 1099 C ALA A 69 -7.716 9.851 1.064 1.00 0.00 C ATOM 1100 O ALA A 69 -8.394 9.545 2.046 1.00 0.00 O ATOM 1101 CB ALA A 69 -8.044 9.490 -1.427 1.00 0.00 C ATOM 0 H ALA A 69 -9.012 7.484 -0.313 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.421 8.747 -0.287 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.524 10.419 -1.660 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.895 8.777 -2.238 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.109 9.689 -1.311 1.00 0.00 H new ATOM 1107 N ALA A 70 -7.126 11.025 0.956 1.00 0.00 N ATOM 1108 CA ALA A 70 -7.291 12.118 1.838 1.00 0.00 C ATOM 1109 C ALA A 70 -8.485 12.825 1.205 1.00 0.00 C ATOM 1110 O ALA A 70 -8.661 12.862 -0.015 1.00 0.00 O ATOM 1111 CB ALA A 70 -6.024 12.956 1.782 1.00 0.00 C ATOM 0 H ALA A 70 -6.481 11.234 0.194 1.00 0.00 H new ATOM 0 HA ALA A 70 -7.455 11.882 2.889 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.122 13.809 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.172 12.349 2.088 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.868 13.312 0.764 1.00 0.00 H new ATOM 1117 N GLY A 71 -9.295 13.345 2.082 1.00 0.00 N ATOM 1118 CA GLY A 71 -10.594 13.999 1.994 1.00 0.00 C ATOM 1119 C GLY A 71 -11.208 14.179 0.603 1.00 0.00 C ATOM 1120 O GLY A 71 -12.270 13.595 0.373 1.00 0.00 O ATOM 0 H GLY A 71 -9.011 13.318 3.061 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -11.298 13.429 2.600 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -10.505 14.984 2.451 1.00 0.00 H new ATOM 1124 N GLN A 72 -10.715 15.108 -0.233 1.00 0.00 N ATOM 1125 CA GLN A 72 -11.124 15.301 -1.633 1.00 0.00 C ATOM 1126 C GLN A 72 -10.026 15.082 -2.711 1.00 0.00 C ATOM 1127 O GLN A 72 -10.139 15.599 -3.817 1.00 0.00 O ATOM 1128 CB GLN A 72 -11.941 16.595 -1.759 1.00 0.00 C ATOM 1129 CG GLN A 72 -13.324 16.505 -1.066 1.00 0.00 C ATOM 1130 CD GLN A 72 -14.196 15.313 -1.502 1.00 0.00 C ATOM 1131 OE1 GLN A 72 -14.888 14.693 -0.692 1.00 0.00 O ATOM 1132 NE2 GLN A 72 -14.190 14.961 -2.780 1.00 0.00 N ATOM 0 H GLN A 72 -9.995 15.769 0.059 1.00 0.00 H new ATOM 0 HA GLN A 72 -11.782 14.471 -1.889 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -11.376 17.419 -1.325 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -12.084 16.827 -2.814 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -13.170 16.448 0.012 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -13.872 17.427 -1.261 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -13.616 15.476 -3.448 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -14.759 14.175 -3.095 1.00 0.00 H new ATOM 1141 N ALA A 73 -8.989 14.301 -2.410 1.00 0.00 N ATOM 1142 CA ALA A 73 -7.756 14.013 -3.153 1.00 0.00 C ATOM 1143 C ALA A 73 -7.527 12.614 -3.804 1.00 0.00 C ATOM 1144 O ALA A 73 -6.459 12.057 -3.570 1.00 0.00 O ATOM 1145 CB ALA A 73 -6.628 14.378 -2.204 1.00 0.00 C ATOM 0 H ALA A 73 -8.992 13.789 -1.528 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.820 14.603 -4.067 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.670 14.190 -2.688 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.701 15.433 -1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.703 13.773 -1.300 1.00 0.00 H new ATOM 1151 N GLU A 74 -8.519 11.919 -4.377 1.00 0.00 N ATOM 1152 CA GLU A 74 -8.419 10.545 -4.893 1.00 0.00 C ATOM 1153 C GLU A 74 -7.099 10.250 -5.614 1.00 0.00 C ATOM 1154 O GLU A 74 -6.770 10.848 -6.640 1.00 0.00 O ATOM 1155 CB GLU A 74 -9.621 10.139 -5.766 1.00 0.00 C ATOM 1156 CG GLU A 74 -10.925 10.025 -4.956 1.00 0.00 C ATOM 1157 CD GLU A 74 -11.908 8.902 -5.325 1.00 0.00 C ATOM 1158 OE1 GLU A 74 -11.679 8.170 -6.317 1.00 0.00 O ATOM 1159 OE2 GLU A 74 -12.894 8.769 -4.559 1.00 0.00 O ATOM 0 H GLU A 74 -9.451 12.314 -4.499 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.436 9.922 -3.999 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.753 10.873 -6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.411 9.184 -6.247 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.657 9.902 -3.907 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.455 10.974 -5.041 1.00 0.00 H new ATOM 1166 N TYR A 75 -6.347 9.322 -5.026 1.00 0.00 N ATOM 1167 CA TYR A 75 -5.115 8.762 -5.548 1.00 0.00 C ATOM 1168 C TYR A 75 -5.526 7.639 -6.490 1.00 0.00 C ATOM 1169 O TYR A 75 -6.376 6.827 -6.129 1.00 0.00 O ATOM 1170 CB TYR A 75 -4.291 8.221 -4.371 1.00 0.00 C ATOM 1171 CG TYR A 75 -3.596 9.302 -3.567 1.00 0.00 C ATOM 1172 CD1 TYR A 75 -4.304 10.007 -2.580 1.00 0.00 C ATOM 1173 CD2 TYR A 75 -2.247 9.619 -3.821 1.00 0.00 C ATOM 1174 CE1 TYR A 75 -3.670 11.014 -1.838 1.00 0.00 C ATOM 1175 CE2 TYR A 75 -1.597 10.621 -3.078 1.00 0.00 C ATOM 1176 CZ TYR A 75 -2.311 11.312 -2.070 1.00 0.00 C ATOM 1177 OH TYR A 75 -1.707 12.238 -1.280 1.00 0.00 O ATOM 0 H TYR A 75 -6.600 8.922 -4.122 1.00 0.00 H new ATOM 0 HA TYR A 75 -4.508 9.496 -6.077 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.946 7.654 -3.710 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.543 7.526 -4.752 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.341 9.773 -2.392 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -1.708 9.089 -4.592 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.222 11.562 -1.089 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -0.563 10.861 -3.275 1.00 0.00 H new ATOM 0 HH TYR A 75 -0.771 12.341 -1.553 1.00 0.00 H new ATOM 1187 N PHE A 76 -4.960 7.579 -7.688 1.00 0.00 N ATOM 1188 CA PHE A 76 -5.217 6.495 -8.621 1.00 0.00 C ATOM 1189 C PHE A 76 -4.265 5.368 -8.210 1.00 0.00 C ATOM 1190 O PHE A 76 -3.155 5.654 -7.754 1.00 0.00 O ATOM 1191 CB PHE A 76 -4.887 6.981 -10.042 1.00 0.00 C ATOM 1192 CG PHE A 76 -5.562 6.213 -11.158 1.00 0.00 C ATOM 1193 CD1 PHE A 76 -5.156 4.920 -11.524 1.00 0.00 C ATOM 1194 CD2 PHE A 76 -6.647 6.811 -11.828 1.00 0.00 C ATOM 1195 CE1 PHE A 76 -5.836 4.226 -12.533 1.00 0.00 C ATOM 1196 CE2 PHE A 76 -7.334 6.117 -12.836 1.00 0.00 C ATOM 1197 CZ PHE A 76 -6.939 4.809 -13.176 1.00 0.00 C ATOM 0 H PHE A 76 -4.310 8.282 -8.039 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.254 6.161 -8.607 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.167 8.031 -10.124 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -3.808 6.927 -10.186 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.316 4.459 -11.026 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.953 7.812 -11.564 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -5.510 3.237 -12.818 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.162 6.584 -13.349 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.482 4.257 -13.928 1.00 0.00 H new ATOM 1207 N TYR A 77 -4.626 4.105 -8.403 1.00 0.00 N ATOM 1208 CA TYR A 77 -3.744 2.979 -8.132 1.00 0.00 C ATOM 1209 C TYR A 77 -3.767 1.974 -9.279 1.00 0.00 C ATOM 1210 O TYR A 77 -4.728 1.924 -10.052 1.00 0.00 O ATOM 1211 CB TYR A 77 -4.185 2.279 -6.830 1.00 0.00 C ATOM 1212 CG TYR A 77 -5.422 1.396 -6.970 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -5.298 0.111 -7.536 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -6.696 1.854 -6.581 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -6.432 -0.674 -7.772 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -7.829 1.029 -6.731 1.00 0.00 C ATOM 1217 CZ TYR A 77 -7.693 -0.245 -7.327 1.00 0.00 C ATOM 1218 OH TYR A 77 -8.746 -1.092 -7.445 1.00 0.00 O ATOM 0 H TYR A 77 -5.544 3.833 -8.754 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.728 3.359 -8.026 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.359 1.669 -6.463 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.381 3.039 -6.073 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.320 -0.271 -7.790 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.805 2.845 -6.165 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.337 -1.613 -8.298 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.796 1.369 -6.392 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.473 -1.884 -7.953 1.00 0.00 H new ATOM 1228 N GLU A 78 -2.728 1.143 -9.353 1.00 0.00 N ATOM 1229 CA GLU A 78 -2.653 0.032 -10.286 1.00 0.00 C ATOM 1230 C GLU A 78 -1.750 -1.041 -9.682 1.00 0.00 C ATOM 1231 O GLU A 78 -0.756 -0.732 -9.027 1.00 0.00 O ATOM 1232 CB GLU A 78 -2.242 0.484 -11.700 1.00 0.00 C ATOM 1233 CG GLU A 78 -2.164 -0.711 -12.666 1.00 0.00 C ATOM 1234 CD GLU A 78 -2.116 -0.281 -14.136 1.00 0.00 C ATOM 1235 OE1 GLU A 78 -3.209 -0.163 -14.736 1.00 0.00 O ATOM 1236 OE2 GLU A 78 -0.990 -0.107 -14.655 1.00 0.00 O ATOM 0 H GLU A 78 -1.906 1.228 -8.756 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.641 -0.404 -10.433 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.961 1.212 -12.075 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.275 0.984 -11.658 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.278 -1.302 -12.435 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.028 -1.357 -12.509 1.00 0.00 H new ATOM 1243 N PHE A 79 -2.152 -2.304 -9.808 1.00 0.00 N ATOM 1244 CA PHE A 79 -1.465 -3.453 -9.230 1.00 0.00 C ATOM 1245 C PHE A 79 -0.361 -3.934 -10.175 1.00 0.00 C ATOM 1246 O PHE A 79 -0.628 -4.610 -11.168 1.00 0.00 O ATOM 1247 CB PHE A 79 -2.462 -4.587 -8.910 1.00 0.00 C ATOM 1248 CG PHE A 79 -3.288 -4.434 -7.638 1.00 0.00 C ATOM 1249 CD1 PHE A 79 -4.313 -3.475 -7.560 1.00 0.00 C ATOM 1250 CD2 PHE A 79 -3.059 -5.273 -6.527 1.00 0.00 C ATOM 1251 CE1 PHE A 79 -5.098 -3.359 -6.401 1.00 0.00 C ATOM 1252 CE2 PHE A 79 -3.837 -5.144 -5.358 1.00 0.00 C ATOM 1253 CZ PHE A 79 -4.863 -4.183 -5.299 1.00 0.00 C ATOM 0 H PHE A 79 -2.989 -2.562 -10.331 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.004 -3.149 -8.290 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.148 -4.684 -9.751 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.905 -5.521 -8.843 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.499 -2.821 -8.399 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.281 -6.021 -6.572 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.890 -2.626 -6.362 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.645 -5.783 -4.508 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.464 -4.084 -4.407 1.00 0.00 H new ATOM 1263 N LEU A 80 0.890 -3.615 -9.830 1.00 0.00 N ATOM 1264 CA LEU A 80 2.103 -4.071 -10.505 1.00 0.00 C ATOM 1265 C LEU A 80 2.170 -5.603 -10.415 1.00 0.00 C ATOM 1266 O LEU A 80 2.447 -6.288 -11.407 1.00 0.00 O ATOM 1267 CB LEU A 80 3.312 -3.402 -9.815 1.00 0.00 C ATOM 1268 CG LEU A 80 4.613 -3.336 -10.640 1.00 0.00 C ATOM 1269 CD1 LEU A 80 5.691 -2.614 -9.822 1.00 0.00 C ATOM 1270 CD2 LEU A 80 5.167 -4.702 -11.059 1.00 0.00 C ATOM 0 H LEU A 80 1.091 -3.005 -9.038 1.00 0.00 H new ATOM 0 HA LEU A 80 2.107 -3.796 -11.560 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.030 -2.386 -9.537 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.519 -3.939 -8.890 1.00 0.00 H new ATOM 0 HG LEU A 80 4.359 -2.802 -11.556 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.614 -2.564 -10.400 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.354 -1.604 -9.588 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.872 -3.160 -8.896 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.082 -4.563 -11.635 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.384 -5.295 -10.170 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.429 -5.222 -11.670 1.00 0.00 H new ATOM 1282 N SER A 81 1.874 -6.150 -9.234 1.00 0.00 N ATOM 1283 CA SER A 81 1.894 -7.572 -8.959 1.00 0.00 C ATOM 1284 C SER A 81 0.656 -8.015 -8.197 1.00 0.00 C ATOM 1285 O SER A 81 0.155 -7.295 -7.335 1.00 0.00 O ATOM 1286 CB SER A 81 3.136 -7.937 -8.146 1.00 0.00 C ATOM 1287 OG SER A 81 4.324 -7.812 -8.901 1.00 0.00 O ATOM 0 H SER A 81 1.607 -5.591 -8.424 1.00 0.00 H new ATOM 0 HA SER A 81 1.912 -8.086 -9.920 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.196 -7.293 -7.268 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.043 -8.961 -7.784 1.00 0.00 H new ATOM 0 HG SER A 81 4.975 -8.480 -8.600 1.00 0.00 H new ATOM 1293 N LEU A 82 0.193 -9.222 -8.531 1.00 0.00 N ATOM 1294 CA LEU A 82 -0.877 -9.984 -7.900 1.00 0.00 C ATOM 1295 C LEU A 82 -0.805 -11.346 -8.598 1.00 0.00 C ATOM 1296 O LEU A 82 -1.431 -11.525 -9.639 1.00 0.00 O ATOM 1297 CB LEU A 82 -2.226 -9.260 -8.104 1.00 0.00 C ATOM 1298 CG LEU A 82 -3.284 -9.760 -7.107 1.00 0.00 C ATOM 1299 CD1 LEU A 82 -4.002 -8.594 -6.443 1.00 0.00 C ATOM 1300 CD2 LEU A 82 -4.339 -10.640 -7.762 1.00 0.00 C ATOM 0 H LEU A 82 0.595 -9.731 -9.318 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.779 -10.093 -6.820 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.087 -8.186 -7.982 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.578 -9.422 -9.123 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.737 -10.349 -6.370 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.745 -8.975 -5.743 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.279 -7.980 -5.906 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.497 -7.991 -7.204 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.060 -10.964 -7.011 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.854 -10.074 -8.539 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.860 -11.513 -8.206 1.00 0.00 H new ATOM 1312 N ARG A 83 -0.067 -12.318 -8.044 1.00 0.00 N ATOM 1313 CA ARG A 83 0.176 -13.625 -8.696 1.00 0.00 C ATOM 1314 C ARG A 83 0.813 -14.616 -7.719 1.00 0.00 C ATOM 1315 O ARG A 83 1.542 -14.195 -6.818 1.00 0.00 O ATOM 1316 CB ARG A 83 1.202 -13.497 -9.856 1.00 0.00 C ATOM 1317 CG ARG A 83 0.731 -12.983 -11.235 1.00 0.00 C ATOM 1318 CD ARG A 83 0.981 -11.497 -11.562 1.00 0.00 C ATOM 1319 NE ARG A 83 2.391 -11.090 -11.431 1.00 0.00 N ATOM 1320 CZ ARG A 83 2.864 -9.856 -11.637 1.00 0.00 C ATOM 1321 NH1 ARG A 83 2.119 -8.929 -12.239 1.00 0.00 N ATOM 1322 NH2 ARG A 83 4.068 -9.549 -11.184 1.00 0.00 N ATOM 0 H ARG A 83 0.381 -12.226 -7.132 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.797 -13.964 -9.050 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.999 -12.836 -9.516 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.647 -14.480 -10.008 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.219 -13.583 -12.003 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.340 -13.170 -11.316 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.648 -11.297 -12.580 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.371 -10.881 -10.901 1.00 0.00 H new ATOM 0 HE ARG A 83 3.062 -11.809 -11.161 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.174 -9.156 -12.550 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.493 -7.992 -12.389 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.619 -10.248 -10.687 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.445 -8.613 -11.332 1.00 0.00 H new ATOM 1336 N SER A 84 0.603 -15.920 -7.916 1.00 0.00 N ATOM 1337 CA SER A 84 1.268 -16.958 -7.141 1.00 0.00 C ATOM 1338 C SER A 84 2.675 -17.141 -7.694 1.00 0.00 C ATOM 1339 O SER A 84 2.851 -17.385 -8.896 1.00 0.00 O ATOM 1340 CB SER A 84 0.532 -18.294 -7.232 1.00 0.00 C ATOM 1341 OG SER A 84 0.921 -19.098 -6.138 1.00 0.00 O ATOM 0 H SER A 84 -0.037 -16.282 -8.622 1.00 0.00 H new ATOM 0 HA SER A 84 1.284 -16.650 -6.096 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.546 -18.134 -7.219 1.00 0.00 H new ATOM 0 HB3 SER A 84 0.769 -18.793 -8.172 1.00 0.00 H new ATOM 0 HG SER A 84 0.491 -18.769 -5.321 1.00 0.00 H new ATOM 1347 N LEU A 85 3.679 -17.080 -6.820 1.00 0.00 N ATOM 1348 CA LEU A 85 5.046 -17.362 -7.217 1.00 0.00 C ATOM 1349 C LEU A 85 5.343 -18.855 -7.119 1.00 0.00 C ATOM 1350 O LEU A 85 6.172 -19.306 -7.908 1.00 0.00 O ATOM 1351 CB LEU A 85 6.047 -16.575 -6.359 1.00 0.00 C ATOM 1352 CG LEU A 85 5.972 -15.048 -6.530 1.00 0.00 C ATOM 1353 CD1 LEU A 85 6.990 -14.404 -5.586 1.00 0.00 C ATOM 1354 CD2 LEU A 85 6.268 -14.599 -7.966 1.00 0.00 C ATOM 0 H LEU A 85 3.566 -16.838 -5.836 1.00 0.00 H new ATOM 0 HA LEU A 85 5.156 -17.047 -8.255 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.878 -16.819 -5.310 1.00 0.00 H new ATOM 0 HB3 LEU A 85 7.056 -16.906 -6.605 1.00 0.00 H new ATOM 0 HG LEU A 85 4.954 -14.735 -6.296 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.951 -13.320 -5.694 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.754 -14.675 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.991 -14.757 -5.834 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.201 -13.513 -8.029 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.272 -14.918 -8.247 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.542 -15.047 -8.644 1.00 0.00 H new ATOM 1366 N ASP A 86 4.667 -19.640 -6.257 1.00 0.00 N ATOM 1367 CA ASP A 86 4.892 -21.090 -6.300 1.00 0.00 C ATOM 1368 C ASP A 86 3.962 -21.715 -7.330 1.00 0.00 C ATOM 1369 O ASP A 86 2.885 -21.204 -7.633 1.00 0.00 O ATOM 1370 CB ASP A 86 4.764 -21.901 -4.992 1.00 0.00 C ATOM 1371 CG ASP A 86 5.447 -23.266 -5.190 1.00 0.00 C ATOM 1372 OD1 ASP A 86 6.350 -23.407 -6.046 1.00 0.00 O ATOM 1373 OD2 ASP A 86 4.938 -24.233 -4.611 1.00 0.00 O ATOM 0 H ASP A 86 3.997 -19.315 -5.560 1.00 0.00 H new ATOM 0 HA ASP A 86 5.951 -21.155 -6.549 1.00 0.00 H new ATOM 0 HB2 ASP A 86 5.228 -21.362 -4.166 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.714 -22.038 -4.733 1.00 0.00 H new ATOM 1378 N LYS A 87 4.397 -22.832 -7.887 1.00 0.00 N ATOM 1379 CA LYS A 87 3.760 -23.653 -8.893 1.00 0.00 C ATOM 1380 C LYS A 87 3.247 -24.972 -8.335 1.00 0.00 C ATOM 1381 O LYS A 87 2.222 -25.464 -8.787 1.00 0.00 O ATOM 1382 CB LYS A 87 4.819 -23.888 -9.959 1.00 0.00 C ATOM 1383 CG LYS A 87 5.029 -22.766 -11.012 1.00 0.00 C ATOM 1384 CD LYS A 87 4.645 -21.296 -10.692 1.00 0.00 C ATOM 1385 CE LYS A 87 3.149 -20.995 -10.934 1.00 0.00 C ATOM 1386 NZ LYS A 87 2.572 -19.960 -10.038 1.00 0.00 N ATOM 0 H LYS A 87 5.299 -23.223 -7.615 1.00 0.00 H new ATOM 0 HA LYS A 87 2.878 -23.152 -9.292 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.771 -24.062 -9.457 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.566 -24.806 -10.490 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.086 -22.770 -11.279 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.474 -23.056 -11.904 1.00 0.00 H new ATOM 0 HD2 LYS A 87 4.889 -21.081 -9.652 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.248 -20.627 -11.306 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.019 -20.675 -11.968 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.582 -21.918 -10.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 1.645 -19.663 -10.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.458 -20.353 -9.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.209 -19.139 -10.001 1.00 0.00 H new ATOM 1400 N GLY A 88 3.979 -25.555 -7.401 1.00 0.00 N ATOM 1401 CA GLY A 88 3.565 -26.746 -6.672 1.00 0.00 C ATOM 1402 C GLY A 88 2.393 -26.410 -5.747 1.00 0.00 C ATOM 1403 O GLY A 88 1.242 -26.713 -6.048 1.00 0.00 O ATOM 0 H GLY A 88 4.896 -25.208 -7.121 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.274 -27.529 -7.372 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.400 -27.135 -6.089 1.00 0.00 H new ATOM 1407 N ILE A 89 2.688 -25.745 -4.632 1.00 0.00 N ATOM 1408 CA ILE A 89 1.807 -25.276 -3.550 1.00 0.00 C ATOM 1409 C ILE A 89 0.990 -24.048 -4.013 1.00 0.00 C ATOM 1410 O ILE A 89 0.463 -23.279 -3.215 1.00 0.00 O ATOM 1411 CB ILE A 89 2.695 -25.000 -2.298 1.00 0.00 C ATOM 1412 CG1 ILE A 89 3.514 -26.239 -1.881 1.00 0.00 C ATOM 1413 CG2 ILE A 89 1.921 -24.565 -1.043 1.00 0.00 C ATOM 1414 CD1 ILE A 89 4.965 -26.200 -2.365 1.00 0.00 C ATOM 0 H ILE A 89 3.657 -25.491 -4.438 1.00 0.00 H new ATOM 0 HA ILE A 89 1.068 -26.031 -3.282 1.00 0.00 H new ATOM 0 HB ILE A 89 3.332 -24.181 -2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.504 -26.323 -0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.031 -27.134 -2.275 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.621 -24.396 -0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.377 -23.644 -1.252 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.215 -25.347 -0.762 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.482 -27.101 -2.037 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.984 -26.147 -3.454 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.464 -25.324 -1.950 1.00 0.00 H new ATOM 1426 N MET A 90 0.869 -23.864 -5.323 1.00 0.00 N ATOM 1427 CA MET A 90 0.267 -22.732 -6.002 1.00 0.00 C ATOM 1428 C MET A 90 -1.040 -22.315 -5.331 1.00 0.00 C ATOM 1429 O MET A 90 -1.906 -23.125 -4.989 1.00 0.00 O ATOM 1430 CB MET A 90 0.105 -23.147 -7.462 1.00 0.00 C ATOM 1431 CG MET A 90 -0.410 -22.100 -8.451 1.00 0.00 C ATOM 1432 SD MET A 90 0.148 -22.423 -10.159 1.00 0.00 S ATOM 1433 CE MET A 90 -0.220 -24.196 -10.387 1.00 0.00 C ATOM 0 H MET A 90 1.217 -24.558 -5.985 1.00 0.00 H new ATOM 0 HA MET A 90 0.893 -21.841 -5.946 1.00 0.00 H new ATOM 0 HB2 MET A 90 1.073 -23.497 -7.820 1.00 0.00 H new ATOM 0 HB3 MET A 90 -0.574 -23.999 -7.494 1.00 0.00 H new ATOM 0 HG2 MET A 90 -1.500 -22.084 -8.424 1.00 0.00 H new ATOM 0 HG3 MET A 90 -0.069 -21.112 -8.141 1.00 0.00 H new ATOM 0 HE1 MET A 90 0.473 -24.621 -11.113 1.00 0.00 H new ATOM 0 HE2 MET A 90 -0.112 -24.715 -9.435 1.00 0.00 H new ATOM 0 HE3 MET A 90 -1.241 -24.312 -10.750 1.00 0.00 H new ATOM 1443 N ALA A 91 -1.116 -21.017 -5.087 1.00 0.00 N ATOM 1444 CA ALA A 91 -2.166 -20.313 -4.393 1.00 0.00 C ATOM 1445 C ALA A 91 -2.114 -18.915 -4.953 1.00 0.00 C ATOM 1446 O ALA A 91 -1.126 -18.206 -4.724 1.00 0.00 O ATOM 1447 CB ALA A 91 -1.911 -20.290 -2.878 1.00 0.00 C ATOM 0 H ALA A 91 -0.381 -20.382 -5.398 1.00 0.00 H new ATOM 0 HA ALA A 91 -3.137 -20.788 -4.532 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.719 -19.753 -2.381 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.869 -21.312 -2.501 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.964 -19.789 -2.676 1.00 0.00 H new ATOM 1453 N ASP A 92 -3.156 -18.531 -5.670 1.00 0.00 N ATOM 1454 CA ASP A 92 -3.153 -17.253 -6.376 1.00 0.00 C ATOM 1455 C ASP A 92 -3.921 -16.232 -5.563 1.00 0.00 C ATOM 1456 O ASP A 92 -4.994 -16.550 -5.053 1.00 0.00 O ATOM 1457 CB ASP A 92 -3.609 -17.368 -7.840 1.00 0.00 C ATOM 1458 CG ASP A 92 -2.447 -17.839 -8.724 1.00 0.00 C ATOM 1459 OD1 ASP A 92 -2.248 -19.067 -8.862 1.00 0.00 O ATOM 1460 OD2 ASP A 92 -1.661 -16.963 -9.159 1.00 0.00 O ATOM 0 H ASP A 92 -4.010 -19.078 -5.781 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.125 -16.901 -6.463 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.440 -18.070 -7.915 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.974 -16.403 -8.191 1.00 0.00 H new ATOM 1465 N PRO A 93 -3.376 -15.022 -5.370 1.00 0.00 N ATOM 1466 CA PRO A 93 -4.110 -13.971 -4.704 1.00 0.00 C ATOM 1467 C PRO A 93 -5.261 -13.513 -5.598 1.00 0.00 C ATOM 1468 O PRO A 93 -5.202 -13.570 -6.825 1.00 0.00 O ATOM 1469 CB PRO A 93 -3.095 -12.857 -4.447 1.00 0.00 C ATOM 1470 CG PRO A 93 -2.089 -13.039 -5.581 1.00 0.00 C ATOM 1471 CD PRO A 93 -2.082 -14.544 -5.823 1.00 0.00 C ATOM 0 HA PRO A 93 -4.558 -14.293 -3.764 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.561 -11.872 -4.476 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.624 -12.958 -3.469 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -2.390 -12.492 -6.474 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -1.101 -12.674 -5.301 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.929 -14.770 -6.878 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.273 -15.025 -5.273 1.00 0.00 H new ATOM 1479 N THR A 94 -6.293 -12.994 -4.957 1.00 0.00 N ATOM 1480 CA THR A 94 -7.458 -12.371 -5.565 1.00 0.00 C ATOM 1481 C THR A 94 -7.761 -11.120 -4.738 1.00 0.00 C ATOM 1482 O THR A 94 -7.414 -11.086 -3.556 1.00 0.00 O ATOM 1483 CB THR A 94 -8.626 -13.377 -5.581 1.00 0.00 C ATOM 1484 OG1 THR A 94 -8.774 -14.014 -4.324 1.00 0.00 O ATOM 1485 CG2 THR A 94 -8.431 -14.478 -6.629 1.00 0.00 C ATOM 0 H THR A 94 -6.344 -12.996 -3.938 1.00 0.00 H new ATOM 0 HA THR A 94 -7.289 -12.083 -6.603 1.00 0.00 H new ATOM 0 HB THR A 94 -9.513 -12.791 -5.824 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.313 -13.490 -3.636 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.280 -15.161 -6.601 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.359 -14.029 -7.620 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.515 -15.028 -6.413 1.00 0.00 H new ATOM 1493 N VAL A 95 -8.372 -10.090 -5.325 1.00 0.00 N ATOM 1494 CA VAL A 95 -8.746 -8.871 -4.611 1.00 0.00 C ATOM 1495 C VAL A 95 -10.223 -8.529 -4.785 1.00 0.00 C ATOM 1496 O VAL A 95 -10.834 -8.864 -5.796 1.00 0.00 O ATOM 1497 CB VAL A 95 -7.810 -7.693 -4.914 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -6.538 -7.791 -4.065 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -7.458 -7.569 -6.404 1.00 0.00 C ATOM 0 H VAL A 95 -8.622 -10.079 -6.314 1.00 0.00 H new ATOM 0 HA VAL A 95 -8.611 -9.080 -3.550 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.353 -6.786 -4.650 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.884 -6.949 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.804 -7.771 -3.008 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.020 -8.723 -4.291 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.794 -6.717 -6.551 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.960 -8.480 -6.737 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.370 -7.422 -6.982 1.00 0.00 H new ATOM 1509 N ASN A 96 -10.768 -7.810 -3.800 1.00 0.00 N ATOM 1510 CA ASN A 96 -12.127 -7.260 -3.774 1.00 0.00 C ATOM 1511 C ASN A 96 -12.310 -6.016 -4.657 1.00 0.00 C ATOM 1512 O ASN A 96 -13.326 -5.332 -4.572 1.00 0.00 O ATOM 1513 CB ASN A 96 -12.482 -6.928 -2.314 1.00 0.00 C ATOM 1514 CG ASN A 96 -13.960 -6.630 -2.095 1.00 0.00 C ATOM 1515 OD1 ASN A 96 -14.830 -7.352 -2.561 1.00 0.00 O ATOM 1516 ND2 ASN A 96 -14.267 -5.616 -1.302 1.00 0.00 N ATOM 0 H ASN A 96 -10.245 -7.584 -2.954 1.00 0.00 H new ATOM 0 HA ASN A 96 -12.796 -8.014 -4.187 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -12.191 -7.765 -1.679 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -11.896 -6.067 -1.994 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -15.242 -5.427 -1.071 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -13.528 -5.024 -0.922 1.00 0.00 H new ATOM 1523 N VAL A 97 -11.312 -5.673 -5.466 1.00 0.00 N ATOM 1524 CA VAL A 97 -11.325 -4.518 -6.364 1.00 0.00 C ATOM 1525 C VAL A 97 -10.660 -4.896 -7.693 1.00 0.00 C ATOM 1526 O VAL A 97 -10.008 -5.939 -7.758 1.00 0.00 O ATOM 1527 CB VAL A 97 -10.632 -3.301 -5.714 1.00 0.00 C ATOM 1528 CG1 VAL A 97 -11.445 -2.719 -4.556 1.00 0.00 C ATOM 1529 CG2 VAL A 97 -9.188 -3.581 -5.263 1.00 0.00 C ATOM 0 H VAL A 97 -10.444 -6.206 -5.518 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.358 -4.231 -6.559 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.579 -2.556 -6.508 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.915 -1.866 -4.132 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.420 -2.396 -4.922 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -11.580 -3.480 -3.787 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.765 -2.681 -4.816 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.186 -4.386 -4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.588 -3.874 -6.125 1.00 0.00 H new ATOM 1539 N PRO A 98 -10.822 -4.103 -8.766 1.00 0.00 N ATOM 1540 CA PRO A 98 -10.106 -4.348 -10.008 1.00 0.00 C ATOM 1541 C PRO A 98 -8.598 -4.118 -9.814 1.00 0.00 C ATOM 1542 O PRO A 98 -8.163 -3.484 -8.847 1.00 0.00 O ATOM 1543 CB PRO A 98 -10.696 -3.384 -11.045 1.00 0.00 C ATOM 1544 CG PRO A 98 -11.893 -2.718 -10.361 1.00 0.00 C ATOM 1545 CD PRO A 98 -11.642 -2.908 -8.868 1.00 0.00 C ATOM 0 HA PRO A 98 -10.219 -5.380 -10.340 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.959 -2.642 -11.353 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.006 -3.918 -11.943 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -11.959 -1.661 -10.620 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -12.831 -3.181 -10.667 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -11.132 -2.044 -8.442 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -12.579 -3.026 -8.324 1.00 0.00 H new ATOM 1553 N LEU A 99 -7.807 -4.586 -10.787 1.00 0.00 N ATOM 1554 CA LEU A 99 -6.348 -4.458 -10.806 1.00 0.00 C ATOM 1555 C LEU A 99 -5.894 -2.999 -10.963 1.00 0.00 C ATOM 1556 O LEU A 99 -4.712 -2.730 -10.803 1.00 0.00 O ATOM 1557 CB LEU A 99 -5.736 -5.335 -11.923 1.00 0.00 C ATOM 1558 CG LEU A 99 -5.560 -6.837 -11.647 1.00 0.00 C ATOM 1559 CD1 LEU A 99 -4.340 -7.067 -10.773 1.00 0.00 C ATOM 1560 CD2 LEU A 99 -6.783 -7.525 -11.026 1.00 0.00 C ATOM 0 H LEU A 99 -8.175 -5.076 -11.602 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.985 -4.809 -9.840 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.361 -5.230 -12.810 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.757 -4.924 -12.171 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.428 -7.298 -12.626 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.224 -8.134 -10.583 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.452 -6.690 -11.281 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.466 -6.542 -9.826 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.565 -8.581 -10.868 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.018 -7.056 -10.071 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -7.636 -7.427 -11.698 1.00 0.00 H new ATOM 1572 N LEU A 100 -6.783 -2.056 -11.268 1.00 0.00 N ATOM 1573 CA LEU A 100 -6.517 -0.623 -11.315 1.00 0.00 C ATOM 1574 C LEU A 100 -7.771 0.091 -10.814 1.00 0.00 C ATOM 1575 O LEU A 100 -8.850 -0.510 -10.800 1.00 0.00 O ATOM 1576 CB LEU A 100 -6.091 -0.109 -12.703 1.00 0.00 C ATOM 1577 CG LEU A 100 -7.210 0.033 -13.749 1.00 0.00 C ATOM 1578 CD1 LEU A 100 -6.627 0.585 -15.051 1.00 0.00 C ATOM 1579 CD2 LEU A 100 -7.893 -1.307 -14.031 1.00 0.00 C ATOM 0 H LEU A 100 -7.751 -2.282 -11.499 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.660 -0.409 -10.677 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.615 0.863 -12.577 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.334 -0.785 -13.101 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.957 0.718 -13.348 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.421 0.685 -15.791 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.180 1.561 -14.864 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.865 -0.098 -15.426 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.677 -1.166 -14.775 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.158 -2.018 -14.409 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.331 -1.693 -13.110 1.00 0.00 H new ATOM 1591 N GLY A 101 -7.669 1.367 -10.462 1.00 0.00 N ATOM 1592 CA GLY A 101 -8.819 2.128 -9.989 1.00 0.00 C ATOM 1593 C GLY A 101 -8.363 3.351 -9.220 1.00 0.00 C ATOM 1594 O GLY A 101 -7.221 3.780 -9.362 1.00 0.00 O ATOM 0 H GLY A 101 -6.799 1.898 -10.495 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.435 2.432 -10.835 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.441 1.500 -9.351 1.00 0.00 H new ATOM 1598 N THR A 102 -9.247 3.932 -8.415 1.00 0.00 N ATOM 1599 CA THR A 102 -8.890 5.027 -7.531 1.00 0.00 C ATOM 1600 C THR A 102 -9.124 4.579 -6.091 1.00 0.00 C ATOM 1601 O THR A 102 -9.934 3.690 -5.811 1.00 0.00 O ATOM 1602 CB THR A 102 -9.632 6.320 -7.922 1.00 0.00 C ATOM 1603 OG1 THR A 102 -11.033 6.149 -7.899 1.00 0.00 O ATOM 1604 CG2 THR A 102 -9.240 6.795 -9.329 1.00 0.00 C ATOM 0 H THR A 102 -10.227 3.655 -8.360 1.00 0.00 H new ATOM 0 HA THR A 102 -7.834 5.277 -7.628 1.00 0.00 H new ATOM 0 HB THR A 102 -9.339 7.065 -7.182 1.00 0.00 H new ATOM 0 HG1 THR A 102 -11.431 6.790 -7.273 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.784 7.709 -9.569 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.168 6.991 -9.361 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.490 6.023 -10.056 1.00 0.00 H new ATOM 1612 N VAL A 103 -8.351 5.150 -5.175 1.00 0.00 N ATOM 1613 CA VAL A 103 -8.475 4.932 -3.747 1.00 0.00 C ATOM 1614 C VAL A 103 -9.478 5.986 -3.248 1.00 0.00 C ATOM 1615 O VAL A 103 -9.150 7.176 -3.286 1.00 0.00 O ATOM 1616 CB VAL A 103 -7.085 5.069 -3.085 1.00 0.00 C ATOM 1617 CG1 VAL A 103 -7.175 4.692 -1.606 1.00 0.00 C ATOM 1618 CG2 VAL A 103 -6.010 4.180 -3.734 1.00 0.00 C ATOM 0 H VAL A 103 -7.600 5.796 -5.417 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.834 3.934 -3.496 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.789 6.110 -3.219 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.192 4.791 -1.145 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.880 5.355 -1.104 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.517 3.661 -1.513 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.059 4.325 -3.221 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.308 3.134 -3.657 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.900 4.450 -4.784 1.00 0.00 H new ATOM 1628 N PRO A 104 -10.677 5.607 -2.768 1.00 0.00 N ATOM 1629 CA PRO A 104 -11.684 6.579 -2.359 1.00 0.00 C ATOM 1630 C PRO A 104 -11.332 7.202 -1.027 1.00 0.00 C ATOM 1631 O PRO A 104 -10.713 6.565 -0.195 1.00 0.00 O ATOM 1632 CB PRO A 104 -13.011 5.823 -2.351 1.00 0.00 C ATOM 1633 CG PRO A 104 -12.565 4.405 -1.992 1.00 0.00 C ATOM 1634 CD PRO A 104 -11.220 4.262 -2.701 1.00 0.00 C ATOM 0 HA PRO A 104 -11.746 7.425 -3.043 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -13.708 6.230 -1.618 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -13.509 5.861 -3.320 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -12.466 4.277 -0.914 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -13.282 3.660 -2.337 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.555 3.596 -2.151 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -11.344 3.838 -3.697 1.00 0.00 H new ATOM 1642 N HIS A 105 -11.806 8.410 -0.733 1.00 0.00 N ATOM 1643 CA HIS A 105 -11.372 9.127 0.477 1.00 0.00 C ATOM 1644 C HIS A 105 -11.973 8.574 1.766 1.00 0.00 C ATOM 1645 O HIS A 105 -11.746 9.114 2.846 1.00 0.00 O ATOM 1646 CB HIS A 105 -11.815 10.575 0.434 1.00 0.00 C ATOM 1647 CG HIS A 105 -11.734 11.166 -0.924 1.00 0.00 C ATOM 1648 ND1 HIS A 105 -12.795 11.287 -1.773 1.00 0.00 N flip ATOM 1649 CD2 HIS A 105 -10.643 11.718 -1.513 1.00 0.00 C flip ATOM 1650 CE1 HIS A 105 -12.374 12.030 -2.864 1.00 0.00 C flip ATOM 1651 NE2 HIS A 105 -11.058 12.202 -2.682 1.00 0.00 N flip ATOM 0 H HIS A 105 -12.484 8.914 -1.305 1.00 0.00 H new ATOM 0 HA HIS A 105 -10.288 9.010 0.483 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -12.841 10.646 0.794 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -11.197 11.159 1.116 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -13.728 10.901 -1.631 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -9.640 11.757 -1.114 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -12.977 12.392 -3.684 1.00 0.00 H new ATOM 1659 N LYS A 106 -12.902 7.637 1.632 1.00 0.00 N ATOM 1660 CA LYS A 106 -13.669 7.069 2.707 1.00 0.00 C ATOM 1661 C LYS A 106 -13.294 5.590 2.755 1.00 0.00 C ATOM 1662 O LYS A 106 -13.433 4.911 1.734 1.00 0.00 O ATOM 1663 CB LYS A 106 -15.159 7.427 2.532 1.00 0.00 C ATOM 1664 CG LYS A 106 -15.421 8.949 2.706 1.00 0.00 C ATOM 1665 CD LYS A 106 -15.371 9.824 1.427 1.00 0.00 C ATOM 1666 CE LYS A 106 -15.238 11.330 1.782 1.00 0.00 C ATOM 1667 NZ LYS A 106 -14.870 12.217 0.638 1.00 0.00 N ATOM 0 H LYS A 106 -13.145 7.241 0.724 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.447 7.475 3.694 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.493 7.113 1.543 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -15.752 6.872 3.259 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -16.403 9.073 3.163 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -14.689 9.340 3.412 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -14.529 9.518 0.807 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -16.275 9.665 0.839 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -16.184 11.674 2.200 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -14.486 11.439 2.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -13.859 12.456 0.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -15.059 11.724 -0.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -15.435 13.089 0.679 1.00 0.00 H new ATOM 1681 N ALA A 107 -12.806 5.139 3.915 1.00 0.00 N ATOM 1682 CA ALA A 107 -12.254 3.815 4.183 1.00 0.00 C ATOM 1683 C ALA A 107 -13.034 2.723 3.466 1.00 0.00 C ATOM 1684 O ALA A 107 -14.190 2.458 3.796 1.00 0.00 O ATOM 1685 CB ALA A 107 -12.204 3.559 5.695 1.00 0.00 C ATOM 0 H ALA A 107 -12.787 5.732 4.745 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.237 3.788 3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.790 2.568 5.883 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.575 4.311 6.171 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.211 3.616 6.107 1.00 0.00 H new ATOM 1691 N SER A 108 -12.387 2.110 2.478 1.00 0.00 N ATOM 1692 CA SER A 108 -12.926 0.994 1.725 1.00 0.00 C ATOM 1693 C SER A 108 -12.002 -0.197 1.947 1.00 0.00 C ATOM 1694 O SER A 108 -10.782 -0.043 2.044 1.00 0.00 O ATOM 1695 CB SER A 108 -13.079 1.389 0.262 1.00 0.00 C ATOM 1696 OG SER A 108 -13.971 2.486 0.158 1.00 0.00 O ATOM 0 H SER A 108 -11.453 2.386 2.176 1.00 0.00 H new ATOM 0 HA SER A 108 -13.924 0.713 2.061 1.00 0.00 H new ATOM 0 HB2 SER A 108 -12.109 1.655 -0.157 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.455 0.545 -0.316 1.00 0.00 H new ATOM 0 HG SER A 108 -13.599 3.257 0.636 1.00 0.00 H new ATOM 1702 N VAL A 109 -12.607 -1.379 2.005 1.00 0.00 N ATOM 1703 CA VAL A 109 -11.953 -2.630 2.348 1.00 0.00 C ATOM 1704 C VAL A 109 -11.637 -3.452 1.099 1.00 0.00 C ATOM 1705 O VAL A 109 -12.535 -3.863 0.355 1.00 0.00 O ATOM 1706 CB VAL A 109 -12.842 -3.415 3.340 1.00 0.00 C ATOM 1707 CG1 VAL A 109 -12.081 -4.608 3.927 1.00 0.00 C ATOM 1708 CG2 VAL A 109 -13.357 -2.550 4.508 1.00 0.00 C ATOM 0 H VAL A 109 -13.601 -1.493 1.807 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.998 -2.415 2.828 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.700 -3.752 2.759 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -12.727 -5.145 4.622 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.778 -5.278 3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -11.197 -4.251 4.455 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.974 -3.160 5.168 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.510 -2.153 5.068 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -13.951 -1.725 4.115 1.00 0.00 H new ATOM 1718 N VAL A 110 -10.352 -3.687 0.860 1.00 0.00 N ATOM 1719 CA VAL A 110 -9.866 -4.555 -0.187 1.00 0.00 C ATOM 1720 C VAL A 110 -9.568 -5.876 0.519 1.00 0.00 C ATOM 1721 O VAL A 110 -8.549 -6.018 1.198 1.00 0.00 O ATOM 1722 CB VAL A 110 -8.603 -3.949 -0.838 1.00 0.00 C ATOM 1723 CG1 VAL A 110 -7.983 -4.915 -1.862 1.00 0.00 C ATOM 1724 CG2 VAL A 110 -8.942 -2.625 -1.534 1.00 0.00 C ATOM 0 H VAL A 110 -9.604 -3.263 1.409 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.582 -4.691 -0.998 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.879 -3.770 -0.043 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.096 -4.459 -2.302 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.704 -5.844 -1.364 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.709 -5.128 -2.647 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -8.041 -2.211 -1.987 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.689 -2.802 -2.307 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.337 -1.920 -0.802 1.00 0.00 H new ATOM 1734 N GLN A 111 -10.445 -6.866 0.364 1.00 0.00 N ATOM 1735 CA GLN A 111 -10.145 -8.185 0.888 1.00 0.00 C ATOM 1736 C GLN A 111 -9.183 -8.799 -0.125 1.00 0.00 C ATOM 1737 O GLN A 111 -9.453 -8.727 -1.329 1.00 0.00 O ATOM 1738 CB GLN A 111 -11.407 -9.044 1.090 1.00 0.00 C ATOM 1739 CG GLN A 111 -10.985 -10.448 1.555 1.00 0.00 C ATOM 1740 CD GLN A 111 -12.086 -11.281 2.199 1.00 0.00 C ATOM 1741 OE1 GLN A 111 -12.448 -12.343 1.698 1.00 0.00 O ATOM 1742 NE2 GLN A 111 -12.545 -10.889 3.374 1.00 0.00 N ATOM 0 H GLN A 111 -11.345 -6.779 -0.108 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.704 -8.128 1.883 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.062 -8.583 1.829 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -11.972 -9.109 0.160 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.594 -10.994 0.697 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.166 -10.346 2.267 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -12.233 -10.004 3.774 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -13.211 -11.471 3.881 1.00 0.00 H new ATOM 1751 N VAL A 112 -8.071 -9.357 0.350 1.00 0.00 N ATOM 1752 CA VAL A 112 -7.141 -10.097 -0.482 1.00 0.00 C ATOM 1753 C VAL A 112 -7.480 -11.539 -0.115 1.00 0.00 C ATOM 1754 O VAL A 112 -7.298 -11.927 1.042 1.00 0.00 O ATOM 1755 CB VAL A 112 -5.659 -9.758 -0.189 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.804 -10.138 -1.407 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -5.423 -8.270 0.124 1.00 0.00 C ATOM 0 H VAL A 112 -7.794 -9.305 1.330 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.240 -9.869 -1.543 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.378 -10.327 0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.759 -9.901 -1.206 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.903 -11.206 -1.602 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.142 -9.577 -2.278 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.364 -8.103 0.319 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.735 -7.665 -0.728 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -6.003 -7.986 1.002 1.00 0.00 H new ATOM 1767 N GLY A 113 -8.022 -12.310 -1.052 1.00 0.00 N ATOM 1768 CA GLY A 113 -8.334 -13.707 -0.903 1.00 0.00 C ATOM 1769 C GLY A 113 -7.200 -14.521 -1.490 1.00 0.00 C ATOM 1770 O GLY A 113 -6.565 -14.075 -2.444 1.00 0.00 O ATOM 0 H GLY A 113 -8.263 -11.950 -1.976 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.471 -13.954 0.150 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.270 -13.942 -1.410 1.00 0.00 H new ATOM 1774 N PHE A 114 -6.954 -15.721 -0.972 1.00 0.00 N ATOM 1775 CA PHE A 114 -5.821 -16.535 -1.372 1.00 0.00 C ATOM 1776 C PHE A 114 -6.294 -17.980 -1.630 1.00 0.00 C ATOM 1777 O PHE A 114 -6.023 -18.873 -0.810 1.00 0.00 O ATOM 1778 CB PHE A 114 -4.744 -16.480 -0.261 1.00 0.00 C ATOM 1779 CG PHE A 114 -4.515 -15.151 0.436 1.00 0.00 C ATOM 1780 CD1 PHE A 114 -4.117 -14.014 -0.287 1.00 0.00 C ATOM 1781 CD2 PHE A 114 -4.654 -15.070 1.836 1.00 0.00 C ATOM 1782 CE1 PHE A 114 -3.850 -12.812 0.393 1.00 0.00 C ATOM 1783 CE2 PHE A 114 -4.390 -13.865 2.507 1.00 0.00 C ATOM 1784 CZ PHE A 114 -4.005 -12.724 1.785 1.00 0.00 C ATOM 0 H PHE A 114 -7.541 -16.154 -0.259 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.383 -16.154 -2.295 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -5.008 -17.216 0.499 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.797 -16.798 -0.697 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.016 -14.063 -1.361 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -4.965 -15.939 2.396 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.522 -11.946 -0.163 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -4.483 -13.816 3.582 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.830 -11.789 2.296 1.00 0.00 H new ATOM 1794 N PRO A 115 -7.002 -18.253 -2.738 1.00 0.00 N ATOM 1795 CA PRO A 115 -7.370 -19.609 -3.121 1.00 0.00 C ATOM 1796 C PRO A 115 -6.108 -20.428 -3.417 1.00 0.00 C ATOM 1797 O PRO A 115 -5.332 -20.082 -4.314 1.00 0.00 O ATOM 1798 CB PRO A 115 -8.292 -19.472 -4.341 1.00 0.00 C ATOM 1799 CG PRO A 115 -7.976 -18.082 -4.893 1.00 0.00 C ATOM 1800 CD PRO A 115 -7.645 -17.297 -3.627 1.00 0.00 C ATOM 0 HA PRO A 115 -7.891 -20.142 -2.326 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -8.094 -20.249 -5.080 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -9.341 -19.560 -4.060 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -7.138 -18.102 -5.590 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -8.824 -17.654 -5.427 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -6.984 -16.458 -3.846 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.546 -16.883 -3.174 1.00 0.00 H new ATOM 1808 N CYS A 116 -5.881 -21.482 -2.621 1.00 0.00 N ATOM 1809 CA CYS A 116 -4.805 -22.439 -2.850 1.00 0.00 C ATOM 1810 C CYS A 116 -5.365 -23.554 -3.720 1.00 0.00 C ATOM 1811 O CYS A 116 -6.528 -23.919 -3.550 1.00 0.00 O ATOM 1812 CB CYS A 116 -4.250 -23.027 -1.544 1.00 0.00 C ATOM 1813 SG CYS A 116 -2.609 -23.748 -1.787 1.00 0.00 S ATOM 0 H CYS A 116 -6.445 -21.690 -1.797 1.00 0.00 H new ATOM 0 HA CYS A 116 -3.974 -21.927 -3.335 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -4.197 -22.246 -0.786 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -4.932 -23.790 -1.168 1.00 0.00 H new ATOM 1818 N LEU A 117 -4.543 -24.133 -4.597 1.00 0.00 N ATOM 1819 CA LEU A 117 -5.013 -25.170 -5.512 1.00 0.00 C ATOM 1820 C LEU A 117 -5.235 -26.503 -4.781 1.00 0.00 C ATOM 1821 O LEU A 117 -5.813 -27.421 -5.353 1.00 0.00 O ATOM 1822 CB LEU A 117 -4.089 -25.326 -6.734 1.00 0.00 C ATOM 1823 CG LEU A 117 -3.736 -24.046 -7.537 1.00 0.00 C ATOM 1824 CD1 LEU A 117 -3.442 -24.422 -8.989 1.00 0.00 C ATOM 1825 CD2 LEU A 117 -4.753 -22.896 -7.531 1.00 0.00 C ATOM 0 H LEU A 117 -3.554 -23.902 -4.692 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.981 -24.848 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.157 -25.777 -6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.555 -26.034 -7.419 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.872 -23.647 -7.006 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.194 -23.524 -9.554 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.602 -25.115 -9.022 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.321 -24.895 -9.427 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.372 -22.070 -8.132 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.698 -23.244 -7.949 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.912 -22.556 -6.508 1.00 0.00 H new ATOM 1837 N GLY A 118 -4.753 -26.625 -3.539 1.00 0.00 N ATOM 1838 CA GLY A 118 -4.961 -27.734 -2.622 1.00 0.00 C ATOM 1839 C GLY A 118 -4.529 -29.108 -3.109 1.00 0.00 C ATOM 1840 O GLY A 118 -5.047 -30.096 -2.607 1.00 0.00 O ATOM 0 H GLY A 118 -4.168 -25.898 -3.127 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.427 -27.517 -1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.022 -27.778 -2.375 1.00 0.00 H new ATOM 1844 N LYS A 119 -3.625 -29.216 -4.086 1.00 0.00 N ATOM 1845 CA LYS A 119 -3.085 -30.518 -4.507 1.00 0.00 C ATOM 1846 C LYS A 119 -1.694 -30.822 -3.979 1.00 0.00 C ATOM 1847 O LYS A 119 -1.457 -31.971 -3.627 1.00 0.00 O ATOM 1848 CB LYS A 119 -3.299 -30.846 -5.984 1.00 0.00 C ATOM 1849 CG LYS A 119 -4.713 -31.409 -6.227 1.00 0.00 C ATOM 1850 CD LYS A 119 -5.924 -30.484 -6.036 1.00 0.00 C ATOM 1851 CE LYS A 119 -7.251 -31.238 -6.200 1.00 0.00 C ATOM 1852 NZ LYS A 119 -7.504 -32.187 -5.095 1.00 0.00 N ATOM 0 H LYS A 119 -3.250 -28.420 -4.602 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.716 -31.244 -3.994 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.154 -29.948 -6.584 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.554 -31.572 -6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.746 -31.788 -7.249 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.845 -32.265 -5.565 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.883 -30.032 -5.045 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.877 -29.670 -6.759 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.069 -30.520 -6.252 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.242 -31.780 -7.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.358 -32.742 -5.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.691 -32.827 -4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.641 -31.660 -4.209 1.00 0.00 H new ATOM 1866 N GLN A 120 -0.778 -29.856 -3.952 1.00 0.00 N ATOM 1867 CA GLN A 120 0.527 -30.056 -3.331 1.00 0.00 C ATOM 1868 C GLN A 120 0.475 -29.504 -1.906 1.00 0.00 C ATOM 1869 O GLN A 120 -0.166 -28.483 -1.645 1.00 0.00 O ATOM 1870 CB GLN A 120 1.612 -29.390 -4.184 1.00 0.00 C ATOM 1871 CG GLN A 120 3.073 -29.653 -3.774 1.00 0.00 C ATOM 1872 CD GLN A 120 3.392 -31.118 -3.497 1.00 0.00 C ATOM 1873 OE1 GLN A 120 3.393 -31.949 -4.394 1.00 0.00 O ATOM 1874 NE2 GLN A 120 3.668 -31.456 -2.246 1.00 0.00 N ATOM 0 H GLN A 120 -0.916 -28.928 -4.353 1.00 0.00 H new ATOM 0 HA GLN A 120 0.777 -31.115 -3.274 1.00 0.00 H new ATOM 0 HB2 GLN A 120 1.484 -29.719 -5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 120 1.443 -28.313 -4.169 1.00 0.00 H new ATOM 0 HG2 GLN A 120 3.731 -29.293 -4.565 1.00 0.00 H new ATOM 0 HG3 GLN A 120 3.299 -29.069 -2.882 1.00 0.00 H new ATOM 0 HE21 GLN A 120 3.662 -30.747 -1.513 1.00 0.00 H new ATOM 0 HE22 GLN A 120 3.887 -32.425 -2.016 1.00 0.00 H new ATOM 1883 N ASP A 121 1.206 -30.158 -1.012 1.00 0.00 N ATOM 1884 CA ASP A 121 1.413 -29.749 0.378 1.00 0.00 C ATOM 1885 C ASP A 121 2.711 -28.946 0.442 1.00 0.00 C ATOM 1886 O ASP A 121 3.638 -29.231 -0.328 1.00 0.00 O ATOM 1887 CB ASP A 121 1.595 -30.942 1.335 1.00 0.00 C ATOM 1888 CG ASP A 121 0.487 -31.981 1.276 1.00 0.00 C ATOM 1889 OD1 ASP A 121 0.579 -32.867 0.403 1.00 0.00 O ATOM 1890 OD2 ASP A 121 -0.439 -31.875 2.110 1.00 0.00 O ATOM 0 H ASP A 121 1.693 -31.024 -1.242 1.00 0.00 H new ATOM 0 HA ASP A 121 0.531 -29.185 0.684 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.543 -31.429 1.109 1.00 0.00 H new ATOM 0 HB3 ASP A 121 1.666 -30.564 2.355 1.00 0.00 H new ATOM 1895 N GLY A 122 2.842 -28.019 1.395 1.00 0.00 N ATOM 1896 CA GLY A 122 4.073 -27.264 1.622 1.00 0.00 C ATOM 1897 C GLY A 122 3.769 -25.799 1.894 1.00 0.00 C ATOM 1898 O GLY A 122 2.704 -25.461 2.410 1.00 0.00 O ATOM 0 H GLY A 122 2.088 -27.771 2.036 1.00 0.00 H new ATOM 0 HA2 GLY A 122 4.615 -27.690 2.466 1.00 0.00 H new ATOM 0 HA3 GLY A 122 4.722 -27.349 0.751 1.00 0.00 H new ATOM 1902 N VAL A 123 4.719 -24.920 1.571 1.00 0.00 N ATOM 1903 CA VAL A 123 4.565 -23.478 1.724 1.00 0.00 C ATOM 1904 C VAL A 123 4.906 -22.804 0.395 1.00 0.00 C ATOM 1905 O VAL A 123 6.049 -22.870 -0.055 1.00 0.00 O ATOM 1906 CB VAL A 123 5.431 -22.937 2.887 1.00 0.00 C ATOM 1907 CG1 VAL A 123 5.084 -21.469 3.187 1.00 0.00 C ATOM 1908 CG2 VAL A 123 5.266 -23.735 4.190 1.00 0.00 C ATOM 0 H VAL A 123 5.625 -25.195 1.192 1.00 0.00 H new ATOM 0 HA VAL A 123 3.532 -23.247 1.983 1.00 0.00 H new ATOM 0 HB VAL A 123 6.463 -23.036 2.550 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.704 -21.109 4.008 1.00 0.00 H new ATOM 0 HG12 VAL A 123 5.268 -20.863 2.300 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.033 -21.393 3.466 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.900 -23.303 4.964 1.00 0.00 H new ATOM 0 HG22 VAL A 123 4.225 -23.697 4.511 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.555 -24.772 4.021 1.00 0.00 H new ATOM 1918 N ALA A 124 3.905 -22.185 -0.230 1.00 0.00 N ATOM 1919 CA ALA A 124 4.054 -21.381 -1.432 1.00 0.00 C ATOM 1920 C ALA A 124 4.393 -19.949 -1.041 1.00 0.00 C ATOM 1921 O ALA A 124 4.312 -19.565 0.127 1.00 0.00 O ATOM 1922 CB ALA A 124 2.742 -21.344 -2.233 1.00 0.00 C ATOM 0 H ALA A 124 2.941 -22.234 0.100 1.00 0.00 H new ATOM 0 HA ALA A 124 4.844 -21.824 -2.038 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.879 -20.736 -3.128 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.463 -22.357 -2.522 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.952 -20.912 -1.618 1.00 0.00 H new ATOM 1928 N ALA A 125 4.691 -19.141 -2.053 1.00 0.00 N ATOM 1929 CA ALA A 125 4.916 -17.710 -1.973 1.00 0.00 C ATOM 1930 C ALA A 125 4.012 -17.067 -3.024 1.00 0.00 C ATOM 1931 O ALA A 125 3.747 -17.691 -4.055 1.00 0.00 O ATOM 1932 CB ALA A 125 6.391 -17.402 -2.244 1.00 0.00 C ATOM 0 H ALA A 125 4.787 -19.493 -3.006 1.00 0.00 H new ATOM 0 HA ALA A 125 4.683 -17.318 -0.983 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.555 -16.326 -2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 125 7.010 -17.906 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.659 -17.754 -3.240 1.00 0.00 H new ATOM 1938 N PHE A 126 3.556 -15.838 -2.801 1.00 0.00 N ATOM 1939 CA PHE A 126 2.798 -15.073 -3.782 1.00 0.00 C ATOM 1940 C PHE A 126 3.116 -13.589 -3.603 1.00 0.00 C ATOM 1941 O PHE A 126 3.517 -13.170 -2.514 1.00 0.00 O ATOM 1942 CB PHE A 126 1.300 -15.411 -3.705 1.00 0.00 C ATOM 1943 CG PHE A 126 0.540 -14.944 -2.484 1.00 0.00 C ATOM 1944 CD1 PHE A 126 -0.019 -13.654 -2.479 1.00 0.00 C ATOM 1945 CD2 PHE A 126 0.313 -15.813 -1.400 1.00 0.00 C ATOM 1946 CE1 PHE A 126 -0.796 -13.230 -1.392 1.00 0.00 C ATOM 1947 CE2 PHE A 126 -0.459 -15.383 -0.306 1.00 0.00 C ATOM 1948 CZ PHE A 126 -0.998 -14.084 -0.297 1.00 0.00 C ATOM 0 H PHE A 126 3.705 -15.341 -1.923 1.00 0.00 H new ATOM 0 HA PHE A 126 3.094 -15.345 -4.795 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.814 -14.989 -4.585 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.196 -16.494 -3.772 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.150 -12.989 -3.313 1.00 0.00 H new ATOM 0 HD2 PHE A 126 0.731 -16.809 -1.409 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -1.240 -12.245 -1.397 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.638 -16.049 0.525 1.00 0.00 H new ATOM 0 HZ PHE A 126 -1.568 -13.743 0.554 1.00 0.00 H new ATOM 1958 N GLU A 127 2.966 -12.807 -4.669 1.00 0.00 N ATOM 1959 CA GLU A 127 3.329 -11.404 -4.750 1.00 0.00 C ATOM 1960 C GLU A 127 2.079 -10.542 -4.907 1.00 0.00 C ATOM 1961 O GLU A 127 1.149 -10.941 -5.620 1.00 0.00 O ATOM 1962 CB GLU A 127 4.273 -11.190 -5.955 1.00 0.00 C ATOM 1963 CG GLU A 127 3.776 -11.753 -7.307 1.00 0.00 C ATOM 1964 CD GLU A 127 4.552 -11.272 -8.542 1.00 0.00 C ATOM 1965 OE1 GLU A 127 5.230 -10.223 -8.495 1.00 0.00 O ATOM 1966 OE2 GLU A 127 4.358 -11.859 -9.631 1.00 0.00 O ATOM 0 H GLU A 127 2.568 -13.157 -5.540 1.00 0.00 H new ATOM 0 HA GLU A 127 3.838 -11.111 -3.832 1.00 0.00 H new ATOM 0 HB2 GLU A 127 4.447 -10.120 -6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.235 -11.647 -5.724 1.00 0.00 H new ATOM 0 HG2 GLU A 127 3.824 -12.841 -7.269 1.00 0.00 H new ATOM 0 HG3 GLU A 127 2.727 -11.485 -7.430 1.00 0.00 H new ATOM 1973 N VAL A 128 2.062 -9.378 -4.245 1.00 0.00 N ATOM 1974 CA VAL A 128 1.025 -8.361 -4.380 1.00 0.00 C ATOM 1975 C VAL A 128 1.769 -7.037 -4.193 1.00 0.00 C ATOM 1976 O VAL A 128 2.257 -6.785 -3.098 1.00 0.00 O ATOM 1977 CB VAL A 128 -0.117 -8.520 -3.351 1.00 0.00 C ATOM 1978 CG1 VAL A 128 -1.178 -7.425 -3.545 1.00 0.00 C ATOM 1979 CG2 VAL A 128 -0.825 -9.882 -3.439 1.00 0.00 C ATOM 0 H VAL A 128 2.792 -9.116 -3.583 1.00 0.00 H new ATOM 0 HA VAL A 128 0.523 -8.432 -5.345 1.00 0.00 H new ATOM 0 HB VAL A 128 0.357 -8.439 -2.373 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.973 -7.555 -2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.718 -6.446 -3.413 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -1.596 -7.497 -4.549 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.616 -9.930 -2.691 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -1.257 -10.004 -4.432 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -0.104 -10.679 -3.257 1.00 0.00 H new ATOM 1989 N ASP A 129 1.869 -6.197 -5.221 1.00 0.00 N ATOM 1990 CA ASP A 129 2.644 -4.951 -5.197 1.00 0.00 C ATOM 1991 C ASP A 129 1.865 -3.943 -6.031 1.00 0.00 C ATOM 1992 O ASP A 129 1.324 -4.320 -7.073 1.00 0.00 O ATOM 1993 CB ASP A 129 4.053 -5.178 -5.756 1.00 0.00 C ATOM 1994 CG ASP A 129 4.961 -3.994 -5.444 1.00 0.00 C ATOM 1995 OD1 ASP A 129 5.543 -3.993 -4.338 1.00 0.00 O ATOM 1996 OD2 ASP A 129 5.113 -3.116 -6.320 1.00 0.00 O ATOM 0 H ASP A 129 1.405 -6.364 -6.114 1.00 0.00 H new ATOM 0 HA ASP A 129 2.776 -4.584 -4.179 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.476 -6.087 -5.329 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.001 -5.327 -6.835 1.00 0.00 H new ATOM 2001 N VAL A 130 1.752 -2.690 -5.589 1.00 0.00 N ATOM 2002 CA VAL A 130 0.910 -1.694 -6.241 1.00 0.00 C ATOM 2003 C VAL A 130 1.646 -0.367 -6.331 1.00 0.00 C ATOM 2004 O VAL A 130 2.440 -0.004 -5.460 1.00 0.00 O ATOM 2005 CB VAL A 130 -0.408 -1.582 -5.433 1.00 0.00 C ATOM 2006 CG1 VAL A 130 -1.493 -0.689 -6.042 1.00 0.00 C ATOM 2007 CG2 VAL A 130 -1.057 -2.959 -5.299 1.00 0.00 C ATOM 0 H VAL A 130 2.244 -2.339 -4.767 1.00 0.00 H new ATOM 0 HA VAL A 130 0.672 -1.989 -7.263 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.087 -1.139 -4.490 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.368 -0.686 -5.392 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.113 0.327 -6.144 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.771 -1.072 -7.024 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.982 -2.871 -4.730 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -1.277 -3.356 -6.290 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.375 -3.634 -4.781 1.00 0.00 H new ATOM 2017 N ILE A 131 1.351 0.390 -7.371 1.00 0.00 N ATOM 2018 CA ILE A 131 1.844 1.733 -7.562 1.00 0.00 C ATOM 2019 C ILE A 131 0.634 2.653 -7.525 1.00 0.00 C ATOM 2020 O ILE A 131 -0.516 2.233 -7.676 1.00 0.00 O ATOM 2021 CB ILE A 131 2.701 1.861 -8.835 1.00 0.00 C ATOM 2022 CG1 ILE A 131 1.888 1.685 -10.129 1.00 0.00 C ATOM 2023 CG2 ILE A 131 3.932 0.942 -8.759 1.00 0.00 C ATOM 2024 CD1 ILE A 131 1.664 0.212 -10.546 1.00 0.00 C ATOM 0 H ILE A 131 0.743 0.074 -8.127 1.00 0.00 H new ATOM 0 HA ILE A 131 2.533 2.020 -6.768 1.00 0.00 H new ATOM 0 HB ILE A 131 3.068 2.886 -8.880 1.00 0.00 H new ATOM 0 HG12 ILE A 131 0.918 2.166 -10.003 1.00 0.00 H new ATOM 0 HG13 ILE A 131 2.399 2.206 -10.939 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.523 1.049 -9.669 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.540 1.218 -7.897 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.607 -0.093 -8.657 1.00 0.00 H new ATOM 0 HD11 ILE A 131 1.083 0.179 -11.467 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.628 -0.271 -10.708 1.00 0.00 H new ATOM 0 HD13 ILE A 131 1.124 -0.311 -9.757 1.00 0.00 H new ATOM 2036 N VAL A 132 0.907 3.926 -7.325 1.00 0.00 N ATOM 2037 CA VAL A 132 -0.090 4.944 -7.127 1.00 0.00 C ATOM 2038 C VAL A 132 0.358 6.167 -7.902 1.00 0.00 C ATOM 2039 O VAL A 132 1.524 6.576 -7.879 1.00 0.00 O ATOM 2040 CB VAL A 132 -0.284 5.180 -5.618 1.00 0.00 C ATOM 2041 CG1 VAL A 132 -0.913 6.542 -5.321 1.00 0.00 C ATOM 2042 CG2 VAL A 132 -1.148 4.080 -4.983 1.00 0.00 C ATOM 0 H VAL A 132 1.861 4.286 -7.296 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.072 4.657 -7.504 1.00 0.00 H new ATOM 0 HB VAL A 132 0.714 5.155 -5.180 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -1.030 6.662 -4.244 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.269 7.332 -5.706 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -1.890 6.604 -5.801 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.264 4.278 -3.918 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.129 4.067 -5.459 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.665 3.113 -5.121 1.00 0.00 H new ATOM 2052 N MET A 133 -0.606 6.754 -8.588 1.00 0.00 N ATOM 2053 CA MET A 133 -0.449 7.920 -9.425 1.00 0.00 C ATOM 2054 C MET A 133 -1.607 8.856 -9.121 1.00 0.00 C ATOM 2055 O MET A 133 -2.454 8.563 -8.278 1.00 0.00 O ATOM 2056 CB MET A 133 -0.500 7.514 -10.914 1.00 0.00 C ATOM 2057 CG MET A 133 0.411 6.343 -11.317 1.00 0.00 C ATOM 2058 SD MET A 133 -0.429 4.906 -12.036 1.00 0.00 S ATOM 2059 CE MET A 133 -1.710 4.554 -10.800 1.00 0.00 C ATOM 0 H MET A 133 -1.566 6.410 -8.573 1.00 0.00 H new ATOM 0 HA MET A 133 0.509 8.402 -9.229 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.528 7.254 -11.166 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.234 8.382 -11.518 1.00 0.00 H new ATOM 0 HG2 MET A 133 1.146 6.708 -12.035 1.00 0.00 H new ATOM 0 HG3 MET A 133 0.962 6.015 -10.436 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.240 3.642 -11.075 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.246 4.424 -9.822 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.415 5.385 -10.760 1.00 0.00 H new ATOM 2069 N ASN A 134 -1.605 10.035 -9.720 1.00 0.00 N ATOM 2070 CA ASN A 134 -2.740 10.940 -9.623 1.00 0.00 C ATOM 2071 C ASN A 134 -3.589 10.598 -10.868 1.00 0.00 C ATOM 2072 O ASN A 134 -3.192 9.761 -11.685 1.00 0.00 O ATOM 2073 CB ASN A 134 -2.293 12.407 -9.516 1.00 0.00 C ATOM 2074 CG ASN A 134 -1.674 12.976 -10.790 1.00 0.00 C ATOM 2075 OD1 ASN A 134 -1.509 12.286 -11.789 1.00 0.00 O ATOM 2076 ND2 ASN A 134 -1.351 14.255 -10.778 1.00 0.00 N ATOM 0 H ASN A 134 -0.829 10.389 -10.280 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.330 10.815 -8.715 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -3.154 13.017 -9.242 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -1.570 12.495 -8.705 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.955 14.689 -11.612 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -1.497 14.810 -9.935 1.00 0.00 H new ATOM 2083 N SER A 135 -4.763 11.202 -11.049 1.00 0.00 N ATOM 2084 CA SER A 135 -5.619 10.869 -12.194 1.00 0.00 C ATOM 2085 C SER A 135 -5.004 11.263 -13.557 1.00 0.00 C ATOM 2086 O SER A 135 -5.641 10.996 -14.575 1.00 0.00 O ATOM 2087 CB SER A 135 -6.995 11.519 -11.995 1.00 0.00 C ATOM 2088 OG SER A 135 -7.937 10.993 -12.905 1.00 0.00 O ATOM 0 H SER A 135 -5.142 11.916 -10.428 1.00 0.00 H new ATOM 0 HA SER A 135 -5.720 9.784 -12.228 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.337 11.351 -10.974 1.00 0.00 H new ATOM 0 HB3 SER A 135 -6.915 12.598 -12.131 1.00 0.00 H new ATOM 0 HG SER A 135 -7.499 10.817 -13.764 1.00 0.00 H new ATOM 2094 N GLU A 136 -3.836 11.920 -13.617 1.00 0.00 N ATOM 2095 CA GLU A 136 -3.132 12.208 -14.865 1.00 0.00 C ATOM 2096 C GLU A 136 -2.240 11.022 -15.263 1.00 0.00 C ATOM 2097 O GLU A 136 -1.768 10.963 -16.397 1.00 0.00 O ATOM 2098 CB GLU A 136 -2.210 13.434 -14.731 1.00 0.00 C ATOM 2099 CG GLU A 136 -2.830 14.692 -14.104 1.00 0.00 C ATOM 2100 CD GLU A 136 -1.760 15.771 -13.894 1.00 0.00 C ATOM 2101 OE1 GLU A 136 -0.776 15.476 -13.170 1.00 0.00 O ATOM 2102 OE2 GLU A 136 -1.929 16.885 -14.433 1.00 0.00 O ATOM 0 H GLU A 136 -3.353 12.268 -12.789 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.900 12.398 -15.615 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.344 13.146 -14.134 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.841 13.694 -15.723 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.620 15.076 -14.750 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.293 14.440 -13.150 1.00 0.00 H new ATOM 2109 N GLY A 137 -1.981 10.094 -14.334 1.00 0.00 N ATOM 2110 CA GLY A 137 -1.056 8.985 -14.506 1.00 0.00 C ATOM 2111 C GLY A 137 0.342 9.317 -13.974 1.00 0.00 C ATOM 2112 O GLY A 137 1.219 8.455 -14.010 1.00 0.00 O ATOM 0 H GLY A 137 -2.427 10.101 -13.417 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.442 8.107 -13.988 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.990 8.728 -15.563 1.00 0.00 H new ATOM 2116 N ASN A 138 0.576 10.527 -13.444 1.00 0.00 N ATOM 2117 CA ASN A 138 1.856 10.863 -12.823 1.00 0.00 C ATOM 2118 C ASN A 138 1.974 10.087 -11.518 1.00 0.00 C ATOM 2119 O ASN A 138 1.172 10.280 -10.602 1.00 0.00 O ATOM 2120 CB ASN A 138 2.016 12.357 -12.535 1.00 0.00 C ATOM 2121 CG ASN A 138 2.303 13.170 -13.790 1.00 0.00 C ATOM 2122 OD1 ASN A 138 3.285 12.910 -14.477 1.00 0.00 O ATOM 2123 ND2 ASN A 138 1.504 14.170 -14.122 1.00 0.00 N ATOM 0 H ASN A 138 -0.107 11.285 -13.435 1.00 0.00 H new ATOM 0 HA ASN A 138 2.643 10.594 -13.527 1.00 0.00 H new ATOM 0 HB2 ASN A 138 1.107 12.732 -12.064 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.827 12.500 -11.821 1.00 0.00 H new ATOM 0 HD21 ASN A 138 1.703 14.728 -14.952 1.00 0.00 H new ATOM 0 HD22 ASN A 138 0.688 14.383 -13.548 1.00 0.00 H new ATOM 2130 N THR A 139 2.954 9.194 -11.452 1.00 0.00 N ATOM 2131 CA THR A 139 3.254 8.335 -10.311 1.00 0.00 C ATOM 2132 C THR A 139 3.684 9.233 -9.143 1.00 0.00 C ATOM 2133 O THR A 139 4.391 10.222 -9.348 1.00 0.00 O ATOM 2134 CB THR A 139 4.380 7.367 -10.695 1.00 0.00 C ATOM 2135 OG1 THR A 139 4.237 6.907 -12.029 1.00 0.00 O ATOM 2136 CG2 THR A 139 4.425 6.142 -9.774 1.00 0.00 C ATOM 0 H THR A 139 3.594 9.041 -12.232 1.00 0.00 H new ATOM 0 HA THR A 139 2.382 7.750 -10.019 1.00 0.00 H new ATOM 0 HB THR A 139 5.306 7.933 -10.592 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.970 6.294 -12.244 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.237 5.484 -10.083 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.591 6.465 -8.746 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.479 5.604 -9.837 1.00 0.00 H new ATOM 2144 N ILE A 140 3.277 8.884 -7.923 1.00 0.00 N ATOM 2145 CA ILE A 140 3.493 9.682 -6.720 1.00 0.00 C ATOM 2146 C ILE A 140 3.858 8.852 -5.489 1.00 0.00 C ATOM 2147 O ILE A 140 4.662 9.288 -4.669 1.00 0.00 O ATOM 2148 CB ILE A 140 2.315 10.604 -6.431 1.00 0.00 C ATOM 2149 CG1 ILE A 140 0.963 9.875 -6.414 1.00 0.00 C ATOM 2150 CG2 ILE A 140 2.400 11.841 -7.361 1.00 0.00 C ATOM 2151 CD1 ILE A 140 -0.182 10.854 -6.580 1.00 0.00 C ATOM 0 H ILE A 140 2.775 8.015 -7.741 1.00 0.00 H new ATOM 0 HA ILE A 140 4.364 10.300 -6.938 1.00 0.00 H new ATOM 0 HB ILE A 140 2.383 10.974 -5.408 1.00 0.00 H new ATOM 0 HG12 ILE A 140 0.934 9.136 -7.215 1.00 0.00 H new ATOM 0 HG13 ILE A 140 0.850 9.333 -5.475 1.00 0.00 H new ATOM 0 HG21 ILE A 140 1.560 12.506 -7.160 1.00 0.00 H new ATOM 0 HG22 ILE A 140 3.334 12.371 -7.177 1.00 0.00 H new ATOM 0 HG23 ILE A 140 2.366 11.517 -8.401 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -1.128 10.313 -6.565 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -0.164 11.577 -5.764 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -0.078 11.377 -7.531 1.00 0.00 H new ATOM 2163 N LEU A 141 3.259 7.674 -5.344 1.00 0.00 N ATOM 2164 CA LEU A 141 3.465 6.758 -4.221 1.00 0.00 C ATOM 2165 C LEU A 141 3.655 5.361 -4.816 1.00 0.00 C ATOM 2166 O LEU A 141 3.078 5.049 -5.857 1.00 0.00 O ATOM 2167 CB LEU A 141 2.268 6.921 -3.254 1.00 0.00 C ATOM 2168 CG LEU A 141 2.197 6.101 -1.949 1.00 0.00 C ATOM 2169 CD1 LEU A 141 1.789 4.634 -2.125 1.00 0.00 C ATOM 2170 CD2 LEU A 141 3.483 6.211 -1.128 1.00 0.00 C ATOM 0 H LEU A 141 2.593 7.316 -6.028 1.00 0.00 H new ATOM 0 HA LEU A 141 4.354 6.962 -3.624 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.221 7.974 -2.975 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.364 6.701 -3.822 1.00 0.00 H new ATOM 0 HG LEU A 141 1.383 6.565 -1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.768 4.143 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 141 0.799 4.584 -2.578 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.509 4.131 -2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 141 3.386 5.618 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.323 5.840 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.658 7.254 -0.864 1.00 0.00 H new ATOM 2182 N GLN A 142 4.495 4.522 -4.211 1.00 0.00 N ATOM 2183 CA GLN A 142 4.803 3.200 -4.737 1.00 0.00 C ATOM 2184 C GLN A 142 5.063 2.251 -3.584 1.00 0.00 C ATOM 2185 O GLN A 142 5.721 2.605 -2.607 1.00 0.00 O ATOM 2186 CB GLN A 142 5.988 3.321 -5.696 1.00 0.00 C ATOM 2187 CG GLN A 142 6.541 2.042 -6.342 1.00 0.00 C ATOM 2188 CD GLN A 142 8.052 1.875 -6.182 1.00 0.00 C ATOM 2189 OE1 GLN A 142 8.837 2.702 -6.626 1.00 0.00 O ATOM 2190 NE2 GLN A 142 8.494 0.775 -5.601 1.00 0.00 N ATOM 0 H GLN A 142 4.980 4.744 -3.341 1.00 0.00 H new ATOM 0 HA GLN A 142 3.966 2.789 -5.301 1.00 0.00 H new ATOM 0 HB2 GLN A 142 5.697 3.999 -6.499 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.805 3.799 -5.155 1.00 0.00 H new ATOM 0 HG2 GLN A 142 6.041 1.179 -5.903 1.00 0.00 H new ATOM 0 HG3 GLN A 142 6.296 2.047 -7.404 1.00 0.00 H new ATOM 0 HE21 GLN A 142 7.832 0.091 -5.234 1.00 0.00 H new ATOM 0 HE22 GLN A 142 9.497 0.609 -5.519 1.00 0.00 H new ATOM 2199 N THR A 143 4.508 1.055 -3.707 1.00 0.00 N ATOM 2200 CA THR A 143 4.755 -0.037 -2.771 1.00 0.00 C ATOM 2201 C THR A 143 6.187 -0.489 -3.069 1.00 0.00 C ATOM 2202 O THR A 143 6.525 -0.639 -4.244 1.00 0.00 O ATOM 2203 CB THR A 143 3.732 -1.166 -2.986 1.00 0.00 C ATOM 2204 OG1 THR A 143 2.428 -0.627 -2.918 1.00 0.00 O ATOM 2205 CG2 THR A 143 3.769 -2.274 -1.937 1.00 0.00 C ATOM 0 H THR A 143 3.869 0.811 -4.463 1.00 0.00 H new ATOM 0 HA THR A 143 4.647 0.263 -1.729 1.00 0.00 H new ATOM 0 HB THR A 143 3.991 -1.596 -3.953 1.00 0.00 H new ATOM 0 HG1 THR A 143 2.072 -0.516 -3.824 1.00 0.00 H new ATOM 0 HG21 THR A 143 3.013 -3.023 -2.172 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.754 -2.740 -1.935 1.00 0.00 H new ATOM 0 HG23 THR A 143 3.566 -1.851 -0.953 1.00 0.00 H new ATOM 2213 N PRO A 144 7.084 -0.627 -2.082 1.00 0.00 N ATOM 2214 CA PRO A 144 8.403 -1.138 -2.372 1.00 0.00 C ATOM 2215 C PRO A 144 8.289 -2.629 -2.638 1.00 0.00 C ATOM 2216 O PRO A 144 7.579 -3.354 -1.928 1.00 0.00 O ATOM 2217 CB PRO A 144 9.241 -0.910 -1.137 1.00 0.00 C ATOM 2218 CG PRO A 144 8.201 -0.963 -0.011 1.00 0.00 C ATOM 2219 CD PRO A 144 6.907 -0.449 -0.655 1.00 0.00 C ATOM 0 HA PRO A 144 8.848 -0.648 -3.238 1.00 0.00 H new ATOM 0 HB2 PRO A 144 10.006 -1.678 -1.019 1.00 0.00 H new ATOM 0 HB3 PRO A 144 9.756 0.050 -1.168 1.00 0.00 H new ATOM 0 HG2 PRO A 144 8.079 -1.977 0.369 1.00 0.00 H new ATOM 0 HG3 PRO A 144 8.498 -0.340 0.833 1.00 0.00 H new ATOM 0 HD2 PRO A 144 6.042 -1.006 -0.295 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.736 0.599 -0.409 1.00 0.00 H new ATOM 2227 N GLN A 145 9.103 -3.102 -3.573 1.00 0.00 N ATOM 2228 CA GLN A 145 8.968 -4.469 -3.981 1.00 0.00 C ATOM 2229 C GLN A 145 9.658 -5.302 -2.918 1.00 0.00 C ATOM 2230 O GLN A 145 10.869 -5.217 -2.730 1.00 0.00 O ATOM 2231 CB GLN A 145 9.553 -4.704 -5.372 1.00 0.00 C ATOM 2232 CG GLN A 145 8.628 -4.102 -6.440 1.00 0.00 C ATOM 2233 CD GLN A 145 8.700 -2.577 -6.543 1.00 0.00 C ATOM 2234 OE1 GLN A 145 9.765 -1.978 -6.388 1.00 0.00 O ATOM 2235 NE2 GLN A 145 7.589 -1.915 -6.795 1.00 0.00 N ATOM 0 H GLN A 145 9.836 -2.570 -4.042 1.00 0.00 H new ATOM 0 HA GLN A 145 7.919 -4.751 -4.065 1.00 0.00 H new ATOM 0 HB2 GLN A 145 10.543 -4.253 -5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 145 9.677 -5.773 -5.547 1.00 0.00 H new ATOM 0 HG2 GLN A 145 8.881 -4.533 -7.409 1.00 0.00 H new ATOM 0 HG3 GLN A 145 7.601 -4.392 -6.220 1.00 0.00 H new ATOM 0 HE21 GLN A 145 6.712 -2.420 -6.922 1.00 0.00 H new ATOM 0 HE22 GLN A 145 7.606 -0.897 -6.863 1.00 0.00 H new ATOM 2244 N ASN A 146 8.831 -6.054 -2.208 1.00 0.00 N ATOM 2245 CA ASN A 146 8.964 -7.090 -1.186 1.00 0.00 C ATOM 2246 C ASN A 146 7.616 -7.483 -0.587 1.00 0.00 C ATOM 2247 O ASN A 146 7.590 -8.365 0.262 1.00 0.00 O ATOM 2248 CB ASN A 146 10.178 -7.075 -0.223 1.00 0.00 C ATOM 2249 CG ASN A 146 11.467 -7.697 -0.773 1.00 0.00 C ATOM 2250 OD1 ASN A 146 11.683 -8.899 -0.611 1.00 0.00 O ATOM 2251 ND2 ASN A 146 12.377 -6.950 -1.362 1.00 0.00 N ATOM 0 H ASN A 146 7.834 -5.917 -2.377 1.00 0.00 H new ATOM 0 HA ASN A 146 9.316 -7.942 -1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 146 10.385 -6.042 0.056 1.00 0.00 H new ATOM 0 HB3 ASN A 146 9.902 -7.603 0.690 1.00 0.00 H new ATOM 0 HD21 ASN A 146 13.252 -7.367 -1.680 1.00 0.00 H new ATOM 0 HD22 ASN A 146 12.207 -5.954 -1.501 1.00 0.00 H new ATOM 2258 N ALA A 147 6.511 -6.821 -0.955 1.00 0.00 N ATOM 2259 CA ALA A 147 5.164 -7.186 -0.536 1.00 0.00 C ATOM 2260 C ALA A 147 4.828 -8.583 -1.100 1.00 0.00 C ATOM 2261 O ALA A 147 4.303 -8.763 -2.203 1.00 0.00 O ATOM 2262 CB ALA A 147 4.215 -6.055 -0.937 1.00 0.00 C ATOM 0 H ALA A 147 6.536 -6.003 -1.563 1.00 0.00 H new ATOM 0 HA ALA A 147 5.062 -7.286 0.545 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.199 -6.307 -0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 147 4.522 -5.131 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 147 4.247 -5.920 -2.018 1.00 0.00 H new ATOM 2268 N ILE A 148 5.227 -9.596 -0.331 1.00 0.00 N ATOM 2269 CA ILE A 148 5.179 -11.012 -0.634 1.00 0.00 C ATOM 2270 C ILE A 148 4.612 -11.677 0.614 1.00 0.00 C ATOM 2271 O ILE A 148 5.022 -11.318 1.721 1.00 0.00 O ATOM 2272 CB ILE A 148 6.607 -11.526 -0.908 1.00 0.00 C ATOM 2273 CG1 ILE A 148 7.226 -10.870 -2.162 1.00 0.00 C ATOM 2274 CG2 ILE A 148 6.685 -13.064 -0.986 1.00 0.00 C ATOM 2275 CD1 ILE A 148 7.115 -11.663 -3.464 1.00 0.00 C ATOM 0 H ILE A 148 5.623 -9.425 0.593 1.00 0.00 H new ATOM 0 HA ILE A 148 4.572 -11.227 -1.514 1.00 0.00 H new ATOM 0 HB ILE A 148 7.204 -11.225 -0.047 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.752 -9.900 -2.310 1.00 0.00 H new ATOM 0 HG13 ILE A 148 8.281 -10.682 -1.964 1.00 0.00 H new ATOM 0 HG21 ILE A 148 7.714 -13.367 -1.181 1.00 0.00 H new ATOM 0 HG22 ILE A 148 6.353 -13.494 -0.041 1.00 0.00 H new ATOM 0 HG23 ILE A 148 6.043 -13.420 -1.792 1.00 0.00 H new ATOM 0 HD11 ILE A 148 7.584 -11.103 -4.273 1.00 0.00 H new ATOM 0 HD12 ILE A 148 7.617 -12.623 -3.349 1.00 0.00 H new ATOM 0 HD13 ILE A 148 6.064 -11.829 -3.700 1.00 0.00 H new ATOM 2287 N PHE A 149 3.734 -12.662 0.447 1.00 0.00 N ATOM 2288 CA PHE A 149 3.228 -13.468 1.550 1.00 0.00 C ATOM 2289 C PHE A 149 3.554 -14.923 1.207 1.00 0.00 C ATOM 2290 O PHE A 149 3.907 -15.244 0.066 1.00 0.00 O ATOM 2291 CB PHE A 149 1.724 -13.284 1.812 1.00 0.00 C ATOM 2292 CG PHE A 149 1.128 -11.895 1.687 1.00 0.00 C ATOM 2293 CD1 PHE A 149 0.927 -11.351 0.406 1.00 0.00 C ATOM 2294 CD2 PHE A 149 0.609 -11.228 2.814 1.00 0.00 C ATOM 2295 CE1 PHE A 149 0.150 -10.197 0.241 1.00 0.00 C ATOM 2296 CE2 PHE A 149 -0.173 -10.072 2.643 1.00 0.00 C ATOM 2297 CZ PHE A 149 -0.429 -9.574 1.354 1.00 0.00 C ATOM 0 H PHE A 149 3.353 -12.923 -0.462 1.00 0.00 H new ATOM 0 HA PHE A 149 3.705 -13.150 2.477 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.186 -13.937 1.125 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.518 -13.643 2.820 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.374 -11.825 -0.455 1.00 0.00 H new ATOM 0 HD2 PHE A 149 0.811 -11.603 3.806 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.003 -9.787 -0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -0.579 -9.565 3.506 1.00 0.00 H new ATOM 0 HZ PHE A 149 -1.070 -8.714 1.222 1.00 0.00 H new ATOM 2307 N PHE A 150 3.424 -15.816 2.183 1.00 0.00 N ATOM 2308 CA PHE A 150 3.807 -17.211 2.075 1.00 0.00 C ATOM 2309 C PHE A 150 2.632 -18.045 2.548 1.00 0.00 C ATOM 2310 O PHE A 150 2.301 -17.977 3.728 1.00 0.00 O ATOM 2311 CB PHE A 150 5.070 -17.435 2.927 1.00 0.00 C ATOM 2312 CG PHE A 150 6.285 -16.737 2.343 1.00 0.00 C ATOM 2313 CD1 PHE A 150 7.046 -17.366 1.340 1.00 0.00 C ATOM 2314 CD2 PHE A 150 6.570 -15.404 2.701 1.00 0.00 C ATOM 2315 CE1 PHE A 150 8.046 -16.647 0.660 1.00 0.00 C ATOM 2316 CE2 PHE A 150 7.559 -14.682 2.012 1.00 0.00 C ATOM 2317 CZ PHE A 150 8.268 -15.293 0.961 1.00 0.00 C ATOM 0 H PHE A 150 3.037 -15.577 3.096 1.00 0.00 H new ATOM 0 HA PHE A 150 4.045 -17.501 1.052 1.00 0.00 H new ATOM 0 HB2 PHE A 150 4.894 -17.069 3.939 1.00 0.00 H new ATOM 0 HB3 PHE A 150 5.269 -18.504 3.005 1.00 0.00 H new ATOM 0 HD1 PHE A 150 6.862 -18.401 1.092 1.00 0.00 H new ATOM 0 HD2 PHE A 150 6.026 -14.936 3.508 1.00 0.00 H new ATOM 0 HE1 PHE A 150 8.644 -17.137 -0.094 1.00 0.00 H new ATOM 0 HE2 PHE A 150 7.775 -13.660 2.288 1.00 0.00 H new ATOM 0 HZ PHE A 150 8.982 -14.722 0.387 1.00 0.00 H new ATOM 2327 N LYS A 151 1.979 -18.825 1.679 1.00 0.00 N ATOM 2328 CA LYS A 151 0.793 -19.577 2.094 1.00 0.00 C ATOM 2329 C LYS A 151 1.187 -21.024 2.314 1.00 0.00 C ATOM 2330 O LYS A 151 1.690 -21.674 1.405 1.00 0.00 O ATOM 2331 CB LYS A 151 -0.408 -19.441 1.138 1.00 0.00 C ATOM 2332 CG LYS A 151 -1.668 -19.813 1.948 1.00 0.00 C ATOM 2333 CD LYS A 151 -3.004 -19.733 1.202 1.00 0.00 C ATOM 2334 CE LYS A 151 -4.099 -19.687 2.281 1.00 0.00 C ATOM 2335 NZ LYS A 151 -5.477 -19.836 1.769 1.00 0.00 N ATOM 0 H LYS A 151 2.246 -18.950 0.703 1.00 0.00 H new ATOM 0 HA LYS A 151 0.435 -19.143 3.028 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.482 -18.424 0.753 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.293 -20.100 0.277 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.546 -20.829 2.323 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -1.722 -19.157 2.817 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.044 -18.846 0.570 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.137 -20.596 0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -3.908 -20.477 3.007 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.025 -18.739 2.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -6.142 -19.375 2.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.549 -19.392 0.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.712 -20.846 1.692 1.00 0.00 H new ATOM 2349 N THR A 152 0.963 -21.525 3.519 1.00 0.00 N ATOM 2350 CA THR A 152 1.160 -22.919 3.856 1.00 0.00 C ATOM 2351 C THR A 152 -0.122 -23.611 3.417 1.00 0.00 C ATOM 2352 O THR A 152 -1.180 -23.269 3.952 1.00 0.00 O ATOM 2353 CB THR A 152 1.337 -23.044 5.375 1.00 0.00 C ATOM 2354 OG1 THR A 152 2.355 -22.167 5.823 1.00 0.00 O ATOM 2355 CG2 THR A 152 1.636 -24.468 5.846 1.00 0.00 C ATOM 0 H THR A 152 0.633 -20.960 4.302 1.00 0.00 H new ATOM 0 HA THR A 152 2.039 -23.353 3.379 1.00 0.00 H new ATOM 0 HB THR A 152 0.378 -22.767 5.814 1.00 0.00 H new ATOM 0 HG1 THR A 152 2.458 -22.254 6.794 1.00 0.00 H new ATOM 0 HG21 THR A 152 1.748 -24.477 6.930 1.00 0.00 H new ATOM 0 HG22 THR A 152 0.815 -25.126 5.561 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.559 -24.818 5.383 1.00 0.00 H new ATOM 2363 N CYS A 153 -0.047 -24.532 2.458 1.00 0.00 N ATOM 2364 CA CYS A 153 -1.185 -25.343 2.041 1.00 0.00 C ATOM 2365 C CYS A 153 -0.907 -26.819 2.302 1.00 0.00 C ATOM 2366 O CYS A 153 0.228 -27.220 2.564 1.00 0.00 O ATOM 2367 CB CYS A 153 -1.552 -25.123 0.573 1.00 0.00 C ATOM 2368 SG CYS A 153 -1.644 -23.429 -0.027 1.00 0.00 S ATOM 0 H CYS A 153 0.811 -24.736 1.946 1.00 0.00 H new ATOM 0 HA CYS A 153 -2.041 -25.025 2.637 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -0.822 -25.655 -0.037 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -2.519 -25.594 0.396 1.00 0.00 H new ATOM 2373 N LEU A 154 -1.967 -27.617 2.233 1.00 0.00 N ATOM 2374 CA LEU A 154 -1.942 -29.063 2.319 1.00 0.00 C ATOM 2375 C LEU A 154 -2.888 -29.599 1.249 1.00 0.00 C ATOM 2376 O LEU A 154 -3.751 -28.853 0.768 1.00 0.00 O ATOM 2377 CB LEU A 154 -2.258 -29.527 3.750 1.00 0.00 C ATOM 2378 CG LEU A 154 -3.632 -29.152 4.340 1.00 0.00 C ATOM 2379 CD1 LEU A 154 -4.778 -30.045 3.855 1.00 0.00 C ATOM 2380 CD2 LEU A 154 -3.549 -29.262 5.869 1.00 0.00 C ATOM 0 H LEU A 154 -2.911 -27.250 2.110 1.00 0.00 H new ATOM 0 HA LEU A 154 -0.950 -29.469 2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -2.167 -30.613 3.778 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -1.489 -29.125 4.410 1.00 0.00 H new ATOM 0 HG LEU A 154 -3.854 -28.139 4.005 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.712 -29.719 4.313 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -4.861 -29.973 2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.577 -31.079 4.136 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -4.513 -29.000 6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -3.290 -30.284 6.147 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -2.785 -28.580 6.242 1.00 0.00 H new ATOM 2392 N GLN A 155 -2.707 -30.857 0.867 1.00 0.00 N ATOM 2393 CA GLN A 155 -3.521 -31.534 -0.125 1.00 0.00 C ATOM 2394 C GLN A 155 -4.923 -31.806 0.428 1.00 0.00 C ATOM 2395 O GLN A 155 -5.060 -32.383 1.509 1.00 0.00 O ATOM 2396 CB GLN A 155 -2.829 -32.833 -0.564 1.00 0.00 C ATOM 2397 CG GLN A 155 -3.664 -33.619 -1.597 1.00 0.00 C ATOM 2398 CD GLN A 155 -4.259 -34.927 -1.064 1.00 0.00 C ATOM 2399 OE1 GLN A 155 -4.209 -35.957 -1.726 1.00 0.00 O ATOM 2400 NE2 GLN A 155 -4.870 -34.937 0.113 1.00 0.00 N ATOM 0 H GLN A 155 -1.969 -31.447 1.251 1.00 0.00 H new ATOM 0 HA GLN A 155 -3.632 -30.893 -0.999 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -1.854 -32.597 -0.991 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.651 -33.460 0.309 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.475 -32.982 -1.951 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.036 -33.844 -2.459 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -4.916 -34.084 0.671 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -5.293 -35.797 0.460 1.00 0.00 H new ATOM 2409 N ALA A 156 -5.961 -31.491 -0.346 1.00 0.00 N ATOM 2410 CA ALA A 156 -7.354 -31.777 -0.067 1.00 0.00 C ATOM 2411 C ALA A 156 -8.110 -31.878 -1.396 1.00 0.00 C ATOM 2412 O ALA A 156 -7.652 -31.413 -2.444 1.00 0.00 O ATOM 2413 CB ALA A 156 -7.945 -30.656 0.797 1.00 0.00 C ATOM 0 H ALA A 156 -5.837 -31.002 -1.233 1.00 0.00 H new ATOM 0 HA ALA A 156 -7.444 -32.718 0.475 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -8.993 -30.872 1.006 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -7.394 -30.590 1.735 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -7.869 -29.708 0.265 1.00 0.00 H new ATOM 2419 N GLU A 157 -9.278 -32.491 -1.346 1.00 0.00 N ATOM 2420 CA GLU A 157 -10.289 -32.650 -2.372 1.00 0.00 C ATOM 2421 C GLU A 157 -11.614 -32.724 -1.617 1.00 0.00 C ATOM 2422 O GLU A 157 -11.573 -33.215 -0.463 1.00 0.00 O ATOM 2423 CB GLU A 157 -9.997 -33.923 -3.180 1.00 0.00 C ATOM 2424 CG GLU A 157 -10.765 -33.972 -4.517 1.00 0.00 C ATOM 2425 CD GLU A 157 -9.992 -34.721 -5.615 1.00 0.00 C ATOM 2426 OE1 GLU A 157 -9.023 -34.106 -6.131 1.00 0.00 O ATOM 2427 OE2 GLU A 157 -10.352 -35.869 -5.953 1.00 0.00 O ATOM 2428 OXT GLU A 157 -12.614 -32.219 -2.165 1.00 0.00 O ATOM 0 H GLU A 157 -9.574 -32.943 -0.481 1.00 0.00 H new ATOM 0 HA GLU A 157 -10.310 -31.832 -3.092 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -8.927 -33.984 -3.378 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -10.261 -34.796 -2.582 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -11.729 -34.457 -4.361 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -10.970 -32.955 -4.851 1.00 0.00 H new TER 2435 GLU A 157