USER MOD reduce.3.24.130724 H: found=0, std=0, add=1368, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1370 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 16 HIS : no HD1:sc= -7.75! C(o=-13!,f=-29!) USER MOD Set 1.2: B 86 ASN : amide:sc= -5.29! C(o=-13!,f=-11!) USER MOD Set 2.1: B 30 LYS NZ :NH3+ 179:sc= -1.45 (180deg=-2.22!) USER MOD Set 2.2: B 64 ASN : amide:sc= -1.17! C(o=-2.6!,f=-27!) USER MOD Set 3.1: B 25 LYS NZ :NH3+ 168:sc= 0.581! (180deg=0) USER MOD Set 3.2: B 26 TYR OH : rot 180:sc= 1.08 USER MOD Set 4.1: A 82 THR OG1 : rot 26:sc= -0.229 USER MOD Set 4.2: B 8 MET CE :methyl -163:sc= -3.2 (180deg=-4.56!) USER MOD Set 5.1: A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 59 LYS NZ :NH3+ -144:sc= 0.716 (180deg=-5.04!) USER MOD Set 6.1: A 42 SER OG : rot 60:sc= 1.34 USER MOD Set 6.2: B 2 SER OG : rot 105:sc= 0.908 USER MOD Set 7.1: A 25 LYS NZ :NH3+ 136:sc= 0.874! (180deg=-0.183) USER MOD Set 7.2: A 26 TYR OH : rot 94:sc= 1.61 USER MOD Set 7.3: B 87 ASN : amide:sc= -0.629! C(o=1.9!,f=-4.8!) USER MOD Set 8.1: A 8 MET CE :methyl -138:sc= -4.97! (180deg=-7.23!) USER MOD Set 8.2: B 82 THR OG1 : rot 69:sc= 0.488 USER MOD Single : A 2 SER OG : rot 49:sc= 1.52 USER MOD Single : A 6 THR OG1 : rot 73:sc= 0.809 USER MOD Single : A 10 THR OG1 : rot 71:sc= 0.116 USER MOD Single : A 13 ASN : amide:sc= -1.1 X(o=-1.1,f=-0.95) USER MOD Single : A 18 HIS : no HE2:sc= -0.768 K(o=-0.77,f=-7.5!) USER MOD Single : A 19 SER OG : rot -34:sc= 1.01 USER MOD Single : A 21 LYS NZ :NH3+ 168:sc= -0.128 (180deg=-0.649!) USER MOD Single : A 27 LYS NZ :NH3+ -155:sc= 0.547 (180deg=-1.25) USER MOD Single : A 29 SER OG : rot 49:sc= 0.192 USER MOD Single : A 30 LYS NZ :NH3+ 175:sc= -3.12! (180deg=-3.54!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -127:sc= -0.139 (180deg=-1.07) USER MOD Single : A 38 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.19) USER MOD Single : A 39 THR OG1 : rot 66:sc= 0.738 USER MOD Single : A 48 GLN : amide:sc= -2.32! C(o=-2.3!,f=-4!) USER MOD Single : A 49 LYS NZ :NH3+ -116:sc= 0.724 (180deg=-1.95!) USER MOD Single : A 56 LYS NZ :NH3+ 163:sc= 0.524 (180deg=-0.228) USER MOD Single : A 64 ASN : amide:sc= -0.881 K(o=-0.88,f=-1.4!) USER MOD Single : A 72 GLN : amide:sc= -1.2 X(o=-1.2,f=-0.99) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.642 USER MOD Single : A 85 MET CE :methyl -147:sc= -1.02 (180deg=-4.31!) USER MOD Single : A 86 ASN : amide:sc= -3.2 K(o=-3.2,f=-7.9!) USER MOD Single : A 87 ASN : amide:sc= 0.954! K(o=0.95!,f=-0.17) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 76:sc= 0.75 USER MOD Single : B 13 ASN : amide:sc= -0.847 K(o=-0.85,f=-0.25) USER MOD Single : B 16 HIS : no HE2:sc= -7.6! C(o=-7.6!,f=-7.8!) USER MOD Single : B 18 HIS : no HE2:sc= -3.18! C(o=-3.2!,f=-11!) USER MOD Single : B 19 SER OG : rot 96:sc= 0.858 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.371) USER MOD Single : B 29 SER OG : rot 7:sc= -1.97! USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ 158:sc= -0.0671 (180deg=-1.52!) USER MOD Single : B 38 GLN : amide:sc= 0.247 K(o=0.25,f=-0.32) USER MOD Single : B 39 THR OG1 : rot 71:sc= 0.701 USER MOD Single : B 42 SER OG : rot 57:sc= 1.17 USER MOD Single : B 48 GLN : amide:sc= -8.35! C(o=-8.4!,f=-4.1!) USER MOD Single : B 49 LYS NZ :NH3+ 150:sc= -0.163 (180deg=-0.839) USER MOD Single : B 56 LYS NZ :NH3+ 160:sc= 0.459 (180deg=-0.506) USER MOD Single : B 58 MET CE :methyl -110:sc= -0.119 (180deg=-1.7) USER MOD Single : B 59 LYS NZ :NH3+ -142:sc= -0.876 (180deg=-6.34!) USER MOD Single : B 72 GLN : amide:sc= -1.43! C(o=-1.4!,f=-3!) USER MOD Single : B 74 TYR OH : rot -31:sc= -0.889 USER MOD Single : B 85 MET CE :methyl 159:sc= -1.27 (180deg=-2.81!) USER MOD ----------------------------------------------------------------- ATOM 8 N SER A 2 -9.913 5.238 10.782 1.00 0.00 N ATOM 9 CA SER A 2 -9.479 4.035 11.475 1.00 0.00 C ATOM 10 C SER A 2 -7.962 3.865 11.363 1.00 0.00 C ATOM 11 O SER A 2 -7.296 4.623 10.648 1.00 0.00 O ATOM 12 CB SER A 2 -10.193 2.834 10.893 1.00 0.00 C ATOM 13 OG SER A 2 -11.547 3.196 10.612 1.00 0.00 O ATOM 0 HA SER A 2 -9.729 4.123 12.532 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.694 2.503 9.982 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.163 2.000 11.594 1.00 0.00 H new ATOM 0 HG SER A 2 -11.563 4.041 10.115 1.00 0.00 H new ATOM 19 N GLU A 3 -7.414 2.882 12.066 1.00 0.00 N ATOM 20 CA GLU A 3 -5.973 2.653 12.059 1.00 0.00 C ATOM 21 C GLU A 3 -5.478 2.421 10.648 1.00 0.00 C ATOM 22 O GLU A 3 -4.514 3.043 10.202 1.00 0.00 O ATOM 23 CB GLU A 3 -5.647 1.398 12.875 1.00 0.00 C ATOM 24 CG GLU A 3 -5.988 1.615 14.345 1.00 0.00 C ATOM 25 CD GLU A 3 -7.473 1.370 14.616 1.00 0.00 C ATOM 26 OE1 GLU A 3 -8.226 1.172 13.682 1.00 0.00 O ATOM 27 OE2 GLU A 3 -7.840 1.419 15.765 1.00 0.00 O ATOM 0 H GLU A 3 -7.943 2.232 12.647 1.00 0.00 H new ATOM 0 HA GLU A 3 -5.490 3.532 12.485 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.208 0.548 12.487 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.589 1.155 12.773 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.389 0.945 14.962 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.727 2.633 14.634 1.00 0.00 H new ATOM 34 N LEU A 4 -6.156 1.544 9.942 1.00 0.00 N ATOM 35 CA LEU A 4 -5.768 1.203 8.587 1.00 0.00 C ATOM 36 C LEU A 4 -5.868 2.437 7.723 1.00 0.00 C ATOM 37 O LEU A 4 -4.959 2.756 6.958 1.00 0.00 O ATOM 38 CB LEU A 4 -6.706 0.108 8.040 1.00 0.00 C ATOM 39 CG LEU A 4 -6.308 -1.295 8.571 1.00 0.00 C ATOM 40 CD1 LEU A 4 -5.233 -1.915 7.694 1.00 0.00 C ATOM 41 CD2 LEU A 4 -5.811 -1.221 10.020 1.00 0.00 C ATOM 0 H LEU A 4 -6.982 1.051 10.283 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.744 0.831 8.579 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.734 0.330 8.328 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.673 0.109 6.951 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.200 -1.921 8.542 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.968 -2.898 8.083 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.608 -2.017 6.676 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.350 -1.275 7.693 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.540 -2.219 10.363 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.938 -0.570 10.073 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.601 -0.821 10.656 1.00 0.00 H new ATOM 53 N GLU A 5 -6.951 3.163 7.911 1.00 0.00 N ATOM 54 CA GLU A 5 -7.197 4.372 7.170 1.00 0.00 C ATOM 55 C GLU A 5 -6.149 5.410 7.541 1.00 0.00 C ATOM 56 O GLU A 5 -5.494 5.999 6.675 1.00 0.00 O ATOM 57 CB GLU A 5 -8.587 4.882 7.535 1.00 0.00 C ATOM 58 CG GLU A 5 -9.632 3.849 7.093 1.00 0.00 C ATOM 59 CD GLU A 5 -11.022 4.310 7.482 1.00 0.00 C ATOM 60 OE1 GLU A 5 -11.218 4.631 8.639 1.00 0.00 O ATOM 61 OE2 GLU A 5 -11.867 4.361 6.616 1.00 0.00 O ATOM 0 H GLU A 5 -7.682 2.927 8.582 1.00 0.00 H new ATOM 0 HA GLU A 5 -7.142 4.182 6.098 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.656 5.050 8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.776 5.840 7.050 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.578 3.705 6.014 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.418 2.885 7.554 1.00 0.00 H new ATOM 68 N THR A 6 -5.909 5.532 8.834 1.00 0.00 N ATOM 69 CA THR A 6 -4.877 6.415 9.327 1.00 0.00 C ATOM 70 C THR A 6 -3.520 5.947 8.808 1.00 0.00 C ATOM 71 O THR A 6 -2.725 6.751 8.311 1.00 0.00 O ATOM 72 CB THR A 6 -4.898 6.440 10.865 1.00 0.00 C ATOM 73 OG1 THR A 6 -6.241 6.634 11.316 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.029 7.593 11.381 1.00 0.00 C ATOM 0 H THR A 6 -6.418 5.028 9.560 1.00 0.00 H new ATOM 0 HA THR A 6 -5.058 7.428 8.969 1.00 0.00 H new ATOM 0 HB THR A 6 -4.509 5.494 11.242 1.00 0.00 H new ATOM 0 HG1 THR A 6 -6.756 5.812 11.173 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.049 7.604 12.471 1.00 0.00 H new ATOM 0 HG22 THR A 6 -3.003 7.457 11.038 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.416 8.539 11.001 1.00 0.00 H new ATOM 82 N ALA A 7 -3.278 4.636 8.879 1.00 0.00 N ATOM 83 CA ALA A 7 -2.034 4.078 8.390 1.00 0.00 C ATOM 84 C ALA A 7 -1.804 4.488 6.946 1.00 0.00 C ATOM 85 O ALA A 7 -0.732 4.996 6.601 1.00 0.00 O ATOM 86 CB ALA A 7 -2.055 2.550 8.503 1.00 0.00 C ATOM 0 H ALA A 7 -3.927 3.953 9.269 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.218 4.465 9.000 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.114 2.145 8.132 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.187 2.264 9.547 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -2.880 2.153 7.911 1.00 0.00 H new ATOM 92 N MET A 8 -2.821 4.296 6.111 1.00 0.00 N ATOM 93 CA MET A 8 -2.686 4.659 4.710 1.00 0.00 C ATOM 94 C MET A 8 -2.486 6.152 4.564 1.00 0.00 C ATOM 95 O MET A 8 -1.597 6.597 3.832 1.00 0.00 O ATOM 96 CB MET A 8 -3.900 4.192 3.890 1.00 0.00 C ATOM 97 CG MET A 8 -4.005 2.663 3.936 1.00 0.00 C ATOM 98 SD MET A 8 -2.436 1.917 3.422 1.00 0.00 S ATOM 99 CE MET A 8 -2.423 2.526 1.719 1.00 0.00 C ATOM 0 H MET A 8 -3.724 3.901 6.373 1.00 0.00 H new ATOM 0 HA MET A 8 -1.805 4.151 4.318 1.00 0.00 H new ATOM 0 HB2 MET A 8 -4.811 4.640 4.286 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.803 4.528 2.857 1.00 0.00 H new ATOM 0 HG2 MET A 8 -4.258 2.338 4.945 1.00 0.00 H new ATOM 0 HG3 MET A 8 -4.809 2.326 3.282 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.089 1.732 1.051 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.428 2.839 1.437 1.00 0.00 H new ATOM 0 HE3 MET A 8 -1.744 3.375 1.641 1.00 0.00 H new ATOM 109 N GLU A 9 -3.225 6.935 5.336 1.00 0.00 N ATOM 110 CA GLU A 9 -3.033 8.375 5.306 1.00 0.00 C ATOM 111 C GLU A 9 -1.665 8.761 5.846 1.00 0.00 C ATOM 112 O GLU A 9 -1.030 9.689 5.348 1.00 0.00 O ATOM 113 CB GLU A 9 -4.133 9.148 6.022 1.00 0.00 C ATOM 114 CG GLU A 9 -5.442 9.046 5.231 1.00 0.00 C ATOM 115 CD GLU A 9 -6.536 9.858 5.905 1.00 0.00 C ATOM 116 OE1 GLU A 9 -6.236 10.573 6.842 1.00 0.00 O ATOM 117 OE2 GLU A 9 -7.665 9.765 5.472 1.00 0.00 O ATOM 0 H GLU A 9 -3.947 6.606 5.977 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.089 8.660 4.255 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.273 8.751 7.027 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.844 10.193 6.130 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.288 9.406 4.214 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -5.749 8.003 5.157 1.00 0.00 H new ATOM 124 N THR A 10 -1.192 8.027 6.836 1.00 0.00 N ATOM 125 CA THR A 10 0.118 8.303 7.388 1.00 0.00 C ATOM 126 C THR A 10 1.132 8.237 6.247 1.00 0.00 C ATOM 127 O THR A 10 1.936 9.159 6.058 1.00 0.00 O ATOM 128 CB THR A 10 0.463 7.276 8.491 1.00 0.00 C ATOM 129 OG1 THR A 10 -0.652 7.132 9.371 1.00 0.00 O ATOM 130 CG2 THR A 10 1.666 7.767 9.309 1.00 0.00 C ATOM 0 H THR A 10 -1.687 7.247 7.268 1.00 0.00 H new ATOM 0 HA THR A 10 0.138 9.292 7.845 1.00 0.00 H new ATOM 0 HB THR A 10 0.701 6.322 8.020 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.376 6.661 8.908 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.902 7.037 10.084 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.527 7.890 8.652 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.425 8.723 9.773 1.00 0.00 H new ATOM 138 N LEU A 11 0.987 7.226 5.400 1.00 0.00 N ATOM 139 CA LEU A 11 1.813 7.118 4.203 1.00 0.00 C ATOM 140 C LEU A 11 1.545 8.317 3.281 1.00 0.00 C ATOM 141 O LEU A 11 2.474 8.900 2.709 1.00 0.00 O ATOM 142 CB LEU A 11 1.505 5.812 3.460 1.00 0.00 C ATOM 143 CG LEU A 11 1.944 4.591 4.291 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.353 3.320 3.670 1.00 0.00 C ATOM 145 CD2 LEU A 11 3.475 4.467 4.285 1.00 0.00 C ATOM 0 H LEU A 11 0.309 6.473 5.518 1.00 0.00 H new ATOM 0 HA LEU A 11 2.863 7.114 4.497 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.437 5.750 3.252 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.018 5.806 2.498 1.00 0.00 H new ATOM 0 HG LEU A 11 1.592 4.718 5.315 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.661 2.453 4.254 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.265 3.388 3.667 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.713 3.214 2.646 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.772 3.600 4.876 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.826 4.345 3.260 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.915 5.367 4.715 1.00 0.00 H new ATOM 157 N ILE A 12 0.273 8.692 3.164 1.00 0.00 N ATOM 158 CA ILE A 12 -0.132 9.828 2.328 1.00 0.00 C ATOM 159 C ILE A 12 0.502 11.105 2.866 1.00 0.00 C ATOM 160 O ILE A 12 1.018 11.930 2.104 1.00 0.00 O ATOM 161 CB ILE A 12 -1.676 9.965 2.349 1.00 0.00 C ATOM 162 CG1 ILE A 12 -2.348 8.778 1.643 1.00 0.00 C ATOM 163 CG2 ILE A 12 -2.118 11.262 1.677 1.00 0.00 C ATOM 164 CD1 ILE A 12 -2.073 8.828 0.132 1.00 0.00 C ATOM 0 H ILE A 12 -0.500 8.226 3.638 1.00 0.00 H new ATOM 0 HA ILE A 12 0.201 9.661 1.303 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.984 9.978 3.395 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -1.974 7.841 2.056 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.423 8.800 1.824 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.205 11.334 1.705 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.684 12.111 2.205 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.780 11.268 0.641 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.556 7.980 -0.354 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.470 9.756 -0.279 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -0.998 8.783 -0.044 1.00 0.00 H new ATOM 176 N ASN A 13 0.471 11.258 4.179 1.00 0.00 N ATOM 177 CA ASN A 13 1.014 12.450 4.817 1.00 0.00 C ATOM 178 C ASN A 13 2.479 12.558 4.488 1.00 0.00 C ATOM 179 O ASN A 13 2.957 13.612 4.052 1.00 0.00 O ATOM 180 CB ASN A 13 0.883 12.318 6.335 1.00 0.00 C ATOM 181 CG ASN A 13 -0.574 12.326 6.755 1.00 0.00 C ATOM 182 OD1 ASN A 13 -1.397 13.007 6.144 1.00 0.00 O ATOM 183 ND2 ASN A 13 -0.950 11.581 7.746 1.00 0.00 N ATOM 0 H ASN A 13 0.077 10.574 4.825 1.00 0.00 H new ATOM 0 HA ASN A 13 0.472 13.327 4.463 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.356 11.393 6.666 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.411 13.138 6.822 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -1.932 11.557 8.023 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.265 11.018 8.250 1.00 0.00 H new ATOM 190 N VAL A 14 3.161 11.432 4.590 1.00 0.00 N ATOM 191 CA VAL A 14 4.559 11.345 4.234 1.00 0.00 C ATOM 192 C VAL A 14 4.737 11.617 2.749 1.00 0.00 C ATOM 193 O VAL A 14 5.641 12.354 2.338 1.00 0.00 O ATOM 194 CB VAL A 14 5.091 9.949 4.595 1.00 0.00 C ATOM 195 CG1 VAL A 14 6.483 9.742 4.004 1.00 0.00 C ATOM 196 CG2 VAL A 14 5.166 9.817 6.114 1.00 0.00 C ATOM 0 H VAL A 14 2.759 10.555 4.922 1.00 0.00 H new ATOM 0 HA VAL A 14 5.123 12.094 4.789 1.00 0.00 H new ATOM 0 HB VAL A 14 4.417 9.197 4.186 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.846 8.749 4.268 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.435 9.834 2.919 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.163 10.495 4.402 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.543 8.828 6.375 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.837 10.578 6.513 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.172 9.951 6.540 1.00 0.00 H new ATOM 206 N PHE A 15 3.894 10.994 1.947 1.00 0.00 N ATOM 207 CA PHE A 15 3.986 11.136 0.511 1.00 0.00 C ATOM 208 C PHE A 15 3.822 12.604 0.133 1.00 0.00 C ATOM 209 O PHE A 15 4.683 13.182 -0.536 1.00 0.00 O ATOM 210 CB PHE A 15 2.895 10.292 -0.151 1.00 0.00 C ATOM 211 CG PHE A 15 3.083 10.264 -1.650 1.00 0.00 C ATOM 212 CD1 PHE A 15 4.022 9.392 -2.216 1.00 0.00 C ATOM 213 CD2 PHE A 15 2.319 11.095 -2.471 1.00 0.00 C ATOM 214 CE1 PHE A 15 4.194 9.352 -3.598 1.00 0.00 C ATOM 215 CE2 PHE A 15 2.494 11.053 -3.856 1.00 0.00 C ATOM 216 CZ PHE A 15 3.429 10.181 -4.418 1.00 0.00 C ATOM 0 H PHE A 15 3.140 10.386 2.267 1.00 0.00 H new ATOM 0 HA PHE A 15 4.961 10.791 0.166 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.923 9.276 0.244 1.00 0.00 H new ATOM 0 HB3 PHE A 15 1.914 10.701 0.091 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.613 8.750 -1.580 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.595 11.768 -2.037 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.919 8.680 -4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.905 11.696 -4.493 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.560 10.149 -5.490 1.00 0.00 H new ATOM 226 N HIS A 16 2.794 13.246 0.688 1.00 0.00 N ATOM 227 CA HIS A 16 2.593 14.676 0.454 1.00 0.00 C ATOM 228 C HIS A 16 3.781 15.460 0.953 1.00 0.00 C ATOM 229 O HIS A 16 4.196 16.446 0.324 1.00 0.00 O ATOM 230 CB HIS A 16 1.338 15.203 1.153 1.00 0.00 C ATOM 231 CG HIS A 16 0.103 14.682 0.497 1.00 0.00 C ATOM 232 ND1 HIS A 16 -0.151 14.833 -0.862 1.00 0.00 N ATOM 233 CD2 HIS A 16 -0.975 14.022 1.009 1.00 0.00 C ATOM 234 CE1 HIS A 16 -1.348 14.268 -1.104 1.00 0.00 C ATOM 235 NE2 HIS A 16 -1.893 13.758 0.002 1.00 0.00 N ATOM 0 H HIS A 16 2.099 12.808 1.292 1.00 0.00 H new ATOM 0 HA HIS A 16 2.474 14.805 -0.622 1.00 0.00 H new ATOM 0 HB2 HIS A 16 1.350 14.907 2.202 1.00 0.00 H new ATOM 0 HB3 HIS A 16 1.335 16.293 1.130 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -1.097 13.745 2.046 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.813 14.232 -2.078 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -2.789 13.279 0.089 1.00 0.00 H new ATOM 244 N ALA A 17 4.293 15.061 2.112 1.00 0.00 N ATOM 245 CA ALA A 17 5.393 15.774 2.731 1.00 0.00 C ATOM 246 C ALA A 17 6.532 15.911 1.749 1.00 0.00 C ATOM 247 O ALA A 17 7.067 17.004 1.556 1.00 0.00 O ATOM 248 CB ALA A 17 5.873 15.039 3.989 1.00 0.00 C ATOM 0 H ALA A 17 3.963 14.251 2.636 1.00 0.00 H new ATOM 0 HA ALA A 17 5.046 16.766 3.021 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.699 15.590 4.439 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.053 14.967 4.703 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.209 14.038 3.720 1.00 0.00 H new ATOM 254 N HIS A 18 6.895 14.802 1.117 1.00 0.00 N ATOM 255 CA HIS A 18 7.953 14.814 0.116 1.00 0.00 C ATOM 256 C HIS A 18 7.468 15.398 -1.213 1.00 0.00 C ATOM 257 O HIS A 18 8.189 16.173 -1.855 1.00 0.00 O ATOM 258 CB HIS A 18 8.563 13.419 -0.056 1.00 0.00 C ATOM 259 CG HIS A 18 9.283 13.048 1.221 1.00 0.00 C ATOM 260 ND1 HIS A 18 10.589 13.448 1.488 1.00 0.00 N ATOM 261 CD2 HIS A 18 8.875 12.350 2.336 1.00 0.00 C ATOM 262 CE1 HIS A 18 10.908 12.997 2.716 1.00 0.00 C ATOM 263 NE2 HIS A 18 9.902 12.321 3.278 1.00 0.00 N ATOM 0 H HIS A 18 6.474 13.887 1.279 1.00 0.00 H new ATOM 0 HA HIS A 18 8.744 15.472 0.476 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.784 12.690 -0.277 1.00 0.00 H new ATOM 0 HB3 HIS A 18 9.256 13.410 -0.898 1.00 0.00 H new ATOM 0 HD1 HIS A 18 11.194 13.985 0.867 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.904 11.893 2.462 1.00 0.00 H new ATOM 0 HE1 HIS A 18 11.864 13.162 3.190 1.00 0.00 H new ATOM 272 N SER A 19 6.218 15.095 -1.591 1.00 0.00 N ATOM 273 CA SER A 19 5.656 15.641 -2.830 1.00 0.00 C ATOM 274 C SER A 19 5.695 17.157 -2.794 1.00 0.00 C ATOM 275 O SER A 19 6.053 17.812 -3.781 1.00 0.00 O ATOM 276 CB SER A 19 4.200 15.194 -3.022 1.00 0.00 C ATOM 277 OG SER A 19 4.127 13.775 -3.121 1.00 0.00 O ATOM 0 H SER A 19 5.589 14.487 -1.067 1.00 0.00 H new ATOM 0 HA SER A 19 6.257 15.267 -3.659 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.593 15.538 -2.185 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.788 15.650 -3.923 1.00 0.00 H new ATOM 0 HG SER A 19 4.926 13.437 -3.577 1.00 0.00 H new ATOM 283 N GLY A 20 5.336 17.713 -1.651 1.00 0.00 N ATOM 284 CA GLY A 20 5.309 19.150 -1.496 1.00 0.00 C ATOM 285 C GLY A 20 6.665 19.746 -1.796 1.00 0.00 C ATOM 286 O GLY A 20 6.762 20.792 -2.437 1.00 0.00 O ATOM 0 H GLY A 20 5.060 17.190 -0.820 1.00 0.00 H new ATOM 0 HA2 GLY A 20 4.562 19.579 -2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.011 19.405 -0.479 1.00 0.00 H new ATOM 290 N LYS A 21 7.714 19.094 -1.312 1.00 0.00 N ATOM 291 CA LYS A 21 9.063 19.596 -1.512 1.00 0.00 C ATOM 292 C LYS A 21 9.406 19.559 -2.988 1.00 0.00 C ATOM 293 O LYS A 21 9.997 20.498 -3.531 1.00 0.00 O ATOM 294 CB LYS A 21 10.065 18.716 -0.759 1.00 0.00 C ATOM 295 CG LYS A 21 9.647 18.588 0.703 1.00 0.00 C ATOM 296 CD LYS A 21 9.636 19.959 1.391 1.00 0.00 C ATOM 297 CE LYS A 21 8.852 19.869 2.715 1.00 0.00 C ATOM 298 NZ LYS A 21 8.449 18.453 2.992 1.00 0.00 N ATOM 0 H LYS A 21 7.656 18.224 -0.783 1.00 0.00 H new ATOM 0 HA LYS A 21 9.115 20.619 -1.139 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.114 17.730 -1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.063 19.149 -0.824 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.656 18.138 0.764 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.333 17.920 1.224 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.657 20.288 1.583 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.180 20.702 0.737 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.465 20.245 3.534 1.00 0.00 H new ATOM 0 HE3 LYS A 21 7.966 20.502 2.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 8.106 18.375 3.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.692 18.173 2.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 9.269 17.827 2.862 1.00 0.00 H new ATOM 312 N GLU A 22 9.107 18.430 -3.614 1.00 0.00 N ATOM 313 CA GLU A 22 9.455 18.232 -4.998 1.00 0.00 C ATOM 314 C GLU A 22 8.608 19.104 -5.911 1.00 0.00 C ATOM 315 O GLU A 22 9.133 19.726 -6.836 1.00 0.00 O ATOM 316 CB GLU A 22 9.370 16.759 -5.375 1.00 0.00 C ATOM 317 CG GLU A 22 10.438 15.969 -4.614 1.00 0.00 C ATOM 318 CD GLU A 22 10.267 14.489 -4.860 1.00 0.00 C ATOM 319 OE1 GLU A 22 9.270 14.122 -5.438 1.00 0.00 O ATOM 320 OE2 GLU A 22 11.125 13.741 -4.459 1.00 0.00 O ATOM 0 H GLU A 22 8.625 17.643 -3.179 1.00 0.00 H new ATOM 0 HA GLU A 22 10.491 18.543 -5.134 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.379 16.370 -5.139 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.512 16.640 -6.449 1.00 0.00 H new ATOM 0 HG2 GLU A 22 11.431 16.286 -4.933 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.364 16.178 -3.547 1.00 0.00 H new ATOM 327 N GLY A 23 7.311 19.209 -5.622 1.00 0.00 N ATOM 328 CA GLY A 23 6.452 20.074 -6.425 1.00 0.00 C ATOM 329 C GLY A 23 4.974 19.737 -6.294 1.00 0.00 C ATOM 330 O GLY A 23 4.191 20.534 -5.760 1.00 0.00 O ATOM 0 H GLY A 23 6.843 18.720 -4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 23 6.610 21.110 -6.127 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.745 19.996 -7.472 1.00 0.00 H new ATOM 334 N ASP A 24 4.574 18.628 -6.899 1.00 0.00 N ATOM 335 CA ASP A 24 3.158 18.255 -7.005 1.00 0.00 C ATOM 336 C ASP A 24 2.510 18.077 -5.647 1.00 0.00 C ATOM 337 O ASP A 24 3.182 17.774 -4.657 1.00 0.00 O ATOM 338 CB ASP A 24 2.988 16.967 -7.816 1.00 0.00 C ATOM 339 CG ASP A 24 1.559 16.852 -8.306 1.00 0.00 C ATOM 340 OD1 ASP A 24 0.737 16.355 -7.568 1.00 0.00 O ATOM 341 OD2 ASP A 24 1.303 17.277 -9.418 1.00 0.00 O ATOM 0 H ASP A 24 5.213 17.960 -7.330 1.00 0.00 H new ATOM 0 HA ASP A 24 2.660 19.078 -7.518 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.673 16.967 -8.663 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.242 16.103 -7.201 1.00 0.00 H new ATOM 346 N LYS A 25 1.190 18.209 -5.609 1.00 0.00 N ATOM 347 CA LYS A 25 0.446 17.965 -4.384 1.00 0.00 C ATOM 348 C LYS A 25 0.542 16.494 -4.019 1.00 0.00 C ATOM 349 O LYS A 25 0.630 16.140 -2.833 1.00 0.00 O ATOM 350 CB LYS A 25 -1.025 18.427 -4.499 1.00 0.00 C ATOM 351 CG LYS A 25 -1.656 17.950 -5.810 1.00 0.00 C ATOM 352 CD LYS A 25 -1.599 19.062 -6.860 1.00 0.00 C ATOM 353 CE LYS A 25 -2.253 18.555 -8.146 1.00 0.00 C ATOM 354 NZ LYS A 25 -3.720 18.394 -7.936 1.00 0.00 N ATOM 0 H LYS A 25 0.617 18.482 -6.408 1.00 0.00 H new ATOM 0 HA LYS A 25 0.891 18.558 -3.585 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.597 18.040 -3.656 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.072 19.515 -4.444 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.130 17.068 -6.175 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -2.691 17.655 -5.638 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.116 19.951 -6.498 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.565 19.350 -7.050 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -2.067 19.256 -8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -1.811 17.602 -8.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -4.232 18.778 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.947 17.385 -7.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.006 18.907 -7.078 1.00 0.00 H new ATOM 368 N TYR A 26 0.655 15.648 -5.043 1.00 0.00 N ATOM 369 CA TYR A 26 0.900 14.236 -4.825 1.00 0.00 C ATOM 370 C TYR A 26 1.707 13.623 -5.974 1.00 0.00 C ATOM 371 O TYR A 26 1.153 12.903 -6.805 1.00 0.00 O ATOM 372 CB TYR A 26 -0.441 13.487 -4.675 1.00 0.00 C ATOM 373 CG TYR A 26 -1.519 14.182 -5.494 1.00 0.00 C ATOM 374 CD1 TYR A 26 -1.480 14.145 -6.893 1.00 0.00 C ATOM 375 CD2 TYR A 26 -2.549 14.875 -4.852 1.00 0.00 C ATOM 376 CE1 TYR A 26 -2.462 14.793 -7.637 1.00 0.00 C ATOM 377 CE2 TYR A 26 -3.527 15.520 -5.603 1.00 0.00 C ATOM 378 CZ TYR A 26 -3.484 15.480 -6.988 1.00 0.00 C ATOM 379 OH TYR A 26 -4.453 16.127 -7.716 1.00 0.00 O ATOM 0 H TYR A 26 0.580 15.921 -6.023 1.00 0.00 H new ATOM 0 HA TYR A 26 1.483 14.135 -3.909 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -0.330 12.455 -5.007 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -0.734 13.455 -3.626 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -0.686 13.613 -7.396 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.586 14.910 -3.773 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -2.431 14.763 -8.716 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -4.323 16.054 -5.105 1.00 0.00 H new ATOM 0 HH TYR A 26 -5.223 15.533 -7.837 1.00 0.00 H new ATOM 389 N LYS A 27 3.013 13.628 -5.808 1.00 0.00 N ATOM 390 CA LYS A 27 3.931 12.862 -6.640 1.00 0.00 C ATOM 391 C LYS A 27 5.223 12.702 -5.892 1.00 0.00 C ATOM 392 O LYS A 27 5.548 13.527 -5.037 1.00 0.00 O ATOM 393 CB LYS A 27 4.215 13.526 -8.003 1.00 0.00 C ATOM 394 CG LYS A 27 2.971 13.535 -8.918 1.00 0.00 C ATOM 395 CD LYS A 27 2.457 12.098 -9.180 1.00 0.00 C ATOM 396 CE LYS A 27 3.499 11.275 -9.947 1.00 0.00 C ATOM 397 NZ LYS A 27 3.975 12.030 -11.129 1.00 0.00 N ATOM 0 H LYS A 27 3.479 14.171 -5.081 1.00 0.00 H new ATOM 0 HA LYS A 27 3.462 11.901 -6.850 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.554 14.550 -7.843 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.027 12.996 -8.501 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.181 14.128 -8.456 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.217 14.014 -9.866 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.229 11.611 -8.232 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.528 12.138 -9.749 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.339 11.039 -9.294 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.064 10.327 -10.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 4.323 11.365 -11.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 3.191 12.588 -11.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.746 12.668 -10.846 1.00 0.00 H new ATOM 411 N LEU A 28 5.968 11.681 -6.211 1.00 0.00 N ATOM 412 CA LEU A 28 7.237 11.478 -5.577 1.00 0.00 C ATOM 413 C LEU A 28 8.315 11.265 -6.631 1.00 0.00 C ATOM 414 O LEU A 28 8.116 10.531 -7.599 1.00 0.00 O ATOM 415 CB LEU A 28 7.144 10.297 -4.612 1.00 0.00 C ATOM 416 CG LEU A 28 8.491 10.047 -3.939 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.835 11.220 -3.005 1.00 0.00 C ATOM 418 CD2 LEU A 28 8.404 8.762 -3.122 1.00 0.00 C ATOM 0 H LEU A 28 5.717 10.978 -6.906 1.00 0.00 H new ATOM 0 HA LEU A 28 7.510 12.362 -5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.385 10.497 -3.856 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.829 9.404 -5.151 1.00 0.00 H new ATOM 0 HG LEU A 28 9.267 9.956 -4.699 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.797 11.035 -2.528 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.888 12.142 -3.584 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.064 11.315 -2.241 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.362 8.574 -2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.627 8.864 -2.364 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.161 7.928 -3.780 1.00 0.00 H new ATOM 430 N SER A 29 9.411 11.955 -6.482 1.00 0.00 N ATOM 431 CA SER A 29 10.511 11.865 -7.410 1.00 0.00 C ATOM 432 C SER A 29 11.629 11.033 -6.786 1.00 0.00 C ATOM 433 O SER A 29 11.517 10.599 -5.631 1.00 0.00 O ATOM 434 CB SER A 29 10.999 13.265 -7.787 1.00 0.00 C ATOM 435 OG SER A 29 9.886 14.161 -7.819 1.00 0.00 O ATOM 0 H SER A 29 9.570 12.601 -5.709 1.00 0.00 H new ATOM 0 HA SER A 29 10.183 11.373 -8.326 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.739 13.611 -7.065 1.00 0.00 H new ATOM 0 HB3 SER A 29 11.490 13.242 -8.760 1.00 0.00 H new ATOM 0 HG SER A 29 9.363 14.062 -6.996 1.00 0.00 H new ATOM 441 N LYS A 30 12.665 10.744 -7.543 1.00 0.00 N ATOM 442 CA LYS A 30 13.725 9.875 -7.045 1.00 0.00 C ATOM 443 C LYS A 30 14.635 10.609 -6.069 1.00 0.00 C ATOM 444 O LYS A 30 15.496 9.995 -5.433 1.00 0.00 O ATOM 445 CB LYS A 30 14.552 9.298 -8.200 1.00 0.00 C ATOM 446 CG LYS A 30 13.629 8.769 -9.317 1.00 0.00 C ATOM 447 CD LYS A 30 12.548 7.834 -8.743 1.00 0.00 C ATOM 448 CE LYS A 30 13.175 6.522 -8.243 1.00 0.00 C ATOM 449 NZ LYS A 30 14.062 5.946 -9.283 1.00 0.00 N ATOM 0 H LYS A 30 12.802 11.089 -8.493 1.00 0.00 H new ATOM 0 HA LYS A 30 13.245 9.053 -6.513 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.213 10.067 -8.601 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.187 8.491 -7.833 1.00 0.00 H new ATOM 0 HG2 LYS A 30 13.156 9.606 -9.830 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.221 8.234 -10.060 1.00 0.00 H new ATOM 0 HD2 LYS A 30 12.029 8.330 -7.923 1.00 0.00 H new ATOM 0 HD3 LYS A 30 11.803 7.618 -9.509 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.744 6.707 -7.332 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.390 5.809 -7.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.544 5.107 -8.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 13.495 5.674 -10.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 14.770 6.653 -9.566 1.00 0.00 H new ATOM 463 N LYS A 31 14.417 11.908 -5.919 1.00 0.00 N ATOM 464 CA LYS A 31 15.216 12.699 -4.989 1.00 0.00 C ATOM 465 C LYS A 31 14.903 12.268 -3.569 1.00 0.00 C ATOM 466 O LYS A 31 15.712 11.626 -2.902 1.00 0.00 O ATOM 467 CB LYS A 31 14.956 14.228 -5.145 1.00 0.00 C ATOM 468 CG LYS A 31 13.828 14.494 -6.155 1.00 0.00 C ATOM 469 CD LYS A 31 13.600 15.996 -6.323 1.00 0.00 C ATOM 470 CE LYS A 31 12.548 16.221 -7.424 1.00 0.00 C ATOM 471 NZ LYS A 31 12.617 17.627 -7.913 1.00 0.00 N ATOM 0 H LYS A 31 13.702 12.433 -6.422 1.00 0.00 H new ATOM 0 HA LYS A 31 16.267 12.522 -5.216 1.00 0.00 H new ATOM 0 HB2 LYS A 31 14.692 14.656 -4.178 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.869 14.724 -5.475 1.00 0.00 H new ATOM 0 HG2 LYS A 31 14.082 14.049 -7.117 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.909 14.017 -5.816 1.00 0.00 H new ATOM 0 HD2 LYS A 31 13.262 16.433 -5.384 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.534 16.492 -6.587 1.00 0.00 H new ATOM 0 HE2 LYS A 31 12.720 15.531 -8.250 1.00 0.00 H new ATOM 0 HE3 LYS A 31 11.552 16.011 -7.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 11.904 17.771 -8.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.432 18.279 -7.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 13.564 17.814 -8.301 1.00 0.00 H new ATOM 485 N GLU A 32 13.703 12.592 -3.135 1.00 0.00 N ATOM 486 CA GLU A 32 13.244 12.248 -1.809 1.00 0.00 C ATOM 487 C GLU A 32 13.012 10.745 -1.650 1.00 0.00 C ATOM 488 O GLU A 32 13.101 10.230 -0.550 1.00 0.00 O ATOM 489 CB GLU A 32 11.963 13.028 -1.479 1.00 0.00 C ATOM 490 CG GLU A 32 12.289 14.527 -1.397 1.00 0.00 C ATOM 491 CD GLU A 32 13.205 14.802 -0.226 1.00 0.00 C ATOM 492 OE1 GLU A 32 12.779 14.605 0.888 1.00 0.00 O ATOM 493 OE2 GLU A 32 14.328 15.176 -0.456 1.00 0.00 O ATOM 0 H GLU A 32 13.019 13.102 -3.694 1.00 0.00 H new ATOM 0 HA GLU A 32 14.029 12.526 -1.106 1.00 0.00 H new ATOM 0 HB2 GLU A 32 11.207 12.850 -2.244 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.546 12.682 -0.533 1.00 0.00 H new ATOM 0 HG2 GLU A 32 12.763 14.854 -2.323 1.00 0.00 H new ATOM 0 HG3 GLU A 32 11.369 15.101 -1.290 1.00 0.00 H new ATOM 500 N LEU A 33 12.546 10.087 -2.711 1.00 0.00 N ATOM 501 CA LEU A 33 12.044 8.709 -2.589 1.00 0.00 C ATOM 502 C LEU A 33 13.066 7.747 -2.003 1.00 0.00 C ATOM 503 O LEU A 33 12.762 7.046 -1.032 1.00 0.00 O ATOM 504 CB LEU A 33 11.568 8.200 -3.964 1.00 0.00 C ATOM 505 CG LEU A 33 11.177 6.692 -3.956 1.00 0.00 C ATOM 506 CD1 LEU A 33 12.402 5.816 -4.253 1.00 0.00 C ATOM 507 CD2 LEU A 33 10.551 6.264 -2.614 1.00 0.00 C ATOM 0 H LEU A 33 12.503 10.474 -3.654 1.00 0.00 H new ATOM 0 HA LEU A 33 11.209 8.740 -1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.710 8.790 -4.286 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.358 8.360 -4.697 1.00 0.00 H new ATOM 0 HG LEU A 33 10.430 6.553 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 33 12.109 4.766 -4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.803 6.072 -5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.165 5.987 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 33 10.294 5.205 -2.654 1.00 0.00 H new ATOM 0 HD22 LEU A 33 11.265 6.434 -1.809 1.00 0.00 H new ATOM 0 HD23 LEU A 33 9.650 6.849 -2.430 1.00 0.00 H new ATOM 519 N LYS A 34 14.282 7.728 -2.527 1.00 0.00 N ATOM 520 CA LYS A 34 15.263 6.809 -1.967 1.00 0.00 C ATOM 521 C LYS A 34 15.562 7.159 -0.531 1.00 0.00 C ATOM 522 O LYS A 34 15.590 6.280 0.337 1.00 0.00 O ATOM 523 CB LYS A 34 16.553 6.719 -2.785 1.00 0.00 C ATOM 524 CG LYS A 34 16.282 6.014 -4.119 1.00 0.00 C ATOM 525 CD LYS A 34 17.611 5.703 -4.822 1.00 0.00 C ATOM 526 CE LYS A 34 18.304 7.005 -5.241 1.00 0.00 C ATOM 527 NZ LYS A 34 19.282 7.417 -4.192 1.00 0.00 N ATOM 0 H LYS A 34 14.604 8.308 -3.302 1.00 0.00 H new ATOM 0 HA LYS A 34 14.810 5.818 -2.008 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.948 7.718 -2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 34 17.312 6.173 -2.224 1.00 0.00 H new ATOM 0 HG2 LYS A 34 15.726 5.092 -3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.662 6.646 -4.755 1.00 0.00 H new ATOM 0 HD2 LYS A 34 18.260 5.135 -4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 34 17.431 5.080 -5.698 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.815 6.865 -6.193 1.00 0.00 H new ATOM 0 HE3 LYS A 34 17.563 7.791 -5.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 19.094 8.400 -3.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 19.186 6.794 -3.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 20.248 7.344 -4.570 1.00 0.00 H new ATOM 541 N GLU A 35 15.687 8.449 -0.264 1.00 0.00 N ATOM 542 CA GLU A 35 15.906 8.918 1.090 1.00 0.00 C ATOM 543 C GLU A 35 14.680 8.601 1.925 1.00 0.00 C ATOM 544 O GLU A 35 14.781 8.081 3.030 1.00 0.00 O ATOM 545 CB GLU A 35 16.120 10.430 1.084 1.00 0.00 C ATOM 546 CG GLU A 35 17.440 10.772 0.383 1.00 0.00 C ATOM 547 CD GLU A 35 17.603 12.277 0.280 1.00 0.00 C ATOM 548 OE1 GLU A 35 16.806 12.990 0.862 1.00 0.00 O ATOM 549 OE2 GLU A 35 18.520 12.698 -0.371 1.00 0.00 O ATOM 0 H GLU A 35 15.640 9.187 -0.967 1.00 0.00 H new ATOM 0 HA GLU A 35 16.786 8.427 1.506 1.00 0.00 H new ATOM 0 HB2 GLU A 35 15.291 10.921 0.574 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.134 10.807 2.107 1.00 0.00 H new ATOM 0 HG2 GLU A 35 18.276 10.345 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 35 17.458 10.328 -0.612 1.00 0.00 H new ATOM 556 N LEU A 36 13.524 8.862 1.354 1.00 0.00 N ATOM 557 CA LEU A 36 12.256 8.608 2.004 1.00 0.00 C ATOM 558 C LEU A 36 12.090 7.139 2.333 1.00 0.00 C ATOM 559 O LEU A 36 11.743 6.789 3.465 1.00 0.00 O ATOM 560 CB LEU A 36 11.116 9.107 1.073 1.00 0.00 C ATOM 561 CG LEU A 36 9.808 8.320 1.269 1.00 0.00 C ATOM 562 CD1 LEU A 36 9.322 8.426 2.708 1.00 0.00 C ATOM 563 CD2 LEU A 36 8.730 8.882 0.335 1.00 0.00 C ATOM 0 H LEU A 36 13.437 9.259 0.419 1.00 0.00 H new ATOM 0 HA LEU A 36 12.218 9.147 2.951 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.932 10.164 1.264 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.436 9.021 0.034 1.00 0.00 H new ATOM 0 HG LEU A 36 9.999 7.272 1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.396 7.862 2.822 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.079 8.020 3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.142 9.472 2.955 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.803 8.325 0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.560 9.933 0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.060 8.787 -0.700 1.00 0.00 H new ATOM 575 N LEU A 37 12.350 6.278 1.368 1.00 0.00 N ATOM 576 CA LEU A 37 12.173 4.854 1.600 1.00 0.00 C ATOM 577 C LEU A 37 13.117 4.345 2.681 1.00 0.00 C ATOM 578 O LEU A 37 12.687 3.704 3.640 1.00 0.00 O ATOM 579 CB LEU A 37 12.338 4.056 0.289 1.00 0.00 C ATOM 580 CG LEU A 37 12.092 2.540 0.509 1.00 0.00 C ATOM 581 CD1 LEU A 37 13.351 1.862 1.060 1.00 0.00 C ATOM 582 CD2 LEU A 37 10.925 2.312 1.474 1.00 0.00 C ATOM 0 H LEU A 37 12.677 6.529 0.435 1.00 0.00 H new ATOM 0 HA LEU A 37 11.155 4.700 1.959 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.640 4.434 -0.458 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.342 4.209 -0.107 1.00 0.00 H new ATOM 0 HG LEU A 37 11.844 2.100 -0.457 1.00 0.00 H new ATOM 0 HD11 LEU A 37 13.157 0.799 1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 37 14.171 1.987 0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 37 13.622 2.317 2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.771 1.242 1.613 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.152 2.774 2.435 1.00 0.00 H new ATOM 0 HD23 LEU A 37 10.020 2.758 1.062 1.00 0.00 H new ATOM 594 N GLN A 38 14.384 4.696 2.573 1.00 0.00 N ATOM 595 CA GLN A 38 15.346 4.278 3.580 1.00 0.00 C ATOM 596 C GLN A 38 15.033 4.933 4.913 1.00 0.00 C ATOM 597 O GLN A 38 15.206 4.334 5.977 1.00 0.00 O ATOM 598 CB GLN A 38 16.787 4.590 3.132 1.00 0.00 C ATOM 599 CG GLN A 38 16.997 6.099 2.994 1.00 0.00 C ATOM 600 CD GLN A 38 18.369 6.380 2.396 1.00 0.00 C ATOM 601 OE1 GLN A 38 18.638 5.995 1.254 1.00 0.00 O ATOM 602 NE2 GLN A 38 19.253 7.020 3.089 1.00 0.00 N ATOM 0 H GLN A 38 14.768 5.259 1.814 1.00 0.00 H new ATOM 0 HA GLN A 38 15.267 3.198 3.703 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.494 4.184 3.856 1.00 0.00 H new ATOM 0 HB3 GLN A 38 16.991 4.101 2.179 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.220 6.526 2.360 1.00 0.00 H new ATOM 0 HG3 GLN A 38 16.911 6.577 3.970 1.00 0.00 H new ATOM 0 HE21 GLN A 38 19.030 7.338 4.032 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.174 7.207 2.693 1.00 0.00 H new ATOM 611 N THR A 39 14.655 6.195 4.852 1.00 0.00 N ATOM 612 CA THR A 39 14.372 6.964 6.040 1.00 0.00 C ATOM 613 C THR A 39 13.159 6.444 6.809 1.00 0.00 C ATOM 614 O THR A 39 13.237 6.251 8.018 1.00 0.00 O ATOM 615 CB THR A 39 14.165 8.424 5.655 1.00 0.00 C ATOM 616 OG1 THR A 39 15.369 8.932 5.106 1.00 0.00 O ATOM 617 CG2 THR A 39 13.771 9.242 6.873 1.00 0.00 C ATOM 0 H THR A 39 14.537 6.711 3.980 1.00 0.00 H new ATOM 0 HA THR A 39 15.228 6.865 6.708 1.00 0.00 H new ATOM 0 HB THR A 39 13.364 8.491 4.919 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.557 8.481 4.257 1.00 0.00 H new ATOM 0 HG21 THR A 39 13.627 10.282 6.581 1.00 0.00 H new ATOM 0 HG22 THR A 39 12.843 8.850 7.290 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.560 9.181 7.623 1.00 0.00 H new ATOM 625 N GLU A 40 12.031 6.289 6.133 1.00 0.00 N ATOM 626 CA GLU A 40 10.819 5.886 6.833 1.00 0.00 C ATOM 627 C GLU A 40 10.848 4.424 7.230 1.00 0.00 C ATOM 628 O GLU A 40 10.414 4.062 8.315 1.00 0.00 O ATOM 629 CB GLU A 40 9.566 6.204 6.023 1.00 0.00 C ATOM 630 CG GLU A 40 9.460 7.726 5.808 1.00 0.00 C ATOM 631 CD GLU A 40 9.326 8.484 7.122 1.00 0.00 C ATOM 632 OE1 GLU A 40 8.932 7.894 8.106 1.00 0.00 O ATOM 633 OE2 GLU A 40 9.610 9.662 7.119 1.00 0.00 O ATOM 0 H GLU A 40 11.928 6.431 5.128 1.00 0.00 H new ATOM 0 HA GLU A 40 10.782 6.473 7.751 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.603 5.693 5.061 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.681 5.838 6.544 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.343 8.078 5.276 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.599 7.943 5.176 1.00 0.00 H new ATOM 640 N LEU A 41 11.344 3.585 6.347 1.00 0.00 N ATOM 641 CA LEU A 41 11.385 2.154 6.609 1.00 0.00 C ATOM 642 C LEU A 41 12.651 1.757 7.322 1.00 0.00 C ATOM 643 O LEU A 41 13.292 0.792 6.950 1.00 0.00 O ATOM 644 CB LEU A 41 11.208 1.348 5.317 1.00 0.00 C ATOM 645 CG LEU A 41 9.712 1.114 5.067 1.00 0.00 C ATOM 646 CD1 LEU A 41 9.013 2.449 4.808 1.00 0.00 C ATOM 647 CD2 LEU A 41 9.524 0.193 3.862 1.00 0.00 C ATOM 0 H LEU A 41 11.725 3.863 5.442 1.00 0.00 H new ATOM 0 HA LEU A 41 10.549 1.921 7.268 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.649 1.884 4.477 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.729 0.394 5.396 1.00 0.00 H new ATOM 0 HG LEU A 41 9.274 0.645 5.948 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.951 2.276 4.631 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.135 3.098 5.675 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.453 2.926 3.933 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.460 0.031 3.690 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.968 0.653 2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 41 10.010 -0.763 4.056 1.00 0.00 H new ATOM 659 N SER A 42 13.028 2.515 8.322 1.00 0.00 N ATOM 660 CA SER A 42 14.275 2.268 9.015 1.00 0.00 C ATOM 661 C SER A 42 14.360 0.828 9.528 1.00 0.00 C ATOM 662 O SER A 42 15.351 0.132 9.279 1.00 0.00 O ATOM 663 CB SER A 42 14.393 3.240 10.188 1.00 0.00 C ATOM 664 OG SER A 42 13.092 3.779 10.490 1.00 0.00 O ATOM 0 H SER A 42 12.493 3.308 8.676 1.00 0.00 H new ATOM 0 HA SER A 42 15.095 2.419 8.313 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.799 2.728 11.060 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.085 4.045 9.940 1.00 0.00 H new ATOM 0 HG SER A 42 12.484 3.050 10.732 1.00 0.00 H new ATOM 670 N GLY A 43 13.305 0.359 10.169 1.00 0.00 N ATOM 671 CA GLY A 43 13.269 -1.014 10.671 1.00 0.00 C ATOM 672 C GLY A 43 13.175 -2.019 9.532 1.00 0.00 C ATOM 673 O GLY A 43 13.902 -3.022 9.505 1.00 0.00 O ATOM 0 H GLY A 43 12.462 0.901 10.357 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.165 -1.211 11.260 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.416 -1.137 11.338 1.00 0.00 H new ATOM 677 N PHE A 44 12.318 -1.726 8.570 1.00 0.00 N ATOM 678 CA PHE A 44 12.164 -2.587 7.406 1.00 0.00 C ATOM 679 C PHE A 44 13.417 -2.567 6.584 1.00 0.00 C ATOM 680 O PHE A 44 13.961 -3.608 6.235 1.00 0.00 O ATOM 681 CB PHE A 44 10.950 -2.176 6.556 1.00 0.00 C ATOM 682 CG PHE A 44 9.679 -2.697 7.189 1.00 0.00 C ATOM 683 CD1 PHE A 44 9.369 -4.055 7.089 1.00 0.00 C ATOM 684 CD2 PHE A 44 8.813 -1.831 7.871 1.00 0.00 C ATOM 685 CE1 PHE A 44 8.198 -4.552 7.667 1.00 0.00 C ATOM 686 CE2 PHE A 44 7.639 -2.336 8.448 1.00 0.00 C ATOM 687 CZ PHE A 44 7.335 -3.695 8.345 1.00 0.00 C ATOM 0 H PHE A 44 11.718 -0.901 8.570 1.00 0.00 H new ATOM 0 HA PHE A 44 11.986 -3.603 7.758 1.00 0.00 H new ATOM 0 HB2 PHE A 44 10.906 -1.090 6.471 1.00 0.00 H new ATOM 0 HB3 PHE A 44 11.052 -2.571 5.545 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.036 -4.723 6.564 1.00 0.00 H new ATOM 0 HD2 PHE A 44 9.049 -0.780 7.952 1.00 0.00 H new ATOM 0 HE1 PHE A 44 7.962 -5.603 7.588 1.00 0.00 H new ATOM 0 HE2 PHE A 44 6.968 -1.672 8.973 1.00 0.00 H new ATOM 0 HZ PHE A 44 6.431 -4.081 8.791 1.00 0.00 H new ATOM 697 N LEU A 45 13.962 -1.389 6.428 1.00 0.00 N ATOM 698 CA LEU A 45 15.223 -1.232 5.771 1.00 0.00 C ATOM 699 C LEU A 45 16.292 -1.975 6.524 1.00 0.00 C ATOM 700 O LEU A 45 17.048 -2.731 5.935 1.00 0.00 O ATOM 701 CB LEU A 45 15.581 0.255 5.674 1.00 0.00 C ATOM 702 CG LEU A 45 17.001 0.410 5.148 1.00 0.00 C ATOM 703 CD1 LEU A 45 17.141 -0.239 3.768 1.00 0.00 C ATOM 704 CD2 LEU A 45 17.372 1.891 5.064 1.00 0.00 C ATOM 0 H LEU A 45 13.543 -0.518 6.753 1.00 0.00 H new ATOM 0 HA LEU A 45 15.152 -1.644 4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.881 0.765 5.012 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.493 0.724 6.654 1.00 0.00 H new ATOM 0 HG LEU A 45 17.679 -0.091 5.839 1.00 0.00 H new ATOM 0 HD11 LEU A 45 18.163 -0.117 3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.906 -1.301 3.840 1.00 0.00 H new ATOM 0 HD13 LEU A 45 16.453 0.238 3.070 1.00 0.00 H new ATOM 0 HD21 LEU A 45 18.390 1.990 4.687 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.684 2.401 4.390 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.307 2.339 6.056 1.00 0.00 H new ATOM 716 N ASP A 46 16.301 -1.815 7.839 1.00 0.00 N ATOM 717 CA ASP A 46 17.289 -2.477 8.678 1.00 0.00 C ATOM 718 C ASP A 46 17.247 -3.980 8.456 1.00 0.00 C ATOM 719 O ASP A 46 18.265 -4.607 8.175 1.00 0.00 O ATOM 720 CB ASP A 46 17.014 -2.153 10.155 1.00 0.00 C ATOM 721 CG ASP A 46 18.018 -2.833 11.054 1.00 0.00 C ATOM 722 OD1 ASP A 46 19.184 -2.505 10.962 1.00 0.00 O ATOM 723 OD2 ASP A 46 17.609 -3.660 11.841 1.00 0.00 O ATOM 0 H ASP A 46 15.636 -1.233 8.348 1.00 0.00 H new ATOM 0 HA ASP A 46 18.282 -2.115 8.411 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.055 -1.075 10.308 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.007 -2.474 10.420 1.00 0.00 H new ATOM 728 N ALA A 47 16.055 -4.537 8.467 1.00 0.00 N ATOM 729 CA ALA A 47 15.890 -5.954 8.168 1.00 0.00 C ATOM 730 C ALA A 47 16.232 -6.246 6.712 1.00 0.00 C ATOM 731 O ALA A 47 16.703 -7.336 6.378 1.00 0.00 O ATOM 732 CB ALA A 47 14.466 -6.410 8.466 1.00 0.00 C ATOM 0 H ALA A 47 15.189 -4.040 8.677 1.00 0.00 H new ATOM 0 HA ALA A 47 16.577 -6.509 8.807 1.00 0.00 H new ATOM 0 HB1 ALA A 47 14.368 -7.471 8.235 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.245 -6.246 9.521 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.766 -5.839 7.856 1.00 0.00 H new ATOM 738 N GLN A 48 15.884 -5.312 5.840 1.00 0.00 N ATOM 739 CA GLN A 48 16.036 -5.490 4.396 1.00 0.00 C ATOM 740 C GLN A 48 17.431 -5.139 3.880 1.00 0.00 C ATOM 741 O GLN A 48 17.676 -5.206 2.673 1.00 0.00 O ATOM 742 CB GLN A 48 14.960 -4.702 3.637 1.00 0.00 C ATOM 743 CG GLN A 48 13.582 -5.290 3.973 1.00 0.00 C ATOM 744 CD GLN A 48 13.516 -6.724 3.499 1.00 0.00 C ATOM 745 OE1 GLN A 48 13.488 -6.980 2.302 1.00 0.00 O ATOM 746 NE2 GLN A 48 13.532 -7.677 4.369 1.00 0.00 N ATOM 0 H GLN A 48 15.489 -4.410 6.108 1.00 0.00 H new ATOM 0 HA GLN A 48 15.903 -6.555 4.205 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.998 -3.649 3.915 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.141 -4.755 2.563 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.407 -5.243 5.048 1.00 0.00 H new ATOM 0 HG3 GLN A 48 12.798 -4.702 3.496 1.00 0.00 H new ATOM 0 HE21 GLN A 48 13.555 -7.458 5.365 1.00 0.00 H new ATOM 0 HE22 GLN A 48 13.521 -8.649 4.061 1.00 0.00 H new ATOM 755 N LYS A 49 18.329 -4.745 4.771 1.00 0.00 N ATOM 756 CA LYS A 49 19.672 -4.312 4.346 1.00 0.00 C ATOM 757 C LYS A 49 20.396 -5.419 3.588 1.00 0.00 C ATOM 758 O LYS A 49 21.160 -5.148 2.654 1.00 0.00 O ATOM 759 CB LYS A 49 20.532 -3.838 5.533 1.00 0.00 C ATOM 760 CG LYS A 49 19.941 -2.544 6.122 1.00 0.00 C ATOM 761 CD LYS A 49 20.862 -1.974 7.223 1.00 0.00 C ATOM 762 CE LYS A 49 20.902 -2.928 8.427 1.00 0.00 C ATOM 763 NZ LYS A 49 21.206 -2.179 9.661 1.00 0.00 N ATOM 0 H LYS A 49 18.167 -4.712 5.777 1.00 0.00 H new ATOM 0 HA LYS A 49 19.527 -3.464 3.677 1.00 0.00 H new ATOM 0 HB2 LYS A 49 20.570 -4.613 6.299 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.557 -3.664 5.205 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.811 -1.805 5.331 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.953 -2.745 6.536 1.00 0.00 H new ATOM 0 HD2 LYS A 49 21.868 -1.832 6.828 1.00 0.00 H new ATOM 0 HD3 LYS A 49 20.502 -0.994 7.538 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.944 -3.437 8.529 1.00 0.00 H new ATOM 0 HE3 LYS A 49 21.656 -3.698 8.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 22.118 -2.499 10.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.258 -1.163 9.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 20.457 -2.347 10.363 1.00 0.00 H new ATOM 777 N ASP A 50 20.203 -6.657 4.015 1.00 0.00 N ATOM 778 CA ASP A 50 20.862 -7.800 3.373 1.00 0.00 C ATOM 779 C ASP A 50 19.848 -8.721 2.698 1.00 0.00 C ATOM 780 O ASP A 50 19.978 -9.949 2.744 1.00 0.00 O ATOM 781 CB ASP A 50 21.721 -8.588 4.380 1.00 0.00 C ATOM 782 CG ASP A 50 22.544 -9.655 3.671 1.00 0.00 C ATOM 783 OD1 ASP A 50 22.783 -9.516 2.484 1.00 0.00 O ATOM 784 OD2 ASP A 50 22.930 -10.601 4.327 1.00 0.00 O ATOM 0 H ASP A 50 19.599 -6.903 4.800 1.00 0.00 H new ATOM 0 HA ASP A 50 21.522 -7.401 2.602 1.00 0.00 H new ATOM 0 HB2 ASP A 50 22.384 -7.905 4.912 1.00 0.00 H new ATOM 0 HB3 ASP A 50 21.078 -9.055 5.126 1.00 0.00 H new ATOM 789 N VAL A 51 18.807 -8.135 2.122 1.00 0.00 N ATOM 790 CA VAL A 51 17.765 -8.914 1.453 1.00 0.00 C ATOM 791 C VAL A 51 17.761 -8.678 -0.067 1.00 0.00 C ATOM 792 O VAL A 51 17.134 -9.432 -0.817 1.00 0.00 O ATOM 793 CB VAL A 51 16.395 -8.614 2.085 1.00 0.00 C ATOM 794 CG1 VAL A 51 15.296 -9.435 1.398 1.00 0.00 C ATOM 795 CG2 VAL A 51 16.445 -8.996 3.572 1.00 0.00 C ATOM 0 H VAL A 51 18.659 -7.126 2.103 1.00 0.00 H new ATOM 0 HA VAL A 51 17.982 -9.972 1.597 1.00 0.00 H new ATOM 0 HB VAL A 51 16.171 -7.554 1.967 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.333 -9.211 1.857 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.261 -9.181 0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.512 -10.498 1.509 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.480 -8.789 4.034 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.672 -10.058 3.667 1.00 0.00 H new ATOM 0 HG23 VAL A 51 17.219 -8.413 4.072 1.00 0.00 H new ATOM 805 N ASP A 52 18.469 -7.646 -0.511 1.00 0.00 N ATOM 806 CA ASP A 52 18.586 -7.298 -1.944 1.00 0.00 C ATOM 807 C ASP A 52 17.241 -6.937 -2.581 1.00 0.00 C ATOM 808 O ASP A 52 17.181 -6.117 -3.497 1.00 0.00 O ATOM 809 CB ASP A 52 19.257 -8.428 -2.737 1.00 0.00 C ATOM 810 CG ASP A 52 19.813 -7.886 -4.042 1.00 0.00 C ATOM 811 OD1 ASP A 52 19.041 -7.632 -4.934 1.00 0.00 O ATOM 812 OD2 ASP A 52 21.012 -7.738 -4.140 1.00 0.00 O ATOM 0 H ASP A 52 18.984 -7.018 0.106 1.00 0.00 H new ATOM 0 HA ASP A 52 19.215 -6.409 -1.988 1.00 0.00 H new ATOM 0 HB2 ASP A 52 20.059 -8.872 -2.147 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.535 -9.219 -2.940 1.00 0.00 H new ATOM 817 N ALA A 53 16.167 -7.531 -2.088 1.00 0.00 N ATOM 818 CA ALA A 53 14.834 -7.278 -2.638 1.00 0.00 C ATOM 819 C ALA A 53 14.531 -5.792 -2.645 1.00 0.00 C ATOM 820 O ALA A 53 13.865 -5.283 -3.551 1.00 0.00 O ATOM 821 CB ALA A 53 13.764 -8.016 -1.825 1.00 0.00 C ATOM 0 H ALA A 53 16.186 -8.191 -1.310 1.00 0.00 H new ATOM 0 HA ALA A 53 14.819 -7.648 -3.663 1.00 0.00 H new ATOM 0 HB1 ALA A 53 12.781 -7.815 -2.250 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.960 -9.088 -1.854 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.790 -7.671 -0.791 1.00 0.00 H new ATOM 827 N VAL A 54 15.053 -5.094 -1.659 1.00 0.00 N ATOM 828 CA VAL A 54 14.853 -3.663 -1.566 1.00 0.00 C ATOM 829 C VAL A 54 15.388 -2.984 -2.821 1.00 0.00 C ATOM 830 O VAL A 54 14.694 -2.176 -3.449 1.00 0.00 O ATOM 831 CB VAL A 54 15.533 -3.109 -0.288 1.00 0.00 C ATOM 832 CG1 VAL A 54 17.046 -3.370 -0.312 1.00 0.00 C ATOM 833 CG2 VAL A 54 15.272 -1.604 -0.153 1.00 0.00 C ATOM 0 H VAL A 54 15.619 -5.494 -0.911 1.00 0.00 H new ATOM 0 HA VAL A 54 13.786 -3.450 -1.493 1.00 0.00 H new ATOM 0 HB VAL A 54 15.104 -3.627 0.570 1.00 0.00 H new ATOM 0 HG11 VAL A 54 17.498 -2.971 0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 54 17.229 -4.443 -0.368 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.486 -2.881 -1.181 1.00 0.00 H new ATOM 0 HG21 VAL A 54 15.756 -1.230 0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 54 15.675 -1.085 -1.023 1.00 0.00 H new ATOM 0 HG23 VAL A 54 14.199 -1.425 -0.090 1.00 0.00 H new ATOM 843 N ASP A 55 16.567 -3.402 -3.248 1.00 0.00 N ATOM 844 CA ASP A 55 17.159 -2.885 -4.469 1.00 0.00 C ATOM 845 C ASP A 55 16.279 -3.194 -5.646 1.00 0.00 C ATOM 846 O ASP A 55 16.074 -2.350 -6.526 1.00 0.00 O ATOM 847 CB ASP A 55 18.517 -3.527 -4.708 1.00 0.00 C ATOM 848 CG ASP A 55 19.113 -2.985 -5.989 1.00 0.00 C ATOM 849 OD1 ASP A 55 19.252 -1.780 -6.097 1.00 0.00 O ATOM 850 OD2 ASP A 55 19.400 -3.769 -6.855 1.00 0.00 O ATOM 0 H ASP A 55 17.134 -4.099 -2.766 1.00 0.00 H new ATOM 0 HA ASP A 55 17.270 -1.806 -4.359 1.00 0.00 H new ATOM 0 HB2 ASP A 55 19.182 -3.320 -3.869 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.413 -4.610 -4.773 1.00 0.00 H new ATOM 855 N LYS A 56 15.813 -4.423 -5.684 1.00 0.00 N ATOM 856 CA LYS A 56 14.979 -4.901 -6.766 1.00 0.00 C ATOM 857 C LYS A 56 13.659 -4.148 -6.803 1.00 0.00 C ATOM 858 O LYS A 56 13.248 -3.650 -7.850 1.00 0.00 O ATOM 859 CB LYS A 56 14.728 -6.389 -6.564 1.00 0.00 C ATOM 860 CG LYS A 56 16.021 -7.169 -6.829 1.00 0.00 C ATOM 861 CD LYS A 56 15.800 -8.632 -6.463 1.00 0.00 C ATOM 862 CE LYS A 56 16.932 -9.515 -7.014 1.00 0.00 C ATOM 863 NZ LYS A 56 18.244 -8.842 -6.849 1.00 0.00 N ATOM 0 H LYS A 56 16.002 -5.121 -4.964 1.00 0.00 H new ATOM 0 HA LYS A 56 15.486 -4.733 -7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 56 14.381 -6.575 -5.548 1.00 0.00 H new ATOM 0 HB3 LYS A 56 13.941 -6.730 -7.237 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.305 -7.082 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS A 56 16.839 -6.753 -6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 56 15.748 -8.736 -5.379 1.00 0.00 H new ATOM 0 HD3 LYS A 56 14.843 -8.970 -6.862 1.00 0.00 H new ATOM 0 HE2 LYS A 56 16.940 -10.473 -6.494 1.00 0.00 H new ATOM 0 HE3 LYS A 56 16.755 -9.727 -8.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 19.008 -9.541 -6.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 18.350 -8.105 -7.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 18.295 -8.408 -5.905 1.00 0.00 H new ATOM 877 N VAL A 57 13.051 -3.981 -5.645 1.00 0.00 N ATOM 878 CA VAL A 57 11.810 -3.235 -5.565 1.00 0.00 C ATOM 879 C VAL A 57 12.071 -1.777 -5.941 1.00 0.00 C ATOM 880 O VAL A 57 11.362 -1.194 -6.767 1.00 0.00 O ATOM 881 CB VAL A 57 11.205 -3.355 -4.150 1.00 0.00 C ATOM 882 CG1 VAL A 57 9.887 -2.578 -4.066 1.00 0.00 C ATOM 883 CG2 VAL A 57 10.942 -4.833 -3.822 1.00 0.00 C ATOM 0 H VAL A 57 13.391 -4.347 -4.756 1.00 0.00 H new ATOM 0 HA VAL A 57 11.086 -3.648 -6.267 1.00 0.00 H new ATOM 0 HB VAL A 57 11.912 -2.938 -3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.472 -2.672 -3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.070 -1.526 -4.286 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.180 -2.982 -4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.515 -4.913 -2.822 1.00 0.00 H new ATOM 0 HG22 VAL A 57 10.244 -5.249 -4.549 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.880 -5.387 -3.862 1.00 0.00 H new ATOM 893 N MET A 58 13.150 -1.221 -5.400 1.00 0.00 N ATOM 894 CA MET A 58 13.557 0.126 -5.755 1.00 0.00 C ATOM 895 C MET A 58 14.011 0.178 -7.209 1.00 0.00 C ATOM 896 O MET A 58 14.016 1.242 -7.825 1.00 0.00 O ATOM 897 CB MET A 58 14.645 0.662 -4.785 1.00 0.00 C ATOM 898 CG MET A 58 15.975 0.934 -5.514 1.00 0.00 C ATOM 899 SD MET A 58 17.195 1.544 -4.318 1.00 0.00 S ATOM 900 CE MET A 58 18.565 1.764 -5.483 1.00 0.00 C ATOM 0 H MET A 58 13.753 -1.682 -4.718 1.00 0.00 H new ATOM 0 HA MET A 58 12.695 0.785 -5.653 1.00 0.00 H new ATOM 0 HB2 MET A 58 14.293 1.581 -4.315 1.00 0.00 H new ATOM 0 HB3 MET A 58 14.809 -0.062 -3.987 1.00 0.00 H new ATOM 0 HG2 MET A 58 16.337 0.022 -5.988 1.00 0.00 H new ATOM 0 HG3 MET A 58 15.826 1.668 -6.306 1.00 0.00 H new ATOM 0 HE1 MET A 58 19.438 2.141 -4.951 1.00 0.00 H new ATOM 0 HE2 MET A 58 18.807 0.807 -5.945 1.00 0.00 H new ATOM 0 HE3 MET A 58 18.275 2.477 -6.255 1.00 0.00 H new ATOM 910 N LYS A 59 14.397 -0.977 -7.746 1.00 0.00 N ATOM 911 CA LYS A 59 14.877 -1.059 -9.119 1.00 0.00 C ATOM 912 C LYS A 59 13.789 -0.659 -10.074 1.00 0.00 C ATOM 913 O LYS A 59 14.001 0.167 -10.953 1.00 0.00 O ATOM 914 CB LYS A 59 15.384 -2.466 -9.460 1.00 0.00 C ATOM 915 CG LYS A 59 16.281 -2.401 -10.706 1.00 0.00 C ATOM 916 CD LYS A 59 17.556 -1.586 -10.415 1.00 0.00 C ATOM 917 CE LYS A 59 18.216 -2.047 -9.106 1.00 0.00 C ATOM 918 NZ LYS A 59 17.744 -1.192 -7.969 1.00 0.00 N ATOM 0 H LYS A 59 14.386 -1.868 -7.249 1.00 0.00 H new ATOM 0 HA LYS A 59 15.716 -0.370 -9.217 1.00 0.00 H new ATOM 0 HB2 LYS A 59 15.942 -2.877 -8.618 1.00 0.00 H new ATOM 0 HB3 LYS A 59 14.541 -3.134 -9.640 1.00 0.00 H new ATOM 0 HG2 LYS A 59 16.551 -3.409 -11.019 1.00 0.00 H new ATOM 0 HG3 LYS A 59 15.733 -1.947 -11.532 1.00 0.00 H new ATOM 0 HD2 LYS A 59 18.259 -1.697 -11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 59 17.308 -0.527 -10.348 1.00 0.00 H new ATOM 0 HE2 LYS A 59 17.971 -3.092 -8.913 1.00 0.00 H new ATOM 0 HE3 LYS A 59 19.301 -1.985 -9.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 18.524 -1.046 -7.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 17.426 -0.272 -8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 16.954 -1.664 -7.485 1.00 0.00 H new ATOM 932 N GLU A 60 12.592 -1.143 -9.824 1.00 0.00 N ATOM 933 CA GLU A 60 11.473 -0.748 -10.634 1.00 0.00 C ATOM 934 C GLU A 60 11.345 0.749 -10.542 1.00 0.00 C ATOM 935 O GLU A 60 11.195 1.436 -11.543 1.00 0.00 O ATOM 936 CB GLU A 60 10.196 -1.386 -10.111 1.00 0.00 C ATOM 937 CG GLU A 60 10.214 -2.901 -10.342 1.00 0.00 C ATOM 938 CD GLU A 60 8.950 -3.534 -9.781 1.00 0.00 C ATOM 939 OE1 GLU A 60 8.095 -2.805 -9.311 1.00 0.00 O ATOM 940 OE2 GLU A 60 8.847 -4.740 -9.830 1.00 0.00 O ATOM 0 H GLU A 60 12.375 -1.801 -9.076 1.00 0.00 H new ATOM 0 HA GLU A 60 11.628 -1.067 -11.665 1.00 0.00 H new ATOM 0 HB2 GLU A 60 10.088 -1.177 -9.047 1.00 0.00 H new ATOM 0 HB3 GLU A 60 9.333 -0.947 -10.611 1.00 0.00 H new ATOM 0 HG2 GLU A 60 10.293 -3.112 -11.408 1.00 0.00 H new ATOM 0 HG3 GLU A 60 11.091 -3.338 -9.865 1.00 0.00 H new ATOM 947 N LEU A 61 11.522 1.260 -9.340 1.00 0.00 N ATOM 948 CA LEU A 61 11.526 2.684 -9.129 1.00 0.00 C ATOM 949 C LEU A 61 12.724 3.315 -9.842 1.00 0.00 C ATOM 950 O LEU A 61 12.614 4.401 -10.420 1.00 0.00 O ATOM 951 CB LEU A 61 11.503 3.030 -7.643 1.00 0.00 C ATOM 952 CG LEU A 61 10.210 2.499 -7.009 1.00 0.00 C ATOM 953 CD1 LEU A 61 10.079 3.035 -5.602 1.00 0.00 C ATOM 954 CD2 LEU A 61 8.983 2.894 -7.831 1.00 0.00 C ATOM 0 H LEU A 61 11.665 0.705 -8.496 1.00 0.00 H new ATOM 0 HA LEU A 61 10.615 3.101 -9.559 1.00 0.00 H new ATOM 0 HB2 LEU A 61 12.369 2.595 -7.145 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.568 4.110 -7.510 1.00 0.00 H new ATOM 0 HG LEU A 61 10.263 1.411 -6.987 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.160 2.657 -5.153 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.933 2.711 -5.008 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.048 4.124 -5.629 1.00 0.00 H new ATOM 0 HD21 LEU A 61 8.084 2.502 -7.355 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.919 3.981 -7.889 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.070 2.481 -8.836 1.00 0.00 H new ATOM 966 N ASP A 62 13.867 2.621 -9.826 1.00 0.00 N ATOM 967 CA ASP A 62 15.051 3.098 -10.548 1.00 0.00 C ATOM 968 C ASP A 62 14.712 3.161 -12.024 1.00 0.00 C ATOM 969 O ASP A 62 15.021 4.137 -12.701 1.00 0.00 O ATOM 970 CB ASP A 62 16.238 2.123 -10.374 1.00 0.00 C ATOM 971 CG ASP A 62 16.835 2.170 -8.975 1.00 0.00 C ATOM 972 OD1 ASP A 62 16.652 3.161 -8.297 1.00 0.00 O ATOM 973 OD2 ASP A 62 17.476 1.199 -8.599 1.00 0.00 O ATOM 0 H ASP A 62 13.997 1.740 -9.329 1.00 0.00 H new ATOM 0 HA ASP A 62 15.332 4.075 -10.154 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.904 1.108 -10.588 1.00 0.00 H new ATOM 0 HB3 ASP A 62 17.011 2.364 -11.103 1.00 0.00 H new ATOM 978 N GLU A 63 14.029 2.126 -12.502 1.00 0.00 N ATOM 979 CA GLU A 63 13.580 2.061 -13.887 1.00 0.00 C ATOM 980 C GLU A 63 12.497 3.100 -14.120 1.00 0.00 C ATOM 981 O GLU A 63 12.536 3.869 -15.079 1.00 0.00 O ATOM 982 CB GLU A 63 12.991 0.671 -14.156 1.00 0.00 C ATOM 983 CG GLU A 63 14.071 -0.411 -13.992 1.00 0.00 C ATOM 984 CD GLU A 63 15.152 -0.281 -15.043 1.00 0.00 C ATOM 985 OE1 GLU A 63 14.895 0.307 -16.068 1.00 0.00 O ATOM 986 OE2 GLU A 63 16.229 -0.773 -14.806 1.00 0.00 O ATOM 0 H GLU A 63 13.772 1.312 -11.943 1.00 0.00 H new ATOM 0 HA GLU A 63 14.423 2.251 -14.551 1.00 0.00 H new ATOM 0 HB2 GLU A 63 12.168 0.479 -13.468 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.579 0.633 -15.165 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.516 -0.335 -13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 63 13.612 -1.397 -14.061 1.00 0.00 H new ATOM 993 N ASN A 64 11.529 3.104 -13.221 1.00 0.00 N ATOM 994 CA ASN A 64 10.384 3.999 -13.292 1.00 0.00 C ATOM 995 C ASN A 64 10.794 5.438 -13.063 1.00 0.00 C ATOM 996 O ASN A 64 10.065 6.367 -13.407 1.00 0.00 O ATOM 997 CB ASN A 64 9.312 3.580 -12.282 1.00 0.00 C ATOM 998 CG ASN A 64 7.930 4.005 -12.761 1.00 0.00 C ATOM 999 OD1 ASN A 64 7.808 4.802 -13.698 1.00 0.00 O ATOM 1000 ND2 ASN A 64 6.881 3.515 -12.184 1.00 0.00 N ATOM 0 H ASN A 64 11.514 2.481 -12.413 1.00 0.00 H new ATOM 0 HA ASN A 64 9.966 3.927 -14.296 1.00 0.00 H new ATOM 0 HB2 ASN A 64 9.338 2.499 -12.143 1.00 0.00 H new ATOM 0 HB3 ASN A 64 9.522 4.032 -11.312 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.951 3.786 -12.502 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.984 2.858 -11.411 1.00 0.00 H new ATOM 1007 N GLY A 65 11.967 5.626 -12.489 1.00 0.00 N ATOM 1008 CA GLY A 65 12.486 6.963 -12.209 1.00 0.00 C ATOM 1009 C GLY A 65 12.758 7.742 -13.489 1.00 0.00 C ATOM 1010 O GLY A 65 13.502 8.722 -13.478 1.00 0.00 O ATOM 0 H GLY A 65 12.587 4.868 -12.204 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.770 7.510 -11.595 1.00 0.00 H new ATOM 0 HA3 GLY A 65 13.406 6.882 -11.630 1.00 0.00 H new ATOM 1014 N ASP A 66 12.090 7.351 -14.568 1.00 0.00 N ATOM 1015 CA ASP A 66 12.188 8.065 -15.826 1.00 0.00 C ATOM 1016 C ASP A 66 11.672 9.466 -15.628 1.00 0.00 C ATOM 1017 O ASP A 66 12.259 10.434 -16.097 1.00 0.00 O ATOM 1018 CB ASP A 66 11.333 7.368 -16.889 1.00 0.00 C ATOM 1019 CG ASP A 66 11.457 8.090 -18.215 1.00 0.00 C ATOM 1020 OD1 ASP A 66 12.534 8.090 -18.771 1.00 0.00 O ATOM 1021 OD2 ASP A 66 10.472 8.639 -18.658 1.00 0.00 O ATOM 0 H ASP A 66 11.473 6.539 -14.592 1.00 0.00 H new ATOM 0 HA ASP A 66 13.227 8.083 -16.154 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.651 6.331 -17.000 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.290 7.349 -16.573 1.00 0.00 H new ATOM 1026 N GLY A 67 10.581 9.558 -14.890 1.00 0.00 N ATOM 1027 CA GLY A 67 9.965 10.830 -14.567 1.00 0.00 C ATOM 1028 C GLY A 67 9.784 10.966 -13.068 1.00 0.00 C ATOM 1029 O GLY A 67 10.522 11.706 -12.413 1.00 0.00 O ATOM 0 H GLY A 67 10.097 8.751 -14.497 1.00 0.00 H new ATOM 0 HA2 GLY A 67 10.584 11.646 -14.940 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.999 10.910 -15.065 1.00 0.00 H new ATOM 1033 N GLU A 68 8.807 10.246 -12.529 1.00 0.00 N ATOM 1034 CA GLU A 68 8.493 10.289 -11.099 1.00 0.00 C ATOM 1035 C GLU A 68 7.960 8.947 -10.611 1.00 0.00 C ATOM 1036 O GLU A 68 7.693 8.046 -11.408 1.00 0.00 O ATOM 1037 CB GLU A 68 7.445 11.373 -10.815 1.00 0.00 C ATOM 1038 CG GLU A 68 8.036 12.775 -11.039 1.00 0.00 C ATOM 1039 CD GLU A 68 6.964 13.836 -10.855 1.00 0.00 C ATOM 1040 OE1 GLU A 68 5.825 13.475 -10.653 1.00 0.00 O ATOM 1041 OE2 GLU A 68 7.289 14.992 -10.922 1.00 0.00 O ATOM 0 H GLU A 68 8.210 9.617 -13.066 1.00 0.00 H new ATOM 0 HA GLU A 68 9.417 10.518 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 68 6.581 11.229 -11.464 1.00 0.00 H new ATOM 0 HB3 GLU A 68 7.090 11.283 -9.788 1.00 0.00 H new ATOM 0 HG2 GLU A 68 8.853 12.949 -10.339 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.456 12.844 -12.042 1.00 0.00 H new ATOM 1048 N VAL A 69 7.698 8.877 -9.318 1.00 0.00 N ATOM 1049 CA VAL A 69 7.069 7.729 -8.697 1.00 0.00 C ATOM 1050 C VAL A 69 5.846 8.200 -7.904 1.00 0.00 C ATOM 1051 O VAL A 69 5.871 9.275 -7.292 1.00 0.00 O ATOM 1052 CB VAL A 69 8.094 6.977 -7.807 1.00 0.00 C ATOM 1053 CG1 VAL A 69 8.889 7.962 -6.951 1.00 0.00 C ATOM 1054 CG2 VAL A 69 7.387 5.973 -6.892 1.00 0.00 C ATOM 0 H VAL A 69 7.920 9.627 -8.663 1.00 0.00 H new ATOM 0 HA VAL A 69 6.730 7.024 -9.456 1.00 0.00 H new ATOM 0 HB VAL A 69 8.775 6.441 -8.468 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.602 7.415 -6.334 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.426 8.655 -7.598 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.207 8.519 -6.309 1.00 0.00 H new ATOM 0 HG21 VAL A 69 8.125 5.458 -6.278 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.683 6.500 -6.248 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.848 5.245 -7.498 1.00 0.00 H new ATOM 1064 N ASP A 70 4.738 7.483 -8.025 1.00 0.00 N ATOM 1065 CA ASP A 70 3.490 7.921 -7.386 1.00 0.00 C ATOM 1066 C ASP A 70 3.282 7.260 -6.026 1.00 0.00 C ATOM 1067 O ASP A 70 4.085 6.431 -5.584 1.00 0.00 O ATOM 1068 CB ASP A 70 2.265 7.675 -8.291 1.00 0.00 C ATOM 1069 CG ASP A 70 1.498 6.452 -7.823 1.00 0.00 C ATOM 1070 OD1 ASP A 70 2.037 5.378 -7.907 1.00 0.00 O ATOM 1071 OD2 ASP A 70 0.382 6.612 -7.370 1.00 0.00 O ATOM 0 H ASP A 70 4.669 6.610 -8.548 1.00 0.00 H new ATOM 0 HA ASP A 70 3.587 8.995 -7.228 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.613 8.548 -8.277 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.589 7.536 -9.322 1.00 0.00 H new ATOM 1076 N PHE A 71 2.174 7.606 -5.395 1.00 0.00 N ATOM 1077 CA PHE A 71 1.804 7.038 -4.111 1.00 0.00 C ATOM 1078 C PHE A 71 1.607 5.532 -4.228 1.00 0.00 C ATOM 1079 O PHE A 71 2.085 4.761 -3.386 1.00 0.00 O ATOM 1080 CB PHE A 71 0.521 7.693 -3.593 1.00 0.00 C ATOM 1081 CG PHE A 71 0.164 7.135 -2.232 1.00 0.00 C ATOM 1082 CD1 PHE A 71 0.949 7.456 -1.120 1.00 0.00 C ATOM 1083 CD2 PHE A 71 -0.960 6.309 -2.078 1.00 0.00 C ATOM 1084 CE1 PHE A 71 0.619 6.955 0.142 1.00 0.00 C ATOM 1085 CE2 PHE A 71 -1.287 5.806 -0.807 1.00 0.00 C ATOM 1086 CZ PHE A 71 -0.499 6.133 0.301 1.00 0.00 C ATOM 0 H PHE A 71 1.507 8.287 -5.757 1.00 0.00 H new ATOM 0 HA PHE A 71 2.612 7.230 -3.405 1.00 0.00 H new ATOM 0 HB2 PHE A 71 0.656 8.773 -3.528 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.295 7.515 -4.293 1.00 0.00 H new ATOM 0 HD1 PHE A 71 1.813 8.093 -1.237 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.571 6.061 -2.933 1.00 0.00 H new ATOM 0 HE1 PHE A 71 1.230 7.204 0.997 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.148 5.166 -0.686 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.754 5.751 1.278 1.00 0.00 H new ATOM 1096 N GLN A 72 0.902 5.115 -5.274 1.00 0.00 N ATOM 1097 CA GLN A 72 0.619 3.704 -5.489 1.00 0.00 C ATOM 1098 C GLN A 72 1.919 2.930 -5.661 1.00 0.00 C ATOM 1099 O GLN A 72 2.104 1.860 -5.077 1.00 0.00 O ATOM 1100 CB GLN A 72 -0.285 3.528 -6.714 1.00 0.00 C ATOM 1101 CG GLN A 72 -1.660 4.133 -6.408 1.00 0.00 C ATOM 1102 CD GLN A 72 -2.560 4.042 -7.628 1.00 0.00 C ATOM 1103 OE1 GLN A 72 -3.256 3.047 -7.813 1.00 0.00 O ATOM 1104 NE2 GLN A 72 -2.580 5.013 -8.481 1.00 0.00 N ATOM 0 H GLN A 72 0.517 5.736 -5.986 1.00 0.00 H new ATOM 0 HA GLN A 72 0.097 3.309 -4.618 1.00 0.00 H new ATOM 0 HB2 GLN A 72 0.157 4.017 -7.582 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.385 2.471 -6.960 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -2.118 3.607 -5.570 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -1.548 5.175 -6.108 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -2.002 5.839 -8.327 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -3.174 4.953 -9.308 1.00 0.00 H new ATOM 1113 N GLU A 73 2.849 3.513 -6.387 1.00 0.00 N ATOM 1114 CA GLU A 73 4.177 2.934 -6.524 1.00 0.00 C ATOM 1115 C GLU A 73 4.909 3.006 -5.173 1.00 0.00 C ATOM 1116 O GLU A 73 5.588 2.060 -4.757 1.00 0.00 O ATOM 1117 CB GLU A 73 4.957 3.687 -7.604 1.00 0.00 C ATOM 1118 CG GLU A 73 4.309 3.420 -8.977 1.00 0.00 C ATOM 1119 CD GLU A 73 4.967 4.260 -10.067 1.00 0.00 C ATOM 1120 OE1 GLU A 73 5.966 4.883 -9.795 1.00 0.00 O ATOM 1121 OE2 GLU A 73 4.455 4.261 -11.170 1.00 0.00 O ATOM 0 H GLU A 73 2.714 4.388 -6.893 1.00 0.00 H new ATOM 0 HA GLU A 73 4.096 1.889 -6.822 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.957 4.756 -7.390 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.998 3.363 -7.611 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.398 2.362 -9.225 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.244 3.648 -8.931 1.00 0.00 H new ATOM 1128 N TYR A 74 4.737 4.131 -4.486 1.00 0.00 N ATOM 1129 CA TYR A 74 5.344 4.348 -3.170 1.00 0.00 C ATOM 1130 C TYR A 74 4.868 3.326 -2.141 1.00 0.00 C ATOM 1131 O TYR A 74 5.682 2.731 -1.427 1.00 0.00 O ATOM 1132 CB TYR A 74 5.060 5.787 -2.695 1.00 0.00 C ATOM 1133 CG TYR A 74 5.448 5.997 -1.236 1.00 0.00 C ATOM 1134 CD1 TYR A 74 6.768 5.787 -0.801 1.00 0.00 C ATOM 1135 CD2 TYR A 74 4.473 6.423 -0.319 1.00 0.00 C ATOM 1136 CE1 TYR A 74 7.097 6.000 0.545 1.00 0.00 C ATOM 1137 CE2 TYR A 74 4.810 6.636 1.022 1.00 0.00 C ATOM 1138 CZ TYR A 74 6.120 6.425 1.454 1.00 0.00 C ATOM 1139 OH TYR A 74 6.449 6.632 2.776 1.00 0.00 O ATOM 0 H TYR A 74 4.177 4.916 -4.820 1.00 0.00 H new ATOM 0 HA TYR A 74 6.421 4.211 -3.270 1.00 0.00 H new ATOM 0 HB2 TYR A 74 5.610 6.490 -3.321 1.00 0.00 H new ATOM 0 HB3 TYR A 74 4.000 6.008 -2.823 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.525 5.463 -1.500 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.458 6.587 -0.651 1.00 0.00 H new ATOM 0 HE1 TYR A 74 8.110 5.835 0.883 1.00 0.00 H new ATOM 0 HE2 TYR A 74 4.056 6.964 1.723 1.00 0.00 H new ATOM 0 HH TYR A 74 5.654 6.926 3.269 1.00 0.00 H new ATOM 1149 N VAL A 75 3.564 3.120 -2.050 1.00 0.00 N ATOM 1150 CA VAL A 75 3.039 2.173 -1.068 1.00 0.00 C ATOM 1151 C VAL A 75 3.499 0.737 -1.351 1.00 0.00 C ATOM 1152 O VAL A 75 3.913 0.018 -0.436 1.00 0.00 O ATOM 1153 CB VAL A 75 1.507 2.256 -0.944 1.00 0.00 C ATOM 1154 CG1 VAL A 75 1.120 3.585 -0.294 1.00 0.00 C ATOM 1155 CG2 VAL A 75 0.858 2.171 -2.325 1.00 0.00 C ATOM 0 H VAL A 75 2.861 3.581 -2.627 1.00 0.00 H new ATOM 0 HA VAL A 75 3.457 2.464 -0.104 1.00 0.00 H new ATOM 0 HB VAL A 75 1.159 1.424 -0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.035 3.645 -0.206 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.569 3.650 0.697 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.480 4.409 -0.910 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.225 2.231 -2.222 1.00 0.00 H new ATOM 0 HG22 VAL A 75 1.210 2.996 -2.944 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.126 1.225 -2.795 1.00 0.00 H new ATOM 1165 N VAL A 76 3.474 0.329 -2.615 1.00 0.00 N ATOM 1166 CA VAL A 76 3.933 -1.007 -2.959 1.00 0.00 C ATOM 1167 C VAL A 76 5.427 -1.144 -2.675 1.00 0.00 C ATOM 1168 O VAL A 76 5.893 -2.209 -2.252 1.00 0.00 O ATOM 1169 CB VAL A 76 3.582 -1.373 -4.420 1.00 0.00 C ATOM 1170 CG1 VAL A 76 4.307 -0.448 -5.398 1.00 0.00 C ATOM 1171 CG2 VAL A 76 3.968 -2.830 -4.714 1.00 0.00 C ATOM 0 H VAL A 76 3.148 0.891 -3.401 1.00 0.00 H new ATOM 0 HA VAL A 76 3.406 -1.723 -2.328 1.00 0.00 H new ATOM 0 HB VAL A 76 2.506 -1.252 -4.548 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.046 -0.723 -6.420 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.009 0.584 -5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.384 -0.545 -5.260 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.715 -3.072 -5.746 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.040 -2.960 -4.563 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.424 -3.493 -4.042 1.00 0.00 H new ATOM 1181 N LEU A 77 6.163 -0.044 -2.854 1.00 0.00 N ATOM 1182 CA LEU A 77 7.600 -0.048 -2.597 1.00 0.00 C ATOM 1183 C LEU A 77 7.859 -0.402 -1.150 1.00 0.00 C ATOM 1184 O LEU A 77 8.643 -1.305 -0.849 1.00 0.00 O ATOM 1185 CB LEU A 77 8.164 1.361 -2.869 1.00 0.00 C ATOM 1186 CG LEU A 77 9.658 1.438 -2.496 1.00 0.00 C ATOM 1187 CD1 LEU A 77 10.497 0.585 -3.447 1.00 0.00 C ATOM 1188 CD2 LEU A 77 10.128 2.898 -2.547 1.00 0.00 C ATOM 0 H LEU A 77 5.790 0.850 -3.172 1.00 0.00 H new ATOM 0 HA LEU A 77 8.080 -0.780 -3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.035 1.612 -3.922 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.603 2.098 -2.295 1.00 0.00 H new ATOM 0 HG LEU A 77 9.786 1.051 -1.485 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.548 0.654 -3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.172 -0.454 -3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.370 0.946 -4.468 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.184 2.950 -2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 77 9.986 3.291 -3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.548 3.492 -1.841 1.00 0.00 H new ATOM 1200 N VAL A 78 7.162 0.267 -0.258 1.00 0.00 N ATOM 1201 CA VAL A 78 7.303 -0.018 1.147 1.00 0.00 C ATOM 1202 C VAL A 78 6.638 -1.346 1.503 1.00 0.00 C ATOM 1203 O VAL A 78 7.195 -2.159 2.257 1.00 0.00 O ATOM 1204 CB VAL A 78 6.786 1.159 2.004 1.00 0.00 C ATOM 1205 CG1 VAL A 78 7.437 2.464 1.515 1.00 0.00 C ATOM 1206 CG2 VAL A 78 5.271 1.294 1.874 1.00 0.00 C ATOM 0 H VAL A 78 6.497 1.007 -0.482 1.00 0.00 H new ATOM 0 HA VAL A 78 8.363 -0.128 1.376 1.00 0.00 H new ATOM 0 HB VAL A 78 7.041 0.968 3.046 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.076 3.298 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.520 2.389 1.612 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.177 2.631 0.470 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.926 2.128 2.485 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.010 1.476 0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.793 0.375 2.213 1.00 0.00 H new ATOM 1216 N ALA A 79 5.457 -1.581 0.940 1.00 0.00 N ATOM 1217 CA ALA A 79 4.711 -2.803 1.218 1.00 0.00 C ATOM 1218 C ALA A 79 5.468 -4.035 0.771 1.00 0.00 C ATOM 1219 O ALA A 79 5.496 -5.042 1.483 1.00 0.00 O ATOM 1220 CB ALA A 79 3.347 -2.771 0.544 1.00 0.00 C ATOM 0 H ALA A 79 4.997 -0.943 0.290 1.00 0.00 H new ATOM 0 HA ALA A 79 4.577 -2.855 2.298 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.810 -3.693 0.766 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.777 -1.920 0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.476 -2.677 -0.534 1.00 0.00 H new ATOM 1226 N ALA A 80 6.102 -3.959 -0.394 1.00 0.00 N ATOM 1227 CA ALA A 80 6.869 -5.092 -0.896 1.00 0.00 C ATOM 1228 C ALA A 80 7.939 -5.458 0.116 1.00 0.00 C ATOM 1229 O ALA A 80 8.080 -6.619 0.511 1.00 0.00 O ATOM 1230 CB ALA A 80 7.518 -4.753 -2.241 1.00 0.00 C ATOM 0 H ALA A 80 6.101 -3.138 -1.000 1.00 0.00 H new ATOM 0 HA ALA A 80 6.197 -5.937 -1.044 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.086 -5.612 -2.598 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.743 -4.503 -2.966 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.187 -3.902 -2.118 1.00 0.00 H new ATOM 1236 N LEU A 81 8.611 -4.440 0.613 1.00 0.00 N ATOM 1237 CA LEU A 81 9.589 -4.611 1.673 1.00 0.00 C ATOM 1238 C LEU A 81 8.901 -5.115 2.927 1.00 0.00 C ATOM 1239 O LEU A 81 9.428 -5.963 3.653 1.00 0.00 O ATOM 1240 CB LEU A 81 10.268 -3.276 1.976 1.00 0.00 C ATOM 1241 CG LEU A 81 11.136 -2.854 0.788 1.00 0.00 C ATOM 1242 CD1 LEU A 81 11.627 -1.422 0.999 1.00 0.00 C ATOM 1243 CD2 LEU A 81 12.340 -3.792 0.670 1.00 0.00 C ATOM 0 H LEU A 81 8.498 -3.477 0.298 1.00 0.00 H new ATOM 0 HA LEU A 81 10.338 -5.334 1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.516 -2.513 2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 81 10.881 -3.365 2.873 1.00 0.00 H new ATOM 0 HG LEU A 81 10.545 -2.907 -0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.245 -1.121 0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.771 -0.752 1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.215 -1.370 1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.956 -3.489 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 81 12.931 -3.742 1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.992 -4.814 0.518 1.00 0.00 H new ATOM 1255 N THR A 82 7.736 -4.559 3.195 1.00 0.00 N ATOM 1256 CA THR A 82 6.993 -4.897 4.386 1.00 0.00 C ATOM 1257 C THR A 82 6.630 -6.386 4.391 1.00 0.00 C ATOM 1258 O THR A 82 6.939 -7.107 5.349 1.00 0.00 O ATOM 1259 CB THR A 82 5.713 -4.041 4.454 1.00 0.00 C ATOM 1260 OG1 THR A 82 6.030 -2.668 4.245 1.00 0.00 O ATOM 1261 CG2 THR A 82 5.041 -4.196 5.815 1.00 0.00 C ATOM 0 H THR A 82 7.284 -3.867 2.598 1.00 0.00 H new ATOM 0 HA THR A 82 7.613 -4.693 5.259 1.00 0.00 H new ATOM 0 HB THR A 82 5.032 -4.382 3.674 1.00 0.00 H new ATOM 0 HG1 THR A 82 6.849 -2.599 3.712 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.139 -3.585 5.847 1.00 0.00 H new ATOM 0 HG22 THR A 82 4.777 -5.242 5.974 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.726 -3.872 6.598 1.00 0.00 H new ATOM 1269 N VAL A 83 6.044 -6.864 3.294 1.00 0.00 N ATOM 1270 CA VAL A 83 5.673 -8.268 3.209 1.00 0.00 C ATOM 1271 C VAL A 83 6.906 -9.157 3.288 1.00 0.00 C ATOM 1272 O VAL A 83 6.925 -10.146 4.036 1.00 0.00 O ATOM 1273 CB VAL A 83 4.824 -8.548 1.938 1.00 0.00 C ATOM 1274 CG1 VAL A 83 5.600 -8.220 0.660 1.00 0.00 C ATOM 1275 CG2 VAL A 83 4.369 -10.011 1.893 1.00 0.00 C ATOM 0 H VAL A 83 5.821 -6.309 2.468 1.00 0.00 H new ATOM 0 HA VAL A 83 5.045 -8.511 4.066 1.00 0.00 H new ATOM 0 HB VAL A 83 3.949 -7.900 1.992 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.975 -8.428 -0.209 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.878 -7.166 0.663 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.501 -8.832 0.614 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.777 -10.180 0.994 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.242 -10.663 1.881 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.764 -10.231 2.773 1.00 0.00 H new ATOM 1285 N ALA A 84 7.960 -8.765 2.576 1.00 0.00 N ATOM 1286 CA ALA A 84 9.197 -9.531 2.589 1.00 0.00 C ATOM 1287 C ALA A 84 9.713 -9.689 4.005 1.00 0.00 C ATOM 1288 O ALA A 84 10.002 -10.800 4.450 1.00 0.00 O ATOM 1289 CB ALA A 84 10.268 -8.847 1.728 1.00 0.00 C ATOM 0 H ALA A 84 7.980 -7.930 1.990 1.00 0.00 H new ATOM 0 HA ALA A 84 8.983 -10.516 2.175 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.185 -9.436 1.752 1.00 0.00 H new ATOM 0 HB2 ALA A 84 9.913 -8.769 0.700 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.468 -7.850 2.120 1.00 0.00 H new ATOM 1295 N MET A 85 9.840 -8.578 4.715 1.00 0.00 N ATOM 1296 CA MET A 85 10.322 -8.633 6.086 1.00 0.00 C ATOM 1297 C MET A 85 9.279 -9.272 6.996 1.00 0.00 C ATOM 1298 O MET A 85 9.611 -10.039 7.893 1.00 0.00 O ATOM 1299 CB MET A 85 10.672 -7.242 6.615 1.00 0.00 C ATOM 1300 CG MET A 85 11.409 -7.386 7.954 1.00 0.00 C ATOM 1301 SD MET A 85 11.700 -5.757 8.672 1.00 0.00 S ATOM 1302 CE MET A 85 10.297 -5.761 9.812 1.00 0.00 C ATOM 0 H MET A 85 9.620 -7.643 4.372 1.00 0.00 H new ATOM 0 HA MET A 85 11.227 -9.241 6.086 1.00 0.00 H new ATOM 0 HB2 MET A 85 11.297 -6.713 5.896 1.00 0.00 H new ATOM 0 HB3 MET A 85 9.766 -6.650 6.746 1.00 0.00 H new ATOM 0 HG2 MET A 85 10.820 -7.995 8.640 1.00 0.00 H new ATOM 0 HG3 MET A 85 12.357 -7.902 7.804 1.00 0.00 H new ATOM 0 HE1 MET A 85 9.916 -4.746 9.924 1.00 0.00 H new ATOM 0 HE2 MET A 85 9.509 -6.402 9.417 1.00 0.00 H new ATOM 0 HE3 MET A 85 10.618 -6.137 10.783 1.00 0.00 H new ATOM 1312 N ASN A 86 8.021 -8.892 6.812 1.00 0.00 N ATOM 1313 CA ASN A 86 6.958 -9.375 7.688 1.00 0.00 C ATOM 1314 C ASN A 86 6.760 -10.858 7.591 1.00 0.00 C ATOM 1315 O ASN A 86 6.396 -11.504 8.573 1.00 0.00 O ATOM 1316 CB ASN A 86 5.651 -8.619 7.506 1.00 0.00 C ATOM 1317 CG ASN A 86 5.664 -7.391 8.404 1.00 0.00 C ATOM 1318 OD1 ASN A 86 5.688 -6.276 7.922 1.00 0.00 O ATOM 1319 ND2 ASN A 86 5.643 -7.542 9.699 1.00 0.00 N ATOM 0 H ASN A 86 7.713 -8.259 6.074 1.00 0.00 H new ATOM 0 HA ASN A 86 7.298 -9.167 8.702 1.00 0.00 H new ATOM 0 HB2 ASN A 86 5.528 -8.323 6.464 1.00 0.00 H new ATOM 0 HB3 ASN A 86 4.806 -9.261 7.757 1.00 0.00 H new ATOM 0 HD21 ASN A 86 5.647 -6.724 10.308 1.00 0.00 H new ATOM 0 HD22 ASN A 86 5.623 -8.478 10.103 1.00 0.00 H new ATOM 1326 N ASN A 87 7.014 -11.407 6.423 1.00 0.00 N ATOM 1327 CA ASN A 87 6.888 -12.842 6.227 1.00 0.00 C ATOM 1328 C ASN A 87 7.769 -13.570 7.230 1.00 0.00 C ATOM 1329 O ASN A 87 7.417 -14.645 7.722 1.00 0.00 O ATOM 1330 CB ASN A 87 7.290 -13.227 4.801 1.00 0.00 C ATOM 1331 CG ASN A 87 6.656 -14.562 4.419 1.00 0.00 C ATOM 1332 OD1 ASN A 87 6.267 -14.760 3.262 1.00 0.00 O ATOM 1333 ND2 ASN A 87 6.525 -15.491 5.313 1.00 0.00 N ATOM 0 H ASN A 87 7.308 -10.888 5.596 1.00 0.00 H new ATOM 0 HA ASN A 87 5.848 -13.130 6.381 1.00 0.00 H new ATOM 0 HB2 ASN A 87 6.972 -12.452 4.104 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.375 -13.297 4.727 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.101 -16.384 5.062 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.845 -15.329 6.268 1.00 0.00 H new ATOM 1340 N PHE A 88 8.890 -12.952 7.558 1.00 0.00 N ATOM 1341 CA PHE A 88 9.837 -13.507 8.518 1.00 0.00 C ATOM 1342 C PHE A 88 9.226 -13.747 9.883 1.00 0.00 C ATOM 1343 O PHE A 88 9.502 -14.759 10.500 1.00 0.00 O ATOM 1344 CB PHE A 88 11.083 -12.616 8.644 1.00 0.00 C ATOM 1345 CG PHE A 88 11.926 -13.069 9.817 1.00 0.00 C ATOM 1346 CD1 PHE A 88 12.509 -14.344 9.821 1.00 0.00 C ATOM 1347 CD2 PHE A 88 12.122 -12.203 10.905 1.00 0.00 C ATOM 1348 CE1 PHE A 88 13.285 -14.751 10.915 1.00 0.00 C ATOM 1349 CE2 PHE A 88 12.894 -12.612 11.993 1.00 0.00 C ATOM 1350 CZ PHE A 88 13.478 -13.882 12.000 1.00 0.00 C ATOM 0 H PHE A 88 9.172 -12.052 7.169 1.00 0.00 H new ATOM 0 HA PHE A 88 10.131 -14.480 8.124 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.668 -12.663 7.725 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.785 -11.576 8.780 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.361 -15.010 8.984 1.00 0.00 H new ATOM 0 HD2 PHE A 88 11.675 -11.220 10.900 1.00 0.00 H new ATOM 0 HE1 PHE A 88 13.734 -15.733 10.923 1.00 0.00 H new ATOM 0 HE2 PHE A 88 13.041 -11.946 12.831 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.078 -14.195 12.841 1.00 0.00 H new ATOM 1360 N PHE A 89 8.478 -12.793 10.404 1.00 0.00 N ATOM 1361 CA PHE A 89 8.006 -12.917 11.787 1.00 0.00 C ATOM 1362 C PHE A 89 7.258 -14.224 11.979 1.00 0.00 C ATOM 1363 O PHE A 89 7.483 -14.945 12.948 1.00 0.00 O ATOM 1364 CB PHE A 89 7.072 -11.753 12.153 1.00 0.00 C ATOM 1365 CG PHE A 89 7.852 -10.462 12.233 1.00 0.00 C ATOM 1366 CD1 PHE A 89 8.756 -10.244 13.277 1.00 0.00 C ATOM 1367 CD2 PHE A 89 7.663 -9.481 11.258 1.00 0.00 C ATOM 1368 CE1 PHE A 89 9.468 -9.044 13.341 1.00 0.00 C ATOM 1369 CE2 PHE A 89 8.376 -8.279 11.321 1.00 0.00 C ATOM 1370 CZ PHE A 89 9.280 -8.061 12.366 1.00 0.00 C ATOM 0 H PHE A 89 8.187 -11.946 9.917 1.00 0.00 H new ATOM 0 HA PHE A 89 8.881 -12.896 12.437 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.282 -11.663 11.407 1.00 0.00 H new ATOM 0 HB3 PHE A 89 6.587 -11.953 13.109 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.903 -11.002 14.032 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.964 -9.651 10.452 1.00 0.00 H new ATOM 0 HE1 PHE A 89 10.167 -8.875 14.147 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.229 -7.522 10.565 1.00 0.00 H new ATOM 0 HZ PHE A 89 9.832 -7.134 12.419 1.00 0.00 H new ATOM 1380 N TRP A 90 6.394 -14.539 11.044 1.00 0.00 N ATOM 1381 CA TRP A 90 5.627 -15.776 11.099 1.00 0.00 C ATOM 1382 C TRP A 90 6.526 -16.965 10.868 1.00 0.00 C ATOM 1383 O TRP A 90 6.476 -17.953 11.600 1.00 0.00 O ATOM 1384 CB TRP A 90 4.549 -15.741 10.039 1.00 0.00 C ATOM 1385 CG TRP A 90 3.688 -14.570 10.315 1.00 0.00 C ATOM 1386 CD1 TRP A 90 3.877 -13.346 9.794 1.00 0.00 C ATOM 1387 CD2 TRP A 90 2.519 -14.478 11.169 1.00 0.00 C ATOM 1388 NE1 TRP A 90 2.903 -12.509 10.271 1.00 0.00 N ATOM 1389 CE2 TRP A 90 2.032 -13.158 11.120 1.00 0.00 C ATOM 1390 CE3 TRP A 90 1.838 -15.407 11.973 1.00 0.00 C ATOM 1391 CZ2 TRP A 90 0.910 -12.763 11.841 1.00 0.00 C ATOM 1392 CZ3 TRP A 90 0.701 -15.017 12.700 1.00 0.00 C ATOM 1393 CH2 TRP A 90 0.239 -13.696 12.632 1.00 0.00 C ATOM 0 H TRP A 90 6.199 -13.957 10.229 1.00 0.00 H new ATOM 0 HA TRP A 90 5.174 -15.869 12.086 1.00 0.00 H new ATOM 0 HB2 TRP A 90 4.991 -15.665 9.046 1.00 0.00 H new ATOM 0 HB3 TRP A 90 3.963 -16.660 10.058 1.00 0.00 H new ATOM 0 HD1 TRP A 90 4.667 -13.068 9.112 1.00 0.00 H new ATOM 0 HE1 TRP A 90 2.831 -11.521 10.027 1.00 0.00 H new ATOM 0 HE3 TRP A 90 2.190 -16.426 12.033 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 0.561 -11.742 11.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 0.181 -15.738 13.313 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -0.636 -13.400 13.192 1.00 0.00 H new ATOM 1453 N SER B 2 9.658 3.496 12.050 1.00 0.00 N ATOM 1454 CA SER B 2 8.800 4.665 11.882 1.00 0.00 C ATOM 1455 C SER B 2 7.327 4.280 12.031 1.00 0.00 C ATOM 1456 O SER B 2 6.947 3.131 11.770 1.00 0.00 O ATOM 1457 CB SER B 2 9.045 5.295 10.506 1.00 0.00 C ATOM 1458 OG SER B 2 10.448 5.396 10.283 1.00 0.00 O ATOM 0 HA SER B 2 9.044 5.391 12.657 1.00 0.00 H new ATOM 0 HB2 SER B 2 8.583 4.688 9.727 1.00 0.00 H new ATOM 0 HB3 SER B 2 8.584 6.282 10.457 1.00 0.00 H new ATOM 0 HG SER B 2 10.729 4.705 9.647 1.00 0.00 H new ATOM 1464 N GLU B 3 6.481 5.252 12.354 1.00 0.00 N ATOM 1465 CA GLU B 3 5.052 4.992 12.456 1.00 0.00 C ATOM 1466 C GLU B 3 4.551 4.427 11.147 1.00 0.00 C ATOM 1467 O GLU B 3 3.643 3.594 11.127 1.00 0.00 O ATOM 1468 CB GLU B 3 4.265 6.263 12.801 1.00 0.00 C ATOM 1469 CG GLU B 3 4.561 6.692 14.241 1.00 0.00 C ATOM 1470 CD GLU B 3 3.776 7.946 14.573 1.00 0.00 C ATOM 1471 OE1 GLU B 3 3.786 8.862 13.778 1.00 0.00 O ATOM 1472 OE2 GLU B 3 3.172 7.979 15.620 1.00 0.00 O ATOM 0 H GLU B 3 6.756 6.215 12.547 1.00 0.00 H new ATOM 0 HA GLU B 3 4.897 4.275 13.262 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.533 7.064 12.112 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.197 6.083 12.679 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.295 5.891 14.931 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.628 6.876 14.363 1.00 0.00 H new ATOM 1479 N LEU B 4 5.195 4.825 10.059 1.00 0.00 N ATOM 1480 CA LEU B 4 4.866 4.281 8.755 1.00 0.00 C ATOM 1481 C LEU B 4 5.132 2.795 8.761 1.00 0.00 C ATOM 1482 O LEU B 4 4.297 2.005 8.329 1.00 0.00 O ATOM 1483 CB LEU B 4 5.691 4.948 7.640 1.00 0.00 C ATOM 1484 CG LEU B 4 5.228 6.397 7.388 1.00 0.00 C ATOM 1485 CD1 LEU B 4 3.723 6.442 7.130 1.00 0.00 C ATOM 1486 CD2 LEU B 4 5.568 7.288 8.586 1.00 0.00 C ATOM 0 H LEU B 4 5.943 5.518 10.056 1.00 0.00 H new ATOM 0 HA LEU B 4 3.813 4.478 8.555 1.00 0.00 H new ATOM 0 HB2 LEU B 4 6.746 4.944 7.914 1.00 0.00 H new ATOM 0 HB3 LEU B 4 5.598 4.370 6.721 1.00 0.00 H new ATOM 0 HG LEU B 4 5.752 6.769 6.508 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.415 7.473 6.954 1.00 0.00 H new ATOM 0 HD12 LEU B 4 3.486 5.838 6.254 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.193 6.048 7.997 1.00 0.00 H new ATOM 0 HD21 LEU B 4 5.233 8.306 8.389 1.00 0.00 H new ATOM 0 HD22 LEU B 4 5.067 6.907 9.476 1.00 0.00 H new ATOM 0 HD23 LEU B 4 6.646 7.285 8.747 1.00 0.00 H new ATOM 1498 N GLU B 5 6.247 2.405 9.356 1.00 0.00 N ATOM 1499 CA GLU B 5 6.572 0.998 9.472 1.00 0.00 C ATOM 1500 C GLU B 5 5.506 0.319 10.313 1.00 0.00 C ATOM 1501 O GLU B 5 4.931 -0.696 9.916 1.00 0.00 O ATOM 1502 CB GLU B 5 7.957 0.825 10.123 1.00 0.00 C ATOM 1503 CG GLU B 5 8.998 1.570 9.275 1.00 0.00 C ATOM 1504 CD GLU B 5 10.404 1.224 9.730 1.00 0.00 C ATOM 1505 OE1 GLU B 5 10.809 0.113 9.493 1.00 0.00 O ATOM 1506 OE2 GLU B 5 11.067 2.080 10.293 1.00 0.00 O ATOM 0 H GLU B 5 6.935 3.039 9.762 1.00 0.00 H new ATOM 0 HA GLU B 5 6.602 0.543 8.482 1.00 0.00 H new ATOM 0 HB2 GLU B 5 7.948 1.217 11.140 1.00 0.00 H new ATOM 0 HB3 GLU B 5 8.213 -0.232 10.191 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.875 1.307 8.224 1.00 0.00 H new ATOM 0 HG3 GLU B 5 8.838 2.645 9.355 1.00 0.00 H new ATOM 1513 N THR B 6 5.117 0.985 11.384 1.00 0.00 N ATOM 1514 CA THR B 6 4.018 0.526 12.201 1.00 0.00 C ATOM 1515 C THR B 6 2.731 0.494 11.366 1.00 0.00 C ATOM 1516 O THR B 6 1.979 -0.484 11.397 1.00 0.00 O ATOM 1517 CB THR B 6 3.859 1.443 13.414 1.00 0.00 C ATOM 1518 OG1 THR B 6 5.142 1.668 13.999 1.00 0.00 O ATOM 1519 CG2 THR B 6 2.929 0.791 14.445 1.00 0.00 C ATOM 0 H THR B 6 5.551 1.850 11.707 1.00 0.00 H new ATOM 0 HA THR B 6 4.223 -0.484 12.557 1.00 0.00 H new ATOM 0 HB THR B 6 3.425 2.392 13.098 1.00 0.00 H new ATOM 0 HG1 THR B 6 5.048 2.257 14.777 1.00 0.00 H new ATOM 0 HG21 THR B 6 2.821 1.451 15.306 1.00 0.00 H new ATOM 0 HG22 THR B 6 1.951 0.618 13.995 1.00 0.00 H new ATOM 0 HG23 THR B 6 3.353 -0.160 14.767 1.00 0.00 H new ATOM 1527 N ALA B 7 2.500 1.553 10.593 1.00 0.00 N ATOM 1528 CA ALA B 7 1.334 1.619 9.737 1.00 0.00 C ATOM 1529 C ALA B 7 1.338 0.446 8.777 1.00 0.00 C ATOM 1530 O ALA B 7 0.331 -0.253 8.634 1.00 0.00 O ATOM 1531 CB ALA B 7 1.310 2.940 8.957 1.00 0.00 C ATOM 0 H ALA B 7 3.107 2.371 10.547 1.00 0.00 H new ATOM 0 HA ALA B 7 0.440 1.572 10.358 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.426 2.970 8.320 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.281 3.775 9.657 1.00 0.00 H new ATOM 0 HB3 ALA B 7 2.205 3.014 8.340 1.00 0.00 H new ATOM 1537 N MET B 8 2.501 0.188 8.183 1.00 0.00 N ATOM 1538 CA MET B 8 2.631 -0.950 7.281 1.00 0.00 C ATOM 1539 C MET B 8 2.399 -2.245 8.029 1.00 0.00 C ATOM 1540 O MET B 8 1.640 -3.106 7.578 1.00 0.00 O ATOM 1541 CB MET B 8 4.015 -0.967 6.610 1.00 0.00 C ATOM 1542 CG MET B 8 4.204 0.284 5.744 1.00 0.00 C ATOM 1543 SD MET B 8 2.836 0.419 4.556 1.00 0.00 S ATOM 1544 CE MET B 8 3.162 -1.110 3.659 1.00 0.00 C ATOM 0 H MET B 8 3.350 0.740 8.307 1.00 0.00 H new ATOM 0 HA MET B 8 1.875 -0.851 6.502 1.00 0.00 H new ATOM 0 HB2 MET B 8 4.794 -1.012 7.371 1.00 0.00 H new ATOM 0 HB3 MET B 8 4.117 -1.861 5.996 1.00 0.00 H new ATOM 0 HG2 MET B 8 4.240 1.172 6.374 1.00 0.00 H new ATOM 0 HG3 MET B 8 5.155 0.231 5.214 1.00 0.00 H new ATOM 0 HE1 MET B 8 2.639 -1.090 2.703 1.00 0.00 H new ATOM 0 HE2 MET B 8 4.233 -1.208 3.484 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.811 -1.958 4.247 1.00 0.00 H new ATOM 1554 N GLU B 9 2.938 -2.341 9.231 1.00 0.00 N ATOM 1555 CA GLU B 9 2.688 -3.519 10.053 1.00 0.00 C ATOM 1556 C GLU B 9 1.219 -3.618 10.410 1.00 0.00 C ATOM 1557 O GLU B 9 0.638 -4.711 10.420 1.00 0.00 O ATOM 1558 CB GLU B 9 3.534 -3.539 11.327 1.00 0.00 C ATOM 1559 CG GLU B 9 4.998 -3.809 10.982 1.00 0.00 C ATOM 1560 CD GLU B 9 5.813 -3.859 12.253 1.00 0.00 C ATOM 1561 OE1 GLU B 9 5.709 -2.944 13.035 1.00 0.00 O ATOM 1562 OE2 GLU B 9 6.523 -4.820 12.442 1.00 0.00 O ATOM 0 H GLU B 9 3.540 -1.636 9.656 1.00 0.00 H new ATOM 0 HA GLU B 9 2.978 -4.383 9.455 1.00 0.00 H new ATOM 0 HB2 GLU B 9 3.445 -2.585 11.847 1.00 0.00 H new ATOM 0 HB3 GLU B 9 3.165 -4.308 12.006 1.00 0.00 H new ATOM 0 HG2 GLU B 9 5.088 -4.752 10.442 1.00 0.00 H new ATOM 0 HG3 GLU B 9 5.378 -3.027 10.324 1.00 0.00 H new ATOM 1569 N THR B 10 0.603 -2.479 10.663 1.00 0.00 N ATOM 1570 CA THR B 10 -0.806 -2.461 10.991 1.00 0.00 C ATOM 1571 C THR B 10 -1.574 -3.113 9.848 1.00 0.00 C ATOM 1572 O THR B 10 -2.397 -4.011 10.063 1.00 0.00 O ATOM 1573 CB THR B 10 -1.282 -1.016 11.236 1.00 0.00 C ATOM 1574 OG1 THR B 10 -0.353 -0.349 12.092 1.00 0.00 O ATOM 1575 CG2 THR B 10 -2.658 -1.026 11.914 1.00 0.00 C ATOM 0 H THR B 10 1.052 -1.563 10.648 1.00 0.00 H new ATOM 0 HA THR B 10 -0.987 -3.019 11.909 1.00 0.00 H new ATOM 0 HB THR B 10 -1.349 -0.498 10.279 1.00 0.00 H new ATOM 0 HG1 THR B 10 0.447 -0.105 11.580 1.00 0.00 H new ATOM 0 HG21 THR B 10 -2.987 -0.001 12.084 1.00 0.00 H new ATOM 0 HG22 THR B 10 -3.376 -1.536 11.272 1.00 0.00 H new ATOM 0 HG23 THR B 10 -2.590 -1.548 12.869 1.00 0.00 H new ATOM 1583 N LEU B 11 -1.197 -2.765 8.625 1.00 0.00 N ATOM 1584 CA LEU B 11 -1.770 -3.403 7.444 1.00 0.00 C ATOM 1585 C LEU B 11 -1.439 -4.895 7.442 1.00 0.00 C ATOM 1586 O LEU B 11 -2.293 -5.739 7.133 1.00 0.00 O ATOM 1587 CB LEU B 11 -1.205 -2.766 6.163 1.00 0.00 C ATOM 1588 CG LEU B 11 -1.716 -1.329 5.991 1.00 0.00 C ATOM 1589 CD1 LEU B 11 -0.879 -0.625 4.919 1.00 0.00 C ATOM 1590 CD2 LEU B 11 -3.178 -1.355 5.528 1.00 0.00 C ATOM 0 H LEU B 11 -0.500 -2.048 8.424 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.851 -3.265 7.472 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -0.116 -2.766 6.203 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.492 -3.364 5.298 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.637 -0.802 6.942 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.236 0.397 4.791 1.00 0.00 H new ATOM 0 HD12 LEU B 11 0.167 -0.608 5.227 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -0.971 -1.162 3.975 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -3.539 -0.334 5.406 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.249 -1.881 4.576 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.786 -1.869 6.272 1.00 0.00 H new ATOM 1602 N ILE B 12 -0.198 -5.219 7.784 1.00 0.00 N ATOM 1603 CA ILE B 12 0.251 -6.610 7.796 1.00 0.00 C ATOM 1604 C ILE B 12 -0.542 -7.394 8.815 1.00 0.00 C ATOM 1605 O ILE B 12 -0.960 -8.532 8.560 1.00 0.00 O ATOM 1606 CB ILE B 12 1.744 -6.670 8.176 1.00 0.00 C ATOM 1607 CG1 ILE B 12 2.618 -6.062 7.069 1.00 0.00 C ATOM 1608 CG2 ILE B 12 2.178 -8.118 8.454 1.00 0.00 C ATOM 1609 CD1 ILE B 12 2.704 -7.006 5.865 1.00 0.00 C ATOM 0 H ILE B 12 0.515 -4.542 8.056 1.00 0.00 H new ATOM 0 HA ILE B 12 0.103 -7.038 6.804 1.00 0.00 H new ATOM 0 HB ILE B 12 1.879 -6.084 9.085 1.00 0.00 H new ATOM 0 HG12 ILE B 12 2.203 -5.104 6.757 1.00 0.00 H new ATOM 0 HG13 ILE B 12 3.618 -5.866 7.455 1.00 0.00 H new ATOM 0 HG21 ILE B 12 3.235 -8.136 8.720 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.589 -8.523 9.277 1.00 0.00 H new ATOM 0 HG23 ILE B 12 2.018 -8.723 7.562 1.00 0.00 H new ATOM 0 HD11 ILE B 12 3.328 -6.555 5.093 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.141 -7.955 6.177 1.00 0.00 H new ATOM 0 HD13 ILE B 12 1.704 -7.181 5.467 1.00 0.00 H new ATOM 1621 N ASN B 13 -0.708 -6.807 9.979 1.00 0.00 N ATOM 1622 CA ASN B 13 -1.381 -7.485 11.064 1.00 0.00 C ATOM 1623 C ASN B 13 -2.796 -7.803 10.663 1.00 0.00 C ATOM 1624 O ASN B 13 -3.250 -8.938 10.801 1.00 0.00 O ATOM 1625 CB ASN B 13 -1.372 -6.600 12.304 1.00 0.00 C ATOM 1626 CG ASN B 13 0.023 -6.594 12.914 1.00 0.00 C ATOM 1627 OD1 ASN B 13 0.535 -7.646 13.316 1.00 0.00 O ATOM 1628 ND2 ASN B 13 0.690 -5.486 12.971 1.00 0.00 N ATOM 0 H ASN B 13 -0.387 -5.864 10.198 1.00 0.00 H new ATOM 0 HA ASN B 13 -0.861 -8.416 11.289 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -1.670 -5.585 12.041 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -2.097 -6.967 13.031 1.00 0.00 H new ATOM 0 HD21 ASN B 13 1.638 -5.480 13.347 1.00 0.00 H new ATOM 0 HD22 ASN B 13 0.268 -4.619 12.639 1.00 0.00 H new ATOM 1635 N VAL B 14 -3.447 -6.843 10.030 1.00 0.00 N ATOM 1636 CA VAL B 14 -4.772 -7.076 9.497 1.00 0.00 C ATOM 1637 C VAL B 14 -4.713 -8.137 8.404 1.00 0.00 C ATOM 1638 O VAL B 14 -5.519 -9.074 8.380 1.00 0.00 O ATOM 1639 CB VAL B 14 -5.367 -5.769 8.954 1.00 0.00 C ATOM 1640 CG1 VAL B 14 -6.715 -6.049 8.291 1.00 0.00 C ATOM 1641 CG2 VAL B 14 -5.570 -4.783 10.110 1.00 0.00 C ATOM 0 H VAL B 14 -3.081 -5.904 9.875 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.418 -7.437 10.297 1.00 0.00 H new ATOM 0 HB VAL B 14 -4.684 -5.343 8.220 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -7.132 -5.118 7.908 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -6.577 -6.751 7.468 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -7.398 -6.478 9.023 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -5.992 -3.854 9.726 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -6.251 -5.216 10.842 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -4.611 -4.576 10.585 1.00 0.00 H new ATOM 1651 N PHE B 15 -3.750 -7.995 7.507 1.00 0.00 N ATOM 1652 CA PHE B 15 -3.602 -8.928 6.398 1.00 0.00 C ATOM 1653 C PHE B 15 -3.411 -10.353 6.912 1.00 0.00 C ATOM 1654 O PHE B 15 -4.107 -11.280 6.478 1.00 0.00 O ATOM 1655 CB PHE B 15 -2.403 -8.529 5.532 1.00 0.00 C ATOM 1656 CG PHE B 15 -2.265 -9.488 4.371 1.00 0.00 C ATOM 1657 CD1 PHE B 15 -2.963 -9.252 3.180 1.00 0.00 C ATOM 1658 CD2 PHE B 15 -1.444 -10.616 4.488 1.00 0.00 C ATOM 1659 CE1 PHE B 15 -2.836 -10.140 2.107 1.00 0.00 C ATOM 1660 CE2 PHE B 15 -1.321 -11.503 3.415 1.00 0.00 C ATOM 1661 CZ PHE B 15 -2.015 -11.265 2.227 1.00 0.00 C ATOM 0 H PHE B 15 -3.060 -7.244 7.524 1.00 0.00 H new ATOM 0 HA PHE B 15 -4.511 -8.891 5.798 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -2.533 -7.512 5.162 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -1.492 -8.536 6.131 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -3.599 -8.384 3.090 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -0.906 -10.800 5.406 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -3.371 -9.957 1.187 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -0.688 -12.374 3.505 1.00 0.00 H new ATOM 0 HZ PHE B 15 -1.917 -11.952 1.399 1.00 0.00 H new ATOM 1671 N HIS B 16 -2.509 -10.517 7.871 1.00 0.00 N ATOM 1672 CA HIS B 16 -2.266 -11.833 8.446 1.00 0.00 C ATOM 1673 C HIS B 16 -3.471 -12.333 9.210 1.00 0.00 C ATOM 1674 O HIS B 16 -3.831 -13.512 9.112 1.00 0.00 O ATOM 1675 CB HIS B 16 -1.017 -11.828 9.326 1.00 0.00 C ATOM 1676 CG HIS B 16 0.195 -11.882 8.435 1.00 0.00 C ATOM 1677 ND1 HIS B 16 1.035 -12.993 8.386 1.00 0.00 N ATOM 1678 CD2 HIS B 16 0.696 -10.996 7.515 1.00 0.00 C ATOM 1679 CE1 HIS B 16 1.980 -12.737 7.460 1.00 0.00 C ATOM 1680 NE2 HIS B 16 1.815 -11.538 6.898 1.00 0.00 N ATOM 0 H HIS B 16 -1.941 -9.766 8.263 1.00 0.00 H new ATOM 0 HA HIS B 16 -2.090 -12.524 7.622 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -0.993 -10.931 9.944 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -1.027 -12.682 10.003 1.00 0.00 H new ATOM 0 HD1 HIS B 16 0.950 -13.841 8.946 1.00 0.00 H new ATOM 0 HD2 HIS B 16 0.281 -10.022 7.302 1.00 0.00 H new ATOM 0 HE1 HIS B 16 2.776 -13.421 7.203 1.00 0.00 H new ATOM 1689 N ALA B 17 -4.128 -11.430 9.933 1.00 0.00 N ATOM 1690 CA ALA B 17 -5.316 -11.807 10.687 1.00 0.00 C ATOM 1691 C ALA B 17 -6.325 -12.465 9.763 1.00 0.00 C ATOM 1692 O ALA B 17 -6.778 -13.582 10.015 1.00 0.00 O ATOM 1693 CB ALA B 17 -5.951 -10.573 11.343 1.00 0.00 C ATOM 0 H ALA B 17 -3.862 -10.448 10.012 1.00 0.00 H new ATOM 0 HA ALA B 17 -5.023 -12.509 11.467 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -6.837 -10.874 11.902 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -5.233 -10.112 12.021 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -6.234 -9.856 10.572 1.00 0.00 H new ATOM 1699 N HIS B 18 -6.617 -11.803 8.653 1.00 0.00 N ATOM 1700 CA HIS B 18 -7.535 -12.367 7.670 1.00 0.00 C ATOM 1701 C HIS B 18 -6.930 -13.605 7.007 1.00 0.00 C ATOM 1702 O HIS B 18 -7.625 -14.605 6.796 1.00 0.00 O ATOM 1703 CB HIS B 18 -7.911 -11.329 6.610 1.00 0.00 C ATOM 1704 CG HIS B 18 -8.782 -10.267 7.228 1.00 0.00 C ATOM 1705 ND1 HIS B 18 -10.145 -10.444 7.426 1.00 0.00 N ATOM 1706 CD2 HIS B 18 -8.497 -9.016 7.709 1.00 0.00 C ATOM 1707 CE1 HIS B 18 -10.618 -9.326 8.007 1.00 0.00 C ATOM 1708 NE2 HIS B 18 -9.656 -8.424 8.201 1.00 0.00 N ATOM 0 H HIS B 18 -6.239 -10.887 8.411 1.00 0.00 H new ATOM 0 HA HIS B 18 -8.442 -12.664 8.196 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -7.011 -10.878 6.193 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -8.437 -11.811 5.786 1.00 0.00 H new ATOM 0 HD1 HIS B 18 -10.688 -11.270 7.177 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -7.519 -8.558 7.707 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -11.652 -9.178 8.283 1.00 0.00 H new ATOM 1717 N SER B 19 -5.631 -13.548 6.712 1.00 0.00 N ATOM 1718 CA SER B 19 -4.957 -14.673 6.071 1.00 0.00 C ATOM 1719 C SER B 19 -5.106 -15.919 6.924 1.00 0.00 C ATOM 1720 O SER B 19 -5.452 -16.997 6.427 1.00 0.00 O ATOM 1721 CB SER B 19 -3.464 -14.372 5.907 1.00 0.00 C ATOM 1722 OG SER B 19 -3.282 -13.159 5.177 1.00 0.00 O ATOM 0 H SER B 19 -5.032 -12.745 6.904 1.00 0.00 H new ATOM 0 HA SER B 19 -5.411 -14.833 5.093 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.993 -14.290 6.886 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.975 -15.195 5.386 1.00 0.00 H new ATOM 0 HG SER B 19 -3.150 -12.417 5.803 1.00 0.00 H new ATOM 1728 N GLY B 20 -4.887 -15.761 8.219 1.00 0.00 N ATOM 1729 CA GLY B 20 -4.998 -16.875 9.136 1.00 0.00 C ATOM 1730 C GLY B 20 -6.403 -17.427 9.125 1.00 0.00 C ATOM 1731 O GLY B 20 -6.608 -18.642 9.159 1.00 0.00 O ATOM 0 H GLY B 20 -4.632 -14.874 8.654 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -4.291 -17.656 8.856 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -4.735 -16.553 10.143 1.00 0.00 H new ATOM 1735 N LYS B 21 -7.377 -16.538 9.083 1.00 0.00 N ATOM 1736 CA LYS B 21 -8.765 -16.949 9.099 1.00 0.00 C ATOM 1737 C LYS B 21 -9.123 -17.753 7.857 1.00 0.00 C ATOM 1738 O LYS B 21 -9.775 -18.797 7.958 1.00 0.00 O ATOM 1739 CB LYS B 21 -9.687 -15.733 9.238 1.00 0.00 C ATOM 1740 CG LYS B 21 -9.469 -15.060 10.608 1.00 0.00 C ATOM 1741 CD LYS B 21 -9.909 -16.002 11.730 1.00 0.00 C ATOM 1742 CE LYS B 21 -9.703 -15.334 13.099 1.00 0.00 C ATOM 1743 NZ LYS B 21 -10.168 -16.256 14.166 1.00 0.00 N ATOM 0 H LYS B 21 -7.232 -15.529 9.038 1.00 0.00 H new ATOM 0 HA LYS B 21 -8.908 -17.595 9.965 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -9.486 -15.021 8.438 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -10.727 -16.042 9.137 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -8.418 -14.800 10.732 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -10.035 -14.130 10.660 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -10.958 -16.267 11.601 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -9.338 -16.929 11.681 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -8.650 -15.092 13.244 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -10.256 -14.396 13.146 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -10.031 -15.809 15.095 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -11.177 -16.466 14.028 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -9.622 -17.140 14.123 1.00 0.00 H new ATOM 1757 N GLU B 22 -8.684 -17.300 6.693 1.00 0.00 N ATOM 1758 CA GLU B 22 -8.987 -18.028 5.465 1.00 0.00 C ATOM 1759 C GLU B 22 -8.253 -19.368 5.424 1.00 0.00 C ATOM 1760 O GLU B 22 -8.837 -20.384 5.043 1.00 0.00 O ATOM 1761 CB GLU B 22 -8.710 -17.188 4.216 1.00 0.00 C ATOM 1762 CG GLU B 22 -9.686 -16.008 4.182 1.00 0.00 C ATOM 1763 CD GLU B 22 -9.373 -15.111 3.011 1.00 0.00 C ATOM 1764 OE1 GLU B 22 -8.257 -15.166 2.537 1.00 0.00 O ATOM 1765 OE2 GLU B 22 -10.248 -14.399 2.585 1.00 0.00 O ATOM 0 H GLU B 22 -8.130 -16.453 6.570 1.00 0.00 H new ATOM 0 HA GLU B 22 -10.056 -18.238 5.467 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.682 -16.826 4.226 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -8.825 -17.797 3.319 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -10.710 -16.375 4.106 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -9.618 -15.443 5.112 1.00 0.00 H new ATOM 1772 N GLY B 23 -7.009 -19.394 5.909 1.00 0.00 N ATOM 1773 CA GLY B 23 -6.283 -20.666 6.032 1.00 0.00 C ATOM 1774 C GLY B 23 -4.827 -20.582 5.580 1.00 0.00 C ATOM 1775 O GLY B 23 -4.011 -21.448 5.937 1.00 0.00 O ATOM 0 H GLY B 23 -6.491 -18.571 6.217 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -6.314 -20.994 7.071 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -6.795 -21.426 5.442 1.00 0.00 H new ATOM 1779 N ASP B 24 -4.495 -19.584 4.770 1.00 0.00 N ATOM 1780 CA ASP B 24 -3.123 -19.464 4.270 1.00 0.00 C ATOM 1781 C ASP B 24 -2.187 -18.932 5.337 1.00 0.00 C ATOM 1782 O ASP B 24 -2.606 -18.173 6.217 1.00 0.00 O ATOM 1783 CB ASP B 24 -3.035 -18.584 3.028 1.00 0.00 C ATOM 1784 CG ASP B 24 -1.673 -18.782 2.391 1.00 0.00 C ATOM 1785 OD1 ASP B 24 -0.745 -18.129 2.800 1.00 0.00 O ATOM 1786 OD2 ASP B 24 -1.569 -19.616 1.519 1.00 0.00 O ATOM 0 H ASP B 24 -5.137 -18.859 4.449 1.00 0.00 H new ATOM 0 HA ASP B 24 -2.812 -20.472 3.995 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -3.824 -18.845 2.323 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -3.179 -17.537 3.295 1.00 0.00 H new ATOM 1791 N LYS B 25 -0.907 -19.277 5.234 1.00 0.00 N ATOM 1792 CA LYS B 25 0.074 -18.754 6.174 1.00 0.00 C ATOM 1793 C LYS B 25 0.123 -17.272 6.027 1.00 0.00 C ATOM 1794 O LYS B 25 -0.005 -16.532 6.999 1.00 0.00 O ATOM 1795 CB LYS B 25 1.452 -19.269 5.837 1.00 0.00 C ATOM 1796 CG LYS B 25 1.490 -20.762 6.020 1.00 0.00 C ATOM 1797 CD LYS B 25 2.933 -21.257 5.864 1.00 0.00 C ATOM 1798 CE LYS B 25 3.384 -21.134 4.403 1.00 0.00 C ATOM 1799 NZ LYS B 25 4.855 -20.935 4.359 1.00 0.00 N ATOM 0 H LYS B 25 -0.531 -19.904 4.523 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.209 -19.060 7.181 1.00 0.00 H new ATOM 0 HB2 LYS B 25 1.706 -19.012 4.809 1.00 0.00 H new ATOM 0 HB3 LYS B 25 2.196 -18.795 6.478 1.00 0.00 H new ATOM 0 HG2 LYS B 25 1.107 -21.029 7.005 1.00 0.00 H new ATOM 0 HG3 LYS B 25 0.846 -21.246 5.286 1.00 0.00 H new ATOM 0 HD2 LYS B 25 3.595 -20.676 6.506 1.00 0.00 H new ATOM 0 HD3 LYS B 25 3.005 -22.295 6.188 1.00 0.00 H new ATOM 0 HE2 LYS B 25 3.110 -22.032 3.849 1.00 0.00 H new ATOM 0 HE3 LYS B 25 2.878 -20.296 3.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 5.192 -21.054 3.382 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 5.086 -19.977 4.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 5.319 -21.635 4.973 1.00 0.00 H new ATOM 1813 N TYR B 26 0.153 -16.840 4.784 1.00 0.00 N ATOM 1814 CA TYR B 26 0.068 -15.452 4.487 1.00 0.00 C ATOM 1815 C TYR B 26 -0.340 -15.271 3.036 1.00 0.00 C ATOM 1816 O TYR B 26 0.502 -15.012 2.164 1.00 0.00 O ATOM 1817 CB TYR B 26 1.430 -14.762 4.750 1.00 0.00 C ATOM 1818 CG TYR B 26 2.518 -15.815 4.869 1.00 0.00 C ATOM 1819 CD1 TYR B 26 3.062 -16.395 3.719 1.00 0.00 C ATOM 1820 CD2 TYR B 26 2.957 -16.224 6.131 1.00 0.00 C ATOM 1821 CE1 TYR B 26 4.042 -17.379 3.832 1.00 0.00 C ATOM 1822 CE2 TYR B 26 3.938 -17.217 6.238 1.00 0.00 C ATOM 1823 CZ TYR B 26 4.478 -17.793 5.086 1.00 0.00 C ATOM 1824 OH TYR B 26 5.436 -18.782 5.188 1.00 0.00 O ATOM 0 H TYR B 26 0.237 -17.446 3.968 1.00 0.00 H new ATOM 0 HA TYR B 26 -0.681 -14.992 5.132 1.00 0.00 H new ATOM 0 HB2 TYR B 26 1.663 -14.073 3.938 1.00 0.00 H new ATOM 0 HB3 TYR B 26 1.380 -14.171 5.665 1.00 0.00 H new ATOM 0 HD1 TYR B 26 2.723 -16.080 2.743 1.00 0.00 H new ATOM 0 HD2 TYR B 26 2.541 -15.775 7.021 1.00 0.00 H new ATOM 0 HE1 TYR B 26 4.465 -17.822 2.942 1.00 0.00 H new ATOM 0 HE2 TYR B 26 4.277 -17.538 7.212 1.00 0.00 H new ATOM 0 HH TYR B 26 5.630 -18.953 6.133 1.00 0.00 H new ATOM 1834 N LYS B 27 -1.633 -15.199 2.839 1.00 0.00 N ATOM 1835 CA LYS B 27 -2.263 -14.881 1.574 1.00 0.00 C ATOM 1836 C LYS B 27 -3.678 -14.488 1.900 1.00 0.00 C ATOM 1837 O LYS B 27 -4.213 -14.931 2.923 1.00 0.00 O ATOM 1838 CB LYS B 27 -2.289 -16.099 0.622 1.00 0.00 C ATOM 1839 CG LYS B 27 -0.867 -16.528 0.182 1.00 0.00 C ATOM 1840 CD LYS B 27 -0.224 -15.472 -0.737 1.00 0.00 C ATOM 1841 CE LYS B 27 -0.730 -15.664 -2.172 1.00 0.00 C ATOM 1842 NZ LYS B 27 0.161 -14.967 -3.124 1.00 0.00 N ATOM 0 H LYS B 27 -2.307 -15.367 3.586 1.00 0.00 H new ATOM 0 HA LYS B 27 -1.708 -14.089 1.071 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -2.782 -16.935 1.118 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -2.883 -15.856 -0.259 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -0.241 -16.677 1.062 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -0.918 -17.484 -0.339 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.470 -14.470 -0.385 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.862 -15.563 -0.708 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -0.771 -16.726 -2.412 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -1.745 -15.277 -2.262 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -0.369 -14.733 -3.988 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.518 -14.092 -2.689 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 0.962 -15.585 -3.366 1.00 0.00 H new ATOM 1856 N LEU B 28 -4.295 -13.706 1.065 1.00 0.00 N ATOM 1857 CA LEU B 28 -5.654 -13.296 1.321 1.00 0.00 C ATOM 1858 C LEU B 28 -6.541 -13.652 0.143 1.00 0.00 C ATOM 1859 O LEU B 28 -6.210 -13.350 -0.990 1.00 0.00 O ATOM 1860 CB LEU B 28 -5.678 -11.792 1.581 1.00 0.00 C ATOM 1861 CG LEU B 28 -7.081 -11.344 1.973 1.00 0.00 C ATOM 1862 CD1 LEU B 28 -7.453 -11.948 3.325 1.00 0.00 C ATOM 1863 CD2 LEU B 28 -7.110 -9.824 2.077 1.00 0.00 C ATOM 0 H LEU B 28 -3.887 -13.338 0.205 1.00 0.00 H new ATOM 0 HA LEU B 28 -6.036 -13.818 2.198 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -4.974 -11.542 2.375 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -5.354 -11.257 0.688 1.00 0.00 H new ATOM 0 HG LEU B 28 -7.794 -11.678 1.219 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -8.457 -11.626 3.603 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -7.426 -13.036 3.257 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -6.742 -11.614 4.081 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -8.111 -9.498 2.357 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -6.397 -9.497 2.834 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -6.842 -9.388 1.114 1.00 0.00 H new ATOM 1875 N SER B 29 -7.674 -14.252 0.403 1.00 0.00 N ATOM 1876 CA SER B 29 -8.622 -14.534 -0.654 1.00 0.00 C ATOM 1877 C SER B 29 -9.672 -13.438 -0.693 1.00 0.00 C ATOM 1878 O SER B 29 -9.619 -12.481 0.088 1.00 0.00 O ATOM 1879 CB SER B 29 -9.266 -15.922 -0.512 1.00 0.00 C ATOM 1880 OG SER B 29 -8.718 -16.611 0.605 1.00 0.00 O ATOM 0 H SER B 29 -7.966 -14.555 1.332 1.00 0.00 H new ATOM 0 HA SER B 29 -8.081 -14.550 -1.600 1.00 0.00 H new ATOM 0 HB2 SER B 29 -10.344 -15.819 -0.390 1.00 0.00 H new ATOM 0 HB3 SER B 29 -9.102 -16.501 -1.421 1.00 0.00 H new ATOM 0 HG SER B 29 -8.125 -16.010 1.101 1.00 0.00 H new ATOM 1886 N LYS B 30 -10.598 -13.532 -1.614 1.00 0.00 N ATOM 1887 CA LYS B 30 -11.600 -12.490 -1.748 1.00 0.00 C ATOM 1888 C LYS B 30 -12.688 -12.623 -0.691 1.00 0.00 C ATOM 1889 O LYS B 30 -13.582 -11.762 -0.592 1.00 0.00 O ATOM 1890 CB LYS B 30 -12.185 -12.463 -3.157 1.00 0.00 C ATOM 1891 CG LYS B 30 -11.048 -12.548 -4.204 1.00 0.00 C ATOM 1892 CD LYS B 30 -9.912 -11.544 -3.889 1.00 0.00 C ATOM 1893 CE LYS B 30 -9.835 -10.475 -4.974 1.00 0.00 C ATOM 1894 NZ LYS B 30 -9.275 -11.065 -6.208 1.00 0.00 N ATOM 0 H LYS B 30 -10.684 -14.304 -2.275 1.00 0.00 H new ATOM 0 HA LYS B 30 -11.105 -11.533 -1.582 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -12.875 -13.296 -3.289 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -12.758 -11.548 -3.304 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -10.645 -13.561 -4.224 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -11.450 -12.345 -5.197 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -10.089 -11.077 -2.920 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -8.960 -12.071 -3.820 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -10.827 -10.069 -5.170 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -9.212 -9.646 -4.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -9.238 -10.341 -6.953 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -8.315 -11.417 -6.020 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -9.878 -11.853 -6.521 1.00 0.00 H new ATOM 1908 N LYS B 31 -12.601 -13.677 0.115 1.00 0.00 N ATOM 1909 CA LYS B 31 -13.554 -13.879 1.198 1.00 0.00 C ATOM 1910 C LYS B 31 -13.389 -12.748 2.199 1.00 0.00 C ATOM 1911 O LYS B 31 -14.225 -11.841 2.293 1.00 0.00 O ATOM 1912 CB LYS B 31 -13.306 -15.227 1.931 1.00 0.00 C ATOM 1913 CG LYS B 31 -12.380 -16.137 1.112 1.00 0.00 C ATOM 1914 CD LYS B 31 -12.150 -17.461 1.834 1.00 0.00 C ATOM 1915 CE LYS B 31 -11.238 -18.361 0.990 1.00 0.00 C ATOM 1916 NZ LYS B 31 -12.064 -19.317 0.217 1.00 0.00 N ATOM 0 H LYS B 31 -11.885 -14.399 0.039 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.559 -13.896 0.776 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -12.863 -15.037 2.909 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -14.257 -15.731 2.104 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -12.819 -16.323 0.132 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -11.426 -15.638 0.945 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -11.697 -17.280 2.809 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -13.103 -17.959 2.013 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -10.636 -17.754 0.313 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -10.545 -18.902 1.635 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -11.445 -19.927 -0.355 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -12.620 -19.904 0.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -12.708 -18.792 -0.409 1.00 0.00 H new ATOM 1930 N GLU B 32 -12.268 -12.771 2.894 1.00 0.00 N ATOM 1931 CA GLU B 32 -11.959 -11.757 3.868 1.00 0.00 C ATOM 1932 C GLU B 32 -11.693 -10.419 3.211 1.00 0.00 C ATOM 1933 O GLU B 32 -12.013 -9.392 3.777 1.00 0.00 O ATOM 1934 CB GLU B 32 -10.740 -12.169 4.698 1.00 0.00 C ATOM 1935 CG GLU B 32 -11.061 -13.391 5.566 1.00 0.00 C ATOM 1936 CD GLU B 32 -12.108 -13.056 6.596 1.00 0.00 C ATOM 1937 OE1 GLU B 32 -11.952 -12.068 7.267 1.00 0.00 O ATOM 1938 OE2 GLU B 32 -13.050 -13.801 6.715 1.00 0.00 O ATOM 0 H GLU B 32 -11.553 -13.492 2.796 1.00 0.00 H new ATOM 0 HA GLU B 32 -12.827 -11.654 4.520 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.904 -12.396 4.037 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -10.428 -11.339 5.332 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.413 -14.208 4.936 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -10.155 -13.738 6.062 1.00 0.00 H new ATOM 1945 N LEU B 33 -11.016 -10.424 2.063 1.00 0.00 N ATOM 1946 CA LEU B 33 -10.548 -9.165 1.465 1.00 0.00 C ATOM 1947 C LEU B 33 -11.696 -8.210 1.206 1.00 0.00 C ATOM 1948 O LEU B 33 -11.624 -7.031 1.578 1.00 0.00 O ATOM 1949 CB LEU B 33 -9.799 -9.448 0.143 1.00 0.00 C ATOM 1950 CG LEU B 33 -9.250 -8.143 -0.504 1.00 0.00 C ATOM 1951 CD1 LEU B 33 -10.333 -7.455 -1.343 1.00 0.00 C ATOM 1952 CD2 LEU B 33 -8.720 -7.167 0.558 1.00 0.00 C ATOM 0 H LEU B 33 -10.781 -11.264 1.535 1.00 0.00 H new ATOM 0 HA LEU B 33 -9.869 -8.695 2.176 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -8.974 -10.134 0.333 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -10.472 -9.945 -0.556 1.00 0.00 H new ATOM 0 HG LEU B 33 -8.422 -8.428 -1.153 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -9.927 -6.545 -1.786 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -10.662 -8.128 -2.135 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -11.181 -7.202 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -8.345 -6.267 0.070 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -9.526 -6.900 1.241 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -7.913 -7.640 1.117 1.00 0.00 H new ATOM 1964 N LYS B 34 -12.771 -8.699 0.619 1.00 0.00 N ATOM 1965 CA LYS B 34 -13.890 -7.818 0.355 1.00 0.00 C ATOM 1966 C LYS B 34 -14.474 -7.299 1.660 1.00 0.00 C ATOM 1967 O LYS B 34 -14.765 -6.111 1.790 1.00 0.00 O ATOM 1968 CB LYS B 34 -14.974 -8.505 -0.475 1.00 0.00 C ATOM 1969 CG LYS B 34 -14.458 -8.778 -1.897 1.00 0.00 C ATOM 1970 CD LYS B 34 -15.607 -9.310 -2.780 1.00 0.00 C ATOM 1971 CE LYS B 34 -15.634 -10.844 -2.782 1.00 0.00 C ATOM 1972 NZ LYS B 34 -15.851 -11.362 -1.403 1.00 0.00 N ATOM 0 H LYS B 34 -12.893 -9.668 0.324 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.514 -6.977 -0.228 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -15.267 -9.441 -0.000 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -15.864 -7.877 -0.517 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -14.051 -7.863 -2.327 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -13.646 -9.504 -1.865 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -16.559 -8.926 -2.414 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -15.487 -8.944 -3.799 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -16.428 -11.199 -3.440 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -14.695 -11.230 -3.179 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -16.232 -12.328 -1.451 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -14.947 -11.372 -0.890 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -16.526 -10.748 -0.904 1.00 0.00 H new ATOM 1986 N GLU B 35 -14.594 -8.184 2.637 1.00 0.00 N ATOM 1987 CA GLU B 35 -15.085 -7.801 3.946 1.00 0.00 C ATOM 1988 C GLU B 35 -14.067 -6.910 4.647 1.00 0.00 C ATOM 1989 O GLU B 35 -14.410 -5.868 5.190 1.00 0.00 O ATOM 1990 CB GLU B 35 -15.353 -9.059 4.770 1.00 0.00 C ATOM 1991 CG GLU B 35 -16.543 -9.812 4.149 1.00 0.00 C ATOM 1992 CD GLU B 35 -16.788 -11.133 4.854 1.00 0.00 C ATOM 1993 OE1 GLU B 35 -16.091 -11.429 5.799 1.00 0.00 O ATOM 1994 OE2 GLU B 35 -17.672 -11.838 4.438 1.00 0.00 O ATOM 0 H GLU B 35 -14.357 -9.172 2.546 1.00 0.00 H new ATOM 0 HA GLU B 35 -16.013 -7.240 3.838 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -14.469 -9.696 4.785 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -15.572 -8.794 5.804 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -17.439 -9.194 4.209 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -16.350 -9.992 3.091 1.00 0.00 H new ATOM 2001 N LEU B 36 -12.813 -7.303 4.569 1.00 0.00 N ATOM 2002 CA LEU B 36 -11.714 -6.563 5.177 1.00 0.00 C ATOM 2003 C LEU B 36 -11.594 -5.164 4.621 1.00 0.00 C ATOM 2004 O LEU B 36 -11.502 -4.193 5.378 1.00 0.00 O ATOM 2005 CB LEU B 36 -10.399 -7.358 4.934 1.00 0.00 C ATOM 2006 CG LEU B 36 -9.178 -6.435 4.739 1.00 0.00 C ATOM 2007 CD1 LEU B 36 -8.949 -5.545 5.947 1.00 0.00 C ATOM 2008 CD2 LEU B 36 -7.934 -7.294 4.502 1.00 0.00 C ATOM 0 H LEU B 36 -12.520 -8.149 4.080 1.00 0.00 H new ATOM 0 HA LEU B 36 -11.908 -6.458 6.245 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -10.218 -8.021 5.780 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -10.517 -7.989 4.053 1.00 0.00 H new ATOM 0 HG LEU B 36 -9.371 -5.793 3.880 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -8.081 -4.910 5.772 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -9.828 -4.921 6.111 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -8.774 -6.164 6.827 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.067 -6.648 4.363 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -7.770 -7.942 5.363 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.078 -7.905 3.611 1.00 0.00 H new ATOM 2020 N LEU B 37 -11.579 -5.051 3.313 1.00 0.00 N ATOM 2021 CA LEU B 37 -11.360 -3.754 2.705 1.00 0.00 C ATOM 2022 C LEU B 37 -12.469 -2.781 3.067 1.00 0.00 C ATOM 2023 O LEU B 37 -12.206 -1.676 3.545 1.00 0.00 O ATOM 2024 CB LEU B 37 -11.199 -3.891 1.176 1.00 0.00 C ATOM 2025 CG LEU B 37 -10.969 -2.520 0.499 1.00 0.00 C ATOM 2026 CD1 LEU B 37 -12.301 -1.793 0.301 1.00 0.00 C ATOM 2027 CD2 LEU B 37 -10.025 -1.652 1.336 1.00 0.00 C ATOM 0 H LEU B 37 -11.713 -5.822 2.659 1.00 0.00 H new ATOM 0 HA LEU B 37 -10.432 -3.344 3.103 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -10.359 -4.551 0.956 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -12.090 -4.359 0.757 1.00 0.00 H new ATOM 0 HG LEU B 37 -10.511 -2.697 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -12.122 -0.830 -0.177 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.954 -2.395 -0.330 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -12.777 -1.635 1.269 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -9.878 -0.692 0.840 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -10.460 -1.488 2.322 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -9.065 -2.157 1.442 1.00 0.00 H new ATOM 2039 N GLN B 38 -13.702 -3.219 2.943 1.00 0.00 N ATOM 2040 CA GLN B 38 -14.816 -2.370 3.315 1.00 0.00 C ATOM 2041 C GLN B 38 -14.819 -2.116 4.815 1.00 0.00 C ATOM 2042 O GLN B 38 -15.112 -1.013 5.265 1.00 0.00 O ATOM 2043 CB GLN B 38 -16.146 -2.983 2.856 1.00 0.00 C ATOM 2044 CG GLN B 38 -16.421 -4.289 3.603 1.00 0.00 C ATOM 2045 CD GLN B 38 -17.590 -5.003 2.950 1.00 0.00 C ATOM 2046 OE1 GLN B 38 -18.745 -4.743 3.284 1.00 0.00 O ATOM 2047 NE2 GLN B 38 -17.364 -5.868 2.028 1.00 0.00 N ATOM 0 H GLN B 38 -13.959 -4.142 2.594 1.00 0.00 H new ATOM 0 HA GLN B 38 -14.699 -1.411 2.811 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -16.958 -2.278 3.033 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -16.115 -3.171 1.783 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -15.536 -4.925 3.585 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -16.645 -4.083 4.650 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -16.405 -6.082 1.753 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -18.143 -6.341 1.571 1.00 0.00 H new ATOM 2056 N THR B 39 -14.543 -3.157 5.577 1.00 0.00 N ATOM 2057 CA THR B 39 -14.567 -3.075 7.021 1.00 0.00 C ATOM 2058 C THR B 39 -13.511 -2.114 7.570 1.00 0.00 C ATOM 2059 O THR B 39 -13.837 -1.200 8.340 1.00 0.00 O ATOM 2060 CB THR B 39 -14.356 -4.481 7.589 1.00 0.00 C ATOM 2061 OG1 THR B 39 -15.436 -5.318 7.191 1.00 0.00 O ATOM 2062 CG2 THR B 39 -14.244 -4.448 9.101 1.00 0.00 C ATOM 0 H THR B 39 -14.297 -4.078 5.213 1.00 0.00 H new ATOM 0 HA THR B 39 -15.534 -2.678 7.328 1.00 0.00 H new ATOM 0 HB THR B 39 -13.421 -4.881 7.196 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.373 -5.498 6.230 1.00 0.00 H new ATOM 0 HG21 THR B 39 -14.095 -5.460 9.477 1.00 0.00 H new ATOM 0 HG22 THR B 39 -13.397 -3.825 9.390 1.00 0.00 H new ATOM 0 HG23 THR B 39 -15.159 -4.035 9.525 1.00 0.00 H new ATOM 2070 N GLU B 40 -12.256 -2.319 7.189 1.00 0.00 N ATOM 2071 CA GLU B 40 -11.170 -1.504 7.723 1.00 0.00 C ATOM 2072 C GLU B 40 -11.210 -0.086 7.192 1.00 0.00 C ATOM 2073 O GLU B 40 -10.969 0.869 7.931 1.00 0.00 O ATOM 2074 CB GLU B 40 -9.819 -2.155 7.438 1.00 0.00 C ATOM 2075 CG GLU B 40 -9.739 -3.498 8.190 1.00 0.00 C ATOM 2076 CD GLU B 40 -9.824 -3.296 9.695 1.00 0.00 C ATOM 2077 OE1 GLU B 40 -9.541 -2.206 10.152 1.00 0.00 O ATOM 2078 OE2 GLU B 40 -10.180 -4.237 10.374 1.00 0.00 O ATOM 0 H GLU B 40 -11.966 -3.033 6.521 1.00 0.00 H new ATOM 0 HA GLU B 40 -11.307 -1.446 8.803 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -9.697 -2.316 6.367 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -9.010 -1.497 7.756 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -10.549 -4.149 7.862 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.805 -4.001 7.941 1.00 0.00 H new ATOM 2085 N LEU B 41 -11.517 0.045 5.919 1.00 0.00 N ATOM 2086 CA LEU B 41 -11.561 1.346 5.272 1.00 0.00 C ATOM 2087 C LEU B 41 -12.987 1.876 5.216 1.00 0.00 C ATOM 2088 O LEU B 41 -13.395 2.458 4.222 1.00 0.00 O ATOM 2089 CB LEU B 41 -10.968 1.253 3.856 1.00 0.00 C ATOM 2090 CG LEU B 41 -9.437 1.416 3.912 1.00 0.00 C ATOM 2091 CD1 LEU B 41 -8.806 0.226 4.642 1.00 0.00 C ATOM 2092 CD2 LEU B 41 -8.874 1.497 2.489 1.00 0.00 C ATOM 0 H LEU B 41 -11.742 -0.738 5.305 1.00 0.00 H new ATOM 0 HA LEU B 41 -10.963 2.043 5.860 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -11.223 0.292 3.409 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -11.401 2.026 3.220 1.00 0.00 H new ATOM 0 HG LEU B 41 -9.200 2.333 4.452 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.724 0.352 4.676 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.197 0.174 5.658 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -9.048 -0.696 4.112 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -7.791 1.612 2.532 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -9.120 0.584 1.948 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.310 2.353 1.974 1.00 0.00 H new ATOM 2104 N SER B 42 -13.755 1.625 6.260 1.00 0.00 N ATOM 2105 CA SER B 42 -15.163 2.010 6.269 1.00 0.00 C ATOM 2106 C SER B 42 -15.344 3.502 5.932 1.00 0.00 C ATOM 2107 O SER B 42 -16.217 3.862 5.131 1.00 0.00 O ATOM 2108 CB SER B 42 -15.800 1.682 7.630 1.00 0.00 C ATOM 2109 OG SER B 42 -15.800 0.260 7.834 1.00 0.00 O ATOM 0 H SER B 42 -13.435 1.160 7.109 1.00 0.00 H new ATOM 0 HA SER B 42 -15.670 1.434 5.495 1.00 0.00 H new ATOM 0 HB2 SER B 42 -15.246 2.174 8.430 1.00 0.00 H new ATOM 0 HB3 SER B 42 -16.820 2.064 7.667 1.00 0.00 H new ATOM 0 HG SER B 42 -14.882 -0.079 7.776 1.00 0.00 H new ATOM 2115 N GLY B 43 -14.493 4.354 6.493 1.00 0.00 N ATOM 2116 CA GLY B 43 -14.549 5.788 6.209 1.00 0.00 C ATOM 2117 C GLY B 43 -14.159 6.071 4.767 1.00 0.00 C ATOM 2118 O GLY B 43 -14.893 6.746 4.037 1.00 0.00 O ATOM 0 H GLY B 43 -13.758 4.081 7.145 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -15.556 6.161 6.398 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -13.879 6.323 6.883 1.00 0.00 H new ATOM 2122 N PHE B 44 -13.063 5.454 4.327 1.00 0.00 N ATOM 2123 CA PHE B 44 -12.645 5.559 2.925 1.00 0.00 C ATOM 2124 C PHE B 44 -13.720 4.963 2.041 1.00 0.00 C ATOM 2125 O PHE B 44 -14.109 5.541 1.033 1.00 0.00 O ATOM 2126 CB PHE B 44 -11.324 4.803 2.685 1.00 0.00 C ATOM 2127 CG PHE B 44 -10.113 5.691 2.899 1.00 0.00 C ATOM 2128 CD1 PHE B 44 -9.649 6.503 1.858 1.00 0.00 C ATOM 2129 CD2 PHE B 44 -9.439 5.682 4.120 1.00 0.00 C ATOM 2130 CE1 PHE B 44 -8.518 7.306 2.043 1.00 0.00 C ATOM 2131 CE2 PHE B 44 -8.306 6.483 4.304 1.00 0.00 C ATOM 2132 CZ PHE B 44 -7.847 7.293 3.265 1.00 0.00 C ATOM 0 H PHE B 44 -12.453 4.882 4.911 1.00 0.00 H new ATOM 0 HA PHE B 44 -12.493 6.612 2.687 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -11.269 3.947 3.358 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -11.311 4.411 1.668 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -10.165 6.510 0.909 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -9.792 5.055 4.926 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -8.165 7.936 1.240 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -7.787 6.474 5.251 1.00 0.00 H new ATOM 0 HZ PHE B 44 -6.972 7.910 3.407 1.00 0.00 H new ATOM 2142 N LEU B 45 -14.234 3.831 2.469 1.00 0.00 N ATOM 2143 CA LEU B 45 -15.278 3.129 1.750 1.00 0.00 C ATOM 2144 C LEU B 45 -16.508 3.991 1.598 1.00 0.00 C ATOM 2145 O LEU B 45 -17.023 4.151 0.491 1.00 0.00 O ATOM 2146 CB LEU B 45 -15.622 1.834 2.522 1.00 0.00 C ATOM 2147 CG LEU B 45 -17.096 1.441 2.334 1.00 0.00 C ATOM 2148 CD1 LEU B 45 -17.418 1.199 0.862 1.00 0.00 C ATOM 2149 CD2 LEU B 45 -17.391 0.177 3.141 1.00 0.00 C ATOM 0 H LEU B 45 -13.939 3.368 3.329 1.00 0.00 H new ATOM 0 HA LEU B 45 -14.923 2.885 0.749 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.981 1.022 2.177 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.414 1.975 3.583 1.00 0.00 H new ATOM 0 HG LEU B 45 -17.720 2.262 2.687 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -18.467 0.923 0.760 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -17.225 2.109 0.293 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -16.792 0.393 0.480 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -18.436 -0.103 3.009 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -16.751 -0.634 2.794 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -17.197 0.366 4.197 1.00 0.00 H new ATOM 2161 N ASP B 46 -16.944 4.590 2.684 1.00 0.00 N ATOM 2162 CA ASP B 46 -18.134 5.420 2.649 1.00 0.00 C ATOM 2163 C ASP B 46 -17.952 6.563 1.680 1.00 0.00 C ATOM 2164 O ASP B 46 -18.802 6.808 0.823 1.00 0.00 O ATOM 2165 CB ASP B 46 -18.456 5.937 4.044 1.00 0.00 C ATOM 2166 CG ASP B 46 -19.693 6.811 4.013 1.00 0.00 C ATOM 2167 OD1 ASP B 46 -20.736 6.313 3.664 1.00 0.00 O ATOM 2168 OD2 ASP B 46 -19.583 7.965 4.357 1.00 0.00 O ATOM 0 H ASP B 46 -16.498 4.521 3.599 1.00 0.00 H new ATOM 0 HA ASP B 46 -18.973 4.816 2.305 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -18.613 5.098 4.722 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -17.611 6.506 4.431 1.00 0.00 H new ATOM 2173 N ALA B 47 -16.798 7.197 1.741 1.00 0.00 N ATOM 2174 CA ALA B 47 -16.466 8.249 0.788 1.00 0.00 C ATOM 2175 C ALA B 47 -16.292 7.672 -0.615 1.00 0.00 C ATOM 2176 O ALA B 47 -16.613 8.324 -1.619 1.00 0.00 O ATOM 2177 CB ALA B 47 -15.180 8.962 1.207 1.00 0.00 C ATOM 0 H ALA B 47 -16.075 7.007 2.435 1.00 0.00 H new ATOM 0 HA ALA B 47 -17.288 8.965 0.778 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -14.946 9.744 0.485 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -15.315 9.407 2.193 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -14.361 8.244 1.242 1.00 0.00 H new ATOM 2183 N GLN B 48 -15.689 6.497 -0.675 1.00 0.00 N ATOM 2184 CA GLN B 48 -15.326 5.854 -1.937 1.00 0.00 C ATOM 2185 C GLN B 48 -16.515 5.452 -2.804 1.00 0.00 C ATOM 2186 O GLN B 48 -16.351 5.260 -4.008 1.00 0.00 O ATOM 2187 CB GLN B 48 -14.422 4.639 -1.697 1.00 0.00 C ATOM 2188 CG GLN B 48 -12.959 5.083 -1.587 1.00 0.00 C ATOM 2189 CD GLN B 48 -12.410 5.426 -2.969 1.00 0.00 C ATOM 2190 OE1 GLN B 48 -11.209 5.533 -3.150 1.00 0.00 O ATOM 2191 NE2 GLN B 48 -13.225 5.587 -3.965 1.00 0.00 N ATOM 0 H GLN B 48 -15.434 5.956 0.151 1.00 0.00 H new ATOM 0 HA GLN B 48 -14.784 6.617 -2.496 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -14.724 4.126 -0.784 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -14.533 3.926 -2.514 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -12.882 5.950 -0.931 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -12.363 4.289 -1.137 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -14.231 5.499 -3.820 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -12.860 5.802 -4.893 1.00 0.00 H new ATOM 2200 N LYS B 49 -17.659 5.191 -2.196 1.00 0.00 N ATOM 2201 CA LYS B 49 -18.785 4.606 -2.947 1.00 0.00 C ATOM 2202 C LYS B 49 -19.162 5.480 -4.137 1.00 0.00 C ATOM 2203 O LYS B 49 -19.383 4.977 -5.242 1.00 0.00 O ATOM 2204 CB LYS B 49 -20.013 4.466 -2.034 1.00 0.00 C ATOM 2205 CG LYS B 49 -19.746 3.419 -0.946 1.00 0.00 C ATOM 2206 CD LYS B 49 -20.937 3.352 0.021 1.00 0.00 C ATOM 2207 CE LYS B 49 -21.954 2.313 -0.471 1.00 0.00 C ATOM 2208 NZ LYS B 49 -21.351 0.954 -0.387 1.00 0.00 N ATOM 0 H LYS B 49 -17.843 5.365 -1.208 1.00 0.00 H new ATOM 0 HA LYS B 49 -18.470 3.626 -3.306 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -20.246 5.427 -1.575 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -20.883 4.175 -2.623 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -19.581 2.443 -1.402 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -18.837 3.673 -0.400 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -20.590 3.089 1.020 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -21.411 4.331 0.095 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -22.860 2.359 0.134 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -22.245 2.531 -1.498 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -22.099 0.252 -0.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -20.867 0.733 -1.281 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -20.665 0.926 0.394 1.00 0.00 H new ATOM 2222 N ASP B 50 -19.194 6.778 -3.913 1.00 0.00 N ATOM 2223 CA ASP B 50 -19.536 7.746 -4.957 1.00 0.00 C ATOM 2224 C ASP B 50 -18.463 7.801 -6.039 1.00 0.00 C ATOM 2225 O ASP B 50 -18.690 8.334 -7.126 1.00 0.00 O ATOM 2226 CB ASP B 50 -19.738 9.144 -4.346 1.00 0.00 C ATOM 2227 CG ASP B 50 -20.462 10.054 -5.323 1.00 0.00 C ATOM 2228 OD1 ASP B 50 -21.523 9.678 -5.778 1.00 0.00 O ATOM 2229 OD2 ASP B 50 -19.961 11.120 -5.598 1.00 0.00 O ATOM 0 H ASP B 50 -18.986 7.199 -3.008 1.00 0.00 H new ATOM 0 HA ASP B 50 -20.467 7.419 -5.420 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -20.311 9.064 -3.422 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -18.772 9.576 -4.085 1.00 0.00 H new ATOM 2234 N VAL B 51 -17.267 7.362 -5.693 1.00 0.00 N ATOM 2235 CA VAL B 51 -16.130 7.466 -6.585 1.00 0.00 C ATOM 2236 C VAL B 51 -16.268 6.524 -7.774 1.00 0.00 C ATOM 2237 O VAL B 51 -15.560 6.683 -8.776 1.00 0.00 O ATOM 2238 CB VAL B 51 -14.827 7.207 -5.814 1.00 0.00 C ATOM 2239 CG1 VAL B 51 -13.613 7.372 -6.736 1.00 0.00 C ATOM 2240 CG2 VAL B 51 -14.718 8.196 -4.646 1.00 0.00 C ATOM 0 H VAL B 51 -17.058 6.927 -4.794 1.00 0.00 H new ATOM 0 HA VAL B 51 -16.098 8.480 -6.983 1.00 0.00 H new ATOM 0 HB VAL B 51 -14.843 6.185 -5.435 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -12.699 7.185 -6.172 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -13.683 6.662 -7.560 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -13.593 8.387 -7.133 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -13.793 8.012 -4.099 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -14.715 9.216 -5.032 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -15.568 8.064 -3.977 1.00 0.00 H new ATOM 2250 N ASP B 52 -17.111 5.496 -7.631 1.00 0.00 N ATOM 2251 CA ASP B 52 -17.296 4.494 -8.691 1.00 0.00 C ATOM 2252 C ASP B 52 -16.029 3.684 -8.884 1.00 0.00 C ATOM 2253 O ASP B 52 -16.044 2.455 -8.817 1.00 0.00 O ATOM 2254 CB ASP B 52 -17.702 5.181 -10.011 1.00 0.00 C ATOM 2255 CG ASP B 52 -18.062 4.173 -11.090 1.00 0.00 C ATOM 2256 OD1 ASP B 52 -17.487 3.108 -11.115 1.00 0.00 O ATOM 2257 OD2 ASP B 52 -18.910 4.485 -11.893 1.00 0.00 O ATOM 0 H ASP B 52 -17.675 5.334 -6.796 1.00 0.00 H new ATOM 0 HA ASP B 52 -18.095 3.816 -8.391 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -18.552 5.839 -9.831 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -16.882 5.809 -10.360 1.00 0.00 H new ATOM 2262 N ALA B 53 -14.922 4.379 -9.054 1.00 0.00 N ATOM 2263 CA ALA B 53 -13.633 3.736 -9.251 1.00 0.00 C ATOM 2264 C ALA B 53 -13.345 2.742 -8.140 1.00 0.00 C ATOM 2265 O ALA B 53 -12.627 1.775 -8.344 1.00 0.00 O ATOM 2266 CB ALA B 53 -12.506 4.773 -9.323 1.00 0.00 C ATOM 0 H ALA B 53 -14.887 5.398 -9.060 1.00 0.00 H new ATOM 0 HA ALA B 53 -13.677 3.200 -10.199 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -11.553 4.265 -9.471 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -12.689 5.451 -10.156 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -12.474 5.341 -8.393 1.00 0.00 H new ATOM 2272 N VAL B 54 -13.953 2.952 -6.979 1.00 0.00 N ATOM 2273 CA VAL B 54 -13.757 2.037 -5.869 1.00 0.00 C ATOM 2274 C VAL B 54 -14.131 0.633 -6.302 1.00 0.00 C ATOM 2275 O VAL B 54 -13.358 -0.318 -6.109 1.00 0.00 O ATOM 2276 CB VAL B 54 -14.592 2.477 -4.646 1.00 0.00 C ATOM 2277 CG1 VAL B 54 -16.088 2.522 -4.996 1.00 0.00 C ATOM 2278 CG2 VAL B 54 -14.373 1.505 -3.469 1.00 0.00 C ATOM 0 H VAL B 54 -14.576 3.736 -6.786 1.00 0.00 H new ATOM 0 HA VAL B 54 -12.708 2.050 -5.575 1.00 0.00 H new ATOM 0 HB VAL B 54 -14.264 3.476 -4.357 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -16.657 2.834 -4.120 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -16.251 3.232 -5.807 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -16.418 1.532 -5.309 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -14.968 1.828 -2.615 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -14.678 0.501 -3.765 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -13.318 1.498 -3.195 1.00 0.00 H new ATOM 2288 N ASP B 55 -15.249 0.522 -7.003 1.00 0.00 N ATOM 2289 CA ASP B 55 -15.653 -0.763 -7.553 1.00 0.00 C ATOM 2290 C ASP B 55 -14.603 -1.260 -8.507 1.00 0.00 C ATOM 2291 O ASP B 55 -14.271 -2.449 -8.538 1.00 0.00 O ATOM 2292 CB ASP B 55 -16.967 -0.639 -8.319 1.00 0.00 C ATOM 2293 CG ASP B 55 -17.341 -1.996 -8.888 1.00 0.00 C ATOM 2294 OD1 ASP B 55 -17.500 -2.917 -8.118 1.00 0.00 O ATOM 2295 OD2 ASP B 55 -17.431 -2.112 -10.084 1.00 0.00 O ATOM 0 H ASP B 55 -15.885 1.294 -7.203 1.00 0.00 H new ATOM 0 HA ASP B 55 -15.779 -1.457 -6.722 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -17.755 -0.279 -7.658 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -16.866 0.091 -9.122 1.00 0.00 H new ATOM 2300 N LYS B 56 -14.157 -0.360 -9.343 1.00 0.00 N ATOM 2301 CA LYS B 56 -13.177 -0.647 -10.364 1.00 0.00 C ATOM 2302 C LYS B 56 -11.811 -1.000 -9.759 1.00 0.00 C ATOM 2303 O LYS B 56 -11.171 -1.963 -10.180 1.00 0.00 O ATOM 2304 CB LYS B 56 -13.097 0.540 -11.314 1.00 0.00 C ATOM 2305 CG LYS B 56 -14.439 0.623 -12.080 1.00 0.00 C ATOM 2306 CD LYS B 56 -14.455 1.849 -12.989 1.00 0.00 C ATOM 2307 CE LYS B 56 -15.704 1.820 -13.886 1.00 0.00 C ATOM 2308 NZ LYS B 56 -16.935 1.814 -13.051 1.00 0.00 N ATOM 0 H LYS B 56 -14.468 0.611 -9.336 1.00 0.00 H new ATOM 0 HA LYS B 56 -13.487 -1.528 -10.926 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -12.915 1.461 -10.760 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -12.267 0.417 -12.010 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -14.583 -0.280 -12.673 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -15.267 0.675 -11.373 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -14.450 2.758 -12.388 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -13.555 1.868 -13.604 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -15.707 2.688 -14.546 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -15.683 0.936 -14.523 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -17.744 2.131 -13.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -17.113 0.851 -12.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -16.810 2.457 -12.243 1.00 0.00 H new ATOM 2322 N VAL B 57 -11.416 -0.289 -8.712 1.00 0.00 N ATOM 2323 CA VAL B 57 -10.173 -0.598 -8.008 1.00 0.00 C ATOM 2324 C VAL B 57 -10.307 -1.968 -7.389 1.00 0.00 C ATOM 2325 O VAL B 57 -9.493 -2.865 -7.611 1.00 0.00 O ATOM 2326 CB VAL B 57 -9.899 0.446 -6.911 1.00 0.00 C ATOM 2327 CG1 VAL B 57 -8.654 0.054 -6.108 1.00 0.00 C ATOM 2328 CG2 VAL B 57 -9.677 1.822 -7.539 1.00 0.00 C ATOM 0 H VAL B 57 -11.934 0.503 -8.330 1.00 0.00 H new ATOM 0 HA VAL B 57 -9.340 -0.578 -8.710 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.762 0.484 -6.247 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -8.470 0.800 -5.335 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -8.812 -0.919 -5.643 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -7.793 0.002 -6.774 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -9.484 2.553 -6.754 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -8.822 1.780 -8.214 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -10.566 2.115 -8.097 1.00 0.00 H new ATOM 2338 N MET B 58 -11.437 -2.168 -6.758 1.00 0.00 N ATOM 2339 CA MET B 58 -11.794 -3.452 -6.228 1.00 0.00 C ATOM 2340 C MET B 58 -11.849 -4.455 -7.362 1.00 0.00 C ATOM 2341 O MET B 58 -11.467 -5.616 -7.205 1.00 0.00 O ATOM 2342 CB MET B 58 -13.148 -3.353 -5.514 1.00 0.00 C ATOM 2343 CG MET B 58 -13.580 -4.725 -5.032 1.00 0.00 C ATOM 2344 SD MET B 58 -15.120 -4.580 -4.090 1.00 0.00 S ATOM 2345 CE MET B 58 -16.226 -4.210 -5.478 1.00 0.00 C ATOM 0 H MET B 58 -12.134 -1.441 -6.599 1.00 0.00 H new ATOM 0 HA MET B 58 -11.050 -3.783 -5.503 1.00 0.00 H new ATOM 0 HB2 MET B 58 -13.074 -2.668 -4.669 1.00 0.00 H new ATOM 0 HB3 MET B 58 -13.897 -2.944 -6.192 1.00 0.00 H new ATOM 0 HG2 MET B 58 -13.723 -5.392 -5.882 1.00 0.00 H new ATOM 0 HG3 MET B 58 -12.801 -5.165 -4.409 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.557 -3.173 -5.413 1.00 0.00 H new ATOM 0 HE2 MET B 58 -15.695 -4.364 -6.417 1.00 0.00 H new ATOM 0 HE3 MET B 58 -17.092 -4.870 -5.439 1.00 0.00 H new ATOM 2355 N LYS B 59 -12.323 -3.995 -8.504 1.00 0.00 N ATOM 2356 CA LYS B 59 -12.432 -4.826 -9.683 1.00 0.00 C ATOM 2357 C LYS B 59 -11.054 -5.298 -10.116 1.00 0.00 C ATOM 2358 O LYS B 59 -10.859 -6.473 -10.424 1.00 0.00 O ATOM 2359 CB LYS B 59 -13.101 -4.056 -10.820 1.00 0.00 C ATOM 2360 CG LYS B 59 -13.710 -5.041 -11.806 1.00 0.00 C ATOM 2361 CD LYS B 59 -14.957 -5.702 -11.178 1.00 0.00 C ATOM 2362 CE LYS B 59 -15.953 -4.628 -10.687 1.00 0.00 C ATOM 2363 NZ LYS B 59 -15.715 -4.327 -9.244 1.00 0.00 N ATOM 0 H LYS B 59 -12.642 -3.036 -8.638 1.00 0.00 H new ATOM 0 HA LYS B 59 -13.046 -5.693 -9.441 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -13.873 -3.397 -10.423 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -12.371 -3.423 -11.325 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -13.984 -4.526 -12.727 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -12.978 -5.803 -12.073 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -15.441 -6.347 -11.911 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -14.658 -6.337 -10.344 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -15.841 -3.720 -11.279 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -16.976 -4.977 -10.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -16.626 -4.175 -8.766 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -15.220 -5.126 -8.800 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -15.133 -3.469 -9.160 1.00 0.00 H new ATOM 2377 N GLU B 60 -10.083 -4.403 -10.065 1.00 0.00 N ATOM 2378 CA GLU B 60 -8.719 -4.772 -10.403 1.00 0.00 C ATOM 2379 C GLU B 60 -8.267 -5.863 -9.452 1.00 0.00 C ATOM 2380 O GLU B 60 -7.733 -6.900 -9.869 1.00 0.00 O ATOM 2381 CB GLU B 60 -7.796 -3.569 -10.263 1.00 0.00 C ATOM 2382 CG GLU B 60 -8.102 -2.525 -11.343 1.00 0.00 C ATOM 2383 CD GLU B 60 -7.203 -1.310 -11.186 1.00 0.00 C ATOM 2384 OE1 GLU B 60 -6.287 -1.358 -10.392 1.00 0.00 O ATOM 2385 OE2 GLU B 60 -7.437 -0.341 -11.863 1.00 0.00 O ATOM 0 H GLU B 60 -10.210 -3.427 -9.796 1.00 0.00 H new ATOM 0 HA GLU B 60 -8.682 -5.123 -11.434 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -7.917 -3.124 -9.275 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -6.757 -3.890 -10.343 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -7.960 -2.964 -12.331 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -9.147 -2.221 -11.277 1.00 0.00 H new ATOM 2392 N LEU B 61 -8.627 -5.696 -8.194 1.00 0.00 N ATOM 2393 CA LEU B 61 -8.422 -6.740 -7.215 1.00 0.00 C ATOM 2394 C LEU B 61 -9.261 -7.948 -7.595 1.00 0.00 C ATOM 2395 O LEU B 61 -8.856 -9.092 -7.398 1.00 0.00 O ATOM 2396 CB LEU B 61 -8.761 -6.261 -5.800 1.00 0.00 C ATOM 2397 CG LEU B 61 -7.573 -5.499 -5.181 1.00 0.00 C ATOM 2398 CD1 LEU B 61 -6.506 -6.482 -4.693 1.00 0.00 C ATOM 2399 CD2 LEU B 61 -6.952 -4.531 -6.195 1.00 0.00 C ATOM 0 H LEU B 61 -9.062 -4.849 -7.829 1.00 0.00 H new ATOM 0 HA LEU B 61 -7.368 -7.016 -7.211 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -9.638 -5.614 -5.830 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -9.017 -7.115 -5.174 1.00 0.00 H new ATOM 0 HG LEU B 61 -7.950 -4.924 -4.335 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -5.673 -5.929 -4.258 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -6.936 -7.142 -3.939 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -6.147 -7.077 -5.533 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -6.116 -4.006 -5.732 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -6.596 -5.090 -7.060 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -7.702 -3.808 -6.514 1.00 0.00 H new ATOM 2411 N ASP B 62 -10.451 -7.696 -8.102 1.00 0.00 N ATOM 2412 CA ASP B 62 -11.343 -8.774 -8.484 1.00 0.00 C ATOM 2413 C ASP B 62 -10.705 -9.627 -9.582 1.00 0.00 C ATOM 2414 O ASP B 62 -10.789 -10.859 -9.545 1.00 0.00 O ATOM 2415 CB ASP B 62 -12.707 -8.244 -8.936 1.00 0.00 C ATOM 2416 CG ASP B 62 -13.706 -9.376 -8.966 1.00 0.00 C ATOM 2417 OD1 ASP B 62 -13.933 -9.962 -7.926 1.00 0.00 O ATOM 2418 OD2 ASP B 62 -14.240 -9.641 -10.020 1.00 0.00 O ATOM 0 H ASP B 62 -10.822 -6.759 -8.259 1.00 0.00 H new ATOM 0 HA ASP B 62 -11.509 -9.397 -7.605 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -13.048 -7.463 -8.257 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -12.624 -7.793 -9.925 1.00 0.00 H new ATOM 2423 N GLU B 63 -9.965 -8.983 -10.490 1.00 0.00 N ATOM 2424 CA GLU B 63 -9.235 -9.722 -11.538 1.00 0.00 C ATOM 2425 C GLU B 63 -8.423 -10.788 -10.850 1.00 0.00 C ATOM 2426 O GLU B 63 -8.336 -11.934 -11.284 1.00 0.00 O ATOM 2427 CB GLU B 63 -8.208 -8.817 -12.221 1.00 0.00 C ATOM 2428 CG GLU B 63 -8.862 -7.589 -12.852 1.00 0.00 C ATOM 2429 CD GLU B 63 -7.804 -6.714 -13.511 1.00 0.00 C ATOM 2430 OE1 GLU B 63 -6.709 -7.197 -13.743 1.00 0.00 O ATOM 2431 OE2 GLU B 63 -8.098 -5.576 -13.793 1.00 0.00 O ATOM 0 H GLU B 63 -9.853 -7.970 -10.526 1.00 0.00 H new ATOM 0 HA GLU B 63 -9.953 -10.108 -12.261 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -7.464 -8.498 -11.492 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -7.680 -9.382 -12.989 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -9.600 -7.900 -13.591 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -9.394 -7.019 -12.090 1.00 0.00 H new ATOM 2438 N ASN B 64 -7.800 -10.363 -9.781 1.00 0.00 N ATOM 2439 CA ASN B 64 -6.939 -11.189 -8.984 1.00 0.00 C ATOM 2440 C ASN B 64 -7.680 -12.397 -8.404 1.00 0.00 C ATOM 2441 O ASN B 64 -7.062 -13.298 -7.830 1.00 0.00 O ATOM 2442 CB ASN B 64 -6.266 -10.334 -7.899 1.00 0.00 C ATOM 2443 CG ASN B 64 -5.962 -11.162 -6.672 1.00 0.00 C ATOM 2444 OD1 ASN B 64 -6.891 -11.537 -5.928 1.00 0.00 O ATOM 2445 ND2 ASN B 64 -4.743 -11.454 -6.400 1.00 0.00 N ATOM 0 H ASN B 64 -7.882 -9.407 -9.434 1.00 0.00 H new ATOM 0 HA ASN B 64 -6.159 -11.603 -9.623 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -5.344 -9.903 -8.290 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -6.917 -9.503 -7.629 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -4.523 -11.999 -5.567 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -3.994 -11.141 -7.017 1.00 0.00 H new ATOM 2452 N GLY B 65 -8.988 -12.461 -8.628 1.00 0.00 N ATOM 2453 CA GLY B 65 -9.802 -13.600 -8.182 1.00 0.00 C ATOM 2454 C GLY B 65 -9.301 -14.923 -8.779 1.00 0.00 C ATOM 2455 O GLY B 65 -9.914 -15.984 -8.582 1.00 0.00 O ATOM 0 H GLY B 65 -9.515 -11.737 -9.117 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -9.779 -13.660 -7.094 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -10.841 -13.440 -8.471 1.00 0.00 H new ATOM 2459 N ASP B 66 -8.150 -14.867 -9.438 1.00 0.00 N ATOM 2460 CA ASP B 66 -7.504 -16.042 -10.000 1.00 0.00 C ATOM 2461 C ASP B 66 -7.257 -17.027 -8.882 1.00 0.00 C ATOM 2462 O ASP B 66 -7.418 -18.236 -9.042 1.00 0.00 O ATOM 2463 CB ASP B 66 -6.149 -15.633 -10.593 1.00 0.00 C ATOM 2464 CG ASP B 66 -5.614 -16.726 -11.483 1.00 0.00 C ATOM 2465 OD1 ASP B 66 -6.079 -16.832 -12.595 1.00 0.00 O ATOM 2466 OD2 ASP B 66 -4.727 -17.427 -11.057 1.00 0.00 O ATOM 0 H ASP B 66 -7.638 -14.000 -9.597 1.00 0.00 H new ATOM 0 HA ASP B 66 -8.133 -16.483 -10.773 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -6.258 -14.711 -11.164 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -5.440 -15.429 -9.790 1.00 0.00 H new ATOM 2471 N GLY B 67 -6.908 -16.491 -7.731 1.00 0.00 N ATOM 2472 CA GLY B 67 -6.692 -17.296 -6.546 1.00 0.00 C ATOM 2473 C GLY B 67 -6.808 -16.448 -5.302 1.00 0.00 C ATOM 2474 O GLY B 67 -7.897 -16.289 -4.740 1.00 0.00 O ATOM 0 H GLY B 67 -6.767 -15.491 -7.590 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -7.422 -18.105 -6.511 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -5.706 -17.758 -6.588 1.00 0.00 H new ATOM 2478 N GLU B 68 -5.693 -15.900 -4.881 1.00 0.00 N ATOM 2479 CA GLU B 68 -5.637 -15.082 -3.686 1.00 0.00 C ATOM 2480 C GLU B 68 -5.115 -13.699 -4.013 1.00 0.00 C ATOM 2481 O GLU B 68 -4.507 -13.488 -5.068 1.00 0.00 O ATOM 2482 CB GLU B 68 -4.707 -15.727 -2.639 1.00 0.00 C ATOM 2483 CG GLU B 68 -4.685 -17.261 -2.797 1.00 0.00 C ATOM 2484 CD GLU B 68 -3.643 -17.687 -3.827 1.00 0.00 C ATOM 2485 OE1 GLU B 68 -3.414 -16.951 -4.769 1.00 0.00 O ATOM 2486 OE2 GLU B 68 -3.077 -18.739 -3.655 1.00 0.00 O ATOM 0 H GLU B 68 -4.796 -16.007 -5.356 1.00 0.00 H new ATOM 0 HA GLU B 68 -6.647 -15.005 -3.284 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -3.698 -15.331 -2.750 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -5.044 -15.465 -1.636 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -4.464 -17.726 -1.836 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -5.670 -17.613 -3.103 1.00 0.00 H new ATOM 2493 N VAL B 69 -5.190 -12.830 -3.030 1.00 0.00 N ATOM 2494 CA VAL B 69 -4.596 -11.519 -3.077 1.00 0.00 C ATOM 2495 C VAL B 69 -3.577 -11.415 -1.942 1.00 0.00 C ATOM 2496 O VAL B 69 -3.854 -11.827 -0.812 1.00 0.00 O ATOM 2497 CB VAL B 69 -5.703 -10.427 -2.973 1.00 0.00 C ATOM 2498 CG1 VAL B 69 -6.766 -10.826 -1.946 1.00 0.00 C ATOM 2499 CG2 VAL B 69 -5.103 -9.064 -2.577 1.00 0.00 C ATOM 0 H VAL B 69 -5.678 -13.023 -2.156 1.00 0.00 H new ATOM 0 HA VAL B 69 -4.082 -11.359 -4.025 1.00 0.00 H new ATOM 0 HB VAL B 69 -6.166 -10.339 -3.956 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.528 -10.049 -1.891 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -7.228 -11.766 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -6.300 -10.947 -0.968 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -5.898 -8.321 -2.512 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -4.608 -9.151 -1.610 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -4.377 -8.754 -3.329 1.00 0.00 H new ATOM 2509 N ASP B 70 -2.359 -11.009 -2.267 1.00 0.00 N ATOM 2510 CA ASP B 70 -1.297 -10.977 -1.271 1.00 0.00 C ATOM 2511 C ASP B 70 -1.196 -9.608 -0.623 1.00 0.00 C ATOM 2512 O ASP B 70 -1.994 -8.721 -0.908 1.00 0.00 O ATOM 2513 CB ASP B 70 0.049 -11.419 -1.860 1.00 0.00 C ATOM 2514 CG ASP B 70 0.898 -10.217 -2.222 1.00 0.00 C ATOM 2515 OD1 ASP B 70 0.657 -9.638 -3.248 1.00 0.00 O ATOM 2516 OD2 ASP B 70 1.787 -9.895 -1.461 1.00 0.00 O ATOM 0 H ASP B 70 -2.083 -10.701 -3.199 1.00 0.00 H new ATOM 0 HA ASP B 70 -1.557 -11.695 -0.493 1.00 0.00 H new ATOM 0 HB2 ASP B 70 0.580 -12.041 -1.139 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -0.120 -12.031 -2.746 1.00 0.00 H new ATOM 2521 N PHE B 71 -0.218 -9.441 0.253 1.00 0.00 N ATOM 2522 CA PHE B 71 -0.049 -8.175 0.948 1.00 0.00 C ATOM 2523 C PHE B 71 0.201 -7.066 -0.056 1.00 0.00 C ATOM 2524 O PHE B 71 -0.427 -6.004 0.006 1.00 0.00 O ATOM 2525 CB PHE B 71 1.114 -8.236 1.942 1.00 0.00 C ATOM 2526 CG PHE B 71 1.114 -6.968 2.782 1.00 0.00 C ATOM 2527 CD1 PHE B 71 0.100 -6.776 3.726 1.00 0.00 C ATOM 2528 CD2 PHE B 71 2.117 -5.993 2.627 1.00 0.00 C ATOM 2529 CE1 PHE B 71 0.083 -5.625 4.509 1.00 0.00 C ATOM 2530 CE2 PHE B 71 2.091 -4.839 3.421 1.00 0.00 C ATOM 2531 CZ PHE B 71 1.076 -4.659 4.359 1.00 0.00 C ATOM 0 H PHE B 71 0.465 -10.158 0.498 1.00 0.00 H new ATOM 0 HA PHE B 71 -0.964 -7.972 1.504 1.00 0.00 H new ATOM 0 HB2 PHE B 71 1.016 -9.112 2.583 1.00 0.00 H new ATOM 0 HB3 PHE B 71 2.060 -8.335 1.409 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -0.671 -7.522 3.848 1.00 0.00 H new ATOM 0 HD2 PHE B 71 2.903 -6.134 1.900 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -0.703 -5.480 5.236 1.00 0.00 H new ATOM 0 HE2 PHE B 71 2.858 -4.088 3.306 1.00 0.00 H new ATOM 0 HZ PHE B 71 1.059 -3.769 4.971 1.00 0.00 H new ATOM 2541 N GLN B 72 1.079 -7.335 -1.014 1.00 0.00 N ATOM 2542 CA GLN B 72 1.378 -6.371 -2.057 1.00 0.00 C ATOM 2543 C GLN B 72 0.115 -6.040 -2.844 1.00 0.00 C ATOM 2544 O GLN B 72 -0.183 -4.873 -3.098 1.00 0.00 O ATOM 2545 CB GLN B 72 2.472 -6.915 -2.981 1.00 0.00 C ATOM 2546 CG GLN B 72 3.829 -6.876 -2.285 1.00 0.00 C ATOM 2547 CD GLN B 72 4.891 -7.506 -3.182 1.00 0.00 C ATOM 2548 OE1 GLN B 72 6.063 -7.565 -2.808 1.00 0.00 O ATOM 2549 NE2 GLN B 72 4.558 -7.973 -4.348 1.00 0.00 N ATOM 0 H GLN B 72 1.594 -8.212 -1.088 1.00 0.00 H new ATOM 0 HA GLN B 72 1.745 -5.453 -1.598 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.235 -7.939 -3.271 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.509 -6.325 -3.897 1.00 0.00 H new ATOM 0 HG2 GLN B 72 4.100 -5.846 -2.055 1.00 0.00 H new ATOM 0 HG3 GLN B 72 3.777 -7.412 -1.337 1.00 0.00 H new ATOM 0 HE21 GLN B 72 3.588 -7.925 -4.659 1.00 0.00 H new ATOM 0 HE22 GLN B 72 5.267 -8.388 -4.953 1.00 0.00 H new ATOM 2558 N GLU B 73 -0.670 -7.058 -3.141 1.00 0.00 N ATOM 2559 CA GLU B 73 -1.961 -6.855 -3.784 1.00 0.00 C ATOM 2560 C GLU B 73 -2.942 -6.153 -2.820 1.00 0.00 C ATOM 2561 O GLU B 73 -3.676 -5.243 -3.209 1.00 0.00 O ATOM 2562 CB GLU B 73 -2.516 -8.202 -4.256 1.00 0.00 C ATOM 2563 CG GLU B 73 -1.669 -8.727 -5.428 1.00 0.00 C ATOM 2564 CD GLU B 73 -2.102 -10.135 -5.795 1.00 0.00 C ATOM 2565 OE1 GLU B 73 -2.142 -10.966 -4.911 1.00 0.00 O ATOM 2566 OE2 GLU B 73 -2.395 -10.367 -6.949 1.00 0.00 O ATOM 0 H GLU B 73 -0.440 -8.033 -2.949 1.00 0.00 H new ATOM 0 HA GLU B 73 -1.833 -6.208 -4.652 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.504 -8.919 -3.435 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.555 -8.090 -4.566 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.778 -8.068 -6.290 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -0.614 -8.722 -5.155 1.00 0.00 H new ATOM 2573 N TYR B 74 -2.931 -6.572 -1.561 1.00 0.00 N ATOM 2574 CA TYR B 74 -3.786 -5.975 -0.526 1.00 0.00 C ATOM 2575 C TYR B 74 -3.487 -4.495 -0.300 1.00 0.00 C ATOM 2576 O TYR B 74 -4.409 -3.674 -0.235 1.00 0.00 O ATOM 2577 CB TYR B 74 -3.676 -6.779 0.787 1.00 0.00 C ATOM 2578 CG TYR B 74 -4.334 -6.053 1.957 1.00 0.00 C ATOM 2579 CD1 TYR B 74 -5.702 -5.725 1.936 1.00 0.00 C ATOM 2580 CD2 TYR B 74 -3.558 -5.719 3.078 1.00 0.00 C ATOM 2581 CE1 TYR B 74 -6.280 -5.062 3.032 1.00 0.00 C ATOM 2582 CE2 TYR B 74 -4.141 -5.060 4.172 1.00 0.00 C ATOM 2583 CZ TYR B 74 -5.498 -4.732 4.148 1.00 0.00 C ATOM 2584 OH TYR B 74 -6.062 -4.080 5.219 1.00 0.00 O ATOM 0 H TYR B 74 -2.336 -7.329 -1.224 1.00 0.00 H new ATOM 0 HA TYR B 74 -4.815 -6.026 -0.883 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -4.145 -7.754 0.656 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -2.625 -6.958 1.016 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -6.307 -5.982 1.079 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -2.508 -5.970 3.099 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -7.329 -4.806 3.015 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -3.540 -4.807 5.033 1.00 0.00 H new ATOM 0 HH TYR B 74 -6.789 -3.502 4.905 1.00 0.00 H new ATOM 2594 N VAL B 75 -2.215 -4.148 -0.153 1.00 0.00 N ATOM 2595 CA VAL B 75 -1.867 -2.760 0.124 1.00 0.00 C ATOM 2596 C VAL B 75 -2.259 -1.833 -1.021 1.00 0.00 C ATOM 2597 O VAL B 75 -2.747 -0.718 -0.793 1.00 0.00 O ATOM 2598 CB VAL B 75 -0.383 -2.587 0.490 1.00 0.00 C ATOM 2599 CG1 VAL B 75 -0.112 -3.217 1.858 1.00 0.00 C ATOM 2600 CG2 VAL B 75 0.509 -3.251 -0.559 1.00 0.00 C ATOM 0 H VAL B 75 -1.425 -4.790 -0.219 1.00 0.00 H new ATOM 0 HA VAL B 75 -2.450 -2.472 0.999 1.00 0.00 H new ATOM 0 HB VAL B 75 -0.156 -1.521 0.524 1.00 0.00 H new ATOM 0 HG11 VAL B 75 0.940 -3.093 2.114 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.729 -2.729 2.612 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.354 -4.279 1.824 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.555 -3.118 -0.283 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.279 -4.315 -0.611 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.329 -2.793 -1.532 1.00 0.00 H new ATOM 2610 N VAL B 76 -2.058 -2.280 -2.254 1.00 0.00 N ATOM 2611 CA VAL B 76 -2.387 -1.449 -3.395 1.00 0.00 C ATOM 2612 C VAL B 76 -3.885 -1.170 -3.453 1.00 0.00 C ATOM 2613 O VAL B 76 -4.300 -0.057 -3.776 1.00 0.00 O ATOM 2614 CB VAL B 76 -1.850 -2.046 -4.717 1.00 0.00 C ATOM 2615 CG1 VAL B 76 -2.483 -3.408 -4.999 1.00 0.00 C ATOM 2616 CG2 VAL B 76 -2.139 -1.092 -5.886 1.00 0.00 C ATOM 0 H VAL B 76 -1.675 -3.197 -2.483 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.883 -0.491 -3.265 1.00 0.00 H new ATOM 0 HB VAL B 76 -0.773 -2.177 -4.614 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -2.089 -3.806 -5.934 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -2.248 -4.094 -4.185 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.564 -3.297 -5.079 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -1.756 -1.523 -6.811 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -3.215 -0.940 -5.974 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -1.651 -0.134 -5.703 1.00 0.00 H new ATOM 2626 N LEU B 77 -4.690 -2.152 -3.059 1.00 0.00 N ATOM 2627 CA LEU B 77 -6.138 -1.969 -3.040 1.00 0.00 C ATOM 2628 C LEU B 77 -6.515 -0.850 -2.095 1.00 0.00 C ATOM 2629 O LEU B 77 -7.213 0.086 -2.478 1.00 0.00 O ATOM 2630 CB LEU B 77 -6.818 -3.272 -2.579 1.00 0.00 C ATOM 2631 CG LEU B 77 -8.343 -3.072 -2.435 1.00 0.00 C ATOM 2632 CD1 LEU B 77 -8.960 -2.606 -3.754 1.00 0.00 C ATOM 2633 CD2 LEU B 77 -8.997 -4.389 -1.999 1.00 0.00 C ATOM 0 H LEU B 77 -4.371 -3.071 -2.752 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.471 -1.714 -4.046 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.617 -4.067 -3.297 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.396 -3.590 -1.625 1.00 0.00 H new ATOM 0 HG LEU B 77 -8.519 -2.305 -1.681 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.034 -2.473 -3.626 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -8.510 -1.659 -4.052 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.777 -3.354 -4.526 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.073 -4.245 -1.898 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -8.802 -5.157 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.581 -4.702 -1.041 1.00 0.00 H new ATOM 2645 N VAL B 78 -5.983 -0.893 -0.889 1.00 0.00 N ATOM 2646 CA VAL B 78 -6.239 0.171 0.056 1.00 0.00 C ATOM 2647 C VAL B 78 -5.546 1.455 -0.385 1.00 0.00 C ATOM 2648 O VAL B 78 -6.132 2.540 -0.333 1.00 0.00 O ATOM 2649 CB VAL B 78 -5.847 -0.237 1.492 1.00 0.00 C ATOM 2650 CG1 VAL B 78 -6.589 -1.523 1.877 1.00 0.00 C ATOM 2651 CG2 VAL B 78 -4.345 -0.494 1.582 1.00 0.00 C ATOM 0 H VAL B 78 -5.381 -1.641 -0.546 1.00 0.00 H new ATOM 0 HA VAL B 78 -7.312 0.362 0.071 1.00 0.00 H new ATOM 0 HB VAL B 78 -6.116 0.574 2.169 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.313 -1.813 2.891 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.664 -1.351 1.828 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.318 -2.321 1.185 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.085 -0.781 2.601 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.072 -1.298 0.898 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.804 0.413 1.311 1.00 0.00 H new ATOM 2661 N ALA B 79 -4.305 1.328 -0.848 1.00 0.00 N ATOM 2662 CA ALA B 79 -3.542 2.486 -1.290 1.00 0.00 C ATOM 2663 C ALA B 79 -4.177 3.143 -2.490 1.00 0.00 C ATOM 2664 O ALA B 79 -4.276 4.368 -2.548 1.00 0.00 O ATOM 2665 CB ALA B 79 -2.103 2.103 -1.610 1.00 0.00 C ATOM 0 H ALA B 79 -3.811 0.439 -0.926 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.541 3.202 -0.468 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.556 2.987 -1.938 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.629 1.692 -0.719 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.093 1.355 -2.403 1.00 0.00 H new ATOM 2671 N ALA B 80 -4.603 2.339 -3.453 1.00 0.00 N ATOM 2672 CA ALA B 80 -5.221 2.880 -4.644 1.00 0.00 C ATOM 2673 C ALA B 80 -6.482 3.629 -4.259 1.00 0.00 C ATOM 2674 O ALA B 80 -6.693 4.771 -4.662 1.00 0.00 O ATOM 2675 CB ALA B 80 -5.548 1.768 -5.638 1.00 0.00 C ATOM 0 H ALA B 80 -4.531 1.322 -3.430 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.523 3.566 -5.125 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.012 2.198 -6.526 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -4.631 1.252 -5.922 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.235 1.059 -5.177 1.00 0.00 H new ATOM 2681 N LEU B 81 -7.255 3.033 -3.363 1.00 0.00 N ATOM 2682 CA LEU B 81 -8.425 3.707 -2.822 1.00 0.00 C ATOM 2683 C LEU B 81 -7.987 4.947 -2.055 1.00 0.00 C ATOM 2684 O LEU B 81 -8.559 6.032 -2.209 1.00 0.00 O ATOM 2685 CB LEU B 81 -9.222 2.767 -1.904 1.00 0.00 C ATOM 2686 CG LEU B 81 -9.862 1.639 -2.733 1.00 0.00 C ATOM 2687 CD1 LEU B 81 -10.512 0.615 -1.799 1.00 0.00 C ATOM 2688 CD2 LEU B 81 -10.928 2.216 -3.668 1.00 0.00 C ATOM 0 H LEU B 81 -7.096 2.094 -2.999 1.00 0.00 H new ATOM 0 HA LEU B 81 -9.074 4.002 -3.647 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.565 2.343 -1.145 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -9.996 3.328 -1.379 1.00 0.00 H new ATOM 0 HG LEU B 81 -9.086 1.154 -3.325 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -10.964 -0.182 -2.390 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -9.754 0.192 -1.139 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -11.281 1.104 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -11.375 1.411 -4.251 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.700 2.710 -3.078 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -10.468 2.939 -4.342 1.00 0.00 H new ATOM 2700 N THR B 82 -6.910 4.805 -1.294 1.00 0.00 N ATOM 2701 CA THR B 82 -6.367 5.934 -0.571 1.00 0.00 C ATOM 2702 C THR B 82 -5.940 7.017 -1.551 1.00 0.00 C ATOM 2703 O THR B 82 -6.277 8.186 -1.379 1.00 0.00 O ATOM 2704 CB THR B 82 -5.159 5.505 0.283 1.00 0.00 C ATOM 2705 OG1 THR B 82 -5.484 4.355 1.053 1.00 0.00 O ATOM 2706 CG2 THR B 82 -4.752 6.646 1.218 1.00 0.00 C ATOM 0 H THR B 82 -6.404 3.929 -1.166 1.00 0.00 H new ATOM 0 HA THR B 82 -7.141 6.324 0.090 1.00 0.00 H new ATOM 0 HB THR B 82 -4.329 5.266 -0.382 1.00 0.00 H new ATOM 0 HG1 THR B 82 -5.593 3.583 0.459 1.00 0.00 H new ATOM 0 HG21 THR B 82 -3.897 6.336 1.819 1.00 0.00 H new ATOM 0 HG22 THR B 82 -4.482 7.522 0.628 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.586 6.894 1.874 1.00 0.00 H new ATOM 2714 N VAL B 83 -5.215 6.632 -2.588 1.00 0.00 N ATOM 2715 CA VAL B 83 -4.756 7.601 -3.556 1.00 0.00 C ATOM 2716 C VAL B 83 -5.937 8.264 -4.244 1.00 0.00 C ATOM 2717 O VAL B 83 -5.981 9.494 -4.384 1.00 0.00 O ATOM 2718 CB VAL B 83 -3.750 6.976 -4.561 1.00 0.00 C ATOM 2719 CG1 VAL B 83 -4.432 6.466 -5.827 1.00 0.00 C ATOM 2720 CG2 VAL B 83 -2.684 8.003 -4.933 1.00 0.00 C ATOM 0 H VAL B 83 -4.937 5.669 -2.776 1.00 0.00 H new ATOM 0 HA VAL B 83 -4.207 8.382 -3.029 1.00 0.00 H new ATOM 0 HB VAL B 83 -3.292 6.119 -4.068 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -3.685 6.039 -6.496 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -5.163 5.701 -5.564 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -4.936 7.293 -6.327 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -1.981 7.559 -5.638 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -3.159 8.870 -5.392 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.150 8.314 -4.035 1.00 0.00 H new ATOM 2730 N ALA B 84 -6.934 7.459 -4.603 1.00 0.00 N ATOM 2731 CA ALA B 84 -8.138 7.995 -5.229 1.00 0.00 C ATOM 2732 C ALA B 84 -8.774 9.045 -4.332 1.00 0.00 C ATOM 2733 O ALA B 84 -8.934 10.202 -4.735 1.00 0.00 O ATOM 2734 CB ALA B 84 -9.145 6.874 -5.514 1.00 0.00 C ATOM 0 H ALA B 84 -6.933 6.447 -4.473 1.00 0.00 H new ATOM 0 HA ALA B 84 -7.855 8.458 -6.174 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -10.036 7.295 -5.981 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -8.695 6.143 -6.185 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -9.421 6.387 -4.579 1.00 0.00 H new ATOM 2740 N MET B 85 -9.033 8.683 -3.079 1.00 0.00 N ATOM 2741 CA MET B 85 -9.532 9.662 -2.123 1.00 0.00 C ATOM 2742 C MET B 85 -8.510 10.742 -1.847 1.00 0.00 C ATOM 2743 O MET B 85 -8.856 11.918 -1.755 1.00 0.00 O ATOM 2744 CB MET B 85 -10.026 9.030 -0.825 1.00 0.00 C ATOM 2745 CG MET B 85 -11.430 8.452 -1.045 1.00 0.00 C ATOM 2746 SD MET B 85 -12.025 7.702 0.492 1.00 0.00 S ATOM 2747 CE MET B 85 -12.002 9.201 1.513 1.00 0.00 C ATOM 0 H MET B 85 -8.909 7.741 -2.709 1.00 0.00 H new ATOM 0 HA MET B 85 -10.399 10.126 -2.593 1.00 0.00 H new ATOM 0 HB2 MET B 85 -9.342 8.243 -0.507 1.00 0.00 H new ATOM 0 HB3 MET B 85 -10.047 9.775 -0.029 1.00 0.00 H new ATOM 0 HG2 MET B 85 -12.112 9.239 -1.365 1.00 0.00 H new ATOM 0 HG3 MET B 85 -11.407 7.707 -1.840 1.00 0.00 H new ATOM 0 HE1 MET B 85 -12.664 9.069 2.369 1.00 0.00 H new ATOM 0 HE2 MET B 85 -10.987 9.386 1.865 1.00 0.00 H new ATOM 0 HE3 MET B 85 -12.341 10.050 0.920 1.00 0.00 H new ATOM 2757 N ASN B 86 -7.251 10.352 -1.748 1.00 0.00 N ATOM 2758 CA ASN B 86 -6.203 11.315 -1.483 1.00 0.00 C ATOM 2759 C ASN B 86 -6.178 12.355 -2.565 1.00 0.00 C ATOM 2760 O ASN B 86 -6.168 13.538 -2.275 1.00 0.00 O ATOM 2761 CB ASN B 86 -4.846 10.628 -1.421 1.00 0.00 C ATOM 2762 CG ASN B 86 -3.740 11.666 -1.250 1.00 0.00 C ATOM 2763 OD1 ASN B 86 -3.893 12.639 -0.510 1.00 0.00 O ATOM 2764 ND2 ASN B 86 -2.629 11.527 -1.896 1.00 0.00 N ATOM 0 H ASN B 86 -6.935 9.387 -1.846 1.00 0.00 H new ATOM 0 HA ASN B 86 -6.408 11.787 -0.522 1.00 0.00 H new ATOM 0 HB2 ASN B 86 -4.825 9.922 -0.591 1.00 0.00 H new ATOM 0 HB3 ASN B 86 -4.679 10.053 -2.332 1.00 0.00 H new ATOM 0 HD21 ASN B 86 -1.888 12.220 -1.791 1.00 0.00 H new ATOM 0 HD22 ASN B 86 -2.494 10.725 -2.511 1.00 0.00 H new ATOM 2771 N ASN B 87 -6.275 11.920 -3.812 1.00 0.00 N ATOM 2772 CA ASN B 87 -6.372 12.860 -4.918 1.00 0.00 C ATOM 2773 C ASN B 87 -7.664 13.640 -4.810 1.00 0.00 C ATOM 2774 O ASN B 87 -7.683 14.863 -4.951 1.00 0.00 O ATOM 2775 CB ASN B 87 -6.317 12.136 -6.267 1.00 0.00 C ATOM 2776 CG ASN B 87 -6.448 13.153 -7.402 1.00 0.00 C ATOM 2777 OD1 ASN B 87 -5.893 14.250 -7.326 1.00 0.00 O ATOM 2778 ND2 ASN B 87 -7.152 12.861 -8.448 1.00 0.00 N ATOM 0 H ASN B 87 -6.289 10.936 -4.081 1.00 0.00 H new ATOM 0 HA ASN B 87 -5.523 13.542 -4.863 1.00 0.00 H new ATOM 0 HB2 ASN B 87 -5.378 11.591 -6.360 1.00 0.00 H new ATOM 0 HB3 ASN B 87 -7.120 11.401 -6.329 1.00 0.00 H new ATOM 0 HD21 ASN B 87 -7.245 13.538 -9.205 1.00 0.00 H new ATOM 0 HD22 ASN B 87 -7.613 11.954 -8.515 1.00 0.00 H new ATOM 2785 N PHE B 88 -8.731 12.935 -4.469 1.00 0.00 N ATOM 2786 CA PHE B 88 -10.022 13.572 -4.293 1.00 0.00 C ATOM 2787 C PHE B 88 -9.960 14.617 -3.200 1.00 0.00 C ATOM 2788 O PHE B 88 -10.508 15.697 -3.347 1.00 0.00 O ATOM 2789 CB PHE B 88 -11.132 12.559 -4.005 1.00 0.00 C ATOM 2790 CG PHE B 88 -12.443 13.304 -3.851 1.00 0.00 C ATOM 2791 CD1 PHE B 88 -13.018 13.948 -4.954 1.00 0.00 C ATOM 2792 CD2 PHE B 88 -13.080 13.355 -2.604 1.00 0.00 C ATOM 2793 CE1 PHE B 88 -14.222 14.644 -4.811 1.00 0.00 C ATOM 2794 CE2 PHE B 88 -14.285 14.052 -2.466 1.00 0.00 C ATOM 2795 CZ PHE B 88 -14.855 14.694 -3.567 1.00 0.00 C ATOM 0 H PHE B 88 -8.727 11.928 -4.310 1.00 0.00 H new ATOM 0 HA PHE B 88 -10.268 14.062 -5.235 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.202 11.835 -4.817 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -10.907 12.000 -3.097 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.530 13.907 -5.917 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -12.642 12.857 -1.752 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -14.662 15.143 -5.662 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -14.776 14.094 -1.505 1.00 0.00 H new ATOM 0 HZ PHE B 88 -15.786 15.230 -3.457 1.00 0.00 H new ATOM 2805 N PHE B 89 -9.319 14.287 -2.090 1.00 0.00 N ATOM 2806 CA PHE B 89 -9.227 15.221 -0.970 1.00 0.00 C ATOM 2807 C PHE B 89 -8.934 16.635 -1.473 1.00 0.00 C ATOM 2808 O PHE B 89 -9.597 17.597 -1.068 1.00 0.00 O ATOM 2809 CB PHE B 89 -8.131 14.776 0.020 1.00 0.00 C ATOM 2810 CG PHE B 89 -8.764 14.213 1.280 1.00 0.00 C ATOM 2811 CD1 PHE B 89 -9.365 12.950 1.267 1.00 0.00 C ATOM 2812 CD2 PHE B 89 -8.743 14.958 2.463 1.00 0.00 C ATOM 2813 CE1 PHE B 89 -9.945 12.436 2.432 1.00 0.00 C ATOM 2814 CE2 PHE B 89 -9.323 14.446 3.629 1.00 0.00 C ATOM 2815 CZ PHE B 89 -9.922 13.183 3.614 1.00 0.00 C ATOM 0 H PHE B 89 -8.858 13.390 -1.937 1.00 0.00 H new ATOM 0 HA PHE B 89 -10.186 15.224 -0.452 1.00 0.00 H new ATOM 0 HB2 PHE B 89 -7.495 14.023 -0.444 1.00 0.00 H new ATOM 0 HB3 PHE B 89 -7.492 15.622 0.272 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -9.381 12.370 0.356 1.00 0.00 H new ATOM 0 HD2 PHE B 89 -8.277 15.932 2.477 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -10.411 11.462 2.418 1.00 0.00 H new ATOM 0 HE2 PHE B 89 -9.308 15.026 4.540 1.00 0.00 H new ATOM 0 HZ PHE B 89 -10.366 12.785 4.514 1.00 0.00 H new