USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1022 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 87 ASN : amide:sc= -2.56! X(o=-4.4!,f=-4) USER MOD Set 1.2: A 111 GLN : amide:sc= -1.87! C(o=-4.4!,f=-9.5!) USER MOD Set 2.1: A 45 THR OG1 : rot 152:sc= -0.75 USER MOD Set 2.2: A 60 GLN : amide:sc= -0.0633 X(o=-0.81,f=-0.88) USER MOD Set 2.3: A 78 THR OG1 : rot -160:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 179:sc= 0 (180deg=-0.00243) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 153:sc= -2.35 (180deg=-4.36!) USER MOD Single : A 16 ASN : amide:sc= -0.349 X(o=-0.35,f=-0.0043) USER MOD Single : A 21 LYS NZ :NH3+ 168:sc= 1.38 (180deg=0.96) USER MOD Single : A 22 ASN : amide:sc= -1.71 K(o=-1.7,f=-6.5!) USER MOD Single : A 24 SER OG : rot -1:sc= 0.801! USER MOD Single : A 25 TYR OH : rot -30:sc= -0.088 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 HIS : no HE2:sc= -2.08 X(o=-2.1,f=-1.7) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 86:sc= 0.497 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 64:sc= 1.2 USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= -0.387 X(o=-0.39,f=0) USER MOD Single : A 73 CYS SG : rot 140:sc= -3.87! USER MOD Single : A 76 HIS : no HD1:sc= 0.0969 K(o=0.097,f=-2.1!) USER MOD Single : A 77 THR OG1 : rot -150:sc= 0.847 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -162:sc= -0.19 (180deg=-0.529) USER MOD Single : A 93 GLN : amide:sc= -8.61! C(o=-8.6!,f=-11!) USER MOD Single : A 94 CYS SG : rot 63:sc= -3.54 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.377 USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 106:sc= -3.56 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= -0.101 (180deg=-0.101) USER MOD Single : A 112 SER OG : rot 69:sc= 1.09 USER MOD Single : A 113 GLN : amide:sc= -0.0627 X(o=-0.063,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.728 -1.462 -6.080 1.00 0.00 N ATOM 2 CA GLY A 1 -25.650 -0.868 -6.848 1.00 0.00 C ATOM 3 C GLY A 1 -25.820 0.627 -7.027 1.00 0.00 C ATOM 4 O GLY A 1 -25.655 1.150 -8.129 1.00 0.00 O ATOM 0 H1 GLY A 1 -26.574 -2.487 -6.001 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.750 -1.041 -5.129 1.00 0.00 H new ATOM 0 H3 GLY A 1 -27.634 -1.284 -6.559 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.701 -1.065 -6.349 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -25.600 -1.345 -7.827 1.00 0.00 H new ATOM 8 N SER A 2 -26.154 1.317 -5.941 1.00 0.00 N ATOM 9 CA SER A 2 -26.353 2.761 -5.984 1.00 0.00 C ATOM 10 C SER A 2 -25.386 3.471 -5.042 1.00 0.00 C ATOM 11 O SER A 2 -24.622 2.831 -4.320 1.00 0.00 O ATOM 12 CB SER A 2 -27.795 3.110 -5.611 1.00 0.00 C ATOM 13 OG SER A 2 -28.173 4.364 -6.151 1.00 0.00 O ATOM 0 H SER A 2 -26.292 0.899 -5.021 1.00 0.00 H new ATOM 0 HA SER A 2 -26.156 3.100 -7.001 1.00 0.00 H new ATOM 0 HB2 SER A 2 -28.467 2.335 -5.979 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.898 3.132 -4.526 1.00 0.00 H new ATOM 0 HG SER A 2 -29.099 4.563 -5.900 1.00 0.00 H new ATOM 19 N SER A 3 -25.425 4.800 -5.056 1.00 0.00 N ATOM 20 CA SER A 3 -24.550 5.599 -4.206 1.00 0.00 C ATOM 21 C SER A 3 -24.594 5.105 -2.763 1.00 0.00 C ATOM 22 O SER A 3 -25.575 5.318 -2.052 1.00 0.00 O ATOM 23 CB SER A 3 -24.954 7.073 -4.265 1.00 0.00 C ATOM 24 OG SER A 3 -24.592 7.652 -5.507 1.00 0.00 O ATOM 0 H SER A 3 -26.053 5.346 -5.646 1.00 0.00 H new ATOM 0 HA SER A 3 -23.530 5.494 -4.576 1.00 0.00 H new ATOM 0 HB2 SER A 3 -26.030 7.165 -4.117 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.473 7.618 -3.452 1.00 0.00 H new ATOM 0 HG SER A 3 -24.863 8.594 -5.520 1.00 0.00 H new ATOM 30 N GLY A 4 -23.522 4.443 -2.337 1.00 0.00 N ATOM 31 CA GLY A 4 -23.458 3.928 -0.982 1.00 0.00 C ATOM 32 C GLY A 4 -22.445 4.665 -0.129 1.00 0.00 C ATOM 33 O GLY A 4 -22.749 5.712 0.442 1.00 0.00 O ATOM 0 H GLY A 4 -22.697 4.254 -2.906 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -24.442 4.006 -0.520 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.202 2.869 -1.011 1.00 0.00 H new ATOM 37 N SER A 5 -21.237 4.116 -0.041 1.00 0.00 N ATOM 38 CA SER A 5 -20.177 4.726 0.753 1.00 0.00 C ATOM 39 C SER A 5 -19.109 5.340 -0.147 1.00 0.00 C ATOM 40 O SER A 5 -18.817 6.532 -0.059 1.00 0.00 O ATOM 41 CB SER A 5 -19.544 3.687 1.680 1.00 0.00 C ATOM 42 OG SER A 5 -18.528 4.268 2.479 1.00 0.00 O ATOM 0 H SER A 5 -20.969 3.251 -0.510 1.00 0.00 H new ATOM 0 HA SER A 5 -20.619 5.519 1.356 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.311 3.252 2.321 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.125 2.874 1.087 1.00 0.00 H new ATOM 0 HG SER A 5 -18.140 3.584 3.064 1.00 0.00 H new ATOM 48 N SER A 6 -18.528 4.515 -1.013 1.00 0.00 N ATOM 49 CA SER A 6 -17.489 4.974 -1.927 1.00 0.00 C ATOM 50 C SER A 6 -18.036 5.117 -3.344 1.00 0.00 C ATOM 51 O SER A 6 -18.164 6.225 -3.863 1.00 0.00 O ATOM 52 CB SER A 6 -16.308 4.001 -1.920 1.00 0.00 C ATOM 53 OG SER A 6 -15.364 4.353 -0.924 1.00 0.00 O ATOM 0 H SER A 6 -18.759 3.525 -1.100 1.00 0.00 H new ATOM 0 HA SER A 6 -17.147 5.952 -1.588 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.668 2.988 -1.742 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.827 4.001 -2.898 1.00 0.00 H new ATOM 0 HG SER A 6 -14.620 3.715 -0.939 1.00 0.00 H new ATOM 59 N GLY A 7 -18.359 3.986 -3.964 1.00 0.00 N ATOM 60 CA GLY A 7 -18.889 4.006 -5.315 1.00 0.00 C ATOM 61 C GLY A 7 -18.599 2.724 -6.071 1.00 0.00 C ATOM 62 O GLY A 7 -19.424 1.811 -6.099 1.00 0.00 O ATOM 0 H GLY A 7 -18.263 3.057 -3.555 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -19.967 4.166 -5.277 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.461 4.849 -5.858 1.00 0.00 H new ATOM 66 N VAL A 8 -17.423 2.656 -6.687 1.00 0.00 N ATOM 67 CA VAL A 8 -17.026 1.477 -7.447 1.00 0.00 C ATOM 68 C VAL A 8 -16.931 0.249 -6.548 1.00 0.00 C ATOM 69 O VAL A 8 -17.017 0.355 -5.325 1.00 0.00 O ATOM 70 CB VAL A 8 -15.672 1.692 -8.150 1.00 0.00 C ATOM 71 CG1 VAL A 8 -14.525 1.475 -7.175 1.00 0.00 C ATOM 72 CG2 VAL A 8 -15.544 0.768 -9.352 1.00 0.00 C ATOM 0 H VAL A 8 -16.729 3.403 -6.675 1.00 0.00 H new ATOM 0 HA VAL A 8 -17.796 1.312 -8.201 1.00 0.00 H new ATOM 0 HB VAL A 8 -15.625 2.721 -8.506 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.576 1.631 -7.689 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -14.611 2.181 -6.349 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.565 0.457 -6.787 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.582 0.933 -9.837 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.611 -0.269 -9.023 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -16.347 0.977 -10.059 1.00 0.00 H new ATOM 82 N ASP A 9 -16.752 -0.915 -7.163 1.00 0.00 N ATOM 83 CA ASP A 9 -16.643 -2.164 -6.418 1.00 0.00 C ATOM 84 C ASP A 9 -15.442 -2.133 -5.478 1.00 0.00 C ATOM 85 O ASP A 9 -14.295 -2.172 -5.921 1.00 0.00 O ATOM 86 CB ASP A 9 -16.524 -3.347 -7.379 1.00 0.00 C ATOM 87 CG ASP A 9 -17.876 -3.866 -7.829 1.00 0.00 C ATOM 88 OD1 ASP A 9 -18.572 -3.142 -8.572 1.00 0.00 O ATOM 89 OD2 ASP A 9 -18.237 -4.996 -7.439 1.00 0.00 O ATOM 0 H ASP A 9 -16.679 -1.020 -8.175 1.00 0.00 H new ATOM 0 HA ASP A 9 -17.547 -2.282 -5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.945 -3.045 -8.252 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.972 -4.152 -6.893 1.00 0.00 H new ATOM 94 N GLU A 10 -15.715 -2.062 -4.179 1.00 0.00 N ATOM 95 CA GLU A 10 -14.655 -2.024 -3.178 1.00 0.00 C ATOM 96 C GLU A 10 -13.873 -3.334 -3.163 1.00 0.00 C ATOM 97 O GLU A 10 -14.359 -4.381 -3.592 1.00 0.00 O ATOM 98 CB GLU A 10 -15.243 -1.752 -1.791 1.00 0.00 C ATOM 99 CG GLU A 10 -15.508 -0.280 -1.520 1.00 0.00 C ATOM 100 CD GLU A 10 -16.344 -0.058 -0.275 1.00 0.00 C ATOM 101 OE1 GLU A 10 -17.548 -0.388 -0.303 1.00 0.00 O ATOM 102 OE2 GLU A 10 -15.795 0.446 0.727 1.00 0.00 O ATOM 0 H GLU A 10 -16.660 -2.030 -3.795 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.971 -1.216 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -16.176 -2.306 -1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.558 -2.135 -1.034 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.558 0.243 -1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -16.018 0.158 -2.378 1.00 0.00 H new ATOM 109 N PRO A 11 -12.632 -3.276 -2.657 1.00 0.00 N ATOM 110 CA PRO A 11 -11.756 -4.449 -2.574 1.00 0.00 C ATOM 111 C PRO A 11 -12.237 -5.459 -1.538 1.00 0.00 C ATOM 112 O PRO A 11 -11.553 -6.441 -1.253 1.00 0.00 O ATOM 113 CB PRO A 11 -10.408 -3.855 -2.157 1.00 0.00 C ATOM 114 CG PRO A 11 -10.754 -2.589 -1.451 1.00 0.00 C ATOM 115 CD PRO A 11 -11.989 -2.062 -2.128 1.00 0.00 C ATOM 0 HA PRO A 11 -11.722 -5.001 -3.514 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -9.860 -4.535 -1.505 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -9.774 -3.665 -3.023 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -10.937 -2.770 -0.392 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -9.937 -1.870 -1.515 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -12.638 -1.536 -1.428 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -11.742 -1.359 -2.923 1.00 0.00 H new ATOM 123 N GLU A 12 -13.417 -5.210 -0.979 1.00 0.00 N ATOM 124 CA GLU A 12 -13.988 -6.100 0.026 1.00 0.00 C ATOM 125 C GLU A 12 -13.636 -7.554 -0.272 1.00 0.00 C ATOM 126 O GLU A 12 -13.078 -8.255 0.572 1.00 0.00 O ATOM 127 CB GLU A 12 -15.507 -5.932 0.084 1.00 0.00 C ATOM 128 CG GLU A 12 -16.169 -5.901 -1.284 1.00 0.00 C ATOM 129 CD GLU A 12 -17.430 -5.059 -1.303 1.00 0.00 C ATOM 130 OE1 GLU A 12 -17.455 -4.014 -0.621 1.00 0.00 O ATOM 131 OE2 GLU A 12 -18.391 -5.446 -2.000 1.00 0.00 O ATOM 0 H GLU A 12 -13.996 -4.401 -1.204 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.564 -5.833 0.994 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.933 -6.750 0.666 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.742 -5.008 0.613 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.463 -5.508 -2.016 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.412 -6.919 -1.589 1.00 0.00 H new ATOM 138 N SER A 13 -13.968 -8.002 -1.479 1.00 0.00 N ATOM 139 CA SER A 13 -13.693 -9.374 -1.888 1.00 0.00 C ATOM 140 C SER A 13 -12.208 -9.695 -1.746 1.00 0.00 C ATOM 141 O SER A 13 -11.836 -10.781 -1.302 1.00 0.00 O ATOM 142 CB SER A 13 -14.138 -9.596 -3.334 1.00 0.00 C ATOM 143 OG SER A 13 -14.354 -10.972 -3.596 1.00 0.00 O ATOM 0 H SER A 13 -14.428 -7.434 -2.191 1.00 0.00 H new ATOM 0 HA SER A 13 -14.256 -10.042 -1.236 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.055 -9.038 -3.525 1.00 0.00 H new ATOM 0 HB3 SER A 13 -13.380 -9.208 -4.015 1.00 0.00 H new ATOM 0 HG SER A 13 -14.639 -11.087 -4.526 1.00 0.00 H new ATOM 149 N MET A 14 -11.364 -8.742 -2.127 1.00 0.00 N ATOM 150 CA MET A 14 -9.919 -8.922 -2.041 1.00 0.00 C ATOM 151 C MET A 14 -9.448 -8.859 -0.592 1.00 0.00 C ATOM 152 O MET A 14 -10.080 -8.219 0.250 1.00 0.00 O ATOM 153 CB MET A 14 -9.201 -7.855 -2.870 1.00 0.00 C ATOM 154 CG MET A 14 -9.374 -8.032 -4.369 1.00 0.00 C ATOM 155 SD MET A 14 -9.392 -6.462 -5.256 1.00 0.00 S ATOM 156 CE MET A 14 -8.020 -5.616 -4.474 1.00 0.00 C ATOM 0 H MET A 14 -11.655 -7.838 -2.498 1.00 0.00 H new ATOM 0 HA MET A 14 -9.676 -9.907 -2.440 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.574 -6.872 -2.583 1.00 0.00 H new ATOM 0 HB3 MET A 14 -8.138 -7.875 -2.630 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.565 -8.653 -4.753 1.00 0.00 H new ATOM 0 HG3 MET A 14 -10.305 -8.565 -4.563 1.00 0.00 H new ATOM 0 HE1 MET A 14 -7.595 -4.893 -5.169 1.00 0.00 H new ATOM 0 HE2 MET A 14 -8.373 -5.098 -3.582 1.00 0.00 H new ATOM 0 HE3 MET A 14 -7.257 -6.342 -4.194 1.00 0.00 H new ATOM 166 N VAL A 15 -8.335 -9.527 -0.306 1.00 0.00 N ATOM 167 CA VAL A 15 -7.779 -9.546 1.042 1.00 0.00 C ATOM 168 C VAL A 15 -6.713 -8.469 1.212 1.00 0.00 C ATOM 169 O VAL A 15 -5.776 -8.380 0.420 1.00 0.00 O ATOM 170 CB VAL A 15 -7.166 -10.918 1.377 1.00 0.00 C ATOM 171 CG1 VAL A 15 -6.623 -10.928 2.798 1.00 0.00 C ATOM 172 CG2 VAL A 15 -8.194 -12.022 1.183 1.00 0.00 C ATOM 0 H VAL A 15 -7.800 -10.062 -0.990 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.603 -9.348 1.727 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.336 -11.102 0.695 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.194 -11.906 3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.853 -10.163 2.899 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.433 -10.722 3.498 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.744 -12.985 1.424 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.046 -11.845 1.839 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.530 -12.028 0.146 1.00 0.00 H new ATOM 182 N ASN A 16 -6.863 -7.655 2.251 1.00 0.00 N ATOM 183 CA ASN A 16 -5.912 -6.583 2.526 1.00 0.00 C ATOM 184 C ASN A 16 -4.847 -7.042 3.518 1.00 0.00 C ATOM 185 O ASN A 16 -5.162 -7.471 4.629 1.00 0.00 O ATOM 186 CB ASN A 16 -6.640 -5.355 3.074 1.00 0.00 C ATOM 187 CG ASN A 16 -7.704 -4.841 2.123 1.00 0.00 C ATOM 188 OD1 ASN A 16 -8.872 -5.215 2.220 1.00 0.00 O ATOM 189 ND2 ASN A 16 -7.302 -3.978 1.196 1.00 0.00 N ATOM 0 H ASN A 16 -7.633 -7.717 2.917 1.00 0.00 H new ATOM 0 HA ASN A 16 -5.421 -6.318 1.590 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -7.101 -5.606 4.029 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -5.916 -4.563 3.267 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -7.973 -3.598 0.528 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -6.323 -3.696 1.153 1.00 0.00 H new ATOM 196 N LEU A 17 -3.587 -6.948 3.110 1.00 0.00 N ATOM 197 CA LEU A 17 -2.474 -7.352 3.962 1.00 0.00 C ATOM 198 C LEU A 17 -2.238 -6.331 5.070 1.00 0.00 C ATOM 199 O LEU A 17 -2.466 -5.136 4.885 1.00 0.00 O ATOM 200 CB LEU A 17 -1.202 -7.521 3.129 1.00 0.00 C ATOM 201 CG LEU A 17 -1.312 -8.445 1.916 1.00 0.00 C ATOM 202 CD1 LEU A 17 -0.078 -8.320 1.036 1.00 0.00 C ATOM 203 CD2 LEU A 17 -1.510 -9.887 2.360 1.00 0.00 C ATOM 0 H LEU A 17 -3.310 -6.595 2.194 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.729 -8.307 4.421 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -0.885 -6.537 2.784 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.414 -7.900 3.779 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.181 -8.144 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.174 -8.985 0.178 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.019 -7.291 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.807 -8.594 1.610 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.586 -10.530 1.483 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.661 -10.200 2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.425 -9.964 2.948 1.00 0.00 H new ATOM 215 N ALA A 18 -1.778 -6.810 6.221 1.00 0.00 N ATOM 216 CA ALA A 18 -1.507 -5.938 7.358 1.00 0.00 C ATOM 217 C ALA A 18 -0.007 -5.751 7.561 1.00 0.00 C ATOM 218 O ALA A 18 0.443 -4.689 7.990 1.00 0.00 O ATOM 219 CB ALA A 18 -2.146 -6.501 8.619 1.00 0.00 C ATOM 0 H ALA A 18 -1.585 -7.797 6.391 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.943 -4.962 7.148 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -1.936 -5.840 9.460 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.224 -6.577 8.478 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.737 -7.490 8.824 1.00 0.00 H new ATOM 225 N PHE A 19 0.761 -6.789 7.249 1.00 0.00 N ATOM 226 CA PHE A 19 2.211 -6.740 7.399 1.00 0.00 C ATOM 227 C PHE A 19 2.891 -7.713 6.441 1.00 0.00 C ATOM 228 O PHE A 19 2.659 -8.921 6.497 1.00 0.00 O ATOM 229 CB PHE A 19 2.607 -7.065 8.841 1.00 0.00 C ATOM 230 CG PHE A 19 3.978 -7.667 8.964 1.00 0.00 C ATOM 231 CD1 PHE A 19 5.072 -7.060 8.367 1.00 0.00 C ATOM 232 CD2 PHE A 19 4.173 -8.838 9.677 1.00 0.00 C ATOM 233 CE1 PHE A 19 6.334 -7.612 8.478 1.00 0.00 C ATOM 234 CE2 PHE A 19 5.433 -9.395 9.793 1.00 0.00 C ATOM 235 CZ PHE A 19 6.515 -8.780 9.193 1.00 0.00 C ATOM 0 H PHE A 19 0.404 -7.675 6.891 1.00 0.00 H new ATOM 0 HA PHE A 19 2.542 -5.730 7.157 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.565 -6.152 9.436 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.876 -7.755 9.263 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.936 -6.145 7.809 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.330 -9.322 10.148 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.178 -7.131 8.006 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.571 -10.309 10.351 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.501 -9.212 9.283 1.00 0.00 H new ATOM 245 N VAL A 20 3.731 -7.178 5.561 1.00 0.00 N ATOM 246 CA VAL A 20 4.445 -7.998 4.590 1.00 0.00 C ATOM 247 C VAL A 20 5.947 -7.979 4.853 1.00 0.00 C ATOM 248 O VAL A 20 6.555 -6.915 4.969 1.00 0.00 O ATOM 249 CB VAL A 20 4.182 -7.520 3.149 1.00 0.00 C ATOM 250 CG1 VAL A 20 5.099 -8.239 2.172 1.00 0.00 C ATOM 251 CG2 VAL A 20 2.722 -7.730 2.777 1.00 0.00 C ATOM 0 H VAL A 20 3.934 -6.180 5.501 1.00 0.00 H new ATOM 0 HA VAL A 20 4.072 -9.016 4.701 1.00 0.00 H new ATOM 0 HB VAL A 20 4.398 -6.453 3.093 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.899 -7.888 1.160 1.00 0.00 H new ATOM 0 HG12 VAL A 20 6.138 -8.032 2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.919 -9.313 2.226 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.554 -7.387 1.756 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.477 -8.790 2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 20 2.088 -7.164 3.459 1.00 0.00 H new ATOM 261 N LYS A 21 6.540 -9.164 4.947 1.00 0.00 N ATOM 262 CA LYS A 21 7.972 -9.286 5.195 1.00 0.00 C ATOM 263 C LYS A 21 8.776 -8.712 4.033 1.00 0.00 C ATOM 264 O LYS A 21 8.934 -9.357 2.997 1.00 0.00 O ATOM 265 CB LYS A 21 8.349 -10.753 5.415 1.00 0.00 C ATOM 266 CG LYS A 21 9.603 -10.939 6.253 1.00 0.00 C ATOM 267 CD LYS A 21 10.723 -10.023 5.791 1.00 0.00 C ATOM 268 CE LYS A 21 12.012 -10.290 6.554 1.00 0.00 C ATOM 269 NZ LYS A 21 13.115 -9.393 6.112 1.00 0.00 N ATOM 0 H LYS A 21 6.051 -10.054 4.855 1.00 0.00 H new ATOM 0 HA LYS A 21 8.210 -8.717 6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 21 7.518 -11.264 5.901 1.00 0.00 H new ATOM 0 HB3 LYS A 21 8.495 -11.231 4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.375 -10.738 7.300 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.932 -11.976 6.192 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.894 -10.166 4.724 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.425 -8.984 5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.837 -10.152 7.621 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.310 -11.329 6.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.907 -9.461 6.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.437 -9.679 5.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.772 -8.412 6.079 1.00 0.00 H new ATOM 283 N ASN A 22 9.285 -7.498 4.213 1.00 0.00 N ATOM 284 CA ASN A 22 10.074 -6.838 3.179 1.00 0.00 C ATOM 285 C ASN A 22 11.116 -5.912 3.798 1.00 0.00 C ATOM 286 O ASN A 22 11.121 -5.688 5.009 1.00 0.00 O ATOM 287 CB ASN A 22 9.162 -6.044 2.242 1.00 0.00 C ATOM 288 CG ASN A 22 8.681 -4.747 2.864 1.00 0.00 C ATOM 289 OD1 ASN A 22 8.947 -3.662 2.347 1.00 0.00 O ATOM 290 ND2 ASN A 22 7.970 -4.855 3.980 1.00 0.00 N ATOM 0 H ASN A 22 9.165 -6.951 5.065 1.00 0.00 H new ATOM 0 HA ASN A 22 10.592 -7.607 2.606 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.698 -5.824 1.319 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.301 -6.656 1.973 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.620 -4.017 4.445 1.00 0.00 H new ATOM 0 HD22 ASN A 22 7.774 -5.776 4.373 1.00 0.00 H new ATOM 297 N ASP A 23 11.996 -5.377 2.960 1.00 0.00 N ATOM 298 CA ASP A 23 13.043 -4.473 3.424 1.00 0.00 C ATOM 299 C ASP A 23 13.313 -3.380 2.395 1.00 0.00 C ATOM 300 O ASP A 23 13.629 -3.665 1.240 1.00 0.00 O ATOM 301 CB ASP A 23 14.328 -5.251 3.709 1.00 0.00 C ATOM 302 CG ASP A 23 14.319 -5.905 5.077 1.00 0.00 C ATOM 303 OD1 ASP A 23 13.532 -5.462 5.940 1.00 0.00 O ATOM 304 OD2 ASP A 23 15.097 -6.859 5.283 1.00 0.00 O ATOM 0 H ASP A 23 12.006 -5.553 1.955 1.00 0.00 H new ATOM 0 HA ASP A 23 12.700 -4.002 4.345 1.00 0.00 H new ATOM 0 HB2 ASP A 23 14.463 -6.016 2.945 1.00 0.00 H new ATOM 0 HB3 ASP A 23 15.181 -4.576 3.638 1.00 0.00 H new ATOM 309 N SER A 24 13.184 -2.128 2.821 1.00 0.00 N ATOM 310 CA SER A 24 13.409 -0.991 1.936 1.00 0.00 C ATOM 311 C SER A 24 14.598 -0.161 2.409 1.00 0.00 C ATOM 312 O SER A 24 14.610 0.343 3.533 1.00 0.00 O ATOM 313 CB SER A 24 12.157 -0.116 1.866 1.00 0.00 C ATOM 314 OG SER A 24 12.076 0.749 2.985 1.00 0.00 O ATOM 0 H SER A 24 12.925 -1.875 3.774 1.00 0.00 H new ATOM 0 HA SER A 24 13.630 -1.376 0.940 1.00 0.00 H new ATOM 0 HB2 SER A 24 12.171 0.472 0.948 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.270 -0.748 1.826 1.00 0.00 H new ATOM 0 HG SER A 24 12.834 0.582 3.583 1.00 0.00 H new ATOM 320 N TYR A 25 15.596 -0.022 1.544 1.00 0.00 N ATOM 321 CA TYR A 25 16.792 0.745 1.873 1.00 0.00 C ATOM 322 C TYR A 25 16.773 2.106 1.183 1.00 0.00 C ATOM 323 O TYR A 25 16.246 2.247 0.080 1.00 0.00 O ATOM 324 CB TYR A 25 18.047 -0.028 1.466 1.00 0.00 C ATOM 325 CG TYR A 25 18.119 -0.331 -0.013 1.00 0.00 C ATOM 326 CD1 TYR A 25 17.547 -1.484 -0.535 1.00 0.00 C ATOM 327 CD2 TYR A 25 18.758 0.538 -0.890 1.00 0.00 C ATOM 328 CE1 TYR A 25 17.611 -1.765 -1.886 1.00 0.00 C ATOM 329 CE2 TYR A 25 18.826 0.266 -2.243 1.00 0.00 C ATOM 330 CZ TYR A 25 18.251 -0.887 -2.736 1.00 0.00 C ATOM 331 OH TYR A 25 18.316 -1.163 -4.082 1.00 0.00 O ATOM 0 H TYR A 25 15.601 -0.430 0.609 1.00 0.00 H new ATOM 0 HA TYR A 25 16.805 0.904 2.951 1.00 0.00 H new ATOM 0 HB2 TYR A 25 18.927 0.547 1.754 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.083 -0.965 2.022 1.00 0.00 H new ATOM 0 HD1 TYR A 25 17.043 -2.173 0.127 1.00 0.00 H new ATOM 0 HD2 TYR A 25 19.209 1.441 -0.507 1.00 0.00 H new ATOM 0 HE1 TYR A 25 17.162 -2.667 -2.275 1.00 0.00 H new ATOM 0 HE2 TYR A 25 19.326 0.952 -2.911 1.00 0.00 H new ATOM 0 HH TYR A 25 18.324 -2.134 -4.217 1.00 0.00 H new ATOM 341 N GLU A 26 17.353 3.104 1.843 1.00 0.00 N ATOM 342 CA GLU A 26 17.403 4.454 1.293 1.00 0.00 C ATOM 343 C GLU A 26 18.420 4.543 0.160 1.00 0.00 C ATOM 344 O GLU A 26 19.629 4.535 0.393 1.00 0.00 O ATOM 345 CB GLU A 26 17.755 5.462 2.390 1.00 0.00 C ATOM 346 CG GLU A 26 16.643 5.671 3.404 1.00 0.00 C ATOM 347 CD GLU A 26 16.685 4.660 4.533 1.00 0.00 C ATOM 348 OE1 GLU A 26 17.763 4.498 5.144 1.00 0.00 O ATOM 349 OE2 GLU A 26 15.642 4.030 4.805 1.00 0.00 O ATOM 0 H GLU A 26 17.794 3.004 2.757 1.00 0.00 H new ATOM 0 HA GLU A 26 16.418 4.692 0.892 1.00 0.00 H new ATOM 0 HB2 GLU A 26 18.650 5.122 2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 26 17.999 6.419 1.928 1.00 0.00 H new ATOM 0 HG2 GLU A 26 16.719 6.676 3.819 1.00 0.00 H new ATOM 0 HG3 GLU A 26 15.679 5.606 2.899 1.00 0.00 H new ATOM 356 N LYS A 27 17.922 4.627 -1.069 1.00 0.00 N ATOM 357 CA LYS A 27 18.785 4.719 -2.241 1.00 0.00 C ATOM 358 C LYS A 27 18.747 6.122 -2.837 1.00 0.00 C ATOM 359 O LYS A 27 17.787 6.866 -2.638 1.00 0.00 O ATOM 360 CB LYS A 27 18.360 3.693 -3.294 1.00 0.00 C ATOM 361 CG LYS A 27 19.385 3.493 -4.397 1.00 0.00 C ATOM 362 CD LYS A 27 18.988 2.359 -5.328 1.00 0.00 C ATOM 363 CE LYS A 27 18.037 2.837 -6.414 1.00 0.00 C ATOM 364 NZ LYS A 27 18.766 3.277 -7.636 1.00 0.00 N ATOM 0 H LYS A 27 16.924 4.633 -1.279 1.00 0.00 H new ATOM 0 HA LYS A 27 19.807 4.506 -1.927 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.175 2.737 -2.804 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.417 4.011 -3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 27 19.490 4.415 -4.969 1.00 0.00 H new ATOM 0 HG3 LYS A 27 20.359 3.279 -3.956 1.00 0.00 H new ATOM 0 HD2 LYS A 27 19.881 1.933 -5.786 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.515 1.563 -4.753 1.00 0.00 H new ATOM 0 HE2 LYS A 27 17.347 2.033 -6.672 1.00 0.00 H new ATOM 0 HE3 LYS A 27 17.436 3.663 -6.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 18.082 3.595 -8.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.406 4.061 -7.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 19.320 2.482 -8.015 1.00 0.00 H new ATOM 378 N GLY A 28 19.797 6.477 -3.572 1.00 0.00 N ATOM 379 CA GLY A 28 19.862 7.790 -4.187 1.00 0.00 C ATOM 380 C GLY A 28 19.431 8.895 -3.242 1.00 0.00 C ATOM 381 O GLY A 28 19.241 8.679 -2.045 1.00 0.00 O ATOM 0 H GLY A 28 20.603 5.879 -3.752 1.00 0.00 H new ATOM 0 HA2 GLY A 28 20.881 7.980 -4.523 1.00 0.00 H new ATOM 0 HA3 GLY A 28 19.227 7.805 -5.072 1.00 0.00 H new ATOM 385 N PRO A 29 19.271 10.112 -3.783 1.00 0.00 N ATOM 386 CA PRO A 29 18.858 11.279 -2.998 1.00 0.00 C ATOM 387 C PRO A 29 17.408 11.185 -2.537 1.00 0.00 C ATOM 388 O PRO A 29 17.110 11.350 -1.354 1.00 0.00 O ATOM 389 CB PRO A 29 19.035 12.444 -3.975 1.00 0.00 C ATOM 390 CG PRO A 29 18.910 11.828 -5.325 1.00 0.00 C ATOM 391 CD PRO A 29 19.479 10.442 -5.203 1.00 0.00 C ATOM 0 HA PRO A 29 19.440 11.381 -2.082 1.00 0.00 H new ATOM 0 HB2 PRO A 29 18.277 13.211 -3.818 1.00 0.00 H new ATOM 0 HB3 PRO A 29 20.005 12.924 -3.847 1.00 0.00 H new ATOM 0 HG2 PRO A 29 17.868 11.795 -5.644 1.00 0.00 H new ATOM 0 HG3 PRO A 29 19.453 12.409 -6.070 1.00 0.00 H new ATOM 0 HD2 PRO A 29 18.966 9.738 -5.858 1.00 0.00 H new ATOM 0 HD3 PRO A 29 20.535 10.416 -5.471 1.00 0.00 H new ATOM 399 N ASP A 30 16.509 10.919 -3.479 1.00 0.00 N ATOM 400 CA ASP A 30 15.089 10.801 -3.169 1.00 0.00 C ATOM 401 C ASP A 30 14.548 9.444 -3.608 1.00 0.00 C ATOM 402 O ASP A 30 13.339 9.264 -3.751 1.00 0.00 O ATOM 403 CB ASP A 30 14.302 11.922 -3.850 1.00 0.00 C ATOM 404 CG ASP A 30 14.944 12.375 -5.147 1.00 0.00 C ATOM 405 OD1 ASP A 30 15.336 11.503 -5.950 1.00 0.00 O ATOM 406 OD2 ASP A 30 15.056 13.601 -5.358 1.00 0.00 O ATOM 0 H ASP A 30 16.739 10.781 -4.463 1.00 0.00 H new ATOM 0 HA ASP A 30 14.970 10.888 -2.089 1.00 0.00 H new ATOM 0 HB2 ASP A 30 13.287 11.579 -4.051 1.00 0.00 H new ATOM 0 HB3 ASP A 30 14.223 12.771 -3.171 1.00 0.00 H new ATOM 411 N SER A 31 15.451 8.493 -3.819 1.00 0.00 N ATOM 412 CA SER A 31 15.065 7.153 -4.246 1.00 0.00 C ATOM 413 C SER A 31 14.891 6.229 -3.045 1.00 0.00 C ATOM 414 O SER A 31 15.524 6.417 -2.006 1.00 0.00 O ATOM 415 CB SER A 31 16.113 6.577 -5.200 1.00 0.00 C ATOM 416 OG SER A 31 16.350 7.453 -6.288 1.00 0.00 O ATOM 0 H SER A 31 16.456 8.625 -3.701 1.00 0.00 H new ATOM 0 HA SER A 31 14.111 7.226 -4.767 1.00 0.00 H new ATOM 0 HB2 SER A 31 17.044 6.403 -4.660 1.00 0.00 H new ATOM 0 HB3 SER A 31 15.776 5.610 -5.574 1.00 0.00 H new ATOM 0 HG SER A 31 17.025 7.062 -6.882 1.00 0.00 H new ATOM 422 N VAL A 32 14.027 5.229 -3.195 1.00 0.00 N ATOM 423 CA VAL A 32 13.770 4.274 -2.124 1.00 0.00 C ATOM 424 C VAL A 32 13.352 2.920 -2.684 1.00 0.00 C ATOM 425 O VAL A 32 12.229 2.751 -3.159 1.00 0.00 O ATOM 426 CB VAL A 32 12.672 4.783 -1.170 1.00 0.00 C ATOM 427 CG1 VAL A 32 12.247 3.683 -0.210 1.00 0.00 C ATOM 428 CG2 VAL A 32 13.155 6.009 -0.409 1.00 0.00 C ATOM 0 H VAL A 32 13.494 5.060 -4.048 1.00 0.00 H new ATOM 0 HA VAL A 32 14.701 4.163 -1.569 1.00 0.00 H new ATOM 0 HB VAL A 32 11.804 5.070 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.471 4.061 0.456 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.859 2.836 -0.776 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.106 3.362 0.379 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.367 6.356 0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.039 5.750 0.174 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.405 6.801 -1.115 1.00 0.00 H new ATOM 438 N VAL A 33 14.265 1.955 -2.626 1.00 0.00 N ATOM 439 CA VAL A 33 13.991 0.613 -3.126 1.00 0.00 C ATOM 440 C VAL A 33 13.403 -0.272 -2.033 1.00 0.00 C ATOM 441 O VAL A 33 13.770 -0.159 -0.863 1.00 0.00 O ATOM 442 CB VAL A 33 15.267 -0.051 -3.678 1.00 0.00 C ATOM 443 CG1 VAL A 33 15.037 -1.537 -3.912 1.00 0.00 C ATOM 444 CG2 VAL A 33 15.713 0.636 -4.960 1.00 0.00 C ATOM 0 H VAL A 33 15.200 2.078 -2.238 1.00 0.00 H new ATOM 0 HA VAL A 33 13.266 0.718 -3.933 1.00 0.00 H new ATOM 0 HB VAL A 33 16.061 0.058 -2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 33 15.949 -1.989 -4.302 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.768 -2.016 -2.971 1.00 0.00 H new ATOM 0 HG13 VAL A 33 14.229 -1.671 -4.631 1.00 0.00 H new ATOM 0 HG21 VAL A 33 16.616 0.154 -5.336 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.923 0.560 -5.707 1.00 0.00 H new ATOM 0 HG23 VAL A 33 15.920 1.687 -4.757 1.00 0.00 H new ATOM 454 N VAL A 34 12.488 -1.155 -2.422 1.00 0.00 N ATOM 455 CA VAL A 34 11.849 -2.061 -1.475 1.00 0.00 C ATOM 456 C VAL A 34 12.035 -3.515 -1.896 1.00 0.00 C ATOM 457 O VAL A 34 11.938 -3.848 -3.077 1.00 0.00 O ATOM 458 CB VAL A 34 10.344 -1.765 -1.343 1.00 0.00 C ATOM 459 CG1 VAL A 34 9.701 -2.705 -0.334 1.00 0.00 C ATOM 460 CG2 VAL A 34 10.119 -0.313 -0.950 1.00 0.00 C ATOM 0 H VAL A 34 12.173 -1.262 -3.386 1.00 0.00 H new ATOM 0 HA VAL A 34 12.329 -1.900 -0.510 1.00 0.00 H new ATOM 0 HB VAL A 34 9.872 -1.933 -2.311 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.637 -2.481 -0.254 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.831 -3.736 -0.663 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.174 -2.573 0.639 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.050 -0.122 -0.861 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.604 -0.116 0.006 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.542 0.340 -1.713 1.00 0.00 H new ATOM 470 N HIS A 35 12.303 -4.377 -0.920 1.00 0.00 N ATOM 471 CA HIS A 35 12.501 -5.797 -1.188 1.00 0.00 C ATOM 472 C HIS A 35 11.452 -6.638 -0.467 1.00 0.00 C ATOM 473 O HIS A 35 11.551 -6.873 0.738 1.00 0.00 O ATOM 474 CB HIS A 35 13.903 -6.228 -0.756 1.00 0.00 C ATOM 475 CG HIS A 35 14.989 -5.722 -1.655 1.00 0.00 C ATOM 476 ND1 HIS A 35 16.218 -6.336 -1.770 1.00 0.00 N ATOM 477 CD2 HIS A 35 15.024 -4.654 -2.486 1.00 0.00 C ATOM 478 CE1 HIS A 35 16.963 -5.667 -2.631 1.00 0.00 C ATOM 479 NE2 HIS A 35 16.262 -4.641 -3.080 1.00 0.00 N ATOM 0 H HIS A 35 12.388 -4.117 0.063 1.00 0.00 H new ATOM 0 HA HIS A 35 12.394 -5.957 -2.261 1.00 0.00 H new ATOM 0 HB2 HIS A 35 14.087 -5.873 0.258 1.00 0.00 H new ATOM 0 HB3 HIS A 35 13.946 -7.317 -0.725 1.00 0.00 H new ATOM 0 HD1 HIS A 35 16.507 -7.176 -1.268 1.00 0.00 H new ATOM 0 HD2 HIS A 35 14.227 -3.944 -2.651 1.00 0.00 H new ATOM 0 HE1 HIS A 35 17.974 -5.916 -2.919 1.00 0.00 H new ATOM 488 N VAL A 36 10.447 -7.089 -1.211 1.00 0.00 N ATOM 489 CA VAL A 36 9.380 -7.904 -0.643 1.00 0.00 C ATOM 490 C VAL A 36 9.718 -9.388 -0.728 1.00 0.00 C ATOM 491 O VAL A 36 9.998 -9.911 -1.807 1.00 0.00 O ATOM 492 CB VAL A 36 8.040 -7.652 -1.358 1.00 0.00 C ATOM 493 CG1 VAL A 36 6.902 -8.339 -0.619 1.00 0.00 C ATOM 494 CG2 VAL A 36 7.778 -6.159 -1.488 1.00 0.00 C ATOM 0 H VAL A 36 10.350 -6.903 -2.209 1.00 0.00 H new ATOM 0 HA VAL A 36 9.284 -7.615 0.404 1.00 0.00 H new ATOM 0 HB VAL A 36 8.098 -8.076 -2.360 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.963 -8.149 -1.139 1.00 0.00 H new ATOM 0 HG12 VAL A 36 7.087 -9.413 -0.584 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.839 -7.948 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.827 -5.999 -1.996 1.00 0.00 H new ATOM 0 HG22 VAL A 36 7.740 -5.709 -0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.579 -5.698 -2.065 1.00 0.00 H new ATOM 504 N TYR A 37 9.690 -10.062 0.417 1.00 0.00 N ATOM 505 CA TYR A 37 9.995 -11.486 0.473 1.00 0.00 C ATOM 506 C TYR A 37 8.776 -12.320 0.087 1.00 0.00 C ATOM 507 O TYR A 37 7.843 -12.477 0.874 1.00 0.00 O ATOM 508 CB TYR A 37 10.468 -11.873 1.875 1.00 0.00 C ATOM 509 CG TYR A 37 11.825 -11.310 2.233 1.00 0.00 C ATOM 510 CD1 TYR A 37 12.437 -10.356 1.428 1.00 0.00 C ATOM 511 CD2 TYR A 37 12.495 -11.730 3.375 1.00 0.00 C ATOM 512 CE1 TYR A 37 13.677 -9.839 1.750 1.00 0.00 C ATOM 513 CE2 TYR A 37 13.734 -11.217 3.706 1.00 0.00 C ATOM 514 CZ TYR A 37 14.321 -10.272 2.890 1.00 0.00 C ATOM 515 OH TYR A 37 15.556 -9.760 3.216 1.00 0.00 O ATOM 0 H TYR A 37 9.459 -9.644 1.318 1.00 0.00 H new ATOM 0 HA TYR A 37 10.793 -11.689 -0.241 1.00 0.00 H new ATOM 0 HB2 TYR A 37 9.736 -11.527 2.605 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.503 -12.960 1.950 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.934 -10.013 0.536 1.00 0.00 H new ATOM 0 HD2 TYR A 37 12.039 -12.471 4.015 1.00 0.00 H new ATOM 0 HE1 TYR A 37 14.139 -9.100 1.113 1.00 0.00 H new ATOM 0 HE2 TYR A 37 14.240 -11.554 4.599 1.00 0.00 H new ATOM 0 HH TYR A 37 15.870 -10.169 4.049 1.00 0.00 H new ATOM 525 N VAL A 38 8.794 -12.854 -1.130 1.00 0.00 N ATOM 526 CA VAL A 38 7.693 -13.673 -1.621 1.00 0.00 C ATOM 527 C VAL A 38 8.062 -14.363 -2.930 1.00 0.00 C ATOM 528 O VAL A 38 8.851 -13.841 -3.718 1.00 0.00 O ATOM 529 CB VAL A 38 6.420 -12.832 -1.838 1.00 0.00 C ATOM 530 CG1 VAL A 38 6.650 -11.785 -2.917 1.00 0.00 C ATOM 531 CG2 VAL A 38 5.244 -13.729 -2.194 1.00 0.00 C ATOM 0 H VAL A 38 9.559 -12.734 -1.794 1.00 0.00 H new ATOM 0 HA VAL A 38 7.496 -14.427 -0.859 1.00 0.00 H new ATOM 0 HB VAL A 38 6.183 -12.314 -0.908 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.741 -11.201 -3.057 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.463 -11.124 -2.616 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.911 -12.279 -3.853 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.353 -13.119 -2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.468 -14.276 -3.110 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.067 -14.436 -1.384 1.00 0.00 H new ATOM 541 N LYS A 39 7.486 -15.539 -3.155 1.00 0.00 N ATOM 542 CA LYS A 39 7.752 -16.301 -4.369 1.00 0.00 C ATOM 543 C LYS A 39 6.455 -16.824 -4.979 1.00 0.00 C ATOM 544 O LYS A 39 5.378 -16.648 -4.412 1.00 0.00 O ATOM 545 CB LYS A 39 8.693 -17.470 -4.066 1.00 0.00 C ATOM 546 CG LYS A 39 9.974 -17.054 -3.364 1.00 0.00 C ATOM 547 CD LYS A 39 10.959 -18.207 -3.272 1.00 0.00 C ATOM 548 CE LYS A 39 11.414 -18.663 -4.649 1.00 0.00 C ATOM 549 NZ LYS A 39 12.759 -19.301 -4.606 1.00 0.00 N ATOM 0 H LYS A 39 6.832 -15.985 -2.512 1.00 0.00 H new ATOM 0 HA LYS A 39 8.229 -15.635 -5.089 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.168 -18.196 -3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.947 -17.972 -4.999 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.432 -16.225 -3.903 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.740 -16.693 -2.362 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.825 -17.901 -2.685 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.496 -19.042 -2.746 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.690 -19.369 -5.055 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.439 -17.808 -5.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.033 -19.598 -5.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.455 -18.619 -4.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.729 -20.132 -3.981 1.00 0.00 H new ATOM 563 N GLU A 40 6.568 -17.467 -6.137 1.00 0.00 N ATOM 564 CA GLU A 40 5.403 -18.015 -6.822 1.00 0.00 C ATOM 565 C GLU A 40 4.317 -16.955 -6.981 1.00 0.00 C ATOM 566 O GLU A 40 3.152 -17.193 -6.661 1.00 0.00 O ATOM 567 CB GLU A 40 4.850 -19.217 -6.052 1.00 0.00 C ATOM 568 CG GLU A 40 5.920 -20.036 -5.351 1.00 0.00 C ATOM 569 CD GLU A 40 6.679 -20.940 -6.303 1.00 0.00 C ATOM 570 OE1 GLU A 40 6.975 -20.497 -7.433 1.00 0.00 O ATOM 571 OE2 GLU A 40 6.978 -22.090 -5.919 1.00 0.00 O ATOM 0 H GLU A 40 7.453 -17.621 -6.620 1.00 0.00 H new ATOM 0 HA GLU A 40 5.716 -18.341 -7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.132 -18.864 -5.312 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.306 -19.861 -6.743 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.622 -19.364 -4.857 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.457 -20.642 -4.572 1.00 0.00 H new ATOM 578 N ILE A 41 4.708 -15.786 -7.477 1.00 0.00 N ATOM 579 CA ILE A 41 3.769 -14.690 -7.679 1.00 0.00 C ATOM 580 C ILE A 41 3.324 -14.609 -9.135 1.00 0.00 C ATOM 581 O ILE A 41 4.093 -14.916 -10.048 1.00 0.00 O ATOM 582 CB ILE A 41 4.382 -13.339 -7.265 1.00 0.00 C ATOM 583 CG1 ILE A 41 4.301 -13.161 -5.748 1.00 0.00 C ATOM 584 CG2 ILE A 41 3.674 -12.196 -7.977 1.00 0.00 C ATOM 585 CD1 ILE A 41 4.298 -11.714 -5.308 1.00 0.00 C ATOM 0 H ILE A 41 5.669 -15.574 -7.746 1.00 0.00 H new ATOM 0 HA ILE A 41 2.904 -14.895 -7.048 1.00 0.00 H new ATOM 0 HB ILE A 41 5.432 -13.328 -7.557 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.396 -13.645 -5.381 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.146 -13.671 -5.285 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.118 -11.248 -7.674 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.779 -12.318 -9.055 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.617 -12.202 -7.713 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.239 -11.664 -4.221 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.215 -11.230 -5.644 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.438 -11.204 -5.742 1.00 0.00 H new ATOM 597 N CYS A 42 2.080 -14.193 -9.346 1.00 0.00 N ATOM 598 CA CYS A 42 1.533 -14.070 -10.693 1.00 0.00 C ATOM 599 C CYS A 42 1.646 -12.634 -11.196 1.00 0.00 C ATOM 600 O CYS A 42 0.873 -11.763 -10.796 1.00 0.00 O ATOM 601 CB CYS A 42 0.071 -14.517 -10.714 1.00 0.00 C ATOM 602 SG CYS A 42 -0.456 -15.243 -12.284 1.00 0.00 S ATOM 0 H CYS A 42 1.431 -13.935 -8.602 1.00 0.00 H new ATOM 0 HA CYS A 42 2.112 -14.714 -11.355 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -0.087 -15.245 -9.918 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -0.563 -13.659 -10.492 1.00 0.00 H new ATOM 0 HG CYS A 42 -1.706 -15.592 -12.203 1.00 0.00 H new ATOM 608 N ARG A 43 2.614 -12.395 -12.074 1.00 0.00 N ATOM 609 CA ARG A 43 2.830 -11.064 -12.630 1.00 0.00 C ATOM 610 C ARG A 43 1.657 -10.647 -13.513 1.00 0.00 C ATOM 611 O ARG A 43 1.565 -9.496 -13.938 1.00 0.00 O ATOM 612 CB ARG A 43 4.128 -11.030 -13.439 1.00 0.00 C ATOM 613 CG ARG A 43 5.338 -11.536 -12.670 1.00 0.00 C ATOM 614 CD ARG A 43 6.637 -11.100 -13.327 1.00 0.00 C ATOM 615 NE ARG A 43 7.725 -12.039 -13.066 1.00 0.00 N ATOM 616 CZ ARG A 43 7.859 -13.201 -13.696 1.00 0.00 C ATOM 617 NH1 ARG A 43 6.980 -13.565 -14.619 1.00 0.00 N ATOM 618 NH2 ARG A 43 8.876 -14.002 -13.403 1.00 0.00 N ATOM 0 H ARG A 43 3.261 -13.105 -12.416 1.00 0.00 H new ATOM 0 HA ARG A 43 2.908 -10.360 -11.802 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.002 -11.633 -14.338 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.317 -10.007 -13.765 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.303 -11.162 -11.647 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.305 -12.624 -12.613 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.487 -11.010 -14.403 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.915 -10.112 -12.960 1.00 0.00 H new ATOM 0 HE ARG A 43 8.419 -11.789 -12.362 1.00 0.00 H new ATOM 0 HH11 ARG A 43 6.197 -12.952 -14.848 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.086 -14.458 -15.101 1.00 0.00 H new ATOM 0 HH21 ARG A 43 9.555 -13.726 -12.694 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.978 -14.894 -13.887 1.00 0.00 H new ATOM 632 N ASP A 44 0.763 -11.592 -13.785 1.00 0.00 N ATOM 633 CA ASP A 44 -0.404 -11.323 -14.617 1.00 0.00 C ATOM 634 C ASP A 44 -1.545 -10.749 -13.782 1.00 0.00 C ATOM 635 O ASP A 44 -2.305 -9.900 -14.250 1.00 0.00 O ATOM 636 CB ASP A 44 -0.862 -12.602 -15.319 1.00 0.00 C ATOM 637 CG ASP A 44 -0.019 -12.929 -16.535 1.00 0.00 C ATOM 638 OD1 ASP A 44 0.348 -11.990 -17.273 1.00 0.00 O ATOM 639 OD2 ASP A 44 0.275 -14.123 -16.750 1.00 0.00 O ATOM 0 H ASP A 44 0.824 -12.550 -13.442 1.00 0.00 H new ATOM 0 HA ASP A 44 -0.122 -10.587 -15.369 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.819 -13.434 -14.616 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.904 -12.494 -15.621 1.00 0.00 H new ATOM 644 N THR A 45 -1.661 -11.219 -12.544 1.00 0.00 N ATOM 645 CA THR A 45 -2.710 -10.755 -11.645 1.00 0.00 C ATOM 646 C THR A 45 -2.129 -9.939 -10.497 1.00 0.00 C ATOM 647 O THR A 45 -2.803 -9.688 -9.498 1.00 0.00 O ATOM 648 CB THR A 45 -3.516 -11.934 -11.066 1.00 0.00 C ATOM 649 OG1 THR A 45 -2.646 -12.815 -10.347 1.00 0.00 O ATOM 650 CG2 THR A 45 -4.222 -12.702 -12.173 1.00 0.00 C ATOM 0 H THR A 45 -1.041 -11.921 -12.141 1.00 0.00 H new ATOM 0 HA THR A 45 -3.375 -10.124 -12.235 1.00 0.00 H new ATOM 0 HB THR A 45 -4.269 -11.533 -10.387 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.150 -13.264 -9.637 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.784 -13.529 -11.740 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.905 -12.035 -12.700 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.483 -13.092 -12.873 1.00 0.00 H new ATOM 658 N SER A 46 -0.874 -9.526 -10.646 1.00 0.00 N ATOM 659 CA SER A 46 -0.201 -8.740 -9.619 1.00 0.00 C ATOM 660 C SER A 46 0.190 -7.366 -10.155 1.00 0.00 C ATOM 661 O SER A 46 1.003 -7.255 -11.072 1.00 0.00 O ATOM 662 CB SER A 46 1.042 -9.476 -9.116 1.00 0.00 C ATOM 663 OG SER A 46 0.702 -10.744 -8.580 1.00 0.00 O ATOM 0 H SER A 46 -0.303 -9.723 -11.468 1.00 0.00 H new ATOM 0 HA SER A 46 -0.894 -8.603 -8.789 1.00 0.00 H new ATOM 0 HB2 SER A 46 1.750 -9.602 -9.935 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.540 -8.877 -8.353 1.00 0.00 H new ATOM 0 HG SER A 46 0.674 -11.407 -9.301 1.00 0.00 H new ATOM 669 N ARG A 47 -0.395 -6.323 -9.576 1.00 0.00 N ATOM 670 CA ARG A 47 -0.110 -4.956 -9.996 1.00 0.00 C ATOM 671 C ARG A 47 0.306 -4.098 -8.805 1.00 0.00 C ATOM 672 O ARG A 47 0.363 -4.575 -7.672 1.00 0.00 O ATOM 673 CB ARG A 47 -1.334 -4.343 -10.677 1.00 0.00 C ATOM 674 CG ARG A 47 -2.623 -4.526 -9.893 1.00 0.00 C ATOM 675 CD ARG A 47 -2.887 -3.344 -8.972 1.00 0.00 C ATOM 676 NE ARG A 47 -3.652 -2.292 -9.636 1.00 0.00 N ATOM 677 CZ ARG A 47 -4.967 -2.341 -9.814 1.00 0.00 C ATOM 678 NH1 ARG A 47 -5.660 -3.385 -9.380 1.00 0.00 N ATOM 679 NH2 ARG A 47 -5.592 -1.345 -10.428 1.00 0.00 N ATOM 0 H ARG A 47 -1.069 -6.398 -8.815 1.00 0.00 H new ATOM 0 HA ARG A 47 0.715 -4.985 -10.707 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.159 -3.278 -10.829 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.452 -4.791 -11.664 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -3.457 -4.643 -10.585 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -2.565 -5.442 -9.304 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.430 -3.686 -8.091 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -1.938 -2.937 -8.624 1.00 0.00 H new ATOM 0 HE ARG A 47 -3.149 -1.475 -9.982 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.183 -4.153 -8.908 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.670 -3.420 -9.518 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -5.062 -0.541 -10.764 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.602 -1.384 -10.564 1.00 0.00 H new ATOM 693 N VAL A 48 0.596 -2.828 -9.071 1.00 0.00 N ATOM 694 CA VAL A 48 1.007 -1.902 -8.021 1.00 0.00 C ATOM 695 C VAL A 48 0.565 -0.479 -8.341 1.00 0.00 C ATOM 696 O VAL A 48 0.780 0.016 -9.449 1.00 0.00 O ATOM 697 CB VAL A 48 2.534 -1.921 -7.822 1.00 0.00 C ATOM 698 CG1 VAL A 48 2.940 -0.958 -6.717 1.00 0.00 C ATOM 699 CG2 VAL A 48 3.012 -3.332 -7.513 1.00 0.00 C ATOM 0 H VAL A 48 0.554 -2.417 -10.004 1.00 0.00 H new ATOM 0 HA VAL A 48 0.524 -2.232 -7.101 1.00 0.00 H new ATOM 0 HB VAL A 48 3.009 -1.595 -8.748 1.00 0.00 H new ATOM 0 HG11 VAL A 48 4.022 -0.985 -6.590 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.631 0.053 -6.983 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.458 -1.251 -5.784 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.093 -3.328 -7.375 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.531 -3.688 -6.602 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.754 -3.993 -8.341 1.00 0.00 H new ATOM 709 N LEU A 49 -0.053 0.177 -7.365 1.00 0.00 N ATOM 710 CA LEU A 49 -0.525 1.546 -7.541 1.00 0.00 C ATOM 711 C LEU A 49 0.360 2.529 -6.782 1.00 0.00 C ATOM 712 O LEU A 49 0.552 2.402 -5.573 1.00 0.00 O ATOM 713 CB LEU A 49 -1.973 1.672 -7.064 1.00 0.00 C ATOM 714 CG LEU A 49 -2.977 0.714 -7.706 1.00 0.00 C ATOM 715 CD1 LEU A 49 -3.114 1.001 -9.193 1.00 0.00 C ATOM 716 CD2 LEU A 49 -2.558 -0.731 -7.477 1.00 0.00 C ATOM 0 H LEU A 49 -0.239 -0.217 -6.443 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.476 1.787 -8.603 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.994 1.519 -5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.307 2.693 -7.247 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.948 0.869 -7.236 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.833 0.309 -9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.461 2.024 -9.336 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.146 0.876 -9.678 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.284 -1.398 -7.941 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.576 -0.900 -7.919 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.513 -0.932 -6.407 1.00 0.00 H new ATOM 728 N PHE A 50 0.895 3.511 -7.500 1.00 0.00 N ATOM 729 CA PHE A 50 1.759 4.518 -6.894 1.00 0.00 C ATOM 730 C PHE A 50 1.000 5.823 -6.672 1.00 0.00 C ATOM 731 O PHE A 50 0.703 6.550 -7.619 1.00 0.00 O ATOM 732 CB PHE A 50 2.981 4.770 -7.779 1.00 0.00 C ATOM 733 CG PHE A 50 3.917 3.598 -7.857 1.00 0.00 C ATOM 734 CD1 PHE A 50 4.551 3.124 -6.719 1.00 0.00 C ATOM 735 CD2 PHE A 50 4.163 2.970 -9.067 1.00 0.00 C ATOM 736 CE1 PHE A 50 5.413 2.046 -6.788 1.00 0.00 C ATOM 737 CE2 PHE A 50 5.024 1.891 -9.142 1.00 0.00 C ATOM 738 CZ PHE A 50 5.649 1.428 -8.001 1.00 0.00 C ATOM 0 H PHE A 50 0.746 3.631 -8.502 1.00 0.00 H new ATOM 0 HA PHE A 50 2.091 4.142 -5.926 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.645 5.024 -8.784 1.00 0.00 H new ATOM 0 HB3 PHE A 50 3.525 5.634 -7.397 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.369 3.602 -5.768 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.676 3.328 -9.962 1.00 0.00 H new ATOM 0 HE1 PHE A 50 5.902 1.687 -5.894 1.00 0.00 H new ATOM 0 HE2 PHE A 50 5.208 1.411 -10.092 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.321 0.584 -8.057 1.00 0.00 H new ATOM 748 N ARG A 51 0.688 6.112 -5.412 1.00 0.00 N ATOM 749 CA ARG A 51 -0.037 7.327 -5.064 1.00 0.00 C ATOM 750 C ARG A 51 0.929 8.460 -4.730 1.00 0.00 C ATOM 751 O ARG A 51 2.145 8.302 -4.832 1.00 0.00 O ATOM 752 CB ARG A 51 -0.968 7.069 -3.878 1.00 0.00 C ATOM 753 CG ARG A 51 -2.362 6.620 -4.285 1.00 0.00 C ATOM 754 CD ARG A 51 -3.254 7.805 -4.620 1.00 0.00 C ATOM 755 NE ARG A 51 -3.450 8.685 -3.471 1.00 0.00 N ATOM 756 CZ ARG A 51 -4.408 9.603 -3.403 1.00 0.00 C ATOM 757 NH1 ARG A 51 -5.252 9.760 -4.413 1.00 0.00 N ATOM 758 NH2 ARG A 51 -4.523 10.365 -2.323 1.00 0.00 N ATOM 0 H ARG A 51 0.926 5.521 -4.616 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.633 7.624 -5.927 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.523 6.308 -3.236 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.048 7.980 -3.284 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.295 5.959 -5.149 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.810 6.043 -3.476 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.811 8.372 -5.439 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.221 7.443 -4.969 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.817 8.590 -2.677 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.167 9.175 -5.244 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.987 10.465 -4.359 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -3.876 10.246 -1.544 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.259 11.069 -2.272 1.00 0.00 H new ATOM 772 N GLU A 52 0.378 9.602 -4.330 1.00 0.00 N ATOM 773 CA GLU A 52 1.191 10.761 -3.982 1.00 0.00 C ATOM 774 C GLU A 52 1.663 10.679 -2.533 1.00 0.00 C ATOM 775 O GLU A 52 2.792 11.051 -2.216 1.00 0.00 O ATOM 776 CB GLU A 52 0.399 12.052 -4.200 1.00 0.00 C ATOM 777 CG GLU A 52 -0.640 12.317 -3.123 1.00 0.00 C ATOM 778 CD GLU A 52 -1.809 13.139 -3.631 1.00 0.00 C ATOM 779 OE1 GLU A 52 -2.515 12.666 -4.545 1.00 0.00 O ATOM 780 OE2 GLU A 52 -2.017 14.256 -3.113 1.00 0.00 O ATOM 0 H GLU A 52 -0.627 9.749 -4.239 1.00 0.00 H new ATOM 0 HA GLU A 52 2.066 10.767 -4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.093 12.892 -4.239 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.098 12.004 -5.169 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.009 11.367 -2.738 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.169 12.838 -2.289 1.00 0.00 H new ATOM 787 N GLN A 53 0.789 10.191 -1.659 1.00 0.00 N ATOM 788 CA GLN A 53 1.115 10.061 -0.244 1.00 0.00 C ATOM 789 C GLN A 53 0.959 8.617 0.221 1.00 0.00 C ATOM 790 O GLN A 53 0.774 8.354 1.409 1.00 0.00 O ATOM 791 CB GLN A 53 0.221 10.978 0.593 1.00 0.00 C ATOM 792 CG GLN A 53 0.751 11.230 1.996 1.00 0.00 C ATOM 793 CD GLN A 53 -0.352 11.527 2.992 1.00 0.00 C ATOM 794 OE1 GLN A 53 -0.844 12.653 3.073 1.00 0.00 O ATOM 795 NE2 GLN A 53 -0.747 10.516 3.757 1.00 0.00 N ATOM 0 H GLN A 53 -0.150 9.879 -1.906 1.00 0.00 H new ATOM 0 HA GLN A 53 2.155 10.356 -0.108 1.00 0.00 H new ATOM 0 HB2 GLN A 53 0.111 11.933 0.078 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -0.773 10.537 0.663 1.00 0.00 H new ATOM 0 HG2 GLN A 53 1.312 10.357 2.330 1.00 0.00 H new ATOM 0 HG3 GLN A 53 1.449 12.067 1.972 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -0.311 9.599 3.656 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -1.486 10.656 4.446 1.00 0.00 H new ATOM 804 N ASP A 54 1.035 7.686 -0.723 1.00 0.00 N ATOM 805 CA ASP A 54 0.903 6.267 -0.410 1.00 0.00 C ATOM 806 C ASP A 54 1.221 5.410 -1.631 1.00 0.00 C ATOM 807 O ASP A 54 1.555 5.928 -2.697 1.00 0.00 O ATOM 808 CB ASP A 54 -0.510 5.963 0.089 1.00 0.00 C ATOM 809 CG ASP A 54 -1.571 6.737 -0.668 1.00 0.00 C ATOM 810 OD1 ASP A 54 -1.538 7.984 -0.626 1.00 0.00 O ATOM 811 OD2 ASP A 54 -2.435 6.095 -1.302 1.00 0.00 O ATOM 0 H ASP A 54 1.187 7.888 -1.711 1.00 0.00 H new ATOM 0 HA ASP A 54 1.617 6.025 0.377 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -0.705 4.895 -0.009 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.577 6.203 1.150 1.00 0.00 H new ATOM 816 N PHE A 55 1.116 4.095 -1.468 1.00 0.00 N ATOM 817 CA PHE A 55 1.394 3.165 -2.556 1.00 0.00 C ATOM 818 C PHE A 55 0.911 1.760 -2.208 1.00 0.00 C ATOM 819 O PHE A 55 1.411 1.132 -1.274 1.00 0.00 O ATOM 820 CB PHE A 55 2.893 3.140 -2.863 1.00 0.00 C ATOM 821 CG PHE A 55 3.668 2.196 -1.988 1.00 0.00 C ATOM 822 CD1 PHE A 55 3.774 0.854 -2.317 1.00 0.00 C ATOM 823 CD2 PHE A 55 4.291 2.651 -0.837 1.00 0.00 C ATOM 824 CE1 PHE A 55 4.486 -0.017 -1.515 1.00 0.00 C ATOM 825 CE2 PHE A 55 5.005 1.784 -0.031 1.00 0.00 C ATOM 826 CZ PHE A 55 5.102 0.449 -0.370 1.00 0.00 C ATOM 0 H PHE A 55 0.840 3.650 -0.593 1.00 0.00 H new ATOM 0 HA PHE A 55 0.855 3.507 -3.439 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.038 2.858 -3.906 1.00 0.00 H new ATOM 0 HB3 PHE A 55 3.297 4.146 -2.746 1.00 0.00 H new ATOM 0 HD1 PHE A 55 3.294 0.484 -3.211 1.00 0.00 H new ATOM 0 HD2 PHE A 55 4.218 3.694 -0.567 1.00 0.00 H new ATOM 0 HE1 PHE A 55 4.561 -1.061 -1.783 1.00 0.00 H new ATOM 0 HE2 PHE A 55 5.487 2.151 0.863 1.00 0.00 H new ATOM 0 HZ PHE A 55 5.659 -0.230 0.259 1.00 0.00 H new ATOM 836 N THR A 56 -0.066 1.273 -2.966 1.00 0.00 N ATOM 837 CA THR A 56 -0.619 -0.056 -2.738 1.00 0.00 C ATOM 838 C THR A 56 -0.008 -1.077 -3.690 1.00 0.00 C ATOM 839 O THR A 56 0.278 -0.768 -4.848 1.00 0.00 O ATOM 840 CB THR A 56 -2.150 -0.065 -2.908 1.00 0.00 C ATOM 841 OG1 THR A 56 -2.711 1.130 -2.352 1.00 0.00 O ATOM 842 CG2 THR A 56 -2.764 -1.282 -2.232 1.00 0.00 C ATOM 0 H THR A 56 -0.491 1.779 -3.743 1.00 0.00 H new ATOM 0 HA THR A 56 -0.373 -0.328 -1.711 1.00 0.00 H new ATOM 0 HB THR A 56 -2.375 -0.110 -3.974 1.00 0.00 H new ATOM 0 HG1 THR A 56 -3.684 1.118 -2.465 1.00 0.00 H new ATOM 0 HG21 THR A 56 -3.846 -1.266 -2.366 1.00 0.00 H new ATOM 0 HG22 THR A 56 -2.357 -2.190 -2.677 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.530 -1.264 -1.168 1.00 0.00 H new ATOM 850 N LEU A 57 0.189 -2.295 -3.198 1.00 0.00 N ATOM 851 CA LEU A 57 0.767 -3.363 -4.006 1.00 0.00 C ATOM 852 C LEU A 57 -0.147 -4.585 -4.026 1.00 0.00 C ATOM 853 O LEU A 57 -0.339 -5.245 -3.005 1.00 0.00 O ATOM 854 CB LEU A 57 2.144 -3.751 -3.466 1.00 0.00 C ATOM 855 CG LEU A 57 2.573 -5.200 -3.698 1.00 0.00 C ATOM 856 CD1 LEU A 57 2.880 -5.437 -5.169 1.00 0.00 C ATOM 857 CD2 LEU A 57 3.780 -5.544 -2.837 1.00 0.00 C ATOM 0 H LEU A 57 -0.043 -2.568 -2.243 1.00 0.00 H new ATOM 0 HA LEU A 57 0.875 -2.995 -5.026 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.888 -3.096 -3.920 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.160 -3.556 -2.394 1.00 0.00 H new ATOM 0 HG LEU A 57 1.749 -5.853 -3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.184 -6.474 -5.315 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.990 -5.232 -5.764 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.687 -4.775 -5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.071 -6.579 -3.015 1.00 0.00 H new ATOM 0 HD22 LEU A 57 4.609 -4.885 -3.093 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.525 -5.415 -1.785 1.00 0.00 H new ATOM 869 N ILE A 58 -0.704 -4.881 -5.195 1.00 0.00 N ATOM 870 CA ILE A 58 -1.594 -6.025 -5.349 1.00 0.00 C ATOM 871 C ILE A 58 -0.899 -7.168 -6.081 1.00 0.00 C ATOM 872 O ILE A 58 -0.503 -7.028 -7.239 1.00 0.00 O ATOM 873 CB ILE A 58 -2.875 -5.644 -6.114 1.00 0.00 C ATOM 874 CG1 ILE A 58 -3.630 -4.540 -5.371 1.00 0.00 C ATOM 875 CG2 ILE A 58 -3.762 -6.865 -6.304 1.00 0.00 C ATOM 876 CD1 ILE A 58 -2.925 -3.202 -5.398 1.00 0.00 C ATOM 0 H ILE A 58 -0.555 -4.345 -6.050 1.00 0.00 H new ATOM 0 HA ILE A 58 -1.864 -6.351 -4.345 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.594 -5.267 -7.098 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.621 -4.428 -5.812 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.775 -4.844 -4.334 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.663 -6.579 -6.846 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.222 -7.622 -6.872 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.038 -7.270 -5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.517 -2.468 -4.852 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -1.945 -3.298 -4.931 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.804 -2.875 -6.431 1.00 0.00 H new ATOM 888 N PHE A 59 -0.754 -8.300 -5.399 1.00 0.00 N ATOM 889 CA PHE A 59 -0.108 -9.468 -5.985 1.00 0.00 C ATOM 890 C PHE A 59 -0.638 -10.754 -5.360 1.00 0.00 C ATOM 891 O PHE A 59 -0.907 -10.807 -4.160 1.00 0.00 O ATOM 892 CB PHE A 59 1.409 -9.385 -5.799 1.00 0.00 C ATOM 893 CG PHE A 59 1.858 -9.680 -4.397 1.00 0.00 C ATOM 894 CD1 PHE A 59 1.767 -10.964 -3.882 1.00 0.00 C ATOM 895 CD2 PHE A 59 2.371 -8.675 -3.593 1.00 0.00 C ATOM 896 CE1 PHE A 59 2.179 -11.239 -2.592 1.00 0.00 C ATOM 897 CE2 PHE A 59 2.784 -8.944 -2.302 1.00 0.00 C ATOM 898 CZ PHE A 59 2.689 -10.228 -1.801 1.00 0.00 C ATOM 0 H PHE A 59 -1.075 -8.433 -4.440 1.00 0.00 H new ATOM 0 HA PHE A 59 -0.337 -9.482 -7.051 1.00 0.00 H new ATOM 0 HB2 PHE A 59 1.890 -10.086 -6.481 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.747 -8.387 -6.078 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.370 -11.758 -4.496 1.00 0.00 H new ATOM 0 HD2 PHE A 59 2.449 -7.670 -3.980 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.102 -12.243 -2.203 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.181 -8.151 -1.685 1.00 0.00 H new ATOM 0 HZ PHE A 59 3.013 -10.441 -0.793 1.00 0.00 H new ATOM 908 N GLN A 60 -0.787 -11.788 -6.182 1.00 0.00 N ATOM 909 CA GLN A 60 -1.286 -13.074 -5.709 1.00 0.00 C ATOM 910 C GLN A 60 -0.166 -14.107 -5.657 1.00 0.00 C ATOM 911 O GLN A 60 0.304 -14.583 -6.691 1.00 0.00 O ATOM 912 CB GLN A 60 -2.413 -13.571 -6.617 1.00 0.00 C ATOM 913 CG GLN A 60 -3.779 -13.012 -6.253 1.00 0.00 C ATOM 914 CD GLN A 60 -4.767 -13.092 -7.400 1.00 0.00 C ATOM 915 OE1 GLN A 60 -4.684 -13.984 -8.245 1.00 0.00 O ATOM 916 NE2 GLN A 60 -5.709 -12.158 -7.436 1.00 0.00 N ATOM 0 H GLN A 60 -0.569 -11.760 -7.178 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.675 -12.936 -4.700 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -2.183 -13.302 -7.648 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.451 -14.659 -6.572 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -4.175 -13.560 -5.398 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.671 -11.973 -5.943 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -5.740 -11.437 -6.715 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.402 -12.161 -8.185 1.00 0.00 H new ATOM 925 N THR A 61 0.259 -14.451 -4.445 1.00 0.00 N ATOM 926 CA THR A 61 1.325 -15.427 -4.257 1.00 0.00 C ATOM 927 C THR A 61 0.758 -16.809 -3.954 1.00 0.00 C ATOM 928 O THR A 61 -0.290 -16.936 -3.322 1.00 0.00 O ATOM 929 CB THR A 61 2.272 -15.011 -3.115 1.00 0.00 C ATOM 930 OG1 THR A 61 3.329 -15.968 -2.982 1.00 0.00 O ATOM 931 CG2 THR A 61 1.516 -14.897 -1.800 1.00 0.00 C ATOM 0 H THR A 61 -0.119 -14.068 -3.579 1.00 0.00 H new ATOM 0 HA THR A 61 1.887 -15.465 -5.190 1.00 0.00 H new ATOM 0 HB THR A 61 2.694 -14.036 -3.359 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.875 -15.968 -3.796 1.00 0.00 H new ATOM 0 HG21 THR A 61 2.205 -14.602 -1.009 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.731 -14.147 -1.896 1.00 0.00 H new ATOM 0 HG23 THR A 61 1.070 -15.860 -1.552 1.00 0.00 H new ATOM 939 N ARG A 62 1.458 -17.843 -4.409 1.00 0.00 N ATOM 940 CA ARG A 62 1.024 -19.217 -4.187 1.00 0.00 C ATOM 941 C ARG A 62 2.126 -20.035 -3.520 1.00 0.00 C ATOM 942 O ARG A 62 2.112 -21.265 -3.563 1.00 0.00 O ATOM 943 CB ARG A 62 0.622 -19.868 -5.512 1.00 0.00 C ATOM 944 CG ARG A 62 1.793 -20.112 -6.450 1.00 0.00 C ATOM 945 CD ARG A 62 1.326 -20.320 -7.882 1.00 0.00 C ATOM 946 NE ARG A 62 0.591 -21.572 -8.041 1.00 0.00 N ATOM 947 CZ ARG A 62 1.176 -22.746 -8.255 1.00 0.00 C ATOM 948 NH1 ARG A 62 2.497 -22.827 -8.334 1.00 0.00 N ATOM 949 NH2 ARG A 62 0.439 -23.841 -8.389 1.00 0.00 N ATOM 0 H ARG A 62 2.328 -17.755 -4.934 1.00 0.00 H new ATOM 0 HA ARG A 62 0.160 -19.195 -3.523 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.129 -20.818 -5.306 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -0.108 -19.232 -6.013 1.00 0.00 H new ATOM 0 HG2 ARG A 62 2.476 -19.264 -6.409 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.351 -20.987 -6.117 1.00 0.00 H new ATOM 0 HD2 ARG A 62 0.691 -19.486 -8.181 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.188 -20.319 -8.548 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.427 -21.544 -7.985 1.00 0.00 H new ATOM 0 HH11 ARG A 62 3.067 -21.987 -8.230 1.00 0.00 H new ATOM 0 HH12 ARG A 62 2.944 -23.729 -8.498 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -0.577 -23.782 -8.328 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.889 -24.742 -8.553 1.00 0.00 H new ATOM 963 N ASP A 63 3.078 -19.343 -2.903 1.00 0.00 N ATOM 964 CA ASP A 63 4.187 -20.004 -2.226 1.00 0.00 C ATOM 965 C ASP A 63 3.786 -20.432 -0.818 1.00 0.00 C ATOM 966 O ASP A 63 3.717 -19.611 0.096 1.00 0.00 O ATOM 967 CB ASP A 63 5.401 -19.076 -2.164 1.00 0.00 C ATOM 968 CG ASP A 63 6.685 -19.822 -1.859 1.00 0.00 C ATOM 969 OD1 ASP A 63 6.824 -20.975 -2.316 1.00 0.00 O ATOM 970 OD2 ASP A 63 7.551 -19.252 -1.162 1.00 0.00 O ATOM 0 H ASP A 63 3.104 -18.324 -2.858 1.00 0.00 H new ATOM 0 HA ASP A 63 4.450 -20.895 -2.796 1.00 0.00 H new ATOM 0 HB2 ASP A 63 5.505 -18.554 -3.115 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.235 -18.316 -1.400 1.00 0.00 H new ATOM 975 N GLY A 64 3.522 -21.724 -0.650 1.00 0.00 N ATOM 976 CA GLY A 64 3.130 -22.239 0.649 1.00 0.00 C ATOM 977 C GLY A 64 3.835 -21.532 1.789 1.00 0.00 C ATOM 978 O GLY A 64 3.269 -21.364 2.868 1.00 0.00 O ATOM 0 H GLY A 64 3.573 -22.424 -1.391 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.052 -22.131 0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.350 -23.306 0.695 1.00 0.00 H new ATOM 982 N ASN A 65 5.075 -21.118 1.550 1.00 0.00 N ATOM 983 CA ASN A 65 5.859 -20.427 2.568 1.00 0.00 C ATOM 984 C ASN A 65 5.239 -19.075 2.908 1.00 0.00 C ATOM 985 O ASN A 65 5.112 -18.715 4.078 1.00 0.00 O ATOM 986 CB ASN A 65 7.299 -20.234 2.087 1.00 0.00 C ATOM 987 CG ASN A 65 8.133 -21.491 2.239 1.00 0.00 C ATOM 988 OD1 ASN A 65 8.876 -21.644 3.208 1.00 0.00 O ATOM 989 ND2 ASN A 65 8.012 -22.400 1.278 1.00 0.00 N ATOM 0 H ASN A 65 5.558 -21.249 0.661 1.00 0.00 H new ATOM 0 HA ASN A 65 5.862 -21.041 3.468 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.292 -19.931 1.040 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.762 -19.424 2.651 1.00 0.00 H new ATOM 0 HD21 ASN A 65 8.547 -23.267 1.326 1.00 0.00 H new ATOM 0 HD22 ASN A 65 7.384 -22.231 0.492 1.00 0.00 H new ATOM 996 N PHE A 66 4.853 -18.331 1.876 1.00 0.00 N ATOM 997 CA PHE A 66 4.246 -17.019 2.065 1.00 0.00 C ATOM 998 C PHE A 66 2.781 -17.150 2.468 1.00 0.00 C ATOM 999 O PHE A 66 2.278 -16.378 3.286 1.00 0.00 O ATOM 1000 CB PHE A 66 4.362 -16.191 0.783 1.00 0.00 C ATOM 1001 CG PHE A 66 3.929 -14.763 0.951 1.00 0.00 C ATOM 1002 CD1 PHE A 66 2.592 -14.446 1.128 1.00 0.00 C ATOM 1003 CD2 PHE A 66 4.860 -13.736 0.933 1.00 0.00 C ATOM 1004 CE1 PHE A 66 2.191 -13.132 1.282 1.00 0.00 C ATOM 1005 CE2 PHE A 66 4.465 -12.421 1.087 1.00 0.00 C ATOM 1006 CZ PHE A 66 3.129 -12.119 1.263 1.00 0.00 C ATOM 0 H PHE A 66 4.950 -18.615 0.901 1.00 0.00 H new ATOM 0 HA PHE A 66 4.781 -16.511 2.868 1.00 0.00 H new ATOM 0 HB2 PHE A 66 5.396 -16.211 0.440 1.00 0.00 H new ATOM 0 HB3 PHE A 66 3.758 -16.656 0.004 1.00 0.00 H new ATOM 0 HD1 PHE A 66 1.854 -15.235 1.146 1.00 0.00 H new ATOM 0 HD2 PHE A 66 5.906 -13.967 0.797 1.00 0.00 H new ATOM 0 HE1 PHE A 66 1.145 -12.898 1.417 1.00 0.00 H new ATOM 0 HE2 PHE A 66 5.200 -11.630 1.070 1.00 0.00 H new ATOM 0 HZ PHE A 66 2.818 -11.092 1.386 1.00 0.00 H new ATOM 1016 N LEU A 67 2.100 -18.133 1.890 1.00 0.00 N ATOM 1017 CA LEU A 67 0.691 -18.367 2.188 1.00 0.00 C ATOM 1018 C LEU A 67 0.512 -18.857 3.621 1.00 0.00 C ATOM 1019 O LEU A 67 -0.292 -18.312 4.377 1.00 0.00 O ATOM 1020 CB LEU A 67 0.106 -19.389 1.211 1.00 0.00 C ATOM 1021 CG LEU A 67 -0.240 -18.863 -0.183 1.00 0.00 C ATOM 1022 CD1 LEU A 67 -0.945 -19.936 -0.998 1.00 0.00 C ATOM 1023 CD2 LEU A 67 -1.102 -17.613 -0.083 1.00 0.00 C ATOM 0 H LEU A 67 2.501 -18.781 1.212 1.00 0.00 H new ATOM 0 HA LEU A 67 0.160 -17.422 2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.818 -20.207 1.102 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.797 -19.809 1.653 1.00 0.00 H new ATOM 0 HG LEU A 67 0.687 -18.600 -0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.184 -19.544 -1.987 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.293 -20.803 -1.099 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.865 -20.231 -0.493 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.338 -17.253 -1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.026 -17.849 0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.560 -16.840 0.462 1.00 0.00 H new ATOM 1035 N ARG A 68 1.267 -19.886 3.988 1.00 0.00 N ATOM 1036 CA ARG A 68 1.193 -20.448 5.331 1.00 0.00 C ATOM 1037 C ARG A 68 1.099 -19.343 6.379 1.00 0.00 C ATOM 1038 O ARG A 68 0.350 -19.455 7.351 1.00 0.00 O ATOM 1039 CB ARG A 68 2.414 -21.327 5.609 1.00 0.00 C ATOM 1040 CG ARG A 68 2.216 -22.784 5.227 1.00 0.00 C ATOM 1041 CD ARG A 68 3.259 -23.678 5.879 1.00 0.00 C ATOM 1042 NE ARG A 68 2.874 -25.086 5.841 1.00 0.00 N ATOM 1043 CZ ARG A 68 3.382 -26.010 6.649 1.00 0.00 C ATOM 1044 NH1 ARG A 68 4.292 -25.675 7.554 1.00 0.00 N ATOM 1045 NH2 ARG A 68 2.981 -27.271 6.553 1.00 0.00 N ATOM 0 H ARG A 68 1.938 -20.348 3.374 1.00 0.00 H new ATOM 0 HA ARG A 68 0.293 -21.060 5.391 1.00 0.00 H new ATOM 0 HB2 ARG A 68 3.269 -20.930 5.062 1.00 0.00 H new ATOM 0 HB3 ARG A 68 2.659 -21.268 6.669 1.00 0.00 H new ATOM 0 HG2 ARG A 68 1.219 -23.108 5.527 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.272 -22.888 4.143 1.00 0.00 H new ATOM 0 HD2 ARG A 68 4.215 -23.550 5.371 1.00 0.00 H new ATOM 0 HD3 ARG A 68 3.404 -23.370 6.914 1.00 0.00 H new ATOM 0 HE ARG A 68 2.176 -25.376 5.156 1.00 0.00 H new ATOM 0 HH11 ARG A 68 4.603 -24.707 7.630 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.681 -26.386 8.174 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.282 -27.532 5.858 1.00 0.00 H new ATOM 0 HH22 ARG A 68 3.372 -27.979 7.174 1.00 0.00 H new ATOM 1059 N LEU A 69 1.864 -18.276 6.175 1.00 0.00 N ATOM 1060 CA LEU A 69 1.869 -17.150 7.102 1.00 0.00 C ATOM 1061 C LEU A 69 0.468 -16.566 7.257 1.00 0.00 C ATOM 1062 O LEU A 69 0.057 -16.195 8.357 1.00 0.00 O ATOM 1063 CB LEU A 69 2.834 -16.067 6.615 1.00 0.00 C ATOM 1064 CG LEU A 69 4.184 -16.558 6.092 1.00 0.00 C ATOM 1065 CD1 LEU A 69 5.039 -15.384 5.639 1.00 0.00 C ATOM 1066 CD2 LEU A 69 4.907 -17.368 7.158 1.00 0.00 C ATOM 0 H LEU A 69 2.489 -18.167 5.376 1.00 0.00 H new ATOM 0 HA LEU A 69 2.201 -17.513 8.074 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.344 -15.501 5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.015 -15.374 7.436 1.00 0.00 H new ATOM 0 HG LEU A 69 4.006 -17.205 5.233 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.996 -15.752 5.270 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.525 -14.846 4.842 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.209 -14.712 6.480 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.866 -17.709 6.768 1.00 0.00 H new ATOM 0 HD22 LEU A 69 5.074 -16.746 8.037 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.300 -18.230 7.434 1.00 0.00 H new ATOM 1078 N HIS A 70 -0.262 -16.491 6.149 1.00 0.00 N ATOM 1079 CA HIS A 70 -1.618 -15.955 6.161 1.00 0.00 C ATOM 1080 C HIS A 70 -2.646 -17.076 6.036 1.00 0.00 C ATOM 1081 O HIS A 70 -3.032 -17.476 4.937 1.00 0.00 O ATOM 1082 CB HIS A 70 -1.803 -14.948 5.026 1.00 0.00 C ATOM 1083 CG HIS A 70 -0.826 -13.814 5.066 1.00 0.00 C ATOM 1084 ND1 HIS A 70 -1.177 -12.530 5.426 1.00 0.00 N ATOM 1085 CD2 HIS A 70 0.499 -13.777 4.791 1.00 0.00 C ATOM 1086 CE1 HIS A 70 -0.111 -11.752 5.369 1.00 0.00 C ATOM 1087 NE2 HIS A 70 0.919 -12.484 4.986 1.00 0.00 N ATOM 0 H HIS A 70 0.063 -16.795 5.231 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.773 -15.448 7.113 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -1.706 -15.466 4.072 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.815 -14.546 5.069 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.112 -14.609 4.477 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.086 -10.697 5.597 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.872 -12.144 4.856 1.00 0.00 H new ATOM 1096 N PRO A 71 -3.100 -17.595 7.186 1.00 0.00 N ATOM 1097 CA PRO A 71 -4.088 -18.677 7.231 1.00 0.00 C ATOM 1098 C PRO A 71 -5.471 -18.218 6.779 1.00 0.00 C ATOM 1099 O PRO A 71 -5.858 -17.072 7.001 1.00 0.00 O ATOM 1100 CB PRO A 71 -4.113 -19.074 8.709 1.00 0.00 C ATOM 1101 CG PRO A 71 -3.669 -17.852 9.437 1.00 0.00 C ATOM 1102 CD PRO A 71 -2.683 -17.166 8.532 1.00 0.00 C ATOM 0 HA PRO A 71 -3.827 -19.496 6.560 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -5.112 -19.379 9.020 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -3.448 -19.915 8.904 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -4.515 -17.201 9.658 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.209 -18.111 10.390 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.725 -16.082 8.639 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.659 -17.468 8.751 1.00 0.00 H new ATOM 1110 N GLY A 72 -6.211 -19.122 6.144 1.00 0.00 N ATOM 1111 CA GLY A 72 -7.542 -18.790 5.671 1.00 0.00 C ATOM 1112 C GLY A 72 -7.551 -18.360 4.218 1.00 0.00 C ATOM 1113 O GLY A 72 -8.594 -18.385 3.562 1.00 0.00 O ATOM 0 H GLY A 72 -5.913 -20.078 5.949 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.194 -19.655 5.795 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -7.954 -17.990 6.286 1.00 0.00 H new ATOM 1117 N CYS A 73 -6.389 -17.962 3.713 1.00 0.00 N ATOM 1118 CA CYS A 73 -6.267 -17.522 2.328 1.00 0.00 C ATOM 1119 C CYS A 73 -5.552 -18.572 1.484 1.00 0.00 C ATOM 1120 O CYS A 73 -5.128 -19.608 1.993 1.00 0.00 O ATOM 1121 CB CYS A 73 -5.512 -16.193 2.258 1.00 0.00 C ATOM 1122 SG CYS A 73 -6.422 -14.790 2.946 1.00 0.00 S ATOM 0 H CYS A 73 -5.517 -17.935 4.242 1.00 0.00 H new ATOM 0 HA CYS A 73 -7.271 -17.383 1.927 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -4.567 -16.296 2.791 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -5.269 -15.980 1.217 1.00 0.00 H new ATOM 0 HG CYS A 73 -5.606 -14.029 3.614 1.00 0.00 H new ATOM 1128 N GLY A 74 -5.423 -18.297 0.189 1.00 0.00 N ATOM 1129 CA GLY A 74 -4.761 -19.228 -0.705 1.00 0.00 C ATOM 1130 C GLY A 74 -4.063 -18.531 -1.855 1.00 0.00 C ATOM 1131 O GLY A 74 -3.823 -17.323 -1.824 1.00 0.00 O ATOM 0 H GLY A 74 -5.766 -17.446 -0.256 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -4.033 -19.812 -0.142 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -5.494 -19.930 -1.101 1.00 0.00 H new ATOM 1135 N PRO A 75 -3.723 -19.300 -2.900 1.00 0.00 N ATOM 1136 CA PRO A 75 -3.042 -18.769 -4.085 1.00 0.00 C ATOM 1137 C PRO A 75 -3.946 -17.867 -4.918 1.00 0.00 C ATOM 1138 O PRO A 75 -3.483 -16.908 -5.536 1.00 0.00 O ATOM 1139 CB PRO A 75 -2.671 -20.028 -4.874 1.00 0.00 C ATOM 1140 CG PRO A 75 -3.665 -21.051 -4.445 1.00 0.00 C ATOM 1141 CD PRO A 75 -3.978 -20.746 -3.006 1.00 0.00 C ATOM 0 HA PRO A 75 -2.187 -18.147 -3.819 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.723 -19.852 -5.948 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.653 -20.348 -4.653 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.564 -21.003 -5.059 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -3.260 -22.057 -4.552 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -5.011 -20.991 -2.759 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.344 -21.317 -2.327 1.00 0.00 H new ATOM 1149 N HIS A 76 -5.238 -18.179 -4.929 1.00 0.00 N ATOM 1150 CA HIS A 76 -6.208 -17.395 -5.686 1.00 0.00 C ATOM 1151 C HIS A 76 -6.754 -16.247 -4.843 1.00 0.00 C ATOM 1152 O HIS A 76 -7.739 -15.605 -5.211 1.00 0.00 O ATOM 1153 CB HIS A 76 -7.356 -18.285 -6.162 1.00 0.00 C ATOM 1154 CG HIS A 76 -7.646 -19.431 -5.242 1.00 0.00 C ATOM 1155 ND1 HIS A 76 -7.667 -19.308 -3.869 1.00 0.00 N ATOM 1156 CD2 HIS A 76 -7.929 -20.728 -5.506 1.00 0.00 C ATOM 1157 CE1 HIS A 76 -7.949 -20.479 -3.328 1.00 0.00 C ATOM 1158 NE2 HIS A 76 -8.113 -21.358 -4.299 1.00 0.00 N ATOM 0 H HIS A 76 -5.638 -18.969 -4.422 1.00 0.00 H new ATOM 0 HA HIS A 76 -5.700 -16.976 -6.555 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -8.255 -17.678 -6.268 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -7.116 -18.675 -7.151 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -7.997 -21.183 -6.483 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -8.031 -20.683 -2.271 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -8.340 -22.345 -4.174 1.00 0.00 H new ATOM 1167 N THR A 77 -6.110 -15.993 -3.708 1.00 0.00 N ATOM 1168 CA THR A 77 -6.532 -14.925 -2.811 1.00 0.00 C ATOM 1169 C THR A 77 -5.762 -13.639 -3.087 1.00 0.00 C ATOM 1170 O THR A 77 -4.535 -13.604 -2.989 1.00 0.00 O ATOM 1171 CB THR A 77 -6.337 -15.320 -1.335 1.00 0.00 C ATOM 1172 OG1 THR A 77 -7.122 -16.478 -1.030 1.00 0.00 O ATOM 1173 CG2 THR A 77 -6.732 -14.177 -0.412 1.00 0.00 C ATOM 0 H THR A 77 -5.293 -16.513 -3.388 1.00 0.00 H new ATOM 0 HA THR A 77 -7.593 -14.757 -2.997 1.00 0.00 H new ATOM 0 HB THR A 77 -5.282 -15.545 -1.179 1.00 0.00 H new ATOM 0 HG1 THR A 77 -7.387 -16.455 -0.087 1.00 0.00 H new ATOM 0 HG21 THR A 77 -6.586 -14.480 0.625 1.00 0.00 H new ATOM 0 HG22 THR A 77 -6.113 -13.306 -0.627 1.00 0.00 H new ATOM 0 HG23 THR A 77 -7.780 -13.926 -0.572 1.00 0.00 H new ATOM 1181 N THR A 78 -6.489 -12.581 -3.433 1.00 0.00 N ATOM 1182 CA THR A 78 -5.874 -11.292 -3.724 1.00 0.00 C ATOM 1183 C THR A 78 -5.330 -10.644 -2.456 1.00 0.00 C ATOM 1184 O THR A 78 -5.997 -10.626 -1.421 1.00 0.00 O ATOM 1185 CB THR A 78 -6.875 -10.330 -4.390 1.00 0.00 C ATOM 1186 OG1 THR A 78 -7.700 -11.045 -5.317 1.00 0.00 O ATOM 1187 CG2 THR A 78 -6.147 -9.207 -5.113 1.00 0.00 C ATOM 0 H THR A 78 -7.505 -12.592 -3.519 1.00 0.00 H new ATOM 0 HA THR A 78 -5.051 -11.482 -4.413 1.00 0.00 H new ATOM 0 HB THR A 78 -7.500 -9.894 -3.610 1.00 0.00 H new ATOM 0 HG1 THR A 78 -8.099 -10.415 -5.953 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.875 -8.540 -5.576 1.00 0.00 H new ATOM 0 HG22 THR A 78 -5.543 -8.646 -4.400 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.501 -9.629 -5.883 1.00 0.00 H new ATOM 1195 N PHE A 79 -4.115 -10.112 -2.544 1.00 0.00 N ATOM 1196 CA PHE A 79 -3.481 -9.463 -1.402 1.00 0.00 C ATOM 1197 C PHE A 79 -3.184 -7.997 -1.707 1.00 0.00 C ATOM 1198 O PHE A 79 -2.404 -7.685 -2.607 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.189 -10.190 -1.028 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.412 -11.585 -0.517 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -3.390 -11.842 0.430 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -1.645 -12.639 -0.985 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -3.598 -13.124 0.902 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -1.848 -13.924 -0.517 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.826 -14.167 0.427 1.00 0.00 C ATOM 0 H PHE A 79 -3.550 -10.118 -3.393 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.171 -9.508 -0.560 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -1.539 -10.231 -1.902 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.664 -9.613 -0.267 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.997 -11.031 0.804 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.879 -12.455 -1.724 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.363 -13.311 1.641 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.242 -14.737 -0.889 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.987 -15.170 0.793 1.00 0.00 H new ATOM 1215 N ARG A 80 -3.811 -7.103 -0.950 1.00 0.00 N ATOM 1216 CA ARG A 80 -3.615 -5.670 -1.140 1.00 0.00 C ATOM 1217 C ARG A 80 -2.795 -5.078 0.003 1.00 0.00 C ATOM 1218 O ARG A 80 -3.252 -5.024 1.145 1.00 0.00 O ATOM 1219 CB ARG A 80 -4.965 -4.958 -1.236 1.00 0.00 C ATOM 1220 CG ARG A 80 -4.887 -3.591 -1.895 1.00 0.00 C ATOM 1221 CD ARG A 80 -6.178 -3.248 -2.622 1.00 0.00 C ATOM 1222 NE ARG A 80 -6.192 -1.865 -3.090 1.00 0.00 N ATOM 1223 CZ ARG A 80 -6.981 -1.427 -4.065 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -7.816 -2.259 -4.671 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -6.936 -0.153 -4.435 1.00 0.00 N ATOM 0 H ARG A 80 -4.459 -7.345 -0.200 1.00 0.00 H new ATOM 0 HA ARG A 80 -3.068 -5.523 -2.071 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -5.657 -5.584 -1.799 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -5.379 -4.846 -0.234 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -4.681 -2.833 -1.139 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -4.056 -3.573 -2.600 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -6.305 -3.919 -3.471 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -7.024 -3.414 -1.955 1.00 0.00 H new ATOM 0 HE ARG A 80 -5.562 -1.199 -2.644 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -7.854 -3.239 -4.389 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -8.421 -1.920 -5.419 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -6.295 0.491 -3.971 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -7.542 0.182 -5.184 1.00 0.00 H new ATOM 1239 N TRP A 81 -1.583 -4.636 -0.313 1.00 0.00 N ATOM 1240 CA TRP A 81 -0.700 -4.048 0.688 1.00 0.00 C ATOM 1241 C TRP A 81 -0.664 -2.529 0.557 1.00 0.00 C ATOM 1242 O TRP A 81 0.015 -1.989 -0.316 1.00 0.00 O ATOM 1243 CB TRP A 81 0.713 -4.618 0.548 1.00 0.00 C ATOM 1244 CG TRP A 81 1.569 -4.387 1.756 1.00 0.00 C ATOM 1245 CD1 TRP A 81 1.159 -4.363 3.059 1.00 0.00 C ATOM 1246 CD2 TRP A 81 2.980 -4.144 1.774 1.00 0.00 C ATOM 1247 NE1 TRP A 81 2.230 -4.121 3.885 1.00 0.00 N ATOM 1248 CE2 TRP A 81 3.359 -3.984 3.121 1.00 0.00 C ATOM 1249 CE3 TRP A 81 3.961 -4.049 0.783 1.00 0.00 C ATOM 1250 CZ2 TRP A 81 4.675 -3.733 3.499 1.00 0.00 C ATOM 1251 CZ3 TRP A 81 5.266 -3.800 1.160 1.00 0.00 C ATOM 1252 CH2 TRP A 81 5.614 -3.645 2.508 1.00 0.00 C ATOM 0 H TRP A 81 -1.190 -4.673 -1.253 1.00 0.00 H new ATOM 0 HA TRP A 81 -1.090 -4.300 1.674 1.00 0.00 H new ATOM 0 HB2 TRP A 81 0.648 -5.689 0.357 1.00 0.00 H new ATOM 0 HB3 TRP A 81 1.194 -4.168 -0.321 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.142 -4.512 3.391 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.191 -4.054 4.902 1.00 0.00 H new ATOM 0 HE3 TRP A 81 3.703 -4.168 -0.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 4.945 -3.612 4.538 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 6.032 -3.723 0.402 1.00 0.00 H new ATOM 0 HH2 TRP A 81 6.644 -3.452 2.770 1.00 0.00 H new ATOM 1263 N GLN A 82 -1.398 -1.847 1.430 1.00 0.00 N ATOM 1264 CA GLN A 82 -1.450 -0.390 1.410 1.00 0.00 C ATOM 1265 C GLN A 82 -0.548 0.201 2.489 1.00 0.00 C ATOM 1266 O GLN A 82 -0.696 -0.104 3.672 1.00 0.00 O ATOM 1267 CB GLN A 82 -2.887 0.093 1.610 1.00 0.00 C ATOM 1268 CG GLN A 82 -3.084 1.566 1.290 1.00 0.00 C ATOM 1269 CD GLN A 82 -4.509 2.029 1.521 1.00 0.00 C ATOM 1270 OE1 GLN A 82 -4.880 2.402 2.635 1.00 0.00 O ATOM 1271 NE2 GLN A 82 -5.317 2.007 0.468 1.00 0.00 N ATOM 0 H GLN A 82 -1.965 -2.280 2.160 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.093 -0.052 0.437 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.551 -0.499 0.980 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.182 -0.088 2.644 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -2.409 2.161 1.905 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -2.811 1.747 0.250 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -4.968 1.690 -0.436 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.287 2.307 0.563 1.00 0.00 H new ATOM 1280 N VAL A 83 0.387 1.048 2.072 1.00 0.00 N ATOM 1281 CA VAL A 83 1.313 1.683 3.003 1.00 0.00 C ATOM 1282 C VAL A 83 1.082 3.189 3.066 1.00 0.00 C ATOM 1283 O VAL A 83 0.904 3.845 2.040 1.00 0.00 O ATOM 1284 CB VAL A 83 2.778 1.415 2.608 1.00 0.00 C ATOM 1285 CG1 VAL A 83 3.726 2.115 3.569 1.00 0.00 C ATOM 1286 CG2 VAL A 83 3.053 -0.080 2.568 1.00 0.00 C ATOM 0 H VAL A 83 0.524 1.311 1.096 1.00 0.00 H new ATOM 0 HA VAL A 83 1.124 1.248 3.984 1.00 0.00 H new ATOM 0 HB VAL A 83 2.948 1.819 1.610 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.756 1.915 3.275 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.543 3.189 3.542 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.559 1.744 4.580 1.00 0.00 H new ATOM 0 HG21 VAL A 83 4.092 -0.251 2.287 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.867 -0.511 3.552 1.00 0.00 H new ATOM 0 HG23 VAL A 83 2.397 -0.551 1.836 1.00 0.00 H new ATOM 1296 N LYS A 84 1.088 3.732 4.279 1.00 0.00 N ATOM 1297 CA LYS A 84 0.881 5.161 4.479 1.00 0.00 C ATOM 1298 C LYS A 84 2.214 5.889 4.625 1.00 0.00 C ATOM 1299 O LYS A 84 2.878 5.787 5.657 1.00 0.00 O ATOM 1300 CB LYS A 84 0.017 5.405 5.718 1.00 0.00 C ATOM 1301 CG LYS A 84 -0.798 6.685 5.650 1.00 0.00 C ATOM 1302 CD LYS A 84 -1.997 6.633 6.582 1.00 0.00 C ATOM 1303 CE LYS A 84 -1.581 6.807 8.035 1.00 0.00 C ATOM 1304 NZ LYS A 84 -1.249 5.505 8.677 1.00 0.00 N ATOM 0 H LYS A 84 1.234 3.203 5.139 1.00 0.00 H new ATOM 0 HA LYS A 84 0.366 5.553 3.602 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.659 4.561 5.851 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.660 5.440 6.598 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.167 7.534 5.914 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.138 6.847 4.627 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.706 7.415 6.309 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.512 5.680 6.461 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.717 7.469 8.088 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.387 7.290 8.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.269 5.613 9.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.946 4.789 8.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -0.299 5.203 8.379 1.00 0.00 H new ATOM 1318 N LEU A 85 2.599 6.623 3.586 1.00 0.00 N ATOM 1319 CA LEU A 85 3.852 7.369 3.600 1.00 0.00 C ATOM 1320 C LEU A 85 3.686 8.700 4.325 1.00 0.00 C ATOM 1321 O LEU A 85 2.972 9.588 3.858 1.00 0.00 O ATOM 1322 CB LEU A 85 4.340 7.611 2.170 1.00 0.00 C ATOM 1323 CG LEU A 85 4.218 6.428 1.210 1.00 0.00 C ATOM 1324 CD1 LEU A 85 4.164 6.912 -0.231 1.00 0.00 C ATOM 1325 CD2 LEU A 85 5.377 5.461 1.406 1.00 0.00 C ATOM 0 H LEU A 85 2.062 6.717 2.724 1.00 0.00 H new ATOM 0 HA LEU A 85 4.593 6.776 4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.782 8.450 1.754 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.386 7.914 2.211 1.00 0.00 H new ATOM 0 HG LEU A 85 3.289 5.901 1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 85 4.077 6.055 -0.900 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.301 7.565 -0.364 1.00 0.00 H new ATOM 0 HD13 LEU A 85 5.075 7.463 -0.464 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.274 4.625 0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.318 5.977 1.214 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.370 5.088 2.430 1.00 0.00 H new ATOM 1337 N ARG A 86 4.351 8.833 5.468 1.00 0.00 N ATOM 1338 CA ARG A 86 4.277 10.057 6.257 1.00 0.00 C ATOM 1339 C ARG A 86 4.348 11.288 5.359 1.00 0.00 C ATOM 1340 O ARG A 86 3.454 12.133 5.376 1.00 0.00 O ATOM 1341 CB ARG A 86 5.411 10.096 7.284 1.00 0.00 C ATOM 1342 CG ARG A 86 5.163 9.216 8.498 1.00 0.00 C ATOM 1343 CD ARG A 86 4.435 9.974 9.597 1.00 0.00 C ATOM 1344 NE ARG A 86 3.026 10.184 9.275 1.00 0.00 N ATOM 1345 CZ ARG A 86 2.246 11.047 9.917 1.00 0.00 C ATOM 1346 NH1 ARG A 86 2.736 11.777 10.909 1.00 0.00 N ATOM 1347 NH2 ARG A 86 0.973 11.182 9.566 1.00 0.00 N ATOM 0 H ARG A 86 4.947 8.108 5.868 1.00 0.00 H new ATOM 0 HA ARG A 86 3.321 10.065 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.337 9.783 6.802 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.555 11.125 7.615 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.576 8.346 8.204 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.114 8.844 8.880 1.00 0.00 H new ATOM 0 HD2 ARG A 86 4.515 9.421 10.533 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.919 10.938 9.754 1.00 0.00 H new ATOM 0 HE ARG A 86 2.618 9.638 8.516 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.714 11.677 11.181 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.135 12.439 11.400 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.592 10.623 8.803 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.375 11.845 10.060 1.00 0.00 H new ATOM 1361 N ASN A 87 5.417 11.382 4.575 1.00 0.00 N ATOM 1362 CA ASN A 87 5.605 12.511 3.671 1.00 0.00 C ATOM 1363 C ASN A 87 5.056 12.193 2.284 1.00 0.00 C ATOM 1364 O ASN A 87 4.667 11.059 2.002 1.00 0.00 O ATOM 1365 CB ASN A 87 7.089 12.872 3.574 1.00 0.00 C ATOM 1366 CG ASN A 87 7.311 14.249 2.979 1.00 0.00 C ATOM 1367 OD1 ASN A 87 7.010 15.264 3.607 1.00 0.00 O ATOM 1368 ND2 ASN A 87 7.839 14.289 1.762 1.00 0.00 N ATOM 0 H ASN A 87 6.166 10.690 4.547 1.00 0.00 H new ATOM 0 HA ASN A 87 5.057 13.363 4.074 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.536 12.832 4.568 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.602 12.128 2.964 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.011 15.187 1.310 1.00 0.00 H new ATOM 0 HD22 ASN A 87 8.073 13.422 1.279 1.00 0.00 H new ATOM 1375 N LEU A 88 5.026 13.202 1.420 1.00 0.00 N ATOM 1376 CA LEU A 88 4.525 13.032 0.061 1.00 0.00 C ATOM 1377 C LEU A 88 5.562 12.341 -0.819 1.00 0.00 C ATOM 1378 O LEU A 88 6.706 12.142 -0.408 1.00 0.00 O ATOM 1379 CB LEU A 88 4.152 14.388 -0.540 1.00 0.00 C ATOM 1380 CG LEU A 88 2.835 14.997 -0.056 1.00 0.00 C ATOM 1381 CD1 LEU A 88 2.608 16.356 -0.699 1.00 0.00 C ATOM 1382 CD2 LEU A 88 1.673 14.062 -0.357 1.00 0.00 C ATOM 0 H LEU A 88 5.343 14.147 1.637 1.00 0.00 H new ATOM 0 HA LEU A 88 3.635 12.404 0.104 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.956 15.092 -0.324 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.104 14.282 -1.624 1.00 0.00 H new ATOM 0 HG LEU A 88 2.895 15.134 1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.666 16.774 -0.343 1.00 0.00 H new ATOM 0 HD12 LEU A 88 3.426 17.026 -0.433 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.569 16.244 -1.782 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.744 14.511 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.611 13.893 -1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.831 13.111 0.151 1.00 0.00 H new ATOM 1394 N ILE A 89 5.155 11.979 -2.031 1.00 0.00 N ATOM 1395 CA ILE A 89 6.050 11.313 -2.970 1.00 0.00 C ATOM 1396 C ILE A 89 5.587 11.516 -4.409 1.00 0.00 C ATOM 1397 O ILE A 89 4.493 12.025 -4.653 1.00 0.00 O ATOM 1398 CB ILE A 89 6.146 9.803 -2.682 1.00 0.00 C ATOM 1399 CG1 ILE A 89 4.792 9.130 -2.911 1.00 0.00 C ATOM 1400 CG2 ILE A 89 6.627 9.566 -1.258 1.00 0.00 C ATOM 1401 CD1 ILE A 89 4.901 7.697 -3.381 1.00 0.00 C ATOM 0 H ILE A 89 4.212 12.136 -2.386 1.00 0.00 H new ATOM 0 HA ILE A 89 7.034 11.763 -2.840 1.00 0.00 H new ATOM 0 HB ILE A 89 6.869 9.363 -3.368 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.221 9.157 -1.983 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.230 9.704 -3.648 1.00 0.00 H new ATOM 0 HG21 ILE A 89 6.690 8.494 -1.069 1.00 0.00 H new ATOM 0 HG22 ILE A 89 7.611 10.016 -1.127 1.00 0.00 H new ATOM 0 HG23 ILE A 89 5.925 10.018 -0.557 1.00 0.00 H new ATOM 0 HD11 ILE A 89 3.902 7.284 -3.523 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.445 7.664 -4.325 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.435 7.109 -2.634 1.00 0.00 H new ATOM 1413 N GLU A 90 6.427 11.113 -5.357 1.00 0.00 N ATOM 1414 CA GLU A 90 6.102 11.250 -6.772 1.00 0.00 C ATOM 1415 C GLU A 90 5.926 9.882 -7.425 1.00 0.00 C ATOM 1416 O GLU A 90 6.891 9.215 -7.798 1.00 0.00 O ATOM 1417 CB GLU A 90 7.198 12.035 -7.496 1.00 0.00 C ATOM 1418 CG GLU A 90 7.006 13.541 -7.440 1.00 0.00 C ATOM 1419 CD GLU A 90 8.272 14.304 -7.781 1.00 0.00 C ATOM 1420 OE1 GLU A 90 8.956 13.916 -8.750 1.00 0.00 O ATOM 1421 OE2 GLU A 90 8.578 15.289 -7.076 1.00 0.00 O ATOM 0 H GLU A 90 7.336 10.690 -5.171 1.00 0.00 H new ATOM 0 HA GLU A 90 5.161 11.795 -6.851 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.164 11.784 -7.057 1.00 0.00 H new ATOM 0 HB3 GLU A 90 7.230 11.720 -8.539 1.00 0.00 H new ATOM 0 HG2 GLU A 90 6.215 13.829 -8.133 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.673 13.824 -6.441 1.00 0.00 H new ATOM 1428 N PRO A 91 4.663 9.453 -7.566 1.00 0.00 N ATOM 1429 CA PRO A 91 4.329 8.162 -8.174 1.00 0.00 C ATOM 1430 C PRO A 91 4.609 8.136 -9.672 1.00 0.00 C ATOM 1431 O PRO A 91 4.617 7.074 -10.293 1.00 0.00 O ATOM 1432 CB PRO A 91 2.828 8.022 -7.908 1.00 0.00 C ATOM 1433 CG PRO A 91 2.336 9.421 -7.768 1.00 0.00 C ATOM 1434 CD PRO A 91 3.463 10.196 -7.144 1.00 0.00 C ATOM 0 HA PRO A 91 4.927 7.350 -7.760 1.00 0.00 H new ATOM 0 HB2 PRO A 91 2.327 7.506 -8.727 1.00 0.00 H new ATOM 0 HB3 PRO A 91 2.638 7.443 -7.004 1.00 0.00 H new ATOM 0 HG2 PRO A 91 2.066 9.838 -8.738 1.00 0.00 H new ATOM 0 HG3 PRO A 91 1.443 9.460 -7.144 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.485 11.227 -7.496 1.00 0.00 H new ATOM 0 HD3 PRO A 91 3.373 10.231 -6.058 1.00 0.00 H new ATOM 1442 N GLU A 92 4.837 9.313 -10.247 1.00 0.00 N ATOM 1443 CA GLU A 92 5.117 9.424 -11.674 1.00 0.00 C ATOM 1444 C GLU A 92 6.485 8.835 -12.007 1.00 0.00 C ATOM 1445 O GLU A 92 6.775 8.529 -13.163 1.00 0.00 O ATOM 1446 CB GLU A 92 5.059 10.887 -12.116 1.00 0.00 C ATOM 1447 CG GLU A 92 3.666 11.349 -12.509 1.00 0.00 C ATOM 1448 CD GLU A 92 3.385 11.164 -13.987 1.00 0.00 C ATOM 1449 OE1 GLU A 92 4.177 11.670 -14.810 1.00 0.00 O ATOM 1450 OE2 GLU A 92 2.374 10.512 -14.321 1.00 0.00 O ATOM 0 H GLU A 92 4.833 10.202 -9.747 1.00 0.00 H new ATOM 0 HA GLU A 92 4.356 8.859 -12.212 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.427 11.517 -11.306 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.732 11.029 -12.962 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.927 10.795 -11.930 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.550 12.401 -12.250 1.00 0.00 H new ATOM 1457 N GLN A 93 7.321 8.680 -10.986 1.00 0.00 N ATOM 1458 CA GLN A 93 8.659 8.130 -11.170 1.00 0.00 C ATOM 1459 C GLN A 93 8.755 6.726 -10.583 1.00 0.00 C ATOM 1460 O GLN A 93 9.590 5.923 -11.002 1.00 0.00 O ATOM 1461 CB GLN A 93 9.702 9.040 -10.521 1.00 0.00 C ATOM 1462 CG GLN A 93 9.276 10.497 -10.445 1.00 0.00 C ATOM 1463 CD GLN A 93 8.475 10.935 -11.656 1.00 0.00 C ATOM 1464 OE1 GLN A 93 8.600 10.360 -12.738 1.00 0.00 O ATOM 1465 NE2 GLN A 93 7.646 11.957 -11.480 1.00 0.00 N ATOM 0 H GLN A 93 7.096 8.927 -10.022 1.00 0.00 H new ATOM 0 HA GLN A 93 8.856 8.071 -12.240 1.00 0.00 H new ATOM 0 HB2 GLN A 93 9.911 8.678 -9.514 1.00 0.00 H new ATOM 0 HB3 GLN A 93 10.633 8.971 -11.084 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.680 10.651 -9.545 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.161 11.126 -10.353 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.574 12.404 -10.566 1.00 0.00 H new ATOM 0 HE22 GLN A 93 7.081 12.295 -12.259 1.00 0.00 H new ATOM 1474 N CYS A 94 7.898 6.437 -9.610 1.00 0.00 N ATOM 1475 CA CYS A 94 7.888 5.130 -8.963 1.00 0.00 C ATOM 1476 C CYS A 94 7.865 4.011 -9.999 1.00 0.00 C ATOM 1477 O CYS A 94 7.579 4.243 -11.175 1.00 0.00 O ATOM 1478 CB CYS A 94 6.679 5.006 -8.035 1.00 0.00 C ATOM 1479 SG CYS A 94 6.809 5.983 -6.519 1.00 0.00 S ATOM 0 H CYS A 94 7.201 7.090 -9.252 1.00 0.00 H new ATOM 0 HA CYS A 94 8.800 5.037 -8.374 1.00 0.00 H new ATOM 0 HB2 CYS A 94 5.785 5.314 -8.577 1.00 0.00 H new ATOM 0 HB3 CYS A 94 6.545 3.958 -7.769 1.00 0.00 H new ATOM 0 HG CYS A 94 6.875 7.246 -6.821 1.00 0.00 H new ATOM 1485 N THR A 95 8.170 2.795 -9.557 1.00 0.00 N ATOM 1486 CA THR A 95 8.188 1.640 -10.445 1.00 0.00 C ATOM 1487 C THR A 95 8.023 0.342 -9.663 1.00 0.00 C ATOM 1488 O THR A 95 8.543 0.202 -8.556 1.00 0.00 O ATOM 1489 CB THR A 95 9.496 1.575 -11.256 1.00 0.00 C ATOM 1490 OG1 THR A 95 10.620 1.528 -10.370 1.00 0.00 O ATOM 1491 CG2 THR A 95 9.621 2.778 -12.179 1.00 0.00 C ATOM 0 H THR A 95 8.408 2.585 -8.588 1.00 0.00 H new ATOM 0 HA THR A 95 7.349 1.756 -11.131 1.00 0.00 H new ATOM 0 HB THR A 95 9.476 0.671 -11.865 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.447 1.485 -10.893 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.552 2.710 -12.741 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.779 2.794 -12.872 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.621 3.693 -11.586 1.00 0.00 H new ATOM 1499 N PHE A 96 7.298 -0.607 -10.246 1.00 0.00 N ATOM 1500 CA PHE A 96 7.064 -1.895 -9.603 1.00 0.00 C ATOM 1501 C PHE A 96 7.437 -3.044 -10.536 1.00 0.00 C ATOM 1502 O PHE A 96 6.907 -3.156 -11.642 1.00 0.00 O ATOM 1503 CB PHE A 96 5.599 -2.020 -9.182 1.00 0.00 C ATOM 1504 CG PHE A 96 4.674 -2.350 -10.318 1.00 0.00 C ATOM 1505 CD1 PHE A 96 4.545 -3.654 -10.768 1.00 0.00 C ATOM 1506 CD2 PHE A 96 3.934 -1.355 -10.937 1.00 0.00 C ATOM 1507 CE1 PHE A 96 3.694 -3.961 -11.813 1.00 0.00 C ATOM 1508 CE2 PHE A 96 3.082 -1.656 -11.983 1.00 0.00 C ATOM 1509 CZ PHE A 96 2.963 -2.960 -12.422 1.00 0.00 C ATOM 0 H PHE A 96 6.862 -0.508 -11.163 1.00 0.00 H new ATOM 0 HA PHE A 96 7.695 -1.951 -8.716 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.514 -2.793 -8.418 1.00 0.00 H new ATOM 0 HB3 PHE A 96 5.280 -1.084 -8.725 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.116 -4.440 -10.297 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.024 -0.333 -10.598 1.00 0.00 H new ATOM 0 HE1 PHE A 96 3.601 -4.982 -12.153 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.510 -0.872 -12.457 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.299 -3.197 -13.240 1.00 0.00 H new ATOM 1519 N CYS A 97 8.351 -3.893 -10.082 1.00 0.00 N ATOM 1520 CA CYS A 97 8.797 -5.033 -10.875 1.00 0.00 C ATOM 1521 C CYS A 97 9.191 -6.201 -9.976 1.00 0.00 C ATOM 1522 O CYS A 97 9.975 -6.040 -9.040 1.00 0.00 O ATOM 1523 CB CYS A 97 9.978 -4.635 -11.761 1.00 0.00 C ATOM 1524 SG CYS A 97 10.210 -5.698 -13.205 1.00 0.00 S ATOM 0 H CYS A 97 8.798 -3.814 -9.169 1.00 0.00 H new ATOM 0 HA CYS A 97 7.968 -5.349 -11.508 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.835 -3.608 -12.098 1.00 0.00 H new ATOM 0 HB3 CYS A 97 10.889 -4.650 -11.162 1.00 0.00 H new ATOM 0 HG CYS A 97 11.231 -5.279 -13.892 1.00 0.00 H new ATOM 1530 N PHE A 98 8.642 -7.376 -10.265 1.00 0.00 N ATOM 1531 CA PHE A 98 8.934 -8.570 -9.481 1.00 0.00 C ATOM 1532 C PHE A 98 10.340 -9.083 -9.776 1.00 0.00 C ATOM 1533 O PHE A 98 10.888 -8.846 -10.853 1.00 0.00 O ATOM 1534 CB PHE A 98 7.907 -9.665 -9.778 1.00 0.00 C ATOM 1535 CG PHE A 98 6.485 -9.185 -9.716 1.00 0.00 C ATOM 1536 CD1 PHE A 98 5.898 -8.573 -10.812 1.00 0.00 C ATOM 1537 CD2 PHE A 98 5.735 -9.346 -8.562 1.00 0.00 C ATOM 1538 CE1 PHE A 98 4.589 -8.131 -10.758 1.00 0.00 C ATOM 1539 CE2 PHE A 98 4.426 -8.906 -8.503 1.00 0.00 C ATOM 1540 CZ PHE A 98 3.853 -8.297 -9.602 1.00 0.00 C ATOM 0 H PHE A 98 7.992 -7.527 -11.037 1.00 0.00 H new ATOM 0 HA PHE A 98 8.877 -8.304 -8.425 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.101 -10.075 -10.769 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.039 -10.479 -9.065 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.469 -8.440 -11.719 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.178 -9.821 -7.699 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.143 -7.656 -11.619 1.00 0.00 H new ATOM 0 HE2 PHE A 98 3.852 -9.038 -7.598 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.831 -7.951 -9.557 1.00 0.00 H new ATOM 1550 N THR A 99 10.921 -9.788 -8.810 1.00 0.00 N ATOM 1551 CA THR A 99 12.264 -10.333 -8.963 1.00 0.00 C ATOM 1552 C THR A 99 12.267 -11.847 -8.781 1.00 0.00 C ATOM 1553 O THR A 99 11.211 -12.472 -8.685 1.00 0.00 O ATOM 1554 CB THR A 99 13.244 -9.705 -7.955 1.00 0.00 C ATOM 1555 OG1 THR A 99 13.327 -10.518 -6.779 1.00 0.00 O ATOM 1556 CG2 THR A 99 12.803 -8.299 -7.576 1.00 0.00 C ATOM 0 H THR A 99 10.482 -9.995 -7.913 1.00 0.00 H new ATOM 0 HA THR A 99 12.590 -10.090 -9.974 1.00 0.00 H new ATOM 0 HB THR A 99 14.226 -9.647 -8.425 1.00 0.00 H new ATOM 0 HG1 THR A 99 14.181 -10.999 -6.774 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.510 -7.876 -6.863 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.770 -7.675 -8.469 1.00 0.00 H new ATOM 0 HG23 THR A 99 11.812 -8.338 -7.124 1.00 0.00 H new ATOM 1564 N ALA A 100 13.460 -12.430 -8.733 1.00 0.00 N ATOM 1565 CA ALA A 100 13.599 -13.871 -8.559 1.00 0.00 C ATOM 1566 C ALA A 100 12.630 -14.393 -7.503 1.00 0.00 C ATOM 1567 O ALA A 100 11.617 -15.011 -7.829 1.00 0.00 O ATOM 1568 CB ALA A 100 15.031 -14.221 -8.182 1.00 0.00 C ATOM 0 H ALA A 100 14.344 -11.927 -8.812 1.00 0.00 H new ATOM 0 HA ALA A 100 13.356 -14.351 -9.507 1.00 0.00 H new ATOM 0 HB1 ALA A 100 15.121 -15.300 -8.055 1.00 0.00 H new ATOM 0 HB2 ALA A 100 15.706 -13.891 -8.972 1.00 0.00 H new ATOM 0 HB3 ALA A 100 15.294 -13.723 -7.249 1.00 0.00 H new ATOM 1574 N SER A 101 12.948 -14.141 -6.238 1.00 0.00 N ATOM 1575 CA SER A 101 12.108 -14.589 -5.134 1.00 0.00 C ATOM 1576 C SER A 101 11.652 -13.408 -4.283 1.00 0.00 C ATOM 1577 O SER A 101 11.177 -13.584 -3.161 1.00 0.00 O ATOM 1578 CB SER A 101 12.864 -15.596 -4.266 1.00 0.00 C ATOM 1579 OG SER A 101 14.137 -15.095 -3.895 1.00 0.00 O ATOM 0 H SER A 101 13.782 -13.628 -5.952 1.00 0.00 H new ATOM 0 HA SER A 101 11.226 -15.072 -5.555 1.00 0.00 H new ATOM 0 HB2 SER A 101 12.282 -15.819 -3.371 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.983 -16.533 -4.810 1.00 0.00 H new ATOM 0 HG SER A 101 14.600 -15.756 -3.339 1.00 0.00 H new ATOM 1585 N ARG A 102 11.801 -12.204 -4.826 1.00 0.00 N ATOM 1586 CA ARG A 102 11.406 -10.992 -4.117 1.00 0.00 C ATOM 1587 C ARG A 102 10.862 -9.948 -5.087 1.00 0.00 C ATOM 1588 O ARG A 102 10.995 -10.087 -6.303 1.00 0.00 O ATOM 1589 CB ARG A 102 12.595 -10.417 -3.346 1.00 0.00 C ATOM 1590 CG ARG A 102 13.561 -9.628 -4.215 1.00 0.00 C ATOM 1591 CD ARG A 102 14.419 -8.689 -3.383 1.00 0.00 C ATOM 1592 NE ARG A 102 15.565 -8.183 -4.135 1.00 0.00 N ATOM 1593 CZ ARG A 102 16.589 -8.941 -4.512 1.00 0.00 C ATOM 1594 NH1 ARG A 102 16.610 -10.231 -4.208 1.00 0.00 N ATOM 1595 NH2 ARG A 102 17.594 -8.408 -5.194 1.00 0.00 N ATOM 0 H ARG A 102 12.192 -12.042 -5.754 1.00 0.00 H new ATOM 0 HA ARG A 102 10.617 -11.254 -3.412 1.00 0.00 H new ATOM 0 HB2 ARG A 102 12.223 -9.770 -2.551 1.00 0.00 H new ATOM 0 HB3 ARG A 102 13.135 -11.233 -2.866 1.00 0.00 H new ATOM 0 HG2 ARG A 102 14.202 -10.316 -4.766 1.00 0.00 H new ATOM 0 HG3 ARG A 102 13.002 -9.053 -4.953 1.00 0.00 H new ATOM 0 HD2 ARG A 102 13.812 -7.851 -3.040 1.00 0.00 H new ATOM 0 HD3 ARG A 102 14.771 -9.212 -2.494 1.00 0.00 H new ATOM 0 HE ARG A 102 15.580 -7.194 -4.384 1.00 0.00 H new ATOM 0 HH11 ARG A 102 15.839 -10.644 -3.683 1.00 0.00 H new ATOM 0 HH12 ARG A 102 17.397 -10.811 -4.499 1.00 0.00 H new ATOM 0 HH21 ARG A 102 17.581 -7.416 -5.429 1.00 0.00 H new ATOM 0 HH22 ARG A 102 18.380 -8.991 -5.483 1.00 0.00 H new ATOM 1609 N ILE A 103 10.248 -8.903 -4.541 1.00 0.00 N ATOM 1610 CA ILE A 103 9.685 -7.836 -5.358 1.00 0.00 C ATOM 1611 C ILE A 103 10.447 -6.530 -5.158 1.00 0.00 C ATOM 1612 O ILE A 103 10.847 -6.197 -4.042 1.00 0.00 O ATOM 1613 CB ILE A 103 8.197 -7.604 -5.033 1.00 0.00 C ATOM 1614 CG1 ILE A 103 7.468 -8.942 -4.895 1.00 0.00 C ATOM 1615 CG2 ILE A 103 7.547 -6.749 -6.110 1.00 0.00 C ATOM 1616 CD1 ILE A 103 6.174 -8.847 -4.117 1.00 0.00 C ATOM 0 H ILE A 103 10.128 -8.773 -3.536 1.00 0.00 H new ATOM 0 HA ILE A 103 9.777 -8.152 -6.397 1.00 0.00 H new ATOM 0 HB ILE A 103 8.126 -7.074 -4.083 1.00 0.00 H new ATOM 0 HG12 ILE A 103 7.257 -9.336 -5.889 1.00 0.00 H new ATOM 0 HG13 ILE A 103 8.127 -9.657 -4.402 1.00 0.00 H new ATOM 0 HG21 ILE A 103 6.496 -6.594 -5.866 1.00 0.00 H new ATOM 0 HG22 ILE A 103 8.053 -5.785 -6.164 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.626 -7.254 -7.073 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.711 -9.832 -4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 103 6.380 -8.483 -3.111 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.497 -8.157 -4.620 1.00 0.00 H new ATOM 1628 N ASP A 104 10.643 -5.794 -6.246 1.00 0.00 N ATOM 1629 CA ASP A 104 11.355 -4.522 -6.191 1.00 0.00 C ATOM 1630 C ASP A 104 10.414 -3.360 -6.491 1.00 0.00 C ATOM 1631 O ASP A 104 9.738 -3.345 -7.520 1.00 0.00 O ATOM 1632 CB ASP A 104 12.519 -4.521 -7.183 1.00 0.00 C ATOM 1633 CG ASP A 104 13.674 -3.657 -6.720 1.00 0.00 C ATOM 1634 OD1 ASP A 104 13.442 -2.466 -6.420 1.00 0.00 O ATOM 1635 OD2 ASP A 104 14.811 -4.170 -6.655 1.00 0.00 O ATOM 0 H ASP A 104 10.319 -6.056 -7.177 1.00 0.00 H new ATOM 0 HA ASP A 104 11.748 -4.397 -5.182 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.869 -5.543 -7.328 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.167 -4.164 -8.151 1.00 0.00 H new ATOM 1640 N ILE A 105 10.375 -2.388 -5.585 1.00 0.00 N ATOM 1641 CA ILE A 105 9.517 -1.222 -5.752 1.00 0.00 C ATOM 1642 C ILE A 105 10.292 0.069 -5.512 1.00 0.00 C ATOM 1643 O ILE A 105 10.685 0.369 -4.384 1.00 0.00 O ATOM 1644 CB ILE A 105 8.310 -1.269 -4.796 1.00 0.00 C ATOM 1645 CG1 ILE A 105 7.454 -2.504 -5.082 1.00 0.00 C ATOM 1646 CG2 ILE A 105 7.481 0.000 -4.928 1.00 0.00 C ATOM 1647 CD1 ILE A 105 6.741 -3.040 -3.860 1.00 0.00 C ATOM 0 H ILE A 105 10.928 -2.385 -4.728 1.00 0.00 H new ATOM 0 HA ILE A 105 9.156 -1.240 -6.780 1.00 0.00 H new ATOM 0 HB ILE A 105 8.677 -1.334 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 105 6.715 -2.256 -5.844 1.00 0.00 H new ATOM 0 HG13 ILE A 105 8.088 -3.288 -5.496 1.00 0.00 H new ATOM 0 HG21 ILE A 105 6.632 -0.048 -4.246 1.00 0.00 H new ATOM 0 HG22 ILE A 105 8.097 0.864 -4.680 1.00 0.00 H new ATOM 0 HG23 ILE A 105 7.120 0.094 -5.952 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.153 -3.915 -4.136 1.00 0.00 H new ATOM 0 HD12 ILE A 105 7.475 -3.320 -3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.081 -2.272 -3.458 1.00 0.00 H new ATOM 1659 N CYS A 106 10.506 0.831 -6.579 1.00 0.00 N ATOM 1660 CA CYS A 106 11.233 2.092 -6.484 1.00 0.00 C ATOM 1661 C CYS A 106 10.290 3.239 -6.138 1.00 0.00 C ATOM 1662 O CYS A 106 9.344 3.523 -6.874 1.00 0.00 O ATOM 1663 CB CYS A 106 11.954 2.389 -7.800 1.00 0.00 C ATOM 1664 SG CYS A 106 13.391 3.473 -7.626 1.00 0.00 S ATOM 0 H CYS A 106 10.187 0.598 -7.519 1.00 0.00 H new ATOM 0 HA CYS A 106 11.970 1.998 -5.686 1.00 0.00 H new ATOM 0 HB2 CYS A 106 12.274 1.448 -8.247 1.00 0.00 H new ATOM 0 HB3 CYS A 106 11.248 2.847 -8.493 1.00 0.00 H new ATOM 0 HG CYS A 106 13.935 3.663 -8.791 1.00 0.00 H new ATOM 1670 N LEU A 107 10.552 3.894 -5.012 1.00 0.00 N ATOM 1671 CA LEU A 107 9.725 5.010 -4.566 1.00 0.00 C ATOM 1672 C LEU A 107 10.502 6.321 -4.625 1.00 0.00 C ATOM 1673 O LEU A 107 11.485 6.505 -3.907 1.00 0.00 O ATOM 1674 CB LEU A 107 9.226 4.763 -3.141 1.00 0.00 C ATOM 1675 CG LEU A 107 8.156 3.682 -2.982 1.00 0.00 C ATOM 1676 CD1 LEU A 107 8.210 3.079 -1.587 1.00 0.00 C ATOM 1677 CD2 LEU A 107 6.774 4.254 -3.265 1.00 0.00 C ATOM 0 H LEU A 107 11.330 3.672 -4.391 1.00 0.00 H new ATOM 0 HA LEU A 107 8.869 5.086 -5.236 1.00 0.00 H new ATOM 0 HB2 LEU A 107 10.080 4.494 -2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 107 8.829 5.699 -2.749 1.00 0.00 H new ATOM 0 HG LEU A 107 8.355 2.891 -3.705 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.442 2.312 -1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 107 9.191 2.633 -1.421 1.00 0.00 H new ATOM 0 HD13 LEU A 107 8.037 3.860 -0.846 1.00 0.00 H new ATOM 0 HD21 LEU A 107 6.025 3.471 -3.147 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.565 5.064 -2.566 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.741 4.637 -4.285 1.00 0.00 H new ATOM 1689 N ARG A 108 10.053 7.231 -5.484 1.00 0.00 N ATOM 1690 CA ARG A 108 10.705 8.526 -5.636 1.00 0.00 C ATOM 1691 C ARG A 108 10.063 9.568 -4.726 1.00 0.00 C ATOM 1692 O ARG A 108 8.991 10.094 -5.025 1.00 0.00 O ATOM 1693 CB ARG A 108 10.633 8.990 -7.092 1.00 0.00 C ATOM 1694 CG ARG A 108 10.884 10.478 -7.270 1.00 0.00 C ATOM 1695 CD ARG A 108 12.185 10.907 -6.609 1.00 0.00 C ATOM 1696 NE ARG A 108 12.813 12.023 -7.310 1.00 0.00 N ATOM 1697 CZ ARG A 108 13.398 11.910 -8.497 1.00 0.00 C ATOM 1698 NH1 ARG A 108 13.436 10.737 -9.112 1.00 0.00 N ATOM 1699 NH2 ARG A 108 13.948 12.973 -9.071 1.00 0.00 N ATOM 0 H ARG A 108 9.240 7.095 -6.085 1.00 0.00 H new ATOM 0 HA ARG A 108 11.751 8.414 -5.349 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.365 8.434 -7.678 1.00 0.00 H new ATOM 0 HB3 ARG A 108 9.650 8.745 -7.494 1.00 0.00 H new ATOM 0 HG2 ARG A 108 10.918 10.718 -8.333 1.00 0.00 H new ATOM 0 HG3 ARG A 108 10.055 11.042 -6.843 1.00 0.00 H new ATOM 0 HD2 ARG A 108 11.990 11.192 -5.575 1.00 0.00 H new ATOM 0 HD3 ARG A 108 12.874 10.062 -6.582 1.00 0.00 H new ATOM 0 HE ARG A 108 12.802 12.940 -6.864 1.00 0.00 H new ATOM 0 HH11 ARG A 108 13.015 9.918 -8.674 1.00 0.00 H new ATOM 0 HH12 ARG A 108 13.886 10.653 -10.024 1.00 0.00 H new ATOM 0 HH21 ARG A 108 13.922 13.878 -8.600 1.00 0.00 H new ATOM 0 HH22 ARG A 108 14.397 12.885 -9.983 1.00 0.00 H new ATOM 1713 N LYS A 109 10.725 9.862 -3.612 1.00 0.00 N ATOM 1714 CA LYS A 109 10.221 10.842 -2.657 1.00 0.00 C ATOM 1715 C LYS A 109 10.401 12.261 -3.187 1.00 0.00 C ATOM 1716 O LYS A 109 11.319 12.532 -3.962 1.00 0.00 O ATOM 1717 CB LYS A 109 10.939 10.693 -1.314 1.00 0.00 C ATOM 1718 CG LYS A 109 10.819 9.304 -0.712 1.00 0.00 C ATOM 1719 CD LYS A 109 11.314 9.275 0.725 1.00 0.00 C ATOM 1720 CE LYS A 109 12.764 9.724 0.824 1.00 0.00 C ATOM 1721 NZ LYS A 109 13.283 9.618 2.216 1.00 0.00 N ATOM 0 H LYS A 109 11.613 9.435 -3.348 1.00 0.00 H new ATOM 0 HA LYS A 109 9.156 10.658 -2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 109 11.994 10.933 -1.447 1.00 0.00 H new ATOM 0 HB3 LYS A 109 10.533 11.421 -0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 109 9.779 8.980 -0.746 1.00 0.00 H new ATOM 0 HG3 LYS A 109 11.393 8.596 -1.310 1.00 0.00 H new ATOM 0 HD2 LYS A 109 10.689 9.923 1.340 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.216 8.265 1.124 1.00 0.00 H new ATOM 0 HE2 LYS A 109 13.379 9.116 0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.849 10.755 0.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.274 9.933 2.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 12.712 10.218 2.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.226 8.629 2.534 1.00 0.00 H new ATOM 1735 N ARG A 110 9.521 13.163 -2.764 1.00 0.00 N ATOM 1736 CA ARG A 110 9.584 14.554 -3.196 1.00 0.00 C ATOM 1737 C ARG A 110 10.681 15.306 -2.448 1.00 0.00 C ATOM 1738 O ARG A 110 10.947 16.474 -2.729 1.00 0.00 O ATOM 1739 CB ARG A 110 8.236 15.241 -2.972 1.00 0.00 C ATOM 1740 CG ARG A 110 7.244 15.018 -4.102 1.00 0.00 C ATOM 1741 CD ARG A 110 5.948 15.776 -3.863 1.00 0.00 C ATOM 1742 NE ARG A 110 5.171 15.933 -5.090 1.00 0.00 N ATOM 1743 CZ ARG A 110 3.858 16.135 -5.108 1.00 0.00 C ATOM 1744 NH1 ARG A 110 3.180 16.207 -3.971 1.00 0.00 N ATOM 1745 NH2 ARG A 110 3.222 16.268 -6.264 1.00 0.00 N ATOM 0 H ARG A 110 8.756 12.955 -2.122 1.00 0.00 H new ATOM 0 HA ARG A 110 9.819 14.568 -4.260 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.802 14.876 -2.041 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.399 16.312 -2.849 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.686 15.340 -5.045 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.032 13.953 -4.196 1.00 0.00 H new ATOM 0 HD2 ARG A 110 5.350 15.247 -3.121 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.174 16.759 -3.449 1.00 0.00 H new ATOM 0 HE ARG A 110 5.664 15.885 -5.982 1.00 0.00 H new ATOM 0 HH11 ARG A 110 3.666 16.107 -3.080 1.00 0.00 H new ATOM 0 HH12 ARG A 110 2.172 16.362 -3.987 1.00 0.00 H new ATOM 0 HH21 ARG A 110 3.741 16.215 -7.141 1.00 0.00 H new ATOM 0 HH22 ARG A 110 2.214 16.423 -6.277 1.00 0.00 H new ATOM 1759 N GLN A 111 11.313 14.628 -1.495 1.00 0.00 N ATOM 1760 CA GLN A 111 12.379 15.233 -0.707 1.00 0.00 C ATOM 1761 C GLN A 111 13.553 14.272 -0.549 1.00 0.00 C ATOM 1762 O GLN A 111 13.536 13.164 -1.085 1.00 0.00 O ATOM 1763 CB GLN A 111 11.854 15.646 0.669 1.00 0.00 C ATOM 1764 CG GLN A 111 11.036 16.927 0.649 1.00 0.00 C ATOM 1765 CD GLN A 111 10.098 17.039 1.835 1.00 0.00 C ATOM 1766 OE1 GLN A 111 9.462 16.063 2.233 1.00 0.00 O ATOM 1767 NE2 GLN A 111 10.009 18.234 2.408 1.00 0.00 N ATOM 0 H GLN A 111 11.105 13.660 -1.251 1.00 0.00 H new ATOM 0 HA GLN A 111 12.728 16.120 -1.236 1.00 0.00 H new ATOM 0 HB2 GLN A 111 11.241 14.840 1.072 1.00 0.00 H new ATOM 0 HB3 GLN A 111 12.698 15.774 1.347 1.00 0.00 H new ATOM 0 HG2 GLN A 111 11.710 17.784 0.641 1.00 0.00 H new ATOM 0 HG3 GLN A 111 10.456 16.969 -0.273 1.00 0.00 H new ATOM 0 HE21 GLN A 111 10.555 19.016 2.045 1.00 0.00 H new ATOM 0 HE22 GLN A 111 9.395 18.370 3.211 1.00 0.00 H new ATOM 1776 N SER A 112 14.570 14.703 0.191 1.00 0.00 N ATOM 1777 CA SER A 112 15.753 13.882 0.416 1.00 0.00 C ATOM 1778 C SER A 112 16.012 13.699 1.908 1.00 0.00 C ATOM 1779 O SER A 112 17.159 13.604 2.342 1.00 0.00 O ATOM 1780 CB SER A 112 16.975 14.517 -0.251 1.00 0.00 C ATOM 1781 OG SER A 112 17.706 15.307 0.671 1.00 0.00 O ATOM 0 H SER A 112 14.598 15.616 0.645 1.00 0.00 H new ATOM 0 HA SER A 112 15.574 12.902 -0.027 1.00 0.00 H new ATOM 0 HB2 SER A 112 17.619 13.736 -0.656 1.00 0.00 H new ATOM 0 HB3 SER A 112 16.655 15.134 -1.090 1.00 0.00 H new ATOM 0 HG SER A 112 18.130 14.725 1.336 1.00 0.00 H new ATOM 1787 N GLN A 113 14.936 13.651 2.687 1.00 0.00 N ATOM 1788 CA GLN A 113 15.046 13.480 4.131 1.00 0.00 C ATOM 1789 C GLN A 113 14.179 12.320 4.610 1.00 0.00 C ATOM 1790 O GLN A 113 12.956 12.352 4.480 1.00 0.00 O ATOM 1791 CB GLN A 113 14.638 14.767 4.850 1.00 0.00 C ATOM 1792 CG GLN A 113 13.227 15.227 4.523 1.00 0.00 C ATOM 1793 CD GLN A 113 13.057 16.727 4.652 1.00 0.00 C ATOM 1794 OE1 GLN A 113 12.311 17.208 5.507 1.00 0.00 O ATOM 1795 NE2 GLN A 113 13.749 17.478 3.803 1.00 0.00 N ATOM 0 H GLN A 113 13.979 13.728 2.343 1.00 0.00 H new ATOM 0 HA GLN A 113 16.086 13.254 4.366 1.00 0.00 H new ATOM 0 HB2 GLN A 113 14.721 14.614 5.926 1.00 0.00 H new ATOM 0 HB3 GLN A 113 15.339 15.559 4.586 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.976 14.923 3.507 1.00 0.00 H new ATOM 0 HG3 GLN A 113 12.523 14.727 5.188 1.00 0.00 H new ATOM 0 HE21 GLN A 113 14.355 17.038 3.110 1.00 0.00 H new ATOM 0 HE22 GLN A 113 13.674 18.494 3.843 1.00 0.00 H new ATOM 1804 N ARG A 114 14.822 11.297 5.162 1.00 0.00 N ATOM 1805 CA ARG A 114 14.110 10.125 5.659 1.00 0.00 C ATOM 1806 C ARG A 114 13.051 10.526 6.682 1.00 0.00 C ATOM 1807 O ARG A 114 13.305 11.350 7.561 1.00 0.00 O ATOM 1808 CB ARG A 114 15.091 9.133 6.286 1.00 0.00 C ATOM 1809 CG ARG A 114 14.603 7.694 6.259 1.00 0.00 C ATOM 1810 CD ARG A 114 15.382 6.823 7.233 1.00 0.00 C ATOM 1811 NE ARG A 114 14.613 5.657 7.659 1.00 0.00 N ATOM 1812 CZ ARG A 114 15.147 4.616 8.288 1.00 0.00 C ATOM 1813 NH1 ARG A 114 16.443 4.596 8.563 1.00 0.00 N ATOM 1814 NH2 ARG A 114 14.382 3.591 8.644 1.00 0.00 N ATOM 0 H ARG A 114 15.835 11.255 5.277 1.00 0.00 H new ATOM 0 HA ARG A 114 13.613 9.648 4.814 1.00 0.00 H new ATOM 0 HB2 ARG A 114 16.043 9.195 5.759 1.00 0.00 H new ATOM 0 HB3 ARG A 114 15.279 9.425 7.319 1.00 0.00 H new ATOM 0 HG2 ARG A 114 13.543 7.663 6.510 1.00 0.00 H new ATOM 0 HG3 ARG A 114 14.704 7.293 5.250 1.00 0.00 H new ATOM 0 HD2 ARG A 114 16.309 6.494 6.764 1.00 0.00 H new ATOM 0 HD3 ARG A 114 15.659 7.414 8.106 1.00 0.00 H new ATOM 0 HE ARG A 114 13.612 5.641 7.463 1.00 0.00 H new ATOM 0 HH11 ARG A 114 17.034 5.382 8.292 1.00 0.00 H new ATOM 0 HH12 ARG A 114 16.850 3.795 9.046 1.00 0.00 H new ATOM 0 HH21 ARG A 114 13.384 3.603 8.435 1.00 0.00 H new ATOM 0 HH22 ARG A 114 14.792 2.792 9.127 1.00 0.00 H new ATOM 1828 N TRP A 115 11.867 9.939 6.560 1.00 0.00 N ATOM 1829 CA TRP A 115 10.769 10.235 7.475 1.00 0.00 C ATOM 1830 C TRP A 115 10.962 9.519 8.807 1.00 0.00 C ATOM 1831 O TRP A 115 10.475 9.971 9.842 1.00 0.00 O ATOM 1832 CB TRP A 115 9.434 9.826 6.850 1.00 0.00 C ATOM 1833 CG TRP A 115 9.389 10.019 5.365 1.00 0.00 C ATOM 1834 CD1 TRP A 115 9.844 11.100 4.665 1.00 0.00 C ATOM 1835 CD2 TRP A 115 8.857 9.107 4.398 1.00 0.00 C ATOM 1836 NE1 TRP A 115 9.628 10.914 3.320 1.00 0.00 N ATOM 1837 CE2 TRP A 115 9.024 9.699 3.131 1.00 0.00 C ATOM 1838 CE3 TRP A 115 8.258 7.847 4.479 1.00 0.00 C ATOM 1839 CZ2 TRP A 115 8.612 9.074 1.957 1.00 0.00 C ATOM 1840 CZ3 TRP A 115 7.850 7.228 3.313 1.00 0.00 C ATOM 1841 CH2 TRP A 115 8.029 7.841 2.066 1.00 0.00 C ATOM 0 H TRP A 115 11.641 9.255 5.837 1.00 0.00 H new ATOM 0 HA TRP A 115 10.762 11.309 7.660 1.00 0.00 H new ATOM 0 HB2 TRP A 115 9.240 8.778 7.079 1.00 0.00 H new ATOM 0 HB3 TRP A 115 8.633 10.406 7.309 1.00 0.00 H new ATOM 0 HD1 TRP A 115 10.306 11.972 5.103 1.00 0.00 H new ATOM 0 HE1 TRP A 115 9.877 11.573 2.583 1.00 0.00 H new ATOM 0 HE3 TRP A 115 8.117 7.366 5.436 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 8.748 9.546 0.995 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 7.385 6.255 3.364 1.00 0.00 H new ATOM 0 HH2 TRP A 115 7.700 7.330 1.173 1.00 0.00 H new ATOM 1852 N GLY A 116 11.677 8.398 8.774 1.00 0.00 N ATOM 1853 CA GLY A 116 11.922 7.638 9.985 1.00 0.00 C ATOM 1854 C GLY A 116 10.930 6.507 10.170 1.00 0.00 C ATOM 1855 O GLY A 116 10.575 6.161 11.296 1.00 0.00 O ATOM 0 H GLY A 116 12.091 8.003 7.929 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.932 7.230 9.956 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.872 8.305 10.845 1.00 0.00 H new ATOM 1859 N GLY A 117 10.479 5.930 9.060 1.00 0.00 N ATOM 1860 CA GLY A 117 9.524 4.838 9.127 1.00 0.00 C ATOM 1861 C GLY A 117 8.586 4.816 7.937 1.00 0.00 C ATOM 1862 O GLY A 117 7.567 5.509 7.927 1.00 0.00 O ATOM 0 H GLY A 117 10.757 6.199 8.116 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.062 3.891 9.180 1.00 0.00 H new ATOM 0 HA3 GLY A 117 8.941 4.925 10.044 1.00 0.00 H new ATOM 1866 N LEU A 118 8.928 4.019 6.931 1.00 0.00 N ATOM 1867 CA LEU A 118 8.108 3.910 5.729 1.00 0.00 C ATOM 1868 C LEU A 118 6.627 4.047 6.065 1.00 0.00 C ATOM 1869 O LEU A 118 5.918 4.857 5.469 1.00 0.00 O ATOM 1870 CB LEU A 118 8.364 2.572 5.033 1.00 0.00 C ATOM 1871 CG LEU A 118 7.932 2.484 3.569 1.00 0.00 C ATOM 1872 CD1 LEU A 118 8.914 3.226 2.676 1.00 0.00 C ATOM 1873 CD2 LEU A 118 7.808 1.030 3.136 1.00 0.00 C ATOM 0 H LEU A 118 9.767 3.439 6.923 1.00 0.00 H new ATOM 0 HA LEU A 118 8.384 4.721 5.056 1.00 0.00 H new ATOM 0 HB2 LEU A 118 9.430 2.354 5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 118 7.848 1.790 5.591 1.00 0.00 H new ATOM 0 HG LEU A 118 6.955 2.957 3.470 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.590 3.152 1.638 1.00 0.00 H new ATOM 0 HD12 LEU A 118 8.952 4.275 2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 118 9.905 2.784 2.779 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.500 0.986 2.091 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.771 0.533 3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.064 0.528 3.755 1.00 0.00 H new ATOM 1885 N GLU A 119 6.167 3.250 7.025 1.00 0.00 N ATOM 1886 CA GLU A 119 4.770 3.284 7.441 1.00 0.00 C ATOM 1887 C GLU A 119 4.555 4.321 8.540 1.00 0.00 C ATOM 1888 O GLU A 119 5.388 4.479 9.431 1.00 0.00 O ATOM 1889 CB GLU A 119 4.328 1.904 7.934 1.00 0.00 C ATOM 1890 CG GLU A 119 4.515 0.802 6.905 1.00 0.00 C ATOM 1891 CD GLU A 119 4.777 -0.550 7.539 1.00 0.00 C ATOM 1892 OE1 GLU A 119 4.262 -0.793 8.650 1.00 0.00 O ATOM 1893 OE2 GLU A 119 5.498 -1.364 6.925 1.00 0.00 O ATOM 0 H GLU A 119 6.741 2.574 7.529 1.00 0.00 H new ATOM 0 HA GLU A 119 4.167 3.564 6.577 1.00 0.00 H new ATOM 0 HB2 GLU A 119 4.891 1.651 8.832 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.277 1.949 8.219 1.00 0.00 H new ATOM 0 HG2 GLU A 119 3.625 0.739 6.279 1.00 0.00 H new ATOM 0 HG3 GLU A 119 5.347 1.059 6.250 1.00 0.00 H new ATOM 1900 N ALA A 120 3.431 5.026 8.467 1.00 0.00 N ATOM 1901 CA ALA A 120 3.104 6.047 9.455 1.00 0.00 C ATOM 1902 C ALA A 120 2.477 5.427 10.699 1.00 0.00 C ATOM 1903 O ALA A 120 1.763 4.426 10.630 1.00 0.00 O ATOM 1904 CB ALA A 120 2.169 7.085 8.852 1.00 0.00 C ATOM 0 H ALA A 120 2.731 4.909 7.734 1.00 0.00 H new ATOM 0 HA ALA A 120 4.030 6.538 9.753 1.00 0.00 H new ATOM 0 HB1 ALA A 120 1.933 7.841 9.601 1.00 0.00 H new ATOM 0 HB2 ALA A 120 2.653 7.559 7.998 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.250 6.600 8.524 1.00 0.00 H new ATOM 1910 N PRO A 121 2.749 6.032 11.865 1.00 0.00 N ATOM 1911 CA PRO A 121 2.221 5.556 13.146 1.00 0.00 C ATOM 1912 C PRO A 121 0.717 5.775 13.271 1.00 0.00 C ATOM 1913 O PRO A 121 0.058 6.179 12.314 1.00 0.00 O ATOM 1914 CB PRO A 121 2.972 6.403 14.176 1.00 0.00 C ATOM 1915 CG PRO A 121 3.346 7.645 13.445 1.00 0.00 C ATOM 1916 CD PRO A 121 3.593 7.229 12.021 1.00 0.00 C ATOM 0 HA PRO A 121 2.363 4.483 13.271 1.00 0.00 H new ATOM 0 HB2 PRO A 121 2.344 6.625 15.039 1.00 0.00 H new ATOM 0 HB3 PRO A 121 3.854 5.882 14.549 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.549 8.386 13.502 1.00 0.00 H new ATOM 0 HG3 PRO A 121 4.237 8.100 13.879 1.00 0.00 H new ATOM 0 HD2 PRO A 121 3.312 8.014 11.318 1.00 0.00 H new ATOM 0 HD3 PRO A 121 4.645 7.005 11.844 1.00 0.00 H new ATOM 1924 N ALA A 122 0.181 5.506 14.457 1.00 0.00 N ATOM 1925 CA ALA A 122 -1.245 5.676 14.707 1.00 0.00 C ATOM 1926 C ALA A 122 -1.498 6.163 16.130 1.00 0.00 C ATOM 1927 O ALA A 122 -1.123 5.503 17.098 1.00 0.00 O ATOM 1928 CB ALA A 122 -1.985 4.371 14.455 1.00 0.00 C ATOM 0 H ALA A 122 0.713 5.169 15.260 1.00 0.00 H new ATOM 0 HA ALA A 122 -1.621 6.433 14.019 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.049 4.513 14.646 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -1.840 4.065 13.419 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.597 3.599 15.119 1.00 0.00 H new ATOM 1934 N ALA A 123 -2.137 7.323 16.248 1.00 0.00 N ATOM 1935 CA ALA A 123 -2.441 7.898 17.553 1.00 0.00 C ATOM 1936 C ALA A 123 -3.938 8.140 17.710 1.00 0.00 C ATOM 1937 O ALA A 123 -4.729 7.790 16.834 1.00 0.00 O ATOM 1938 CB ALA A 123 -1.670 9.195 17.751 1.00 0.00 C ATOM 0 H ALA A 123 -2.454 7.882 15.456 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.133 7.185 18.318 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.907 9.613 18.729 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.600 8.995 17.691 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -1.950 9.907 16.975 1.00 0.00 H new ATOM 1944 N ARG A 124 -4.321 8.741 18.832 1.00 0.00 N ATOM 1945 CA ARG A 124 -5.724 9.029 19.104 1.00 0.00 C ATOM 1946 C ARG A 124 -6.131 10.370 18.501 1.00 0.00 C ATOM 1947 O ARG A 124 -7.034 11.040 19.002 1.00 0.00 O ATOM 1948 CB ARG A 124 -5.982 9.037 20.612 1.00 0.00 C ATOM 1949 CG ARG A 124 -5.060 9.969 21.382 1.00 0.00 C ATOM 1950 CD ARG A 124 -5.497 10.111 22.832 1.00 0.00 C ATOM 1951 NE ARG A 124 -4.852 11.245 23.489 1.00 0.00 N ATOM 1952 CZ ARG A 124 -5.294 12.494 23.400 1.00 0.00 C ATOM 1953 NH1 ARG A 124 -6.376 12.769 22.685 1.00 0.00 N ATOM 1954 NH2 ARG A 124 -4.652 13.472 24.027 1.00 0.00 N ATOM 0 H ARG A 124 -3.679 9.038 19.567 1.00 0.00 H new ATOM 0 HA ARG A 124 -6.325 8.245 18.643 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -7.016 9.330 20.794 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -5.866 8.024 20.998 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -4.040 9.587 21.344 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -5.051 10.949 20.906 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -6.579 10.235 22.874 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -5.260 9.195 23.374 1.00 0.00 H new ATOM 0 HE ARG A 124 -4.016 11.068 24.047 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -6.872 12.020 22.201 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -6.713 13.729 22.619 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -3.819 13.264 24.577 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -4.992 14.431 23.958 1.00 0.00 H new ATOM 1968 N VAL A 125 -5.460 10.755 17.420 1.00 0.00 N ATOM 1969 CA VAL A 125 -5.752 12.015 16.747 1.00 0.00 C ATOM 1970 C VAL A 125 -6.600 11.789 15.501 1.00 0.00 C ATOM 1971 O VAL A 125 -6.207 11.056 14.595 1.00 0.00 O ATOM 1972 CB VAL A 125 -4.459 12.751 16.348 1.00 0.00 C ATOM 1973 CG1 VAL A 125 -4.783 14.020 15.576 1.00 0.00 C ATOM 1974 CG2 VAL A 125 -3.623 13.066 17.580 1.00 0.00 C ATOM 0 H VAL A 125 -4.710 10.212 16.992 1.00 0.00 H new ATOM 0 HA VAL A 125 -6.308 12.630 17.455 1.00 0.00 H new ATOM 0 HB VAL A 125 -3.876 12.098 15.698 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.857 14.526 15.303 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.337 13.765 14.673 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -5.387 14.680 16.198 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -2.713 13.586 17.279 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -4.196 13.700 18.257 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -3.360 12.138 18.088 1.00 0.00 H new ATOM 1984 N GLY A 126 -7.767 12.425 15.463 1.00 0.00 N ATOM 1985 CA GLY A 126 -8.654 12.281 14.324 1.00 0.00 C ATOM 1986 C GLY A 126 -10.106 12.528 14.683 1.00 0.00 C ATOM 1987 O GLY A 126 -10.406 13.332 15.564 1.00 0.00 O ATOM 0 H GLY A 126 -8.114 13.038 16.201 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -8.353 12.979 13.543 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.551 11.277 13.912 1.00 0.00 H new ATOM 1991 N GLY A 127 -11.010 11.835 13.998 1.00 0.00 N ATOM 1992 CA GLY A 127 -12.427 11.999 14.263 1.00 0.00 C ATOM 1993 C GLY A 127 -13.295 11.362 13.195 1.00 0.00 C ATOM 1994 O GLY A 127 -12.785 10.776 12.240 1.00 0.00 O ATOM 0 H GLY A 127 -10.786 11.163 13.264 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -12.666 11.559 15.231 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -12.660 13.062 14.330 1.00 0.00 H new ATOM 1998 N ALA A 128 -14.609 11.475 13.357 1.00 0.00 N ATOM 1999 CA ALA A 128 -15.548 10.906 12.400 1.00 0.00 C ATOM 2000 C ALA A 128 -16.647 11.904 12.048 1.00 0.00 C ATOM 2001 O ALA A 128 -16.808 12.925 12.716 1.00 0.00 O ATOM 2002 CB ALA A 128 -16.155 9.624 12.953 1.00 0.00 C ATOM 0 H ALA A 128 -15.047 11.956 14.143 1.00 0.00 H new ATOM 0 HA ALA A 128 -15.000 10.672 11.487 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -16.855 9.210 12.227 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -15.363 8.901 13.147 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -16.682 9.842 13.882 1.00 0.00 H new ATOM 2008 N SER A 129 -17.399 11.602 10.995 1.00 0.00 N ATOM 2009 CA SER A 129 -18.479 12.476 10.552 1.00 0.00 C ATOM 2010 C SER A 129 -19.566 11.677 9.838 1.00 0.00 C ATOM 2011 O SER A 129 -19.297 10.633 9.245 1.00 0.00 O ATOM 2012 CB SER A 129 -17.936 13.563 9.622 1.00 0.00 C ATOM 2013 OG SER A 129 -17.341 12.996 8.468 1.00 0.00 O ATOM 0 H SER A 129 -17.281 10.759 10.433 1.00 0.00 H new ATOM 0 HA SER A 129 -18.916 12.947 11.433 1.00 0.00 H new ATOM 0 HB2 SER A 129 -18.745 14.231 9.327 1.00 0.00 H new ATOM 0 HB3 SER A 129 -17.201 14.168 10.154 1.00 0.00 H new ATOM 0 HG SER A 129 -17.003 13.711 7.889 1.00 0.00 H new ATOM 2019 N GLY A 130 -20.797 12.176 9.901 1.00 0.00 N ATOM 2020 CA GLY A 130 -21.906 11.497 9.258 1.00 0.00 C ATOM 2021 C GLY A 130 -23.194 12.294 9.330 1.00 0.00 C ATOM 2022 O GLY A 130 -24.073 12.021 10.147 1.00 0.00 O ATOM 0 H GLY A 130 -21.045 13.038 10.386 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -21.657 11.309 8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -22.056 10.526 9.730 1.00 0.00 H new ATOM 2026 N PRO A 131 -23.317 13.307 8.459 1.00 0.00 N ATOM 2027 CA PRO A 131 -24.502 14.168 8.408 1.00 0.00 C ATOM 2028 C PRO A 131 -25.729 13.434 7.878 1.00 0.00 C ATOM 2029 O PRO A 131 -26.805 13.493 8.473 1.00 0.00 O ATOM 2030 CB PRO A 131 -24.090 15.284 7.446 1.00 0.00 C ATOM 2031 CG PRO A 131 -23.040 14.672 6.584 1.00 0.00 C ATOM 2032 CD PRO A 131 -22.308 13.690 7.457 1.00 0.00 C ATOM 0 HA PRO A 131 -24.789 14.525 9.397 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -24.937 15.629 6.853 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -23.705 16.149 7.985 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -23.484 14.173 5.723 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -22.361 15.432 6.197 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -21.959 12.828 6.888 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -21.431 14.141 7.922 1.00 0.00 H new ATOM 2040 N SER A 132 -25.560 12.742 6.756 1.00 0.00 N ATOM 2041 CA SER A 132 -26.655 11.998 6.144 1.00 0.00 C ATOM 2042 C SER A 132 -27.085 10.834 7.031 1.00 0.00 C ATOM 2043 O SER A 132 -26.267 10.241 7.735 1.00 0.00 O ATOM 2044 CB SER A 132 -26.239 11.478 4.766 1.00 0.00 C ATOM 2045 OG SER A 132 -27.308 10.793 4.136 1.00 0.00 O ATOM 0 H SER A 132 -24.675 12.681 6.252 1.00 0.00 H new ATOM 0 HA SER A 132 -27.501 12.675 6.029 1.00 0.00 H new ATOM 0 HB2 SER A 132 -25.918 12.311 4.141 1.00 0.00 H new ATOM 0 HB3 SER A 132 -25.385 10.809 4.869 1.00 0.00 H new ATOM 0 HG SER A 132 -27.018 10.472 3.257 1.00 0.00 H new ATOM 2051 N SER A 133 -28.374 10.513 6.993 1.00 0.00 N ATOM 2052 CA SER A 133 -28.915 9.423 7.796 1.00 0.00 C ATOM 2053 C SER A 133 -30.379 9.168 7.451 1.00 0.00 C ATOM 2054 O SER A 133 -31.137 10.100 7.183 1.00 0.00 O ATOM 2055 CB SER A 133 -28.779 9.743 9.286 1.00 0.00 C ATOM 2056 OG SER A 133 -29.615 10.826 9.654 1.00 0.00 O ATOM 0 H SER A 133 -29.064 10.993 6.414 1.00 0.00 H new ATOM 0 HA SER A 133 -28.345 8.522 7.571 1.00 0.00 H new ATOM 0 HB2 SER A 133 -29.038 8.863 9.875 1.00 0.00 H new ATOM 0 HB3 SER A 133 -27.742 9.986 9.516 1.00 0.00 H new ATOM 0 HG SER A 133 -29.511 11.009 10.611 1.00 0.00 H new ATOM 2062 N GLY A 134 -30.770 7.897 7.459 1.00 0.00 N ATOM 2063 CA GLY A 134 -32.141 7.541 7.145 1.00 0.00 C ATOM 2064 C GLY A 134 -32.247 6.690 5.895 1.00 0.00 C ATOM 2065 O GLY A 134 -33.332 6.528 5.337 1.00 0.00 O ATOM 0 H GLY A 134 -30.162 7.108 7.677 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -32.575 7.001 7.987 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -32.728 8.450 7.013 1.00 0.00 H new TER 2069 GLY A 134