USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 795 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 88 THR OG1 : rot 180:sc= 0.0331 USER MOD Set 1.2: A 91 LYS NZ :NH3+ 153:sc= 0.0182 (180deg=-0.554) USER MOD Set 2.1: A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 42 ASN : amide:sc= -0.0233 X(o=-0.023,f=-0.03) USER MOD Set 3.1: A 10 TYR OH : rot -60:sc= 0.162 USER MOD Set 3.2: A 56 GLN : amide:sc= 0.153 X(o=0.31,f=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) 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= -0.0524 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -1.86 K(o=-1.9,f=0.27) USER MOD Single : A 18 THR OG1 : rot -38:sc= 0.0422 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0298 USER MOD Single : A 23 SER OG : rot 75:sc= 0.951 USER MOD Single : A 36 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.0197) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= -0.483 X(o=-0.48,f=-0.14) USER MOD Single : A 39 MET CE :methyl -167:sc= -0.991 (180deg=-1.6) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -1.77 X(o=-1.8,f=-1.3) USER MOD Single : A 57 MET CE :methyl -107:sc= -3.48! (180deg=-6.65!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 180:sc= -1.25 USER MOD Single : A 73 SER OG : rot -91:sc= 1.2 USER MOD Single : A 74 ASN : amide:sc= -0.632 K(o=-0.63,f=-1.8) USER MOD Single : A 76 MET CE :methyl -170:sc= -2.09 (180deg=-2.31) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 170:sc= -0.806 USER MOD Single : A 80 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00215) USER MOD Single : A 81 GLN : amide:sc= -0.779 K(o=-0.78,f=-2) USER MOD Single : A 83 MET CE :methyl 143:sc= -0.0867 (180deg=-0.426) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot -56:sc= -0.469 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.084 -18.179 -3.427 1.00 0.00 N ATOM 2 CA GLY A 1 -24.227 -17.327 -3.144 1.00 0.00 C ATOM 3 C GLY A 1 -23.920 -15.868 -3.487 1.00 0.00 C ATOM 4 O GLY A 1 -24.579 -15.276 -4.342 1.00 0.00 O ATOM 0 H1 GLY A 1 -23.317 -19.164 -3.186 1.00 0.00 H new ATOM 0 H2 GLY A 1 -22.846 -18.117 -4.438 1.00 0.00 H new ATOM 0 H3 GLY A 1 -22.270 -17.867 -2.860 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -25.089 -17.666 -3.718 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -24.494 -17.408 -2.090 1.00 0.00 H new ATOM 8 N SER A 2 -22.921 -15.330 -2.804 1.00 0.00 N ATOM 9 CA SER A 2 -22.520 -13.951 -3.025 1.00 0.00 C ATOM 10 C SER A 2 -21.002 -13.869 -3.200 1.00 0.00 C ATOM 11 O SER A 2 -20.516 -13.398 -4.227 1.00 0.00 O ATOM 12 CB SER A 2 -22.970 -13.054 -1.871 1.00 0.00 C ATOM 13 OG SER A 2 -24.227 -12.435 -2.134 1.00 0.00 O ATOM 0 H SER A 2 -22.377 -15.824 -2.097 1.00 0.00 H new ATOM 0 HA SER A 2 -23.004 -13.596 -3.935 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.041 -13.646 -0.958 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.217 -12.286 -1.695 1.00 0.00 H new ATOM 0 HG SER A 2 -24.480 -11.872 -1.373 1.00 0.00 H new ATOM 19 N SER A 3 -20.295 -14.335 -2.181 1.00 0.00 N ATOM 20 CA SER A 3 -18.843 -14.321 -2.209 1.00 0.00 C ATOM 21 C SER A 3 -18.330 -15.275 -3.289 1.00 0.00 C ATOM 22 O SER A 3 -18.778 -16.417 -3.377 1.00 0.00 O ATOM 23 CB SER A 3 -18.262 -14.702 -0.845 1.00 0.00 C ATOM 24 OG SER A 3 -18.321 -16.106 -0.614 1.00 0.00 O ATOM 0 H SER A 3 -20.701 -14.725 -1.330 1.00 0.00 H new ATOM 0 HA SER A 3 -18.516 -13.308 -2.444 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.226 -14.368 -0.786 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.810 -14.182 -0.059 1.00 0.00 H new ATOM 0 HG SER A 3 -17.939 -16.309 0.266 1.00 0.00 H new ATOM 30 N GLY A 4 -17.399 -14.771 -4.085 1.00 0.00 N ATOM 31 CA GLY A 4 -16.821 -15.564 -5.157 1.00 0.00 C ATOM 32 C GLY A 4 -15.942 -16.684 -4.597 1.00 0.00 C ATOM 33 O GLY A 4 -16.308 -17.337 -3.621 1.00 0.00 O ATOM 0 H GLY A 4 -17.030 -13.823 -4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -17.616 -15.992 -5.767 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.228 -14.923 -5.809 1.00 0.00 H new ATOM 37 N SER A 5 -14.798 -16.872 -5.239 1.00 0.00 N ATOM 38 CA SER A 5 -13.863 -17.901 -4.817 1.00 0.00 C ATOM 39 C SER A 5 -12.426 -17.414 -5.011 1.00 0.00 C ATOM 40 O SER A 5 -11.669 -17.304 -4.048 1.00 0.00 O ATOM 41 CB SER A 5 -14.091 -19.202 -5.589 1.00 0.00 C ATOM 42 OG SER A 5 -14.071 -18.997 -6.999 1.00 0.00 O ATOM 0 H SER A 5 -14.498 -16.329 -6.048 1.00 0.00 H new ATOM 0 HA SER A 5 -14.032 -18.103 -3.759 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.322 -19.925 -5.317 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.049 -19.632 -5.299 1.00 0.00 H new ATOM 0 HG SER A 5 -14.218 -19.851 -7.456 1.00 0.00 H new ATOM 48 N SER A 6 -12.093 -17.135 -6.262 1.00 0.00 N ATOM 49 CA SER A 6 -10.760 -16.662 -6.595 1.00 0.00 C ATOM 50 C SER A 6 -10.841 -15.588 -7.681 1.00 0.00 C ATOM 51 O SER A 6 -11.873 -15.437 -8.333 1.00 0.00 O ATOM 52 CB SER A 6 -9.865 -17.815 -7.054 1.00 0.00 C ATOM 53 OG SER A 6 -8.860 -18.126 -6.093 1.00 0.00 O ATOM 0 H SER A 6 -12.724 -17.227 -7.058 1.00 0.00 H new ATOM 0 HA SER A 6 -10.317 -16.229 -5.698 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.477 -18.698 -7.237 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.393 -17.553 -8.001 1.00 0.00 H new ATOM 0 HG SER A 6 -8.311 -18.868 -6.422 1.00 0.00 H new ATOM 59 N GLY A 7 -9.739 -14.871 -7.843 1.00 0.00 N ATOM 60 CA GLY A 7 -9.673 -13.815 -8.840 1.00 0.00 C ATOM 61 C GLY A 7 -9.275 -12.483 -8.201 1.00 0.00 C ATOM 62 O GLY A 7 -8.090 -12.171 -8.096 1.00 0.00 O ATOM 0 H GLY A 7 -8.885 -15.000 -7.301 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.951 -14.083 -9.611 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.641 -13.712 -9.331 1.00 0.00 H new ATOM 66 N GLU A 8 -10.288 -11.734 -7.792 1.00 0.00 N ATOM 67 CA GLU A 8 -10.058 -10.442 -7.167 1.00 0.00 C ATOM 68 C GLU A 8 -10.108 -10.573 -5.643 1.00 0.00 C ATOM 69 O GLU A 8 -10.759 -11.474 -5.115 1.00 0.00 O ATOM 70 CB GLU A 8 -11.070 -9.406 -7.661 1.00 0.00 C ATOM 71 CG GLU A 8 -12.499 -9.823 -7.307 1.00 0.00 C ATOM 72 CD GLU A 8 -13.274 -8.654 -6.694 1.00 0.00 C ATOM 73 OE1 GLU A 8 -13.426 -7.639 -7.407 1.00 0.00 O ATOM 74 OE2 GLU A 8 -13.698 -8.804 -5.528 1.00 0.00 O ATOM 0 H GLU A 8 -11.270 -11.996 -7.881 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.064 -10.095 -7.450 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -10.850 -8.436 -7.216 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.978 -9.289 -8.741 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -13.012 -10.175 -8.202 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -12.475 -10.657 -6.605 1.00 0.00 H new ATOM 81 N GLY A 9 -9.412 -9.662 -4.980 1.00 0.00 N ATOM 82 CA GLY A 9 -9.368 -9.665 -3.527 1.00 0.00 C ATOM 83 C GLY A 9 -8.538 -8.492 -3.001 1.00 0.00 C ATOM 84 O GLY A 9 -8.836 -7.335 -3.293 1.00 0.00 O ATOM 0 H GLY A 9 -8.874 -8.917 -5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.381 -9.606 -3.129 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -8.941 -10.604 -3.174 1.00 0.00 H new ATOM 88 N TYR A 10 -7.512 -8.832 -2.235 1.00 0.00 N ATOM 89 CA TYR A 10 -6.636 -7.822 -1.666 1.00 0.00 C ATOM 90 C TYR A 10 -5.884 -7.067 -2.764 1.00 0.00 C ATOM 91 O TYR A 10 -6.047 -5.857 -2.913 1.00 0.00 O ATOM 92 CB TYR A 10 -5.626 -8.579 -0.801 1.00 0.00 C ATOM 93 CG TYR A 10 -6.185 -9.046 0.545 1.00 0.00 C ATOM 94 CD1 TYR A 10 -7.010 -8.215 1.275 1.00 0.00 C ATOM 95 CD2 TYR A 10 -5.866 -10.299 1.028 1.00 0.00 C ATOM 96 CE1 TYR A 10 -7.536 -8.654 2.541 1.00 0.00 C ATOM 97 CE2 TYR A 10 -6.392 -10.738 2.294 1.00 0.00 C ATOM 98 CZ TYR A 10 -7.202 -9.894 2.988 1.00 0.00 C ATOM 99 OH TYR A 10 -7.699 -10.309 4.184 1.00 0.00 O ATOM 0 H TYR A 10 -7.268 -9.793 -1.995 1.00 0.00 H new ATOM 0 HA TYR A 10 -7.211 -7.092 -1.096 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -5.268 -9.447 -1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -4.764 -7.937 -0.622 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -7.261 -7.235 0.896 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -5.222 -10.950 0.456 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -8.182 -8.013 3.123 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -6.149 -11.715 2.684 1.00 0.00 H new ATOM 0 HH TYR A 10 -7.398 -9.702 4.892 1.00 0.00 H new ATOM 109 N GLU A 11 -5.076 -7.812 -3.504 1.00 0.00 N ATOM 110 CA GLU A 11 -4.299 -7.228 -4.583 1.00 0.00 C ATOM 111 C GLU A 11 -5.153 -6.238 -5.377 1.00 0.00 C ATOM 112 O GLU A 11 -4.753 -5.093 -5.584 1.00 0.00 O ATOM 113 CB GLU A 11 -3.726 -8.314 -5.496 1.00 0.00 C ATOM 114 CG GLU A 11 -2.348 -8.767 -5.012 1.00 0.00 C ATOM 115 CD GLU A 11 -2.048 -10.196 -5.470 1.00 0.00 C ATOM 116 OE1 GLU A 11 -2.964 -11.037 -5.344 1.00 0.00 O ATOM 117 OE2 GLU A 11 -0.909 -10.414 -5.937 1.00 0.00 O ATOM 0 H GLU A 11 -4.943 -8.815 -3.377 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.460 -6.685 -4.148 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.404 -9.167 -5.523 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -3.651 -7.935 -6.515 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -1.584 -8.091 -5.395 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -2.305 -8.713 -3.924 1.00 0.00 H new ATOM 124 N GLN A 12 -6.315 -6.715 -5.801 1.00 0.00 N ATOM 125 CA GLN A 12 -7.229 -5.886 -6.568 1.00 0.00 C ATOM 126 C GLN A 12 -7.343 -4.497 -5.937 1.00 0.00 C ATOM 127 O GLN A 12 -6.945 -3.503 -6.541 1.00 0.00 O ATOM 128 CB GLN A 12 -8.603 -6.549 -6.685 1.00 0.00 C ATOM 129 CG GLN A 12 -9.507 -5.771 -7.643 1.00 0.00 C ATOM 130 CD GLN A 12 -10.715 -5.189 -6.906 1.00 0.00 C ATOM 131 OE1 GLN A 12 -11.807 -5.732 -6.924 1.00 0.00 O ATOM 132 NE2 GLN A 12 -10.458 -4.055 -6.259 1.00 0.00 N ATOM 0 H GLN A 12 -6.644 -7.665 -5.628 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.828 -5.774 -7.576 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.488 -7.573 -7.039 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.070 -6.603 -5.702 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -8.940 -4.966 -8.111 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -9.847 -6.429 -8.443 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.520 -3.654 -6.285 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.199 -3.587 -5.737 1.00 0.00 H new ATOM 141 N ASP A 13 -7.888 -4.474 -4.730 1.00 0.00 N ATOM 142 CA ASP A 13 -8.059 -3.223 -4.010 1.00 0.00 C ATOM 143 C ASP A 13 -6.726 -2.473 -3.976 1.00 0.00 C ATOM 144 O ASP A 13 -6.607 -1.384 -4.537 1.00 0.00 O ATOM 145 CB ASP A 13 -8.497 -3.474 -2.566 1.00 0.00 C ATOM 146 CG ASP A 13 -9.540 -2.493 -2.027 1.00 0.00 C ATOM 147 OD1 ASP A 13 -9.195 -1.296 -1.926 1.00 0.00 O ATOM 148 OD2 ASP A 13 -10.659 -2.962 -1.728 1.00 0.00 O ATOM 0 H ASP A 13 -8.217 -5.301 -4.232 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.824 -2.641 -4.523 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.900 -4.484 -2.495 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -7.617 -3.435 -1.923 1.00 0.00 H new ATOM 153 N PHE A 14 -5.756 -3.085 -3.312 1.00 0.00 N ATOM 154 CA PHE A 14 -4.436 -2.488 -3.198 1.00 0.00 C ATOM 155 C PHE A 14 -4.010 -1.840 -4.517 1.00 0.00 C ATOM 156 O PHE A 14 -3.805 -0.629 -4.580 1.00 0.00 O ATOM 157 CB PHE A 14 -3.462 -3.619 -2.861 1.00 0.00 C ATOM 158 CG PHE A 14 -2.004 -3.169 -2.741 1.00 0.00 C ATOM 159 CD1 PHE A 14 -1.570 -2.570 -1.600 1.00 0.00 C ATOM 160 CD2 PHE A 14 -1.143 -3.369 -3.774 1.00 0.00 C ATOM 161 CE1 PHE A 14 -0.217 -2.153 -1.488 1.00 0.00 C ATOM 162 CE2 PHE A 14 0.210 -2.951 -3.662 1.00 0.00 C ATOM 163 CZ PHE A 14 0.644 -2.352 -2.521 1.00 0.00 C ATOM 0 H PHE A 14 -5.858 -3.988 -2.848 1.00 0.00 H new ATOM 0 HA PHE A 14 -4.443 -1.714 -2.431 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.768 -4.080 -1.922 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -3.532 -4.387 -3.631 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.254 -2.411 -0.779 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.488 -3.846 -4.680 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.128 -1.678 -0.582 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.894 -3.109 -4.483 1.00 0.00 H new ATOM 0 HZ PHE A 14 1.673 -2.034 -2.435 1.00 0.00 H new ATOM 173 N ALA A 15 -3.891 -2.676 -5.538 1.00 0.00 N ATOM 174 CA ALA A 15 -3.494 -2.200 -6.853 1.00 0.00 C ATOM 175 C ALA A 15 -4.287 -0.936 -7.193 1.00 0.00 C ATOM 176 O ALA A 15 -3.704 0.103 -7.498 1.00 0.00 O ATOM 177 CB ALA A 15 -3.699 -3.312 -7.882 1.00 0.00 C ATOM 0 H ALA A 15 -4.062 -3.680 -5.482 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.436 -1.938 -6.864 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.401 -2.955 -8.868 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -3.092 -4.176 -7.610 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.750 -3.600 -7.902 1.00 0.00 H new ATOM 183 N VAL A 16 -5.604 -1.068 -7.130 1.00 0.00 N ATOM 184 CA VAL A 16 -6.483 0.051 -7.429 1.00 0.00 C ATOM 185 C VAL A 16 -6.085 1.250 -6.566 1.00 0.00 C ATOM 186 O VAL A 16 -6.119 2.390 -7.028 1.00 0.00 O ATOM 187 CB VAL A 16 -7.942 -0.366 -7.237 1.00 0.00 C ATOM 188 CG1 VAL A 16 -8.842 0.858 -7.054 1.00 0.00 C ATOM 189 CG2 VAL A 16 -8.424 -1.230 -8.404 1.00 0.00 C ATOM 0 H VAL A 16 -6.084 -1.932 -6.877 1.00 0.00 H new ATOM 0 HA VAL A 16 -6.379 0.352 -8.471 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.002 -0.966 -6.329 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.874 0.534 -6.919 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.520 1.418 -6.176 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.774 1.495 -7.936 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.464 -1.513 -8.242 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.342 -0.666 -9.333 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.810 -2.128 -8.470 1.00 0.00 H new ATOM 199 N LEU A 17 -5.717 0.953 -5.329 1.00 0.00 N ATOM 200 CA LEU A 17 -5.313 1.993 -4.398 1.00 0.00 C ATOM 201 C LEU A 17 -3.984 2.594 -4.857 1.00 0.00 C ATOM 202 O LEU A 17 -3.928 3.759 -5.248 1.00 0.00 O ATOM 203 CB LEU A 17 -5.280 1.449 -2.968 1.00 0.00 C ATOM 204 CG LEU A 17 -6.610 1.471 -2.211 1.00 0.00 C ATOM 205 CD1 LEU A 17 -6.551 0.576 -0.972 1.00 0.00 C ATOM 206 CD2 LEU A 17 -7.018 2.904 -1.864 1.00 0.00 C ATOM 0 H LEU A 17 -5.690 0.007 -4.949 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.044 2.802 -4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -4.920 0.421 -3.000 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.551 2.025 -2.398 1.00 0.00 H new ATOM 0 HG LEU A 17 -7.382 1.065 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.509 0.610 -0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.338 -0.450 -1.274 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.764 0.929 -0.305 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.966 2.892 -1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -6.251 3.359 -1.237 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.128 3.483 -2.781 1.00 0.00 H new ATOM 218 N THR A 18 -2.946 1.773 -4.795 1.00 0.00 N ATOM 219 CA THR A 18 -1.620 2.210 -5.200 1.00 0.00 C ATOM 220 C THR A 18 -1.709 3.104 -6.438 1.00 0.00 C ATOM 221 O THR A 18 -1.065 4.151 -6.499 1.00 0.00 O ATOM 222 CB THR A 18 -0.756 0.965 -5.410 1.00 0.00 C ATOM 223 OG1 THR A 18 -1.414 0.259 -6.458 1.00 0.00 O ATOM 224 CG2 THR A 18 -0.813 0.005 -4.220 1.00 0.00 C ATOM 0 H THR A 18 -2.996 0.807 -4.470 1.00 0.00 H new ATOM 0 HA THR A 18 -1.152 2.822 -4.429 1.00 0.00 H new ATOM 0 HB THR A 18 0.277 1.265 -5.584 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.384 0.332 -6.343 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.183 -0.861 -4.421 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.456 0.514 -3.325 1.00 0.00 H new ATOM 0 HG23 THR A 18 -1.841 -0.322 -4.066 1.00 0.00 H new ATOM 232 N ALA A 19 -2.511 2.660 -7.393 1.00 0.00 N ATOM 233 CA ALA A 19 -2.692 3.407 -8.626 1.00 0.00 C ATOM 234 C ALA A 19 -3.291 4.778 -8.304 1.00 0.00 C ATOM 235 O ALA A 19 -2.675 5.808 -8.573 1.00 0.00 O ATOM 236 CB ALA A 19 -3.566 2.601 -9.589 1.00 0.00 C ATOM 0 H ALA A 19 -3.043 1.792 -7.338 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.733 3.573 -9.117 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.701 3.162 -10.514 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.082 1.649 -9.809 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.538 2.417 -9.131 1.00 0.00 H new ATOM 242 N GLU A 20 -4.486 4.746 -7.732 1.00 0.00 N ATOM 243 CA GLU A 20 -5.175 5.973 -7.369 1.00 0.00 C ATOM 244 C GLU A 20 -4.259 6.869 -6.532 1.00 0.00 C ATOM 245 O GLU A 20 -4.395 8.091 -6.551 1.00 0.00 O ATOM 246 CB GLU A 20 -6.477 5.672 -6.625 1.00 0.00 C ATOM 247 CG GLU A 20 -7.619 6.550 -7.140 1.00 0.00 C ATOM 248 CD GLU A 20 -8.076 6.097 -8.528 1.00 0.00 C ATOM 249 OE1 GLU A 20 -7.310 6.340 -9.485 1.00 0.00 O ATOM 250 OE2 GLU A 20 -9.182 5.519 -8.600 1.00 0.00 O ATOM 0 H GLU A 20 -4.995 3.890 -7.511 1.00 0.00 H new ATOM 0 HA GLU A 20 -5.434 6.505 -8.284 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -6.737 4.621 -6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -6.337 5.841 -5.557 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -8.458 6.507 -6.445 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.293 7.589 -7.182 1.00 0.00 H new ATOM 257 N ILE A 21 -3.348 6.226 -5.817 1.00 0.00 N ATOM 258 CA ILE A 21 -2.411 6.949 -4.975 1.00 0.00 C ATOM 259 C ILE A 21 -1.291 7.526 -5.844 1.00 0.00 C ATOM 260 O ILE A 21 -1.156 8.743 -5.960 1.00 0.00 O ATOM 261 CB ILE A 21 -1.909 6.053 -3.840 1.00 0.00 C ATOM 262 CG1 ILE A 21 -3.071 5.561 -2.975 1.00 0.00 C ATOM 263 CG2 ILE A 21 -0.839 6.766 -3.011 1.00 0.00 C ATOM 264 CD1 ILE A 21 -2.683 4.298 -2.204 1.00 0.00 C ATOM 0 H ILE A 21 -3.239 5.212 -5.804 1.00 0.00 H new ATOM 0 HA ILE A 21 -2.905 7.791 -4.491 1.00 0.00 H new ATOM 0 HB ILE A 21 -1.441 5.173 -4.281 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -3.365 6.343 -2.275 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -3.937 5.356 -3.605 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.499 6.108 -2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.005 7.025 -3.651 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -1.259 7.674 -2.579 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.526 3.969 -1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -2.413 3.511 -2.908 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.833 4.513 -1.557 1.00 0.00 H new ATOM 276 N THR A 22 -0.518 6.625 -6.432 1.00 0.00 N ATOM 277 CA THR A 22 0.585 7.030 -7.286 1.00 0.00 C ATOM 278 C THR A 22 0.191 8.246 -8.126 1.00 0.00 C ATOM 279 O THR A 22 0.947 9.212 -8.219 1.00 0.00 O ATOM 280 CB THR A 22 1.000 5.820 -8.127 1.00 0.00 C ATOM 281 OG1 THR A 22 2.302 5.495 -7.648 1.00 0.00 O ATOM 282 CG2 THR A 22 1.222 6.178 -9.598 1.00 0.00 C ATOM 0 H THR A 22 -0.634 5.616 -6.334 1.00 0.00 H new ATOM 0 HA THR A 22 1.446 7.346 -6.697 1.00 0.00 H new ATOM 0 HB THR A 22 0.235 5.047 -8.053 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.647 4.719 -8.138 1.00 0.00 H new ATOM 0 HG21 THR A 22 1.515 5.285 -10.150 1.00 0.00 H new ATOM 0 HG22 THR A 22 0.299 6.578 -10.018 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.011 6.927 -9.675 1.00 0.00 H new ATOM 290 N SER A 23 -0.992 8.160 -8.716 1.00 0.00 N ATOM 291 CA SER A 23 -1.496 9.242 -9.545 1.00 0.00 C ATOM 292 C SER A 23 -1.648 10.514 -8.709 1.00 0.00 C ATOM 293 O SER A 23 -1.092 11.556 -9.051 1.00 0.00 O ATOM 294 CB SER A 23 -2.832 8.866 -10.188 1.00 0.00 C ATOM 295 OG SER A 23 -2.797 7.568 -10.774 1.00 0.00 O ATOM 0 H SER A 23 -1.616 7.357 -8.636 1.00 0.00 H new ATOM 0 HA SER A 23 -0.778 9.424 -10.344 1.00 0.00 H new ATOM 0 HB2 SER A 23 -3.619 8.903 -9.435 1.00 0.00 H new ATOM 0 HB3 SER A 23 -3.086 9.601 -10.951 1.00 0.00 H new ATOM 0 HG SER A 23 -2.832 6.889 -10.068 1.00 0.00 H new ATOM 301 N LYS A 24 -2.405 10.387 -7.629 1.00 0.00 N ATOM 302 CA LYS A 24 -2.637 11.514 -6.741 1.00 0.00 C ATOM 303 C LYS A 24 -1.293 12.076 -6.275 1.00 0.00 C ATOM 304 O LYS A 24 -1.119 13.291 -6.195 1.00 0.00 O ATOM 305 CB LYS A 24 -3.565 11.109 -5.594 1.00 0.00 C ATOM 306 CG LYS A 24 -5.005 10.945 -6.085 1.00 0.00 C ATOM 307 CD LYS A 24 -5.863 10.230 -5.039 1.00 0.00 C ATOM 308 CE LYS A 24 -7.351 10.356 -5.372 1.00 0.00 C ATOM 309 NZ LYS A 24 -8.068 11.057 -4.284 1.00 0.00 N ATOM 0 H LYS A 24 -2.866 9.521 -7.349 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.152 12.316 -7.270 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.218 10.174 -5.154 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.529 11.864 -4.808 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.432 11.924 -6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.013 10.378 -7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.585 9.177 -4.993 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.670 10.654 -4.054 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.475 10.901 -6.308 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.782 9.366 -5.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.076 11.134 -4.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.964 10.521 -3.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.668 12.009 -4.162 1.00 0.00 H new ATOM 323 N ILE A 25 -0.377 11.166 -5.980 1.00 0.00 N ATOM 324 CA ILE A 25 0.947 11.556 -5.524 1.00 0.00 C ATOM 325 C ILE A 25 1.605 12.443 -6.583 1.00 0.00 C ATOM 326 O ILE A 25 2.378 13.341 -6.252 1.00 0.00 O ATOM 327 CB ILE A 25 1.772 10.322 -5.157 1.00 0.00 C ATOM 328 CG1 ILE A 25 1.274 9.698 -3.851 1.00 0.00 C ATOM 329 CG2 ILE A 25 3.264 10.657 -5.100 1.00 0.00 C ATOM 330 CD1 ILE A 25 1.961 8.356 -3.588 1.00 0.00 C ATOM 0 H ILE A 25 -0.525 10.159 -6.048 1.00 0.00 H new ATOM 0 HA ILE A 25 0.877 12.147 -4.611 1.00 0.00 H new ATOM 0 HB ILE A 25 1.639 9.577 -5.941 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.467 10.378 -3.022 1.00 0.00 H new ATOM 0 HG13 ILE A 25 0.195 9.555 -3.901 1.00 0.00 H new ATOM 0 HG21 ILE A 25 3.828 9.762 -4.837 1.00 0.00 H new ATOM 0 HG22 ILE A 25 3.593 11.020 -6.074 1.00 0.00 H new ATOM 0 HG23 ILE A 25 3.435 11.428 -4.349 1.00 0.00 H new ATOM 0 HD11 ILE A 25 1.589 7.934 -2.654 1.00 0.00 H new ATOM 0 HD12 ILE A 25 1.746 7.670 -4.407 1.00 0.00 H new ATOM 0 HD13 ILE A 25 3.038 8.507 -3.515 1.00 0.00 H new ATOM 342 N ALA A 26 1.274 12.161 -7.835 1.00 0.00 N ATOM 343 CA ALA A 26 1.823 12.922 -8.944 1.00 0.00 C ATOM 344 C ALA A 26 1.063 14.243 -9.076 1.00 0.00 C ATOM 345 O ALA A 26 1.555 15.187 -9.693 1.00 0.00 O ATOM 346 CB ALA A 26 1.759 12.082 -10.221 1.00 0.00 C ATOM 0 H ALA A 26 0.632 11.416 -8.106 1.00 0.00 H new ATOM 0 HA ALA A 26 2.871 13.161 -8.764 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.171 12.653 -11.053 1.00 0.00 H new ATOM 0 HB2 ALA A 26 2.339 11.169 -10.085 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.722 11.825 -10.436 1.00 0.00 H new ATOM 352 N ARG A 27 -0.123 14.268 -8.486 1.00 0.00 N ATOM 353 CA ARG A 27 -0.955 15.458 -8.530 1.00 0.00 C ATOM 354 C ARG A 27 -0.622 16.384 -7.358 1.00 0.00 C ATOM 355 O ARG A 27 -0.711 17.604 -7.481 1.00 0.00 O ATOM 356 CB ARG A 27 -2.440 15.094 -8.476 1.00 0.00 C ATOM 357 CG ARG A 27 -2.862 14.326 -9.731 1.00 0.00 C ATOM 358 CD ARG A 27 -4.307 14.654 -10.114 1.00 0.00 C ATOM 359 NE ARG A 27 -5.216 14.316 -8.996 1.00 0.00 N ATOM 360 CZ ARG A 27 -6.551 14.264 -9.103 1.00 0.00 C ATOM 361 NH1 ARG A 27 -7.140 14.527 -10.278 1.00 0.00 N ATOM 362 NH2 ARG A 27 -7.297 13.949 -8.036 1.00 0.00 N ATOM 0 H ARG A 27 -0.527 13.483 -7.975 1.00 0.00 H new ATOM 0 HA ARG A 27 -0.751 15.969 -9.471 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.638 14.489 -7.591 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.037 16.001 -8.382 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.197 14.578 -10.557 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.762 13.255 -9.557 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -4.396 15.713 -10.358 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.591 14.096 -11.006 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.801 14.110 -8.088 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.572 14.767 -11.091 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.156 14.487 -10.359 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.849 13.749 -7.142 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -8.313 13.910 -8.118 1.00 0.00 H new ATOM 376 N VAL A 28 -0.244 15.767 -6.248 1.00 0.00 N ATOM 377 CA VAL A 28 0.104 16.520 -5.055 1.00 0.00 C ATOM 378 C VAL A 28 0.854 17.790 -5.460 1.00 0.00 C ATOM 379 O VAL A 28 0.476 18.892 -5.063 1.00 0.00 O ATOM 380 CB VAL A 28 0.900 15.636 -4.092 1.00 0.00 C ATOM 381 CG1 VAL A 28 2.079 16.404 -3.491 1.00 0.00 C ATOM 382 CG2 VAL A 28 -0.003 15.071 -2.994 1.00 0.00 C ATOM 0 H VAL A 28 -0.171 14.754 -6.150 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.795 16.830 -4.522 1.00 0.00 H new ATOM 0 HB VAL A 28 1.301 14.797 -4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.628 15.753 -2.810 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.742 16.736 -4.290 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.708 17.271 -2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.587 14.446 -2.323 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.447 15.891 -2.430 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.794 14.472 -3.446 1.00 0.00 H new ATOM 392 N PRO A 29 1.932 17.590 -6.264 1.00 0.00 N ATOM 393 CA PRO A 29 2.739 18.706 -6.727 1.00 0.00 C ATOM 394 C PRO A 29 2.017 19.484 -7.829 1.00 0.00 C ATOM 395 O PRO A 29 2.219 20.689 -7.977 1.00 0.00 O ATOM 396 CB PRO A 29 4.042 18.081 -7.197 1.00 0.00 C ATOM 397 CG PRO A 29 3.744 16.607 -7.414 1.00 0.00 C ATOM 398 CD PRO A 29 2.409 16.299 -6.753 1.00 0.00 C ATOM 0 HA PRO A 29 2.926 19.443 -5.946 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.389 18.549 -8.118 1.00 0.00 H new ATOM 0 HB3 PRO A 29 4.829 18.215 -6.455 1.00 0.00 H new ATOM 0 HG2 PRO A 29 3.704 16.378 -8.479 1.00 0.00 H new ATOM 0 HG3 PRO A 29 4.534 15.991 -6.985 1.00 0.00 H new ATOM 0 HD2 PRO A 29 1.707 15.860 -7.463 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.526 15.585 -5.938 1.00 0.00 H new ATOM 406 N ARG A 30 1.191 18.764 -8.574 1.00 0.00 N ATOM 407 CA ARG A 30 0.439 19.372 -9.658 1.00 0.00 C ATOM 408 C ARG A 30 -0.957 19.773 -9.176 1.00 0.00 C ATOM 409 O ARG A 30 -1.915 19.746 -9.947 1.00 0.00 O ATOM 410 CB ARG A 30 0.307 18.413 -10.843 1.00 0.00 C ATOM 411 CG ARG A 30 1.514 18.523 -11.775 1.00 0.00 C ATOM 412 CD ARG A 30 1.201 17.930 -13.150 1.00 0.00 C ATOM 413 NE ARG A 30 2.457 17.561 -13.841 1.00 0.00 N ATOM 414 CZ ARG A 30 2.532 16.675 -14.843 1.00 0.00 C ATOM 415 NH1 ARG A 30 1.423 16.062 -15.279 1.00 0.00 N ATOM 416 NH2 ARG A 30 3.715 16.403 -15.410 1.00 0.00 N ATOM 0 H ARG A 30 1.026 17.765 -8.448 1.00 0.00 H new ATOM 0 HA ARG A 30 0.983 20.259 -9.983 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.217 17.390 -10.479 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.605 18.636 -11.396 1.00 0.00 H new ATOM 0 HG2 ARG A 30 1.800 19.569 -11.883 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.365 18.003 -11.336 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.565 17.051 -13.040 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.646 18.652 -13.749 1.00 0.00 H new ATOM 0 HE ARG A 30 3.320 18.010 -13.535 1.00 0.00 H new ATOM 0 HH11 ARG A 30 0.522 16.270 -14.848 1.00 0.00 H new ATOM 0 HH12 ARG A 30 1.480 15.387 -16.042 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.559 16.871 -15.079 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.772 15.728 -16.173 1.00 0.00 H new ATOM 430 N LEU A 31 -1.028 20.134 -7.904 1.00 0.00 N ATOM 431 CA LEU A 31 -2.290 20.540 -7.310 1.00 0.00 C ATOM 432 C LEU A 31 -2.102 21.871 -6.580 1.00 0.00 C ATOM 433 O LEU A 31 -0.980 22.243 -6.239 1.00 0.00 O ATOM 434 CB LEU A 31 -2.847 19.425 -6.422 1.00 0.00 C ATOM 435 CG LEU A 31 -3.490 18.244 -7.152 1.00 0.00 C ATOM 436 CD1 LEU A 31 -3.714 17.067 -6.199 1.00 0.00 C ATOM 437 CD2 LEU A 31 -4.782 18.669 -7.851 1.00 0.00 C ATOM 0 H LEU A 31 -0.231 20.154 -7.267 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.039 20.705 -8.084 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.037 19.044 -5.800 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.588 19.859 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.802 17.905 -7.926 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.172 16.241 -6.743 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.757 16.745 -5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.372 17.376 -5.387 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.218 17.811 -8.362 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.488 19.049 -7.112 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.562 19.451 -8.578 1.00 0.00 H new ATOM 449 N PRO A 32 -3.246 22.571 -6.357 1.00 0.00 N ATOM 450 CA PRO A 32 -3.218 23.853 -5.674 1.00 0.00 C ATOM 451 C PRO A 32 -2.996 23.669 -4.171 1.00 0.00 C ATOM 452 O PRO A 32 -3.076 22.553 -3.660 1.00 0.00 O ATOM 453 CB PRO A 32 -4.552 24.503 -6.002 1.00 0.00 C ATOM 454 CG PRO A 32 -5.461 23.377 -6.466 1.00 0.00 C ATOM 455 CD PRO A 32 -4.592 22.162 -6.747 1.00 0.00 C ATOM 0 HA PRO A 32 -2.392 24.485 -5.999 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.967 25.005 -5.128 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.438 25.258 -6.779 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -6.204 23.147 -5.702 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -6.007 23.672 -7.362 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.924 21.296 -6.174 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.631 21.882 -7.800 1.00 0.00 H new ATOM 463 N PRO A 33 -2.714 24.811 -3.488 1.00 0.00 N ATOM 464 CA PRO A 33 -2.480 24.786 -2.054 1.00 0.00 C ATOM 465 C PRO A 33 -3.792 24.610 -1.287 1.00 0.00 C ATOM 466 O PRO A 33 -3.799 24.598 -0.057 1.00 0.00 O ATOM 467 CB PRO A 33 -1.784 26.102 -1.746 1.00 0.00 C ATOM 468 CG PRO A 33 -2.069 27.011 -2.930 1.00 0.00 C ATOM 469 CD PRO A 33 -2.611 26.150 -4.060 1.00 0.00 C ATOM 0 HA PRO A 33 -1.864 23.942 -1.743 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.162 26.536 -0.820 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.712 25.956 -1.615 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.791 27.780 -2.656 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.160 27.525 -3.244 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.581 26.510 -4.402 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -1.944 26.162 -4.922 1.00 0.00 H new ATOM 477 N ASP A 34 -4.870 24.479 -2.045 1.00 0.00 N ATOM 478 CA ASP A 34 -6.185 24.304 -1.452 1.00 0.00 C ATOM 479 C ASP A 34 -6.592 22.833 -1.549 1.00 0.00 C ATOM 480 O ASP A 34 -7.283 22.317 -0.671 1.00 0.00 O ATOM 481 CB ASP A 34 -7.237 25.135 -2.190 1.00 0.00 C ATOM 482 CG ASP A 34 -7.640 26.436 -1.493 1.00 0.00 C ATOM 483 OD1 ASP A 34 -6.785 26.972 -0.755 1.00 0.00 O ATOM 484 OD2 ASP A 34 -8.793 26.864 -1.713 1.00 0.00 O ATOM 0 H ASP A 34 -4.860 24.490 -3.065 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.132 24.629 -0.413 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -6.857 25.375 -3.183 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.129 24.524 -2.329 1.00 0.00 H new ATOM 489 N GLU A 35 -6.147 22.198 -2.624 1.00 0.00 N ATOM 490 CA GLU A 35 -6.457 20.796 -2.846 1.00 0.00 C ATOM 491 C GLU A 35 -5.249 19.924 -2.498 1.00 0.00 C ATOM 492 O GLU A 35 -5.395 18.732 -2.232 1.00 0.00 O ATOM 493 CB GLU A 35 -6.908 20.556 -4.288 1.00 0.00 C ATOM 494 CG GLU A 35 -8.434 20.564 -4.394 1.00 0.00 C ATOM 495 CD GLU A 35 -8.895 21.343 -5.628 1.00 0.00 C ATOM 496 OE1 GLU A 35 -8.787 20.770 -6.733 1.00 0.00 O ATOM 497 OE2 GLU A 35 -9.344 22.494 -5.437 1.00 0.00 O ATOM 0 H GLU A 35 -5.575 22.629 -3.350 1.00 0.00 H new ATOM 0 HA GLU A 35 -7.282 20.518 -2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -6.491 21.327 -4.936 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.521 19.600 -4.640 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -8.804 19.540 -4.447 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -8.862 21.011 -3.497 1.00 0.00 H new ATOM 504 N LYS A 36 -4.083 20.552 -2.509 1.00 0.00 N ATOM 505 CA LYS A 36 -2.850 19.849 -2.198 1.00 0.00 C ATOM 506 C LYS A 36 -2.893 19.373 -0.744 1.00 0.00 C ATOM 507 O LYS A 36 -2.761 18.180 -0.474 1.00 0.00 O ATOM 508 CB LYS A 36 -1.637 20.723 -2.523 1.00 0.00 C ATOM 509 CG LYS A 36 -0.339 20.048 -2.075 1.00 0.00 C ATOM 510 CD LYS A 36 0.882 20.816 -2.584 1.00 0.00 C ATOM 511 CE LYS A 36 2.069 20.652 -1.632 1.00 0.00 C ATOM 512 NZ LYS A 36 2.081 21.739 -0.628 1.00 0.00 N ATOM 0 H LYS A 36 -3.966 21.541 -2.729 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.750 18.961 -2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.600 20.915 -3.595 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.738 21.689 -2.029 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.311 19.993 -0.987 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.310 19.024 -2.447 1.00 0.00 H new ATOM 0 HD2 LYS A 36 1.155 20.456 -3.576 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.635 21.873 -2.685 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.010 19.686 -1.130 1.00 0.00 H new ATOM 0 HE3 LYS A 36 3.001 20.661 -2.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 2.695 21.470 0.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 2.442 22.611 -1.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.114 21.901 -0.280 1.00 0.00 H new ATOM 526 N LYS A 37 -3.078 20.330 0.153 1.00 0.00 N ATOM 527 CA LYS A 37 -3.140 20.024 1.572 1.00 0.00 C ATOM 528 C LYS A 37 -4.002 18.778 1.783 1.00 0.00 C ATOM 529 O LYS A 37 -3.542 17.789 2.351 1.00 0.00 O ATOM 530 CB LYS A 37 -3.617 21.243 2.363 1.00 0.00 C ATOM 531 CG LYS A 37 -2.500 21.793 3.251 1.00 0.00 C ATOM 532 CD LYS A 37 -1.848 23.023 2.615 1.00 0.00 C ATOM 533 CE LYS A 37 -0.381 22.753 2.278 1.00 0.00 C ATOM 534 NZ LYS A 37 0.382 24.021 2.231 1.00 0.00 N ATOM 0 H LYS A 37 -3.187 21.318 -0.075 1.00 0.00 H new ATOM 0 HA LYS A 37 -2.146 19.794 1.956 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -3.954 22.018 1.675 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -4.474 20.969 2.979 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -2.904 22.056 4.229 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -1.747 21.022 3.414 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.388 23.298 1.709 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -1.918 23.870 3.297 1.00 0.00 H new ATOM 0 HE2 LYS A 37 0.053 22.088 3.024 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -0.310 22.243 1.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.376 23.820 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -0.023 24.643 1.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 0.329 24.492 3.157 1.00 0.00 H new ATOM 548 N GLN A 38 -5.238 18.866 1.314 1.00 0.00 N ATOM 549 CA GLN A 38 -6.169 17.758 1.445 1.00 0.00 C ATOM 550 C GLN A 38 -5.613 16.513 0.750 1.00 0.00 C ATOM 551 O GLN A 38 -5.685 15.411 1.292 1.00 0.00 O ATOM 552 CB GLN A 38 -7.545 18.129 0.887 1.00 0.00 C ATOM 553 CG GLN A 38 -8.095 19.381 1.574 1.00 0.00 C ATOM 554 CD GLN A 38 -8.432 19.099 3.039 1.00 0.00 C ATOM 555 OE1 GLN A 38 -9.537 18.715 3.386 1.00 0.00 O ATOM 556 NE2 GLN A 38 -7.422 19.310 3.877 1.00 0.00 N ATOM 0 H GLN A 38 -5.616 19.688 0.843 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.291 17.535 2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.472 18.301 -0.187 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.236 17.298 1.030 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.361 20.185 1.514 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -8.988 19.724 1.051 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.522 19.632 3.520 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -7.547 19.150 4.877 1.00 0.00 H new ATOM 565 N MET A 39 -5.072 16.731 -0.440 1.00 0.00 N ATOM 566 CA MET A 39 -4.504 15.640 -1.214 1.00 0.00 C ATOM 567 C MET A 39 -3.345 14.980 -0.464 1.00 0.00 C ATOM 568 O MET A 39 -3.201 13.759 -0.488 1.00 0.00 O ATOM 569 CB MET A 39 -4.004 16.175 -2.558 1.00 0.00 C ATOM 570 CG MET A 39 -3.485 15.038 -3.441 1.00 0.00 C ATOM 571 SD MET A 39 -4.723 13.760 -3.582 1.00 0.00 S ATOM 572 CE MET A 39 -5.525 14.270 -5.092 1.00 0.00 C ATOM 0 H MET A 39 -5.015 17.646 -0.887 1.00 0.00 H new ATOM 0 HA MET A 39 -5.280 14.892 -1.376 1.00 0.00 H new ATOM 0 HB2 MET A 39 -4.813 16.697 -3.069 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.210 16.903 -2.391 1.00 0.00 H new ATOM 0 HG2 MET A 39 -3.232 15.421 -4.430 1.00 0.00 H new ATOM 0 HG3 MET A 39 -2.571 14.625 -3.015 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.462 13.725 -5.208 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.730 15.340 -5.052 1.00 0.00 H new ATOM 0 HE3 MET A 39 -4.874 14.057 -5.940 1.00 0.00 H new ATOM 582 N VAL A 40 -2.549 15.817 0.184 1.00 0.00 N ATOM 583 CA VAL A 40 -1.407 15.330 0.940 1.00 0.00 C ATOM 584 C VAL A 40 -1.895 14.718 2.255 1.00 0.00 C ATOM 585 O VAL A 40 -1.097 14.215 3.043 1.00 0.00 O ATOM 586 CB VAL A 40 -0.395 16.459 1.145 1.00 0.00 C ATOM 587 CG1 VAL A 40 0.722 16.027 2.097 1.00 0.00 C ATOM 588 CG2 VAL A 40 0.176 16.934 -0.192 1.00 0.00 C ATOM 0 H VAL A 40 -2.672 16.829 0.201 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.890 14.545 0.388 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.918 17.299 1.602 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.428 16.847 2.226 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.294 15.762 3.064 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.241 15.164 1.681 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.892 17.737 -0.017 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.676 16.103 -0.690 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.633 17.301 -0.823 1.00 0.00 H new ATOM 598 N ALA A 41 -3.204 14.782 2.450 1.00 0.00 N ATOM 599 CA ALA A 41 -3.808 14.240 3.656 1.00 0.00 C ATOM 600 C ALA A 41 -4.663 13.025 3.291 1.00 0.00 C ATOM 601 O ALA A 41 -4.724 12.056 4.046 1.00 0.00 O ATOM 602 CB ALA A 41 -4.617 15.333 4.357 1.00 0.00 C ATOM 0 H ALA A 41 -3.863 15.201 1.794 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.040 13.905 4.353 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.070 14.927 5.261 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -3.958 16.160 4.621 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.400 15.692 3.689 1.00 0.00 H new ATOM 608 N ASN A 42 -5.302 13.117 2.134 1.00 0.00 N ATOM 609 CA ASN A 42 -6.151 12.037 1.660 1.00 0.00 C ATOM 610 C ASN A 42 -5.287 10.811 1.355 1.00 0.00 C ATOM 611 O ASN A 42 -5.643 9.691 1.717 1.00 0.00 O ATOM 612 CB ASN A 42 -6.880 12.433 0.375 1.00 0.00 C ATOM 613 CG ASN A 42 -8.019 11.459 0.069 1.00 0.00 C ATOM 614 OD1 ASN A 42 -7.993 10.717 -0.899 1.00 0.00 O ATOM 615 ND2 ASN A 42 -9.019 11.503 0.945 1.00 0.00 N ATOM 0 H ASN A 42 -5.249 13.923 1.511 1.00 0.00 H new ATOM 0 HA ASN A 42 -6.883 11.818 2.437 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -7.277 13.443 0.475 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -6.176 12.448 -0.457 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.827 10.892 0.828 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.978 12.148 1.734 1.00 0.00 H new ATOM 622 N VAL A 43 -4.168 11.066 0.693 1.00 0.00 N ATOM 623 CA VAL A 43 -3.251 9.997 0.335 1.00 0.00 C ATOM 624 C VAL A 43 -2.737 9.324 1.609 1.00 0.00 C ATOM 625 O VAL A 43 -2.548 8.109 1.641 1.00 0.00 O ATOM 626 CB VAL A 43 -2.127 10.546 -0.546 1.00 0.00 C ATOM 627 CG1 VAL A 43 -0.977 9.542 -0.655 1.00 0.00 C ATOM 628 CG2 VAL A 43 -2.653 10.929 -1.931 1.00 0.00 C ATOM 0 H VAL A 43 -3.876 11.997 0.395 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.763 9.234 -0.252 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.741 11.449 -0.073 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.191 9.956 -1.286 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -0.576 9.339 0.338 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.344 8.614 -1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.834 11.316 -2.537 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.078 10.050 -2.415 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.422 11.694 -1.829 1.00 0.00 H new ATOM 638 N GLU A 44 -2.526 10.143 2.629 1.00 0.00 N ATOM 639 CA GLU A 44 -2.038 9.642 3.903 1.00 0.00 C ATOM 640 C GLU A 44 -2.945 8.520 4.415 1.00 0.00 C ATOM 641 O GLU A 44 -2.541 7.731 5.267 1.00 0.00 O ATOM 642 CB GLU A 44 -1.928 10.770 4.930 1.00 0.00 C ATOM 643 CG GLU A 44 -0.655 11.590 4.710 1.00 0.00 C ATOM 644 CD GLU A 44 0.160 11.694 6.001 1.00 0.00 C ATOM 645 OE1 GLU A 44 0.921 10.739 6.269 1.00 0.00 O ATOM 646 OE2 GLU A 44 0.004 12.725 6.689 1.00 0.00 O ATOM 0 H GLU A 44 -2.684 11.150 2.599 1.00 0.00 H new ATOM 0 HA GLU A 44 -1.038 9.234 3.752 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.800 11.419 4.857 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.926 10.351 5.936 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.050 11.127 3.930 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.917 12.588 4.360 1.00 0.00 H new ATOM 653 N LYS A 45 -4.153 8.486 3.872 1.00 0.00 N ATOM 654 CA LYS A 45 -5.120 7.475 4.264 1.00 0.00 C ATOM 655 C LYS A 45 -5.016 6.280 3.313 1.00 0.00 C ATOM 656 O LYS A 45 -4.753 5.159 3.746 1.00 0.00 O ATOM 657 CB LYS A 45 -6.525 8.078 4.341 1.00 0.00 C ATOM 658 CG LYS A 45 -7.329 7.449 5.481 1.00 0.00 C ATOM 659 CD LYS A 45 -8.624 6.824 4.958 1.00 0.00 C ATOM 660 CE LYS A 45 -9.686 7.895 4.702 1.00 0.00 C ATOM 661 NZ LYS A 45 -11.003 7.270 4.450 1.00 0.00 N ATOM 0 H LYS A 45 -4.484 9.142 3.164 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.900 7.107 5.266 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.455 9.155 4.492 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.044 7.922 3.395 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -6.728 6.687 5.978 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.563 8.208 6.228 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -8.422 6.279 4.036 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.000 6.100 5.680 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.752 8.562 5.561 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.397 8.505 3.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.712 8.011 4.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -10.940 6.651 3.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.284 6.707 5.278 1.00 0.00 H new ATOM 675 N GLN A 46 -5.226 6.561 2.036 1.00 0.00 N ATOM 676 CA GLN A 46 -5.159 5.524 1.020 1.00 0.00 C ATOM 677 C GLN A 46 -3.857 4.732 1.156 1.00 0.00 C ATOM 678 O GLN A 46 -3.814 3.542 0.847 1.00 0.00 O ATOM 679 CB GLN A 46 -5.294 6.120 -0.382 1.00 0.00 C ATOM 680 CG GLN A 46 -6.765 6.303 -0.761 1.00 0.00 C ATOM 681 CD GLN A 46 -7.579 6.811 0.431 1.00 0.00 C ATOM 682 OE1 GLN A 46 -7.665 7.999 0.696 1.00 0.00 O ATOM 683 NE2 GLN A 46 -8.168 5.848 1.134 1.00 0.00 N ATOM 0 H GLN A 46 -5.443 7.492 1.681 1.00 0.00 H new ATOM 0 HA GLN A 46 -5.995 4.841 1.170 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -4.782 7.081 -0.423 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -4.807 5.468 -1.107 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -6.846 7.008 -1.588 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -7.175 5.355 -1.109 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -8.055 4.873 0.857 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -8.733 6.085 1.950 1.00 0.00 H new ATOM 692 N LEU A 47 -2.826 5.424 1.620 1.00 0.00 N ATOM 693 CA LEU A 47 -1.526 4.800 1.800 1.00 0.00 C ATOM 694 C LEU A 47 -1.605 3.790 2.947 1.00 0.00 C ATOM 695 O LEU A 47 -1.451 2.589 2.732 1.00 0.00 O ATOM 696 CB LEU A 47 -0.443 5.864 1.991 1.00 0.00 C ATOM 697 CG LEU A 47 0.152 6.452 0.711 1.00 0.00 C ATOM 698 CD1 LEU A 47 1.054 7.648 1.024 1.00 0.00 C ATOM 699 CD2 LEU A 47 0.885 5.378 -0.097 1.00 0.00 C ATOM 0 H LEU A 47 -2.865 6.410 1.877 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.242 4.246 0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.862 6.679 2.581 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.366 5.429 2.578 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.666 6.819 0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.464 8.047 0.096 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.472 8.421 1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.869 7.329 1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.299 5.823 -1.002 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.693 4.959 0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.186 4.587 -0.368 1.00 0.00 H new ATOM 711 N GLU A 48 -1.845 4.315 4.140 1.00 0.00 N ATOM 712 CA GLU A 48 -1.946 3.474 5.320 1.00 0.00 C ATOM 713 C GLU A 48 -2.963 2.354 5.089 1.00 0.00 C ATOM 714 O GLU A 48 -2.848 1.277 5.671 1.00 0.00 O ATOM 715 CB GLU A 48 -2.314 4.302 6.553 1.00 0.00 C ATOM 716 CG GLU A 48 -3.587 5.113 6.309 1.00 0.00 C ATOM 717 CD GLU A 48 -3.909 6.004 7.511 1.00 0.00 C ATOM 718 OE1 GLU A 48 -3.321 7.106 7.574 1.00 0.00 O ATOM 719 OE2 GLU A 48 -4.734 5.564 8.339 1.00 0.00 O ATOM 0 H GLU A 48 -1.972 5.312 4.314 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.972 3.021 5.504 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -2.457 3.642 7.409 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.493 4.974 6.803 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.465 5.729 5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -4.421 4.438 6.118 1.00 0.00 H new ATOM 726 N GLU A 49 -3.935 2.647 4.238 1.00 0.00 N ATOM 727 CA GLU A 49 -4.971 1.679 3.922 1.00 0.00 C ATOM 728 C GLU A 49 -4.393 0.538 3.082 1.00 0.00 C ATOM 729 O GLU A 49 -4.883 -0.589 3.138 1.00 0.00 O ATOM 730 CB GLU A 49 -6.146 2.346 3.205 1.00 0.00 C ATOM 731 CG GLU A 49 -6.871 3.323 4.134 1.00 0.00 C ATOM 732 CD GLU A 49 -8.350 2.957 4.267 1.00 0.00 C ATOM 733 OE1 GLU A 49 -9.017 2.896 3.212 1.00 0.00 O ATOM 734 OE2 GLU A 49 -8.781 2.747 5.422 1.00 0.00 O ATOM 0 H GLU A 49 -4.027 3.542 3.757 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.348 1.262 4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.785 2.876 2.323 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.844 1.585 2.856 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.400 3.313 5.117 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.777 4.337 3.746 1.00 0.00 H new ATOM 741 N ALA A 50 -3.359 0.870 2.322 1.00 0.00 N ATOM 742 CA ALA A 50 -2.710 -0.112 1.472 1.00 0.00 C ATOM 743 C ALA A 50 -1.629 -0.841 2.274 1.00 0.00 C ATOM 744 O ALA A 50 -1.306 -1.992 1.985 1.00 0.00 O ATOM 745 CB ALA A 50 -2.146 0.581 0.229 1.00 0.00 C ATOM 0 H ALA A 50 -2.955 1.806 2.278 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.428 -0.859 1.132 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.659 -0.156 -0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -2.957 1.058 -0.321 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.420 1.336 0.531 1.00 0.00 H new ATOM 751 N ARG A 51 -1.101 -0.140 3.266 1.00 0.00 N ATOM 752 CA ARG A 51 -0.063 -0.705 4.112 1.00 0.00 C ATOM 753 C ARG A 51 -0.572 -1.974 4.799 1.00 0.00 C ATOM 754 O ARG A 51 0.119 -2.991 4.823 1.00 0.00 O ATOM 755 CB ARG A 51 0.387 0.298 5.176 1.00 0.00 C ATOM 756 CG ARG A 51 1.284 1.377 4.568 1.00 0.00 C ATOM 757 CD ARG A 51 2.299 1.888 5.593 1.00 0.00 C ATOM 758 NE ARG A 51 1.991 3.290 5.954 1.00 0.00 N ATOM 759 CZ ARG A 51 2.528 3.930 7.002 1.00 0.00 C ATOM 760 NH1 ARG A 51 3.401 3.299 7.798 1.00 0.00 N ATOM 761 NH2 ARG A 51 2.190 5.202 7.254 1.00 0.00 N ATOM 0 H ARG A 51 -1.372 0.814 3.503 1.00 0.00 H new ATOM 0 HA ARG A 51 0.788 -0.948 3.476 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.486 0.762 5.636 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.925 -0.223 5.968 1.00 0.00 H new ATOM 0 HG2 ARG A 51 1.808 0.973 3.702 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.672 2.206 4.213 1.00 0.00 H new ATOM 0 HD2 ARG A 51 2.276 1.261 6.484 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.307 1.822 5.183 1.00 0.00 H new ATOM 0 HE ARG A 51 1.329 3.801 5.369 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.658 2.331 7.607 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.809 3.787 8.595 1.00 0.00 H new ATOM 0 HH21 ARG A 51 1.524 5.682 6.648 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.598 5.690 8.051 1.00 0.00 H new ATOM 775 N GLU A 52 -1.777 -1.872 5.342 1.00 0.00 N ATOM 776 CA GLU A 52 -2.386 -2.999 6.028 1.00 0.00 C ATOM 777 C GLU A 52 -2.541 -4.182 5.071 1.00 0.00 C ATOM 778 O GLU A 52 -2.385 -5.334 5.472 1.00 0.00 O ATOM 779 CB GLU A 52 -3.733 -2.606 6.638 1.00 0.00 C ATOM 780 CG GLU A 52 -4.841 -2.632 5.584 1.00 0.00 C ATOM 781 CD GLU A 52 -5.428 -4.038 5.439 1.00 0.00 C ATOM 782 OE1 GLU A 52 -5.543 -4.715 6.484 1.00 0.00 O ATOM 783 OE2 GLU A 52 -5.749 -4.403 4.288 1.00 0.00 O ATOM 0 H GLU A 52 -2.347 -1.027 5.321 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.729 -3.301 6.844 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -3.982 -3.290 7.449 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -3.662 -1.609 7.072 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -5.629 -1.932 5.862 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -4.443 -2.299 4.625 1.00 0.00 H new ATOM 790 N LEU A 53 -2.848 -3.857 3.823 1.00 0.00 N ATOM 791 CA LEU A 53 -3.027 -4.878 2.806 1.00 0.00 C ATOM 792 C LEU A 53 -1.785 -5.771 2.762 1.00 0.00 C ATOM 793 O LEU A 53 -1.880 -6.982 2.951 1.00 0.00 O ATOM 794 CB LEU A 53 -3.373 -4.238 1.460 1.00 0.00 C ATOM 795 CG LEU A 53 -4.828 -4.371 1.008 1.00 0.00 C ATOM 796 CD1 LEU A 53 -5.277 -3.131 0.233 1.00 0.00 C ATOM 797 CD2 LEU A 53 -5.038 -5.657 0.205 1.00 0.00 C ATOM 0 H LEU A 53 -2.977 -2.900 3.494 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.872 -5.520 3.054 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.124 -3.178 1.510 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.734 -4.680 0.695 1.00 0.00 H new ATOM 0 HG LEU A 53 -5.456 -4.440 1.896 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.315 -3.252 -0.077 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -5.188 -2.252 0.871 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.648 -3.005 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.081 -5.727 -0.104 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.398 -5.644 -0.677 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.785 -6.518 0.824 1.00 0.00 H new ATOM 809 N LEU A 54 -0.649 -5.137 2.510 1.00 0.00 N ATOM 810 CA LEU A 54 0.610 -5.859 2.438 1.00 0.00 C ATOM 811 C LEU A 54 0.766 -6.729 3.687 1.00 0.00 C ATOM 812 O LEU A 54 1.380 -7.794 3.634 1.00 0.00 O ATOM 813 CB LEU A 54 1.772 -4.888 2.216 1.00 0.00 C ATOM 814 CG LEU A 54 1.712 -4.052 0.936 1.00 0.00 C ATOM 815 CD1 LEU A 54 3.118 -3.699 0.445 1.00 0.00 C ATOM 816 CD2 LEU A 54 0.890 -4.760 -0.143 1.00 0.00 C ATOM 0 H LEU A 54 -0.574 -4.132 2.353 1.00 0.00 H new ATOM 0 HA LEU A 54 0.616 -6.530 1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 54 1.820 -4.209 3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.701 -5.459 2.210 1.00 0.00 H new ATOM 0 HG LEU A 54 1.205 -3.114 1.164 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.047 -3.105 -0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.638 -3.126 1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.672 -4.615 0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.863 -4.145 -1.042 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.346 -5.722 -0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.126 -4.918 0.219 1.00 0.00 H new ATOM 828 N GLU A 55 0.200 -6.243 4.782 1.00 0.00 N ATOM 829 CA GLU A 55 0.269 -6.963 6.042 1.00 0.00 C ATOM 830 C GLU A 55 -0.578 -8.235 5.974 1.00 0.00 C ATOM 831 O GLU A 55 -0.134 -9.304 6.388 1.00 0.00 O ATOM 832 CB GLU A 55 -0.171 -6.073 7.207 1.00 0.00 C ATOM 833 CG GLU A 55 0.975 -5.861 8.198 1.00 0.00 C ATOM 834 CD GLU A 55 0.498 -6.059 9.638 1.00 0.00 C ATOM 835 OE1 GLU A 55 -0.431 -6.875 9.821 1.00 0.00 O ATOM 836 OE2 GLU A 55 1.073 -5.389 10.524 1.00 0.00 O ATOM 0 H GLU A 55 -0.308 -5.360 4.823 1.00 0.00 H new ATOM 0 HA GLU A 55 1.306 -7.249 6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.510 -5.110 6.826 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.019 -6.529 7.718 1.00 0.00 H new ATOM 0 HG2 GLU A 55 1.783 -6.559 7.980 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.381 -4.856 8.080 1.00 0.00 H new ATOM 843 N GLN A 56 -1.784 -8.077 5.447 1.00 0.00 N ATOM 844 CA GLN A 56 -2.697 -9.200 5.318 1.00 0.00 C ATOM 845 C GLN A 56 -2.214 -10.155 4.226 1.00 0.00 C ATOM 846 O GLN A 56 -2.103 -11.359 4.453 1.00 0.00 O ATOM 847 CB GLN A 56 -4.122 -8.718 5.035 1.00 0.00 C ATOM 848 CG GLN A 56 -4.726 -8.039 6.265 1.00 0.00 C ATOM 849 CD GLN A 56 -5.786 -8.929 6.917 1.00 0.00 C ATOM 850 OE1 GLN A 56 -6.980 -8.714 6.785 1.00 0.00 O ATOM 851 NE2 GLN A 56 -5.285 -9.936 7.626 1.00 0.00 N ATOM 0 H GLN A 56 -2.150 -7.188 5.105 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.713 -9.741 6.264 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.114 -8.020 4.197 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -4.744 -9.563 4.740 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -3.939 -7.817 6.986 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.172 -7.087 5.977 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -4.275 -10.058 7.695 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.911 -10.586 8.101 1.00 0.00 H new ATOM 860 N MET A 57 -1.939 -9.583 3.063 1.00 0.00 N ATOM 861 CA MET A 57 -1.470 -10.369 1.934 1.00 0.00 C ATOM 862 C MET A 57 -0.226 -11.177 2.308 1.00 0.00 C ATOM 863 O MET A 57 -0.079 -12.325 1.892 1.00 0.00 O ATOM 864 CB MET A 57 -1.142 -9.438 0.765 1.00 0.00 C ATOM 865 CG MET A 57 -2.376 -8.642 0.335 1.00 0.00 C ATOM 866 SD MET A 57 -2.192 -8.096 -1.354 1.00 0.00 S ATOM 867 CE MET A 57 -1.442 -6.499 -1.084 1.00 0.00 C ATOM 0 H MET A 57 -2.032 -8.584 2.878 1.00 0.00 H new ATOM 0 HA MET A 57 -2.259 -11.064 1.646 1.00 0.00 H new ATOM 0 HB2 MET A 57 -0.345 -8.753 1.054 1.00 0.00 H new ATOM 0 HB3 MET A 57 -0.770 -10.022 -0.077 1.00 0.00 H new ATOM 0 HG2 MET A 57 -3.269 -9.260 0.431 1.00 0.00 H new ATOM 0 HG3 MET A 57 -2.511 -7.782 0.991 1.00 0.00 H new ATOM 0 HE1 MET A 57 -2.171 -5.715 -1.289 1.00 0.00 H new ATOM 0 HE2 MET A 57 -1.110 -6.423 -0.049 1.00 0.00 H new ATOM 0 HE3 MET A 57 -0.586 -6.382 -1.749 1.00 0.00 H new ATOM 877 N ASP A 58 0.638 -10.546 3.089 1.00 0.00 N ATOM 878 CA ASP A 58 1.865 -11.192 3.524 1.00 0.00 C ATOM 879 C ASP A 58 1.526 -12.296 4.527 1.00 0.00 C ATOM 880 O ASP A 58 1.994 -13.426 4.393 1.00 0.00 O ATOM 881 CB ASP A 58 2.797 -10.195 4.215 1.00 0.00 C ATOM 882 CG ASP A 58 4.162 -10.757 4.616 1.00 0.00 C ATOM 883 OD1 ASP A 58 4.194 -11.517 5.608 1.00 0.00 O ATOM 884 OD2 ASP A 58 5.143 -10.415 3.922 1.00 0.00 O ATOM 0 H ASP A 58 0.513 -9.594 3.432 1.00 0.00 H new ATOM 0 HA ASP A 58 2.362 -11.600 2.644 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.952 -9.345 3.551 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.301 -9.815 5.108 1.00 0.00 H new ATOM 889 N LEU A 59 0.716 -11.932 5.510 1.00 0.00 N ATOM 890 CA LEU A 59 0.309 -12.878 6.535 1.00 0.00 C ATOM 891 C LEU A 59 -0.609 -13.932 5.914 1.00 0.00 C ATOM 892 O LEU A 59 -0.944 -14.925 6.559 1.00 0.00 O ATOM 893 CB LEU A 59 -0.313 -12.144 7.725 1.00 0.00 C ATOM 894 CG LEU A 59 0.616 -11.883 8.912 1.00 0.00 C ATOM 895 CD1 LEU A 59 0.651 -10.395 9.265 1.00 0.00 C ATOM 896 CD2 LEU A 59 0.226 -12.748 10.113 1.00 0.00 C ATOM 0 H LEU A 59 0.330 -10.994 5.618 1.00 0.00 H new ATOM 0 HA LEU A 59 1.176 -13.405 6.933 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.700 -11.187 7.374 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.167 -12.723 8.078 1.00 0.00 H new ATOM 0 HG LEU A 59 1.628 -12.169 8.623 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.319 -10.238 10.112 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.012 -9.826 8.408 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.352 -10.059 9.527 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.902 -12.544 10.943 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.796 -12.516 10.412 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.294 -13.801 9.840 1.00 0.00 H new ATOM 908 N GLU A 60 -0.990 -13.681 4.670 1.00 0.00 N ATOM 909 CA GLU A 60 -1.863 -14.597 3.956 1.00 0.00 C ATOM 910 C GLU A 60 -1.049 -15.459 2.988 1.00 0.00 C ATOM 911 O GLU A 60 -1.216 -16.677 2.945 1.00 0.00 O ATOM 912 CB GLU A 60 -2.968 -13.838 3.218 1.00 0.00 C ATOM 913 CG GLU A 60 -3.564 -14.691 2.096 1.00 0.00 C ATOM 914 CD GLU A 60 -5.091 -14.714 2.178 1.00 0.00 C ATOM 915 OE1 GLU A 60 -5.635 -13.839 2.886 1.00 0.00 O ATOM 916 OE2 GLU A 60 -5.680 -15.607 1.532 1.00 0.00 O ATOM 0 H GLU A 60 -0.710 -12.857 4.138 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.342 -15.254 4.683 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -3.752 -13.556 3.921 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.565 -12.914 2.803 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.254 -14.295 1.129 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.177 -15.708 2.163 1.00 0.00 H new ATOM 923 N VAL A 61 -0.187 -14.793 2.234 1.00 0.00 N ATOM 924 CA VAL A 61 0.653 -15.482 1.269 1.00 0.00 C ATOM 925 C VAL A 61 1.336 -16.669 1.951 1.00 0.00 C ATOM 926 O VAL A 61 1.737 -17.624 1.288 1.00 0.00 O ATOM 927 CB VAL A 61 1.644 -14.501 0.642 1.00 0.00 C ATOM 928 CG1 VAL A 61 3.038 -15.123 0.534 1.00 0.00 C ATOM 929 CG2 VAL A 61 1.151 -14.020 -0.724 1.00 0.00 C ATOM 0 H VAL A 61 -0.052 -13.783 2.272 1.00 0.00 H new ATOM 0 HA VAL A 61 0.050 -15.879 0.452 1.00 0.00 H new ATOM 0 HB VAL A 61 1.714 -13.633 1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 61 3.723 -14.404 0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.395 -15.392 1.528 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.990 -16.017 -0.088 1.00 0.00 H new ATOM 0 HG21 VAL A 61 1.875 -13.323 -1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.037 -14.874 -1.391 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.190 -13.519 -0.608 1.00 0.00 H new ATOM 939 N ARG A 62 1.448 -16.570 3.268 1.00 0.00 N ATOM 940 CA ARG A 62 2.077 -17.624 4.047 1.00 0.00 C ATOM 941 C ARG A 62 1.332 -18.946 3.849 1.00 0.00 C ATOM 942 O ARG A 62 1.942 -19.963 3.523 1.00 0.00 O ATOM 943 CB ARG A 62 2.093 -17.273 5.536 1.00 0.00 C ATOM 944 CG ARG A 62 3.524 -17.237 6.075 1.00 0.00 C ATOM 945 CD ARG A 62 3.593 -16.463 7.393 1.00 0.00 C ATOM 946 NE ARG A 62 4.897 -16.702 8.052 1.00 0.00 N ATOM 947 CZ ARG A 62 5.330 -16.029 9.127 1.00 0.00 C ATOM 948 NH1 ARG A 62 4.567 -15.071 9.670 1.00 0.00 N ATOM 949 NH2 ARG A 62 6.527 -16.314 9.658 1.00 0.00 N ATOM 0 H ARG A 62 1.114 -15.777 3.815 1.00 0.00 H new ATOM 0 HA ARG A 62 3.105 -17.726 3.699 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.618 -16.304 5.690 1.00 0.00 H new ATOM 0 HB3 ARG A 62 1.509 -18.006 6.092 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.885 -18.254 6.227 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.182 -16.772 5.341 1.00 0.00 H new ATOM 0 HD2 ARG A 62 3.460 -15.397 7.206 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.781 -16.775 8.050 1.00 0.00 H new ATOM 0 HE ARG A 62 5.504 -17.424 7.664 1.00 0.00 H new ATOM 0 HH11 ARG A 62 3.656 -14.854 9.265 1.00 0.00 H new ATOM 0 HH12 ARG A 62 4.897 -14.559 10.488 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.108 -17.043 9.244 1.00 0.00 H new ATOM 0 HH22 ARG A 62 6.857 -15.802 10.476 1.00 0.00 H new ATOM 963 N GLU A 63 0.025 -18.888 4.055 1.00 0.00 N ATOM 964 CA GLU A 63 -0.809 -20.069 3.903 1.00 0.00 C ATOM 965 C GLU A 63 -0.757 -20.574 2.460 1.00 0.00 C ATOM 966 O GLU A 63 -0.699 -21.779 2.223 1.00 0.00 O ATOM 967 CB GLU A 63 -2.250 -19.781 4.331 1.00 0.00 C ATOM 968 CG GLU A 63 -3.072 -19.238 3.161 1.00 0.00 C ATOM 969 CD GLU A 63 -4.454 -18.779 3.628 1.00 0.00 C ATOM 970 OE1 GLU A 63 -4.497 -18.039 4.634 1.00 0.00 O ATOM 971 OE2 GLU A 63 -5.438 -19.179 2.968 1.00 0.00 O ATOM 0 H GLU A 63 -0.477 -18.043 4.326 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.420 -20.851 4.555 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.710 -20.694 4.710 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.253 -19.059 5.148 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.545 -18.404 2.698 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.180 -20.010 2.399 1.00 0.00 H new ATOM 978 N ILE A 64 -0.780 -19.627 1.534 1.00 0.00 N ATOM 979 CA ILE A 64 -0.735 -19.961 0.121 1.00 0.00 C ATOM 980 C ILE A 64 0.295 -21.070 -0.105 1.00 0.00 C ATOM 981 O ILE A 64 1.344 -21.087 0.537 1.00 0.00 O ATOM 982 CB ILE A 64 -0.483 -18.707 -0.719 1.00 0.00 C ATOM 983 CG1 ILE A 64 -1.624 -17.701 -0.559 1.00 0.00 C ATOM 984 CG2 ILE A 64 -0.239 -19.069 -2.185 1.00 0.00 C ATOM 985 CD1 ILE A 64 -1.649 -16.709 -1.724 1.00 0.00 C ATOM 0 H ILE A 64 -0.829 -18.628 1.735 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.699 -20.349 -0.209 1.00 0.00 H new ATOM 0 HB ILE A 64 0.423 -18.226 -0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.575 -18.230 -0.507 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.508 -17.161 0.381 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.063 -18.160 -2.760 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.632 -19.720 -2.259 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.113 -19.586 -2.582 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.470 -16.005 -1.585 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.706 -16.164 -1.758 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.790 -17.250 -2.660 1.00 0.00 H new ATOM 997 N PRO A 65 -0.050 -21.992 -1.043 1.00 0.00 N ATOM 998 CA PRO A 65 0.833 -23.101 -1.362 1.00 0.00 C ATOM 999 C PRO A 65 2.019 -22.633 -2.207 1.00 0.00 C ATOM 1000 O PRO A 65 1.983 -21.549 -2.787 1.00 0.00 O ATOM 1001 CB PRO A 65 -0.047 -24.111 -2.080 1.00 0.00 C ATOM 1002 CG PRO A 65 -1.270 -23.339 -2.548 1.00 0.00 C ATOM 1003 CD PRO A 65 -1.284 -22.003 -1.823 1.00 0.00 C ATOM 0 HA PRO A 65 1.286 -23.546 -0.476 1.00 0.00 H new ATOM 0 HB2 PRO A 65 0.479 -24.558 -2.923 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.331 -24.926 -1.414 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -1.236 -23.187 -3.627 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.180 -23.899 -2.333 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.315 -21.171 -2.526 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.160 -21.910 -1.180 1.00 0.00 H new ATOM 1011 N PRO A 66 3.069 -23.496 -2.252 1.00 0.00 N ATOM 1012 CA PRO A 66 4.264 -23.182 -3.017 1.00 0.00 C ATOM 1013 C PRO A 66 4.015 -23.353 -4.517 1.00 0.00 C ATOM 1014 O PRO A 66 4.923 -23.169 -5.326 1.00 0.00 O ATOM 1015 CB PRO A 66 5.332 -24.122 -2.482 1.00 0.00 C ATOM 1016 CG PRO A 66 4.586 -25.238 -1.769 1.00 0.00 C ATOM 1017 CD PRO A 66 3.146 -24.789 -1.578 1.00 0.00 C ATOM 0 HA PRO A 66 4.574 -22.143 -2.905 1.00 0.00 H new ATOM 0 HB2 PRO A 66 5.945 -24.517 -3.292 1.00 0.00 H new ATOM 0 HB3 PRO A 66 6.003 -23.602 -1.798 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.625 -26.157 -2.354 1.00 0.00 H new ATOM 0 HG3 PRO A 66 5.050 -25.453 -0.806 1.00 0.00 H new ATOM 0 HD2 PRO A 66 2.447 -25.504 -2.012 1.00 0.00 H new ATOM 0 HD3 PRO A 66 2.896 -24.700 -0.521 1.00 0.00 H new ATOM 1025 N GLN A 67 2.779 -23.702 -4.843 1.00 0.00 N ATOM 1026 CA GLN A 67 2.399 -23.900 -6.232 1.00 0.00 C ATOM 1027 C GLN A 67 1.624 -22.685 -6.748 1.00 0.00 C ATOM 1028 O GLN A 67 1.493 -22.496 -7.956 1.00 0.00 O ATOM 1029 CB GLN A 67 1.584 -25.183 -6.400 1.00 0.00 C ATOM 1030 CG GLN A 67 1.992 -25.929 -7.672 1.00 0.00 C ATOM 1031 CD GLN A 67 2.099 -27.434 -7.414 1.00 0.00 C ATOM 1032 OE1 GLN A 67 3.173 -28.012 -7.399 1.00 0.00 O ATOM 1033 NE2 GLN A 67 0.929 -28.033 -7.214 1.00 0.00 N ATOM 0 H GLN A 67 2.028 -23.853 -4.170 1.00 0.00 H new ATOM 0 HA GLN A 67 3.307 -24.006 -6.826 1.00 0.00 H new ATOM 0 HB2 GLN A 67 1.731 -25.827 -5.533 1.00 0.00 H new ATOM 0 HB3 GLN A 67 0.522 -24.941 -6.441 1.00 0.00 H new ATOM 0 HG2 GLN A 67 1.260 -25.742 -8.458 1.00 0.00 H new ATOM 0 HG3 GLN A 67 2.949 -25.549 -8.030 1.00 0.00 H new ATOM 0 HE21 GLN A 67 0.067 -27.489 -7.240 1.00 0.00 H new ATOM 0 HE22 GLN A 67 0.894 -29.036 -7.034 1.00 0.00 H new ATOM 1042 N SER A 68 1.130 -21.895 -5.806 1.00 0.00 N ATOM 1043 CA SER A 68 0.372 -20.705 -6.150 1.00 0.00 C ATOM 1044 C SER A 68 1.156 -19.452 -5.755 1.00 0.00 C ATOM 1045 O SER A 68 0.956 -18.383 -6.330 1.00 0.00 O ATOM 1046 CB SER A 68 -0.999 -20.709 -5.470 1.00 0.00 C ATOM 1047 OG SER A 68 -1.826 -19.643 -5.928 1.00 0.00 O ATOM 0 H SER A 68 1.240 -22.056 -4.805 1.00 0.00 H new ATOM 0 HA SER A 68 0.213 -20.702 -7.228 1.00 0.00 H new ATOM 0 HB2 SER A 68 -1.495 -21.660 -5.661 1.00 0.00 H new ATOM 0 HB3 SER A 68 -0.868 -20.628 -4.391 1.00 0.00 H new ATOM 0 HG SER A 68 -2.692 -19.682 -5.471 1.00 0.00 H new ATOM 1053 N ARG A 69 2.032 -19.625 -4.776 1.00 0.00 N ATOM 1054 CA ARG A 69 2.847 -18.521 -4.297 1.00 0.00 C ATOM 1055 C ARG A 69 3.838 -18.086 -5.378 1.00 0.00 C ATOM 1056 O ARG A 69 4.231 -16.921 -5.432 1.00 0.00 O ATOM 1057 CB ARG A 69 3.618 -18.914 -3.036 1.00 0.00 C ATOM 1058 CG ARG A 69 3.124 -18.123 -1.823 1.00 0.00 C ATOM 1059 CD ARG A 69 4.141 -18.178 -0.681 1.00 0.00 C ATOM 1060 NE ARG A 69 5.212 -17.182 -0.910 1.00 0.00 N ATOM 1061 CZ ARG A 69 6.288 -17.042 -0.123 1.00 0.00 C ATOM 1062 NH1 ARG A 69 6.442 -17.832 0.948 1.00 0.00 N ATOM 1063 NH2 ARG A 69 7.210 -16.112 -0.408 1.00 0.00 N ATOM 0 H ARG A 69 2.195 -20.513 -4.301 1.00 0.00 H new ATOM 0 HA ARG A 69 2.179 -17.694 -4.058 1.00 0.00 H new ATOM 0 HB2 ARG A 69 3.500 -19.982 -2.851 1.00 0.00 H new ATOM 0 HB3 ARG A 69 4.682 -18.732 -3.185 1.00 0.00 H new ATOM 0 HG2 ARG A 69 2.948 -17.086 -2.108 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.170 -18.527 -1.485 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.645 -17.979 0.269 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.571 -19.177 -0.613 1.00 0.00 H new ATOM 0 HE ARG A 69 5.126 -16.564 -1.717 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.740 -18.540 1.165 1.00 0.00 H new ATOM 0 HH12 ARG A 69 7.261 -17.725 1.547 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.093 -15.511 -1.224 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.029 -16.005 0.191 1.00 0.00 H new ATOM 1077 N GLY A 70 4.213 -19.044 -6.213 1.00 0.00 N ATOM 1078 CA GLY A 70 5.151 -18.774 -7.289 1.00 0.00 C ATOM 1079 C GLY A 70 4.910 -17.388 -7.892 1.00 0.00 C ATOM 1080 O GLY A 70 5.855 -16.639 -8.133 1.00 0.00 O ATOM 0 H GLY A 70 3.884 -20.008 -6.166 1.00 0.00 H new ATOM 0 HA2 GLY A 70 6.171 -18.838 -6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.050 -19.534 -8.064 1.00 0.00 H new ATOM 1084 N MET A 71 3.639 -17.089 -8.117 1.00 0.00 N ATOM 1085 CA MET A 71 3.262 -15.807 -8.687 1.00 0.00 C ATOM 1086 C MET A 71 3.167 -14.732 -7.603 1.00 0.00 C ATOM 1087 O MET A 71 3.931 -13.768 -7.610 1.00 0.00 O ATOM 1088 CB MET A 71 1.911 -15.940 -9.394 1.00 0.00 C ATOM 1089 CG MET A 71 2.003 -15.464 -10.845 1.00 0.00 C ATOM 1090 SD MET A 71 1.932 -16.862 -11.952 1.00 0.00 S ATOM 1091 CE MET A 71 0.169 -16.958 -12.217 1.00 0.00 C ATOM 0 H MET A 71 2.857 -17.712 -7.915 1.00 0.00 H new ATOM 0 HA MET A 71 4.029 -15.509 -9.402 1.00 0.00 H new ATOM 0 HB2 MET A 71 1.584 -16.979 -9.368 1.00 0.00 H new ATOM 0 HB3 MET A 71 1.159 -15.356 -8.863 1.00 0.00 H new ATOM 0 HG2 MET A 71 1.187 -14.775 -11.063 1.00 0.00 H new ATOM 0 HG3 MET A 71 2.932 -14.915 -10.998 1.00 0.00 H new ATOM 0 HE1 MET A 71 -0.053 -17.785 -12.891 1.00 0.00 H new ATOM 0 HE2 MET A 71 -0.334 -17.122 -11.264 1.00 0.00 H new ATOM 0 HE3 MET A 71 -0.184 -16.026 -12.658 1.00 0.00 H new ATOM 1101 N TYR A 72 2.222 -14.933 -6.696 1.00 0.00 N ATOM 1102 CA TYR A 72 2.017 -13.993 -5.607 1.00 0.00 C ATOM 1103 C TYR A 72 3.354 -13.491 -5.057 1.00 0.00 C ATOM 1104 O TYR A 72 3.562 -12.286 -4.926 1.00 0.00 O ATOM 1105 CB TYR A 72 1.288 -14.771 -4.510 1.00 0.00 C ATOM 1106 CG TYR A 72 0.416 -13.899 -3.604 1.00 0.00 C ATOM 1107 CD1 TYR A 72 0.891 -12.686 -3.148 1.00 0.00 C ATOM 1108 CD2 TYR A 72 -0.846 -14.326 -3.242 1.00 0.00 C ATOM 1109 CE1 TYR A 72 0.070 -11.866 -2.296 1.00 0.00 C ATOM 1110 CE2 TYR A 72 -1.666 -13.506 -2.389 1.00 0.00 C ATOM 1111 CZ TYR A 72 -1.168 -12.316 -1.958 1.00 0.00 C ATOM 1112 OH TYR A 72 -1.943 -11.541 -1.153 1.00 0.00 O ATOM 0 H TYR A 72 1.590 -15.733 -6.693 1.00 0.00 H new ATOM 0 HA TYR A 72 1.453 -13.126 -5.950 1.00 0.00 H new ATOM 0 HB2 TYR A 72 0.663 -15.534 -4.974 1.00 0.00 H new ATOM 0 HB3 TYR A 72 2.024 -15.291 -3.897 1.00 0.00 H new ATOM 0 HD1 TYR A 72 1.879 -12.352 -3.430 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -1.218 -15.275 -3.599 1.00 0.00 H new ATOM 0 HE1 TYR A 72 0.429 -10.914 -1.933 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -2.655 -13.829 -2.098 1.00 0.00 H new ATOM 0 HH TYR A 72 -2.801 -11.988 -0.996 1.00 0.00 H new ATOM 1122 N SER A 73 4.225 -14.441 -4.751 1.00 0.00 N ATOM 1123 CA SER A 73 5.536 -14.110 -4.218 1.00 0.00 C ATOM 1124 C SER A 73 6.211 -13.061 -5.104 1.00 0.00 C ATOM 1125 O SER A 73 6.375 -11.912 -4.698 1.00 0.00 O ATOM 1126 CB SER A 73 6.416 -15.357 -4.107 1.00 0.00 C ATOM 1127 OG SER A 73 6.493 -16.068 -5.339 1.00 0.00 O ATOM 0 H SER A 73 4.049 -15.440 -4.862 1.00 0.00 H new ATOM 0 HA SER A 73 5.405 -13.700 -3.216 1.00 0.00 H new ATOM 0 HB2 SER A 73 7.419 -15.066 -3.793 1.00 0.00 H new ATOM 0 HB3 SER A 73 6.018 -16.014 -3.334 1.00 0.00 H new ATOM 0 HG SER A 73 5.783 -16.742 -5.372 1.00 0.00 H new ATOM 1133 N ASN A 74 6.586 -13.495 -6.299 1.00 0.00 N ATOM 1134 CA ASN A 74 7.240 -12.608 -7.246 1.00 0.00 C ATOM 1135 C ASN A 74 6.548 -11.244 -7.222 1.00 0.00 C ATOM 1136 O ASN A 74 7.179 -10.219 -7.477 1.00 0.00 O ATOM 1137 CB ASN A 74 7.150 -13.160 -8.670 1.00 0.00 C ATOM 1138 CG ASN A 74 7.566 -12.103 -9.695 1.00 0.00 C ATOM 1139 OD1 ASN A 74 8.411 -11.258 -9.446 1.00 0.00 O ATOM 1140 ND2 ASN A 74 6.929 -12.196 -10.858 1.00 0.00 N ATOM 0 H ASN A 74 6.449 -14.449 -6.633 1.00 0.00 H new ATOM 0 HA ASN A 74 8.288 -12.521 -6.959 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.791 -14.036 -8.765 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.130 -13.487 -8.873 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.137 -11.536 -11.607 1.00 0.00 H new ATOM 0 HD22 ASN A 74 6.232 -12.927 -11.001 1.00 0.00 H new ATOM 1147 N ARG A 75 5.260 -11.275 -6.913 1.00 0.00 N ATOM 1148 CA ARG A 75 4.476 -10.054 -6.853 1.00 0.00 C ATOM 1149 C ARG A 75 4.737 -9.319 -5.537 1.00 0.00 C ATOM 1150 O ARG A 75 5.041 -8.127 -5.536 1.00 0.00 O ATOM 1151 CB ARG A 75 2.980 -10.353 -6.974 1.00 0.00 C ATOM 1152 CG ARG A 75 2.452 -9.961 -8.355 1.00 0.00 C ATOM 1153 CD ARG A 75 1.130 -10.669 -8.658 1.00 0.00 C ATOM 1154 NE ARG A 75 1.182 -11.286 -10.002 1.00 0.00 N ATOM 1155 CZ ARG A 75 1.398 -10.604 -11.134 1.00 0.00 C ATOM 1156 NH1 ARG A 75 1.582 -9.277 -11.092 1.00 0.00 N ATOM 1157 NH2 ARG A 75 1.429 -11.248 -12.309 1.00 0.00 N ATOM 0 H ARG A 75 4.740 -12.127 -6.702 1.00 0.00 H new ATOM 0 HA ARG A 75 4.778 -9.425 -7.690 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.803 -11.414 -6.801 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.433 -9.809 -6.204 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.309 -8.881 -8.401 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.189 -10.218 -9.116 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.937 -11.433 -7.905 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.307 -9.957 -8.608 1.00 0.00 H new ATOM 0 HE ARG A 75 1.045 -12.294 -10.070 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.558 -8.787 -10.198 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.747 -8.757 -11.954 1.00 0.00 H new ATOM 0 HH21 ARG A 75 1.288 -12.258 -12.341 1.00 0.00 H new ATOM 0 HH22 ARG A 75 1.594 -10.728 -13.171 1.00 0.00 H new ATOM 1171 N MET A 76 4.610 -10.062 -4.446 1.00 0.00 N ATOM 1172 CA MET A 76 4.828 -9.496 -3.126 1.00 0.00 C ATOM 1173 C MET A 76 6.048 -8.571 -3.121 1.00 0.00 C ATOM 1174 O MET A 76 5.991 -7.467 -2.583 1.00 0.00 O ATOM 1175 CB MET A 76 5.039 -10.625 -2.115 1.00 0.00 C ATOM 1176 CG MET A 76 3.711 -11.056 -1.490 1.00 0.00 C ATOM 1177 SD MET A 76 3.513 -10.291 0.110 1.00 0.00 S ATOM 1178 CE MET A 76 1.997 -9.388 -0.164 1.00 0.00 C ATOM 0 H MET A 76 4.359 -11.051 -4.450 1.00 0.00 H new ATOM 0 HA MET A 76 3.950 -8.911 -2.852 1.00 0.00 H new ATOM 0 HB2 MET A 76 5.506 -11.477 -2.608 1.00 0.00 H new ATOM 0 HB3 MET A 76 5.723 -10.295 -1.333 1.00 0.00 H new ATOM 0 HG2 MET A 76 2.884 -10.774 -2.142 1.00 0.00 H new ATOM 0 HG3 MET A 76 3.682 -12.141 -1.390 1.00 0.00 H new ATOM 0 HE1 MET A 76 1.819 -8.713 0.673 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.079 -8.811 -1.085 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.166 -10.089 -0.247 1.00 0.00 H new ATOM 1188 N ARG A 77 7.121 -9.057 -3.726 1.00 0.00 N ATOM 1189 CA ARG A 77 8.352 -8.288 -3.798 1.00 0.00 C ATOM 1190 C ARG A 77 8.112 -6.969 -4.535 1.00 0.00 C ATOM 1191 O ARG A 77 8.531 -5.910 -4.071 1.00 0.00 O ATOM 1192 CB ARG A 77 9.451 -9.073 -4.517 1.00 0.00 C ATOM 1193 CG ARG A 77 9.830 -10.331 -3.732 1.00 0.00 C ATOM 1194 CD ARG A 77 11.265 -10.239 -3.210 1.00 0.00 C ATOM 1195 NE ARG A 77 12.141 -11.156 -3.973 1.00 0.00 N ATOM 1196 CZ ARG A 77 13.478 -11.075 -3.993 1.00 0.00 C ATOM 1197 NH1 ARG A 77 14.102 -10.119 -3.291 1.00 0.00 N ATOM 1198 NH2 ARG A 77 14.192 -11.950 -4.714 1.00 0.00 N ATOM 0 H ARG A 77 7.164 -9.974 -4.171 1.00 0.00 H new ATOM 0 HA ARG A 77 8.675 -8.084 -2.777 1.00 0.00 H new ATOM 0 HB2 ARG A 77 9.111 -9.351 -5.514 1.00 0.00 H new ATOM 0 HB3 ARG A 77 10.330 -8.441 -4.645 1.00 0.00 H new ATOM 0 HG2 ARG A 77 9.143 -10.463 -2.896 1.00 0.00 H new ATOM 0 HG3 ARG A 77 9.727 -11.208 -4.371 1.00 0.00 H new ATOM 0 HD2 ARG A 77 11.629 -9.216 -3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 77 11.292 -10.494 -2.151 1.00 0.00 H new ATOM 0 HE ARG A 77 11.699 -11.896 -4.518 1.00 0.00 H new ATOM 0 HH11 ARG A 77 13.559 -9.453 -2.741 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.120 -10.057 -3.306 1.00 0.00 H new ATOM 0 HH21 ARG A 77 13.718 -12.678 -5.248 1.00 0.00 H new ATOM 0 HH22 ARG A 77 15.210 -11.888 -4.729 1.00 0.00 H new ATOM 1212 N SER A 78 7.438 -7.077 -5.670 1.00 0.00 N ATOM 1213 CA SER A 78 7.137 -5.906 -6.476 1.00 0.00 C ATOM 1214 C SER A 78 6.358 -4.885 -5.644 1.00 0.00 C ATOM 1215 O SER A 78 6.801 -3.751 -5.472 1.00 0.00 O ATOM 1216 CB SER A 78 6.343 -6.287 -7.727 1.00 0.00 C ATOM 1217 OG SER A 78 7.068 -6.012 -8.923 1.00 0.00 O ATOM 0 H SER A 78 7.092 -7.958 -6.051 1.00 0.00 H new ATOM 0 HA SER A 78 8.079 -5.461 -6.798 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.094 -7.348 -7.690 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.401 -5.739 -7.740 1.00 0.00 H new ATOM 0 HG SER A 78 6.529 -6.270 -9.699 1.00 0.00 H new ATOM 1223 N TYR A 79 5.209 -5.324 -5.149 1.00 0.00 N ATOM 1224 CA TYR A 79 4.365 -4.463 -4.340 1.00 0.00 C ATOM 1225 C TYR A 79 5.182 -3.753 -3.258 1.00 0.00 C ATOM 1226 O TYR A 79 5.255 -2.526 -3.236 1.00 0.00 O ATOM 1227 CB TYR A 79 3.343 -5.384 -3.669 1.00 0.00 C ATOM 1228 CG TYR A 79 2.303 -5.964 -4.629 1.00 0.00 C ATOM 1229 CD1 TYR A 79 1.789 -5.183 -5.644 1.00 0.00 C ATOM 1230 CD2 TYR A 79 1.880 -7.269 -4.481 1.00 0.00 C ATOM 1231 CE1 TYR A 79 0.810 -5.729 -6.548 1.00 0.00 C ATOM 1232 CE2 TYR A 79 0.901 -7.816 -5.385 1.00 0.00 C ATOM 1233 CZ TYR A 79 0.414 -7.019 -6.374 1.00 0.00 C ATOM 1234 OH TYR A 79 -0.510 -7.535 -7.227 1.00 0.00 O ATOM 0 H TYR A 79 4.844 -6.265 -5.293 1.00 0.00 H new ATOM 0 HA TYR A 79 3.896 -3.697 -4.957 1.00 0.00 H new ATOM 0 HB2 TYR A 79 3.872 -6.204 -3.184 1.00 0.00 H new ATOM 0 HB3 TYR A 79 2.829 -4.829 -2.885 1.00 0.00 H new ATOM 0 HD1 TYR A 79 2.121 -4.162 -5.760 1.00 0.00 H new ATOM 0 HD2 TYR A 79 2.283 -7.880 -3.687 1.00 0.00 H new ATOM 0 HE1 TYR A 79 0.399 -5.128 -7.346 1.00 0.00 H new ATOM 0 HE2 TYR A 79 0.561 -8.836 -5.280 1.00 0.00 H new ATOM 0 HH TYR A 79 -0.579 -8.503 -7.088 1.00 0.00 H new ATOM 1244 N LYS A 80 5.775 -4.556 -2.387 1.00 0.00 N ATOM 1245 CA LYS A 80 6.584 -4.021 -1.306 1.00 0.00 C ATOM 1246 C LYS A 80 7.450 -2.878 -1.840 1.00 0.00 C ATOM 1247 O LYS A 80 7.409 -1.766 -1.316 1.00 0.00 O ATOM 1248 CB LYS A 80 7.385 -5.137 -0.632 1.00 0.00 C ATOM 1249 CG LYS A 80 6.752 -5.538 0.702 1.00 0.00 C ATOM 1250 CD LYS A 80 6.631 -7.058 0.816 1.00 0.00 C ATOM 1251 CE LYS A 80 5.285 -7.457 1.425 1.00 0.00 C ATOM 1252 NZ LYS A 80 5.215 -7.043 2.844 1.00 0.00 N ATOM 0 H LYS A 80 5.711 -5.574 -2.408 1.00 0.00 H new ATOM 0 HA LYS A 80 5.948 -3.602 -0.526 1.00 0.00 H new ATOM 0 HB2 LYS A 80 7.433 -6.004 -1.291 1.00 0.00 H new ATOM 0 HB3 LYS A 80 8.410 -4.805 -0.467 1.00 0.00 H new ATOM 0 HG2 LYS A 80 7.356 -5.155 1.525 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.765 -5.083 0.792 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.736 -7.510 -0.170 1.00 0.00 H new ATOM 0 HD3 LYS A 80 7.442 -7.446 1.432 1.00 0.00 H new ATOM 0 HE2 LYS A 80 4.474 -6.993 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 80 5.150 -8.536 1.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 4.302 -7.336 3.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 5.988 -7.492 3.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.306 -6.009 2.909 1.00 0.00 H new ATOM 1266 N GLN A 81 8.213 -3.192 -2.877 1.00 0.00 N ATOM 1267 CA GLN A 81 9.087 -2.205 -3.488 1.00 0.00 C ATOM 1268 C GLN A 81 8.306 -0.929 -3.808 1.00 0.00 C ATOM 1269 O GLN A 81 8.683 0.159 -3.374 1.00 0.00 O ATOM 1270 CB GLN A 81 9.756 -2.768 -4.743 1.00 0.00 C ATOM 1271 CG GLN A 81 11.199 -3.188 -4.455 1.00 0.00 C ATOM 1272 CD GLN A 81 12.005 -2.021 -3.880 1.00 0.00 C ATOM 1273 OE1 GLN A 81 11.643 -0.863 -4.004 1.00 0.00 O ATOM 1274 NE2 GLN A 81 13.114 -2.390 -3.245 1.00 0.00 N ATOM 0 H GLN A 81 8.244 -4.115 -3.309 1.00 0.00 H new ATOM 0 HA GLN A 81 9.875 -1.956 -2.777 1.00 0.00 H new ATOM 0 HB2 GLN A 81 9.190 -3.625 -5.107 1.00 0.00 H new ATOM 0 HB3 GLN A 81 9.743 -2.018 -5.534 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.206 -4.021 -3.752 1.00 0.00 H new ATOM 0 HG3 GLN A 81 11.669 -3.542 -5.373 1.00 0.00 H new ATOM 0 HE21 GLN A 81 13.358 -3.378 -3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 81 13.720 -1.685 -2.825 1.00 0.00 H new ATOM 1283 N GLU A 82 7.233 -1.105 -4.564 1.00 0.00 N ATOM 1284 CA GLU A 82 6.395 0.019 -4.947 1.00 0.00 C ATOM 1285 C GLU A 82 5.848 0.722 -3.703 1.00 0.00 C ATOM 1286 O GLU A 82 6.021 1.929 -3.541 1.00 0.00 O ATOM 1287 CB GLU A 82 5.258 -0.432 -5.866 1.00 0.00 C ATOM 1288 CG GLU A 82 4.438 0.764 -6.351 1.00 0.00 C ATOM 1289 CD GLU A 82 4.837 1.162 -7.774 1.00 0.00 C ATOM 1290 OE1 GLU A 82 4.746 0.281 -8.656 1.00 0.00 O ATOM 1291 OE2 GLU A 82 5.225 2.338 -7.947 1.00 0.00 O ATOM 0 H GLU A 82 6.924 -2.009 -4.922 1.00 0.00 H new ATOM 0 HA GLU A 82 7.007 0.730 -5.503 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.668 -0.967 -6.722 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.611 -1.130 -5.334 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.377 0.517 -6.323 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.587 1.608 -5.678 1.00 0.00 H new ATOM 1298 N MET A 83 5.200 -0.063 -2.855 1.00 0.00 N ATOM 1299 CA MET A 83 4.627 0.469 -1.631 1.00 0.00 C ATOM 1300 C MET A 83 5.610 1.408 -0.929 1.00 0.00 C ATOM 1301 O MET A 83 5.384 2.616 -0.869 1.00 0.00 O ATOM 1302 CB MET A 83 4.265 -0.685 -0.693 1.00 0.00 C ATOM 1303 CG MET A 83 2.904 -0.450 -0.035 1.00 0.00 C ATOM 1304 SD MET A 83 3.013 0.901 1.127 1.00 0.00 S ATOM 1305 CE MET A 83 1.563 1.831 0.658 1.00 0.00 C ATOM 0 H MET A 83 5.059 -1.064 -2.992 1.00 0.00 H new ATOM 0 HA MET A 83 3.732 1.036 -1.887 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.246 -1.621 -1.252 1.00 0.00 H new ATOM 0 HB3 MET A 83 5.031 -0.788 0.075 1.00 0.00 H new ATOM 0 HG2 MET A 83 2.157 -0.226 -0.796 1.00 0.00 H new ATOM 0 HG3 MET A 83 2.577 -1.355 0.477 1.00 0.00 H new ATOM 0 HE1 MET A 83 1.098 2.254 1.549 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.850 2.636 -0.018 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.854 1.172 0.157 1.00 0.00 H new ATOM 1315 N GLY A 84 6.679 0.818 -0.415 1.00 0.00 N ATOM 1316 CA GLY A 84 7.697 1.587 0.281 1.00 0.00 C ATOM 1317 C GLY A 84 8.028 2.873 -0.480 1.00 0.00 C ATOM 1318 O GLY A 84 8.236 3.921 0.128 1.00 0.00 O ATOM 0 H GLY A 84 6.863 -0.184 -0.467 1.00 0.00 H new ATOM 0 HA2 GLY A 84 7.350 1.833 1.284 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.599 0.985 0.395 1.00 0.00 H new ATOM 1322 N LYS A 85 8.066 2.749 -1.799 1.00 0.00 N ATOM 1323 CA LYS A 85 8.368 3.888 -2.649 1.00 0.00 C ATOM 1324 C LYS A 85 7.229 4.905 -2.555 1.00 0.00 C ATOM 1325 O LYS A 85 7.472 6.102 -2.405 1.00 0.00 O ATOM 1326 CB LYS A 85 8.665 3.426 -4.077 1.00 0.00 C ATOM 1327 CG LYS A 85 8.951 4.620 -4.991 1.00 0.00 C ATOM 1328 CD LYS A 85 8.628 4.284 -6.448 1.00 0.00 C ATOM 1329 CE LYS A 85 9.883 3.830 -7.196 1.00 0.00 C ATOM 1330 NZ LYS A 85 9.782 4.173 -8.633 1.00 0.00 N ATOM 0 H LYS A 85 7.893 1.877 -2.299 1.00 0.00 H new ATOM 0 HA LYS A 85 9.273 4.390 -2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 85 9.522 2.752 -4.074 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.817 2.862 -4.464 1.00 0.00 H new ATOM 0 HG2 LYS A 85 8.358 5.477 -4.672 1.00 0.00 H new ATOM 0 HG3 LYS A 85 9.999 4.907 -4.904 1.00 0.00 H new ATOM 0 HD2 LYS A 85 7.874 3.498 -6.485 1.00 0.00 H new ATOM 0 HD3 LYS A 85 8.202 5.158 -6.941 1.00 0.00 H new ATOM 0 HE2 LYS A 85 10.763 4.305 -6.763 1.00 0.00 H new ATOM 0 HE3 LYS A 85 10.013 2.754 -7.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.642 3.858 -9.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 8.953 3.699 -9.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 9.680 5.203 -8.738 1.00 0.00 H new ATOM 1344 N LEU A 86 6.011 4.392 -2.648 1.00 0.00 N ATOM 1345 CA LEU A 86 4.834 5.241 -2.575 1.00 0.00 C ATOM 1346 C LEU A 86 4.948 6.160 -1.358 1.00 0.00 C ATOM 1347 O LEU A 86 4.428 7.275 -1.367 1.00 0.00 O ATOM 1348 CB LEU A 86 3.561 4.393 -2.589 1.00 0.00 C ATOM 1349 CG LEU A 86 2.916 4.173 -3.959 1.00 0.00 C ATOM 1350 CD1 LEU A 86 2.224 2.810 -4.027 1.00 0.00 C ATOM 1351 CD2 LEU A 86 1.963 5.318 -4.308 1.00 0.00 C ATOM 0 H LEU A 86 5.814 3.399 -2.773 1.00 0.00 H new ATOM 0 HA LEU A 86 4.772 5.883 -3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.792 3.419 -2.158 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.827 4.865 -1.936 1.00 0.00 H new ATOM 0 HG LEU A 86 3.705 4.171 -4.711 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.774 2.679 -5.011 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.956 2.021 -3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.448 2.757 -3.263 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.519 5.136 -5.287 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.175 5.377 -3.557 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.515 6.257 -4.329 1.00 0.00 H new ATOM 1363 N GLU A 87 5.630 5.658 -0.339 1.00 0.00 N ATOM 1364 CA GLU A 87 5.818 6.421 0.884 1.00 0.00 C ATOM 1365 C GLU A 87 6.798 7.572 0.646 1.00 0.00 C ATOM 1366 O GLU A 87 6.637 8.654 1.207 1.00 0.00 O ATOM 1367 CB GLU A 87 6.298 5.520 2.023 1.00 0.00 C ATOM 1368 CG GLU A 87 5.129 5.097 2.916 1.00 0.00 C ATOM 1369 CD GLU A 87 5.340 5.571 4.356 1.00 0.00 C ATOM 1370 OE1 GLU A 87 6.148 4.922 5.055 1.00 0.00 O ATOM 1371 OE2 GLU A 87 4.689 6.572 4.724 1.00 0.00 O ATOM 0 H GLU A 87 6.059 4.733 -0.335 1.00 0.00 H new ATOM 0 HA GLU A 87 4.857 6.843 1.178 1.00 0.00 H new ATOM 0 HB2 GLU A 87 6.785 4.636 1.612 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.044 6.047 2.619 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.200 5.511 2.525 1.00 0.00 H new ATOM 0 HG3 GLU A 87 5.027 4.012 2.898 1.00 0.00 H new ATOM 1378 N THR A 88 7.791 7.299 -0.187 1.00 0.00 N ATOM 1379 CA THR A 88 8.797 8.298 -0.506 1.00 0.00 C ATOM 1380 C THR A 88 8.279 9.249 -1.587 1.00 0.00 C ATOM 1381 O THR A 88 8.176 10.454 -1.361 1.00 0.00 O ATOM 1382 CB THR A 88 10.081 7.567 -0.904 1.00 0.00 C ATOM 1383 OG1 THR A 88 10.725 7.295 0.338 1.00 0.00 O ATOM 1384 CG2 THR A 88 11.066 8.474 -1.644 1.00 0.00 C ATOM 0 H THR A 88 7.921 6.400 -0.651 1.00 0.00 H new ATOM 0 HA THR A 88 9.018 8.926 0.357 1.00 0.00 H new ATOM 0 HB THR A 88 9.832 6.713 -1.533 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.566 6.820 0.173 1.00 0.00 H new ATOM 0 HG21 THR A 88 11.959 7.906 -1.903 1.00 0.00 H new ATOM 0 HG22 THR A 88 10.600 8.852 -2.554 1.00 0.00 H new ATOM 0 HG23 THR A 88 11.342 9.311 -1.003 1.00 0.00 H new ATOM 1392 N ASP A 89 7.967 8.672 -2.738 1.00 0.00 N ATOM 1393 CA ASP A 89 7.463 9.453 -3.855 1.00 0.00 C ATOM 1394 C ASP A 89 6.389 10.420 -3.351 1.00 0.00 C ATOM 1395 O ASP A 89 6.250 11.525 -3.872 1.00 0.00 O ATOM 1396 CB ASP A 89 6.828 8.552 -4.915 1.00 0.00 C ATOM 1397 CG ASP A 89 7.668 8.349 -6.178 1.00 0.00 C ATOM 1398 OD1 ASP A 89 8.898 8.189 -6.022 1.00 0.00 O ATOM 1399 OD2 ASP A 89 7.061 8.358 -7.271 1.00 0.00 O ATOM 0 H ASP A 89 8.054 7.672 -2.921 1.00 0.00 H new ATOM 0 HA ASP A 89 8.302 9.992 -4.296 1.00 0.00 H new ATOM 0 HB2 ASP A 89 6.628 7.578 -4.469 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.865 8.976 -5.201 1.00 0.00 H new ATOM 1404 N PHE A 90 5.656 9.968 -2.344 1.00 0.00 N ATOM 1405 CA PHE A 90 4.599 10.778 -1.764 1.00 0.00 C ATOM 1406 C PHE A 90 5.175 12.006 -1.056 1.00 0.00 C ATOM 1407 O PHE A 90 4.688 13.120 -1.241 1.00 0.00 O ATOM 1408 CB PHE A 90 3.876 9.904 -0.738 1.00 0.00 C ATOM 1409 CG PHE A 90 2.956 10.682 0.204 1.00 0.00 C ATOM 1410 CD1 PHE A 90 2.183 11.691 -0.280 1.00 0.00 C ATOM 1411 CD2 PHE A 90 2.911 10.365 1.526 1.00 0.00 C ATOM 1412 CE1 PHE A 90 1.329 12.413 0.595 1.00 0.00 C ATOM 1413 CE2 PHE A 90 2.057 11.088 2.401 1.00 0.00 C ATOM 1414 CZ PHE A 90 1.284 12.096 1.917 1.00 0.00 C ATOM 0 H PHE A 90 5.774 9.050 -1.915 1.00 0.00 H new ATOM 0 HA PHE A 90 3.926 11.126 -2.547 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.288 9.153 -1.266 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.618 9.369 -0.145 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.219 11.943 -1.330 1.00 0.00 H new ATOM 0 HD2 PHE A 90 3.525 9.564 1.910 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.715 13.214 0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 90 2.022 10.837 3.451 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.634 12.645 2.582 1.00 0.00 H new ATOM 1424 N LYS A 91 6.205 11.760 -0.259 1.00 0.00 N ATOM 1425 CA LYS A 91 6.852 12.832 0.479 1.00 0.00 C ATOM 1426 C LYS A 91 7.709 13.660 -0.481 1.00 0.00 C ATOM 1427 O LYS A 91 8.037 14.809 -0.191 1.00 0.00 O ATOM 1428 CB LYS A 91 7.632 12.268 1.668 1.00 0.00 C ATOM 1429 CG LYS A 91 9.099 12.032 1.301 1.00 0.00 C ATOM 1430 CD LYS A 91 9.768 11.085 2.298 1.00 0.00 C ATOM 1431 CE LYS A 91 11.293 11.180 2.206 1.00 0.00 C ATOM 1432 NZ LYS A 91 11.870 9.878 1.802 1.00 0.00 N ATOM 0 H LYS A 91 6.607 10.835 -0.108 1.00 0.00 H new ATOM 0 HA LYS A 91 6.108 13.505 0.905 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.571 12.959 2.508 1.00 0.00 H new ATOM 0 HB3 LYS A 91 7.180 11.331 1.992 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.163 11.613 0.297 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.631 12.983 1.284 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.445 11.329 3.310 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.451 10.061 2.101 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.573 11.948 1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.703 11.483 3.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.774 10.036 1.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.031 9.293 2.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.211 9.390 1.163 1.00 0.00 H new ATOM 1446 N ARG A 92 8.046 13.044 -1.604 1.00 0.00 N ATOM 1447 CA ARG A 92 8.858 13.710 -2.608 1.00 0.00 C ATOM 1448 C ARG A 92 7.968 14.476 -3.589 1.00 0.00 C ATOM 1449 O ARG A 92 8.464 15.115 -4.515 1.00 0.00 O ATOM 1450 CB ARG A 92 9.710 12.704 -3.384 1.00 0.00 C ATOM 1451 CG ARG A 92 11.122 12.615 -2.800 1.00 0.00 C ATOM 1452 CD ARG A 92 12.009 11.699 -3.646 1.00 0.00 C ATOM 1453 NE ARG A 92 13.128 12.474 -4.227 1.00 0.00 N ATOM 1454 CZ ARG A 92 13.999 11.982 -5.118 1.00 0.00 C ATOM 1455 NH1 ARG A 92 13.886 10.714 -5.536 1.00 0.00 N ATOM 1456 NH2 ARG A 92 14.983 12.758 -5.592 1.00 0.00 N ATOM 0 H ARG A 92 7.772 12.091 -1.841 1.00 0.00 H new ATOM 0 HA ARG A 92 9.518 14.406 -2.091 1.00 0.00 H new ATOM 0 HB2 ARG A 92 9.238 11.722 -3.354 1.00 0.00 H new ATOM 0 HB3 ARG A 92 9.764 13.000 -4.432 1.00 0.00 H new ATOM 0 HG2 ARG A 92 11.563 13.611 -2.752 1.00 0.00 H new ATOM 0 HG3 ARG A 92 11.074 12.238 -1.778 1.00 0.00 H new ATOM 0 HD2 ARG A 92 12.398 10.887 -3.032 1.00 0.00 H new ATOM 0 HD3 ARG A 92 11.420 11.242 -4.442 1.00 0.00 H new ATOM 0 HE ARG A 92 13.243 13.443 -3.931 1.00 0.00 H new ATOM 0 HH11 ARG A 92 13.137 10.123 -5.176 1.00 0.00 H new ATOM 0 HH12 ARG A 92 14.549 10.340 -6.214 1.00 0.00 H new ATOM 0 HH21 ARG A 92 15.069 13.723 -5.274 1.00 0.00 H new ATOM 0 HH22 ARG A 92 15.646 12.383 -6.270 1.00 0.00 H new ATOM 1470 N SER A 93 6.667 14.387 -3.351 1.00 0.00 N ATOM 1471 CA SER A 93 5.703 15.064 -4.201 1.00 0.00 C ATOM 1472 C SER A 93 5.109 16.266 -3.465 1.00 0.00 C ATOM 1473 O SER A 93 4.869 17.311 -4.067 1.00 0.00 O ATOM 1474 CB SER A 93 4.591 14.109 -4.641 1.00 0.00 C ATOM 1475 OG SER A 93 3.577 13.977 -3.649 1.00 0.00 O ATOM 0 H SER A 93 6.259 13.856 -2.582 1.00 0.00 H new ATOM 0 HA SER A 93 6.221 15.413 -5.094 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.147 14.473 -5.568 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.018 13.129 -4.855 1.00 0.00 H new ATOM 0 HG SER A 93 3.982 13.689 -2.804 1.00 0.00 H new ATOM 1481 N ARG A 94 4.889 16.078 -2.172 1.00 0.00 N ATOM 1482 CA ARG A 94 4.328 17.134 -1.347 1.00 0.00 C ATOM 1483 C ARG A 94 5.397 18.179 -1.021 1.00 0.00 C ATOM 1484 O ARG A 94 5.113 19.181 -0.367 1.00 0.00 O ATOM 1485 CB ARG A 94 3.760 16.572 -0.042 1.00 0.00 C ATOM 1486 CG ARG A 94 4.869 15.968 0.823 1.00 0.00 C ATOM 1487 CD ARG A 94 4.286 15.267 2.051 1.00 0.00 C ATOM 1488 NE ARG A 94 5.332 15.106 3.086 1.00 0.00 N ATOM 1489 CZ ARG A 94 5.081 14.819 4.370 1.00 0.00 C ATOM 1490 NH1 ARG A 94 3.817 14.661 4.786 1.00 0.00 N ATOM 1491 NH2 ARG A 94 6.093 14.691 5.239 1.00 0.00 N ATOM 0 H ARG A 94 5.089 15.210 -1.675 1.00 0.00 H new ATOM 0 HA ARG A 94 3.520 17.600 -1.911 1.00 0.00 H new ATOM 0 HB2 ARG A 94 3.254 17.364 0.510 1.00 0.00 H new ATOM 0 HB3 ARG A 94 3.012 15.811 -0.265 1.00 0.00 H new ATOM 0 HG2 ARG A 94 5.448 15.256 0.234 1.00 0.00 H new ATOM 0 HG3 ARG A 94 5.556 16.753 1.140 1.00 0.00 H new ATOM 0 HD2 ARG A 94 3.454 15.847 2.450 1.00 0.00 H new ATOM 0 HD3 ARG A 94 3.889 14.292 1.769 1.00 0.00 H new ATOM 0 HE ARG A 94 6.305 15.221 2.804 1.00 0.00 H new ATOM 0 HH11 ARG A 94 3.046 14.759 4.125 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.625 14.442 5.764 1.00 0.00 H new ATOM 0 HH21 ARG A 94 7.055 14.812 4.923 1.00 0.00 H new ATOM 0 HH22 ARG A 94 5.901 14.472 6.217 1.00 0.00 H new ATOM 1505 N ILE A 95 6.606 17.909 -1.493 1.00 0.00 N ATOM 1506 CA ILE A 95 7.719 18.813 -1.261 1.00 0.00 C ATOM 1507 C ILE A 95 7.840 19.780 -2.440 1.00 0.00 C ATOM 1508 O ILE A 95 8.916 20.316 -2.700 1.00 0.00 O ATOM 1509 CB ILE A 95 8.999 18.024 -0.979 1.00 0.00 C ATOM 1510 CG1 ILE A 95 9.294 17.035 -2.108 1.00 0.00 C ATOM 1511 CG2 ILE A 95 8.929 17.333 0.385 1.00 0.00 C ATOM 1512 CD1 ILE A 95 10.742 16.545 -2.044 1.00 0.00 C ATOM 0 H ILE A 95 6.838 17.077 -2.035 1.00 0.00 H new ATOM 0 HA ILE A 95 7.541 19.416 -0.371 1.00 0.00 H new ATOM 0 HB ILE A 95 9.831 18.727 -0.941 1.00 0.00 H new ATOM 0 HG12 ILE A 95 8.615 16.185 -2.038 1.00 0.00 H new ATOM 0 HG13 ILE A 95 9.110 17.511 -3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 95 9.851 16.779 0.560 1.00 0.00 H new ATOM 0 HG22 ILE A 95 8.802 18.082 1.166 1.00 0.00 H new ATOM 0 HG23 ILE A 95 8.084 16.645 0.401 1.00 0.00 H new ATOM 0 HD11 ILE A 95 10.925 15.843 -2.858 1.00 0.00 H new ATOM 0 HD12 ILE A 95 11.418 17.395 -2.139 1.00 0.00 H new ATOM 0 HD13 ILE A 95 10.916 16.048 -1.090 1.00 0.00 H new ATOM 1524 N ALA A 96 6.721 19.974 -3.122 1.00 0.00 N ATOM 1525 CA ALA A 96 6.688 20.868 -4.267 1.00 0.00 C ATOM 1526 C ALA A 96 6.008 22.178 -3.866 1.00 0.00 C ATOM 1527 O ALA A 96 4.840 22.399 -4.184 1.00 0.00 O ATOM 1528 CB ALA A 96 5.979 20.176 -5.434 1.00 0.00 C ATOM 0 H ALA A 96 5.830 19.527 -2.904 1.00 0.00 H new ATOM 0 HA ALA A 96 7.699 21.109 -4.596 1.00 0.00 H new ATOM 0 HB1 ALA A 96 5.954 20.846 -6.293 1.00 0.00 H new ATOM 0 HB2 ALA A 96 6.518 19.266 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.960 19.922 -5.142 1.00 0.00 H new ATOM 1534 N SER A 97 6.768 23.015 -3.174 1.00 0.00 N ATOM 1535 CA SER A 97 6.253 24.298 -2.727 1.00 0.00 C ATOM 1536 C SER A 97 7.401 25.299 -2.578 1.00 0.00 C ATOM 1537 O SER A 97 8.542 24.909 -2.338 1.00 0.00 O ATOM 1538 CB SER A 97 5.497 24.157 -1.404 1.00 0.00 C ATOM 1539 OG SER A 97 6.345 23.709 -0.350 1.00 0.00 O ATOM 0 H SER A 97 7.736 22.829 -2.912 1.00 0.00 H new ATOM 0 HA SER A 97 5.553 24.666 -3.477 1.00 0.00 H new ATOM 0 HB2 SER A 97 5.058 25.117 -1.133 1.00 0.00 H new ATOM 0 HB3 SER A 97 4.673 23.454 -1.530 1.00 0.00 H new ATOM 0 HG SER A 97 5.826 23.633 0.478 1.00 0.00 H new ATOM 1545 N GLY A 98 7.058 26.570 -2.728 1.00 0.00 N ATOM 1546 CA GLY A 98 8.045 27.630 -2.614 1.00 0.00 C ATOM 1547 C GLY A 98 8.987 27.377 -1.434 1.00 0.00 C ATOM 1548 O GLY A 98 8.578 27.472 -0.278 1.00 0.00 O ATOM 0 H GLY A 98 6.110 26.890 -2.928 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.622 27.696 -3.537 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.542 28.588 -2.483 1.00 0.00 H new ATOM 1552 N PRO A 99 10.262 27.052 -1.777 1.00 0.00 N ATOM 1553 CA PRO A 99 11.265 26.785 -0.760 1.00 0.00 C ATOM 1554 C PRO A 99 11.736 28.082 -0.100 1.00 0.00 C ATOM 1555 O PRO A 99 11.261 29.165 -0.441 1.00 0.00 O ATOM 1556 CB PRO A 99 12.379 26.051 -1.489 1.00 0.00 C ATOM 1557 CG PRO A 99 12.173 26.343 -2.966 1.00 0.00 C ATOM 1558 CD PRO A 99 10.781 26.930 -3.136 1.00 0.00 C ATOM 0 HA PRO A 99 10.880 26.182 0.062 1.00 0.00 H new ATOM 0 HB2 PRO A 99 13.358 26.396 -1.155 1.00 0.00 H new ATOM 0 HB3 PRO A 99 12.335 24.980 -1.293 1.00 0.00 H new ATOM 0 HG2 PRO A 99 12.928 27.042 -3.326 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.277 25.431 -3.553 1.00 0.00 H new ATOM 0 HD2 PRO A 99 10.818 27.899 -3.634 1.00 0.00 H new ATOM 0 HD3 PRO A 99 10.150 26.282 -3.744 1.00 0.00 H new ATOM 1566 N SER A 100 12.664 27.931 0.833 1.00 0.00 N ATOM 1567 CA SER A 100 13.205 29.078 1.543 1.00 0.00 C ATOM 1568 C SER A 100 14.669 28.825 1.908 1.00 0.00 C ATOM 1569 O SER A 100 14.960 28.089 2.850 1.00 0.00 O ATOM 1570 CB SER A 100 12.389 29.380 2.802 1.00 0.00 C ATOM 1571 OG SER A 100 12.716 30.651 3.357 1.00 0.00 O ATOM 0 H SER A 100 13.055 27.032 1.114 1.00 0.00 H new ATOM 0 HA SER A 100 13.146 29.946 0.886 1.00 0.00 H new ATOM 0 HB2 SER A 100 11.326 29.352 2.561 1.00 0.00 H new ATOM 0 HB3 SER A 100 12.568 28.603 3.545 1.00 0.00 H new ATOM 0 HG SER A 100 12.173 30.808 4.158 1.00 0.00 H new ATOM 1577 N SER A 101 15.553 29.448 1.143 1.00 0.00 N ATOM 1578 CA SER A 101 16.980 29.300 1.374 1.00 0.00 C ATOM 1579 C SER A 101 17.720 30.550 0.894 1.00 0.00 C ATOM 1580 O SER A 101 17.224 31.279 0.037 1.00 0.00 O ATOM 1581 CB SER A 101 17.525 28.056 0.669 1.00 0.00 C ATOM 1582 OG SER A 101 17.606 28.235 -0.743 1.00 0.00 O ATOM 0 H SER A 101 15.309 30.057 0.362 1.00 0.00 H new ATOM 0 HA SER A 101 17.143 29.178 2.445 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.514 27.821 1.062 1.00 0.00 H new ATOM 0 HB3 SER A 101 16.883 27.203 0.890 1.00 0.00 H new ATOM 0 HG SER A 101 17.960 27.420 -1.156 1.00 0.00 H new ATOM 1588 N GLY A 102 18.896 30.758 1.467 1.00 0.00 N ATOM 1589 CA GLY A 102 19.710 31.907 1.109 1.00 0.00 C ATOM 1590 C GLY A 102 21.033 31.467 0.480 1.00 0.00 C ATOM 1591 O GLY A 102 21.804 32.298 0.001 1.00 0.00 O ATOM 0 H GLY A 102 19.305 30.150 2.177 1.00 0.00 H new ATOM 0 HA2 GLY A 102 19.164 32.540 0.410 1.00 0.00 H new ATOM 0 HA3 GLY A 102 19.907 32.508 1.997 1.00 0.00 H new TER 1595 GLY A 102