USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 970 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 19 ASN : amide:sc= -1.85! C(o=-2!,f=-1.1!) USER MOD Set 1.2: A 116 HIS : no HD1:sc= -0.195 X(o=-2,f=-2.4) USER MOD Set 2.1: A 94 SER OG : rot -1:sc= 0.937 USER MOD Set 2.2: A 112 GLN : amide:sc= -1.09! C(o=-0.16!,f=-2.5!) USER MOD Set 3.1: A 60 SER OG : rot 180:sc= -1.26 USER MOD Set 3.2: A 61 ASN : amide:sc= -4.18 K(o=-5.4,f=-4.7!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 4:sc= 0.572 USER MOD Single : A 3 SER OG : rot 13:sc= 0.797! USER MOD Single : A 5 SER OG : rot 27:sc= 0.922 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.0899 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 163:sc= -0.0353 (180deg=-0.275) USER MOD Single : A 31 HIS : no HE2:sc= -1.02 K(o=-1,f=-2) USER MOD Single : A 32 ASN : amide:sc= -1.75! K(o=-1.7!,f=-1.9e-05) USER MOD Single : A 35 GLN : amide:sc= -0.0202 K(o=-0.02,f=-0.66) USER MOD Single : A 40 TYR OH : rot 179:sc= 0.285 USER MOD Single : A 41 ASN : amide:sc= -7.3! C(o=-7.3!,f=-4.2!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.789 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.764 USER MOD Single : A 51 ASN : amide:sc= 0.521 K(o=0.52,f=-3.8!) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.837 USER MOD Single : A 62 GLN : amide:sc= -0.126 K(o=-0.13,f=-1.7!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot -4:sc= 0.136 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -4.44! C(o=-4.4!,f=-3.7!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 81 SER OG : rot 140:sc=-0.00833 USER MOD Single : A 84 MET CE :methyl -127:sc= -1.42 (180deg=-4.15!) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 92 THR OG1 : rot 99:sc= 0.217 USER MOD Single : A 95 TYR OH : rot -18:sc= 0.00635 USER MOD Single : A 96 THR OG1 : rot -160:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.354 X(o=-0.35,f=-0.35) USER MOD Single : A 101 LYS NZ :NH3+ -119:sc=-0.00626 (180deg=-2.34!) USER MOD Single : A 103 ASN : amide:sc= -4.97! C(o=-5!,f=-14!) USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0172 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.745 10.748 23.468 1.00 0.00 N ATOM 2 CA GLY A 1 11.839 11.613 23.067 1.00 0.00 C ATOM 3 C GLY A 1 12.356 11.290 21.680 1.00 0.00 C ATOM 4 O GLY A 1 13.529 10.957 21.510 1.00 0.00 O ATOM 0 H1 GLY A 1 10.428 11.010 24.423 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.955 10.854 22.800 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.067 9.759 23.469 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.506 12.651 23.095 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.653 11.520 23.785 1.00 0.00 H new ATOM 8 N SER A 2 11.479 11.385 20.686 1.00 0.00 N ATOM 9 CA SER A 2 11.853 11.094 19.306 1.00 0.00 C ATOM 10 C SER A 2 10.885 11.755 18.330 1.00 0.00 C ATOM 11 O SER A 2 9.679 11.512 18.376 1.00 0.00 O ATOM 12 CB SER A 2 11.880 9.582 19.071 1.00 0.00 C ATOM 13 OG SER A 2 10.568 9.053 19.006 1.00 0.00 O ATOM 0 H SER A 2 10.505 11.661 20.810 1.00 0.00 H new ATOM 0 HA SER A 2 12.850 11.499 19.132 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.410 9.364 18.144 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.432 9.096 19.875 1.00 0.00 H new ATOM 0 HG SER A 2 9.917 9.784 19.063 1.00 0.00 H new ATOM 19 N SER A 3 11.422 12.591 17.448 1.00 0.00 N ATOM 20 CA SER A 3 10.606 13.291 16.463 1.00 0.00 C ATOM 21 C SER A 3 11.483 14.050 15.472 1.00 0.00 C ATOM 22 O SER A 3 12.236 14.946 15.852 1.00 0.00 O ATOM 23 CB SER A 3 9.647 14.259 17.158 1.00 0.00 C ATOM 24 OG SER A 3 10.333 15.404 17.633 1.00 0.00 O ATOM 0 H SER A 3 12.419 12.800 17.395 1.00 0.00 H new ATOM 0 HA SER A 3 10.026 12.548 15.915 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.865 14.563 16.463 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.156 13.754 17.990 1.00 0.00 H new ATOM 0 HG SER A 3 11.232 15.432 17.244 1.00 0.00 H new ATOM 30 N GLY A 4 11.379 13.685 14.198 1.00 0.00 N ATOM 31 CA GLY A 4 12.168 14.341 13.171 1.00 0.00 C ATOM 32 C GLY A 4 11.484 14.329 11.819 1.00 0.00 C ATOM 33 O GLY A 4 11.664 13.399 11.033 1.00 0.00 O ATOM 0 H GLY A 4 10.763 12.947 13.858 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.361 15.372 13.468 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.136 13.847 13.089 1.00 0.00 H new ATOM 37 N SER A 5 10.696 15.364 11.547 1.00 0.00 N ATOM 38 CA SER A 5 9.978 15.467 10.282 1.00 0.00 C ATOM 39 C SER A 5 9.563 16.909 10.008 1.00 0.00 C ATOM 40 O SER A 5 9.346 17.691 10.934 1.00 0.00 O ATOM 41 CB SER A 5 8.743 14.564 10.298 1.00 0.00 C ATOM 42 OG SER A 5 9.091 13.219 10.019 1.00 0.00 O ATOM 0 H SER A 5 10.538 16.143 12.186 1.00 0.00 H new ATOM 0 HA SER A 5 10.647 15.142 9.485 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.258 14.623 11.272 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.021 14.917 9.561 1.00 0.00 H new ATOM 0 HG SER A 5 10.017 13.057 10.295 1.00 0.00 H new ATOM 48 N SER A 6 9.456 17.255 8.729 1.00 0.00 N ATOM 49 CA SER A 6 9.071 18.604 8.332 1.00 0.00 C ATOM 50 C SER A 6 7.780 19.028 9.025 1.00 0.00 C ATOM 51 O SER A 6 6.837 18.246 9.138 1.00 0.00 O ATOM 52 CB SER A 6 8.897 18.681 6.814 1.00 0.00 C ATOM 53 OG SER A 6 10.073 18.263 6.143 1.00 0.00 O ATOM 0 H SER A 6 9.631 16.620 7.950 1.00 0.00 H new ATOM 0 HA SER A 6 9.866 19.286 8.635 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.059 18.055 6.509 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.653 19.703 6.524 1.00 0.00 H new ATOM 0 HG SER A 6 9.935 18.320 5.174 1.00 0.00 H new ATOM 59 N GLY A 7 7.746 20.274 9.489 1.00 0.00 N ATOM 60 CA GLY A 7 6.567 20.781 10.166 1.00 0.00 C ATOM 61 C GLY A 7 6.093 19.860 11.274 1.00 0.00 C ATOM 62 O GLY A 7 6.872 19.074 11.814 1.00 0.00 O ATOM 0 H GLY A 7 8.514 20.941 9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.786 21.764 10.584 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.765 20.915 9.441 1.00 0.00 H new ATOM 66 N THR A 8 4.812 19.958 11.614 1.00 0.00 N ATOM 67 CA THR A 8 4.236 19.130 12.666 1.00 0.00 C ATOM 68 C THR A 8 2.982 18.413 12.178 1.00 0.00 C ATOM 69 O THR A 8 1.995 18.304 12.904 1.00 0.00 O ATOM 70 CB THR A 8 3.883 19.967 13.910 1.00 0.00 C ATOM 71 OG1 THR A 8 3.149 21.134 13.523 1.00 0.00 O ATOM 72 CG2 THR A 8 5.140 20.378 14.660 1.00 0.00 C ATOM 0 H THR A 8 4.154 20.602 11.176 1.00 0.00 H new ATOM 0 HA THR A 8 4.991 18.392 12.936 1.00 0.00 H new ATOM 0 HB THR A 8 3.269 19.355 14.570 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.927 21.660 14.320 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.865 20.968 15.534 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.681 19.487 14.979 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.776 20.974 14.005 1.00 0.00 H new ATOM 80 N ALA A 9 3.029 17.926 10.942 1.00 0.00 N ATOM 81 CA ALA A 9 1.897 17.216 10.358 1.00 0.00 C ATOM 82 C ALA A 9 2.311 16.470 9.094 1.00 0.00 C ATOM 83 O ALA A 9 2.994 17.023 8.232 1.00 0.00 O ATOM 84 CB ALA A 9 0.766 18.187 10.053 1.00 0.00 C ATOM 0 H ALA A 9 3.838 18.010 10.326 1.00 0.00 H new ATOM 0 HA ALA A 9 1.546 16.482 11.084 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.073 17.644 9.617 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.445 18.672 10.975 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.115 18.942 9.348 1.00 0.00 H new ATOM 90 N GLN A 10 1.893 15.213 8.991 1.00 0.00 N ATOM 91 CA GLN A 10 2.222 14.391 7.832 1.00 0.00 C ATOM 92 C GLN A 10 1.159 13.321 7.605 1.00 0.00 C ATOM 93 O GLN A 10 0.799 12.583 8.523 1.00 0.00 O ATOM 94 CB GLN A 10 3.591 13.736 8.018 1.00 0.00 C ATOM 95 CG GLN A 10 3.671 12.826 9.233 1.00 0.00 C ATOM 96 CD GLN A 10 5.007 12.119 9.347 1.00 0.00 C ATOM 97 OE1 GLN A 10 5.864 12.243 8.471 1.00 0.00 O ATOM 98 NE2 GLN A 10 5.192 11.373 10.430 1.00 0.00 N ATOM 0 H GLN A 10 1.326 14.741 9.696 1.00 0.00 H new ATOM 0 HA GLN A 10 2.253 15.038 6.955 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.832 13.158 7.126 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.348 14.515 8.108 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.498 13.414 10.134 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.875 12.083 9.179 1.00 0.00 H new ATOM 0 HE21 GLN A 10 4.454 11.299 11.130 1.00 0.00 H new ATOM 0 HE22 GLN A 10 6.072 10.874 10.561 1.00 0.00 H new ATOM 107 N LEU A 11 0.660 13.242 6.376 1.00 0.00 N ATOM 108 CA LEU A 11 -0.363 12.262 6.027 1.00 0.00 C ATOM 109 C LEU A 11 -0.037 10.898 6.627 1.00 0.00 C ATOM 110 O LEU A 11 0.858 10.196 6.153 1.00 0.00 O ATOM 111 CB LEU A 11 -0.489 12.146 4.507 1.00 0.00 C ATOM 112 CG LEU A 11 -1.852 11.700 3.978 1.00 0.00 C ATOM 113 CD1 LEU A 11 -2.972 12.398 4.734 1.00 0.00 C ATOM 114 CD2 LEU A 11 -1.962 11.975 2.486 1.00 0.00 C ATOM 0 H LEU A 11 0.947 13.845 5.605 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.313 12.602 6.439 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.251 13.115 4.068 1.00 0.00 H new ATOM 0 HB3 LEU A 11 0.264 11.442 4.153 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.948 10.626 4.137 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.935 12.068 4.344 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.906 12.150 5.793 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.879 13.477 4.607 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.939 11.651 2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -1.844 13.043 2.303 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.182 11.428 1.957 1.00 0.00 H new ATOM 126 N THR A 12 -0.770 10.526 7.672 1.00 0.00 N ATOM 127 CA THR A 12 -0.560 9.246 8.336 1.00 0.00 C ATOM 128 C THR A 12 -1.837 8.415 8.344 1.00 0.00 C ATOM 129 O THR A 12 -2.902 8.892 7.950 1.00 0.00 O ATOM 130 CB THR A 12 -0.077 9.438 9.787 1.00 0.00 C ATOM 131 OG1 THR A 12 0.404 8.196 10.311 1.00 0.00 O ATOM 132 CG2 THR A 12 -1.202 9.964 10.666 1.00 0.00 C ATOM 0 H THR A 12 -1.515 11.094 8.077 1.00 0.00 H new ATOM 0 HA THR A 12 0.209 8.720 7.771 1.00 0.00 H new ATOM 0 HB THR A 12 0.732 10.168 9.784 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.711 8.327 11.233 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.838 10.092 11.685 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.546 10.924 10.281 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.029 9.254 10.662 1.00 0.00 H new ATOM 140 N ILE A 13 -1.725 7.170 8.795 1.00 0.00 N ATOM 141 CA ILE A 13 -2.872 6.273 8.855 1.00 0.00 C ATOM 142 C ILE A 13 -2.842 5.426 10.123 1.00 0.00 C ATOM 143 O ILE A 13 -1.789 4.934 10.527 1.00 0.00 O ATOM 144 CB ILE A 13 -2.923 5.341 7.630 1.00 0.00 C ATOM 145 CG1 ILE A 13 -3.400 6.110 6.396 1.00 0.00 C ATOM 146 CG2 ILE A 13 -3.834 4.154 7.905 1.00 0.00 C ATOM 147 CD1 ILE A 13 -3.236 5.341 5.104 1.00 0.00 C ATOM 0 H ILE A 13 -0.851 6.760 9.124 1.00 0.00 H new ATOM 0 HA ILE A 13 -3.763 6.901 8.861 1.00 0.00 H new ATOM 0 HB ILE A 13 -1.918 4.966 7.436 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -4.451 6.370 6.524 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -2.846 7.046 6.325 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.860 3.505 7.030 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.455 3.595 8.761 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.841 4.511 8.122 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -3.595 5.947 4.272 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.183 5.104 4.953 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.812 4.417 5.155 1.00 0.00 H new ATOM 159 N GLU A 14 -4.005 5.260 10.745 1.00 0.00 N ATOM 160 CA GLU A 14 -4.112 4.472 11.967 1.00 0.00 C ATOM 161 C GLU A 14 -5.203 3.413 11.837 1.00 0.00 C ATOM 162 O GLU A 14 -6.391 3.733 11.794 1.00 0.00 O ATOM 163 CB GLU A 14 -4.406 5.380 13.162 1.00 0.00 C ATOM 164 CG GLU A 14 -4.487 4.637 14.485 1.00 0.00 C ATOM 165 CD GLU A 14 -4.615 5.572 15.672 1.00 0.00 C ATOM 166 OE1 GLU A 14 -5.382 6.553 15.576 1.00 0.00 O ATOM 167 OE2 GLU A 14 -3.948 5.323 16.698 1.00 0.00 O ATOM 0 H GLU A 14 -4.886 5.661 10.423 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.159 3.969 12.129 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.629 6.141 13.229 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.348 5.901 12.989 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.342 3.961 14.466 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.596 4.021 14.607 1.00 0.00 H new ATOM 174 N ALA A 15 -4.791 2.151 11.776 1.00 0.00 N ATOM 175 CA ALA A 15 -5.732 1.045 11.653 1.00 0.00 C ATOM 176 C ALA A 15 -6.607 0.928 12.897 1.00 0.00 C ATOM 177 O ALA A 15 -6.124 1.061 14.022 1.00 0.00 O ATOM 178 CB ALA A 15 -4.987 -0.258 11.405 1.00 0.00 C ATOM 0 H ALA A 15 -3.811 1.869 11.810 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.381 1.246 10.801 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.703 -1.075 11.315 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.411 -0.178 10.483 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.313 -0.456 12.238 1.00 0.00 H new ATOM 184 N VAL A 16 -7.895 0.678 12.688 1.00 0.00 N ATOM 185 CA VAL A 16 -8.837 0.542 13.793 1.00 0.00 C ATOM 186 C VAL A 16 -9.829 -0.586 13.534 1.00 0.00 C ATOM 187 O VAL A 16 -10.714 -0.485 12.684 1.00 0.00 O ATOM 188 CB VAL A 16 -9.615 1.850 14.031 1.00 0.00 C ATOM 189 CG1 VAL A 16 -10.611 1.679 15.168 1.00 0.00 C ATOM 190 CG2 VAL A 16 -8.656 2.995 14.319 1.00 0.00 C ATOM 0 H VAL A 16 -8.311 0.565 11.763 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.251 0.309 14.682 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.172 2.092 13.125 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.151 2.613 15.322 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.318 0.888 14.917 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.079 1.413 16.081 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.223 3.911 14.485 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.071 2.764 15.209 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.986 3.131 13.470 1.00 0.00 H new ATOM 200 N PRO A 17 -9.680 -1.688 14.284 1.00 0.00 N ATOM 201 CA PRO A 17 -8.630 -1.820 15.298 1.00 0.00 C ATOM 202 C PRO A 17 -7.240 -1.933 14.682 1.00 0.00 C ATOM 203 O PRO A 17 -7.087 -1.900 13.461 1.00 0.00 O ATOM 204 CB PRO A 17 -8.999 -3.115 16.025 1.00 0.00 C ATOM 205 CG PRO A 17 -9.780 -3.900 15.028 1.00 0.00 C ATOM 206 CD PRO A 17 -10.525 -2.891 14.199 1.00 0.00 C ATOM 0 HA PRO A 17 -8.582 -0.948 15.950 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -8.109 -3.656 16.346 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -9.589 -2.913 16.919 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -9.121 -4.506 14.406 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -10.469 -4.584 15.523 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -10.644 -3.227 13.169 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -11.525 -2.708 14.592 1.00 0.00 H new ATOM 214 N SER A 18 -6.229 -2.066 15.534 1.00 0.00 N ATOM 215 CA SER A 18 -4.850 -2.181 15.073 1.00 0.00 C ATOM 216 C SER A 18 -4.473 -3.641 14.845 1.00 0.00 C ATOM 217 O SER A 18 -3.605 -3.949 14.030 1.00 0.00 O ATOM 218 CB SER A 18 -3.896 -1.548 16.088 1.00 0.00 C ATOM 219 OG SER A 18 -2.563 -1.554 15.608 1.00 0.00 O ATOM 0 H SER A 18 -6.339 -2.097 16.548 1.00 0.00 H new ATOM 0 HA SER A 18 -4.765 -1.650 14.125 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.207 -0.524 16.294 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.949 -2.093 17.030 1.00 0.00 H new ATOM 0 HG SER A 18 -1.974 -1.143 16.274 1.00 0.00 H new ATOM 225 N ASN A 19 -5.133 -4.537 15.572 1.00 0.00 N ATOM 226 CA ASN A 19 -4.868 -5.966 15.451 1.00 0.00 C ATOM 227 C ASN A 19 -6.170 -6.757 15.383 1.00 0.00 C ATOM 228 O ASN A 19 -6.692 -7.201 16.405 1.00 0.00 O ATOM 229 CB ASN A 19 -4.024 -6.451 16.631 1.00 0.00 C ATOM 230 CG ASN A 19 -4.794 -6.438 17.937 1.00 0.00 C ATOM 231 OD1 ASN A 19 -5.080 -7.488 18.512 1.00 0.00 O ATOM 232 ND2 ASN A 19 -5.134 -5.245 18.411 1.00 0.00 N ATOM 0 H ASN A 19 -5.855 -4.298 16.251 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.315 -6.131 14.526 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.672 -7.463 16.430 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.141 -5.819 16.727 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.654 -5.173 19.286 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.875 -4.401 17.900 1.00 0.00 H new ATOM 239 N ALA A 20 -6.689 -6.930 14.172 1.00 0.00 N ATOM 240 CA ALA A 20 -7.929 -7.670 13.971 1.00 0.00 C ATOM 241 C ALA A 20 -7.652 -9.151 13.738 1.00 0.00 C ATOM 242 O ALA A 20 -6.514 -9.549 13.491 1.00 0.00 O ATOM 243 CB ALA A 20 -8.708 -7.086 12.801 1.00 0.00 C ATOM 0 H ALA A 20 -6.270 -6.568 13.315 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.530 -7.577 14.876 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.632 -7.648 12.662 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.946 -6.042 13.007 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.105 -7.149 11.895 1.00 0.00 H new ATOM 249 N ALA A 21 -8.701 -9.964 13.819 1.00 0.00 N ATOM 250 CA ALA A 21 -8.570 -11.402 13.616 1.00 0.00 C ATOM 251 C ALA A 21 -9.222 -11.832 12.306 1.00 0.00 C ATOM 252 O ALA A 21 -10.068 -11.124 11.761 1.00 0.00 O ATOM 253 CB ALA A 21 -9.183 -12.158 14.785 1.00 0.00 C ATOM 0 H ALA A 21 -9.650 -9.651 14.024 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.508 -11.641 13.560 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -9.078 -13.230 14.620 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.671 -11.881 15.706 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.240 -11.905 14.867 1.00 0.00 H new ATOM 259 N GLU A 22 -8.821 -12.997 11.805 1.00 0.00 N ATOM 260 CA GLU A 22 -9.365 -13.520 10.558 1.00 0.00 C ATOM 261 C GLU A 22 -10.889 -13.437 10.553 1.00 0.00 C ATOM 262 O GLU A 22 -11.550 -13.889 11.487 1.00 0.00 O ATOM 263 CB GLU A 22 -8.922 -14.969 10.350 1.00 0.00 C ATOM 264 CG GLU A 22 -7.502 -15.102 9.824 1.00 0.00 C ATOM 265 CD GLU A 22 -6.974 -16.520 9.923 1.00 0.00 C ATOM 266 OE1 GLU A 22 -7.502 -17.293 10.750 1.00 0.00 O ATOM 267 OE2 GLU A 22 -6.033 -16.856 9.174 1.00 0.00 O ATOM 0 H GLU A 22 -8.122 -13.596 12.244 1.00 0.00 H new ATOM 0 HA GLU A 22 -8.982 -12.910 9.740 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -9.001 -15.504 11.296 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -9.606 -15.453 9.652 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.472 -14.779 8.783 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.847 -14.434 10.384 1.00 0.00 H new ATOM 274 N GLY A 23 -11.441 -12.854 9.492 1.00 0.00 N ATOM 275 CA GLY A 23 -12.882 -12.721 9.385 1.00 0.00 C ATOM 276 C GLY A 23 -13.387 -11.408 9.948 1.00 0.00 C ATOM 277 O GLY A 23 -14.565 -11.076 9.811 1.00 0.00 O ATOM 0 H GLY A 23 -10.916 -12.472 8.706 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.174 -12.800 8.338 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.360 -13.547 9.912 1.00 0.00 H new ATOM 281 N LYS A 24 -12.495 -10.657 10.585 1.00 0.00 N ATOM 282 CA LYS A 24 -12.855 -9.372 11.172 1.00 0.00 C ATOM 283 C LYS A 24 -12.674 -8.243 10.163 1.00 0.00 C ATOM 284 O LYS A 24 -12.236 -8.471 9.036 1.00 0.00 O ATOM 285 CB LYS A 24 -12.005 -9.100 12.416 1.00 0.00 C ATOM 286 CG LYS A 24 -12.252 -10.082 13.548 1.00 0.00 C ATOM 287 CD LYS A 24 -13.524 -9.747 14.309 1.00 0.00 C ATOM 288 CE LYS A 24 -13.650 -10.579 15.576 1.00 0.00 C ATOM 289 NZ LYS A 24 -12.618 -10.214 16.585 1.00 0.00 N ATOM 0 H LYS A 24 -11.516 -10.917 10.708 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.906 -9.414 11.459 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.951 -9.134 12.140 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -12.209 -8.090 12.771 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.323 -11.092 13.145 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -11.404 -10.071 14.232 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -13.527 -8.688 14.566 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -14.389 -9.923 13.669 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.642 -10.439 16.005 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.556 -11.636 15.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -12.900 -10.578 17.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.704 -10.629 16.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.528 -9.179 16.631 1.00 0.00 H new ATOM 303 N GLU A 25 -13.012 -7.026 10.576 1.00 0.00 N ATOM 304 CA GLU A 25 -12.886 -5.862 9.707 1.00 0.00 C ATOM 305 C GLU A 25 -11.948 -4.825 10.319 1.00 0.00 C ATOM 306 O GLU A 25 -11.940 -4.619 11.532 1.00 0.00 O ATOM 307 CB GLU A 25 -14.259 -5.236 9.452 1.00 0.00 C ATOM 308 CG GLU A 25 -15.335 -6.251 9.103 1.00 0.00 C ATOM 309 CD GLU A 25 -15.784 -7.062 10.303 1.00 0.00 C ATOM 310 OE1 GLU A 25 -15.840 -6.496 11.415 1.00 0.00 O ATOM 311 OE2 GLU A 25 -16.079 -8.263 10.130 1.00 0.00 O ATOM 0 H GLU A 25 -13.375 -6.820 11.507 1.00 0.00 H new ATOM 0 HA GLU A 25 -12.464 -6.194 8.758 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -14.567 -4.683 10.339 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -14.175 -4.514 8.640 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -16.194 -5.732 8.678 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -14.957 -6.925 8.334 1.00 0.00 H new ATOM 318 N VAL A 26 -11.159 -4.175 9.469 1.00 0.00 N ATOM 319 CA VAL A 26 -10.217 -3.159 9.925 1.00 0.00 C ATOM 320 C VAL A 26 -10.453 -1.832 9.212 1.00 0.00 C ATOM 321 O VAL A 26 -10.580 -1.787 7.987 1.00 0.00 O ATOM 322 CB VAL A 26 -8.760 -3.601 9.695 1.00 0.00 C ATOM 323 CG1 VAL A 26 -7.798 -2.482 10.062 1.00 0.00 C ATOM 324 CG2 VAL A 26 -8.454 -4.861 10.491 1.00 0.00 C ATOM 0 H VAL A 26 -11.153 -4.334 8.461 1.00 0.00 H new ATOM 0 HA VAL A 26 -10.384 -3.029 10.994 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.630 -3.827 8.637 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.773 -2.813 9.893 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -8.004 -1.608 9.444 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.926 -2.222 11.113 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.420 -5.159 10.317 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.601 -4.665 11.553 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.121 -5.663 10.174 1.00 0.00 H new ATOM 334 N LEU A 27 -10.510 -0.754 9.985 1.00 0.00 N ATOM 335 CA LEU A 27 -10.730 0.576 9.428 1.00 0.00 C ATOM 336 C LEU A 27 -9.443 1.396 9.451 1.00 0.00 C ATOM 337 O LEU A 27 -9.003 1.850 10.507 1.00 0.00 O ATOM 338 CB LEU A 27 -11.825 1.304 10.209 1.00 0.00 C ATOM 339 CG LEU A 27 -11.943 2.807 9.958 1.00 0.00 C ATOM 340 CD1 LEU A 27 -12.855 3.081 8.772 1.00 0.00 C ATOM 341 CD2 LEU A 27 -12.457 3.517 11.202 1.00 0.00 C ATOM 0 H LEU A 27 -10.407 -0.774 11.000 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.048 0.460 8.392 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -12.782 0.840 9.971 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.650 1.146 11.273 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.951 3.195 9.725 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.927 4.156 8.609 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.446 2.605 7.881 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.847 2.678 8.975 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.535 4.586 11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.439 3.124 11.465 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.766 3.350 12.028 1.00 0.00 H new ATOM 353 N LEU A 28 -8.847 1.583 8.279 1.00 0.00 N ATOM 354 CA LEU A 28 -7.611 2.351 8.163 1.00 0.00 C ATOM 355 C LEU A 28 -7.903 3.846 8.103 1.00 0.00 C ATOM 356 O LEU A 28 -8.144 4.400 7.029 1.00 0.00 O ATOM 357 CB LEU A 28 -6.835 1.920 6.917 1.00 0.00 C ATOM 358 CG LEU A 28 -6.267 0.501 6.938 1.00 0.00 C ATOM 359 CD1 LEU A 28 -5.690 0.137 5.578 1.00 0.00 C ATOM 360 CD2 LEU A 28 -5.207 0.366 8.021 1.00 0.00 C ATOM 0 H LEU A 28 -9.199 1.214 7.396 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.005 2.154 9.047 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.493 2.014 6.053 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.011 2.618 6.767 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.079 -0.191 7.164 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.290 -0.876 5.612 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.474 0.193 4.823 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.891 0.834 5.323 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.814 -0.651 8.021 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.396 1.068 7.826 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.650 0.584 8.993 1.00 0.00 H new ATOM 372 N LEU A 29 -7.879 4.496 9.262 1.00 0.00 N ATOM 373 CA LEU A 29 -8.138 5.929 9.341 1.00 0.00 C ATOM 374 C LEU A 29 -6.965 6.727 8.780 1.00 0.00 C ATOM 375 O LEU A 29 -5.853 6.214 8.659 1.00 0.00 O ATOM 376 CB LEU A 29 -8.402 6.340 10.791 1.00 0.00 C ATOM 377 CG LEU A 29 -9.860 6.287 11.248 1.00 0.00 C ATOM 378 CD1 LEU A 29 -9.953 6.462 12.756 1.00 0.00 C ATOM 379 CD2 LEU A 29 -10.682 7.350 10.534 1.00 0.00 C ATOM 0 H LEU A 29 -7.683 4.053 10.160 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.021 6.147 8.741 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.814 5.695 11.443 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.034 7.356 10.932 1.00 0.00 H new ATOM 0 HG LEU A 29 -10.266 5.309 10.990 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -10.998 6.422 13.063 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.398 5.664 13.250 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.529 7.426 13.037 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -11.717 7.297 10.872 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -10.276 8.336 10.760 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.642 7.179 9.458 1.00 0.00 H new ATOM 391 N VAL A 30 -7.221 7.986 8.440 1.00 0.00 N ATOM 392 CA VAL A 30 -6.186 8.857 7.895 1.00 0.00 C ATOM 393 C VAL A 30 -6.199 10.220 8.578 1.00 0.00 C ATOM 394 O VAL A 30 -7.228 10.895 8.622 1.00 0.00 O ATOM 395 CB VAL A 30 -6.361 9.054 6.378 1.00 0.00 C ATOM 396 CG1 VAL A 30 -5.038 9.440 5.734 1.00 0.00 C ATOM 397 CG2 VAL A 30 -6.926 7.794 5.739 1.00 0.00 C ATOM 0 H VAL A 30 -8.137 8.426 8.532 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.230 8.369 8.083 1.00 0.00 H new ATOM 0 HB VAL A 30 -7.069 9.866 6.214 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.181 9.575 4.662 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.678 10.371 6.172 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.306 8.651 5.906 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.043 7.951 4.667 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.244 6.961 5.911 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.896 7.566 6.180 1.00 0.00 H new ATOM 407 N HIS A 31 -5.048 10.619 9.110 1.00 0.00 N ATOM 408 CA HIS A 31 -4.926 11.903 9.791 1.00 0.00 C ATOM 409 C HIS A 31 -4.119 12.889 8.951 1.00 0.00 C ATOM 410 O HIS A 31 -3.600 12.537 7.893 1.00 0.00 O ATOM 411 CB HIS A 31 -4.264 11.719 11.157 1.00 0.00 C ATOM 412 CG HIS A 31 -4.728 10.496 11.887 1.00 0.00 C ATOM 413 ND1 HIS A 31 -6.051 10.259 12.195 1.00 0.00 N ATOM 414 CD2 HIS A 31 -4.035 9.437 12.369 1.00 0.00 C ATOM 415 CE1 HIS A 31 -6.152 9.109 12.836 1.00 0.00 C ATOM 416 NE2 HIS A 31 -4.943 8.590 12.954 1.00 0.00 N ATOM 0 H HIS A 31 -4.187 10.072 9.083 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.928 12.308 9.932 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -3.184 11.665 11.024 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -4.466 12.597 11.771 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -6.830 10.876 11.964 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -2.967 9.287 12.305 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -7.067 8.668 13.202 1.00 0.00 H new ATOM 425 N ASN A 32 -4.020 14.125 9.430 1.00 0.00 N ATOM 426 CA ASN A 32 -3.277 15.161 8.722 1.00 0.00 C ATOM 427 C ASN A 32 -3.724 15.252 7.266 1.00 0.00 C ATOM 428 O ASN A 32 -2.969 15.697 6.400 1.00 0.00 O ATOM 429 CB ASN A 32 -1.775 14.879 8.790 1.00 0.00 C ATOM 430 CG ASN A 32 -1.227 15.004 10.198 1.00 0.00 C ATOM 431 OD1 ASN A 32 -1.663 15.854 10.974 1.00 0.00 O ATOM 432 ND2 ASN A 32 -0.264 14.154 10.535 1.00 0.00 N ATOM 0 H ASN A 32 -4.445 14.433 10.305 1.00 0.00 H new ATOM 0 HA ASN A 32 -3.482 16.115 9.207 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -1.579 13.875 8.415 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.248 15.572 8.135 1.00 0.00 H new ATOM 0 HD21 ASN A 32 0.144 14.190 11.469 1.00 0.00 H new ATOM 0 HD22 ASN A 32 0.067 13.465 9.860 1.00 0.00 H new ATOM 439 N LEU A 33 -4.955 14.828 7.003 1.00 0.00 N ATOM 440 CA LEU A 33 -5.503 14.861 5.652 1.00 0.00 C ATOM 441 C LEU A 33 -5.291 16.229 5.012 1.00 0.00 C ATOM 442 O LEU A 33 -5.111 17.239 5.692 1.00 0.00 O ATOM 443 CB LEU A 33 -6.995 14.523 5.677 1.00 0.00 C ATOM 444 CG LEU A 33 -7.345 13.039 5.793 1.00 0.00 C ATOM 445 CD1 LEU A 33 -8.845 12.832 5.653 1.00 0.00 C ATOM 446 CD2 LEU A 33 -6.593 12.230 4.746 1.00 0.00 C ATOM 0 H LEU A 33 -5.593 14.457 7.708 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.978 14.115 5.055 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.453 15.050 6.514 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.451 14.913 4.767 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.041 12.690 6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -9.075 11.770 5.738 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.363 13.380 6.440 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.174 13.198 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.854 11.176 4.844 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.865 12.581 3.751 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.520 12.353 4.893 1.00 0.00 H new ATOM 458 N PRO A 34 -5.315 16.266 3.671 1.00 0.00 N ATOM 459 CA PRO A 34 -5.130 17.505 2.910 1.00 0.00 C ATOM 460 C PRO A 34 -6.313 18.456 3.054 1.00 0.00 C ATOM 461 O PRO A 34 -7.264 18.172 3.781 1.00 0.00 O ATOM 462 CB PRO A 34 -5.009 17.018 1.463 1.00 0.00 C ATOM 463 CG PRO A 34 -5.736 15.717 1.440 1.00 0.00 C ATOM 464 CD PRO A 34 -5.525 15.101 2.795 1.00 0.00 C ATOM 0 HA PRO A 34 -4.266 18.071 3.258 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -5.451 17.731 0.767 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -3.966 16.894 1.173 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.797 15.866 1.240 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.351 15.069 0.652 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.388 14.513 3.108 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -4.664 14.432 2.803 1.00 0.00 H new ATOM 472 N GLN A 35 -6.246 19.586 2.357 1.00 0.00 N ATOM 473 CA GLN A 35 -7.312 20.579 2.409 1.00 0.00 C ATOM 474 C GLN A 35 -8.488 20.162 1.532 1.00 0.00 C ATOM 475 O GLN A 35 -9.626 20.089 1.996 1.00 0.00 O ATOM 476 CB GLN A 35 -6.788 21.945 1.963 1.00 0.00 C ATOM 477 CG GLN A 35 -6.281 21.964 0.530 1.00 0.00 C ATOM 478 CD GLN A 35 -5.472 23.206 0.214 1.00 0.00 C ATOM 479 OE1 GLN A 35 -4.671 23.664 1.030 1.00 0.00 O ATOM 480 NE2 GLN A 35 -5.677 23.760 -0.976 1.00 0.00 N ATOM 0 H GLN A 35 -5.465 19.836 1.750 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.658 20.649 3.440 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -7.584 22.682 2.068 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.981 22.251 2.629 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.667 21.081 0.354 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -7.129 21.904 -0.152 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.350 23.347 -1.622 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.161 24.598 -1.244 1.00 0.00 H new ATOM 489 N ASP A 36 -8.206 19.889 0.263 1.00 0.00 N ATOM 490 CA ASP A 36 -9.240 19.477 -0.679 1.00 0.00 C ATOM 491 C ASP A 36 -8.806 18.238 -1.456 1.00 0.00 C ATOM 492 O ASP A 36 -8.215 18.325 -2.532 1.00 0.00 O ATOM 493 CB ASP A 36 -9.558 20.617 -1.649 1.00 0.00 C ATOM 494 CG ASP A 36 -10.391 21.709 -1.006 1.00 0.00 C ATOM 495 OD1 ASP A 36 -11.635 21.606 -1.043 1.00 0.00 O ATOM 496 OD2 ASP A 36 -9.798 22.665 -0.466 1.00 0.00 O ATOM 0 H ASP A 36 -7.270 19.946 -0.137 1.00 0.00 H new ATOM 0 HA ASP A 36 -10.137 19.231 -0.111 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -8.627 21.045 -2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -10.091 20.218 -2.512 1.00 0.00 H new ATOM 501 N PRO A 37 -9.105 17.055 -0.898 1.00 0.00 N ATOM 502 CA PRO A 37 -8.755 15.775 -1.521 1.00 0.00 C ATOM 503 C PRO A 37 -9.572 15.500 -2.778 1.00 0.00 C ATOM 504 O PRO A 37 -10.633 14.878 -2.716 1.00 0.00 O ATOM 505 CB PRO A 37 -9.084 14.750 -0.433 1.00 0.00 C ATOM 506 CG PRO A 37 -10.127 15.407 0.404 1.00 0.00 C ATOM 507 CD PRO A 37 -9.808 16.877 0.384 1.00 0.00 C ATOM 0 HA PRO A 37 -7.715 15.751 -1.848 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.451 13.819 -0.864 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -8.202 14.502 0.157 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -11.124 15.218 0.005 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.112 15.018 1.422 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -10.711 17.485 0.435 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.182 17.164 1.229 1.00 0.00 H new ATOM 515 N ARG A 38 -9.071 15.965 -3.917 1.00 0.00 N ATOM 516 CA ARG A 38 -9.756 15.769 -5.190 1.00 0.00 C ATOM 517 C ARG A 38 -10.240 14.329 -5.330 1.00 0.00 C ATOM 518 O ARG A 38 -11.262 14.065 -5.963 1.00 0.00 O ATOM 519 CB ARG A 38 -8.827 16.122 -6.353 1.00 0.00 C ATOM 520 CG ARG A 38 -9.547 16.271 -7.683 1.00 0.00 C ATOM 521 CD ARG A 38 -8.583 16.161 -8.854 1.00 0.00 C ATOM 522 NE ARG A 38 -8.442 14.785 -9.319 1.00 0.00 N ATOM 523 CZ ARG A 38 -7.881 14.454 -10.477 1.00 0.00 C ATOM 524 NH1 ARG A 38 -7.411 15.397 -11.283 1.00 0.00 N ATOM 525 NH2 ARG A 38 -7.789 13.179 -10.831 1.00 0.00 N ATOM 0 H ARG A 38 -8.193 16.480 -3.985 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.623 16.429 -5.214 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.309 17.053 -6.124 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -8.065 15.348 -6.446 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.316 15.503 -7.770 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -10.054 17.235 -7.717 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -8.936 16.786 -9.674 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -7.607 16.545 -8.557 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.793 14.036 -8.722 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -7.480 16.379 -11.014 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -6.981 15.141 -12.172 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -8.149 12.451 -10.214 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.358 12.926 -11.720 1.00 0.00 H new ATOM 539 N GLY A 39 -9.498 13.399 -4.734 1.00 0.00 N ATOM 540 CA GLY A 39 -9.867 11.998 -4.805 1.00 0.00 C ATOM 541 C GLY A 39 -8.869 11.099 -4.103 1.00 0.00 C ATOM 542 O GLY A 39 -7.701 11.458 -3.950 1.00 0.00 O ATOM 0 H GLY A 39 -8.648 13.592 -4.204 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -10.852 11.862 -4.357 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -9.948 11.699 -5.850 1.00 0.00 H new ATOM 546 N TYR A 40 -9.329 9.930 -3.672 1.00 0.00 N ATOM 547 CA TYR A 40 -8.469 8.979 -2.978 1.00 0.00 C ATOM 548 C TYR A 40 -8.102 7.811 -3.888 1.00 0.00 C ATOM 549 O TYR A 40 -8.763 7.563 -4.895 1.00 0.00 O ATOM 550 CB TYR A 40 -9.161 8.460 -1.717 1.00 0.00 C ATOM 551 CG TYR A 40 -9.808 9.548 -0.890 1.00 0.00 C ATOM 552 CD1 TYR A 40 -9.049 10.571 -0.337 1.00 0.00 C ATOM 553 CD2 TYR A 40 -11.179 9.552 -0.662 1.00 0.00 C ATOM 554 CE1 TYR A 40 -9.636 11.567 0.420 1.00 0.00 C ATOM 555 CE2 TYR A 40 -11.774 10.544 0.092 1.00 0.00 C ATOM 556 CZ TYR A 40 -10.999 11.549 0.632 1.00 0.00 C ATOM 557 OH TYR A 40 -11.587 12.540 1.384 1.00 0.00 O ATOM 0 H TYR A 40 -10.293 9.618 -3.791 1.00 0.00 H new ATOM 0 HA TYR A 40 -7.553 9.497 -2.695 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -9.921 7.732 -2.003 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -8.431 7.934 -1.102 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -7.982 10.588 -0.501 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.789 8.766 -1.082 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -9.031 12.355 0.843 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.841 10.533 0.258 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.555 12.390 1.423 1.00 0.00 H new ATOM 567 N ASN A 41 -7.042 7.096 -3.524 1.00 0.00 N ATOM 568 CA ASN A 41 -6.586 5.953 -4.307 1.00 0.00 C ATOM 569 C ASN A 41 -5.756 5.003 -3.449 1.00 0.00 C ATOM 570 O ASN A 41 -4.612 5.300 -3.105 1.00 0.00 O ATOM 571 CB ASN A 41 -5.763 6.425 -5.507 1.00 0.00 C ATOM 572 CG ASN A 41 -6.577 7.268 -6.470 1.00 0.00 C ATOM 573 OD1 ASN A 41 -7.308 6.741 -7.308 1.00 0.00 O ATOM 574 ND2 ASN A 41 -6.453 8.585 -6.353 1.00 0.00 N ATOM 0 H ASN A 41 -6.483 7.288 -2.693 1.00 0.00 H new ATOM 0 HA ASN A 41 -7.464 5.417 -4.666 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -4.909 7.004 -5.154 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -5.364 5.558 -6.034 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -6.976 9.204 -6.973 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -5.835 8.978 -5.643 1.00 0.00 H new ATOM 581 N TRP A 42 -6.339 3.859 -3.108 1.00 0.00 N ATOM 582 CA TRP A 42 -5.653 2.865 -2.291 1.00 0.00 C ATOM 583 C TRP A 42 -4.916 1.857 -3.165 1.00 0.00 C ATOM 584 O TRP A 42 -5.288 1.631 -4.317 1.00 0.00 O ATOM 585 CB TRP A 42 -6.652 2.141 -1.387 1.00 0.00 C ATOM 586 CG TRP A 42 -7.112 2.970 -0.226 1.00 0.00 C ATOM 587 CD1 TRP A 42 -8.153 3.854 -0.212 1.00 0.00 C ATOM 588 CD2 TRP A 42 -6.544 2.994 1.088 1.00 0.00 C ATOM 589 NE1 TRP A 42 -8.267 4.426 1.032 1.00 0.00 N ATOM 590 CE2 TRP A 42 -7.292 3.914 1.848 1.00 0.00 C ATOM 591 CE3 TRP A 42 -5.479 2.327 1.698 1.00 0.00 C ATOM 592 CZ2 TRP A 42 -7.006 4.183 3.184 1.00 0.00 C ATOM 593 CZ3 TRP A 42 -5.196 2.594 3.024 1.00 0.00 C ATOM 594 CH2 TRP A 42 -5.958 3.515 3.755 1.00 0.00 C ATOM 0 H TRP A 42 -7.285 3.597 -3.385 1.00 0.00 H new ATOM 0 HA TRP A 42 -4.921 3.383 -1.671 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -7.518 1.845 -1.979 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -6.194 1.226 -1.012 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -8.792 4.071 -1.055 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -8.964 5.119 1.304 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.887 1.615 1.143 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -7.591 4.894 3.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -4.374 2.084 3.505 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.713 3.701 4.790 1.00 0.00 H new ATOM 605 N TYR A 43 -3.870 1.253 -2.612 1.00 0.00 N ATOM 606 CA TYR A 43 -3.080 0.270 -3.343 1.00 0.00 C ATOM 607 C TYR A 43 -2.549 -0.809 -2.404 1.00 0.00 C ATOM 608 O TYR A 43 -2.639 -0.686 -1.182 1.00 0.00 O ATOM 609 CB TYR A 43 -1.916 0.953 -4.063 1.00 0.00 C ATOM 610 CG TYR A 43 -2.338 2.130 -4.913 1.00 0.00 C ATOM 611 CD1 TYR A 43 -2.415 3.409 -4.375 1.00 0.00 C ATOM 612 CD2 TYR A 43 -2.660 1.963 -6.255 1.00 0.00 C ATOM 613 CE1 TYR A 43 -2.800 4.487 -5.148 1.00 0.00 C ATOM 614 CE2 TYR A 43 -3.045 3.036 -7.035 1.00 0.00 C ATOM 615 CZ TYR A 43 -3.114 4.295 -6.478 1.00 0.00 C ATOM 616 OH TYR A 43 -3.498 5.366 -7.252 1.00 0.00 O ATOM 0 H TYR A 43 -3.550 1.427 -1.659 1.00 0.00 H new ATOM 0 HA TYR A 43 -3.728 -0.203 -4.081 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -1.190 1.291 -3.323 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -1.411 0.222 -4.694 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.170 3.563 -3.335 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -2.608 0.978 -6.695 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.855 5.474 -4.714 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -3.291 2.889 -8.076 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.683 5.060 -8.165 1.00 0.00 H new ATOM 626 N LYS A 44 -1.994 -1.868 -2.984 1.00 0.00 N ATOM 627 CA LYS A 44 -1.445 -2.970 -2.202 1.00 0.00 C ATOM 628 C LYS A 44 0.076 -3.012 -2.315 1.00 0.00 C ATOM 629 O LYS A 44 0.628 -2.964 -3.413 1.00 0.00 O ATOM 630 CB LYS A 44 -2.039 -4.300 -2.671 1.00 0.00 C ATOM 631 CG LYS A 44 -1.854 -5.432 -1.675 1.00 0.00 C ATOM 632 CD LYS A 44 -2.978 -6.450 -1.774 1.00 0.00 C ATOM 633 CE LYS A 44 -2.841 -7.313 -3.020 1.00 0.00 C ATOM 634 NZ LYS A 44 -4.104 -8.034 -3.336 1.00 0.00 N ATOM 0 H LYS A 44 -1.912 -1.987 -3.994 1.00 0.00 H new ATOM 0 HA LYS A 44 -1.710 -2.809 -1.157 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -3.104 -4.166 -2.863 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.578 -4.581 -3.618 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -0.899 -5.925 -1.856 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -1.817 -5.026 -0.664 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.974 -7.085 -0.888 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.938 -5.933 -1.792 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.559 -6.687 -3.866 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.037 -8.035 -2.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.970 -8.611 -4.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.360 -8.651 -2.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.866 -7.345 -3.499 1.00 0.00 H new ATOM 648 N GLY A 45 0.747 -3.104 -1.171 1.00 0.00 N ATOM 649 CA GLY A 45 2.198 -3.153 -1.164 1.00 0.00 C ATOM 650 C GLY A 45 2.811 -2.053 -0.321 1.00 0.00 C ATOM 651 O GLY A 45 2.250 -1.661 0.702 1.00 0.00 O ATOM 0 H GLY A 45 0.312 -3.145 -0.249 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.524 -4.122 -0.785 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.566 -3.071 -2.187 1.00 0.00 H new ATOM 655 N GLU A 46 3.966 -1.554 -0.751 1.00 0.00 N ATOM 656 CA GLU A 46 4.656 -0.494 -0.026 1.00 0.00 C ATOM 657 C GLU A 46 4.973 0.679 -0.949 1.00 0.00 C ATOM 658 O GLU A 46 5.917 1.433 -0.713 1.00 0.00 O ATOM 659 CB GLU A 46 5.947 -1.029 0.598 1.00 0.00 C ATOM 660 CG GLU A 46 5.713 -2.042 1.706 1.00 0.00 C ATOM 661 CD GLU A 46 6.877 -2.999 1.876 1.00 0.00 C ATOM 662 OE1 GLU A 46 7.318 -3.584 0.865 1.00 0.00 O ATOM 663 OE2 GLU A 46 7.347 -3.162 3.022 1.00 0.00 O ATOM 0 H GLU A 46 4.443 -1.867 -1.597 1.00 0.00 H new ATOM 0 HA GLU A 46 3.996 -0.142 0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.554 -1.490 -0.182 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.521 -0.193 0.997 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.540 -1.515 2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.809 -2.610 1.489 1.00 0.00 H new ATOM 670 N THR A 47 4.176 0.827 -2.003 1.00 0.00 N ATOM 671 CA THR A 47 4.371 1.906 -2.963 1.00 0.00 C ATOM 672 C THR A 47 3.182 2.021 -3.910 1.00 0.00 C ATOM 673 O THR A 47 2.307 1.156 -3.931 1.00 0.00 O ATOM 674 CB THR A 47 5.654 1.697 -3.790 1.00 0.00 C ATOM 675 OG1 THR A 47 5.487 2.248 -5.101 1.00 0.00 O ATOM 676 CG2 THR A 47 5.994 0.218 -3.896 1.00 0.00 C ATOM 0 H THR A 47 3.389 0.213 -2.213 1.00 0.00 H new ATOM 0 HA THR A 47 4.464 2.827 -2.388 1.00 0.00 H new ATOM 0 HB THR A 47 6.474 2.207 -3.284 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.307 2.113 -5.620 1.00 0.00 H new ATOM 0 HG21 THR A 47 6.903 0.095 -4.484 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.149 -0.192 -2.898 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.173 -0.310 -4.382 1.00 0.00 H new ATOM 684 N VAL A 48 3.158 3.094 -4.695 1.00 0.00 N ATOM 685 CA VAL A 48 2.077 3.320 -5.646 1.00 0.00 C ATOM 686 C VAL A 48 2.119 2.301 -6.779 1.00 0.00 C ATOM 687 O VAL A 48 2.925 2.416 -7.702 1.00 0.00 O ATOM 688 CB VAL A 48 2.144 4.738 -6.244 1.00 0.00 C ATOM 689 CG1 VAL A 48 1.018 4.950 -7.245 1.00 0.00 C ATOM 690 CG2 VAL A 48 2.090 5.784 -5.141 1.00 0.00 C ATOM 0 H VAL A 48 3.875 3.820 -4.691 1.00 0.00 H new ATOM 0 HA VAL A 48 1.143 3.208 -5.096 1.00 0.00 H new ATOM 0 HB VAL A 48 3.092 4.846 -6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.082 5.957 -7.657 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.106 4.222 -8.052 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.058 4.823 -6.745 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.138 6.780 -5.581 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.159 5.678 -4.584 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.934 5.644 -4.466 1.00 0.00 H new ATOM 700 N ASP A 49 1.245 1.303 -6.702 1.00 0.00 N ATOM 701 CA ASP A 49 1.180 0.263 -7.722 1.00 0.00 C ATOM 702 C ASP A 49 -0.188 0.247 -8.396 1.00 0.00 C ATOM 703 O ASP A 49 -1.163 -0.250 -7.832 1.00 0.00 O ATOM 704 CB ASP A 49 1.475 -1.105 -7.104 1.00 0.00 C ATOM 705 CG ASP A 49 2.961 -1.394 -7.017 1.00 0.00 C ATOM 706 OD1 ASP A 49 3.683 -1.087 -7.989 1.00 0.00 O ATOM 707 OD2 ASP A 49 3.401 -1.924 -5.977 1.00 0.00 O ATOM 0 H ASP A 49 0.572 1.192 -5.944 1.00 0.00 H new ATOM 0 HA ASP A 49 1.934 0.482 -8.478 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.040 -1.151 -6.106 1.00 0.00 H new ATOM 0 HB3 ASP A 49 0.991 -1.880 -7.698 1.00 0.00 H new ATOM 712 N ALA A 50 -0.253 0.795 -9.605 1.00 0.00 N ATOM 713 CA ALA A 50 -1.501 0.842 -10.356 1.00 0.00 C ATOM 714 C ALA A 50 -2.047 -0.560 -10.603 1.00 0.00 C ATOM 715 O ALA A 50 -3.257 -0.781 -10.560 1.00 0.00 O ATOM 716 CB ALA A 50 -1.295 1.571 -11.676 1.00 0.00 C ATOM 0 H ALA A 50 0.544 1.213 -10.085 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.233 1.388 -9.762 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.235 1.599 -12.227 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.959 2.589 -11.481 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.543 1.048 -12.267 1.00 0.00 H new ATOM 722 N ASN A 51 -1.148 -1.503 -10.861 1.00 0.00 N ATOM 723 CA ASN A 51 -1.540 -2.884 -11.116 1.00 0.00 C ATOM 724 C ASN A 51 -2.163 -3.512 -9.873 1.00 0.00 C ATOM 725 O ASN A 51 -2.937 -4.464 -9.967 1.00 0.00 O ATOM 726 CB ASN A 51 -0.330 -3.706 -11.565 1.00 0.00 C ATOM 727 CG ASN A 51 0.547 -2.955 -12.548 1.00 0.00 C ATOM 728 OD1 ASN A 51 1.128 -1.922 -12.216 1.00 0.00 O ATOM 729 ND2 ASN A 51 0.645 -3.472 -13.767 1.00 0.00 N ATOM 0 H ASN A 51 -0.142 -1.336 -10.899 1.00 0.00 H new ATOM 0 HA ASN A 51 -2.285 -2.882 -11.912 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.262 -3.983 -10.692 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -0.674 -4.633 -12.024 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.220 -3.010 -14.472 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.146 -4.331 -13.998 1.00 0.00 H new ATOM 736 N ARG A 52 -1.819 -2.970 -8.709 1.00 0.00 N ATOM 737 CA ARG A 52 -2.343 -3.477 -7.446 1.00 0.00 C ATOM 738 C ARG A 52 -3.356 -2.504 -6.849 1.00 0.00 C ATOM 739 O ARG A 52 -3.690 -2.589 -5.667 1.00 0.00 O ATOM 740 CB ARG A 52 -1.203 -3.715 -6.455 1.00 0.00 C ATOM 741 CG ARG A 52 -0.152 -4.690 -6.958 1.00 0.00 C ATOM 742 CD ARG A 52 -0.630 -6.130 -6.848 1.00 0.00 C ATOM 743 NE ARG A 52 0.378 -7.078 -7.314 1.00 0.00 N ATOM 744 CZ ARG A 52 0.129 -8.363 -7.542 1.00 0.00 C ATOM 745 NH1 ARG A 52 -1.089 -8.850 -7.347 1.00 0.00 N ATOM 746 NH2 ARG A 52 1.099 -9.164 -7.965 1.00 0.00 N ATOM 0 H ARG A 52 -1.180 -2.180 -8.614 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.846 -4.423 -7.644 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.724 -2.762 -6.230 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -1.618 -4.092 -5.520 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.088 -4.464 -7.997 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.766 -4.565 -6.384 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.882 -6.350 -5.811 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.542 -6.255 -7.431 1.00 0.00 H new ATOM 0 HE ARG A 52 1.325 -6.735 -7.473 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.837 -8.238 -7.021 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.278 -9.837 -7.523 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.037 -8.793 -8.115 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.906 -10.150 -8.140 1.00 0.00 H new ATOM 760 N ARG A 53 -3.841 -1.582 -7.674 1.00 0.00 N ATOM 761 CA ARG A 53 -4.814 -0.593 -7.227 1.00 0.00 C ATOM 762 C ARG A 53 -6.039 -1.271 -6.620 1.00 0.00 C ATOM 763 O ARG A 53 -6.898 -1.781 -7.340 1.00 0.00 O ATOM 764 CB ARG A 53 -5.238 0.301 -8.394 1.00 0.00 C ATOM 765 CG ARG A 53 -6.294 1.328 -8.022 1.00 0.00 C ATOM 766 CD ARG A 53 -6.485 2.356 -9.127 1.00 0.00 C ATOM 767 NE ARG A 53 -7.263 1.822 -10.242 1.00 0.00 N ATOM 768 CZ ARG A 53 -7.269 2.360 -11.457 1.00 0.00 C ATOM 769 NH1 ARG A 53 -6.543 3.439 -11.712 1.00 0.00 N ATOM 770 NH2 ARG A 53 -8.003 1.816 -12.420 1.00 0.00 N ATOM 0 H ARG A 53 -3.576 -1.499 -8.655 1.00 0.00 H new ATOM 0 HA ARG A 53 -4.343 0.022 -6.460 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -4.361 0.819 -8.781 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -5.620 -0.325 -9.200 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -7.240 0.824 -7.825 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -6.004 1.832 -7.100 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.987 3.234 -8.722 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -5.511 2.685 -9.489 1.00 0.00 H new ATOM 0 HE ARG A 53 -7.832 0.991 -10.079 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.977 3.859 -10.974 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -6.550 3.849 -12.646 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.562 0.985 -12.227 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.008 2.229 -13.353 1.00 0.00 H new ATOM 784 N ILE A 54 -6.113 -1.272 -5.294 1.00 0.00 N ATOM 785 CA ILE A 54 -7.233 -1.886 -4.592 1.00 0.00 C ATOM 786 C ILE A 54 -8.551 -1.223 -4.974 1.00 0.00 C ATOM 787 O ILE A 54 -9.504 -1.896 -5.370 1.00 0.00 O ATOM 788 CB ILE A 54 -7.053 -1.803 -3.064 1.00 0.00 C ATOM 789 CG1 ILE A 54 -5.738 -2.465 -2.647 1.00 0.00 C ATOM 790 CG2 ILE A 54 -8.230 -2.458 -2.356 1.00 0.00 C ATOM 791 CD1 ILE A 54 -5.136 -1.873 -1.391 1.00 0.00 C ATOM 0 H ILE A 54 -5.410 -0.854 -4.684 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.257 -2.934 -4.891 1.00 0.00 H new ATOM 0 HB ILE A 54 -7.018 -0.753 -2.773 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.910 -3.530 -2.491 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -5.020 -2.374 -3.462 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.089 -2.392 -1.277 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -9.152 -1.947 -2.633 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.294 -3.506 -2.650 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.206 -2.390 -1.154 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -4.932 -0.814 -1.549 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.836 -1.988 -0.563 1.00 0.00 H new ATOM 803 N ILE A 55 -8.599 0.099 -4.855 1.00 0.00 N ATOM 804 CA ILE A 55 -9.800 0.853 -5.191 1.00 0.00 C ATOM 805 C ILE A 55 -9.519 2.352 -5.218 1.00 0.00 C ATOM 806 O ILE A 55 -8.697 2.854 -4.453 1.00 0.00 O ATOM 807 CB ILE A 55 -10.938 0.574 -4.191 1.00 0.00 C ATOM 808 CG1 ILE A 55 -12.273 1.065 -4.754 1.00 0.00 C ATOM 809 CG2 ILE A 55 -10.644 1.240 -2.855 1.00 0.00 C ATOM 810 CD1 ILE A 55 -13.466 0.281 -4.253 1.00 0.00 C ATOM 0 H ILE A 55 -7.820 0.670 -4.528 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.110 0.526 -6.183 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.006 -0.502 -4.032 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.403 2.115 -4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.242 1.008 -5.842 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -11.457 1.034 -2.159 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -9.711 0.847 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.553 2.317 -2.998 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -14.378 0.685 -4.694 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -13.359 -0.766 -4.537 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -13.523 0.359 -3.167 1.00 0.00 H new ATOM 822 N GLY A 56 -10.209 3.062 -6.106 1.00 0.00 N ATOM 823 CA GLY A 56 -10.021 4.497 -6.215 1.00 0.00 C ATOM 824 C GLY A 56 -11.333 5.246 -6.335 1.00 0.00 C ATOM 825 O GLY A 56 -12.200 4.872 -7.124 1.00 0.00 O ATOM 0 H GLY A 56 -10.894 2.669 -6.751 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.479 4.857 -5.340 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.401 4.714 -7.085 1.00 0.00 H new ATOM 829 N TYR A 57 -11.480 6.306 -5.548 1.00 0.00 N ATOM 830 CA TYR A 57 -12.698 7.108 -5.565 1.00 0.00 C ATOM 831 C TYR A 57 -12.377 8.582 -5.792 1.00 0.00 C ATOM 832 O TYR A 57 -11.392 9.102 -5.268 1.00 0.00 O ATOM 833 CB TYR A 57 -13.465 6.937 -4.253 1.00 0.00 C ATOM 834 CG TYR A 57 -14.605 7.917 -4.086 1.00 0.00 C ATOM 835 CD1 TYR A 57 -15.692 7.902 -4.951 1.00 0.00 C ATOM 836 CD2 TYR A 57 -14.594 8.858 -3.064 1.00 0.00 C ATOM 837 CE1 TYR A 57 -16.735 8.795 -4.803 1.00 0.00 C ATOM 838 CE2 TYR A 57 -15.634 9.754 -2.907 1.00 0.00 C ATOM 839 CZ TYR A 57 -16.702 9.719 -3.779 1.00 0.00 C ATOM 840 OH TYR A 57 -17.738 10.611 -3.628 1.00 0.00 O ATOM 0 H TYR A 57 -10.771 6.630 -4.890 1.00 0.00 H new ATOM 0 HA TYR A 57 -13.320 6.760 -6.389 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -13.859 5.922 -4.202 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -12.772 7.053 -3.419 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -15.722 7.179 -5.753 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.758 8.890 -2.381 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -17.572 8.770 -5.485 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -15.611 10.478 -2.106 1.00 0.00 H new ATOM 0 HH TYR A 57 -17.560 11.192 -2.859 1.00 0.00 H new ATOM 850 N VAL A 58 -13.216 9.250 -6.577 1.00 0.00 N ATOM 851 CA VAL A 58 -13.024 10.664 -6.873 1.00 0.00 C ATOM 852 C VAL A 58 -14.184 11.499 -6.341 1.00 0.00 C ATOM 853 O VAL A 58 -15.321 11.357 -6.790 1.00 0.00 O ATOM 854 CB VAL A 58 -12.884 10.907 -8.387 1.00 0.00 C ATOM 855 CG1 VAL A 58 -12.467 12.344 -8.662 1.00 0.00 C ATOM 856 CG2 VAL A 58 -11.888 9.929 -8.993 1.00 0.00 C ATOM 0 H VAL A 58 -14.036 8.834 -7.019 1.00 0.00 H new ATOM 0 HA VAL A 58 -12.102 10.969 -6.377 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.854 10.740 -8.855 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -12.373 12.496 -9.737 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.220 13.024 -8.264 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.509 12.543 -8.183 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -11.801 10.115 -10.064 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -10.914 10.062 -8.521 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.234 8.909 -8.829 1.00 0.00 H new ATOM 866 N ILE A 59 -13.887 12.371 -5.383 1.00 0.00 N ATOM 867 CA ILE A 59 -14.905 13.230 -4.791 1.00 0.00 C ATOM 868 C ILE A 59 -15.422 14.247 -5.802 1.00 0.00 C ATOM 869 O ILE A 59 -16.571 14.682 -5.728 1.00 0.00 O ATOM 870 CB ILE A 59 -14.362 13.979 -3.559 1.00 0.00 C ATOM 871 CG1 ILE A 59 -13.907 12.984 -2.490 1.00 0.00 C ATOM 872 CG2 ILE A 59 -15.422 14.917 -3.001 1.00 0.00 C ATOM 873 CD1 ILE A 59 -12.805 13.515 -1.600 1.00 0.00 C ATOM 0 H ILE A 59 -12.950 12.501 -5.001 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.724 12.581 -4.481 1.00 0.00 H new ATOM 0 HB ILE A 59 -13.501 14.575 -3.864 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -14.762 12.711 -1.872 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -13.562 12.072 -2.977 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -15.024 15.439 -2.131 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -15.703 15.644 -3.763 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -16.300 14.341 -2.708 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -12.533 12.756 -0.866 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -11.934 13.762 -2.207 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -13.153 14.410 -1.085 1.00 0.00 H new ATOM 885 N SER A 60 -14.567 14.619 -6.749 1.00 0.00 N ATOM 886 CA SER A 60 -14.937 15.586 -7.776 1.00 0.00 C ATOM 887 C SER A 60 -16.188 15.133 -8.524 1.00 0.00 C ATOM 888 O SER A 60 -17.131 15.903 -8.700 1.00 0.00 O ATOM 889 CB SER A 60 -13.783 15.782 -8.761 1.00 0.00 C ATOM 890 OG SER A 60 -13.833 14.822 -9.802 1.00 0.00 O ATOM 0 H SER A 60 -13.613 14.266 -6.827 1.00 0.00 H new ATOM 0 HA SER A 60 -15.152 16.535 -7.286 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.829 16.785 -9.185 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.833 15.702 -8.233 1.00 0.00 H new ATOM 0 HG SER A 60 -13.086 14.969 -10.419 1.00 0.00 H new ATOM 896 N ASN A 61 -16.186 13.878 -8.961 1.00 0.00 N ATOM 897 CA ASN A 61 -17.320 13.322 -9.690 1.00 0.00 C ATOM 898 C ASN A 61 -17.904 12.120 -8.953 1.00 0.00 C ATOM 899 O ASN A 61 -18.650 11.330 -9.530 1.00 0.00 O ATOM 900 CB ASN A 61 -16.893 12.911 -11.101 1.00 0.00 C ATOM 901 CG ASN A 61 -15.441 12.479 -11.163 1.00 0.00 C ATOM 902 OD1 ASN A 61 -14.578 13.228 -11.622 1.00 0.00 O ATOM 903 ND2 ASN A 61 -15.164 11.266 -10.700 1.00 0.00 N ATOM 0 H ASN A 61 -15.413 13.227 -8.823 1.00 0.00 H new ATOM 0 HA ASN A 61 -18.089 14.092 -9.759 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -17.527 12.094 -11.446 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -17.050 13.747 -11.783 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.204 10.921 -10.716 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -15.911 10.679 -10.328 1.00 0.00 H new ATOM 910 N GLN A 62 -17.559 11.992 -7.676 1.00 0.00 N ATOM 911 CA GLN A 62 -18.049 10.887 -6.860 1.00 0.00 C ATOM 912 C GLN A 62 -18.110 9.597 -7.671 1.00 0.00 C ATOM 913 O GLN A 62 -19.119 8.893 -7.659 1.00 0.00 O ATOM 914 CB GLN A 62 -19.433 11.216 -6.298 1.00 0.00 C ATOM 915 CG GLN A 62 -19.438 12.404 -5.350 1.00 0.00 C ATOM 916 CD GLN A 62 -20.603 12.371 -4.380 1.00 0.00 C ATOM 917 OE1 GLN A 62 -21.098 11.302 -4.022 1.00 0.00 O ATOM 918 NE2 GLN A 62 -21.048 13.546 -3.948 1.00 0.00 N ATOM 0 H GLN A 62 -16.943 12.639 -7.184 1.00 0.00 H new ATOM 0 HA GLN A 62 -17.354 10.742 -6.033 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -20.113 11.419 -7.125 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -19.820 10.342 -5.774 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -18.503 12.421 -4.789 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -19.478 13.326 -5.929 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -20.608 14.408 -4.271 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -21.829 13.586 -3.294 1.00 0.00 H new ATOM 927 N GLN A 63 -17.024 9.294 -8.375 1.00 0.00 N ATOM 928 CA GLN A 63 -16.955 8.089 -9.193 1.00 0.00 C ATOM 929 C GLN A 63 -16.073 7.034 -8.534 1.00 0.00 C ATOM 930 O GLN A 63 -15.013 7.348 -7.992 1.00 0.00 O ATOM 931 CB GLN A 63 -16.418 8.422 -10.586 1.00 0.00 C ATOM 932 CG GLN A 63 -16.529 7.271 -11.572 1.00 0.00 C ATOM 933 CD GLN A 63 -15.884 7.583 -12.908 1.00 0.00 C ATOM 934 OE1 GLN A 63 -16.070 8.667 -13.462 1.00 0.00 O ATOM 935 NE2 GLN A 63 -15.121 6.632 -13.434 1.00 0.00 N ATOM 0 H GLN A 63 -16.180 9.866 -8.395 1.00 0.00 H new ATOM 0 HA GLN A 63 -17.963 7.686 -9.287 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -16.962 9.281 -10.980 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -15.372 8.718 -10.502 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -16.060 6.385 -11.144 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -17.581 7.031 -11.728 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -14.994 5.748 -12.940 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.662 6.785 -14.332 1.00 0.00 H new ATOM 944 N ILE A 64 -16.519 5.783 -8.583 1.00 0.00 N ATOM 945 CA ILE A 64 -15.769 4.682 -7.991 1.00 0.00 C ATOM 946 C ILE A 64 -15.315 3.690 -9.057 1.00 0.00 C ATOM 947 O ILE A 64 -16.112 3.237 -9.880 1.00 0.00 O ATOM 948 CB ILE A 64 -16.606 3.935 -6.935 1.00 0.00 C ATOM 949 CG1 ILE A 64 -17.038 4.895 -5.824 1.00 0.00 C ATOM 950 CG2 ILE A 64 -15.813 2.772 -6.358 1.00 0.00 C ATOM 951 CD1 ILE A 64 -17.982 4.271 -4.821 1.00 0.00 C ATOM 0 H ILE A 64 -17.395 5.507 -9.026 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.895 5.119 -7.508 1.00 0.00 H new ATOM 0 HB ILE A 64 -17.500 3.538 -7.415 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -16.152 5.256 -5.302 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -17.520 5.764 -6.272 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -16.417 2.254 -5.613 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -15.549 2.079 -7.157 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -14.904 3.149 -5.889 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -18.246 5.008 -4.063 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -18.885 3.935 -5.331 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -17.496 3.419 -4.345 1.00 0.00 H new ATOM 963 N THR A 65 -14.029 3.355 -9.036 1.00 0.00 N ATOM 964 CA THR A 65 -13.468 2.417 -10.000 1.00 0.00 C ATOM 965 C THR A 65 -12.588 1.380 -9.310 1.00 0.00 C ATOM 966 O THR A 65 -11.417 1.621 -9.016 1.00 0.00 O ATOM 967 CB THR A 65 -12.638 3.144 -11.074 1.00 0.00 C ATOM 968 OG1 THR A 65 -13.376 4.256 -11.593 1.00 0.00 O ATOM 969 CG2 THR A 65 -12.273 2.198 -12.208 1.00 0.00 C ATOM 0 H THR A 65 -13.356 3.720 -8.362 1.00 0.00 H new ATOM 0 HA THR A 65 -14.309 1.916 -10.479 1.00 0.00 H new ATOM 0 HB THR A 65 -11.719 3.502 -10.611 1.00 0.00 H new ATOM 0 HG1 THR A 65 -12.841 4.714 -12.274 1.00 0.00 H new ATOM 0 HG21 THR A 65 -11.687 2.734 -12.955 1.00 0.00 H new ATOM 0 HG22 THR A 65 -11.687 1.367 -11.815 1.00 0.00 H new ATOM 0 HG23 THR A 65 -13.183 1.814 -12.669 1.00 0.00 H new ATOM 977 N PRO A 66 -13.163 0.198 -9.044 1.00 0.00 N ATOM 978 CA PRO A 66 -12.447 -0.900 -8.386 1.00 0.00 C ATOM 979 C PRO A 66 -11.375 -1.511 -9.281 1.00 0.00 C ATOM 980 O PRO A 66 -11.591 -1.716 -10.475 1.00 0.00 O ATOM 981 CB PRO A 66 -13.551 -1.921 -8.100 1.00 0.00 C ATOM 982 CG PRO A 66 -14.600 -1.642 -9.121 1.00 0.00 C ATOM 983 CD PRO A 66 -14.555 -0.159 -9.366 1.00 0.00 C ATOM 0 HA PRO A 66 -11.916 -0.565 -7.495 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.178 -2.942 -8.185 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.943 -1.808 -7.089 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -14.407 -2.195 -10.040 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -15.583 -1.949 -8.764 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.804 0.085 -10.399 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -15.264 0.375 -8.732 1.00 0.00 H new ATOM 991 N GLY A 67 -10.217 -1.801 -8.696 1.00 0.00 N ATOM 992 CA GLY A 67 -9.128 -2.387 -9.456 1.00 0.00 C ATOM 993 C GLY A 67 -9.069 -3.895 -9.316 1.00 0.00 C ATOM 994 O GLY A 67 -9.993 -4.529 -8.805 1.00 0.00 O ATOM 0 H GLY A 67 -10.013 -1.641 -7.709 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -9.242 -2.127 -10.508 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -8.184 -1.957 -9.122 1.00 0.00 H new ATOM 998 N PRO A 68 -7.962 -4.494 -9.781 1.00 0.00 N ATOM 999 CA PRO A 68 -7.761 -5.945 -9.718 1.00 0.00 C ATOM 1000 C PRO A 68 -7.548 -6.439 -8.291 1.00 0.00 C ATOM 1001 O PRO A 68 -7.937 -7.554 -7.946 1.00 0.00 O ATOM 1002 CB PRO A 68 -6.498 -6.164 -10.554 1.00 0.00 C ATOM 1003 CG PRO A 68 -5.766 -4.868 -10.482 1.00 0.00 C ATOM 1004 CD PRO A 68 -6.822 -3.801 -10.402 1.00 0.00 C ATOM 0 HA PRO A 68 -8.630 -6.494 -10.082 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.896 -6.981 -10.156 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -6.745 -6.423 -11.584 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.113 -4.837 -9.610 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -5.134 -4.727 -11.359 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -6.492 -2.953 -9.802 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -7.077 -3.413 -11.388 1.00 0.00 H new ATOM 1012 N ALA A 69 -6.929 -5.601 -7.466 1.00 0.00 N ATOM 1013 CA ALA A 69 -6.667 -5.953 -6.075 1.00 0.00 C ATOM 1014 C ALA A 69 -7.888 -5.685 -5.202 1.00 0.00 C ATOM 1015 O ALA A 69 -7.759 -5.301 -4.039 1.00 0.00 O ATOM 1016 CB ALA A 69 -5.463 -5.182 -5.554 1.00 0.00 C ATOM 0 H ALA A 69 -6.600 -4.674 -7.736 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.448 -7.020 -6.030 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.279 -5.454 -4.515 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.587 -5.427 -6.154 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -5.660 -4.112 -5.619 1.00 0.00 H new ATOM 1022 N TYR A 70 -9.071 -5.888 -5.769 1.00 0.00 N ATOM 1023 CA TYR A 70 -10.316 -5.665 -5.043 1.00 0.00 C ATOM 1024 C TYR A 70 -10.973 -6.990 -4.668 1.00 0.00 C ATOM 1025 O TYR A 70 -11.044 -7.912 -5.481 1.00 0.00 O ATOM 1026 CB TYR A 70 -11.278 -4.826 -5.884 1.00 0.00 C ATOM 1027 CG TYR A 70 -12.458 -4.292 -5.103 1.00 0.00 C ATOM 1028 CD1 TYR A 70 -12.277 -3.661 -3.878 1.00 0.00 C ATOM 1029 CD2 TYR A 70 -13.753 -4.419 -5.590 1.00 0.00 C ATOM 1030 CE1 TYR A 70 -13.352 -3.173 -3.161 1.00 0.00 C ATOM 1031 CE2 TYR A 70 -14.834 -3.932 -4.880 1.00 0.00 C ATOM 1032 CZ TYR A 70 -14.629 -3.311 -3.666 1.00 0.00 C ATOM 1033 OH TYR A 70 -15.702 -2.824 -2.955 1.00 0.00 O ATOM 0 H TYR A 70 -9.195 -6.207 -6.730 1.00 0.00 H new ATOM 0 HA TYR A 70 -10.080 -5.125 -4.126 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.732 -3.989 -6.319 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -11.645 -5.431 -6.713 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -11.279 -3.550 -3.480 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -13.918 -4.907 -6.540 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -13.194 -2.686 -2.210 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -15.834 -4.037 -5.274 1.00 0.00 H new ATOM 0 HH TYR A 70 -15.392 -2.472 -2.095 1.00 0.00 H new ATOM 1043 N SER A 71 -11.452 -7.077 -3.431 1.00 0.00 N ATOM 1044 CA SER A 71 -12.101 -8.289 -2.946 1.00 0.00 C ATOM 1045 C SER A 71 -13.518 -7.991 -2.465 1.00 0.00 C ATOM 1046 O SER A 71 -14.070 -8.718 -1.640 1.00 0.00 O ATOM 1047 CB SER A 71 -11.285 -8.911 -1.811 1.00 0.00 C ATOM 1048 OG SER A 71 -10.207 -9.678 -2.319 1.00 0.00 O ATOM 0 H SER A 71 -11.403 -6.322 -2.747 1.00 0.00 H new ATOM 0 HA SER A 71 -12.158 -8.997 -3.773 1.00 0.00 H new ATOM 0 HB2 SER A 71 -10.901 -8.124 -1.161 1.00 0.00 H new ATOM 0 HB3 SER A 71 -11.929 -9.543 -1.200 1.00 0.00 H new ATOM 0 HG SER A 71 -9.700 -10.063 -1.574 1.00 0.00 H new ATOM 1054 N ASN A 72 -14.100 -6.916 -2.987 1.00 0.00 N ATOM 1055 CA ASN A 72 -15.452 -6.521 -2.610 1.00 0.00 C ATOM 1056 C ASN A 72 -15.623 -6.540 -1.094 1.00 0.00 C ATOM 1057 O ASN A 72 -16.718 -6.780 -0.586 1.00 0.00 O ATOM 1058 CB ASN A 72 -16.478 -7.451 -3.262 1.00 0.00 C ATOM 1059 CG ASN A 72 -16.327 -8.889 -2.805 1.00 0.00 C ATOM 1060 OD1 ASN A 72 -16.804 -9.265 -1.734 1.00 0.00 O ATOM 1061 ND2 ASN A 72 -15.661 -9.701 -3.617 1.00 0.00 N ATOM 0 H ASN A 72 -13.657 -6.303 -3.672 1.00 0.00 H new ATOM 0 HA ASN A 72 -15.617 -5.503 -2.963 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -17.483 -7.101 -3.026 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.370 -7.404 -4.346 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -15.528 -10.680 -3.363 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -15.283 -9.346 -4.495 1.00 0.00 H new ATOM 1068 N ARG A 73 -14.532 -6.286 -0.378 1.00 0.00 N ATOM 1069 CA ARG A 73 -14.560 -6.274 1.079 1.00 0.00 C ATOM 1070 C ARG A 73 -14.086 -4.929 1.622 1.00 0.00 C ATOM 1071 O ARG A 73 -14.428 -4.545 2.740 1.00 0.00 O ATOM 1072 CB ARG A 73 -13.685 -7.398 1.636 1.00 0.00 C ATOM 1073 CG ARG A 73 -12.422 -7.645 0.827 1.00 0.00 C ATOM 1074 CD ARG A 73 -11.687 -8.887 1.306 1.00 0.00 C ATOM 1075 NE ARG A 73 -10.245 -8.784 1.099 1.00 0.00 N ATOM 1076 CZ ARG A 73 -9.424 -9.828 1.113 1.00 0.00 C ATOM 1077 NH1 ARG A 73 -9.900 -11.047 1.322 1.00 0.00 N ATOM 1078 NH2 ARG A 73 -8.124 -9.653 0.916 1.00 0.00 N ATOM 0 H ARG A 73 -13.618 -6.086 -0.784 1.00 0.00 H new ATOM 0 HA ARG A 73 -15.590 -6.432 1.399 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -13.408 -7.156 2.662 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.269 -8.318 1.672 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -12.679 -7.757 -0.226 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -11.764 -6.779 0.904 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.891 -9.043 2.365 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -12.068 -9.760 0.776 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.846 -7.860 0.935 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.899 -11.185 1.473 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.267 -11.847 1.332 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.754 -8.716 0.754 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.494 -10.455 0.927 1.00 0.00 H new ATOM 1092 N GLU A 74 -13.296 -4.219 0.822 1.00 0.00 N ATOM 1093 CA GLU A 74 -12.775 -2.918 1.223 1.00 0.00 C ATOM 1094 C GLU A 74 -13.676 -1.793 0.723 1.00 0.00 C ATOM 1095 O GLU A 74 -14.128 -1.806 -0.422 1.00 0.00 O ATOM 1096 CB GLU A 74 -11.355 -2.726 0.687 1.00 0.00 C ATOM 1097 CG GLU A 74 -10.381 -3.799 1.143 1.00 0.00 C ATOM 1098 CD GLU A 74 -9.280 -4.057 0.132 1.00 0.00 C ATOM 1099 OE1 GLU A 74 -9.601 -4.468 -1.002 1.00 0.00 O ATOM 1100 OE2 GLU A 74 -8.098 -3.847 0.476 1.00 0.00 O ATOM 0 H GLU A 74 -13.003 -4.523 -0.107 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.752 -2.884 2.312 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.386 -2.715 -0.403 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.984 -1.752 1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.935 -3.500 2.092 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.926 -4.725 1.325 1.00 0.00 H new ATOM 1107 N THR A 75 -13.934 -0.819 1.591 1.00 0.00 N ATOM 1108 CA THR A 75 -14.782 0.313 1.240 1.00 0.00 C ATOM 1109 C THR A 75 -14.098 1.635 1.569 1.00 0.00 C ATOM 1110 O THR A 75 -13.616 1.835 2.684 1.00 0.00 O ATOM 1111 CB THR A 75 -16.134 0.251 1.975 1.00 0.00 C ATOM 1112 OG1 THR A 75 -16.841 -0.937 1.601 1.00 0.00 O ATOM 1113 CG2 THR A 75 -16.981 1.473 1.653 1.00 0.00 C ATOM 0 H THR A 75 -13.567 -0.792 2.542 1.00 0.00 H new ATOM 0 HA THR A 75 -14.958 0.255 0.166 1.00 0.00 H new ATOM 0 HB THR A 75 -15.939 0.235 3.047 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.699 -0.970 2.074 1.00 0.00 H new ATOM 0 HG21 THR A 75 -17.931 1.407 2.183 1.00 0.00 H new ATOM 0 HG22 THR A 75 -16.453 2.374 1.965 1.00 0.00 H new ATOM 0 HG23 THR A 75 -17.167 1.514 0.580 1.00 0.00 H new ATOM 1121 N ILE A 76 -14.059 2.534 0.591 1.00 0.00 N ATOM 1122 CA ILE A 76 -13.435 3.838 0.779 1.00 0.00 C ATOM 1123 C ILE A 76 -14.297 4.739 1.657 1.00 0.00 C ATOM 1124 O ILE A 76 -15.475 4.461 1.883 1.00 0.00 O ATOM 1125 CB ILE A 76 -13.185 4.541 -0.569 1.00 0.00 C ATOM 1126 CG1 ILE A 76 -13.005 3.508 -1.682 1.00 0.00 C ATOM 1127 CG2 ILE A 76 -11.964 5.445 -0.476 1.00 0.00 C ATOM 1128 CD1 ILE A 76 -14.292 3.159 -2.396 1.00 0.00 C ATOM 0 H ILE A 76 -14.452 2.384 -0.338 1.00 0.00 H new ATOM 0 HA ILE A 76 -12.479 3.662 1.272 1.00 0.00 H new ATOM 0 HB ILE A 76 -14.052 5.157 -0.807 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.288 3.890 -2.409 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.576 2.600 -1.258 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.800 5.935 -1.436 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -12.128 6.200 0.293 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.089 4.849 -0.219 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -14.089 2.421 -3.172 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -15.004 2.747 -1.681 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -14.711 4.057 -2.850 1.00 0.00 H new ATOM 1140 N TYR A 77 -13.702 5.820 2.148 1.00 0.00 N ATOM 1141 CA TYR A 77 -14.415 6.763 3.003 1.00 0.00 C ATOM 1142 C TYR A 77 -14.158 8.200 2.562 1.00 0.00 C ATOM 1143 O TYR A 77 -13.202 8.495 1.844 1.00 0.00 O ATOM 1144 CB TYR A 77 -13.993 6.582 4.462 1.00 0.00 C ATOM 1145 CG TYR A 77 -14.822 5.563 5.211 1.00 0.00 C ATOM 1146 CD1 TYR A 77 -14.710 4.207 4.933 1.00 0.00 C ATOM 1147 CD2 TYR A 77 -15.718 5.958 6.196 1.00 0.00 C ATOM 1148 CE1 TYR A 77 -15.466 3.273 5.614 1.00 0.00 C ATOM 1149 CE2 TYR A 77 -16.478 5.032 6.884 1.00 0.00 C ATOM 1150 CZ TYR A 77 -16.349 3.690 6.589 1.00 0.00 C ATOM 1151 OH TYR A 77 -17.103 2.763 7.271 1.00 0.00 O ATOM 0 H TYR A 77 -12.728 6.066 1.969 1.00 0.00 H new ATOM 0 HA TYR A 77 -15.482 6.560 2.913 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -12.946 6.280 4.494 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -14.064 7.542 4.973 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -14.020 3.877 4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -15.822 7.008 6.428 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -15.367 2.222 5.385 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -17.169 5.356 7.648 1.00 0.00 H new ATOM 0 HH TYR A 77 -17.673 3.221 7.924 1.00 0.00 H new ATOM 1161 N PRO A 78 -15.031 9.118 3.001 1.00 0.00 N ATOM 1162 CA PRO A 78 -14.920 10.541 2.666 1.00 0.00 C ATOM 1163 C PRO A 78 -13.729 11.206 3.348 1.00 0.00 C ATOM 1164 O PRO A 78 -13.517 12.410 3.211 1.00 0.00 O ATOM 1165 CB PRO A 78 -16.233 11.132 3.187 1.00 0.00 C ATOM 1166 CG PRO A 78 -16.659 10.207 4.274 1.00 0.00 C ATOM 1167 CD PRO A 78 -16.195 8.838 3.860 1.00 0.00 C ATOM 0 HA PRO A 78 -14.760 10.697 1.599 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -16.090 12.145 3.563 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -16.983 11.188 2.398 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -16.218 10.496 5.228 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -17.741 10.229 4.404 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -15.922 8.229 4.721 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -16.972 8.296 3.320 1.00 0.00 H new ATOM 1175 N ASN A 79 -12.955 10.413 4.081 1.00 0.00 N ATOM 1176 CA ASN A 79 -11.784 10.926 4.784 1.00 0.00 C ATOM 1177 C ASN A 79 -10.514 10.229 4.305 1.00 0.00 C ATOM 1178 O ASN A 79 -9.463 10.330 4.937 1.00 0.00 O ATOM 1179 CB ASN A 79 -11.946 10.735 6.293 1.00 0.00 C ATOM 1180 CG ASN A 79 -12.675 11.892 6.948 1.00 0.00 C ATOM 1181 OD1 ASN A 79 -13.594 12.469 6.367 1.00 0.00 O ATOM 1182 ND2 ASN A 79 -12.266 12.237 8.163 1.00 0.00 N ATOM 0 H ASN A 79 -13.117 9.413 4.204 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.697 11.991 4.566 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -12.492 9.811 6.483 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.963 10.624 6.750 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.718 13.009 8.653 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.500 11.730 8.606 1.00 0.00 H new ATOM 1189 N ALA A 80 -10.619 9.524 3.183 1.00 0.00 N ATOM 1190 CA ALA A 80 -9.479 8.813 2.618 1.00 0.00 C ATOM 1191 C ALA A 80 -9.169 7.550 3.414 1.00 0.00 C ATOM 1192 O ALA A 80 -8.025 7.101 3.464 1.00 0.00 O ATOM 1193 CB ALA A 80 -8.260 9.723 2.573 1.00 0.00 C ATOM 0 H ALA A 80 -11.482 9.430 2.648 1.00 0.00 H new ATOM 0 HA ALA A 80 -9.736 8.516 1.601 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.416 9.180 2.149 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.479 10.594 1.955 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.011 10.049 3.583 1.00 0.00 H new ATOM 1199 N SER A 81 -10.197 6.982 4.037 1.00 0.00 N ATOM 1200 CA SER A 81 -10.034 5.773 4.836 1.00 0.00 C ATOM 1201 C SER A 81 -10.610 4.561 4.110 1.00 0.00 C ATOM 1202 O SER A 81 -11.535 4.686 3.306 1.00 0.00 O ATOM 1203 CB SER A 81 -10.714 5.938 6.196 1.00 0.00 C ATOM 1204 OG SER A 81 -10.338 7.159 6.809 1.00 0.00 O ATOM 0 H SER A 81 -11.152 7.340 4.004 1.00 0.00 H new ATOM 0 HA SER A 81 -8.967 5.610 4.990 1.00 0.00 H new ATOM 0 HB2 SER A 81 -11.796 5.908 6.071 1.00 0.00 H new ATOM 0 HB3 SER A 81 -10.445 5.104 6.844 1.00 0.00 H new ATOM 0 HG SER A 81 -11.119 7.561 7.243 1.00 0.00 H new ATOM 1210 N LEU A 82 -10.057 3.388 4.399 1.00 0.00 N ATOM 1211 CA LEU A 82 -10.515 2.152 3.774 1.00 0.00 C ATOM 1212 C LEU A 82 -10.851 1.102 4.828 1.00 0.00 C ATOM 1213 O LEU A 82 -10.007 0.736 5.647 1.00 0.00 O ATOM 1214 CB LEU A 82 -9.446 1.612 2.822 1.00 0.00 C ATOM 1215 CG LEU A 82 -9.809 0.338 2.059 1.00 0.00 C ATOM 1216 CD1 LEU A 82 -10.506 0.680 0.751 1.00 0.00 C ATOM 1217 CD2 LEU A 82 -8.566 -0.501 1.800 1.00 0.00 C ATOM 0 H LEU A 82 -9.291 3.267 5.062 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.419 2.373 3.207 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.207 2.390 2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.539 1.422 3.396 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.496 -0.246 2.671 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.757 -0.239 0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.418 1.239 0.960 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.843 1.285 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.843 -1.404 1.256 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -7.855 0.075 1.208 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.108 -0.776 2.750 1.00 0.00 H new ATOM 1229 N LEU A 83 -12.088 0.619 4.801 1.00 0.00 N ATOM 1230 CA LEU A 83 -12.536 -0.392 5.753 1.00 0.00 C ATOM 1231 C LEU A 83 -12.425 -1.791 5.154 1.00 0.00 C ATOM 1232 O LEU A 83 -13.245 -2.190 4.328 1.00 0.00 O ATOM 1233 CB LEU A 83 -13.981 -0.119 6.175 1.00 0.00 C ATOM 1234 CG LEU A 83 -14.641 -1.191 7.042 1.00 0.00 C ATOM 1235 CD1 LEU A 83 -14.055 -1.179 8.445 1.00 0.00 C ATOM 1236 CD2 LEU A 83 -16.148 -0.985 7.089 1.00 0.00 C ATOM 0 H LEU A 83 -12.799 0.911 4.130 1.00 0.00 H new ATOM 0 HA LEU A 83 -11.892 -0.340 6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.007 0.826 6.718 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -14.582 0.013 5.275 1.00 0.00 H new ATOM 0 HG LEU A 83 -14.441 -2.165 6.596 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -14.537 -1.949 9.047 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -12.984 -1.376 8.394 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -14.223 -0.203 8.901 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -16.602 -1.757 7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -16.368 -0.004 7.510 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -16.555 -1.046 6.080 1.00 0.00 H new ATOM 1248 N MET A 84 -11.406 -2.531 5.579 1.00 0.00 N ATOM 1249 CA MET A 84 -11.190 -3.887 5.087 1.00 0.00 C ATOM 1250 C MET A 84 -12.073 -4.883 5.833 1.00 0.00 C ATOM 1251 O MET A 84 -12.195 -4.822 7.057 1.00 0.00 O ATOM 1252 CB MET A 84 -9.719 -4.279 5.237 1.00 0.00 C ATOM 1253 CG MET A 84 -9.252 -5.293 4.206 1.00 0.00 C ATOM 1254 SD MET A 84 -7.466 -5.262 3.961 1.00 0.00 S ATOM 1255 CE MET A 84 -7.231 -3.580 3.394 1.00 0.00 C ATOM 0 H MET A 84 -10.718 -2.215 6.262 1.00 0.00 H new ATOM 0 HA MET A 84 -11.458 -3.911 4.031 1.00 0.00 H new ATOM 0 HB2 MET A 84 -9.103 -3.383 5.158 1.00 0.00 H new ATOM 0 HB3 MET A 84 -9.561 -4.688 6.235 1.00 0.00 H new ATOM 0 HG2 MET A 84 -9.554 -6.292 4.521 1.00 0.00 H new ATOM 0 HG3 MET A 84 -9.749 -5.095 3.256 1.00 0.00 H new ATOM 0 HE1 MET A 84 -6.677 -3.587 2.455 1.00 0.00 H new ATOM 0 HE2 MET A 84 -8.202 -3.109 3.239 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.671 -3.019 4.142 1.00 0.00 H new ATOM 1265 N ARG A 85 -12.685 -5.798 5.089 1.00 0.00 N ATOM 1266 CA ARG A 85 -13.557 -6.805 5.680 1.00 0.00 C ATOM 1267 C ARG A 85 -13.050 -8.211 5.373 1.00 0.00 C ATOM 1268 O ARG A 85 -12.281 -8.413 4.434 1.00 0.00 O ATOM 1269 CB ARG A 85 -14.987 -6.642 5.161 1.00 0.00 C ATOM 1270 CG ARG A 85 -15.657 -5.356 5.617 1.00 0.00 C ATOM 1271 CD ARG A 85 -17.167 -5.515 5.700 1.00 0.00 C ATOM 1272 NE ARG A 85 -17.559 -6.518 6.686 1.00 0.00 N ATOM 1273 CZ ARG A 85 -18.799 -6.656 7.142 1.00 0.00 C ATOM 1274 NH1 ARG A 85 -19.763 -5.859 6.703 1.00 0.00 N ATOM 1275 NH2 ARG A 85 -19.077 -7.593 8.039 1.00 0.00 N ATOM 0 H ARG A 85 -12.593 -5.863 4.075 1.00 0.00 H new ATOM 0 HA ARG A 85 -13.552 -6.663 6.761 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -14.974 -6.669 4.071 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -15.584 -7.491 5.494 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -15.266 -5.067 6.593 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -15.412 -4.551 4.924 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -17.619 -4.557 5.958 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -17.556 -5.797 4.722 1.00 0.00 H new ATOM 0 HE ARG A 85 -16.841 -7.148 7.044 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -19.554 -5.137 6.013 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -20.714 -5.967 7.055 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -18.338 -8.208 8.379 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -20.030 -7.698 8.388 1.00 0.00 H new ATOM 1289 N ASN A 86 -13.487 -9.180 6.171 1.00 0.00 N ATOM 1290 CA ASN A 86 -13.076 -10.567 5.985 1.00 0.00 C ATOM 1291 C ASN A 86 -11.567 -10.665 5.784 1.00 0.00 C ATOM 1292 O ASN A 86 -11.093 -11.374 4.896 1.00 0.00 O ATOM 1293 CB ASN A 86 -13.803 -11.179 4.785 1.00 0.00 C ATOM 1294 CG ASN A 86 -15.297 -11.299 5.014 1.00 0.00 C ATOM 1295 OD1 ASN A 86 -15.790 -12.346 5.433 1.00 0.00 O ATOM 1296 ND2 ASN A 86 -16.026 -10.223 4.739 1.00 0.00 N ATOM 0 H ASN A 86 -14.125 -9.030 6.952 1.00 0.00 H new ATOM 0 HA ASN A 86 -13.341 -11.123 6.884 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.622 -10.566 3.902 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.389 -12.166 4.578 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.037 -10.244 4.873 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.575 -9.376 4.393 1.00 0.00 H new ATOM 1303 N VAL A 87 -10.817 -9.950 6.617 1.00 0.00 N ATOM 1304 CA VAL A 87 -9.362 -9.958 6.532 1.00 0.00 C ATOM 1305 C VAL A 87 -8.802 -11.348 6.814 1.00 0.00 C ATOM 1306 O VAL A 87 -9.468 -12.186 7.423 1.00 0.00 O ATOM 1307 CB VAL A 87 -8.737 -8.955 7.521 1.00 0.00 C ATOM 1308 CG1 VAL A 87 -9.248 -7.548 7.249 1.00 0.00 C ATOM 1309 CG2 VAL A 87 -9.028 -9.369 8.955 1.00 0.00 C ATOM 0 H VAL A 87 -11.193 -9.358 7.358 1.00 0.00 H new ATOM 0 HA VAL A 87 -9.103 -9.665 5.515 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.656 -8.957 7.379 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -8.796 -6.853 7.957 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.983 -7.255 6.233 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -10.332 -7.526 7.362 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.579 -8.649 9.640 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -10.106 -9.397 9.114 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -8.608 -10.357 9.141 1.00 0.00 H new ATOM 1319 N THR A 88 -7.573 -11.587 6.366 1.00 0.00 N ATOM 1320 CA THR A 88 -6.924 -12.876 6.569 1.00 0.00 C ATOM 1321 C THR A 88 -5.451 -12.699 6.923 1.00 0.00 C ATOM 1322 O THR A 88 -4.853 -11.663 6.633 1.00 0.00 O ATOM 1323 CB THR A 88 -7.036 -13.765 5.316 1.00 0.00 C ATOM 1324 OG1 THR A 88 -6.613 -13.036 4.159 1.00 0.00 O ATOM 1325 CG2 THR A 88 -8.465 -14.249 5.123 1.00 0.00 C ATOM 0 H THR A 88 -7.008 -10.905 5.861 1.00 0.00 H new ATOM 0 HA THR A 88 -7.439 -13.363 7.397 1.00 0.00 H new ATOM 0 HB THR A 88 -6.391 -14.633 5.454 1.00 0.00 H new ATOM 0 HG1 THR A 88 -6.686 -13.609 3.367 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.520 -14.875 4.232 1.00 0.00 H new ATOM 0 HG22 THR A 88 -8.774 -14.828 5.993 1.00 0.00 H new ATOM 0 HG23 THR A 88 -9.127 -13.391 5.005 1.00 0.00 H new ATOM 1333 N ARG A 89 -4.872 -13.718 7.550 1.00 0.00 N ATOM 1334 CA ARG A 89 -3.469 -13.675 7.944 1.00 0.00 C ATOM 1335 C ARG A 89 -2.586 -13.270 6.767 1.00 0.00 C ATOM 1336 O ARG A 89 -1.459 -12.815 6.952 1.00 0.00 O ATOM 1337 CB ARG A 89 -3.026 -15.036 8.483 1.00 0.00 C ATOM 1338 CG ARG A 89 -3.104 -16.153 7.454 1.00 0.00 C ATOM 1339 CD ARG A 89 -3.024 -17.522 8.112 1.00 0.00 C ATOM 1340 NE ARG A 89 -2.472 -18.530 7.211 1.00 0.00 N ATOM 1341 CZ ARG A 89 -2.667 -19.835 7.361 1.00 0.00 C ATOM 1342 NH1 ARG A 89 -3.396 -20.288 8.371 1.00 0.00 N ATOM 1343 NH2 ARG A 89 -2.131 -20.691 6.499 1.00 0.00 N ATOM 0 H ARG A 89 -5.353 -14.583 7.796 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.362 -12.928 8.731 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.001 -14.958 8.845 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.647 -15.298 9.339 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -4.036 -16.070 6.895 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.291 -16.045 6.736 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.406 -17.458 9.007 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -4.019 -17.829 8.433 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.906 -18.214 6.423 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.809 -19.634 9.036 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.544 -21.291 8.484 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.569 -20.346 5.721 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.281 -21.693 6.615 1.00 0.00 H new ATOM 1357 N ASN A 90 -3.108 -13.441 5.556 1.00 0.00 N ATOM 1358 CA ASN A 90 -2.367 -13.094 4.349 1.00 0.00 C ATOM 1359 C ASN A 90 -2.350 -11.584 4.136 1.00 0.00 C ATOM 1360 O ASN A 90 -1.303 -10.997 3.863 1.00 0.00 O ATOM 1361 CB ASN A 90 -2.984 -13.785 3.131 1.00 0.00 C ATOM 1362 CG ASN A 90 -2.690 -13.050 1.838 1.00 0.00 C ATOM 1363 OD1 ASN A 90 -1.531 -12.880 1.457 1.00 0.00 O ATOM 1364 ND2 ASN A 90 -3.740 -12.609 1.156 1.00 0.00 N ATOM 0 H ASN A 90 -4.040 -13.817 5.385 1.00 0.00 H new ATOM 0 HA ASN A 90 -1.340 -13.437 4.472 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.601 -14.803 3.062 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -4.063 -13.859 3.266 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.604 -12.107 0.279 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -4.683 -12.772 1.509 1.00 0.00 H new ATOM 1371 N ASP A 91 -3.516 -10.960 4.263 1.00 0.00 N ATOM 1372 CA ASP A 91 -3.636 -9.518 4.086 1.00 0.00 C ATOM 1373 C ASP A 91 -2.478 -8.790 4.762 1.00 0.00 C ATOM 1374 O ASP A 91 -1.975 -7.789 4.250 1.00 0.00 O ATOM 1375 CB ASP A 91 -4.967 -9.022 4.653 1.00 0.00 C ATOM 1376 CG ASP A 91 -6.105 -9.159 3.661 1.00 0.00 C ATOM 1377 OD1 ASP A 91 -5.966 -9.947 2.702 1.00 0.00 O ATOM 1378 OD2 ASP A 91 -7.136 -8.478 3.843 1.00 0.00 O ATOM 0 H ASP A 91 -4.392 -11.431 4.488 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.603 -9.304 3.018 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.206 -9.584 5.556 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.867 -7.977 4.945 1.00 0.00 H new ATOM 1383 N THR A 92 -2.060 -9.298 5.917 1.00 0.00 N ATOM 1384 CA THR A 92 -0.964 -8.695 6.665 1.00 0.00 C ATOM 1385 C THR A 92 0.210 -8.366 5.750 1.00 0.00 C ATOM 1386 O THR A 92 0.763 -9.246 5.091 1.00 0.00 O ATOM 1387 CB THR A 92 -0.475 -9.624 7.793 1.00 0.00 C ATOM 1388 OG1 THR A 92 -1.595 -10.135 8.526 1.00 0.00 O ATOM 1389 CG2 THR A 92 0.460 -8.884 8.737 1.00 0.00 C ATOM 0 H THR A 92 -2.464 -10.126 6.355 1.00 0.00 H new ATOM 0 HA THR A 92 -1.350 -7.775 7.103 1.00 0.00 H new ATOM 0 HB THR A 92 0.072 -10.451 7.341 1.00 0.00 H new ATOM 0 HG1 THR A 92 -1.811 -11.036 8.207 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.792 -9.560 9.525 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.325 -8.521 8.182 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.066 -8.039 9.182 1.00 0.00 H new ATOM 1397 N GLY A 93 0.587 -7.091 5.714 1.00 0.00 N ATOM 1398 CA GLY A 93 1.694 -6.668 4.876 1.00 0.00 C ATOM 1399 C GLY A 93 1.864 -5.162 4.856 1.00 0.00 C ATOM 1400 O GLY A 93 2.432 -4.582 5.781 1.00 0.00 O ATOM 0 H GLY A 93 0.146 -6.344 6.250 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.614 -7.130 5.235 1.00 0.00 H new ATOM 0 HA3 GLY A 93 1.533 -7.026 3.859 1.00 0.00 H new ATOM 1404 N SER A 94 1.371 -4.527 3.797 1.00 0.00 N ATOM 1405 CA SER A 94 1.475 -3.079 3.658 1.00 0.00 C ATOM 1406 C SER A 94 0.429 -2.550 2.682 1.00 0.00 C ATOM 1407 O SER A 94 0.074 -3.220 1.711 1.00 0.00 O ATOM 1408 CB SER A 94 2.876 -2.691 3.180 1.00 0.00 C ATOM 1409 OG SER A 94 3.847 -2.958 4.177 1.00 0.00 O ATOM 0 H SER A 94 0.896 -4.992 3.023 1.00 0.00 H new ATOM 0 HA SER A 94 1.294 -2.631 4.635 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.120 -3.244 2.273 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.896 -1.632 2.923 1.00 0.00 H new ATOM 0 HG SER A 94 3.406 -3.317 4.975 1.00 0.00 H new ATOM 1415 N TYR A 95 -0.062 -1.345 2.946 1.00 0.00 N ATOM 1416 CA TYR A 95 -1.070 -0.726 2.094 1.00 0.00 C ATOM 1417 C TYR A 95 -0.810 0.770 1.941 1.00 0.00 C ATOM 1418 O TYR A 95 -0.786 1.512 2.923 1.00 0.00 O ATOM 1419 CB TYR A 95 -2.468 -0.955 2.672 1.00 0.00 C ATOM 1420 CG TYR A 95 -2.936 -2.389 2.572 1.00 0.00 C ATOM 1421 CD1 TYR A 95 -2.568 -3.330 3.525 1.00 0.00 C ATOM 1422 CD2 TYR A 95 -3.749 -2.803 1.523 1.00 0.00 C ATOM 1423 CE1 TYR A 95 -2.993 -4.641 3.437 1.00 0.00 C ATOM 1424 CE2 TYR A 95 -4.180 -4.112 1.427 1.00 0.00 C ATOM 1425 CZ TYR A 95 -3.799 -5.028 2.386 1.00 0.00 C ATOM 1426 OH TYR A 95 -4.226 -6.333 2.296 1.00 0.00 O ATOM 0 H TYR A 95 0.222 -0.777 3.744 1.00 0.00 H new ATOM 0 HA TYR A 95 -1.011 -1.190 1.109 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.473 -0.652 3.719 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.178 -0.313 2.150 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -1.938 -3.031 4.350 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.049 -2.089 0.770 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -2.696 -5.359 4.187 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -4.812 -4.417 0.606 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.660 -6.902 2.858 1.00 0.00 H new ATOM 1436 N THR A 96 -0.617 1.206 0.700 1.00 0.00 N ATOM 1437 CA THR A 96 -0.358 2.612 0.416 1.00 0.00 C ATOM 1438 C THR A 96 -1.606 3.302 -0.124 1.00 0.00 C ATOM 1439 O THR A 96 -2.300 2.766 -0.989 1.00 0.00 O ATOM 1440 CB THR A 96 0.787 2.778 -0.601 1.00 0.00 C ATOM 1441 OG1 THR A 96 1.985 2.180 -0.092 1.00 0.00 O ATOM 1442 CG2 THR A 96 1.036 4.249 -0.900 1.00 0.00 C ATOM 0 H THR A 96 -0.635 0.606 -0.124 1.00 0.00 H new ATOM 0 HA THR A 96 -0.067 3.077 1.358 1.00 0.00 H new ATOM 0 HB THR A 96 0.497 2.279 -1.526 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.761 2.548 -0.565 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.849 4.341 -1.620 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.131 4.694 -1.314 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.306 4.767 0.020 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.885 4.495 0.390 1.00 0.00 N ATOM 1451 CA LEU A 97 -3.050 5.260 -0.041 1.00 0.00 C ATOM 1452 C LEU A 97 -2.645 6.658 -0.496 1.00 0.00 C ATOM 1453 O LEU A 97 -2.176 7.469 0.302 1.00 0.00 O ATOM 1454 CB LEU A 97 -4.070 5.356 1.095 1.00 0.00 C ATOM 1455 CG LEU A 97 -5.058 6.520 1.012 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -4.427 7.795 1.550 1.00 0.00 C ATOM 1457 CD2 LEU A 97 -5.529 6.720 -0.421 1.00 0.00 C ATOM 0 H LEU A 97 -1.321 4.953 1.105 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.504 4.741 -0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.637 4.426 1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.528 5.432 2.038 1.00 0.00 H new ATOM 0 HG LEU A 97 -5.925 6.280 1.628 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.145 8.613 1.483 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -4.141 7.648 2.591 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.543 8.040 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.231 7.553 -0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.672 6.938 -1.059 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.021 5.813 -0.772 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.831 6.933 -1.783 1.00 0.00 N ATOM 1470 CA GLN A 98 -2.486 8.234 -2.344 1.00 0.00 C ATOM 1471 C GLN A 98 -3.732 9.091 -2.537 1.00 0.00 C ATOM 1472 O GLN A 98 -4.720 8.647 -3.122 1.00 0.00 O ATOM 1473 CB GLN A 98 -1.760 8.061 -3.679 1.00 0.00 C ATOM 1474 CG GLN A 98 -1.619 9.354 -4.467 1.00 0.00 C ATOM 1475 CD GLN A 98 -0.620 9.240 -5.601 1.00 0.00 C ATOM 1476 OE1 GLN A 98 0.587 9.372 -5.396 1.00 0.00 O ATOM 1477 NE2 GLN A 98 -1.118 8.994 -6.807 1.00 0.00 N ATOM 0 H GLN A 98 -3.219 6.272 -2.457 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.824 8.740 -1.642 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.768 7.649 -3.493 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -2.299 7.333 -4.285 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -2.591 9.637 -4.871 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.309 10.153 -3.794 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -2.125 8.892 -6.932 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.493 8.907 -7.609 1.00 0.00 H new ATOM 1486 N VAL A 99 -3.680 10.323 -2.040 1.00 0.00 N ATOM 1487 CA VAL A 99 -4.805 11.243 -2.158 1.00 0.00 C ATOM 1488 C VAL A 99 -4.450 12.434 -3.042 1.00 0.00 C ATOM 1489 O VAL A 99 -3.480 13.147 -2.780 1.00 0.00 O ATOM 1490 CB VAL A 99 -5.257 11.758 -0.779 1.00 0.00 C ATOM 1491 CG1 VAL A 99 -4.058 12.213 0.040 1.00 0.00 C ATOM 1492 CG2 VAL A 99 -6.265 12.886 -0.935 1.00 0.00 C ATOM 0 H VAL A 99 -2.871 10.707 -1.552 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.623 10.686 -2.615 1.00 0.00 H new ATOM 0 HB VAL A 99 -5.742 10.940 -0.246 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.397 12.574 1.011 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.375 11.375 0.182 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.542 13.016 -0.486 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.573 13.237 0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.809 13.708 -1.487 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -7.136 12.522 -1.480 1.00 0.00 H new ATOM 1502 N ILE A 100 -5.241 12.645 -4.088 1.00 0.00 N ATOM 1503 CA ILE A 100 -5.011 13.751 -5.009 1.00 0.00 C ATOM 1504 C ILE A 100 -5.700 15.022 -4.524 1.00 0.00 C ATOM 1505 O ILE A 100 -6.843 14.987 -4.068 1.00 0.00 O ATOM 1506 CB ILE A 100 -5.513 13.417 -6.426 1.00 0.00 C ATOM 1507 CG1 ILE A 100 -4.700 12.265 -7.021 1.00 0.00 C ATOM 1508 CG2 ILE A 100 -5.433 14.645 -7.320 1.00 0.00 C ATOM 1509 CD1 ILE A 100 -4.948 10.936 -6.342 1.00 0.00 C ATOM 0 H ILE A 100 -6.047 12.064 -4.319 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.934 13.915 -5.043 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.556 13.106 -6.361 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.938 12.172 -8.081 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.639 12.506 -6.953 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.791 14.392 -8.318 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.051 15.440 -6.903 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.399 14.984 -7.381 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.339 10.166 -6.816 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.683 11.011 -5.287 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -6.002 10.672 -6.433 1.00 0.00 H new ATOM 1521 N LYS A 101 -4.998 16.145 -4.629 1.00 0.00 N ATOM 1522 CA LYS A 101 -5.541 17.430 -4.205 1.00 0.00 C ATOM 1523 C LYS A 101 -6.176 18.167 -5.380 1.00 0.00 C ATOM 1524 O LYS A 101 -5.978 17.797 -6.538 1.00 0.00 O ATOM 1525 CB LYS A 101 -4.440 18.292 -3.582 1.00 0.00 C ATOM 1526 CG LYS A 101 -4.010 17.826 -2.202 1.00 0.00 C ATOM 1527 CD LYS A 101 -2.857 16.840 -2.281 1.00 0.00 C ATOM 1528 CE LYS A 101 -1.513 17.551 -2.261 1.00 0.00 C ATOM 1529 NZ LYS A 101 -1.149 18.010 -0.892 1.00 0.00 N ATOM 0 H LYS A 101 -4.051 16.191 -5.005 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.312 17.242 -3.458 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.573 18.292 -4.243 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -4.791 19.322 -3.516 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.714 18.687 -1.602 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.855 17.360 -1.695 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.914 16.144 -1.444 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.944 16.249 -3.193 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -0.741 16.879 -2.636 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.545 18.407 -2.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.052 19.045 -0.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.894 17.729 -0.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.247 17.576 -0.609 1.00 0.00 H new ATOM 1543 N LEU A 102 -6.937 19.212 -5.075 1.00 0.00 N ATOM 1544 CA LEU A 102 -7.600 20.003 -6.106 1.00 0.00 C ATOM 1545 C LEU A 102 -6.590 20.846 -6.878 1.00 0.00 C ATOM 1546 O LEU A 102 -6.884 21.344 -7.964 1.00 0.00 O ATOM 1547 CB LEU A 102 -8.664 20.906 -5.480 1.00 0.00 C ATOM 1548 CG LEU A 102 -10.050 20.286 -5.301 1.00 0.00 C ATOM 1549 CD1 LEU A 102 -10.924 20.574 -6.511 1.00 0.00 C ATOM 1550 CD2 LEU A 102 -9.937 18.786 -5.067 1.00 0.00 C ATOM 0 H LEU A 102 -7.110 19.531 -4.122 1.00 0.00 H new ATOM 0 HA LEU A 102 -8.081 19.317 -6.803 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.306 21.233 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.764 21.798 -6.098 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.518 20.736 -4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.906 20.125 -6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.032 21.652 -6.633 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.461 20.152 -7.403 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -10.933 18.361 -4.942 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.449 18.320 -5.923 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.348 18.601 -4.169 1.00 0.00 H new ATOM 1562 N ASN A 103 -5.399 21.001 -6.310 1.00 0.00 N ATOM 1563 CA ASN A 103 -4.345 21.783 -6.946 1.00 0.00 C ATOM 1564 C ASN A 103 -3.475 20.902 -7.836 1.00 0.00 C ATOM 1565 O ASN A 103 -2.299 21.193 -8.059 1.00 0.00 O ATOM 1566 CB ASN A 103 -3.479 22.468 -5.886 1.00 0.00 C ATOM 1567 CG ASN A 103 -2.722 21.474 -5.027 1.00 0.00 C ATOM 1568 OD1 ASN A 103 -3.133 20.322 -4.882 1.00 0.00 O ATOM 1569 ND2 ASN A 103 -1.609 21.915 -4.452 1.00 0.00 N ATOM 0 H ASN A 103 -5.139 20.596 -5.411 1.00 0.00 H new ATOM 0 HA ASN A 103 -4.817 22.544 -7.568 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -2.770 23.135 -6.376 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.111 23.087 -5.249 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -1.058 21.291 -3.863 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.306 22.878 -4.600 1.00 0.00 H new ATOM 1576 N LEU A 104 -4.061 19.823 -8.344 1.00 0.00 N ATOM 1577 CA LEU A 104 -3.340 18.898 -9.212 1.00 0.00 C ATOM 1578 C LEU A 104 -2.117 18.327 -8.502 1.00 0.00 C ATOM 1579 O LEU A 104 -1.017 18.314 -9.054 1.00 0.00 O ATOM 1580 CB LEU A 104 -2.913 19.604 -10.500 1.00 0.00 C ATOM 1581 CG LEU A 104 -4.045 20.099 -11.401 1.00 0.00 C ATOM 1582 CD1 LEU A 104 -3.484 20.807 -12.624 1.00 0.00 C ATOM 1583 CD2 LEU A 104 -4.942 18.942 -11.817 1.00 0.00 C ATOM 0 H LEU A 104 -5.033 19.567 -8.170 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.010 18.075 -9.461 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.289 20.457 -10.233 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.290 18.920 -11.076 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.645 20.813 -10.837 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.305 21.152 -13.253 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.886 21.661 -12.307 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.859 20.116 -13.190 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.742 19.314 -12.458 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.354 18.203 -12.362 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.374 18.479 -10.930 1.00 0.00 H new ATOM 1595 N MET A 105 -2.317 17.854 -7.277 1.00 0.00 N ATOM 1596 CA MET A 105 -1.230 17.278 -6.493 1.00 0.00 C ATOM 1597 C MET A 105 -1.634 15.925 -5.916 1.00 0.00 C ATOM 1598 O MET A 105 -2.779 15.496 -6.057 1.00 0.00 O ATOM 1599 CB MET A 105 -0.828 18.228 -5.363 1.00 0.00 C ATOM 1600 CG MET A 105 0.012 19.405 -5.829 1.00 0.00 C ATOM 1601 SD MET A 105 1.781 19.060 -5.777 1.00 0.00 S ATOM 1602 CE MET A 105 2.287 19.639 -7.395 1.00 0.00 C ATOM 0 H MET A 105 -3.221 17.858 -6.805 1.00 0.00 H new ATOM 0 HA MET A 105 -0.376 17.131 -7.155 1.00 0.00 H new ATOM 0 HB2 MET A 105 -1.729 18.604 -4.878 1.00 0.00 H new ATOM 0 HB3 MET A 105 -0.271 17.670 -4.611 1.00 0.00 H new ATOM 0 HG2 MET A 105 -0.273 19.669 -6.847 1.00 0.00 H new ATOM 0 HG3 MET A 105 -0.204 20.271 -5.203 1.00 0.00 H new ATOM 0 HE1 MET A 105 3.360 19.492 -7.515 1.00 0.00 H new ATOM 0 HE2 MET A 105 1.756 19.078 -8.164 1.00 0.00 H new ATOM 0 HE3 MET A 105 2.053 20.699 -7.492 1.00 0.00 H new ATOM 1612 N SER A 106 -0.686 15.256 -5.267 1.00 0.00 N ATOM 1613 CA SER A 106 -0.942 13.950 -4.673 1.00 0.00 C ATOM 1614 C SER A 106 0.031 13.672 -3.530 1.00 0.00 C ATOM 1615 O SER A 106 1.196 14.065 -3.584 1.00 0.00 O ATOM 1616 CB SER A 106 -0.828 12.852 -5.732 1.00 0.00 C ATOM 1617 OG SER A 106 0.399 12.948 -6.435 1.00 0.00 O ATOM 0 H SER A 106 0.267 15.598 -5.139 1.00 0.00 H new ATOM 0 HA SER A 106 -1.956 13.954 -4.272 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.903 11.874 -5.256 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.659 12.930 -6.433 1.00 0.00 H new ATOM 0 HG SER A 106 0.449 12.235 -7.105 1.00 0.00 H new ATOM 1623 N GLU A 107 -0.458 12.993 -2.497 1.00 0.00 N ATOM 1624 CA GLU A 107 0.368 12.664 -1.341 1.00 0.00 C ATOM 1625 C GLU A 107 0.422 11.154 -1.123 1.00 0.00 C ATOM 1626 O GLU A 107 -0.418 10.413 -1.634 1.00 0.00 O ATOM 1627 CB GLU A 107 -0.174 13.352 -0.087 1.00 0.00 C ATOM 1628 CG GLU A 107 -0.050 14.866 -0.123 1.00 0.00 C ATOM 1629 CD GLU A 107 -0.639 15.529 1.108 1.00 0.00 C ATOM 1630 OE1 GLU A 107 -1.728 15.103 1.547 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -0.011 16.473 1.632 1.00 0.00 O ATOM 0 H GLU A 107 -1.420 12.660 -2.437 1.00 0.00 H new ATOM 0 HA GLU A 107 1.379 13.022 -1.535 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.223 13.085 0.040 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.359 12.973 0.785 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.002 15.139 -0.210 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -0.553 15.247 -1.012 1.00 0.00 H new ATOM 1638 N GLU A 108 1.415 10.707 -0.362 1.00 0.00 N ATOM 1639 CA GLU A 108 1.579 9.286 -0.077 1.00 0.00 C ATOM 1640 C GLU A 108 1.604 9.032 1.427 1.00 0.00 C ATOM 1641 O GLU A 108 2.156 9.822 2.193 1.00 0.00 O ATOM 1642 CB GLU A 108 2.867 8.761 -0.716 1.00 0.00 C ATOM 1643 CG GLU A 108 2.675 8.235 -2.128 1.00 0.00 C ATOM 1644 CD GLU A 108 3.932 8.351 -2.969 1.00 0.00 C ATOM 1645 OE1 GLU A 108 4.876 7.568 -2.736 1.00 0.00 O ATOM 1646 OE2 GLU A 108 3.970 9.224 -3.861 1.00 0.00 O ATOM 0 H GLU A 108 2.118 11.308 0.068 1.00 0.00 H new ATOM 0 HA GLU A 108 0.728 8.755 -0.503 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.607 9.561 -0.733 1.00 0.00 H new ATOM 0 HB3 GLU A 108 3.273 7.965 -0.093 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.367 7.190 -2.084 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.867 8.786 -2.610 1.00 0.00 H new ATOM 1653 N VAL A 109 1.001 7.923 1.844 1.00 0.00 N ATOM 1654 CA VAL A 109 0.953 7.563 3.256 1.00 0.00 C ATOM 1655 C VAL A 109 0.789 6.058 3.434 1.00 0.00 C ATOM 1656 O VAL A 109 -0.275 5.501 3.160 1.00 0.00 O ATOM 1657 CB VAL A 109 -0.200 8.283 3.980 1.00 0.00 C ATOM 1658 CG1 VAL A 109 -1.483 8.186 3.170 1.00 0.00 C ATOM 1659 CG2 VAL A 109 -0.395 7.707 5.374 1.00 0.00 C ATOM 0 H VAL A 109 0.539 7.258 1.224 1.00 0.00 H new ATOM 0 HA VAL A 109 1.900 7.877 3.695 1.00 0.00 H new ATOM 0 HB VAL A 109 0.059 9.337 4.080 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.286 8.700 3.698 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.334 8.650 2.195 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.750 7.138 3.036 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.214 8.227 5.871 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -0.632 6.646 5.299 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.520 7.835 5.952 1.00 0.00 H new ATOM 1669 N THR A 110 1.849 5.402 3.895 1.00 0.00 N ATOM 1670 CA THR A 110 1.824 3.961 4.110 1.00 0.00 C ATOM 1671 C THR A 110 1.021 3.605 5.356 1.00 0.00 C ATOM 1672 O THR A 110 1.458 3.852 6.479 1.00 0.00 O ATOM 1673 CB THR A 110 3.247 3.388 4.249 1.00 0.00 C ATOM 1674 OG1 THR A 110 4.178 4.214 3.541 1.00 0.00 O ATOM 1675 CG2 THR A 110 3.313 1.966 3.713 1.00 0.00 C ATOM 0 H THR A 110 2.737 5.847 4.127 1.00 0.00 H new ATOM 0 HA THR A 110 1.347 3.520 3.235 1.00 0.00 H new ATOM 0 HB THR A 110 3.507 3.372 5.307 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.081 3.844 3.635 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.328 1.583 3.822 1.00 0.00 H new ATOM 0 HG22 THR A 110 2.624 1.334 4.273 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.035 1.961 2.659 1.00 0.00 H new ATOM 1683 N GLY A 111 -0.156 3.022 5.150 1.00 0.00 N ATOM 1684 CA GLY A 111 -1.001 2.641 6.266 1.00 0.00 C ATOM 1685 C GLY A 111 -1.529 1.225 6.137 1.00 0.00 C ATOM 1686 O GLY A 111 -2.281 0.919 5.213 1.00 0.00 O ATOM 0 H GLY A 111 -0.539 2.807 4.230 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -0.435 2.731 7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.840 3.333 6.335 1.00 0.00 H new ATOM 1690 N GLN A 112 -1.131 0.361 7.065 1.00 0.00 N ATOM 1691 CA GLN A 112 -1.567 -1.030 7.049 1.00 0.00 C ATOM 1692 C GLN A 112 -1.878 -1.520 8.460 1.00 0.00 C ATOM 1693 O GLN A 112 -1.828 -0.751 9.420 1.00 0.00 O ATOM 1694 CB GLN A 112 -0.494 -1.916 6.413 1.00 0.00 C ATOM 1695 CG GLN A 112 0.801 -1.968 7.208 1.00 0.00 C ATOM 1696 CD GLN A 112 1.527 -0.638 7.227 1.00 0.00 C ATOM 1697 OE1 GLN A 112 1.397 0.140 8.172 1.00 0.00 O ATOM 1698 NE2 GLN A 112 2.299 -0.369 6.180 1.00 0.00 N ATOM 0 H GLN A 112 -0.508 0.599 7.837 1.00 0.00 H new ATOM 0 HA GLN A 112 -2.478 -1.092 6.454 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -0.886 -2.927 6.306 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -0.280 -1.549 5.409 1.00 0.00 H new ATOM 0 HG2 GLN A 112 0.583 -2.273 8.231 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.455 -2.729 6.781 1.00 0.00 H new ATOM 0 HE21 GLN A 112 2.378 -1.043 5.418 1.00 0.00 H new ATOM 0 HE22 GLN A 112 2.813 0.511 6.138 1.00 0.00 H new ATOM 1707 N PHE A 113 -2.198 -2.804 8.578 1.00 0.00 N ATOM 1708 CA PHE A 113 -2.518 -3.396 9.871 1.00 0.00 C ATOM 1709 C PHE A 113 -1.956 -4.811 9.976 1.00 0.00 C ATOM 1710 O PHE A 113 -1.295 -5.297 9.058 1.00 0.00 O ATOM 1711 CB PHE A 113 -4.033 -3.421 10.085 1.00 0.00 C ATOM 1712 CG PHE A 113 -4.776 -4.178 9.021 1.00 0.00 C ATOM 1713 CD1 PHE A 113 -4.968 -3.626 7.765 1.00 0.00 C ATOM 1714 CD2 PHE A 113 -5.284 -5.441 9.278 1.00 0.00 C ATOM 1715 CE1 PHE A 113 -5.650 -4.320 6.784 1.00 0.00 C ATOM 1716 CE2 PHE A 113 -5.967 -6.140 8.302 1.00 0.00 C ATOM 1717 CZ PHE A 113 -6.152 -5.579 7.053 1.00 0.00 C ATOM 0 H PHE A 113 -2.243 -3.455 7.794 1.00 0.00 H new ATOM 0 HA PHE A 113 -2.059 -2.782 10.646 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -4.248 -3.869 11.055 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -4.404 -2.397 10.118 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -4.580 -2.641 7.550 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -5.144 -5.884 10.253 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -5.791 -3.879 5.808 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -6.356 -7.125 8.515 1.00 0.00 H new ATOM 0 HZ PHE A 113 -6.688 -6.123 6.289 1.00 0.00 H new ATOM 1727 N SER A 114 -2.224 -5.466 11.101 1.00 0.00 N ATOM 1728 CA SER A 114 -1.741 -6.824 11.328 1.00 0.00 C ATOM 1729 C SER A 114 -2.875 -7.731 11.797 1.00 0.00 C ATOM 1730 O SER A 114 -3.606 -7.400 12.730 1.00 0.00 O ATOM 1731 CB SER A 114 -0.614 -6.820 12.363 1.00 0.00 C ATOM 1732 OG SER A 114 -0.020 -8.102 12.474 1.00 0.00 O ATOM 0 H SER A 114 -2.772 -5.079 11.869 1.00 0.00 H new ATOM 0 HA SER A 114 -1.356 -7.210 10.384 1.00 0.00 H new ATOM 0 HB2 SER A 114 0.142 -6.088 12.079 1.00 0.00 H new ATOM 0 HB3 SER A 114 -1.007 -6.512 13.332 1.00 0.00 H new ATOM 0 HG SER A 114 0.698 -8.073 13.140 1.00 0.00 H new ATOM 1738 N VAL A 115 -3.014 -8.880 11.142 1.00 0.00 N ATOM 1739 CA VAL A 115 -4.057 -9.837 11.490 1.00 0.00 C ATOM 1740 C VAL A 115 -3.474 -11.042 12.221 1.00 0.00 C ATOM 1741 O VAL A 115 -2.313 -11.400 12.023 1.00 0.00 O ATOM 1742 CB VAL A 115 -4.812 -10.325 10.240 1.00 0.00 C ATOM 1743 CG1 VAL A 115 -6.004 -11.182 10.636 1.00 0.00 C ATOM 1744 CG2 VAL A 115 -5.254 -9.143 9.390 1.00 0.00 C ATOM 0 H VAL A 115 -2.417 -9.170 10.368 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.756 -9.319 12.147 1.00 0.00 H new ATOM 0 HB VAL A 115 -4.136 -10.939 9.645 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -6.525 -11.517 9.739 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.658 -12.048 11.200 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.685 -10.596 11.253 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -5.786 -9.506 8.511 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -5.914 -8.501 9.974 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.379 -8.574 9.075 1.00 0.00 H new ATOM 1754 N HIS A 116 -4.289 -11.665 13.066 1.00 0.00 N ATOM 1755 CA HIS A 116 -3.856 -12.832 13.826 1.00 0.00 C ATOM 1756 C HIS A 116 -5.012 -13.805 14.035 1.00 0.00 C ATOM 1757 O HIS A 116 -6.148 -13.410 14.299 1.00 0.00 O ATOM 1758 CB HIS A 116 -3.284 -12.403 15.178 1.00 0.00 C ATOM 1759 CG HIS A 116 -4.240 -11.599 16.004 1.00 0.00 C ATOM 1760 ND1 HIS A 116 -4.782 -12.057 17.187 1.00 0.00 N ATOM 1761 CD2 HIS A 116 -4.749 -10.359 15.814 1.00 0.00 C ATOM 1762 CE1 HIS A 116 -5.585 -11.134 17.687 1.00 0.00 C ATOM 1763 NE2 HIS A 116 -5.582 -10.094 16.873 1.00 0.00 N ATOM 0 H HIS A 116 -5.253 -11.381 13.242 1.00 0.00 H new ATOM 0 HA HIS A 116 -3.078 -13.338 13.255 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -2.991 -13.291 15.738 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -2.379 -11.818 15.012 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -4.539 -9.701 14.984 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -6.148 -11.216 18.605 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -6.112 -9.233 17.009 1.00 0.00 H new ATOM 1772 N PRO A 117 -4.719 -15.108 13.915 1.00 0.00 N ATOM 1773 CA PRO A 117 -5.721 -16.165 14.087 1.00 0.00 C ATOM 1774 C PRO A 117 -6.177 -16.301 15.535 1.00 0.00 C ATOM 1775 O PRO A 117 -5.372 -16.206 16.460 1.00 0.00 O ATOM 1776 CB PRO A 117 -4.984 -17.429 13.637 1.00 0.00 C ATOM 1777 CG PRO A 117 -3.542 -17.125 13.856 1.00 0.00 C ATOM 1778 CD PRO A 117 -3.386 -15.652 13.603 1.00 0.00 C ATOM 0 HA PRO A 117 -6.630 -15.961 13.521 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.298 -18.298 14.216 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.187 -17.654 12.590 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -3.239 -17.381 14.871 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -2.914 -17.706 13.180 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -2.615 -15.215 14.238 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -3.101 -15.450 12.570 1.00 0.00 H new ATOM 1786 N GLU A 118 -7.474 -16.523 15.724 1.00 0.00 N ATOM 1787 CA GLU A 118 -8.037 -16.672 17.061 1.00 0.00 C ATOM 1788 C GLU A 118 -7.673 -18.029 17.657 1.00 0.00 C ATOM 1789 O GLU A 118 -8.458 -18.976 17.600 1.00 0.00 O ATOM 1790 CB GLU A 118 -9.558 -16.512 17.019 1.00 0.00 C ATOM 1791 CG GLU A 118 -10.014 -15.082 16.782 1.00 0.00 C ATOM 1792 CD GLU A 118 -11.495 -14.986 16.471 1.00 0.00 C ATOM 1793 OE1 GLU A 118 -11.857 -15.066 15.278 1.00 0.00 O ATOM 1794 OE2 GLU A 118 -12.291 -14.831 17.420 1.00 0.00 O ATOM 0 H GLU A 118 -8.154 -16.604 14.968 1.00 0.00 H new ATOM 0 HA GLU A 118 -7.614 -15.892 17.694 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -9.960 -17.148 16.230 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -9.978 -16.867 17.960 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -9.792 -14.483 17.665 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -9.445 -14.655 15.956 1.00 0.00 H new ATOM 1801 N THR A 119 -6.475 -18.116 18.227 1.00 0.00 N ATOM 1802 CA THR A 119 -6.005 -19.356 18.832 1.00 0.00 C ATOM 1803 C THR A 119 -5.258 -19.085 20.132 1.00 0.00 C ATOM 1804 O THR A 119 -4.682 -18.016 20.335 1.00 0.00 O ATOM 1805 CB THR A 119 -5.082 -20.133 17.875 1.00 0.00 C ATOM 1806 OG1 THR A 119 -4.017 -19.287 17.427 1.00 0.00 O ATOM 1807 CG2 THR A 119 -5.860 -20.655 16.676 1.00 0.00 C ATOM 0 H THR A 119 -5.813 -17.342 18.282 1.00 0.00 H new ATOM 0 HA THR A 119 -6.888 -19.959 19.043 1.00 0.00 H new ATOM 0 HB THR A 119 -4.667 -20.983 18.417 1.00 0.00 H new ATOM 0 HG1 THR A 119 -3.434 -19.789 16.820 1.00 0.00 H new ATOM 0 HG21 THR A 119 -5.187 -21.200 16.015 1.00 0.00 H new ATOM 0 HG22 THR A 119 -6.651 -21.322 17.018 1.00 0.00 H new ATOM 0 HG23 THR A 119 -6.300 -19.817 16.135 1.00 0.00 H new ATOM 1815 N PRO A 120 -5.264 -20.075 21.037 1.00 0.00 N ATOM 1816 CA PRO A 120 -4.589 -19.967 22.334 1.00 0.00 C ATOM 1817 C PRO A 120 -3.070 -19.968 22.199 1.00 0.00 C ATOM 1818 O PRO A 120 -2.532 -20.228 21.123 1.00 0.00 O ATOM 1819 CB PRO A 120 -5.059 -21.216 23.084 1.00 0.00 C ATOM 1820 CG PRO A 120 -5.406 -22.192 22.013 1.00 0.00 C ATOM 1821 CD PRO A 120 -5.929 -21.377 20.863 1.00 0.00 C ATOM 0 HA PRO A 120 -4.829 -19.033 22.841 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.276 -21.605 23.736 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.920 -20.998 23.715 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -4.532 -22.771 21.715 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.156 -22.902 22.361 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -5.680 -21.830 19.903 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -7.014 -21.282 20.899 1.00 0.00 H new ATOM 1829 N LYS A 121 -2.383 -19.674 23.298 1.00 0.00 N ATOM 1830 CA LYS A 121 -0.925 -19.642 23.304 1.00 0.00 C ATOM 1831 C LYS A 121 -0.376 -20.107 24.649 1.00 0.00 C ATOM 1832 O LYS A 121 -0.421 -19.388 25.647 1.00 0.00 O ATOM 1833 CB LYS A 121 -0.425 -18.229 22.997 1.00 0.00 C ATOM 1834 CG LYS A 121 0.919 -18.200 22.290 1.00 0.00 C ATOM 1835 CD LYS A 121 1.494 -16.794 22.244 1.00 0.00 C ATOM 1836 CE LYS A 121 2.488 -16.636 21.103 1.00 0.00 C ATOM 1837 NZ LYS A 121 2.854 -15.210 20.879 1.00 0.00 N ATOM 0 H LYS A 121 -2.813 -19.454 24.197 1.00 0.00 H new ATOM 0 HA LYS A 121 -0.568 -20.323 22.531 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -1.163 -17.718 22.378 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -0.348 -17.669 23.929 1.00 0.00 H new ATOM 0 HG2 LYS A 121 1.616 -18.863 22.804 1.00 0.00 H new ATOM 0 HG3 LYS A 121 0.806 -18.581 21.275 1.00 0.00 H new ATOM 0 HD2 LYS A 121 0.685 -16.073 22.126 1.00 0.00 H new ATOM 0 HD3 LYS A 121 1.986 -16.570 23.190 1.00 0.00 H new ATOM 0 HE2 LYS A 121 3.387 -17.211 21.323 1.00 0.00 H new ATOM 0 HE3 LYS A 121 2.061 -17.049 20.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 3.533 -15.145 20.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 2.000 -14.665 20.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 3.285 -14.823 21.742 1.00 0.00 H new ATOM 1851 N PRO A 122 0.156 -21.338 24.678 1.00 0.00 N ATOM 1852 CA PRO A 122 0.726 -21.925 25.894 1.00 0.00 C ATOM 1853 C PRO A 122 2.026 -21.246 26.312 1.00 0.00 C ATOM 1854 O PRO A 122 2.202 -20.882 27.474 1.00 0.00 O ATOM 1855 CB PRO A 122 0.986 -23.380 25.498 1.00 0.00 C ATOM 1856 CG PRO A 122 1.149 -23.346 24.017 1.00 0.00 C ATOM 1857 CD PRO A 122 0.243 -22.251 23.526 1.00 0.00 C ATOM 0 HA PRO A 122 0.060 -21.815 26.750 1.00 0.00 H new ATOM 0 HB2 PRO A 122 1.880 -23.769 25.986 1.00 0.00 H new ATOM 0 HB3 PRO A 122 0.157 -24.024 25.790 1.00 0.00 H new ATOM 0 HG2 PRO A 122 2.185 -23.148 23.743 1.00 0.00 H new ATOM 0 HG3 PRO A 122 0.880 -24.304 23.573 1.00 0.00 H new ATOM 0 HD2 PRO A 122 0.654 -21.752 22.648 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -0.737 -22.636 23.244 1.00 0.00 H new ATOM 1865 N SER A 123 2.934 -21.080 25.356 1.00 0.00 N ATOM 1866 CA SER A 123 4.220 -20.447 25.625 1.00 0.00 C ATOM 1867 C SER A 123 4.531 -19.381 24.579 1.00 0.00 C ATOM 1868 O SER A 123 3.835 -19.265 23.570 1.00 0.00 O ATOM 1869 CB SER A 123 5.334 -21.496 25.647 1.00 0.00 C ATOM 1870 OG SER A 123 5.106 -22.461 26.659 1.00 0.00 O ATOM 0 H SER A 123 2.803 -21.375 24.388 1.00 0.00 H new ATOM 0 HA SER A 123 4.163 -19.967 26.602 1.00 0.00 H new ATOM 0 HB2 SER A 123 5.393 -21.989 24.677 1.00 0.00 H new ATOM 0 HB3 SER A 123 6.294 -21.008 25.815 1.00 0.00 H new ATOM 0 HG SER A 123 5.831 -23.121 26.651 1.00 0.00 H new ATOM 1876 N ILE A 124 5.580 -18.605 24.828 1.00 0.00 N ATOM 1877 CA ILE A 124 5.985 -17.549 23.909 1.00 0.00 C ATOM 1878 C ILE A 124 7.447 -17.701 23.506 1.00 0.00 C ATOM 1879 O ILE A 124 7.777 -17.717 22.320 1.00 0.00 O ATOM 1880 CB ILE A 124 5.776 -16.154 24.527 1.00 0.00 C ATOM 1881 CG1 ILE A 124 4.306 -15.950 24.897 1.00 0.00 C ATOM 1882 CG2 ILE A 124 6.240 -15.072 23.563 1.00 0.00 C ATOM 1883 CD1 ILE A 124 4.072 -14.774 25.819 1.00 0.00 C ATOM 0 H ILE A 124 6.165 -18.688 25.659 1.00 0.00 H new ATOM 0 HA ILE A 124 5.356 -17.643 23.024 1.00 0.00 H new ATOM 0 HB ILE A 124 6.373 -16.084 25.436 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.727 -15.807 23.985 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.931 -16.855 25.374 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.086 -14.092 24.014 1.00 0.00 H new ATOM 0 HG22 ILE A 124 7.299 -15.209 23.345 1.00 0.00 H new ATOM 0 HG23 ILE A 124 5.668 -15.139 22.638 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.008 -14.690 26.039 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.623 -14.924 26.747 1.00 0.00 H new ATOM 0 HD13 ILE A 124 4.416 -13.859 25.336 1.00 0.00 H new ATOM 1895 N SER A 125 8.321 -17.813 24.501 1.00 0.00 N ATOM 1896 CA SER A 125 9.750 -17.962 24.250 1.00 0.00 C ATOM 1897 C SER A 125 10.076 -19.381 23.794 1.00 0.00 C ATOM 1898 O SER A 125 10.068 -20.319 24.590 1.00 0.00 O ATOM 1899 CB SER A 125 10.548 -17.624 25.511 1.00 0.00 C ATOM 1900 OG SER A 125 11.842 -17.149 25.183 1.00 0.00 O ATOM 0 H SER A 125 8.065 -17.803 25.488 1.00 0.00 H new ATOM 0 HA SER A 125 10.029 -17.270 23.455 1.00 0.00 H new ATOM 0 HB2 SER A 125 10.016 -16.869 26.090 1.00 0.00 H new ATOM 0 HB3 SER A 125 10.631 -18.510 26.141 1.00 0.00 H new ATOM 0 HG SER A 125 12.331 -16.938 26.006 1.00 0.00 H new ATOM 1906 N GLY A 126 10.364 -19.530 22.504 1.00 0.00 N ATOM 1907 CA GLY A 126 10.689 -20.836 21.962 1.00 0.00 C ATOM 1908 C GLY A 126 10.769 -20.832 20.449 1.00 0.00 C ATOM 1909 O GLY A 126 10.141 -20.016 19.774 1.00 0.00 O ATOM 0 H GLY A 126 10.378 -18.769 21.825 1.00 0.00 H new ATOM 0 HA2 GLY A 126 11.642 -21.169 22.372 1.00 0.00 H new ATOM 0 HA3 GLY A 126 9.936 -21.556 22.281 1.00 0.00 H new ATOM 1913 N PRO A 127 11.560 -21.762 19.892 1.00 0.00 N ATOM 1914 CA PRO A 127 11.740 -21.882 18.442 1.00 0.00 C ATOM 1915 C PRO A 127 10.485 -22.390 17.742 1.00 0.00 C ATOM 1916 O PRO A 127 10.273 -22.128 16.558 1.00 0.00 O ATOM 1917 CB PRO A 127 12.876 -22.901 18.309 1.00 0.00 C ATOM 1918 CG PRO A 127 12.809 -23.708 19.560 1.00 0.00 C ATOM 1919 CD PRO A 127 12.338 -22.767 20.635 1.00 0.00 C ATOM 0 HA PRO A 127 11.955 -20.920 17.977 1.00 0.00 H new ATOM 0 HB2 PRO A 127 12.745 -23.527 17.426 1.00 0.00 H new ATOM 0 HB3 PRO A 127 13.842 -22.406 18.208 1.00 0.00 H new ATOM 0 HG2 PRO A 127 12.122 -24.547 19.447 1.00 0.00 H new ATOM 0 HG3 PRO A 127 13.785 -24.126 19.807 1.00 0.00 H new ATOM 0 HD2 PRO A 127 11.727 -23.279 21.378 1.00 0.00 H new ATOM 0 HD3 PRO A 127 13.174 -22.314 21.168 1.00 0.00 H new ATOM 1927 N SER A 128 9.653 -23.118 18.481 1.00 0.00 N ATOM 1928 CA SER A 128 8.420 -23.665 17.930 1.00 0.00 C ATOM 1929 C SER A 128 7.379 -23.871 19.026 1.00 0.00 C ATOM 1930 O SER A 128 7.714 -24.216 20.159 1.00 0.00 O ATOM 1931 CB SER A 128 8.698 -24.992 17.220 1.00 0.00 C ATOM 1932 OG SER A 128 7.497 -25.584 16.756 1.00 0.00 O ATOM 0 H SER A 128 9.811 -23.342 19.463 1.00 0.00 H new ATOM 0 HA SER A 128 8.026 -22.950 17.208 1.00 0.00 H new ATOM 0 HB2 SER A 128 9.372 -24.824 16.380 1.00 0.00 H new ATOM 0 HB3 SER A 128 9.203 -25.675 17.903 1.00 0.00 H new ATOM 0 HG SER A 128 7.702 -26.429 16.305 1.00 0.00 H new ATOM 1938 N SER A 129 6.114 -23.656 18.680 1.00 0.00 N ATOM 1939 CA SER A 129 5.022 -23.813 19.635 1.00 0.00 C ATOM 1940 C SER A 129 5.283 -24.992 20.568 1.00 0.00 C ATOM 1941 O SER A 129 5.074 -24.899 21.777 1.00 0.00 O ATOM 1942 CB SER A 129 3.697 -24.015 18.898 1.00 0.00 C ATOM 1943 OG SER A 129 3.130 -22.773 18.518 1.00 0.00 O ATOM 0 H SER A 129 5.819 -23.373 17.746 1.00 0.00 H new ATOM 0 HA SER A 129 4.961 -22.904 20.234 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.860 -24.630 18.013 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.000 -24.556 19.538 1.00 0.00 H new ATOM 0 HG SER A 129 2.285 -22.930 18.047 1.00 0.00 H new ATOM 1949 N GLY A 130 5.742 -26.101 19.997 1.00 0.00 N ATOM 1950 CA GLY A 130 6.024 -27.282 20.791 1.00 0.00 C ATOM 1951 C GLY A 130 4.889 -28.286 20.761 1.00 0.00 C ATOM 1952 O GLY A 130 4.721 -29.014 19.783 1.00 0.00 O ATOM 0 H GLY A 130 5.924 -26.203 18.998 1.00 0.00 H new ATOM 0 HA2 GLY A 130 6.934 -27.756 20.422 1.00 0.00 H new ATOM 0 HA3 GLY A 130 6.215 -26.985 21.822 1.00 0.00 H new TER 1956 GLY A 130