USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 859 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 104 HIS : no HD1:sc= -0.0531 X(o=-0.053,f=-0.053) USER MOD Set 2.1: A 56 LYS NZ :NH3+ -179:sc= 0.88 (180deg=0) USER MOD Set 2.2: A 81 THR OG1 : rot 109:sc= 2.02 USER MOD Set 2.3: A 84 ASN : amide:sc= -2.82! C(o=0.08!,f=-2.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -129:sc= 0.0436 (180deg=-0.319) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 8 GLN : amide:sc= 0.287 X(o=0.29,f=-0.12) USER MOD Single : A 15 GLN : amide:sc= 0.856 K(o=0.86,f=-1.2) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -1.3 K(o=-1.3,f=-3.3!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc=-0.00589 X(o=-0.0059,f=0) USER MOD Single : A 29 TYR OH : rot 30:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.0256 X(o=-0.026,f=0) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ -149:sc= 0.38 (180deg=0.0677) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -25:sc= 0.198 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc=-0.00569 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 6:sc= 0.875 USER MOD Single : A 75 TYR OH : rot 180:sc= -0.175 USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 1.66 K(o=1.7,f=-0.035) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 102 HIS : no HD1:sc= -0.218 X(o=-0.22,f=-0.22) USER MOD Single : A 103 HIS : no HD1:sc= -0.225 X(o=-0.23,f=-0.22) USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.509 -8.299 -2.763 1.00 0.00 N ATOM 2 CA MET A 1 -0.468 -7.561 -3.505 1.00 0.00 C ATOM 3 C MET A 1 0.272 -6.603 -2.573 1.00 0.00 C ATOM 4 O MET A 1 -0.207 -6.302 -1.480 1.00 0.00 O ATOM 5 CB MET A 1 -1.064 -6.787 -4.686 1.00 0.00 C ATOM 6 CG MET A 1 -1.708 -7.739 -5.696 1.00 0.00 C ATOM 7 SD MET A 1 -2.382 -6.900 -7.152 1.00 0.00 S ATOM 8 CE MET A 1 -3.009 -8.346 -8.049 1.00 0.00 C ATOM 0 H1 MET A 1 -1.407 -9.318 -2.943 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.406 -8.115 -1.745 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.449 -7.985 -3.078 1.00 0.00 H new ATOM 0 HA MET A 1 0.237 -8.292 -3.901 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.808 -6.079 -4.323 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.283 -6.205 -5.176 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.966 -8.470 -6.019 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.507 -8.292 -5.203 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.466 -8.024 -8.985 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.185 -9.027 -8.263 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.754 -8.858 -7.439 1.00 0.00 H new ATOM 20 N SER A 2 1.443 -6.129 -3.009 1.00 0.00 N ATOM 21 CA SER A 2 2.276 -5.219 -2.235 1.00 0.00 C ATOM 22 C SER A 2 2.929 -4.183 -3.147 1.00 0.00 C ATOM 23 O SER A 2 2.980 -4.363 -4.364 1.00 0.00 O ATOM 24 CB SER A 2 3.355 -6.013 -1.492 1.00 0.00 C ATOM 25 OG SER A 2 2.766 -6.973 -0.637 1.00 0.00 O ATOM 0 H SER A 2 1.838 -6.371 -3.918 1.00 0.00 H new ATOM 0 HA SER A 2 1.648 -4.698 -1.513 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.008 -6.509 -2.210 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.978 -5.334 -0.910 1.00 0.00 H new ATOM 0 HG SER A 2 3.469 -7.472 -0.172 1.00 0.00 H new ATOM 31 N GLU A 3 3.428 -3.096 -2.555 1.00 0.00 N ATOM 32 CA GLU A 3 4.075 -2.016 -3.289 1.00 0.00 C ATOM 33 C GLU A 3 5.411 -1.616 -2.652 1.00 0.00 C ATOM 34 O GLU A 3 6.025 -0.636 -3.067 1.00 0.00 O ATOM 35 CB GLU A 3 3.124 -0.818 -3.415 1.00 0.00 C ATOM 36 CG GLU A 3 2.827 -0.139 -2.074 1.00 0.00 C ATOM 37 CD GLU A 3 2.005 -1.025 -1.141 1.00 0.00 C ATOM 38 OE1 GLU A 3 0.766 -1.050 -1.316 1.00 0.00 O ATOM 39 OE2 GLU A 3 2.616 -1.673 -0.262 1.00 0.00 O ATOM 0 H GLU A 3 3.392 -2.943 -1.547 1.00 0.00 H new ATOM 0 HA GLU A 3 4.305 -2.376 -4.292 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.559 -0.087 -4.096 1.00 0.00 H new ATOM 0 HB3 GLU A 3 2.187 -1.151 -3.861 1.00 0.00 H new ATOM 0 HG2 GLU A 3 3.766 0.123 -1.587 1.00 0.00 H new ATOM 0 HG3 GLU A 3 2.290 0.792 -2.253 1.00 0.00 H new ATOM 46 N GLN A 4 5.863 -2.371 -1.644 1.00 0.00 N ATOM 47 CA GLN A 4 7.115 -2.114 -0.948 1.00 0.00 C ATOM 48 C GLN A 4 7.780 -3.428 -0.552 1.00 0.00 C ATOM 49 O GLN A 4 7.128 -4.469 -0.464 1.00 0.00 O ATOM 50 CB GLN A 4 6.835 -1.214 0.258 1.00 0.00 C ATOM 51 CG GLN A 4 8.091 -0.894 1.076 1.00 0.00 C ATOM 52 CD GLN A 4 7.806 0.119 2.179 1.00 0.00 C ATOM 53 OE1 GLN A 4 6.682 0.585 2.347 1.00 0.00 O ATOM 54 NE2 GLN A 4 8.832 0.472 2.950 1.00 0.00 N ATOM 0 H GLN A 4 5.360 -3.184 -1.290 1.00 0.00 H new ATOM 0 HA GLN A 4 7.814 -1.595 -1.604 1.00 0.00 H new ATOM 0 HB2 GLN A 4 6.387 -0.282 -0.088 1.00 0.00 H new ATOM 0 HB3 GLN A 4 6.103 -1.699 0.903 1.00 0.00 H new ATOM 0 HG2 GLN A 4 8.481 -1.811 1.517 1.00 0.00 H new ATOM 0 HG3 GLN A 4 8.865 -0.504 0.415 1.00 0.00 H new ATOM 0 HE21 GLN A 4 9.755 0.069 2.787 1.00 0.00 H new ATOM 0 HE22 GLN A 4 8.696 1.146 3.703 1.00 0.00 H new ATOM 63 N LEU A 5 9.091 -3.367 -0.315 1.00 0.00 N ATOM 64 CA LEU A 5 9.915 -4.523 -0.013 1.00 0.00 C ATOM 65 C LEU A 5 9.600 -5.089 1.369 1.00 0.00 C ATOM 66 O LEU A 5 9.069 -4.402 2.243 1.00 0.00 O ATOM 67 CB LEU A 5 11.388 -4.123 -0.126 1.00 0.00 C ATOM 68 CG LEU A 5 11.687 -3.367 -1.426 1.00 0.00 C ATOM 69 CD1 LEU A 5 13.186 -3.083 -1.503 1.00 0.00 C ATOM 70 CD2 LEU A 5 11.289 -4.171 -2.664 1.00 0.00 C ATOM 0 H LEU A 5 9.614 -2.491 -0.330 1.00 0.00 H new ATOM 0 HA LEU A 5 9.698 -5.314 -0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.659 -3.499 0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 5 12.010 -5.017 -0.077 1.00 0.00 H new ATOM 0 HG LEU A 5 11.105 -2.445 -1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 5 13.408 -2.545 -2.425 1.00 0.00 H new ATOM 0 HD12 LEU A 5 13.486 -2.477 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 5 13.736 -4.024 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.519 -3.596 -3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.843 -5.109 -2.682 1.00 0.00 H new ATOM 0 HD23 LEU A 5 10.220 -4.382 -2.633 1.00 0.00 H new ATOM 82 N THR A 6 9.939 -6.364 1.551 1.00 0.00 N ATOM 83 CA THR A 6 9.650 -7.127 2.756 1.00 0.00 C ATOM 84 C THR A 6 10.832 -8.023 3.100 1.00 0.00 C ATOM 85 O THR A 6 11.832 -8.052 2.382 1.00 0.00 O ATOM 86 CB THR A 6 8.392 -7.967 2.522 1.00 0.00 C ATOM 87 OG1 THR A 6 8.098 -8.778 3.636 1.00 0.00 O ATOM 88 CG2 THR A 6 8.558 -8.842 1.284 1.00 0.00 C ATOM 0 H THR A 6 10.435 -6.906 0.844 1.00 0.00 H new ATOM 0 HA THR A 6 9.481 -6.448 3.592 1.00 0.00 H new ATOM 0 HB THR A 6 7.562 -7.277 2.371 1.00 0.00 H new ATOM 0 HG1 THR A 6 7.289 -9.301 3.456 1.00 0.00 H new ATOM 0 HG21 THR A 6 7.655 -9.433 1.132 1.00 0.00 H new ATOM 0 HG22 THR A 6 8.729 -8.210 0.412 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.409 -9.509 1.421 1.00 0.00 H new ATOM 96 N ASP A 7 10.721 -8.759 4.203 1.00 0.00 N ATOM 97 CA ASP A 7 11.757 -9.672 4.654 1.00 0.00 C ATOM 98 C ASP A 7 12.033 -10.743 3.598 1.00 0.00 C ATOM 99 O ASP A 7 13.064 -11.405 3.651 1.00 0.00 O ATOM 100 CB ASP A 7 11.334 -10.304 5.977 1.00 0.00 C ATOM 101 CG ASP A 7 10.053 -11.127 5.850 1.00 0.00 C ATOM 102 OD1 ASP A 7 10.140 -12.261 5.329 1.00 0.00 O ATOM 103 OD2 ASP A 7 8.995 -10.616 6.277 1.00 0.00 O ATOM 0 H ASP A 7 9.902 -8.735 4.810 1.00 0.00 H new ATOM 0 HA ASP A 7 12.682 -9.117 4.807 1.00 0.00 H new ATOM 0 HB2 ASP A 7 12.137 -10.943 6.344 1.00 0.00 H new ATOM 0 HB3 ASP A 7 11.186 -9.520 6.719 1.00 0.00 H new ATOM 108 N GLN A 8 11.119 -10.924 2.637 1.00 0.00 N ATOM 109 CA GLN A 8 11.320 -11.922 1.595 1.00 0.00 C ATOM 110 C GLN A 8 12.443 -11.493 0.651 1.00 0.00 C ATOM 111 O GLN A 8 13.375 -12.255 0.410 1.00 0.00 O ATOM 112 CB GLN A 8 10.014 -12.126 0.820 1.00 0.00 C ATOM 113 CG GLN A 8 10.177 -13.153 -0.305 1.00 0.00 C ATOM 114 CD GLN A 8 10.613 -14.517 0.213 1.00 0.00 C ATOM 115 OE1 GLN A 8 9.784 -15.380 0.497 1.00 0.00 O ATOM 116 NE2 GLN A 8 11.919 -14.728 0.345 1.00 0.00 N ATOM 0 H GLN A 8 10.248 -10.398 2.564 1.00 0.00 H new ATOM 0 HA GLN A 8 11.610 -12.866 2.057 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.233 -12.457 1.504 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.688 -11.175 0.400 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.233 -13.255 -0.840 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.912 -12.788 -1.023 1.00 0.00 H new ATOM 0 HE21 GLN A 8 12.582 -13.992 0.101 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.258 -15.626 0.690 1.00 0.00 H new ATOM 125 N VAL A 9 12.356 -10.272 0.119 1.00 0.00 N ATOM 126 CA VAL A 9 13.317 -9.767 -0.850 1.00 0.00 C ATOM 127 C VAL A 9 14.565 -9.230 -0.152 1.00 0.00 C ATOM 128 O VAL A 9 15.646 -9.222 -0.740 1.00 0.00 O ATOM 129 CB VAL A 9 12.639 -8.707 -1.728 1.00 0.00 C ATOM 130 CG1 VAL A 9 11.899 -7.670 -0.887 1.00 0.00 C ATOM 131 CG2 VAL A 9 13.648 -7.970 -2.611 1.00 0.00 C ATOM 0 H VAL A 9 11.616 -9.610 0.351 1.00 0.00 H new ATOM 0 HA VAL A 9 13.651 -10.581 -1.494 1.00 0.00 H new ATOM 0 HB VAL A 9 11.930 -9.247 -2.356 1.00 0.00 H new ATOM 0 HG11 VAL A 9 11.432 -6.936 -1.543 1.00 0.00 H new ATOM 0 HG12 VAL A 9 11.132 -8.165 -0.291 1.00 0.00 H new ATOM 0 HG13 VAL A 9 12.604 -7.168 -0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 9 13.128 -7.228 -3.217 1.00 0.00 H new ATOM 0 HG22 VAL A 9 14.386 -7.472 -1.982 1.00 0.00 H new ATOM 0 HG23 VAL A 9 14.150 -8.684 -3.264 1.00 0.00 H new ATOM 141 N LEU A 10 14.434 -8.782 1.098 1.00 0.00 N ATOM 142 CA LEU A 10 15.573 -8.298 1.859 1.00 0.00 C ATOM 143 C LEU A 10 16.505 -9.447 2.231 1.00 0.00 C ATOM 144 O LEU A 10 17.708 -9.230 2.353 1.00 0.00 O ATOM 145 CB LEU A 10 15.068 -7.579 3.110 1.00 0.00 C ATOM 146 CG LEU A 10 14.881 -6.077 2.888 1.00 0.00 C ATOM 147 CD1 LEU A 10 14.097 -5.735 1.622 1.00 0.00 C ATOM 148 CD2 LEU A 10 14.136 -5.495 4.085 1.00 0.00 C ATOM 0 H LEU A 10 13.547 -8.747 1.600 1.00 0.00 H new ATOM 0 HA LEU A 10 16.144 -7.599 1.248 1.00 0.00 H new ATOM 0 HB2 LEU A 10 14.119 -8.018 3.419 1.00 0.00 H new ATOM 0 HB3 LEU A 10 15.774 -7.737 3.926 1.00 0.00 H new ATOM 0 HG LEU A 10 15.877 -5.650 2.773 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.005 -4.653 1.532 1.00 0.00 H new ATOM 0 HD12 LEU A 10 14.622 -6.128 0.751 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.104 -6.180 1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 10 13.995 -4.424 3.940 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.164 -5.979 4.179 1.00 0.00 H new ATOM 0 HD23 LEU A 10 14.716 -5.666 4.992 1.00 0.00 H new ATOM 160 N VAL A 11 15.981 -10.664 2.412 1.00 0.00 N ATOM 161 CA VAL A 11 16.832 -11.807 2.716 1.00 0.00 C ATOM 162 C VAL A 11 17.464 -12.343 1.434 1.00 0.00 C ATOM 163 O VAL A 11 18.550 -12.913 1.473 1.00 0.00 O ATOM 164 CB VAL A 11 16.044 -12.885 3.461 1.00 0.00 C ATOM 165 CG1 VAL A 11 16.867 -14.164 3.591 1.00 0.00 C ATOM 166 CG2 VAL A 11 15.722 -12.400 4.874 1.00 0.00 C ATOM 0 H VAL A 11 14.985 -10.876 2.353 1.00 0.00 H new ATOM 0 HA VAL A 11 17.638 -11.487 3.376 1.00 0.00 H new ATOM 0 HB VAL A 11 15.133 -13.084 2.897 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.287 -14.917 4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 11 17.120 -14.536 2.598 1.00 0.00 H new ATOM 0 HG13 VAL A 11 17.783 -13.953 4.143 1.00 0.00 H new ATOM 0 HG21 VAL A 11 15.160 -13.169 5.404 1.00 0.00 H new ATOM 0 HG22 VAL A 11 16.650 -12.195 5.409 1.00 0.00 H new ATOM 0 HG23 VAL A 11 15.126 -11.489 4.819 1.00 0.00 H new ATOM 176 N GLU A 12 16.805 -12.169 0.285 1.00 0.00 N ATOM 177 CA GLU A 12 17.388 -12.581 -0.983 1.00 0.00 C ATOM 178 C GLU A 12 18.524 -11.636 -1.373 1.00 0.00 C ATOM 179 O GLU A 12 19.527 -12.071 -1.933 1.00 0.00 O ATOM 180 CB GLU A 12 16.314 -12.563 -2.067 1.00 0.00 C ATOM 181 CG GLU A 12 15.334 -13.723 -1.899 1.00 0.00 C ATOM 182 CD GLU A 12 14.295 -13.717 -3.017 1.00 0.00 C ATOM 183 OE1 GLU A 12 14.696 -13.953 -4.179 1.00 0.00 O ATOM 184 OE2 GLU A 12 13.109 -13.477 -2.706 1.00 0.00 O ATOM 0 H GLU A 12 15.878 -11.750 0.212 1.00 0.00 H new ATOM 0 HA GLU A 12 17.787 -13.590 -0.879 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.772 -11.618 -2.029 1.00 0.00 H new ATOM 0 HB3 GLU A 12 16.784 -12.621 -3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.877 -14.668 -1.905 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.836 -13.648 -0.932 1.00 0.00 H new ATOM 191 N ARG A 13 18.373 -10.341 -1.076 1.00 0.00 N ATOM 192 CA ARG A 13 19.345 -9.332 -1.464 1.00 0.00 C ATOM 193 C ARG A 13 20.646 -9.475 -0.675 1.00 0.00 C ATOM 194 O ARG A 13 21.722 -9.267 -1.229 1.00 0.00 O ATOM 195 CB ARG A 13 18.688 -7.961 -1.277 1.00 0.00 C ATOM 196 CG ARG A 13 19.606 -6.822 -1.718 1.00 0.00 C ATOM 197 CD ARG A 13 18.823 -5.508 -1.786 1.00 0.00 C ATOM 198 NE ARG A 13 17.799 -5.545 -2.839 1.00 0.00 N ATOM 199 CZ ARG A 13 16.849 -4.619 -2.996 1.00 0.00 C ATOM 200 NH1 ARG A 13 16.779 -3.573 -2.181 1.00 0.00 N ATOM 201 NH2 ARG A 13 15.960 -4.746 -3.976 1.00 0.00 N ATOM 0 H ARG A 13 17.574 -9.971 -0.561 1.00 0.00 H new ATOM 0 HA ARG A 13 19.629 -9.456 -2.509 1.00 0.00 H new ATOM 0 HB2 ARG A 13 17.761 -7.922 -1.849 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.421 -7.827 -0.229 1.00 0.00 H new ATOM 0 HG2 ARG A 13 20.436 -6.723 -1.019 1.00 0.00 H new ATOM 0 HG3 ARG A 13 20.036 -7.049 -2.694 1.00 0.00 H new ATOM 0 HD2 ARG A 13 18.350 -5.315 -0.823 1.00 0.00 H new ATOM 0 HD3 ARG A 13 19.510 -4.683 -1.974 1.00 0.00 H new ATOM 0 HE ARG A 13 17.814 -6.328 -3.492 1.00 0.00 H new ATOM 0 HH11 ARG A 13 17.455 -3.470 -1.425 1.00 0.00 H new ATOM 0 HH12 ARG A 13 16.049 -2.873 -2.311 1.00 0.00 H new ATOM 0 HH21 ARG A 13 16.005 -5.548 -4.604 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.233 -4.041 -4.100 1.00 0.00 H new ATOM 215 N VAL A 14 20.567 -9.832 0.611 1.00 0.00 N ATOM 216 CA VAL A 14 21.764 -10.028 1.424 1.00 0.00 C ATOM 217 C VAL A 14 22.480 -11.323 1.050 1.00 0.00 C ATOM 218 O VAL A 14 23.681 -11.450 1.283 1.00 0.00 O ATOM 219 CB VAL A 14 21.411 -10.007 2.911 1.00 0.00 C ATOM 220 CG1 VAL A 14 20.764 -8.673 3.268 1.00 0.00 C ATOM 221 CG2 VAL A 14 20.454 -11.128 3.290 1.00 0.00 C ATOM 0 H VAL A 14 19.689 -9.990 1.106 1.00 0.00 H new ATOM 0 HA VAL A 14 22.448 -9.204 1.223 1.00 0.00 H new ATOM 0 HB VAL A 14 22.340 -10.148 3.464 1.00 0.00 H new ATOM 0 HG11 VAL A 14 20.514 -8.662 4.329 1.00 0.00 H new ATOM 0 HG12 VAL A 14 21.459 -7.862 3.051 1.00 0.00 H new ATOM 0 HG13 VAL A 14 19.856 -8.540 2.680 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.232 -11.072 4.356 1.00 0.00 H new ATOM 0 HG22 VAL A 14 19.530 -11.025 2.721 1.00 0.00 H new ATOM 0 HG23 VAL A 14 20.914 -12.090 3.065 1.00 0.00 H new ATOM 231 N GLN A 15 21.756 -12.284 0.469 1.00 0.00 N ATOM 232 CA GLN A 15 22.350 -13.517 -0.036 1.00 0.00 C ATOM 233 C GLN A 15 22.993 -13.287 -1.403 1.00 0.00 C ATOM 234 O GLN A 15 23.783 -14.113 -1.859 1.00 0.00 O ATOM 235 CB GLN A 15 21.277 -14.603 -0.127 1.00 0.00 C ATOM 236 CG GLN A 15 20.825 -15.046 1.269 1.00 0.00 C ATOM 237 CD GLN A 15 19.680 -16.057 1.190 1.00 0.00 C ATOM 238 OE1 GLN A 15 19.089 -16.261 0.133 1.00 0.00 O ATOM 239 NE2 GLN A 15 19.356 -16.701 2.305 1.00 0.00 N ATOM 0 H GLN A 15 20.746 -12.226 0.338 1.00 0.00 H new ATOM 0 HA GLN A 15 23.130 -13.841 0.653 1.00 0.00 H new ATOM 0 HB2 GLN A 15 20.421 -14.228 -0.688 1.00 0.00 H new ATOM 0 HB3 GLN A 15 21.667 -15.460 -0.676 1.00 0.00 H new ATOM 0 HG2 GLN A 15 21.667 -15.488 1.802 1.00 0.00 H new ATOM 0 HG3 GLN A 15 20.505 -14.176 1.843 1.00 0.00 H new ATOM 0 HE21 GLN A 15 19.864 -16.512 3.169 1.00 0.00 H new ATOM 0 HE22 GLN A 15 18.599 -17.385 2.297 1.00 0.00 H new ATOM 248 N LYS A 16 22.654 -12.171 -2.056 1.00 0.00 N ATOM 249 CA LYS A 16 23.214 -11.786 -3.346 1.00 0.00 C ATOM 250 C LYS A 16 24.442 -10.887 -3.192 1.00 0.00 C ATOM 251 O LYS A 16 24.983 -10.412 -4.189 1.00 0.00 O ATOM 252 CB LYS A 16 22.114 -11.150 -4.191 1.00 0.00 C ATOM 253 CG LYS A 16 21.137 -12.249 -4.618 1.00 0.00 C ATOM 254 CD LYS A 16 19.884 -11.645 -5.241 1.00 0.00 C ATOM 255 CE LYS A 16 18.875 -12.762 -5.507 1.00 0.00 C ATOM 256 NZ LYS A 16 17.633 -12.234 -6.109 1.00 0.00 N ATOM 0 H LYS A 16 21.973 -11.503 -1.694 1.00 0.00 H new ATOM 0 HA LYS A 16 23.576 -12.674 -3.864 1.00 0.00 H new ATOM 0 HB2 LYS A 16 21.594 -10.381 -3.620 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.542 -10.662 -5.067 1.00 0.00 H new ATOM 0 HG2 LYS A 16 21.620 -12.914 -5.334 1.00 0.00 H new ATOM 0 HG3 LYS A 16 20.864 -12.855 -3.754 1.00 0.00 H new ATOM 0 HD2 LYS A 16 19.453 -10.899 -4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 16 20.134 -11.134 -6.171 1.00 0.00 H new ATOM 0 HE2 LYS A 16 19.317 -13.503 -6.173 1.00 0.00 H new ATOM 0 HE3 LYS A 16 18.640 -13.272 -4.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 16.969 -13.016 -6.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 17.199 -11.545 -5.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 17.856 -11.769 -7.012 1.00 0.00 H new ATOM 270 N GLY A 17 24.885 -10.652 -1.952 1.00 0.00 N ATOM 271 CA GLY A 17 26.126 -9.939 -1.676 1.00 0.00 C ATOM 272 C GLY A 17 25.903 -8.490 -1.249 1.00 0.00 C ATOM 273 O GLY A 17 26.869 -7.763 -1.027 1.00 0.00 O ATOM 0 H GLY A 17 24.388 -10.954 -1.114 1.00 0.00 H new ATOM 0 HA2 GLY A 17 26.672 -10.463 -0.891 1.00 0.00 H new ATOM 0 HA3 GLY A 17 26.754 -9.956 -2.567 1.00 0.00 H new ATOM 277 N ASP A 18 24.647 -8.059 -1.129 1.00 0.00 N ATOM 278 CA ASP A 18 24.316 -6.708 -0.716 1.00 0.00 C ATOM 279 C ASP A 18 24.008 -6.686 0.777 1.00 0.00 C ATOM 280 O ASP A 18 22.853 -6.750 1.190 1.00 0.00 O ATOM 281 CB ASP A 18 23.136 -6.215 -1.554 1.00 0.00 C ATOM 282 CG ASP A 18 23.581 -5.769 -2.942 1.00 0.00 C ATOM 283 OD1 ASP A 18 24.282 -4.735 -3.017 1.00 0.00 O ATOM 284 OD2 ASP A 18 23.219 -6.464 -3.922 1.00 0.00 O ATOM 0 H ASP A 18 23.833 -8.644 -1.318 1.00 0.00 H new ATOM 0 HA ASP A 18 25.159 -6.037 -0.882 1.00 0.00 H new ATOM 0 HB2 ASP A 18 22.397 -7.011 -1.646 1.00 0.00 H new ATOM 0 HB3 ASP A 18 22.648 -5.385 -1.043 1.00 0.00 H new ATOM 289 N GLN A 19 25.063 -6.593 1.594 1.00 0.00 N ATOM 290 CA GLN A 19 24.940 -6.584 3.046 1.00 0.00 C ATOM 291 C GLN A 19 24.235 -5.312 3.522 1.00 0.00 C ATOM 292 O GLN A 19 23.737 -5.261 4.644 1.00 0.00 O ATOM 293 CB GLN A 19 26.346 -6.743 3.640 1.00 0.00 C ATOM 294 CG GLN A 19 26.332 -6.871 5.168 1.00 0.00 C ATOM 295 CD GLN A 19 26.302 -5.524 5.888 1.00 0.00 C ATOM 296 OE1 GLN A 19 26.496 -4.470 5.287 1.00 0.00 O ATOM 297 NE2 GLN A 19 26.056 -5.548 7.195 1.00 0.00 N ATOM 0 H GLN A 19 26.025 -6.522 1.261 1.00 0.00 H new ATOM 0 HA GLN A 19 24.320 -7.412 3.389 1.00 0.00 H new ATOM 0 HB2 GLN A 19 26.820 -7.625 3.210 1.00 0.00 H new ATOM 0 HB3 GLN A 19 26.955 -5.884 3.357 1.00 0.00 H new ATOM 0 HG2 GLN A 19 25.462 -7.455 5.469 1.00 0.00 H new ATOM 0 HG3 GLN A 19 27.214 -7.426 5.487 1.00 0.00 H new ATOM 0 HE21 GLN A 19 25.899 -6.438 7.668 1.00 0.00 H new ATOM 0 HE22 GLN A 19 26.025 -4.677 7.724 1.00 0.00 H new ATOM 306 N LYS A 20 24.187 -4.280 2.672 1.00 0.00 N ATOM 307 CA LYS A 20 23.496 -3.036 2.982 1.00 0.00 C ATOM 308 C LYS A 20 22.011 -3.286 3.222 1.00 0.00 C ATOM 309 O LYS A 20 21.355 -2.503 3.904 1.00 0.00 O ATOM 310 CB LYS A 20 23.702 -2.060 1.819 1.00 0.00 C ATOM 311 CG LYS A 20 23.032 -2.569 0.539 1.00 0.00 C ATOM 312 CD LYS A 20 23.369 -1.658 -0.641 1.00 0.00 C ATOM 313 CE LYS A 20 22.627 -2.150 -1.884 1.00 0.00 C ATOM 314 NZ LYS A 20 22.966 -1.342 -3.068 1.00 0.00 N ATOM 0 H LYS A 20 24.628 -4.290 1.752 1.00 0.00 H new ATOM 0 HA LYS A 20 23.906 -2.608 3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 20 23.293 -1.085 2.083 1.00 0.00 H new ATOM 0 HB3 LYS A 20 24.769 -1.921 1.643 1.00 0.00 H new ATOM 0 HG2 LYS A 20 23.364 -3.585 0.327 1.00 0.00 H new ATOM 0 HG3 LYS A 20 21.952 -2.609 0.678 1.00 0.00 H new ATOM 0 HD2 LYS A 20 23.084 -0.630 -0.416 1.00 0.00 H new ATOM 0 HD3 LYS A 20 24.444 -1.658 -0.821 1.00 0.00 H new ATOM 0 HE2 LYS A 20 22.879 -3.194 -2.070 1.00 0.00 H new ATOM 0 HE3 LYS A 20 21.552 -2.108 -1.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 22.446 -1.701 -3.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 22.703 -0.350 -2.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 23.988 -1.403 -3.249 1.00 0.00 H new ATOM 328 N ALA A 21 21.473 -4.377 2.668 1.00 0.00 N ATOM 329 CA ALA A 21 20.075 -4.718 2.846 1.00 0.00 C ATOM 330 C ALA A 21 19.854 -5.427 4.181 1.00 0.00 C ATOM 331 O ALA A 21 18.726 -5.484 4.664 1.00 0.00 O ATOM 332 CB ALA A 21 19.612 -5.575 1.672 1.00 0.00 C ATOM 0 H ALA A 21 21.995 -5.037 2.091 1.00 0.00 H new ATOM 0 HA ALA A 21 19.479 -3.805 2.867 1.00 0.00 H new ATOM 0 HB1 ALA A 21 18.561 -5.833 1.802 1.00 0.00 H new ATOM 0 HB2 ALA A 21 19.736 -5.018 0.743 1.00 0.00 H new ATOM 0 HB3 ALA A 21 20.207 -6.487 1.630 1.00 0.00 H new ATOM 338 N PHE A 22 20.916 -5.967 4.788 1.00 0.00 N ATOM 339 CA PHE A 22 20.799 -6.609 6.087 1.00 0.00 C ATOM 340 C PHE A 22 20.718 -5.533 7.160 1.00 0.00 C ATOM 341 O PHE A 22 19.989 -5.680 8.136 1.00 0.00 O ATOM 342 CB PHE A 22 21.986 -7.540 6.335 1.00 0.00 C ATOM 343 CG PHE A 22 21.837 -8.337 7.614 1.00 0.00 C ATOM 344 CD1 PHE A 22 20.805 -9.277 7.725 1.00 0.00 C ATOM 345 CD2 PHE A 22 22.722 -8.135 8.683 1.00 0.00 C ATOM 346 CE1 PHE A 22 20.652 -10.012 8.908 1.00 0.00 C ATOM 347 CE2 PHE A 22 22.568 -8.866 9.867 1.00 0.00 C ATOM 348 CZ PHE A 22 21.532 -9.805 9.978 1.00 0.00 C ATOM 0 H PHE A 22 21.858 -5.969 4.398 1.00 0.00 H new ATOM 0 HA PHE A 22 19.894 -7.216 6.117 1.00 0.00 H new ATOM 0 HB2 PHE A 22 22.089 -8.225 5.493 1.00 0.00 H new ATOM 0 HB3 PHE A 22 22.902 -6.952 6.381 1.00 0.00 H new ATOM 0 HD1 PHE A 22 20.127 -9.435 6.899 1.00 0.00 H new ATOM 0 HD2 PHE A 22 23.522 -7.415 8.593 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.857 -10.737 8.995 1.00 0.00 H new ATOM 0 HE2 PHE A 22 23.245 -8.707 10.693 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.412 -10.370 10.891 1.00 0.00 H new ATOM 358 N ASN A 23 21.460 -4.439 6.983 1.00 0.00 N ATOM 359 CA ASN A 23 21.426 -3.320 7.910 1.00 0.00 C ATOM 360 C ASN A 23 20.021 -2.719 7.952 1.00 0.00 C ATOM 361 O ASN A 23 19.528 -2.350 9.016 1.00 0.00 O ATOM 362 CB ASN A 23 22.444 -2.293 7.425 1.00 0.00 C ATOM 363 CG ASN A 23 22.238 -0.934 8.072 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.640 -0.703 9.211 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.604 -0.026 7.338 1.00 0.00 N ATOM 0 H ASN A 23 22.096 -4.309 6.196 1.00 0.00 H new ATOM 0 HA ASN A 23 21.675 -3.643 8.921 1.00 0.00 H new ATOM 0 HB2 ASN A 23 23.450 -2.649 7.644 1.00 0.00 H new ATOM 0 HB3 ASN A 23 22.370 -2.193 6.342 1.00 0.00 H new ATOM 0 HD21 ASN A 23 21.434 0.906 7.715 1.00 0.00 H new ATOM 0 HD22 ASN A 23 21.288 -0.261 6.397 1.00 0.00 H new ATOM 372 N LEU A 24 19.381 -2.624 6.785 1.00 0.00 N ATOM 373 CA LEU A 24 18.022 -2.115 6.677 1.00 0.00 C ATOM 374 C LEU A 24 16.997 -3.156 7.132 1.00 0.00 C ATOM 375 O LEU A 24 15.860 -2.801 7.442 1.00 0.00 O ATOM 376 CB LEU A 24 17.760 -1.713 5.225 1.00 0.00 C ATOM 377 CG LEU A 24 18.697 -0.591 4.764 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.494 -0.353 3.270 1.00 0.00 C ATOM 379 CD2 LEU A 24 18.418 0.712 5.517 1.00 0.00 C ATOM 0 H LEU A 24 19.793 -2.898 5.893 1.00 0.00 H new ATOM 0 HA LEU A 24 17.917 -1.248 7.330 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.889 -2.582 4.579 1.00 0.00 H new ATOM 0 HB3 LEU A 24 16.725 -1.388 5.120 1.00 0.00 H new ATOM 0 HG LEU A 24 19.723 -0.896 4.970 1.00 0.00 H new ATOM 0 HD11 LEU A 24 19.158 0.444 2.935 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.720 -1.268 2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 24 17.459 -0.065 3.085 1.00 0.00 H new ATOM 0 HD21 LEU A 24 19.099 1.488 5.167 1.00 0.00 H new ATOM 0 HD22 LEU A 24 17.389 1.024 5.336 1.00 0.00 H new ATOM 0 HD23 LEU A 24 18.567 0.554 6.585 1.00 0.00 H new ATOM 391 N LEU A 25 17.386 -4.431 7.175 1.00 0.00 N ATOM 392 CA LEU A 25 16.515 -5.504 7.634 1.00 0.00 C ATOM 393 C LEU A 25 16.539 -5.615 9.156 1.00 0.00 C ATOM 394 O LEU A 25 15.483 -5.715 9.777 1.00 0.00 O ATOM 395 CB LEU A 25 16.939 -6.807 6.945 1.00 0.00 C ATOM 396 CG LEU A 25 16.113 -8.023 7.368 1.00 0.00 C ATOM 397 CD1 LEU A 25 14.642 -7.875 6.987 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.679 -9.254 6.666 1.00 0.00 C ATOM 0 H LEU A 25 18.314 -4.745 6.892 1.00 0.00 H new ATOM 0 HA LEU A 25 15.481 -5.289 7.364 1.00 0.00 H new ATOM 0 HB2 LEU A 25 16.856 -6.680 5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 25 17.989 -6.998 7.164 1.00 0.00 H new ATOM 0 HG LEU A 25 16.171 -8.117 8.452 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.093 -8.761 7.306 1.00 0.00 H new ATOM 0 HD12 LEU A 25 14.226 -6.994 7.476 1.00 0.00 H new ATOM 0 HD13 LEU A 25 14.555 -7.764 5.906 1.00 0.00 H new ATOM 0 HD21 LEU A 25 16.104 -10.134 6.954 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.617 -9.118 5.586 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.721 -9.391 6.955 1.00 0.00 H new ATOM 410 N VAL A 26 17.720 -5.594 9.778 1.00 0.00 N ATOM 411 CA VAL A 26 17.791 -5.795 11.221 1.00 0.00 C ATOM 412 C VAL A 26 17.213 -4.614 11.977 1.00 0.00 C ATOM 413 O VAL A 26 16.783 -4.792 13.109 1.00 0.00 O ATOM 414 CB VAL A 26 19.213 -6.076 11.708 1.00 0.00 C ATOM 415 CG1 VAL A 26 19.823 -7.268 10.978 1.00 0.00 C ATOM 416 CG2 VAL A 26 20.115 -4.849 11.583 1.00 0.00 C ATOM 0 H VAL A 26 18.617 -5.444 9.317 1.00 0.00 H new ATOM 0 HA VAL A 26 17.188 -6.679 11.429 1.00 0.00 H new ATOM 0 HB VAL A 26 19.140 -6.323 12.767 1.00 0.00 H new ATOM 0 HG11 VAL A 26 20.834 -7.442 11.347 1.00 0.00 H new ATOM 0 HG12 VAL A 26 19.214 -8.154 11.156 1.00 0.00 H new ATOM 0 HG13 VAL A 26 19.858 -7.061 9.908 1.00 0.00 H new ATOM 0 HG21 VAL A 26 21.115 -5.095 11.940 1.00 0.00 H new ATOM 0 HG22 VAL A 26 20.168 -4.541 10.539 1.00 0.00 H new ATOM 0 HG23 VAL A 26 19.706 -4.034 12.181 1.00 0.00 H new ATOM 426 N VAL A 27 17.187 -3.412 11.388 1.00 0.00 N ATOM 427 CA VAL A 27 16.645 -2.255 12.097 1.00 0.00 C ATOM 428 C VAL A 27 15.129 -2.385 12.264 1.00 0.00 C ATOM 429 O VAL A 27 14.567 -1.833 13.212 1.00 0.00 O ATOM 430 CB VAL A 27 17.065 -0.956 11.401 1.00 0.00 C ATOM 431 CG1 VAL A 27 16.458 -0.837 10.005 1.00 0.00 C ATOM 432 CG2 VAL A 27 16.647 0.263 12.224 1.00 0.00 C ATOM 0 H VAL A 27 17.527 -3.221 10.445 1.00 0.00 H new ATOM 0 HA VAL A 27 17.063 -2.220 13.103 1.00 0.00 H new ATOM 0 HB VAL A 27 18.151 -0.988 11.311 1.00 0.00 H new ATOM 0 HG11 VAL A 27 16.781 0.098 9.546 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.789 -1.675 9.392 1.00 0.00 H new ATOM 0 HG13 VAL A 27 15.371 -0.848 10.079 1.00 0.00 H new ATOM 0 HG21 VAL A 27 16.956 1.173 11.709 1.00 0.00 H new ATOM 0 HG22 VAL A 27 15.564 0.265 12.346 1.00 0.00 H new ATOM 0 HG23 VAL A 27 17.123 0.221 13.204 1.00 0.00 H new ATOM 442 N ARG A 28 14.456 -3.110 11.359 1.00 0.00 N ATOM 443 CA ARG A 28 13.027 -3.368 11.495 1.00 0.00 C ATOM 444 C ARG A 28 12.786 -4.269 12.697 1.00 0.00 C ATOM 445 O ARG A 28 11.766 -4.160 13.372 1.00 0.00 O ATOM 446 CB ARG A 28 12.492 -4.058 10.235 1.00 0.00 C ATOM 447 CG ARG A 28 12.899 -3.331 8.950 1.00 0.00 C ATOM 448 CD ARG A 28 12.281 -4.010 7.727 1.00 0.00 C ATOM 449 NE ARG A 28 10.824 -3.845 7.697 1.00 0.00 N ATOM 450 CZ ARG A 28 10.079 -3.889 6.588 1.00 0.00 C ATOM 451 NH1 ARG A 28 10.635 -4.096 5.396 1.00 0.00 N ATOM 452 NH2 ARG A 28 8.763 -3.724 6.667 1.00 0.00 N ATOM 0 H ARG A 28 14.882 -3.524 10.530 1.00 0.00 H new ATOM 0 HA ARG A 28 12.509 -2.419 11.632 1.00 0.00 H new ATOM 0 HB2 ARG A 28 12.862 -5.083 10.201 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.405 -4.113 10.289 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.576 -2.291 8.997 1.00 0.00 H new ATOM 0 HG3 ARG A 28 13.985 -3.324 8.858 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.714 -3.590 6.819 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.527 -5.072 7.736 1.00 0.00 H new ATOM 0 HE ARG A 28 10.346 -3.686 8.584 1.00 0.00 H new ATOM 0 HH11 ARG A 28 11.644 -4.224 5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.052 -4.127 4.560 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.323 -3.564 7.573 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.193 -3.757 5.822 1.00 0.00 H new ATOM 466 N TYR A 29 13.744 -5.161 12.961 1.00 0.00 N ATOM 467 CA TYR A 29 13.653 -6.118 14.055 1.00 0.00 C ATOM 468 C TYR A 29 14.424 -5.666 15.293 1.00 0.00 C ATOM 469 O TYR A 29 14.302 -6.284 16.342 1.00 0.00 O ATOM 470 CB TYR A 29 14.133 -7.477 13.558 1.00 0.00 C ATOM 471 CG TYR A 29 13.188 -8.086 12.548 1.00 0.00 C ATOM 472 CD1 TYR A 29 13.202 -7.660 11.213 1.00 0.00 C ATOM 473 CD2 TYR A 29 12.278 -9.072 12.959 1.00 0.00 C ATOM 474 CE1 TYR A 29 12.296 -8.194 10.288 1.00 0.00 C ATOM 475 CE2 TYR A 29 11.368 -9.615 12.042 1.00 0.00 C ATOM 476 CZ TYR A 29 11.371 -9.177 10.700 1.00 0.00 C ATOM 477 OH TYR A 29 10.481 -9.702 9.811 1.00 0.00 O ATOM 0 H TYR A 29 14.604 -5.236 12.418 1.00 0.00 H new ATOM 0 HA TYR A 29 12.612 -6.191 14.369 1.00 0.00 H new ATOM 0 HB2 TYR A 29 15.120 -7.369 13.109 1.00 0.00 H new ATOM 0 HB3 TYR A 29 14.241 -8.154 14.406 1.00 0.00 H new ATOM 0 HD1 TYR A 29 13.916 -6.915 10.895 1.00 0.00 H new ATOM 0 HD2 TYR A 29 12.279 -9.413 13.984 1.00 0.00 H new ATOM 0 HE1 TYR A 29 12.305 -7.855 9.263 1.00 0.00 H new ATOM 0 HE2 TYR A 29 10.664 -10.369 12.362 1.00 0.00 H new ATOM 0 HH TYR A 29 10.872 -9.693 8.912 1.00 0.00 H new ATOM 487 N GLN A 30 15.217 -4.602 15.202 1.00 0.00 N ATOM 488 CA GLN A 30 16.039 -4.163 16.317 1.00 0.00 C ATOM 489 C GLN A 30 15.161 -3.750 17.499 1.00 0.00 C ATOM 490 O GLN A 30 15.581 -3.862 18.649 1.00 0.00 O ATOM 491 CB GLN A 30 16.939 -3.031 15.817 1.00 0.00 C ATOM 492 CG GLN A 30 18.014 -2.642 16.830 1.00 0.00 C ATOM 493 CD GLN A 30 18.985 -1.648 16.206 1.00 0.00 C ATOM 494 OE1 GLN A 30 19.062 -0.493 16.617 1.00 0.00 O ATOM 495 NE2 GLN A 30 19.734 -2.095 15.198 1.00 0.00 N ATOM 0 H GLN A 30 15.305 -4.029 14.363 1.00 0.00 H new ATOM 0 HA GLN A 30 16.670 -4.972 16.684 1.00 0.00 H new ATOM 0 HB2 GLN A 30 17.416 -3.336 14.886 1.00 0.00 H new ATOM 0 HB3 GLN A 30 16.326 -2.158 15.590 1.00 0.00 H new ATOM 0 HG2 GLN A 30 17.550 -2.204 17.714 1.00 0.00 H new ATOM 0 HG3 GLN A 30 18.553 -3.530 17.160 1.00 0.00 H new ATOM 0 HE21 GLN A 30 19.642 -3.061 14.884 1.00 0.00 H new ATOM 0 HE22 GLN A 30 20.399 -1.471 14.741 1.00 0.00 H new ATOM 504 N HIS A 31 13.940 -3.278 17.220 1.00 0.00 N ATOM 505 CA HIS A 31 12.985 -2.937 18.266 1.00 0.00 C ATOM 506 C HIS A 31 12.157 -4.152 18.698 1.00 0.00 C ATOM 507 O HIS A 31 11.776 -4.257 19.864 1.00 0.00 O ATOM 508 CB HIS A 31 12.082 -1.810 17.764 1.00 0.00 C ATOM 509 CG HIS A 31 11.114 -1.322 18.809 1.00 0.00 C ATOM 510 ND1 HIS A 31 11.454 -0.548 19.921 1.00 0.00 N ATOM 511 CD2 HIS A 31 9.773 -1.568 18.825 1.00 0.00 C ATOM 512 CE1 HIS A 31 10.300 -0.344 20.578 1.00 0.00 C ATOM 513 NE2 HIS A 31 9.277 -0.943 19.944 1.00 0.00 N ATOM 0 H HIS A 31 13.595 -3.125 16.272 1.00 0.00 H new ATOM 0 HA HIS A 31 13.533 -2.603 19.147 1.00 0.00 H new ATOM 0 HB2 HIS A 31 12.701 -0.976 17.432 1.00 0.00 H new ATOM 0 HB3 HIS A 31 11.524 -2.159 16.895 1.00 0.00 H new ATOM 0 HD2 HIS A 31 9.212 -2.141 18.102 1.00 0.00 H new ATOM 0 HE1 HIS A 31 10.207 0.224 21.492 1.00 0.00 H new ATOM 0 HE2 HIS A 31 8.302 -0.935 20.242 1.00 0.00 H new ATOM 521 N LYS A 32 11.873 -5.077 17.771 1.00 0.00 N ATOM 522 CA LYS A 32 11.015 -6.224 18.065 1.00 0.00 C ATOM 523 C LYS A 32 11.780 -7.347 18.758 1.00 0.00 C ATOM 524 O LYS A 32 11.217 -8.061 19.587 1.00 0.00 O ATOM 525 CB LYS A 32 10.381 -6.737 16.771 1.00 0.00 C ATOM 526 CG LYS A 32 9.525 -5.656 16.114 1.00 0.00 C ATOM 527 CD LYS A 32 8.769 -6.208 14.904 1.00 0.00 C ATOM 528 CE LYS A 32 9.735 -6.703 13.826 1.00 0.00 C ATOM 529 NZ LYS A 32 9.006 -7.224 12.653 1.00 0.00 N ATOM 0 H LYS A 32 12.226 -5.050 16.814 1.00 0.00 H new ATOM 0 HA LYS A 32 10.236 -5.892 18.751 1.00 0.00 H new ATOM 0 HB2 LYS A 32 11.162 -7.056 16.081 1.00 0.00 H new ATOM 0 HB3 LYS A 32 9.767 -7.612 16.985 1.00 0.00 H new ATOM 0 HG2 LYS A 32 8.815 -5.260 16.840 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.159 -4.826 15.802 1.00 0.00 H new ATOM 0 HD2 LYS A 32 8.121 -7.026 15.219 1.00 0.00 H new ATOM 0 HD3 LYS A 32 8.124 -5.433 14.490 1.00 0.00 H new ATOM 0 HE2 LYS A 32 10.389 -5.887 13.518 1.00 0.00 H new ATOM 0 HE3 LYS A 32 10.373 -7.485 14.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.561 -7.983 12.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 8.085 -7.600 12.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 8.858 -6.456 11.967 1.00 0.00 H new ATOM 543 N VAL A 33 13.061 -7.508 18.428 1.00 0.00 N ATOM 544 CA VAL A 33 13.910 -8.529 19.015 1.00 0.00 C ATOM 545 C VAL A 33 14.267 -8.117 20.433 1.00 0.00 C ATOM 546 O VAL A 33 14.327 -8.953 21.332 1.00 0.00 O ATOM 547 CB VAL A 33 15.179 -8.653 18.171 1.00 0.00 C ATOM 548 CG1 VAL A 33 16.094 -9.733 18.696 1.00 0.00 C ATOM 549 CG2 VAL A 33 14.898 -9.149 16.765 1.00 0.00 C ATOM 0 H VAL A 33 13.537 -6.925 17.739 1.00 0.00 H new ATOM 0 HA VAL A 33 13.394 -9.489 19.040 1.00 0.00 H new ATOM 0 HB VAL A 33 15.606 -7.650 18.199 1.00 0.00 H new ATOM 0 HG11 VAL A 33 16.985 -9.791 18.070 1.00 0.00 H new ATOM 0 HG12 VAL A 33 16.384 -9.498 19.720 1.00 0.00 H new ATOM 0 HG13 VAL A 33 15.574 -10.691 18.677 1.00 0.00 H new ATOM 0 HG21 VAL A 33 15.833 -9.218 16.210 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.431 -10.133 16.813 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.228 -8.453 16.261 1.00 0.00 H new ATOM 559 N ALA A 34 14.504 -6.821 20.641 1.00 0.00 N ATOM 560 CA ALA A 34 14.816 -6.303 21.961 1.00 0.00 C ATOM 561 C ALA A 34 13.629 -6.473 22.909 1.00 0.00 C ATOM 562 O ALA A 34 13.816 -6.517 24.123 1.00 0.00 O ATOM 563 CB ALA A 34 15.181 -4.824 21.836 1.00 0.00 C ATOM 0 H ALA A 34 14.484 -6.114 19.906 1.00 0.00 H new ATOM 0 HA ALA A 34 15.656 -6.861 22.375 1.00 0.00 H new ATOM 0 HB1 ALA A 34 15.418 -4.423 22.822 1.00 0.00 H new ATOM 0 HB2 ALA A 34 16.047 -4.717 21.183 1.00 0.00 H new ATOM 0 HB3 ALA A 34 14.339 -4.276 21.414 1.00 0.00 H new ATOM 569 N SER A 35 12.408 -6.570 22.373 1.00 0.00 N ATOM 570 CA SER A 35 11.219 -6.725 23.198 1.00 0.00 C ATOM 571 C SER A 35 11.122 -8.138 23.756 1.00 0.00 C ATOM 572 O SER A 35 10.855 -8.321 24.943 1.00 0.00 O ATOM 573 CB SER A 35 9.987 -6.404 22.355 1.00 0.00 C ATOM 574 OG SER A 35 8.831 -6.412 23.168 1.00 0.00 O ATOM 0 H SER A 35 12.223 -6.543 21.370 1.00 0.00 H new ATOM 0 HA SER A 35 11.279 -6.039 24.043 1.00 0.00 H new ATOM 0 HB2 SER A 35 10.103 -5.428 21.883 1.00 0.00 H new ATOM 0 HB3 SER A 35 9.883 -7.136 21.554 1.00 0.00 H new ATOM 0 HG SER A 35 8.045 -6.204 22.621 1.00 0.00 H new ATOM 580 N LEU A 36 11.337 -9.151 22.910 1.00 0.00 N ATOM 581 CA LEU A 36 11.204 -10.531 23.346 1.00 0.00 C ATOM 582 C LEU A 36 12.440 -10.998 24.103 1.00 0.00 C ATOM 583 O LEU A 36 12.330 -11.859 24.975 1.00 0.00 O ATOM 584 CB LEU A 36 10.889 -11.436 22.146 1.00 0.00 C ATOM 585 CG LEU A 36 12.083 -11.681 21.214 1.00 0.00 C ATOM 586 CD1 LEU A 36 12.918 -12.884 21.653 1.00 0.00 C ATOM 587 CD2 LEU A 36 11.565 -11.990 19.820 1.00 0.00 C ATOM 0 H LEU A 36 11.601 -9.036 21.931 1.00 0.00 H new ATOM 0 HA LEU A 36 10.370 -10.595 24.044 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.527 -12.396 22.514 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.079 -10.989 21.570 1.00 0.00 H new ATOM 0 HG LEU A 36 12.702 -10.784 21.239 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.752 -13.019 20.964 1.00 0.00 H new ATOM 0 HD12 LEU A 36 13.302 -12.713 22.659 1.00 0.00 H new ATOM 0 HD13 LEU A 36 12.296 -13.779 21.650 1.00 0.00 H new ATOM 0 HD21 LEU A 36 12.406 -12.166 19.150 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.936 -12.880 19.854 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.980 -11.146 19.454 1.00 0.00 H new ATOM 599 N VAL A 37 13.612 -10.442 23.781 1.00 0.00 N ATOM 600 CA VAL A 37 14.851 -10.857 24.428 1.00 0.00 C ATOM 601 C VAL A 37 15.054 -10.145 25.762 1.00 0.00 C ATOM 602 O VAL A 37 15.870 -10.578 26.571 1.00 0.00 O ATOM 603 CB VAL A 37 16.020 -10.694 23.448 1.00 0.00 C ATOM 604 CG1 VAL A 37 16.538 -9.265 23.398 1.00 0.00 C ATOM 605 CG2 VAL A 37 17.171 -11.609 23.842 1.00 0.00 C ATOM 0 H VAL A 37 13.724 -9.709 23.081 1.00 0.00 H new ATOM 0 HA VAL A 37 14.795 -11.915 24.685 1.00 0.00 H new ATOM 0 HB VAL A 37 15.638 -10.959 22.462 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.365 -9.202 22.690 1.00 0.00 H new ATOM 0 HG12 VAL A 37 15.736 -8.598 23.080 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.885 -8.969 24.388 1.00 0.00 H new ATOM 0 HG21 VAL A 37 17.993 -11.483 23.138 1.00 0.00 H new ATOM 0 HG22 VAL A 37 17.511 -11.355 24.846 1.00 0.00 H new ATOM 0 HG23 VAL A 37 16.834 -12.646 23.824 1.00 0.00 H new ATOM 615 N SER A 38 14.316 -9.057 26.016 1.00 0.00 N ATOM 616 CA SER A 38 14.340 -8.392 27.316 1.00 0.00 C ATOM 617 C SER A 38 13.709 -9.298 28.376 1.00 0.00 C ATOM 618 O SER A 38 13.820 -9.038 29.574 1.00 0.00 O ATOM 619 CB SER A 38 13.596 -7.054 27.220 1.00 0.00 C ATOM 620 OG SER A 38 13.689 -6.347 28.439 1.00 0.00 O ATOM 0 H SER A 38 13.695 -8.621 25.334 1.00 0.00 H new ATOM 0 HA SER A 38 15.371 -8.195 27.610 1.00 0.00 H new ATOM 0 HB2 SER A 38 14.016 -6.455 26.412 1.00 0.00 H new ATOM 0 HB3 SER A 38 12.549 -7.230 26.974 1.00 0.00 H new ATOM 0 HG SER A 38 13.838 -6.979 29.173 1.00 0.00 H new ATOM 626 N ARG A 39 13.046 -10.377 27.941 1.00 0.00 N ATOM 627 CA ARG A 39 12.474 -11.372 28.837 1.00 0.00 C ATOM 628 C ARG A 39 13.509 -12.420 29.251 1.00 0.00 C ATOM 629 O ARG A 39 13.217 -13.261 30.100 1.00 0.00 O ATOM 630 CB ARG A 39 11.283 -12.053 28.162 1.00 0.00 C ATOM 631 CG ARG A 39 10.254 -11.033 27.672 1.00 0.00 C ATOM 632 CD ARG A 39 9.063 -11.756 27.046 1.00 0.00 C ATOM 633 NE ARG A 39 9.481 -12.595 25.915 1.00 0.00 N ATOM 634 CZ ARG A 39 8.655 -13.395 25.236 1.00 0.00 C ATOM 635 NH1 ARG A 39 7.363 -13.462 25.551 1.00 0.00 N ATOM 636 NH2 ARG A 39 9.116 -14.131 24.228 1.00 0.00 N ATOM 0 H ARG A 39 12.894 -10.579 26.953 1.00 0.00 H new ATOM 0 HA ARG A 39 12.141 -10.859 29.739 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.634 -12.650 27.320 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.810 -12.739 28.864 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.918 -10.414 28.504 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.710 -10.365 26.941 1.00 0.00 H new ATOM 0 HD2 ARG A 39 8.574 -12.374 27.799 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.329 -11.025 26.707 1.00 0.00 H new ATOM 0 HE ARG A 39 10.460 -12.565 25.631 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.995 -12.899 26.318 1.00 0.00 H new ATOM 0 HH12 ARG A 39 6.741 -14.077 25.026 1.00 0.00 H new ATOM 0 HH21 ARG A 39 10.102 -14.085 23.972 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.483 -14.741 23.711 1.00 0.00 H new ATOM 650 N TYR A 40 14.709 -12.375 28.659 1.00 0.00 N ATOM 651 CA TYR A 40 15.752 -13.357 28.922 1.00 0.00 C ATOM 652 C TYR A 40 17.044 -12.710 29.431 1.00 0.00 C ATOM 653 O TYR A 40 17.914 -13.421 29.930 1.00 0.00 O ATOM 654 CB TYR A 40 16.000 -14.172 27.654 1.00 0.00 C ATOM 655 CG TYR A 40 14.797 -14.968 27.192 1.00 0.00 C ATOM 656 CD1 TYR A 40 14.516 -16.215 27.771 1.00 0.00 C ATOM 657 CD2 TYR A 40 13.964 -14.466 26.180 1.00 0.00 C ATOM 658 CE1 TYR A 40 13.396 -16.951 27.361 1.00 0.00 C ATOM 659 CE2 TYR A 40 12.846 -15.201 25.755 1.00 0.00 C ATOM 660 CZ TYR A 40 12.554 -16.443 26.354 1.00 0.00 C ATOM 661 OH TYR A 40 11.462 -17.153 25.955 1.00 0.00 O ATOM 0 H TYR A 40 14.977 -11.656 27.987 1.00 0.00 H new ATOM 0 HA TYR A 40 15.412 -14.018 29.719 1.00 0.00 H new ATOM 0 HB2 TYR A 40 16.306 -13.498 26.854 1.00 0.00 H new ATOM 0 HB3 TYR A 40 16.830 -14.856 27.830 1.00 0.00 H new ATOM 0 HD1 TYR A 40 15.167 -16.610 28.537 1.00 0.00 H new ATOM 0 HD2 TYR A 40 14.184 -13.511 25.727 1.00 0.00 H new ATOM 0 HE1 TYR A 40 13.179 -17.906 27.817 1.00 0.00 H new ATOM 0 HE2 TYR A 40 12.211 -14.816 24.971 1.00 0.00 H new ATOM 0 HH TYR A 40 10.989 -16.659 25.253 1.00 0.00 H new ATOM 671 N VAL A 41 17.176 -11.385 29.316 1.00 0.00 N ATOM 672 CA VAL A 41 18.305 -10.629 29.851 1.00 0.00 C ATOM 673 C VAL A 41 17.819 -9.271 30.354 1.00 0.00 C ATOM 674 O VAL A 41 16.797 -8.774 29.880 1.00 0.00 O ATOM 675 CB VAL A 41 19.411 -10.433 28.799 1.00 0.00 C ATOM 676 CG1 VAL A 41 20.220 -11.712 28.609 1.00 0.00 C ATOM 677 CG2 VAL A 41 18.847 -9.997 27.448 1.00 0.00 C ATOM 0 H VAL A 41 16.488 -10.801 28.840 1.00 0.00 H new ATOM 0 HA VAL A 41 18.732 -11.200 30.676 1.00 0.00 H new ATOM 0 HB VAL A 41 20.059 -9.642 29.177 1.00 0.00 H new ATOM 0 HG11 VAL A 41 20.994 -11.545 27.860 1.00 0.00 H new ATOM 0 HG12 VAL A 41 20.684 -11.993 29.554 1.00 0.00 H new ATOM 0 HG13 VAL A 41 19.561 -12.514 28.276 1.00 0.00 H new ATOM 0 HG21 VAL A 41 19.663 -9.871 26.737 1.00 0.00 H new ATOM 0 HG22 VAL A 41 18.158 -10.757 27.079 1.00 0.00 H new ATOM 0 HG23 VAL A 41 18.317 -9.052 27.563 1.00 0.00 H new ATOM 687 N PRO A 42 18.537 -8.660 31.309 1.00 0.00 N ATOM 688 CA PRO A 42 18.187 -7.365 31.870 1.00 0.00 C ATOM 689 C PRO A 42 18.362 -6.260 30.831 1.00 0.00 C ATOM 690 O PRO A 42 19.031 -6.452 29.816 1.00 0.00 O ATOM 691 CB PRO A 42 19.129 -7.174 33.058 1.00 0.00 C ATOM 692 CG PRO A 42 20.362 -7.973 32.644 1.00 0.00 C ATOM 693 CD PRO A 42 19.747 -9.171 31.925 1.00 0.00 C ATOM 0 HA PRO A 42 17.143 -7.320 32.180 1.00 0.00 H new ATOM 0 HB2 PRO A 42 19.365 -6.123 33.222 1.00 0.00 H new ATOM 0 HB3 PRO A 42 18.694 -7.552 33.984 1.00 0.00 H new ATOM 0 HG2 PRO A 42 21.018 -7.399 31.990 1.00 0.00 H new ATOM 0 HG3 PRO A 42 20.957 -8.277 33.505 1.00 0.00 H new ATOM 0 HD2 PRO A 42 20.430 -9.576 31.178 1.00 0.00 H new ATOM 0 HD3 PRO A 42 19.524 -9.978 32.623 1.00 0.00 H new ATOM 701 N SER A 43 17.755 -5.097 31.086 1.00 0.00 N ATOM 702 CA SER A 43 17.744 -3.988 30.139 1.00 0.00 C ATOM 703 C SER A 43 19.136 -3.401 29.904 1.00 0.00 C ATOM 704 O SER A 43 19.315 -2.596 28.991 1.00 0.00 O ATOM 705 CB SER A 43 16.789 -2.911 30.650 1.00 0.00 C ATOM 706 OG SER A 43 17.221 -2.447 31.913 1.00 0.00 O ATOM 0 H SER A 43 17.259 -4.902 31.956 1.00 0.00 H new ATOM 0 HA SER A 43 17.404 -4.369 29.176 1.00 0.00 H new ATOM 0 HB2 SER A 43 16.749 -2.083 29.943 1.00 0.00 H new ATOM 0 HB3 SER A 43 15.779 -3.314 30.727 1.00 0.00 H new ATOM 0 HG SER A 43 16.606 -1.755 32.235 1.00 0.00 H new ATOM 712 N GLY A 44 20.126 -3.789 30.711 1.00 0.00 N ATOM 713 CA GLY A 44 21.490 -3.314 30.543 1.00 0.00 C ATOM 714 C GLY A 44 22.288 -4.191 29.581 1.00 0.00 C ATOM 715 O GLY A 44 23.315 -3.754 29.064 1.00 0.00 O ATOM 0 H GLY A 44 20.001 -4.435 31.490 1.00 0.00 H new ATOM 0 HA2 GLY A 44 21.474 -2.290 30.171 1.00 0.00 H new ATOM 0 HA3 GLY A 44 21.988 -3.293 31.512 1.00 0.00 H new ATOM 719 N ASP A 45 21.823 -5.422 29.341 1.00 0.00 N ATOM 720 CA ASP A 45 22.490 -6.363 28.451 1.00 0.00 C ATOM 721 C ASP A 45 21.622 -6.708 27.241 1.00 0.00 C ATOM 722 O ASP A 45 22.068 -7.422 26.347 1.00 0.00 O ATOM 723 CB ASP A 45 22.867 -7.620 29.232 1.00 0.00 C ATOM 724 CG ASP A 45 23.872 -7.309 30.343 1.00 0.00 C ATOM 725 OD1 ASP A 45 24.909 -6.685 30.029 1.00 0.00 O ATOM 726 OD2 ASP A 45 23.596 -7.697 31.502 1.00 0.00 O ATOM 0 H ASP A 45 20.970 -5.789 29.763 1.00 0.00 H new ATOM 0 HA ASP A 45 23.396 -5.894 28.066 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.970 -8.063 29.665 1.00 0.00 H new ATOM 0 HB3 ASP A 45 23.292 -8.359 28.552 1.00 0.00 H new ATOM 731 N VAL A 46 20.385 -6.208 27.208 1.00 0.00 N ATOM 732 CA VAL A 46 19.455 -6.532 26.136 1.00 0.00 C ATOM 733 C VAL A 46 19.876 -5.983 24.767 1.00 0.00 C ATOM 734 O VAL A 46 19.574 -6.636 23.770 1.00 0.00 O ATOM 735 CB VAL A 46 18.035 -6.100 26.537 1.00 0.00 C ATOM 736 CG1 VAL A 46 17.801 -4.593 26.457 1.00 0.00 C ATOM 737 CG2 VAL A 46 17.003 -6.782 25.647 1.00 0.00 C ATOM 0 H VAL A 46 20.008 -5.577 27.915 1.00 0.00 H new ATOM 0 HA VAL A 46 19.468 -7.614 26.004 1.00 0.00 H new ATOM 0 HB VAL A 46 17.927 -6.400 27.579 1.00 0.00 H new ATOM 0 HG11 VAL A 46 16.777 -4.367 26.755 1.00 0.00 H new ATOM 0 HG12 VAL A 46 18.494 -4.081 27.125 1.00 0.00 H new ATOM 0 HG13 VAL A 46 17.965 -4.253 25.434 1.00 0.00 H new ATOM 0 HG21 VAL A 46 16.002 -6.467 25.943 1.00 0.00 H new ATOM 0 HG22 VAL A 46 17.179 -6.505 24.608 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.089 -7.863 25.753 1.00 0.00 H new ATOM 747 N PRO A 47 20.558 -4.826 24.642 1.00 0.00 N ATOM 748 CA PRO A 47 20.907 -4.302 23.333 1.00 0.00 C ATOM 749 C PRO A 47 22.112 -5.035 22.746 1.00 0.00 C ATOM 750 O PRO A 47 22.291 -5.048 21.531 1.00 0.00 O ATOM 751 CB PRO A 47 21.227 -2.830 23.573 1.00 0.00 C ATOM 752 CG PRO A 47 21.840 -2.847 24.967 1.00 0.00 C ATOM 753 CD PRO A 47 21.033 -3.928 25.683 1.00 0.00 C ATOM 0 HA PRO A 47 20.099 -4.435 22.614 1.00 0.00 H new ATOM 0 HB2 PRO A 47 21.922 -2.440 22.829 1.00 0.00 H new ATOM 0 HB3 PRO A 47 20.333 -2.208 23.531 1.00 0.00 H new ATOM 0 HG2 PRO A 47 22.902 -3.089 24.938 1.00 0.00 H new ATOM 0 HG3 PRO A 47 21.747 -1.880 25.461 1.00 0.00 H new ATOM 0 HD2 PRO A 47 21.650 -4.461 26.407 1.00 0.00 H new ATOM 0 HD3 PRO A 47 20.199 -3.493 26.234 1.00 0.00 H new ATOM 761 N ASP A 48 22.939 -5.645 23.602 1.00 0.00 N ATOM 762 CA ASP A 48 24.132 -6.341 23.152 1.00 0.00 C ATOM 763 C ASP A 48 23.777 -7.743 22.662 1.00 0.00 C ATOM 764 O ASP A 48 24.466 -8.296 21.806 1.00 0.00 O ATOM 765 CB ASP A 48 25.128 -6.409 24.311 1.00 0.00 C ATOM 766 CG ASP A 48 26.458 -7.008 23.864 1.00 0.00 C ATOM 767 OD1 ASP A 48 27.154 -6.337 23.071 1.00 0.00 O ATOM 768 OD2 ASP A 48 26.773 -8.132 24.319 1.00 0.00 O ATOM 0 H ASP A 48 22.796 -5.666 24.612 1.00 0.00 H new ATOM 0 HA ASP A 48 24.582 -5.801 22.319 1.00 0.00 H new ATOM 0 HB2 ASP A 48 25.293 -5.408 24.711 1.00 0.00 H new ATOM 0 HB3 ASP A 48 24.709 -7.010 25.119 1.00 0.00 H new ATOM 773 N VAL A 49 22.699 -8.322 23.200 1.00 0.00 N ATOM 774 CA VAL A 49 22.250 -9.642 22.786 1.00 0.00 C ATOM 775 C VAL A 49 21.465 -9.543 21.479 1.00 0.00 C ATOM 776 O VAL A 49 21.440 -10.498 20.710 1.00 0.00 O ATOM 777 CB VAL A 49 21.442 -10.282 23.917 1.00 0.00 C ATOM 778 CG1 VAL A 49 20.845 -11.617 23.489 1.00 0.00 C ATOM 779 CG2 VAL A 49 22.364 -10.545 25.112 1.00 0.00 C ATOM 0 H VAL A 49 22.124 -7.891 23.924 1.00 0.00 H new ATOM 0 HA VAL A 49 23.105 -10.289 22.590 1.00 0.00 H new ATOM 0 HB VAL A 49 20.637 -9.595 24.179 1.00 0.00 H new ATOM 0 HG11 VAL A 49 20.278 -12.044 24.316 1.00 0.00 H new ATOM 0 HG12 VAL A 49 20.183 -11.463 22.636 1.00 0.00 H new ATOM 0 HG13 VAL A 49 21.646 -12.300 23.208 1.00 0.00 H new ATOM 0 HG21 VAL A 49 21.792 -11.001 25.920 1.00 0.00 H new ATOM 0 HG22 VAL A 49 23.167 -11.218 24.811 1.00 0.00 H new ATOM 0 HG23 VAL A 49 22.791 -9.603 25.457 1.00 0.00 H new ATOM 789 N VAL A 50 20.830 -8.397 21.213 1.00 0.00 N ATOM 790 CA VAL A 50 20.193 -8.159 19.923 1.00 0.00 C ATOM 791 C VAL A 50 21.271 -8.007 18.856 1.00 0.00 C ATOM 792 O VAL A 50 21.073 -8.425 17.715 1.00 0.00 O ATOM 793 CB VAL A 50 19.337 -6.892 19.999 1.00 0.00 C ATOM 794 CG1 VAL A 50 18.851 -6.465 18.618 1.00 0.00 C ATOM 795 CG2 VAL A 50 18.107 -7.156 20.858 1.00 0.00 C ATOM 0 H VAL A 50 20.746 -7.625 21.874 1.00 0.00 H new ATOM 0 HA VAL A 50 19.549 -9.000 19.665 1.00 0.00 H new ATOM 0 HB VAL A 50 19.957 -6.104 20.427 1.00 0.00 H new ATOM 0 HG11 VAL A 50 18.246 -5.563 18.708 1.00 0.00 H new ATOM 0 HG12 VAL A 50 19.709 -6.264 17.976 1.00 0.00 H new ATOM 0 HG13 VAL A 50 18.250 -7.262 18.181 1.00 0.00 H new ATOM 0 HG21 VAL A 50 17.499 -6.253 20.911 1.00 0.00 H new ATOM 0 HG22 VAL A 50 17.521 -7.962 20.417 1.00 0.00 H new ATOM 0 HG23 VAL A 50 18.419 -7.442 21.862 1.00 0.00 H new ATOM 805 N GLN A 51 22.416 -7.418 19.211 1.00 0.00 N ATOM 806 CA GLN A 51 23.504 -7.257 18.266 1.00 0.00 C ATOM 807 C GLN A 51 24.148 -8.613 17.988 1.00 0.00 C ATOM 808 O GLN A 51 24.441 -8.918 16.837 1.00 0.00 O ATOM 809 CB GLN A 51 24.517 -6.254 18.816 1.00 0.00 C ATOM 810 CG GLN A 51 25.635 -6.009 17.805 1.00 0.00 C ATOM 811 CD GLN A 51 26.606 -4.933 18.274 1.00 0.00 C ATOM 812 OE1 GLN A 51 26.456 -4.360 19.352 1.00 0.00 O ATOM 813 NE2 GLN A 51 27.622 -4.646 17.463 1.00 0.00 N ATOM 0 H GLN A 51 22.605 -7.049 20.143 1.00 0.00 H new ATOM 0 HA GLN A 51 23.123 -6.867 17.322 1.00 0.00 H new ATOM 0 HB2 GLN A 51 24.017 -5.314 19.048 1.00 0.00 H new ATOM 0 HB3 GLN A 51 24.939 -6.629 19.749 1.00 0.00 H new ATOM 0 HG2 GLN A 51 26.179 -6.938 17.634 1.00 0.00 H new ATOM 0 HG3 GLN A 51 25.201 -5.714 16.850 1.00 0.00 H new ATOM 0 HE21 GLN A 51 27.720 -5.138 16.575 1.00 0.00 H new ATOM 0 HE22 GLN A 51 28.302 -3.934 17.730 1.00 0.00 H new ATOM 822 N GLU A 52 24.369 -9.434 19.018 1.00 0.00 N ATOM 823 CA GLU A 52 24.948 -10.750 18.804 1.00 0.00 C ATOM 824 C GLU A 52 23.965 -11.635 18.041 1.00 0.00 C ATOM 825 O GLU A 52 24.381 -12.532 17.313 1.00 0.00 O ATOM 826 CB GLU A 52 25.331 -11.382 20.146 1.00 0.00 C ATOM 827 CG GLU A 52 26.059 -12.712 19.920 1.00 0.00 C ATOM 828 CD GLU A 52 26.577 -13.318 21.224 1.00 0.00 C ATOM 829 OE1 GLU A 52 27.017 -12.541 22.101 1.00 0.00 O ATOM 830 OE2 GLU A 52 26.529 -14.565 21.336 1.00 0.00 O ATOM 0 H GLU A 52 24.158 -9.210 19.991 1.00 0.00 H new ATOM 0 HA GLU A 52 25.854 -10.651 18.205 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.970 -10.701 20.707 1.00 0.00 H new ATOM 0 HB3 GLU A 52 24.436 -11.547 20.746 1.00 0.00 H new ATOM 0 HG2 GLU A 52 25.382 -13.417 19.438 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.894 -12.555 19.238 1.00 0.00 H new ATOM 837 N ALA A 53 22.660 -11.386 18.198 1.00 0.00 N ATOM 838 CA ALA A 53 21.654 -12.149 17.484 1.00 0.00 C ATOM 839 C ALA A 53 21.684 -11.795 16.001 1.00 0.00 C ATOM 840 O ALA A 53 21.479 -12.672 15.166 1.00 0.00 O ATOM 841 CB ALA A 53 20.281 -11.867 18.091 1.00 0.00 C ATOM 0 H ALA A 53 22.286 -10.663 18.813 1.00 0.00 H new ATOM 0 HA ALA A 53 21.864 -13.215 17.578 1.00 0.00 H new ATOM 0 HB1 ALA A 53 19.522 -12.439 17.557 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.281 -12.157 19.142 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.058 -10.803 18.009 1.00 0.00 H new ATOM 847 N PHE A 54 21.937 -10.528 15.655 1.00 0.00 N ATOM 848 CA PHE A 54 22.048 -10.124 14.259 1.00 0.00 C ATOM 849 C PHE A 54 23.372 -10.566 13.640 1.00 0.00 C ATOM 850 O PHE A 54 23.412 -10.876 12.451 1.00 0.00 O ATOM 851 CB PHE A 54 21.881 -8.608 14.154 1.00 0.00 C ATOM 852 CG PHE A 54 20.511 -8.092 14.548 1.00 0.00 C ATOM 853 CD1 PHE A 54 19.368 -8.877 14.334 1.00 0.00 C ATOM 854 CD2 PHE A 54 20.381 -6.818 15.124 1.00 0.00 C ATOM 855 CE1 PHE A 54 18.105 -8.395 14.690 1.00 0.00 C ATOM 856 CE2 PHE A 54 19.113 -6.331 15.463 1.00 0.00 C ATOM 857 CZ PHE A 54 17.975 -7.120 15.248 1.00 0.00 C ATOM 0 H PHE A 54 22.068 -9.770 16.325 1.00 0.00 H new ATOM 0 HA PHE A 54 21.256 -10.618 13.697 1.00 0.00 H new ATOM 0 HB2 PHE A 54 22.630 -8.129 14.785 1.00 0.00 H new ATOM 0 HB3 PHE A 54 22.087 -8.304 13.128 1.00 0.00 H new ATOM 0 HD1 PHE A 54 19.464 -9.858 13.892 1.00 0.00 H new ATOM 0 HD2 PHE A 54 21.258 -6.215 15.305 1.00 0.00 H new ATOM 0 HE1 PHE A 54 17.230 -9.008 14.534 1.00 0.00 H new ATOM 0 HE2 PHE A 54 19.012 -5.345 15.891 1.00 0.00 H new ATOM 0 HZ PHE A 54 16.998 -6.743 15.513 1.00 0.00 H new ATOM 867 N ILE A 55 24.456 -10.604 14.420 1.00 0.00 N ATOM 868 CA ILE A 55 25.740 -11.073 13.911 1.00 0.00 C ATOM 869 C ILE A 55 25.667 -12.581 13.682 1.00 0.00 C ATOM 870 O ILE A 55 26.204 -13.095 12.703 1.00 0.00 O ATOM 871 CB ILE A 55 26.850 -10.715 14.909 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.988 -9.191 15.016 1.00 0.00 C ATOM 873 CG2 ILE A 55 28.182 -11.335 14.473 1.00 0.00 C ATOM 874 CD1 ILE A 55 27.928 -8.784 16.151 1.00 0.00 C ATOM 0 H ILE A 55 24.467 -10.317 15.399 1.00 0.00 H new ATOM 0 HA ILE A 55 25.969 -10.589 12.962 1.00 0.00 H new ATOM 0 HB ILE A 55 26.583 -11.117 15.886 1.00 0.00 H new ATOM 0 HG12 ILE A 55 27.363 -8.793 14.073 1.00 0.00 H new ATOM 0 HG13 ILE A 55 26.006 -8.748 15.181 1.00 0.00 H new ATOM 0 HG21 ILE A 55 28.958 -11.072 15.191 1.00 0.00 H new ATOM 0 HG22 ILE A 55 28.081 -12.419 14.429 1.00 0.00 H new ATOM 0 HG23 ILE A 55 28.455 -10.956 13.488 1.00 0.00 H new ATOM 0 HD11 ILE A 55 27.998 -7.697 16.193 1.00 0.00 H new ATOM 0 HD12 ILE A 55 27.539 -9.159 17.098 1.00 0.00 H new ATOM 0 HD13 ILE A 55 28.917 -9.205 15.973 1.00 0.00 H new ATOM 886 N LYS A 56 24.991 -13.288 14.592 1.00 0.00 N ATOM 887 CA LYS A 56 24.815 -14.728 14.507 1.00 0.00 C ATOM 888 C LYS A 56 23.778 -15.079 13.445 1.00 0.00 C ATOM 889 O LYS A 56 23.876 -16.126 12.806 1.00 0.00 O ATOM 890 CB LYS A 56 24.395 -15.220 15.891 1.00 0.00 C ATOM 891 CG LYS A 56 24.268 -16.743 15.949 1.00 0.00 C ATOM 892 CD LYS A 56 23.807 -17.180 17.341 1.00 0.00 C ATOM 893 CE LYS A 56 24.844 -16.806 18.400 1.00 0.00 C ATOM 894 NZ LYS A 56 24.385 -17.200 19.742 1.00 0.00 N ATOM 0 H LYS A 56 24.550 -12.868 15.411 1.00 0.00 H new ATOM 0 HA LYS A 56 25.743 -15.216 14.209 1.00 0.00 H new ATOM 0 HB2 LYS A 56 25.126 -14.890 16.629 1.00 0.00 H new ATOM 0 HB3 LYS A 56 23.441 -14.767 16.162 1.00 0.00 H new ATOM 0 HG2 LYS A 56 23.556 -17.085 15.198 1.00 0.00 H new ATOM 0 HG3 LYS A 56 25.227 -17.205 15.713 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.853 -16.708 17.577 1.00 0.00 H new ATOM 0 HD3 LYS A 56 23.642 -18.257 17.352 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.792 -17.296 18.176 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.026 -15.732 18.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.096 -16.922 20.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.484 -16.726 19.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.250 -18.231 19.774 1.00 0.00 H new ATOM 908 N ALA A 57 22.782 -14.213 13.244 1.00 0.00 N ATOM 909 CA ALA A 57 21.749 -14.458 12.259 1.00 0.00 C ATOM 910 C ALA A 57 22.324 -14.346 10.854 1.00 0.00 C ATOM 911 O ALA A 57 22.026 -15.186 10.015 1.00 0.00 O ATOM 912 CB ALA A 57 20.600 -13.469 12.439 1.00 0.00 C ATOM 0 H ALA A 57 22.677 -13.337 13.756 1.00 0.00 H new ATOM 0 HA ALA A 57 21.365 -15.468 12.401 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.831 -13.665 11.692 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.175 -13.583 13.436 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.973 -12.452 12.318 1.00 0.00 H new ATOM 918 N TYR A 58 23.147 -13.332 10.573 1.00 0.00 N ATOM 919 CA TYR A 58 23.669 -13.133 9.231 1.00 0.00 C ATOM 920 C TYR A 58 24.506 -14.327 8.777 1.00 0.00 C ATOM 921 O TYR A 58 24.456 -14.719 7.613 1.00 0.00 O ATOM 922 CB TYR A 58 24.532 -11.876 9.225 1.00 0.00 C ATOM 923 CG TYR A 58 25.019 -11.500 7.844 1.00 0.00 C ATOM 924 CD1 TYR A 58 24.122 -10.962 6.909 1.00 0.00 C ATOM 925 CD2 TYR A 58 26.364 -11.696 7.497 1.00 0.00 C ATOM 926 CE1 TYR A 58 24.575 -10.588 5.637 1.00 0.00 C ATOM 927 CE2 TYR A 58 26.825 -11.333 6.222 1.00 0.00 C ATOM 928 CZ TYR A 58 25.929 -10.770 5.287 1.00 0.00 C ATOM 929 OH TYR A 58 26.369 -10.402 4.049 1.00 0.00 O ATOM 0 H TYR A 58 23.461 -12.643 11.257 1.00 0.00 H new ATOM 0 HA TYR A 58 22.832 -13.028 8.541 1.00 0.00 H new ATOM 0 HB2 TYR A 58 23.959 -11.047 9.640 1.00 0.00 H new ATOM 0 HB3 TYR A 58 25.391 -12.029 9.878 1.00 0.00 H new ATOM 0 HD1 TYR A 58 23.082 -10.836 7.170 1.00 0.00 H new ATOM 0 HD2 TYR A 58 27.047 -12.128 8.213 1.00 0.00 H new ATOM 0 HE1 TYR A 58 23.886 -10.160 4.924 1.00 0.00 H new ATOM 0 HE2 TYR A 58 27.861 -11.484 5.957 1.00 0.00 H new ATOM 0 HH TYR A 58 27.327 -10.594 3.972 1.00 0.00 H new ATOM 939 N ARG A 59 25.274 -14.908 9.703 1.00 0.00 N ATOM 940 CA ARG A 59 26.133 -16.046 9.407 1.00 0.00 C ATOM 941 C ARG A 59 25.308 -17.312 9.178 1.00 0.00 C ATOM 942 O ARG A 59 25.758 -18.219 8.481 1.00 0.00 O ATOM 943 CB ARG A 59 27.088 -16.238 10.581 1.00 0.00 C ATOM 944 CG ARG A 59 28.018 -15.030 10.707 1.00 0.00 C ATOM 945 CD ARG A 59 28.768 -15.128 12.029 1.00 0.00 C ATOM 946 NE ARG A 59 29.782 -14.075 12.144 1.00 0.00 N ATOM 947 CZ ARG A 59 30.560 -13.892 13.214 1.00 0.00 C ATOM 948 NH1 ARG A 59 30.451 -14.687 14.278 1.00 0.00 N ATOM 949 NH2 ARG A 59 31.453 -12.910 13.228 1.00 0.00 N ATOM 0 H ARG A 59 25.314 -14.600 10.675 1.00 0.00 H new ATOM 0 HA ARG A 59 26.693 -15.854 8.492 1.00 0.00 H new ATOM 0 HB2 ARG A 59 26.521 -16.368 11.503 1.00 0.00 H new ATOM 0 HB3 ARG A 59 27.675 -17.145 10.437 1.00 0.00 H new ATOM 0 HG2 ARG A 59 28.721 -15.006 9.874 1.00 0.00 H new ATOM 0 HG3 ARG A 59 27.443 -14.105 10.666 1.00 0.00 H new ATOM 0 HD2 ARG A 59 28.063 -15.049 12.857 1.00 0.00 H new ATOM 0 HD3 ARG A 59 29.244 -16.105 12.108 1.00 0.00 H new ATOM 0 HE ARG A 59 29.901 -13.440 11.354 1.00 0.00 H new ATOM 0 HH11 ARG A 59 29.768 -15.445 14.281 1.00 0.00 H new ATOM 0 HH12 ARG A 59 31.051 -14.538 15.090 1.00 0.00 H new ATOM 0 HH21 ARG A 59 31.546 -12.294 12.421 1.00 0.00 H new ATOM 0 HH22 ARG A 59 32.046 -12.772 14.046 1.00 0.00 H new ATOM 963 N ALA A 60 24.106 -17.365 9.757 1.00 0.00 N ATOM 964 CA ALA A 60 23.175 -18.467 9.565 1.00 0.00 C ATOM 965 C ALA A 60 22.155 -18.153 8.468 1.00 0.00 C ATOM 966 O ALA A 60 21.420 -19.041 8.035 1.00 0.00 O ATOM 967 CB ALA A 60 22.487 -18.757 10.899 1.00 0.00 C ATOM 0 H ALA A 60 23.754 -16.635 10.377 1.00 0.00 H new ATOM 0 HA ALA A 60 23.721 -19.351 9.236 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.785 -19.581 10.775 1.00 0.00 H new ATOM 0 HB2 ALA A 60 23.236 -19.028 11.643 1.00 0.00 H new ATOM 0 HB3 ALA A 60 21.949 -17.869 11.232 1.00 0.00 H new ATOM 973 N LEU A 61 22.098 -16.899 8.009 1.00 0.00 N ATOM 974 CA LEU A 61 21.139 -16.463 7.007 1.00 0.00 C ATOM 975 C LEU A 61 21.549 -16.975 5.631 1.00 0.00 C ATOM 976 O LEU A 61 20.710 -17.114 4.743 1.00 0.00 O ATOM 977 CB LEU A 61 21.078 -14.935 7.025 1.00 0.00 C ATOM 978 CG LEU A 61 19.894 -14.391 6.227 1.00 0.00 C ATOM 979 CD1 LEU A 61 18.576 -14.762 6.896 1.00 0.00 C ATOM 980 CD2 LEU A 61 20.001 -12.872 6.181 1.00 0.00 C ATOM 0 H LEU A 61 22.723 -16.159 8.328 1.00 0.00 H new ATOM 0 HA LEU A 61 20.152 -16.867 7.231 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.008 -14.589 8.056 1.00 0.00 H new ATOM 0 HB3 LEU A 61 22.005 -14.532 6.616 1.00 0.00 H new ATOM 0 HG LEU A 61 19.915 -14.819 5.225 1.00 0.00 H new ATOM 0 HD11 LEU A 61 17.747 -14.365 6.311 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.491 -15.847 6.956 1.00 0.00 H new ATOM 0 HD13 LEU A 61 18.546 -14.340 7.901 1.00 0.00 H new ATOM 0 HD21 LEU A 61 19.163 -12.465 5.615 1.00 0.00 H new ATOM 0 HD22 LEU A 61 19.980 -12.475 7.196 1.00 0.00 H new ATOM 0 HD23 LEU A 61 20.937 -12.588 5.699 1.00 0.00 H new ATOM 992 N ASP A 62 22.838 -17.259 5.453 1.00 0.00 N ATOM 993 CA ASP A 62 23.341 -17.883 4.238 1.00 0.00 C ATOM 994 C ASP A 62 22.805 -19.312 4.106 1.00 0.00 C ATOM 995 O ASP A 62 22.940 -19.933 3.052 1.00 0.00 O ATOM 996 CB ASP A 62 24.867 -17.866 4.288 1.00 0.00 C ATOM 997 CG ASP A 62 25.484 -18.397 2.995 1.00 0.00 C ATOM 998 OD1 ASP A 62 25.234 -17.776 1.938 1.00 0.00 O ATOM 999 OD2 ASP A 62 26.206 -19.419 3.074 1.00 0.00 O ATOM 0 H ASP A 62 23.559 -17.062 6.147 1.00 0.00 H new ATOM 0 HA ASP A 62 23.000 -17.330 3.362 1.00 0.00 H new ATOM 0 HB2 ASP A 62 25.213 -16.848 4.464 1.00 0.00 H new ATOM 0 HB3 ASP A 62 25.210 -18.469 5.129 1.00 0.00 H new ATOM 1004 N SER A 63 22.196 -19.834 5.177 1.00 0.00 N ATOM 1005 CA SER A 63 21.616 -21.167 5.206 1.00 0.00 C ATOM 1006 C SER A 63 20.091 -21.122 5.268 1.00 0.00 C ATOM 1007 O SER A 63 19.446 -22.167 5.345 1.00 0.00 O ATOM 1008 CB SER A 63 22.186 -21.945 6.389 1.00 0.00 C ATOM 1009 OG SER A 63 23.590 -22.032 6.280 1.00 0.00 O ATOM 0 H SER A 63 22.095 -19.329 6.057 1.00 0.00 H new ATOM 0 HA SER A 63 21.880 -21.676 4.279 1.00 0.00 H new ATOM 0 HB2 SER A 63 21.916 -21.452 7.323 1.00 0.00 H new ATOM 0 HB3 SER A 63 21.753 -22.945 6.419 1.00 0.00 H new ATOM 0 HG SER A 63 23.947 -22.531 7.044 1.00 0.00 H new ATOM 1015 N PHE A 64 19.499 -19.923 5.232 1.00 0.00 N ATOM 1016 CA PHE A 64 18.050 -19.766 5.211 1.00 0.00 C ATOM 1017 C PHE A 64 17.506 -20.156 3.837 1.00 0.00 C ATOM 1018 O PHE A 64 18.162 -19.913 2.821 1.00 0.00 O ATOM 1019 CB PHE A 64 17.692 -18.328 5.577 1.00 0.00 C ATOM 1020 CG PHE A 64 16.204 -18.064 5.634 1.00 0.00 C ATOM 1021 CD1 PHE A 64 15.458 -18.512 6.731 1.00 0.00 C ATOM 1022 CD2 PHE A 64 15.571 -17.376 4.589 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.079 -18.267 6.789 1.00 0.00 C ATOM 1024 CE2 PHE A 64 14.194 -17.125 4.649 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.449 -17.566 5.751 1.00 0.00 C ATOM 0 H PHE A 64 20.012 -19.042 5.217 1.00 0.00 H new ATOM 0 HA PHE A 64 17.590 -20.426 5.946 1.00 0.00 H new ATOM 0 HB2 PHE A 64 18.131 -18.090 6.546 1.00 0.00 H new ATOM 0 HB3 PHE A 64 18.143 -17.655 4.848 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.945 -19.047 7.533 1.00 0.00 H new ATOM 0 HD2 PHE A 64 16.145 -17.040 3.738 1.00 0.00 H new ATOM 0 HE1 PHE A 64 13.503 -18.618 7.632 1.00 0.00 H new ATOM 0 HE2 PHE A 64 13.707 -16.592 3.846 1.00 0.00 H new ATOM 0 HZ PHE A 64 12.389 -17.366 5.801 1.00 0.00 H new ATOM 1035 N ARG A 65 16.312 -20.759 3.801 1.00 0.00 N ATOM 1036 CA ARG A 65 15.734 -21.292 2.570 1.00 0.00 C ATOM 1037 C ARG A 65 14.254 -20.940 2.418 1.00 0.00 C ATOM 1038 O ARG A 65 13.606 -21.419 1.490 1.00 0.00 O ATOM 1039 CB ARG A 65 15.949 -22.810 2.526 1.00 0.00 C ATOM 1040 CG ARG A 65 17.442 -23.148 2.467 1.00 0.00 C ATOM 1041 CD ARG A 65 17.645 -24.659 2.458 1.00 0.00 C ATOM 1042 NE ARG A 65 19.069 -24.999 2.336 1.00 0.00 N ATOM 1043 CZ ARG A 65 19.538 -26.251 2.274 1.00 0.00 C ATOM 1044 NH1 ARG A 65 18.710 -27.291 2.316 1.00 0.00 N ATOM 1045 NH2 ARG A 65 20.848 -26.463 2.168 1.00 0.00 N ATOM 0 H ARG A 65 15.724 -20.889 4.624 1.00 0.00 H new ATOM 0 HA ARG A 65 16.244 -20.826 1.727 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.502 -23.271 3.407 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.442 -23.228 1.656 1.00 0.00 H new ATOM 0 HG2 ARG A 65 17.885 -22.710 1.573 1.00 0.00 H new ATOM 0 HG3 ARG A 65 17.954 -22.711 3.324 1.00 0.00 H new ATOM 0 HD2 ARG A 65 17.242 -25.089 3.375 1.00 0.00 H new ATOM 0 HD3 ARG A 65 17.090 -25.099 1.629 1.00 0.00 H new ATOM 0 HE ARG A 65 19.742 -24.234 2.296 1.00 0.00 H new ATOM 0 HH11 ARG A 65 17.705 -27.139 2.396 1.00 0.00 H new ATOM 0 HH12 ARG A 65 19.080 -28.240 2.268 1.00 0.00 H new ATOM 0 HH21 ARG A 65 21.491 -25.672 2.134 1.00 0.00 H new ATOM 0 HH22 ARG A 65 21.208 -27.416 2.121 1.00 0.00 H new ATOM 1059 N GLY A 66 13.707 -20.114 3.315 1.00 0.00 N ATOM 1060 CA GLY A 66 12.316 -19.689 3.236 1.00 0.00 C ATOM 1061 C GLY A 66 11.334 -20.804 3.596 1.00 0.00 C ATOM 1062 O GLY A 66 10.146 -20.686 3.309 1.00 0.00 O ATOM 0 H GLY A 66 14.216 -19.726 4.109 1.00 0.00 H new ATOM 0 HA2 GLY A 66 12.161 -18.844 3.907 1.00 0.00 H new ATOM 0 HA3 GLY A 66 12.105 -19.338 2.226 1.00 0.00 H new ATOM 1066 N ASP A 67 11.819 -21.885 4.218 1.00 0.00 N ATOM 1067 CA ASP A 67 10.969 -22.994 4.632 1.00 0.00 C ATOM 1068 C ASP A 67 10.076 -22.589 5.809 1.00 0.00 C ATOM 1069 O ASP A 67 9.156 -23.318 6.181 1.00 0.00 O ATOM 1070 CB ASP A 67 11.857 -24.187 4.992 1.00 0.00 C ATOM 1071 CG ASP A 67 11.035 -25.435 5.300 1.00 0.00 C ATOM 1072 OD1 ASP A 67 10.332 -25.905 4.377 1.00 0.00 O ATOM 1073 OD2 ASP A 67 11.116 -25.910 6.455 1.00 0.00 O ATOM 0 H ASP A 67 12.806 -22.010 4.445 1.00 0.00 H new ATOM 0 HA ASP A 67 10.307 -23.274 3.812 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.538 -24.395 4.167 1.00 0.00 H new ATOM 0 HB3 ASP A 67 12.472 -23.935 5.856 1.00 0.00 H new ATOM 1078 N SER A 68 10.351 -21.420 6.397 1.00 0.00 N ATOM 1079 CA SER A 68 9.571 -20.846 7.483 1.00 0.00 C ATOM 1080 C SER A 68 9.643 -19.322 7.391 1.00 0.00 C ATOM 1081 O SER A 68 10.484 -18.788 6.671 1.00 0.00 O ATOM 1082 CB SER A 68 10.122 -21.337 8.822 1.00 0.00 C ATOM 1083 OG SER A 68 9.301 -20.888 9.877 1.00 0.00 O ATOM 0 H SER A 68 11.142 -20.838 6.120 1.00 0.00 H new ATOM 0 HA SER A 68 8.529 -21.157 7.407 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.171 -22.426 8.827 1.00 0.00 H new ATOM 0 HB3 SER A 68 11.139 -20.972 8.962 1.00 0.00 H new ATOM 0 HG SER A 68 9.660 -21.209 10.730 1.00 0.00 H new ATOM 1089 N ALA A 69 8.769 -18.617 8.110 1.00 0.00 N ATOM 1090 CA ALA A 69 8.759 -17.165 8.083 1.00 0.00 C ATOM 1091 C ALA A 69 10.051 -16.616 8.683 1.00 0.00 C ATOM 1092 O ALA A 69 10.604 -17.195 9.621 1.00 0.00 O ATOM 1093 CB ALA A 69 7.534 -16.645 8.834 1.00 0.00 C ATOM 0 H ALA A 69 8.062 -19.033 8.716 1.00 0.00 H new ATOM 0 HA ALA A 69 8.700 -16.822 7.050 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.529 -15.555 8.812 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.629 -17.021 8.358 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.569 -16.987 9.868 1.00 0.00 H new ATOM 1099 N PHE A 70 10.543 -15.493 8.151 1.00 0.00 N ATOM 1100 CA PHE A 70 11.815 -14.946 8.593 1.00 0.00 C ATOM 1101 C PHE A 70 11.748 -14.437 10.029 1.00 0.00 C ATOM 1102 O PHE A 70 12.740 -14.507 10.751 1.00 0.00 O ATOM 1103 CB PHE A 70 12.238 -13.809 7.665 1.00 0.00 C ATOM 1104 CG PHE A 70 13.480 -13.097 8.150 1.00 0.00 C ATOM 1105 CD1 PHE A 70 14.723 -13.749 8.117 1.00 0.00 C ATOM 1106 CD2 PHE A 70 13.395 -11.787 8.646 1.00 0.00 C ATOM 1107 CE1 PHE A 70 15.869 -13.092 8.585 1.00 0.00 C ATOM 1108 CE2 PHE A 70 14.545 -11.132 9.107 1.00 0.00 C ATOM 1109 CZ PHE A 70 15.785 -11.786 9.078 1.00 0.00 C ATOM 0 H PHE A 70 10.079 -14.954 7.420 1.00 0.00 H new ATOM 0 HA PHE A 70 12.550 -15.750 8.559 1.00 0.00 H new ATOM 0 HB2 PHE A 70 12.418 -14.207 6.667 1.00 0.00 H new ATOM 0 HB3 PHE A 70 11.422 -13.092 7.580 1.00 0.00 H new ATOM 0 HD1 PHE A 70 14.796 -14.755 7.732 1.00 0.00 H new ATOM 0 HD2 PHE A 70 12.441 -11.282 8.673 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.823 -13.598 8.565 1.00 0.00 H new ATOM 0 HE2 PHE A 70 14.476 -10.123 9.485 1.00 0.00 H new ATOM 0 HZ PHE A 70 16.672 -11.283 9.435 1.00 0.00 H new ATOM 1119 N TYR A 71 10.591 -13.923 10.462 1.00 0.00 N ATOM 1120 CA TYR A 71 10.494 -13.384 11.808 1.00 0.00 C ATOM 1121 C TYR A 71 10.552 -14.506 12.842 1.00 0.00 C ATOM 1122 O TYR A 71 11.137 -14.327 13.906 1.00 0.00 O ATOM 1123 CB TYR A 71 9.226 -12.539 11.949 1.00 0.00 C ATOM 1124 CG TYR A 71 7.921 -13.291 11.810 1.00 0.00 C ATOM 1125 CD1 TYR A 71 7.395 -13.989 12.906 1.00 0.00 C ATOM 1126 CD2 TYR A 71 7.237 -13.280 10.587 1.00 0.00 C ATOM 1127 CE1 TYR A 71 6.180 -14.679 12.783 1.00 0.00 C ATOM 1128 CE2 TYR A 71 6.020 -13.964 10.456 1.00 0.00 C ATOM 1129 CZ TYR A 71 5.488 -14.667 11.555 1.00 0.00 C ATOM 1130 OH TYR A 71 4.304 -15.330 11.433 1.00 0.00 O ATOM 0 H TYR A 71 9.734 -13.872 9.911 1.00 0.00 H new ATOM 0 HA TYR A 71 11.347 -12.731 11.993 1.00 0.00 H new ATOM 0 HB2 TYR A 71 9.242 -12.052 12.924 1.00 0.00 H new ATOM 0 HB3 TYR A 71 9.252 -11.750 11.198 1.00 0.00 H new ATOM 0 HD1 TYR A 71 7.926 -13.995 13.846 1.00 0.00 H new ATOM 0 HD2 TYR A 71 7.648 -12.744 9.744 1.00 0.00 H new ATOM 0 HE1 TYR A 71 5.776 -15.218 13.627 1.00 0.00 H new ATOM 0 HE2 TYR A 71 5.491 -13.952 9.514 1.00 0.00 H new ATOM 0 HH TYR A 71 3.959 -15.219 10.522 1.00 0.00 H new ATOM 1140 N THR A 72 9.958 -15.667 12.548 1.00 0.00 N ATOM 1141 CA THR A 72 10.008 -16.788 13.477 1.00 0.00 C ATOM 1142 C THR A 72 11.414 -17.367 13.487 1.00 0.00 C ATOM 1143 O THR A 72 11.903 -17.794 14.531 1.00 0.00 O ATOM 1144 CB THR A 72 9.002 -17.865 13.062 1.00 0.00 C ATOM 1145 OG1 THR A 72 7.708 -17.311 12.981 1.00 0.00 O ATOM 1146 CG2 THR A 72 8.984 -18.998 14.088 1.00 0.00 C ATOM 0 H THR A 72 9.445 -15.849 11.685 1.00 0.00 H new ATOM 0 HA THR A 72 9.749 -16.439 14.477 1.00 0.00 H new ATOM 0 HB THR A 72 9.302 -18.255 12.089 1.00 0.00 H new ATOM 0 HG1 THR A 72 7.759 -16.341 13.111 1.00 0.00 H new ATOM 0 HG21 THR A 72 8.264 -19.756 13.780 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.976 -19.445 14.154 1.00 0.00 H new ATOM 0 HG23 THR A 72 8.699 -18.602 15.063 1.00 0.00 H new ATOM 1154 N TRP A 73 12.072 -17.384 12.328 1.00 0.00 N ATOM 1155 CA TRP A 73 13.415 -17.924 12.215 1.00 0.00 C ATOM 1156 C TRP A 73 14.423 -17.017 12.915 1.00 0.00 C ATOM 1157 O TRP A 73 15.411 -17.509 13.457 1.00 0.00 O ATOM 1158 CB TRP A 73 13.749 -18.077 10.734 1.00 0.00 C ATOM 1159 CG TRP A 73 15.151 -18.507 10.457 1.00 0.00 C ATOM 1160 CD1 TRP A 73 15.562 -19.778 10.253 1.00 0.00 C ATOM 1161 CD2 TRP A 73 16.350 -17.680 10.351 1.00 0.00 C ATOM 1162 NE1 TRP A 73 16.923 -19.797 10.038 1.00 0.00 N ATOM 1163 CE2 TRP A 73 17.464 -18.530 10.110 1.00 0.00 C ATOM 1164 CE3 TRP A 73 16.610 -16.299 10.453 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.769 -18.045 10.000 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 17.916 -15.800 10.336 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.994 -16.669 10.117 1.00 0.00 C ATOM 0 H TRP A 73 11.689 -17.026 11.453 1.00 0.00 H new ATOM 0 HA TRP A 73 13.466 -18.897 12.703 1.00 0.00 H new ATOM 0 HB2 TRP A 73 13.066 -18.803 10.294 1.00 0.00 H new ATOM 0 HB3 TRP A 73 13.569 -17.126 10.234 1.00 0.00 H new ATOM 0 HD1 TRP A 73 14.921 -20.647 10.258 1.00 0.00 H new ATOM 0 HE1 TRP A 73 17.463 -20.642 9.849 1.00 0.00 H new ATOM 0 HE3 TRP A 73 15.792 -15.615 10.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 19.592 -18.722 9.827 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.092 -14.737 10.415 1.00 0.00 H new ATOM 0 HH2 TRP A 73 19.997 -16.277 10.039 1.00 0.00 H new ATOM 1178 N LEU A 74 14.183 -15.702 12.908 1.00 0.00 N ATOM 1179 CA LEU A 74 15.088 -14.738 13.510 1.00 0.00 C ATOM 1180 C LEU A 74 14.897 -14.668 15.022 1.00 0.00 C ATOM 1181 O LEU A 74 15.867 -14.514 15.761 1.00 0.00 O ATOM 1182 CB LEU A 74 14.836 -13.368 12.875 1.00 0.00 C ATOM 1183 CG LEU A 74 15.753 -12.286 13.458 1.00 0.00 C ATOM 1184 CD1 LEU A 74 17.218 -12.565 13.127 1.00 0.00 C ATOM 1185 CD2 LEU A 74 15.359 -10.930 12.881 1.00 0.00 C ATOM 0 H LEU A 74 13.355 -15.284 12.484 1.00 0.00 H new ATOM 0 HA LEU A 74 16.116 -15.050 13.328 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.992 -13.434 11.798 1.00 0.00 H new ATOM 0 HB3 LEU A 74 13.795 -13.083 13.030 1.00 0.00 H new ATOM 0 HG LEU A 74 15.639 -12.287 14.542 1.00 0.00 H new ATOM 0 HD11 LEU A 74 17.843 -11.781 13.554 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.508 -13.529 13.546 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.349 -12.585 12.045 1.00 0.00 H new ATOM 0 HD21 LEU A 74 16.008 -10.157 13.292 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.463 -10.952 11.796 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.324 -10.711 13.141 1.00 0.00 H new ATOM 1197 N TYR A 75 13.654 -14.781 15.496 1.00 0.00 N ATOM 1198 CA TYR A 75 13.384 -14.712 16.925 1.00 0.00 C ATOM 1199 C TYR A 75 13.937 -15.928 17.661 1.00 0.00 C ATOM 1200 O TYR A 75 14.135 -15.865 18.872 1.00 0.00 O ATOM 1201 CB TYR A 75 11.884 -14.527 17.160 1.00 0.00 C ATOM 1202 CG TYR A 75 11.334 -13.200 16.675 1.00 0.00 C ATOM 1203 CD1 TYR A 75 12.150 -12.058 16.631 1.00 0.00 C ATOM 1204 CD2 TYR A 75 9.992 -13.110 16.277 1.00 0.00 C ATOM 1205 CE1 TYR A 75 11.629 -10.831 16.203 1.00 0.00 C ATOM 1206 CE2 TYR A 75 9.465 -11.889 15.835 1.00 0.00 C ATOM 1207 CZ TYR A 75 10.283 -10.745 15.794 1.00 0.00 C ATOM 1208 OH TYR A 75 9.773 -9.559 15.360 1.00 0.00 O ATOM 0 H TYR A 75 12.828 -14.919 14.913 1.00 0.00 H new ATOM 0 HA TYR A 75 13.902 -13.846 17.338 1.00 0.00 H new ATOM 0 HB2 TYR A 75 11.348 -15.333 16.660 1.00 0.00 H new ATOM 0 HB3 TYR A 75 11.681 -14.623 18.227 1.00 0.00 H new ATOM 0 HD1 TYR A 75 13.186 -12.127 16.929 1.00 0.00 H new ATOM 0 HD2 TYR A 75 9.362 -13.986 16.311 1.00 0.00 H new ATOM 0 HE1 TYR A 75 12.257 -9.953 16.186 1.00 0.00 H new ATOM 0 HE2 TYR A 75 8.432 -11.826 15.526 1.00 0.00 H new ATOM 0 HH TYR A 75 8.831 -9.678 15.116 1.00 0.00 H new ATOM 1218 N ARG A 76 14.192 -17.034 16.952 1.00 0.00 N ATOM 1219 CA ARG A 76 14.848 -18.190 17.550 1.00 0.00 C ATOM 1220 C ARG A 76 16.337 -17.915 17.740 1.00 0.00 C ATOM 1221 O ARG A 76 16.959 -18.496 18.629 1.00 0.00 O ATOM 1222 CB ARG A 76 14.641 -19.418 16.658 1.00 0.00 C ATOM 1223 CG ARG A 76 13.177 -19.865 16.662 1.00 0.00 C ATOM 1224 CD ARG A 76 12.779 -20.450 18.014 1.00 0.00 C ATOM 1225 NE ARG A 76 11.392 -20.936 17.989 1.00 0.00 N ATOM 1226 CZ ARG A 76 10.807 -21.583 19.002 1.00 0.00 C ATOM 1227 NH1 ARG A 76 11.475 -21.825 20.128 1.00 0.00 N ATOM 1228 NH2 ARG A 76 9.547 -21.994 18.893 1.00 0.00 N ATOM 0 H ARG A 76 13.953 -17.147 15.967 1.00 0.00 H new ATOM 0 HA ARG A 76 14.408 -18.383 18.528 1.00 0.00 H new ATOM 0 HB2 ARG A 76 14.950 -19.187 15.639 1.00 0.00 H new ATOM 0 HB3 ARG A 76 15.274 -20.234 17.006 1.00 0.00 H new ATOM 0 HG2 ARG A 76 12.535 -19.016 16.428 1.00 0.00 H new ATOM 0 HG3 ARG A 76 13.020 -20.609 15.881 1.00 0.00 H new ATOM 0 HD2 ARG A 76 13.451 -21.269 18.272 1.00 0.00 H new ATOM 0 HD3 ARG A 76 12.889 -19.692 18.789 1.00 0.00 H new ATOM 0 HE ARG A 76 10.842 -20.769 17.146 1.00 0.00 H new ATOM 0 HH11 ARG A 76 12.442 -21.516 20.224 1.00 0.00 H new ATOM 0 HH12 ARG A 76 11.019 -22.319 20.895 1.00 0.00 H new ATOM 0 HH21 ARG A 76 9.025 -21.816 18.035 1.00 0.00 H new ATOM 0 HH22 ARG A 76 9.103 -22.488 19.667 1.00 0.00 H new ATOM 1242 N ILE A 77 16.919 -17.035 16.920 1.00 0.00 N ATOM 1243 CA ILE A 77 18.318 -16.663 17.074 1.00 0.00 C ATOM 1244 C ILE A 77 18.480 -15.792 18.316 1.00 0.00 C ATOM 1245 O ILE A 77 19.477 -15.898 19.024 1.00 0.00 O ATOM 1246 CB ILE A 77 18.828 -15.899 15.842 1.00 0.00 C ATOM 1247 CG1 ILE A 77 18.478 -16.559 14.501 1.00 0.00 C ATOM 1248 CG2 ILE A 77 20.347 -15.737 15.946 1.00 0.00 C ATOM 1249 CD1 ILE A 77 19.013 -17.981 14.343 1.00 0.00 C ATOM 0 H ILE A 77 16.441 -16.572 16.147 1.00 0.00 H new ATOM 0 HA ILE A 77 18.905 -17.575 17.179 1.00 0.00 H new ATOM 0 HB ILE A 77 18.320 -14.934 15.847 1.00 0.00 H new ATOM 0 HG12 ILE A 77 17.394 -16.577 14.390 1.00 0.00 H new ATOM 0 HG13 ILE A 77 18.871 -15.943 13.692 1.00 0.00 H new ATOM 0 HG21 ILE A 77 20.716 -15.196 15.075 1.00 0.00 H new ATOM 0 HG22 ILE A 77 20.592 -15.180 16.850 1.00 0.00 H new ATOM 0 HG23 ILE A 77 20.816 -16.720 15.987 1.00 0.00 H new ATOM 0 HD11 ILE A 77 18.721 -18.373 13.369 1.00 0.00 H new ATOM 0 HD12 ILE A 77 20.100 -17.971 14.420 1.00 0.00 H new ATOM 0 HD13 ILE A 77 18.600 -18.615 15.128 1.00 0.00 H new ATOM 1261 N ALA A 78 17.497 -14.926 18.583 1.00 0.00 N ATOM 1262 CA ALA A 78 17.599 -13.953 19.656 1.00 0.00 C ATOM 1263 C ALA A 78 17.443 -14.590 21.036 1.00 0.00 C ATOM 1264 O ALA A 78 18.153 -14.220 21.970 1.00 0.00 O ATOM 1265 CB ALA A 78 16.541 -12.873 19.435 1.00 0.00 C ATOM 0 H ALA A 78 16.620 -14.886 18.063 1.00 0.00 H new ATOM 0 HA ALA A 78 18.597 -13.514 19.633 1.00 0.00 H new ATOM 0 HB1 ALA A 78 16.604 -12.133 20.233 1.00 0.00 H new ATOM 0 HB2 ALA A 78 16.713 -12.386 18.475 1.00 0.00 H new ATOM 0 HB3 ALA A 78 15.550 -13.328 19.439 1.00 0.00 H new ATOM 1271 N VAL A 79 16.521 -15.547 21.183 1.00 0.00 N ATOM 1272 CA VAL A 79 16.276 -16.163 22.482 1.00 0.00 C ATOM 1273 C VAL A 79 17.342 -17.203 22.811 1.00 0.00 C ATOM 1274 O VAL A 79 17.679 -17.385 23.978 1.00 0.00 O ATOM 1275 CB VAL A 79 14.858 -16.739 22.533 1.00 0.00 C ATOM 1276 CG1 VAL A 79 14.647 -17.835 21.494 1.00 0.00 C ATOM 1277 CG2 VAL A 79 14.576 -17.342 23.905 1.00 0.00 C ATOM 0 H VAL A 79 15.940 -15.906 20.425 1.00 0.00 H new ATOM 0 HA VAL A 79 16.347 -15.398 23.255 1.00 0.00 H new ATOM 0 HB VAL A 79 14.181 -15.910 22.325 1.00 0.00 H new ATOM 0 HG11 VAL A 79 13.628 -18.214 21.567 1.00 0.00 H new ATOM 0 HG12 VAL A 79 14.812 -17.427 20.497 1.00 0.00 H new ATOM 0 HG13 VAL A 79 15.350 -18.648 21.675 1.00 0.00 H new ATOM 0 HG21 VAL A 79 13.564 -17.747 23.924 1.00 0.00 H new ATOM 0 HG22 VAL A 79 15.290 -18.141 24.105 1.00 0.00 H new ATOM 0 HG23 VAL A 79 14.672 -16.570 24.668 1.00 0.00 H new ATOM 1287 N ASN A 80 17.888 -17.887 21.801 1.00 0.00 N ATOM 1288 CA ASN A 80 18.935 -18.865 22.042 1.00 0.00 C ATOM 1289 C ASN A 80 20.258 -18.161 22.352 1.00 0.00 C ATOM 1290 O ASN A 80 21.121 -18.744 23.006 1.00 0.00 O ATOM 1291 CB ASN A 80 19.075 -19.779 20.822 1.00 0.00 C ATOM 1292 CG ASN A 80 17.869 -20.690 20.635 1.00 0.00 C ATOM 1293 OD1 ASN A 80 16.965 -20.731 21.467 1.00 0.00 O ATOM 1294 ND2 ASN A 80 17.846 -21.434 19.535 1.00 0.00 N ATOM 0 H ASN A 80 17.622 -17.779 20.822 1.00 0.00 H new ATOM 0 HA ASN A 80 18.668 -19.474 22.906 1.00 0.00 H new ATOM 0 HB2 ASN A 80 19.208 -19.169 19.928 1.00 0.00 H new ATOM 0 HB3 ASN A 80 19.973 -20.388 20.929 1.00 0.00 H new ATOM 0 HD21 ASN A 80 17.062 -22.063 19.361 1.00 0.00 H new ATOM 0 HD22 ASN A 80 18.612 -21.376 18.864 1.00 0.00 H new ATOM 1301 N THR A 81 20.423 -16.915 21.893 1.00 0.00 N ATOM 1302 CA THR A 81 21.638 -16.161 22.170 1.00 0.00 C ATOM 1303 C THR A 81 21.609 -15.608 23.589 1.00 0.00 C ATOM 1304 O THR A 81 22.656 -15.450 24.208 1.00 0.00 O ATOM 1305 CB THR A 81 21.814 -15.045 21.137 1.00 0.00 C ATOM 1306 OG1 THR A 81 21.954 -15.628 19.860 1.00 0.00 O ATOM 1307 CG2 THR A 81 23.076 -14.230 21.408 1.00 0.00 C ATOM 0 H THR A 81 19.732 -16.416 21.333 1.00 0.00 H new ATOM 0 HA THR A 81 22.496 -16.829 22.093 1.00 0.00 H new ATOM 0 HB THR A 81 20.943 -14.392 21.194 1.00 0.00 H new ATOM 0 HG1 THR A 81 21.148 -15.454 19.331 1.00 0.00 H new ATOM 0 HG21 THR A 81 23.171 -13.446 20.657 1.00 0.00 H new ATOM 0 HG22 THR A 81 23.012 -13.778 22.398 1.00 0.00 H new ATOM 0 HG23 THR A 81 23.948 -14.883 21.363 1.00 0.00 H new ATOM 1315 N ALA A 82 20.418 -15.309 24.113 1.00 0.00 N ATOM 1316 CA ALA A 82 20.278 -14.792 25.462 1.00 0.00 C ATOM 1317 C ALA A 82 20.524 -15.898 26.487 1.00 0.00 C ATOM 1318 O ALA A 82 20.985 -15.627 27.595 1.00 0.00 O ATOM 1319 CB ALA A 82 18.877 -14.203 25.610 1.00 0.00 C ATOM 0 H ALA A 82 19.535 -15.420 23.614 1.00 0.00 H new ATOM 0 HA ALA A 82 21.019 -14.013 25.643 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.753 -13.809 26.619 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.742 -13.399 24.887 1.00 0.00 H new ATOM 0 HB3 ALA A 82 18.135 -14.981 25.430 1.00 0.00 H new ATOM 1325 N LYS A 83 20.221 -17.146 26.118 1.00 0.00 N ATOM 1326 CA LYS A 83 20.426 -18.285 27.003 1.00 0.00 C ATOM 1327 C LYS A 83 21.897 -18.681 27.057 1.00 0.00 C ATOM 1328 O LYS A 83 22.356 -19.167 28.088 1.00 0.00 O ATOM 1329 CB LYS A 83 19.550 -19.447 26.536 1.00 0.00 C ATOM 1330 CG LYS A 83 18.078 -19.109 26.783 1.00 0.00 C ATOM 1331 CD LYS A 83 17.185 -20.204 26.205 1.00 0.00 C ATOM 1332 CE LYS A 83 15.722 -19.838 26.445 1.00 0.00 C ATOM 1333 NZ LYS A 83 14.817 -20.862 25.892 1.00 0.00 N ATOM 0 H LYS A 83 19.831 -17.389 25.207 1.00 0.00 H new ATOM 0 HA LYS A 83 20.136 -18.010 28.017 1.00 0.00 H new ATOM 0 HB2 LYS A 83 19.717 -19.639 25.476 1.00 0.00 H new ATOM 0 HB3 LYS A 83 19.820 -20.357 27.071 1.00 0.00 H new ATOM 0 HG2 LYS A 83 17.895 -19.006 27.853 1.00 0.00 H new ATOM 0 HG3 LYS A 83 17.835 -18.151 26.324 1.00 0.00 H new ATOM 0 HD2 LYS A 83 17.373 -20.318 25.137 1.00 0.00 H new ATOM 0 HD3 LYS A 83 17.414 -21.161 26.673 1.00 0.00 H new ATOM 0 HE2 LYS A 83 15.542 -19.730 27.515 1.00 0.00 H new ATOM 0 HE3 LYS A 83 15.506 -18.873 25.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 13.830 -20.586 26.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 14.973 -20.946 24.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 15.008 -21.777 26.348 1.00 0.00 H new ATOM 1347 N ASN A 84 22.650 -18.480 25.968 1.00 0.00 N ATOM 1348 CA ASN A 84 24.078 -18.766 25.997 1.00 0.00 C ATOM 1349 C ASN A 84 24.859 -17.578 26.557 1.00 0.00 C ATOM 1350 O ASN A 84 26.023 -17.729 26.928 1.00 0.00 O ATOM 1351 CB ASN A 84 24.593 -19.233 24.627 1.00 0.00 C ATOM 1352 CG ASN A 84 24.990 -18.104 23.680 1.00 0.00 C ATOM 1353 OD1 ASN A 84 24.345 -17.886 22.662 1.00 0.00 O ATOM 1354 ND2 ASN A 84 26.058 -17.376 23.997 1.00 0.00 N ATOM 0 H ASN A 84 22.298 -18.128 25.077 1.00 0.00 H new ATOM 0 HA ASN A 84 24.245 -19.601 26.677 1.00 0.00 H new ATOM 0 HB2 ASN A 84 25.455 -19.882 24.779 1.00 0.00 H new ATOM 0 HB3 ASN A 84 23.821 -19.836 24.149 1.00 0.00 H new ATOM 0 HD21 ASN A 84 26.357 -16.616 23.386 1.00 0.00 H new ATOM 0 HD22 ASN A 84 26.578 -17.578 24.851 1.00 0.00 H new ATOM 1361 N TYR A 85 24.233 -16.398 26.619 1.00 0.00 N ATOM 1362 CA TYR A 85 24.896 -15.209 27.130 1.00 0.00 C ATOM 1363 C TYR A 85 24.976 -15.232 28.653 1.00 0.00 C ATOM 1364 O TYR A 85 25.991 -14.837 29.227 1.00 0.00 O ATOM 1365 CB TYR A 85 24.136 -13.974 26.638 1.00 0.00 C ATOM 1366 CG TYR A 85 24.789 -12.665 27.002 1.00 0.00 C ATOM 1367 CD1 TYR A 85 25.879 -12.200 26.252 1.00 0.00 C ATOM 1368 CD2 TYR A 85 24.304 -11.914 28.082 1.00 0.00 C ATOM 1369 CE1 TYR A 85 26.486 -10.981 26.580 1.00 0.00 C ATOM 1370 CE2 TYR A 85 24.909 -10.696 28.419 1.00 0.00 C ATOM 1371 CZ TYR A 85 26.001 -10.222 27.665 1.00 0.00 C ATOM 1372 OH TYR A 85 26.589 -9.040 27.991 1.00 0.00 O ATOM 0 H TYR A 85 23.269 -16.248 26.320 1.00 0.00 H new ATOM 0 HA TYR A 85 25.921 -15.179 26.759 1.00 0.00 H new ATOM 0 HB2 TYR A 85 24.037 -14.029 25.554 1.00 0.00 H new ATOM 0 HB3 TYR A 85 23.128 -13.992 27.052 1.00 0.00 H new ATOM 0 HD1 TYR A 85 26.250 -12.782 25.421 1.00 0.00 H new ATOM 0 HD2 TYR A 85 23.463 -12.275 28.655 1.00 0.00 H new ATOM 0 HE1 TYR A 85 27.325 -10.623 26.002 1.00 0.00 H new ATOM 0 HE2 TYR A 85 24.539 -10.121 29.255 1.00 0.00 H new ATOM 0 HH TYR A 85 26.129 -8.648 28.762 1.00 0.00 H new ATOM 1382 N LEU A 86 23.911 -15.695 29.315 1.00 0.00 N ATOM 1383 CA LEU A 86 23.891 -15.742 30.773 1.00 0.00 C ATOM 1384 C LEU A 86 24.606 -16.975 31.320 1.00 0.00 C ATOM 1385 O LEU A 86 25.080 -16.938 32.454 1.00 0.00 O ATOM 1386 CB LEU A 86 22.449 -15.687 31.278 1.00 0.00 C ATOM 1387 CG LEU A 86 21.773 -14.338 31.004 1.00 0.00 C ATOM 1388 CD1 LEU A 86 20.382 -14.362 31.627 1.00 0.00 C ATOM 1389 CD2 LEU A 86 22.554 -13.175 31.617 1.00 0.00 C ATOM 0 H LEU A 86 23.062 -16.038 28.867 1.00 0.00 H new ATOM 0 HA LEU A 86 24.434 -14.871 31.139 1.00 0.00 H new ATOM 0 HB2 LEU A 86 21.872 -16.480 30.803 1.00 0.00 H new ATOM 0 HB3 LEU A 86 22.437 -15.883 32.350 1.00 0.00 H new ATOM 0 HG LEU A 86 21.730 -14.191 29.925 1.00 0.00 H new ATOM 0 HD11 LEU A 86 19.884 -13.410 31.443 1.00 0.00 H new ATOM 0 HD12 LEU A 86 19.798 -15.168 31.183 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.467 -14.525 32.701 1.00 0.00 H new ATOM 0 HD21 LEU A 86 22.041 -12.238 31.400 1.00 0.00 H new ATOM 0 HD22 LEU A 86 22.621 -13.310 32.696 1.00 0.00 H new ATOM 0 HD23 LEU A 86 23.557 -13.147 31.192 1.00 0.00 H new ATOM 1401 N VAL A 87 24.700 -18.064 30.553 1.00 0.00 N ATOM 1402 CA VAL A 87 25.406 -19.245 31.037 1.00 0.00 C ATOM 1403 C VAL A 87 26.912 -19.078 30.854 1.00 0.00 C ATOM 1404 O VAL A 87 27.695 -19.685 31.580 1.00 0.00 O ATOM 1405 CB VAL A 87 24.883 -20.504 30.339 1.00 0.00 C ATOM 1406 CG1 VAL A 87 25.503 -20.676 28.954 1.00 0.00 C ATOM 1407 CG2 VAL A 87 25.199 -21.749 31.171 1.00 0.00 C ATOM 0 H VAL A 87 24.305 -18.150 29.616 1.00 0.00 H new ATOM 0 HA VAL A 87 25.216 -19.359 32.104 1.00 0.00 H new ATOM 0 HB VAL A 87 23.804 -20.386 30.234 1.00 0.00 H new ATOM 0 HG11 VAL A 87 25.109 -21.579 28.489 1.00 0.00 H new ATOM 0 HG12 VAL A 87 25.258 -19.813 28.336 1.00 0.00 H new ATOM 0 HG13 VAL A 87 26.586 -20.759 29.048 1.00 0.00 H new ATOM 0 HG21 VAL A 87 24.820 -22.634 30.660 1.00 0.00 H new ATOM 0 HG22 VAL A 87 26.278 -21.837 31.298 1.00 0.00 H new ATOM 0 HG23 VAL A 87 24.724 -21.664 32.148 1.00 0.00 H new ATOM 1417 N ALA A 88 27.324 -18.252 29.885 1.00 0.00 N ATOM 1418 CA ALA A 88 28.735 -18.014 29.634 1.00 0.00 C ATOM 1419 C ALA A 88 29.322 -17.052 30.666 1.00 0.00 C ATOM 1420 O ALA A 88 30.539 -16.907 30.756 1.00 0.00 O ATOM 1421 CB ALA A 88 28.904 -17.461 28.220 1.00 0.00 C ATOM 0 H ALA A 88 26.694 -17.741 29.266 1.00 0.00 H new ATOM 0 HA ALA A 88 29.277 -18.956 29.722 1.00 0.00 H new ATOM 0 HB1 ALA A 88 29.961 -17.280 28.024 1.00 0.00 H new ATOM 0 HB2 ALA A 88 28.520 -18.182 27.499 1.00 0.00 H new ATOM 0 HB3 ALA A 88 28.352 -16.526 28.127 1.00 0.00 H new ATOM 1427 N GLN A 89 28.458 -16.395 31.445 1.00 0.00 N ATOM 1428 CA GLN A 89 28.873 -15.486 32.502 1.00 0.00 C ATOM 1429 C GLN A 89 28.386 -15.987 33.865 1.00 0.00 C ATOM 1430 O GLN A 89 28.705 -15.395 34.893 1.00 0.00 O ATOM 1431 CB GLN A 89 28.337 -14.087 32.193 1.00 0.00 C ATOM 1432 CG GLN A 89 28.932 -13.561 30.888 1.00 0.00 C ATOM 1433 CD GLN A 89 28.336 -12.210 30.525 1.00 0.00 C ATOM 1434 OE1 GLN A 89 28.927 -11.167 30.795 1.00 0.00 O ATOM 1435 NE2 GLN A 89 27.158 -12.215 29.908 1.00 0.00 N ATOM 0 H GLN A 89 27.446 -16.484 31.354 1.00 0.00 H new ATOM 0 HA GLN A 89 29.961 -15.443 32.546 1.00 0.00 H new ATOM 0 HB2 GLN A 89 27.250 -14.116 32.118 1.00 0.00 H new ATOM 0 HB3 GLN A 89 28.582 -13.409 33.010 1.00 0.00 H new ATOM 0 HG2 GLN A 89 30.014 -13.471 30.987 1.00 0.00 H new ATOM 0 HG3 GLN A 89 28.744 -14.273 30.085 1.00 0.00 H new ATOM 0 HE21 GLN A 89 26.695 -13.100 29.699 1.00 0.00 H new ATOM 0 HE22 GLN A 89 26.717 -11.334 29.643 1.00 0.00 H new ATOM 1444 N GLY A 90 27.615 -17.080 33.876 1.00 0.00 N ATOM 1445 CA GLY A 90 27.099 -17.680 35.096 1.00 0.00 C ATOM 1446 C GLY A 90 27.786 -19.004 35.430 1.00 0.00 C ATOM 1447 O GLY A 90 27.544 -19.560 36.499 1.00 0.00 O ATOM 0 H GLY A 90 27.333 -17.572 33.028 1.00 0.00 H new ATOM 0 HA2 GLY A 90 27.234 -16.985 35.925 1.00 0.00 H new ATOM 0 HA3 GLY A 90 26.027 -17.847 34.991 1.00 0.00 H new ATOM 1451 N ARG A 91 28.637 -19.512 34.526 1.00 0.00 N ATOM 1452 CA ARG A 91 29.371 -20.756 34.729 1.00 0.00 C ATOM 1453 C ARG A 91 30.867 -20.587 34.459 1.00 0.00 C ATOM 1454 O ARG A 91 31.608 -21.569 34.513 1.00 0.00 O ATOM 1455 CB ARG A 91 28.802 -21.858 33.825 1.00 0.00 C ATOM 1456 CG ARG A 91 27.322 -22.161 34.085 1.00 0.00 C ATOM 1457 CD ARG A 91 27.073 -22.706 35.491 1.00 0.00 C ATOM 1458 NE ARG A 91 27.799 -23.961 35.726 1.00 0.00 N ATOM 1459 CZ ARG A 91 27.750 -24.655 36.868 1.00 0.00 C ATOM 1460 NH1 ARG A 91 27.017 -24.236 37.896 1.00 0.00 N ATOM 1461 NH2 ARG A 91 28.445 -25.781 36.987 1.00 0.00 N ATOM 0 H ARG A 91 28.832 -19.064 33.631 1.00 0.00 H new ATOM 0 HA ARG A 91 29.251 -21.040 35.775 1.00 0.00 H new ATOM 0 HB2 ARG A 91 28.926 -21.562 32.783 1.00 0.00 H new ATOM 0 HB3 ARG A 91 29.382 -22.770 33.969 1.00 0.00 H new ATOM 0 HG2 ARG A 91 26.738 -21.252 33.943 1.00 0.00 H new ATOM 0 HG3 ARG A 91 26.968 -22.885 33.351 1.00 0.00 H new ATOM 0 HD2 ARG A 91 27.381 -21.964 36.228 1.00 0.00 H new ATOM 0 HD3 ARG A 91 26.005 -22.872 35.633 1.00 0.00 H new ATOM 0 HE ARG A 91 28.378 -24.327 34.970 1.00 0.00 H new ATOM 0 HH11 ARG A 91 26.480 -23.372 37.821 1.00 0.00 H new ATOM 0 HH12 ARG A 91 26.992 -24.779 38.759 1.00 0.00 H new ATOM 0 HH21 ARG A 91 29.014 -26.114 36.209 1.00 0.00 H new ATOM 0 HH22 ARG A 91 28.410 -26.313 37.857 1.00 0.00 H new ATOM 1475 N ARG A 92 31.318 -19.360 34.166 1.00 0.00 N ATOM 1476 CA ARG A 92 32.713 -19.087 33.829 1.00 0.00 C ATOM 1477 C ARG A 92 33.211 -17.782 34.455 1.00 0.00 C ATOM 1478 O ARG A 92 34.327 -17.359 34.163 1.00 0.00 O ATOM 1479 CB ARG A 92 32.879 -19.024 32.306 1.00 0.00 C ATOM 1480 CG ARG A 92 32.384 -20.296 31.610 1.00 0.00 C ATOM 1481 CD ARG A 92 32.594 -20.161 30.104 1.00 0.00 C ATOM 1482 NE ARG A 92 32.106 -21.348 29.390 1.00 0.00 N ATOM 1483 CZ ARG A 92 31.901 -21.401 28.071 1.00 0.00 C ATOM 1484 NH1 ARG A 92 32.140 -20.340 27.303 1.00 0.00 N ATOM 1485 NH2 ARG A 92 31.453 -22.519 27.508 1.00 0.00 N ATOM 0 H ARG A 92 30.723 -18.532 34.157 1.00 0.00 H new ATOM 0 HA ARG A 92 33.313 -19.901 34.236 1.00 0.00 H new ATOM 0 HB2 ARG A 92 32.331 -18.165 31.919 1.00 0.00 H new ATOM 0 HB3 ARG A 92 33.930 -18.867 32.064 1.00 0.00 H new ATOM 0 HG2 ARG A 92 32.924 -21.165 31.988 1.00 0.00 H new ATOM 0 HG3 ARG A 92 31.328 -20.457 31.829 1.00 0.00 H new ATOM 0 HD2 ARG A 92 32.074 -19.275 29.740 1.00 0.00 H new ATOM 0 HD3 ARG A 92 33.654 -20.017 29.894 1.00 0.00 H new ATOM 0 HE ARG A 92 31.911 -22.187 29.937 1.00 0.00 H new ATOM 0 HH11 ARG A 92 32.483 -19.475 27.721 1.00 0.00 H new ATOM 0 HH12 ARG A 92 31.980 -20.392 26.297 1.00 0.00 H new ATOM 0 HH21 ARG A 92 31.265 -23.340 28.083 1.00 0.00 H new ATOM 0 HH22 ARG A 92 31.298 -22.556 26.501 1.00 0.00 H new ATOM 1499 N LEU A 93 32.403 -17.141 35.307 1.00 0.00 N ATOM 1500 CA LEU A 93 32.745 -15.839 35.862 1.00 0.00 C ATOM 1501 C LEU A 93 32.215 -15.670 37.292 1.00 0.00 C ATOM 1502 O LEU A 93 32.404 -14.623 37.906 1.00 0.00 O ATOM 1503 CB LEU A 93 32.202 -14.763 34.911 1.00 0.00 C ATOM 1504 CG LEU A 93 32.689 -13.340 35.212 1.00 0.00 C ATOM 1505 CD1 LEU A 93 34.216 -13.247 35.191 1.00 0.00 C ATOM 1506 CD2 LEU A 93 32.134 -12.395 34.150 1.00 0.00 C ATOM 0 H LEU A 93 31.506 -17.509 35.624 1.00 0.00 H new ATOM 0 HA LEU A 93 33.828 -15.743 35.942 1.00 0.00 H new ATOM 0 HB2 LEU A 93 32.486 -15.022 33.891 1.00 0.00 H new ATOM 0 HB3 LEU A 93 31.113 -14.776 34.952 1.00 0.00 H new ATOM 0 HG LEU A 93 32.341 -13.068 36.208 1.00 0.00 H new ATOM 0 HD11 LEU A 93 34.521 -12.223 35.409 1.00 0.00 H new ATOM 0 HD12 LEU A 93 34.632 -13.917 35.943 1.00 0.00 H new ATOM 0 HD13 LEU A 93 34.584 -13.534 34.206 1.00 0.00 H new ATOM 0 HD21 LEU A 93 32.474 -11.379 34.353 1.00 0.00 H new ATOM 0 HD22 LEU A 93 32.487 -12.705 33.167 1.00 0.00 H new ATOM 0 HD23 LEU A 93 31.045 -12.424 34.170 1.00 0.00 H new ATOM 1518 N GLU A 94 31.552 -16.692 37.840 1.00 0.00 N ATOM 1519 CA GLU A 94 31.019 -16.647 39.188 1.00 0.00 C ATOM 1520 C GLU A 94 32.145 -16.679 40.221 1.00 0.00 C ATOM 1521 O GLU A 94 33.250 -17.151 39.952 1.00 0.00 O ATOM 1522 CB GLU A 94 30.019 -17.790 39.404 1.00 0.00 C ATOM 1523 CG GLU A 94 30.675 -19.177 39.469 1.00 0.00 C ATOM 1524 CD GLU A 94 31.366 -19.580 38.166 1.00 0.00 C ATOM 1525 OE1 GLU A 94 30.833 -19.228 37.090 1.00 0.00 O ATOM 1526 OE2 GLU A 94 32.424 -20.241 38.255 1.00 0.00 O ATOM 0 H GLU A 94 31.374 -17.571 37.354 1.00 0.00 H new ATOM 0 HA GLU A 94 30.485 -15.706 39.321 1.00 0.00 H new ATOM 0 HB2 GLU A 94 29.472 -17.613 40.330 1.00 0.00 H new ATOM 0 HB3 GLU A 94 29.289 -17.780 38.595 1.00 0.00 H new ATOM 0 HG2 GLU A 94 31.405 -19.188 40.278 1.00 0.00 H new ATOM 0 HG3 GLU A 94 29.916 -19.919 39.714 1.00 0.00 H new ATOM 1533 N LEU A 95 31.848 -16.167 41.414 1.00 0.00 N ATOM 1534 CA LEU A 95 32.813 -16.094 42.501 1.00 0.00 C ATOM 1535 C LEU A 95 32.764 -17.359 43.356 1.00 0.00 C ATOM 1536 O LEU A 95 33.699 -17.623 44.114 1.00 0.00 O ATOM 1537 CB LEU A 95 32.535 -14.858 43.366 1.00 0.00 C ATOM 1538 CG LEU A 95 32.849 -13.503 42.713 1.00 0.00 C ATOM 1539 CD1 LEU A 95 34.302 -13.432 42.247 1.00 0.00 C ATOM 1540 CD2 LEU A 95 31.942 -13.187 41.526 1.00 0.00 C ATOM 0 H LEU A 95 30.930 -15.792 41.651 1.00 0.00 H new ATOM 0 HA LEU A 95 33.812 -16.011 42.072 1.00 0.00 H new ATOM 0 HB2 LEU A 95 31.483 -14.867 43.653 1.00 0.00 H new ATOM 0 HB3 LEU A 95 33.117 -14.942 44.284 1.00 0.00 H new ATOM 0 HG LEU A 95 32.668 -12.760 43.490 1.00 0.00 H new ATOM 0 HD11 LEU A 95 34.490 -12.461 41.790 1.00 0.00 H new ATOM 0 HD12 LEU A 95 34.965 -13.566 43.102 1.00 0.00 H new ATOM 0 HD13 LEU A 95 34.489 -14.219 41.516 1.00 0.00 H new ATOM 0 HD21 LEU A 95 32.214 -12.217 41.108 1.00 0.00 H new ATOM 0 HD22 LEU A 95 32.060 -13.957 40.763 1.00 0.00 H new ATOM 0 HD23 LEU A 95 30.904 -13.161 41.858 1.00 0.00 H new ATOM 1552 N VAL A 96 31.685 -18.142 43.241 1.00 0.00 N ATOM 1553 CA VAL A 96 31.506 -19.375 43.998 1.00 0.00 C ATOM 1554 C VAL A 96 30.781 -20.394 43.120 1.00 0.00 C ATOM 1555 O VAL A 96 29.780 -20.049 42.492 1.00 0.00 O ATOM 1556 CB VAL A 96 30.691 -19.095 45.273 1.00 0.00 C ATOM 1557 CG1 VAL A 96 30.580 -20.354 46.131 1.00 0.00 C ATOM 1558 CG2 VAL A 96 31.344 -18.011 46.132 1.00 0.00 C ATOM 0 H VAL A 96 30.909 -17.931 42.614 1.00 0.00 H new ATOM 0 HA VAL A 96 32.478 -19.773 44.291 1.00 0.00 H new ATOM 0 HB VAL A 96 29.706 -18.764 44.944 1.00 0.00 H new ATOM 0 HG11 VAL A 96 30.000 -20.134 47.027 1.00 0.00 H new ATOM 0 HG12 VAL A 96 30.084 -21.140 45.562 1.00 0.00 H new ATOM 0 HG13 VAL A 96 31.577 -20.688 46.417 1.00 0.00 H new ATOM 0 HG21 VAL A 96 30.740 -17.840 47.023 1.00 0.00 H new ATOM 0 HG22 VAL A 96 32.343 -18.333 46.426 1.00 0.00 H new ATOM 0 HG23 VAL A 96 31.415 -17.086 45.559 1.00 0.00 H new ATOM 1568 N PRO A 97 31.260 -21.644 43.057 1.00 0.00 N ATOM 1569 CA PRO A 97 30.639 -22.700 42.276 1.00 0.00 C ATOM 1570 C PRO A 97 29.335 -23.157 42.928 1.00 0.00 C ATOM 1571 O PRO A 97 29.124 -22.953 44.124 1.00 0.00 O ATOM 1572 CB PRO A 97 31.668 -23.831 42.238 1.00 0.00 C ATOM 1573 CG PRO A 97 32.406 -23.656 43.565 1.00 0.00 C ATOM 1574 CD PRO A 97 32.446 -22.138 43.735 1.00 0.00 C ATOM 0 HA PRO A 97 30.375 -22.367 41.272 1.00 0.00 H new ATOM 0 HB2 PRO A 97 31.193 -24.809 42.165 1.00 0.00 H new ATOM 0 HB3 PRO A 97 32.340 -23.739 41.385 1.00 0.00 H new ATOM 0 HG2 PRO A 97 31.880 -24.141 44.387 1.00 0.00 H new ATOM 0 HG3 PRO A 97 33.407 -24.085 43.530 1.00 0.00 H new ATOM 0 HD2 PRO A 97 32.441 -21.860 44.789 1.00 0.00 H new ATOM 0 HD3 PRO A 97 33.352 -21.717 43.299 1.00 0.00 H new ATOM 1582 N ARG A 98 28.455 -23.783 42.141 1.00 0.00 N ATOM 1583 CA ARG A 98 27.169 -24.262 42.631 1.00 0.00 C ATOM 1584 C ARG A 98 26.706 -25.496 41.864 1.00 0.00 C ATOM 1585 O ARG A 98 27.056 -25.678 40.698 1.00 0.00 O ATOM 1586 CB ARG A 98 26.134 -23.135 42.546 1.00 0.00 C ATOM 1587 CG ARG A 98 25.867 -22.725 41.098 1.00 0.00 C ATOM 1588 CD ARG A 98 24.939 -21.511 41.062 1.00 0.00 C ATOM 1589 NE ARG A 98 24.581 -21.156 39.685 1.00 0.00 N ATOM 1590 CZ ARG A 98 25.407 -20.566 38.815 1.00 0.00 C ATOM 1591 NH1 ARG A 98 26.649 -20.235 39.158 1.00 0.00 N ATOM 1592 NH2 ARG A 98 24.991 -20.303 37.580 1.00 0.00 N ATOM 0 H ARG A 98 28.617 -23.969 41.151 1.00 0.00 H new ATOM 0 HA ARG A 98 27.281 -24.559 43.674 1.00 0.00 H new ATOM 0 HB2 ARG A 98 25.203 -23.459 43.011 1.00 0.00 H new ATOM 0 HB3 ARG A 98 26.488 -22.272 43.110 1.00 0.00 H new ATOM 0 HG2 ARG A 98 26.807 -22.490 40.599 1.00 0.00 H new ATOM 0 HG3 ARG A 98 25.416 -23.555 40.554 1.00 0.00 H new ATOM 0 HD2 ARG A 98 24.035 -21.725 41.632 1.00 0.00 H new ATOM 0 HD3 ARG A 98 25.426 -20.663 41.544 1.00 0.00 H new ATOM 0 HE ARG A 98 23.636 -21.374 39.369 1.00 0.00 H new ATOM 0 HH11 ARG A 98 26.987 -20.431 40.100 1.00 0.00 H new ATOM 0 HH12 ARG A 98 27.263 -19.785 38.479 1.00 0.00 H new ATOM 0 HH21 ARG A 98 24.043 -20.551 37.297 1.00 0.00 H new ATOM 0 HH22 ARG A 98 25.620 -19.853 36.915 1.00 0.00 H new ATOM 1606 N GLY A 99 25.914 -26.335 42.531 1.00 0.00 N ATOM 1607 CA GLY A 99 25.370 -27.561 41.960 1.00 0.00 C ATOM 1608 C GLY A 99 24.923 -28.512 43.069 1.00 0.00 C ATOM 1609 O GLY A 99 25.261 -28.317 44.237 1.00 0.00 O ATOM 0 H GLY A 99 25.630 -26.177 43.498 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.526 -27.325 41.312 1.00 0.00 H new ATOM 0 HA3 GLY A 99 26.123 -28.045 41.338 1.00 0.00 H new ATOM 1613 N SER A 100 24.158 -29.544 42.704 1.00 0.00 N ATOM 1614 CA SER A 100 23.675 -30.539 43.653 1.00 0.00 C ATOM 1615 C SER A 100 23.439 -31.880 42.963 1.00 0.00 C ATOM 1616 O SER A 100 23.416 -31.959 41.735 1.00 0.00 O ATOM 1617 CB SER A 100 22.385 -30.041 44.309 1.00 0.00 C ATOM 1618 OG SER A 100 21.372 -29.879 43.339 1.00 0.00 O ATOM 0 H SER A 100 23.859 -29.709 41.743 1.00 0.00 H new ATOM 0 HA SER A 100 24.434 -30.687 44.421 1.00 0.00 H new ATOM 0 HB2 SER A 100 22.059 -30.750 45.070 1.00 0.00 H new ATOM 0 HB3 SER A 100 22.569 -29.093 44.814 1.00 0.00 H new ATOM 0 HG SER A 100 20.552 -29.562 43.772 1.00 0.00 H new ATOM 1624 N HIS A 101 23.263 -32.939 43.762 1.00 0.00 N ATOM 1625 CA HIS A 101 23.052 -34.293 43.266 1.00 0.00 C ATOM 1626 C HIS A 101 21.849 -34.959 43.938 1.00 0.00 C ATOM 1627 O HIS A 101 21.652 -36.166 43.794 1.00 0.00 O ATOM 1628 CB HIS A 101 24.328 -35.114 43.476 1.00 0.00 C ATOM 1629 CG HIS A 101 24.684 -35.287 44.931 1.00 0.00 C ATOM 1630 ND1 HIS A 101 25.313 -34.329 45.730 1.00 0.00 N ATOM 1631 CD2 HIS A 101 24.435 -36.404 45.678 1.00 0.00 C ATOM 1632 CE1 HIS A 101 25.430 -34.897 46.943 1.00 0.00 C ATOM 1633 NE2 HIS A 101 24.916 -36.139 46.940 1.00 0.00 N ATOM 0 H HIS A 101 23.264 -32.873 44.780 1.00 0.00 H new ATOM 0 HA HIS A 101 22.829 -34.244 42.200 1.00 0.00 H new ATOM 0 HB2 HIS A 101 24.201 -36.096 43.019 1.00 0.00 H new ATOM 0 HB3 HIS A 101 25.156 -34.627 42.960 1.00 0.00 H new ATOM 0 HD2 HIS A 101 23.956 -37.313 45.345 1.00 0.00 H new ATOM 0 HE1 HIS A 101 25.876 -34.420 47.803 1.00 0.00 H new ATOM 0 HE2 HIS A 101 24.887 -36.776 47.736 1.00 0.00 H new ATOM 1641 N HIS A 102 21.047 -34.177 44.668 1.00 0.00 N ATOM 1642 CA HIS A 102 19.880 -34.675 45.385 1.00 0.00 C ATOM 1643 C HIS A 102 18.600 -33.992 44.900 1.00 0.00 C ATOM 1644 O HIS A 102 17.538 -34.156 45.497 1.00 0.00 O ATOM 1645 CB HIS A 102 20.107 -34.496 46.888 1.00 0.00 C ATOM 1646 CG HIS A 102 19.074 -35.193 47.738 1.00 0.00 C ATOM 1647 ND1 HIS A 102 18.807 -36.564 47.723 1.00 0.00 N ATOM 1648 CD2 HIS A 102 18.256 -34.584 48.643 1.00 0.00 C ATOM 1649 CE1 HIS A 102 17.826 -36.744 48.623 1.00 0.00 C ATOM 1650 NE2 HIS A 102 17.476 -35.576 49.191 1.00 0.00 N ATOM 0 H HIS A 102 21.195 -33.174 44.775 1.00 0.00 H new ATOM 0 HA HIS A 102 19.748 -35.738 45.182 1.00 0.00 H new ATOM 0 HB2 HIS A 102 21.095 -34.876 47.146 1.00 0.00 H new ATOM 0 HB3 HIS A 102 20.103 -33.432 47.124 1.00 0.00 H new ATOM 0 HD2 HIS A 102 18.226 -33.531 48.882 1.00 0.00 H new ATOM 0 HE1 HIS A 102 17.379 -37.698 48.859 1.00 0.00 H new ATOM 0 HE2 HIS A 102 16.758 -35.448 49.904 1.00 0.00 H new ATOM 1658 N HIS A 103 18.700 -33.219 43.814 1.00 0.00 N ATOM 1659 CA HIS A 103 17.570 -32.508 43.231 1.00 0.00 C ATOM 1660 C HIS A 103 17.546 -32.672 41.710 1.00 0.00 C ATOM 1661 O HIS A 103 16.710 -32.077 41.031 1.00 0.00 O ATOM 1662 CB HIS A 103 17.649 -31.035 43.643 1.00 0.00 C ATOM 1663 CG HIS A 103 16.444 -30.223 43.245 1.00 0.00 C ATOM 1664 ND1 HIS A 103 16.474 -29.055 42.478 1.00 0.00 N ATOM 1665 CD2 HIS A 103 15.151 -30.509 43.583 1.00 0.00 C ATOM 1666 CE1 HIS A 103 15.189 -28.673 42.366 1.00 0.00 C ATOM 1667 NE2 HIS A 103 14.377 -29.522 43.020 1.00 0.00 N ATOM 0 H HIS A 103 19.577 -33.071 43.315 1.00 0.00 H new ATOM 0 HA HIS A 103 16.637 -32.929 43.605 1.00 0.00 H new ATOM 0 HB2 HIS A 103 17.773 -30.977 44.724 1.00 0.00 H new ATOM 0 HB3 HIS A 103 18.538 -30.590 43.196 1.00 0.00 H new ATOM 0 HD2 HIS A 103 14.806 -31.344 44.175 1.00 0.00 H new ATOM 0 HE1 HIS A 103 14.854 -27.801 41.823 1.00 0.00 H new ATOM 0 HE2 HIS A 103 13.362 -29.447 43.087 1.00 0.00 H new ATOM 1675 N HIS A 104 18.463 -33.478 41.168 1.00 0.00 N ATOM 1676 CA HIS A 104 18.585 -33.712 39.734 1.00 0.00 C ATOM 1677 C HIS A 104 18.877 -35.186 39.466 1.00 0.00 C ATOM 1678 O HIS A 104 19.279 -35.914 40.372 1.00 0.00 O ATOM 1679 CB HIS A 104 19.707 -32.838 39.168 1.00 0.00 C ATOM 1680 CG HIS A 104 19.472 -31.364 39.365 1.00 0.00 C ATOM 1681 ND1 HIS A 104 18.611 -30.572 38.601 1.00 0.00 N ATOM 1682 CD2 HIS A 104 20.063 -30.590 40.323 1.00 0.00 C ATOM 1683 CE1 HIS A 104 18.703 -29.339 39.124 1.00 0.00 C ATOM 1684 NE2 HIS A 104 19.565 -29.319 40.158 1.00 0.00 N ATOM 0 H HIS A 104 19.148 -33.991 41.723 1.00 0.00 H new ATOM 0 HA HIS A 104 17.647 -33.451 39.245 1.00 0.00 H new ATOM 0 HB2 HIS A 104 20.648 -33.115 39.643 1.00 0.00 H new ATOM 0 HB3 HIS A 104 19.815 -33.042 38.103 1.00 0.00 H new ATOM 0 HD2 HIS A 104 20.780 -30.913 41.064 1.00 0.00 H new ATOM 0 HE1 HIS A 104 18.159 -28.479 38.764 1.00 0.00 H new ATOM 0 HE2 HIS A 104 19.807 -28.503 40.721 1.00 0.00 H new ATOM 1692 N HIS A 105 18.674 -35.617 38.215 1.00 0.00 N ATOM 1693 CA HIS A 105 18.898 -36.994 37.784 1.00 0.00 C ATOM 1694 C HIS A 105 18.135 -38.015 38.631 1.00 0.00 C ATOM 1695 O HIS A 105 18.503 -39.187 38.663 1.00 0.00 O ATOM 1696 CB HIS A 105 20.399 -37.285 37.715 1.00 0.00 C ATOM 1697 CG HIS A 105 21.148 -36.296 36.862 1.00 0.00 C ATOM 1698 ND1 HIS A 105 21.952 -35.258 37.341 1.00 0.00 N ATOM 1699 CD2 HIS A 105 21.147 -36.271 35.495 1.00 0.00 C ATOM 1700 CE1 HIS A 105 22.414 -34.633 36.247 1.00 0.00 C ATOM 1701 NE2 HIS A 105 21.949 -35.218 35.127 1.00 0.00 N ATOM 0 H HIS A 105 18.345 -35.007 37.467 1.00 0.00 H new ATOM 0 HA HIS A 105 18.487 -37.101 36.780 1.00 0.00 H new ATOM 0 HB2 HIS A 105 20.813 -37.275 38.723 1.00 0.00 H new ATOM 0 HB3 HIS A 105 20.552 -38.289 37.318 1.00 0.00 H new ATOM 0 HD2 HIS A 105 20.620 -36.945 34.836 1.00 0.00 H new ATOM 0 HE1 HIS A 105 23.071 -33.776 36.263 1.00 0.00 H new ATOM 0 HE2 HIS A 105 22.156 -34.929 34.171 1.00 0.00 H new ATOM 1709 N HIS A 106 17.074 -37.572 39.312 1.00 0.00 N ATOM 1710 CA HIS A 106 16.261 -38.424 40.169 1.00 0.00 C ATOM 1711 C HIS A 106 14.800 -37.982 40.124 1.00 0.00 C ATOM 1712 O HIS A 106 13.942 -38.865 39.901 1.00 0.00 O ATOM 1713 CB HIS A 106 16.808 -38.359 41.598 1.00 0.00 C ATOM 1714 CG HIS A 106 16.049 -39.239 42.556 1.00 0.00 C ATOM 1715 ND1 HIS A 106 15.215 -38.786 43.583 1.00 0.00 N ATOM 1716 CD2 HIS A 106 16.067 -40.603 42.559 1.00 0.00 C ATOM 1717 CE1 HIS A 106 14.749 -39.899 44.177 1.00 0.00 C ATOM 1718 NE2 HIS A 106 15.243 -41.001 43.586 1.00 0.00 N ATOM 1719 OXT HIS A 106 14.556 -36.770 40.309 1.00 0.00 O ATOM 0 H HIS A 106 16.757 -36.603 39.280 1.00 0.00 H new ATOM 0 HA HIS A 106 16.307 -39.454 39.815 1.00 0.00 H new ATOM 0 HB2 HIS A 106 17.857 -38.655 41.594 1.00 0.00 H new ATOM 0 HB3 HIS A 106 16.769 -37.328 41.950 1.00 0.00 H new ATOM 0 HD2 HIS A 106 16.619 -41.244 41.888 1.00 0.00 H new ATOM 0 HE1 HIS A 106 14.069 -39.907 45.016 1.00 0.00 H new ATOM 0 HE2 HIS A 106 15.042 -41.965 43.853 1.00 0.00 H new TER 1727 HIS A 106