USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 773 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 37 GLN :FLIP amide:sc= -0.589 F(o=-1.9,f=-0.59) USER MOD Set 1.2: A 53 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 25 GLN :FLIP amide:sc= 0.0894 F(o=-3,f=-1.1) USER MOD Set 2.2: A 77 GLN : amide:sc= -1.15 K(o=-1.1,f=-5.9!) USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.127 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -170:sc= -0.181 USER MOD Single : A 13 ASN : amide:sc= -0.102 K(o=-0.1,f=-0.66) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 34:sc= -1.93 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.258 K(o=-0.26,f=-3.8!) USER MOD Single : A 48 THR OG1 : rot 180:sc=0.000993 USER MOD Single : A 49 GLN : amide:sc= -0.325 K(o=-0.33,f=-3.2!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.223 X(o=-0.22,f=-0.58) USER MOD Single : A 76 MET CE :methyl 174:sc= -6.7! (180deg=-6.76!) USER MOD Single : A 78 ASN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 81 ASN : amide:sc= -1.44 K(o=-1.4,f=-2.2!) USER MOD Single : A 91 TYR OH : rot 167:sc= -0.266 USER MOD Single : A 92 GLN : amide:sc= 0.782 K(o=0.78,f=-1.5!) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 46:sc= 0.988 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.708 -2.908 -22.408 1.00 0.00 N ATOM 2 CA GLY A 1 -17.965 -1.869 -23.100 1.00 0.00 C ATOM 3 C GLY A 1 -17.593 -0.732 -22.147 1.00 0.00 C ATOM 4 O GLY A 1 -17.808 -0.834 -20.940 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.314 -3.839 -22.653 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.636 -2.761 -21.381 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.707 -2.869 -22.694 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.060 -2.293 -23.536 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.562 -1.477 -23.923 1.00 0.00 H new ATOM 8 N SER A 2 -17.042 0.326 -22.724 1.00 0.00 N ATOM 9 CA SER A 2 -16.639 1.481 -21.941 1.00 0.00 C ATOM 10 C SER A 2 -16.105 2.579 -22.864 1.00 0.00 C ATOM 11 O SER A 2 -15.502 2.288 -23.896 1.00 0.00 O ATOM 12 CB SER A 2 -15.582 1.101 -20.902 1.00 0.00 C ATOM 13 OG SER A 2 -15.116 2.234 -20.175 1.00 0.00 O ATOM 0 H SER A 2 -16.865 0.407 -23.725 1.00 0.00 H new ATOM 0 HA SER A 2 -17.514 1.855 -21.409 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.001 0.373 -20.208 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.741 0.619 -21.400 1.00 0.00 H new ATOM 0 HG SER A 2 -14.444 1.949 -19.521 1.00 0.00 H new ATOM 19 N SER A 3 -16.346 3.817 -22.459 1.00 0.00 N ATOM 20 CA SER A 3 -15.897 4.959 -23.236 1.00 0.00 C ATOM 21 C SER A 3 -15.442 6.082 -22.302 1.00 0.00 C ATOM 22 O SER A 3 -15.812 6.107 -21.129 1.00 0.00 O ATOM 23 CB SER A 3 -17.002 5.459 -24.169 1.00 0.00 C ATOM 24 OG SER A 3 -16.570 5.517 -25.526 1.00 0.00 O ATOM 0 H SER A 3 -16.847 4.054 -21.603 1.00 0.00 H new ATOM 0 HA SER A 3 -15.054 4.644 -23.851 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.867 4.800 -24.092 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.326 6.449 -23.849 1.00 0.00 H new ATOM 0 HG SER A 3 -17.304 5.839 -26.090 1.00 0.00 H new ATOM 30 N GLY A 4 -14.646 6.985 -22.857 1.00 0.00 N ATOM 31 CA GLY A 4 -14.137 8.107 -22.088 1.00 0.00 C ATOM 32 C GLY A 4 -15.248 9.117 -21.791 1.00 0.00 C ATOM 33 O GLY A 4 -16.360 8.991 -22.302 1.00 0.00 O ATOM 0 H GLY A 4 -14.341 6.962 -23.830 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.708 7.747 -21.153 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.334 8.596 -22.639 1.00 0.00 H new ATOM 37 N SER A 5 -14.909 10.096 -20.965 1.00 0.00 N ATOM 38 CA SER A 5 -15.863 11.126 -20.593 1.00 0.00 C ATOM 39 C SER A 5 -15.131 12.320 -19.977 1.00 0.00 C ATOM 40 O SER A 5 -14.039 12.170 -19.433 1.00 0.00 O ATOM 41 CB SER A 5 -16.908 10.583 -19.616 1.00 0.00 C ATOM 42 OG SER A 5 -18.237 10.796 -20.083 1.00 0.00 O ATOM 0 H SER A 5 -13.986 10.197 -20.543 1.00 0.00 H new ATOM 0 HA SER A 5 -16.382 11.452 -21.494 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.743 9.516 -19.465 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.783 11.065 -18.646 1.00 0.00 H new ATOM 0 HG SER A 5 -18.874 10.434 -19.432 1.00 0.00 H new ATOM 48 N SER A 6 -15.763 13.480 -20.084 1.00 0.00 N ATOM 49 CA SER A 6 -15.185 14.699 -19.545 1.00 0.00 C ATOM 50 C SER A 6 -15.213 14.660 -18.016 1.00 0.00 C ATOM 51 O SER A 6 -15.953 13.874 -17.425 1.00 0.00 O ATOM 52 CB SER A 6 -15.928 15.935 -20.058 1.00 0.00 C ATOM 53 OG SER A 6 -16.062 15.926 -21.476 1.00 0.00 O ATOM 0 H SER A 6 -16.669 13.601 -20.536 1.00 0.00 H new ATOM 0 HA SER A 6 -14.150 14.765 -19.882 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.916 15.980 -19.601 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.393 16.833 -19.750 1.00 0.00 H new ATOM 0 HG SER A 6 -16.543 16.730 -21.764 1.00 0.00 H new ATOM 59 N GLY A 7 -14.399 15.517 -17.418 1.00 0.00 N ATOM 60 CA GLY A 7 -14.321 15.590 -15.969 1.00 0.00 C ATOM 61 C GLY A 7 -13.082 16.371 -15.525 1.00 0.00 C ATOM 62 O GLY A 7 -12.064 16.371 -16.215 1.00 0.00 O ATOM 0 H GLY A 7 -13.787 16.167 -17.911 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.218 16.070 -15.577 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.290 14.584 -15.552 1.00 0.00 H new ATOM 66 N LYS A 8 -13.210 17.017 -14.375 1.00 0.00 N ATOM 67 CA LYS A 8 -12.114 17.800 -13.831 1.00 0.00 C ATOM 68 C LYS A 8 -11.132 16.868 -13.119 1.00 0.00 C ATOM 69 O LYS A 8 -11.436 15.699 -12.889 1.00 0.00 O ATOM 70 CB LYS A 8 -12.649 18.925 -12.942 1.00 0.00 C ATOM 71 CG LYS A 8 -12.470 20.287 -13.615 1.00 0.00 C ATOM 72 CD LYS A 8 -12.188 21.377 -12.579 1.00 0.00 C ATOM 73 CE LYS A 8 -13.304 22.424 -12.568 1.00 0.00 C ATOM 74 NZ LYS A 8 -14.158 22.260 -11.371 1.00 0.00 N ATOM 0 H LYS A 8 -14.056 17.014 -13.805 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.563 18.293 -14.632 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -13.705 18.756 -12.731 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.127 18.917 -11.985 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.649 20.238 -14.330 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -13.368 20.539 -14.178 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.095 20.929 -11.590 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -11.235 21.858 -12.802 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -12.872 23.425 -12.579 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.909 22.328 -13.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -14.910 22.979 -11.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -14.585 21.312 -11.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -13.580 22.374 -10.514 1.00 0.00 H new ATOM 88 N PRO A 9 -9.943 17.436 -12.781 1.00 0.00 N ATOM 89 CA PRO A 9 -8.914 16.669 -12.100 1.00 0.00 C ATOM 90 C PRO A 9 -9.271 16.459 -10.627 1.00 0.00 C ATOM 91 O PRO A 9 -10.045 17.226 -10.057 1.00 0.00 O ATOM 92 CB PRO A 9 -7.635 17.468 -12.293 1.00 0.00 C ATOM 93 CG PRO A 9 -8.075 18.873 -12.669 1.00 0.00 C ATOM 94 CD PRO A 9 -9.548 18.818 -13.038 1.00 0.00 C ATOM 0 HA PRO A 9 -8.804 15.662 -12.503 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -7.038 17.476 -11.381 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -7.015 17.030 -13.075 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.916 19.558 -11.837 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -7.486 19.246 -13.506 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -10.133 19.515 -12.438 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -9.705 19.087 -14.083 1.00 0.00 H new ATOM 102 N GLU A 10 -8.691 15.415 -10.053 1.00 0.00 N ATOM 103 CA GLU A 10 -8.938 15.094 -8.658 1.00 0.00 C ATOM 104 C GLU A 10 -7.728 15.476 -7.803 1.00 0.00 C ATOM 105 O GLU A 10 -6.656 15.766 -8.332 1.00 0.00 O ATOM 106 CB GLU A 10 -9.284 13.614 -8.489 1.00 0.00 C ATOM 107 CG GLU A 10 -10.753 13.435 -8.099 1.00 0.00 C ATOM 108 CD GLU A 10 -11.589 12.991 -9.301 1.00 0.00 C ATOM 109 OE1 GLU A 10 -11.639 11.764 -9.536 1.00 0.00 O ATOM 110 OE2 GLU A 10 -12.160 13.889 -9.958 1.00 0.00 O ATOM 0 H GLU A 10 -8.050 14.780 -10.529 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.796 15.674 -8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.083 13.082 -9.419 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.645 13.172 -7.725 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -10.834 12.696 -7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.145 14.373 -7.705 1.00 0.00 H new ATOM 117 N PRO A 11 -7.946 15.463 -6.460 1.00 0.00 N ATOM 118 CA PRO A 11 -6.886 15.803 -5.527 1.00 0.00 C ATOM 119 C PRO A 11 -5.872 14.664 -5.409 1.00 0.00 C ATOM 120 O PRO A 11 -5.679 14.110 -4.328 1.00 0.00 O ATOM 121 CB PRO A 11 -7.596 16.105 -4.218 1.00 0.00 C ATOM 122 CG PRO A 11 -8.975 15.474 -4.337 1.00 0.00 C ATOM 123 CD PRO A 11 -9.202 15.124 -5.798 1.00 0.00 C ATOM 0 HA PRO A 11 -6.298 16.661 -5.853 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -7.048 15.690 -3.372 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -7.671 17.180 -4.053 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -9.041 14.581 -3.716 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -9.742 16.164 -3.986 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -9.441 14.067 -5.920 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -10.035 15.689 -6.216 1.00 0.00 H new ATOM 131 N THR A 12 -5.251 14.348 -6.536 1.00 0.00 N ATOM 132 CA THR A 12 -4.262 13.284 -6.572 1.00 0.00 C ATOM 133 C THR A 12 -3.147 13.626 -7.562 1.00 0.00 C ATOM 134 O THR A 12 -3.273 14.567 -8.344 1.00 0.00 O ATOM 135 CB THR A 12 -4.985 11.976 -6.899 1.00 0.00 C ATOM 136 OG1 THR A 12 -3.982 10.976 -6.744 1.00 0.00 O ATOM 137 CG2 THR A 12 -5.382 11.880 -8.374 1.00 0.00 C ATOM 0 H THR A 12 -5.414 14.810 -7.431 1.00 0.00 H new ATOM 0 HA THR A 12 -3.772 13.167 -5.606 1.00 0.00 H new ATOM 0 HB THR A 12 -5.875 11.888 -6.276 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.317 10.121 -7.087 1.00 0.00 H new ATOM 0 HG21 THR A 12 -5.892 10.933 -8.553 1.00 0.00 H new ATOM 0 HG22 THR A 12 -6.049 12.704 -8.626 1.00 0.00 H new ATOM 0 HG23 THR A 12 -4.488 11.934 -8.996 1.00 0.00 H new ATOM 145 N ASN A 13 -2.080 12.843 -7.497 1.00 0.00 N ATOM 146 CA ASN A 13 -0.944 13.051 -8.378 1.00 0.00 C ATOM 147 C ASN A 13 -1.448 13.364 -9.788 1.00 0.00 C ATOM 148 O ASN A 13 -1.052 14.364 -10.385 1.00 0.00 O ATOM 149 CB ASN A 13 -0.070 11.797 -8.456 1.00 0.00 C ATOM 150 CG ASN A 13 1.245 11.998 -7.700 1.00 0.00 C ATOM 151 OD1 ASN A 13 1.325 12.726 -6.724 1.00 0.00 O ATOM 152 ND2 ASN A 13 2.268 11.312 -8.202 1.00 0.00 N ATOM 0 H ASN A 13 -1.979 12.063 -6.847 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.355 13.877 -7.979 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.609 10.947 -8.037 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.139 11.559 -9.499 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.188 11.377 -7.767 1.00 0.00 H new ATOM 0 HD22 ASN A 13 2.132 10.721 -9.022 1.00 0.00 H new ATOM 159 N SER A 14 -2.314 12.490 -10.280 1.00 0.00 N ATOM 160 CA SER A 14 -2.876 12.660 -11.609 1.00 0.00 C ATOM 161 C SER A 14 -4.184 11.876 -11.728 1.00 0.00 C ATOM 162 O SER A 14 -5.230 12.448 -12.034 1.00 0.00 O ATOM 163 CB SER A 14 -1.888 12.211 -12.687 1.00 0.00 C ATOM 164 OG SER A 14 -1.482 13.292 -13.523 1.00 0.00 O ATOM 0 H SER A 14 -2.640 11.662 -9.782 1.00 0.00 H new ATOM 0 HA SER A 14 -3.080 13.720 -11.761 1.00 0.00 H new ATOM 0 HB2 SER A 14 -1.011 11.770 -12.214 1.00 0.00 H new ATOM 0 HB3 SER A 14 -2.346 11.433 -13.297 1.00 0.00 H new ATOM 0 HG SER A 14 -0.850 12.965 -14.197 1.00 0.00 H new ATOM 170 N SER A 15 -4.084 10.579 -11.481 1.00 0.00 N ATOM 171 CA SER A 15 -5.246 9.710 -11.556 1.00 0.00 C ATOM 172 C SER A 15 -4.827 8.255 -11.338 1.00 0.00 C ATOM 173 O SER A 15 -4.061 7.701 -12.124 1.00 0.00 O ATOM 174 CB SER A 15 -5.960 9.861 -12.901 1.00 0.00 C ATOM 175 OG SER A 15 -7.352 10.117 -12.741 1.00 0.00 O ATOM 0 H SER A 15 -3.215 10.108 -11.228 1.00 0.00 H new ATOM 0 HA SER A 15 -5.943 10.002 -10.770 1.00 0.00 H new ATOM 0 HB2 SER A 15 -5.504 10.675 -13.464 1.00 0.00 H new ATOM 0 HB3 SER A 15 -5.824 8.953 -13.488 1.00 0.00 H new ATOM 0 HG SER A 15 -7.771 10.209 -13.622 1.00 0.00 H new ATOM 181 N VAL A 16 -5.349 7.677 -10.265 1.00 0.00 N ATOM 182 CA VAL A 16 -5.038 6.297 -9.934 1.00 0.00 C ATOM 183 C VAL A 16 -6.227 5.674 -9.198 1.00 0.00 C ATOM 184 O VAL A 16 -6.858 6.326 -8.368 1.00 0.00 O ATOM 185 CB VAL A 16 -3.738 6.232 -9.130 1.00 0.00 C ATOM 186 CG1 VAL A 16 -3.659 4.937 -8.319 1.00 0.00 C ATOM 187 CG2 VAL A 16 -2.520 6.380 -10.045 1.00 0.00 C ATOM 0 H VAL A 16 -5.985 8.139 -9.615 1.00 0.00 H new ATOM 0 HA VAL A 16 -4.874 5.714 -10.840 1.00 0.00 H new ATOM 0 HB VAL A 16 -3.735 7.067 -8.429 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -2.725 4.916 -7.757 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.500 4.889 -7.627 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -3.695 4.082 -8.994 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -1.609 6.330 -9.449 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.517 5.575 -10.780 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -2.565 7.340 -10.559 1.00 0.00 H new ATOM 197 N GLU A 17 -6.496 4.420 -9.531 1.00 0.00 N ATOM 198 CA GLU A 17 -7.598 3.702 -8.912 1.00 0.00 C ATOM 199 C GLU A 17 -7.135 3.035 -7.616 1.00 0.00 C ATOM 200 O GLU A 17 -5.946 3.043 -7.299 1.00 0.00 O ATOM 201 CB GLU A 17 -8.192 2.673 -9.877 1.00 0.00 C ATOM 202 CG GLU A 17 -7.262 1.469 -10.034 1.00 0.00 C ATOM 203 CD GLU A 17 -7.766 0.527 -11.130 1.00 0.00 C ATOM 204 OE1 GLU A 17 -7.663 0.924 -12.311 1.00 0.00 O ATOM 205 OE2 GLU A 17 -8.242 -0.568 -10.762 1.00 0.00 O ATOM 0 H GLU A 17 -5.970 3.883 -10.221 1.00 0.00 H new ATOM 0 HA GLU A 17 -8.382 4.419 -8.668 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.163 2.342 -9.509 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.361 3.136 -10.849 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -6.256 1.811 -10.278 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -7.195 0.930 -9.089 1.00 0.00 H new ATOM 212 N VAL A 18 -8.098 2.473 -6.900 1.00 0.00 N ATOM 213 CA VAL A 18 -7.805 1.802 -5.645 1.00 0.00 C ATOM 214 C VAL A 18 -8.603 0.499 -5.569 1.00 0.00 C ATOM 215 O VAL A 18 -9.791 0.475 -5.887 1.00 0.00 O ATOM 216 CB VAL A 18 -8.083 2.744 -4.471 1.00 0.00 C ATOM 217 CG1 VAL A 18 -8.016 1.993 -3.139 1.00 0.00 C ATOM 218 CG2 VAL A 18 -7.120 3.932 -4.481 1.00 0.00 C ATOM 0 H VAL A 18 -9.083 2.469 -7.166 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.749 1.539 -5.590 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.095 3.134 -4.585 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.217 2.685 -2.321 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -8.760 1.197 -3.132 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -7.023 1.562 -3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.339 4.585 -3.637 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.095 3.570 -4.403 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.238 4.489 -5.411 1.00 0.00 H new ATOM 228 N SER A 19 -7.917 -0.553 -5.146 1.00 0.00 N ATOM 229 CA SER A 19 -8.547 -1.857 -5.025 1.00 0.00 C ATOM 230 C SER A 19 -9.164 -2.012 -3.633 1.00 0.00 C ATOM 231 O SER A 19 -8.706 -1.392 -2.674 1.00 0.00 O ATOM 232 CB SER A 19 -7.543 -2.981 -5.288 1.00 0.00 C ATOM 233 OG SER A 19 -7.899 -3.758 -6.428 1.00 0.00 O ATOM 0 H SER A 19 -6.932 -0.529 -4.883 1.00 0.00 H new ATOM 0 HA SER A 19 -9.334 -1.927 -5.775 1.00 0.00 H new ATOM 0 HB2 SER A 19 -6.551 -2.554 -5.436 1.00 0.00 H new ATOM 0 HB3 SER A 19 -7.485 -3.627 -4.412 1.00 0.00 H new ATOM 0 HG SER A 19 -7.233 -4.464 -6.564 1.00 0.00 H new ATOM 239 N PRO A 20 -10.221 -2.865 -3.565 1.00 0.00 N ATOM 240 CA PRO A 20 -10.906 -3.109 -2.306 1.00 0.00 C ATOM 241 C PRO A 20 -10.073 -4.014 -1.396 1.00 0.00 C ATOM 242 O PRO A 20 -10.369 -4.149 -0.210 1.00 0.00 O ATOM 243 CB PRO A 20 -12.239 -3.725 -2.697 1.00 0.00 C ATOM 244 CG PRO A 20 -12.064 -4.230 -4.120 1.00 0.00 C ATOM 245 CD PRO A 20 -10.791 -3.616 -4.679 1.00 0.00 C ATOM 0 HA PRO A 20 -11.058 -2.199 -1.726 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -12.505 -4.540 -2.024 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -13.041 -2.989 -2.640 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -12.001 -5.318 -4.134 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -12.922 -3.953 -4.732 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.103 -4.384 -5.032 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.005 -2.965 -5.527 1.00 0.00 H new ATOM 253 N ASP A 21 -9.047 -4.610 -1.986 1.00 0.00 N ATOM 254 CA ASP A 21 -8.170 -5.498 -1.243 1.00 0.00 C ATOM 255 C ASP A 21 -6.864 -4.768 -0.923 1.00 0.00 C ATOM 256 O ASP A 21 -5.905 -5.379 -0.455 1.00 0.00 O ATOM 257 CB ASP A 21 -7.825 -6.744 -2.062 1.00 0.00 C ATOM 258 CG ASP A 21 -8.988 -7.334 -2.863 1.00 0.00 C ATOM 259 OD1 ASP A 21 -9.967 -7.759 -2.212 1.00 0.00 O ATOM 260 OD2 ASP A 21 -8.872 -7.345 -4.107 1.00 0.00 O ATOM 0 H ASP A 21 -8.804 -4.495 -2.970 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.687 -5.797 -0.331 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.018 -6.495 -2.751 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.443 -7.510 -1.387 1.00 0.00 H new ATOM 265 N ILE A 22 -6.870 -3.469 -1.187 1.00 0.00 N ATOM 266 CA ILE A 22 -5.698 -2.649 -0.933 1.00 0.00 C ATOM 267 C ILE A 22 -5.114 -3.010 0.434 1.00 0.00 C ATOM 268 O ILE A 22 -3.901 -2.953 0.630 1.00 0.00 O ATOM 269 CB ILE A 22 -6.041 -1.165 -1.082 1.00 0.00 C ATOM 270 CG1 ILE A 22 -4.860 -0.285 -0.666 1.00 0.00 C ATOM 271 CG2 ILE A 22 -7.315 -0.816 -0.312 1.00 0.00 C ATOM 272 CD1 ILE A 22 -3.890 -0.081 -1.831 1.00 0.00 C ATOM 0 H ILE A 22 -7.668 -2.965 -1.574 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.924 -2.851 -1.674 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.237 -0.964 -2.135 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.226 0.681 -0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.336 -0.746 0.171 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.536 0.244 -0.435 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.146 -1.407 -0.697 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.173 -1.037 0.746 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.060 0.548 -1.508 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -3.507 -1.047 -2.159 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.411 0.402 -2.658 1.00 0.00 H new ATOM 284 N TYR A 23 -6.005 -3.376 1.344 1.00 0.00 N ATOM 285 CA TYR A 23 -5.593 -3.747 2.687 1.00 0.00 C ATOM 286 C TYR A 23 -4.816 -5.065 2.678 1.00 0.00 C ATOM 287 O TYR A 23 -3.651 -5.106 3.069 1.00 0.00 O ATOM 288 CB TYR A 23 -6.884 -3.935 3.487 1.00 0.00 C ATOM 289 CG TYR A 23 -7.930 -2.845 3.246 1.00 0.00 C ATOM 290 CD1 TYR A 23 -7.857 -1.653 3.937 1.00 0.00 C ATOM 291 CD2 TYR A 23 -8.946 -3.054 2.336 1.00 0.00 C ATOM 292 CE1 TYR A 23 -8.842 -0.627 3.710 1.00 0.00 C ATOM 293 CE2 TYR A 23 -9.931 -2.028 2.109 1.00 0.00 C ATOM 294 CZ TYR A 23 -9.830 -0.866 2.807 1.00 0.00 C ATOM 295 OH TYR A 23 -10.760 0.103 2.592 1.00 0.00 O ATOM 0 H TYR A 23 -7.010 -3.423 1.178 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.944 -2.983 3.114 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.318 -4.903 3.235 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -6.640 -3.962 4.549 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.061 -1.489 4.648 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -9.003 -3.987 1.794 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.797 0.310 4.245 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.732 -2.179 1.400 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.341 0.984 2.683 1.00 0.00 H new ATOM 305 N GLN A 24 -5.494 -6.111 2.227 1.00 0.00 N ATOM 306 CA GLN A 24 -4.882 -7.427 2.162 1.00 0.00 C ATOM 307 C GLN A 24 -3.659 -7.399 1.242 1.00 0.00 C ATOM 308 O GLN A 24 -2.768 -8.238 1.362 1.00 0.00 O ATOM 309 CB GLN A 24 -5.892 -8.479 1.699 1.00 0.00 C ATOM 310 CG GLN A 24 -5.282 -9.881 1.743 1.00 0.00 C ATOM 311 CD GLN A 24 -6.184 -10.847 2.515 1.00 0.00 C ATOM 312 OE1 GLN A 24 -7.234 -11.261 2.052 1.00 0.00 O ATOM 313 NE2 GLN A 24 -5.716 -11.182 3.714 1.00 0.00 N ATOM 0 H GLN A 24 -6.461 -6.073 1.903 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.553 -7.703 3.164 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.777 -8.443 2.335 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.219 -8.252 0.684 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.133 -10.249 0.728 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.300 -9.840 2.214 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -4.829 -10.799 4.041 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -6.244 -11.822 4.307 1.00 0.00 H new ATOM 322 N GLN A 25 -3.656 -6.425 0.344 1.00 0.00 N ATOM 323 CA GLN A 25 -2.558 -6.276 -0.596 1.00 0.00 C ATOM 324 C GLN A 25 -1.307 -5.770 0.125 1.00 0.00 C ATOM 325 O GLN A 25 -0.196 -6.204 -0.173 1.00 0.00 O ATOM 326 CB GLN A 25 -2.943 -5.344 -1.747 1.00 0.00 C ATOM 327 CG GLN A 25 -3.928 -6.026 -2.698 1.00 0.00 C ATOM 328 CD GLN A 25 -3.685 -5.590 -4.144 1.00 0.00 C ATOM 329 OE1 GLN A 25 -4.180 -4.391 -4.438 1.00 0.00 O flip ATOM 330 NE2 GLN A 25 -3.087 -6.295 -4.940 1.00 0.00 N flip ATOM 0 H GLN A 25 -4.397 -5.731 0.247 1.00 0.00 H new ATOM 0 HA GLN A 25 -2.337 -7.254 -1.023 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -3.389 -4.433 -1.348 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -2.048 -5.048 -2.295 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.826 -7.108 -2.619 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.949 -5.780 -2.407 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.732 -7.206 -4.649 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.941 -5.974 -5.897 1.00 0.00 H new ATOM 339 N VAL A 26 -1.531 -4.858 1.061 1.00 0.00 N ATOM 340 CA VAL A 26 -0.436 -4.288 1.827 1.00 0.00 C ATOM 341 C VAL A 26 0.195 -5.378 2.695 1.00 0.00 C ATOM 342 O VAL A 26 1.369 -5.706 2.531 1.00 0.00 O ATOM 343 CB VAL A 26 -0.933 -3.090 2.638 1.00 0.00 C ATOM 344 CG1 VAL A 26 0.169 -2.551 3.552 1.00 0.00 C ATOM 345 CG2 VAL A 26 -1.470 -1.990 1.719 1.00 0.00 C ATOM 0 H VAL A 26 -2.454 -4.500 1.306 1.00 0.00 H new ATOM 0 HA VAL A 26 0.341 -3.913 1.161 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.754 -3.430 3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.211 -1.700 4.117 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.484 -3.333 4.242 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.020 -2.235 2.949 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -1.817 -1.150 2.321 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.677 -1.655 1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -2.299 -2.381 1.130 1.00 0.00 H new ATOM 355 N ARG A 27 -0.613 -5.909 3.602 1.00 0.00 N ATOM 356 CA ARG A 27 -0.148 -6.955 4.497 1.00 0.00 C ATOM 357 C ARG A 27 0.711 -7.965 3.733 1.00 0.00 C ATOM 358 O ARG A 27 1.784 -8.348 4.196 1.00 0.00 O ATOM 359 CB ARG A 27 -1.324 -7.686 5.147 1.00 0.00 C ATOM 360 CG ARG A 27 -2.106 -6.752 6.073 1.00 0.00 C ATOM 361 CD ARG A 27 -3.593 -6.743 5.714 1.00 0.00 C ATOM 362 NE ARG A 27 -4.412 -6.775 6.947 1.00 0.00 N ATOM 363 CZ ARG A 27 -4.342 -7.744 7.870 1.00 0.00 C ATOM 364 NH1 ARG A 27 -3.491 -8.766 7.706 1.00 0.00 N ATOM 365 NH2 ARG A 27 -5.122 -7.690 8.958 1.00 0.00 N ATOM 0 H ARG A 27 -1.586 -5.634 3.736 1.00 0.00 H new ATOM 0 HA ARG A 27 0.448 -6.482 5.277 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.986 -8.076 4.374 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.957 -8.542 5.714 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -1.980 -7.071 7.108 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -1.704 -5.741 6.000 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.830 -5.852 5.133 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.830 -7.603 5.088 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.071 -6.012 7.104 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -2.896 -8.807 6.878 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -3.438 -9.503 8.409 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -5.769 -6.911 9.084 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -5.069 -8.427 9.661 1.00 0.00 H new ATOM 379 N ASP A 28 0.207 -8.366 2.575 1.00 0.00 N ATOM 380 CA ASP A 28 0.915 -9.323 1.742 1.00 0.00 C ATOM 381 C ASP A 28 2.210 -8.688 1.231 1.00 0.00 C ATOM 382 O ASP A 28 3.249 -9.345 1.179 1.00 0.00 O ATOM 383 CB ASP A 28 0.075 -9.725 0.528 1.00 0.00 C ATOM 384 CG ASP A 28 0.231 -11.182 0.087 1.00 0.00 C ATOM 385 OD1 ASP A 28 0.530 -12.013 0.972 1.00 0.00 O ATOM 386 OD2 ASP A 28 0.049 -11.430 -1.124 1.00 0.00 O ATOM 0 H ASP A 28 -0.683 -8.045 2.194 1.00 0.00 H new ATOM 0 HA ASP A 28 1.122 -10.207 2.346 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -0.975 -9.540 0.754 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.339 -9.078 -0.308 1.00 0.00 H new ATOM 391 N GLU A 29 2.106 -7.419 0.866 1.00 0.00 N ATOM 392 CA GLU A 29 3.256 -6.688 0.361 1.00 0.00 C ATOM 393 C GLU A 29 4.348 -6.612 1.430 1.00 0.00 C ATOM 394 O GLU A 29 5.522 -6.833 1.139 1.00 0.00 O ATOM 395 CB GLU A 29 2.853 -5.290 -0.111 1.00 0.00 C ATOM 396 CG GLU A 29 4.080 -4.476 -0.524 1.00 0.00 C ATOM 397 CD GLU A 29 4.879 -5.200 -1.610 1.00 0.00 C ATOM 398 OE1 GLU A 29 4.226 -5.743 -2.527 1.00 0.00 O ATOM 399 OE2 GLU A 29 6.124 -5.195 -1.498 1.00 0.00 O ATOM 0 H GLU A 29 1.243 -6.878 0.910 1.00 0.00 H new ATOM 0 HA GLU A 29 3.654 -7.226 -0.500 1.00 0.00 H new ATOM 0 HB2 GLU A 29 2.166 -5.371 -0.953 1.00 0.00 H new ATOM 0 HB3 GLU A 29 2.320 -4.772 0.687 1.00 0.00 H new ATOM 0 HG2 GLU A 29 3.766 -3.498 -0.890 1.00 0.00 H new ATOM 0 HG3 GLU A 29 4.715 -4.303 0.345 1.00 0.00 H new ATOM 406 N LEU A 30 3.921 -6.300 2.645 1.00 0.00 N ATOM 407 CA LEU A 30 4.848 -6.192 3.759 1.00 0.00 C ATOM 408 C LEU A 30 5.509 -7.551 4.000 1.00 0.00 C ATOM 409 O LEU A 30 6.724 -7.632 4.175 1.00 0.00 O ATOM 410 CB LEU A 30 4.141 -5.624 4.991 1.00 0.00 C ATOM 411 CG LEU A 30 3.299 -4.368 4.762 1.00 0.00 C ATOM 412 CD1 LEU A 30 2.435 -4.056 5.985 1.00 0.00 C ATOM 413 CD2 LEU A 30 4.181 -3.182 4.365 1.00 0.00 C ATOM 0 H LEU A 30 2.946 -6.119 2.882 1.00 0.00 H new ATOM 0 HA LEU A 30 5.645 -5.487 3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.496 -6.399 5.405 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.894 -5.400 5.746 1.00 0.00 H new ATOM 0 HG LEU A 30 2.621 -4.558 3.930 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.847 -3.158 5.795 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.766 -4.894 6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.076 -3.893 6.851 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.558 -2.302 4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.900 -2.981 5.160 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.715 -3.418 3.444 1.00 0.00 H new ATOM 425 N LYS A 31 4.679 -8.584 4.002 1.00 0.00 N ATOM 426 CA LYS A 31 5.168 -9.935 4.219 1.00 0.00 C ATOM 427 C LYS A 31 6.010 -10.368 3.018 1.00 0.00 C ATOM 428 O LYS A 31 6.678 -11.400 3.062 1.00 0.00 O ATOM 429 CB LYS A 31 4.006 -10.882 4.528 1.00 0.00 C ATOM 430 CG LYS A 31 4.518 -12.225 5.052 1.00 0.00 C ATOM 431 CD LYS A 31 3.955 -13.385 4.227 1.00 0.00 C ATOM 432 CE LYS A 31 2.761 -14.031 4.933 1.00 0.00 C ATOM 433 NZ LYS A 31 2.771 -15.497 4.733 1.00 0.00 N ATOM 0 H LYS A 31 3.672 -8.513 3.857 1.00 0.00 H new ATOM 0 HA LYS A 31 5.818 -9.968 5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.347 -10.426 5.267 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.413 -11.041 3.628 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.607 -12.243 5.015 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.232 -12.345 6.097 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.649 -13.023 3.245 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.733 -14.131 4.064 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.794 -13.803 5.998 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.832 -13.612 4.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.954 -15.919 5.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.717 -15.709 3.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.649 -15.895 5.123 1.00 0.00 H new ATOM 447 N ARG A 32 5.952 -9.556 1.972 1.00 0.00 N ATOM 448 CA ARG A 32 6.701 -9.842 0.760 1.00 0.00 C ATOM 449 C ARG A 32 8.102 -9.233 0.846 1.00 0.00 C ATOM 450 O ARG A 32 9.096 -9.918 0.611 1.00 0.00 O ATOM 451 CB ARG A 32 5.986 -9.287 -0.474 1.00 0.00 C ATOM 452 CG ARG A 32 6.020 -10.294 -1.626 1.00 0.00 C ATOM 453 CD ARG A 32 4.654 -10.958 -1.813 1.00 0.00 C ATOM 454 NE ARG A 32 4.791 -12.429 -1.722 1.00 0.00 N ATOM 455 CZ ARG A 32 3.835 -13.296 -2.085 1.00 0.00 C ATOM 456 NH1 ARG A 32 2.669 -12.845 -2.565 1.00 0.00 N ATOM 457 NH2 ARG A 32 4.047 -14.614 -1.967 1.00 0.00 N ATOM 0 H ARG A 32 5.398 -8.700 1.939 1.00 0.00 H new ATOM 0 HA ARG A 32 6.777 -10.925 0.665 1.00 0.00 H new ATOM 0 HB2 ARG A 32 4.952 -9.050 -0.224 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.460 -8.356 -0.786 1.00 0.00 H new ATOM 0 HG2 ARG A 32 6.312 -9.789 -2.547 1.00 0.00 H new ATOM 0 HG3 ARG A 32 6.774 -11.055 -1.427 1.00 0.00 H new ATOM 0 HD2 ARG A 32 3.960 -10.601 -1.052 1.00 0.00 H new ATOM 0 HD3 ARG A 32 4.236 -10.682 -2.781 1.00 0.00 H new ATOM 0 HE ARG A 32 5.667 -12.806 -1.361 1.00 0.00 H new ATOM 0 HH11 ARG A 32 2.508 -11.842 -2.654 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.942 -13.505 -2.841 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.935 -14.957 -1.601 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.320 -15.274 -2.243 1.00 0.00 H new ATOM 471 N ALA A 33 8.136 -7.952 1.184 1.00 0.00 N ATOM 472 CA ALA A 33 9.398 -7.243 1.304 1.00 0.00 C ATOM 473 C ALA A 33 9.882 -7.313 2.754 1.00 0.00 C ATOM 474 O ALA A 33 10.952 -6.801 3.081 1.00 0.00 O ATOM 475 CB ALA A 33 9.224 -5.803 0.817 1.00 0.00 C ATOM 0 H ALA A 33 7.309 -7.387 1.378 1.00 0.00 H new ATOM 0 HA ALA A 33 10.160 -7.709 0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.171 -5.271 0.907 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.908 -5.807 -0.226 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.468 -5.303 1.423 1.00 0.00 H new ATOM 481 N SER A 34 9.071 -7.952 3.585 1.00 0.00 N ATOM 482 CA SER A 34 9.402 -8.096 4.992 1.00 0.00 C ATOM 483 C SER A 34 9.861 -6.752 5.562 1.00 0.00 C ATOM 484 O SER A 34 10.910 -6.669 6.199 1.00 0.00 O ATOM 485 CB SER A 34 10.485 -9.157 5.197 1.00 0.00 C ATOM 486 OG SER A 34 10.390 -9.777 6.476 1.00 0.00 O ATOM 0 H SER A 34 8.185 -8.376 3.310 1.00 0.00 H new ATOM 0 HA SER A 34 8.507 -8.422 5.522 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.401 -9.916 4.419 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.468 -8.698 5.089 1.00 0.00 H new ATOM 0 HG SER A 34 11.098 -10.449 6.567 1.00 0.00 H new ATOM 492 N VAL A 35 9.053 -5.732 5.312 1.00 0.00 N ATOM 493 CA VAL A 35 9.363 -4.396 5.792 1.00 0.00 C ATOM 494 C VAL A 35 8.476 -4.073 6.996 1.00 0.00 C ATOM 495 O VAL A 35 7.609 -4.865 7.363 1.00 0.00 O ATOM 496 CB VAL A 35 9.217 -3.384 4.653 1.00 0.00 C ATOM 497 CG1 VAL A 35 9.151 -4.090 3.297 1.00 0.00 C ATOM 498 CG2 VAL A 35 7.994 -2.491 4.867 1.00 0.00 C ATOM 0 H VAL A 35 8.184 -5.804 4.783 1.00 0.00 H new ATOM 0 HA VAL A 35 10.399 -4.341 6.127 1.00 0.00 H new ATOM 0 HB VAL A 35 10.101 -2.747 4.655 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.047 -3.348 2.505 1.00 0.00 H new ATOM 0 HG12 VAL A 35 10.065 -4.663 3.140 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.294 -4.763 3.278 1.00 0.00 H new ATOM 0 HG21 VAL A 35 7.913 -1.781 4.044 1.00 0.00 H new ATOM 0 HG22 VAL A 35 7.096 -3.107 4.904 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.100 -1.947 5.806 1.00 0.00 H new ATOM 508 N SER A 36 8.723 -2.908 7.576 1.00 0.00 N ATOM 509 CA SER A 36 7.957 -2.471 8.732 1.00 0.00 C ATOM 510 C SER A 36 6.775 -1.611 8.280 1.00 0.00 C ATOM 511 O SER A 36 6.911 -0.784 7.380 1.00 0.00 O ATOM 512 CB SER A 36 8.836 -1.691 9.712 1.00 0.00 C ATOM 513 OG SER A 36 9.186 -2.471 10.851 1.00 0.00 O ATOM 0 H SER A 36 9.442 -2.253 7.268 1.00 0.00 H new ATOM 0 HA SER A 36 7.580 -3.354 9.248 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.743 -1.364 9.204 1.00 0.00 H new ATOM 0 HB3 SER A 36 8.310 -0.793 10.035 1.00 0.00 H new ATOM 0 HG SER A 36 9.748 -1.939 11.452 1.00 0.00 H new ATOM 519 N GLN A 37 5.640 -1.836 8.927 1.00 0.00 N ATOM 520 CA GLN A 37 4.434 -1.093 8.603 1.00 0.00 C ATOM 521 C GLN A 37 4.752 0.397 8.461 1.00 0.00 C ATOM 522 O GLN A 37 4.039 1.123 7.769 1.00 0.00 O ATOM 523 CB GLN A 37 3.349 -1.324 9.656 1.00 0.00 C ATOM 524 CG GLN A 37 2.500 -2.549 9.309 1.00 0.00 C ATOM 525 CD GLN A 37 1.324 -2.693 10.278 1.00 0.00 C ATOM 526 OE1 GLN A 37 0.176 -2.212 9.811 1.00 0.00 O flip ATOM 527 NE2 GLN A 37 1.451 -3.208 11.377 1.00 0.00 N flip ATOM 0 H GLN A 37 5.531 -2.522 9.674 1.00 0.00 H new ATOM 0 HA GLN A 37 4.051 -1.456 7.649 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.810 -1.462 10.634 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.711 -0.443 9.725 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.127 -2.460 8.289 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.118 -3.446 9.345 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.362 -3.557 11.674 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.646 -3.289 11.998 1.00 0.00 H new ATOM 536 N ALA A 38 5.821 0.808 9.125 1.00 0.00 N ATOM 537 CA ALA A 38 6.242 2.198 9.081 1.00 0.00 C ATOM 538 C ALA A 38 7.047 2.442 7.804 1.00 0.00 C ATOM 539 O ALA A 38 6.738 3.351 7.035 1.00 0.00 O ATOM 540 CB ALA A 38 7.037 2.532 10.345 1.00 0.00 C ATOM 0 H ALA A 38 6.409 0.202 9.697 1.00 0.00 H new ATOM 0 HA ALA A 38 5.377 2.860 9.057 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.353 3.575 10.311 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.410 2.371 11.222 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.915 1.889 10.403 1.00 0.00 H new ATOM 546 N VAL A 39 8.065 1.615 7.617 1.00 0.00 N ATOM 547 CA VAL A 39 8.918 1.730 6.446 1.00 0.00 C ATOM 548 C VAL A 39 8.045 1.837 5.194 1.00 0.00 C ATOM 549 O VAL A 39 8.269 2.702 4.349 1.00 0.00 O ATOM 550 CB VAL A 39 9.897 0.555 6.394 1.00 0.00 C ATOM 551 CG1 VAL A 39 10.518 0.420 5.003 1.00 0.00 C ATOM 552 CG2 VAL A 39 10.979 0.695 7.467 1.00 0.00 C ATOM 0 H VAL A 39 8.319 0.862 8.257 1.00 0.00 H new ATOM 0 HA VAL A 39 9.522 2.636 6.500 1.00 0.00 H new ATOM 0 HB VAL A 39 9.337 -0.357 6.600 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.210 -0.422 4.994 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.731 0.252 4.268 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.057 1.335 4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.662 -0.153 7.408 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.534 1.619 7.306 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.513 0.718 8.452 1.00 0.00 H new ATOM 562 N PHE A 40 7.069 0.945 5.114 1.00 0.00 N ATOM 563 CA PHE A 40 6.162 0.928 3.979 1.00 0.00 C ATOM 564 C PHE A 40 5.333 2.213 3.920 1.00 0.00 C ATOM 565 O PHE A 40 5.458 2.993 2.977 1.00 0.00 O ATOM 566 CB PHE A 40 5.221 -0.263 4.176 1.00 0.00 C ATOM 567 CG PHE A 40 4.064 -0.313 3.176 1.00 0.00 C ATOM 568 CD1 PHE A 40 4.244 -0.888 1.957 1.00 0.00 C ATOM 569 CD2 PHE A 40 2.856 0.216 3.507 1.00 0.00 C ATOM 570 CE1 PHE A 40 3.170 -0.935 1.029 1.00 0.00 C ATOM 571 CE2 PHE A 40 1.782 0.169 2.579 1.00 0.00 C ATOM 572 CZ PHE A 40 1.962 -0.406 1.359 1.00 0.00 C ATOM 0 H PHE A 40 6.886 0.229 5.817 1.00 0.00 H new ATOM 0 HA PHE A 40 6.729 0.850 3.051 1.00 0.00 H new ATOM 0 HB2 PHE A 40 5.797 -1.185 4.096 1.00 0.00 H new ATOM 0 HB3 PHE A 40 4.813 -0.228 5.186 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.203 -1.309 1.695 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.713 0.672 4.476 1.00 0.00 H new ATOM 0 HE1 PHE A 40 3.313 -1.391 0.061 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.823 0.590 2.842 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.145 -0.442 0.653 1.00 0.00 H new ATOM 582 N ALA A 41 4.506 2.393 4.939 1.00 0.00 N ATOM 583 CA ALA A 41 3.658 3.570 5.015 1.00 0.00 C ATOM 584 C ALA A 41 4.492 4.816 4.710 1.00 0.00 C ATOM 585 O ALA A 41 3.958 5.831 4.266 1.00 0.00 O ATOM 586 CB ALA A 41 2.997 3.635 6.394 1.00 0.00 C ATOM 0 H ALA A 41 4.405 1.743 5.719 1.00 0.00 H new ATOM 0 HA ALA A 41 2.861 3.517 4.273 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.361 4.518 6.451 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.393 2.741 6.550 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.766 3.692 7.164 1.00 0.00 H new ATOM 592 N ARG A 42 5.788 4.697 4.960 1.00 0.00 N ATOM 593 CA ARG A 42 6.701 5.801 4.717 1.00 0.00 C ATOM 594 C ARG A 42 7.040 5.891 3.227 1.00 0.00 C ATOM 595 O ARG A 42 7.166 6.986 2.681 1.00 0.00 O ATOM 596 CB ARG A 42 7.994 5.633 5.518 1.00 0.00 C ATOM 597 CG ARG A 42 8.873 6.880 5.407 1.00 0.00 C ATOM 598 CD ARG A 42 8.103 8.134 5.823 1.00 0.00 C ATOM 599 NE ARG A 42 8.922 8.948 6.747 1.00 0.00 N ATOM 600 CZ ARG A 42 8.998 8.738 8.069 1.00 0.00 C ATOM 601 NH1 ARG A 42 8.304 7.738 8.628 1.00 0.00 N ATOM 602 NH2 ARG A 42 9.768 9.527 8.830 1.00 0.00 N ATOM 0 H ARG A 42 6.227 3.853 5.328 1.00 0.00 H new ATOM 0 HA ARG A 42 6.206 6.718 5.037 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.756 5.444 6.565 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.542 4.764 5.153 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.755 6.765 6.038 1.00 0.00 H new ATOM 0 HG3 ARG A 42 9.226 6.990 4.382 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.843 8.720 4.942 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.167 7.853 6.306 1.00 0.00 H new ATOM 0 HE ARG A 42 9.463 9.718 6.354 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.718 7.137 8.048 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.361 7.577 9.634 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.297 10.288 8.404 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.825 9.367 9.836 1.00 0.00 H new ATOM 616 N VAL A 43 7.179 4.725 2.613 1.00 0.00 N ATOM 617 CA VAL A 43 7.501 4.659 1.198 1.00 0.00 C ATOM 618 C VAL A 43 6.227 4.368 0.402 1.00 0.00 C ATOM 619 O VAL A 43 6.285 4.128 -0.803 1.00 0.00 O ATOM 620 CB VAL A 43 8.604 3.625 0.960 1.00 0.00 C ATOM 621 CG1 VAL A 43 9.818 3.903 1.849 1.00 0.00 C ATOM 622 CG2 VAL A 43 8.079 2.204 1.178 1.00 0.00 C ATOM 0 H VAL A 43 7.075 3.819 3.070 1.00 0.00 H new ATOM 0 HA VAL A 43 7.890 5.616 0.850 1.00 0.00 H new ATOM 0 HB VAL A 43 8.923 3.709 -0.079 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.587 3.154 1.660 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.214 4.894 1.625 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.519 3.860 2.896 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.882 1.488 1.003 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.719 2.102 2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.261 2.008 0.485 1.00 0.00 H new ATOM 632 N ALA A 44 5.107 4.399 1.108 1.00 0.00 N ATOM 633 CA ALA A 44 3.821 4.141 0.483 1.00 0.00 C ATOM 634 C ALA A 44 3.096 5.469 0.253 1.00 0.00 C ATOM 635 O ALA A 44 2.731 5.793 -0.876 1.00 0.00 O ATOM 636 CB ALA A 44 3.012 3.179 1.355 1.00 0.00 C ATOM 0 H ALA A 44 5.063 4.599 2.107 1.00 0.00 H new ATOM 0 HA ALA A 44 3.955 3.665 -0.488 1.00 0.00 H new ATOM 0 HB1 ALA A 44 2.047 2.986 0.885 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.557 2.241 1.464 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.855 3.624 2.338 1.00 0.00 H new ATOM 642 N PHE A 45 2.909 6.201 1.341 1.00 0.00 N ATOM 643 CA PHE A 45 2.234 7.486 1.272 1.00 0.00 C ATOM 644 C PHE A 45 2.783 8.451 2.324 1.00 0.00 C ATOM 645 O PHE A 45 2.088 9.373 2.749 1.00 0.00 O ATOM 646 CB PHE A 45 0.753 7.229 1.556 1.00 0.00 C ATOM 647 CG PHE A 45 0.499 6.127 2.587 1.00 0.00 C ATOM 648 CD1 PHE A 45 0.739 4.828 2.267 1.00 0.00 C ATOM 649 CD2 PHE A 45 0.034 6.448 3.824 1.00 0.00 C ATOM 650 CE1 PHE A 45 0.504 3.805 3.224 1.00 0.00 C ATOM 651 CE2 PHE A 45 -0.202 5.425 4.781 1.00 0.00 C ATOM 652 CZ PHE A 45 0.038 4.126 4.461 1.00 0.00 C ATOM 0 H PHE A 45 3.213 5.929 2.276 1.00 0.00 H new ATOM 0 HA PHE A 45 2.388 7.935 0.291 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.295 8.154 1.907 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.256 6.962 0.624 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.109 4.574 1.285 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.156 7.480 4.079 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.695 2.773 2.970 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -0.572 5.680 5.763 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.141 3.349 5.189 1.00 0.00 H new ATOM 662 N ASN A 46 4.026 8.206 2.714 1.00 0.00 N ATOM 663 CA ASN A 46 4.676 9.042 3.709 1.00 0.00 C ATOM 664 C ASN A 46 3.816 9.086 4.973 1.00 0.00 C ATOM 665 O ASN A 46 3.297 10.139 5.339 1.00 0.00 O ATOM 666 CB ASN A 46 4.842 10.475 3.200 1.00 0.00 C ATOM 667 CG ASN A 46 5.702 11.302 4.159 1.00 0.00 C ATOM 668 OD1 ASN A 46 6.532 10.787 4.890 1.00 0.00 O ATOM 669 ND2 ASN A 46 5.457 12.608 4.116 1.00 0.00 N ATOM 0 H ASN A 46 4.600 7.441 2.359 1.00 0.00 H new ATOM 0 HA ASN A 46 5.658 8.617 3.917 1.00 0.00 H new ATOM 0 HB2 ASN A 46 5.302 10.463 2.212 1.00 0.00 H new ATOM 0 HB3 ASN A 46 3.863 10.941 3.090 1.00 0.00 H new ATOM 0 HD21 ASN A 46 5.978 13.245 4.719 1.00 0.00 H new ATOM 0 HD22 ASN A 46 4.748 12.973 3.480 1.00 0.00 H new ATOM 676 N ARG A 47 3.692 7.929 5.607 1.00 0.00 N ATOM 677 CA ARG A 47 2.904 7.822 6.823 1.00 0.00 C ATOM 678 C ARG A 47 3.636 6.962 7.855 1.00 0.00 C ATOM 679 O ARG A 47 4.712 6.434 7.579 1.00 0.00 O ATOM 680 CB ARG A 47 1.532 7.207 6.537 1.00 0.00 C ATOM 681 CG ARG A 47 0.462 8.292 6.407 1.00 0.00 C ATOM 682 CD ARG A 47 0.194 8.963 7.756 1.00 0.00 C ATOM 683 NE ARG A 47 -0.599 10.198 7.558 1.00 0.00 N ATOM 684 CZ ARG A 47 -0.076 11.375 7.191 1.00 0.00 C ATOM 685 NH1 ARG A 47 1.242 11.486 6.978 1.00 0.00 N ATOM 686 NH2 ARG A 47 -0.871 12.442 7.036 1.00 0.00 N ATOM 0 H ARG A 47 4.124 7.057 5.301 1.00 0.00 H new ATOM 0 HA ARG A 47 2.763 8.828 7.218 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.576 6.622 5.618 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.263 6.520 7.339 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.784 9.040 5.682 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.460 7.854 6.025 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -0.342 8.278 8.412 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.138 9.201 8.247 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.606 10.149 7.711 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.848 10.674 7.095 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.640 12.383 6.698 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.875 12.358 7.198 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.473 13.338 6.757 1.00 0.00 H new ATOM 700 N THR A 48 3.022 6.848 9.024 1.00 0.00 N ATOM 701 CA THR A 48 3.602 6.062 10.100 1.00 0.00 C ATOM 702 C THR A 48 2.975 4.666 10.138 1.00 0.00 C ATOM 703 O THR A 48 2.479 4.177 9.124 1.00 0.00 O ATOM 704 CB THR A 48 3.427 6.842 11.404 1.00 0.00 C ATOM 705 OG1 THR A 48 2.014 6.927 11.571 1.00 0.00 O ATOM 706 CG2 THR A 48 3.875 8.300 11.279 1.00 0.00 C ATOM 0 H THR A 48 2.129 7.287 9.249 1.00 0.00 H new ATOM 0 HA THR A 48 4.668 5.902 9.942 1.00 0.00 H new ATOM 0 HB THR A 48 3.994 6.354 12.197 1.00 0.00 H new ATOM 0 HG1 THR A 48 1.811 7.417 12.395 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.730 8.808 12.232 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.930 8.334 11.007 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.285 8.797 10.509 1.00 0.00 H new ATOM 714 N GLN A 49 3.018 4.066 11.318 1.00 0.00 N ATOM 715 CA GLN A 49 2.460 2.736 11.502 1.00 0.00 C ATOM 716 C GLN A 49 1.099 2.823 12.197 1.00 0.00 C ATOM 717 O GLN A 49 0.112 2.278 11.706 1.00 0.00 O ATOM 718 CB GLN A 49 3.421 1.842 12.287 1.00 0.00 C ATOM 719 CG GLN A 49 2.771 0.498 12.620 1.00 0.00 C ATOM 720 CD GLN A 49 2.635 0.314 14.133 1.00 0.00 C ATOM 721 OE1 GLN A 49 3.088 1.124 14.926 1.00 0.00 O ATOM 722 NE2 GLN A 49 1.989 -0.793 14.488 1.00 0.00 N ATOM 0 H GLN A 49 3.430 4.476 12.156 1.00 0.00 H new ATOM 0 HA GLN A 49 2.316 2.284 10.520 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.328 1.677 11.705 1.00 0.00 H new ATOM 0 HB3 GLN A 49 3.720 2.343 13.207 1.00 0.00 H new ATOM 0 HG2 GLN A 49 1.788 0.440 12.153 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.370 -0.312 12.204 1.00 0.00 H new ATOM 0 HE21 GLN A 49 1.635 -1.429 13.773 1.00 0.00 H new ATOM 0 HE22 GLN A 49 1.847 -1.006 15.475 1.00 0.00 H new ATOM 731 N GLY A 50 1.092 3.512 13.328 1.00 0.00 N ATOM 732 CA GLY A 50 -0.131 3.677 14.096 1.00 0.00 C ATOM 733 C GLY A 50 -1.308 4.029 13.183 1.00 0.00 C ATOM 734 O GLY A 50 -2.455 3.713 13.494 1.00 0.00 O ATOM 0 H GLY A 50 1.913 3.963 13.732 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -0.350 2.758 14.640 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.005 4.463 14.839 1.00 0.00 H new ATOM 738 N LEU A 51 -0.982 4.678 12.075 1.00 0.00 N ATOM 739 CA LEU A 51 -1.998 5.077 11.115 1.00 0.00 C ATOM 740 C LEU A 51 -2.297 3.904 10.180 1.00 0.00 C ATOM 741 O LEU A 51 -3.409 3.377 10.174 1.00 0.00 O ATOM 742 CB LEU A 51 -1.574 6.353 10.386 1.00 0.00 C ATOM 743 CG LEU A 51 -2.440 6.761 9.191 1.00 0.00 C ATOM 744 CD1 LEU A 51 -1.975 6.061 7.913 1.00 0.00 C ATOM 745 CD2 LEU A 51 -3.922 6.510 9.477 1.00 0.00 C ATOM 0 H LEU A 51 -0.029 4.938 11.820 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.929 5.324 11.625 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.570 7.174 11.103 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.548 6.227 10.040 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.321 7.833 9.032 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.607 6.368 7.079 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.941 6.334 7.704 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.046 4.981 8.043 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.515 6.808 8.612 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.080 5.450 9.677 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.229 7.093 10.346 1.00 0.00 H new ATOM 757 N LEU A 52 -1.285 3.529 9.411 1.00 0.00 N ATOM 758 CA LEU A 52 -1.426 2.428 8.473 1.00 0.00 C ATOM 759 C LEU A 52 -2.173 1.277 9.152 1.00 0.00 C ATOM 760 O LEU A 52 -3.034 0.646 8.542 1.00 0.00 O ATOM 761 CB LEU A 52 -0.062 2.027 7.909 1.00 0.00 C ATOM 762 CG LEU A 52 0.018 0.639 7.269 1.00 0.00 C ATOM 763 CD1 LEU A 52 -0.772 0.593 5.960 1.00 0.00 C ATOM 764 CD2 LEU A 52 1.473 0.207 7.076 1.00 0.00 C ATOM 0 H LEU A 52 -0.364 3.968 9.418 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.023 2.734 7.614 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.232 2.766 7.164 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.671 2.077 8.714 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.443 -0.078 7.949 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.699 -0.404 5.526 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.818 0.827 6.158 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.363 1.324 5.262 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.501 -0.782 6.620 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.981 0.920 6.427 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.974 0.175 8.043 1.00 0.00 H new ATOM 776 N SER A 53 -1.816 1.041 10.406 1.00 0.00 N ATOM 777 CA SER A 53 -2.441 -0.022 11.174 1.00 0.00 C ATOM 778 C SER A 53 -3.951 0.210 11.255 1.00 0.00 C ATOM 779 O SER A 53 -4.734 -0.602 10.763 1.00 0.00 O ATOM 780 CB SER A 53 -1.842 -0.113 12.579 1.00 0.00 C ATOM 781 OG SER A 53 -1.441 -1.441 12.904 1.00 0.00 O ATOM 0 H SER A 53 -1.102 1.568 10.909 1.00 0.00 H new ATOM 0 HA SER A 53 -2.251 -0.968 10.666 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.982 0.553 12.650 1.00 0.00 H new ATOM 0 HB3 SER A 53 -2.574 0.233 13.308 1.00 0.00 H new ATOM 0 HG SER A 53 -1.062 -1.456 13.808 1.00 0.00 H new ATOM 787 N GLU A 54 -4.314 1.320 11.879 1.00 0.00 N ATOM 788 CA GLU A 54 -5.717 1.669 12.031 1.00 0.00 C ATOM 789 C GLU A 54 -6.455 1.491 10.702 1.00 0.00 C ATOM 790 O GLU A 54 -7.634 1.142 10.685 1.00 0.00 O ATOM 791 CB GLU A 54 -5.873 3.097 12.558 1.00 0.00 C ATOM 792 CG GLU A 54 -6.179 4.071 11.419 1.00 0.00 C ATOM 793 CD GLU A 54 -6.036 5.522 11.885 1.00 0.00 C ATOM 794 OE1 GLU A 54 -5.330 5.726 12.895 1.00 0.00 O ATOM 795 OE2 GLU A 54 -6.637 6.393 11.220 1.00 0.00 O ATOM 0 H GLU A 54 -3.661 1.990 12.286 1.00 0.00 H new ATOM 0 HA GLU A 54 -6.161 0.996 12.764 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.675 3.131 13.295 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -4.959 3.403 13.067 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.503 3.885 10.585 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -7.191 3.901 11.052 1.00 0.00 H new ATOM 802 N ILE A 55 -5.730 1.739 9.622 1.00 0.00 N ATOM 803 CA ILE A 55 -6.301 1.611 8.292 1.00 0.00 C ATOM 804 C ILE A 55 -6.561 0.133 7.994 1.00 0.00 C ATOM 805 O ILE A 55 -7.643 -0.230 7.535 1.00 0.00 O ATOM 806 CB ILE A 55 -5.408 2.299 7.257 1.00 0.00 C ATOM 807 CG1 ILE A 55 -5.356 3.809 7.495 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.856 1.959 5.834 1.00 0.00 C ATOM 809 CD1 ILE A 55 -4.318 4.472 6.587 1.00 0.00 C ATOM 0 H ILE A 55 -4.752 2.028 9.640 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.263 2.122 8.239 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.393 1.919 7.375 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.338 4.244 7.309 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -5.112 4.008 8.538 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.205 2.461 5.118 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.800 0.881 5.683 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.883 2.293 5.686 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.301 5.545 6.776 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.333 4.052 6.793 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -4.579 4.292 5.544 1.00 0.00 H new ATOM 821 N LEU A 56 -5.551 -0.680 8.267 1.00 0.00 N ATOM 822 CA LEU A 56 -5.658 -2.110 8.034 1.00 0.00 C ATOM 823 C LEU A 56 -6.614 -2.720 9.061 1.00 0.00 C ATOM 824 O LEU A 56 -7.073 -3.849 8.893 1.00 0.00 O ATOM 825 CB LEU A 56 -4.271 -2.756 8.026 1.00 0.00 C ATOM 826 CG LEU A 56 -3.281 -2.207 6.996 1.00 0.00 C ATOM 827 CD1 LEU A 56 -1.840 -2.527 7.396 1.00 0.00 C ATOM 828 CD2 LEU A 56 -3.613 -2.716 5.592 1.00 0.00 C ATOM 0 H LEU A 56 -4.655 -0.376 8.647 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.082 -2.305 7.049 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.833 -2.642 9.018 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.391 -3.825 7.851 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.375 -1.121 6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.157 -2.126 6.647 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.623 -2.076 8.364 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.712 -3.607 7.462 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.895 -2.311 4.879 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.564 -3.805 5.579 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -4.618 -2.395 5.317 1.00 0.00 H new ATOM 840 N ARG A 57 -6.887 -1.946 10.101 1.00 0.00 N ATOM 841 CA ARG A 57 -7.781 -2.396 11.154 1.00 0.00 C ATOM 842 C ARG A 57 -9.238 -2.168 10.747 1.00 0.00 C ATOM 843 O ARG A 57 -10.022 -3.114 10.676 1.00 0.00 O ATOM 844 CB ARG A 57 -7.503 -1.657 12.465 1.00 0.00 C ATOM 845 CG ARG A 57 -7.696 -2.583 13.668 1.00 0.00 C ATOM 846 CD ARG A 57 -9.155 -2.584 14.130 1.00 0.00 C ATOM 847 NE ARG A 57 -9.463 -3.852 14.829 1.00 0.00 N ATOM 848 CZ ARG A 57 -10.703 -4.320 15.024 1.00 0.00 C ATOM 849 NH1 ARG A 57 -11.758 -3.629 14.574 1.00 0.00 N ATOM 850 NH2 ARG A 57 -10.887 -5.480 15.669 1.00 0.00 N ATOM 0 H ARG A 57 -6.505 -1.010 10.237 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.605 -3.461 11.306 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.484 -1.270 12.459 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.170 -0.799 12.551 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.394 -3.596 13.404 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.052 -2.261 14.486 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.335 -1.739 14.795 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.817 -2.462 13.273 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.682 -4.404 15.184 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.618 -2.746 14.083 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.702 -3.985 14.723 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -10.083 -6.006 16.011 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.831 -5.837 15.818 1.00 0.00 H new ATOM 864 N LYS A 58 -9.558 -0.908 10.491 1.00 0.00 N ATOM 865 CA LYS A 58 -10.907 -0.544 10.093 1.00 0.00 C ATOM 866 C LYS A 58 -11.114 -0.903 8.620 1.00 0.00 C ATOM 867 O LYS A 58 -12.185 -1.371 8.236 1.00 0.00 O ATOM 868 CB LYS A 58 -11.181 0.927 10.412 1.00 0.00 C ATOM 869 CG LYS A 58 -10.986 1.210 11.903 1.00 0.00 C ATOM 870 CD LYS A 58 -10.406 2.609 12.123 1.00 0.00 C ATOM 871 CE LYS A 58 -9.796 2.735 13.521 1.00 0.00 C ATOM 872 NZ LYS A 58 -10.666 3.555 14.394 1.00 0.00 N ATOM 0 H LYS A 58 -8.906 -0.126 10.552 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.640 -1.112 10.666 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.513 1.560 9.828 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.200 1.183 10.120 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.941 1.122 12.422 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -10.319 0.464 12.335 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.645 2.814 11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -11.190 3.356 11.995 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.663 1.745 13.957 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.807 3.189 13.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.238 3.631 15.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.772 4.505 13.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.601 3.106 14.473 1.00 0.00 H new ATOM 886 N GLU A 59 -10.072 -0.671 7.835 1.00 0.00 N ATOM 887 CA GLU A 59 -10.126 -0.964 6.413 1.00 0.00 C ATOM 888 C GLU A 59 -11.171 -0.080 5.729 1.00 0.00 C ATOM 889 O GLU A 59 -11.975 -0.565 4.934 1.00 0.00 O ATOM 890 CB GLU A 59 -10.418 -2.446 6.170 1.00 0.00 C ATOM 891 CG GLU A 59 -9.169 -3.297 6.409 1.00 0.00 C ATOM 892 CD GLU A 59 -9.242 -4.609 5.625 1.00 0.00 C ATOM 893 OE1 GLU A 59 -9.711 -4.554 4.467 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.827 -5.638 6.200 1.00 0.00 O ATOM 0 H GLU A 59 -9.185 -0.283 8.157 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.151 -0.743 5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.219 -2.776 6.831 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.769 -2.588 5.148 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.282 -2.739 6.110 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.068 -3.510 7.473 1.00 0.00 H new ATOM 901 N GLU A 60 -11.124 1.201 6.062 1.00 0.00 N ATOM 902 CA GLU A 60 -12.056 2.158 5.489 1.00 0.00 C ATOM 903 C GLU A 60 -12.145 1.969 3.973 1.00 0.00 C ATOM 904 O GLU A 60 -11.240 2.364 3.241 1.00 0.00 O ATOM 905 CB GLU A 60 -11.656 3.592 5.841 1.00 0.00 C ATOM 906 CG GLU A 60 -12.656 4.217 6.816 1.00 0.00 C ATOM 907 CD GLU A 60 -13.055 5.624 6.366 1.00 0.00 C ATOM 908 OE1 GLU A 60 -12.299 6.562 6.699 1.00 0.00 O ATOM 909 OE2 GLU A 60 -14.106 5.729 5.698 1.00 0.00 O ATOM 0 H GLU A 60 -10.455 1.599 6.721 1.00 0.00 H new ATOM 0 HA GLU A 60 -13.042 1.976 5.917 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.660 3.597 6.283 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -11.605 4.192 4.933 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.544 3.588 6.885 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.218 4.261 7.813 1.00 0.00 H new ATOM 916 N ASP A 61 -13.246 1.366 3.547 1.00 0.00 N ATOM 917 CA ASP A 61 -13.465 1.121 2.132 1.00 0.00 C ATOM 918 C ASP A 61 -13.094 2.375 1.338 1.00 0.00 C ATOM 919 O ASP A 61 -13.371 3.492 1.771 1.00 0.00 O ATOM 920 CB ASP A 61 -14.934 0.799 1.850 1.00 0.00 C ATOM 921 CG ASP A 61 -15.194 -0.604 1.299 1.00 0.00 C ATOM 922 OD1 ASP A 61 -14.203 -1.354 1.165 1.00 0.00 O ATOM 923 OD2 ASP A 61 -16.378 -0.895 1.024 1.00 0.00 O ATOM 0 H ASP A 61 -13.995 1.040 4.157 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.847 0.273 1.837 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -15.501 0.921 2.773 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.321 1.530 1.139 1.00 0.00 H new ATOM 928 N PRO A 62 -12.456 2.142 0.160 1.00 0.00 N ATOM 929 CA PRO A 62 -12.045 3.239 -0.698 1.00 0.00 C ATOM 930 C PRO A 62 -13.245 3.844 -1.429 1.00 0.00 C ATOM 931 O PRO A 62 -13.094 4.786 -2.206 1.00 0.00 O ATOM 932 CB PRO A 62 -11.017 2.637 -1.643 1.00 0.00 C ATOM 933 CG PRO A 62 -11.232 1.133 -1.587 1.00 0.00 C ATOM 934 CD PRO A 62 -12.111 0.832 -0.384 1.00 0.00 C ATOM 0 HA PRO A 62 -11.615 4.070 -0.139 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -11.151 3.013 -2.657 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.004 2.899 -1.337 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -11.706 0.781 -2.503 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.277 0.614 -1.502 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.003 0.276 -0.674 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.582 0.225 0.351 1.00 0.00 H new ATOM 942 N ARG A 63 -14.411 3.279 -1.153 1.00 0.00 N ATOM 943 CA ARG A 63 -15.637 3.750 -1.774 1.00 0.00 C ATOM 944 C ARG A 63 -16.244 4.889 -0.952 1.00 0.00 C ATOM 945 O ARG A 63 -16.829 5.818 -1.508 1.00 0.00 O ATOM 946 CB ARG A 63 -16.661 2.620 -1.901 1.00 0.00 C ATOM 947 CG ARG A 63 -16.020 1.364 -2.493 1.00 0.00 C ATOM 948 CD ARG A 63 -16.674 0.989 -3.824 1.00 0.00 C ATOM 949 NE ARG A 63 -17.149 -0.412 -3.778 1.00 0.00 N ATOM 950 CZ ARG A 63 -18.242 -0.813 -3.114 1.00 0.00 C ATOM 951 NH1 ARG A 63 -18.978 0.077 -2.435 1.00 0.00 N ATOM 952 NH2 ARG A 63 -18.597 -2.105 -3.127 1.00 0.00 N ATOM 0 H ARG A 63 -14.533 2.499 -0.507 1.00 0.00 H new ATOM 0 HA ARG A 63 -15.386 4.110 -2.772 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -17.079 2.392 -0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -17.488 2.943 -2.533 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -14.953 1.532 -2.643 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -16.117 0.536 -1.790 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -17.509 1.658 -4.029 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -15.959 1.113 -4.637 1.00 0.00 H new ATOM 0 HE ARG A 63 -16.611 -1.116 -4.283 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -18.707 1.060 -2.423 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -19.810 -0.229 -1.930 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -18.035 -2.783 -3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -19.429 -2.410 -2.622 1.00 0.00 H new ATOM 966 N THR A 64 -16.085 4.781 0.359 1.00 0.00 N ATOM 967 CA THR A 64 -16.610 5.790 1.263 1.00 0.00 C ATOM 968 C THR A 64 -15.466 6.538 1.949 1.00 0.00 C ATOM 969 O THR A 64 -15.643 7.666 2.405 1.00 0.00 O ATOM 970 CB THR A 64 -17.559 5.098 2.244 1.00 0.00 C ATOM 971 OG1 THR A 64 -17.705 6.037 3.306 1.00 0.00 O ATOM 972 CG2 THR A 64 -16.923 3.876 2.910 1.00 0.00 C ATOM 0 H THR A 64 -15.600 4.010 0.817 1.00 0.00 H new ATOM 0 HA THR A 64 -17.175 6.550 0.723 1.00 0.00 H new ATOM 0 HB THR A 64 -18.465 4.795 1.720 1.00 0.00 H new ATOM 0 HG1 THR A 64 -18.307 5.670 3.987 1.00 0.00 H new ATOM 0 HG21 THR A 64 -17.638 3.422 3.596 1.00 0.00 H new ATOM 0 HG22 THR A 64 -16.642 3.151 2.147 1.00 0.00 H new ATOM 0 HG23 THR A 64 -16.035 4.184 3.462 1.00 0.00 H new ATOM 980 N ALA A 65 -14.317 5.879 2.001 1.00 0.00 N ATOM 981 CA ALA A 65 -13.144 6.468 2.624 1.00 0.00 C ATOM 982 C ALA A 65 -13.081 7.957 2.277 1.00 0.00 C ATOM 983 O ALA A 65 -13.345 8.345 1.140 1.00 0.00 O ATOM 984 CB ALA A 65 -11.893 5.711 2.175 1.00 0.00 C ATOM 0 H ALA A 65 -14.174 4.943 1.622 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.203 6.385 3.709 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -11.013 6.153 2.642 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -11.975 4.665 2.471 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -11.799 5.775 1.091 1.00 0.00 H new ATOM 990 N SER A 66 -12.729 8.750 3.278 1.00 0.00 N ATOM 991 CA SER A 66 -12.628 10.188 3.093 1.00 0.00 C ATOM 992 C SER A 66 -11.392 10.522 2.255 1.00 0.00 C ATOM 993 O SER A 66 -10.418 9.770 2.252 1.00 0.00 O ATOM 994 CB SER A 66 -12.568 10.914 4.439 1.00 0.00 C ATOM 995 OG SER A 66 -13.857 11.338 4.874 1.00 0.00 O ATOM 0 H SER A 66 -12.510 8.424 4.220 1.00 0.00 H new ATOM 0 HA SER A 66 -13.520 10.528 2.566 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.132 10.253 5.188 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.911 11.779 4.355 1.00 0.00 H new ATOM 0 HG SER A 66 -13.777 11.795 5.737 1.00 0.00 H new ATOM 1001 N GLN A 67 -11.472 11.650 1.564 1.00 0.00 N ATOM 1002 CA GLN A 67 -10.372 12.092 0.724 1.00 0.00 C ATOM 1003 C GLN A 67 -9.043 11.938 1.466 1.00 0.00 C ATOM 1004 O GLN A 67 -8.072 11.429 0.908 1.00 0.00 O ATOM 1005 CB GLN A 67 -10.580 13.536 0.265 1.00 0.00 C ATOM 1006 CG GLN A 67 -11.150 13.584 -1.154 1.00 0.00 C ATOM 1007 CD GLN A 67 -11.498 15.018 -1.558 1.00 0.00 C ATOM 1008 OE1 GLN A 67 -10.854 15.975 -1.161 1.00 0.00 O ATOM 1009 NE2 GLN A 67 -12.550 15.113 -2.366 1.00 0.00 N ATOM 0 H GLN A 67 -12.281 12.271 1.569 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.344 11.463 -0.166 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -11.258 14.045 0.950 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -9.631 14.072 0.298 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -10.425 13.171 -1.855 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.041 12.960 -1.213 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -13.045 14.271 -2.661 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -12.862 16.028 -2.691 1.00 0.00 H new ATOM 1018 N SER A 68 -9.041 12.389 2.712 1.00 0.00 N ATOM 1019 CA SER A 68 -7.847 12.308 3.535 1.00 0.00 C ATOM 1020 C SER A 68 -7.264 10.895 3.474 1.00 0.00 C ATOM 1021 O SER A 68 -6.074 10.721 3.214 1.00 0.00 O ATOM 1022 CB SER A 68 -8.150 12.694 4.984 1.00 0.00 C ATOM 1023 OG SER A 68 -7.221 13.651 5.487 1.00 0.00 O ATOM 0 H SER A 68 -9.848 12.812 3.171 1.00 0.00 H new ATOM 0 HA SER A 68 -7.114 13.014 3.144 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.159 13.101 5.047 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.126 11.802 5.610 1.00 0.00 H new ATOM 0 HG SER A 68 -7.449 13.873 6.414 1.00 0.00 H new ATOM 1029 N LEU A 69 -8.129 9.921 3.718 1.00 0.00 N ATOM 1030 CA LEU A 69 -7.714 8.528 3.694 1.00 0.00 C ATOM 1031 C LEU A 69 -7.422 8.113 2.251 1.00 0.00 C ATOM 1032 O LEU A 69 -6.332 7.632 1.948 1.00 0.00 O ATOM 1033 CB LEU A 69 -8.754 7.648 4.389 1.00 0.00 C ATOM 1034 CG LEU A 69 -8.217 6.389 5.073 1.00 0.00 C ATOM 1035 CD1 LEU A 69 -9.254 5.803 6.034 1.00 0.00 C ATOM 1036 CD2 LEU A 69 -7.748 5.362 4.041 1.00 0.00 C ATOM 0 H LEU A 69 -9.115 10.069 3.933 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.790 8.395 4.257 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.271 8.251 5.136 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.498 7.348 3.651 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.347 6.668 5.668 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.847 4.909 6.507 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.498 6.540 6.799 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.156 5.542 5.481 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.371 4.477 4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.584 5.082 3.401 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.954 5.794 3.432 1.00 0.00 H new ATOM 1048 N LEU A 70 -8.417 8.313 1.398 1.00 0.00 N ATOM 1049 CA LEU A 70 -8.281 7.965 -0.006 1.00 0.00 C ATOM 1050 C LEU A 70 -6.910 8.423 -0.510 1.00 0.00 C ATOM 1051 O LEU A 70 -6.213 7.673 -1.191 1.00 0.00 O ATOM 1052 CB LEU A 70 -9.452 8.528 -0.813 1.00 0.00 C ATOM 1053 CG LEU A 70 -10.640 7.585 -1.018 1.00 0.00 C ATOM 1054 CD1 LEU A 70 -11.869 8.351 -1.512 1.00 0.00 C ATOM 1055 CD2 LEU A 70 -10.270 6.431 -1.952 1.00 0.00 C ATOM 0 H LEU A 70 -9.321 8.712 1.653 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.324 6.884 -0.137 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.810 9.429 -0.315 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.081 8.831 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 70 -10.899 7.148 -0.054 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -12.699 7.658 -1.650 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -12.146 9.107 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -11.639 8.835 -2.461 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -11.132 5.776 -2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.969 6.829 -2.921 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.445 5.864 -1.521 1.00 0.00 H new ATOM 1067 N VAL A 71 -6.565 9.652 -0.155 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.291 10.218 -0.562 1.00 0.00 C ATOM 1069 C VAL A 71 -4.174 9.214 -0.271 1.00 0.00 C ATOM 1070 O VAL A 71 -3.264 9.040 -1.080 1.00 0.00 O ATOM 1071 CB VAL A 71 -5.074 11.568 0.125 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -3.583 11.896 0.232 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -5.830 12.682 -0.603 1.00 0.00 C ATOM 0 H VAL A 71 -7.146 10.271 0.410 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.285 10.409 -1.635 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.475 11.497 1.136 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.457 12.860 0.724 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.081 11.123 0.814 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.147 11.938 -0.766 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.659 13.631 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.474 12.752 -1.631 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.897 12.458 -0.603 1.00 0.00 H new ATOM 1083 N ASN A 72 -4.281 8.577 0.886 1.00 0.00 N ATOM 1084 CA ASN A 72 -3.292 7.594 1.294 1.00 0.00 C ATOM 1085 C ASN A 72 -3.499 6.307 0.494 1.00 0.00 C ATOM 1086 O ASN A 72 -2.547 5.749 -0.049 1.00 0.00 O ATOM 1087 CB ASN A 72 -3.432 7.256 2.780 1.00 0.00 C ATOM 1088 CG ASN A 72 -3.042 8.450 3.653 1.00 0.00 C ATOM 1089 OD1 ASN A 72 -1.982 9.037 3.511 1.00 0.00 O ATOM 1090 ND2 ASN A 72 -3.956 8.776 4.562 1.00 0.00 N ATOM 0 H ASN A 72 -5.038 8.723 1.554 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.303 8.014 1.112 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -4.460 6.964 2.995 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.801 6.401 3.023 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.790 9.560 5.194 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.823 8.243 4.628 1.00 0.00 H new ATOM 1097 N LEU A 73 -4.750 5.872 0.448 1.00 0.00 N ATOM 1098 CA LEU A 73 -5.094 4.660 -0.276 1.00 0.00 C ATOM 1099 C LEU A 73 -4.546 4.750 -1.702 1.00 0.00 C ATOM 1100 O LEU A 73 -3.848 3.846 -2.160 1.00 0.00 O ATOM 1101 CB LEU A 73 -6.602 4.407 -0.212 1.00 0.00 C ATOM 1102 CG LEU A 73 -7.222 4.403 1.186 1.00 0.00 C ATOM 1103 CD1 LEU A 73 -8.739 4.216 1.113 1.00 0.00 C ATOM 1104 CD2 LEU A 73 -6.557 3.352 2.078 1.00 0.00 C ATOM 0 H LEU A 73 -5.537 6.337 0.900 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.628 3.792 0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.104 5.169 -0.808 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.810 3.446 -0.683 1.00 0.00 H new ATOM 0 HG LEU A 73 -7.039 5.375 1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.155 4.217 2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.179 5.031 0.538 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.966 3.267 0.628 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -7.016 3.370 3.066 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.687 2.364 1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.493 3.572 2.168 1.00 0.00 H new ATOM 1116 N ARG A 74 -4.882 5.847 -2.363 1.00 0.00 N ATOM 1117 CA ARG A 74 -4.432 6.067 -3.727 1.00 0.00 C ATOM 1118 C ARG A 74 -2.909 5.953 -3.808 1.00 0.00 C ATOM 1119 O ARG A 74 -2.379 5.272 -4.686 1.00 0.00 O ATOM 1120 CB ARG A 74 -4.862 7.445 -4.234 1.00 0.00 C ATOM 1121 CG ARG A 74 -6.244 7.383 -4.887 1.00 0.00 C ATOM 1122 CD ARG A 74 -6.689 8.768 -5.361 1.00 0.00 C ATOM 1123 NE ARG A 74 -7.520 8.643 -6.580 1.00 0.00 N ATOM 1124 CZ ARG A 74 -8.330 9.607 -7.039 1.00 0.00 C ATOM 1125 NH1 ARG A 74 -8.423 10.772 -6.383 1.00 0.00 N ATOM 1126 NH2 ARG A 74 -9.047 9.405 -8.153 1.00 0.00 N ATOM 0 H ARG A 74 -5.461 6.594 -1.979 1.00 0.00 H new ATOM 0 HA ARG A 74 -4.891 5.303 -4.355 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.879 8.152 -3.405 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.132 7.815 -4.954 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.220 6.696 -5.733 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.969 6.988 -4.175 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.256 9.266 -4.574 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -5.817 9.388 -5.567 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.473 7.769 -7.103 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -7.877 10.925 -5.535 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.039 11.506 -6.732 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.976 8.518 -8.651 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.664 10.138 -8.503 1.00 0.00 H new ATOM 1140 N ALA A 75 -2.247 6.630 -2.882 1.00 0.00 N ATOM 1141 CA ALA A 75 -0.794 6.613 -2.838 1.00 0.00 C ATOM 1142 C ALA A 75 -0.309 5.168 -2.713 1.00 0.00 C ATOM 1143 O ALA A 75 0.564 4.736 -3.465 1.00 0.00 O ATOM 1144 CB ALA A 75 -0.309 7.493 -1.684 1.00 0.00 C ATOM 0 H ALA A 75 -2.689 7.194 -2.156 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.377 7.022 -3.758 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.780 7.481 -1.650 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.656 8.515 -1.835 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.705 7.111 -0.743 1.00 0.00 H new ATOM 1150 N MET A 76 -0.895 4.460 -1.758 1.00 0.00 N ATOM 1151 CA MET A 76 -0.532 3.073 -1.526 1.00 0.00 C ATOM 1152 C MET A 76 -0.627 2.258 -2.818 1.00 0.00 C ATOM 1153 O MET A 76 0.389 1.811 -3.350 1.00 0.00 O ATOM 1154 CB MET A 76 -1.465 2.471 -0.473 1.00 0.00 C ATOM 1155 CG MET A 76 -1.045 2.891 0.936 1.00 0.00 C ATOM 1156 SD MET A 76 -2.150 2.176 2.142 1.00 0.00 S ATOM 1157 CE MET A 76 -3.129 3.611 2.554 1.00 0.00 C ATOM 0 H MET A 76 -1.618 4.821 -1.136 1.00 0.00 H new ATOM 0 HA MET A 76 0.499 3.040 -1.173 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.489 2.793 -0.662 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.454 1.384 -0.551 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.022 2.568 1.131 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.057 3.978 1.019 1.00 0.00 H new ATOM 0 HE1 MET A 76 -3.941 3.318 3.219 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.501 4.350 3.052 1.00 0.00 H new ATOM 0 HE3 MET A 76 -3.544 4.042 1.643 1.00 0.00 H new ATOM 1167 N GLN A 77 -1.855 2.089 -3.285 1.00 0.00 N ATOM 1168 CA GLN A 77 -2.095 1.336 -4.504 1.00 0.00 C ATOM 1169 C GLN A 77 -1.158 1.813 -5.616 1.00 0.00 C ATOM 1170 O GLN A 77 -0.747 1.025 -6.467 1.00 0.00 O ATOM 1171 CB GLN A 77 -3.559 1.444 -4.936 1.00 0.00 C ATOM 1172 CG GLN A 77 -3.795 0.716 -6.261 1.00 0.00 C ATOM 1173 CD GLN A 77 -4.636 -0.545 -6.051 1.00 0.00 C ATOM 1174 OE1 GLN A 77 -5.672 -0.740 -6.664 1.00 0.00 O ATOM 1175 NE2 GLN A 77 -4.133 -1.387 -5.152 1.00 0.00 N ATOM 0 H GLN A 77 -2.695 2.461 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 77 -1.886 0.285 -4.306 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.202 1.020 -4.165 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.835 2.493 -5.039 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -4.300 1.382 -6.961 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.838 0.449 -6.709 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.260 -1.162 -4.675 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.620 -2.258 -4.940 1.00 0.00 H new ATOM 1184 N ASN A 78 -0.847 3.100 -5.572 1.00 0.00 N ATOM 1185 CA ASN A 78 0.033 3.691 -6.565 1.00 0.00 C ATOM 1186 C ASN A 78 1.459 3.181 -6.345 1.00 0.00 C ATOM 1187 O ASN A 78 2.210 2.993 -7.301 1.00 0.00 O ATOM 1188 CB ASN A 78 0.053 5.216 -6.446 1.00 0.00 C ATOM 1189 CG ASN A 78 0.728 5.852 -7.663 1.00 0.00 C ATOM 1190 OD1 ASN A 78 0.849 5.257 -8.720 1.00 0.00 O ATOM 1191 ND2 ASN A 78 1.160 7.093 -7.454 1.00 0.00 N ATOM 0 H ASN A 78 -1.189 3.750 -4.864 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.336 3.411 -7.552 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.966 5.591 -6.354 1.00 0.00 H new ATOM 0 HB3 ASN A 78 0.583 5.507 -5.539 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.625 7.604 -8.204 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.026 7.533 -6.544 1.00 0.00 H new ATOM 1198 N PHE A 79 1.789 2.971 -5.079 1.00 0.00 N ATOM 1199 CA PHE A 79 3.111 2.486 -4.720 1.00 0.00 C ATOM 1200 C PHE A 79 3.230 0.982 -4.971 1.00 0.00 C ATOM 1201 O PHE A 79 4.289 0.497 -5.366 1.00 0.00 O ATOM 1202 CB PHE A 79 3.297 2.758 -3.226 1.00 0.00 C ATOM 1203 CG PHE A 79 4.614 2.228 -2.656 1.00 0.00 C ATOM 1204 CD1 PHE A 79 5.789 2.825 -2.991 1.00 0.00 C ATOM 1205 CD2 PHE A 79 4.610 1.159 -1.815 1.00 0.00 C ATOM 1206 CE1 PHE A 79 7.012 2.333 -2.462 1.00 0.00 C ATOM 1207 CE2 PHE A 79 5.832 0.667 -1.287 1.00 0.00 C ATOM 1208 CZ PHE A 79 7.007 1.264 -1.621 1.00 0.00 C ATOM 0 H PHE A 79 1.163 3.128 -4.289 1.00 0.00 H new ATOM 0 HA PHE A 79 3.868 2.989 -5.322 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.245 3.833 -3.054 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.469 2.307 -2.679 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.792 3.673 -3.659 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.677 0.685 -1.549 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.945 2.807 -2.727 1.00 0.00 H new ATOM 0 HE2 PHE A 79 5.829 -0.182 -0.620 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.937 0.889 -1.218 1.00 0.00 H new ATOM 1218 N LEU A 80 2.129 0.285 -4.731 1.00 0.00 N ATOM 1219 CA LEU A 80 2.096 -1.154 -4.927 1.00 0.00 C ATOM 1220 C LEU A 80 2.194 -1.464 -6.422 1.00 0.00 C ATOM 1221 O LEU A 80 2.471 -2.599 -6.807 1.00 0.00 O ATOM 1222 CB LEU A 80 0.863 -1.759 -4.253 1.00 0.00 C ATOM 1223 CG LEU A 80 0.769 -1.574 -2.737 1.00 0.00 C ATOM 1224 CD1 LEU A 80 -0.640 -1.893 -2.232 1.00 0.00 C ATOM 1225 CD2 LEU A 80 1.837 -2.400 -2.016 1.00 0.00 C ATOM 0 H LEU A 80 1.253 0.691 -4.402 1.00 0.00 H new ATOM 0 HA LEU A 80 2.955 -1.623 -4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.026 -1.323 -4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.841 -2.827 -4.471 1.00 0.00 H new ATOM 0 HG LEU A 80 0.964 -0.526 -2.508 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.680 -1.754 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.358 -1.226 -2.710 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.888 -2.927 -2.474 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.748 -2.250 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.698 -3.456 -2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.826 -2.083 -2.346 1.00 0.00 H new ATOM 1237 N ASN A 81 1.962 -0.435 -7.223 1.00 0.00 N ATOM 1238 CA ASN A 81 2.020 -0.583 -8.667 1.00 0.00 C ATOM 1239 C ASN A 81 3.483 -0.622 -9.113 1.00 0.00 C ATOM 1240 O ASN A 81 3.812 -1.244 -10.122 1.00 0.00 O ATOM 1241 CB ASN A 81 1.343 0.595 -9.370 1.00 0.00 C ATOM 1242 CG ASN A 81 -0.176 0.539 -9.194 1.00 0.00 C ATOM 1243 OD1 ASN A 81 -0.764 -0.509 -8.979 1.00 0.00 O ATOM 1244 ND2 ASN A 81 -0.777 1.721 -9.299 1.00 0.00 N ATOM 0 H ASN A 81 1.733 0.505 -6.899 1.00 0.00 H new ATOM 0 HA ASN A 81 1.504 -1.506 -8.932 1.00 0.00 H new ATOM 0 HB2 ASN A 81 1.725 1.533 -8.966 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.591 0.581 -10.431 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.790 1.789 -9.199 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.225 2.559 -9.480 1.00 0.00 H new ATOM 1251 N LEU A 82 4.322 0.051 -8.339 1.00 0.00 N ATOM 1252 CA LEU A 82 5.742 0.101 -8.642 1.00 0.00 C ATOM 1253 C LEU A 82 6.250 -1.314 -8.921 1.00 0.00 C ATOM 1254 O LEU A 82 5.588 -2.294 -8.581 1.00 0.00 O ATOM 1255 CB LEU A 82 6.503 0.818 -7.525 1.00 0.00 C ATOM 1256 CG LEU A 82 6.491 2.348 -7.580 1.00 0.00 C ATOM 1257 CD1 LEU A 82 7.497 2.939 -6.591 1.00 0.00 C ATOM 1258 CD2 LEU A 82 6.729 2.846 -9.007 1.00 0.00 C ATOM 0 H LEU A 82 4.046 0.566 -7.503 1.00 0.00 H new ATOM 0 HA LEU A 82 5.918 0.687 -9.544 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.084 0.505 -6.568 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.540 0.482 -7.545 1.00 0.00 H new ATOM 0 HG LEU A 82 5.502 2.694 -7.279 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.469 4.027 -6.650 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.241 2.624 -5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.499 2.588 -6.838 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.716 3.936 -9.019 1.00 0.00 H new ATOM 0 HD22 LEU A 82 7.697 2.491 -9.360 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.944 2.466 -9.661 1.00 0.00 H new ATOM 1270 N PRO A 83 7.452 -1.379 -9.554 1.00 0.00 N ATOM 1271 CA PRO A 83 8.057 -2.659 -9.883 1.00 0.00 C ATOM 1272 C PRO A 83 8.639 -3.327 -8.635 1.00 0.00 C ATOM 1273 O PRO A 83 9.336 -2.686 -7.851 1.00 0.00 O ATOM 1274 CB PRO A 83 9.110 -2.339 -10.931 1.00 0.00 C ATOM 1275 CG PRO A 83 9.377 -0.847 -10.812 1.00 0.00 C ATOM 1276 CD PRO A 83 8.265 -0.241 -9.972 1.00 0.00 C ATOM 0 HA PRO A 83 7.335 -3.378 -10.270 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.020 -2.914 -10.758 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.757 -2.594 -11.930 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.347 -0.668 -10.348 1.00 0.00 H new ATOM 0 HG3 PRO A 83 9.406 -0.384 -11.799 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.666 0.296 -9.112 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.678 0.474 -10.549 1.00 0.00 H new ATOM 1284 N GLU A 84 8.330 -4.608 -8.491 1.00 0.00 N ATOM 1285 CA GLU A 84 8.813 -5.370 -7.352 1.00 0.00 C ATOM 1286 C GLU A 84 10.290 -5.064 -7.097 1.00 0.00 C ATOM 1287 O GLU A 84 10.711 -4.927 -5.949 1.00 0.00 O ATOM 1288 CB GLU A 84 8.592 -6.869 -7.562 1.00 0.00 C ATOM 1289 CG GLU A 84 8.736 -7.243 -9.039 1.00 0.00 C ATOM 1290 CD GLU A 84 9.385 -8.619 -9.195 1.00 0.00 C ATOM 1291 OE1 GLU A 84 8.643 -9.616 -9.063 1.00 0.00 O ATOM 1292 OE2 GLU A 84 10.610 -8.644 -9.442 1.00 0.00 O ATOM 0 H GLU A 84 7.752 -5.137 -9.144 1.00 0.00 H new ATOM 0 HA GLU A 84 8.243 -5.072 -6.472 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.312 -7.433 -6.969 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.599 -7.147 -7.208 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.755 -7.243 -9.515 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.339 -6.493 -9.551 1.00 0.00 H new ATOM 1299 N VAL A 85 11.038 -4.966 -8.186 1.00 0.00 N ATOM 1300 CA VAL A 85 12.459 -4.679 -8.095 1.00 0.00 C ATOM 1301 C VAL A 85 12.662 -3.356 -7.354 1.00 0.00 C ATOM 1302 O VAL A 85 13.576 -3.229 -6.541 1.00 0.00 O ATOM 1303 CB VAL A 85 13.085 -4.683 -9.491 1.00 0.00 C ATOM 1304 CG1 VAL A 85 12.424 -5.734 -10.385 1.00 0.00 C ATOM 1305 CG2 VAL A 85 13.010 -3.295 -10.130 1.00 0.00 C ATOM 0 H VAL A 85 10.686 -5.080 -9.137 1.00 0.00 H new ATOM 0 HA VAL A 85 12.968 -5.454 -7.522 1.00 0.00 H new ATOM 0 HB VAL A 85 14.137 -4.947 -9.385 1.00 0.00 H new ATOM 0 HG11 VAL A 85 12.887 -5.716 -11.371 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.552 -6.721 -9.942 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.361 -5.514 -10.480 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.462 -3.326 -11.121 1.00 0.00 H new ATOM 0 HG22 VAL A 85 11.967 -2.990 -10.216 1.00 0.00 H new ATOM 0 HG23 VAL A 85 13.547 -2.579 -9.508 1.00 0.00 H new ATOM 1315 N GLU A 86 11.793 -2.404 -7.660 1.00 0.00 N ATOM 1316 CA GLU A 86 11.864 -1.095 -7.033 1.00 0.00 C ATOM 1317 C GLU A 86 11.460 -1.189 -5.561 1.00 0.00 C ATOM 1318 O GLU A 86 12.241 -0.845 -4.675 1.00 0.00 O ATOM 1319 CB GLU A 86 10.993 -0.082 -7.778 1.00 0.00 C ATOM 1320 CG GLU A 86 11.837 0.784 -8.715 1.00 0.00 C ATOM 1321 CD GLU A 86 12.990 1.447 -7.959 1.00 0.00 C ATOM 1322 OE1 GLU A 86 12.687 2.273 -7.071 1.00 0.00 O ATOM 1323 OE2 GLU A 86 14.149 1.113 -8.286 1.00 0.00 O ATOM 0 H GLU A 86 11.036 -2.513 -8.334 1.00 0.00 H new ATOM 0 HA GLU A 86 12.895 -0.745 -7.084 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.229 -0.607 -8.352 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.473 0.553 -7.061 1.00 0.00 H new ATOM 0 HG2 GLU A 86 12.233 0.171 -9.524 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.210 1.549 -9.172 1.00 0.00 H new ATOM 1330 N ARG A 87 10.239 -1.657 -5.344 1.00 0.00 N ATOM 1331 CA ARG A 87 9.722 -1.801 -3.994 1.00 0.00 C ATOM 1332 C ARG A 87 10.769 -2.455 -3.091 1.00 0.00 C ATOM 1333 O ARG A 87 10.947 -2.047 -1.944 1.00 0.00 O ATOM 1334 CB ARG A 87 8.446 -2.646 -3.980 1.00 0.00 C ATOM 1335 CG ARG A 87 7.464 -2.174 -5.054 1.00 0.00 C ATOM 1336 CD ARG A 87 6.017 -2.351 -4.590 1.00 0.00 C ATOM 1337 NE ARG A 87 5.400 -3.504 -5.283 1.00 0.00 N ATOM 1338 CZ ARG A 87 5.636 -4.785 -4.967 1.00 0.00 C ATOM 1339 NH1 ARG A 87 6.476 -5.084 -3.967 1.00 0.00 N ATOM 1340 NH2 ARG A 87 5.032 -5.766 -5.651 1.00 0.00 N ATOM 0 H ARG A 87 9.593 -1.941 -6.081 1.00 0.00 H new ATOM 0 HA ARG A 87 9.488 -0.804 -3.621 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.697 -3.693 -4.147 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.975 -2.584 -2.999 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.650 -1.125 -5.286 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.626 -2.737 -5.973 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.989 -2.507 -3.512 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.447 -1.445 -4.796 1.00 0.00 H new ATOM 0 HE ARG A 87 4.755 -3.312 -6.049 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.936 -4.337 -3.446 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.656 -6.059 -3.726 1.00 0.00 H new ATOM 0 HH21 ARG A 87 4.393 -5.538 -6.412 1.00 0.00 H new ATOM 0 HH22 ARG A 87 5.212 -6.741 -5.410 1.00 0.00 H new ATOM 1354 N ASP A 88 11.435 -3.460 -3.642 1.00 0.00 N ATOM 1355 CA ASP A 88 12.459 -4.175 -2.900 1.00 0.00 C ATOM 1356 C ASP A 88 13.550 -3.192 -2.469 1.00 0.00 C ATOM 1357 O ASP A 88 13.971 -3.194 -1.314 1.00 0.00 O ATOM 1358 CB ASP A 88 13.111 -5.256 -3.764 1.00 0.00 C ATOM 1359 CG ASP A 88 12.549 -6.665 -3.571 1.00 0.00 C ATOM 1360 OD1 ASP A 88 12.097 -6.946 -2.439 1.00 0.00 O ATOM 1361 OD2 ASP A 88 12.582 -7.430 -4.559 1.00 0.00 O ATOM 0 H ASP A 88 11.285 -3.796 -4.593 1.00 0.00 H new ATOM 0 HA ASP A 88 11.986 -4.641 -2.035 1.00 0.00 H new ATOM 0 HB2 ASP A 88 13.001 -4.978 -4.812 1.00 0.00 H new ATOM 0 HB3 ASP A 88 14.180 -5.275 -3.550 1.00 0.00 H new ATOM 1366 N ARG A 89 13.976 -2.375 -3.422 1.00 0.00 N ATOM 1367 CA ARG A 89 15.010 -1.389 -3.156 1.00 0.00 C ATOM 1368 C ARG A 89 14.449 -0.250 -2.303 1.00 0.00 C ATOM 1369 O ARG A 89 15.027 0.105 -1.276 1.00 0.00 O ATOM 1370 CB ARG A 89 15.571 -0.815 -4.457 1.00 0.00 C ATOM 1371 CG ARG A 89 17.029 -1.234 -4.659 1.00 0.00 C ATOM 1372 CD ARG A 89 17.330 -1.476 -6.139 1.00 0.00 C ATOM 1373 NE ARG A 89 18.784 -1.355 -6.386 1.00 0.00 N ATOM 1374 CZ ARG A 89 19.344 -1.375 -7.603 1.00 0.00 C ATOM 1375 NH1 ARG A 89 18.576 -1.512 -8.692 1.00 0.00 N ATOM 1376 NH2 ARG A 89 20.673 -1.259 -7.731 1.00 0.00 N ATOM 0 H ARG A 89 13.624 -2.376 -4.379 1.00 0.00 H new ATOM 0 HA ARG A 89 15.815 -1.889 -2.617 1.00 0.00 H new ATOM 0 HB2 ARG A 89 14.970 -1.159 -5.299 1.00 0.00 H new ATOM 0 HB3 ARG A 89 15.501 0.273 -4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 89 17.691 -0.459 -4.272 1.00 0.00 H new ATOM 0 HG3 ARG A 89 17.233 -2.141 -4.090 1.00 0.00 H new ATOM 0 HD2 ARG A 89 16.984 -2.467 -6.432 1.00 0.00 H new ATOM 0 HD3 ARG A 89 16.788 -0.756 -6.751 1.00 0.00 H new ATOM 0 HE ARG A 89 19.399 -1.250 -5.579 1.00 0.00 H new ATOM 0 HH11 ARG A 89 17.565 -1.601 -8.595 1.00 0.00 H new ATOM 0 HH12 ARG A 89 19.003 -1.527 -9.618 1.00 0.00 H new ATOM 0 HH21 ARG A 89 21.258 -1.156 -6.902 1.00 0.00 H new ATOM 0 HH22 ARG A 89 21.099 -1.274 -8.657 1.00 0.00 H new ATOM 1390 N ILE A 90 13.329 0.293 -2.759 1.00 0.00 N ATOM 1391 CA ILE A 90 12.684 1.385 -2.051 1.00 0.00 C ATOM 1392 C ILE A 90 12.720 1.104 -0.547 1.00 0.00 C ATOM 1393 O ILE A 90 13.135 1.955 0.237 1.00 0.00 O ATOM 1394 CB ILE A 90 11.275 1.621 -2.599 1.00 0.00 C ATOM 1395 CG1 ILE A 90 11.323 2.053 -4.066 1.00 0.00 C ATOM 1396 CG2 ILE A 90 10.510 2.622 -1.732 1.00 0.00 C ATOM 1397 CD1 ILE A 90 9.918 2.098 -4.671 1.00 0.00 C ATOM 0 H ILE A 90 12.852 -0.004 -3.610 1.00 0.00 H new ATOM 0 HA ILE A 90 13.225 2.317 -2.215 1.00 0.00 H new ATOM 0 HB ILE A 90 10.730 0.678 -2.558 1.00 0.00 H new ATOM 0 HG12 ILE A 90 11.788 3.036 -4.144 1.00 0.00 H new ATOM 0 HG13 ILE A 90 11.945 1.360 -4.633 1.00 0.00 H new ATOM 0 HG21 ILE A 90 9.512 2.772 -2.144 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.429 2.236 -0.716 1.00 0.00 H new ATOM 0 HG23 ILE A 90 11.043 3.573 -1.718 1.00 0.00 H new ATOM 0 HD11 ILE A 90 9.981 2.408 -5.714 1.00 0.00 H new ATOM 0 HD12 ILE A 90 9.465 1.108 -4.613 1.00 0.00 H new ATOM 0 HD13 ILE A 90 9.306 2.810 -4.117 1.00 0.00 H new ATOM 1409 N TYR A 91 12.278 -0.094 -0.191 1.00 0.00 N ATOM 1410 CA TYR A 91 12.255 -0.498 1.204 1.00 0.00 C ATOM 1411 C TYR A 91 13.665 -0.509 1.796 1.00 0.00 C ATOM 1412 O TYR A 91 13.899 0.055 2.864 1.00 0.00 O ATOM 1413 CB TYR A 91 11.696 -1.922 1.222 1.00 0.00 C ATOM 1414 CG TYR A 91 10.246 -2.027 0.745 1.00 0.00 C ATOM 1415 CD1 TYR A 91 9.356 -1.006 1.010 1.00 0.00 C ATOM 1416 CD2 TYR A 91 9.828 -3.143 0.049 1.00 0.00 C ATOM 1417 CE1 TYR A 91 7.991 -1.105 0.561 1.00 0.00 C ATOM 1418 CE2 TYR A 91 8.463 -3.242 -0.400 1.00 0.00 C ATOM 1419 CZ TYR A 91 7.612 -2.219 -0.122 1.00 0.00 C ATOM 1420 OH TYR A 91 6.323 -2.312 -0.546 1.00 0.00 O ATOM 0 H TYR A 91 11.933 -0.797 -0.845 1.00 0.00 H new ATOM 0 HA TYR A 91 11.654 0.195 1.793 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.322 -2.555 0.593 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.763 -2.315 2.236 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.683 -0.132 1.554 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.524 -3.942 -0.159 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.285 -0.313 0.762 1.00 0.00 H new ATOM 0 HE2 TYR A 91 8.123 -4.110 -0.946 1.00 0.00 H new ATOM 0 HH TYR A 91 6.243 -3.047 -1.190 1.00 0.00 H new ATOM 1430 N GLN A 92 14.569 -1.157 1.076 1.00 0.00 N ATOM 1431 CA GLN A 92 15.951 -1.249 1.517 1.00 0.00 C ATOM 1432 C GLN A 92 16.509 0.145 1.808 1.00 0.00 C ATOM 1433 O GLN A 92 17.085 0.377 2.870 1.00 0.00 O ATOM 1434 CB GLN A 92 16.809 -1.978 0.481 1.00 0.00 C ATOM 1435 CG GLN A 92 18.293 -1.899 0.845 1.00 0.00 C ATOM 1436 CD GLN A 92 18.631 -2.865 1.982 1.00 0.00 C ATOM 1437 OE1 GLN A 92 17.976 -3.873 2.189 1.00 0.00 O ATOM 1438 NE2 GLN A 92 19.687 -2.502 2.704 1.00 0.00 N ATOM 0 H GLN A 92 14.372 -1.623 0.191 1.00 0.00 H new ATOM 0 HA GLN A 92 15.980 -1.830 2.439 1.00 0.00 H new ATOM 0 HB2 GLN A 92 16.501 -3.022 0.418 1.00 0.00 H new ATOM 0 HB3 GLN A 92 16.648 -1.539 -0.504 1.00 0.00 H new ATOM 0 HG2 GLN A 92 18.899 -2.135 -0.030 1.00 0.00 H new ATOM 0 HG3 GLN A 92 18.545 -0.881 1.141 1.00 0.00 H new ATOM 0 HE21 GLN A 92 20.190 -1.645 2.476 1.00 0.00 H new ATOM 0 HE22 GLN A 92 19.994 -3.081 3.486 1.00 0.00 H new ATOM 1447 N ASP A 93 16.319 1.037 0.847 1.00 0.00 N ATOM 1448 CA ASP A 93 16.797 2.402 0.987 1.00 0.00 C ATOM 1449 C ASP A 93 16.262 2.993 2.293 1.00 0.00 C ATOM 1450 O ASP A 93 16.927 3.810 2.927 1.00 0.00 O ATOM 1451 CB ASP A 93 16.304 3.279 -0.165 1.00 0.00 C ATOM 1452 CG ASP A 93 17.386 4.117 -0.849 1.00 0.00 C ATOM 1453 OD1 ASP A 93 18.012 3.579 -1.787 1.00 0.00 O ATOM 1454 OD2 ASP A 93 17.563 5.277 -0.417 1.00 0.00 O ATOM 0 H ASP A 93 15.840 0.841 -0.032 1.00 0.00 H new ATOM 0 HA ASP A 93 17.887 2.380 0.983 1.00 0.00 H new ATOM 0 HB2 ASP A 93 15.834 2.640 -0.913 1.00 0.00 H new ATOM 0 HB3 ASP A 93 15.532 3.949 0.213 1.00 0.00 H new ATOM 1459 N GLU A 94 15.065 2.556 2.657 1.00 0.00 N ATOM 1460 CA GLU A 94 14.433 3.032 3.876 1.00 0.00 C ATOM 1461 C GLU A 94 15.268 2.637 5.095 1.00 0.00 C ATOM 1462 O GLU A 94 15.795 3.499 5.797 1.00 0.00 O ATOM 1463 CB GLU A 94 13.003 2.501 3.995 1.00 0.00 C ATOM 1464 CG GLU A 94 12.041 3.610 4.427 1.00 0.00 C ATOM 1465 CD GLU A 94 12.254 3.979 5.896 1.00 0.00 C ATOM 1466 OE1 GLU A 94 13.420 4.257 6.248 1.00 0.00 O ATOM 1467 OE2 GLU A 94 11.245 3.974 6.634 1.00 0.00 O ATOM 0 H GLU A 94 14.516 1.877 2.129 1.00 0.00 H new ATOM 0 HA GLU A 94 14.379 4.120 3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.683 2.090 3.038 1.00 0.00 H new ATOM 0 HB3 GLU A 94 12.973 1.686 4.718 1.00 0.00 H new ATOM 0 HG2 GLU A 94 12.191 4.490 3.802 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.012 3.283 4.276 1.00 0.00 H new ATOM 1474 N ARG A 95 15.363 1.333 5.311 1.00 0.00 N ATOM 1475 CA ARG A 95 16.125 0.813 6.433 1.00 0.00 C ATOM 1476 C ARG A 95 17.607 1.159 6.274 1.00 0.00 C ATOM 1477 O ARG A 95 18.220 1.711 7.187 1.00 0.00 O ATOM 1478 CB ARG A 95 15.972 -0.705 6.547 1.00 0.00 C ATOM 1479 CG ARG A 95 14.508 -1.094 6.764 1.00 0.00 C ATOM 1480 CD ARG A 95 14.062 -2.141 5.742 1.00 0.00 C ATOM 1481 NE ARG A 95 13.820 -3.436 6.416 1.00 0.00 N ATOM 1482 CZ ARG A 95 14.792 -4.241 6.866 1.00 0.00 C ATOM 1483 NH1 ARG A 95 16.076 -3.889 6.717 1.00 0.00 N ATOM 1484 NH2 ARG A 95 14.479 -5.398 7.466 1.00 0.00 N ATOM 0 H ARG A 95 14.924 0.621 4.727 1.00 0.00 H new ATOM 0 HA ARG A 95 15.736 1.275 7.340 1.00 0.00 H new ATOM 0 HB2 ARG A 95 16.348 -1.181 5.641 1.00 0.00 H new ATOM 0 HB3 ARG A 95 16.577 -1.074 7.376 1.00 0.00 H new ATOM 0 HG2 ARG A 95 14.378 -1.487 7.773 1.00 0.00 H new ATOM 0 HG3 ARG A 95 13.877 -0.209 6.682 1.00 0.00 H new ATOM 0 HD2 ARG A 95 13.154 -1.807 5.240 1.00 0.00 H new ATOM 0 HD3 ARG A 95 14.826 -2.259 4.973 1.00 0.00 H new ATOM 0 HE ARG A 95 12.853 -3.734 6.546 1.00 0.00 H new ATOM 0 HH11 ARG A 95 16.314 -3.008 6.261 1.00 0.00 H new ATOM 0 HH12 ARG A 95 16.816 -4.502 7.060 1.00 0.00 H new ATOM 0 HH21 ARG A 95 13.501 -5.665 7.580 1.00 0.00 H new ATOM 0 HH22 ARG A 95 15.219 -6.011 7.809 1.00 0.00 H new ATOM 1498 N SER A 96 18.139 0.820 5.110 1.00 0.00 N ATOM 1499 CA SER A 96 19.538 1.087 4.819 1.00 0.00 C ATOM 1500 C SER A 96 20.430 0.345 5.816 1.00 0.00 C ATOM 1501 O SER A 96 20.871 0.920 6.809 1.00 0.00 O ATOM 1502 CB SER A 96 19.831 2.588 4.861 1.00 0.00 C ATOM 1503 OG SER A 96 20.544 3.025 3.707 1.00 0.00 O ATOM 0 H SER A 96 17.627 0.362 4.356 1.00 0.00 H new ATOM 0 HA SER A 96 19.753 0.729 3.812 1.00 0.00 H new ATOM 0 HB2 SER A 96 18.893 3.138 4.938 1.00 0.00 H new ATOM 0 HB3 SER A 96 20.411 2.819 5.755 1.00 0.00 H new ATOM 0 HG SER A 96 20.710 3.989 3.771 1.00 0.00 H new ATOM 1509 N GLY A 97 20.671 -0.923 5.515 1.00 0.00 N ATOM 1510 CA GLY A 97 21.503 -1.751 6.372 1.00 0.00 C ATOM 1511 C GLY A 97 21.537 -3.196 5.872 1.00 0.00 C ATOM 1512 O GLY A 97 20.937 -3.517 4.847 1.00 0.00 O ATOM 0 H GLY A 97 20.305 -1.397 4.690 1.00 0.00 H new ATOM 0 HA2 GLY A 97 22.516 -1.348 6.401 1.00 0.00 H new ATOM 0 HA3 GLY A 97 21.120 -1.724 7.392 1.00 0.00 H new ATOM 1516 N PRO A 98 22.264 -4.053 6.639 1.00 0.00 N ATOM 1517 CA PRO A 98 22.384 -5.457 6.284 1.00 0.00 C ATOM 1518 C PRO A 98 21.093 -6.215 6.601 1.00 0.00 C ATOM 1519 O PRO A 98 20.680 -6.289 7.757 1.00 0.00 O ATOM 1520 CB PRO A 98 23.579 -5.961 7.077 1.00 0.00 C ATOM 1521 CG PRO A 98 23.796 -4.952 8.193 1.00 0.00 C ATOM 1522 CD PRO A 98 22.987 -3.708 7.859 1.00 0.00 C ATOM 0 HA PRO A 98 22.538 -5.610 5.216 1.00 0.00 H new ATOM 0 HB2 PRO A 98 23.388 -6.955 7.481 1.00 0.00 H new ATOM 0 HB3 PRO A 98 24.463 -6.039 6.444 1.00 0.00 H new ATOM 0 HG2 PRO A 98 23.480 -5.367 9.150 1.00 0.00 H new ATOM 0 HG3 PRO A 98 24.854 -4.706 8.285 1.00 0.00 H new ATOM 0 HD2 PRO A 98 22.301 -3.453 8.667 1.00 0.00 H new ATOM 0 HD3 PRO A 98 23.634 -2.844 7.705 1.00 0.00 H new ATOM 1530 N SER A 99 20.492 -6.759 5.552 1.00 0.00 N ATOM 1531 CA SER A 99 19.257 -7.508 5.704 1.00 0.00 C ATOM 1532 C SER A 99 18.896 -8.194 4.385 1.00 0.00 C ATOM 1533 O SER A 99 19.062 -7.614 3.313 1.00 0.00 O ATOM 1534 CB SER A 99 18.113 -6.599 6.159 1.00 0.00 C ATOM 1535 OG SER A 99 17.971 -6.590 7.577 1.00 0.00 O ATOM 0 H SER A 99 20.838 -6.696 4.594 1.00 0.00 H new ATOM 0 HA SER A 99 19.410 -8.266 6.472 1.00 0.00 H new ATOM 0 HB2 SER A 99 18.294 -5.584 5.806 1.00 0.00 H new ATOM 0 HB3 SER A 99 17.181 -6.933 5.703 1.00 0.00 H new ATOM 0 HG SER A 99 18.852 -6.488 7.993 1.00 0.00 H new ATOM 1541 N SER A 100 18.410 -9.421 4.506 1.00 0.00 N ATOM 1542 CA SER A 100 18.025 -10.193 3.337 1.00 0.00 C ATOM 1543 C SER A 100 16.684 -10.886 3.586 1.00 0.00 C ATOM 1544 O SER A 100 16.647 -12.037 4.018 1.00 0.00 O ATOM 1545 CB SER A 100 19.097 -11.224 2.980 1.00 0.00 C ATOM 1546 OG SER A 100 19.520 -11.107 1.624 1.00 0.00 O ATOM 0 H SER A 100 18.274 -9.900 5.396 1.00 0.00 H new ATOM 0 HA SER A 100 17.922 -9.509 2.494 1.00 0.00 H new ATOM 0 HB2 SER A 100 19.955 -11.098 3.640 1.00 0.00 H new ATOM 0 HB3 SER A 100 18.707 -12.227 3.153 1.00 0.00 H new ATOM 0 HG SER A 100 20.206 -11.781 1.436 1.00 0.00 H new ATOM 1552 N GLY A 101 15.615 -10.155 3.303 1.00 0.00 N ATOM 1553 CA GLY A 101 14.275 -10.685 3.490 1.00 0.00 C ATOM 1554 C GLY A 101 13.221 -9.593 3.296 1.00 0.00 C ATOM 1555 O GLY A 101 13.445 -8.634 2.559 1.00 0.00 O ATOM 0 H GLY A 101 15.650 -9.200 2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 101 14.099 -11.495 2.783 1.00 0.00 H new ATOM 0 HA3 GLY A 101 14.184 -11.109 4.490 1.00 0.00 H new TER 1559 GLY A 101