USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=21 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 16 THR OG1 : rot -130:sc= -2.97! USER MOD Set 1.2: A 19 ASN : amide:sc= -4.64! C(o=-9!,f=-11!) USER MOD Set 1.3: A 62 TYR OH : rot 150:sc= -1.39! USER MOD Set 2.1: A 26 ASN : amide:sc= -2.92! C(o=-4.8!,f=-8.4!) USER MOD Set 2.2: A 85 ASN :FLIP amide:sc= -1.85 F(o=-9.5,f=-4.8) USER MOD Single : A 1 GLY N :NH3+ 179:sc= 0.487 (180deg=0.486) USER MOD Single : A 2 SER OG : rot 180:sc= -0.062 USER MOD Single : A 3 HIS :FLIP no HD1:sc= -0.38 F(o=-1.2,f=-0.38) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -9.96! C(o=-10!,f=-22!) USER MOD Single : A 28 ASN :FLIP amide:sc= -0.169 F(o=-0.99,f=-0.17) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 162:sc= -0.941 (180deg=-1.69!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -127:sc= 0.848 (180deg=-0.565) USER MOD Single : A 45 ASN : amide:sc= 0.00711 X(o=0.0071,f=0) USER MOD Single : A 54 THR OG1 : rot -170:sc= 0 USER MOD Single : A 56 THR OG1 : rot 128:sc= 0.0992 USER MOD Single : A 57 ASN : amide:sc= -0.089 X(o=-0.089,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -142:sc= -0.0848 (180deg=-1.18) USER MOD Single : A 67 SER OG : rot -92:sc= -1.8! USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 95:sc= -5.8! USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -37:sc= 0.676 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 79.033 -5.946 -10.170 1.00 0.00 N ATOM 2 CA GLY A 1 78.507 -6.977 -11.110 1.00 0.00 C ATOM 3 C GLY A 1 79.450 -7.106 -12.308 1.00 0.00 C ATOM 4 O GLY A 1 80.321 -6.285 -12.515 1.00 0.00 O ATOM 0 H1 GLY A 1 78.383 -5.847 -9.364 1.00 0.00 H new ATOM 0 H2 GLY A 1 79.970 -6.237 -9.825 1.00 0.00 H new ATOM 0 H3 GLY A 1 79.114 -5.034 -10.664 1.00 0.00 H new ATOM 0 HA2 GLY A 1 78.416 -7.936 -10.600 1.00 0.00 H new ATOM 0 HA3 GLY A 1 77.508 -6.700 -11.448 1.00 0.00 H new ATOM 10 N SER A 2 79.282 -8.130 -13.099 1.00 0.00 N ATOM 11 CA SER A 2 80.170 -8.310 -14.284 1.00 0.00 C ATOM 12 C SER A 2 79.336 -8.350 -15.568 1.00 0.00 C ATOM 13 O SER A 2 79.776 -8.839 -16.590 1.00 0.00 O ATOM 14 CB SER A 2 80.867 -9.650 -14.056 1.00 0.00 C ATOM 15 OG SER A 2 80.147 -10.674 -14.728 1.00 0.00 O ATOM 0 H SER A 2 78.569 -8.849 -12.977 1.00 0.00 H new ATOM 0 HA SER A 2 80.883 -7.493 -14.394 1.00 0.00 H new ATOM 0 HB2 SER A 2 81.892 -9.608 -14.425 1.00 0.00 H new ATOM 0 HB3 SER A 2 80.922 -9.868 -12.989 1.00 0.00 H new ATOM 0 HG SER A 2 80.593 -11.535 -14.585 1.00 0.00 H new ATOM 21 N HIS A 3 78.137 -7.838 -15.524 1.00 0.00 N ATOM 22 CA HIS A 3 77.277 -7.848 -16.743 1.00 0.00 C ATOM 23 C HIS A 3 75.976 -7.086 -16.478 1.00 0.00 C ATOM 24 O HIS A 3 75.618 -6.824 -15.346 1.00 0.00 O ATOM 25 CB HIS A 3 76.989 -9.324 -17.012 1.00 0.00 C ATOM 26 CG HIS A 3 76.126 -9.876 -15.911 1.00 0.00 C ATOM 27 ND1 HIS A 3 76.149 -9.698 -14.551 1.00 0.00 N flip ATOM 28 CD2 HIS A 3 75.070 -10.739 -16.162 1.00 0.00 C flip ATOM 29 CE1 HIS A 3 75.126 -10.436 -13.964 1.00 0.00 C flip ATOM 30 NE2 HIS A 3 74.507 -11.045 -14.979 1.00 0.00 N flip ATOM 0 H HIS A 3 77.715 -7.413 -14.698 1.00 0.00 H new ATOM 0 HA HIS A 3 77.759 -7.366 -17.593 1.00 0.00 H new ATOM 0 HB2 HIS A 3 76.488 -9.438 -17.973 1.00 0.00 H new ATOM 0 HB3 HIS A 3 77.923 -9.883 -17.071 1.00 0.00 H new ATOM 0 HD2 HIS A 3 74.757 -11.100 -17.131 1.00 0.00 H new ATOM 0 HE1 HIS A 3 74.884 -10.502 -12.913 1.00 0.00 H new ATOM 0 HE2 HIS A 3 73.705 -11.666 -14.870 1.00 0.00 H new ATOM 38 N MET A 4 75.265 -6.729 -17.512 1.00 0.00 N ATOM 39 CA MET A 4 73.987 -5.985 -17.318 1.00 0.00 C ATOM 40 C MET A 4 74.248 -4.673 -16.574 1.00 0.00 C ATOM 41 O MET A 4 73.655 -4.401 -15.548 1.00 0.00 O ATOM 42 CB MET A 4 73.111 -6.915 -16.477 1.00 0.00 C ATOM 43 CG MET A 4 72.112 -7.635 -17.385 1.00 0.00 C ATOM 44 SD MET A 4 70.499 -7.708 -16.567 1.00 0.00 S ATOM 45 CE MET A 4 70.370 -9.511 -16.482 1.00 0.00 C ATOM 0 H MET A 4 75.513 -6.920 -18.483 1.00 0.00 H new ATOM 0 HA MET A 4 73.512 -5.724 -18.264 1.00 0.00 H new ATOM 0 HB2 MET A 4 73.732 -7.642 -15.953 1.00 0.00 H new ATOM 0 HB3 MET A 4 72.580 -6.343 -15.716 1.00 0.00 H new ATOM 0 HG2 MET A 4 72.026 -7.111 -18.337 1.00 0.00 H new ATOM 0 HG3 MET A 4 72.466 -8.642 -17.606 1.00 0.00 H new ATOM 0 HE1 MET A 4 69.430 -9.786 -16.003 1.00 0.00 H new ATOM 0 HE2 MET A 4 70.399 -9.926 -17.490 1.00 0.00 H new ATOM 0 HE3 MET A 4 71.203 -9.908 -15.902 1.00 0.00 H new ATOM 55 N LEU A 5 75.130 -3.856 -17.082 1.00 0.00 N ATOM 56 CA LEU A 5 75.427 -2.562 -16.403 1.00 0.00 C ATOM 57 C LEU A 5 74.149 -1.732 -16.265 1.00 0.00 C ATOM 58 O LEU A 5 73.837 -0.911 -17.105 1.00 0.00 O ATOM 59 CB LEU A 5 76.430 -1.857 -17.316 1.00 0.00 C ATOM 60 CG LEU A 5 77.841 -2.365 -17.015 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.149 -2.168 -15.530 1.00 0.00 C ATOM 62 CD2 LEU A 5 77.928 -3.854 -17.360 1.00 0.00 C ATOM 0 H LEU A 5 75.658 -4.028 -17.938 1.00 0.00 H new ATOM 0 HA LEU A 5 75.822 -2.704 -15.397 1.00 0.00 H new ATOM 0 HB2 LEU A 5 76.180 -2.044 -18.360 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.380 -0.779 -17.164 1.00 0.00 H new ATOM 0 HG LEU A 5 78.563 -1.808 -17.612 1.00 0.00 H new ATOM 0 HD11 LEU A 5 79.155 -2.530 -15.316 1.00 0.00 H new ATOM 0 HD12 LEU A 5 78.084 -1.108 -15.282 1.00 0.00 H new ATOM 0 HD13 LEU A 5 77.428 -2.725 -14.932 1.00 0.00 H new ATOM 0 HD21 LEU A 5 78.933 -4.219 -17.146 1.00 0.00 H new ATOM 0 HD22 LEU A 5 77.206 -4.409 -16.761 1.00 0.00 H new ATOM 0 HD23 LEU A 5 77.708 -3.996 -18.418 1.00 0.00 H new ATOM 74 N GLU A 6 73.406 -1.937 -15.212 1.00 0.00 N ATOM 75 CA GLU A 6 72.149 -1.158 -15.022 1.00 0.00 C ATOM 76 C GLU A 6 71.524 -1.485 -13.663 1.00 0.00 C ATOM 77 O GLU A 6 71.262 -2.629 -13.348 1.00 0.00 O ATOM 78 CB GLU A 6 71.229 -1.608 -16.157 1.00 0.00 C ATOM 79 CG GLU A 6 70.790 -3.054 -15.916 1.00 0.00 C ATOM 80 CD GLU A 6 70.094 -3.592 -17.169 1.00 0.00 C ATOM 81 OE1 GLU A 6 69.159 -2.953 -17.623 1.00 0.00 O ATOM 82 OE2 GLU A 6 70.509 -4.632 -17.651 1.00 0.00 O ATOM 0 H GLU A 6 73.615 -2.610 -14.475 1.00 0.00 H new ATOM 0 HA GLU A 6 72.323 -0.082 -15.040 1.00 0.00 H new ATOM 0 HB2 GLU A 6 70.357 -0.957 -16.212 1.00 0.00 H new ATOM 0 HB3 GLU A 6 71.747 -1.529 -17.113 1.00 0.00 H new ATOM 0 HG2 GLU A 6 71.654 -3.672 -15.674 1.00 0.00 H new ATOM 0 HG3 GLU A 6 70.114 -3.103 -15.062 1.00 0.00 H new ATOM 89 N ASP A 7 71.285 -0.488 -12.855 1.00 0.00 N ATOM 90 CA ASP A 7 70.677 -0.744 -11.517 1.00 0.00 C ATOM 91 C ASP A 7 69.327 -0.032 -11.405 1.00 0.00 C ATOM 92 O ASP A 7 69.134 1.029 -11.967 1.00 0.00 O ATOM 93 CB ASP A 7 71.674 -0.162 -10.512 1.00 0.00 C ATOM 94 CG ASP A 7 72.660 -1.251 -10.084 1.00 0.00 C ATOM 95 OD1 ASP A 7 72.284 -2.077 -9.270 1.00 0.00 O ATOM 96 OD2 ASP A 7 73.776 -1.238 -10.577 1.00 0.00 O ATOM 0 H ASP A 7 71.484 0.491 -13.062 1.00 0.00 H new ATOM 0 HA ASP A 7 70.493 -1.804 -11.343 1.00 0.00 H new ATOM 0 HB2 ASP A 7 72.211 0.675 -10.959 1.00 0.00 H new ATOM 0 HB3 ASP A 7 71.145 0.227 -9.642 1.00 0.00 H new ATOM 101 N PRO A 8 68.433 -0.645 -10.677 1.00 0.00 N ATOM 102 CA PRO A 8 67.082 -0.070 -10.484 1.00 0.00 C ATOM 103 C PRO A 8 67.151 1.147 -9.568 1.00 0.00 C ATOM 104 O PRO A 8 66.853 1.081 -8.392 1.00 0.00 O ATOM 105 CB PRO A 8 66.298 -1.195 -9.833 1.00 0.00 C ATOM 106 CG PRO A 8 67.328 -2.051 -9.169 1.00 0.00 C ATOM 107 CD PRO A 8 68.596 -1.918 -9.974 1.00 0.00 C ATOM 0 HA PRO A 8 66.626 0.272 -11.413 1.00 0.00 H new ATOM 0 HB2 PRO A 8 65.580 -0.809 -9.110 1.00 0.00 H new ATOM 0 HB3 PRO A 8 65.732 -1.761 -10.573 1.00 0.00 H new ATOM 0 HG2 PRO A 8 67.489 -1.732 -8.139 1.00 0.00 H new ATOM 0 HG3 PRO A 8 67.001 -3.090 -9.133 1.00 0.00 H new ATOM 0 HD2 PRO A 8 69.478 -1.911 -9.333 1.00 0.00 H new ATOM 0 HD3 PRO A 8 68.716 -2.747 -10.671 1.00 0.00 H new ATOM 115 N VAL A 9 67.541 2.254 -10.113 1.00 0.00 N ATOM 116 CA VAL A 9 67.642 3.500 -9.301 1.00 0.00 C ATOM 117 C VAL A 9 67.895 4.705 -10.212 1.00 0.00 C ATOM 118 O VAL A 9 68.635 4.624 -11.173 1.00 0.00 O ATOM 119 CB VAL A 9 68.832 3.273 -8.370 1.00 0.00 C ATOM 120 CG1 VAL A 9 70.131 3.338 -9.176 1.00 0.00 C ATOM 121 CG2 VAL A 9 68.847 4.358 -7.291 1.00 0.00 C ATOM 0 H VAL A 9 67.798 2.357 -11.095 1.00 0.00 H new ATOM 0 HA VAL A 9 66.726 3.707 -8.747 1.00 0.00 H new ATOM 0 HB VAL A 9 68.745 2.293 -7.901 1.00 0.00 H new ATOM 0 HG11 VAL A 9 70.980 3.176 -8.512 1.00 0.00 H new ATOM 0 HG12 VAL A 9 70.120 2.567 -9.946 1.00 0.00 H new ATOM 0 HG13 VAL A 9 70.219 4.318 -9.645 1.00 0.00 H new ATOM 0 HG21 VAL A 9 69.695 4.198 -6.626 1.00 0.00 H new ATOM 0 HG22 VAL A 9 68.934 5.337 -7.761 1.00 0.00 H new ATOM 0 HG23 VAL A 9 67.922 4.313 -6.717 1.00 0.00 H new ATOM 131 N GLU A 10 67.285 5.821 -9.920 1.00 0.00 N ATOM 132 CA GLU A 10 67.492 7.028 -10.769 1.00 0.00 C ATOM 133 C GLU A 10 68.837 7.683 -10.441 1.00 0.00 C ATOM 134 O GLU A 10 69.399 7.472 -9.386 1.00 0.00 O ATOM 135 CB GLU A 10 66.338 7.966 -10.413 1.00 0.00 C ATOM 136 CG GLU A 10 65.386 8.081 -11.605 1.00 0.00 C ATOM 137 CD GLU A 10 64.454 9.276 -11.400 1.00 0.00 C ATOM 138 OE1 GLU A 10 64.563 9.918 -10.368 1.00 0.00 O ATOM 139 OE2 GLU A 10 63.647 9.531 -12.279 1.00 0.00 O ATOM 0 H GLU A 10 66.652 5.949 -9.130 1.00 0.00 H new ATOM 0 HA GLU A 10 67.508 6.786 -11.832 1.00 0.00 H new ATOM 0 HB2 GLU A 10 65.803 7.587 -9.542 1.00 0.00 H new ATOM 0 HB3 GLU A 10 66.724 8.950 -10.147 1.00 0.00 H new ATOM 0 HG2 GLU A 10 65.954 8.203 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 10 64.804 7.166 -11.708 1.00 0.00 H new ATOM 146 N GLY A 11 69.355 8.477 -11.338 1.00 0.00 N ATOM 147 CA GLY A 11 70.661 9.144 -11.076 1.00 0.00 C ATOM 148 C GLY A 11 70.415 10.575 -10.593 1.00 0.00 C ATOM 149 O GLY A 11 71.239 11.163 -9.921 1.00 0.00 O ATOM 0 H GLY A 11 68.930 8.692 -12.240 1.00 0.00 H new ATOM 0 HA2 GLY A 11 71.222 8.587 -10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 11 71.265 9.154 -11.983 1.00 0.00 H new ATOM 153 N SER A 12 69.289 11.139 -10.929 1.00 0.00 N ATOM 154 CA SER A 12 68.991 12.531 -10.489 1.00 0.00 C ATOM 155 C SER A 12 68.128 12.512 -9.224 1.00 0.00 C ATOM 156 O SER A 12 67.232 13.317 -9.060 1.00 0.00 O ATOM 157 CB SER A 12 68.223 13.159 -11.652 1.00 0.00 C ATOM 158 OG SER A 12 68.721 12.641 -12.877 1.00 0.00 O ATOM 0 H SER A 12 68.561 10.696 -11.490 1.00 0.00 H new ATOM 0 HA SER A 12 69.895 13.090 -10.249 1.00 0.00 H new ATOM 0 HB2 SER A 12 67.159 12.943 -11.559 1.00 0.00 H new ATOM 0 HB3 SER A 12 68.332 14.243 -11.631 1.00 0.00 H new ATOM 0 HG SER A 12 68.230 13.040 -13.625 1.00 0.00 H new ATOM 164 N GLU A 13 68.391 11.601 -8.328 1.00 0.00 N ATOM 165 CA GLU A 13 67.586 11.531 -7.077 1.00 0.00 C ATOM 166 C GLU A 13 68.223 10.555 -6.095 1.00 0.00 C ATOM 167 O GLU A 13 67.561 9.937 -5.285 1.00 0.00 O ATOM 168 CB GLU A 13 66.223 11.025 -7.516 1.00 0.00 C ATOM 169 CG GLU A 13 65.181 12.133 -7.346 1.00 0.00 C ATOM 170 CD GLU A 13 64.157 12.049 -8.480 1.00 0.00 C ATOM 171 OE1 GLU A 13 64.450 12.550 -9.554 1.00 0.00 O ATOM 172 OE2 GLU A 13 63.100 11.485 -8.257 1.00 0.00 O ATOM 0 H GLU A 13 69.129 10.902 -8.409 1.00 0.00 H new ATOM 0 HA GLU A 13 67.522 12.495 -6.573 1.00 0.00 H new ATOM 0 HB2 GLU A 13 66.261 10.706 -8.557 1.00 0.00 H new ATOM 0 HB3 GLU A 13 65.941 10.153 -6.925 1.00 0.00 H new ATOM 0 HG2 GLU A 13 64.681 12.032 -6.382 1.00 0.00 H new ATOM 0 HG3 GLU A 13 65.667 13.108 -7.352 1.00 0.00 H new ATOM 179 N SER A 14 69.503 10.423 -6.173 1.00 0.00 N ATOM 180 CA SER A 14 70.225 9.492 -5.256 1.00 0.00 C ATOM 181 C SER A 14 69.990 9.896 -3.799 1.00 0.00 C ATOM 182 O SER A 14 69.222 10.793 -3.510 1.00 0.00 O ATOM 183 CB SER A 14 71.700 9.643 -5.623 1.00 0.00 C ATOM 184 OG SER A 14 72.105 8.529 -6.410 1.00 0.00 O ATOM 0 H SER A 14 70.097 10.921 -6.836 1.00 0.00 H new ATOM 0 HA SER A 14 69.882 8.462 -5.358 1.00 0.00 H new ATOM 0 HB2 SER A 14 71.856 10.569 -6.176 1.00 0.00 H new ATOM 0 HB3 SER A 14 72.307 9.705 -4.720 1.00 0.00 H new ATOM 0 HG SER A 14 73.051 8.624 -6.649 1.00 0.00 H new ATOM 190 N THR A 15 70.644 9.242 -2.879 1.00 0.00 N ATOM 191 CA THR A 15 70.458 9.591 -1.442 1.00 0.00 C ATOM 192 C THR A 15 71.735 10.220 -0.878 1.00 0.00 C ATOM 193 O THR A 15 71.811 10.554 0.287 1.00 0.00 O ATOM 194 CB THR A 15 70.163 8.261 -0.746 1.00 0.00 C ATOM 195 OG1 THR A 15 68.841 7.845 -1.061 1.00 0.00 O ATOM 196 CG2 THR A 15 70.300 8.433 0.769 1.00 0.00 C ATOM 0 H THR A 15 71.299 8.481 -3.060 1.00 0.00 H new ATOM 0 HA THR A 15 69.657 10.315 -1.295 1.00 0.00 H new ATOM 0 HB THR A 15 70.872 7.507 -1.089 1.00 0.00 H new ATOM 0 HG1 THR A 15 68.652 6.992 -0.617 1.00 0.00 H new ATOM 0 HG21 THR A 15 70.090 7.485 1.263 1.00 0.00 H new ATOM 0 HG22 THR A 15 71.315 8.750 1.009 1.00 0.00 H new ATOM 0 HG23 THR A 15 69.593 9.187 1.115 1.00 0.00 H new ATOM 204 N THR A 16 72.739 10.383 -1.696 1.00 0.00 N ATOM 205 CA THR A 16 74.009 10.989 -1.203 1.00 0.00 C ATOM 206 C THR A 16 74.951 11.279 -2.375 1.00 0.00 C ATOM 207 O THR A 16 74.760 10.781 -3.466 1.00 0.00 O ATOM 208 CB THR A 16 74.624 9.940 -0.276 1.00 0.00 C ATOM 209 OG1 THR A 16 73.901 8.723 -0.391 1.00 0.00 O ATOM 210 CG2 THR A 16 74.567 10.433 1.170 1.00 0.00 C ATOM 0 H THR A 16 72.735 10.123 -2.682 1.00 0.00 H new ATOM 0 HA THR A 16 73.836 11.935 -0.690 1.00 0.00 H new ATOM 0 HB THR A 16 75.663 9.774 -0.559 1.00 0.00 H new ATOM 0 HG1 THR A 16 73.665 8.397 0.503 1.00 0.00 H new ATOM 0 HG21 THR A 16 75.006 9.683 1.828 1.00 0.00 H new ATOM 0 HG22 THR A 16 75.125 11.365 1.259 1.00 0.00 H new ATOM 0 HG23 THR A 16 73.529 10.603 1.456 1.00 0.00 H new ATOM 218 N PRO A 17 75.936 12.088 -2.101 1.00 0.00 N ATOM 219 CA PRO A 17 76.926 12.468 -3.136 1.00 0.00 C ATOM 220 C PRO A 17 77.943 11.343 -3.352 1.00 0.00 C ATOM 221 O PRO A 17 78.513 11.207 -4.416 1.00 0.00 O ATOM 222 CB PRO A 17 77.605 13.697 -2.542 1.00 0.00 C ATOM 223 CG PRO A 17 77.437 13.564 -1.060 1.00 0.00 C ATOM 224 CD PRO A 17 76.208 12.726 -0.810 1.00 0.00 C ATOM 0 HA PRO A 17 76.473 12.658 -4.109 1.00 0.00 H new ATOM 0 HB2 PRO A 17 78.659 13.735 -2.816 1.00 0.00 H new ATOM 0 HB3 PRO A 17 77.147 14.615 -2.909 1.00 0.00 H new ATOM 0 HG2 PRO A 17 78.316 13.096 -0.616 1.00 0.00 H new ATOM 0 HG3 PRO A 17 77.331 14.545 -0.598 1.00 0.00 H new ATOM 0 HD2 PRO A 17 76.383 11.986 -0.030 1.00 0.00 H new ATOM 0 HD3 PRO A 17 75.368 13.339 -0.485 1.00 0.00 H new ATOM 232 N PHE A 18 78.181 10.538 -2.352 1.00 0.00 N ATOM 233 CA PHE A 18 79.166 9.430 -2.507 1.00 0.00 C ATOM 234 C PHE A 18 78.455 8.075 -2.517 1.00 0.00 C ATOM 235 O PHE A 18 77.838 7.677 -1.550 1.00 0.00 O ATOM 236 CB PHE A 18 80.086 9.542 -1.291 1.00 0.00 C ATOM 237 CG PHE A 18 80.921 10.793 -1.409 1.00 0.00 C ATOM 238 CD1 PHE A 18 82.061 10.800 -2.221 1.00 0.00 C ATOM 239 CD2 PHE A 18 80.552 11.947 -0.710 1.00 0.00 C ATOM 240 CE1 PHE A 18 82.832 11.963 -2.334 1.00 0.00 C ATOM 241 CE2 PHE A 18 81.324 13.110 -0.822 1.00 0.00 C ATOM 242 CZ PHE A 18 82.464 13.118 -1.634 1.00 0.00 C ATOM 0 H PHE A 18 77.737 10.600 -1.436 1.00 0.00 H new ATOM 0 HA PHE A 18 79.716 9.502 -3.445 1.00 0.00 H new ATOM 0 HB2 PHE A 18 79.495 9.571 -0.375 1.00 0.00 H new ATOM 0 HB3 PHE A 18 80.731 8.666 -1.227 1.00 0.00 H new ATOM 0 HD1 PHE A 18 82.346 9.909 -2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 18 79.672 11.941 -0.084 1.00 0.00 H new ATOM 0 HE1 PHE A 18 83.711 11.969 -2.961 1.00 0.00 H new ATOM 0 HE2 PHE A 18 81.040 14.001 -0.282 1.00 0.00 H new ATOM 0 HZ PHE A 18 83.059 14.015 -1.720 1.00 0.00 H new ATOM 252 N ASN A 19 78.541 7.366 -3.606 1.00 0.00 N ATOM 253 CA ASN A 19 77.882 6.039 -3.694 1.00 0.00 C ATOM 254 C ASN A 19 78.760 5.080 -4.491 1.00 0.00 C ATOM 255 O ASN A 19 79.592 5.486 -5.277 1.00 0.00 O ATOM 256 CB ASN A 19 76.570 6.298 -4.428 1.00 0.00 C ATOM 257 CG ASN A 19 75.804 7.421 -3.729 1.00 0.00 C ATOM 258 OD1 ASN A 19 76.235 8.557 -3.727 1.00 0.00 O ATOM 259 ND2 ASN A 19 74.677 7.150 -3.127 1.00 0.00 N ATOM 0 H ASN A 19 79.045 7.653 -4.445 1.00 0.00 H new ATOM 0 HA ASN A 19 77.717 5.588 -2.715 1.00 0.00 H new ATOM 0 HB2 ASN A 19 76.769 6.570 -5.464 1.00 0.00 H new ATOM 0 HB3 ASN A 19 75.967 5.390 -4.447 1.00 0.00 H new ATOM 0 HD21 ASN A 19 74.159 7.892 -2.656 1.00 0.00 H new ATOM 0 HD22 ASN A 19 74.315 6.197 -3.128 1.00 0.00 H new ATOM 266 N LEU A 20 78.584 3.811 -4.286 1.00 0.00 N ATOM 267 CA LEU A 20 79.409 2.817 -5.023 1.00 0.00 C ATOM 268 C LEU A 20 78.778 1.428 -4.921 1.00 0.00 C ATOM 269 O LEU A 20 77.871 1.202 -4.146 1.00 0.00 O ATOM 270 CB LEU A 20 80.797 2.860 -4.354 1.00 0.00 C ATOM 271 CG LEU A 20 80.775 2.217 -2.955 1.00 0.00 C ATOM 272 CD1 LEU A 20 79.573 2.712 -2.149 1.00 0.00 C ATOM 273 CD2 LEU A 20 80.704 0.695 -3.083 1.00 0.00 C ATOM 0 H LEU A 20 77.903 3.415 -3.638 1.00 0.00 H new ATOM 0 HA LEU A 20 79.480 3.044 -6.087 1.00 0.00 H new ATOM 0 HB2 LEU A 20 81.520 2.340 -4.982 1.00 0.00 H new ATOM 0 HB3 LEU A 20 81.130 3.895 -4.274 1.00 0.00 H new ATOM 0 HG LEU A 20 81.690 2.501 -2.435 1.00 0.00 H new ATOM 0 HD11 LEU A 20 79.578 2.245 -1.164 1.00 0.00 H new ATOM 0 HD12 LEU A 20 79.631 3.795 -2.037 1.00 0.00 H new ATOM 0 HD13 LEU A 20 78.652 2.450 -2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 20 80.689 0.247 -2.090 1.00 0.00 H new ATOM 0 HD22 LEU A 20 79.797 0.417 -3.621 1.00 0.00 H new ATOM 0 HD23 LEU A 20 81.575 0.335 -3.630 1.00 0.00 H new ATOM 285 N PHE A 21 79.249 0.496 -5.702 1.00 0.00 N ATOM 286 CA PHE A 21 78.671 -0.876 -5.651 1.00 0.00 C ATOM 287 C PHE A 21 79.596 -1.812 -4.870 1.00 0.00 C ATOM 288 O PHE A 21 80.779 -1.573 -4.746 1.00 0.00 O ATOM 289 CB PHE A 21 78.570 -1.317 -7.111 1.00 0.00 C ATOM 290 CG PHE A 21 77.734 -2.570 -7.202 1.00 0.00 C ATOM 291 CD1 PHE A 21 76.339 -2.477 -7.283 1.00 0.00 C ATOM 292 CD2 PHE A 21 78.353 -3.826 -7.206 1.00 0.00 C ATOM 293 CE1 PHE A 21 75.563 -3.639 -7.367 1.00 0.00 C ATOM 294 CE2 PHE A 21 77.577 -4.989 -7.290 1.00 0.00 C ATOM 295 CZ PHE A 21 76.183 -4.895 -7.371 1.00 0.00 C ATOM 0 H PHE A 21 80.007 0.624 -6.372 1.00 0.00 H new ATOM 0 HA PHE A 21 77.703 -0.898 -5.150 1.00 0.00 H new ATOM 0 HB2 PHE A 21 78.123 -0.525 -7.711 1.00 0.00 H new ATOM 0 HB3 PHE A 21 79.565 -1.501 -7.516 1.00 0.00 H new ATOM 0 HD1 PHE A 21 75.862 -1.508 -7.281 1.00 0.00 H new ATOM 0 HD2 PHE A 21 79.429 -3.898 -7.144 1.00 0.00 H new ATOM 0 HE1 PHE A 21 74.487 -3.567 -7.429 1.00 0.00 H new ATOM 0 HE2 PHE A 21 78.054 -5.958 -7.292 1.00 0.00 H new ATOM 0 HZ PHE A 21 75.585 -5.792 -7.437 1.00 0.00 H new ATOM 305 N ILE A 22 79.059 -2.880 -4.349 1.00 0.00 N ATOM 306 CA ILE A 22 79.895 -3.845 -3.581 1.00 0.00 C ATOM 307 C ILE A 22 79.706 -5.249 -4.152 1.00 0.00 C ATOM 308 O ILE A 22 78.794 -5.496 -4.913 1.00 0.00 O ATOM 309 CB ILE A 22 79.373 -3.770 -2.147 1.00 0.00 C ATOM 310 CG1 ILE A 22 79.742 -2.415 -1.539 1.00 0.00 C ATOM 311 CG2 ILE A 22 80.004 -4.889 -1.315 1.00 0.00 C ATOM 312 CD1 ILE A 22 79.476 -2.440 -0.033 1.00 0.00 C ATOM 0 H ILE A 22 78.072 -3.127 -4.422 1.00 0.00 H new ATOM 0 HA ILE A 22 80.959 -3.614 -3.632 1.00 0.00 H new ATOM 0 HB ILE A 22 78.289 -3.885 -2.150 1.00 0.00 H new ATOM 0 HG12 ILE A 22 80.792 -2.193 -1.730 1.00 0.00 H new ATOM 0 HG13 ILE A 22 79.159 -1.623 -2.009 1.00 0.00 H new ATOM 0 HG21 ILE A 22 79.632 -4.836 -0.292 1.00 0.00 H new ATOM 0 HG22 ILE A 22 79.742 -5.855 -1.747 1.00 0.00 H new ATOM 0 HG23 ILE A 22 81.088 -4.774 -1.313 1.00 0.00 H new ATOM 0 HD11 ILE A 22 79.739 -1.474 0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 22 78.420 -2.642 0.147 1.00 0.00 H new ATOM 0 HD13 ILE A 22 80.079 -3.221 0.430 1.00 0.00 H new ATOM 324 N GLY A 23 80.558 -6.168 -3.798 1.00 0.00 N ATOM 325 CA GLY A 23 80.421 -7.552 -4.331 1.00 0.00 C ATOM 326 C GLY A 23 81.180 -8.525 -3.429 1.00 0.00 C ATOM 327 O GLY A 23 82.395 -8.564 -3.437 1.00 0.00 O ATOM 0 H GLY A 23 81.343 -6.022 -3.163 1.00 0.00 H new ATOM 0 HA2 GLY A 23 79.369 -7.831 -4.380 1.00 0.00 H new ATOM 0 HA3 GLY A 23 80.812 -7.602 -5.347 1.00 0.00 H new ATOM 331 N ASN A 24 80.450 -9.303 -2.657 1.00 0.00 N ATOM 332 CA ASN A 24 81.050 -10.313 -1.716 1.00 0.00 C ATOM 333 C ASN A 24 80.142 -10.431 -0.487 1.00 0.00 C ATOM 334 O ASN A 24 80.500 -10.044 0.607 1.00 0.00 O ATOM 335 CB ASN A 24 82.434 -9.793 -1.308 1.00 0.00 C ATOM 336 CG ASN A 24 82.916 -10.514 -0.046 1.00 0.00 C ATOM 337 OD1 ASN A 24 82.794 -9.995 1.046 1.00 0.00 O ATOM 338 ND2 ASN A 24 83.462 -11.694 -0.153 1.00 0.00 N ATOM 0 H ASN A 24 79.430 -9.278 -2.640 1.00 0.00 H new ATOM 0 HA ASN A 24 81.143 -11.294 -2.182 1.00 0.00 H new ATOM 0 HB2 ASN A 24 83.144 -9.951 -2.120 1.00 0.00 H new ATOM 0 HB3 ASN A 24 82.389 -8.719 -1.128 1.00 0.00 H new ATOM 0 HD21 ASN A 24 83.787 -12.183 0.681 1.00 0.00 H new ATOM 0 HD22 ASN A 24 83.563 -12.128 -1.071 1.00 0.00 H new ATOM 345 N LEU A 25 78.956 -10.944 -0.667 1.00 0.00 N ATOM 346 CA LEU A 25 78.016 -11.065 0.483 1.00 0.00 C ATOM 347 C LEU A 25 78.040 -12.476 1.061 1.00 0.00 C ATOM 348 O LEU A 25 77.978 -13.460 0.350 1.00 0.00 O ATOM 349 CB LEU A 25 76.639 -10.749 -0.099 1.00 0.00 C ATOM 350 CG LEU A 25 76.407 -9.239 -0.070 1.00 0.00 C ATOM 351 CD1 LEU A 25 76.415 -8.748 1.379 1.00 0.00 C ATOM 352 CD2 LEU A 25 77.520 -8.536 -0.851 1.00 0.00 C ATOM 0 H LEU A 25 78.598 -11.284 -1.559 1.00 0.00 H new ATOM 0 HA LEU A 25 78.284 -10.393 1.298 1.00 0.00 H new ATOM 0 HB2 LEU A 25 76.572 -11.118 -1.122 1.00 0.00 H new ATOM 0 HB3 LEU A 25 75.864 -11.258 0.475 1.00 0.00 H new ATOM 0 HG LEU A 25 75.443 -9.012 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 25 76.249 -7.671 1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 25 75.623 -9.247 1.937 1.00 0.00 H new ATOM 0 HD13 LEU A 25 77.379 -8.976 1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 25 77.355 -7.459 -0.830 1.00 0.00 H new ATOM 0 HD22 LEU A 25 78.484 -8.764 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 25 77.515 -8.884 -1.884 1.00 0.00 H new ATOM 364 N ASN A 26 78.120 -12.572 2.355 1.00 0.00 N ATOM 365 CA ASN A 26 78.139 -13.903 3.014 1.00 0.00 C ATOM 366 C ASN A 26 76.875 -14.685 2.648 1.00 0.00 C ATOM 367 O ASN A 26 75.783 -14.314 3.032 1.00 0.00 O ATOM 368 CB ASN A 26 78.160 -13.574 4.504 1.00 0.00 C ATOM 369 CG ASN A 26 78.955 -14.640 5.259 1.00 0.00 C ATOM 370 OD1 ASN A 26 79.279 -15.676 4.713 1.00 0.00 O ATOM 371 ND2 ASN A 26 79.285 -14.428 6.504 1.00 0.00 N ATOM 0 H ASN A 26 78.174 -11.777 2.991 1.00 0.00 H new ATOM 0 HA ASN A 26 78.986 -14.520 2.713 1.00 0.00 H new ATOM 0 HB2 ASN A 26 78.608 -12.593 4.663 1.00 0.00 H new ATOM 0 HB3 ASN A 26 77.142 -13.526 4.889 1.00 0.00 H new ATOM 0 HD21 ASN A 26 79.815 -15.132 7.018 1.00 0.00 H new ATOM 0 HD22 ASN A 26 79.013 -13.558 6.963 1.00 0.00 H new ATOM 378 N PRO A 27 77.066 -15.745 1.912 1.00 0.00 N ATOM 379 CA PRO A 27 75.922 -16.590 1.485 1.00 0.00 C ATOM 380 C PRO A 27 75.366 -17.378 2.674 1.00 0.00 C ATOM 381 O PRO A 27 74.172 -17.572 2.797 1.00 0.00 O ATOM 382 CB PRO A 27 76.539 -17.526 0.448 1.00 0.00 C ATOM 383 CG PRO A 27 77.992 -17.582 0.794 1.00 0.00 C ATOM 384 CD PRO A 27 78.348 -16.254 1.412 1.00 0.00 C ATOM 0 HA PRO A 27 75.086 -16.014 1.088 1.00 0.00 H new ATOM 0 HB2 PRO A 27 76.085 -18.516 0.490 1.00 0.00 H new ATOM 0 HB3 PRO A 27 76.388 -17.149 -0.563 1.00 0.00 H new ATOM 0 HG2 PRO A 27 78.192 -18.397 1.489 1.00 0.00 H new ATOM 0 HG3 PRO A 27 78.594 -17.767 -0.096 1.00 0.00 H new ATOM 0 HD2 PRO A 27 79.074 -16.369 2.217 1.00 0.00 H new ATOM 0 HD3 PRO A 27 78.789 -15.577 0.680 1.00 0.00 H new ATOM 392 N ASN A 28 76.218 -17.827 3.556 1.00 0.00 N ATOM 393 CA ASN A 28 75.730 -18.594 4.737 1.00 0.00 C ATOM 394 C ASN A 28 75.088 -17.637 5.741 1.00 0.00 C ATOM 395 O ASN A 28 74.363 -18.040 6.629 1.00 0.00 O ATOM 396 CB ASN A 28 76.979 -19.245 5.334 1.00 0.00 C ATOM 397 CG ASN A 28 77.772 -19.938 4.225 1.00 0.00 C ATOM 398 OD1 ASN A 28 78.807 -19.334 3.706 1.00 0.00 O flip ATOM 399 ND2 ASN A 28 77.449 -21.039 3.827 1.00 0.00 N flip ATOM 0 H ASN A 28 77.228 -17.696 3.510 1.00 0.00 H new ATOM 0 HA ASN A 28 74.978 -19.337 4.472 1.00 0.00 H new ATOM 0 HB2 ASN A 28 77.597 -18.491 5.821 1.00 0.00 H new ATOM 0 HB3 ASN A 28 76.695 -19.968 6.099 1.00 0.00 H new ATOM 0 HD21 ASN A 28 76.641 -21.511 4.232 1.00 0.00 H new ATOM 0 HD22 ASN A 28 77.986 -21.492 3.087 1.00 0.00 H new ATOM 406 N LYS A 29 75.349 -16.369 5.597 1.00 0.00 N ATOM 407 CA LYS A 29 74.759 -15.368 6.528 1.00 0.00 C ATOM 408 C LYS A 29 73.720 -14.526 5.788 1.00 0.00 C ATOM 409 O LYS A 29 73.153 -14.949 4.801 1.00 0.00 O ATOM 410 CB LYS A 29 75.938 -14.502 6.972 1.00 0.00 C ATOM 411 CG LYS A 29 76.129 -14.638 8.484 1.00 0.00 C ATOM 412 CD LYS A 29 74.962 -13.967 9.209 1.00 0.00 C ATOM 413 CE LYS A 29 74.825 -14.560 10.614 1.00 0.00 C ATOM 414 NZ LYS A 29 73.662 -13.853 11.219 1.00 0.00 N ATOM 0 H LYS A 29 75.949 -15.980 4.870 1.00 0.00 H new ATOM 0 HA LYS A 29 74.254 -15.829 7.377 1.00 0.00 H new ATOM 0 HB2 LYS A 29 76.845 -14.809 6.451 1.00 0.00 H new ATOM 0 HB3 LYS A 29 75.757 -13.460 6.710 1.00 0.00 H new ATOM 0 HG2 LYS A 29 76.186 -15.691 8.761 1.00 0.00 H new ATOM 0 HG3 LYS A 29 77.070 -14.178 8.785 1.00 0.00 H new ATOM 0 HD2 LYS A 29 75.129 -12.892 9.271 1.00 0.00 H new ATOM 0 HD3 LYS A 29 74.039 -14.115 8.649 1.00 0.00 H new ATOM 0 HE2 LYS A 29 74.655 -15.636 10.573 1.00 0.00 H new ATOM 0 HE3 LYS A 29 75.731 -14.402 11.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 73.505 -14.206 12.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 73.855 -12.832 11.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 72.813 -14.027 10.645 1.00 0.00 H new ATOM 428 N SER A 30 73.470 -13.336 6.252 1.00 0.00 N ATOM 429 CA SER A 30 72.468 -12.469 5.569 1.00 0.00 C ATOM 430 C SER A 30 73.113 -11.156 5.134 1.00 0.00 C ATOM 431 O SER A 30 74.015 -10.650 5.776 1.00 0.00 O ATOM 432 CB SER A 30 71.392 -12.197 6.614 1.00 0.00 C ATOM 433 OG SER A 30 71.139 -13.386 7.351 1.00 0.00 O ATOM 0 H SER A 30 73.914 -12.925 7.073 1.00 0.00 H new ATOM 0 HA SER A 30 72.063 -12.945 4.676 1.00 0.00 H new ATOM 0 HB2 SER A 30 71.714 -11.401 7.286 1.00 0.00 H new ATOM 0 HB3 SER A 30 70.477 -11.854 6.130 1.00 0.00 H new ATOM 0 HG SER A 30 70.449 -13.213 8.025 1.00 0.00 H new ATOM 439 N VAL A 31 72.654 -10.589 4.055 1.00 0.00 N ATOM 440 CA VAL A 31 73.243 -9.303 3.600 1.00 0.00 C ATOM 441 C VAL A 31 72.852 -8.196 4.578 1.00 0.00 C ATOM 442 O VAL A 31 73.624 -7.301 4.860 1.00 0.00 O ATOM 443 CB VAL A 31 72.660 -9.039 2.210 1.00 0.00 C ATOM 444 CG1 VAL A 31 73.559 -8.053 1.465 1.00 0.00 C ATOM 445 CG2 VAL A 31 72.588 -10.347 1.418 1.00 0.00 C ATOM 0 H VAL A 31 71.902 -10.958 3.473 1.00 0.00 H new ATOM 0 HA VAL A 31 74.332 -9.336 3.560 1.00 0.00 H new ATOM 0 HB VAL A 31 71.658 -8.624 2.315 1.00 0.00 H new ATOM 0 HG11 VAL A 31 73.147 -7.862 0.474 1.00 0.00 H new ATOM 0 HG12 VAL A 31 73.613 -7.118 2.022 1.00 0.00 H new ATOM 0 HG13 VAL A 31 74.559 -8.475 1.367 1.00 0.00 H new ATOM 0 HG21 VAL A 31 72.172 -10.151 0.430 1.00 0.00 H new ATOM 0 HG22 VAL A 31 73.589 -10.765 1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 31 71.951 -11.057 1.946 1.00 0.00 H new ATOM 455 N ALA A 32 71.663 -8.261 5.118 1.00 0.00 N ATOM 456 CA ALA A 32 71.238 -7.222 6.096 1.00 0.00 C ATOM 457 C ALA A 32 72.267 -7.152 7.222 1.00 0.00 C ATOM 458 O ALA A 32 72.695 -6.088 7.629 1.00 0.00 O ATOM 459 CB ALA A 32 69.885 -7.699 6.626 1.00 0.00 C ATOM 0 H ALA A 32 70.972 -8.986 4.924 1.00 0.00 H new ATOM 0 HA ALA A 32 71.161 -6.228 5.656 1.00 0.00 H new ATOM 0 HB1 ALA A 32 69.506 -6.982 7.355 1.00 0.00 H new ATOM 0 HB2 ALA A 32 69.180 -7.783 5.799 1.00 0.00 H new ATOM 0 HB3 ALA A 32 70.003 -8.672 7.102 1.00 0.00 H new ATOM 465 N GLU A 33 72.685 -8.286 7.709 1.00 0.00 N ATOM 466 CA GLU A 33 73.708 -8.298 8.790 1.00 0.00 C ATOM 467 C GLU A 33 74.989 -7.656 8.262 1.00 0.00 C ATOM 468 O GLU A 33 75.592 -6.827 8.912 1.00 0.00 O ATOM 469 CB GLU A 33 73.927 -9.777 9.114 1.00 0.00 C ATOM 470 CG GLU A 33 72.598 -10.411 9.529 1.00 0.00 C ATOM 471 CD GLU A 33 72.322 -10.100 11.001 1.00 0.00 C ATOM 472 OE1 GLU A 33 73.099 -10.535 11.834 1.00 0.00 O ATOM 473 OE2 GLU A 33 71.338 -9.430 11.269 1.00 0.00 O ATOM 0 H GLU A 33 72.363 -9.205 7.405 1.00 0.00 H new ATOM 0 HA GLU A 33 73.404 -7.743 9.677 1.00 0.00 H new ATOM 0 HB2 GLU A 33 74.333 -10.294 8.245 1.00 0.00 H new ATOM 0 HB3 GLU A 33 74.658 -9.880 9.916 1.00 0.00 H new ATOM 0 HG2 GLU A 33 71.790 -10.026 8.907 1.00 0.00 H new ATOM 0 HG3 GLU A 33 72.633 -11.489 9.375 1.00 0.00 H new ATOM 480 N LEU A 34 75.393 -8.009 7.069 1.00 0.00 N ATOM 481 CA LEU A 34 76.610 -7.389 6.492 1.00 0.00 C ATOM 482 C LEU A 34 76.406 -5.879 6.464 1.00 0.00 C ATOM 483 O LEU A 34 77.333 -5.107 6.608 1.00 0.00 O ATOM 484 CB LEU A 34 76.707 -7.952 5.075 1.00 0.00 C ATOM 485 CG LEU A 34 77.659 -9.149 5.062 1.00 0.00 C ATOM 486 CD1 LEU A 34 76.851 -10.444 5.154 1.00 0.00 C ATOM 487 CD2 LEU A 34 78.465 -9.143 3.762 1.00 0.00 C ATOM 0 H LEU A 34 74.931 -8.698 6.476 1.00 0.00 H new ATOM 0 HA LEU A 34 77.517 -7.597 7.059 1.00 0.00 H new ATOM 0 HB2 LEU A 34 75.720 -8.256 4.725 1.00 0.00 H new ATOM 0 HB3 LEU A 34 77.065 -7.183 4.391 1.00 0.00 H new ATOM 0 HG LEU A 34 78.338 -9.083 5.912 1.00 0.00 H new ATOM 0 HD11 LEU A 34 77.529 -11.297 5.145 1.00 0.00 H new ATOM 0 HD12 LEU A 34 76.275 -10.448 6.079 1.00 0.00 H new ATOM 0 HD13 LEU A 34 76.172 -10.511 4.304 1.00 0.00 H new ATOM 0 HD21 LEU A 34 79.144 -9.996 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 34 77.786 -9.209 2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 34 79.041 -8.220 3.695 1.00 0.00 H new ATOM 499 N LYS A 35 75.180 -5.456 6.301 1.00 0.00 N ATOM 500 CA LYS A 35 74.888 -4.000 6.289 1.00 0.00 C ATOM 501 C LYS A 35 75.346 -3.398 7.615 1.00 0.00 C ATOM 502 O LYS A 35 76.214 -2.550 7.663 1.00 0.00 O ATOM 503 CB LYS A 35 73.368 -3.899 6.144 1.00 0.00 C ATOM 504 CG LYS A 35 73.022 -2.950 4.996 1.00 0.00 C ATOM 505 CD LYS A 35 73.427 -3.587 3.664 1.00 0.00 C ATOM 506 CE LYS A 35 72.572 -4.831 3.409 1.00 0.00 C ATOM 507 NZ LYS A 35 71.171 -4.328 3.347 1.00 0.00 N ATOM 0 H LYS A 35 74.369 -6.061 6.176 1.00 0.00 H new ATOM 0 HA LYS A 35 75.398 -3.466 5.487 1.00 0.00 H new ATOM 0 HB2 LYS A 35 72.945 -4.885 5.953 1.00 0.00 H new ATOM 0 HB3 LYS A 35 72.928 -3.537 7.073 1.00 0.00 H new ATOM 0 HG2 LYS A 35 71.953 -2.735 4.998 1.00 0.00 H new ATOM 0 HG3 LYS A 35 73.539 -1.999 5.128 1.00 0.00 H new ATOM 0 HD2 LYS A 35 73.297 -2.871 2.852 1.00 0.00 H new ATOM 0 HD3 LYS A 35 74.483 -3.857 3.684 1.00 0.00 H new ATOM 0 HE2 LYS A 35 72.857 -5.322 2.479 1.00 0.00 H new ATOM 0 HE3 LYS A 35 72.694 -5.564 4.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 70.568 -5.037 2.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 70.822 -4.153 4.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 71.144 -3.442 2.803 1.00 0.00 H new ATOM 521 N VAL A 36 74.782 -3.860 8.698 1.00 0.00 N ATOM 522 CA VAL A 36 75.193 -3.350 10.035 1.00 0.00 C ATOM 523 C VAL A 36 76.683 -3.597 10.225 1.00 0.00 C ATOM 524 O VAL A 36 77.397 -2.764 10.735 1.00 0.00 O ATOM 525 CB VAL A 36 74.390 -4.180 11.025 1.00 0.00 C ATOM 526 CG1 VAL A 36 74.821 -3.837 12.453 1.00 0.00 C ATOM 527 CG2 VAL A 36 72.899 -3.883 10.854 1.00 0.00 C ATOM 0 H VAL A 36 74.051 -4.572 8.713 1.00 0.00 H new ATOM 0 HA VAL A 36 75.015 -2.282 10.159 1.00 0.00 H new ATOM 0 HB VAL A 36 74.571 -5.238 10.838 1.00 0.00 H new ATOM 0 HG11 VAL A 36 74.244 -4.433 13.160 1.00 0.00 H new ATOM 0 HG12 VAL A 36 75.882 -4.055 12.575 1.00 0.00 H new ATOM 0 HG13 VAL A 36 74.644 -2.778 12.642 1.00 0.00 H new ATOM 0 HG21 VAL A 36 72.326 -4.479 11.564 1.00 0.00 H new ATOM 0 HG22 VAL A 36 72.716 -2.824 11.037 1.00 0.00 H new ATOM 0 HG23 VAL A 36 72.592 -4.134 9.839 1.00 0.00 H new ATOM 537 N ALA A 37 77.160 -4.735 9.803 1.00 0.00 N ATOM 538 CA ALA A 37 78.611 -5.016 9.944 1.00 0.00 C ATOM 539 C ALA A 37 79.383 -3.982 9.137 1.00 0.00 C ATOM 540 O ALA A 37 80.463 -3.566 9.503 1.00 0.00 O ATOM 541 CB ALA A 37 78.810 -6.419 9.368 1.00 0.00 C ATOM 0 H ALA A 37 76.610 -5.477 9.370 1.00 0.00 H new ATOM 0 HA ALA A 37 78.961 -4.966 10.975 1.00 0.00 H new ATOM 0 HB1 ALA A 37 79.862 -6.695 9.438 1.00 0.00 H new ATOM 0 HB2 ALA A 37 78.209 -7.132 9.932 1.00 0.00 H new ATOM 0 HB3 ALA A 37 78.501 -6.430 8.323 1.00 0.00 H new ATOM 547 N ILE A 38 78.817 -3.545 8.046 1.00 0.00 N ATOM 548 CA ILE A 38 79.494 -2.516 7.216 1.00 0.00 C ATOM 549 C ILE A 38 79.263 -1.139 7.838 1.00 0.00 C ATOM 550 O ILE A 38 80.090 -0.255 7.740 1.00 0.00 O ATOM 551 CB ILE A 38 78.829 -2.603 5.842 1.00 0.00 C ATOM 552 CG1 ILE A 38 79.175 -3.944 5.191 1.00 0.00 C ATOM 553 CG2 ILE A 38 79.336 -1.464 4.956 1.00 0.00 C ATOM 554 CD1 ILE A 38 78.044 -4.363 4.250 1.00 0.00 C ATOM 0 H ILE A 38 77.912 -3.859 7.695 1.00 0.00 H new ATOM 0 HA ILE A 38 80.571 -2.672 7.147 1.00 0.00 H new ATOM 0 HB ILE A 38 77.748 -2.522 5.957 1.00 0.00 H new ATOM 0 HG12 ILE A 38 80.110 -3.861 4.638 1.00 0.00 H new ATOM 0 HG13 ILE A 38 79.325 -4.704 5.958 1.00 0.00 H new ATOM 0 HG21 ILE A 38 78.862 -1.526 3.977 1.00 0.00 H new ATOM 0 HG22 ILE A 38 79.091 -0.507 5.418 1.00 0.00 H new ATOM 0 HG23 ILE A 38 80.417 -1.546 4.842 1.00 0.00 H new ATOM 0 HD11 ILE A 38 78.291 -5.318 3.787 1.00 0.00 H new ATOM 0 HD12 ILE A 38 77.118 -4.463 4.816 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.916 -3.607 3.476 1.00 0.00 H new ATOM 566 N SER A 39 78.149 -0.957 8.499 1.00 0.00 N ATOM 567 CA SER A 39 77.887 0.362 9.142 1.00 0.00 C ATOM 568 C SER A 39 78.705 0.449 10.427 1.00 0.00 C ATOM 569 O SER A 39 79.088 1.514 10.876 1.00 0.00 O ATOM 570 CB SER A 39 76.390 0.370 9.449 1.00 0.00 C ATOM 571 OG SER A 39 76.151 1.175 10.596 1.00 0.00 O ATOM 0 H SER A 39 77.417 -1.657 8.620 1.00 0.00 H new ATOM 0 HA SER A 39 78.162 1.208 8.513 1.00 0.00 H new ATOM 0 HB2 SER A 39 75.834 0.758 8.596 1.00 0.00 H new ATOM 0 HB3 SER A 39 76.037 -0.646 9.624 1.00 0.00 H new ATOM 0 HG SER A 39 75.192 1.184 10.795 1.00 0.00 H new ATOM 577 N GLU A 40 78.987 -0.680 11.008 1.00 0.00 N ATOM 578 CA GLU A 40 79.788 -0.707 12.254 1.00 0.00 C ATOM 579 C GLU A 40 81.271 -0.665 11.904 1.00 0.00 C ATOM 580 O GLU A 40 82.053 0.021 12.532 1.00 0.00 O ATOM 581 CB GLU A 40 79.420 -2.031 12.908 1.00 0.00 C ATOM 582 CG GLU A 40 79.226 -1.826 14.411 1.00 0.00 C ATOM 583 CD GLU A 40 80.567 -1.995 15.129 1.00 0.00 C ATOM 584 OE1 GLU A 40 81.515 -2.407 14.481 1.00 0.00 O ATOM 585 OE2 GLU A 40 80.621 -1.711 16.313 1.00 0.00 O ATOM 0 H GLU A 40 78.692 -1.595 10.667 1.00 0.00 H new ATOM 0 HA GLU A 40 79.592 0.139 12.912 1.00 0.00 H new ATOM 0 HB2 GLU A 40 78.506 -2.426 12.464 1.00 0.00 H new ATOM 0 HB3 GLU A 40 80.204 -2.766 12.730 1.00 0.00 H new ATOM 0 HG2 GLU A 40 78.822 -0.832 14.604 1.00 0.00 H new ATOM 0 HG3 GLU A 40 78.503 -2.545 14.796 1.00 0.00 H new ATOM 592 N LEU A 41 81.658 -1.383 10.889 1.00 0.00 N ATOM 593 CA LEU A 41 83.088 -1.371 10.479 1.00 0.00 C ATOM 594 C LEU A 41 83.470 0.046 10.070 1.00 0.00 C ATOM 595 O LEU A 41 84.570 0.502 10.313 1.00 0.00 O ATOM 596 CB LEU A 41 83.180 -2.324 9.285 1.00 0.00 C ATOM 597 CG LEU A 41 84.605 -2.868 9.168 1.00 0.00 C ATOM 598 CD1 LEU A 41 84.799 -4.017 10.159 1.00 0.00 C ATOM 599 CD2 LEU A 41 84.836 -3.382 7.745 1.00 0.00 C ATOM 0 H LEU A 41 81.048 -1.976 10.327 1.00 0.00 H new ATOM 0 HA LEU A 41 83.761 -1.681 11.279 1.00 0.00 H new ATOM 0 HB2 LEU A 41 82.475 -3.146 9.409 1.00 0.00 H new ATOM 0 HB3 LEU A 41 82.903 -1.802 8.369 1.00 0.00 H new ATOM 0 HG LEU A 41 85.316 -2.073 9.391 1.00 0.00 H new ATOM 0 HD11 LEU A 41 85.815 -4.403 10.074 1.00 0.00 H new ATOM 0 HD12 LEU A 41 84.632 -3.655 11.173 1.00 0.00 H new ATOM 0 HD13 LEU A 41 84.088 -4.813 9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 41 85.851 -3.770 7.659 1.00 0.00 H new ATOM 0 HD22 LEU A 41 84.123 -4.177 7.525 1.00 0.00 H new ATOM 0 HD23 LEU A 41 84.699 -2.565 7.036 1.00 0.00 H new ATOM 611 N PHE A 42 82.557 0.753 9.469 1.00 0.00 N ATOM 612 CA PHE A 42 82.845 2.143 9.064 1.00 0.00 C ATOM 613 C PHE A 42 82.589 3.058 10.258 1.00 0.00 C ATOM 614 O PHE A 42 83.120 4.146 10.351 1.00 0.00 O ATOM 615 CB PHE A 42 81.850 2.429 7.947 1.00 0.00 C ATOM 616 CG PHE A 42 82.259 1.696 6.688 1.00 0.00 C ATOM 617 CD1 PHE A 42 82.377 0.300 6.690 1.00 0.00 C ATOM 618 CD2 PHE A 42 82.518 2.416 5.516 1.00 0.00 C ATOM 619 CE1 PHE A 42 82.753 -0.373 5.522 1.00 0.00 C ATOM 620 CE2 PHE A 42 82.894 1.743 4.347 1.00 0.00 C ATOM 621 CZ PHE A 42 83.012 0.349 4.351 1.00 0.00 C ATOM 0 H PHE A 42 81.620 0.421 9.242 1.00 0.00 H new ATOM 0 HA PHE A 42 83.873 2.299 8.737 1.00 0.00 H new ATOM 0 HB2 PHE A 42 80.851 2.117 8.251 1.00 0.00 H new ATOM 0 HB3 PHE A 42 81.805 3.501 7.755 1.00 0.00 H new ATOM 0 HD1 PHE A 42 82.178 -0.257 7.593 1.00 0.00 H new ATOM 0 HD2 PHE A 42 82.428 3.492 5.513 1.00 0.00 H new ATOM 0 HE1 PHE A 42 82.843 -1.449 5.524 1.00 0.00 H new ATOM 0 HE2 PHE A 42 83.093 2.300 3.443 1.00 0.00 H new ATOM 0 HZ PHE A 42 83.303 -0.170 3.450 1.00 0.00 H new ATOM 631 N ALA A 43 81.782 2.609 11.182 1.00 0.00 N ATOM 632 CA ALA A 43 81.494 3.436 12.386 1.00 0.00 C ATOM 633 C ALA A 43 82.724 3.457 13.289 1.00 0.00 C ATOM 634 O ALA A 43 83.030 4.447 13.924 1.00 0.00 O ATOM 635 CB ALA A 43 80.323 2.738 13.081 1.00 0.00 C ATOM 0 H ALA A 43 81.311 1.705 11.154 1.00 0.00 H new ATOM 0 HA ALA A 43 81.251 4.470 12.140 1.00 0.00 H new ATOM 0 HB1 ALA A 43 80.052 3.291 13.981 1.00 0.00 H new ATOM 0 HB2 ALA A 43 79.468 2.702 12.406 1.00 0.00 H new ATOM 0 HB3 ALA A 43 80.614 1.723 13.352 1.00 0.00 H new ATOM 641 N LYS A 44 83.443 2.369 13.336 1.00 0.00 N ATOM 642 CA LYS A 44 84.668 2.320 14.177 1.00 0.00 C ATOM 643 C LYS A 44 85.803 3.045 13.456 1.00 0.00 C ATOM 644 O LYS A 44 86.791 3.428 14.050 1.00 0.00 O ATOM 645 CB LYS A 44 84.989 0.831 14.328 1.00 0.00 C ATOM 646 CG LYS A 44 84.502 0.339 15.692 1.00 0.00 C ATOM 647 CD LYS A 44 84.764 -1.163 15.816 1.00 0.00 C ATOM 648 CE LYS A 44 84.261 -1.875 14.557 1.00 0.00 C ATOM 649 NZ LYS A 44 84.005 -3.278 14.985 1.00 0.00 N ATOM 0 H LYS A 44 83.233 1.511 12.826 1.00 0.00 H new ATOM 0 HA LYS A 44 84.535 2.800 15.146 1.00 0.00 H new ATOM 0 HB2 LYS A 44 84.509 0.262 13.532 1.00 0.00 H new ATOM 0 HB3 LYS A 44 86.063 0.668 14.233 1.00 0.00 H new ATOM 0 HG2 LYS A 44 85.017 0.876 16.489 1.00 0.00 H new ATOM 0 HG3 LYS A 44 83.437 0.544 15.805 1.00 0.00 H new ATOM 0 HD2 LYS A 44 85.830 -1.347 15.949 1.00 0.00 H new ATOM 0 HD3 LYS A 44 84.259 -1.559 16.697 1.00 0.00 H new ATOM 0 HE2 LYS A 44 83.354 -1.407 14.175 1.00 0.00 H new ATOM 0 HE3 LYS A 44 85.001 -1.835 13.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 84.508 -3.932 14.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 84.344 -3.411 15.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 82.984 -3.473 14.944 1.00 0.00 H new ATOM 663 N ASN A 45 85.658 3.243 12.173 1.00 0.00 N ATOM 664 CA ASN A 45 86.714 3.951 11.402 1.00 0.00 C ATOM 665 C ASN A 45 86.451 5.456 11.436 1.00 0.00 C ATOM 666 O ASN A 45 87.315 6.248 11.115 1.00 0.00 O ATOM 667 CB ASN A 45 86.582 3.413 9.978 1.00 0.00 C ATOM 668 CG ASN A 45 87.601 2.296 9.758 1.00 0.00 C ATOM 669 OD1 ASN A 45 88.516 2.437 8.970 1.00 0.00 O ATOM 670 ND2 ASN A 45 87.482 1.182 10.428 1.00 0.00 N ATOM 0 H ASN A 45 84.851 2.943 11.627 1.00 0.00 H new ATOM 0 HA ASN A 45 87.714 3.789 11.806 1.00 0.00 H new ATOM 0 HB2 ASN A 45 85.573 3.036 9.812 1.00 0.00 H new ATOM 0 HB3 ASN A 45 86.745 4.215 9.258 1.00 0.00 H new ATOM 0 HD21 ASN A 45 88.157 0.430 10.290 1.00 0.00 H new ATOM 0 HD22 ASN A 45 86.714 1.064 11.089 1.00 0.00 H new ATOM 677 N ASP A 46 85.248 5.838 11.806 1.00 0.00 N ATOM 678 CA ASP A 46 84.856 7.283 11.868 1.00 0.00 C ATOM 679 C ASP A 46 84.316 7.695 10.511 1.00 0.00 C ATOM 680 O ASP A 46 84.423 8.831 10.094 1.00 0.00 O ATOM 681 CB ASP A 46 86.107 8.086 12.238 1.00 0.00 C ATOM 682 CG ASP A 46 85.715 9.261 13.136 1.00 0.00 C ATOM 683 OD1 ASP A 46 85.505 9.032 14.317 1.00 0.00 O ATOM 684 OD2 ASP A 46 85.629 10.367 12.629 1.00 0.00 O ATOM 0 H ASP A 46 84.506 5.191 12.073 1.00 0.00 H new ATOM 0 HA ASP A 46 84.081 7.464 12.613 1.00 0.00 H new ATOM 0 HB2 ASP A 46 86.824 7.446 12.752 1.00 0.00 H new ATOM 0 HB3 ASP A 46 86.597 8.452 11.336 1.00 0.00 H new ATOM 689 N LEU A 47 83.728 6.762 9.824 1.00 0.00 N ATOM 690 CA LEU A 47 83.157 7.062 8.492 1.00 0.00 C ATOM 691 C LEU A 47 81.773 7.690 8.663 1.00 0.00 C ATOM 692 O LEU A 47 81.560 8.519 9.524 1.00 0.00 O ATOM 693 CB LEU A 47 83.075 5.698 7.794 1.00 0.00 C ATOM 694 CG LEU A 47 83.530 5.846 6.340 1.00 0.00 C ATOM 695 CD1 LEU A 47 84.463 4.690 5.979 1.00 0.00 C ATOM 696 CD2 LEU A 47 82.313 5.824 5.415 1.00 0.00 C ATOM 0 H LEU A 47 83.619 5.796 10.133 1.00 0.00 H new ATOM 0 HA LEU A 47 83.752 7.769 7.914 1.00 0.00 H new ATOM 0 HB2 LEU A 47 83.703 4.973 8.312 1.00 0.00 H new ATOM 0 HB3 LEU A 47 82.054 5.318 7.831 1.00 0.00 H new ATOM 0 HG LEU A 47 84.057 6.793 6.221 1.00 0.00 H new ATOM 0 HD11 LEU A 47 84.788 4.794 4.944 1.00 0.00 H new ATOM 0 HD12 LEU A 47 85.333 4.706 6.636 1.00 0.00 H new ATOM 0 HD13 LEU A 47 83.934 3.744 6.100 1.00 0.00 H new ATOM 0 HD21 LEU A 47 82.640 5.930 4.381 1.00 0.00 H new ATOM 0 HD22 LEU A 47 81.783 4.879 5.533 1.00 0.00 H new ATOM 0 HD23 LEU A 47 81.647 6.648 5.671 1.00 0.00 H new ATOM 708 N ALA A 48 80.836 7.299 7.855 1.00 0.00 N ATOM 709 CA ALA A 48 79.463 7.865 7.967 1.00 0.00 C ATOM 710 C ALA A 48 78.550 7.224 6.925 1.00 0.00 C ATOM 711 O ALA A 48 77.953 7.892 6.104 1.00 0.00 O ATOM 712 CB ALA A 48 79.617 9.363 7.700 1.00 0.00 C ATOM 0 H ALA A 48 80.959 6.607 7.116 1.00 0.00 H new ATOM 0 HA ALA A 48 79.018 7.677 8.944 1.00 0.00 H new ATOM 0 HB1 ALA A 48 78.642 9.846 7.766 1.00 0.00 H new ATOM 0 HB2 ALA A 48 80.289 9.797 8.441 1.00 0.00 H new ATOM 0 HB3 ALA A 48 80.030 9.514 6.703 1.00 0.00 H new ATOM 718 N VAL A 49 78.441 5.929 6.960 1.00 0.00 N ATOM 719 CA VAL A 49 77.579 5.222 5.994 1.00 0.00 C ATOM 720 C VAL A 49 76.191 5.851 5.975 1.00 0.00 C ATOM 721 O VAL A 49 75.483 5.871 6.962 1.00 0.00 O ATOM 722 CB VAL A 49 77.530 3.788 6.509 1.00 0.00 C ATOM 723 CG1 VAL A 49 78.914 3.150 6.373 1.00 0.00 C ATOM 724 CG2 VAL A 49 77.112 3.783 7.982 1.00 0.00 C ATOM 0 H VAL A 49 78.921 5.327 7.628 1.00 0.00 H new ATOM 0 HA VAL A 49 77.953 5.273 4.971 1.00 0.00 H new ATOM 0 HB VAL A 49 76.806 3.220 5.925 1.00 0.00 H new ATOM 0 HG11 VAL A 49 78.880 2.125 6.741 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.213 3.149 5.325 1.00 0.00 H new ATOM 0 HG13 VAL A 49 79.637 3.721 6.956 1.00 0.00 H new ATOM 0 HG21 VAL A 49 77.078 2.757 8.347 1.00 0.00 H new ATOM 0 HG22 VAL A 49 77.834 4.352 8.567 1.00 0.00 H new ATOM 0 HG23 VAL A 49 76.126 4.237 8.082 1.00 0.00 H new ATOM 734 N VAL A 50 75.815 6.373 4.853 1.00 0.00 N ATOM 735 CA VAL A 50 74.477 7.028 4.728 1.00 0.00 C ATOM 736 C VAL A 50 73.429 5.997 4.313 1.00 0.00 C ATOM 737 O VAL A 50 72.345 5.946 4.859 1.00 0.00 O ATOM 738 CB VAL A 50 74.632 8.100 3.635 1.00 0.00 C ATOM 739 CG1 VAL A 50 73.743 9.299 3.960 1.00 0.00 C ATOM 740 CG2 VAL A 50 76.083 8.571 3.561 1.00 0.00 C ATOM 0 H VAL A 50 76.377 6.379 4.002 1.00 0.00 H new ATOM 0 HA VAL A 50 74.152 7.465 5.672 1.00 0.00 H new ATOM 0 HB VAL A 50 74.340 7.666 2.679 1.00 0.00 H new ATOM 0 HG11 VAL A 50 73.855 10.056 3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 50 72.702 8.978 4.006 1.00 0.00 H new ATOM 0 HG13 VAL A 50 74.036 9.719 4.922 1.00 0.00 H new ATOM 0 HG21 VAL A 50 76.180 9.329 2.784 1.00 0.00 H new ATOM 0 HG22 VAL A 50 76.377 8.995 4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 50 76.729 7.725 3.325 1.00 0.00 H new ATOM 750 N ASP A 51 73.739 5.172 3.349 1.00 0.00 N ATOM 751 CA ASP A 51 72.747 4.150 2.907 1.00 0.00 C ATOM 752 C ASP A 51 73.447 2.841 2.529 1.00 0.00 C ATOM 753 O ASP A 51 74.630 2.812 2.255 1.00 0.00 O ATOM 754 CB ASP A 51 72.065 4.764 1.686 1.00 0.00 C ATOM 755 CG ASP A 51 70.548 4.645 1.834 1.00 0.00 C ATOM 756 OD1 ASP A 51 69.995 5.360 2.654 1.00 0.00 O ATOM 757 OD2 ASP A 51 69.963 3.841 1.127 1.00 0.00 O ATOM 0 H ASP A 51 74.629 5.161 2.852 1.00 0.00 H new ATOM 0 HA ASP A 51 72.036 3.905 3.696 1.00 0.00 H new ATOM 0 HB2 ASP A 51 72.350 5.811 1.586 1.00 0.00 H new ATOM 0 HB3 ASP A 51 72.393 4.256 0.779 1.00 0.00 H new ATOM 762 N VAL A 52 72.719 1.759 2.508 1.00 0.00 N ATOM 763 CA VAL A 52 73.325 0.447 2.141 1.00 0.00 C ATOM 764 C VAL A 52 72.251 -0.460 1.534 1.00 0.00 C ATOM 765 O VAL A 52 71.073 -0.275 1.761 1.00 0.00 O ATOM 766 CB VAL A 52 73.857 -0.150 3.450 1.00 0.00 C ATOM 767 CG1 VAL A 52 74.918 -1.205 3.130 1.00 0.00 C ATOM 768 CG2 VAL A 52 74.489 0.951 4.308 1.00 0.00 C ATOM 0 H VAL A 52 71.724 1.727 2.731 1.00 0.00 H new ATOM 0 HA VAL A 52 74.122 0.553 1.405 1.00 0.00 H new ATOM 0 HB VAL A 52 73.031 -0.605 3.997 1.00 0.00 H new ATOM 0 HG11 VAL A 52 75.298 -1.632 4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 52 74.475 -1.994 2.523 1.00 0.00 H new ATOM 0 HG13 VAL A 52 75.738 -0.742 2.581 1.00 0.00 H new ATOM 0 HG21 VAL A 52 74.864 0.519 5.236 1.00 0.00 H new ATOM 0 HG22 VAL A 52 75.313 1.410 3.762 1.00 0.00 H new ATOM 0 HG23 VAL A 52 73.740 1.709 4.538 1.00 0.00 H new ATOM 778 N ARG A 53 72.645 -1.434 0.763 1.00 0.00 N ATOM 779 CA ARG A 53 71.639 -2.344 0.144 1.00 0.00 C ATOM 780 C ARG A 53 72.304 -3.652 -0.286 1.00 0.00 C ATOM 781 O ARG A 53 73.511 -3.751 -0.367 1.00 0.00 O ATOM 782 CB ARG A 53 71.113 -1.585 -1.074 1.00 0.00 C ATOM 783 CG ARG A 53 69.770 -0.936 -0.731 1.00 0.00 C ATOM 784 CD ARG A 53 68.788 -1.155 -1.883 1.00 0.00 C ATOM 785 NE ARG A 53 68.261 0.201 -2.201 1.00 0.00 N ATOM 786 CZ ARG A 53 67.764 0.448 -3.383 1.00 0.00 C ATOM 787 NH1 ARG A 53 66.872 -0.354 -3.896 1.00 0.00 N ATOM 788 NH2 ARG A 53 68.159 1.497 -4.051 1.00 0.00 N ATOM 0 H ARG A 53 73.617 -1.640 0.534 1.00 0.00 H new ATOM 0 HA ARG A 53 70.839 -2.607 0.837 1.00 0.00 H new ATOM 0 HB2 ARG A 53 71.830 -0.823 -1.378 1.00 0.00 H new ATOM 0 HB3 ARG A 53 70.995 -2.266 -1.917 1.00 0.00 H new ATOM 0 HG2 ARG A 53 69.371 -1.366 0.188 1.00 0.00 H new ATOM 0 HG3 ARG A 53 69.905 0.131 -0.552 1.00 0.00 H new ATOM 0 HD2 ARG A 53 69.284 -1.598 -2.746 1.00 0.00 H new ATOM 0 HD3 ARG A 53 67.985 -1.833 -1.594 1.00 0.00 H new ATOM 0 HE ARG A 53 68.288 0.937 -1.495 1.00 0.00 H new ATOM 0 HH11 ARG A 53 66.563 -1.174 -3.374 1.00 0.00 H new ATOM 0 HH12 ARG A 53 66.484 -0.161 -4.819 1.00 0.00 H new ATOM 0 HH21 ARG A 53 68.856 2.124 -3.650 1.00 0.00 H new ATOM 0 HH22 ARG A 53 67.771 1.690 -4.974 1.00 0.00 H new ATOM 802 N THR A 54 71.523 -4.663 -0.550 1.00 0.00 N ATOM 803 CA THR A 54 72.099 -5.964 -0.962 1.00 0.00 C ATOM 804 C THR A 54 72.206 -6.054 -2.485 1.00 0.00 C ATOM 805 O THR A 54 71.490 -5.397 -3.214 1.00 0.00 O ATOM 806 CB THR A 54 71.102 -6.997 -0.440 1.00 0.00 C ATOM 807 OG1 THR A 54 69.945 -6.993 -1.265 1.00 0.00 O ATOM 808 CG2 THR A 54 70.706 -6.654 0.998 1.00 0.00 C ATOM 0 H THR A 54 70.505 -4.639 -0.496 1.00 0.00 H new ATOM 0 HA THR A 54 73.106 -6.112 -0.572 1.00 0.00 H new ATOM 0 HB THR A 54 71.562 -7.985 -0.459 1.00 0.00 H new ATOM 0 HG1 THR A 54 69.243 -7.535 -0.847 1.00 0.00 H new ATOM 0 HG21 THR A 54 69.995 -7.394 1.366 1.00 0.00 H new ATOM 0 HG22 THR A 54 71.594 -6.658 1.631 1.00 0.00 H new ATOM 0 HG23 THR A 54 70.247 -5.666 1.023 1.00 0.00 H new ATOM 816 N GLY A 55 73.092 -6.879 -2.962 1.00 0.00 N ATOM 817 CA GLY A 55 73.261 -7.047 -4.427 1.00 0.00 C ATOM 818 C GLY A 55 72.762 -8.436 -4.806 1.00 0.00 C ATOM 819 O GLY A 55 73.120 -9.422 -4.192 1.00 0.00 O ATOM 0 H GLY A 55 73.714 -7.451 -2.391 1.00 0.00 H new ATOM 0 HA2 GLY A 55 72.701 -6.282 -4.965 1.00 0.00 H new ATOM 0 HA3 GLY A 55 74.308 -6.930 -4.705 1.00 0.00 H new ATOM 823 N THR A 56 71.916 -8.518 -5.790 1.00 0.00 N ATOM 824 CA THR A 56 71.363 -9.843 -6.193 1.00 0.00 C ATOM 825 C THR A 56 70.622 -10.468 -5.005 1.00 0.00 C ATOM 826 O THR A 56 70.280 -11.634 -5.008 1.00 0.00 O ATOM 827 CB THR A 56 72.578 -10.687 -6.597 1.00 0.00 C ATOM 828 OG1 THR A 56 72.991 -10.318 -7.905 1.00 0.00 O ATOM 829 CG2 THR A 56 72.201 -12.169 -6.583 1.00 0.00 C ATOM 0 H THR A 56 71.581 -7.724 -6.336 1.00 0.00 H new ATOM 0 HA THR A 56 70.649 -9.770 -7.014 1.00 0.00 H new ATOM 0 HB THR A 56 73.391 -10.514 -5.892 1.00 0.00 H new ATOM 0 HG1 THR A 56 73.948 -10.108 -7.899 1.00 0.00 H new ATOM 0 HG21 THR A 56 73.066 -12.767 -6.870 1.00 0.00 H new ATOM 0 HG22 THR A 56 71.880 -12.453 -5.581 1.00 0.00 H new ATOM 0 HG23 THR A 56 71.388 -12.344 -7.288 1.00 0.00 H new ATOM 837 N ASN A 57 70.355 -9.687 -3.992 1.00 0.00 N ATOM 838 CA ASN A 57 69.623 -10.209 -2.803 1.00 0.00 C ATOM 839 C ASN A 57 70.496 -11.172 -1.989 1.00 0.00 C ATOM 840 O ASN A 57 69.998 -11.909 -1.160 1.00 0.00 O ATOM 841 CB ASN A 57 68.408 -10.943 -3.372 1.00 0.00 C ATOM 842 CG ASN A 57 67.133 -10.396 -2.728 1.00 0.00 C ATOM 843 OD1 ASN A 57 66.187 -10.062 -3.413 1.00 0.00 O ATOM 844 ND2 ASN A 57 67.067 -10.289 -1.428 1.00 0.00 N ATOM 0 H ASN A 57 70.615 -8.702 -3.938 1.00 0.00 H new ATOM 0 HA ASN A 57 69.341 -9.404 -2.124 1.00 0.00 H new ATOM 0 HB2 ASN A 57 68.366 -10.814 -4.454 1.00 0.00 H new ATOM 0 HB3 ASN A 57 68.494 -12.013 -3.182 1.00 0.00 H new ATOM 0 HD21 ASN A 57 66.221 -9.925 -0.988 1.00 0.00 H new ATOM 0 HD22 ASN A 57 67.861 -10.569 -0.852 1.00 0.00 H new ATOM 851 N ARG A 58 71.789 -11.181 -2.205 1.00 0.00 N ATOM 852 CA ARG A 58 72.661 -12.114 -1.420 1.00 0.00 C ATOM 853 C ARG A 58 74.074 -12.190 -2.006 1.00 0.00 C ATOM 854 O ARG A 58 75.008 -12.579 -1.333 1.00 0.00 O ATOM 855 CB ARG A 58 71.985 -13.478 -1.542 1.00 0.00 C ATOM 856 CG ARG A 58 71.480 -13.924 -0.169 1.00 0.00 C ATOM 857 CD ARG A 58 70.451 -15.044 -0.343 1.00 0.00 C ATOM 858 NE ARG A 58 70.409 -15.736 0.974 1.00 0.00 N ATOM 859 CZ ARG A 58 71.479 -16.319 1.440 1.00 0.00 C ATOM 860 NH1 ARG A 58 72.018 -17.312 0.786 1.00 0.00 N ATOM 861 NH2 ARG A 58 72.012 -15.910 2.560 1.00 0.00 N ATOM 0 H ARG A 58 72.275 -10.592 -2.881 1.00 0.00 H new ATOM 0 HA ARG A 58 72.767 -11.779 -0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 58 71.155 -13.422 -2.246 1.00 0.00 H new ATOM 0 HB3 ARG A 58 72.689 -14.210 -1.937 1.00 0.00 H new ATOM 0 HG2 ARG A 58 72.313 -14.273 0.441 1.00 0.00 H new ATOM 0 HG3 ARG A 58 71.031 -13.081 0.357 1.00 0.00 H new ATOM 0 HD2 ARG A 58 69.473 -14.644 -0.610 1.00 0.00 H new ATOM 0 HD3 ARG A 58 70.743 -15.728 -1.139 1.00 0.00 H new ATOM 0 HE ARG A 58 69.543 -15.754 1.513 1.00 0.00 H new ATOM 0 HH11 ARG A 58 71.603 -17.632 -0.089 1.00 0.00 H new ATOM 0 HH12 ARG A 58 72.855 -17.768 1.150 1.00 0.00 H new ATOM 0 HH21 ARG A 58 71.592 -15.134 3.071 1.00 0.00 H new ATOM 0 HH22 ARG A 58 72.849 -16.367 2.923 1.00 0.00 H new ATOM 875 N LYS A 59 74.242 -11.852 -3.252 1.00 0.00 N ATOM 876 CA LYS A 59 75.600 -11.945 -3.861 1.00 0.00 C ATOM 877 C LYS A 59 76.395 -10.651 -3.673 1.00 0.00 C ATOM 878 O LYS A 59 77.411 -10.631 -3.008 1.00 0.00 O ATOM 879 CB LYS A 59 75.347 -12.203 -5.347 1.00 0.00 C ATOM 880 CG LYS A 59 76.004 -13.523 -5.756 1.00 0.00 C ATOM 881 CD LYS A 59 74.961 -14.432 -6.408 1.00 0.00 C ATOM 882 CE LYS A 59 74.883 -15.753 -5.639 1.00 0.00 C ATOM 883 NZ LYS A 59 76.256 -16.324 -5.716 1.00 0.00 N ATOM 0 H LYS A 59 73.505 -11.517 -3.873 1.00 0.00 H new ATOM 0 HA LYS A 59 76.192 -12.731 -3.393 1.00 0.00 H new ATOM 0 HB2 LYS A 59 74.275 -12.242 -5.543 1.00 0.00 H new ATOM 0 HB3 LYS A 59 75.750 -11.384 -5.943 1.00 0.00 H new ATOM 0 HG2 LYS A 59 76.822 -13.334 -6.451 1.00 0.00 H new ATOM 0 HG3 LYS A 59 76.434 -14.013 -4.883 1.00 0.00 H new ATOM 0 HD2 LYS A 59 73.987 -13.942 -6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 59 75.226 -14.620 -7.448 1.00 0.00 H new ATOM 0 HE2 LYS A 59 74.580 -15.590 -4.605 1.00 0.00 H new ATOM 0 HE3 LYS A 59 74.150 -16.426 -6.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 76.197 -17.356 -5.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 76.758 -15.913 -6.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 76.774 -16.102 -4.842 1.00 0.00 H new ATOM 897 N PHE A 60 75.960 -9.577 -4.267 1.00 0.00 N ATOM 898 CA PHE A 60 76.719 -8.296 -4.132 1.00 0.00 C ATOM 899 C PHE A 60 76.018 -7.355 -3.148 1.00 0.00 C ATOM 900 O PHE A 60 75.390 -7.787 -2.205 1.00 0.00 O ATOM 901 CB PHE A 60 76.745 -7.684 -5.538 1.00 0.00 C ATOM 902 CG PHE A 60 76.889 -8.772 -6.579 1.00 0.00 C ATOM 903 CD1 PHE A 60 77.690 -9.890 -6.318 1.00 0.00 C ATOM 904 CD2 PHE A 60 76.220 -8.661 -7.804 1.00 0.00 C ATOM 905 CE1 PHE A 60 77.823 -10.897 -7.282 1.00 0.00 C ATOM 906 CE2 PHE A 60 76.351 -9.668 -8.768 1.00 0.00 C ATOM 907 CZ PHE A 60 77.153 -10.785 -8.507 1.00 0.00 C ATOM 0 H PHE A 60 75.117 -9.526 -4.838 1.00 0.00 H new ATOM 0 HA PHE A 60 77.725 -8.462 -3.746 1.00 0.00 H new ATOM 0 HB2 PHE A 60 75.829 -7.121 -5.714 1.00 0.00 H new ATOM 0 HB3 PHE A 60 77.573 -6.980 -5.621 1.00 0.00 H new ATOM 0 HD1 PHE A 60 78.206 -9.976 -5.373 1.00 0.00 H new ATOM 0 HD2 PHE A 60 75.603 -7.798 -8.005 1.00 0.00 H new ATOM 0 HE1 PHE A 60 78.442 -11.759 -7.081 1.00 0.00 H new ATOM 0 HE2 PHE A 60 75.834 -9.583 -9.712 1.00 0.00 H new ATOM 0 HZ PHE A 60 77.255 -11.561 -9.251 1.00 0.00 H new ATOM 917 N GLY A 61 76.128 -6.070 -3.359 1.00 0.00 N ATOM 918 CA GLY A 61 75.469 -5.100 -2.434 1.00 0.00 C ATOM 919 C GLY A 61 75.780 -3.672 -2.883 1.00 0.00 C ATOM 920 O GLY A 61 76.459 -3.453 -3.865 1.00 0.00 O ATOM 0 H GLY A 61 76.645 -5.650 -4.131 1.00 0.00 H new ATOM 0 HA2 GLY A 61 74.391 -5.263 -2.427 1.00 0.00 H new ATOM 0 HA3 GLY A 61 75.822 -5.257 -1.415 1.00 0.00 H new ATOM 924 N TYR A 62 75.279 -2.698 -2.176 1.00 0.00 N ATOM 925 CA TYR A 62 75.536 -1.278 -2.567 1.00 0.00 C ATOM 926 C TYR A 62 75.492 -0.378 -1.339 1.00 0.00 C ATOM 927 O TYR A 62 74.820 -0.665 -0.369 1.00 0.00 O ATOM 928 CB TYR A 62 74.412 -0.939 -3.548 1.00 0.00 C ATOM 929 CG TYR A 62 74.316 0.556 -3.736 1.00 0.00 C ATOM 930 CD1 TYR A 62 75.242 1.223 -4.545 1.00 0.00 C ATOM 931 CD2 TYR A 62 73.289 1.271 -3.110 1.00 0.00 C ATOM 932 CE1 TYR A 62 75.142 2.608 -4.728 1.00 0.00 C ATOM 933 CE2 TYR A 62 73.190 2.656 -3.290 1.00 0.00 C ATOM 934 CZ TYR A 62 74.116 3.324 -4.100 1.00 0.00 C ATOM 935 OH TYR A 62 74.013 4.687 -4.281 1.00 0.00 O ATOM 0 H TYR A 62 74.702 -2.821 -1.344 1.00 0.00 H new ATOM 0 HA TYR A 62 76.519 -1.134 -3.015 1.00 0.00 H new ATOM 0 HB2 TYR A 62 74.599 -1.422 -4.507 1.00 0.00 H new ATOM 0 HB3 TYR A 62 73.464 -1.327 -3.175 1.00 0.00 H new ATOM 0 HD1 TYR A 62 76.034 0.670 -5.028 1.00 0.00 H new ATOM 0 HD2 TYR A 62 72.573 0.755 -2.488 1.00 0.00 H new ATOM 0 HE1 TYR A 62 75.856 3.123 -5.353 1.00 0.00 H new ATOM 0 HE2 TYR A 62 72.400 3.209 -2.804 1.00 0.00 H new ATOM 0 HH TYR A 62 73.073 4.956 -4.215 1.00 0.00 H new ATOM 945 N VAL A 63 76.231 0.697 -1.358 1.00 0.00 N ATOM 946 CA VAL A 63 76.250 1.588 -0.171 1.00 0.00 C ATOM 947 C VAL A 63 76.522 3.042 -0.573 1.00 0.00 C ATOM 948 O VAL A 63 77.134 3.317 -1.585 1.00 0.00 O ATOM 949 CB VAL A 63 77.395 1.050 0.685 1.00 0.00 C ATOM 950 CG1 VAL A 63 77.275 1.614 2.091 1.00 0.00 C ATOM 951 CG2 VAL A 63 77.326 -0.479 0.754 1.00 0.00 C ATOM 0 H VAL A 63 76.817 0.993 -2.139 1.00 0.00 H new ATOM 0 HA VAL A 63 75.294 1.592 0.353 1.00 0.00 H new ATOM 0 HB VAL A 63 78.344 1.348 0.240 1.00 0.00 H new ATOM 0 HG11 VAL A 63 78.090 1.233 2.707 1.00 0.00 H new ATOM 0 HG12 VAL A 63 77.327 2.702 2.052 1.00 0.00 H new ATOM 0 HG13 VAL A 63 76.321 1.312 2.524 1.00 0.00 H new ATOM 0 HG21 VAL A 63 78.146 -0.853 1.366 1.00 0.00 H new ATOM 0 HG22 VAL A 63 76.376 -0.781 1.196 1.00 0.00 H new ATOM 0 HG23 VAL A 63 77.406 -0.893 -0.251 1.00 0.00 H new ATOM 961 N ASP A 64 76.066 3.971 0.225 1.00 0.00 N ATOM 962 CA ASP A 64 76.284 5.409 -0.085 1.00 0.00 C ATOM 963 C ASP A 64 77.026 6.091 1.066 1.00 0.00 C ATOM 964 O ASP A 64 76.730 5.866 2.226 1.00 0.00 O ATOM 965 CB ASP A 64 74.883 5.994 -0.217 1.00 0.00 C ATOM 966 CG ASP A 64 74.011 5.066 -1.065 1.00 0.00 C ATOM 967 OD1 ASP A 64 74.565 4.220 -1.743 1.00 0.00 O ATOM 968 OD2 ASP A 64 72.801 5.219 -1.020 1.00 0.00 O ATOM 0 H ASP A 64 75.548 3.791 1.085 1.00 0.00 H new ATOM 0 HA ASP A 64 76.882 5.550 -0.985 1.00 0.00 H new ATOM 0 HB2 ASP A 64 74.439 6.124 0.770 1.00 0.00 H new ATOM 0 HB3 ASP A 64 74.933 6.981 -0.676 1.00 0.00 H new ATOM 973 N PHE A 65 77.975 6.930 0.755 1.00 0.00 N ATOM 974 CA PHE A 65 78.733 7.638 1.825 1.00 0.00 C ATOM 975 C PHE A 65 78.270 9.092 1.916 1.00 0.00 C ATOM 976 O PHE A 65 77.488 9.555 1.110 1.00 0.00 O ATOM 977 CB PHE A 65 80.196 7.556 1.403 1.00 0.00 C ATOM 978 CG PHE A 65 80.665 6.132 1.552 1.00 0.00 C ATOM 979 CD1 PHE A 65 80.855 5.592 2.829 1.00 0.00 C ATOM 980 CD2 PHE A 65 80.899 5.346 0.418 1.00 0.00 C ATOM 981 CE1 PHE A 65 81.279 4.267 2.973 1.00 0.00 C ATOM 982 CE2 PHE A 65 81.325 4.021 0.561 1.00 0.00 C ATOM 983 CZ PHE A 65 81.514 3.481 1.840 1.00 0.00 C ATOM 0 H PHE A 65 78.259 7.157 -0.198 1.00 0.00 H new ATOM 0 HA PHE A 65 78.578 7.194 2.808 1.00 0.00 H new ATOM 0 HB2 PHE A 65 80.310 7.885 0.370 1.00 0.00 H new ATOM 0 HB3 PHE A 65 80.804 8.220 2.018 1.00 0.00 H new ATOM 0 HD1 PHE A 65 80.674 6.199 3.704 1.00 0.00 H new ATOM 0 HD2 PHE A 65 80.751 5.762 -0.567 1.00 0.00 H new ATOM 0 HE1 PHE A 65 81.425 3.851 3.959 1.00 0.00 H new ATOM 0 HE2 PHE A 65 81.508 3.415 -0.314 1.00 0.00 H new ATOM 0 HZ PHE A 65 81.841 2.458 1.951 1.00 0.00 H new ATOM 993 N GLU A 66 78.725 9.809 2.905 1.00 0.00 N ATOM 994 CA GLU A 66 78.278 11.221 3.051 1.00 0.00 C ATOM 995 C GLU A 66 79.455 12.192 2.922 1.00 0.00 C ATOM 996 O GLU A 66 79.365 13.341 3.307 1.00 0.00 O ATOM 997 CB GLU A 66 77.656 11.288 4.451 1.00 0.00 C ATOM 998 CG GLU A 66 78.737 11.547 5.504 1.00 0.00 C ATOM 999 CD GLU A 66 78.747 13.031 5.872 1.00 0.00 C ATOM 1000 OE1 GLU A 66 78.041 13.786 5.226 1.00 0.00 O ATOM 1001 OE2 GLU A 66 79.462 13.387 6.795 1.00 0.00 O ATOM 0 H GLU A 66 79.382 9.481 3.613 1.00 0.00 H new ATOM 0 HA GLU A 66 77.571 11.510 2.273 1.00 0.00 H new ATOM 0 HB2 GLU A 66 76.908 12.080 4.486 1.00 0.00 H new ATOM 0 HB3 GLU A 66 77.141 10.353 4.672 1.00 0.00 H new ATOM 0 HG2 GLU A 66 78.547 10.943 6.391 1.00 0.00 H new ATOM 0 HG3 GLU A 66 79.713 11.250 5.119 1.00 0.00 H new ATOM 1008 N SER A 67 80.554 11.748 2.385 1.00 0.00 N ATOM 1009 CA SER A 67 81.720 12.673 2.243 1.00 0.00 C ATOM 1010 C SER A 67 82.801 12.104 1.340 1.00 0.00 C ATOM 1011 O SER A 67 82.782 10.954 0.939 1.00 0.00 O ATOM 1012 CB SER A 67 82.291 12.831 3.646 1.00 0.00 C ATOM 1013 OG SER A 67 82.452 11.547 4.235 1.00 0.00 O ATOM 0 H SER A 67 80.700 10.799 2.041 1.00 0.00 H new ATOM 0 HA SER A 67 81.396 13.613 1.797 1.00 0.00 H new ATOM 0 HB2 SER A 67 83.250 13.348 3.605 1.00 0.00 H new ATOM 0 HB3 SER A 67 81.625 13.442 4.255 1.00 0.00 H new ATOM 0 HG SER A 67 81.645 11.315 4.740 1.00 0.00 H new ATOM 1019 N ALA A 68 83.776 12.915 1.071 1.00 0.00 N ATOM 1020 CA ALA A 68 84.925 12.476 0.247 1.00 0.00 C ATOM 1021 C ALA A 68 85.802 11.612 1.127 1.00 0.00 C ATOM 1022 O ALA A 68 86.540 10.758 0.675 1.00 0.00 O ATOM 1023 CB ALA A 68 85.656 13.767 -0.101 1.00 0.00 C ATOM 0 H ALA A 68 83.826 13.881 1.393 1.00 0.00 H new ATOM 0 HA ALA A 68 84.647 11.914 -0.645 1.00 0.00 H new ATOM 0 HB1 ALA A 68 86.527 13.538 -0.714 1.00 0.00 H new ATOM 0 HB2 ALA A 68 84.987 14.426 -0.654 1.00 0.00 H new ATOM 0 HB3 ALA A 68 85.977 14.262 0.816 1.00 0.00 H new ATOM 1029 N GLU A 69 85.705 11.848 2.400 1.00 0.00 N ATOM 1030 CA GLU A 69 86.499 11.079 3.376 1.00 0.00 C ATOM 1031 C GLU A 69 85.880 9.695 3.560 1.00 0.00 C ATOM 1032 O GLU A 69 86.562 8.729 3.847 1.00 0.00 O ATOM 1033 CB GLU A 69 86.397 11.913 4.647 1.00 0.00 C ATOM 1034 CG GLU A 69 87.776 12.026 5.290 1.00 0.00 C ATOM 1035 CD GLU A 69 87.758 11.362 6.668 1.00 0.00 C ATOM 1036 OE1 GLU A 69 86.691 11.290 7.254 1.00 0.00 O ATOM 1037 OE2 GLU A 69 88.811 10.936 7.112 1.00 0.00 O ATOM 0 H GLU A 69 85.096 12.556 2.809 1.00 0.00 H new ATOM 0 HA GLU A 69 87.534 10.912 3.076 1.00 0.00 H new ATOM 0 HB2 GLU A 69 86.010 12.905 4.414 1.00 0.00 H new ATOM 0 HB3 GLU A 69 85.696 11.452 5.343 1.00 0.00 H new ATOM 0 HG2 GLU A 69 88.524 11.550 4.656 1.00 0.00 H new ATOM 0 HG3 GLU A 69 88.059 13.074 5.384 1.00 0.00 H new ATOM 1044 N ASP A 70 84.595 9.578 3.356 1.00 0.00 N ATOM 1045 CA ASP A 70 83.949 8.250 3.480 1.00 0.00 C ATOM 1046 C ASP A 70 84.217 7.493 2.193 1.00 0.00 C ATOM 1047 O ASP A 70 84.329 6.284 2.171 1.00 0.00 O ATOM 1048 CB ASP A 70 82.455 8.531 3.642 1.00 0.00 C ATOM 1049 CG ASP A 70 82.189 9.116 5.028 1.00 0.00 C ATOM 1050 OD1 ASP A 70 82.976 8.854 5.923 1.00 0.00 O ATOM 1051 OD2 ASP A 70 81.201 9.817 5.171 1.00 0.00 O ATOM 0 H ASP A 70 83.970 10.346 3.110 1.00 0.00 H new ATOM 0 HA ASP A 70 84.319 7.660 4.319 1.00 0.00 H new ATOM 0 HB2 ASP A 70 82.120 9.227 2.873 1.00 0.00 H new ATOM 0 HB3 ASP A 70 81.886 7.611 3.509 1.00 0.00 H new ATOM 1056 N LEU A 71 84.339 8.216 1.115 1.00 0.00 N ATOM 1057 CA LEU A 71 84.622 7.562 -0.182 1.00 0.00 C ATOM 1058 C LEU A 71 86.068 7.056 -0.189 1.00 0.00 C ATOM 1059 O LEU A 71 86.364 5.988 -0.687 1.00 0.00 O ATOM 1060 CB LEU A 71 84.422 8.653 -1.235 1.00 0.00 C ATOM 1061 CG LEU A 71 85.077 8.224 -2.547 1.00 0.00 C ATOM 1062 CD1 LEU A 71 84.523 6.864 -2.975 1.00 0.00 C ATOM 1063 CD2 LEU A 71 84.774 9.260 -3.632 1.00 0.00 C ATOM 0 H LEU A 71 84.254 9.232 1.081 1.00 0.00 H new ATOM 0 HA LEU A 71 83.976 6.705 -0.372 1.00 0.00 H new ATOM 0 HB2 LEU A 71 83.358 8.833 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 71 84.857 9.591 -0.889 1.00 0.00 H new ATOM 0 HG LEU A 71 86.155 8.149 -2.405 1.00 0.00 H new ATOM 0 HD11 LEU A 71 84.991 6.559 -3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 71 84.738 6.124 -2.204 1.00 0.00 H new ATOM 0 HD13 LEU A 71 83.445 6.938 -3.116 1.00 0.00 H new ATOM 0 HD21 LEU A 71 85.241 8.954 -4.568 1.00 0.00 H new ATOM 0 HD22 LEU A 71 83.696 9.335 -3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 71 85.169 10.230 -3.329 1.00 0.00 H new ATOM 1075 N GLU A 72 86.966 7.818 0.377 1.00 0.00 N ATOM 1076 CA GLU A 72 88.393 7.389 0.420 1.00 0.00 C ATOM 1077 C GLU A 72 88.552 6.232 1.408 1.00 0.00 C ATOM 1078 O GLU A 72 89.377 5.355 1.231 1.00 0.00 O ATOM 1079 CB GLU A 72 89.165 8.619 0.899 1.00 0.00 C ATOM 1080 CG GLU A 72 90.559 8.198 1.369 1.00 0.00 C ATOM 1081 CD GLU A 72 91.422 9.442 1.583 1.00 0.00 C ATOM 1082 OE1 GLU A 72 90.857 10.504 1.787 1.00 0.00 O ATOM 1083 OE2 GLU A 72 92.635 9.312 1.539 1.00 0.00 O ATOM 0 H GLU A 72 86.772 8.720 0.812 1.00 0.00 H new ATOM 0 HA GLU A 72 88.755 7.040 -0.547 1.00 0.00 H new ATOM 0 HB2 GLU A 72 89.247 9.347 0.092 1.00 0.00 H new ATOM 0 HB3 GLU A 72 88.627 9.105 1.713 1.00 0.00 H new ATOM 0 HG2 GLU A 72 90.486 7.629 2.296 1.00 0.00 H new ATOM 0 HG3 GLU A 72 91.022 7.544 0.630 1.00 0.00 H new ATOM 1090 N LYS A 73 87.743 6.203 2.433 1.00 0.00 N ATOM 1091 CA LYS A 73 87.828 5.091 3.407 1.00 0.00 C ATOM 1092 C LYS A 73 87.024 3.935 2.845 1.00 0.00 C ATOM 1093 O LYS A 73 87.291 2.779 3.106 1.00 0.00 O ATOM 1094 CB LYS A 73 87.198 5.623 4.695 1.00 0.00 C ATOM 1095 CG LYS A 73 87.897 6.919 5.110 1.00 0.00 C ATOM 1096 CD LYS A 73 88.949 6.612 6.178 1.00 0.00 C ATOM 1097 CE LYS A 73 89.741 7.883 6.494 1.00 0.00 C ATOM 1098 NZ LYS A 73 90.797 7.450 7.451 1.00 0.00 N ATOM 0 H LYS A 73 87.029 6.904 2.633 1.00 0.00 H new ATOM 0 HA LYS A 73 88.845 4.749 3.597 1.00 0.00 H new ATOM 0 HB2 LYS A 73 86.134 5.804 4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 73 87.285 4.881 5.488 1.00 0.00 H new ATOM 0 HG2 LYS A 73 88.368 7.384 4.244 1.00 0.00 H new ATOM 0 HG3 LYS A 73 87.167 7.630 5.497 1.00 0.00 H new ATOM 0 HD2 LYS A 73 88.467 6.237 7.081 1.00 0.00 H new ATOM 0 HD3 LYS A 73 89.622 5.829 5.827 1.00 0.00 H new ATOM 0 HE2 LYS A 73 90.177 8.311 5.591 1.00 0.00 H new ATOM 0 HE3 LYS A 73 89.101 8.649 6.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 91.383 8.268 7.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 90.352 7.053 8.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 91.395 6.726 7.004 1.00 0.00 H new ATOM 1112 N ALA A 74 86.046 4.252 2.041 1.00 0.00 N ATOM 1113 CA ALA A 74 85.228 3.188 1.424 1.00 0.00 C ATOM 1114 C ALA A 74 86.115 2.387 0.476 1.00 0.00 C ATOM 1115 O ALA A 74 85.935 1.202 0.281 1.00 0.00 O ATOM 1116 CB ALA A 74 84.128 3.918 0.655 1.00 0.00 C ATOM 0 H ALA A 74 85.783 5.205 1.789 1.00 0.00 H new ATOM 0 HA ALA A 74 84.801 2.496 2.151 1.00 0.00 H new ATOM 0 HB1 ALA A 74 83.479 3.190 0.169 1.00 0.00 H new ATOM 0 HB2 ALA A 74 83.541 4.523 1.346 1.00 0.00 H new ATOM 0 HB3 ALA A 74 84.578 4.563 -0.099 1.00 0.00 H new ATOM 1122 N LEU A 75 87.088 3.039 -0.101 1.00 0.00 N ATOM 1123 CA LEU A 75 88.015 2.343 -1.025 1.00 0.00 C ATOM 1124 C LEU A 75 89.030 1.544 -0.212 1.00 0.00 C ATOM 1125 O LEU A 75 89.320 0.402 -0.507 1.00 0.00 O ATOM 1126 CB LEU A 75 88.703 3.470 -1.791 1.00 0.00 C ATOM 1127 CG LEU A 75 89.175 2.957 -3.146 1.00 0.00 C ATOM 1128 CD1 LEU A 75 90.277 1.916 -2.940 1.00 0.00 C ATOM 1129 CD2 LEU A 75 87.998 2.320 -3.887 1.00 0.00 C ATOM 0 H LEU A 75 87.278 4.032 0.032 1.00 0.00 H new ATOM 0 HA LEU A 75 87.514 1.643 -1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 75 88.014 4.304 -1.927 1.00 0.00 H new ATOM 0 HB3 LEU A 75 89.551 3.847 -1.219 1.00 0.00 H new ATOM 0 HG LEU A 75 89.567 3.787 -3.735 1.00 0.00 H new ATOM 0 HD11 LEU A 75 90.616 1.548 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 75 91.114 2.372 -2.412 1.00 0.00 H new ATOM 0 HD13 LEU A 75 89.887 1.085 -2.352 1.00 0.00 H new ATOM 0 HD21 LEU A 75 88.334 1.953 -4.857 1.00 0.00 H new ATOM 0 HD22 LEU A 75 87.605 1.489 -3.300 1.00 0.00 H new ATOM 0 HD23 LEU A 75 87.214 3.064 -4.033 1.00 0.00 H new ATOM 1141 N GLU A 76 89.564 2.135 0.822 1.00 0.00 N ATOM 1142 CA GLU A 76 90.550 1.405 1.664 1.00 0.00 C ATOM 1143 C GLU A 76 89.820 0.375 2.528 1.00 0.00 C ATOM 1144 O GLU A 76 90.398 -0.588 2.991 1.00 0.00 O ATOM 1145 CB GLU A 76 91.199 2.474 2.538 1.00 0.00 C ATOM 1146 CG GLU A 76 92.677 2.608 2.171 1.00 0.00 C ATOM 1147 CD GLU A 76 93.532 1.910 3.230 1.00 0.00 C ATOM 1148 OE1 GLU A 76 92.981 1.126 3.984 1.00 0.00 O ATOM 1149 OE2 GLU A 76 94.723 2.171 3.269 1.00 0.00 O ATOM 0 H GLU A 76 89.360 3.089 1.118 1.00 0.00 H new ATOM 0 HA GLU A 76 91.291 0.868 1.071 1.00 0.00 H new ATOM 0 HB2 GLU A 76 90.691 3.429 2.400 1.00 0.00 H new ATOM 0 HB3 GLU A 76 91.098 2.209 3.590 1.00 0.00 H new ATOM 0 HG2 GLU A 76 92.861 2.167 1.191 1.00 0.00 H new ATOM 0 HG3 GLU A 76 92.952 3.661 2.103 1.00 0.00 H new ATOM 1156 N LEU A 77 88.548 0.573 2.740 1.00 0.00 N ATOM 1157 CA LEU A 77 87.764 -0.389 3.566 1.00 0.00 C ATOM 1158 C LEU A 77 87.549 -1.689 2.797 1.00 0.00 C ATOM 1159 O LEU A 77 87.008 -2.649 3.309 1.00 0.00 O ATOM 1160 CB LEU A 77 86.433 0.306 3.806 1.00 0.00 C ATOM 1161 CG LEU A 77 86.523 1.115 5.089 1.00 0.00 C ATOM 1162 CD1 LEU A 77 85.599 2.326 4.982 1.00 0.00 C ATOM 1163 CD2 LEU A 77 86.098 0.234 6.262 1.00 0.00 C ATOM 0 H LEU A 77 88.016 1.363 2.375 1.00 0.00 H new ATOM 0 HA LEU A 77 88.270 -0.648 4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 77 86.191 0.957 2.966 1.00 0.00 H new ATOM 0 HB3 LEU A 77 85.632 -0.429 3.880 1.00 0.00 H new ATOM 0 HG LEU A 77 87.545 1.458 5.248 1.00 0.00 H new ATOM 0 HD11 LEU A 77 85.659 2.911 5.900 1.00 0.00 H new ATOM 0 HD12 LEU A 77 85.905 2.943 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 77 84.573 1.989 4.833 1.00 0.00 H new ATOM 0 HD21 LEU A 77 86.159 0.806 7.188 1.00 0.00 H new ATOM 0 HD22 LEU A 77 85.072 -0.103 6.111 1.00 0.00 H new ATOM 0 HD23 LEU A 77 86.758 -0.631 6.326 1.00 0.00 H new ATOM 1175 N THR A 78 87.970 -1.719 1.568 1.00 0.00 N ATOM 1176 CA THR A 78 87.798 -2.951 0.744 1.00 0.00 C ATOM 1177 C THR A 78 88.738 -4.060 1.216 1.00 0.00 C ATOM 1178 O THR A 78 88.776 -5.138 0.658 1.00 0.00 O ATOM 1179 CB THR A 78 88.136 -2.528 -0.686 1.00 0.00 C ATOM 1180 OG1 THR A 78 87.354 -1.394 -1.039 1.00 0.00 O ATOM 1181 CG2 THR A 78 87.835 -3.679 -1.646 1.00 0.00 C ATOM 0 H THR A 78 88.429 -0.942 1.093 1.00 0.00 H new ATOM 0 HA THR A 78 86.787 -3.351 0.823 1.00 0.00 H new ATOM 0 HB THR A 78 89.194 -2.274 -0.750 1.00 0.00 H new ATOM 0 HG1 THR A 78 87.869 -0.577 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 78 88.076 -3.376 -2.665 1.00 0.00 H new ATOM 0 HG22 THR A 78 88.436 -4.547 -1.374 1.00 0.00 H new ATOM 0 HG23 THR A 78 86.778 -3.936 -1.585 1.00 0.00 H new ATOM 1189 N GLY A 79 89.483 -3.805 2.245 1.00 0.00 N ATOM 1190 CA GLY A 79 90.414 -4.840 2.773 1.00 0.00 C ATOM 1191 C GLY A 79 89.780 -5.516 3.992 1.00 0.00 C ATOM 1192 O GLY A 79 90.334 -6.436 4.562 1.00 0.00 O ATOM 0 H GLY A 79 89.491 -2.919 2.750 1.00 0.00 H new ATOM 0 HA2 GLY A 79 90.628 -5.581 2.002 1.00 0.00 H new ATOM 0 HA3 GLY A 79 91.365 -4.384 3.049 1.00 0.00 H new ATOM 1196 N LEU A 80 88.622 -5.065 4.398 1.00 0.00 N ATOM 1197 CA LEU A 80 87.952 -5.678 5.579 1.00 0.00 C ATOM 1198 C LEU A 80 87.023 -6.807 5.136 1.00 0.00 C ATOM 1199 O LEU A 80 86.281 -6.678 4.184 1.00 0.00 O ATOM 1200 CB LEU A 80 87.154 -4.540 6.208 1.00 0.00 C ATOM 1201 CG LEU A 80 88.007 -3.846 7.271 1.00 0.00 C ATOM 1202 CD1 LEU A 80 87.998 -2.335 7.028 1.00 0.00 C ATOM 1203 CD2 LEU A 80 87.433 -4.143 8.659 1.00 0.00 C ATOM 0 H LEU A 80 88.112 -4.297 3.961 1.00 0.00 H new ATOM 0 HA LEU A 80 88.664 -6.115 6.279 1.00 0.00 H new ATOM 0 HB2 LEU A 80 86.855 -3.824 5.442 1.00 0.00 H new ATOM 0 HB3 LEU A 80 86.239 -4.928 6.656 1.00 0.00 H new ATOM 0 HG LEU A 80 89.031 -4.216 7.213 1.00 0.00 H new ATOM 0 HD11 LEU A 80 88.606 -1.841 7.786 1.00 0.00 H new ATOM 0 HD12 LEU A 80 88.407 -2.123 6.040 1.00 0.00 H new ATOM 0 HD13 LEU A 80 86.975 -1.963 7.085 1.00 0.00 H new ATOM 0 HD21 LEU A 80 88.040 -3.649 9.417 1.00 0.00 H new ATOM 0 HD22 LEU A 80 86.409 -3.773 8.716 1.00 0.00 H new ATOM 0 HD23 LEU A 80 87.440 -5.219 8.833 1.00 0.00 H new ATOM 1215 N LYS A 81 87.062 -7.913 5.825 1.00 0.00 N ATOM 1216 CA LYS A 81 86.187 -9.064 5.456 1.00 0.00 C ATOM 1217 C LYS A 81 84.859 -8.971 6.169 1.00 0.00 C ATOM 1218 O LYS A 81 84.588 -9.677 7.120 1.00 0.00 O ATOM 1219 CB LYS A 81 86.909 -10.279 5.945 1.00 0.00 C ATOM 1220 CG LYS A 81 87.587 -10.992 4.778 1.00 0.00 C ATOM 1221 CD LYS A 81 89.004 -11.402 5.183 1.00 0.00 C ATOM 1222 CE LYS A 81 90.017 -10.461 4.526 1.00 0.00 C ATOM 1223 NZ LYS A 81 90.705 -11.293 3.501 1.00 0.00 N ATOM 0 H LYS A 81 87.665 -8.071 6.632 1.00 0.00 H new ATOM 0 HA LYS A 81 85.993 -9.085 4.384 1.00 0.00 H new ATOM 0 HB2 LYS A 81 87.653 -9.994 6.689 1.00 0.00 H new ATOM 0 HB3 LYS A 81 86.209 -10.954 6.436 1.00 0.00 H new ATOM 0 HG2 LYS A 81 87.011 -11.872 4.491 1.00 0.00 H new ATOM 0 HG3 LYS A 81 87.622 -10.336 3.908 1.00 0.00 H new ATOM 0 HD2 LYS A 81 89.108 -11.365 6.267 1.00 0.00 H new ATOM 0 HD3 LYS A 81 89.197 -12.431 4.879 1.00 0.00 H new ATOM 0 HE2 LYS A 81 89.522 -9.603 4.071 1.00 0.00 H new ATOM 0 HE3 LYS A 81 90.725 -10.070 5.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 91.416 -10.717 3.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 91.173 -12.098 3.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 90.007 -11.646 2.815 1.00 0.00 H new ATOM 1237 N VAL A 82 84.042 -8.115 5.701 1.00 0.00 N ATOM 1238 CA VAL A 82 82.696 -7.948 6.318 1.00 0.00 C ATOM 1239 C VAL A 82 82.107 -9.333 6.615 1.00 0.00 C ATOM 1240 O VAL A 82 82.086 -10.203 5.767 1.00 0.00 O ATOM 1241 CB VAL A 82 81.864 -7.197 5.274 1.00 0.00 C ATOM 1242 CG1 VAL A 82 80.374 -7.466 5.500 1.00 0.00 C ATOM 1243 CG2 VAL A 82 82.134 -5.698 5.407 1.00 0.00 C ATOM 0 H VAL A 82 84.232 -7.505 4.906 1.00 0.00 H new ATOM 0 HA VAL A 82 82.721 -7.400 7.260 1.00 0.00 H new ATOM 0 HB VAL A 82 82.140 -7.539 4.277 1.00 0.00 H new ATOM 0 HG11 VAL A 82 79.790 -6.928 4.753 1.00 0.00 H new ATOM 0 HG12 VAL A 82 80.180 -8.535 5.412 1.00 0.00 H new ATOM 0 HG13 VAL A 82 80.090 -7.127 6.496 1.00 0.00 H new ATOM 0 HG21 VAL A 82 81.546 -5.155 4.667 1.00 0.00 H new ATOM 0 HG22 VAL A 82 81.856 -5.365 6.407 1.00 0.00 H new ATOM 0 HG23 VAL A 82 83.194 -5.503 5.242 1.00 0.00 H new ATOM 1253 N PHE A 83 81.647 -9.548 7.817 1.00 0.00 N ATOM 1254 CA PHE A 83 81.082 -10.881 8.174 1.00 0.00 C ATOM 1255 C PHE A 83 82.006 -12.004 7.688 1.00 0.00 C ATOM 1256 O PHE A 83 81.580 -13.126 7.495 1.00 0.00 O ATOM 1257 CB PHE A 83 79.732 -10.948 7.463 1.00 0.00 C ATOM 1258 CG PHE A 83 78.632 -10.973 8.495 1.00 0.00 C ATOM 1259 CD1 PHE A 83 78.261 -12.183 9.093 1.00 0.00 C ATOM 1260 CD2 PHE A 83 77.986 -9.786 8.859 1.00 0.00 C ATOM 1261 CE1 PHE A 83 77.245 -12.207 10.054 1.00 0.00 C ATOM 1262 CE2 PHE A 83 76.968 -9.810 9.821 1.00 0.00 C ATOM 1263 CZ PHE A 83 76.598 -11.020 10.419 1.00 0.00 C ATOM 0 H PHE A 83 81.638 -8.858 8.568 1.00 0.00 H new ATOM 0 HA PHE A 83 80.979 -11.005 9.252 1.00 0.00 H new ATOM 0 HB2 PHE A 83 79.611 -10.088 6.805 1.00 0.00 H new ATOM 0 HB3 PHE A 83 79.681 -11.839 6.837 1.00 0.00 H new ATOM 0 HD1 PHE A 83 78.760 -13.099 8.812 1.00 0.00 H new ATOM 0 HD2 PHE A 83 78.272 -8.852 8.398 1.00 0.00 H new ATOM 0 HE1 PHE A 83 76.959 -13.141 10.515 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.468 -8.894 10.101 1.00 0.00 H new ATOM 0 HZ PHE A 83 75.814 -11.038 11.162 1.00 0.00 H new ATOM 1273 N GLY A 84 83.267 -11.717 7.489 1.00 0.00 N ATOM 1274 CA GLY A 84 84.206 -12.775 7.019 1.00 0.00 C ATOM 1275 C GLY A 84 84.285 -12.738 5.494 1.00 0.00 C ATOM 1276 O GLY A 84 84.720 -13.680 4.861 1.00 0.00 O ATOM 0 H GLY A 84 83.685 -10.797 7.632 1.00 0.00 H new ATOM 0 HA2 GLY A 84 85.195 -12.617 7.450 1.00 0.00 H new ATOM 0 HA3 GLY A 84 83.865 -13.755 7.353 1.00 0.00 H new ATOM 1280 N ASN A 85 83.865 -11.656 4.900 1.00 0.00 N ATOM 1281 CA ASN A 85 83.913 -11.555 3.415 1.00 0.00 C ATOM 1282 C ASN A 85 84.494 -10.201 3.000 1.00 0.00 C ATOM 1283 O ASN A 85 83.875 -9.171 3.177 1.00 0.00 O ATOM 1284 CB ASN A 85 82.456 -11.674 2.963 1.00 0.00 C ATOM 1285 CG ASN A 85 81.773 -12.812 3.724 1.00 0.00 C ATOM 1286 OD1 ASN A 85 81.365 -12.610 4.947 1.00 0.00 O flip ATOM 1287 ND2 ASN A 85 81.611 -13.897 3.200 1.00 0.00 N flip ATOM 0 H ASN A 85 83.490 -10.837 5.379 1.00 0.00 H new ATOM 0 HA ASN A 85 84.542 -12.324 2.967 1.00 0.00 H new ATOM 0 HB2 ASN A 85 81.931 -10.736 3.144 1.00 0.00 H new ATOM 0 HB3 ASN A 85 82.412 -11.863 1.890 1.00 0.00 H new ATOM 0 HD21 ASN A 85 81.930 -14.054 2.244 1.00 0.00 H new ATOM 0 HD22 ASN A 85 81.156 -14.650 3.716 1.00 0.00 H new ATOM 1294 N GLU A 86 85.679 -10.195 2.452 1.00 0.00 N ATOM 1295 CA GLU A 86 86.300 -8.907 2.024 1.00 0.00 C ATOM 1296 C GLU A 86 85.398 -8.199 1.017 1.00 0.00 C ATOM 1297 O GLU A 86 85.599 -8.273 -0.179 1.00 0.00 O ATOM 1298 CB GLU A 86 87.624 -9.304 1.383 1.00 0.00 C ATOM 1299 CG GLU A 86 88.273 -8.076 0.739 1.00 0.00 C ATOM 1300 CD GLU A 86 89.534 -8.502 -0.015 1.00 0.00 C ATOM 1301 OE1 GLU A 86 90.493 -8.879 0.638 1.00 0.00 O ATOM 1302 OE2 GLU A 86 89.520 -8.443 -1.234 1.00 0.00 O ATOM 0 H GLU A 86 86.245 -11.026 2.282 1.00 0.00 H new ATOM 0 HA GLU A 86 86.445 -8.217 2.855 1.00 0.00 H new ATOM 0 HB2 GLU A 86 88.290 -9.728 2.134 1.00 0.00 H new ATOM 0 HB3 GLU A 86 87.459 -10.076 0.632 1.00 0.00 H new ATOM 0 HG2 GLU A 86 87.572 -7.597 0.055 1.00 0.00 H new ATOM 0 HG3 GLU A 86 88.524 -7.341 1.504 1.00 0.00 H new ATOM 1309 N ILE A 87 84.399 -7.516 1.497 1.00 0.00 N ATOM 1310 CA ILE A 87 83.472 -6.802 0.574 1.00 0.00 C ATOM 1311 C ILE A 87 84.260 -6.079 -0.519 1.00 0.00 C ATOM 1312 O ILE A 87 85.118 -5.263 -0.245 1.00 0.00 O ATOM 1313 CB ILE A 87 82.725 -5.793 1.444 1.00 0.00 C ATOM 1314 CG1 ILE A 87 83.706 -5.118 2.408 1.00 0.00 C ATOM 1315 CG2 ILE A 87 81.637 -6.515 2.240 1.00 0.00 C ATOM 1316 CD1 ILE A 87 83.206 -3.712 2.743 1.00 0.00 C ATOM 0 H ILE A 87 84.183 -7.420 2.489 1.00 0.00 H new ATOM 0 HA ILE A 87 82.790 -7.490 0.075 1.00 0.00 H new ATOM 0 HB ILE A 87 82.267 -5.035 0.809 1.00 0.00 H new ATOM 0 HG12 ILE A 87 83.801 -5.708 3.319 1.00 0.00 H new ATOM 0 HG13 ILE A 87 84.697 -5.065 1.957 1.00 0.00 H new ATOM 0 HG21 ILE A 87 81.103 -5.796 2.861 1.00 0.00 H new ATOM 0 HG22 ILE A 87 80.938 -6.990 1.552 1.00 0.00 H new ATOM 0 HG23 ILE A 87 82.094 -7.274 2.875 1.00 0.00 H new ATOM 0 HD11 ILE A 87 83.904 -3.232 3.429 1.00 0.00 H new ATOM 0 HD12 ILE A 87 83.134 -3.124 1.828 1.00 0.00 H new ATOM 0 HD13 ILE A 87 82.224 -3.777 3.211 1.00 0.00 H new ATOM 1328 N LYS A 88 83.970 -6.364 -1.758 1.00 0.00 N ATOM 1329 CA LYS A 88 84.696 -5.684 -2.868 1.00 0.00 C ATOM 1330 C LYS A 88 83.771 -4.664 -3.532 1.00 0.00 C ATOM 1331 O LYS A 88 82.635 -4.955 -3.837 1.00 0.00 O ATOM 1332 CB LYS A 88 85.063 -6.790 -3.858 1.00 0.00 C ATOM 1333 CG LYS A 88 85.610 -8.008 -3.107 1.00 0.00 C ATOM 1334 CD LYS A 88 85.587 -9.228 -4.031 1.00 0.00 C ATOM 1335 CE LYS A 88 87.021 -9.682 -4.316 1.00 0.00 C ATOM 1336 NZ LYS A 88 87.492 -8.807 -5.426 1.00 0.00 N ATOM 0 H LYS A 88 83.262 -7.038 -2.050 1.00 0.00 H new ATOM 0 HA LYS A 88 85.581 -5.152 -2.518 1.00 0.00 H new ATOM 0 HB2 LYS A 88 84.186 -7.075 -4.439 1.00 0.00 H new ATOM 0 HB3 LYS A 88 85.808 -6.424 -4.565 1.00 0.00 H new ATOM 0 HG2 LYS A 88 86.628 -7.813 -2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 88 85.010 -8.200 -2.218 1.00 0.00 H new ATOM 0 HD2 LYS A 88 85.024 -10.038 -3.567 1.00 0.00 H new ATOM 0 HD3 LYS A 88 85.081 -8.981 -4.964 1.00 0.00 H new ATOM 0 HE2 LYS A 88 87.652 -9.573 -3.434 1.00 0.00 H new ATOM 0 HE3 LYS A 88 87.052 -10.733 -4.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 88.469 -9.060 -5.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 86.878 -8.937 -6.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 87.458 -7.813 -5.122 1.00 0.00 H new ATOM 1350 N LEU A 89 84.238 -3.473 -3.755 1.00 0.00 N ATOM 1351 CA LEU A 89 83.368 -2.457 -4.389 1.00 0.00 C ATOM 1352 C LEU A 89 83.980 -1.933 -5.685 1.00 0.00 C ATOM 1353 O LEU A 89 85.049 -2.337 -6.097 1.00 0.00 O ATOM 1354 CB LEU A 89 83.219 -1.332 -3.357 1.00 0.00 C ATOM 1355 CG LEU A 89 84.556 -0.965 -2.689 1.00 0.00 C ATOM 1356 CD1 LEU A 89 84.924 -2.012 -1.636 1.00 0.00 C ATOM 1357 CD2 LEU A 89 85.669 -0.856 -3.739 1.00 0.00 C ATOM 0 H LEU A 89 85.182 -3.161 -3.526 1.00 0.00 H new ATOM 0 HA LEU A 89 82.401 -2.880 -4.662 1.00 0.00 H new ATOM 0 HB2 LEU A 89 82.805 -0.449 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 89 82.506 -1.638 -2.591 1.00 0.00 H new ATOM 0 HG LEU A 89 84.445 0.003 -2.200 1.00 0.00 H new ATOM 0 HD11 LEU A 89 85.872 -1.742 -1.170 1.00 0.00 H new ATOM 0 HD12 LEU A 89 84.144 -2.053 -0.875 1.00 0.00 H new ATOM 0 HD13 LEU A 89 85.019 -2.988 -2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 89 86.607 -0.596 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 89 85.780 -1.811 -4.252 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.411 -0.083 -4.463 1.00 0.00 H new ATOM 1369 N GLU A 90 83.290 -1.043 -6.336 1.00 0.00 N ATOM 1370 CA GLU A 90 83.800 -0.485 -7.617 1.00 0.00 C ATOM 1371 C GLU A 90 82.835 0.593 -8.130 1.00 0.00 C ATOM 1372 O GLU A 90 81.643 0.530 -7.903 1.00 0.00 O ATOM 1373 CB GLU A 90 83.850 -1.690 -8.565 1.00 0.00 C ATOM 1374 CG GLU A 90 83.707 -1.227 -10.015 1.00 0.00 C ATOM 1375 CD GLU A 90 84.711 -1.975 -10.894 1.00 0.00 C ATOM 1376 OE1 GLU A 90 85.880 -1.630 -10.848 1.00 0.00 O ATOM 1377 OE2 GLU A 90 84.294 -2.881 -11.597 1.00 0.00 O ATOM 0 H GLU A 90 82.388 -0.675 -6.034 1.00 0.00 H new ATOM 0 HA GLU A 90 84.776 -0.009 -7.522 1.00 0.00 H new ATOM 0 HB2 GLU A 90 84.792 -2.224 -8.437 1.00 0.00 H new ATOM 0 HB3 GLU A 90 83.051 -2.389 -8.318 1.00 0.00 H new ATOM 0 HG2 GLU A 90 82.692 -1.411 -10.368 1.00 0.00 H new ATOM 0 HG3 GLU A 90 83.878 -0.153 -10.083 1.00 0.00 H new ATOM 1384 N LYS A 91 83.342 1.581 -8.816 1.00 0.00 N ATOM 1385 CA LYS A 91 82.452 2.659 -9.338 1.00 0.00 C ATOM 1386 C LYS A 91 81.390 2.066 -10.270 1.00 0.00 C ATOM 1387 O LYS A 91 81.705 1.578 -11.338 1.00 0.00 O ATOM 1388 CB LYS A 91 83.380 3.597 -10.109 1.00 0.00 C ATOM 1389 CG LYS A 91 83.578 4.888 -9.311 1.00 0.00 C ATOM 1390 CD LYS A 91 84.316 5.914 -10.172 1.00 0.00 C ATOM 1391 CE LYS A 91 85.225 6.768 -9.284 1.00 0.00 C ATOM 1392 NZ LYS A 91 86.549 6.088 -9.323 1.00 0.00 N ATOM 0 H LYS A 91 84.332 1.689 -9.038 1.00 0.00 H new ATOM 0 HA LYS A 91 81.919 3.177 -8.541 1.00 0.00 H new ATOM 0 HB2 LYS A 91 84.341 3.113 -10.283 1.00 0.00 H new ATOM 0 HB3 LYS A 91 82.955 3.823 -11.087 1.00 0.00 H new ATOM 0 HG2 LYS A 91 82.613 5.287 -8.999 1.00 0.00 H new ATOM 0 HG3 LYS A 91 84.146 4.683 -8.404 1.00 0.00 H new ATOM 0 HD2 LYS A 91 84.907 5.407 -10.934 1.00 0.00 H new ATOM 0 HD3 LYS A 91 83.600 6.549 -10.694 1.00 0.00 H new ATOM 0 HE2 LYS A 91 85.295 7.790 -9.657 1.00 0.00 H new ATOM 0 HE3 LYS A 91 84.841 6.826 -8.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 87.227 6.615 -8.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 86.453 5.120 -8.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 86.893 6.054 -10.304 1.00 0.00 H new ATOM 1406 N PRO A 92 80.162 2.131 -9.831 1.00 0.00 N ATOM 1407 CA PRO A 92 79.036 1.593 -10.634 1.00 0.00 C ATOM 1408 C PRO A 92 78.747 2.508 -11.829 1.00 0.00 C ATOM 1409 O PRO A 92 79.459 3.460 -12.080 1.00 0.00 O ATOM 1410 CB PRO A 92 77.866 1.593 -9.655 1.00 0.00 C ATOM 1411 CG PRO A 92 78.206 2.642 -8.644 1.00 0.00 C ATOM 1412 CD PRO A 92 79.710 2.703 -8.558 1.00 0.00 C ATOM 0 HA PRO A 92 79.238 0.606 -11.049 1.00 0.00 H new ATOM 0 HB2 PRO A 92 76.928 1.822 -10.161 1.00 0.00 H new ATOM 0 HB3 PRO A 92 77.745 0.617 -9.185 1.00 0.00 H new ATOM 0 HG2 PRO A 92 77.797 3.608 -8.939 1.00 0.00 H new ATOM 0 HG3 PRO A 92 77.774 2.396 -7.674 1.00 0.00 H new ATOM 0 HD2 PRO A 92 80.061 3.727 -8.434 1.00 0.00 H new ATOM 0 HD3 PRO A 92 80.085 2.132 -7.708 1.00 0.00 H new ATOM 1420 N LYS A 93 77.708 2.227 -12.566 1.00 0.00 N ATOM 1421 CA LYS A 93 77.374 3.080 -13.742 1.00 0.00 C ATOM 1422 C LYS A 93 78.646 3.428 -14.520 1.00 0.00 C ATOM 1423 O LYS A 93 79.169 4.520 -14.417 1.00 0.00 O ATOM 1424 CB LYS A 93 76.744 4.342 -13.151 1.00 0.00 C ATOM 1425 CG LYS A 93 75.580 4.796 -14.035 1.00 0.00 C ATOM 1426 CD LYS A 93 74.330 4.988 -13.175 1.00 0.00 C ATOM 1427 CE LYS A 93 73.117 5.217 -14.080 1.00 0.00 C ATOM 1428 NZ LYS A 93 72.091 5.839 -13.197 1.00 0.00 N ATOM 0 H LYS A 93 77.075 1.443 -12.405 1.00 0.00 H new ATOM 0 HA LYS A 93 76.703 2.578 -14.439 1.00 0.00 H new ATOM 0 HB2 LYS A 93 76.390 4.145 -12.139 1.00 0.00 H new ATOM 0 HB3 LYS A 93 77.490 5.134 -13.079 1.00 0.00 H new ATOM 0 HG2 LYS A 93 75.834 5.729 -14.539 1.00 0.00 H new ATOM 0 HG3 LYS A 93 75.389 4.056 -14.812 1.00 0.00 H new ATOM 0 HD2 LYS A 93 74.169 4.111 -12.548 1.00 0.00 H new ATOM 0 HD3 LYS A 93 74.463 5.838 -12.506 1.00 0.00 H new ATOM 0 HE2 LYS A 93 73.366 5.870 -14.917 1.00 0.00 H new ATOM 0 HE3 LYS A 93 72.757 4.279 -14.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 71.228 6.027 -13.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 71.869 5.192 -12.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 72.459 6.733 -12.814 1.00 0.00 H new ATOM 1442 N GLY A 94 79.147 2.509 -15.299 1.00 0.00 N ATOM 1443 CA GLY A 94 80.384 2.789 -16.080 1.00 0.00 C ATOM 1444 C GLY A 94 80.165 2.403 -17.545 1.00 0.00 C ATOM 1445 O GLY A 94 81.082 2.409 -18.341 1.00 0.00 O ATOM 0 H GLY A 94 78.753 1.577 -15.428 1.00 0.00 H new ATOM 0 HA2 GLY A 94 80.641 3.846 -16.006 1.00 0.00 H new ATOM 0 HA3 GLY A 94 81.222 2.227 -15.667 1.00 0.00 H new ATOM 1449 N ARG A 95 78.956 2.067 -17.906 1.00 0.00 N ATOM 1450 CA ARG A 95 78.682 1.682 -19.320 1.00 0.00 C ATOM 1451 C ARG A 95 77.750 2.703 -19.976 1.00 0.00 C ATOM 1452 O ARG A 95 76.698 2.364 -20.481 1.00 0.00 O ATOM 1453 CB ARG A 95 78.004 0.314 -19.234 1.00 0.00 C ATOM 1454 CG ARG A 95 77.526 -0.106 -20.626 1.00 0.00 C ATOM 1455 CD ARG A 95 77.690 -1.619 -20.787 1.00 0.00 C ATOM 1456 NE ARG A 95 76.986 -1.948 -22.057 1.00 0.00 N ATOM 1457 CZ ARG A 95 76.845 -3.193 -22.422 1.00 0.00 C ATOM 1458 NH1 ARG A 95 76.830 -4.139 -21.523 1.00 0.00 N ATOM 1459 NH2 ARG A 95 76.718 -3.492 -23.686 1.00 0.00 N ATOM 0 H ARG A 95 78.148 2.042 -17.284 1.00 0.00 H new ATOM 0 HA ARG A 95 79.590 1.650 -19.922 1.00 0.00 H new ATOM 0 HB2 ARG A 95 78.701 -0.425 -18.839 1.00 0.00 H new ATOM 0 HB3 ARG A 95 77.160 0.357 -18.545 1.00 0.00 H new ATOM 0 HG2 ARG A 95 76.482 0.174 -20.763 1.00 0.00 H new ATOM 0 HG3 ARG A 95 78.099 0.416 -21.392 1.00 0.00 H new ATOM 0 HD2 ARG A 95 78.742 -1.899 -20.835 1.00 0.00 H new ATOM 0 HD3 ARG A 95 77.255 -2.155 -19.944 1.00 0.00 H new ATOM 0 HE ARG A 95 76.614 -1.200 -22.642 1.00 0.00 H new ATOM 0 HH11 ARG A 95 76.928 -3.905 -20.535 1.00 0.00 H new ATOM 0 HH12 ARG A 95 76.720 -5.112 -21.808 1.00 0.00 H new ATOM 0 HH21 ARG A 95 76.729 -2.753 -24.389 1.00 0.00 H new ATOM 0 HH22 ARG A 95 76.608 -4.465 -23.971 1.00 0.00 H new ATOM 1473 N ASP A 96 78.128 3.953 -19.973 1.00 0.00 N ATOM 1474 CA ASP A 96 77.262 4.994 -20.598 1.00 0.00 C ATOM 1475 C ASP A 96 76.947 4.619 -22.049 1.00 0.00 C ATOM 1476 O ASP A 96 77.691 3.904 -22.691 1.00 0.00 O ATOM 1477 CB ASP A 96 78.088 6.280 -20.545 1.00 0.00 C ATOM 1478 CG ASP A 96 77.692 7.090 -19.309 1.00 0.00 C ATOM 1479 OD1 ASP A 96 76.670 6.776 -18.722 1.00 0.00 O ATOM 1480 OD2 ASP A 96 78.418 8.010 -18.970 1.00 0.00 O ATOM 0 H ASP A 96 78.997 4.298 -19.566 1.00 0.00 H new ATOM 0 HA ASP A 96 76.307 5.100 -20.083 1.00 0.00 H new ATOM 0 HB2 ASP A 96 79.151 6.041 -20.511 1.00 0.00 H new ATOM 0 HB3 ASP A 96 77.922 6.869 -21.447 1.00 0.00 H new ATOM 1485 N GLY A 97 75.849 5.094 -22.570 1.00 0.00 N ATOM 1486 CA GLY A 97 75.488 4.764 -23.978 1.00 0.00 C ATOM 1487 C GLY A 97 74.768 5.954 -24.614 1.00 0.00 C ATOM 1488 O GLY A 97 73.617 5.866 -24.990 1.00 0.00 O ATOM 0 H GLY A 97 75.186 5.696 -22.082 1.00 0.00 H new ATOM 0 HA2 GLY A 97 76.386 4.522 -24.547 1.00 0.00 H new ATOM 0 HA3 GLY A 97 74.847 3.882 -24.003 1.00 0.00 H new ATOM 1492 N THR A 98 75.439 7.066 -24.739 1.00 0.00 N ATOM 1493 CA THR A 98 74.793 8.263 -25.353 1.00 0.00 C ATOM 1494 C THR A 98 73.362 8.419 -24.831 1.00 0.00 C ATOM 1495 O THR A 98 73.031 7.963 -23.755 1.00 0.00 O ATOM 1496 CB THR A 98 74.784 8.004 -26.857 1.00 0.00 C ATOM 1497 OG1 THR A 98 73.658 7.206 -27.196 1.00 0.00 O ATOM 1498 CG2 THR A 98 76.071 7.286 -27.279 1.00 0.00 C ATOM 0 H THR A 98 76.406 7.199 -24.443 1.00 0.00 H new ATOM 0 HA THR A 98 75.328 9.180 -25.107 1.00 0.00 H new ATOM 0 HB THR A 98 74.725 8.958 -27.380 1.00 0.00 H new ATOM 0 HG1 THR A 98 73.497 6.549 -26.487 1.00 0.00 H new ATOM 0 HG21 THR A 98 76.052 7.107 -28.354 1.00 0.00 H new ATOM 0 HG22 THR A 98 76.932 7.906 -27.029 1.00 0.00 H new ATOM 0 HG23 THR A 98 76.145 6.334 -26.754 1.00 0.00 H new ATOM 1506 N ARG A 99 72.512 9.061 -25.585 1.00 0.00 N ATOM 1507 CA ARG A 99 71.104 9.246 -25.130 1.00 0.00 C ATOM 1508 C ARG A 99 70.134 8.927 -26.270 1.00 0.00 C ATOM 1509 O ARG A 99 69.093 9.539 -26.402 1.00 0.00 O ATOM 1510 CB ARG A 99 71.005 10.720 -24.737 1.00 0.00 C ATOM 1511 CG ARG A 99 71.273 11.595 -25.964 1.00 0.00 C ATOM 1512 CD ARG A 99 70.731 13.004 -25.715 1.00 0.00 C ATOM 1513 NE ARG A 99 71.559 13.892 -26.576 1.00 0.00 N ATOM 1514 CZ ARG A 99 71.523 15.186 -26.405 1.00 0.00 C ATOM 1515 NH1 ARG A 99 72.192 15.734 -25.428 1.00 0.00 N ATOM 1516 NH2 ARG A 99 70.818 15.930 -27.213 1.00 0.00 N ATOM 0 H ARG A 99 72.731 9.465 -26.496 1.00 0.00 H new ATOM 0 HA ARG A 99 70.847 8.586 -24.301 1.00 0.00 H new ATOM 0 HB2 ARG A 99 70.015 10.934 -24.334 1.00 0.00 H new ATOM 0 HB3 ARG A 99 71.725 10.947 -23.951 1.00 0.00 H new ATOM 0 HG2 ARG A 99 72.343 11.636 -26.168 1.00 0.00 H new ATOM 0 HG3 ARG A 99 70.798 11.161 -26.844 1.00 0.00 H new ATOM 0 HD2 ARG A 99 69.675 13.073 -25.977 1.00 0.00 H new ATOM 0 HD3 ARG A 99 70.818 13.280 -24.664 1.00 0.00 H new ATOM 0 HE ARG A 99 72.155 13.490 -27.300 1.00 0.00 H new ATOM 0 HH11 ARG A 99 72.743 15.152 -24.798 1.00 0.00 H new ATOM 0 HH12 ARG A 99 72.164 16.745 -25.295 1.00 0.00 H new ATOM 0 HH21 ARG A 99 70.296 15.500 -27.977 1.00 0.00 H new ATOM 0 HH22 ARG A 99 70.789 16.941 -27.081 1.00 0.00 H new ATOM 1530 N GLY A 100 70.467 7.973 -27.096 1.00 0.00 N ATOM 1531 CA GLY A 100 69.563 7.616 -28.226 1.00 0.00 C ATOM 1532 C GLY A 100 70.154 8.139 -29.537 1.00 0.00 C ATOM 1533 O GLY A 100 70.940 9.065 -29.550 1.00 0.00 O ATOM 0 H GLY A 100 71.326 7.426 -27.037 1.00 0.00 H new ATOM 0 HA2 GLY A 100 69.437 6.535 -28.277 1.00 0.00 H new ATOM 0 HA3 GLY A 100 68.574 8.045 -28.064 1.00 0.00 H new ATOM 1537 N CYS A 101 69.779 7.554 -30.642 1.00 0.00 N ATOM 1538 CA CYS A 101 70.320 8.019 -31.952 1.00 0.00 C ATOM 1539 C CYS A 101 69.175 8.451 -32.873 1.00 0.00 C ATOM 1540 O CYS A 101 68.032 8.285 -32.482 1.00 0.00 O ATOM 1541 CB CYS A 101 71.046 6.806 -32.533 1.00 0.00 C ATOM 1542 SG CYS A 101 72.556 6.495 -31.583 1.00 0.00 S ATOM 1543 OXT CYS A 101 69.463 8.940 -33.953 1.00 0.00 O ATOM 0 H CYS A 101 69.122 6.775 -30.695 1.00 0.00 H new ATOM 0 HA CYS A 101 70.983 8.878 -31.844 1.00 0.00 H new ATOM 0 HB2 CYS A 101 70.397 5.931 -32.502 1.00 0.00 H new ATOM 0 HB3 CYS A 101 71.292 6.983 -33.580 1.00 0.00 H new ATOM 0 HG CYS A 101 73.173 5.462 -32.075 1.00 0.00 H new TER 1549 CYS A 101