USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 863 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 29 SER OG : rot -113:sc= 0.771 USER MOD Set 1.2: A 117 SER OG : rot 101:sc= -1.57 USER MOD Set 2.1: A 52 GLN : amide:sc= -3.81 X(o=-4.5,f=-4.2) USER MOD Set 2.2: A 96 GLN : amide:sc= -0.667 K(o=-4.5,f=-7.4!) USER MOD Set 3.1: A 90 GLN : amide:sc= -0.648! X(o=-3.5!,f=-3.6) USER MOD Set 3.2: A 111 ASN : amide:sc= -2.89! C(o=-3.5!,f=-8.9!) USER MOD Set 4.1: A 28 THR OG1 : rot 153:sc= -2.3! USER MOD Set 4.2: A 31 SER OG : rot 180:sc= 0.0147 USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0189 (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 48:sc= 0.255 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.338 USER MOD Single : A 20 MET CE :methyl -166:sc= -0.0558 (180deg=-0.354) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.0284 X(o=-0.028,f=-0.069) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 GLN : amide:sc= -0.0136 X(o=-0.014,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0245 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.472 X(o=-0.47,f=-0.34) USER MOD Single : A 45 ASN : amide:sc= -6.67! C(o=-6.7!,f=-13!) USER MOD Single : A 51 TYR OH : rot 60:sc= -2.25 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 59 SER OG : rot 133:sc= 0.329 USER MOD Single : A 62 SER OG : rot -78:sc= 1.27 USER MOD Single : A 63 ASN : amide:sc= -0.0486 K(o=-0.049,f=-0.82) USER MOD Single : A 65 GLN : amide:sc= -0.0277 X(o=-0.028,f=-0.15) USER MOD Single : A 66 TYR OH : rot 144:sc= -0.0997 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -172:sc= -2.48 (180deg=-2.79!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 108:sc= -0.23 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.0518 K(o=-0.052,f=-0.57) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 30:sc= -0.602 USER MOD Single : A 99 ASN : amide:sc= -1.97 K(o=-2,f=-12!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0.00518 USER MOD Single : A 107 SER OG : rot 90:sc= -2.72! USER MOD Single : A 108 SER OG : rot -64:sc= 0.15 USER MOD Single : A 113 THR OG1 : rot 180:sc=-0.00141 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.194 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 35.708 15.148 12.123 1.00 0.00 N ATOM 2 CA GLY A 1 36.480 15.217 10.894 1.00 0.00 C ATOM 3 C GLY A 1 35.592 15.604 9.710 1.00 0.00 C ATOM 4 O GLY A 1 34.682 16.419 9.852 1.00 0.00 O ATOM 0 H1 GLY A 1 36.195 15.684 12.869 1.00 0.00 H new ATOM 0 H2 GLY A 1 34.764 15.555 11.964 1.00 0.00 H new ATOM 0 H3 GLY A 1 35.611 14.155 12.417 1.00 0.00 H new ATOM 0 HA2 GLY A 1 37.283 15.946 11.005 1.00 0.00 H new ATOM 0 HA3 GLY A 1 36.950 14.253 10.701 1.00 0.00 H new ATOM 8 N SER A 2 35.887 15.000 8.568 1.00 0.00 N ATOM 9 CA SER A 2 35.126 15.271 7.360 1.00 0.00 C ATOM 10 C SER A 2 35.340 16.721 6.921 1.00 0.00 C ATOM 11 O SER A 2 35.702 17.572 7.732 1.00 0.00 O ATOM 12 CB SER A 2 33.636 14.995 7.573 1.00 0.00 C ATOM 13 OG SER A 2 33.257 13.710 7.090 1.00 0.00 O ATOM 0 H SER A 2 36.642 14.324 8.454 1.00 0.00 H new ATOM 0 HA SER A 2 35.482 14.604 6.575 1.00 0.00 H new ATOM 0 HB2 SER A 2 33.402 15.066 8.635 1.00 0.00 H new ATOM 0 HB3 SER A 2 33.049 15.761 7.065 1.00 0.00 H new ATOM 0 HG SER A 2 32.299 13.571 7.246 1.00 0.00 H new ATOM 19 N SER A 3 35.108 16.958 5.638 1.00 0.00 N ATOM 20 CA SER A 3 35.270 18.291 5.082 1.00 0.00 C ATOM 21 C SER A 3 34.813 18.307 3.622 1.00 0.00 C ATOM 22 O SER A 3 34.614 17.255 3.018 1.00 0.00 O ATOM 23 CB SER A 3 36.723 18.758 5.189 1.00 0.00 C ATOM 24 OG SER A 3 37.592 17.996 4.355 1.00 0.00 O ATOM 0 H SER A 3 34.809 16.250 4.968 1.00 0.00 H new ATOM 0 HA SER A 3 34.652 18.980 5.657 1.00 0.00 H new ATOM 0 HB2 SER A 3 36.787 19.811 4.913 1.00 0.00 H new ATOM 0 HB3 SER A 3 37.054 18.679 6.225 1.00 0.00 H new ATOM 0 HG SER A 3 38.510 18.326 4.451 1.00 0.00 H new ATOM 30 N GLY A 4 34.660 19.514 3.097 1.00 0.00 N ATOM 31 CA GLY A 4 34.230 19.682 1.719 1.00 0.00 C ATOM 32 C GLY A 4 32.819 20.269 1.653 1.00 0.00 C ATOM 33 O GLY A 4 31.921 19.819 2.364 1.00 0.00 O ATOM 0 H GLY A 4 34.826 20.385 3.601 1.00 0.00 H new ATOM 0 HA2 GLY A 4 34.925 20.337 1.195 1.00 0.00 H new ATOM 0 HA3 GLY A 4 34.252 18.720 1.208 1.00 0.00 H new ATOM 37 N SER A 5 32.666 21.265 0.793 1.00 0.00 N ATOM 38 CA SER A 5 31.379 21.918 0.625 1.00 0.00 C ATOM 39 C SER A 5 30.427 21.006 -0.151 1.00 0.00 C ATOM 40 O SER A 5 30.279 21.145 -1.364 1.00 0.00 O ATOM 41 CB SER A 5 31.532 23.260 -0.094 1.00 0.00 C ATOM 42 OG SER A 5 30.821 24.303 0.566 1.00 0.00 O ATOM 0 H SER A 5 33.412 21.636 0.205 1.00 0.00 H new ATOM 0 HA SER A 5 30.962 22.111 1.613 1.00 0.00 H new ATOM 0 HB2 SER A 5 32.588 23.522 -0.152 1.00 0.00 H new ATOM 0 HB3 SER A 5 31.170 23.166 -1.118 1.00 0.00 H new ATOM 0 HG SER A 5 30.945 25.143 0.077 1.00 0.00 H new ATOM 48 N SER A 6 29.806 20.093 0.581 1.00 0.00 N ATOM 49 CA SER A 6 28.872 19.158 -0.023 1.00 0.00 C ATOM 50 C SER A 6 28.054 18.458 1.065 1.00 0.00 C ATOM 51 O SER A 6 28.423 18.486 2.238 1.00 0.00 O ATOM 52 CB SER A 6 29.604 18.126 -0.883 1.00 0.00 C ATOM 53 OG SER A 6 29.523 18.433 -2.272 1.00 0.00 O ATOM 0 H SER A 6 29.931 19.981 1.587 1.00 0.00 H new ATOM 0 HA SER A 6 28.198 19.719 -0.671 1.00 0.00 H new ATOM 0 HB2 SER A 6 30.651 18.081 -0.582 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.178 17.138 -0.705 1.00 0.00 H new ATOM 0 HG SER A 6 29.750 19.376 -2.412 1.00 0.00 H new ATOM 59 N GLY A 7 26.959 17.848 0.637 1.00 0.00 N ATOM 60 CA GLY A 7 26.086 17.143 1.559 1.00 0.00 C ATOM 61 C GLY A 7 26.819 15.976 2.224 1.00 0.00 C ATOM 62 O GLY A 7 27.875 15.554 1.755 1.00 0.00 O ATOM 0 H GLY A 7 26.656 17.827 -0.337 1.00 0.00 H new ATOM 0 HA2 GLY A 7 25.724 17.832 2.322 1.00 0.00 H new ATOM 0 HA3 GLY A 7 25.211 16.771 1.025 1.00 0.00 H new ATOM 66 N ILE A 8 26.229 15.487 3.305 1.00 0.00 N ATOM 67 CA ILE A 8 26.812 14.376 4.038 1.00 0.00 C ATOM 68 C ILE A 8 26.202 13.065 3.540 1.00 0.00 C ATOM 69 O ILE A 8 25.954 12.153 4.327 1.00 0.00 O ATOM 70 CB ILE A 8 26.661 14.591 5.545 1.00 0.00 C ATOM 71 CG1 ILE A 8 25.189 14.740 5.933 1.00 0.00 C ATOM 72 CG2 ILE A 8 27.501 15.781 6.016 1.00 0.00 C ATOM 73 CD1 ILE A 8 24.972 14.388 7.407 1.00 0.00 C ATOM 0 H ILE A 8 25.353 15.840 3.691 1.00 0.00 H new ATOM 0 HA ILE A 8 27.885 14.319 3.853 1.00 0.00 H new ATOM 0 HB ILE A 8 27.041 13.706 6.056 1.00 0.00 H new ATOM 0 HG12 ILE A 8 24.862 15.763 5.748 1.00 0.00 H new ATOM 0 HG13 ILE A 8 24.577 14.091 5.307 1.00 0.00 H new ATOM 0 HG21 ILE A 8 27.376 15.912 7.091 1.00 0.00 H new ATOM 0 HG22 ILE A 8 28.552 15.596 5.793 1.00 0.00 H new ATOM 0 HG23 ILE A 8 27.174 16.684 5.500 1.00 0.00 H new ATOM 0 HD11 ILE A 8 23.917 14.502 7.657 1.00 0.00 H new ATOM 0 HD12 ILE A 8 25.277 13.357 7.583 1.00 0.00 H new ATOM 0 HD13 ILE A 8 25.567 15.054 8.032 1.00 0.00 H new ATOM 85 N SER A 9 25.977 13.012 2.235 1.00 0.00 N ATOM 86 CA SER A 9 25.401 11.827 1.623 1.00 0.00 C ATOM 87 C SER A 9 23.973 11.617 2.131 1.00 0.00 C ATOM 88 O SER A 9 23.517 10.482 2.263 1.00 0.00 O ATOM 89 CB SER A 9 26.253 10.589 1.909 1.00 0.00 C ATOM 90 OG SER A 9 26.164 9.626 0.862 1.00 0.00 O ATOM 0 H SER A 9 26.183 13.771 1.585 1.00 0.00 H new ATOM 0 HA SER A 9 25.378 11.977 0.544 1.00 0.00 H new ATOM 0 HB2 SER A 9 27.293 10.887 2.040 1.00 0.00 H new ATOM 0 HB3 SER A 9 25.931 10.136 2.847 1.00 0.00 H new ATOM 0 HG SER A 9 26.723 8.852 1.081 1.00 0.00 H new ATOM 96 N THR A 10 23.306 12.730 2.403 1.00 0.00 N ATOM 97 CA THR A 10 21.940 12.682 2.894 1.00 0.00 C ATOM 98 C THR A 10 21.001 13.412 1.931 1.00 0.00 C ATOM 99 O THR A 10 21.214 13.396 0.719 1.00 0.00 O ATOM 100 CB THR A 10 21.926 13.259 4.311 1.00 0.00 C ATOM 101 OG1 THR A 10 20.645 12.897 4.820 1.00 0.00 O ATOM 102 CG2 THR A 10 21.912 14.789 4.319 1.00 0.00 C ATOM 0 H THR A 10 23.687 13.670 2.292 1.00 0.00 H new ATOM 0 HA THR A 10 21.573 11.657 2.942 1.00 0.00 H new ATOM 0 HB THR A 10 22.798 12.901 4.858 1.00 0.00 H new ATOM 0 HG1 THR A 10 20.551 13.230 5.737 1.00 0.00 H new ATOM 0 HG21 THR A 10 21.902 15.147 5.348 1.00 0.00 H new ATOM 0 HG22 THR A 10 22.802 15.164 3.813 1.00 0.00 H new ATOM 0 HG23 THR A 10 21.022 15.147 3.802 1.00 0.00 H new ATOM 110 N GLU A 11 19.983 14.035 2.506 1.00 0.00 N ATOM 111 CA GLU A 11 19.012 14.770 1.714 1.00 0.00 C ATOM 112 C GLU A 11 18.603 13.955 0.485 1.00 0.00 C ATOM 113 O GLU A 11 19.205 14.085 -0.579 1.00 0.00 O ATOM 114 CB GLU A 11 19.560 16.139 1.306 1.00 0.00 C ATOM 115 CG GLU A 11 19.071 17.231 2.259 1.00 0.00 C ATOM 116 CD GLU A 11 19.387 18.623 1.707 1.00 0.00 C ATOM 117 OE1 GLU A 11 18.743 18.995 0.703 1.00 0.00 O ATOM 118 OE2 GLU A 11 20.267 19.282 2.302 1.00 0.00 O ATOM 0 H GLU A 11 19.810 14.046 3.511 1.00 0.00 H new ATOM 0 HA GLU A 11 18.126 14.938 2.326 1.00 0.00 H new ATOM 0 HB2 GLU A 11 20.650 16.113 1.305 1.00 0.00 H new ATOM 0 HB3 GLU A 11 19.246 16.372 0.289 1.00 0.00 H new ATOM 0 HG2 GLU A 11 17.996 17.132 2.411 1.00 0.00 H new ATOM 0 HG3 GLU A 11 19.543 17.106 3.233 1.00 0.00 H new ATOM 125 N GLU A 12 17.582 13.131 0.673 1.00 0.00 N ATOM 126 CA GLU A 12 17.086 12.295 -0.406 1.00 0.00 C ATOM 127 C GLU A 12 15.879 12.955 -1.077 1.00 0.00 C ATOM 128 O GLU A 12 15.445 14.029 -0.664 1.00 0.00 O ATOM 129 CB GLU A 12 16.734 10.895 0.102 1.00 0.00 C ATOM 130 CG GLU A 12 17.997 10.069 0.350 1.00 0.00 C ATOM 131 CD GLU A 12 18.736 10.557 1.598 1.00 0.00 C ATOM 132 OE1 GLU A 12 18.114 10.506 2.681 1.00 0.00 O ATOM 133 OE2 GLU A 12 19.905 10.970 1.440 1.00 0.00 O ATOM 0 H GLU A 12 17.085 13.025 1.557 1.00 0.00 H new ATOM 0 HA GLU A 12 17.876 12.188 -1.149 1.00 0.00 H new ATOM 0 HB2 GLU A 12 16.159 10.973 1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 12 16.101 10.388 -0.626 1.00 0.00 H new ATOM 0 HG2 GLU A 12 17.731 9.018 0.468 1.00 0.00 H new ATOM 0 HG3 GLU A 12 18.655 10.136 -0.516 1.00 0.00 H new ATOM 140 N ALA A 13 15.371 12.283 -2.100 1.00 0.00 N ATOM 141 CA ALA A 13 14.223 12.791 -2.832 1.00 0.00 C ATOM 142 C ALA A 13 13.137 11.714 -2.879 1.00 0.00 C ATOM 143 O ALA A 13 13.439 10.522 -2.853 1.00 0.00 O ATOM 144 CB ALA A 13 14.663 13.236 -4.228 1.00 0.00 C ATOM 0 H ALA A 13 15.733 11.392 -2.439 1.00 0.00 H new ATOM 0 HA ALA A 13 13.803 13.662 -2.330 1.00 0.00 H new ATOM 0 HB1 ALA A 13 13.802 13.617 -4.777 1.00 0.00 H new ATOM 0 HB2 ALA A 13 15.413 14.022 -4.140 1.00 0.00 H new ATOM 0 HB3 ALA A 13 15.088 12.387 -4.763 1.00 0.00 H new ATOM 150 N ALA A 14 11.896 12.173 -2.947 1.00 0.00 N ATOM 151 CA ALA A 14 10.764 11.264 -2.998 1.00 0.00 C ATOM 152 C ALA A 14 10.964 10.270 -4.144 1.00 0.00 C ATOM 153 O ALA A 14 11.747 10.522 -5.059 1.00 0.00 O ATOM 154 CB ALA A 14 9.470 12.067 -3.142 1.00 0.00 C ATOM 0 H ALA A 14 11.650 13.163 -2.968 1.00 0.00 H new ATOM 0 HA ALA A 14 10.691 10.691 -2.074 1.00 0.00 H new ATOM 0 HB1 ALA A 14 8.621 11.385 -3.180 1.00 0.00 H new ATOM 0 HB2 ALA A 14 9.360 12.736 -2.288 1.00 0.00 H new ATOM 0 HB3 ALA A 14 9.506 12.653 -4.060 1.00 0.00 H new ATOM 160 N PRO A 15 10.223 9.133 -4.056 1.00 0.00 N ATOM 161 CA PRO A 15 10.312 8.101 -5.075 1.00 0.00 C ATOM 162 C PRO A 15 9.575 8.523 -6.348 1.00 0.00 C ATOM 163 O PRO A 15 8.611 9.284 -6.288 1.00 0.00 O ATOM 164 CB PRO A 15 9.718 6.859 -4.429 1.00 0.00 C ATOM 165 CG PRO A 15 8.900 7.354 -3.247 1.00 0.00 C ATOM 166 CD PRO A 15 9.285 8.801 -2.987 1.00 0.00 C ATOM 0 HA PRO A 15 11.336 7.915 -5.398 1.00 0.00 H new ATOM 0 HB2 PRO A 15 9.093 6.313 -5.135 1.00 0.00 H new ATOM 0 HB3 PRO A 15 10.502 6.176 -4.103 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.834 7.275 -3.461 1.00 0.00 H new ATOM 0 HG3 PRO A 15 9.094 6.743 -2.366 1.00 0.00 H new ATOM 0 HD2 PRO A 15 8.412 9.453 -3.010 1.00 0.00 H new ATOM 0 HD3 PRO A 15 9.745 8.918 -2.006 1.00 0.00 H new ATOM 174 N ASP A 16 10.058 8.010 -7.470 1.00 0.00 N ATOM 175 CA ASP A 16 9.458 8.324 -8.755 1.00 0.00 C ATOM 176 C ASP A 16 9.025 7.027 -9.442 1.00 0.00 C ATOM 177 O ASP A 16 9.227 6.859 -10.643 1.00 0.00 O ATOM 178 CB ASP A 16 10.457 9.033 -9.671 1.00 0.00 C ATOM 179 CG ASP A 16 10.632 10.529 -9.402 1.00 0.00 C ATOM 180 OD1 ASP A 16 11.501 10.857 -8.566 1.00 0.00 O ATOM 181 OD2 ASP A 16 9.893 11.310 -10.039 1.00 0.00 O ATOM 0 H ASP A 16 10.858 7.379 -7.516 1.00 0.00 H new ATOM 0 HA ASP A 16 8.604 8.978 -8.577 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.427 8.546 -9.572 1.00 0.00 H new ATOM 0 HB3 ASP A 16 10.137 8.900 -10.704 1.00 0.00 H new ATOM 186 N GLY A 17 8.438 6.142 -8.649 1.00 0.00 N ATOM 187 CA GLY A 17 7.976 4.865 -9.165 1.00 0.00 C ATOM 188 C GLY A 17 7.328 4.029 -8.059 1.00 0.00 C ATOM 189 O GLY A 17 7.855 3.942 -6.952 1.00 0.00 O ATOM 0 H GLY A 17 8.272 6.285 -7.653 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.258 5.031 -9.968 1.00 0.00 H new ATOM 0 HA3 GLY A 17 8.815 4.318 -9.596 1.00 0.00 H new ATOM 193 N PRO A 18 6.163 3.420 -8.408 1.00 0.00 N ATOM 194 CA PRO A 18 5.437 2.594 -7.458 1.00 0.00 C ATOM 195 C PRO A 18 6.127 1.242 -7.267 1.00 0.00 C ATOM 196 O PRO A 18 7.063 0.911 -7.993 1.00 0.00 O ATOM 197 CB PRO A 18 4.036 2.470 -8.035 1.00 0.00 C ATOM 198 CG PRO A 18 4.156 2.837 -9.505 1.00 0.00 C ATOM 199 CD PRO A 18 5.508 3.501 -9.710 1.00 0.00 C ATOM 0 HA PRO A 18 5.405 3.030 -6.460 1.00 0.00 H new ATOM 0 HB2 PRO A 18 3.653 1.457 -7.916 1.00 0.00 H new ATOM 0 HB3 PRO A 18 3.342 3.136 -7.522 1.00 0.00 H new ATOM 0 HG2 PRO A 18 4.069 1.948 -10.129 1.00 0.00 H new ATOM 0 HG3 PRO A 18 3.351 3.511 -9.797 1.00 0.00 H new ATOM 0 HD2 PRO A 18 6.088 2.989 -10.477 1.00 0.00 H new ATOM 0 HD3 PRO A 18 5.396 4.536 -10.033 1.00 0.00 H new ATOM 207 N PRO A 19 5.625 0.477 -6.261 1.00 0.00 N ATOM 208 CA PRO A 19 6.184 -0.831 -5.966 1.00 0.00 C ATOM 209 C PRO A 19 5.750 -1.861 -7.011 1.00 0.00 C ATOM 210 O PRO A 19 4.808 -1.625 -7.767 1.00 0.00 O ATOM 211 CB PRO A 19 5.692 -1.162 -4.566 1.00 0.00 C ATOM 212 CG PRO A 19 4.505 -0.246 -4.314 1.00 0.00 C ATOM 213 CD PRO A 19 4.517 0.837 -5.381 1.00 0.00 C ATOM 0 HA PRO A 19 7.273 -0.841 -6.004 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.400 -2.209 -4.492 1.00 0.00 H new ATOM 0 HB3 PRO A 19 6.476 -0.997 -3.827 1.00 0.00 H new ATOM 0 HG2 PRO A 19 3.573 -0.810 -4.353 1.00 0.00 H new ATOM 0 HG3 PRO A 19 4.569 0.197 -3.320 1.00 0.00 H new ATOM 0 HD2 PRO A 19 3.573 0.868 -5.925 1.00 0.00 H new ATOM 0 HD3 PRO A 19 4.664 1.824 -4.942 1.00 0.00 H new ATOM 221 N MET A 20 6.457 -2.981 -7.021 1.00 0.00 N ATOM 222 CA MET A 20 6.157 -4.048 -7.961 1.00 0.00 C ATOM 223 C MET A 20 5.499 -5.234 -7.252 1.00 0.00 C ATOM 224 O MET A 20 5.418 -5.262 -6.025 1.00 0.00 O ATOM 225 CB MET A 20 7.448 -4.510 -8.638 1.00 0.00 C ATOM 226 CG MET A 20 8.312 -3.314 -9.046 1.00 0.00 C ATOM 227 SD MET A 20 7.311 -2.095 -9.882 1.00 0.00 S ATOM 228 CE MET A 20 7.338 -2.757 -11.540 1.00 0.00 C ATOM 0 H MET A 20 7.237 -3.173 -6.393 1.00 0.00 H new ATOM 0 HA MET A 20 5.462 -3.664 -8.708 1.00 0.00 H new ATOM 0 HB2 MET A 20 8.008 -5.153 -7.960 1.00 0.00 H new ATOM 0 HB3 MET A 20 7.208 -5.107 -9.518 1.00 0.00 H new ATOM 0 HG2 MET A 20 8.776 -2.873 -8.164 1.00 0.00 H new ATOM 0 HG3 MET A 20 9.119 -3.644 -9.700 1.00 0.00 H new ATOM 0 HE1 MET A 20 6.977 -2.002 -12.239 1.00 0.00 H new ATOM 0 HE2 MET A 20 8.358 -3.037 -11.803 1.00 0.00 H new ATOM 0 HE3 MET A 20 6.695 -3.636 -11.591 1.00 0.00 H new ATOM 238 N ASP A 21 5.047 -6.185 -8.056 1.00 0.00 N ATOM 239 CA ASP A 21 4.399 -7.371 -7.522 1.00 0.00 C ATOM 240 C ASP A 21 3.237 -6.950 -6.620 1.00 0.00 C ATOM 241 O ASP A 21 2.973 -7.588 -5.602 1.00 0.00 O ATOM 242 CB ASP A 21 5.373 -8.199 -6.681 1.00 0.00 C ATOM 243 CG ASP A 21 4.941 -9.645 -6.428 1.00 0.00 C ATOM 244 OD1 ASP A 21 3.875 -9.817 -5.799 1.00 0.00 O ATOM 245 OD2 ASP A 21 5.687 -10.546 -6.870 1.00 0.00 O ATOM 0 H ASP A 21 5.117 -6.158 -9.073 1.00 0.00 H new ATOM 0 HA ASP A 21 4.047 -7.970 -8.362 1.00 0.00 H new ATOM 0 HB2 ASP A 21 6.343 -8.207 -7.178 1.00 0.00 H new ATOM 0 HB3 ASP A 21 5.512 -7.704 -5.720 1.00 0.00 H new ATOM 250 N VAL A 22 2.574 -5.877 -7.026 1.00 0.00 N ATOM 251 CA VAL A 22 1.446 -5.363 -6.268 1.00 0.00 C ATOM 252 C VAL A 22 0.199 -6.186 -6.596 1.00 0.00 C ATOM 253 O VAL A 22 -0.312 -6.128 -7.713 1.00 0.00 O ATOM 254 CB VAL A 22 1.266 -3.869 -6.545 1.00 0.00 C ATOM 255 CG1 VAL A 22 0.123 -3.290 -5.709 1.00 0.00 C ATOM 256 CG2 VAL A 22 2.569 -3.105 -6.298 1.00 0.00 C ATOM 0 H VAL A 22 2.796 -5.349 -7.870 1.00 0.00 H new ATOM 0 HA VAL A 22 1.629 -5.462 -5.198 1.00 0.00 H new ATOM 0 HB VAL A 22 1.004 -3.752 -7.596 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.016 -2.227 -5.925 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.805 -3.805 -5.956 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.342 -3.425 -4.650 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.414 -2.046 -6.502 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.875 -3.234 -5.260 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.347 -3.491 -6.956 1.00 0.00 H new ATOM 266 N THR A 23 -0.256 -6.934 -5.601 1.00 0.00 N ATOM 267 CA THR A 23 -1.434 -7.768 -5.769 1.00 0.00 C ATOM 268 C THR A 23 -2.146 -7.961 -4.429 1.00 0.00 C ATOM 269 O THR A 23 -1.541 -7.799 -3.371 1.00 0.00 O ATOM 270 CB THR A 23 -0.994 -9.082 -6.419 1.00 0.00 C ATOM 271 OG1 THR A 23 -2.188 -9.599 -7.000 1.00 0.00 O ATOM 272 CG2 THR A 23 -0.593 -10.139 -5.388 1.00 0.00 C ATOM 0 H THR A 23 0.170 -6.980 -4.675 1.00 0.00 H new ATOM 0 HA THR A 23 -2.165 -7.294 -6.424 1.00 0.00 H new ATOM 0 HB THR A 23 -0.156 -8.893 -7.090 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.993 -10.450 -7.445 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.289 -11.051 -5.901 1.00 0.00 H new ATOM 0 HG22 THR A 23 0.238 -9.766 -4.789 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.441 -10.354 -4.738 1.00 0.00 H new ATOM 280 N LEU A 24 -3.423 -8.305 -4.519 1.00 0.00 N ATOM 281 CA LEU A 24 -4.225 -8.522 -3.326 1.00 0.00 C ATOM 282 C LEU A 24 -4.512 -10.017 -3.176 1.00 0.00 C ATOM 283 O LEU A 24 -4.320 -10.788 -4.115 1.00 0.00 O ATOM 284 CB LEU A 24 -5.484 -7.654 -3.362 1.00 0.00 C ATOM 285 CG LEU A 24 -5.264 -6.164 -3.631 1.00 0.00 C ATOM 286 CD1 LEU A 24 -6.598 -5.425 -3.751 1.00 0.00 C ATOM 287 CD2 LEU A 24 -4.358 -5.542 -2.566 1.00 0.00 C ATOM 0 H LEU A 24 -3.922 -8.439 -5.399 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.678 -8.211 -2.436 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.150 -8.047 -4.130 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.001 -7.758 -2.408 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.753 -6.062 -4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.413 -4.368 -3.942 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.175 -5.847 -4.574 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.159 -5.533 -2.822 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.218 -4.483 -2.781 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.819 -5.655 -1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.391 -6.044 -2.573 1.00 0.00 H new ATOM 299 N GLN A 25 -4.969 -10.383 -1.987 1.00 0.00 N ATOM 300 CA GLN A 25 -5.286 -11.772 -1.702 1.00 0.00 C ATOM 301 C GLN A 25 -6.080 -11.878 -0.398 1.00 0.00 C ATOM 302 O GLN A 25 -5.587 -11.506 0.666 1.00 0.00 O ATOM 303 CB GLN A 25 -4.015 -12.622 -1.641 1.00 0.00 C ATOM 304 CG GLN A 25 -4.293 -14.055 -2.098 1.00 0.00 C ATOM 305 CD GLN A 25 -3.302 -14.487 -3.181 1.00 0.00 C ATOM 306 OE1 GLN A 25 -3.052 -13.783 -4.146 1.00 0.00 O ATOM 307 NE2 GLN A 25 -2.753 -15.679 -2.969 1.00 0.00 N ATOM 0 H GLN A 25 -5.127 -9.741 -1.210 1.00 0.00 H new ATOM 0 HA GLN A 25 -5.904 -12.158 -2.513 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -3.245 -12.178 -2.272 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -3.627 -12.630 -0.623 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.224 -14.732 -1.246 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -5.311 -14.127 -2.482 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -3.006 -16.217 -2.140 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.078 -16.056 -3.635 1.00 0.00 H new ATOM 316 N PRO A 26 -7.329 -12.401 -0.527 1.00 0.00 N ATOM 317 CA PRO A 26 -8.196 -12.561 0.628 1.00 0.00 C ATOM 318 C PRO A 26 -7.751 -13.746 1.488 1.00 0.00 C ATOM 319 O PRO A 26 -7.791 -14.891 1.041 1.00 0.00 O ATOM 320 CB PRO A 26 -9.591 -12.737 0.051 1.00 0.00 C ATOM 321 CG PRO A 26 -9.394 -13.133 -1.403 1.00 0.00 C ATOM 322 CD PRO A 26 -7.946 -12.852 -1.771 1.00 0.00 C ATOM 0 HA PRO A 26 -8.163 -11.704 1.301 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -10.144 -13.504 0.593 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -10.166 -11.814 0.130 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -9.626 -14.188 -1.546 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -10.068 -12.568 -2.047 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.454 -13.746 -2.156 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.875 -12.090 -2.547 1.00 0.00 H new ATOM 330 N VAL A 27 -7.336 -13.429 2.706 1.00 0.00 N ATOM 331 CA VAL A 27 -6.884 -14.453 3.632 1.00 0.00 C ATOM 332 C VAL A 27 -8.003 -14.763 4.629 1.00 0.00 C ATOM 333 O VAL A 27 -8.123 -15.893 5.100 1.00 0.00 O ATOM 334 CB VAL A 27 -5.586 -14.010 4.309 1.00 0.00 C ATOM 335 CG1 VAL A 27 -4.379 -14.268 3.405 1.00 0.00 C ATOM 336 CG2 VAL A 27 -5.657 -12.538 4.721 1.00 0.00 C ATOM 0 H VAL A 27 -7.303 -12.478 3.073 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.658 -15.377 3.099 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.460 -14.606 5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.470 -13.944 3.911 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.311 -15.333 3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.495 -13.711 2.475 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.722 -12.249 5.200 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.819 -11.920 3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -6.482 -12.395 5.419 1.00 0.00 H new ATOM 346 N THR A 28 -8.792 -13.740 4.920 1.00 0.00 N ATOM 347 CA THR A 28 -9.897 -13.889 5.852 1.00 0.00 C ATOM 348 C THR A 28 -11.205 -13.425 5.208 1.00 0.00 C ATOM 349 O THR A 28 -11.284 -13.283 3.988 1.00 0.00 O ATOM 350 CB THR A 28 -9.544 -13.125 7.130 1.00 0.00 C ATOM 351 OG1 THR A 28 -9.327 -11.788 6.686 1.00 0.00 O ATOM 352 CG2 THR A 28 -8.194 -13.548 7.711 1.00 0.00 C ATOM 0 H THR A 28 -8.688 -12.804 4.527 1.00 0.00 H new ATOM 0 HA THR A 28 -10.054 -14.935 6.114 1.00 0.00 H new ATOM 0 HB THR A 28 -10.325 -13.282 7.874 1.00 0.00 H new ATOM 0 HG1 THR A 28 -9.519 -11.165 7.418 1.00 0.00 H new ATOM 0 HG21 THR A 28 -7.992 -12.976 8.616 1.00 0.00 H new ATOM 0 HG22 THR A 28 -8.218 -14.611 7.952 1.00 0.00 H new ATOM 0 HG23 THR A 28 -7.408 -13.359 6.980 1.00 0.00 H new ATOM 360 N SER A 29 -12.198 -13.201 6.056 1.00 0.00 N ATOM 361 CA SER A 29 -13.498 -12.755 5.584 1.00 0.00 C ATOM 362 C SER A 29 -13.593 -11.231 5.675 1.00 0.00 C ATOM 363 O SER A 29 -14.389 -10.612 4.969 1.00 0.00 O ATOM 364 CB SER A 29 -14.627 -13.406 6.385 1.00 0.00 C ATOM 365 OG SER A 29 -14.542 -14.829 6.370 1.00 0.00 O ATOM 0 H SER A 29 -12.129 -13.320 7.067 1.00 0.00 H new ATOM 0 HA SER A 29 -13.606 -13.058 4.542 1.00 0.00 H new ATOM 0 HB2 SER A 29 -14.591 -13.052 7.415 1.00 0.00 H new ATOM 0 HB3 SER A 29 -15.588 -13.096 5.974 1.00 0.00 H new ATOM 0 HG SER A 29 -15.304 -15.197 5.877 1.00 0.00 H new ATOM 371 N GLN A 30 -12.772 -10.669 6.549 1.00 0.00 N ATOM 372 CA GLN A 30 -12.753 -9.229 6.741 1.00 0.00 C ATOM 373 C GLN A 30 -11.313 -8.715 6.763 1.00 0.00 C ATOM 374 O GLN A 30 -10.975 -7.836 7.555 1.00 0.00 O ATOM 375 CB GLN A 30 -13.495 -8.837 8.021 1.00 0.00 C ATOM 376 CG GLN A 30 -14.975 -9.212 7.934 1.00 0.00 C ATOM 377 CD GLN A 30 -15.591 -9.342 9.328 1.00 0.00 C ATOM 378 OE1 GLN A 30 -16.273 -8.458 9.819 1.00 0.00 O ATOM 379 NE2 GLN A 30 -15.314 -10.492 9.937 1.00 0.00 N ATOM 0 H GLN A 30 -12.114 -11.185 7.133 1.00 0.00 H new ATOM 0 HA GLN A 30 -13.271 -8.763 5.902 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -13.040 -9.336 8.877 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -13.397 -7.764 8.188 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -15.513 -8.454 7.364 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -15.084 -10.153 7.395 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -14.736 -11.190 9.469 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -15.679 -10.675 10.871 1.00 0.00 H new ATOM 388 N SER A 31 -10.502 -9.284 5.883 1.00 0.00 N ATOM 389 CA SER A 31 -9.105 -8.894 5.791 1.00 0.00 C ATOM 390 C SER A 31 -8.504 -9.405 4.481 1.00 0.00 C ATOM 391 O SER A 31 -8.759 -10.539 4.077 1.00 0.00 O ATOM 392 CB SER A 31 -8.306 -9.423 6.984 1.00 0.00 C ATOM 393 OG SER A 31 -9.152 -9.838 8.052 1.00 0.00 O ATOM 0 H SER A 31 -10.786 -10.012 5.227 1.00 0.00 H new ATOM 0 HA SER A 31 -9.052 -7.805 5.807 1.00 0.00 H new ATOM 0 HB2 SER A 31 -7.689 -10.262 6.663 1.00 0.00 H new ATOM 0 HB3 SER A 31 -7.628 -8.647 7.339 1.00 0.00 H new ATOM 0 HG SER A 31 -8.604 -10.170 8.793 1.00 0.00 H new ATOM 399 N ILE A 32 -7.717 -8.545 3.852 1.00 0.00 N ATOM 400 CA ILE A 32 -7.078 -8.895 2.595 1.00 0.00 C ATOM 401 C ILE A 32 -5.566 -8.698 2.724 1.00 0.00 C ATOM 402 O ILE A 32 -5.112 -7.801 3.432 1.00 0.00 O ATOM 403 CB ILE A 32 -7.703 -8.112 1.439 1.00 0.00 C ATOM 404 CG1 ILE A 32 -9.189 -8.447 1.290 1.00 0.00 C ATOM 405 CG2 ILE A 32 -6.930 -8.343 0.139 1.00 0.00 C ATOM 406 CD1 ILE A 32 -9.845 -7.567 0.224 1.00 0.00 C ATOM 0 H ILE A 32 -7.507 -7.606 4.190 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.245 -9.947 2.364 1.00 0.00 H new ATOM 0 HB ILE A 32 -7.634 -7.049 1.670 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.304 -9.497 1.021 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -9.695 -8.306 2.245 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.395 -7.775 -0.667 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.898 -8.015 0.266 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -6.945 -9.404 -0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.900 -7.825 0.138 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -9.750 -6.519 0.508 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -9.353 -7.729 -0.735 1.00 0.00 H new ATOM 418 N GLN A 33 -4.829 -9.552 2.030 1.00 0.00 N ATOM 419 CA GLN A 33 -3.378 -9.483 2.058 1.00 0.00 C ATOM 420 C GLN A 33 -2.857 -8.745 0.823 1.00 0.00 C ATOM 421 O GLN A 33 -3.305 -9.003 -0.293 1.00 0.00 O ATOM 422 CB GLN A 33 -2.764 -10.881 2.161 1.00 0.00 C ATOM 423 CG GLN A 33 -1.262 -10.802 2.439 1.00 0.00 C ATOM 424 CD GLN A 33 -0.747 -12.109 3.046 1.00 0.00 C ATOM 425 OE1 GLN A 33 -0.974 -13.193 2.534 1.00 0.00 O ATOM 426 NE2 GLN A 33 -0.042 -11.946 4.162 1.00 0.00 N ATOM 0 H GLN A 33 -5.209 -10.296 1.445 1.00 0.00 H new ATOM 0 HA GLN A 33 -3.078 -8.924 2.944 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.256 -11.440 2.957 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -2.937 -11.427 1.234 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -0.728 -10.592 1.513 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -1.057 -9.975 3.119 1.00 0.00 H new ATOM 0 HE21 GLN A 33 0.110 -11.010 4.537 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.346 -12.757 4.643 1.00 0.00 H new ATOM 435 N VAL A 34 -1.918 -7.842 1.065 1.00 0.00 N ATOM 436 CA VAL A 34 -1.332 -7.065 -0.013 1.00 0.00 C ATOM 437 C VAL A 34 0.187 -7.246 0.001 1.00 0.00 C ATOM 438 O VAL A 34 0.859 -6.815 0.936 1.00 0.00 O ATOM 439 CB VAL A 34 -1.760 -5.600 0.104 1.00 0.00 C ATOM 440 CG1 VAL A 34 -1.142 -4.757 -1.013 1.00 0.00 C ATOM 441 CG2 VAL A 34 -3.285 -5.474 0.106 1.00 0.00 C ATOM 0 H VAL A 34 -1.549 -7.631 1.992 1.00 0.00 H new ATOM 0 HA VAL A 34 -1.693 -7.419 -0.978 1.00 0.00 H new ATOM 0 HB VAL A 34 -1.390 -5.218 1.055 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -1.462 -3.721 -0.906 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -0.055 -4.809 -0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.468 -5.140 -1.980 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.563 -4.423 0.190 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.685 -5.882 -0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.695 -6.027 0.952 1.00 0.00 H new ATOM 451 N THR A 35 0.684 -7.885 -1.048 1.00 0.00 N ATOM 452 CA THR A 35 2.112 -8.129 -1.168 1.00 0.00 C ATOM 453 C THR A 35 2.684 -7.365 -2.364 1.00 0.00 C ATOM 454 O THR A 35 2.044 -7.273 -3.410 1.00 0.00 O ATOM 455 CB THR A 35 2.327 -9.641 -1.253 1.00 0.00 C ATOM 456 OG1 THR A 35 1.190 -10.115 -1.969 1.00 0.00 O ATOM 457 CG2 THR A 35 2.221 -10.325 0.111 1.00 0.00 C ATOM 0 H THR A 35 0.124 -8.241 -1.822 1.00 0.00 H new ATOM 0 HA THR A 35 2.652 -7.758 -0.297 1.00 0.00 H new ATOM 0 HB THR A 35 3.307 -9.844 -1.685 1.00 0.00 H new ATOM 0 HG1 THR A 35 1.250 -11.088 -2.071 1.00 0.00 H new ATOM 0 HG21 THR A 35 2.382 -11.397 -0.006 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.976 -9.916 0.783 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.230 -10.150 0.530 1.00 0.00 H new ATOM 465 N TRP A 36 3.884 -6.838 -2.169 1.00 0.00 N ATOM 466 CA TRP A 36 4.550 -6.085 -3.218 1.00 0.00 C ATOM 467 C TRP A 36 6.060 -6.216 -3.008 1.00 0.00 C ATOM 468 O TRP A 36 6.513 -6.522 -1.907 1.00 0.00 O ATOM 469 CB TRP A 36 4.073 -4.632 -3.238 1.00 0.00 C ATOM 470 CG TRP A 36 4.504 -3.819 -2.016 1.00 0.00 C ATOM 471 CD1 TRP A 36 5.699 -3.264 -1.773 1.00 0.00 C ATOM 472 CD2 TRP A 36 3.688 -3.489 -0.871 1.00 0.00 C ATOM 473 NE1 TRP A 36 5.714 -2.604 -0.561 1.00 0.00 N ATOM 474 CE2 TRP A 36 4.452 -2.745 0.005 1.00 0.00 C ATOM 475 CE3 TRP A 36 2.349 -3.809 -0.586 1.00 0.00 C ATOM 476 CZ2 TRP A 36 3.966 -2.259 1.224 1.00 0.00 C ATOM 477 CZ3 TRP A 36 1.878 -3.316 0.637 1.00 0.00 C ATOM 478 CH2 TRP A 36 2.634 -2.565 1.529 1.00 0.00 C ATOM 0 H TRP A 36 4.412 -6.918 -1.300 1.00 0.00 H new ATOM 0 HA TRP A 36 4.299 -6.487 -4.200 1.00 0.00 H new ATOM 0 HB2 TRP A 36 4.454 -4.147 -4.137 1.00 0.00 H new ATOM 0 HB3 TRP A 36 2.985 -4.618 -3.306 1.00 0.00 H new ATOM 0 HD1 TRP A 36 6.545 -3.325 -2.442 1.00 0.00 H new ATOM 0 HE1 TRP A 36 6.505 -2.105 -0.155 1.00 0.00 H new ATOM 0 HE3 TRP A 36 1.733 -4.389 -1.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 4.585 -1.679 1.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 0.855 -3.535 0.906 1.00 0.00 H new ATOM 0 HH2 TRP A 36 2.196 -2.219 2.454 1.00 0.00 H new ATOM 489 N LYS A 37 6.797 -5.978 -4.083 1.00 0.00 N ATOM 490 CA LYS A 37 8.247 -6.066 -4.031 1.00 0.00 C ATOM 491 C LYS A 37 8.846 -4.677 -4.262 1.00 0.00 C ATOM 492 O LYS A 37 8.192 -3.801 -4.826 1.00 0.00 O ATOM 493 CB LYS A 37 8.755 -7.126 -5.009 1.00 0.00 C ATOM 494 CG LYS A 37 8.480 -8.536 -4.482 1.00 0.00 C ATOM 495 CD LYS A 37 9.015 -9.596 -5.447 1.00 0.00 C ATOM 496 CE LYS A 37 10.240 -10.302 -4.861 1.00 0.00 C ATOM 497 NZ LYS A 37 10.698 -11.381 -5.765 1.00 0.00 N ATOM 0 H LYS A 37 6.418 -5.724 -4.995 1.00 0.00 H new ATOM 0 HA LYS A 37 8.574 -6.394 -3.044 1.00 0.00 H new ATOM 0 HB2 LYS A 37 8.271 -6.995 -5.977 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.825 -6.996 -5.168 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.946 -8.660 -3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.408 -8.674 -4.343 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.235 -10.328 -5.658 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.279 -9.129 -6.396 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.044 -9.582 -4.708 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.995 -10.718 -3.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.530 -11.850 -5.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.935 -12.077 -5.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.952 -10.976 -6.689 1.00 0.00 H new ATOM 511 N ALA A 38 10.083 -4.519 -3.815 1.00 0.00 N ATOM 512 CA ALA A 38 10.778 -3.252 -3.967 1.00 0.00 C ATOM 513 C ALA A 38 10.463 -2.665 -5.344 1.00 0.00 C ATOM 514 O ALA A 38 10.374 -3.396 -6.329 1.00 0.00 O ATOM 515 CB ALA A 38 12.278 -3.463 -3.751 1.00 0.00 C ATOM 0 H ALA A 38 10.622 -5.248 -3.347 1.00 0.00 H new ATOM 0 HA ALA A 38 10.439 -2.536 -3.218 1.00 0.00 H new ATOM 0 HB1 ALA A 38 12.799 -2.513 -3.865 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.450 -3.853 -2.748 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.655 -4.174 -4.486 1.00 0.00 H new ATOM 521 N PRO A 39 10.300 -1.315 -5.370 1.00 0.00 N ATOM 522 CA PRO A 39 9.998 -0.621 -6.610 1.00 0.00 C ATOM 523 C PRO A 39 11.239 -0.522 -7.499 1.00 0.00 C ATOM 524 O PRO A 39 12.342 -0.860 -7.072 1.00 0.00 O ATOM 525 CB PRO A 39 9.465 0.737 -6.181 1.00 0.00 C ATOM 526 CG PRO A 39 9.921 0.929 -4.744 1.00 0.00 C ATOM 527 CD PRO A 39 10.399 -0.417 -4.223 1.00 0.00 C ATOM 0 HA PRO A 39 9.264 -1.148 -7.219 1.00 0.00 H new ATOM 0 HB2 PRO A 39 9.852 1.529 -6.823 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.378 0.771 -6.254 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.724 1.665 -4.693 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.103 1.307 -4.131 1.00 0.00 H new ATOM 0 HD2 PRO A 39 11.423 -0.358 -3.854 1.00 0.00 H new ATOM 0 HD3 PRO A 39 9.781 -0.763 -3.395 1.00 0.00 H new ATOM 535 N LYS A 40 11.017 -0.058 -8.720 1.00 0.00 N ATOM 536 CA LYS A 40 12.103 0.090 -9.674 1.00 0.00 C ATOM 537 C LYS A 40 13.356 0.575 -8.942 1.00 0.00 C ATOM 538 O LYS A 40 13.293 1.519 -8.155 1.00 0.00 O ATOM 539 CB LYS A 40 11.679 0.993 -10.834 1.00 0.00 C ATOM 540 CG LYS A 40 11.289 0.165 -12.060 1.00 0.00 C ATOM 541 CD LYS A 40 9.777 -0.064 -12.108 1.00 0.00 C ATOM 542 CE LYS A 40 9.261 -0.018 -13.547 1.00 0.00 C ATOM 543 NZ LYS A 40 7.981 0.722 -13.616 1.00 0.00 N ATOM 0 H LYS A 40 10.101 0.221 -9.071 1.00 0.00 H new ATOM 0 HA LYS A 40 12.349 -0.872 -10.124 1.00 0.00 H new ATOM 0 HB2 LYS A 40 10.837 1.614 -10.527 1.00 0.00 H new ATOM 0 HB3 LYS A 40 12.495 1.668 -11.091 1.00 0.00 H new ATOM 0 HG2 LYS A 40 11.612 0.677 -12.967 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.805 -0.795 -12.034 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.538 -1.030 -11.663 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.271 0.696 -11.512 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.000 0.461 -14.189 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.122 -1.032 -13.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 7.645 0.744 -14.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.273 0.248 -13.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 8.124 1.695 -13.278 1.00 0.00 H new ATOM 557 N LYS A 41 14.465 -0.091 -9.228 1.00 0.00 N ATOM 558 CA LYS A 41 15.730 0.261 -8.607 1.00 0.00 C ATOM 559 C LYS A 41 16.089 1.703 -8.972 1.00 0.00 C ATOM 560 O LYS A 41 16.335 2.527 -8.092 1.00 0.00 O ATOM 561 CB LYS A 41 16.811 -0.755 -8.980 1.00 0.00 C ATOM 562 CG LYS A 41 18.208 -0.142 -8.855 1.00 0.00 C ATOM 563 CD LYS A 41 18.584 0.069 -7.387 1.00 0.00 C ATOM 564 CE LYS A 41 19.897 0.844 -7.264 1.00 0.00 C ATOM 565 NZ LYS A 41 20.903 0.046 -6.529 1.00 0.00 N ATOM 0 H LYS A 41 14.514 -0.873 -9.882 1.00 0.00 H new ATOM 0 HA LYS A 41 15.646 0.218 -7.521 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.734 -1.628 -8.332 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.652 -1.102 -10.001 1.00 0.00 H new ATOM 0 HG2 LYS A 41 18.940 -0.795 -9.331 1.00 0.00 H new ATOM 0 HG3 LYS A 41 18.240 0.811 -9.383 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.788 0.612 -6.878 1.00 0.00 H new ATOM 0 HD3 LYS A 41 18.679 -0.896 -6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 41 20.275 1.091 -8.256 1.00 0.00 H new ATOM 0 HE3 LYS A 41 19.722 1.787 -6.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 21.788 0.587 -6.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 20.547 -0.168 -5.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 21.082 -0.842 -7.040 1.00 0.00 H new ATOM 579 N GLU A 42 16.108 1.963 -10.270 1.00 0.00 N ATOM 580 CA GLU A 42 16.433 3.291 -10.763 1.00 0.00 C ATOM 581 C GLU A 42 15.402 4.308 -10.266 1.00 0.00 C ATOM 582 O GLU A 42 15.676 5.507 -10.229 1.00 0.00 O ATOM 583 CB GLU A 42 16.523 3.303 -12.290 1.00 0.00 C ATOM 584 CG GLU A 42 15.135 3.180 -12.922 1.00 0.00 C ATOM 585 CD GLU A 42 15.230 2.642 -14.351 1.00 0.00 C ATOM 586 OE1 GLU A 42 15.788 3.373 -15.197 1.00 0.00 O ATOM 587 OE2 GLU A 42 14.742 1.511 -14.566 1.00 0.00 O ATOM 0 H GLU A 42 15.904 1.277 -10.996 1.00 0.00 H new ATOM 0 HA GLU A 42 17.411 3.573 -10.373 1.00 0.00 H new ATOM 0 HB2 GLU A 42 16.997 4.226 -12.623 1.00 0.00 H new ATOM 0 HB3 GLU A 42 17.154 2.481 -12.627 1.00 0.00 H new ATOM 0 HG2 GLU A 42 14.515 2.516 -12.320 1.00 0.00 H new ATOM 0 HG3 GLU A 42 14.646 4.154 -12.928 1.00 0.00 H new ATOM 594 N LEU A 43 14.239 3.792 -9.897 1.00 0.00 N ATOM 595 CA LEU A 43 13.167 4.640 -9.405 1.00 0.00 C ATOM 596 C LEU A 43 12.962 4.380 -7.911 1.00 0.00 C ATOM 597 O LEU A 43 11.841 4.133 -7.468 1.00 0.00 O ATOM 598 CB LEU A 43 11.901 4.444 -10.242 1.00 0.00 C ATOM 599 CG LEU A 43 12.061 4.628 -11.753 1.00 0.00 C ATOM 600 CD1 LEU A 43 10.765 4.281 -12.488 1.00 0.00 C ATOM 601 CD2 LEU A 43 12.548 6.040 -12.084 1.00 0.00 C ATOM 0 H LEU A 43 14.016 2.797 -9.929 1.00 0.00 H new ATOM 0 HA LEU A 43 13.433 5.691 -9.513 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.518 3.440 -10.057 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.144 5.144 -9.889 1.00 0.00 H new ATOM 0 HG LEU A 43 12.825 3.934 -12.103 1.00 0.00 H new ATOM 0 HD11 LEU A 43 10.906 4.420 -13.560 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.501 3.243 -12.289 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.964 4.933 -12.140 1.00 0.00 H new ATOM 0 HD21 LEU A 43 12.654 6.145 -13.164 1.00 0.00 H new ATOM 0 HD22 LEU A 43 11.826 6.769 -11.718 1.00 0.00 H new ATOM 0 HD23 LEU A 43 13.512 6.213 -11.607 1.00 0.00 H new ATOM 613 N GLN A 44 14.062 4.443 -7.176 1.00 0.00 N ATOM 614 CA GLN A 44 14.018 4.218 -5.741 1.00 0.00 C ATOM 615 C GLN A 44 14.187 5.541 -4.990 1.00 0.00 C ATOM 616 O GLN A 44 13.369 5.883 -4.138 1.00 0.00 O ATOM 617 CB GLN A 44 15.080 3.204 -5.312 1.00 0.00 C ATOM 618 CG GLN A 44 14.479 1.804 -5.178 1.00 0.00 C ATOM 619 CD GLN A 44 15.409 0.881 -4.388 1.00 0.00 C ATOM 620 OE1 GLN A 44 15.933 1.232 -3.343 1.00 0.00 O ATOM 621 NE2 GLN A 44 15.584 -0.315 -4.942 1.00 0.00 N ATOM 0 H GLN A 44 14.990 4.647 -7.547 1.00 0.00 H new ATOM 0 HA GLN A 44 13.043 3.802 -5.488 1.00 0.00 H new ATOM 0 HB2 GLN A 44 15.889 3.188 -6.043 1.00 0.00 H new ATOM 0 HB3 GLN A 44 15.516 3.509 -4.361 1.00 0.00 H new ATOM 0 HG2 GLN A 44 13.512 1.866 -4.679 1.00 0.00 H new ATOM 0 HG3 GLN A 44 14.300 1.385 -6.168 1.00 0.00 H new ATOM 0 HE21 GLN A 44 15.115 -0.545 -5.818 1.00 0.00 H new ATOM 0 HE22 GLN A 44 16.187 -1.003 -4.491 1.00 0.00 H new ATOM 630 N ASN A 45 15.253 6.247 -5.335 1.00 0.00 N ATOM 631 CA ASN A 45 15.540 7.525 -4.704 1.00 0.00 C ATOM 632 C ASN A 45 15.973 7.288 -3.256 1.00 0.00 C ATOM 633 O ASN A 45 15.343 7.790 -2.326 1.00 0.00 O ATOM 634 CB ASN A 45 14.300 8.421 -4.686 1.00 0.00 C ATOM 635 CG ASN A 45 13.594 8.407 -6.044 1.00 0.00 C ATOM 636 OD1 ASN A 45 13.163 7.378 -6.538 1.00 0.00 O ATOM 637 ND2 ASN A 45 13.500 9.604 -6.617 1.00 0.00 N ATOM 0 H ASN A 45 15.929 5.959 -6.043 1.00 0.00 H new ATOM 0 HA ASN A 45 16.330 8.013 -5.275 1.00 0.00 H new ATOM 0 HB2 ASN A 45 13.613 8.081 -3.911 1.00 0.00 H new ATOM 0 HB3 ASN A 45 14.588 9.441 -4.432 1.00 0.00 H new ATOM 0 HD21 ASN A 45 13.045 9.700 -7.525 1.00 0.00 H new ATOM 0 HD22 ASN A 45 13.883 10.425 -6.148 1.00 0.00 H new ATOM 644 N GLY A 46 17.045 6.523 -3.110 1.00 0.00 N ATOM 645 CA GLY A 46 17.570 6.213 -1.791 1.00 0.00 C ATOM 646 C GLY A 46 16.700 5.171 -1.086 1.00 0.00 C ATOM 647 O GLY A 46 15.549 4.959 -1.465 1.00 0.00 O ATOM 0 H GLY A 46 17.564 6.109 -3.884 1.00 0.00 H new ATOM 0 HA2 GLY A 46 18.590 5.840 -1.880 1.00 0.00 H new ATOM 0 HA3 GLY A 46 17.614 7.122 -1.190 1.00 0.00 H new ATOM 651 N VAL A 47 17.283 4.548 -0.072 1.00 0.00 N ATOM 652 CA VAL A 47 16.575 3.533 0.689 1.00 0.00 C ATOM 653 C VAL A 47 15.146 4.008 0.959 1.00 0.00 C ATOM 654 O VAL A 47 14.854 5.198 0.858 1.00 0.00 O ATOM 655 CB VAL A 47 17.347 3.206 1.969 1.00 0.00 C ATOM 656 CG1 VAL A 47 16.504 2.348 2.914 1.00 0.00 C ATOM 657 CG2 VAL A 47 18.677 2.521 1.647 1.00 0.00 C ATOM 0 H VAL A 47 18.238 4.727 0.240 1.00 0.00 H new ATOM 0 HA VAL A 47 16.508 2.606 0.119 1.00 0.00 H new ATOM 0 HB VAL A 47 17.567 4.145 2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 47 17.076 2.130 3.816 1.00 0.00 H new ATOM 0 HG12 VAL A 47 15.596 2.887 3.182 1.00 0.00 H new ATOM 0 HG13 VAL A 47 16.238 1.414 2.418 1.00 0.00 H new ATOM 0 HG21 VAL A 47 19.206 2.299 2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 47 18.487 1.593 1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 47 19.287 3.182 1.030 1.00 0.00 H new ATOM 667 N ILE A 48 14.292 3.052 1.296 1.00 0.00 N ATOM 668 CA ILE A 48 12.901 3.357 1.581 1.00 0.00 C ATOM 669 C ILE A 48 12.659 3.257 3.088 1.00 0.00 C ATOM 670 O ILE A 48 13.067 2.285 3.722 1.00 0.00 O ATOM 671 CB ILE A 48 11.976 2.467 0.749 1.00 0.00 C ATOM 672 CG1 ILE A 48 12.517 2.290 -0.672 1.00 0.00 C ATOM 673 CG2 ILE A 48 10.544 3.007 0.754 1.00 0.00 C ATOM 674 CD1 ILE A 48 12.292 3.554 -1.505 1.00 0.00 C ATOM 0 H ILE A 48 14.537 2.065 1.378 1.00 0.00 H new ATOM 0 HA ILE A 48 12.668 4.381 1.288 1.00 0.00 H new ATOM 0 HB ILE A 48 11.949 1.479 1.209 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.582 2.060 -0.634 1.00 0.00 H new ATOM 0 HG13 ILE A 48 12.025 1.443 -1.150 1.00 0.00 H new ATOM 0 HG21 ILE A 48 9.907 2.356 0.155 1.00 0.00 H new ATOM 0 HG22 ILE A 48 10.171 3.038 1.778 1.00 0.00 H new ATOM 0 HG23 ILE A 48 10.533 4.012 0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.685 3.402 -2.510 1.00 0.00 H new ATOM 0 HD12 ILE A 48 11.225 3.767 -1.561 1.00 0.00 H new ATOM 0 HD13 ILE A 48 12.806 4.394 -1.038 1.00 0.00 H new ATOM 686 N ARG A 49 11.996 4.274 3.618 1.00 0.00 N ATOM 687 CA ARG A 49 11.694 4.312 5.039 1.00 0.00 C ATOM 688 C ARG A 49 10.438 3.492 5.337 1.00 0.00 C ATOM 689 O ARG A 49 10.283 2.966 6.438 1.00 0.00 O ATOM 690 CB ARG A 49 11.482 5.749 5.518 1.00 0.00 C ATOM 691 CG ARG A 49 12.784 6.550 5.442 1.00 0.00 C ATOM 692 CD ARG A 49 13.446 6.653 6.818 1.00 0.00 C ATOM 693 NE ARG A 49 14.917 6.588 6.678 1.00 0.00 N ATOM 694 CZ ARG A 49 15.761 6.388 7.699 1.00 0.00 C ATOM 695 NH1 ARG A 49 15.284 6.233 8.942 1.00 0.00 N ATOM 696 NH2 ARG A 49 17.082 6.343 7.478 1.00 0.00 N ATOM 0 H ARG A 49 11.659 5.078 3.089 1.00 0.00 H new ATOM 0 HA ARG A 49 12.545 3.885 5.570 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.718 6.231 4.907 1.00 0.00 H new ATOM 0 HB3 ARG A 49 11.113 5.744 6.544 1.00 0.00 H new ATOM 0 HG2 ARG A 49 13.468 6.073 4.740 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.579 7.549 5.058 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.159 7.588 7.300 1.00 0.00 H new ATOM 0 HD3 ARG A 49 13.097 5.844 7.460 1.00 0.00 H new ATOM 0 HE ARG A 49 15.314 6.703 5.745 1.00 0.00 H new ATOM 0 HH11 ARG A 49 14.279 6.267 9.110 1.00 0.00 H new ATOM 0 HH12 ARG A 49 15.926 6.081 9.719 1.00 0.00 H new ATOM 0 HH21 ARG A 49 17.445 6.461 6.532 1.00 0.00 H new ATOM 0 HH22 ARG A 49 17.724 6.191 8.256 1.00 0.00 H new ATOM 710 N GLY A 50 9.573 3.408 4.337 1.00 0.00 N ATOM 711 CA GLY A 50 8.335 2.660 4.479 1.00 0.00 C ATOM 712 C GLY A 50 7.441 2.843 3.251 1.00 0.00 C ATOM 713 O GLY A 50 7.852 3.451 2.264 1.00 0.00 O ATOM 0 H GLY A 50 9.705 3.845 3.425 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.559 1.602 4.616 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.805 2.992 5.372 1.00 0.00 H new ATOM 717 N TYR A 51 6.235 2.304 3.352 1.00 0.00 N ATOM 718 CA TYR A 51 5.279 2.399 2.262 1.00 0.00 C ATOM 719 C TYR A 51 3.861 2.616 2.794 1.00 0.00 C ATOM 720 O TYR A 51 3.590 2.368 3.968 1.00 0.00 O ATOM 721 CB TYR A 51 5.337 1.057 1.531 1.00 0.00 C ATOM 722 CG TYR A 51 6.615 0.847 0.716 1.00 0.00 C ATOM 723 CD1 TYR A 51 7.820 0.651 1.360 1.00 0.00 C ATOM 724 CD2 TYR A 51 6.563 0.854 -0.663 1.00 0.00 C ATOM 725 CE1 TYR A 51 9.023 0.454 0.593 1.00 0.00 C ATOM 726 CE2 TYR A 51 7.766 0.657 -1.430 1.00 0.00 C ATOM 727 CZ TYR A 51 8.936 0.466 -0.764 1.00 0.00 C ATOM 728 OH TYR A 51 10.072 0.280 -1.489 1.00 0.00 O ATOM 0 H TYR A 51 5.898 1.800 4.172 1.00 0.00 H new ATOM 0 HA TYR A 51 5.521 3.239 1.612 1.00 0.00 H new ATOM 0 HB2 TYR A 51 5.248 0.253 2.261 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.477 0.980 0.866 1.00 0.00 H new ATOM 0 HD1 TYR A 51 7.861 0.645 2.439 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.620 1.007 -1.167 1.00 0.00 H new ATOM 0 HE1 TYR A 51 9.972 0.300 1.084 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.739 0.661 -2.510 1.00 0.00 H new ATOM 0 HH TYR A 51 10.460 -0.593 -1.271 1.00 0.00 H new ATOM 738 N GLN A 52 2.993 3.075 1.904 1.00 0.00 N ATOM 739 CA GLN A 52 1.609 3.327 2.269 1.00 0.00 C ATOM 740 C GLN A 52 0.684 2.338 1.558 1.00 0.00 C ATOM 741 O GLN A 52 0.987 1.880 0.457 1.00 0.00 O ATOM 742 CB GLN A 52 1.214 4.771 1.954 1.00 0.00 C ATOM 743 CG GLN A 52 1.611 5.710 3.095 1.00 0.00 C ATOM 744 CD GLN A 52 0.975 7.090 2.916 1.00 0.00 C ATOM 745 OE1 GLN A 52 0.597 7.491 1.828 1.00 0.00 O ATOM 746 NE2 GLN A 52 0.879 7.791 4.042 1.00 0.00 N ATOM 0 H GLN A 52 3.221 3.279 0.931 1.00 0.00 H new ATOM 0 HA GLN A 52 1.505 3.183 3.344 1.00 0.00 H new ATOM 0 HB2 GLN A 52 1.697 5.091 1.031 1.00 0.00 H new ATOM 0 HB3 GLN A 52 0.138 4.829 1.788 1.00 0.00 H new ATOM 0 HG2 GLN A 52 1.299 5.283 4.048 1.00 0.00 H new ATOM 0 HG3 GLN A 52 2.696 5.807 3.130 1.00 0.00 H new ATOM 0 HE21 GLN A 52 1.216 7.395 4.920 1.00 0.00 H new ATOM 0 HE22 GLN A 52 0.469 8.725 4.028 1.00 0.00 H new ATOM 755 N ILE A 53 -0.425 2.036 2.217 1.00 0.00 N ATOM 756 CA ILE A 53 -1.397 1.109 1.661 1.00 0.00 C ATOM 757 C ILE A 53 -2.793 1.729 1.746 1.00 0.00 C ATOM 758 O ILE A 53 -3.456 1.635 2.778 1.00 0.00 O ATOM 759 CB ILE A 53 -1.287 -0.255 2.345 1.00 0.00 C ATOM 760 CG1 ILE A 53 0.121 -0.834 2.190 1.00 0.00 C ATOM 761 CG2 ILE A 53 -2.361 -1.215 1.830 1.00 0.00 C ATOM 762 CD1 ILE A 53 1.074 -0.243 3.230 1.00 0.00 C ATOM 0 H ILE A 53 -0.672 2.416 3.130 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.192 0.929 0.606 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.463 -0.117 3.412 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.086 -1.918 2.298 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.496 -0.625 1.188 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.260 -2.177 2.332 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.348 -0.800 2.035 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.241 -1.353 0.755 1.00 0.00 H new ATOM 0 HD11 ILE A 53 2.068 -0.671 3.098 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.125 0.838 3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.709 -0.475 4.231 1.00 0.00 H new ATOM 774 N GLY A 54 -3.198 2.349 0.648 1.00 0.00 N ATOM 775 CA GLY A 54 -4.503 2.984 0.585 1.00 0.00 C ATOM 776 C GLY A 54 -5.569 2.001 0.097 1.00 0.00 C ATOM 777 O GLY A 54 -5.520 1.543 -1.044 1.00 0.00 O ATOM 0 H GLY A 54 -2.645 2.425 -0.206 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.775 3.361 1.571 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -4.461 3.843 -0.085 1.00 0.00 H new ATOM 781 N TYR A 55 -6.507 1.705 0.985 1.00 0.00 N ATOM 782 CA TYR A 55 -7.582 0.784 0.658 1.00 0.00 C ATOM 783 C TYR A 55 -8.944 1.384 1.013 1.00 0.00 C ATOM 784 O TYR A 55 -9.080 2.070 2.024 1.00 0.00 O ATOM 785 CB TYR A 55 -7.348 -0.460 1.517 1.00 0.00 C ATOM 786 CG TYR A 55 -7.568 -0.233 3.014 1.00 0.00 C ATOM 787 CD1 TYR A 55 -6.621 0.442 3.757 1.00 0.00 C ATOM 788 CD2 TYR A 55 -8.715 -0.703 3.622 1.00 0.00 C ATOM 789 CE1 TYR A 55 -6.829 0.655 5.166 1.00 0.00 C ATOM 790 CE2 TYR A 55 -8.923 -0.490 5.031 1.00 0.00 C ATOM 791 CZ TYR A 55 -7.969 0.179 5.733 1.00 0.00 C ATOM 792 OH TYR A 55 -8.166 0.381 7.064 1.00 0.00 O ATOM 0 H TYR A 55 -6.545 2.087 1.930 1.00 0.00 H new ATOM 0 HA TYR A 55 -7.585 0.561 -0.409 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -8.014 -1.253 1.178 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -6.328 -0.811 1.359 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -5.724 0.811 3.282 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -9.457 -1.231 3.041 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -6.096 1.181 5.759 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -9.816 -0.853 5.519 1.00 0.00 H new ATOM 0 HH TYR A 55 -9.023 -0.012 7.331 1.00 0.00 H new ATOM 802 N ARG A 56 -9.918 1.104 0.159 1.00 0.00 N ATOM 803 CA ARG A 56 -11.265 1.608 0.369 1.00 0.00 C ATOM 804 C ARG A 56 -12.280 0.732 -0.367 1.00 0.00 C ATOM 805 O ARG A 56 -11.972 0.164 -1.414 1.00 0.00 O ATOM 806 CB ARG A 56 -11.396 3.051 -0.122 1.00 0.00 C ATOM 807 CG ARG A 56 -10.824 3.204 -1.532 1.00 0.00 C ATOM 808 CD ARG A 56 -11.382 4.452 -2.218 1.00 0.00 C ATOM 809 NE ARG A 56 -11.378 4.268 -3.687 1.00 0.00 N ATOM 810 CZ ARG A 56 -11.887 5.151 -4.557 1.00 0.00 C ATOM 811 NH1 ARG A 56 -12.444 6.285 -4.111 1.00 0.00 N ATOM 812 NH2 ARG A 56 -11.839 4.900 -5.872 1.00 0.00 N ATOM 0 H ARG A 56 -9.801 0.535 -0.679 1.00 0.00 H new ATOM 0 HA ARG A 56 -11.466 1.581 1.440 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -12.445 3.347 -0.117 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.873 3.720 0.561 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -9.737 3.267 -1.482 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.065 2.321 -2.124 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.397 4.645 -1.870 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -10.783 5.322 -1.951 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.961 3.415 -4.060 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -12.480 6.476 -3.110 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -12.832 6.957 -4.773 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.415 4.037 -6.211 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.227 5.572 -6.534 1.00 0.00 H new ATOM 826 N GLU A 57 -13.471 0.649 0.210 1.00 0.00 N ATOM 827 CA GLU A 57 -14.533 -0.149 -0.379 1.00 0.00 C ATOM 828 C GLU A 57 -14.804 0.304 -1.815 1.00 0.00 C ATOM 829 O GLU A 57 -15.191 1.449 -2.045 1.00 0.00 O ATOM 830 CB GLU A 57 -15.805 -0.078 0.468 1.00 0.00 C ATOM 831 CG GLU A 57 -16.564 -1.406 0.432 1.00 0.00 C ATOM 832 CD GLU A 57 -17.991 -1.237 0.956 1.00 0.00 C ATOM 833 OE1 GLU A 57 -18.152 -0.463 1.924 1.00 0.00 O ATOM 834 OE2 GLU A 57 -18.889 -1.886 0.376 1.00 0.00 O ATOM 0 H GLU A 57 -13.723 1.121 1.078 1.00 0.00 H new ATOM 0 HA GLU A 57 -14.209 -1.189 -0.403 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.547 0.169 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.447 0.722 0.099 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.591 -1.786 -0.589 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -16.037 -2.146 1.034 1.00 0.00 H new ATOM 841 N ASN A 58 -14.591 -0.617 -2.742 1.00 0.00 N ATOM 842 CA ASN A 58 -14.807 -0.327 -4.149 1.00 0.00 C ATOM 843 C ASN A 58 -16.217 -0.769 -4.546 1.00 0.00 C ATOM 844 O ASN A 58 -16.407 -1.386 -5.592 1.00 0.00 O ATOM 845 CB ASN A 58 -13.810 -1.085 -5.028 1.00 0.00 C ATOM 846 CG ASN A 58 -13.555 -0.337 -6.338 1.00 0.00 C ATOM 847 OD1 ASN A 58 -14.276 -0.475 -7.312 1.00 0.00 O ATOM 848 ND2 ASN A 58 -12.491 0.461 -6.307 1.00 0.00 N ATOM 0 H ASN A 58 -14.271 -1.565 -2.546 1.00 0.00 H new ATOM 0 HA ASN A 58 -14.675 0.745 -4.296 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -12.871 -1.215 -4.490 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -14.194 -2.082 -5.243 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -12.236 1.004 -7.132 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -11.930 0.530 -5.458 1.00 0.00 H new ATOM 855 N SER A 59 -17.170 -0.435 -3.688 1.00 0.00 N ATOM 856 CA SER A 59 -18.558 -0.789 -3.936 1.00 0.00 C ATOM 857 C SER A 59 -19.188 0.212 -4.906 1.00 0.00 C ATOM 858 O SER A 59 -18.619 1.270 -5.169 1.00 0.00 O ATOM 859 CB SER A 59 -19.355 -0.838 -2.631 1.00 0.00 C ATOM 860 OG SER A 59 -19.868 -2.141 -2.367 1.00 0.00 O ATOM 0 H SER A 59 -17.009 0.077 -2.821 1.00 0.00 H new ATOM 0 HA SER A 59 -18.583 -1.783 -4.383 1.00 0.00 H new ATOM 0 HB2 SER A 59 -18.717 -0.525 -1.805 1.00 0.00 H new ATOM 0 HB3 SER A 59 -20.180 -0.127 -2.683 1.00 0.00 H new ATOM 0 HG SER A 59 -19.684 -2.383 -1.435 1.00 0.00 H new ATOM 866 N PRO A 60 -20.387 -0.168 -5.425 1.00 0.00 N ATOM 867 CA PRO A 60 -21.101 0.684 -6.360 1.00 0.00 C ATOM 868 C PRO A 60 -21.749 1.868 -5.639 1.00 0.00 C ATOM 869 O PRO A 60 -22.905 1.791 -5.227 1.00 0.00 O ATOM 870 CB PRO A 60 -22.114 -0.230 -7.030 1.00 0.00 C ATOM 871 CG PRO A 60 -22.247 -1.441 -6.122 1.00 0.00 C ATOM 872 CD PRO A 60 -21.091 -1.414 -5.136 1.00 0.00 C ATOM 0 HA PRO A 60 -20.443 1.139 -7.101 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -23.073 0.273 -7.153 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -21.778 -0.523 -8.025 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -23.200 -1.419 -5.593 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -22.228 -2.361 -6.707 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -21.448 -1.438 -4.106 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -20.438 -2.277 -5.267 1.00 0.00 H new ATOM 880 N GLY A 61 -20.975 2.936 -5.509 1.00 0.00 N ATOM 881 CA GLY A 61 -21.459 4.134 -4.845 1.00 0.00 C ATOM 882 C GLY A 61 -20.642 4.432 -3.586 1.00 0.00 C ATOM 883 O GLY A 61 -21.196 4.814 -2.557 1.00 0.00 O ATOM 0 H GLY A 61 -20.016 2.996 -5.852 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.402 4.981 -5.529 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.509 4.008 -4.580 1.00 0.00 H new ATOM 887 N SER A 62 -19.336 4.245 -3.710 1.00 0.00 N ATOM 888 CA SER A 62 -18.436 4.488 -2.595 1.00 0.00 C ATOM 889 C SER A 62 -17.938 5.934 -2.631 1.00 0.00 C ATOM 890 O SER A 62 -18.045 6.606 -3.656 1.00 0.00 O ATOM 891 CB SER A 62 -17.253 3.518 -2.620 1.00 0.00 C ATOM 892 OG SER A 62 -17.095 2.902 -3.895 1.00 0.00 O ATOM 0 H SER A 62 -18.880 3.928 -4.565 1.00 0.00 H new ATOM 0 HA SER A 62 -18.986 4.323 -1.669 1.00 0.00 H new ATOM 0 HB2 SER A 62 -16.340 4.053 -2.360 1.00 0.00 H new ATOM 0 HB3 SER A 62 -17.399 2.749 -1.861 1.00 0.00 H new ATOM 0 HG SER A 62 -17.751 2.180 -3.993 1.00 0.00 H new ATOM 898 N ASN A 63 -17.404 6.371 -1.500 1.00 0.00 N ATOM 899 CA ASN A 63 -16.889 7.725 -1.390 1.00 0.00 C ATOM 900 C ASN A 63 -16.308 7.933 0.011 1.00 0.00 C ATOM 901 O ASN A 63 -16.445 9.009 0.590 1.00 0.00 O ATOM 902 CB ASN A 63 -18.000 8.756 -1.598 1.00 0.00 C ATOM 903 CG ASN A 63 -17.469 9.995 -2.322 1.00 0.00 C ATOM 904 OD1 ASN A 63 -16.280 10.263 -2.359 1.00 0.00 O ATOM 905 ND2 ASN A 63 -18.416 10.735 -2.893 1.00 0.00 N ATOM 0 H ASN A 63 -17.317 5.811 -0.652 1.00 0.00 H new ATOM 0 HA ASN A 63 -16.125 7.858 -2.156 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -18.810 8.312 -2.176 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -18.418 9.045 -0.634 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -18.164 11.584 -3.400 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -19.394 10.454 -2.824 1.00 0.00 H new ATOM 912 N GLY A 64 -15.673 6.885 0.515 1.00 0.00 N ATOM 913 CA GLY A 64 -15.072 6.939 1.836 1.00 0.00 C ATOM 914 C GLY A 64 -13.564 7.184 1.743 1.00 0.00 C ATOM 915 O GLY A 64 -12.821 6.862 2.668 1.00 0.00 O ATOM 0 H GLY A 64 -15.562 5.994 0.032 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -15.538 7.733 2.419 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -15.260 6.004 2.364 1.00 0.00 H new ATOM 919 N GLN A 65 -13.158 7.753 0.617 1.00 0.00 N ATOM 920 CA GLN A 65 -11.753 8.045 0.391 1.00 0.00 C ATOM 921 C GLN A 65 -10.906 6.793 0.627 1.00 0.00 C ATOM 922 O GLN A 65 -11.408 5.782 1.114 1.00 0.00 O ATOM 923 CB GLN A 65 -11.284 9.200 1.278 1.00 0.00 C ATOM 924 CG GLN A 65 -10.685 10.329 0.436 1.00 0.00 C ATOM 925 CD GLN A 65 -9.188 10.484 0.713 1.00 0.00 C ATOM 926 OE1 GLN A 65 -8.748 10.598 1.845 1.00 0.00 O ATOM 927 NE2 GLN A 65 -8.433 10.482 -0.382 1.00 0.00 N ATOM 0 H GLN A 65 -13.778 8.019 -0.148 1.00 0.00 H new ATOM 0 HA GLN A 65 -11.628 8.354 -0.647 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -12.124 9.581 1.859 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -10.541 8.839 1.990 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -10.843 10.122 -0.622 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -11.198 11.265 0.658 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -8.866 10.383 -1.300 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -7.421 10.580 -0.304 1.00 0.00 H new ATOM 936 N TYR A 66 -9.634 6.902 0.271 1.00 0.00 N ATOM 937 CA TYR A 66 -8.712 5.792 0.437 1.00 0.00 C ATOM 938 C TYR A 66 -8.033 5.845 1.807 1.00 0.00 C ATOM 939 O TYR A 66 -7.318 6.798 2.114 1.00 0.00 O ATOM 940 CB TYR A 66 -7.651 5.958 -0.652 1.00 0.00 C ATOM 941 CG TYR A 66 -8.044 5.352 -2.001 1.00 0.00 C ATOM 942 CD1 TYR A 66 -8.737 6.110 -2.922 1.00 0.00 C ATOM 943 CD2 TYR A 66 -7.704 4.047 -2.296 1.00 0.00 C ATOM 944 CE1 TYR A 66 -9.107 5.540 -4.192 1.00 0.00 C ATOM 945 CE2 TYR A 66 -8.074 3.477 -3.566 1.00 0.00 C ATOM 946 CZ TYR A 66 -8.757 4.252 -4.451 1.00 0.00 C ATOM 947 OH TYR A 66 -9.106 3.713 -5.650 1.00 0.00 O ATOM 0 H TYR A 66 -9.221 7.743 -0.132 1.00 0.00 H new ATOM 0 HA TYR A 66 -9.239 4.841 0.365 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -7.448 7.020 -0.788 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -6.723 5.496 -0.314 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -9.002 7.131 -2.691 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -7.161 3.454 -1.575 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -9.650 6.122 -4.922 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -7.815 2.457 -3.810 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.400 3.105 -5.953 1.00 0.00 H new ATOM 957 N SER A 67 -8.279 4.808 2.595 1.00 0.00 N ATOM 958 CA SER A 67 -7.700 4.724 3.925 1.00 0.00 C ATOM 959 C SER A 67 -6.199 4.449 3.825 1.00 0.00 C ATOM 960 O SER A 67 -5.788 3.335 3.503 1.00 0.00 O ATOM 961 CB SER A 67 -8.385 3.638 4.756 1.00 0.00 C ATOM 962 OG SER A 67 -9.722 3.991 5.100 1.00 0.00 O ATOM 0 H SER A 67 -8.872 4.019 2.337 1.00 0.00 H new ATOM 0 HA SER A 67 -7.855 5.679 4.427 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.390 2.703 4.196 1.00 0.00 H new ATOM 0 HB3 SER A 67 -7.811 3.462 5.666 1.00 0.00 H new ATOM 0 HG SER A 67 -10.125 3.271 5.629 1.00 0.00 H new ATOM 968 N ILE A 68 -5.420 5.483 4.108 1.00 0.00 N ATOM 969 CA ILE A 68 -3.972 5.366 4.055 1.00 0.00 C ATOM 970 C ILE A 68 -3.465 4.765 5.367 1.00 0.00 C ATOM 971 O ILE A 68 -4.014 5.039 6.433 1.00 0.00 O ATOM 972 CB ILE A 68 -3.339 6.715 3.710 1.00 0.00 C ATOM 973 CG1 ILE A 68 -3.676 7.129 2.276 1.00 0.00 C ATOM 974 CG2 ILE A 68 -1.829 6.692 3.960 1.00 0.00 C ATOM 975 CD1 ILE A 68 -3.350 6.006 1.290 1.00 0.00 C ATOM 0 H ILE A 68 -5.764 6.405 4.375 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.673 4.686 3.257 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.764 7.470 4.371 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -4.734 7.383 2.206 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.115 8.025 2.011 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -1.403 7.663 3.707 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.637 6.475 5.011 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.369 5.922 3.341 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -3.599 6.326 0.278 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.287 5.771 1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.931 5.119 1.543 1.00 0.00 H new ATOM 987 N VAL A 69 -2.421 3.958 5.247 1.00 0.00 N ATOM 988 CA VAL A 69 -1.833 3.316 6.410 1.00 0.00 C ATOM 989 C VAL A 69 -0.315 3.244 6.234 1.00 0.00 C ATOM 990 O VAL A 69 0.180 2.526 5.366 1.00 0.00 O ATOM 991 CB VAL A 69 -2.475 1.946 6.632 1.00 0.00 C ATOM 992 CG1 VAL A 69 -3.637 2.039 7.623 1.00 0.00 C ATOM 993 CG2 VAL A 69 -2.932 1.333 5.307 1.00 0.00 C ATOM 0 H VAL A 69 -1.967 3.734 4.361 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.029 3.901 7.309 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.720 1.288 7.062 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -4.076 1.051 7.763 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.271 2.412 8.579 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -4.394 2.720 7.234 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -3.385 0.359 5.494 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -3.664 1.989 4.836 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -2.073 1.213 4.646 1.00 0.00 H new ATOM 1003 N GLU A 70 0.383 3.997 7.072 1.00 0.00 N ATOM 1004 CA GLU A 70 1.835 4.027 7.020 1.00 0.00 C ATOM 1005 C GLU A 70 2.419 2.860 7.818 1.00 0.00 C ATOM 1006 O GLU A 70 1.937 2.544 8.905 1.00 0.00 O ATOM 1007 CB GLU A 70 2.374 5.365 7.530 1.00 0.00 C ATOM 1008 CG GLU A 70 3.826 5.230 7.994 1.00 0.00 C ATOM 1009 CD GLU A 70 4.588 6.542 7.797 1.00 0.00 C ATOM 1010 OE1 GLU A 70 4.291 7.226 6.795 1.00 0.00 O ATOM 1011 OE2 GLU A 70 5.451 6.830 8.654 1.00 0.00 O ATOM 0 H GLU A 70 -0.030 4.591 7.791 1.00 0.00 H new ATOM 0 HA GLU A 70 2.144 3.921 5.980 1.00 0.00 H new ATOM 0 HB2 GLU A 70 2.309 6.112 6.739 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.756 5.719 8.355 1.00 0.00 H new ATOM 0 HG2 GLU A 70 3.851 4.945 9.046 1.00 0.00 H new ATOM 0 HG3 GLU A 70 4.317 4.433 7.436 1.00 0.00 H new ATOM 1018 N MET A 71 3.448 2.251 7.248 1.00 0.00 N ATOM 1019 CA MET A 71 4.103 1.126 7.894 1.00 0.00 C ATOM 1020 C MET A 71 5.617 1.178 7.682 1.00 0.00 C ATOM 1021 O MET A 71 6.131 2.113 7.068 1.00 0.00 O ATOM 1022 CB MET A 71 3.552 -0.182 7.322 1.00 0.00 C ATOM 1023 CG MET A 71 3.546 -0.152 5.792 1.00 0.00 C ATOM 1024 SD MET A 71 5.200 -0.400 5.170 1.00 0.00 S ATOM 1025 CE MET A 71 5.121 -2.136 4.763 1.00 0.00 C ATOM 0 H MET A 71 3.844 2.515 6.346 1.00 0.00 H new ATOM 0 HA MET A 71 3.903 1.178 8.964 1.00 0.00 H new ATOM 0 HB2 MET A 71 4.157 -1.019 7.670 1.00 0.00 H new ATOM 0 HB3 MET A 71 2.539 -0.346 7.690 1.00 0.00 H new ATOM 0 HG2 MET A 71 2.884 -0.928 5.407 1.00 0.00 H new ATOM 0 HG3 MET A 71 3.156 0.803 5.440 1.00 0.00 H new ATOM 0 HE1 MET A 71 6.115 -2.492 4.493 1.00 0.00 H new ATOM 0 HE2 MET A 71 4.757 -2.696 5.625 1.00 0.00 H new ATOM 0 HE3 MET A 71 4.442 -2.282 3.923 1.00 0.00 H new ATOM 1035 N LYS A 72 6.291 0.162 8.201 1.00 0.00 N ATOM 1036 CA LYS A 72 7.736 0.080 8.077 1.00 0.00 C ATOM 1037 C LYS A 72 8.091 -0.802 6.878 1.00 0.00 C ATOM 1038 O LYS A 72 7.305 -1.661 6.480 1.00 0.00 O ATOM 1039 CB LYS A 72 8.361 -0.390 9.392 1.00 0.00 C ATOM 1040 CG LYS A 72 8.855 0.799 10.219 1.00 0.00 C ATOM 1041 CD LYS A 72 9.493 0.329 11.528 1.00 0.00 C ATOM 1042 CE LYS A 72 8.943 1.114 12.719 1.00 0.00 C ATOM 1043 NZ LYS A 72 10.021 1.889 13.373 1.00 0.00 N ATOM 0 H LYS A 72 5.862 -0.612 8.709 1.00 0.00 H new ATOM 0 HA LYS A 72 8.158 1.066 7.885 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.628 -0.957 9.965 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.192 -1.063 9.184 1.00 0.00 H new ATOM 0 HG2 LYS A 72 9.581 1.372 9.642 1.00 0.00 H new ATOM 0 HG3 LYS A 72 8.022 1.467 10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.301 -0.735 11.669 1.00 0.00 H new ATOM 0 HD3 LYS A 72 10.575 0.453 11.475 1.00 0.00 H new ATOM 0 HE2 LYS A 72 8.154 1.788 12.385 1.00 0.00 H new ATOM 0 HE3 LYS A 72 8.493 0.428 13.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 9.629 2.416 14.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 10.760 1.240 13.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 10.432 2.557 12.690 1.00 0.00 H new ATOM 1057 N ALA A 73 9.275 -0.559 6.335 1.00 0.00 N ATOM 1058 CA ALA A 73 9.744 -1.321 5.190 1.00 0.00 C ATOM 1059 C ALA A 73 10.518 -2.546 5.679 1.00 0.00 C ATOM 1060 O ALA A 73 11.702 -2.449 5.999 1.00 0.00 O ATOM 1061 CB ALA A 73 10.589 -0.418 4.288 1.00 0.00 C ATOM 0 H ALA A 73 9.924 0.155 6.667 1.00 0.00 H new ATOM 0 HA ALA A 73 8.903 -1.679 4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 73 10.941 -0.989 3.429 1.00 0.00 H new ATOM 0 HB2 ALA A 73 9.984 0.420 3.943 1.00 0.00 H new ATOM 0 HB3 ALA A 73 11.445 -0.042 4.849 1.00 0.00 H new ATOM 1067 N THR A 74 9.819 -3.670 5.723 1.00 0.00 N ATOM 1068 CA THR A 74 10.426 -4.913 6.169 1.00 0.00 C ATOM 1069 C THR A 74 11.770 -5.129 5.471 1.00 0.00 C ATOM 1070 O THR A 74 12.717 -5.623 6.080 1.00 0.00 O ATOM 1071 CB THR A 74 9.424 -6.043 5.923 1.00 0.00 C ATOM 1072 OG1 THR A 74 9.183 -5.994 4.520 1.00 0.00 O ATOM 1073 CG2 THR A 74 8.056 -5.759 6.547 1.00 0.00 C ATOM 0 H THR A 74 8.837 -3.746 5.457 1.00 0.00 H new ATOM 0 HA THR A 74 10.650 -4.885 7.235 1.00 0.00 H new ATOM 0 HB THR A 74 9.821 -6.974 6.328 1.00 0.00 H new ATOM 0 HG1 THR A 74 9.610 -6.763 4.088 1.00 0.00 H new ATOM 0 HG21 THR A 74 7.383 -6.592 6.343 1.00 0.00 H new ATOM 0 HG22 THR A 74 8.166 -5.637 7.625 1.00 0.00 H new ATOM 0 HG23 THR A 74 7.643 -4.846 6.119 1.00 0.00 H new ATOM 1081 N GLY A 75 11.810 -4.750 4.202 1.00 0.00 N ATOM 1082 CA GLY A 75 13.022 -4.896 3.415 1.00 0.00 C ATOM 1083 C GLY A 75 12.747 -4.638 1.932 1.00 0.00 C ATOM 1084 O GLY A 75 12.097 -3.655 1.580 1.00 0.00 O ATOM 0 H GLY A 75 11.022 -4.342 3.699 1.00 0.00 H new ATOM 0 HA2 GLY A 75 13.780 -4.200 3.775 1.00 0.00 H new ATOM 0 HA3 GLY A 75 13.425 -5.900 3.544 1.00 0.00 H new ATOM 1088 N ASP A 76 13.257 -5.537 1.103 1.00 0.00 N ATOM 1089 CA ASP A 76 13.075 -5.418 -0.334 1.00 0.00 C ATOM 1090 C ASP A 76 11.593 -5.591 -0.672 1.00 0.00 C ATOM 1091 O ASP A 76 11.073 -4.920 -1.561 1.00 0.00 O ATOM 1092 CB ASP A 76 13.860 -6.499 -1.080 1.00 0.00 C ATOM 1093 CG ASP A 76 15.220 -6.846 -0.472 1.00 0.00 C ATOM 1094 OD1 ASP A 76 15.950 -5.889 -0.133 1.00 0.00 O ATOM 1095 OD2 ASP A 76 15.500 -8.059 -0.362 1.00 0.00 O ATOM 0 H ASP A 76 13.796 -6.351 1.399 1.00 0.00 H new ATOM 0 HA ASP A 76 13.435 -4.436 -0.639 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.255 -7.405 -1.119 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.012 -6.172 -2.109 1.00 0.00 H new ATOM 1100 N SER A 77 10.955 -6.496 0.056 1.00 0.00 N ATOM 1101 CA SER A 77 9.543 -6.766 -0.155 1.00 0.00 C ATOM 1102 C SER A 77 8.758 -6.484 1.128 1.00 0.00 C ATOM 1103 O SER A 77 9.259 -6.712 2.228 1.00 0.00 O ATOM 1104 CB SER A 77 9.320 -8.211 -0.607 1.00 0.00 C ATOM 1105 OG SER A 77 9.981 -9.144 0.243 1.00 0.00 O ATOM 0 H SER A 77 11.390 -7.051 0.793 1.00 0.00 H new ATOM 0 HA SER A 77 9.184 -6.107 -0.945 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.252 -8.426 -0.620 1.00 0.00 H new ATOM 0 HB3 SER A 77 9.682 -8.331 -1.628 1.00 0.00 H new ATOM 0 HG SER A 77 9.813 -10.055 -0.078 1.00 0.00 H new ATOM 1111 N GLU A 78 7.542 -5.993 0.944 1.00 0.00 N ATOM 1112 CA GLU A 78 6.683 -5.678 2.073 1.00 0.00 C ATOM 1113 C GLU A 78 5.287 -6.267 1.859 1.00 0.00 C ATOM 1114 O GLU A 78 4.881 -6.514 0.724 1.00 0.00 O ATOM 1115 CB GLU A 78 6.612 -4.167 2.303 1.00 0.00 C ATOM 1116 CG GLU A 78 8.002 -3.587 2.569 1.00 0.00 C ATOM 1117 CD GLU A 78 8.396 -2.586 1.481 1.00 0.00 C ATOM 1118 OE1 GLU A 78 7.490 -1.855 1.027 1.00 0.00 O ATOM 1119 OE2 GLU A 78 9.595 -2.575 1.128 1.00 0.00 O ATOM 0 H GLU A 78 7.131 -5.805 0.030 1.00 0.00 H new ATOM 0 HA GLU A 78 7.112 -6.129 2.968 1.00 0.00 H new ATOM 0 HB2 GLU A 78 6.173 -3.683 1.431 1.00 0.00 H new ATOM 0 HB3 GLU A 78 5.958 -3.955 3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 78 8.015 -3.096 3.542 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.735 -4.393 2.609 1.00 0.00 H new ATOM 1126 N VAL A 79 4.591 -6.474 2.967 1.00 0.00 N ATOM 1127 CA VAL A 79 3.249 -7.029 2.914 1.00 0.00 C ATOM 1128 C VAL A 79 2.406 -6.420 4.037 1.00 0.00 C ATOM 1129 O VAL A 79 2.920 -6.125 5.114 1.00 0.00 O ATOM 1130 CB VAL A 79 3.311 -8.556 2.975 1.00 0.00 C ATOM 1131 CG1 VAL A 79 3.921 -9.028 4.297 1.00 0.00 C ATOM 1132 CG2 VAL A 79 1.926 -9.170 2.759 1.00 0.00 C ATOM 0 H VAL A 79 4.931 -6.268 3.906 1.00 0.00 H new ATOM 0 HA VAL A 79 2.767 -6.774 1.970 1.00 0.00 H new ATOM 0 HB VAL A 79 3.958 -8.898 2.167 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.953 -10.117 4.314 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.933 -8.633 4.392 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.312 -8.670 5.127 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.998 -10.257 2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 79 1.246 -8.817 3.535 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.546 -8.875 1.781 1.00 0.00 H new ATOM 1142 N TYR A 80 1.124 -6.249 3.745 1.00 0.00 N ATOM 1143 CA TYR A 80 0.205 -5.680 4.716 1.00 0.00 C ATOM 1144 C TYR A 80 -1.191 -6.288 4.571 1.00 0.00 C ATOM 1145 O TYR A 80 -1.675 -6.480 3.456 1.00 0.00 O ATOM 1146 CB TYR A 80 0.133 -4.185 4.402 1.00 0.00 C ATOM 1147 CG TYR A 80 -0.377 -3.329 5.564 1.00 0.00 C ATOM 1148 CD1 TYR A 80 -1.707 -3.382 5.928 1.00 0.00 C ATOM 1149 CD2 TYR A 80 0.493 -2.505 6.248 1.00 0.00 C ATOM 1150 CE1 TYR A 80 -2.187 -2.577 7.021 1.00 0.00 C ATOM 1151 CE2 TYR A 80 0.014 -1.700 7.341 1.00 0.00 C ATOM 1152 CZ TYR A 80 -1.303 -1.776 7.674 1.00 0.00 C ATOM 1153 OH TYR A 80 -1.756 -1.015 8.707 1.00 0.00 O ATOM 0 H TYR A 80 0.701 -6.495 2.850 1.00 0.00 H new ATOM 0 HA TYR A 80 0.548 -5.878 5.732 1.00 0.00 H new ATOM 0 HB2 TYR A 80 1.125 -3.836 4.115 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -0.519 -4.036 3.541 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.388 -4.027 5.393 1.00 0.00 H new ATOM 0 HD2 TYR A 80 1.534 -2.464 5.963 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -3.226 -2.609 7.316 1.00 0.00 H new ATOM 0 HE2 TYR A 80 0.685 -1.051 7.884 1.00 0.00 H new ATOM 0 HH TYR A 80 -1.014 -0.494 9.080 1.00 0.00 H new ATOM 1163 N THR A 81 -1.799 -6.574 5.713 1.00 0.00 N ATOM 1164 CA THR A 81 -3.130 -7.156 5.726 1.00 0.00 C ATOM 1165 C THR A 81 -4.158 -6.125 6.196 1.00 0.00 C ATOM 1166 O THR A 81 -4.221 -5.800 7.380 1.00 0.00 O ATOM 1167 CB THR A 81 -3.088 -8.413 6.599 1.00 0.00 C ATOM 1168 OG1 THR A 81 -2.367 -9.357 5.812 1.00 0.00 O ATOM 1169 CG2 THR A 81 -4.468 -9.050 6.775 1.00 0.00 C ATOM 0 H THR A 81 -1.394 -6.414 6.635 1.00 0.00 H new ATOM 0 HA THR A 81 -3.444 -7.448 4.724 1.00 0.00 H new ATOM 0 HB THR A 81 -2.677 -8.163 7.577 1.00 0.00 H new ATOM 0 HG1 THR A 81 -2.291 -10.202 6.303 1.00 0.00 H new ATOM 0 HG21 THR A 81 -4.382 -9.937 7.402 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.141 -8.335 7.248 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.866 -9.332 5.800 1.00 0.00 H new ATOM 1177 N LEU A 82 -4.940 -5.640 5.242 1.00 0.00 N ATOM 1178 CA LEU A 82 -5.962 -4.652 5.543 1.00 0.00 C ATOM 1179 C LEU A 82 -7.176 -5.352 6.157 1.00 0.00 C ATOM 1180 O LEU A 82 -7.930 -6.025 5.456 1.00 0.00 O ATOM 1181 CB LEU A 82 -6.293 -3.827 4.298 1.00 0.00 C ATOM 1182 CG LEU A 82 -5.171 -2.932 3.768 1.00 0.00 C ATOM 1183 CD1 LEU A 82 -4.527 -2.132 4.902 1.00 0.00 C ATOM 1184 CD2 LEU A 82 -4.140 -3.750 2.987 1.00 0.00 C ATOM 0 H LEU A 82 -4.886 -5.913 4.261 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.597 -3.939 6.282 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.592 -4.510 3.503 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -7.156 -3.200 4.521 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.606 -2.214 3.073 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.733 -1.504 4.499 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -5.280 -1.504 5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.109 -2.818 5.639 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.353 -3.090 2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -3.705 -4.506 3.641 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.627 -4.237 2.142 1.00 0.00 H new ATOM 1196 N ASP A 83 -7.328 -5.170 7.461 1.00 0.00 N ATOM 1197 CA ASP A 83 -8.437 -5.775 8.177 1.00 0.00 C ATOM 1198 C ASP A 83 -9.620 -4.805 8.192 1.00 0.00 C ATOM 1199 O ASP A 83 -9.556 -3.734 7.590 1.00 0.00 O ATOM 1200 CB ASP A 83 -8.056 -6.079 9.628 1.00 0.00 C ATOM 1201 CG ASP A 83 -7.137 -5.047 10.284 1.00 0.00 C ATOM 1202 OD1 ASP A 83 -7.618 -3.915 10.502 1.00 0.00 O ATOM 1203 OD2 ASP A 83 -5.972 -5.415 10.553 1.00 0.00 O ATOM 0 H ASP A 83 -6.701 -4.612 8.040 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.698 -6.704 7.670 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.969 -6.158 10.219 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -7.568 -7.053 9.663 1.00 0.00 H new ATOM 1208 N ASN A 84 -10.671 -5.214 8.887 1.00 0.00 N ATOM 1209 CA ASN A 84 -11.866 -4.393 8.988 1.00 0.00 C ATOM 1210 C ASN A 84 -12.456 -4.184 7.592 1.00 0.00 C ATOM 1211 O ASN A 84 -12.810 -3.065 7.225 1.00 0.00 O ATOM 1212 CB ASN A 84 -11.542 -3.018 9.575 1.00 0.00 C ATOM 1213 CG ASN A 84 -11.596 -3.048 11.104 1.00 0.00 C ATOM 1214 OD1 ASN A 84 -12.498 -3.604 11.709 1.00 0.00 O ATOM 1215 ND2 ASN A 84 -10.581 -2.421 11.693 1.00 0.00 N ATOM 0 H ASN A 84 -10.720 -6.103 9.385 1.00 0.00 H new ATOM 0 HA ASN A 84 -12.573 -4.906 9.640 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.551 -2.704 9.249 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -12.251 -2.281 9.197 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -10.525 -2.385 12.711 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -9.859 -1.976 11.127 1.00 0.00 H new ATOM 1222 N LEU A 85 -12.544 -5.279 6.851 1.00 0.00 N ATOM 1223 CA LEU A 85 -13.084 -5.230 5.504 1.00 0.00 C ATOM 1224 C LEU A 85 -14.464 -5.890 5.488 1.00 0.00 C ATOM 1225 O LEU A 85 -14.846 -6.563 6.445 1.00 0.00 O ATOM 1226 CB LEU A 85 -12.098 -5.844 4.508 1.00 0.00 C ATOM 1227 CG LEU A 85 -10.657 -5.337 4.592 1.00 0.00 C ATOM 1228 CD1 LEU A 85 -9.776 -6.010 3.538 1.00 0.00 C ATOM 1229 CD2 LEU A 85 -10.606 -3.811 4.493 1.00 0.00 C ATOM 0 H LEU A 85 -12.250 -6.206 7.159 1.00 0.00 H new ATOM 0 HA LEU A 85 -13.220 -4.196 5.186 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -12.091 -6.924 4.653 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -12.469 -5.660 3.500 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.256 -5.610 5.568 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -8.757 -5.631 3.620 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.777 -7.088 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.166 -5.791 2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -9.570 -3.477 4.555 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.033 -3.494 3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -11.178 -3.374 5.311 1.00 0.00 H new ATOM 1241 N LYS A 86 -15.176 -5.675 4.392 1.00 0.00 N ATOM 1242 CA LYS A 86 -16.506 -6.240 4.239 1.00 0.00 C ATOM 1243 C LYS A 86 -16.386 -7.720 3.868 1.00 0.00 C ATOM 1244 O LYS A 86 -15.298 -8.291 3.920 1.00 0.00 O ATOM 1245 CB LYS A 86 -17.326 -5.420 3.241 1.00 0.00 C ATOM 1246 CG LYS A 86 -18.749 -5.194 3.755 1.00 0.00 C ATOM 1247 CD LYS A 86 -19.740 -5.083 2.595 1.00 0.00 C ATOM 1248 CE LYS A 86 -20.646 -3.862 2.763 1.00 0.00 C ATOM 1249 NZ LYS A 86 -21.850 -3.989 1.912 1.00 0.00 N ATOM 0 H LYS A 86 -14.857 -5.117 3.600 1.00 0.00 H new ATOM 0 HA LYS A 86 -17.052 -6.190 5.181 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.841 -4.459 3.069 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -17.360 -5.936 2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -19.039 -6.017 4.408 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -18.783 -4.285 4.355 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -19.196 -5.010 1.653 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -20.347 -5.987 2.543 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -20.941 -3.761 3.808 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -20.100 -2.957 2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -22.454 -3.152 2.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -21.564 -4.063 0.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -22.379 -4.842 2.184 1.00 0.00 H new ATOM 1263 N LYS A 87 -17.521 -8.298 3.501 1.00 0.00 N ATOM 1264 CA LYS A 87 -17.557 -9.700 3.122 1.00 0.00 C ATOM 1265 C LYS A 87 -18.085 -9.823 1.691 1.00 0.00 C ATOM 1266 O LYS A 87 -19.037 -9.140 1.316 1.00 0.00 O ATOM 1267 CB LYS A 87 -18.355 -10.512 4.144 1.00 0.00 C ATOM 1268 CG LYS A 87 -17.706 -10.440 5.528 1.00 0.00 C ATOM 1269 CD LYS A 87 -18.630 -11.026 6.597 1.00 0.00 C ATOM 1270 CE LYS A 87 -18.355 -12.518 6.802 1.00 0.00 C ATOM 1271 NZ LYS A 87 -17.919 -12.778 8.192 1.00 0.00 N ATOM 0 H LYS A 87 -18.422 -7.821 3.458 1.00 0.00 H new ATOM 0 HA LYS A 87 -16.552 -10.122 3.129 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.376 -10.134 4.197 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -18.416 -11.551 3.821 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.762 -10.985 5.520 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.474 -9.403 5.771 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -18.487 -10.494 7.537 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -19.670 -10.881 6.303 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -19.255 -13.093 6.583 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -17.586 -12.851 6.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.737 -13.795 8.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.048 -12.244 8.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -18.665 -12.478 8.852 1.00 0.00 H new ATOM 1285 N PHE A 88 -17.446 -10.700 0.931 1.00 0.00 N ATOM 1286 CA PHE A 88 -17.839 -10.921 -0.450 1.00 0.00 C ATOM 1287 C PHE A 88 -18.067 -9.593 -1.175 1.00 0.00 C ATOM 1288 O PHE A 88 -18.965 -9.483 -2.008 1.00 0.00 O ATOM 1289 CB PHE A 88 -19.154 -11.704 -0.420 1.00 0.00 C ATOM 1290 CG PHE A 88 -19.612 -12.203 -1.792 1.00 0.00 C ATOM 1291 CD1 PHE A 88 -18.705 -12.712 -2.669 1.00 0.00 C ATOM 1292 CD2 PHE A 88 -20.927 -12.137 -2.135 1.00 0.00 C ATOM 1293 CE1 PHE A 88 -19.131 -13.174 -3.942 1.00 0.00 C ATOM 1294 CE2 PHE A 88 -21.352 -12.599 -3.409 1.00 0.00 C ATOM 1295 CZ PHE A 88 -20.445 -13.108 -4.285 1.00 0.00 C ATOM 0 H PHE A 88 -16.658 -11.266 1.246 1.00 0.00 H new ATOM 0 HA PHE A 88 -17.054 -11.462 -0.978 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -19.041 -12.559 0.247 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -19.933 -11.070 0.003 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -17.661 -12.765 -2.397 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -21.647 -11.733 -1.439 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -18.411 -13.578 -4.638 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -22.396 -12.546 -3.682 1.00 0.00 H new ATOM 0 HZ PHE A 88 -20.768 -13.460 -5.253 1.00 0.00 H new ATOM 1305 N ALA A 89 -17.238 -8.619 -0.831 1.00 0.00 N ATOM 1306 CA ALA A 89 -17.337 -7.302 -1.439 1.00 0.00 C ATOM 1307 C ALA A 89 -16.005 -6.951 -2.104 1.00 0.00 C ATOM 1308 O ALA A 89 -14.942 -7.300 -1.595 1.00 0.00 O ATOM 1309 CB ALA A 89 -17.747 -6.280 -0.377 1.00 0.00 C ATOM 0 H ALA A 89 -16.495 -8.715 -0.139 1.00 0.00 H new ATOM 0 HA ALA A 89 -18.104 -7.293 -2.214 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -17.821 -5.292 -0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -18.713 -6.560 0.043 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -16.999 -6.259 0.416 1.00 0.00 H new ATOM 1315 N GLN A 90 -16.107 -6.264 -3.233 1.00 0.00 N ATOM 1316 CA GLN A 90 -14.924 -5.861 -3.973 1.00 0.00 C ATOM 1317 C GLN A 90 -14.226 -4.697 -3.266 1.00 0.00 C ATOM 1318 O GLN A 90 -14.874 -3.733 -2.862 1.00 0.00 O ATOM 1319 CB GLN A 90 -15.278 -5.493 -5.415 1.00 0.00 C ATOM 1320 CG GLN A 90 -14.031 -5.074 -6.197 1.00 0.00 C ATOM 1321 CD GLN A 90 -14.379 -4.752 -7.652 1.00 0.00 C ATOM 1322 OE1 GLN A 90 -14.935 -5.559 -8.378 1.00 0.00 O ATOM 1323 NE2 GLN A 90 -14.021 -3.529 -8.035 1.00 0.00 N ATOM 0 H GLN A 90 -16.991 -5.977 -3.653 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.236 -6.706 -4.007 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -15.750 -6.344 -5.906 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -16.004 -4.680 -5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -13.578 -4.202 -5.726 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -13.291 -5.874 -6.165 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -13.558 -2.903 -7.376 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -14.209 -3.217 -8.988 1.00 0.00 H new ATOM 1332 N TYR A 91 -12.913 -4.826 -3.139 1.00 0.00 N ATOM 1333 CA TYR A 91 -12.121 -3.797 -2.488 1.00 0.00 C ATOM 1334 C TYR A 91 -10.878 -3.457 -3.314 1.00 0.00 C ATOM 1335 O TYR A 91 -10.122 -4.348 -3.699 1.00 0.00 O ATOM 1336 CB TYR A 91 -11.681 -4.388 -1.147 1.00 0.00 C ATOM 1337 CG TYR A 91 -12.596 -4.022 0.024 1.00 0.00 C ATOM 1338 CD1 TYR A 91 -12.351 -2.881 0.760 1.00 0.00 C ATOM 1339 CD2 TYR A 91 -13.665 -4.834 0.344 1.00 0.00 C ATOM 1340 CE1 TYR A 91 -13.212 -2.536 1.862 1.00 0.00 C ATOM 1341 CE2 TYR A 91 -14.525 -4.490 1.446 1.00 0.00 C ATOM 1342 CZ TYR A 91 -14.256 -3.358 2.150 1.00 0.00 C ATOM 1343 OH TYR A 91 -15.069 -3.033 3.191 1.00 0.00 O ATOM 0 H TYR A 91 -12.379 -5.627 -3.476 1.00 0.00 H new ATOM 0 HA TYR A 91 -12.702 -2.882 -2.371 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -11.639 -5.474 -1.236 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -10.670 -4.047 -0.925 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -11.514 -2.247 0.510 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -13.856 -5.727 -0.232 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -13.032 -1.645 2.446 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -15.365 -5.117 1.708 1.00 0.00 H new ATOM 0 HH TYR A 91 -15.094 -2.059 3.295 1.00 0.00 H new ATOM 1353 N GLY A 92 -10.706 -2.167 -3.562 1.00 0.00 N ATOM 1354 CA GLY A 92 -9.568 -1.699 -4.335 1.00 0.00 C ATOM 1355 C GLY A 92 -8.587 -0.923 -3.453 1.00 0.00 C ATOM 1356 O GLY A 92 -8.970 0.044 -2.796 1.00 0.00 O ATOM 0 H GLY A 92 -11.336 -1.431 -3.241 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.059 -2.549 -4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.914 -1.061 -5.148 1.00 0.00 H new ATOM 1360 N VAL A 93 -7.342 -1.376 -3.467 1.00 0.00 N ATOM 1361 CA VAL A 93 -6.305 -0.736 -2.677 1.00 0.00 C ATOM 1362 C VAL A 93 -5.066 -0.520 -3.548 1.00 0.00 C ATOM 1363 O VAL A 93 -4.917 -1.157 -4.590 1.00 0.00 O ATOM 1364 CB VAL A 93 -6.016 -1.565 -1.423 1.00 0.00 C ATOM 1365 CG1 VAL A 93 -6.316 -3.046 -1.663 1.00 0.00 C ATOM 1366 CG2 VAL A 93 -4.573 -1.366 -0.955 1.00 0.00 C ATOM 0 H VAL A 93 -7.028 -2.178 -4.013 1.00 0.00 H new ATOM 0 HA VAL A 93 -6.637 0.244 -2.334 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.677 -1.214 -0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.102 -3.612 -0.756 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.367 -3.166 -1.927 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.693 -3.416 -2.477 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -4.394 -1.966 -0.063 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.888 -1.676 -1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -4.407 -0.314 -0.724 1.00 0.00 H new ATOM 1376 N VAL A 94 -4.209 0.381 -3.090 1.00 0.00 N ATOM 1377 CA VAL A 94 -2.988 0.689 -3.815 1.00 0.00 C ATOM 1378 C VAL A 94 -1.803 0.653 -2.848 1.00 0.00 C ATOM 1379 O VAL A 94 -1.987 0.513 -1.640 1.00 0.00 O ATOM 1380 CB VAL A 94 -3.132 2.031 -4.536 1.00 0.00 C ATOM 1381 CG1 VAL A 94 -4.173 1.944 -5.654 1.00 0.00 C ATOM 1382 CG2 VAL A 94 -3.478 3.148 -3.550 1.00 0.00 C ATOM 0 H VAL A 94 -4.336 0.908 -2.226 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.801 -0.060 -4.585 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.171 2.272 -4.991 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.256 2.911 -6.150 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.867 1.189 -6.378 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -5.139 1.669 -5.231 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.575 4.091 -4.088 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -4.420 2.916 -3.053 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.686 3.234 -2.806 1.00 0.00 H new ATOM 1392 N VAL A 95 -0.613 0.782 -3.416 1.00 0.00 N ATOM 1393 CA VAL A 95 0.602 0.767 -2.620 1.00 0.00 C ATOM 1394 C VAL A 95 1.616 1.739 -3.225 1.00 0.00 C ATOM 1395 O VAL A 95 1.743 1.830 -4.445 1.00 0.00 O ATOM 1396 CB VAL A 95 1.137 -0.663 -2.509 1.00 0.00 C ATOM 1397 CG1 VAL A 95 2.283 -0.742 -1.498 1.00 0.00 C ATOM 1398 CG2 VAL A 95 0.018 -1.640 -2.147 1.00 0.00 C ATOM 0 H VAL A 95 -0.465 0.897 -4.419 1.00 0.00 H new ATOM 0 HA VAL A 95 0.397 1.103 -1.604 1.00 0.00 H new ATOM 0 HB VAL A 95 1.530 -0.951 -3.484 1.00 0.00 H new ATOM 0 HG11 VAL A 95 2.645 -1.768 -1.438 1.00 0.00 H new ATOM 0 HG12 VAL A 95 3.095 -0.089 -1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 95 1.926 -0.425 -0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.425 -2.649 -2.074 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.418 -1.355 -1.190 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.752 -1.614 -2.919 1.00 0.00 H new ATOM 1408 N GLN A 96 2.313 2.442 -2.344 1.00 0.00 N ATOM 1409 CA GLN A 96 3.312 3.405 -2.776 1.00 0.00 C ATOM 1410 C GLN A 96 4.465 3.459 -1.773 1.00 0.00 C ATOM 1411 O GLN A 96 4.266 3.233 -0.580 1.00 0.00 O ATOM 1412 CB GLN A 96 2.690 4.789 -2.973 1.00 0.00 C ATOM 1413 CG GLN A 96 1.494 4.991 -2.040 1.00 0.00 C ATOM 1414 CD GLN A 96 0.754 6.289 -2.370 1.00 0.00 C ATOM 1415 OE1 GLN A 96 0.057 6.400 -3.365 1.00 0.00 O ATOM 1416 NE2 GLN A 96 0.944 7.261 -1.483 1.00 0.00 N ATOM 0 H GLN A 96 2.206 2.364 -1.333 1.00 0.00 H new ATOM 0 HA GLN A 96 3.709 3.081 -3.738 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.438 5.558 -2.782 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.371 4.904 -4.009 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.811 4.146 -2.130 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.836 5.016 -1.005 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.541 7.101 -0.671 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.493 8.167 -1.614 1.00 0.00 H new ATOM 1425 N ALA A 97 5.646 3.761 -2.293 1.00 0.00 N ATOM 1426 CA ALA A 97 6.831 3.848 -1.457 1.00 0.00 C ATOM 1427 C ALA A 97 6.997 5.287 -0.963 1.00 0.00 C ATOM 1428 O ALA A 97 6.956 6.227 -1.754 1.00 0.00 O ATOM 1429 CB ALA A 97 8.048 3.359 -2.245 1.00 0.00 C ATOM 0 H ALA A 97 5.807 3.948 -3.283 1.00 0.00 H new ATOM 0 HA ALA A 97 6.730 3.208 -0.581 1.00 0.00 H new ATOM 0 HB1 ALA A 97 8.937 3.424 -1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 97 7.893 2.324 -2.549 1.00 0.00 H new ATOM 0 HB3 ALA A 97 8.182 3.980 -3.130 1.00 0.00 H new ATOM 1435 N PHE A 98 7.180 5.412 0.344 1.00 0.00 N ATOM 1436 CA PHE A 98 7.352 6.720 0.953 1.00 0.00 C ATOM 1437 C PHE A 98 8.644 6.779 1.769 1.00 0.00 C ATOM 1438 O PHE A 98 8.922 5.882 2.564 1.00 0.00 O ATOM 1439 CB PHE A 98 6.161 6.937 1.889 1.00 0.00 C ATOM 1440 CG PHE A 98 6.360 6.362 3.293 1.00 0.00 C ATOM 1441 CD1 PHE A 98 7.243 6.945 4.148 1.00 0.00 C ATOM 1442 CD2 PHE A 98 5.654 5.268 3.686 1.00 0.00 C ATOM 1443 CE1 PHE A 98 7.428 6.411 5.450 1.00 0.00 C ATOM 1444 CE2 PHE A 98 5.839 4.734 4.989 1.00 0.00 C ATOM 1445 CZ PHE A 98 6.722 5.317 5.843 1.00 0.00 C ATOM 0 H PHE A 98 7.213 4.629 0.997 1.00 0.00 H new ATOM 0 HA PHE A 98 7.407 7.486 0.180 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.966 8.006 1.970 1.00 0.00 H new ATOM 0 HB3 PHE A 98 5.275 6.484 1.444 1.00 0.00 H new ATOM 0 HD1 PHE A 98 7.803 7.814 3.836 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.953 4.805 3.007 1.00 0.00 H new ATOM 0 HE1 PHE A 98 8.129 6.873 6.129 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.279 3.865 5.301 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.863 4.911 6.834 1.00 0.00 H new ATOM 1455 N ASN A 99 9.400 7.844 1.545 1.00 0.00 N ATOM 1456 CA ASN A 99 10.657 8.032 2.250 1.00 0.00 C ATOM 1457 C ASN A 99 10.641 9.387 2.960 1.00 0.00 C ATOM 1458 O ASN A 99 9.682 10.146 2.833 1.00 0.00 O ATOM 1459 CB ASN A 99 11.840 8.020 1.279 1.00 0.00 C ATOM 1460 CG ASN A 99 11.501 8.777 -0.007 1.00 0.00 C ATOM 1461 OD1 ASN A 99 10.601 9.599 -0.055 1.00 0.00 O ATOM 1462 ND2 ASN A 99 12.270 8.455 -1.042 1.00 0.00 N ATOM 0 H ASN A 99 9.166 8.586 0.885 1.00 0.00 H new ATOM 0 HA ASN A 99 10.769 7.216 2.964 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.710 8.474 1.754 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.108 6.991 1.040 1.00 0.00 H new ATOM 0 HD21 ASN A 99 12.124 8.905 -1.946 1.00 0.00 H new ATOM 0 HD22 ASN A 99 13.006 7.758 -0.933 1.00 0.00 H new ATOM 1469 N ARG A 100 11.714 9.648 3.692 1.00 0.00 N ATOM 1470 CA ARG A 100 11.835 10.898 4.422 1.00 0.00 C ATOM 1471 C ARG A 100 11.745 12.085 3.461 1.00 0.00 C ATOM 1472 O ARG A 100 11.403 13.194 3.869 1.00 0.00 O ATOM 1473 CB ARG A 100 13.162 10.966 5.182 1.00 0.00 C ATOM 1474 CG ARG A 100 13.194 9.946 6.321 1.00 0.00 C ATOM 1475 CD ARG A 100 13.237 10.644 7.682 1.00 0.00 C ATOM 1476 NE ARG A 100 14.231 9.986 8.558 1.00 0.00 N ATOM 1477 CZ ARG A 100 14.564 10.424 9.779 1.00 0.00 C ATOM 1478 NH1 ARG A 100 13.984 11.525 10.277 1.00 0.00 N ATOM 1479 NH2 ARG A 100 15.477 9.763 10.504 1.00 0.00 N ATOM 0 H ARG A 100 12.507 9.015 3.795 1.00 0.00 H new ATOM 0 HA ARG A 100 11.015 10.943 5.139 1.00 0.00 H new ATOM 0 HB2 ARG A 100 13.988 10.777 4.496 1.00 0.00 H new ATOM 0 HB3 ARG A 100 13.304 11.969 5.583 1.00 0.00 H new ATOM 0 HG2 ARG A 100 12.314 9.305 6.265 1.00 0.00 H new ATOM 0 HG3 ARG A 100 14.066 9.301 6.212 1.00 0.00 H new ATOM 0 HD2 ARG A 100 13.494 11.695 7.553 1.00 0.00 H new ATOM 0 HD3 ARG A 100 12.252 10.612 8.148 1.00 0.00 H new ATOM 0 HE ARG A 100 14.692 9.145 8.210 1.00 0.00 H new ATOM 0 HH11 ARG A 100 13.289 12.029 9.726 1.00 0.00 H new ATOM 0 HH12 ARG A 100 14.237 11.859 11.207 1.00 0.00 H new ATOM 0 HH21 ARG A 100 15.919 8.925 10.126 1.00 0.00 H new ATOM 0 HH22 ARG A 100 15.730 10.098 11.434 1.00 0.00 H new ATOM 1493 N ALA A 101 12.058 11.812 2.203 1.00 0.00 N ATOM 1494 CA ALA A 101 12.016 12.844 1.181 1.00 0.00 C ATOM 1495 C ALA A 101 10.558 13.155 0.836 1.00 0.00 C ATOM 1496 O ALA A 101 10.248 14.248 0.362 1.00 0.00 O ATOM 1497 CB ALA A 101 12.819 12.387 -0.039 1.00 0.00 C ATOM 0 H ALA A 101 12.342 10.891 1.868 1.00 0.00 H new ATOM 0 HA ALA A 101 12.472 13.764 1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 101 12.788 13.161 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 101 13.854 12.207 0.253 1.00 0.00 H new ATOM 0 HB3 ALA A 101 12.388 11.467 -0.434 1.00 0.00 H new ATOM 1503 N GLY A 102 9.702 12.176 1.086 1.00 0.00 N ATOM 1504 CA GLY A 102 8.284 12.332 0.808 1.00 0.00 C ATOM 1505 C GLY A 102 7.665 11.007 0.358 1.00 0.00 C ATOM 1506 O GLY A 102 8.175 9.937 0.685 1.00 0.00 O ATOM 0 H GLY A 102 9.963 11.271 1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 102 7.772 12.692 1.700 1.00 0.00 H new ATOM 0 HA3 GLY A 102 8.142 13.086 0.033 1.00 0.00 H new ATOM 1510 N THR A 103 6.575 11.123 -0.386 1.00 0.00 N ATOM 1511 CA THR A 103 5.881 9.948 -0.885 1.00 0.00 C ATOM 1512 C THR A 103 5.851 9.956 -2.415 1.00 0.00 C ATOM 1513 O THR A 103 5.892 11.017 -3.035 1.00 0.00 O ATOM 1514 CB THR A 103 4.489 9.916 -0.250 1.00 0.00 C ATOM 1515 OG1 THR A 103 4.726 10.219 1.122 1.00 0.00 O ATOM 1516 CG2 THR A 103 3.890 8.508 -0.223 1.00 0.00 C ATOM 0 H THR A 103 6.155 12.013 -0.655 1.00 0.00 H new ATOM 0 HA THR A 103 6.402 9.032 -0.606 1.00 0.00 H new ATOM 0 HB THR A 103 3.824 10.583 -0.799 1.00 0.00 H new ATOM 0 HG1 THR A 103 3.875 10.221 1.608 1.00 0.00 H new ATOM 0 HG21 THR A 103 2.903 8.541 0.237 1.00 0.00 H new ATOM 0 HG22 THR A 103 3.803 8.130 -1.242 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.537 7.848 0.355 1.00 0.00 H new ATOM 1524 N GLY A 104 5.779 8.759 -2.979 1.00 0.00 N ATOM 1525 CA GLY A 104 5.743 8.615 -4.424 1.00 0.00 C ATOM 1526 C GLY A 104 4.314 8.377 -4.916 1.00 0.00 C ATOM 1527 O GLY A 104 3.364 8.465 -4.140 1.00 0.00 O ATOM 0 H GLY A 104 5.745 7.881 -2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 104 6.148 9.512 -4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 104 6.379 7.783 -4.726 1.00 0.00 H new ATOM 1531 N PRO A 105 4.203 8.073 -6.237 1.00 0.00 N ATOM 1532 CA PRO A 105 2.906 7.823 -6.842 1.00 0.00 C ATOM 1533 C PRO A 105 2.373 6.445 -6.445 1.00 0.00 C ATOM 1534 O PRO A 105 3.138 5.576 -6.029 1.00 0.00 O ATOM 1535 CB PRO A 105 3.136 7.962 -8.338 1.00 0.00 C ATOM 1536 CG PRO A 105 4.636 7.826 -8.544 1.00 0.00 C ATOM 1537 CD PRO A 105 5.307 7.961 -7.187 1.00 0.00 C ATOM 0 HA PRO A 105 2.142 8.523 -6.503 1.00 0.00 H new ATOM 0 HB2 PRO A 105 2.595 7.193 -8.889 1.00 0.00 H new ATOM 0 HB3 PRO A 105 2.778 8.926 -8.700 1.00 0.00 H new ATOM 0 HG2 PRO A 105 4.874 6.862 -8.993 1.00 0.00 H new ATOM 0 HG3 PRO A 105 4.999 8.594 -9.227 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.933 7.096 -6.967 1.00 0.00 H new ATOM 0 HD3 PRO A 105 5.952 8.839 -7.150 1.00 0.00 H new ATOM 1545 N SER A 106 1.065 6.288 -6.588 1.00 0.00 N ATOM 1546 CA SER A 106 0.421 5.030 -6.249 1.00 0.00 C ATOM 1547 C SER A 106 0.694 3.992 -7.340 1.00 0.00 C ATOM 1548 O SER A 106 1.204 4.328 -8.407 1.00 0.00 O ATOM 1549 CB SER A 106 -1.085 5.217 -6.058 1.00 0.00 C ATOM 1550 OG SER A 106 -1.666 5.982 -7.111 1.00 0.00 O ATOM 0 H SER A 106 0.434 7.011 -6.934 1.00 0.00 H new ATOM 0 HA SER A 106 0.838 4.675 -5.307 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.568 4.241 -6.010 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.271 5.712 -5.105 1.00 0.00 H new ATOM 0 HG SER A 106 -2.629 6.078 -6.953 1.00 0.00 H new ATOM 1556 N SER A 107 0.341 2.752 -7.034 1.00 0.00 N ATOM 1557 CA SER A 107 0.541 1.664 -7.975 1.00 0.00 C ATOM 1558 C SER A 107 -0.784 1.305 -8.649 1.00 0.00 C ATOM 1559 O SER A 107 -1.854 1.621 -8.131 1.00 0.00 O ATOM 1560 CB SER A 107 1.132 0.436 -7.279 1.00 0.00 C ATOM 1561 OG SER A 107 0.136 -0.536 -6.974 1.00 0.00 O ATOM 0 H SER A 107 -0.082 2.477 -6.148 1.00 0.00 H new ATOM 0 HA SER A 107 1.250 1.994 -8.734 1.00 0.00 H new ATOM 0 HB2 SER A 107 1.892 -0.012 -7.919 1.00 0.00 H new ATOM 0 HB3 SER A 107 1.630 0.745 -6.360 1.00 0.00 H new ATOM 0 HG SER A 107 0.044 -1.157 -7.726 1.00 0.00 H new ATOM 1567 N SER A 108 -0.670 0.648 -9.795 1.00 0.00 N ATOM 1568 CA SER A 108 -1.847 0.243 -10.545 1.00 0.00 C ATOM 1569 C SER A 108 -2.906 -0.319 -9.595 1.00 0.00 C ATOM 1570 O SER A 108 -2.676 -1.328 -8.930 1.00 0.00 O ATOM 1571 CB SER A 108 -1.489 -0.793 -11.613 1.00 0.00 C ATOM 1572 OG SER A 108 -0.079 -0.926 -11.776 1.00 0.00 O ATOM 0 H SER A 108 0.219 0.386 -10.222 1.00 0.00 H new ATOM 0 HA SER A 108 -2.250 1.121 -11.049 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.915 -1.758 -11.339 1.00 0.00 H new ATOM 0 HB3 SER A 108 -1.938 -0.504 -12.563 1.00 0.00 H new ATOM 0 HG SER A 108 0.293 -0.083 -12.109 1.00 0.00 H new ATOM 1578 N GLU A 109 -4.043 0.359 -9.560 1.00 0.00 N ATOM 1579 CA GLU A 109 -5.139 -0.059 -8.702 1.00 0.00 C ATOM 1580 C GLU A 109 -5.573 -1.484 -9.053 1.00 0.00 C ATOM 1581 O GLU A 109 -5.539 -1.878 -10.218 1.00 0.00 O ATOM 1582 CB GLU A 109 -6.316 0.913 -8.802 1.00 0.00 C ATOM 1583 CG GLU A 109 -7.406 0.559 -7.789 1.00 0.00 C ATOM 1584 CD GLU A 109 -8.725 1.252 -8.139 1.00 0.00 C ATOM 1585 OE1 GLU A 109 -8.868 2.431 -7.749 1.00 0.00 O ATOM 1586 OE2 GLU A 109 -9.561 0.586 -8.788 1.00 0.00 O ATOM 0 H GLU A 109 -4.230 1.196 -10.112 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.790 -0.050 -7.669 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -5.968 1.931 -8.626 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.729 0.887 -9.810 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -7.552 -0.521 -7.769 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -7.089 0.856 -6.789 1.00 0.00 H new ATOM 1593 N ILE A 110 -5.971 -2.217 -8.024 1.00 0.00 N ATOM 1594 CA ILE A 110 -6.411 -3.590 -8.209 1.00 0.00 C ATOM 1595 C ILE A 110 -7.697 -3.820 -7.413 1.00 0.00 C ATOM 1596 O ILE A 110 -8.255 -2.883 -6.842 1.00 0.00 O ATOM 1597 CB ILE A 110 -5.287 -4.565 -7.855 1.00 0.00 C ATOM 1598 CG1 ILE A 110 -4.240 -3.895 -6.962 1.00 0.00 C ATOM 1599 CG2 ILE A 110 -4.664 -5.165 -9.118 1.00 0.00 C ATOM 1600 CD1 ILE A 110 -3.056 -4.831 -6.710 1.00 0.00 C ATOM 0 H ILE A 110 -5.998 -1.887 -7.059 1.00 0.00 H new ATOM 0 HA ILE A 110 -6.646 -3.777 -9.257 1.00 0.00 H new ATOM 0 HB ILE A 110 -5.716 -5.389 -7.285 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -3.889 -2.977 -7.433 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -4.694 -3.613 -6.012 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -3.868 -5.855 -8.838 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.428 -5.702 -9.681 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.252 -4.366 -9.735 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -2.326 -4.331 -6.073 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -3.407 -5.738 -6.217 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.590 -5.092 -7.660 1.00 0.00 H new ATOM 1612 N ASN A 111 -8.132 -5.071 -7.400 1.00 0.00 N ATOM 1613 CA ASN A 111 -9.342 -5.436 -6.683 1.00 0.00 C ATOM 1614 C ASN A 111 -9.261 -6.907 -6.269 1.00 0.00 C ATOM 1615 O ASN A 111 -8.677 -7.724 -6.979 1.00 0.00 O ATOM 1616 CB ASN A 111 -10.579 -5.261 -7.566 1.00 0.00 C ATOM 1617 CG ASN A 111 -10.935 -3.782 -7.724 1.00 0.00 C ATOM 1618 OD1 ASN A 111 -11.762 -3.236 -7.011 1.00 0.00 O ATOM 1619 ND2 ASN A 111 -10.268 -3.165 -8.695 1.00 0.00 N ATOM 0 H ASN A 111 -7.668 -5.845 -7.875 1.00 0.00 H new ATOM 0 HA ASN A 111 -9.426 -4.787 -5.811 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -10.396 -5.701 -8.546 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -11.421 -5.797 -7.128 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -10.435 -2.176 -8.880 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -9.589 -3.681 -9.255 1.00 0.00 H new ATOM 1626 N ALA A 112 -9.855 -7.199 -5.122 1.00 0.00 N ATOM 1627 CA ALA A 112 -9.857 -8.557 -4.605 1.00 0.00 C ATOM 1628 C ALA A 112 -11.105 -8.769 -3.745 1.00 0.00 C ATOM 1629 O ALA A 112 -11.068 -8.571 -2.531 1.00 0.00 O ATOM 1630 CB ALA A 112 -8.564 -8.810 -3.828 1.00 0.00 C ATOM 0 H ALA A 112 -10.338 -6.519 -4.536 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.893 -9.278 -5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -8.566 -9.829 -3.440 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -7.709 -8.675 -4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -8.494 -8.106 -2.999 1.00 0.00 H new ATOM 1636 N THR A 113 -12.181 -9.168 -4.407 1.00 0.00 N ATOM 1637 CA THR A 113 -13.437 -9.409 -3.718 1.00 0.00 C ATOM 1638 C THR A 113 -13.259 -10.482 -2.643 1.00 0.00 C ATOM 1639 O THR A 113 -13.144 -11.667 -2.955 1.00 0.00 O ATOM 1640 CB THR A 113 -14.490 -9.770 -4.768 1.00 0.00 C ATOM 1641 OG1 THR A 113 -14.495 -8.653 -5.653 1.00 0.00 O ATOM 1642 CG2 THR A 113 -15.907 -9.794 -4.192 1.00 0.00 C ATOM 0 H THR A 113 -12.209 -9.330 -5.414 1.00 0.00 H new ATOM 0 HA THR A 113 -13.775 -8.518 -3.190 1.00 0.00 H new ATOM 0 HB THR A 113 -14.255 -10.744 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 113 -15.150 -8.804 -6.367 1.00 0.00 H new ATOM 0 HG21 THR A 113 -16.615 -10.055 -4.978 1.00 0.00 H new ATOM 0 HG22 THR A 113 -15.963 -10.534 -3.393 1.00 0.00 H new ATOM 0 HG23 THR A 113 -16.154 -8.810 -3.793 1.00 0.00 H new ATOM 1650 N THR A 114 -13.241 -10.030 -1.398 1.00 0.00 N ATOM 1651 CA THR A 114 -13.078 -10.936 -0.274 1.00 0.00 C ATOM 1652 C THR A 114 -13.900 -12.209 -0.492 1.00 0.00 C ATOM 1653 O THR A 114 -14.884 -12.197 -1.230 1.00 0.00 O ATOM 1654 CB THR A 114 -13.455 -10.181 1.002 1.00 0.00 C ATOM 1655 OG1 THR A 114 -14.816 -9.811 0.797 1.00 0.00 O ATOM 1656 CG2 THR A 114 -12.722 -8.844 1.129 1.00 0.00 C ATOM 0 H THR A 114 -13.337 -9.047 -1.143 1.00 0.00 H new ATOM 0 HA THR A 114 -12.043 -11.266 -0.179 1.00 0.00 H new ATOM 0 HB THR A 114 -13.232 -10.802 1.870 1.00 0.00 H new ATOM 0 HG1 THR A 114 -15.142 -9.318 1.578 1.00 0.00 H new ATOM 0 HG21 THR A 114 -13.025 -8.349 2.051 1.00 0.00 H new ATOM 0 HG22 THR A 114 -11.646 -9.019 1.148 1.00 0.00 H new ATOM 0 HG23 THR A 114 -12.971 -8.210 0.278 1.00 0.00 H new ATOM 1664 N LEU A 115 -13.465 -13.275 0.163 1.00 0.00 N ATOM 1665 CA LEU A 115 -14.147 -14.553 0.050 1.00 0.00 C ATOM 1666 C LEU A 115 -15.650 -14.342 0.245 1.00 0.00 C ATOM 1667 O LEU A 115 -16.090 -13.239 0.565 1.00 0.00 O ATOM 1668 CB LEU A 115 -13.539 -15.572 1.015 1.00 0.00 C ATOM 1669 CG LEU A 115 -12.051 -15.871 0.825 1.00 0.00 C ATOM 1670 CD1 LEU A 115 -11.580 -15.449 -0.569 1.00 0.00 C ATOM 1671 CD2 LEU A 115 -11.216 -15.223 1.932 1.00 0.00 C ATOM 0 H LEU A 115 -12.648 -13.280 0.774 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.010 -14.972 -0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.690 -15.213 2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -14.092 -16.507 0.921 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.907 -16.949 0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -10.519 -15.673 -0.678 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.145 -15.995 -1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -11.740 -14.379 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.162 -15.451 1.773 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -11.361 -14.143 1.912 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.530 -15.613 2.900 1.00 0.00 H new ATOM 1683 N GLU A 116 -16.397 -15.417 0.043 1.00 0.00 N ATOM 1684 CA GLU A 116 -17.842 -15.364 0.193 1.00 0.00 C ATOM 1685 C GLU A 116 -18.246 -15.805 1.601 1.00 0.00 C ATOM 1686 O GLU A 116 -19.426 -15.786 1.947 1.00 0.00 O ATOM 1687 CB GLU A 116 -18.535 -16.220 -0.869 1.00 0.00 C ATOM 1688 CG GLU A 116 -19.993 -16.487 -0.492 1.00 0.00 C ATOM 1689 CD GLU A 116 -20.757 -17.109 -1.662 1.00 0.00 C ATOM 1690 OE1 GLU A 116 -20.784 -16.462 -2.731 1.00 0.00 O ATOM 1691 OE2 GLU A 116 -21.297 -18.219 -1.462 1.00 0.00 O ATOM 0 H GLU A 116 -16.029 -16.330 -0.223 1.00 0.00 H new ATOM 0 HA GLU A 116 -18.165 -14.333 0.049 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -18.492 -15.714 -1.834 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -18.005 -17.166 -0.981 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -20.033 -17.154 0.369 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -20.472 -15.554 -0.195 1.00 0.00 H new ATOM 1698 N SER A 117 -17.243 -16.191 2.377 1.00 0.00 N ATOM 1699 CA SER A 117 -17.480 -16.636 3.740 1.00 0.00 C ATOM 1700 C SER A 117 -18.547 -17.732 3.755 1.00 0.00 C ATOM 1701 O SER A 117 -19.742 -17.440 3.758 1.00 0.00 O ATOM 1702 CB SER A 117 -17.904 -15.469 4.634 1.00 0.00 C ATOM 1703 OG SER A 117 -16.824 -14.578 4.897 1.00 0.00 O ATOM 0 H SER A 117 -16.265 -16.205 2.088 1.00 0.00 H new ATOM 0 HA SER A 117 -16.548 -17.041 4.135 1.00 0.00 H new ATOM 0 HB2 SER A 117 -18.717 -14.922 4.155 1.00 0.00 H new ATOM 0 HB3 SER A 117 -18.292 -15.856 5.576 1.00 0.00 H new ATOM 0 HG SER A 117 -16.902 -13.790 4.319 1.00 0.00 H new ATOM 1709 N GLY A 118 -18.077 -18.971 3.764 1.00 0.00 N ATOM 1710 CA GLY A 118 -18.976 -20.112 3.779 1.00 0.00 C ATOM 1711 C GLY A 118 -18.592 -21.099 4.883 1.00 0.00 C ATOM 1712 O GLY A 118 -17.841 -20.755 5.794 1.00 0.00 O ATOM 0 H GLY A 118 -17.085 -19.209 3.761 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -20.000 -19.771 3.932 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -18.948 -20.614 2.812 1.00 0.00 H new ATOM 1716 N PRO A 119 -19.137 -22.339 4.761 1.00 0.00 N ATOM 1717 CA PRO A 119 -18.859 -23.378 5.737 1.00 0.00 C ATOM 1718 C PRO A 119 -17.449 -23.943 5.550 1.00 0.00 C ATOM 1719 O PRO A 119 -17.285 -25.121 5.238 1.00 0.00 O ATOM 1720 CB PRO A 119 -19.948 -24.418 5.527 1.00 0.00 C ATOM 1721 CG PRO A 119 -20.516 -24.151 4.142 1.00 0.00 C ATOM 1722 CD PRO A 119 -20.031 -22.782 3.695 1.00 0.00 C ATOM 0 HA PRO A 119 -18.874 -23.007 6.762 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -19.543 -25.428 5.595 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -20.722 -24.333 6.290 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -20.190 -24.919 3.441 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -21.605 -24.182 4.164 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -19.510 -22.839 2.739 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -20.863 -22.091 3.563 1.00 0.00 H new ATOM 1730 N SER A 120 -16.468 -23.075 5.750 1.00 0.00 N ATOM 1731 CA SER A 120 -15.077 -23.473 5.607 1.00 0.00 C ATOM 1732 C SER A 120 -14.922 -24.415 4.412 1.00 0.00 C ATOM 1733 O SER A 120 -15.036 -25.631 4.557 1.00 0.00 O ATOM 1734 CB SER A 120 -14.563 -24.144 6.883 1.00 0.00 C ATOM 1735 OG SER A 120 -13.161 -23.953 7.058 1.00 0.00 O ATOM 0 H SER A 120 -16.608 -22.099 6.010 1.00 0.00 H new ATOM 0 HA SER A 120 -14.481 -22.577 5.434 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.094 -23.740 7.745 1.00 0.00 H new ATOM 0 HB3 SER A 120 -14.782 -25.211 6.845 1.00 0.00 H new ATOM 0 HG SER A 120 -12.871 -24.394 7.884 1.00 0.00 H new ATOM 1741 N SER A 121 -14.666 -23.818 3.258 1.00 0.00 N ATOM 1742 CA SER A 121 -14.494 -24.589 2.038 1.00 0.00 C ATOM 1743 C SER A 121 -13.011 -24.895 1.817 1.00 0.00 C ATOM 1744 O SER A 121 -12.209 -23.985 1.616 1.00 0.00 O ATOM 1745 CB SER A 121 -15.068 -23.845 0.831 1.00 0.00 C ATOM 1746 OG SER A 121 -16.404 -23.407 1.060 1.00 0.00 O ATOM 0 H SER A 121 -14.573 -22.809 3.141 1.00 0.00 H new ATOM 0 HA SER A 121 -15.040 -25.526 2.146 1.00 0.00 H new ATOM 0 HB2 SER A 121 -14.439 -22.985 0.602 1.00 0.00 H new ATOM 0 HB3 SER A 121 -15.045 -24.498 -0.042 1.00 0.00 H new ATOM 0 HG SER A 121 -16.734 -22.935 0.267 1.00 0.00 H new ATOM 1752 N GLY A 122 -12.692 -26.181 1.862 1.00 0.00 N ATOM 1753 CA GLY A 122 -11.320 -26.618 1.669 1.00 0.00 C ATOM 1754 C GLY A 122 -11.107 -28.021 2.241 1.00 0.00 C ATOM 1755 O GLY A 122 -10.076 -28.296 2.853 1.00 0.00 O ATOM 0 H GLY A 122 -13.360 -26.933 2.029 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.079 -26.614 0.606 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -10.640 -25.917 2.152 1.00 0.00 H new TER 1759 GLY A 122