USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 994 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 107 SER OG : rot -12:sc= 0.241 USER MOD Set 1.2: A 113 THR OG1 : rot 116:sc= 0.0813 USER MOD Set 2.1: A 73 HIS : no HE2:sc= -1.64! C(o=-1.1!,f=-13!) USER MOD Set 2.2: A 85 SER OG : rot -116:sc= 0.536 USER MOD Set 3.1: A 55 LYS NZ :NH3+ -146:sc= 1.06 (180deg=0.39) USER MOD Set 3.2: A 82 TYR OH : rot 33:sc= -1.18 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 160:sc= -2.67! USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0104 X(o=-0.01,f=-0.17) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -44:sc= -6.33! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.123 K(o=-0.12,f=-2.1!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 58:sc= -0.35 USER MOD Single : A 53 THR OG1 : rot 59:sc= -4.32! USER MOD Single : A 56 LYS NZ :NH3+ -160:sc= -0.133 (180deg=-0.749) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 168:sc= 0.3 USER MOD Single : A 69 LYS NZ :NH3+ -169:sc= 1.24 (180deg=1.17) USER MOD Single : A 70 HIS :FLIP no HD1:sc= -7.75! C(o=-8.7!,f=-7.7!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -14:sc= 1 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.496 X(o=-0.5,f=-0.045) USER MOD Single : A 80 HIS : no HE2:sc= -3.2! C(o=-3.2!,f=-3.9!) USER MOD Single : A 81 THR OG1 : rot 46:sc= 0.769 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 109:sc= 0.741 USER MOD Single : A 93 SER OG : rot 41:sc= 0.121 USER MOD Single : A 95 ASN : amide:sc= -3.37! C(o=-3.4!,f=-15!) USER MOD Single : A 98 LYS NZ :NH3+ 158:sc= -0.186 (180deg=-1.27!) USER MOD Single : A 101 TYR OH : rot 30:sc= -0.211 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -0.0615 X(o=-0.061,f=-0.061) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 77:sc= 0.764 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= -2.45! C(o=-2.5!,f=-3.8!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -1.65 K(o=-1.6,f=-3.3!) USER MOD Single : A 146 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00106) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -7.662 -1.213 18.672 1.00 0.00 N ATOM 9 CA VAL A 3 -6.314 -1.485 18.097 1.00 0.00 C ATOM 10 C VAL A 3 -5.881 -0.302 17.228 1.00 0.00 C ATOM 11 O VAL A 3 -6.669 0.268 16.501 1.00 0.00 O ATOM 12 CB VAL A 3 -6.370 -2.750 17.240 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.283 -2.510 16.036 1.00 0.00 C ATOM 14 CG2 VAL A 3 -4.963 -3.096 16.750 1.00 0.00 C ATOM 0 HA VAL A 3 -5.597 -1.625 18.906 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.762 -3.575 17.835 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -7.323 -3.411 15.425 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.286 -2.262 16.384 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -6.891 -1.685 15.441 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.002 -3.998 16.139 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.572 -2.271 16.155 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.311 -3.266 17.607 1.00 0.00 H new ATOM 24 N TYR A 4 -4.632 0.070 17.299 1.00 0.00 N ATOM 25 CA TYR A 4 -4.148 1.213 16.476 1.00 0.00 C ATOM 26 C TYR A 4 -3.202 0.694 15.391 1.00 0.00 C ATOM 27 O TYR A 4 -2.581 -0.339 15.540 1.00 0.00 O ATOM 28 CB TYR A 4 -3.404 2.208 17.370 1.00 0.00 C ATOM 29 CG TYR A 4 -4.340 2.725 18.436 1.00 0.00 C ATOM 30 CD1 TYR A 4 -5.246 3.749 18.134 1.00 0.00 C ATOM 31 CD2 TYR A 4 -4.302 2.181 19.725 1.00 0.00 C ATOM 32 CE1 TYR A 4 -6.114 4.230 19.122 1.00 0.00 C ATOM 33 CE2 TYR A 4 -5.170 2.662 20.713 1.00 0.00 C ATOM 34 CZ TYR A 4 -6.076 3.686 20.412 1.00 0.00 C ATOM 35 OH TYR A 4 -6.930 4.159 21.386 1.00 0.00 O ATOM 0 H TYR A 4 -3.927 -0.368 17.891 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.998 1.711 16.010 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -2.542 1.725 17.831 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -3.024 3.036 16.772 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -5.275 4.168 17.139 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.604 1.391 19.958 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -6.812 5.020 18.889 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -5.141 2.243 21.708 1.00 0.00 H new ATOM 0 HH TYR A 4 -6.774 3.673 22.222 1.00 0.00 H new ATOM 45 N THR A 5 -3.089 1.400 14.300 1.00 0.00 N ATOM 46 CA THR A 5 -2.184 0.942 13.208 1.00 0.00 C ATOM 47 C THR A 5 -0.815 1.605 13.367 1.00 0.00 C ATOM 48 O THR A 5 -0.712 2.767 13.705 1.00 0.00 O ATOM 49 CB THR A 5 -2.785 1.327 11.854 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.136 0.894 11.797 1.00 0.00 O ATOM 51 CG2 THR A 5 -1.985 0.661 10.733 1.00 0.00 C ATOM 0 H THR A 5 -3.583 2.273 14.117 1.00 0.00 H new ATOM 0 HA THR A 5 -2.070 -0.141 13.260 1.00 0.00 H new ATOM 0 HB THR A 5 -2.746 2.409 11.732 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.612 1.397 11.103 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.413 0.935 9.769 1.00 0.00 H new ATOM 0 HG22 THR A 5 -0.948 0.995 10.778 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.023 -0.422 10.852 1.00 0.00 H new ATOM 59 N TYR A 6 0.239 0.873 13.125 1.00 0.00 N ATOM 60 CA TYR A 6 1.602 1.460 13.262 1.00 0.00 C ATOM 61 C TYR A 6 2.250 1.568 11.880 1.00 0.00 C ATOM 62 O TYR A 6 2.126 0.685 11.055 1.00 0.00 O ATOM 63 CB TYR A 6 2.457 0.561 14.157 1.00 0.00 C ATOM 64 CG TYR A 6 1.848 0.500 15.537 1.00 0.00 C ATOM 65 CD1 TYR A 6 1.567 1.683 16.232 1.00 0.00 C ATOM 66 CD2 TYR A 6 1.563 -0.740 16.123 1.00 0.00 C ATOM 67 CE1 TYR A 6 1.002 1.625 17.512 1.00 0.00 C ATOM 68 CE2 TYR A 6 0.998 -0.797 17.403 1.00 0.00 C ATOM 69 CZ TYR A 6 0.718 0.386 18.097 1.00 0.00 C ATOM 70 OH TYR A 6 0.162 0.330 19.358 1.00 0.00 O ATOM 0 H TYR A 6 0.215 -0.106 12.839 1.00 0.00 H new ATOM 0 HA TYR A 6 1.528 2.452 13.708 1.00 0.00 H new ATOM 0 HB2 TYR A 6 2.520 -0.440 13.731 1.00 0.00 H new ATOM 0 HB3 TYR A 6 3.474 0.948 14.214 1.00 0.00 H new ATOM 0 HD1 TYR A 6 1.786 2.640 15.781 1.00 0.00 H new ATOM 0 HD2 TYR A 6 1.779 -1.653 15.587 1.00 0.00 H new ATOM 0 HE1 TYR A 6 0.785 2.537 18.048 1.00 0.00 H new ATOM 0 HE2 TYR A 6 0.778 -1.753 17.855 1.00 0.00 H new ATOM 0 HH TYR A 6 0.028 -0.606 19.615 1.00 0.00 H new ATOM 80 N GLU A 7 2.943 2.643 11.622 1.00 0.00 N ATOM 81 CA GLU A 7 3.599 2.805 10.294 1.00 0.00 C ATOM 82 C GLU A 7 5.119 2.775 10.471 1.00 0.00 C ATOM 83 O GLU A 7 5.654 3.320 11.415 1.00 0.00 O ATOM 84 CB GLU A 7 3.183 4.142 9.679 1.00 0.00 C ATOM 85 CG GLU A 7 3.868 4.314 8.321 1.00 0.00 C ATOM 86 CD GLU A 7 3.541 5.698 7.757 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.898 6.464 8.456 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.940 5.969 6.637 1.00 0.00 O ATOM 0 H GLU A 7 3.083 3.416 12.273 1.00 0.00 H new ATOM 0 HA GLU A 7 3.293 1.992 9.635 1.00 0.00 H new ATOM 0 HB2 GLU A 7 2.100 4.178 9.559 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.458 4.961 10.343 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.947 4.199 8.428 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.532 3.540 7.631 1.00 0.00 H new ATOM 95 N ASN A 8 5.819 2.139 9.571 1.00 0.00 N ATOM 96 CA ASN A 8 7.303 2.074 9.690 1.00 0.00 C ATOM 97 C ASN A 8 7.943 2.481 8.362 1.00 0.00 C ATOM 98 O ASN A 8 7.315 2.447 7.322 1.00 0.00 O ATOM 99 CB ASN A 8 7.723 0.646 10.042 1.00 0.00 C ATOM 100 CG ASN A 8 8.965 0.682 10.934 1.00 0.00 C ATOM 101 OD1 ASN A 8 8.956 1.292 11.985 1.00 0.00 O ATOM 102 ND2 ASN A 8 10.044 0.051 10.556 1.00 0.00 N ATOM 0 H ASN A 8 5.427 1.662 8.759 1.00 0.00 H new ATOM 0 HA ASN A 8 7.634 2.755 10.474 1.00 0.00 H new ATOM 0 HB2 ASN A 8 6.909 0.133 10.555 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.932 0.083 9.132 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.878 0.070 11.143 1.00 0.00 H new ATOM 0 HD22 ASN A 8 10.053 -0.461 9.674 1.00 0.00 H new ATOM 109 N GLU A 9 9.191 2.864 8.388 1.00 0.00 N ATOM 110 CA GLU A 9 9.874 3.271 7.126 1.00 0.00 C ATOM 111 C GLU A 9 11.327 2.791 7.158 1.00 0.00 C ATOM 112 O GLU A 9 12.038 3.001 8.121 1.00 0.00 O ATOM 113 CB GLU A 9 9.841 4.795 6.996 1.00 0.00 C ATOM 114 CG GLU A 9 10.189 5.190 5.560 1.00 0.00 C ATOM 115 CD GLU A 9 10.150 6.714 5.426 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.781 7.364 6.391 1.00 0.00 O ATOM 117 OE2 GLU A 9 10.488 7.205 4.362 1.00 0.00 O ATOM 0 H GLU A 9 9.767 2.913 9.228 1.00 0.00 H new ATOM 0 HA GLU A 9 9.362 2.824 6.274 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.853 5.172 7.259 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.550 5.246 7.691 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.179 4.817 5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.483 4.735 4.865 1.00 0.00 H new ATOM 124 N PHE A 10 11.774 2.149 6.113 1.00 0.00 N ATOM 125 CA PHE A 10 13.179 1.658 6.089 1.00 0.00 C ATOM 126 C PHE A 10 13.759 1.833 4.684 1.00 0.00 C ATOM 127 O PHE A 10 13.091 1.610 3.694 1.00 0.00 O ATOM 128 CB PHE A 10 13.209 0.176 6.468 1.00 0.00 C ATOM 129 CG PHE A 10 14.641 -0.301 6.523 1.00 0.00 C ATOM 130 CD1 PHE A 10 15.400 -0.105 7.682 1.00 0.00 C ATOM 131 CD2 PHE A 10 15.208 -0.941 5.413 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.728 -0.547 7.732 1.00 0.00 C ATOM 133 CE2 PHE A 10 16.535 -1.383 5.464 1.00 0.00 C ATOM 134 CZ PHE A 10 17.295 -1.186 6.624 1.00 0.00 C ATOM 0 H PHE A 10 11.227 1.944 5.277 1.00 0.00 H new ATOM 0 HA PHE A 10 13.773 2.229 6.802 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.728 0.027 7.434 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.648 -0.408 5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.962 0.387 8.538 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.622 -1.093 4.519 1.00 0.00 H new ATOM 0 HE1 PHE A 10 17.314 -0.395 8.626 1.00 0.00 H new ATOM 0 HE2 PHE A 10 16.973 -1.876 4.609 1.00 0.00 H new ATOM 0 HZ PHE A 10 18.319 -1.527 6.663 1.00 0.00 H new ATOM 144 N THR A 11 14.999 2.229 4.589 1.00 0.00 N ATOM 145 CA THR A 11 15.622 2.414 3.249 1.00 0.00 C ATOM 146 C THR A 11 16.289 1.107 2.815 1.00 0.00 C ATOM 147 O THR A 11 16.845 0.388 3.620 1.00 0.00 O ATOM 148 CB THR A 11 16.674 3.523 3.323 1.00 0.00 C ATOM 149 OG1 THR A 11 17.835 3.027 3.975 1.00 0.00 O ATOM 150 CG2 THR A 11 16.114 4.711 4.107 1.00 0.00 C ATOM 0 H THR A 11 15.607 2.432 5.382 1.00 0.00 H new ATOM 0 HA THR A 11 14.855 2.690 2.526 1.00 0.00 H new ATOM 0 HB THR A 11 16.932 3.847 2.315 1.00 0.00 H new ATOM 0 HG1 THR A 11 18.511 3.735 4.022 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.865 5.499 4.158 1.00 0.00 H new ATOM 0 HG22 THR A 11 15.223 5.090 3.606 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.854 4.391 5.116 1.00 0.00 H new ATOM 158 N SER A 12 16.238 0.792 1.549 1.00 0.00 N ATOM 159 CA SER A 12 16.870 -0.471 1.073 1.00 0.00 C ATOM 160 C SER A 12 17.542 -0.230 -0.280 1.00 0.00 C ATOM 161 O SER A 12 17.246 0.724 -0.971 1.00 0.00 O ATOM 162 CB SER A 12 15.797 -1.552 0.921 1.00 0.00 C ATOM 163 OG SER A 12 14.943 -1.222 -0.165 1.00 0.00 O ATOM 0 H SER A 12 15.787 1.353 0.826 1.00 0.00 H new ATOM 0 HA SER A 12 17.617 -0.797 1.797 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.264 -2.522 0.749 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.218 -1.636 1.840 1.00 0.00 H new ATOM 0 HG SER A 12 14.715 -0.270 -0.124 1.00 0.00 H new ATOM 169 N ASP A 13 18.443 -1.091 -0.664 1.00 0.00 N ATOM 170 CA ASP A 13 19.133 -0.917 -1.973 1.00 0.00 C ATOM 171 C ASP A 13 18.208 -1.385 -3.098 1.00 0.00 C ATOM 172 O ASP A 13 17.099 -1.821 -2.859 1.00 0.00 O ATOM 173 CB ASP A 13 20.418 -1.747 -1.986 1.00 0.00 C ATOM 174 CG ASP A 13 21.369 -1.202 -3.052 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.025 -0.209 -3.673 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.426 -1.785 -3.231 1.00 0.00 O ATOM 0 H ASP A 13 18.732 -1.909 -0.127 1.00 0.00 H new ATOM 0 HA ASP A 13 19.381 0.134 -2.120 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.895 -1.713 -1.007 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.186 -2.792 -2.191 1.00 0.00 H new ATOM 181 N ILE A 14 18.649 -1.299 -4.323 1.00 0.00 N ATOM 182 CA ILE A 14 17.784 -1.741 -5.454 1.00 0.00 C ATOM 183 C ILE A 14 16.602 -0.778 -5.591 1.00 0.00 C ATOM 184 O ILE A 14 16.061 -0.307 -4.610 1.00 0.00 O ATOM 185 CB ILE A 14 17.267 -3.153 -5.173 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.391 -3.997 -4.566 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.798 -3.796 -6.479 1.00 0.00 C ATOM 188 CD1 ILE A 14 17.979 -4.469 -3.171 1.00 0.00 C ATOM 0 H ILE A 14 19.567 -0.943 -4.589 1.00 0.00 H new ATOM 0 HA ILE A 14 18.359 -1.744 -6.380 1.00 0.00 H new ATOM 0 HB ILE A 14 16.432 -3.100 -4.474 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.601 -4.855 -5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.308 -3.411 -4.507 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.430 -4.802 -6.278 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.997 -3.197 -6.913 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.632 -3.848 -7.179 1.00 0.00 H new ATOM 0 HD11 ILE A 14 18.779 -5.070 -2.739 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.791 -3.604 -2.535 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.073 -5.070 -3.243 1.00 0.00 H new ATOM 200 N PRO A 15 16.198 -0.477 -6.835 1.00 0.00 N ATOM 201 CA PRO A 15 15.081 0.436 -7.102 1.00 0.00 C ATOM 202 C PRO A 15 13.732 -0.164 -6.688 1.00 0.00 C ATOM 203 O PRO A 15 13.519 -1.358 -6.757 1.00 0.00 O ATOM 204 CB PRO A 15 15.134 0.637 -8.616 1.00 0.00 C ATOM 205 CG PRO A 15 15.815 -0.582 -9.135 1.00 0.00 C ATOM 206 CD PRO A 15 16.796 -1.002 -8.075 1.00 0.00 C ATOM 0 HA PRO A 15 15.169 1.363 -6.536 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.134 0.742 -9.037 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.686 1.540 -8.877 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.094 -1.375 -9.334 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.325 -0.372 -10.075 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.911 -2.085 -8.039 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.786 -0.582 -8.254 1.00 0.00 H new ATOM 214 N ALA A 16 12.827 0.667 -6.249 1.00 0.00 N ATOM 215 CA ALA A 16 11.486 0.179 -5.812 1.00 0.00 C ATOM 216 C ALA A 16 10.955 -0.914 -6.750 1.00 0.00 C ATOM 217 O ALA A 16 10.524 -1.957 -6.302 1.00 0.00 O ATOM 218 CB ALA A 16 10.505 1.352 -5.803 1.00 0.00 C ATOM 0 H ALA A 16 12.960 1.675 -6.173 1.00 0.00 H new ATOM 0 HA ALA A 16 11.585 -0.246 -4.813 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.523 1.003 -5.485 1.00 0.00 H new ATOM 0 HB2 ALA A 16 10.859 2.117 -5.112 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.433 1.773 -6.806 1.00 0.00 H new ATOM 224 N PRO A 17 10.958 -0.673 -8.074 1.00 0.00 N ATOM 225 CA PRO A 17 10.442 -1.646 -9.050 1.00 0.00 C ATOM 226 C PRO A 17 11.245 -2.952 -9.073 1.00 0.00 C ATOM 227 O PRO A 17 10.686 -4.029 -9.006 1.00 0.00 O ATOM 228 CB PRO A 17 10.566 -0.912 -10.387 1.00 0.00 C ATOM 229 CG PRO A 17 11.637 0.095 -10.156 1.00 0.00 C ATOM 230 CD PRO A 17 11.462 0.546 -8.734 1.00 0.00 C ATOM 0 HA PRO A 17 9.424 -1.954 -8.810 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.831 -1.596 -11.193 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.627 -0.436 -10.668 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.625 -0.339 -10.311 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.545 0.932 -10.848 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.401 0.886 -8.297 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.756 1.373 -8.654 1.00 0.00 H new ATOM 238 N LYS A 18 12.543 -2.877 -9.171 1.00 0.00 N ATOM 239 CA LYS A 18 13.351 -4.131 -9.201 1.00 0.00 C ATOM 240 C LYS A 18 13.133 -4.916 -7.904 1.00 0.00 C ATOM 241 O LYS A 18 13.108 -6.132 -7.903 1.00 0.00 O ATOM 242 CB LYS A 18 14.834 -3.787 -9.346 1.00 0.00 C ATOM 243 CG LYS A 18 15.088 -3.212 -10.741 1.00 0.00 C ATOM 244 CD LYS A 18 16.588 -2.978 -10.931 1.00 0.00 C ATOM 245 CE LYS A 18 16.826 -2.264 -12.263 1.00 0.00 C ATOM 246 NZ LYS A 18 17.301 -3.248 -13.276 1.00 0.00 N ATOM 0 H LYS A 18 13.077 -2.010 -9.231 1.00 0.00 H new ATOM 0 HA LYS A 18 13.037 -4.739 -10.050 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.127 -3.065 -8.584 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.442 -4.678 -9.192 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.717 -3.898 -11.502 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.544 -2.275 -10.864 1.00 0.00 H new ATOM 0 HD2 LYS A 18 16.981 -2.379 -10.109 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.121 -3.929 -10.915 1.00 0.00 H new ATOM 0 HE2 LYS A 18 15.905 -1.791 -12.604 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.564 -1.472 -12.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.463 -2.763 -14.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 18.189 -3.680 -12.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 16.583 -3.989 -13.404 1.00 0.00 H new ATOM 260 N LEU A 19 12.982 -4.236 -6.802 1.00 0.00 N ATOM 261 CA LEU A 19 12.771 -4.951 -5.510 1.00 0.00 C ATOM 262 C LEU A 19 11.302 -5.367 -5.378 1.00 0.00 C ATOM 263 O LEU A 19 10.981 -6.341 -4.727 1.00 0.00 O ATOM 264 CB LEU A 19 13.145 -4.028 -4.349 1.00 0.00 C ATOM 265 CG LEU A 19 13.011 -4.790 -3.029 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.782 -6.109 -3.123 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.583 -3.945 -1.889 1.00 0.00 C ATOM 0 H LEU A 19 12.995 -3.218 -6.739 1.00 0.00 H new ATOM 0 HA LEU A 19 13.399 -5.841 -5.487 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.166 -3.668 -4.471 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.496 -3.152 -4.343 1.00 0.00 H new ATOM 0 HG LEU A 19 11.959 -4.996 -2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.688 -6.653 -2.183 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.374 -6.712 -3.934 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.834 -5.902 -3.318 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.487 -4.489 -0.949 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.636 -3.738 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.035 -3.005 -1.822 1.00 0.00 H new ATOM 279 N PHE A 20 10.408 -4.634 -5.985 1.00 0.00 N ATOM 280 CA PHE A 20 8.964 -4.989 -5.885 1.00 0.00 C ATOM 281 C PHE A 20 8.692 -6.280 -6.661 1.00 0.00 C ATOM 282 O PHE A 20 7.869 -7.086 -6.276 1.00 0.00 O ATOM 283 CB PHE A 20 8.120 -3.855 -6.472 1.00 0.00 C ATOM 284 CG PHE A 20 6.656 -4.214 -6.373 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.930 -3.883 -5.222 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.024 -4.877 -7.431 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.574 -4.215 -5.130 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.668 -5.210 -7.340 1.00 0.00 C ATOM 289 CZ PHE A 20 3.942 -4.879 -6.189 1.00 0.00 C ATOM 0 H PHE A 20 10.615 -3.807 -6.544 1.00 0.00 H new ATOM 0 HA PHE A 20 8.702 -5.137 -4.837 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.315 -2.927 -5.935 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.394 -3.685 -7.513 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.417 -3.371 -4.405 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.584 -5.132 -8.319 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.015 -3.959 -4.242 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.181 -5.722 -8.157 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.895 -5.136 -6.118 1.00 0.00 H new ATOM 299 N LYS A 21 9.376 -6.481 -7.755 1.00 0.00 N ATOM 300 CA LYS A 21 9.152 -7.718 -8.556 1.00 0.00 C ATOM 301 C LYS A 21 9.630 -8.941 -7.768 1.00 0.00 C ATOM 302 O LYS A 21 9.024 -9.993 -7.811 1.00 0.00 O ATOM 303 CB LYS A 21 9.931 -7.623 -9.868 1.00 0.00 C ATOM 304 CG LYS A 21 9.687 -8.884 -10.699 1.00 0.00 C ATOM 305 CD LYS A 21 10.582 -8.859 -11.940 1.00 0.00 C ATOM 306 CE LYS A 21 10.218 -10.029 -12.856 1.00 0.00 C ATOM 307 NZ LYS A 21 9.180 -9.592 -13.832 1.00 0.00 N ATOM 0 H LYS A 21 10.079 -5.843 -8.128 1.00 0.00 H new ATOM 0 HA LYS A 21 8.088 -7.820 -8.768 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.618 -6.741 -10.426 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.996 -7.510 -9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.899 -9.772 -10.103 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.639 -8.941 -10.994 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.459 -7.915 -12.471 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.630 -8.925 -11.647 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.104 -10.380 -13.384 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.847 -10.866 -12.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 8.932 -10.387 -14.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 8.332 -9.277 -13.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 9.550 -8.806 -14.404 1.00 0.00 H new ATOM 321 N ALA A 22 10.713 -8.814 -7.052 1.00 0.00 N ATOM 322 CA ALA A 22 11.226 -9.974 -6.270 1.00 0.00 C ATOM 323 C ALA A 22 10.580 -9.985 -4.882 1.00 0.00 C ATOM 324 O ALA A 22 10.381 -11.028 -4.290 1.00 0.00 O ATOM 325 CB ALA A 22 12.745 -9.857 -6.125 1.00 0.00 C ATOM 0 H ALA A 22 11.264 -7.959 -6.975 1.00 0.00 H new ATOM 0 HA ALA A 22 10.979 -10.899 -6.790 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.122 -10.705 -5.553 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.205 -9.852 -7.113 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.991 -8.931 -5.605 1.00 0.00 H new ATOM 331 N PHE A 23 10.253 -8.836 -4.358 1.00 0.00 N ATOM 332 CA PHE A 23 9.621 -8.787 -3.009 1.00 0.00 C ATOM 333 C PHE A 23 8.146 -9.178 -3.120 1.00 0.00 C ATOM 334 O PHE A 23 7.482 -9.420 -2.132 1.00 0.00 O ATOM 335 CB PHE A 23 9.730 -7.368 -2.449 1.00 0.00 C ATOM 336 CG PHE A 23 9.086 -7.315 -1.084 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.837 -7.625 0.057 1.00 0.00 C ATOM 338 CD2 PHE A 23 7.738 -6.958 -0.958 1.00 0.00 C ATOM 339 CE1 PHE A 23 9.240 -7.577 1.322 1.00 0.00 C ATOM 340 CE2 PHE A 23 7.142 -6.909 0.307 1.00 0.00 C ATOM 341 CZ PHE A 23 7.891 -7.218 1.448 1.00 0.00 C ATOM 0 H PHE A 23 10.396 -7.930 -4.805 1.00 0.00 H new ATOM 0 HA PHE A 23 10.131 -9.483 -2.343 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.777 -7.072 -2.381 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.242 -6.662 -3.121 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.877 -7.901 -0.039 1.00 0.00 H new ATOM 0 HD2 PHE A 23 7.158 -6.720 -1.838 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.819 -7.817 2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 23 6.102 -6.632 0.403 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.430 -7.180 2.424 1.00 0.00 H new ATOM 351 N VAL A 24 7.626 -9.241 -4.316 1.00 0.00 N ATOM 352 CA VAL A 24 6.194 -9.615 -4.487 1.00 0.00 C ATOM 353 C VAL A 24 6.095 -10.914 -5.291 1.00 0.00 C ATOM 354 O VAL A 24 5.621 -11.921 -4.805 1.00 0.00 O ATOM 355 CB VAL A 24 5.461 -8.497 -5.232 1.00 0.00 C ATOM 356 CG1 VAL A 24 4.002 -8.900 -5.448 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.519 -7.210 -4.406 1.00 0.00 C ATOM 0 H VAL A 24 8.131 -9.050 -5.181 1.00 0.00 H new ATOM 0 HA VAL A 24 5.738 -9.760 -3.508 1.00 0.00 H new ATOM 0 HB VAL A 24 5.938 -8.330 -6.198 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.479 -8.104 -5.979 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.961 -9.816 -6.037 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.524 -9.067 -4.483 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.997 -6.413 -4.936 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.042 -7.376 -3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.559 -6.923 -4.253 1.00 0.00 H new ATOM 367 N LEU A 25 6.535 -10.898 -6.520 1.00 0.00 N ATOM 368 CA LEU A 25 6.461 -12.131 -7.354 1.00 0.00 C ATOM 369 C LEU A 25 7.371 -13.207 -6.761 1.00 0.00 C ATOM 370 O LEU A 25 7.019 -14.369 -6.704 1.00 0.00 O ATOM 371 CB LEU A 25 6.915 -11.810 -8.780 1.00 0.00 C ATOM 372 CG LEU A 25 6.098 -10.637 -9.323 1.00 0.00 C ATOM 373 CD1 LEU A 25 6.466 -10.394 -10.789 1.00 0.00 C ATOM 374 CD2 LEU A 25 4.606 -10.961 -9.221 1.00 0.00 C ATOM 0 H LEU A 25 6.942 -10.085 -6.982 1.00 0.00 H new ATOM 0 HA LEU A 25 5.434 -12.495 -7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.976 -11.562 -8.788 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.787 -12.683 -9.419 1.00 0.00 H new ATOM 0 HG LEU A 25 6.316 -9.743 -8.739 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.884 -9.558 -11.177 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.528 -10.162 -10.864 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.248 -11.289 -11.372 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.025 -10.124 -9.608 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.387 -11.856 -9.804 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.342 -11.134 -8.178 1.00 0.00 H new ATOM 386 N ASP A 26 8.541 -12.833 -6.320 1.00 0.00 N ATOM 387 CA ASP A 26 9.472 -13.838 -5.733 1.00 0.00 C ATOM 388 C ASP A 26 9.308 -13.860 -4.212 1.00 0.00 C ATOM 389 O ASP A 26 10.082 -14.472 -3.504 1.00 0.00 O ATOM 390 CB ASP A 26 10.913 -13.466 -6.087 1.00 0.00 C ATOM 391 CG ASP A 26 11.090 -13.502 -7.607 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.213 -14.026 -8.274 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.101 -13.006 -8.078 1.00 0.00 O ATOM 0 H ASP A 26 8.892 -11.876 -6.341 1.00 0.00 H new ATOM 0 HA ASP A 26 9.242 -14.824 -6.136 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.147 -12.472 -5.706 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.606 -14.161 -5.613 1.00 0.00 H new ATOM 398 N ALA A 27 8.307 -13.195 -3.702 1.00 0.00 N ATOM 399 CA ALA A 27 8.096 -13.177 -2.226 1.00 0.00 C ATOM 400 C ALA A 27 7.633 -14.558 -1.755 1.00 0.00 C ATOM 401 O ALA A 27 8.114 -15.081 -0.769 1.00 0.00 O ATOM 402 CB ALA A 27 7.028 -12.138 -1.879 1.00 0.00 C ATOM 0 H ALA A 27 7.626 -12.663 -4.244 1.00 0.00 H new ATOM 0 HA ALA A 27 9.032 -12.921 -1.730 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.872 -12.123 -0.800 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.356 -11.153 -2.212 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.094 -12.396 -2.377 1.00 0.00 H new ATOM 408 N ASP A 28 6.699 -15.149 -2.447 1.00 0.00 N ATOM 409 CA ASP A 28 6.197 -16.492 -2.035 1.00 0.00 C ATOM 410 C ASP A 28 7.315 -17.529 -2.165 1.00 0.00 C ATOM 411 O ASP A 28 7.312 -18.545 -1.499 1.00 0.00 O ATOM 412 CB ASP A 28 5.024 -16.894 -2.931 1.00 0.00 C ATOM 413 CG ASP A 28 3.829 -15.983 -2.648 1.00 0.00 C ATOM 414 OD1 ASP A 28 3.861 -15.291 -1.644 1.00 0.00 O ATOM 415 OD2 ASP A 28 2.902 -15.992 -3.441 1.00 0.00 O ATOM 0 H ASP A 28 6.260 -14.760 -3.282 1.00 0.00 H new ATOM 0 HA ASP A 28 5.868 -16.448 -0.997 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.312 -16.819 -3.980 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.753 -17.934 -2.748 1.00 0.00 H new ATOM 420 N ASN A 29 8.270 -17.287 -3.021 1.00 0.00 N ATOM 421 CA ASN A 29 9.380 -18.266 -3.191 1.00 0.00 C ATOM 422 C ASN A 29 10.619 -17.779 -2.436 1.00 0.00 C ATOM 423 O ASN A 29 11.384 -18.561 -1.911 1.00 0.00 O ATOM 424 CB ASN A 29 9.711 -18.407 -4.677 1.00 0.00 C ATOM 425 CG ASN A 29 10.546 -19.671 -4.895 1.00 0.00 C ATOM 426 OD1 ASN A 29 10.506 -20.584 -4.094 1.00 0.00 O ATOM 427 ND2 ASN A 29 11.304 -19.764 -5.952 1.00 0.00 N ATOM 0 H ASN A 29 8.329 -16.455 -3.609 1.00 0.00 H new ATOM 0 HA ASN A 29 9.072 -19.233 -2.792 1.00 0.00 H new ATOM 0 HB2 ASN A 29 8.793 -18.459 -5.262 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.260 -17.531 -5.023 1.00 0.00 H new ATOM 0 HD21 ASN A 29 11.863 -20.603 -6.106 1.00 0.00 H new ATOM 0 HD22 ASN A 29 11.338 -18.998 -6.624 1.00 0.00 H new ATOM 434 N LEU A 30 10.823 -16.492 -2.379 1.00 0.00 N ATOM 435 CA LEU A 30 12.013 -15.958 -1.660 1.00 0.00 C ATOM 436 C LEU A 30 11.783 -16.051 -0.150 1.00 0.00 C ATOM 437 O LEU A 30 12.698 -16.284 0.614 1.00 0.00 O ATOM 438 CB LEU A 30 12.230 -14.494 -2.052 1.00 0.00 C ATOM 439 CG LEU A 30 13.516 -13.977 -1.403 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.660 -14.952 -1.690 1.00 0.00 C ATOM 441 CD2 LEU A 30 13.860 -12.602 -1.980 1.00 0.00 C ATOM 0 H LEU A 30 10.217 -15.787 -2.799 1.00 0.00 H new ATOM 0 HA LEU A 30 12.892 -16.543 -1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.295 -14.403 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.380 -13.891 -1.732 1.00 0.00 H new ATOM 0 HG LEU A 30 13.372 -13.894 -0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.576 -14.584 -1.228 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.415 -15.932 -1.280 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.805 -15.036 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 30 14.776 -12.233 -1.519 1.00 0.00 H new ATOM 0 HD22 LEU A 30 14.004 -12.685 -3.057 1.00 0.00 H new ATOM 0 HD23 LEU A 30 13.045 -11.907 -1.776 1.00 0.00 H new ATOM 453 N ILE A 31 10.567 -15.871 0.286 1.00 0.00 N ATOM 454 CA ILE A 31 10.279 -15.948 1.745 1.00 0.00 C ATOM 455 C ILE A 31 10.851 -17.251 2.317 1.00 0.00 C ATOM 456 O ILE A 31 11.615 -17.234 3.261 1.00 0.00 O ATOM 457 CB ILE A 31 8.763 -15.901 1.966 1.00 0.00 C ATOM 458 CG1 ILE A 31 8.261 -14.473 1.743 1.00 0.00 C ATOM 459 CG2 ILE A 31 8.436 -16.335 3.397 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.766 -14.504 1.420 1.00 0.00 C ATOM 0 H ILE A 31 9.760 -15.674 -0.306 1.00 0.00 H new ATOM 0 HA ILE A 31 10.744 -15.104 2.254 1.00 0.00 H new ATOM 0 HB ILE A 31 8.275 -16.576 1.263 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.439 -13.870 2.633 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.811 -14.006 0.926 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.357 -16.300 3.550 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.793 -17.352 3.559 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.924 -15.662 4.102 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.407 -13.487 1.261 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.601 -15.093 0.518 1.00 0.00 H new ATOM 0 HD13 ILE A 31 6.223 -14.954 2.251 1.00 0.00 H new ATOM 472 N PRO A 32 10.472 -18.404 1.737 1.00 0.00 N ATOM 473 CA PRO A 32 10.952 -19.713 2.199 1.00 0.00 C ATOM 474 C PRO A 32 12.442 -19.914 1.905 1.00 0.00 C ATOM 475 O PRO A 32 13.097 -20.739 2.509 1.00 0.00 O ATOM 476 CB PRO A 32 10.122 -20.707 1.387 1.00 0.00 C ATOM 477 CG PRO A 32 9.732 -19.954 0.162 1.00 0.00 C ATOM 478 CD PRO A 32 9.551 -18.525 0.591 1.00 0.00 C ATOM 0 HA PRO A 32 10.845 -19.827 3.278 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.700 -21.597 1.139 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.246 -21.041 1.943 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.500 -20.036 -0.607 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.811 -20.353 -0.264 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.806 -17.828 -0.207 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.520 -18.317 0.878 1.00 0.00 H new ATOM 486 N LYS A 33 12.982 -19.168 0.980 1.00 0.00 N ATOM 487 CA LYS A 33 14.427 -19.320 0.651 1.00 0.00 C ATOM 488 C LYS A 33 15.274 -18.764 1.798 1.00 0.00 C ATOM 489 O LYS A 33 16.333 -19.274 2.105 1.00 0.00 O ATOM 490 CB LYS A 33 14.743 -18.553 -0.634 1.00 0.00 C ATOM 491 CG LYS A 33 14.200 -19.328 -1.837 1.00 0.00 C ATOM 492 CD LYS A 33 15.052 -20.577 -2.067 1.00 0.00 C ATOM 493 CE LYS A 33 14.401 -21.447 -3.145 1.00 0.00 C ATOM 494 NZ LYS A 33 15.461 -22.139 -3.931 1.00 0.00 N ATOM 0 H LYS A 33 12.485 -18.461 0.439 1.00 0.00 H new ATOM 0 HA LYS A 33 14.656 -20.376 0.509 1.00 0.00 H new ATOM 0 HB2 LYS A 33 14.297 -17.559 -0.596 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.820 -18.415 -0.733 1.00 0.00 H new ATOM 0 HG2 LYS A 33 13.162 -19.610 -1.662 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.214 -18.697 -2.726 1.00 0.00 H new ATOM 0 HD2 LYS A 33 16.059 -20.292 -2.373 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.148 -21.140 -1.139 1.00 0.00 H new ATOM 0 HE2 LYS A 33 13.738 -22.179 -2.685 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.788 -20.831 -3.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 15.020 -22.730 -4.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.077 -21.432 -4.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 16.028 -22.738 -3.297 1.00 0.00 H new ATOM 508 N ILE A 34 14.815 -17.722 2.436 1.00 0.00 N ATOM 509 CA ILE A 34 15.595 -17.135 3.562 1.00 0.00 C ATOM 510 C ILE A 34 15.377 -17.971 4.824 1.00 0.00 C ATOM 511 O ILE A 34 16.224 -18.033 5.693 1.00 0.00 O ATOM 512 CB ILE A 34 15.126 -15.701 3.814 1.00 0.00 C ATOM 513 CG1 ILE A 34 15.364 -14.857 2.561 1.00 0.00 C ATOM 514 CG2 ILE A 34 15.910 -15.106 4.985 1.00 0.00 C ATOM 515 CD1 ILE A 34 14.776 -13.459 2.767 1.00 0.00 C ATOM 0 H ILE A 34 13.934 -17.252 2.226 1.00 0.00 H new ATOM 0 HA ILE A 34 16.655 -17.132 3.307 1.00 0.00 H new ATOM 0 HB ILE A 34 14.062 -15.705 4.052 1.00 0.00 H new ATOM 0 HG12 ILE A 34 16.432 -14.787 2.354 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.903 -15.333 1.696 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.576 -14.084 5.165 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.740 -15.706 5.879 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.974 -15.103 4.747 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.946 -12.858 1.874 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.705 -13.539 2.953 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.258 -12.984 3.621 1.00 0.00 H new ATOM 527 N ALA A 35 14.247 -18.614 4.933 1.00 0.00 N ATOM 528 CA ALA A 35 13.977 -19.443 6.142 1.00 0.00 C ATOM 529 C ALA A 35 13.319 -20.760 5.723 1.00 0.00 C ATOM 530 O ALA A 35 12.184 -21.031 6.060 1.00 0.00 O ATOM 531 CB ALA A 35 13.041 -18.682 7.083 1.00 0.00 C ATOM 0 H ALA A 35 13.500 -18.601 4.239 1.00 0.00 H new ATOM 0 HA ALA A 35 14.916 -19.654 6.654 1.00 0.00 H new ATOM 0 HB1 ALA A 35 12.843 -19.288 7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.510 -17.745 7.383 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.103 -18.471 6.570 1.00 0.00 H new ATOM 537 N PRO A 36 14.053 -21.592 4.971 1.00 0.00 N ATOM 538 CA PRO A 36 13.548 -22.889 4.499 1.00 0.00 C ATOM 539 C PRO A 36 13.411 -23.895 5.646 1.00 0.00 C ATOM 540 O PRO A 36 12.412 -24.575 5.773 1.00 0.00 O ATOM 541 CB PRO A 36 14.624 -23.357 3.521 1.00 0.00 C ATOM 542 CG PRO A 36 15.866 -22.664 3.967 1.00 0.00 C ATOM 543 CD PRO A 36 15.432 -21.337 4.522 1.00 0.00 C ATOM 0 HA PRO A 36 12.556 -22.806 4.054 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.742 -24.440 3.551 1.00 0.00 H new ATOM 0 HB3 PRO A 36 14.369 -23.092 2.495 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.388 -23.250 4.724 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.557 -22.530 3.135 1.00 0.00 H new ATOM 0 HD2 PRO A 36 16.070 -21.017 5.346 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.470 -20.553 3.766 1.00 0.00 H new ATOM 551 N GLN A 37 14.410 -23.994 6.481 1.00 0.00 N ATOM 552 CA GLN A 37 14.337 -24.955 7.618 1.00 0.00 C ATOM 553 C GLN A 37 13.232 -24.520 8.583 1.00 0.00 C ATOM 554 O GLN A 37 12.705 -25.314 9.337 1.00 0.00 O ATOM 555 CB GLN A 37 15.678 -24.975 8.354 1.00 0.00 C ATOM 556 CG GLN A 37 16.765 -25.512 7.420 1.00 0.00 C ATOM 557 CD GLN A 37 18.108 -25.523 8.153 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.243 -24.933 9.206 1.00 0.00 O ATOM 559 NE2 GLN A 37 19.114 -26.175 7.637 1.00 0.00 N ATOM 0 H GLN A 37 15.272 -23.452 6.425 1.00 0.00 H new ATOM 0 HA GLN A 37 14.116 -25.952 7.238 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.936 -23.970 8.690 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.607 -25.600 9.244 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.511 -26.519 7.090 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.831 -24.891 6.527 1.00 0.00 H new ATOM 0 HE21 GLN A 37 19.001 -26.671 6.753 1.00 0.00 H new ATOM 0 HE22 GLN A 37 20.013 -26.189 8.118 1.00 0.00 H new ATOM 568 N ALA A 38 12.877 -23.264 8.567 1.00 0.00 N ATOM 569 CA ALA A 38 11.807 -22.780 9.484 1.00 0.00 C ATOM 570 C ALA A 38 10.448 -23.279 8.989 1.00 0.00 C ATOM 571 O ALA A 38 9.673 -23.843 9.736 1.00 0.00 O ATOM 572 CB ALA A 38 11.811 -21.250 9.509 1.00 0.00 C ATOM 0 H ALA A 38 13.282 -22.552 7.959 1.00 0.00 H new ATOM 0 HA ALA A 38 11.989 -23.160 10.489 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.028 -20.895 10.180 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.779 -20.894 9.861 1.00 0.00 H new ATOM 0 HB3 ALA A 38 11.628 -20.869 8.504 1.00 0.00 H new ATOM 578 N VAL A 39 10.151 -23.076 7.734 1.00 0.00 N ATOM 579 CA VAL A 39 8.842 -23.540 7.193 1.00 0.00 C ATOM 580 C VAL A 39 9.075 -24.688 6.208 1.00 0.00 C ATOM 581 O VAL A 39 10.095 -24.756 5.550 1.00 0.00 O ATOM 582 CB VAL A 39 8.151 -22.383 6.469 1.00 0.00 C ATOM 583 CG1 VAL A 39 9.077 -21.839 5.379 1.00 0.00 C ATOM 584 CG2 VAL A 39 6.852 -22.882 5.833 1.00 0.00 C ATOM 0 H VAL A 39 10.758 -22.609 7.060 1.00 0.00 H new ATOM 0 HA VAL A 39 8.212 -23.885 8.013 1.00 0.00 H new ATOM 0 HB VAL A 39 7.925 -21.591 7.183 1.00 0.00 H new ATOM 0 HG11 VAL A 39 8.586 -21.014 4.862 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.003 -21.483 5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.303 -22.631 4.665 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.359 -22.058 5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 39 7.077 -23.674 5.119 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.192 -23.270 6.609 1.00 0.00 H new ATOM 594 N LYS A 40 8.138 -25.590 6.100 1.00 0.00 N ATOM 595 CA LYS A 40 8.309 -26.732 5.156 1.00 0.00 C ATOM 596 C LYS A 40 8.143 -26.234 3.718 1.00 0.00 C ATOM 597 O LYS A 40 8.926 -26.557 2.846 1.00 0.00 O ATOM 598 CB LYS A 40 7.253 -27.800 5.449 1.00 0.00 C ATOM 599 CG LYS A 40 7.499 -29.017 4.556 1.00 0.00 C ATOM 600 CD LYS A 40 6.416 -30.067 4.814 1.00 0.00 C ATOM 601 CE LYS A 40 6.745 -31.342 4.035 1.00 0.00 C ATOM 602 NZ LYS A 40 5.600 -31.691 3.146 1.00 0.00 N ATOM 0 H LYS A 40 7.263 -25.586 6.623 1.00 0.00 H new ATOM 0 HA LYS A 40 9.304 -27.160 5.281 1.00 0.00 H new ATOM 0 HB2 LYS A 40 7.296 -28.091 6.499 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.255 -27.399 5.270 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.490 -28.720 3.507 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.484 -29.437 4.759 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.353 -30.286 5.880 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.442 -29.683 4.509 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.648 -31.196 3.442 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.946 -32.161 4.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.823 -32.558 2.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.748 -31.847 3.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.429 -30.912 2.479 1.00 0.00 H new ATOM 616 N CYS A 41 7.131 -25.452 3.463 1.00 0.00 N ATOM 617 CA CYS A 41 6.915 -24.934 2.082 1.00 0.00 C ATOM 618 C CYS A 41 5.647 -24.078 2.053 1.00 0.00 C ATOM 619 O CYS A 41 4.607 -24.477 2.537 1.00 0.00 O ATOM 620 CB CYS A 41 6.759 -26.108 1.113 1.00 0.00 C ATOM 621 SG CYS A 41 8.186 -26.165 0.000 1.00 0.00 S ATOM 0 H CYS A 41 6.443 -25.149 4.152 1.00 0.00 H new ATOM 0 HA CYS A 41 7.771 -24.329 1.783 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.679 -27.043 1.667 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.840 -25.999 0.538 1.00 0.00 H new ATOM 0 HG CYS A 41 9.276 -26.284 0.698 1.00 0.00 H new ATOM 627 N ALA A 42 5.725 -22.904 1.490 1.00 0.00 N ATOM 628 CA ALA A 42 4.523 -22.025 1.433 1.00 0.00 C ATOM 629 C ALA A 42 3.659 -22.421 0.234 1.00 0.00 C ATOM 630 O ALA A 42 4.133 -22.516 -0.881 1.00 0.00 O ATOM 631 CB ALA A 42 4.964 -20.567 1.284 1.00 0.00 C ATOM 0 H ALA A 42 6.568 -22.515 1.067 1.00 0.00 H new ATOM 0 HA ALA A 42 3.946 -22.138 2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 42 4.085 -19.924 1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.581 -20.284 2.137 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.541 -20.453 0.366 1.00 0.00 H new ATOM 637 N GLU A 43 2.395 -22.656 0.454 1.00 0.00 N ATOM 638 CA GLU A 43 1.503 -23.048 -0.673 1.00 0.00 C ATOM 639 C GLU A 43 0.324 -22.075 -0.755 1.00 0.00 C ATOM 640 O GLU A 43 -0.191 -21.623 0.249 1.00 0.00 O ATOM 641 CB GLU A 43 0.978 -24.465 -0.437 1.00 0.00 C ATOM 642 CG GLU A 43 0.188 -24.928 -1.662 1.00 0.00 C ATOM 643 CD GLU A 43 -0.415 -26.308 -1.388 1.00 0.00 C ATOM 644 OE1 GLU A 43 -0.221 -26.810 -0.292 1.00 0.00 O ATOM 645 OE2 GLU A 43 -1.060 -26.839 -2.277 1.00 0.00 O ATOM 0 H GLU A 43 1.941 -22.594 1.365 1.00 0.00 H new ATOM 0 HA GLU A 43 2.064 -23.018 -1.607 1.00 0.00 H new ATOM 0 HB2 GLU A 43 1.809 -25.145 -0.249 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.342 -24.486 0.448 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -0.602 -24.213 -1.890 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.841 -24.971 -2.534 1.00 0.00 H new ATOM 652 N ILE A 44 -0.107 -21.750 -1.943 1.00 0.00 N ATOM 653 CA ILE A 44 -1.253 -20.808 -2.089 1.00 0.00 C ATOM 654 C ILE A 44 -2.499 -21.585 -2.518 1.00 0.00 C ATOM 655 O ILE A 44 -2.529 -22.202 -3.564 1.00 0.00 O ATOM 656 CB ILE A 44 -0.917 -19.757 -3.150 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.411 -19.083 -2.801 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.026 -18.702 -3.191 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.780 -18.083 -3.898 1.00 0.00 C ATOM 0 H ILE A 44 0.285 -22.096 -2.819 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.442 -20.315 -1.136 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.835 -20.239 -4.124 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.331 -18.573 -1.841 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.196 -19.833 -2.699 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.788 -17.953 -3.946 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.974 -19.180 -3.440 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.107 -18.221 -2.216 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.726 -17.603 -3.649 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.878 -18.606 -4.849 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.001 -17.327 -3.978 1.00 0.00 H new ATOM 671 N LEU A 45 -3.528 -21.562 -1.716 1.00 0.00 N ATOM 672 CA LEU A 45 -4.771 -22.300 -2.076 1.00 0.00 C ATOM 673 C LEU A 45 -5.325 -21.757 -3.394 1.00 0.00 C ATOM 674 O LEU A 45 -5.709 -22.504 -4.272 1.00 0.00 O ATOM 675 CB LEU A 45 -5.812 -22.113 -0.970 1.00 0.00 C ATOM 676 CG LEU A 45 -7.029 -22.992 -1.262 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.664 -24.460 -1.035 1.00 0.00 C ATOM 678 CD2 LEU A 45 -8.176 -22.601 -0.327 1.00 0.00 C ATOM 0 H LEU A 45 -3.561 -21.064 -0.827 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.544 -23.360 -2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.383 -22.377 -0.003 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.111 -21.067 -0.911 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.339 -22.851 -2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.531 -25.087 -1.243 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.847 -24.739 -1.700 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.354 -24.602 0.000 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -9.044 -23.227 -0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.866 -22.742 0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.436 -21.555 -0.488 1.00 0.00 H new ATOM 690 N GLU A 46 -5.368 -20.461 -3.541 1.00 0.00 N ATOM 691 CA GLU A 46 -5.897 -19.871 -4.803 1.00 0.00 C ATOM 692 C GLU A 46 -5.392 -18.435 -4.946 1.00 0.00 C ATOM 693 O GLU A 46 -5.036 -17.793 -3.978 1.00 0.00 O ATOM 694 CB GLU A 46 -7.427 -19.872 -4.765 1.00 0.00 C ATOM 695 CG GLU A 46 -7.937 -21.314 -4.773 1.00 0.00 C ATOM 696 CD GLU A 46 -9.462 -21.315 -4.896 1.00 0.00 C ATOM 697 OE1 GLU A 46 -10.042 -20.243 -4.839 1.00 0.00 O ATOM 698 OE2 GLU A 46 -10.025 -22.388 -5.044 1.00 0.00 O ATOM 0 H GLU A 46 -5.060 -19.785 -2.842 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.554 -20.463 -5.652 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.779 -19.355 -3.872 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.823 -19.330 -5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.494 -21.863 -5.604 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.635 -21.823 -3.858 1.00 0.00 H new ATOM 705 N GLY A 47 -5.355 -17.925 -6.147 1.00 0.00 N ATOM 706 CA GLY A 47 -4.872 -16.531 -6.350 1.00 0.00 C ATOM 707 C GLY A 47 -3.470 -16.561 -6.962 1.00 0.00 C ATOM 708 O GLY A 47 -3.155 -15.800 -7.855 1.00 0.00 O ATOM 0 H GLY A 47 -5.639 -18.414 -6.996 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.555 -15.990 -7.005 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -4.854 -15.999 -5.399 1.00 0.00 H new ATOM 712 N ASP A 48 -2.626 -17.436 -6.489 1.00 0.00 N ATOM 713 CA ASP A 48 -1.245 -17.518 -7.043 1.00 0.00 C ATOM 714 C ASP A 48 -0.548 -16.164 -6.884 1.00 0.00 C ATOM 715 O ASP A 48 0.201 -15.737 -7.740 1.00 0.00 O ATOM 716 CB ASP A 48 -1.313 -17.885 -8.527 1.00 0.00 C ATOM 717 CG ASP A 48 -1.826 -19.320 -8.672 1.00 0.00 C ATOM 718 OD1 ASP A 48 -1.927 -19.998 -7.663 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.110 -19.716 -9.791 1.00 0.00 O ATOM 0 H ASP A 48 -2.833 -18.099 -5.742 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.683 -18.281 -6.504 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.973 -17.196 -9.054 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.327 -17.792 -8.982 1.00 0.00 H new ATOM 724 N GLY A 49 -0.788 -15.486 -5.794 1.00 0.00 N ATOM 725 CA GLY A 49 -0.136 -14.163 -5.582 1.00 0.00 C ATOM 726 C GLY A 49 -0.973 -13.065 -6.243 1.00 0.00 C ATOM 727 O GLY A 49 -0.455 -12.067 -6.701 1.00 0.00 O ATOM 0 H GLY A 49 -1.407 -15.791 -5.043 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.034 -13.964 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.870 -14.170 -6.003 1.00 0.00 H new ATOM 731 N GLY A 50 -2.265 -13.240 -6.294 1.00 0.00 N ATOM 732 CA GLY A 50 -3.133 -12.206 -6.925 1.00 0.00 C ATOM 733 C GLY A 50 -4.058 -11.603 -5.865 1.00 0.00 C ATOM 734 O GLY A 50 -3.861 -11.786 -4.680 1.00 0.00 O ATOM 0 H GLY A 50 -2.757 -14.054 -5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.519 -11.425 -7.375 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.722 -12.650 -7.727 1.00 0.00 H new ATOM 738 N PRO A 51 -5.089 -10.869 -6.307 1.00 0.00 N ATOM 739 CA PRO A 51 -6.056 -10.232 -5.403 1.00 0.00 C ATOM 740 C PRO A 51 -6.946 -11.267 -4.710 1.00 0.00 C ATOM 741 O PRO A 51 -7.501 -12.145 -5.341 1.00 0.00 O ATOM 742 CB PRO A 51 -6.896 -9.357 -6.333 1.00 0.00 C ATOM 743 CG PRO A 51 -6.774 -10.007 -7.670 1.00 0.00 C ATOM 744 CD PRO A 51 -5.395 -10.602 -7.724 1.00 0.00 C ATOM 0 HA PRO A 51 -5.566 -9.675 -4.604 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -7.935 -9.314 -6.006 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.526 -8.332 -6.355 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.535 -10.777 -7.799 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.916 -9.281 -8.470 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.373 -11.515 -8.320 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.676 -9.914 -8.169 1.00 0.00 H new ATOM 752 N GLY A 52 -7.082 -11.174 -3.416 1.00 0.00 N ATOM 753 CA GLY A 52 -7.931 -12.156 -2.685 1.00 0.00 C ATOM 754 C GLY A 52 -7.269 -13.534 -2.741 1.00 0.00 C ATOM 755 O GLY A 52 -7.931 -14.553 -2.720 1.00 0.00 O ATOM 0 H GLY A 52 -6.642 -10.461 -2.834 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.060 -11.843 -1.649 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.925 -12.198 -3.131 1.00 0.00 H new ATOM 759 N THR A 53 -5.967 -13.572 -2.815 1.00 0.00 N ATOM 760 CA THR A 53 -5.260 -14.882 -2.875 1.00 0.00 C ATOM 761 C THR A 53 -5.096 -15.441 -1.460 1.00 0.00 C ATOM 762 O THR A 53 -4.820 -14.718 -0.524 1.00 0.00 O ATOM 763 CB THR A 53 -3.879 -14.686 -3.509 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.031 -14.168 -4.823 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.148 -16.027 -3.566 1.00 0.00 C ATOM 0 H THR A 53 -5.362 -12.751 -2.837 1.00 0.00 H new ATOM 0 HA THR A 53 -5.842 -15.581 -3.475 1.00 0.00 H new ATOM 0 HB THR A 53 -3.299 -13.985 -2.909 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.509 -13.314 -4.784 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.166 -15.887 -4.017 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.031 -16.421 -2.556 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.725 -16.731 -4.165 1.00 0.00 H new ATOM 773 N ILE A 54 -5.260 -16.726 -1.298 1.00 0.00 N ATOM 774 CA ILE A 54 -5.110 -17.331 0.055 1.00 0.00 C ATOM 775 C ILE A 54 -3.786 -18.094 0.123 1.00 0.00 C ATOM 776 O ILE A 54 -3.476 -18.896 -0.735 1.00 0.00 O ATOM 777 CB ILE A 54 -6.271 -18.296 0.315 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.598 -17.581 0.052 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.225 -18.767 1.769 1.00 0.00 C ATOM 780 CD1 ILE A 54 -7.598 -16.227 0.765 1.00 0.00 C ATOM 0 H ILE A 54 -5.491 -17.382 -2.044 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.118 -16.545 0.810 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.185 -19.156 -0.349 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.741 -17.440 -1.019 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -8.429 -18.191 0.407 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.051 -19.454 1.955 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.280 -19.276 1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.312 -17.907 2.433 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.543 -15.717 0.578 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -7.474 -16.380 1.837 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -6.776 -15.618 0.389 1.00 0.00 H new ATOM 792 N LYS A 55 -2.999 -17.849 1.135 1.00 0.00 N ATOM 793 CA LYS A 55 -1.695 -18.558 1.250 1.00 0.00 C ATOM 794 C LYS A 55 -1.708 -19.463 2.485 1.00 0.00 C ATOM 795 O LYS A 55 -2.323 -19.156 3.486 1.00 0.00 O ATOM 796 CB LYS A 55 -0.567 -17.533 1.383 1.00 0.00 C ATOM 797 CG LYS A 55 -0.540 -16.641 0.141 1.00 0.00 C ATOM 798 CD LYS A 55 0.665 -15.700 0.214 1.00 0.00 C ATOM 799 CE LYS A 55 0.625 -14.726 -0.964 1.00 0.00 C ATOM 800 NZ LYS A 55 1.610 -13.631 -0.738 1.00 0.00 N ATOM 0 H LYS A 55 -3.203 -17.189 1.886 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.534 -19.164 0.359 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.716 -16.926 2.276 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.390 -18.042 1.499 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.482 -17.254 -0.759 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.462 -16.064 0.075 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.653 -15.150 1.155 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.591 -16.275 0.193 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.855 -15.251 -1.891 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.377 -14.311 -1.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.241 -12.744 -1.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.768 -13.512 0.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.509 -13.872 -1.202 1.00 0.00 H new ATOM 814 N LYS A 56 -1.028 -20.575 2.421 1.00 0.00 N ATOM 815 CA LYS A 56 -0.994 -21.500 3.588 1.00 0.00 C ATOM 816 C LYS A 56 0.456 -21.890 3.882 1.00 0.00 C ATOM 817 O LYS A 56 1.145 -22.430 3.039 1.00 0.00 O ATOM 818 CB LYS A 56 -1.806 -22.757 3.266 1.00 0.00 C ATOM 819 CG LYS A 56 -1.925 -23.623 4.523 1.00 0.00 C ATOM 820 CD LYS A 56 -2.682 -24.910 4.186 1.00 0.00 C ATOM 821 CE LYS A 56 -2.907 -25.719 5.465 1.00 0.00 C ATOM 822 NZ LYS A 56 -1.607 -25.909 6.168 1.00 0.00 N ATOM 0 H LYS A 56 -0.493 -20.883 1.609 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.423 -21.005 4.460 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.797 -22.481 2.907 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.323 -23.320 2.468 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.934 -23.862 4.908 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.448 -23.075 5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.638 -24.671 3.721 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.116 -25.499 3.465 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.612 -25.202 6.116 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.347 -26.687 5.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.681 -26.713 6.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.860 -26.100 5.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.371 -25.048 6.701 1.00 0.00 H new ATOM 836 N ILE A 57 0.926 -21.617 5.067 1.00 0.00 N ATOM 837 CA ILE A 57 2.333 -21.970 5.408 1.00 0.00 C ATOM 838 C ILE A 57 2.343 -23.048 6.494 1.00 0.00 C ATOM 839 O ILE A 57 1.614 -22.974 7.464 1.00 0.00 O ATOM 840 CB ILE A 57 3.060 -20.724 5.917 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.943 -19.607 4.879 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.535 -21.054 6.147 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.396 -18.284 5.500 1.00 0.00 C ATOM 0 H ILE A 57 0.398 -21.165 5.814 1.00 0.00 H new ATOM 0 HA ILE A 57 2.838 -22.349 4.519 1.00 0.00 H new ATOM 0 HB ILE A 57 2.610 -20.397 6.855 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.555 -19.840 4.008 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.913 -19.524 4.532 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.054 -20.167 6.510 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.619 -21.851 6.886 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.985 -21.380 5.209 1.00 0.00 H new ATOM 0 HD11 ILE A 57 3.313 -17.488 4.760 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.766 -18.050 6.358 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.433 -18.371 5.825 1.00 0.00 H new ATOM 855 N THR A 58 3.165 -24.050 6.339 1.00 0.00 N ATOM 856 CA THR A 58 3.224 -25.134 7.360 1.00 0.00 C ATOM 857 C THR A 58 4.661 -25.274 7.868 1.00 0.00 C ATOM 858 O THR A 58 5.570 -25.557 7.114 1.00 0.00 O ATOM 859 CB THR A 58 2.774 -26.454 6.729 1.00 0.00 C ATOM 860 OG1 THR A 58 1.480 -26.289 6.163 1.00 0.00 O ATOM 861 CG2 THR A 58 2.730 -27.546 7.799 1.00 0.00 C ATOM 0 H THR A 58 3.799 -24.165 5.548 1.00 0.00 H new ATOM 0 HA THR A 58 2.565 -24.888 8.193 1.00 0.00 H new ATOM 0 HB THR A 58 3.479 -26.743 5.949 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.191 -27.133 5.757 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.409 -28.485 7.348 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.723 -27.672 8.232 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.027 -27.261 8.581 1.00 0.00 H new ATOM 869 N PHE A 59 4.873 -25.077 9.140 1.00 0.00 N ATOM 870 CA PHE A 59 6.252 -25.199 9.692 1.00 0.00 C ATOM 871 C PHE A 59 6.258 -26.215 10.836 1.00 0.00 C ATOM 872 O PHE A 59 5.320 -26.305 11.604 1.00 0.00 O ATOM 873 CB PHE A 59 6.712 -23.838 10.218 1.00 0.00 C ATOM 874 CG PHE A 59 5.821 -23.410 11.359 1.00 0.00 C ATOM 875 CD1 PHE A 59 4.557 -22.867 11.094 1.00 0.00 C ATOM 876 CD2 PHE A 59 6.256 -23.555 12.681 1.00 0.00 C ATOM 877 CE1 PHE A 59 3.730 -22.471 12.151 1.00 0.00 C ATOM 878 CE2 PHE A 59 5.430 -23.159 13.738 1.00 0.00 C ATOM 879 CZ PHE A 59 4.166 -22.616 13.473 1.00 0.00 C ATOM 0 H PHE A 59 4.152 -24.837 9.820 1.00 0.00 H new ATOM 0 HA PHE A 59 6.929 -25.534 8.906 1.00 0.00 H new ATOM 0 HB2 PHE A 59 7.747 -23.897 10.554 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.678 -23.097 9.419 1.00 0.00 H new ATOM 0 HD1 PHE A 59 4.221 -22.754 10.074 1.00 0.00 H new ATOM 0 HD2 PHE A 59 7.231 -23.973 12.885 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.755 -22.053 11.947 1.00 0.00 H new ATOM 0 HE2 PHE A 59 5.766 -23.272 14.758 1.00 0.00 H new ATOM 0 HZ PHE A 59 3.528 -22.309 14.289 1.00 0.00 H new ATOM 974 N TYR A 67 0.773 -23.684 11.685 1.00 0.00 N ATOM 975 CA TYR A 67 0.707 -23.211 10.274 1.00 0.00 C ATOM 976 C TYR A 67 0.039 -21.835 10.223 1.00 0.00 C ATOM 977 O TYR A 67 -0.874 -21.549 10.970 1.00 0.00 O ATOM 978 CB TYR A 67 -0.108 -24.204 9.443 1.00 0.00 C ATOM 979 CG TYR A 67 -1.564 -24.111 9.833 1.00 0.00 C ATOM 980 CD1 TYR A 67 -2.045 -24.842 10.926 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.433 -23.292 9.101 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.395 -24.755 11.286 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.782 -23.205 9.462 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.263 -23.936 10.554 1.00 0.00 C ATOM 985 OH TYR A 67 -5.594 -23.849 10.911 1.00 0.00 O ATOM 0 HA TYR A 67 1.716 -23.137 9.869 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.010 -23.988 8.381 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.259 -25.218 9.605 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.375 -25.473 11.491 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.062 -22.728 8.258 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.767 -25.320 12.128 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.452 -22.574 8.898 1.00 0.00 H new ATOM 0 HH TYR A 67 -6.014 -23.106 10.430 1.00 0.00 H new ATOM 995 N VAL A 68 0.488 -20.984 9.340 1.00 0.00 N ATOM 996 CA VAL A 68 -0.117 -19.627 9.232 1.00 0.00 C ATOM 997 C VAL A 68 -0.596 -19.401 7.796 1.00 0.00 C ATOM 998 O VAL A 68 0.016 -19.854 6.850 1.00 0.00 O ATOM 999 CB VAL A 68 0.930 -18.571 9.591 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.282 -17.185 9.581 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.490 -18.861 10.985 1.00 0.00 C ATOM 0 H VAL A 68 1.249 -21.171 8.688 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.961 -19.548 9.917 1.00 0.00 H new ATOM 0 HB VAL A 68 1.739 -18.599 8.861 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.028 -16.433 9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.117 -16.977 8.588 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.527 -17.156 10.311 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.236 -18.109 11.241 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.681 -18.833 11.715 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.952 -19.848 10.993 1.00 0.00 H new ATOM 1011 N LYS A 69 -1.688 -18.707 7.626 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.204 -18.458 6.250 1.00 0.00 C ATOM 1013 C LYS A 69 -2.185 -16.956 5.960 1.00 0.00 C ATOM 1014 O LYS A 69 -2.508 -16.147 6.808 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.637 -18.982 6.141 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.636 -20.504 6.304 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.040 -21.046 6.031 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.079 -22.542 6.350 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.342 -22.864 7.071 1.00 0.00 N ATOM 0 H LYS A 69 -2.244 -18.302 8.379 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.573 -18.974 5.527 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.263 -18.524 6.907 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.063 -18.709 5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -2.921 -20.954 5.616 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.320 -20.772 7.312 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.772 -20.514 6.639 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.310 -20.878 4.988 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.015 -23.123 5.430 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.219 -22.817 6.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.288 -23.831 7.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.476 -22.192 7.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.145 -22.794 6.413 1.00 0.00 H new ATOM 1033 N HIS A 70 -1.810 -16.577 4.769 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.772 -15.127 4.427 1.00 0.00 C ATOM 1035 C HIS A 70 -2.771 -14.844 3.303 1.00 0.00 C ATOM 1036 O HIS A 70 -2.974 -15.654 2.421 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.364 -14.749 3.963 1.00 0.00 C ATOM 1038 CG HIS A 70 0.604 -14.926 5.100 1.00 0.00 C ATOM 1039 ND1 HIS A 70 1.281 -16.026 5.566 1.00 0.00 N flip ATOM 1040 CD2 HIS A 70 0.985 -13.873 5.918 1.00 0.00 C flip ATOM 1041 CE1 HIS A 70 2.069 -15.665 6.655 1.00 0.00 C flip ATOM 1042 NE2 HIS A 70 1.853 -14.358 6.824 1.00 0.00 N flip ATOM 0 H HIS A 70 -1.529 -17.208 4.019 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.035 -14.539 5.306 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.068 -15.373 3.119 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.349 -13.716 3.616 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.647 -12.850 5.842 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.716 -16.304 7.238 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.293 -13.795 7.552 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.397 -13.698 3.326 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.381 -13.365 2.259 1.00 0.00 C ATOM 1052 C LYS A 71 -3.982 -12.047 1.592 1.00 0.00 C ATOM 1053 O LYS A 71 -3.516 -11.130 2.238 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.773 -13.224 2.874 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.800 -12.988 1.764 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.176 -12.741 2.384 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.238 -12.734 1.282 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.166 -11.587 1.495 1.00 0.00 N ATOM 0 H LYS A 71 -3.269 -12.979 4.038 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.393 -14.161 1.514 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.028 -14.124 3.434 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.788 -12.394 3.580 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.504 -12.132 1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.838 -13.852 1.100 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.401 -13.516 3.116 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.182 -11.789 2.916 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.763 -12.655 0.304 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.793 -13.672 1.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.888 -11.581 0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.628 -11.682 2.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.630 -10.696 1.465 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.162 -11.944 0.304 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.794 -10.685 -0.403 1.00 0.00 C ATOM 1074 C ILE A 72 -5.059 -9.881 -0.704 1.00 0.00 C ATOM 1075 O ILE A 72 -6.028 -10.400 -1.220 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.079 -11.026 -1.712 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.905 -11.964 -1.425 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.559 -9.740 -2.358 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.309 -12.455 -2.745 1.00 0.00 C ATOM 0 H ILE A 72 -4.548 -12.678 -0.290 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.131 -10.093 0.228 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.777 -11.517 -2.390 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.145 -11.444 -0.842 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.241 -12.812 -0.828 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.049 -9.982 -3.291 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.396 -9.072 -2.564 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.861 -9.249 -1.680 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.473 -13.123 -2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.071 -12.990 -3.311 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.958 -11.602 -3.325 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.059 -8.615 -0.385 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.263 -7.779 -0.653 1.00 0.00 C ATOM 1093 C HIS A 73 -6.152 -7.153 -2.045 1.00 0.00 C ATOM 1094 O HIS A 73 -7.074 -7.204 -2.835 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.359 -6.671 0.397 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.600 -7.282 1.750 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.784 -7.926 2.069 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.819 -7.352 2.878 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.684 -8.354 3.342 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.505 -8.030 3.880 1.00 0.00 N ATOM 0 H HIS A 73 -4.277 -8.124 0.049 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.155 -8.403 -0.606 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.439 -6.086 0.409 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.169 -5.986 0.146 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.586 -8.053 1.452 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.824 -6.943 2.972 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.461 -8.893 3.864 1.00 0.00 H new ATOM 1108 N SER A 74 -5.029 -6.561 -2.351 1.00 0.00 N ATOM 1109 CA SER A 74 -4.862 -5.933 -3.692 1.00 0.00 C ATOM 1110 C SER A 74 -3.377 -5.676 -3.954 1.00 0.00 C ATOM 1111 O SER A 74 -2.607 -5.441 -3.044 1.00 0.00 O ATOM 1112 CB SER A 74 -5.624 -4.606 -3.731 1.00 0.00 C ATOM 1113 OG SER A 74 -7.018 -4.860 -3.662 1.00 0.00 O ATOM 0 H SER A 74 -4.222 -6.485 -1.732 1.00 0.00 H new ATOM 0 HA SER A 74 -5.255 -6.601 -4.458 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.317 -3.973 -2.898 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.387 -4.065 -4.647 1.00 0.00 H new ATOM 0 HG SER A 74 -7.186 -5.810 -3.835 1.00 0.00 H new ATOM 1119 N ILE A 75 -2.968 -5.721 -5.192 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.534 -5.480 -5.513 1.00 0.00 C ATOM 1121 C ILE A 75 -1.431 -4.439 -6.629 1.00 0.00 C ATOM 1122 O ILE A 75 -2.259 -4.383 -7.516 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.890 -6.788 -5.976 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.459 -7.183 -7.340 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.189 -7.892 -4.960 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.733 -8.428 -7.855 1.00 0.00 C ATOM 0 H ILE A 75 -3.566 -5.914 -5.995 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.018 -5.114 -4.625 1.00 0.00 H new ATOM 0 HB ILE A 75 0.188 -6.652 -6.058 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.528 -7.381 -7.257 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.341 -6.362 -8.047 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.730 -8.824 -5.290 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.783 -7.612 -3.988 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.267 -8.028 -4.877 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.138 -8.710 -8.827 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.331 -8.214 -7.954 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.874 -9.249 -7.152 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.420 -3.615 -6.594 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.268 -2.579 -7.655 1.00 0.00 C ATOM 1140 C ASP A 76 1.142 -2.654 -8.244 1.00 0.00 C ATOM 1141 O ASP A 76 2.060 -2.020 -7.763 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.497 -1.193 -7.052 1.00 0.00 C ATOM 1143 CG ASP A 76 -1.937 -1.088 -6.546 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.741 -1.921 -6.931 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.212 -0.177 -5.784 1.00 0.00 O ATOM 0 H ASP A 76 0.306 -3.614 -5.878 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.000 -2.757 -8.443 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.201 -1.021 -6.233 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.306 -0.423 -7.800 1.00 0.00 H new ATOM 1150 N LYS A 77 1.321 -3.423 -9.283 1.00 0.00 N ATOM 1151 CA LYS A 77 2.672 -3.535 -9.902 1.00 0.00 C ATOM 1152 C LYS A 77 3.104 -2.166 -10.430 1.00 0.00 C ATOM 1153 O LYS A 77 4.258 -1.794 -10.350 1.00 0.00 O ATOM 1154 CB LYS A 77 2.623 -4.536 -11.058 1.00 0.00 C ATOM 1155 CG LYS A 77 2.306 -5.931 -10.513 1.00 0.00 C ATOM 1156 CD LYS A 77 2.387 -6.951 -11.650 1.00 0.00 C ATOM 1157 CE LYS A 77 1.915 -8.316 -11.145 1.00 0.00 C ATOM 1158 NZ LYS A 77 0.439 -8.426 -11.317 1.00 0.00 N ATOM 0 H LYS A 77 0.591 -3.978 -9.730 1.00 0.00 H new ATOM 0 HA LYS A 77 3.387 -3.879 -9.155 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.865 -4.236 -11.781 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.578 -4.548 -11.584 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.010 -6.194 -9.723 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.310 -5.943 -10.069 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.769 -6.628 -12.488 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.411 -7.021 -12.018 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.416 -9.112 -11.695 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.180 -8.439 -10.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.118 -9.354 -10.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.031 -7.674 -10.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.199 -8.327 -12.324 1.00 0.00 H new ATOM 1172 N VAL A 78 2.186 -1.412 -10.970 1.00 0.00 N ATOM 1173 CA VAL A 78 2.543 -0.067 -11.502 1.00 0.00 C ATOM 1174 C VAL A 78 2.849 0.876 -10.338 1.00 0.00 C ATOM 1175 O VAL A 78 3.771 1.666 -10.392 1.00 0.00 O ATOM 1176 CB VAL A 78 1.370 0.487 -12.314 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.655 1.942 -12.690 1.00 0.00 C ATOM 1178 CG2 VAL A 78 1.191 -0.344 -13.585 1.00 0.00 C ATOM 0 H VAL A 78 1.204 -1.670 -11.066 1.00 0.00 H new ATOM 0 HA VAL A 78 3.421 -0.150 -12.142 1.00 0.00 H new ATOM 0 HB VAL A 78 0.459 0.437 -11.718 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.821 2.338 -13.269 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.782 2.534 -11.784 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.566 1.992 -13.286 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.356 0.051 -14.163 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.101 -0.295 -14.183 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.989 -1.381 -13.316 1.00 0.00 H new ATOM 1188 N ASN A 79 2.083 0.802 -9.284 1.00 0.00 N ATOM 1189 CA ASN A 79 2.330 1.695 -8.118 1.00 0.00 C ATOM 1190 C ASN A 79 3.338 1.036 -7.174 1.00 0.00 C ATOM 1191 O ASN A 79 3.585 1.514 -6.084 1.00 0.00 O ATOM 1192 CB ASN A 79 1.015 1.937 -7.374 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.007 2.553 -8.330 1.00 0.00 C ATOM 1194 OD1 ASN A 79 0.261 3.555 -8.961 1.00 0.00 O ATOM 1195 ND2 ASN A 79 -1.176 1.990 -8.465 1.00 0.00 N ATOM 0 H ASN A 79 1.296 0.161 -9.180 1.00 0.00 H new ATOM 0 HA ASN A 79 2.730 2.647 -8.467 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.634 0.998 -6.973 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.182 2.601 -6.526 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.865 2.392 -9.101 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.401 1.148 -7.935 1.00 0.00 H new ATOM 1202 N HIS A 80 3.921 -0.058 -7.580 1.00 0.00 N ATOM 1203 CA HIS A 80 4.911 -0.744 -6.704 1.00 0.00 C ATOM 1204 C HIS A 80 4.358 -0.832 -5.280 1.00 0.00 C ATOM 1205 O HIS A 80 5.071 -0.646 -4.315 1.00 0.00 O ATOM 1206 CB HIS A 80 6.221 0.047 -6.696 1.00 0.00 C ATOM 1207 CG HIS A 80 6.684 0.263 -8.110 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.542 1.480 -8.757 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.288 -0.574 -9.015 1.00 0.00 C ATOM 1210 CE1 HIS A 80 7.050 1.343 -9.995 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.518 0.110 -10.205 1.00 0.00 N ATOM 0 H HIS A 80 3.754 -0.506 -8.481 1.00 0.00 H new ATOM 0 HA HIS A 80 5.097 -1.749 -7.084 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.076 1.006 -6.199 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.981 -0.493 -6.132 1.00 0.00 H new ATOM 0 HD1 HIS A 80 6.128 2.326 -8.366 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.546 -1.607 -8.831 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.076 2.134 -10.730 1.00 0.00 H new ATOM 1219 N THR A 81 3.092 -1.114 -5.142 1.00 0.00 N ATOM 1220 CA THR A 81 2.495 -1.213 -3.781 1.00 0.00 C ATOM 1221 C THR A 81 1.936 -2.622 -3.571 1.00 0.00 C ATOM 1222 O THR A 81 1.298 -3.183 -4.438 1.00 0.00 O ATOM 1223 CB THR A 81 1.364 -0.191 -3.644 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.856 1.102 -3.964 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.837 -0.198 -2.209 1.00 0.00 C ATOM 0 H THR A 81 2.445 -1.280 -5.913 1.00 0.00 H new ATOM 0 HA THR A 81 3.261 -1.010 -3.033 1.00 0.00 H new ATOM 0 HB THR A 81 0.554 -0.451 -4.326 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.387 1.056 -4.786 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.032 0.530 -2.114 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.459 -1.191 -1.965 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.644 0.061 -1.524 1.00 0.00 H new ATOM 1233 N TYR A 82 2.172 -3.199 -2.424 1.00 0.00 N ATOM 1234 CA TYR A 82 1.654 -4.570 -2.160 1.00 0.00 C ATOM 1235 C TYR A 82 0.871 -4.575 -0.845 1.00 0.00 C ATOM 1236 O TYR A 82 1.365 -4.161 0.185 1.00 0.00 O ATOM 1237 CB TYR A 82 2.828 -5.547 -2.055 1.00 0.00 C ATOM 1238 CG TYR A 82 2.298 -6.956 -1.934 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.901 -7.656 -3.080 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.203 -7.562 -0.676 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.410 -8.962 -2.968 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.712 -8.868 -0.563 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.316 -9.568 -1.709 1.00 0.00 C ATOM 1244 OH TYR A 82 0.831 -10.855 -1.598 1.00 0.00 O ATOM 0 H TYR A 82 2.701 -2.780 -1.659 1.00 0.00 H new ATOM 0 HA TYR A 82 0.998 -4.874 -2.976 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.467 -5.461 -2.934 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.443 -5.302 -1.189 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.974 -7.188 -4.051 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.509 -7.022 0.208 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.104 -9.502 -3.852 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.639 -9.335 0.408 1.00 0.00 H new ATOM 0 HH TYR A 82 1.085 -11.370 -2.392 1.00 0.00 H new ATOM 1254 N SER A 83 -0.348 -5.039 -0.872 1.00 0.00 N ATOM 1255 CA SER A 83 -1.162 -5.069 0.376 1.00 0.00 C ATOM 1256 C SER A 83 -1.584 -6.509 0.677 1.00 0.00 C ATOM 1257 O SER A 83 -2.130 -7.194 -0.166 1.00 0.00 O ATOM 1258 CB SER A 83 -2.407 -4.200 0.193 1.00 0.00 C ATOM 1259 OG SER A 83 -3.122 -4.134 1.418 1.00 0.00 O ATOM 0 H SER A 83 -0.816 -5.399 -1.704 1.00 0.00 H new ATOM 0 HA SER A 83 -0.569 -4.684 1.206 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.121 -3.198 -0.128 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.042 -4.616 -0.589 1.00 0.00 H new ATOM 0 HG SER A 83 -3.919 -3.576 1.302 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.338 -6.972 1.871 1.00 0.00 N ATOM 1266 CA TYR A 84 -1.727 -8.367 2.224 1.00 0.00 C ATOM 1267 C TYR A 84 -2.146 -8.424 3.694 1.00 0.00 C ATOM 1268 O TYR A 84 -1.969 -7.478 4.437 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.540 -9.304 1.993 1.00 0.00 C ATOM 1270 CG TYR A 84 0.517 -9.052 3.042 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.421 -7.995 2.885 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.593 -9.876 4.171 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.402 -7.762 3.856 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.574 -9.644 5.143 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.479 -8.587 4.986 1.00 0.00 C ATOM 1276 OH TYR A 84 3.445 -8.358 5.944 1.00 0.00 O ATOM 0 H TYR A 84 -0.885 -6.445 2.618 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.562 -8.680 1.597 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.870 -10.342 2.037 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.125 -9.143 0.998 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.362 -7.359 2.014 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.105 -10.691 4.292 1.00 0.00 H new ATOM 0 HE1 TYR A 84 3.099 -6.946 3.734 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.633 -10.280 6.014 1.00 0.00 H new ATOM 0 HH TYR A 84 3.024 -8.001 6.754 1.00 0.00 H new ATOM 1286 N SER A 85 -2.701 -9.525 4.120 1.00 0.00 N ATOM 1287 CA SER A 85 -3.132 -9.640 5.541 1.00 0.00 C ATOM 1288 C SER A 85 -2.990 -11.093 6.001 1.00 0.00 C ATOM 1289 O SER A 85 -2.969 -12.007 5.202 1.00 0.00 O ATOM 1290 CB SER A 85 -4.594 -9.205 5.668 1.00 0.00 C ATOM 1291 OG SER A 85 -5.408 -10.046 4.865 1.00 0.00 O ATOM 0 H SER A 85 -2.875 -10.350 3.545 1.00 0.00 H new ATOM 0 HA SER A 85 -2.507 -8.999 6.163 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.912 -9.259 6.709 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.704 -8.167 5.355 1.00 0.00 H new ATOM 0 HG SER A 85 -5.825 -9.516 4.154 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.892 -11.313 7.284 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.752 -12.706 7.792 1.00 0.00 C ATOM 1299 C LEU A 86 -4.135 -13.264 8.133 1.00 0.00 C ATOM 1300 O LEU A 86 -4.958 -12.592 8.724 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.878 -12.709 9.047 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.491 -14.148 9.396 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.548 -14.698 8.324 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -0.786 -14.171 10.754 1.00 0.00 C ATOM 0 H LEU A 86 -2.903 -10.588 8.001 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.287 -13.326 7.026 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.982 -12.110 8.881 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.416 -12.254 9.879 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.389 -14.764 9.441 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.273 -15.723 8.573 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.049 -14.682 7.356 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.350 -14.082 8.278 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.510 -15.196 11.003 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.112 -13.554 10.708 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.457 -13.780 11.519 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.399 -14.490 7.766 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.730 -15.089 8.068 1.00 0.00 C ATOM 1318 C ILE A 87 -5.624 -15.970 9.316 1.00 0.00 C ATOM 1319 O ILE A 87 -6.121 -15.629 10.371 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.186 -15.939 6.881 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.170 -15.090 5.608 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.606 -16.450 7.135 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -6.903 -13.771 5.866 1.00 0.00 C ATOM 0 H ILE A 87 -3.750 -15.102 7.270 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.454 -14.294 8.246 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.511 -16.786 6.761 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -5.142 -14.894 5.302 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.648 -15.631 4.791 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.931 -17.056 6.289 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.618 -17.056 8.041 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.281 -15.603 7.256 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.892 -13.165 4.960 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -7.934 -13.978 6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.405 -13.229 6.670 1.00 0.00 H new ATOM 1335 N GLU A 88 -4.981 -17.100 9.204 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.848 -18.002 10.384 1.00 0.00 C ATOM 1337 C GLU A 88 -3.368 -18.187 10.722 1.00 0.00 C ATOM 1338 O GLU A 88 -2.500 -17.947 9.906 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.473 -19.360 10.060 1.00 0.00 C ATOM 1340 CG GLU A 88 -6.952 -19.170 9.718 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.596 -20.534 9.461 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -6.864 -21.505 9.370 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -8.811 -20.584 9.361 1.00 0.00 O ATOM 0 H GLU A 88 -4.542 -17.438 8.347 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.361 -17.561 11.238 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.951 -19.822 9.222 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.369 -20.033 10.911 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.463 -18.663 10.536 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.054 -18.536 8.837 1.00 0.00 H new ATOM 1350 N GLY A 89 -3.071 -18.613 11.920 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.646 -18.814 12.310 1.00 0.00 C ATOM 1352 C GLY A 89 -1.570 -19.131 13.806 1.00 0.00 C ATOM 1353 O GLY A 89 -2.117 -18.424 14.628 1.00 0.00 O ATOM 0 H GLY A 89 -3.754 -18.831 12.646 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.210 -19.629 11.731 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.066 -17.919 12.086 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.896 -20.189 14.164 1.00 0.00 N ATOM 1358 CA ASP A 90 -0.786 -20.551 15.606 1.00 0.00 C ATOM 1359 C ASP A 90 -0.438 -19.305 16.423 1.00 0.00 C ATOM 1360 O ASP A 90 -0.830 -19.171 17.564 1.00 0.00 O ATOM 1361 CB ASP A 90 0.310 -21.602 15.786 1.00 0.00 C ATOM 1362 CG ASP A 90 -0.200 -22.960 15.304 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -1.266 -22.994 14.711 1.00 0.00 O ATOM 1364 OD2 ASP A 90 0.482 -23.944 15.536 1.00 0.00 O ATOM 0 H ASP A 90 -0.417 -20.819 13.521 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.738 -20.955 15.951 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.199 -21.315 15.224 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.602 -21.663 16.835 1.00 0.00 H new ATOM 1369 N ALA A 91 0.296 -18.392 15.848 1.00 0.00 N ATOM 1370 CA ALA A 91 0.668 -17.157 16.595 1.00 0.00 C ATOM 1371 C ALA A 91 -0.585 -16.309 16.830 1.00 0.00 C ATOM 1372 O ALA A 91 -0.684 -15.588 17.802 1.00 0.00 O ATOM 1373 CB ALA A 91 1.684 -16.354 15.780 1.00 0.00 C ATOM 0 H ALA A 91 0.654 -18.448 14.894 1.00 0.00 H new ATOM 0 HA ALA A 91 1.108 -17.429 17.554 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.956 -15.451 16.326 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.575 -16.959 15.612 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.245 -16.080 14.821 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.543 -16.392 15.948 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.790 -15.593 16.123 1.00 0.00 C ATOM 1381 C LEU A 92 -3.633 -16.229 17.221 1.00 0.00 C ATOM 1382 O LEU A 92 -4.329 -15.560 17.959 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.586 -15.587 14.816 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.627 -15.529 13.625 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -3.413 -15.202 12.354 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -1.576 -14.445 13.869 1.00 0.00 C ATOM 0 H LEU A 92 -1.517 -16.978 15.114 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.534 -14.569 16.393 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.205 -16.482 14.753 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.260 -14.731 14.794 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.133 -16.493 13.508 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.731 -15.160 11.505 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.162 -15.975 12.180 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.907 -14.237 12.470 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.893 -14.403 13.021 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.069 -13.480 13.986 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.016 -14.678 14.775 1.00 0.00 H new ATOM 1398 N SER A 93 -3.571 -17.523 17.329 1.00 0.00 N ATOM 1399 CA SER A 93 -4.364 -18.227 18.375 1.00 0.00 C ATOM 1400 C SER A 93 -5.833 -17.815 18.268 1.00 0.00 C ATOM 1401 O SER A 93 -6.212 -17.052 17.401 1.00 0.00 O ATOM 1402 CB SER A 93 -3.828 -17.855 19.758 1.00 0.00 C ATOM 1403 OG SER A 93 -2.727 -18.693 20.080 1.00 0.00 O ATOM 0 H SER A 93 -3.003 -18.128 16.736 1.00 0.00 H new ATOM 0 HA SER A 93 -4.279 -19.304 18.230 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.519 -16.810 19.771 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.613 -17.965 20.506 1.00 0.00 H new ATOM 0 HG SER A 93 -2.168 -18.819 19.285 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.664 -18.312 19.142 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.108 -17.949 19.089 1.00 0.00 C ATOM 1411 C GLU A 94 -8.333 -16.635 19.842 1.00 0.00 C ATOM 1412 O GLU A 94 -9.452 -16.258 20.129 1.00 0.00 O ATOM 1413 CB GLU A 94 -8.937 -19.057 19.742 1.00 0.00 C ATOM 1414 CG GLU A 94 -8.700 -20.376 19.004 1.00 0.00 C ATOM 1415 CD GLU A 94 -9.542 -21.479 19.648 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.114 -21.225 20.695 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -9.600 -22.559 19.083 1.00 0.00 O ATOM 0 H GLU A 94 -6.405 -18.954 19.891 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.414 -17.830 18.050 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.662 -19.161 20.791 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.995 -18.798 19.714 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.965 -20.269 17.952 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.643 -20.641 19.042 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.280 -15.936 20.167 1.00 0.00 N ATOM 1425 CA ASN A 95 -7.439 -14.650 20.902 1.00 0.00 C ATOM 1426 C ASN A 95 -7.041 -13.486 19.994 1.00 0.00 C ATOM 1427 O ASN A 95 -7.269 -12.335 20.310 1.00 0.00 O ATOM 1428 CB ASN A 95 -6.546 -14.659 22.144 1.00 0.00 C ATOM 1429 CG ASN A 95 -5.080 -14.775 21.719 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -4.773 -15.398 20.721 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -4.157 -14.200 22.439 1.00 0.00 N ATOM 0 H ASN A 95 -6.318 -16.200 19.955 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.480 -14.532 21.203 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.697 -13.746 22.720 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.815 -15.493 22.792 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.177 -14.273 22.165 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.415 -13.677 23.276 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.445 -13.772 18.867 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.035 -12.673 17.948 1.00 0.00 C ATOM 1440 C ILE A 96 -6.838 -12.762 16.648 1.00 0.00 C ATOM 1441 O ILE A 96 -7.082 -13.832 16.127 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.542 -12.796 17.634 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -3.754 -12.912 18.941 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.080 -11.554 16.867 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.254 -12.916 18.635 1.00 0.00 C ATOM 0 H ILE A 96 -6.226 -14.715 18.545 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.227 -11.713 18.428 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.369 -13.684 17.026 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.999 -12.080 19.601 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.031 -13.827 19.465 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.017 -11.640 16.642 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.642 -11.471 15.937 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.252 -10.666 17.475 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.693 -12.999 19.566 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.016 -13.763 17.992 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -1.983 -11.989 18.129 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.246 -11.641 16.120 1.00 0.00 N ATOM 1458 CA GLU A 97 -8.030 -11.650 14.852 1.00 0.00 C ATOM 1459 C GLU A 97 -7.074 -11.515 13.665 1.00 0.00 C ATOM 1460 O GLU A 97 -5.874 -11.435 13.831 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.016 -10.480 14.854 1.00 0.00 C ATOM 1462 CG GLU A 97 -9.963 -10.614 16.049 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.016 -9.506 15.992 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -10.873 -8.621 15.165 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -11.947 -9.561 16.779 1.00 0.00 O ATOM 0 H GLU A 97 -7.070 -10.716 16.513 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.582 -12.586 14.769 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.476 -9.535 14.909 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.585 -10.468 13.925 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.446 -11.591 16.036 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.401 -10.549 16.981 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.594 -11.495 12.468 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.708 -11.371 11.277 1.00 0.00 C ATOM 1474 C LYS A 98 -5.867 -10.099 11.398 1.00 0.00 C ATOM 1475 O LYS A 98 -6.179 -9.207 12.163 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.562 -11.296 10.010 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.330 -12.607 9.829 1.00 0.00 C ATOM 1478 CD LYS A 98 -9.115 -12.560 8.517 1.00 0.00 C ATOM 1479 CE LYS A 98 -10.002 -13.803 8.407 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.784 -13.968 9.664 1.00 0.00 N ATOM 0 H LYS A 98 -8.591 -11.559 12.264 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.051 -12.239 11.222 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.259 -10.461 10.078 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.928 -11.112 9.143 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.637 -13.449 9.821 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.010 -12.761 10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.727 -11.659 8.479 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -8.428 -12.514 7.672 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.677 -13.707 7.556 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -9.388 -14.686 8.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.626 -14.548 9.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.194 -14.437 10.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.079 -13.034 10.015 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.799 -10.009 10.653 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.936 -8.796 10.730 1.00 0.00 C ATOM 1496 C ILE A 99 -3.864 -8.129 9.355 1.00 0.00 C ATOM 1497 O ILE A 99 -3.696 -8.783 8.345 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.528 -9.202 11.172 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.615 -10.046 12.445 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.698 -7.948 11.446 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.222 -10.562 12.811 1.00 0.00 C ATOM 0 H ILE A 99 -4.487 -10.723 9.995 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.359 -8.096 11.451 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.054 -9.785 10.383 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.020 -9.450 13.263 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.296 -10.883 12.293 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.695 -8.237 11.761 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.635 -7.348 10.538 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.172 -7.363 12.235 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.283 -11.163 13.718 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.835 -11.173 11.996 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.554 -9.717 12.980 1.00 0.00 H new ATOM 1513 N ASP A 100 -3.989 -6.831 9.308 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.925 -6.123 7.998 1.00 0.00 C ATOM 1515 C ASP A 100 -2.487 -5.672 7.734 1.00 0.00 C ATOM 1516 O ASP A 100 -1.914 -4.917 8.494 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.845 -4.901 8.031 1.00 0.00 C ATOM 1518 CG ASP A 100 -4.862 -4.238 6.652 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -4.279 -4.800 5.740 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -5.459 -3.181 6.531 1.00 0.00 O ATOM 0 H ASP A 100 -4.133 -6.230 10.120 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.247 -6.797 7.204 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.854 -5.200 8.315 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.499 -4.192 8.783 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.897 -6.130 6.664 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.496 -5.728 6.357 1.00 0.00 C ATOM 1527 C TYR A 101 -0.471 -4.883 5.081 1.00 0.00 C ATOM 1528 O TYR A 101 -1.158 -5.171 4.121 1.00 0.00 O ATOM 1529 CB TYR A 101 0.361 -6.978 6.156 1.00 0.00 C ATOM 1530 CG TYR A 101 0.592 -7.652 7.486 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.577 -7.169 8.355 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.180 -8.762 7.851 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.791 -7.795 9.589 1.00 0.00 C ATOM 1534 CE2 TYR A 101 0.033 -9.388 9.085 1.00 0.00 C ATOM 1535 CZ TYR A 101 1.018 -8.904 9.954 1.00 0.00 C ATOM 1536 OH TYR A 101 1.229 -9.522 11.170 1.00 0.00 O ATOM 0 H TYR A 101 -2.325 -6.765 5.990 1.00 0.00 H new ATOM 0 HA TYR A 101 -0.099 -5.143 7.186 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.135 -7.665 5.470 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.315 -6.708 5.703 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.172 -6.313 8.074 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.940 -9.135 7.180 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.552 -7.423 10.259 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.562 -10.244 9.366 1.00 0.00 H new ATOM 0 HH TYR A 101 1.551 -8.863 11.820 1.00 0.00 H new ATOM 1546 N GLU A 102 0.318 -3.845 5.062 1.00 0.00 N ATOM 1547 CA GLU A 102 0.390 -2.984 3.848 1.00 0.00 C ATOM 1548 C GLU A 102 1.856 -2.706 3.511 1.00 0.00 C ATOM 1549 O GLU A 102 2.654 -2.403 4.376 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.333 -1.662 4.114 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.810 -1.937 4.400 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.565 -0.611 4.505 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.915 0.422 4.485 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.780 -0.649 4.605 1.00 0.00 O ATOM 0 H GLU A 102 0.917 -3.555 5.835 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.087 -3.494 3.011 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.123 -1.150 4.961 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.235 -1.002 3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.237 -2.549 3.606 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.913 -2.501 5.327 1.00 0.00 H new ATOM 1561 N THR A 103 2.220 -2.808 2.262 1.00 0.00 N ATOM 1562 CA THR A 103 3.635 -2.551 1.877 1.00 0.00 C ATOM 1563 C THR A 103 3.678 -1.593 0.686 1.00 0.00 C ATOM 1564 O THR A 103 2.935 -1.734 -0.265 1.00 0.00 O ATOM 1565 CB THR A 103 4.307 -3.872 1.491 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.185 -4.793 2.565 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.786 -3.627 1.190 1.00 0.00 C ATOM 0 H THR A 103 1.599 -3.058 1.493 1.00 0.00 H new ATOM 0 HA THR A 103 4.163 -2.105 2.720 1.00 0.00 H new ATOM 0 HB THR A 103 3.823 -4.281 0.604 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.613 -5.640 2.320 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.262 -4.568 0.916 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.877 -2.920 0.365 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.274 -3.218 2.074 1.00 0.00 H new ATOM 1575 N LYS A 104 4.546 -0.620 0.729 1.00 0.00 N ATOM 1576 CA LYS A 104 4.641 0.347 -0.402 1.00 0.00 C ATOM 1577 C LYS A 104 6.114 0.653 -0.682 1.00 0.00 C ATOM 1578 O LYS A 104 6.870 0.985 0.209 1.00 0.00 O ATOM 1579 CB LYS A 104 3.912 1.640 -0.033 1.00 0.00 C ATOM 1580 CG LYS A 104 3.898 2.578 -1.242 1.00 0.00 C ATOM 1581 CD LYS A 104 3.160 3.867 -0.879 1.00 0.00 C ATOM 1582 CE LYS A 104 3.052 4.759 -2.118 1.00 0.00 C ATOM 1583 NZ LYS A 104 1.625 5.127 -2.341 1.00 0.00 N ATOM 0 H LYS A 104 5.194 -0.452 1.499 1.00 0.00 H new ATOM 0 HA LYS A 104 4.181 -0.085 -1.291 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.892 1.419 0.281 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.408 2.122 0.810 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.918 2.805 -1.551 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.410 2.092 -2.087 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.166 3.634 -0.497 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.691 4.392 -0.085 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.654 5.658 -1.986 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.445 4.237 -2.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.550 5.733 -3.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.062 4.264 -2.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.265 5.641 -1.511 1.00 0.00 H new ATOM 1597 N LEU A 105 6.529 0.541 -1.914 1.00 0.00 N ATOM 1598 CA LEU A 105 7.953 0.822 -2.249 1.00 0.00 C ATOM 1599 C LEU A 105 8.081 2.239 -2.807 1.00 0.00 C ATOM 1600 O LEU A 105 7.367 2.629 -3.709 1.00 0.00 O ATOM 1601 CB LEU A 105 8.437 -0.180 -3.298 1.00 0.00 C ATOM 1602 CG LEU A 105 8.321 -1.600 -2.742 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.044 -2.567 -3.678 1.00 0.00 C ATOM 1604 CD2 LEU A 105 8.958 -1.660 -1.352 1.00 0.00 C ATOM 0 H LEU A 105 5.943 0.267 -2.703 1.00 0.00 H new ATOM 0 HA LEU A 105 8.559 0.731 -1.348 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.844 -0.085 -4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.471 0.032 -3.569 1.00 0.00 H new ATOM 0 HG LEU A 105 7.270 -1.879 -2.668 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.964 -3.581 -3.286 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.589 -2.524 -4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 105 10.095 -2.287 -3.749 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.875 -2.672 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.010 -1.383 -1.422 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.444 -0.967 -0.686 1.00 0.00 H new ATOM 1616 N VAL A 106 8.991 3.013 -2.282 1.00 0.00 N ATOM 1617 CA VAL A 106 9.167 4.403 -2.786 1.00 0.00 C ATOM 1618 C VAL A 106 10.653 4.668 -3.039 1.00 0.00 C ATOM 1619 O VAL A 106 11.500 4.315 -2.241 1.00 0.00 O ATOM 1620 CB VAL A 106 8.639 5.396 -1.749 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.734 6.816 -2.308 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.179 5.070 -1.428 1.00 0.00 C ATOM 0 H VAL A 106 9.620 2.742 -1.526 1.00 0.00 H new ATOM 0 HA VAL A 106 8.612 4.525 -3.716 1.00 0.00 H new ATOM 0 HB VAL A 106 9.236 5.323 -0.840 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.358 7.524 -1.569 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.774 7.048 -2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.138 6.890 -3.217 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.802 5.777 -0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.582 5.142 -2.337 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.111 4.058 -1.029 1.00 0.00 H new ATOM 1632 N SER A 107 10.977 5.285 -4.142 1.00 0.00 N ATOM 1633 CA SER A 107 12.409 5.570 -4.442 1.00 0.00 C ATOM 1634 C SER A 107 12.658 7.078 -4.362 1.00 0.00 C ATOM 1635 O SER A 107 11.800 7.877 -4.683 1.00 0.00 O ATOM 1636 CB SER A 107 12.742 5.073 -5.851 1.00 0.00 C ATOM 1637 OG SER A 107 14.101 4.663 -5.899 1.00 0.00 O ATOM 0 H SER A 107 10.313 5.604 -4.848 1.00 0.00 H new ATOM 0 HA SER A 107 13.041 5.059 -3.716 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.090 4.241 -6.118 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.564 5.864 -6.579 1.00 0.00 H new ATOM 0 HG SER A 107 14.562 4.962 -5.087 1.00 0.00 H new ATOM 1643 N ALA A 108 13.826 7.474 -3.936 1.00 0.00 N ATOM 1644 CA ALA A 108 14.128 8.930 -3.837 1.00 0.00 C ATOM 1645 C ALA A 108 15.085 9.331 -4.962 1.00 0.00 C ATOM 1646 O ALA A 108 15.604 8.494 -5.674 1.00 0.00 O ATOM 1647 CB ALA A 108 14.781 9.224 -2.484 1.00 0.00 C ATOM 0 H ALA A 108 14.584 6.853 -3.652 1.00 0.00 H new ATOM 0 HA ALA A 108 13.203 9.500 -3.927 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.002 10.289 -2.411 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.100 8.939 -1.682 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.706 8.654 -2.395 1.00 0.00 H new ATOM 1653 N PRO A 109 15.316 10.641 -5.122 1.00 0.00 N ATOM 1654 CA PRO A 109 16.209 11.167 -6.162 1.00 0.00 C ATOM 1655 C PRO A 109 17.674 10.829 -5.877 1.00 0.00 C ATOM 1656 O PRO A 109 18.524 10.933 -6.738 1.00 0.00 O ATOM 1657 CB PRO A 109 15.996 12.679 -6.085 1.00 0.00 C ATOM 1658 CG PRO A 109 15.529 12.922 -4.689 1.00 0.00 C ATOM 1659 CD PRO A 109 14.727 11.713 -4.300 1.00 0.00 C ATOM 0 HA PRO A 109 15.991 10.742 -7.142 1.00 0.00 H new ATOM 0 HB2 PRO A 109 16.918 13.221 -6.294 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.258 13.013 -6.814 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.374 13.062 -4.015 1.00 0.00 H new ATOM 0 HG3 PRO A 109 14.923 13.826 -4.633 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.814 11.498 -3.235 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.666 11.847 -4.513 1.00 0.00 H new ATOM 1667 N HIS A 110 17.975 10.422 -4.673 1.00 0.00 N ATOM 1668 CA HIS A 110 19.384 10.076 -4.335 1.00 0.00 C ATOM 1669 C HIS A 110 19.756 8.750 -5.002 1.00 0.00 C ATOM 1670 O HIS A 110 20.917 8.445 -5.193 1.00 0.00 O ATOM 1671 CB HIS A 110 19.525 9.941 -2.818 1.00 0.00 C ATOM 1672 CG HIS A 110 20.943 9.570 -2.478 1.00 0.00 C ATOM 1673 ND1 HIS A 110 21.994 10.464 -2.611 1.00 0.00 N ATOM 1674 CD2 HIS A 110 21.501 8.405 -2.011 1.00 0.00 C ATOM 1675 CE1 HIS A 110 23.117 9.830 -2.232 1.00 0.00 C ATOM 1676 NE2 HIS A 110 22.873 8.572 -1.857 1.00 0.00 N ATOM 0 H HIS A 110 17.306 10.315 -3.910 1.00 0.00 H new ATOM 0 HA HIS A 110 20.048 10.862 -4.693 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.257 10.879 -2.332 1.00 0.00 H new ATOM 0 HB3 HIS A 110 18.839 9.181 -2.444 1.00 0.00 H new ATOM 0 HD2 HIS A 110 20.957 7.497 -1.796 1.00 0.00 H new ATOM 0 HE1 HIS A 110 24.097 10.283 -2.231 1.00 0.00 H new ATOM 0 HE2 HIS A 110 23.548 7.882 -1.528 1.00 0.00 H new ATOM 1684 N GLY A 111 18.780 7.961 -5.358 1.00 0.00 N ATOM 1685 CA GLY A 111 19.079 6.656 -6.012 1.00 0.00 C ATOM 1686 C GLY A 111 18.672 5.513 -5.079 1.00 0.00 C ATOM 1687 O GLY A 111 18.384 4.417 -5.514 1.00 0.00 O ATOM 0 H GLY A 111 17.789 8.163 -5.224 1.00 0.00 H new ATOM 0 HA2 GLY A 111 18.540 6.578 -6.956 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.142 6.589 -6.245 1.00 0.00 H new ATOM 1691 N GLY A 112 18.649 5.761 -3.798 1.00 0.00 N ATOM 1692 CA GLY A 112 18.262 4.689 -2.839 1.00 0.00 C ATOM 1693 C GLY A 112 16.753 4.450 -2.923 1.00 0.00 C ATOM 1694 O GLY A 112 16.034 5.183 -3.571 1.00 0.00 O ATOM 0 H GLY A 112 18.881 6.659 -3.375 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.800 3.769 -3.069 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.540 4.976 -1.825 1.00 0.00 H new ATOM 1698 N THR A 113 16.268 3.427 -2.272 1.00 0.00 N ATOM 1699 CA THR A 113 14.807 3.142 -2.317 1.00 0.00 C ATOM 1700 C THR A 113 14.260 3.048 -0.890 1.00 0.00 C ATOM 1701 O THR A 113 14.736 2.275 -0.083 1.00 0.00 O ATOM 1702 CB THR A 113 14.566 1.816 -3.042 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.075 1.904 -4.366 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.067 1.521 -3.088 1.00 0.00 C ATOM 0 H THR A 113 16.820 2.778 -1.712 1.00 0.00 H new ATOM 0 HA THR A 113 14.298 3.945 -2.850 1.00 0.00 H new ATOM 0 HB THR A 113 15.074 1.013 -2.509 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.811 1.266 -4.477 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.898 0.576 -3.605 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.678 1.454 -2.072 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.555 2.322 -3.620 1.00 0.00 H new ATOM 1712 N ILE A 114 13.261 3.827 -0.575 1.00 0.00 N ATOM 1713 CA ILE A 114 12.684 3.780 0.797 1.00 0.00 C ATOM 1714 C ILE A 114 11.442 2.886 0.792 1.00 0.00 C ATOM 1715 O ILE A 114 10.650 2.914 -0.129 1.00 0.00 O ATOM 1716 CB ILE A 114 12.296 5.193 1.236 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.514 6.113 1.129 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.808 5.161 2.685 1.00 0.00 C ATOM 1719 CD1 ILE A 114 13.087 7.559 1.389 1.00 0.00 C ATOM 0 H ILE A 114 12.820 4.494 -1.209 1.00 0.00 H new ATOM 0 HA ILE A 114 13.421 3.376 1.491 1.00 0.00 H new ATOM 0 HB ILE A 114 11.500 5.567 0.592 1.00 0.00 H new ATOM 0 HG12 ILE A 114 14.274 5.812 1.850 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.962 6.027 0.139 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.531 6.168 2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.940 4.506 2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.604 4.787 3.329 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.955 8.214 1.313 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.342 7.857 0.651 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.660 7.638 2.389 1.00 0.00 H new ATOM 1731 N ILE A 115 11.265 2.089 1.811 1.00 0.00 N ATOM 1732 CA ILE A 115 10.074 1.194 1.856 1.00 0.00 C ATOM 1733 C ILE A 115 9.252 1.490 3.113 1.00 0.00 C ATOM 1734 O ILE A 115 9.765 1.502 4.214 1.00 0.00 O ATOM 1735 CB ILE A 115 10.534 -0.265 1.882 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.483 -0.523 0.710 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.317 -1.186 1.765 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.780 -1.144 1.231 1.00 0.00 C ATOM 0 H ILE A 115 11.892 2.019 2.612 1.00 0.00 H new ATOM 0 HA ILE A 115 9.459 1.369 0.973 1.00 0.00 H new ATOM 0 HB ILE A 115 11.053 -0.465 2.820 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.013 -1.190 -0.013 1.00 0.00 H new ATOM 0 HG13 ILE A 115 11.698 0.410 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.644 -2.226 1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.641 -1.004 2.600 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.798 -0.986 0.828 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.456 -1.328 0.396 1.00 0.00 H new ATOM 0 HD12 ILE A 115 13.252 -0.461 1.937 1.00 0.00 H new ATOM 0 HD13 ILE A 115 12.557 -2.086 1.732 1.00 0.00 H new ATOM 1750 N LYS A 116 7.978 1.723 2.956 1.00 0.00 N ATOM 1751 CA LYS A 116 7.120 2.012 4.139 1.00 0.00 C ATOM 1752 C LYS A 116 6.252 0.787 4.438 1.00 0.00 C ATOM 1753 O LYS A 116 5.580 0.266 3.571 1.00 0.00 O ATOM 1754 CB LYS A 116 6.223 3.214 3.839 1.00 0.00 C ATOM 1755 CG LYS A 116 7.072 4.487 3.800 1.00 0.00 C ATOM 1756 CD LYS A 116 6.166 5.699 3.568 1.00 0.00 C ATOM 1757 CE LYS A 116 7.024 6.957 3.426 1.00 0.00 C ATOM 1758 NZ LYS A 116 7.537 7.054 2.031 1.00 0.00 N ATOM 0 H LYS A 116 7.494 1.726 2.058 1.00 0.00 H new ATOM 0 HA LYS A 116 7.747 2.238 5.002 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.715 3.073 2.885 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.449 3.303 4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.618 4.602 4.737 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.814 4.417 3.005 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.566 5.552 2.670 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.471 5.812 4.400 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.435 7.841 3.670 1.00 0.00 H new ATOM 0 HE3 LYS A 116 7.856 6.924 4.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 8.120 7.909 1.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 8.113 6.216 1.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.736 7.105 1.369 1.00 0.00 H new ATOM 1772 N THR A 117 6.264 0.320 5.656 1.00 0.00 N ATOM 1773 CA THR A 117 5.442 -0.875 5.999 1.00 0.00 C ATOM 1774 C THR A 117 4.491 -0.541 7.151 1.00 0.00 C ATOM 1775 O THR A 117 4.880 0.043 8.143 1.00 0.00 O ATOM 1776 CB THR A 117 6.365 -2.022 6.419 1.00 0.00 C ATOM 1777 OG1 THR A 117 7.305 -2.275 5.385 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.534 -3.281 6.675 1.00 0.00 C ATOM 0 H THR A 117 6.805 0.712 6.426 1.00 0.00 H new ATOM 0 HA THR A 117 4.859 -1.171 5.127 1.00 0.00 H new ATOM 0 HB THR A 117 6.894 -1.747 7.331 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.897 -3.008 5.654 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.192 -4.097 6.974 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.814 -3.086 7.470 1.00 0.00 H new ATOM 0 HG23 THR A 117 5.003 -3.558 5.764 1.00 0.00 H new ATOM 1786 N THR A 118 3.247 -0.914 7.026 1.00 0.00 N ATOM 1787 CA THR A 118 2.267 -0.628 8.112 1.00 0.00 C ATOM 1788 C THR A 118 1.697 -1.950 8.630 1.00 0.00 C ATOM 1789 O THR A 118 1.321 -2.816 7.865 1.00 0.00 O ATOM 1790 CB THR A 118 1.131 0.239 7.561 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.675 1.421 6.990 1.00 0.00 O ATOM 1792 CG2 THR A 118 0.175 0.611 8.695 1.00 0.00 C ATOM 0 H THR A 118 2.866 -1.405 6.217 1.00 0.00 H new ATOM 0 HA THR A 118 2.762 -0.097 8.925 1.00 0.00 H new ATOM 0 HB THR A 118 0.586 -0.316 6.798 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.950 1.977 6.635 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.633 1.228 8.302 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.241 -0.296 9.132 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.717 1.167 9.460 1.00 0.00 H new ATOM 1800 N SER A 119 1.635 -2.119 9.923 1.00 0.00 N ATOM 1801 CA SER A 119 1.095 -3.392 10.479 1.00 0.00 C ATOM 1802 C SER A 119 -0.125 -3.104 11.357 1.00 0.00 C ATOM 1803 O SER A 119 -0.097 -2.246 12.216 1.00 0.00 O ATOM 1804 CB SER A 119 2.174 -4.079 11.319 1.00 0.00 C ATOM 1805 OG SER A 119 1.718 -5.363 11.717 1.00 0.00 O ATOM 0 H SER A 119 1.934 -1.433 10.616 1.00 0.00 H new ATOM 0 HA SER A 119 0.798 -4.043 9.657 1.00 0.00 H new ATOM 0 HB2 SER A 119 3.095 -4.171 10.743 1.00 0.00 H new ATOM 0 HB3 SER A 119 2.406 -3.476 12.197 1.00 0.00 H new ATOM 0 HG SER A 119 1.787 -5.983 10.961 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.194 -3.824 11.149 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.419 -3.606 11.970 1.00 0.00 C ATOM 1813 C LYS A 120 -3.054 -4.962 12.286 1.00 0.00 C ATOM 1814 O LYS A 120 -3.255 -5.779 11.411 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.413 -2.744 11.190 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.458 -2.175 12.151 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.533 -1.432 11.354 1.00 0.00 C ATOM 1818 CE LYS A 120 -6.523 -0.778 12.321 1.00 0.00 C ATOM 1819 NZ LYS A 120 -7.531 0.001 11.548 1.00 0.00 N ATOM 0 H LYS A 120 -1.272 -4.556 10.443 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.155 -3.097 12.897 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -2.889 -1.933 10.684 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -3.900 -3.340 10.418 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -4.911 -2.979 12.731 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.984 -1.498 12.862 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.073 -0.674 10.720 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.056 -2.125 10.694 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.019 -1.541 12.921 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -5.993 -0.123 13.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -8.204 0.446 12.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -7.050 0.738 10.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.044 -0.636 10.905 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.367 -5.211 13.530 1.00 0.00 N ATOM 1834 CA TYR A 121 -3.980 -6.521 13.891 1.00 0.00 C ATOM 1835 C TYR A 121 -5.205 -6.293 14.779 1.00 0.00 C ATOM 1836 O TYR A 121 -5.267 -5.346 15.538 1.00 0.00 O ATOM 1837 CB TYR A 121 -2.957 -7.370 14.649 1.00 0.00 C ATOM 1838 CG TYR A 121 -2.725 -6.771 16.016 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -1.863 -5.678 16.164 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -3.371 -7.309 17.134 1.00 0.00 C ATOM 1841 CE1 TYR A 121 -1.648 -5.123 17.431 1.00 0.00 C ATOM 1842 CE2 TYR A 121 -3.157 -6.754 18.402 1.00 0.00 C ATOM 1843 CZ TYR A 121 -2.294 -5.661 18.550 1.00 0.00 C ATOM 1844 OH TYR A 121 -2.083 -5.114 19.799 1.00 0.00 O ATOM 0 H TYR A 121 -3.225 -4.567 14.308 1.00 0.00 H new ATOM 0 HA TYR A 121 -4.285 -7.038 12.981 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.317 -8.394 14.745 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.020 -7.412 14.094 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.364 -5.263 15.301 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -4.035 -8.153 17.019 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -0.983 -4.279 17.545 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -3.657 -7.169 19.265 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.608 -5.606 20.464 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.177 -7.158 14.692 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.396 -6.999 15.534 1.00 0.00 C ATOM 1856 C HIS A 122 -7.476 -8.160 16.527 1.00 0.00 C ATOM 1857 O HIS A 122 -6.887 -9.202 16.326 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.638 -7.002 14.641 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.599 -5.810 13.724 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -8.788 -4.517 14.186 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -8.396 -5.701 12.371 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -8.694 -3.692 13.127 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.457 -4.362 11.996 1.00 0.00 N ATOM 0 H HIS A 122 -6.180 -7.969 14.074 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.346 -6.055 16.077 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.677 -7.922 14.058 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.539 -6.974 15.253 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -8.216 -6.528 11.700 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -8.798 -2.619 13.185 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -8.345 -3.975 11.059 1.00 0.00 H new ATOM 1871 N THR A 123 -8.199 -7.989 17.599 1.00 0.00 N ATOM 1872 CA THR A 123 -8.312 -9.086 18.602 1.00 0.00 C ATOM 1873 C THR A 123 -9.784 -9.319 18.945 1.00 0.00 C ATOM 1874 O THR A 123 -10.616 -8.447 18.781 1.00 0.00 O ATOM 1875 CB THR A 123 -7.549 -8.696 19.870 1.00 0.00 C ATOM 1876 OG1 THR A 123 -8.115 -7.512 20.415 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.079 -8.450 19.528 1.00 0.00 C ATOM 0 H THR A 123 -8.716 -7.139 17.824 1.00 0.00 H new ATOM 0 HA THR A 123 -7.888 -10.001 18.187 1.00 0.00 H new ATOM 0 HB THR A 123 -7.619 -9.503 20.600 1.00 0.00 H new ATOM 0 HG1 THR A 123 -7.629 -7.261 21.228 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.537 -8.172 20.432 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.646 -9.359 19.110 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.005 -7.644 18.798 1.00 0.00 H new ATOM 2169 N ALA A 142 11.003 -7.326 9.722 1.00 0.00 N ATOM 2170 CA ALA A 142 12.076 -6.366 9.340 1.00 0.00 C ATOM 2171 C ALA A 142 13.408 -7.111 9.234 1.00 0.00 C ATOM 2172 O ALA A 142 14.214 -6.843 8.365 1.00 0.00 O ATOM 2173 CB ALA A 142 12.187 -5.273 10.406 1.00 0.00 C ATOM 0 HA ALA A 142 11.834 -5.912 8.379 1.00 0.00 H new ATOM 0 HB1 ALA A 142 12.972 -4.571 10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 142 11.237 -4.744 10.484 1.00 0.00 H new ATOM 0 HB3 ALA A 142 12.430 -5.726 11.367 1.00 0.00 H new ATOM 2179 N HIS A 143 13.645 -8.046 10.114 1.00 0.00 N ATOM 2180 CA HIS A 143 14.923 -8.809 10.065 1.00 0.00 C ATOM 2181 C HIS A 143 15.032 -9.534 8.722 1.00 0.00 C ATOM 2182 O HIS A 143 16.010 -9.405 8.013 1.00 0.00 O ATOM 2183 CB HIS A 143 14.947 -9.834 11.200 1.00 0.00 C ATOM 2184 CG HIS A 143 16.265 -10.558 11.194 1.00 0.00 C ATOM 2185 ND1 HIS A 143 16.628 -11.424 10.175 1.00 0.00 N ATOM 2186 CD2 HIS A 143 17.319 -10.555 12.076 1.00 0.00 C ATOM 2187 CE1 HIS A 143 17.851 -11.903 10.465 1.00 0.00 C ATOM 2188 NE2 HIS A 143 18.318 -11.404 11.614 1.00 0.00 N ATOM 0 H HIS A 143 13.008 -8.314 10.864 1.00 0.00 H new ATOM 0 HA HIS A 143 15.762 -8.122 10.177 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.798 -9.335 12.158 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.129 -10.544 11.080 1.00 0.00 H new ATOM 0 HD2 HIS A 143 17.364 -9.980 12.989 1.00 0.00 H new ATOM 0 HE1 HIS A 143 18.390 -12.605 9.846 1.00 0.00 H new ATOM 0 HE2 HIS A 143 19.215 -11.603 12.057 1.00 0.00 H new ATOM 2196 N LEU A 144 14.036 -10.297 8.365 1.00 0.00 N ATOM 2197 CA LEU A 144 14.084 -11.029 7.068 1.00 0.00 C ATOM 2198 C LEU A 144 14.159 -10.022 5.919 1.00 0.00 C ATOM 2199 O LEU A 144 14.818 -10.249 4.924 1.00 0.00 O ATOM 2200 CB LEU A 144 12.825 -11.883 6.915 1.00 0.00 C ATOM 2201 CG LEU A 144 12.736 -12.872 8.079 1.00 0.00 C ATOM 2202 CD1 LEU A 144 11.655 -13.914 7.782 1.00 0.00 C ATOM 2203 CD2 LEU A 144 14.084 -13.574 8.257 1.00 0.00 C ATOM 0 H LEU A 144 13.190 -10.445 8.916 1.00 0.00 H new ATOM 0 HA LEU A 144 14.963 -11.673 7.047 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.941 -11.246 6.896 1.00 0.00 H new ATOM 0 HB3 LEU A 144 12.850 -12.421 5.967 1.00 0.00 H new ATOM 0 HG LEU A 144 12.482 -12.335 8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 144 11.591 -14.619 8.611 1.00 0.00 H new ATOM 0 HD12 LEU A 144 10.694 -13.415 7.655 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.909 -14.451 6.868 1.00 0.00 H new ATOM 0 HD21 LEU A 144 14.021 -14.279 9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 144 14.338 -14.111 7.343 1.00 0.00 H new ATOM 0 HD23 LEU A 144 14.855 -12.833 8.469 1.00 0.00 H new ATOM 2215 N PHE A 145 13.492 -8.908 6.050 1.00 0.00 N ATOM 2216 CA PHE A 145 13.528 -7.887 4.966 1.00 0.00 C ATOM 2217 C PHE A 145 14.984 -7.555 4.636 1.00 0.00 C ATOM 2218 O PHE A 145 15.360 -7.444 3.486 1.00 0.00 O ATOM 2219 CB PHE A 145 12.809 -6.621 5.432 1.00 0.00 C ATOM 2220 CG PHE A 145 12.576 -5.710 4.250 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.539 -5.980 3.351 1.00 0.00 C ATOM 2222 CD2 PHE A 145 13.400 -4.595 4.054 1.00 0.00 C ATOM 2223 CE1 PHE A 145 11.323 -5.136 2.254 1.00 0.00 C ATOM 2224 CE2 PHE A 145 13.186 -3.751 2.958 1.00 0.00 C ATOM 2225 CZ PHE A 145 12.147 -4.021 2.059 1.00 0.00 C ATOM 0 H PHE A 145 12.924 -8.661 6.861 1.00 0.00 H new ATOM 0 HA PHE A 145 13.031 -8.278 4.078 1.00 0.00 H new ATOM 0 HB2 PHE A 145 11.858 -6.880 5.898 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.405 -6.109 6.188 1.00 0.00 H new ATOM 0 HD1 PHE A 145 10.904 -6.840 3.503 1.00 0.00 H new ATOM 0 HD2 PHE A 145 14.200 -4.386 4.748 1.00 0.00 H new ATOM 0 HE1 PHE A 145 10.522 -5.345 1.560 1.00 0.00 H new ATOM 0 HE2 PHE A 145 13.822 -2.892 2.806 1.00 0.00 H new ATOM 0 HZ PHE A 145 11.981 -3.369 1.214 1.00 0.00 H new ATOM 2235 N LYS A 146 15.807 -7.399 5.637 1.00 0.00 N ATOM 2236 CA LYS A 146 17.238 -7.078 5.381 1.00 0.00 C ATOM 2237 C LYS A 146 17.864 -8.190 4.538 1.00 0.00 C ATOM 2238 O LYS A 146 18.663 -7.941 3.657 1.00 0.00 O ATOM 2239 CB LYS A 146 17.984 -6.966 6.712 1.00 0.00 C ATOM 2240 CG LYS A 146 19.411 -6.477 6.458 1.00 0.00 C ATOM 2241 CD LYS A 146 20.175 -6.422 7.782 1.00 0.00 C ATOM 2242 CE LYS A 146 21.557 -5.808 7.546 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.452 -6.823 6.922 1.00 0.00 N ATOM 0 H LYS A 146 15.549 -7.480 6.621 1.00 0.00 H new ATOM 0 HA LYS A 146 17.308 -6.131 4.846 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.464 -6.275 7.375 1.00 0.00 H new ATOM 0 HB3 LYS A 146 18.004 -7.934 7.213 1.00 0.00 H new ATOM 0 HG2 LYS A 146 19.917 -7.145 5.761 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.392 -5.490 5.996 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.621 -5.829 8.510 1.00 0.00 H new ATOM 0 HD3 LYS A 146 20.276 -7.424 8.198 1.00 0.00 H new ATOM 0 HE2 LYS A 146 21.473 -4.935 6.899 1.00 0.00 H new ATOM 0 HE3 LYS A 146 21.981 -5.466 8.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.396 -6.411 6.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 22.527 -7.651 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.058 -7.117 6.005 1.00 0.00 H new ATOM 2257 N LEU A 147 17.505 -9.417 4.800 1.00 0.00 N ATOM 2258 CA LEU A 147 18.077 -10.543 4.010 1.00 0.00 C ATOM 2259 C LEU A 147 17.667 -10.390 2.546 1.00 0.00 C ATOM 2260 O LEU A 147 18.423 -10.693 1.643 1.00 0.00 O ATOM 2261 CB LEU A 147 17.547 -11.872 4.554 1.00 0.00 C ATOM 2262 CG LEU A 147 18.240 -12.195 5.881 1.00 0.00 C ATOM 2263 CD1 LEU A 147 19.756 -12.105 5.701 1.00 0.00 C ATOM 2264 CD2 LEU A 147 17.793 -11.193 6.947 1.00 0.00 C ATOM 0 H LEU A 147 16.841 -9.688 5.526 1.00 0.00 H new ATOM 0 HA LEU A 147 19.164 -10.530 4.089 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.468 -11.813 4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.728 -12.670 3.834 1.00 0.00 H new ATOM 0 HG LEU A 147 17.971 -13.204 6.194 1.00 0.00 H new ATOM 0 HD11 LEU A 147 20.249 -12.335 6.646 1.00 0.00 H new ATOM 0 HD12 LEU A 147 20.075 -12.819 4.942 1.00 0.00 H new ATOM 0 HD13 LEU A 147 20.026 -11.097 5.387 1.00 0.00 H new ATOM 0 HD21 LEU A 147 18.286 -11.423 7.892 1.00 0.00 H new ATOM 0 HD22 LEU A 147 18.061 -10.184 6.633 1.00 0.00 H new ATOM 0 HD23 LEU A 147 16.713 -11.257 7.077 1.00 0.00 H new ATOM 2276 N ILE A 148 16.475 -9.917 2.301 1.00 0.00 N ATOM 2277 CA ILE A 148 16.020 -9.741 0.894 1.00 0.00 C ATOM 2278 C ILE A 148 17.047 -8.900 0.136 1.00 0.00 C ATOM 2279 O ILE A 148 17.568 -9.311 -0.882 1.00 0.00 O ATOM 2280 CB ILE A 148 14.665 -9.030 0.881 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.622 -9.909 1.573 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.238 -8.775 -0.566 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.318 -9.123 1.733 1.00 0.00 C ATOM 0 H ILE A 148 15.798 -9.645 3.014 1.00 0.00 H new ATOM 0 HA ILE A 148 15.920 -10.715 0.415 1.00 0.00 H new ATOM 0 HB ILE A 148 14.747 -8.080 1.409 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.446 -10.812 0.988 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.989 -10.228 2.549 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.273 -8.269 -0.577 1.00 0.00 H new ATOM 0 HG22 ILE A 148 14.982 -8.149 -1.060 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.155 -9.725 -1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.574 -9.749 2.226 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.501 -8.233 2.336 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.949 -8.826 0.751 1.00 0.00 H new ATOM 2295 N GLU A 149 17.350 -7.728 0.625 1.00 0.00 N ATOM 2296 CA GLU A 149 18.349 -6.870 -0.071 1.00 0.00 C ATOM 2297 C GLU A 149 19.642 -7.663 -0.260 1.00 0.00 C ATOM 2298 O GLU A 149 20.246 -7.642 -1.314 1.00 0.00 O ATOM 2299 CB GLU A 149 18.632 -5.624 0.772 1.00 0.00 C ATOM 2300 CG GLU A 149 17.409 -4.705 0.748 1.00 0.00 C ATOM 2301 CD GLU A 149 16.437 -5.121 1.854 1.00 0.00 C ATOM 2302 OE1 GLU A 149 16.874 -5.779 2.783 1.00 0.00 O ATOM 2303 OE2 GLU A 149 15.271 -4.773 1.752 1.00 0.00 O ATOM 0 H GLU A 149 16.950 -7.329 1.474 1.00 0.00 H new ATOM 0 HA GLU A 149 17.958 -6.565 -1.042 1.00 0.00 H new ATOM 0 HB2 GLU A 149 18.865 -5.911 1.797 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.503 -5.098 0.382 1.00 0.00 H new ATOM 0 HG2 GLU A 149 17.716 -3.669 0.890 1.00 0.00 H new ATOM 0 HG3 GLU A 149 16.917 -4.761 -0.223 1.00 0.00 H new ATOM 2310 N GLY A 150 20.067 -8.370 0.751 1.00 0.00 N ATOM 2311 CA GLY A 150 21.316 -9.171 0.624 1.00 0.00 C ATOM 2312 C GLY A 150 21.065 -10.338 -0.333 1.00 0.00 C ATOM 2313 O GLY A 150 21.960 -10.804 -1.009 1.00 0.00 O ATOM 0 H GLY A 150 19.604 -8.427 1.658 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.127 -8.546 0.251 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.624 -9.545 1.600 1.00 0.00 H new ATOM 2317 N TYR A 151 19.849 -10.812 -0.396 1.00 0.00 N ATOM 2318 CA TYR A 151 19.537 -11.944 -1.311 1.00 0.00 C ATOM 2319 C TYR A 151 19.823 -11.522 -2.753 1.00 0.00 C ATOM 2320 O TYR A 151 20.400 -12.262 -3.525 1.00 0.00 O ATOM 2321 CB TYR A 151 18.059 -12.319 -1.173 1.00 0.00 C ATOM 2322 CG TYR A 151 17.777 -13.558 -1.988 1.00 0.00 C ATOM 2323 CD1 TYR A 151 17.417 -13.442 -3.337 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.875 -14.823 -1.397 1.00 0.00 C ATOM 2325 CE1 TYR A 151 17.155 -14.590 -4.093 1.00 0.00 C ATOM 2326 CE2 TYR A 151 17.614 -15.972 -2.153 1.00 0.00 C ATOM 2327 CZ TYR A 151 17.254 -15.855 -3.500 1.00 0.00 C ATOM 2328 OH TYR A 151 16.997 -16.988 -4.247 1.00 0.00 O ATOM 0 H TYR A 151 19.060 -10.463 0.147 1.00 0.00 H new ATOM 0 HA TYR A 151 20.155 -12.804 -1.052 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.814 -12.496 -0.126 1.00 0.00 H new ATOM 0 HB3 TYR A 151 17.430 -11.496 -1.513 1.00 0.00 H new ATOM 0 HD1 TYR A 151 17.342 -12.466 -3.794 1.00 0.00 H new ATOM 0 HD2 TYR A 151 18.152 -14.913 -0.357 1.00 0.00 H new ATOM 0 HE1 TYR A 151 16.877 -14.501 -5.133 1.00 0.00 H new ATOM 0 HE2 TYR A 151 17.690 -16.948 -1.697 1.00 0.00 H new ATOM 0 HH TYR A 151 17.112 -17.783 -3.685 1.00 0.00 H new ATOM 2338 N LEU A 152 19.426 -10.333 -3.122 1.00 0.00 N ATOM 2339 CA LEU A 152 19.677 -9.864 -4.512 1.00 0.00 C ATOM 2340 C LEU A 152 21.151 -9.485 -4.657 1.00 0.00 C ATOM 2341 O LEU A 152 21.801 -9.838 -5.621 1.00 0.00 O ATOM 2342 CB LEU A 152 18.802 -8.645 -4.810 1.00 0.00 C ATOM 2343 CG LEU A 152 17.333 -9.070 -4.837 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.848 -9.309 -3.408 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.493 -7.966 -5.485 1.00 0.00 C ATOM 0 H LEU A 152 18.939 -9.668 -2.520 1.00 0.00 H new ATOM 0 HA LEU A 152 19.433 -10.660 -5.215 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.956 -7.878 -4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 152 19.083 -8.207 -5.768 1.00 0.00 H new ATOM 0 HG LEU A 152 17.230 -9.989 -5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.801 -9.612 -3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 152 17.446 -10.095 -2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.950 -8.390 -2.831 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.446 -8.269 -5.504 1.00 0.00 H new ATOM 0 HD22 LEU A 152 16.594 -7.046 -4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 152 16.840 -7.796 -6.504 1.00 0.00 H new