USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1203 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 142 GLN : amide:sc= 1.01 K(o=0.81,f=-0.036) USER MOD Set 1.2: A 145 GLN : amide:sc= -0.194 K(o=0.81,f=-1.2) USER MOD Set 2.1: A 39 MET CE :methyl 156:sc= -0.704 (180deg=-2.93!) USER MOD Set 2.2: A 143 THR OG1 : rot 81:sc= 1.3 USER MOD Set 3.1: A 11 SER OG : rot 23:sc= 2.18 USER MOD Set 3.2: A 75 TYR OH : rot 21:sc= 1.24 USER MOD Set 4.1: A 61 HIS : no HE2:sc= 0.731 K(o=3.6,f=-3.1!) USER MOD Set 4.2: A 62 SER OG : rot -165:sc= 1.71 USER MOD Set 4.3: A 111 GLN : amide:sc= 1.18 K(o=3.6,f=-0.74) USER MOD Set 5.1: A 44 HIS : no HE2:sc= 0.677 K(o=1.9,f=-6.5!) USER MOD Set 5.2: A 48 LYS NZ :NH3+ 160:sc= 1.26 (180deg=1.18) USER MOD Set 6.1: A 35 SER OG : rot 90:sc= 1.06 USER MOD Set 6.2: A 38 LYS NZ :NH3+ 172:sc= -1.42! (180deg=-1.37!) USER MOD Set 7.1: A 1 GLY N :NH3+ 150:sc= 1.21 (180deg=-0.913) USER MOD Set 7.2: A 4 MET CE :methyl -171:sc= 0 (180deg=-0.0823) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HE2:sc= -0.12 K(o=-0.12,f=-1.9) USER MOD Single : A 7 GLN : amide:sc= -0.308 K(o=-0.31,f=-3!) USER MOD Single : A 8 GLN : amide:sc= 0.635 K(o=0.63,f=0) USER MOD Single : A 13 TYR OH : rot -143:sc= 1.24 USER MOD Single : A 19 HIS : no HE2:sc= 0.77 K(o=0.77,f=-3.6!) USER MOD Single : A 20 GLN : amide:sc= -1.57 X(o=-1.6,f=-1.9) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.57) USER MOD Single : A 53 MET CE :methyl -157:sc= -0.484 (180deg=-2.86) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= 0.812 K(o=0.81,f=-0.22) USER MOD Single : A 66 THR OG1 : rot 76:sc= 1.26 USER MOD Single : A 68 GLN : amide:sc= -0.23 K(o=-0.23,f=-5!) USER MOD Single : A 72 GLN : amide:sc= 0.0794 X(o=0.079,f=-0.011) USER MOD Single : A 77 TYR OH : rot -9:sc= 0.868 USER MOD Single : A 81 SER OG : rot 180:sc= -0.0122 USER MOD Single : A 84 SER OG : rot 70:sc= 1.68 USER MOD Single : A 87 LYS NZ :NH3+ -160:sc= 1.75 (180deg=0.767) USER MOD Single : A 90 MET CE :methyl 161:sc= -1.52 (180deg=-2.24) USER MOD Single : A 94 THR OG1 : rot -32:sc= 0.152 USER MOD Single : A 96 ASN : amide:sc= 0.389 K(o=0.39,f=-0.39) USER MOD Single : A 102 THR OG1 : rot 127:sc= 1.22 USER MOD Single : A 105 HIS : no HD1:sc= -4.45 X(o=-4.4,f=-4.3) USER MOD Single : A 106 LYS NZ :NH3+ 158:sc= 1.01 (180deg=0.391) USER MOD Single : A 108 SER OG : rot 56:sc= 1.06 USER MOD Single : A 119 LYS NZ :NH3+ -158:sc= 1.1 (180deg=-0.933!) USER MOD Single : A 120 GLN : amide:sc= 0.175 X(o=0.17,f=-0.066) USER MOD Single : A 133 MET CE :methyl -174:sc= -0.806 (180deg=-0.974) USER MOD Single : A 134 ASN : amide:sc= 0.284 K(o=0.28,f=-6.1!) USER MOD Single : A 135 SER OG : rot -30:sc= 0.0537 USER MOD Single : A 138 ASN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0163 USER MOD Single : A 146 ASN : amide:sc= -0.681 K(o=-0.68,f=-5.7!) USER MOD Single : A 151 LYS NZ :NH3+ 163:sc= 1.61 (180deg=1.01) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0.0426 X(o=0.043,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.028 20.362 0.106 1.00 0.00 N ATOM 2 CA GLY A 1 2.374 19.781 -1.066 1.00 0.00 C ATOM 3 C GLY A 1 2.104 20.926 -2.003 1.00 0.00 C ATOM 4 O GLY A 1 2.928 21.202 -2.873 1.00 0.00 O ATOM 0 H1 GLY A 1 2.795 19.799 0.949 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.058 20.363 -0.036 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.697 21.339 0.240 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.012 19.033 -1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.448 19.279 -0.787 1.00 0.00 H new ATOM 8 N SER A 2 1.031 21.669 -1.746 1.00 0.00 N ATOM 9 CA SER A 2 0.987 23.075 -2.119 1.00 0.00 C ATOM 10 C SER A 2 2.035 23.841 -1.294 1.00 0.00 C ATOM 11 O SER A 2 2.592 23.297 -0.331 1.00 0.00 O ATOM 12 CB SER A 2 -0.420 23.606 -1.819 1.00 0.00 C ATOM 13 OG SER A 2 -1.381 22.878 -2.558 1.00 0.00 O ATOM 0 H SER A 2 0.189 21.323 -1.285 1.00 0.00 H new ATOM 0 HA SER A 2 1.208 23.206 -3.178 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.629 23.522 -0.753 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.480 24.664 -2.073 1.00 0.00 H new ATOM 0 HG SER A 2 -2.277 23.223 -2.359 1.00 0.00 H new ATOM 19 N HIS A 3 2.337 25.087 -1.675 1.00 0.00 N ATOM 20 CA HIS A 3 3.207 25.930 -0.867 1.00 0.00 C ATOM 21 C HIS A 3 2.287 26.458 0.225 1.00 0.00 C ATOM 22 O HIS A 3 1.330 27.175 -0.069 1.00 0.00 O ATOM 23 CB HIS A 3 3.835 27.078 -1.667 1.00 0.00 C ATOM 24 CG HIS A 3 4.854 27.875 -0.875 1.00 0.00 C ATOM 25 ND1 HIS A 3 4.755 28.314 0.436 1.00 0.00 N ATOM 26 CD2 HIS A 3 6.074 28.282 -1.347 1.00 0.00 C ATOM 27 CE1 HIS A 3 5.895 28.959 0.734 1.00 0.00 C ATOM 28 NE2 HIS A 3 6.726 28.969 -0.321 1.00 0.00 N ATOM 0 H HIS A 3 1.993 25.525 -2.530 1.00 0.00 H new ATOM 0 HA HIS A 3 4.061 25.374 -0.480 1.00 0.00 H new ATOM 0 HB2 HIS A 3 4.315 26.671 -2.557 1.00 0.00 H new ATOM 0 HB3 HIS A 3 3.046 27.748 -2.008 1.00 0.00 H new ATOM 0 HD1 HIS A 3 3.961 28.173 1.061 1.00 0.00 H new ATOM 0 HD2 HIS A 3 6.463 28.103 -2.338 1.00 0.00 H new ATOM 0 HE1 HIS A 3 6.114 29.408 1.691 1.00 0.00 H new ATOM 36 N MET A 4 2.545 26.061 1.463 1.00 0.00 N ATOM 37 CA MET A 4 1.714 26.374 2.608 1.00 0.00 C ATOM 38 C MET A 4 2.287 27.547 3.406 1.00 0.00 C ATOM 39 O MET A 4 3.317 28.134 3.063 1.00 0.00 O ATOM 40 CB MET A 4 1.492 25.110 3.469 1.00 0.00 C ATOM 41 CG MET A 4 2.721 24.635 4.261 1.00 0.00 C ATOM 42 SD MET A 4 4.046 23.859 3.290 1.00 0.00 S ATOM 43 CE MET A 4 3.253 22.268 2.946 1.00 0.00 C ATOM 0 H MET A 4 3.361 25.497 1.701 1.00 0.00 H new ATOM 0 HA MET A 4 0.735 26.699 2.257 1.00 0.00 H new ATOM 0 HB2 MET A 4 0.681 25.305 4.170 1.00 0.00 H new ATOM 0 HB3 MET A 4 1.163 24.300 2.818 1.00 0.00 H new ATOM 0 HG2 MET A 4 3.140 25.491 4.791 1.00 0.00 H new ATOM 0 HG3 MET A 4 2.388 23.924 5.017 1.00 0.00 H new ATOM 0 HE1 MET A 4 3.977 21.591 2.493 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.885 21.836 3.877 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.419 22.418 2.261 1.00 0.00 H new ATOM 53 N LEU A 5 1.506 27.895 4.417 1.00 0.00 N ATOM 54 CA LEU A 5 1.623 28.822 5.535 1.00 0.00 C ATOM 55 C LEU A 5 1.237 27.924 6.732 1.00 0.00 C ATOM 56 O LEU A 5 0.913 26.753 6.491 1.00 0.00 O ATOM 57 CB LEU A 5 0.731 30.068 5.370 1.00 0.00 C ATOM 58 CG LEU A 5 -0.772 29.904 5.701 1.00 0.00 C ATOM 59 CD1 LEU A 5 -1.462 31.267 5.555 1.00 0.00 C ATOM 60 CD2 LEU A 5 -1.491 28.894 4.795 1.00 0.00 C ATOM 0 H LEU A 5 0.596 27.439 4.478 1.00 0.00 H new ATOM 0 HA LEU A 5 2.612 29.267 5.644 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.133 30.859 6.003 1.00 0.00 H new ATOM 0 HB3 LEU A 5 0.815 30.411 4.339 1.00 0.00 H new ATOM 0 HG LEU A 5 -0.832 29.523 6.720 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.522 31.165 5.786 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -1.008 31.980 6.243 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -1.346 31.626 4.532 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -2.540 28.829 5.083 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -1.419 29.220 3.757 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -1.025 27.914 4.900 1.00 0.00 H new ATOM 72 N ASP A 6 1.285 28.381 7.986 1.00 0.00 N ATOM 73 CA ASP A 6 1.041 27.467 9.109 1.00 0.00 C ATOM 74 C ASP A 6 -0.368 26.870 8.954 1.00 0.00 C ATOM 75 O ASP A 6 -1.380 27.571 9.018 1.00 0.00 O ATOM 76 CB ASP A 6 1.158 28.228 10.443 1.00 0.00 C ATOM 77 CG ASP A 6 2.499 28.948 10.613 1.00 0.00 C ATOM 78 OD1 ASP A 6 2.702 29.950 9.884 1.00 0.00 O ATOM 79 OD2 ASP A 6 3.304 28.498 11.457 1.00 0.00 O ATOM 0 H ASP A 6 1.484 29.347 8.247 1.00 0.00 H new ATOM 0 HA ASP A 6 1.781 26.667 9.108 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.351 28.957 10.509 1.00 0.00 H new ATOM 0 HB3 ASP A 6 1.023 27.527 11.267 1.00 0.00 H new ATOM 84 N GLN A 7 -0.414 25.563 8.691 1.00 0.00 N ATOM 85 CA GLN A 7 -1.517 24.700 8.394 1.00 0.00 C ATOM 86 C GLN A 7 -0.844 23.319 8.276 1.00 0.00 C ATOM 87 O GLN A 7 0.382 23.173 8.318 1.00 0.00 O ATOM 88 CB GLN A 7 -2.189 25.129 7.062 1.00 0.00 C ATOM 89 CG GLN A 7 -3.720 25.200 7.150 1.00 0.00 C ATOM 90 CD GLN A 7 -4.352 23.822 7.316 1.00 0.00 C ATOM 91 OE1 GLN A 7 -4.406 23.285 8.413 1.00 0.00 O ATOM 92 NE2 GLN A 7 -4.789 23.191 6.240 1.00 0.00 N ATOM 0 H GLN A 7 0.455 25.029 8.686 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.311 24.718 9.140 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.803 26.105 6.766 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -1.909 24.425 6.279 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.005 25.832 7.991 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -4.113 25.672 6.249 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -4.741 23.645 5.328 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -5.174 22.250 6.322 1.00 0.00 H new ATOM 101 N GLN A 8 -1.662 22.311 8.077 1.00 0.00 N ATOM 102 CA GLN A 8 -1.301 20.936 7.793 1.00 0.00 C ATOM 103 C GLN A 8 -1.774 20.566 6.378 1.00 0.00 C ATOM 104 O GLN A 8 -2.450 21.342 5.697 1.00 0.00 O ATOM 105 CB GLN A 8 -1.854 19.986 8.866 1.00 0.00 C ATOM 106 CG GLN A 8 -3.373 19.739 8.822 1.00 0.00 C ATOM 107 CD GLN A 8 -3.737 18.416 9.496 1.00 0.00 C ATOM 108 OE1 GLN A 8 -4.181 18.391 10.637 1.00 0.00 O ATOM 109 NE2 GLN A 8 -3.549 17.290 8.819 1.00 0.00 N ATOM 0 H GLN A 8 -2.673 22.438 8.112 1.00 0.00 H new ATOM 0 HA GLN A 8 -0.217 20.830 7.824 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.346 19.026 8.772 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -1.598 20.387 9.847 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -3.892 20.558 9.319 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -3.713 19.728 7.786 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -3.179 17.322 7.869 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.775 16.393 9.249 1.00 0.00 H new ATOM 118 N GLU A 9 -1.438 19.355 5.951 1.00 0.00 N ATOM 119 CA GLU A 9 -1.864 18.709 4.718 1.00 0.00 C ATOM 120 C GLU A 9 -2.266 17.284 5.107 1.00 0.00 C ATOM 121 O GLU A 9 -2.138 16.883 6.268 1.00 0.00 O ATOM 122 CB GLU A 9 -0.736 18.745 3.665 1.00 0.00 C ATOM 123 CG GLU A 9 -0.494 20.153 3.090 1.00 0.00 C ATOM 124 CD GLU A 9 0.583 20.161 1.999 1.00 0.00 C ATOM 125 OE1 GLU A 9 1.687 19.613 2.220 1.00 0.00 O ATOM 126 OE2 GLU A 9 0.383 20.760 0.912 1.00 0.00 O ATOM 0 H GLU A 9 -0.817 18.757 6.496 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.706 19.222 4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.186 18.379 4.116 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.984 18.064 2.851 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.426 20.540 2.679 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.197 20.825 3.895 1.00 0.00 H new ATOM 133 N GLU A 10 -2.785 16.542 4.138 1.00 0.00 N ATOM 134 CA GLU A 10 -3.120 15.125 4.232 1.00 0.00 C ATOM 135 C GLU A 10 -2.761 14.460 2.895 1.00 0.00 C ATOM 136 O GLU A 10 -2.397 15.147 1.936 1.00 0.00 O ATOM 137 CB GLU A 10 -4.611 14.898 4.485 1.00 0.00 C ATOM 138 CG GLU A 10 -5.211 15.328 5.823 1.00 0.00 C ATOM 139 CD GLU A 10 -6.559 14.610 5.968 1.00 0.00 C ATOM 140 OE1 GLU A 10 -6.530 13.420 6.366 1.00 0.00 O ATOM 141 OE2 GLU A 10 -7.590 15.193 5.563 1.00 0.00 O ATOM 0 H GLU A 10 -2.995 16.930 3.218 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.564 14.701 5.068 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.160 15.414 3.697 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.806 13.832 4.364 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.545 15.066 6.645 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.346 16.409 5.854 1.00 0.00 H new ATOM 148 N SER A 11 -2.886 13.131 2.815 1.00 0.00 N ATOM 149 CA SER A 11 -2.625 12.259 1.670 1.00 0.00 C ATOM 150 C SER A 11 -3.008 10.811 2.018 1.00 0.00 C ATOM 151 O SER A 11 -3.454 10.537 3.126 1.00 0.00 O ATOM 152 CB SER A 11 -1.188 12.415 1.141 1.00 0.00 C ATOM 153 OG SER A 11 -1.134 13.555 0.310 1.00 0.00 O ATOM 0 H SER A 11 -3.200 12.593 3.623 1.00 0.00 H new ATOM 0 HA SER A 11 -3.258 12.565 0.837 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.489 12.519 1.971 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.892 11.526 0.584 1.00 0.00 H new ATOM 0 HG SER A 11 -1.864 14.165 0.544 1.00 0.00 H new ATOM 159 N LEU A 12 -2.879 9.915 1.039 1.00 0.00 N ATOM 160 CA LEU A 12 -3.248 8.499 1.023 1.00 0.00 C ATOM 161 C LEU A 12 -2.861 7.755 2.313 1.00 0.00 C ATOM 162 O LEU A 12 -1.701 7.800 2.734 1.00 0.00 O ATOM 163 CB LEU A 12 -2.471 7.938 -0.185 1.00 0.00 C ATOM 164 CG LEU A 12 -2.718 6.495 -0.653 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.853 6.285 -1.892 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.275 5.427 0.337 1.00 0.00 C ATOM 0 H LEU A 12 -2.472 10.192 0.146 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.328 8.370 0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.672 8.593 -1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.409 8.028 0.042 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.792 6.390 -0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.992 5.271 -2.265 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.143 6.999 -2.663 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.805 6.436 -1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.486 4.440 -0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.205 5.522 0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.816 5.553 1.275 1.00 0.00 H new ATOM 178 N TYR A 13 -3.827 7.029 2.887 1.00 0.00 N ATOM 179 CA TYR A 13 -3.696 6.137 4.033 1.00 0.00 C ATOM 180 C TYR A 13 -3.983 4.702 3.567 1.00 0.00 C ATOM 181 O TYR A 13 -4.906 4.488 2.779 1.00 0.00 O ATOM 182 CB TYR A 13 -4.695 6.524 5.135 1.00 0.00 C ATOM 183 CG TYR A 13 -4.630 7.955 5.636 1.00 0.00 C ATOM 184 CD1 TYR A 13 -3.723 8.316 6.650 1.00 0.00 C ATOM 185 CD2 TYR A 13 -5.525 8.913 5.123 1.00 0.00 C ATOM 186 CE1 TYR A 13 -3.670 9.648 7.106 1.00 0.00 C ATOM 187 CE2 TYR A 13 -5.506 10.235 5.603 1.00 0.00 C ATOM 188 CZ TYR A 13 -4.566 10.614 6.587 1.00 0.00 C ATOM 189 OH TYR A 13 -4.526 11.892 7.052 1.00 0.00 O ATOM 0 H TYR A 13 -4.784 7.055 2.535 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.687 6.214 4.438 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.702 6.338 4.763 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.541 5.858 5.984 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.068 7.572 7.078 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -6.231 8.631 4.356 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.944 9.933 7.853 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -6.209 10.959 5.220 1.00 0.00 H new ATOM 0 HH TYR A 13 -5.436 12.252 7.099 1.00 0.00 H new ATOM 199 N LEU A 14 -3.228 3.710 4.042 1.00 0.00 N ATOM 200 CA LEU A 14 -3.366 2.290 3.715 1.00 0.00 C ATOM 201 C LEU A 14 -2.890 1.509 4.940 1.00 0.00 C ATOM 202 O LEU A 14 -1.728 1.642 5.337 1.00 0.00 O ATOM 203 CB LEU A 14 -2.504 1.953 2.479 1.00 0.00 C ATOM 204 CG LEU A 14 -2.762 0.628 1.744 1.00 0.00 C ATOM 205 CD1 LEU A 14 -1.522 0.215 0.947 1.00 0.00 C ATOM 206 CD2 LEU A 14 -3.215 -0.573 2.573 1.00 0.00 C ATOM 0 H LEU A 14 -2.466 3.884 4.698 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.397 2.032 3.475 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.628 2.761 1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.460 1.961 2.791 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.619 0.871 1.115 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.718 -0.725 0.431 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.285 0.988 0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.679 0.088 1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.357 -1.434 1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.457 -0.806 3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.155 -0.337 3.071 1.00 0.00 H new ATOM 218 N TRP A 15 -3.764 0.723 5.560 1.00 0.00 N ATOM 219 CA TRP A 15 -3.438 -0.136 6.683 1.00 0.00 C ATOM 220 C TRP A 15 -3.977 -1.547 6.439 1.00 0.00 C ATOM 221 O TRP A 15 -4.595 -1.827 5.412 1.00 0.00 O ATOM 222 CB TRP A 15 -3.912 0.540 7.977 1.00 0.00 C ATOM 223 CG TRP A 15 -5.376 0.787 8.173 1.00 0.00 C ATOM 224 CD1 TRP A 15 -6.168 0.091 9.021 1.00 0.00 C ATOM 225 CD2 TRP A 15 -6.200 1.873 7.638 1.00 0.00 C ATOM 226 NE1 TRP A 15 -7.422 0.680 9.047 1.00 0.00 N ATOM 227 CE2 TRP A 15 -7.484 1.813 8.253 1.00 0.00 C ATOM 228 CE3 TRP A 15 -5.984 2.932 6.727 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -8.481 2.780 8.005 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -6.988 3.877 6.443 1.00 0.00 C ATOM 231 CH2 TRP A 15 -8.229 3.834 7.101 1.00 0.00 C ATOM 0 H TRP A 15 -4.744 0.667 5.284 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.362 -0.270 6.793 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -3.566 -0.069 8.812 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.403 1.501 8.052 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -5.871 -0.781 9.585 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.208 0.321 9.588 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.025 3.018 6.237 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -9.435 2.714 8.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.802 4.647 5.708 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -8.975 4.593 6.918 1.00 0.00 H new ATOM 242 N ILE A 16 -3.686 -2.468 7.346 1.00 0.00 N ATOM 243 CA ILE A 16 -4.193 -3.827 7.348 1.00 0.00 C ATOM 244 C ILE A 16 -5.077 -3.844 8.583 1.00 0.00 C ATOM 245 O ILE A 16 -4.585 -3.616 9.689 1.00 0.00 O ATOM 246 CB ILE A 16 -3.052 -4.869 7.394 1.00 0.00 C ATOM 247 CG1 ILE A 16 -1.831 -4.496 6.543 1.00 0.00 C ATOM 248 CG2 ILE A 16 -3.565 -6.191 6.850 1.00 0.00 C ATOM 249 CD1 ILE A 16 -0.674 -5.502 6.560 1.00 0.00 C ATOM 0 H ILE A 16 -3.064 -2.278 8.132 1.00 0.00 H new ATOM 0 HA ILE A 16 -4.737 -4.098 6.443 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.742 -4.921 8.438 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -2.157 -4.364 5.511 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -1.454 -3.532 6.885 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -2.765 -6.931 6.879 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.401 -6.535 7.459 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -3.897 -6.056 5.821 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.134 -5.138 5.926 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -0.309 -5.620 7.580 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -1.023 -6.464 6.186 1.00 0.00 H new ATOM 261 N ASP A 17 -6.385 -3.995 8.406 1.00 0.00 N ATOM 262 CA ASP A 17 -7.322 -3.892 9.511 1.00 0.00 C ATOM 263 C ASP A 17 -7.322 -5.147 10.378 1.00 0.00 C ATOM 264 O ASP A 17 -7.295 -6.289 9.910 1.00 0.00 O ATOM 265 CB ASP A 17 -8.736 -3.542 9.026 1.00 0.00 C ATOM 266 CG ASP A 17 -9.273 -4.501 7.961 1.00 0.00 C ATOM 267 OD1 ASP A 17 -8.793 -4.360 6.813 1.00 0.00 O ATOM 268 OD2 ASP A 17 -10.186 -5.310 8.265 1.00 0.00 O ATOM 0 H ASP A 17 -6.818 -4.190 7.503 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.981 -3.069 10.139 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -9.414 -3.543 9.879 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -8.733 -2.529 8.623 1.00 0.00 H new ATOM 273 N ALA A 18 -7.392 -4.890 11.684 1.00 0.00 N ATOM 274 CA ALA A 18 -7.286 -5.862 12.758 1.00 0.00 C ATOM 275 C ALA A 18 -8.320 -6.977 12.700 1.00 0.00 C ATOM 276 O ALA A 18 -8.025 -8.074 13.172 1.00 0.00 O ATOM 277 CB ALA A 18 -7.445 -5.118 14.080 1.00 0.00 C ATOM 0 H ALA A 18 -7.532 -3.942 12.035 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.313 -6.344 12.657 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -7.370 -5.825 14.907 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.660 -4.367 14.172 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.419 -4.630 14.108 1.00 0.00 H new ATOM 283 N HIS A 19 -9.483 -6.750 12.082 1.00 0.00 N ATOM 284 CA HIS A 19 -10.574 -7.708 12.064 1.00 0.00 C ATOM 285 C HIS A 19 -10.093 -9.038 11.484 1.00 0.00 C ATOM 286 O HIS A 19 -10.481 -10.118 11.941 1.00 0.00 O ATOM 287 CB HIS A 19 -11.701 -7.152 11.187 1.00 0.00 C ATOM 288 CG HIS A 19 -12.025 -5.695 11.387 1.00 0.00 C ATOM 289 ND1 HIS A 19 -11.833 -4.722 10.435 1.00 0.00 N ATOM 290 CD2 HIS A 19 -12.519 -5.094 12.513 1.00 0.00 C ATOM 291 CE1 HIS A 19 -12.225 -3.553 10.966 1.00 0.00 C ATOM 292 NE2 HIS A 19 -12.658 -3.730 12.226 1.00 0.00 N ATOM 0 H HIS A 19 -9.688 -5.887 11.578 1.00 0.00 H new ATOM 0 HA HIS A 19 -10.932 -7.873 13.080 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -11.433 -7.306 10.142 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -12.603 -7.735 11.373 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -11.460 -4.863 9.496 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -12.757 -5.580 13.448 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -12.196 -2.603 10.453 1.00 0.00 H new ATOM 300 N GLN A 20 -9.220 -8.969 10.474 1.00 0.00 N ATOM 301 CA GLN A 20 -8.656 -10.148 9.860 1.00 0.00 C ATOM 302 C GLN A 20 -7.746 -10.893 10.835 1.00 0.00 C ATOM 303 O GLN A 20 -7.748 -12.124 10.873 1.00 0.00 O ATOM 304 CB GLN A 20 -7.898 -9.740 8.597 1.00 0.00 C ATOM 305 CG GLN A 20 -7.367 -10.977 7.876 1.00 0.00 C ATOM 306 CD GLN A 20 -8.503 -11.946 7.536 1.00 0.00 C ATOM 307 OE1 GLN A 20 -9.320 -11.690 6.668 1.00 0.00 O ATOM 308 NE2 GLN A 20 -8.621 -13.049 8.252 1.00 0.00 N ATOM 0 H GLN A 20 -8.893 -8.092 10.069 1.00 0.00 H new ATOM 0 HA GLN A 20 -9.460 -10.832 9.588 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.557 -9.179 7.934 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -7.071 -9.080 8.858 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.855 -10.677 6.962 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -6.631 -11.480 8.504 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -7.937 -13.262 8.978 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.397 -13.689 8.079 1.00 0.00 H new ATOM 317 N ALA A 21 -6.937 -10.172 11.605 1.00 0.00 N ATOM 318 CA ALA A 21 -6.127 -10.746 12.650 1.00 0.00 C ATOM 319 C ALA A 21 -6.999 -11.343 13.748 1.00 0.00 C ATOM 320 O ALA A 21 -6.677 -12.423 14.243 1.00 0.00 O ATOM 321 CB ALA A 21 -5.122 -9.728 13.131 1.00 0.00 C ATOM 0 H ALA A 21 -6.831 -9.162 11.512 1.00 0.00 H new ATOM 0 HA ALA A 21 -5.550 -11.586 12.263 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.511 -10.165 13.921 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -4.482 -9.428 12.301 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.646 -8.854 13.519 1.00 0.00 H new ATOM 327 N ARG A 22 -8.151 -10.753 14.075 1.00 0.00 N ATOM 328 CA ARG A 22 -9.068 -11.375 15.011 1.00 0.00 C ATOM 329 C ARG A 22 -9.364 -12.751 14.422 1.00 0.00 C ATOM 330 O ARG A 22 -9.069 -13.771 15.060 1.00 0.00 O ATOM 331 CB ARG A 22 -10.293 -10.465 15.242 1.00 0.00 C ATOM 332 CG ARG A 22 -11.101 -10.740 16.524 1.00 0.00 C ATOM 333 CD ARG A 22 -12.200 -11.804 16.392 1.00 0.00 C ATOM 334 NE ARG A 22 -11.650 -13.153 16.196 1.00 0.00 N ATOM 335 CZ ARG A 22 -12.277 -14.237 15.735 1.00 0.00 C ATOM 336 NH1 ARG A 22 -13.599 -14.232 15.574 1.00 0.00 N ATOM 337 NH2 ARG A 22 -11.558 -15.313 15.428 1.00 0.00 N ATOM 0 H ARG A 22 -8.462 -9.854 13.706 1.00 0.00 H new ATOM 0 HA ARG A 22 -8.663 -11.508 16.014 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.953 -9.429 15.264 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -10.961 -10.563 14.386 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.411 -11.050 17.309 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.559 -9.807 16.852 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.822 -11.794 17.287 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.847 -11.552 15.552 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.668 -13.276 16.443 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.138 -13.397 15.803 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.073 -15.063 15.221 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.545 -15.300 15.546 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -12.020 -16.151 15.074 1.00 0.00 H new ATOM 351 N VAL A 23 -9.868 -12.808 13.190 1.00 0.00 N ATOM 352 CA VAL A 23 -10.161 -14.041 12.469 1.00 0.00 C ATOM 353 C VAL A 23 -8.952 -14.989 12.464 1.00 0.00 C ATOM 354 O VAL A 23 -9.164 -16.200 12.467 1.00 0.00 O ATOM 355 CB VAL A 23 -10.701 -13.702 11.062 1.00 0.00 C ATOM 356 CG1 VAL A 23 -10.883 -14.925 10.149 1.00 0.00 C ATOM 357 CG2 VAL A 23 -12.063 -13.006 11.180 1.00 0.00 C ATOM 0 H VAL A 23 -10.090 -11.970 12.652 1.00 0.00 H new ATOM 0 HA VAL A 23 -10.947 -14.592 12.985 1.00 0.00 H new ATOM 0 HB VAL A 23 -9.947 -13.057 10.610 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.265 -14.602 9.181 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -9.923 -15.423 10.013 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -11.590 -15.618 10.605 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.438 -12.770 10.184 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -12.767 -13.667 11.686 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -11.953 -12.086 11.754 1.00 0.00 H new ATOM 367 N LEU A 24 -7.720 -14.475 12.549 1.00 0.00 N ATOM 368 CA LEU A 24 -6.527 -15.291 12.647 1.00 0.00 C ATOM 369 C LEU A 24 -6.380 -15.990 13.995 1.00 0.00 C ATOM 370 O LEU A 24 -6.143 -17.194 13.991 1.00 0.00 O ATOM 371 CB LEU A 24 -5.229 -14.489 12.374 1.00 0.00 C ATOM 372 CG LEU A 24 -4.872 -14.270 10.893 1.00 0.00 C ATOM 373 CD1 LEU A 24 -4.122 -12.962 10.606 1.00 0.00 C ATOM 374 CD2 LEU A 24 -4.009 -15.445 10.418 1.00 0.00 C ATOM 0 H LEU A 24 -7.532 -13.472 12.551 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.661 -16.045 11.872 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.320 -13.514 12.854 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.398 -15.005 12.855 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.818 -14.205 10.356 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.911 -12.890 9.539 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.737 -12.115 10.912 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.185 -12.950 11.163 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.748 -15.304 9.369 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.099 -15.493 11.015 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.566 -16.375 10.531 1.00 0.00 H new ATOM 386 N ILE A 25 -6.552 -15.286 15.125 1.00 0.00 N ATOM 387 CA ILE A 25 -6.259 -15.896 16.450 1.00 0.00 C ATOM 388 C ILE A 25 -7.004 -15.321 17.665 1.00 0.00 C ATOM 389 O ILE A 25 -6.666 -15.576 18.817 1.00 0.00 O ATOM 390 CB ILE A 25 -4.724 -15.921 16.711 1.00 0.00 C ATOM 391 CG1 ILE A 25 -4.103 -14.542 16.438 1.00 0.00 C ATOM 392 CG2 ILE A 25 -3.942 -17.007 15.946 1.00 0.00 C ATOM 393 CD1 ILE A 25 -2.842 -14.329 17.270 1.00 0.00 C ATOM 0 H ILE A 25 -6.882 -14.322 15.160 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.659 -16.906 16.361 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.631 -16.183 17.765 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.862 -14.452 15.379 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.829 -13.762 16.667 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -2.884 -16.939 16.198 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -4.318 -17.991 16.225 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -4.070 -16.860 14.874 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.426 -13.345 17.055 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.090 -14.394 18.329 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.108 -15.095 17.021 1.00 0.00 H new ATOM 405 N GLY A 26 -8.046 -14.553 17.413 1.00 0.00 N ATOM 406 CA GLY A 26 -8.819 -13.819 18.416 1.00 0.00 C ATOM 407 C GLY A 26 -8.070 -12.620 18.999 1.00 0.00 C ATOM 408 O GLY A 26 -8.479 -12.090 20.025 1.00 0.00 O ATOM 0 H GLY A 26 -8.398 -14.413 16.466 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.750 -13.473 17.966 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.089 -14.498 19.225 1.00 0.00 H new ATOM 412 N PHE A 27 -6.971 -12.229 18.363 1.00 0.00 N ATOM 413 CA PHE A 27 -6.064 -11.167 18.764 1.00 0.00 C ATOM 414 C PHE A 27 -6.397 -9.949 17.899 1.00 0.00 C ATOM 415 O PHE A 27 -6.656 -10.137 16.712 1.00 0.00 O ATOM 416 CB PHE A 27 -4.669 -11.727 18.478 1.00 0.00 C ATOM 417 CG PHE A 27 -3.476 -10.990 19.019 1.00 0.00 C ATOM 418 CD1 PHE A 27 -3.159 -9.704 18.556 1.00 0.00 C ATOM 419 CD2 PHE A 27 -2.630 -11.641 19.939 1.00 0.00 C ATOM 420 CE1 PHE A 27 -2.015 -9.066 19.046 1.00 0.00 C ATOM 421 CE2 PHE A 27 -1.463 -11.009 20.397 1.00 0.00 C ATOM 422 CZ PHE A 27 -1.157 -9.716 19.946 1.00 0.00 C ATOM 0 H PHE A 27 -6.673 -12.677 17.497 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.135 -10.861 19.808 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.634 -12.745 18.867 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.554 -11.795 17.396 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.790 -9.213 17.830 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -2.880 -12.630 20.293 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -1.789 -8.059 18.727 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.807 -11.514 21.090 1.00 0.00 H new ATOM 0 HZ PHE A 27 -0.261 -9.221 20.292 1.00 0.00 H new ATOM 432 N GLU A 28 -6.332 -8.726 18.427 1.00 0.00 N ATOM 433 CA GLU A 28 -6.761 -7.528 17.711 1.00 0.00 C ATOM 434 C GLU A 28 -5.645 -6.472 17.754 1.00 0.00 C ATOM 435 O GLU A 28 -5.245 -6.049 18.834 1.00 0.00 O ATOM 436 CB GLU A 28 -8.063 -7.030 18.359 1.00 0.00 C ATOM 437 CG GLU A 28 -8.874 -6.123 17.424 1.00 0.00 C ATOM 438 CD GLU A 28 -9.951 -6.890 16.636 1.00 0.00 C ATOM 439 OE1 GLU A 28 -10.825 -7.515 17.280 1.00 0.00 O ATOM 440 OE2 GLU A 28 -9.900 -6.865 15.387 1.00 0.00 O ATOM 0 H GLU A 28 -5.979 -8.540 19.366 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.954 -7.741 16.660 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.672 -7.886 18.648 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.825 -6.485 19.273 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.350 -5.337 18.010 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.198 -5.633 16.724 1.00 0.00 H new ATOM 447 N GLU A 29 -5.124 -6.107 16.582 1.00 0.00 N ATOM 448 CA GLU A 29 -4.146 -5.062 16.253 1.00 0.00 C ATOM 449 C GLU A 29 -4.186 -4.854 14.730 1.00 0.00 C ATOM 450 O GLU A 29 -4.241 -5.840 13.988 1.00 0.00 O ATOM 451 CB GLU A 29 -2.691 -5.461 16.569 1.00 0.00 C ATOM 452 CG GLU A 29 -2.139 -5.337 18.002 1.00 0.00 C ATOM 453 CD GLU A 29 -0.660 -5.780 18.077 1.00 0.00 C ATOM 454 OE1 GLU A 29 0.045 -5.787 17.038 1.00 0.00 O ATOM 455 OE2 GLU A 29 -0.242 -6.328 19.117 1.00 0.00 O ATOM 0 H GLU A 29 -5.412 -6.596 15.735 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.411 -4.184 16.843 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.570 -6.501 16.267 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.047 -4.864 15.923 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.229 -4.305 18.340 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.738 -5.947 18.678 1.00 0.00 H new ATOM 462 N ASP A 30 -4.172 -3.599 14.274 1.00 0.00 N ATOM 463 CA ASP A 30 -4.066 -3.191 12.868 1.00 0.00 C ATOM 464 C ASP A 30 -2.574 -3.121 12.510 1.00 0.00 C ATOM 465 O ASP A 30 -1.704 -3.379 13.349 1.00 0.00 O ATOM 466 CB ASP A 30 -4.719 -1.813 12.658 1.00 0.00 C ATOM 467 CG ASP A 30 -3.804 -0.656 13.071 1.00 0.00 C ATOM 468 OD1 ASP A 30 -3.729 -0.412 14.295 1.00 0.00 O ATOM 469 OD2 ASP A 30 -3.196 -0.049 12.160 1.00 0.00 O ATOM 0 H ASP A 30 -4.237 -2.800 14.905 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.581 -3.910 12.230 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.989 -1.700 11.608 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.644 -1.762 13.233 1.00 0.00 H new ATOM 474 N ILE A 31 -2.270 -2.840 11.243 1.00 0.00 N ATOM 475 CA ILE A 31 -0.898 -2.600 10.800 1.00 0.00 C ATOM 476 C ILE A 31 -0.978 -1.404 9.850 1.00 0.00 C ATOM 477 O ILE A 31 -1.480 -1.541 8.735 1.00 0.00 O ATOM 478 CB ILE A 31 -0.258 -3.846 10.126 1.00 0.00 C ATOM 479 CG1 ILE A 31 -0.278 -5.139 10.978 1.00 0.00 C ATOM 480 CG2 ILE A 31 1.210 -3.542 9.762 1.00 0.00 C ATOM 481 CD1 ILE A 31 -1.539 -5.993 10.785 1.00 0.00 C ATOM 0 H ILE A 31 -2.964 -2.773 10.499 1.00 0.00 H new ATOM 0 HA ILE A 31 -0.245 -2.393 11.648 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.876 -4.038 9.249 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.597 -5.740 10.729 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.191 -4.870 12.031 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.656 -4.417 9.290 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.247 -2.699 9.072 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.766 -3.295 10.667 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -1.478 -6.880 11.415 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -2.418 -5.411 11.062 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.618 -6.295 9.741 1.00 0.00 H new ATOM 493 N LEU A 32 -0.404 -0.260 10.225 1.00 0.00 N ATOM 494 CA LEU A 32 -0.475 0.962 9.429 1.00 0.00 C ATOM 495 C LEU A 32 0.721 0.961 8.466 1.00 0.00 C ATOM 496 O LEU A 32 1.866 0.982 8.919 1.00 0.00 O ATOM 497 CB LEU A 32 -0.500 2.189 10.368 1.00 0.00 C ATOM 498 CG LEU A 32 -1.069 3.505 9.783 1.00 0.00 C ATOM 499 CD1 LEU A 32 -0.910 3.665 8.270 1.00 0.00 C ATOM 500 CD2 LEU A 32 -2.554 3.703 10.115 1.00 0.00 C ATOM 0 H LEU A 32 0.124 -0.156 11.092 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.389 1.011 8.837 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.084 1.929 11.251 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.519 2.380 10.705 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.457 4.265 10.270 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.339 4.617 7.958 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.149 3.642 8.011 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.426 2.850 7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.902 4.640 9.681 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.132 2.876 9.703 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.684 3.734 11.197 1.00 0.00 H new ATOM 512 N ILE A 33 0.485 0.893 7.150 1.00 0.00 N ATOM 513 CA ILE A 33 1.550 0.804 6.147 1.00 0.00 C ATOM 514 C ILE A 33 1.895 2.203 5.620 1.00 0.00 C ATOM 515 O ILE A 33 3.062 2.606 5.587 1.00 0.00 O ATOM 516 CB ILE A 33 1.142 -0.127 4.980 1.00 0.00 C ATOM 517 CG1 ILE A 33 0.667 -1.500 5.499 1.00 0.00 C ATOM 518 CG2 ILE A 33 2.321 -0.298 3.997 1.00 0.00 C ATOM 519 CD1 ILE A 33 0.374 -2.473 4.359 1.00 0.00 C ATOM 0 H ILE A 33 -0.454 0.898 6.751 1.00 0.00 H new ATOM 0 HA ILE A 33 2.432 0.376 6.623 1.00 0.00 H new ATOM 0 HB ILE A 33 0.308 0.336 4.453 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.430 -1.925 6.151 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.231 -1.368 6.103 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.022 -0.955 3.180 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.604 0.675 3.595 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.171 -0.735 4.521 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.043 -3.426 4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.408 -2.061 3.721 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.278 -2.627 3.770 1.00 0.00 H new ATOM 531 N VAL A 34 0.875 2.919 5.147 1.00 0.00 N ATOM 532 CA VAL A 34 0.980 4.204 4.479 1.00 0.00 C ATOM 533 C VAL A 34 0.067 5.180 5.207 1.00 0.00 C ATOM 534 O VAL A 34 -1.093 4.857 5.448 1.00 0.00 O ATOM 535 CB VAL A 34 0.543 4.050 2.996 1.00 0.00 C ATOM 536 CG1 VAL A 34 0.937 5.256 2.131 1.00 0.00 C ATOM 537 CG2 VAL A 34 1.088 2.782 2.317 1.00 0.00 C ATOM 0 H VAL A 34 -0.090 2.598 5.226 1.00 0.00 H new ATOM 0 HA VAL A 34 2.006 4.573 4.496 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.543 3.977 3.057 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.606 5.092 1.106 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.465 6.156 2.525 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.020 5.377 2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.741 2.744 1.285 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.178 2.801 2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 34 0.732 1.901 2.852 1.00 0.00 H new ATOM 547 N SER A 35 0.566 6.354 5.573 1.00 0.00 N ATOM 548 CA SER A 35 -0.228 7.427 6.142 1.00 0.00 C ATOM 549 C SER A 35 0.320 8.666 5.453 1.00 0.00 C ATOM 550 O SER A 35 1.538 8.774 5.317 1.00 0.00 O ATOM 551 CB SER A 35 -0.156 7.463 7.679 1.00 0.00 C ATOM 552 OG SER A 35 1.031 8.043 8.174 1.00 0.00 O ATOM 0 H SER A 35 1.554 6.588 5.479 1.00 0.00 H new ATOM 0 HA SER A 35 -1.299 7.316 5.970 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.011 8.021 8.062 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.241 6.446 8.063 1.00 0.00 H new ATOM 0 HG SER A 35 0.899 9.007 8.293 1.00 0.00 H new ATOM 558 N GLU A 36 -0.539 9.541 4.945 1.00 0.00 N ATOM 559 CA GLU A 36 -0.177 10.710 4.157 1.00 0.00 C ATOM 560 C GLU A 36 0.899 10.428 3.078 1.00 0.00 C ATOM 561 O GLU A 36 1.708 11.286 2.740 1.00 0.00 O ATOM 562 CB GLU A 36 0.032 11.958 5.053 1.00 0.00 C ATOM 563 CG GLU A 36 1.369 12.153 5.799 1.00 0.00 C ATOM 564 CD GLU A 36 1.521 11.534 7.198 1.00 0.00 C ATOM 565 OE1 GLU A 36 0.885 10.520 7.564 1.00 0.00 O ATOM 566 OE2 GLU A 36 2.452 11.962 7.918 1.00 0.00 O ATOM 0 H GLU A 36 -1.546 9.451 5.077 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.031 10.975 3.534 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -0.122 12.837 4.427 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -0.760 11.957 5.801 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.163 11.750 5.169 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.546 13.225 5.889 1.00 0.00 H new ATOM 573 N GLY A 37 0.894 9.223 2.489 1.00 0.00 N ATOM 574 CA GLY A 37 1.885 8.768 1.501 1.00 0.00 C ATOM 575 C GLY A 37 3.289 8.473 2.069 1.00 0.00 C ATOM 576 O GLY A 37 4.157 7.975 1.357 1.00 0.00 O ATOM 0 H GLY A 37 0.183 8.520 2.691 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.508 7.865 1.020 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.976 9.528 0.725 1.00 0.00 H new ATOM 580 N LYS A 38 3.505 8.731 3.356 1.00 0.00 N ATOM 581 CA LYS A 38 4.703 8.636 4.198 1.00 0.00 C ATOM 582 C LYS A 38 5.212 7.198 4.413 1.00 0.00 C ATOM 583 O LYS A 38 5.502 6.854 5.559 1.00 0.00 O ATOM 584 CB LYS A 38 4.464 9.405 5.513 1.00 0.00 C ATOM 585 CG LYS A 38 5.754 9.820 6.243 1.00 0.00 C ATOM 586 CD LYS A 38 5.504 10.496 7.601 1.00 0.00 C ATOM 587 CE LYS A 38 4.866 9.575 8.658 1.00 0.00 C ATOM 588 NZ LYS A 38 3.391 9.537 8.571 1.00 0.00 N ATOM 0 H LYS A 38 2.723 9.063 3.921 1.00 0.00 H new ATOM 0 HA LYS A 38 5.525 9.110 3.661 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.878 10.298 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 38 3.865 8.785 6.180 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.375 8.937 6.395 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.319 10.501 5.606 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.452 10.871 7.987 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.857 11.360 7.450 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.258 8.565 8.537 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.158 9.914 9.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.024 8.804 9.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.003 10.462 8.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.106 9.319 7.595 1.00 0.00 H new ATOM 602 N MET A 39 5.154 6.307 3.415 1.00 0.00 N ATOM 603 CA MET A 39 5.488 4.886 3.557 1.00 0.00 C ATOM 604 C MET A 39 6.676 4.623 4.479 1.00 0.00 C ATOM 605 O MET A 39 7.817 5.003 4.211 1.00 0.00 O ATOM 606 CB MET A 39 5.826 4.249 2.197 1.00 0.00 C ATOM 607 CG MET A 39 4.585 3.859 1.414 1.00 0.00 C ATOM 608 SD MET A 39 4.922 3.063 -0.174 1.00 0.00 S ATOM 609 CE MET A 39 3.332 2.238 -0.438 1.00 0.00 C ATOM 0 H MET A 39 4.868 6.559 2.469 1.00 0.00 H new ATOM 0 HA MET A 39 4.594 4.441 3.994 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.418 4.950 1.608 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.444 3.365 2.357 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.983 3.185 2.024 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.985 4.752 1.239 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.185 2.063 -1.504 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.325 1.285 0.091 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.528 2.869 -0.060 1.00 0.00 H new ATOM 619 N ALA A 40 6.357 3.961 5.591 1.00 0.00 N ATOM 620 CA ALA A 40 7.316 3.474 6.559 1.00 0.00 C ATOM 621 C ALA A 40 8.147 2.371 5.889 1.00 0.00 C ATOM 622 O ALA A 40 7.728 1.797 4.881 1.00 0.00 O ATOM 623 CB ALA A 40 6.514 2.929 7.753 1.00 0.00 C ATOM 0 H ALA A 40 5.392 3.747 5.843 1.00 0.00 H new ATOM 0 HA ALA A 40 7.995 4.252 6.907 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.201 2.550 8.510 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.909 3.729 8.180 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.864 2.122 7.416 1.00 0.00 H new ATOM 629 N PRO A 41 9.290 1.985 6.474 1.00 0.00 N ATOM 630 CA PRO A 41 10.111 0.863 6.016 1.00 0.00 C ATOM 631 C PRO A 41 9.449 -0.489 6.370 1.00 0.00 C ATOM 632 O PRO A 41 10.126 -1.447 6.753 1.00 0.00 O ATOM 633 CB PRO A 41 11.479 1.104 6.673 1.00 0.00 C ATOM 634 CG PRO A 41 11.141 1.867 7.955 1.00 0.00 C ATOM 635 CD PRO A 41 9.922 2.684 7.578 1.00 0.00 C ATOM 0 HA PRO A 41 10.221 0.808 4.933 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.989 0.165 6.889 1.00 0.00 H new ATOM 0 HB3 PRO A 41 12.137 1.683 6.025 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.928 1.188 8.780 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.967 2.504 8.271 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.239 2.776 8.422 1.00 0.00 H new ATOM 0 HD3 PRO A 41 10.206 3.695 7.287 1.00 0.00 H new ATOM 643 N PHE A 42 8.122 -0.582 6.207 1.00 0.00 N ATOM 644 CA PHE A 42 7.249 -1.687 6.582 1.00 0.00 C ATOM 645 C PHE A 42 7.733 -3.028 6.037 1.00 0.00 C ATOM 646 O PHE A 42 7.487 -4.049 6.661 1.00 0.00 O ATOM 647 CB PHE A 42 5.821 -1.405 6.073 1.00 0.00 C ATOM 648 CG PHE A 42 5.599 -1.734 4.601 1.00 0.00 C ATOM 649 CD1 PHE A 42 5.893 -0.807 3.585 1.00 0.00 C ATOM 650 CD2 PHE A 42 5.105 -3.002 4.245 1.00 0.00 C ATOM 651 CE1 PHE A 42 5.728 -1.168 2.236 1.00 0.00 C ATOM 652 CE2 PHE A 42 4.951 -3.373 2.899 1.00 0.00 C ATOM 653 CZ PHE A 42 5.281 -2.455 1.887 1.00 0.00 C ATOM 0 H PHE A 42 7.596 0.177 5.775 1.00 0.00 H new ATOM 0 HA PHE A 42 7.260 -1.759 7.670 1.00 0.00 H new ATOM 0 HB2 PHE A 42 5.115 -1.981 6.672 1.00 0.00 H new ATOM 0 HB3 PHE A 42 5.592 -0.352 6.236 1.00 0.00 H new ATOM 0 HD1 PHE A 42 6.245 0.181 3.841 1.00 0.00 H new ATOM 0 HD2 PHE A 42 4.839 -3.704 5.022 1.00 0.00 H new ATOM 0 HE1 PHE A 42 5.947 -0.450 1.460 1.00 0.00 H new ATOM 0 HE2 PHE A 42 4.582 -4.355 2.644 1.00 0.00 H new ATOM 0 HZ PHE A 42 5.192 -2.736 0.848 1.00 0.00 H new ATOM 663 N THR A 43 8.477 -3.024 4.928 1.00 0.00 N ATOM 664 CA THR A 43 9.073 -4.188 4.290 1.00 0.00 C ATOM 665 C THR A 43 9.720 -5.125 5.316 1.00 0.00 C ATOM 666 O THR A 43 9.546 -6.339 5.216 1.00 0.00 O ATOM 667 CB THR A 43 10.084 -3.644 3.264 1.00 0.00 C ATOM 668 OG1 THR A 43 9.392 -3.251 2.097 1.00 0.00 O ATOM 669 CG2 THR A 43 11.209 -4.610 2.882 1.00 0.00 C ATOM 0 H THR A 43 8.688 -2.160 4.429 1.00 0.00 H new ATOM 0 HA THR A 43 8.319 -4.798 3.793 1.00 0.00 H new ATOM 0 HB THR A 43 10.575 -2.802 3.752 1.00 0.00 H new ATOM 0 HG1 THR A 43 10.030 -2.902 1.440 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.867 -4.133 2.155 1.00 0.00 H new ATOM 0 HG22 THR A 43 11.781 -4.872 3.772 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.781 -5.513 2.447 1.00 0.00 H new ATOM 677 N HIS A 44 10.455 -4.574 6.285 1.00 0.00 N ATOM 678 CA HIS A 44 11.165 -5.347 7.288 1.00 0.00 C ATOM 679 C HIS A 44 10.177 -6.184 8.108 1.00 0.00 C ATOM 680 O HIS A 44 10.185 -7.412 8.031 1.00 0.00 O ATOM 681 CB HIS A 44 11.974 -4.357 8.144 1.00 0.00 C ATOM 682 CG HIS A 44 12.620 -4.919 9.386 1.00 0.00 C ATOM 683 ND1 HIS A 44 12.393 -4.465 10.664 1.00 0.00 N ATOM 684 CD2 HIS A 44 13.587 -5.884 9.458 1.00 0.00 C ATOM 685 CE1 HIS A 44 13.236 -5.098 11.488 1.00 0.00 C ATOM 686 NE2 HIS A 44 13.940 -6.026 10.809 1.00 0.00 N ATOM 0 H HIS A 44 10.571 -3.566 6.390 1.00 0.00 H new ATOM 0 HA HIS A 44 11.853 -6.060 6.835 1.00 0.00 H new ATOM 0 HB2 HIS A 44 12.754 -3.923 7.519 1.00 0.00 H new ATOM 0 HB3 HIS A 44 11.313 -3.542 8.441 1.00 0.00 H new ATOM 0 HD1 HIS A 44 11.702 -3.766 10.937 1.00 0.00 H new ATOM 0 HD2 HIS A 44 14.003 -6.435 8.628 1.00 0.00 H new ATOM 0 HE1 HIS A 44 13.338 -4.895 12.544 1.00 0.00 H new ATOM 694 N ASP A 45 9.325 -5.508 8.869 1.00 0.00 N ATOM 695 CA ASP A 45 8.387 -6.081 9.831 1.00 0.00 C ATOM 696 C ASP A 45 7.182 -6.769 9.192 1.00 0.00 C ATOM 697 O ASP A 45 6.516 -7.552 9.856 1.00 0.00 O ATOM 698 CB ASP A 45 8.059 -5.066 10.932 1.00 0.00 C ATOM 699 CG ASP A 45 9.340 -4.768 11.719 1.00 0.00 C ATOM 700 OD1 ASP A 45 9.868 -5.700 12.376 1.00 0.00 O ATOM 701 OD2 ASP A 45 9.925 -3.682 11.514 1.00 0.00 O ATOM 0 H ASP A 45 9.265 -4.490 8.831 1.00 0.00 H new ATOM 0 HA ASP A 45 8.885 -6.915 10.326 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.661 -4.150 10.496 1.00 0.00 H new ATOM 0 HB3 ASP A 45 7.291 -5.463 11.596 1.00 0.00 H new ATOM 706 N PHE A 46 6.820 -6.421 7.958 1.00 0.00 N ATOM 707 CA PHE A 46 5.776 -7.084 7.180 1.00 0.00 C ATOM 708 C PHE A 46 6.303 -8.396 6.598 1.00 0.00 C ATOM 709 O PHE A 46 5.717 -9.454 6.825 1.00 0.00 O ATOM 710 CB PHE A 46 5.327 -6.129 6.060 1.00 0.00 C ATOM 711 CG PHE A 46 4.222 -6.559 5.100 1.00 0.00 C ATOM 712 CD1 PHE A 46 4.419 -7.602 4.167 1.00 0.00 C ATOM 713 CD2 PHE A 46 3.033 -5.804 5.035 1.00 0.00 C ATOM 714 CE1 PHE A 46 3.441 -7.892 3.201 1.00 0.00 C ATOM 715 CE2 PHE A 46 2.075 -6.068 4.041 1.00 0.00 C ATOM 716 CZ PHE A 46 2.279 -7.109 3.121 1.00 0.00 C ATOM 0 H PHE A 46 7.258 -5.647 7.458 1.00 0.00 H new ATOM 0 HA PHE A 46 4.926 -7.324 7.818 1.00 0.00 H new ATOM 0 HB2 PHE A 46 5.005 -5.201 6.532 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.206 -5.893 5.460 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.330 -8.182 4.197 1.00 0.00 H new ATOM 0 HD2 PHE A 46 2.857 -5.017 5.754 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.583 -8.718 2.520 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.179 -5.468 3.985 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.544 -7.306 2.354 1.00 0.00 H new ATOM 726 N ARG A 47 7.399 -8.349 5.820 1.00 0.00 N ATOM 727 CA ARG A 47 7.880 -9.539 5.113 1.00 0.00 C ATOM 728 C ARG A 47 8.444 -10.551 6.119 1.00 0.00 C ATOM 729 O ARG A 47 8.377 -11.754 5.874 1.00 0.00 O ATOM 730 CB ARG A 47 8.888 -9.135 4.024 1.00 0.00 C ATOM 731 CG ARG A 47 9.015 -10.215 2.939 1.00 0.00 C ATOM 732 CD ARG A 47 10.073 -9.844 1.888 1.00 0.00 C ATOM 733 NE ARG A 47 11.386 -10.417 2.229 1.00 0.00 N ATOM 734 CZ ARG A 47 12.519 -10.270 1.530 1.00 0.00 C ATOM 735 NH1 ARG A 47 12.630 -9.375 0.553 1.00 0.00 N ATOM 736 NH2 ARG A 47 13.564 -11.044 1.820 1.00 0.00 N ATOM 0 H ARG A 47 7.959 -7.510 5.669 1.00 0.00 H new ATOM 0 HA ARG A 47 7.054 -10.033 4.602 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.574 -8.196 3.568 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.863 -8.959 4.478 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.279 -11.166 3.401 1.00 0.00 H new ATOM 0 HG3 ARG A 47 8.051 -10.355 2.451 1.00 0.00 H new ATOM 0 HD2 ARG A 47 9.759 -10.205 0.909 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.154 -8.759 1.817 1.00 0.00 H new ATOM 0 HE ARG A 47 11.438 -10.979 3.078 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.839 -8.776 0.318 1.00 0.00 H new ATOM 0 HH12 ARG A 47 13.507 -9.287 0.039 1.00 0.00 H new ATOM 0 HH21 ARG A 47 13.494 -11.737 2.565 1.00 0.00 H new ATOM 0 HH22 ARG A 47 14.434 -10.944 1.296 1.00 0.00 H new ATOM 750 N LYS A 48 9.039 -10.097 7.229 1.00 0.00 N ATOM 751 CA LYS A 48 9.496 -10.933 8.332 1.00 0.00 C ATOM 752 C LYS A 48 8.591 -10.514 9.480 1.00 0.00 C ATOM 753 O LYS A 48 8.727 -9.389 9.938 1.00 0.00 O ATOM 754 CB LYS A 48 10.992 -10.632 8.573 1.00 0.00 C ATOM 755 CG LYS A 48 11.571 -11.026 9.951 1.00 0.00 C ATOM 756 CD LYS A 48 12.198 -9.840 10.721 1.00 0.00 C ATOM 757 CE LYS A 48 11.159 -8.760 11.066 1.00 0.00 C ATOM 758 NZ LYS A 48 11.680 -7.636 11.861 1.00 0.00 N ATOM 0 H LYS A 48 9.219 -9.105 7.383 1.00 0.00 H new ATOM 0 HA LYS A 48 9.434 -12.010 8.173 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.569 -11.144 7.803 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.150 -9.563 8.432 1.00 0.00 H new ATOM 0 HG2 LYS A 48 10.778 -11.463 10.557 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.328 -11.798 9.811 1.00 0.00 H new ATOM 0 HD2 LYS A 48 12.658 -10.207 11.639 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.993 -9.399 10.121 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.741 -8.368 10.139 1.00 0.00 H new ATOM 0 HE3 LYS A 48 10.340 -9.225 11.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.044 -6.819 11.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 11.736 -7.915 12.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.628 -7.379 11.519 1.00 0.00 H new ATOM 772 N ALA A 49 7.710 -11.377 9.983 1.00 0.00 N ATOM 773 CA ALA A 49 6.747 -10.972 11.002 1.00 0.00 C ATOM 774 C ALA A 49 6.225 -12.171 11.775 1.00 0.00 C ATOM 775 O ALA A 49 6.565 -13.320 11.483 1.00 0.00 O ATOM 776 CB ALA A 49 5.536 -10.289 10.345 1.00 0.00 C ATOM 0 H ALA A 49 7.644 -12.356 9.703 1.00 0.00 H new ATOM 0 HA ALA A 49 7.263 -10.290 11.678 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.824 -9.991 11.115 1.00 0.00 H new ATOM 0 HB2 ALA A 49 5.868 -9.407 9.797 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.056 -10.984 9.656 1.00 0.00 H new ATOM 782 N GLN A 50 5.401 -11.873 12.780 1.00 0.00 N ATOM 783 CA GLN A 50 4.672 -12.866 13.551 1.00 0.00 C ATOM 784 C GLN A 50 3.660 -13.487 12.566 1.00 0.00 C ATOM 785 O GLN A 50 3.371 -12.891 11.529 1.00 0.00 O ATOM 786 CB GLN A 50 4.008 -12.138 14.739 1.00 0.00 C ATOM 787 CG GLN A 50 3.098 -13.013 15.614 1.00 0.00 C ATOM 788 CD GLN A 50 2.777 -12.374 16.967 1.00 0.00 C ATOM 789 OE1 GLN A 50 2.952 -13.004 17.997 1.00 0.00 O ATOM 790 NE2 GLN A 50 2.304 -11.136 17.009 1.00 0.00 N ATOM 0 H GLN A 50 5.222 -10.915 13.082 1.00 0.00 H new ATOM 0 HA GLN A 50 5.289 -13.660 13.972 1.00 0.00 H new ATOM 0 HB2 GLN A 50 4.790 -11.713 15.368 1.00 0.00 H new ATOM 0 HB3 GLN A 50 3.422 -11.304 14.352 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.168 -13.208 15.080 1.00 0.00 H new ATOM 0 HG3 GLN A 50 3.579 -13.977 15.779 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.160 -10.615 16.144 1.00 0.00 H new ATOM 0 HE22 GLN A 50 2.084 -10.704 17.907 1.00 0.00 H new ATOM 799 N GLN A 51 3.066 -14.640 12.892 1.00 0.00 N ATOM 800 CA GLN A 51 2.179 -15.404 12.003 1.00 0.00 C ATOM 801 C GLN A 51 1.083 -14.559 11.323 1.00 0.00 C ATOM 802 O GLN A 51 0.665 -14.898 10.226 1.00 0.00 O ATOM 803 CB GLN A 51 1.607 -16.589 12.806 1.00 0.00 C ATOM 804 CG GLN A 51 0.832 -17.636 11.985 1.00 0.00 C ATOM 805 CD GLN A 51 -0.624 -17.248 11.719 1.00 0.00 C ATOM 806 OE1 GLN A 51 -1.384 -16.992 12.644 1.00 0.00 O ATOM 807 NE2 GLN A 51 -1.044 -17.196 10.469 1.00 0.00 N ATOM 0 H GLN A 51 3.191 -15.080 13.804 1.00 0.00 H new ATOM 0 HA GLN A 51 2.767 -15.771 11.162 1.00 0.00 H new ATOM 0 HB2 GLN A 51 2.430 -17.090 13.316 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.945 -16.196 13.578 1.00 0.00 H new ATOM 0 HG2 GLN A 51 1.339 -17.787 11.032 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.855 -18.589 12.513 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -0.402 -17.411 9.706 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.010 -16.941 10.266 1.00 0.00 H new ATOM 816 N ARG A 52 0.675 -13.432 11.915 1.00 0.00 N ATOM 817 CA ARG A 52 -0.344 -12.513 11.408 1.00 0.00 C ATOM 818 C ARG A 52 -0.129 -12.039 9.954 1.00 0.00 C ATOM 819 O ARG A 52 -1.089 -11.526 9.392 1.00 0.00 O ATOM 820 CB ARG A 52 -0.390 -11.300 12.366 1.00 0.00 C ATOM 821 CG ARG A 52 -1.689 -10.470 12.325 1.00 0.00 C ATOM 822 CD ARG A 52 -1.528 -9.099 12.999 1.00 0.00 C ATOM 823 NE ARG A 52 -1.219 -9.183 14.436 1.00 0.00 N ATOM 824 CZ ARG A 52 -0.677 -8.192 15.161 1.00 0.00 C ATOM 825 NH1 ARG A 52 -0.454 -6.987 14.646 1.00 0.00 N ATOM 826 NH2 ARG A 52 -0.331 -8.416 16.424 1.00 0.00 N ATOM 0 H ARG A 52 1.067 -13.122 12.804 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.289 -13.056 11.379 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.240 -11.658 13.385 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.448 -10.643 12.133 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.994 -10.329 11.288 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.487 -11.024 12.820 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.734 -8.547 12.496 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.447 -8.528 12.866 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.432 -10.058 14.915 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -0.696 -6.795 13.674 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.041 -6.254 15.223 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.478 -9.337 16.837 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.081 -7.667 16.980 1.00 0.00 H new ATOM 840 N MET A 53 1.059 -12.182 9.346 1.00 0.00 N ATOM 841 CA MET A 53 1.330 -11.659 8.001 1.00 0.00 C ATOM 842 C MET A 53 1.972 -12.661 7.030 1.00 0.00 C ATOM 843 O MET A 53 1.312 -12.992 6.049 1.00 0.00 O ATOM 844 CB MET A 53 2.118 -10.337 8.083 1.00 0.00 C ATOM 845 CG MET A 53 1.223 -9.129 8.370 1.00 0.00 C ATOM 846 SD MET A 53 -0.084 -8.825 7.148 1.00 0.00 S ATOM 847 CE MET A 53 0.879 -8.806 5.611 1.00 0.00 C ATOM 0 H MET A 53 1.853 -12.661 9.771 1.00 0.00 H new ATOM 0 HA MET A 53 0.353 -11.461 7.559 1.00 0.00 H new ATOM 0 HB2 MET A 53 2.873 -10.418 8.865 1.00 0.00 H new ATOM 0 HB3 MET A 53 2.647 -10.176 7.144 1.00 0.00 H new ATOM 0 HG2 MET A 53 0.760 -9.265 9.347 1.00 0.00 H new ATOM 0 HG3 MET A 53 1.850 -8.240 8.436 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.336 -8.247 4.849 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.843 -8.331 5.792 1.00 0.00 H new ATOM 0 HE3 MET A 53 1.037 -9.828 5.268 1.00 0.00 H new ATOM 857 N PRO A 54 3.218 -13.144 7.220 1.00 0.00 N ATOM 858 CA PRO A 54 3.879 -13.991 6.239 1.00 0.00 C ATOM 859 C PRO A 54 3.211 -15.360 6.129 1.00 0.00 C ATOM 860 O PRO A 54 2.582 -15.640 5.117 1.00 0.00 O ATOM 861 CB PRO A 54 5.355 -14.065 6.654 1.00 0.00 C ATOM 862 CG PRO A 54 5.332 -13.738 8.144 1.00 0.00 C ATOM 863 CD PRO A 54 4.170 -12.755 8.239 1.00 0.00 C ATOM 0 HA PRO A 54 3.799 -13.574 5.235 1.00 0.00 H new ATOM 0 HB2 PRO A 54 5.774 -15.054 6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 54 5.963 -13.352 6.097 1.00 0.00 H new ATOM 0 HG2 PRO A 54 5.165 -14.626 8.753 1.00 0.00 H new ATOM 0 HG3 PRO A 54 6.270 -13.294 8.478 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.714 -12.788 9.229 1.00 0.00 H new ATOM 0 HD3 PRO A 54 4.513 -11.733 8.080 1.00 0.00 H new ATOM 871 N ALA A 55 3.410 -16.238 7.116 1.00 0.00 N ATOM 872 CA ALA A 55 2.923 -17.606 7.057 1.00 0.00 C ATOM 873 C ALA A 55 1.416 -17.621 7.339 1.00 0.00 C ATOM 874 O ALA A 55 0.983 -17.389 8.468 1.00 0.00 O ATOM 875 CB ALA A 55 3.682 -18.470 8.072 1.00 0.00 C ATOM 0 H ALA A 55 3.913 -16.014 7.974 1.00 0.00 H new ATOM 0 HA ALA A 55 3.095 -18.019 6.063 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.314 -19.495 8.025 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.747 -18.456 7.838 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.526 -18.074 9.076 1.00 0.00 H new ATOM 881 N ILE A 56 0.632 -17.978 6.334 1.00 0.00 N ATOM 882 CA ILE A 56 -0.820 -17.981 6.297 1.00 0.00 C ATOM 883 C ILE A 56 -1.232 -19.454 6.201 1.00 0.00 C ATOM 884 O ILE A 56 -0.727 -20.158 5.325 1.00 0.00 O ATOM 885 CB ILE A 56 -1.276 -17.145 5.078 1.00 0.00 C ATOM 886 CG1 ILE A 56 -0.938 -15.651 5.285 1.00 0.00 C ATOM 887 CG2 ILE A 56 -2.779 -17.302 4.797 1.00 0.00 C ATOM 888 CD1 ILE A 56 -0.903 -14.861 3.974 1.00 0.00 C ATOM 0 H ILE A 56 1.029 -18.299 5.451 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.285 -17.535 7.176 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.732 -17.524 4.213 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.676 -15.206 5.952 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.030 -15.568 5.779 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.053 -16.697 3.933 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -3.004 -18.349 4.593 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.348 -16.972 5.666 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.661 -13.819 4.183 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.145 -15.284 3.314 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.878 -14.917 3.490 1.00 0.00 H new ATOM 900 N PRO A 57 -2.104 -19.976 7.076 1.00 0.00 N ATOM 901 CA PRO A 57 -2.577 -21.345 6.958 1.00 0.00 C ATOM 902 C PRO A 57 -3.656 -21.444 5.878 1.00 0.00 C ATOM 903 O PRO A 57 -4.380 -20.480 5.637 1.00 0.00 O ATOM 904 CB PRO A 57 -3.169 -21.667 8.329 1.00 0.00 C ATOM 905 CG PRO A 57 -3.712 -20.314 8.802 1.00 0.00 C ATOM 906 CD PRO A 57 -2.722 -19.309 8.208 1.00 0.00 C ATOM 0 HA PRO A 57 -1.782 -22.035 6.676 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -3.958 -22.416 8.261 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.415 -22.059 9.011 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -4.726 -20.140 8.442 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -3.744 -20.252 9.890 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.232 -18.399 7.893 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.974 -19.017 8.945 1.00 0.00 H new ATOM 914 N VAL A 58 -3.851 -22.645 5.330 1.00 0.00 N ATOM 915 CA VAL A 58 -4.906 -22.991 4.377 1.00 0.00 C ATOM 916 C VAL A 58 -6.277 -22.444 4.812 1.00 0.00 C ATOM 917 O VAL A 58 -7.029 -21.942 3.977 1.00 0.00 O ATOM 918 CB VAL A 58 -4.878 -24.526 4.154 1.00 0.00 C ATOM 919 CG1 VAL A 58 -5.289 -25.358 5.379 1.00 0.00 C ATOM 920 CG2 VAL A 58 -5.678 -24.941 2.916 1.00 0.00 C ATOM 0 H VAL A 58 -3.250 -23.439 5.549 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.722 -22.508 3.417 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.827 -24.756 3.982 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -5.240 -26.418 5.132 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -4.611 -25.147 6.206 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.307 -25.100 5.669 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -5.631 -26.024 2.798 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.717 -24.634 3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.256 -24.462 2.033 1.00 0.00 H new ATOM 930 N ASN A 59 -6.551 -22.494 6.124 1.00 0.00 N ATOM 931 CA ASN A 59 -7.773 -22.031 6.779 1.00 0.00 C ATOM 932 C ASN A 59 -8.084 -20.565 6.485 1.00 0.00 C ATOM 933 O ASN A 59 -9.251 -20.211 6.334 1.00 0.00 O ATOM 934 CB ASN A 59 -7.643 -22.234 8.296 1.00 0.00 C ATOM 935 CG ASN A 59 -8.901 -21.775 9.028 1.00 0.00 C ATOM 936 OD1 ASN A 59 -9.857 -22.524 9.146 1.00 0.00 O ATOM 937 ND2 ASN A 59 -8.922 -20.564 9.565 1.00 0.00 N ATOM 0 H ASN A 59 -5.884 -22.882 6.791 1.00 0.00 H new ATOM 0 HA ASN A 59 -8.599 -22.620 6.379 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.460 -23.287 8.509 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.781 -21.679 8.667 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.743 -20.250 10.083 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.117 -19.946 9.460 1.00 0.00 H new ATOM 944 N ILE A 60 -7.075 -19.687 6.457 1.00 0.00 N ATOM 945 CA ILE A 60 -7.315 -18.312 6.048 1.00 0.00 C ATOM 946 C ILE A 60 -7.412 -18.447 4.530 1.00 0.00 C ATOM 947 O ILE A 60 -6.424 -18.700 3.832 1.00 0.00 O ATOM 948 CB ILE A 60 -6.145 -17.433 6.567 1.00 0.00 C ATOM 949 CG1 ILE A 60 -6.223 -17.209 8.102 1.00 0.00 C ATOM 950 CG2 ILE A 60 -5.982 -16.099 5.830 1.00 0.00 C ATOM 951 CD1 ILE A 60 -6.885 -15.909 8.609 1.00 0.00 C ATOM 0 H ILE A 60 -6.110 -19.902 6.707 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.206 -17.824 6.443 1.00 0.00 H new ATOM 0 HB ILE A 60 -5.248 -18.010 6.344 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.763 -18.051 8.536 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -5.208 -17.244 8.497 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.143 -15.548 6.255 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.794 -16.288 4.773 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.893 -15.511 5.937 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.867 -15.892 9.699 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.339 -15.048 8.224 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.918 -15.868 8.263 1.00 0.00 H new ATOM 963 N HIS A 61 -8.611 -18.207 4.004 1.00 0.00 N ATOM 964 CA HIS A 61 -8.804 -18.178 2.569 1.00 0.00 C ATOM 965 C HIS A 61 -8.341 -16.831 2.053 1.00 0.00 C ATOM 966 O HIS A 61 -7.665 -16.785 1.032 1.00 0.00 O ATOM 967 CB HIS A 61 -10.254 -18.439 2.168 1.00 0.00 C ATOM 968 CG HIS A 61 -10.408 -18.434 0.664 1.00 0.00 C ATOM 969 ND1 HIS A 61 -10.536 -17.311 -0.126 1.00 0.00 N ATOM 970 CD2 HIS A 61 -10.275 -19.513 -0.168 1.00 0.00 C ATOM 971 CE1 HIS A 61 -10.481 -17.708 -1.408 1.00 0.00 C ATOM 972 NE2 HIS A 61 -10.314 -19.039 -1.482 1.00 0.00 N ATOM 0 H HIS A 61 -9.454 -18.032 4.551 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.217 -18.981 2.123 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -10.578 -19.400 2.567 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -10.899 -17.677 2.606 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -10.652 -16.353 0.203 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -10.161 -20.543 0.136 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -10.560 -17.049 -2.260 1.00 0.00 H new ATOM 980 N SER A 62 -8.656 -15.774 2.793 1.00 0.00 N ATOM 981 CA SER A 62 -8.424 -14.400 2.404 1.00 0.00 C ATOM 982 C SER A 62 -7.984 -13.585 3.608 1.00 0.00 C ATOM 983 O SER A 62 -8.216 -14.000 4.744 1.00 0.00 O ATOM 984 CB SER A 62 -9.766 -13.817 1.929 1.00 0.00 C ATOM 985 OG SER A 62 -10.481 -14.632 1.007 1.00 0.00 O ATOM 0 H SER A 62 -9.094 -15.860 3.710 1.00 0.00 H new ATOM 0 HA SER A 62 -7.659 -14.365 1.629 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.397 -13.640 2.800 1.00 0.00 H new ATOM 0 HB3 SER A 62 -9.581 -12.847 1.467 1.00 0.00 H new ATOM 0 HG SER A 62 -11.180 -14.100 0.574 1.00 0.00 H new ATOM 991 N MET A 63 -7.384 -12.429 3.349 1.00 0.00 N ATOM 992 CA MET A 63 -7.011 -11.436 4.337 1.00 0.00 C ATOM 993 C MET A 63 -7.677 -10.127 3.930 1.00 0.00 C ATOM 994 O MET A 63 -8.144 -10.000 2.799 1.00 0.00 O ATOM 995 CB MET A 63 -5.492 -11.298 4.491 1.00 0.00 C ATOM 996 CG MET A 63 -4.934 -12.433 5.355 1.00 0.00 C ATOM 997 SD MET A 63 -3.150 -12.715 5.240 1.00 0.00 S ATOM 998 CE MET A 63 -2.452 -11.083 5.599 1.00 0.00 C ATOM 0 H MET A 63 -7.135 -12.150 2.400 1.00 0.00 H new ATOM 0 HA MET A 63 -7.356 -11.743 5.324 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.018 -11.314 3.509 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.253 -10.336 4.945 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.183 -12.226 6.396 1.00 0.00 H new ATOM 0 HG3 MET A 63 -5.446 -13.356 5.082 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.364 -11.135 5.557 1.00 0.00 H new ATOM 0 HE2 MET A 63 -2.810 -10.364 4.862 1.00 0.00 H new ATOM 0 HE3 MET A 63 -2.761 -10.766 6.595 1.00 0.00 H new ATOM 1008 N ASN A 64 -7.685 -9.143 4.821 1.00 0.00 N ATOM 1009 CA ASN A 64 -8.175 -7.807 4.526 1.00 0.00 C ATOM 1010 C ASN A 64 -7.008 -6.847 4.593 1.00 0.00 C ATOM 1011 O ASN A 64 -6.022 -7.105 5.280 1.00 0.00 O ATOM 1012 CB ASN A 64 -9.152 -7.277 5.588 1.00 0.00 C ATOM 1013 CG ASN A 64 -10.536 -7.880 5.659 1.00 0.00 C ATOM 1014 OD1 ASN A 64 -10.969 -8.647 4.805 1.00 0.00 O ATOM 1015 ND2 ASN A 64 -11.275 -7.480 6.682 1.00 0.00 N ATOM 0 H ASN A 64 -7.348 -9.254 5.777 1.00 0.00 H new ATOM 0 HA ASN A 64 -8.665 -7.869 3.554 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -8.683 -7.407 6.564 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -9.265 -6.205 5.429 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.235 -7.810 6.777 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -10.884 -6.841 7.375 1.00 0.00 H new ATOM 1022 N PHE A 65 -7.170 -5.743 3.888 1.00 0.00 N ATOM 1023 CA PHE A 65 -6.357 -4.550 3.812 1.00 0.00 C ATOM 1024 C PHE A 65 -7.408 -3.445 3.745 1.00 0.00 C ATOM 1025 O PHE A 65 -8.502 -3.669 3.224 1.00 0.00 O ATOM 1026 CB PHE A 65 -5.424 -4.526 2.596 1.00 0.00 C ATOM 1027 CG PHE A 65 -4.129 -5.303 2.734 1.00 0.00 C ATOM 1028 CD1 PHE A 65 -4.115 -6.709 2.777 1.00 0.00 C ATOM 1029 CD2 PHE A 65 -2.913 -4.596 2.801 1.00 0.00 C ATOM 1030 CE1 PHE A 65 -2.900 -7.401 2.917 1.00 0.00 C ATOM 1031 CE2 PHE A 65 -1.697 -5.286 2.912 1.00 0.00 C ATOM 1032 CZ PHE A 65 -1.692 -6.686 2.991 1.00 0.00 C ATOM 0 H PHE A 65 -7.982 -5.655 3.277 1.00 0.00 H new ATOM 0 HA PHE A 65 -5.669 -4.458 4.652 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.969 -4.918 1.737 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.179 -3.488 2.372 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.042 -7.259 2.702 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -2.917 -3.517 2.767 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -2.894 -8.480 2.968 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -0.766 -4.740 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 65 -0.758 -7.216 3.109 1.00 0.00 H new ATOM 1042 N THR A 66 -7.106 -2.251 4.223 1.00 0.00 N ATOM 1043 CA THR A 66 -8.050 -1.152 4.256 1.00 0.00 C ATOM 1044 C THR A 66 -7.295 0.090 3.833 1.00 0.00 C ATOM 1045 O THR A 66 -6.202 0.345 4.327 1.00 0.00 O ATOM 1046 CB THR A 66 -8.662 -1.024 5.655 1.00 0.00 C ATOM 1047 OG1 THR A 66 -9.644 -2.022 5.855 1.00 0.00 O ATOM 1048 CG2 THR A 66 -9.349 0.333 5.816 1.00 0.00 C ATOM 0 H THR A 66 -6.189 -2.016 4.603 1.00 0.00 H new ATOM 0 HA THR A 66 -8.886 -1.314 3.576 1.00 0.00 H new ATOM 0 HB THR A 66 -7.854 -1.130 6.379 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.206 -2.883 6.020 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.778 0.407 6.815 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.619 1.130 5.675 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.141 0.431 5.073 1.00 0.00 H new ATOM 1056 N TRP A 67 -7.864 0.890 2.942 1.00 0.00 N ATOM 1057 CA TRP A 67 -7.205 2.115 2.527 1.00 0.00 C ATOM 1058 C TRP A 67 -8.211 3.211 2.251 1.00 0.00 C ATOM 1059 O TRP A 67 -9.410 2.944 2.097 1.00 0.00 O ATOM 1060 CB TRP A 67 -6.305 1.803 1.320 1.00 0.00 C ATOM 1061 CG TRP A 67 -6.920 1.353 0.024 1.00 0.00 C ATOM 1062 CD1 TRP A 67 -8.228 1.108 -0.229 1.00 0.00 C ATOM 1063 CD2 TRP A 67 -6.211 1.015 -1.206 1.00 0.00 C ATOM 1064 NE1 TRP A 67 -8.379 0.689 -1.535 1.00 0.00 N ATOM 1065 CE2 TRP A 67 -7.159 0.533 -2.157 1.00 0.00 C ATOM 1066 CE3 TRP A 67 -4.854 1.035 -1.598 1.00 0.00 C ATOM 1067 CZ2 TRP A 67 -6.774 0.030 -3.408 1.00 0.00 C ATOM 1068 CZ3 TRP A 67 -4.455 0.520 -2.848 1.00 0.00 C ATOM 1069 CH2 TRP A 67 -5.410 0.005 -3.742 1.00 0.00 C ATOM 0 H TRP A 67 -8.766 0.715 2.500 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.575 2.496 3.331 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.722 2.700 1.109 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.601 1.031 1.631 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.031 1.223 0.484 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.279 0.517 -1.983 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.113 1.450 -0.931 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -7.515 -0.333 -4.104 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.410 0.521 -3.120 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -5.094 -0.411 -4.687 1.00 0.00 H new ATOM 1080 N GLN A 68 -7.720 4.449 2.223 1.00 0.00 N ATOM 1081 CA GLN A 68 -8.508 5.595 1.842 1.00 0.00 C ATOM 1082 C GLN A 68 -7.653 6.835 1.594 1.00 0.00 C ATOM 1083 O GLN A 68 -6.566 6.997 2.145 1.00 0.00 O ATOM 1084 CB GLN A 68 -9.603 5.927 2.872 1.00 0.00 C ATOM 1085 CG GLN A 68 -9.154 5.888 4.331 1.00 0.00 C ATOM 1086 CD GLN A 68 -10.132 6.666 5.198 1.00 0.00 C ATOM 1087 OE1 GLN A 68 -11.112 6.144 5.711 1.00 0.00 O ATOM 1088 NE2 GLN A 68 -9.917 7.953 5.350 1.00 0.00 N ATOM 0 H GLN A 68 -6.756 4.675 2.468 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.988 5.312 0.905 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.995 6.921 2.655 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -10.427 5.225 2.743 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.094 4.855 4.674 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -8.155 6.314 4.424 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.100 8.388 4.922 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.568 8.518 5.896 1.00 0.00 H new ATOM 1097 N ALA A 69 -8.171 7.720 0.748 1.00 0.00 N ATOM 1098 CA ALA A 69 -7.616 9.029 0.459 1.00 0.00 C ATOM 1099 C ALA A 69 -8.076 10.021 1.537 1.00 0.00 C ATOM 1100 O ALA A 69 -8.727 9.654 2.516 1.00 0.00 O ATOM 1101 CB ALA A 69 -8.039 9.447 -0.950 1.00 0.00 C ATOM 0 H ALA A 69 -9.026 7.532 0.225 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.526 9.010 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.627 10.430 -1.177 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.665 8.721 -1.672 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.127 9.488 -1.006 1.00 0.00 H new ATOM 1107 N ALA A 70 -7.754 11.298 1.337 1.00 0.00 N ATOM 1108 CA ALA A 70 -7.981 12.382 2.265 1.00 0.00 C ATOM 1109 C ALA A 70 -8.889 13.409 1.591 1.00 0.00 C ATOM 1110 O ALA A 70 -8.476 14.146 0.698 1.00 0.00 O ATOM 1111 CB ALA A 70 -6.643 12.994 2.654 1.00 0.00 C ATOM 0 H ALA A 70 -7.305 11.611 0.476 1.00 0.00 H new ATOM 0 HA ALA A 70 -8.466 12.026 3.174 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.807 13.813 3.354 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.018 12.234 3.124 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -6.144 13.374 1.763 1.00 0.00 H new ATOM 1117 N GLY A 71 -10.163 13.337 1.946 1.00 0.00 N ATOM 1118 CA GLY A 71 -11.288 14.215 1.614 1.00 0.00 C ATOM 1119 C GLY A 71 -11.562 14.551 0.138 1.00 0.00 C ATOM 1120 O GLY A 71 -12.690 14.322 -0.297 1.00 0.00 O ATOM 0 H GLY A 71 -10.475 12.573 2.545 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -12.191 13.761 2.021 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.138 15.156 2.143 1.00 0.00 H new ATOM 1124 N GLN A 72 -10.660 15.228 -0.586 1.00 0.00 N ATOM 1125 CA GLN A 72 -10.760 15.489 -2.036 1.00 0.00 C ATOM 1126 C GLN A 72 -9.634 14.844 -2.872 1.00 0.00 C ATOM 1127 O GLN A 72 -9.739 14.729 -4.088 1.00 0.00 O ATOM 1128 CB GLN A 72 -10.883 16.999 -2.320 1.00 0.00 C ATOM 1129 CG GLN A 72 -12.303 17.563 -2.134 1.00 0.00 C ATOM 1130 CD GLN A 72 -12.642 17.966 -0.699 1.00 0.00 C ATOM 1131 OE1 GLN A 72 -12.377 19.083 -0.278 1.00 0.00 O ATOM 1132 NE2 GLN A 72 -13.270 17.100 0.079 1.00 0.00 N ATOM 0 H GLN A 72 -9.816 15.622 -0.171 1.00 0.00 H new ATOM 0 HA GLN A 72 -11.676 14.997 -2.363 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -10.201 17.538 -1.662 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -10.558 17.193 -3.342 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -12.422 18.433 -2.780 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -13.023 16.816 -2.468 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -13.492 16.168 -0.271 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -13.532 17.364 1.029 1.00 0.00 H new ATOM 1141 N ALA A 73 -8.571 14.383 -2.219 1.00 0.00 N ATOM 1142 CA ALA A 73 -7.324 13.844 -2.753 1.00 0.00 C ATOM 1143 C ALA A 73 -7.337 12.404 -3.315 1.00 0.00 C ATOM 1144 O ALA A 73 -6.458 11.650 -2.906 1.00 0.00 O ATOM 1145 CB ALA A 73 -6.228 14.055 -1.696 1.00 0.00 C ATOM 0 H ALA A 73 -8.561 14.377 -1.199 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.126 14.406 -3.666 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.283 13.661 -2.069 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.121 15.120 -1.490 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.502 13.534 -0.779 1.00 0.00 H new ATOM 1151 N GLU A 74 -8.377 11.897 -3.997 1.00 0.00 N ATOM 1152 CA GLU A 74 -8.386 10.511 -4.476 1.00 0.00 C ATOM 1153 C GLU A 74 -7.120 10.242 -5.306 1.00 0.00 C ATOM 1154 O GLU A 74 -6.913 10.830 -6.367 1.00 0.00 O ATOM 1155 CB GLU A 74 -9.671 10.156 -5.254 1.00 0.00 C ATOM 1156 CG GLU A 74 -10.925 10.099 -4.356 1.00 0.00 C ATOM 1157 CD GLU A 74 -12.005 9.024 -4.606 1.00 0.00 C ATOM 1158 OE1 GLU A 74 -11.867 8.191 -5.531 1.00 0.00 O ATOM 1159 OE2 GLU A 74 -12.963 8.975 -3.776 1.00 0.00 O ATOM 0 H GLU A 74 -9.218 12.426 -4.227 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.382 9.855 -3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.828 10.894 -6.041 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.538 9.191 -5.744 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.582 9.982 -3.328 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.414 11.071 -4.420 1.00 0.00 H new ATOM 1166 N TYR A 75 -6.261 9.369 -4.781 1.00 0.00 N ATOM 1167 CA TYR A 75 -5.056 8.862 -5.417 1.00 0.00 C ATOM 1168 C TYR A 75 -5.453 7.696 -6.311 1.00 0.00 C ATOM 1169 O TYR A 75 -6.180 6.813 -5.863 1.00 0.00 O ATOM 1170 CB TYR A 75 -4.047 8.451 -4.329 1.00 0.00 C ATOM 1171 CG TYR A 75 -3.235 9.601 -3.751 1.00 0.00 C ATOM 1172 CD1 TYR A 75 -3.694 10.367 -2.662 1.00 0.00 C ATOM 1173 CD2 TYR A 75 -1.990 9.906 -4.332 1.00 0.00 C ATOM 1174 CE1 TYR A 75 -2.917 11.430 -2.155 1.00 0.00 C ATOM 1175 CE2 TYR A 75 -1.202 10.951 -3.823 1.00 0.00 C ATOM 1176 CZ TYR A 75 -1.659 11.721 -2.735 1.00 0.00 C ATOM 1177 OH TYR A 75 -0.873 12.737 -2.284 1.00 0.00 O ATOM 0 H TYR A 75 -6.399 8.978 -3.849 1.00 0.00 H new ATOM 0 HA TYR A 75 -4.574 9.621 -6.034 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.586 7.961 -3.518 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.362 7.714 -4.747 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.649 10.139 -2.211 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -1.638 9.332 -5.176 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.281 12.020 -1.327 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -0.241 11.165 -4.267 1.00 0.00 H new ATOM 0 HH TYR A 75 -1.131 12.968 -1.367 1.00 0.00 H new ATOM 1187 N PHE A 76 -5.025 7.685 -7.570 1.00 0.00 N ATOM 1188 CA PHE A 76 -5.325 6.598 -8.492 1.00 0.00 C ATOM 1189 C PHE A 76 -4.331 5.486 -8.143 1.00 0.00 C ATOM 1190 O PHE A 76 -3.197 5.797 -7.776 1.00 0.00 O ATOM 1191 CB PHE A 76 -5.098 7.088 -9.933 1.00 0.00 C ATOM 1192 CG PHE A 76 -5.835 6.309 -11.003 1.00 0.00 C ATOM 1193 CD1 PHE A 76 -5.453 5.010 -11.376 1.00 0.00 C ATOM 1194 CD2 PHE A 76 -6.956 6.900 -11.619 1.00 0.00 C ATOM 1195 CE1 PHE A 76 -6.190 4.305 -12.337 1.00 0.00 C ATOM 1196 CE2 PHE A 76 -7.703 6.192 -12.574 1.00 0.00 C ATOM 1197 CZ PHE A 76 -7.328 4.880 -12.920 1.00 0.00 C ATOM 0 H PHE A 76 -4.461 8.430 -7.978 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.355 6.250 -8.414 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.399 8.134 -9.996 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.030 7.050 -10.149 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.587 4.552 -10.920 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.243 7.907 -11.354 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -5.880 3.313 -12.630 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.561 6.652 -13.041 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.915 4.318 -13.632 1.00 0.00 H new ATOM 1207 N TYR A 77 -4.679 4.212 -8.285 1.00 0.00 N ATOM 1208 CA TYR A 77 -3.762 3.103 -8.051 1.00 0.00 C ATOM 1209 C TYR A 77 -3.818 2.091 -9.192 1.00 0.00 C ATOM 1210 O TYR A 77 -4.802 2.038 -9.934 1.00 0.00 O ATOM 1211 CB TYR A 77 -4.117 2.401 -6.722 1.00 0.00 C ATOM 1212 CG TYR A 77 -5.319 1.467 -6.809 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -5.158 0.177 -7.354 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -6.602 1.891 -6.411 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -6.270 -0.639 -7.586 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -7.713 1.038 -6.563 1.00 0.00 C ATOM 1217 CZ TYR A 77 -7.547 -0.230 -7.164 1.00 0.00 C ATOM 1218 OH TYR A 77 -8.594 -1.078 -7.329 1.00 0.00 O ATOM 0 H TYR A 77 -5.614 3.918 -8.568 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.751 3.506 -7.997 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.252 1.831 -6.383 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.315 3.160 -5.965 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.169 -0.184 -7.594 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.735 2.875 -5.987 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.147 -1.586 -8.091 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.688 1.352 -6.221 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.311 -1.846 -7.868 1.00 0.00 H new ATOM 1228 N GLU A 78 -2.782 1.258 -9.294 1.00 0.00 N ATOM 1229 CA GLU A 78 -2.726 0.141 -10.221 1.00 0.00 C ATOM 1230 C GLU A 78 -1.803 -0.926 -9.627 1.00 0.00 C ATOM 1231 O GLU A 78 -0.788 -0.605 -9.013 1.00 0.00 O ATOM 1232 CB GLU A 78 -2.342 0.594 -11.641 1.00 0.00 C ATOM 1233 CG GLU A 78 -2.257 -0.596 -12.611 1.00 0.00 C ATOM 1234 CD GLU A 78 -2.205 -0.160 -14.078 1.00 0.00 C ATOM 1235 OE1 GLU A 78 -1.080 0.060 -14.580 1.00 0.00 O ATOM 1236 OE2 GLU A 78 -3.294 -0.081 -14.693 1.00 0.00 O ATOM 0 H GLU A 78 -1.944 1.348 -8.720 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.713 -0.303 -10.347 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.078 1.310 -12.007 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.382 1.110 -11.612 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.370 -1.185 -12.380 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.119 -1.245 -12.460 1.00 0.00 H new ATOM 1243 N PHE A 79 -2.200 -2.194 -9.715 1.00 0.00 N ATOM 1244 CA PHE A 79 -1.451 -3.337 -9.196 1.00 0.00 C ATOM 1245 C PHE A 79 -0.359 -3.741 -10.192 1.00 0.00 C ATOM 1246 O PHE A 79 -0.640 -4.393 -11.197 1.00 0.00 O ATOM 1247 CB PHE A 79 -2.394 -4.525 -8.906 1.00 0.00 C ATOM 1248 CG PHE A 79 -3.228 -4.433 -7.635 1.00 0.00 C ATOM 1249 CD1 PHE A 79 -4.429 -3.704 -7.631 1.00 0.00 C ATOM 1250 CD2 PHE A 79 -2.832 -5.096 -6.456 1.00 0.00 C ATOM 1251 CE1 PHE A 79 -5.209 -3.604 -6.468 1.00 0.00 C ATOM 1252 CE2 PHE A 79 -3.598 -4.972 -5.278 1.00 0.00 C ATOM 1253 CZ PHE A 79 -4.779 -4.206 -5.282 1.00 0.00 C ATOM 0 H PHE A 79 -3.077 -2.462 -10.162 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.979 -3.048 -8.257 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.072 -4.637 -9.752 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.794 -5.433 -8.856 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.757 -3.213 -8.536 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -1.938 -5.702 -6.454 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.142 -3.061 -6.490 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.278 -5.465 -4.372 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.350 -4.084 -4.373 1.00 0.00 H new ATOM 1263 N LEU A 80 0.898 -3.395 -9.892 1.00 0.00 N ATOM 1264 CA LEU A 80 2.072 -3.800 -10.661 1.00 0.00 C ATOM 1265 C LEU A 80 2.246 -5.317 -10.503 1.00 0.00 C ATOM 1266 O LEU A 80 2.537 -6.025 -11.472 1.00 0.00 O ATOM 1267 CB LEU A 80 3.300 -3.023 -10.138 1.00 0.00 C ATOM 1268 CG LEU A 80 4.484 -2.920 -11.123 1.00 0.00 C ATOM 1269 CD1 LEU A 80 5.584 -2.032 -10.530 1.00 0.00 C ATOM 1270 CD2 LEU A 80 5.110 -4.261 -11.509 1.00 0.00 C ATOM 0 H LEU A 80 1.129 -2.812 -9.088 1.00 0.00 H new ATOM 0 HA LEU A 80 1.957 -3.572 -11.721 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.984 -2.015 -9.869 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.650 -3.502 -9.224 1.00 0.00 H new ATOM 0 HG LEU A 80 4.061 -2.492 -12.032 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.415 -1.965 -11.232 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.185 -1.035 -10.343 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.934 -2.464 -9.593 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.933 -4.092 -12.203 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.486 -4.758 -10.615 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.358 -4.890 -11.985 1.00 0.00 H new ATOM 1282 N SER A 81 2.056 -5.837 -9.286 1.00 0.00 N ATOM 1283 CA SER A 81 2.168 -7.254 -8.984 1.00 0.00 C ATOM 1284 C SER A 81 0.998 -7.730 -8.137 1.00 0.00 C ATOM 1285 O SER A 81 0.534 -7.022 -7.245 1.00 0.00 O ATOM 1286 CB SER A 81 3.509 -7.565 -8.309 1.00 0.00 C ATOM 1287 OG SER A 81 4.584 -6.974 -9.026 1.00 0.00 O ATOM 0 H SER A 81 1.816 -5.269 -8.474 1.00 0.00 H new ATOM 0 HA SER A 81 2.134 -7.802 -9.926 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.501 -7.192 -7.285 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.652 -8.644 -8.254 1.00 0.00 H new ATOM 0 HG SER A 81 5.430 -7.183 -8.578 1.00 0.00 H new ATOM 1293 N LEU A 82 0.534 -8.941 -8.441 1.00 0.00 N ATOM 1294 CA LEU A 82 -0.478 -9.713 -7.737 1.00 0.00 C ATOM 1295 C LEU A 82 -0.443 -11.086 -8.418 1.00 0.00 C ATOM 1296 O LEU A 82 -1.088 -11.258 -9.450 1.00 0.00 O ATOM 1297 CB LEU A 82 -1.841 -9.001 -7.847 1.00 0.00 C ATOM 1298 CG LEU A 82 -2.830 -9.608 -6.843 1.00 0.00 C ATOM 1299 CD1 LEU A 82 -3.513 -8.551 -5.983 1.00 0.00 C ATOM 1300 CD2 LEU A 82 -3.888 -10.418 -7.571 1.00 0.00 C ATOM 0 H LEU A 82 0.888 -9.445 -9.254 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.301 -9.817 -6.667 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.721 -7.935 -7.653 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.232 -9.099 -8.860 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.250 -10.252 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.202 -9.035 -5.291 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.761 -7.998 -5.420 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.065 -7.863 -6.623 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.583 -10.843 -6.847 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.432 -9.771 -8.259 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.410 -11.222 -8.130 1.00 0.00 H new ATOM 1312 N ARG A 83 0.334 -12.048 -7.902 1.00 0.00 N ATOM 1313 CA ARG A 83 0.538 -13.359 -8.556 1.00 0.00 C ATOM 1314 C ARG A 83 1.089 -14.394 -7.573 1.00 0.00 C ATOM 1315 O ARG A 83 1.711 -14.016 -6.576 1.00 0.00 O ATOM 1316 CB ARG A 83 1.604 -13.259 -9.680 1.00 0.00 C ATOM 1317 CG ARG A 83 1.184 -12.697 -11.055 1.00 0.00 C ATOM 1318 CD ARG A 83 1.434 -11.198 -11.305 1.00 0.00 C ATOM 1319 NE ARG A 83 2.836 -10.792 -11.095 1.00 0.00 N ATOM 1320 CZ ARG A 83 3.353 -9.592 -11.375 1.00 0.00 C ATOM 1321 NH1 ARG A 83 2.686 -8.725 -12.136 1.00 0.00 N ATOM 1322 NH2 ARG A 83 4.511 -9.260 -10.829 1.00 0.00 N ATOM 0 H ARG A 83 0.840 -11.945 -7.022 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.438 -13.653 -8.943 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.421 -12.641 -9.306 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.008 -14.258 -9.841 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.709 -13.261 -11.826 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.119 -12.890 -11.189 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.143 -10.955 -12.327 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.793 -10.616 -10.644 1.00 0.00 H new ATOM 0 HE ARG A 83 3.467 -11.489 -10.701 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.771 -8.975 -12.511 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.090 -7.812 -12.343 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.989 -9.914 -10.210 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.926 -8.350 -11.027 1.00 0.00 H new ATOM 1336 N SER A 84 0.888 -15.687 -7.844 1.00 0.00 N ATOM 1337 CA SER A 84 1.491 -16.757 -7.060 1.00 0.00 C ATOM 1338 C SER A 84 2.965 -16.863 -7.453 1.00 0.00 C ATOM 1339 O SER A 84 3.364 -16.450 -8.546 1.00 0.00 O ATOM 1340 CB SER A 84 0.824 -18.107 -7.353 1.00 0.00 C ATOM 1341 OG SER A 84 1.082 -18.996 -6.280 1.00 0.00 O ATOM 0 H SER A 84 0.303 -16.016 -8.612 1.00 0.00 H new ATOM 0 HA SER A 84 1.367 -16.526 -6.002 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.250 -17.975 -7.482 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.208 -18.521 -8.285 1.00 0.00 H new ATOM 0 HG SER A 84 0.586 -18.704 -5.487 1.00 0.00 H new ATOM 1347 N LEU A 85 3.768 -17.512 -6.606 1.00 0.00 N ATOM 1348 CA LEU A 85 5.163 -17.797 -6.908 1.00 0.00 C ATOM 1349 C LEU A 85 5.466 -19.289 -6.856 1.00 0.00 C ATOM 1350 O LEU A 85 6.340 -19.710 -7.619 1.00 0.00 O ATOM 1351 CB LEU A 85 6.097 -17.021 -5.968 1.00 0.00 C ATOM 1352 CG LEU A 85 6.039 -15.492 -6.149 1.00 0.00 C ATOM 1353 CD1 LEU A 85 6.889 -14.833 -5.062 1.00 0.00 C ATOM 1354 CD2 LEU A 85 6.555 -15.054 -7.525 1.00 0.00 C ATOM 0 H LEU A 85 3.465 -17.852 -5.694 1.00 0.00 H new ATOM 0 HA LEU A 85 5.344 -17.464 -7.930 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.842 -17.264 -4.937 1.00 0.00 H new ATOM 0 HB3 LEU A 85 7.121 -17.357 -6.131 1.00 0.00 H new ATOM 0 HG LEU A 85 4.997 -15.183 -6.072 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.855 -13.750 -5.180 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.498 -15.103 -4.081 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.920 -15.176 -5.149 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.495 -13.969 -7.607 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.591 -15.370 -7.643 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.946 -15.511 -8.305 1.00 0.00 H new ATOM 1366 N ASP A 86 4.740 -20.123 -6.094 1.00 0.00 N ATOM 1367 CA ASP A 86 5.038 -21.564 -6.112 1.00 0.00 C ATOM 1368 C ASP A 86 4.358 -22.267 -7.295 1.00 0.00 C ATOM 1369 O ASP A 86 3.549 -21.685 -8.017 1.00 0.00 O ATOM 1370 CB ASP A 86 4.741 -22.322 -4.800 1.00 0.00 C ATOM 1371 CG ASP A 86 5.456 -23.681 -4.846 1.00 0.00 C ATOM 1372 OD1 ASP A 86 6.580 -23.759 -5.387 1.00 0.00 O ATOM 1373 OD2 ASP A 86 4.775 -24.691 -4.611 1.00 0.00 O ATOM 0 H ASP A 86 3.974 -19.841 -5.482 1.00 0.00 H new ATOM 0 HA ASP A 86 6.121 -21.603 -6.230 1.00 0.00 H new ATOM 0 HB2 ASP A 86 5.084 -21.743 -3.943 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.667 -22.464 -4.680 1.00 0.00 H new ATOM 1378 N LYS A 87 4.746 -23.511 -7.556 1.00 0.00 N ATOM 1379 CA LYS A 87 4.269 -24.405 -8.585 1.00 0.00 C ATOM 1380 C LYS A 87 3.487 -25.584 -8.017 1.00 0.00 C ATOM 1381 O LYS A 87 2.417 -25.901 -8.516 1.00 0.00 O ATOM 1382 CB LYS A 87 5.490 -24.882 -9.364 1.00 0.00 C ATOM 1383 CG LYS A 87 5.918 -23.844 -10.416 1.00 0.00 C ATOM 1384 CD LYS A 87 6.707 -22.601 -9.948 1.00 0.00 C ATOM 1385 CE LYS A 87 6.234 -21.319 -10.665 1.00 0.00 C ATOM 1386 NZ LYS A 87 5.127 -20.627 -9.963 1.00 0.00 N ATOM 0 H LYS A 87 5.473 -23.953 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 87 3.570 -23.877 -9.234 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.314 -25.067 -8.676 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.265 -25.829 -9.854 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.523 -24.359 -11.162 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.018 -23.494 -10.922 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.589 -22.480 -8.871 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.770 -22.752 -10.137 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.077 -20.634 -10.763 1.00 0.00 H new ATOM 0 HE3 LYS A 87 5.911 -21.574 -11.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.634 -19.997 -10.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.457 -21.331 -9.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 5.512 -20.067 -9.176 1.00 0.00 H new ATOM 1400 N GLY A 88 4.032 -26.263 -7.022 1.00 0.00 N ATOM 1401 CA GLY A 88 3.317 -27.323 -6.329 1.00 0.00 C ATOM 1402 C GLY A 88 2.120 -26.753 -5.567 1.00 0.00 C ATOM 1403 O GLY A 88 0.965 -27.001 -5.906 1.00 0.00 O ATOM 0 H GLY A 88 4.976 -26.097 -6.673 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.977 -28.069 -7.047 1.00 0.00 H new ATOM 0 HA3 GLY A 88 3.989 -27.830 -5.636 1.00 0.00 H new ATOM 1407 N ILE A 89 2.407 -26.011 -4.503 1.00 0.00 N ATOM 1408 CA ILE A 89 1.493 -25.430 -3.515 1.00 0.00 C ATOM 1409 C ILE A 89 0.853 -24.140 -4.079 1.00 0.00 C ATOM 1410 O ILE A 89 0.360 -23.295 -3.340 1.00 0.00 O ATOM 1411 CB ILE A 89 2.313 -25.223 -2.210 1.00 0.00 C ATOM 1412 CG1 ILE A 89 3.019 -26.521 -1.750 1.00 0.00 C ATOM 1413 CG2 ILE A 89 1.508 -24.719 -1.002 1.00 0.00 C ATOM 1414 CD1 ILE A 89 4.541 -26.403 -1.864 1.00 0.00 C ATOM 0 H ILE A 89 3.376 -25.777 -4.286 1.00 0.00 H new ATOM 0 HA ILE A 89 0.650 -26.083 -3.287 1.00 0.00 H new ATOM 0 HB ILE A 89 3.026 -24.452 -2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.746 -26.738 -0.717 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.672 -27.359 -2.354 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.171 -24.608 -0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.059 -23.755 -1.241 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.723 -25.436 -0.763 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.004 -27.333 -1.533 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.814 -26.211 -2.902 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.890 -25.581 -1.239 1.00 0.00 H new ATOM 1426 N MET A 90 0.892 -23.968 -5.400 1.00 0.00 N ATOM 1427 CA MET A 90 0.449 -22.799 -6.146 1.00 0.00 C ATOM 1428 C MET A 90 -0.902 -22.308 -5.610 1.00 0.00 C ATOM 1429 O MET A 90 -1.819 -23.085 -5.329 1.00 0.00 O ATOM 1430 CB MET A 90 0.422 -23.202 -7.621 1.00 0.00 C ATOM 1431 CG MET A 90 0.153 -22.079 -8.626 1.00 0.00 C ATOM 1432 SD MET A 90 0.152 -22.574 -10.388 1.00 0.00 S ATOM 1433 CE MET A 90 0.665 -24.323 -10.384 1.00 0.00 C ATOM 0 H MET A 90 1.260 -24.693 -6.016 1.00 0.00 H new ATOM 0 HA MET A 90 1.124 -21.951 -6.029 1.00 0.00 H new ATOM 0 HB2 MET A 90 1.380 -23.660 -7.868 1.00 0.00 H new ATOM 0 HB3 MET A 90 -0.341 -23.969 -7.752 1.00 0.00 H new ATOM 0 HG2 MET A 90 -0.813 -21.632 -8.393 1.00 0.00 H new ATOM 0 HG3 MET A 90 0.906 -21.303 -8.486 1.00 0.00 H new ATOM 0 HE1 MET A 90 0.374 -24.790 -11.325 1.00 0.00 H new ATOM 0 HE2 MET A 90 1.747 -24.385 -10.268 1.00 0.00 H new ATOM 0 HE3 MET A 90 0.181 -24.842 -9.557 1.00 0.00 H new ATOM 1443 N ALA A 91 -0.981 -20.999 -5.420 1.00 0.00 N ATOM 1444 CA ALA A 91 -2.085 -20.291 -4.809 1.00 0.00 C ATOM 1445 C ALA A 91 -2.013 -18.864 -5.293 1.00 0.00 C ATOM 1446 O ALA A 91 -1.046 -18.166 -4.964 1.00 0.00 O ATOM 1447 CB ALA A 91 -1.970 -20.319 -3.276 1.00 0.00 C ATOM 0 H ALA A 91 -0.230 -20.371 -5.706 1.00 0.00 H new ATOM 0 HA ALA A 91 -3.031 -20.759 -5.080 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.811 -19.781 -2.838 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.981 -21.352 -2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.037 -19.844 -2.972 1.00 0.00 H new ATOM 1453 N ASP A 92 -3.000 -18.447 -6.070 1.00 0.00 N ATOM 1454 CA ASP A 92 -2.959 -17.128 -6.697 1.00 0.00 C ATOM 1455 C ASP A 92 -3.757 -16.140 -5.871 1.00 0.00 C ATOM 1456 O ASP A 92 -4.864 -16.465 -5.441 1.00 0.00 O ATOM 1457 CB ASP A 92 -3.348 -17.128 -8.183 1.00 0.00 C ATOM 1458 CG ASP A 92 -2.149 -17.544 -9.036 1.00 0.00 C ATOM 1459 OD1 ASP A 92 -1.306 -16.653 -9.305 1.00 0.00 O ATOM 1460 OD2 ASP A 92 -2.005 -18.754 -9.317 1.00 0.00 O ATOM 0 H ASP A 92 -3.834 -18.994 -6.283 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.918 -16.805 -6.706 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.179 -17.813 -8.350 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.689 -16.136 -8.479 1.00 0.00 H new ATOM 1465 N PRO A 93 -3.208 -14.951 -5.583 1.00 0.00 N ATOM 1466 CA PRO A 93 -3.960 -13.918 -4.909 1.00 0.00 C ATOM 1467 C PRO A 93 -5.032 -13.371 -5.856 1.00 0.00 C ATOM 1468 O PRO A 93 -4.888 -13.367 -7.077 1.00 0.00 O ATOM 1469 CB PRO A 93 -2.928 -12.863 -4.501 1.00 0.00 C ATOM 1470 CG PRO A 93 -1.839 -13.011 -5.563 1.00 0.00 C ATOM 1471 CD PRO A 93 -1.872 -14.492 -5.916 1.00 0.00 C ATOM 0 HA PRO A 93 -4.493 -14.275 -4.027 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.356 -11.860 -4.500 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.540 -13.045 -3.499 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -2.043 -12.388 -6.434 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.863 -12.713 -5.179 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -1.658 -14.646 -6.974 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.118 -15.044 -5.355 1.00 0.00 H new ATOM 1479 N THR A 94 -6.099 -12.852 -5.269 1.00 0.00 N ATOM 1480 CA THR A 94 -7.204 -12.159 -5.924 1.00 0.00 C ATOM 1481 C THR A 94 -7.594 -10.976 -5.036 1.00 0.00 C ATOM 1482 O THR A 94 -7.304 -11.007 -3.843 1.00 0.00 O ATOM 1483 CB THR A 94 -8.371 -13.148 -6.126 1.00 0.00 C ATOM 1484 OG1 THR A 94 -8.652 -13.852 -4.929 1.00 0.00 O ATOM 1485 CG2 THR A 94 -8.086 -14.187 -7.215 1.00 0.00 C ATOM 0 H THR A 94 -6.227 -12.905 -4.258 1.00 0.00 H new ATOM 0 HA THR A 94 -6.925 -11.784 -6.909 1.00 0.00 H new ATOM 0 HB THR A 94 -9.222 -12.537 -6.429 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.824 -13.972 -4.418 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.941 -14.855 -7.313 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.911 -13.681 -8.164 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.203 -14.765 -6.944 1.00 0.00 H new ATOM 1493 N VAL A 95 -8.230 -9.931 -5.570 1.00 0.00 N ATOM 1494 CA VAL A 95 -8.646 -8.758 -4.796 1.00 0.00 C ATOM 1495 C VAL A 95 -10.131 -8.431 -4.952 1.00 0.00 C ATOM 1496 O VAL A 95 -10.744 -8.719 -5.976 1.00 0.00 O ATOM 1497 CB VAL A 95 -7.727 -7.553 -5.048 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -6.459 -7.671 -4.199 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -7.327 -7.370 -6.521 1.00 0.00 C ATOM 0 H VAL A 95 -8.473 -9.874 -6.559 1.00 0.00 H new ATOM 0 HA VAL A 95 -8.528 -9.020 -3.745 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.307 -6.675 -4.765 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.815 -6.812 -4.386 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.729 -7.700 -3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.929 -8.586 -4.463 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.679 -6.499 -6.616 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.796 -8.257 -6.867 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.222 -7.224 -7.126 1.00 0.00 H new ATOM 1509 N ASN A 96 -10.683 -7.781 -3.922 1.00 0.00 N ATOM 1510 CA ASN A 96 -12.043 -7.233 -3.834 1.00 0.00 C ATOM 1511 C ASN A 96 -12.248 -5.958 -4.664 1.00 0.00 C ATOM 1512 O ASN A 96 -13.256 -5.271 -4.532 1.00 0.00 O ATOM 1513 CB ASN A 96 -12.331 -6.932 -2.355 1.00 0.00 C ATOM 1514 CG ASN A 96 -13.795 -6.633 -2.057 1.00 0.00 C ATOM 1515 OD1 ASN A 96 -14.690 -7.322 -2.526 1.00 0.00 O ATOM 1516 ND2 ASN A 96 -14.060 -5.666 -1.194 1.00 0.00 N ATOM 0 H ASN A 96 -10.154 -7.611 -3.066 1.00 0.00 H new ATOM 0 HA ASN A 96 -12.729 -7.974 -4.244 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -12.015 -7.784 -1.753 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -11.726 -6.080 -2.044 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -15.023 -5.486 -0.910 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -13.301 -5.101 -0.813 1.00 0.00 H new ATOM 1523 N VAL A 97 -11.263 -5.594 -5.473 1.00 0.00 N ATOM 1524 CA VAL A 97 -11.259 -4.415 -6.329 1.00 0.00 C ATOM 1525 C VAL A 97 -10.606 -4.792 -7.664 1.00 0.00 C ATOM 1526 O VAL A 97 -9.976 -5.848 -7.745 1.00 0.00 O ATOM 1527 CB VAL A 97 -10.538 -3.238 -5.642 1.00 0.00 C ATOM 1528 CG1 VAL A 97 -11.344 -2.659 -4.477 1.00 0.00 C ATOM 1529 CG2 VAL A 97 -9.112 -3.572 -5.175 1.00 0.00 C ATOM 0 H VAL A 97 -10.404 -6.138 -5.554 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.280 -4.081 -6.515 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.454 -2.480 -6.421 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.792 -1.833 -4.028 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.304 -2.297 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -11.510 -3.434 -3.729 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.669 -2.695 -4.702 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.147 -4.393 -4.458 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.507 -3.865 -6.033 1.00 0.00 H new ATOM 1539 N PRO A 98 -10.751 -3.982 -8.726 1.00 0.00 N ATOM 1540 CA PRO A 98 -10.045 -4.234 -9.971 1.00 0.00 C ATOM 1541 C PRO A 98 -8.531 -4.043 -9.792 1.00 0.00 C ATOM 1542 O PRO A 98 -8.069 -3.437 -8.818 1.00 0.00 O ATOM 1543 CB PRO A 98 -10.621 -3.251 -10.997 1.00 0.00 C ATOM 1544 CG PRO A 98 -11.761 -2.514 -10.287 1.00 0.00 C ATOM 1545 CD PRO A 98 -11.521 -2.754 -8.800 1.00 0.00 C ATOM 0 HA PRO A 98 -10.181 -5.263 -10.304 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.858 -2.552 -11.338 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -10.987 -3.778 -11.878 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -11.749 -1.450 -10.522 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -12.733 -2.898 -10.597 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -10.978 -1.922 -8.351 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -12.463 -2.848 -8.260 1.00 0.00 H new ATOM 1553 N LEU A 99 -7.768 -4.496 -10.795 1.00 0.00 N ATOM 1554 CA LEU A 99 -6.315 -4.331 -10.880 1.00 0.00 C ATOM 1555 C LEU A 99 -5.905 -2.853 -10.973 1.00 0.00 C ATOM 1556 O LEU A 99 -4.726 -2.565 -10.826 1.00 0.00 O ATOM 1557 CB LEU A 99 -5.733 -5.127 -12.071 1.00 0.00 C ATOM 1558 CG LEU A 99 -5.492 -6.634 -11.886 1.00 0.00 C ATOM 1559 CD1 LEU A 99 -4.213 -6.866 -11.102 1.00 0.00 C ATOM 1560 CD2 LEU A 99 -6.647 -7.393 -11.222 1.00 0.00 C ATOM 0 H LEU A 99 -8.157 -5.001 -11.591 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.898 -4.731 -9.956 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.406 -4.999 -12.919 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.783 -4.669 -12.346 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.410 -7.038 -12.895 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.052 -7.937 -10.977 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.371 -6.433 -11.643 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.296 -6.395 -10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.386 -8.448 -11.134 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -6.831 -6.980 -10.230 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -7.546 -7.291 -11.830 1.00 0.00 H new ATOM 1572 N LEU A 100 -6.825 -1.916 -11.197 1.00 0.00 N ATOM 1573 CA LEU A 100 -6.584 -0.478 -11.173 1.00 0.00 C ATOM 1574 C LEU A 100 -7.836 0.199 -10.611 1.00 0.00 C ATOM 1575 O LEU A 100 -8.906 -0.416 -10.593 1.00 0.00 O ATOM 1576 CB LEU A 100 -6.182 0.099 -12.543 1.00 0.00 C ATOM 1577 CG LEU A 100 -7.313 0.281 -13.569 1.00 0.00 C ATOM 1578 CD1 LEU A 100 -6.744 0.883 -14.855 1.00 0.00 C ATOM 1579 CD2 LEU A 100 -7.998 -1.048 -13.896 1.00 0.00 C ATOM 0 H LEU A 100 -7.795 -2.149 -11.408 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.725 -0.277 -10.532 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.710 1.068 -12.380 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.427 -0.554 -12.980 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.056 0.949 -13.133 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.546 1.012 -15.582 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.294 1.851 -14.635 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.986 0.215 -15.265 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.791 -0.879 -14.624 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.267 -1.742 -14.311 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.424 -1.471 -12.986 1.00 0.00 H new ATOM 1591 N GLY A 101 -7.744 1.459 -10.200 1.00 0.00 N ATOM 1592 CA GLY A 101 -8.885 2.178 -9.639 1.00 0.00 C ATOM 1593 C GLY A 101 -8.423 3.415 -8.892 1.00 0.00 C ATOM 1594 O GLY A 101 -7.309 3.881 -9.107 1.00 0.00 O ATOM 0 H GLY A 101 -6.885 2.008 -10.245 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.570 2.464 -10.437 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.437 1.524 -8.964 1.00 0.00 H new ATOM 1598 N THR A 102 -9.266 3.970 -8.024 1.00 0.00 N ATOM 1599 CA THR A 102 -8.876 5.077 -7.162 1.00 0.00 C ATOM 1600 C THR A 102 -8.989 4.627 -5.710 1.00 0.00 C ATOM 1601 O THR A 102 -9.762 3.724 -5.379 1.00 0.00 O ATOM 1602 CB THR A 102 -9.687 6.355 -7.472 1.00 0.00 C ATOM 1603 OG1 THR A 102 -11.075 6.180 -7.251 1.00 0.00 O ATOM 1604 CG2 THR A 102 -9.484 6.805 -8.927 1.00 0.00 C ATOM 0 H THR A 102 -10.232 3.666 -7.901 1.00 0.00 H new ATOM 0 HA THR A 102 -7.838 5.350 -7.353 1.00 0.00 H new ATOM 0 HB THR A 102 -9.313 7.117 -6.788 1.00 0.00 H new ATOM 0 HG1 THR A 102 -11.403 6.885 -6.654 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.068 7.706 -9.114 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.428 7.014 -9.099 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.812 6.014 -9.602 1.00 0.00 H new ATOM 1612 N VAL A 103 -8.165 5.216 -4.849 1.00 0.00 N ATOM 1613 CA VAL A 103 -8.208 5.026 -3.414 1.00 0.00 C ATOM 1614 C VAL A 103 -9.197 6.111 -2.955 1.00 0.00 C ATOM 1615 O VAL A 103 -8.886 7.300 -3.076 1.00 0.00 O ATOM 1616 CB VAL A 103 -6.794 5.183 -2.812 1.00 0.00 C ATOM 1617 CG1 VAL A 103 -6.827 4.882 -1.311 1.00 0.00 C ATOM 1618 CG2 VAL A 103 -5.771 4.241 -3.470 1.00 0.00 C ATOM 0 H VAL A 103 -7.429 5.857 -5.146 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.527 4.034 -3.094 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.487 6.212 -2.996 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.826 4.995 -0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.506 5.576 -0.816 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.172 3.860 -1.152 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.793 4.389 -3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.085 3.207 -3.328 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.709 4.458 -4.536 1.00 0.00 H new ATOM 1628 N PRO A 104 -10.380 5.753 -2.434 1.00 0.00 N ATOM 1629 CA PRO A 104 -11.422 6.718 -2.103 1.00 0.00 C ATOM 1630 C PRO A 104 -11.285 7.215 -0.670 1.00 0.00 C ATOM 1631 O PRO A 104 -10.700 6.542 0.155 1.00 0.00 O ATOM 1632 CB PRO A 104 -12.695 5.924 -2.394 1.00 0.00 C ATOM 1633 CG PRO A 104 -12.342 4.532 -1.871 1.00 0.00 C ATOM 1634 CD PRO A 104 -10.883 4.393 -2.287 1.00 0.00 C ATOM 0 HA PRO A 104 -11.391 7.647 -2.672 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -13.561 6.343 -1.881 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -12.931 5.910 -3.458 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -12.466 4.459 -0.791 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -12.968 3.759 -2.316 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.313 3.844 -1.537 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.794 3.840 -3.222 1.00 0.00 H new ATOM 1642 N HIS A 105 -11.864 8.360 -0.301 1.00 0.00 N ATOM 1643 CA HIS A 105 -11.659 8.973 1.031 1.00 0.00 C ATOM 1644 C HIS A 105 -12.400 8.246 2.151 1.00 0.00 C ATOM 1645 O HIS A 105 -12.491 8.729 3.275 1.00 0.00 O ATOM 1646 CB HIS A 105 -12.139 10.427 1.071 1.00 0.00 C ATOM 1647 CG HIS A 105 -11.844 11.166 -0.182 1.00 0.00 C ATOM 1648 ND1 HIS A 105 -10.630 11.621 -0.620 1.00 0.00 N ATOM 1649 CD2 HIS A 105 -12.752 11.332 -1.181 1.00 0.00 C ATOM 1650 CE1 HIS A 105 -10.841 12.099 -1.852 1.00 0.00 C ATOM 1651 NE2 HIS A 105 -12.120 11.979 -2.222 1.00 0.00 N ATOM 0 H HIS A 105 -12.487 8.893 -0.908 1.00 0.00 H new ATOM 0 HA HIS A 105 -10.583 8.905 1.192 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.213 10.445 1.253 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -11.665 10.938 1.909 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -13.784 11.014 -1.162 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -10.070 12.530 -2.473 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -12.541 12.300 -3.094 1.00 0.00 H new ATOM 1659 N LYS A 106 -13.033 7.139 1.798 1.00 0.00 N ATOM 1660 CA LYS A 106 -13.903 6.356 2.630 1.00 0.00 C ATOM 1661 C LYS A 106 -13.235 5.002 2.810 1.00 0.00 C ATOM 1662 O LYS A 106 -13.041 4.345 1.785 1.00 0.00 O ATOM 1663 CB LYS A 106 -15.298 6.254 1.992 1.00 0.00 C ATOM 1664 CG LYS A 106 -15.762 7.568 1.327 1.00 0.00 C ATOM 1665 CD LYS A 106 -15.504 7.532 -0.199 1.00 0.00 C ATOM 1666 CE LYS A 106 -15.655 8.867 -0.952 1.00 0.00 C ATOM 1667 NZ LYS A 106 -15.238 8.794 -2.388 1.00 0.00 N ATOM 0 H LYS A 106 -12.940 6.747 0.861 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.057 6.815 3.607 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.292 5.460 1.246 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -16.020 5.967 2.757 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -16.824 7.722 1.517 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.233 8.412 1.770 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -14.494 7.158 -0.366 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -16.188 6.810 -0.644 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -16.695 9.189 -0.900 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -15.060 9.629 -0.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -15.691 9.564 -2.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -14.204 8.889 -2.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -15.528 7.879 -2.788 1.00 0.00 H new ATOM 1681 N ALA A 107 -12.863 4.623 4.039 1.00 0.00 N ATOM 1682 CA ALA A 107 -12.188 3.366 4.362 1.00 0.00 C ATOM 1683 C ALA A 107 -12.835 2.222 3.593 1.00 0.00 C ATOM 1684 O ALA A 107 -13.957 1.821 3.904 1.00 0.00 O ATOM 1685 CB ALA A 107 -12.218 3.087 5.873 1.00 0.00 C ATOM 0 H ALA A 107 -13.030 5.204 4.861 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.143 3.451 4.065 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.708 2.146 6.079 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.715 3.896 6.402 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.252 3.021 6.210 1.00 0.00 H new ATOM 1691 N SER A 108 -12.149 1.746 2.557 1.00 0.00 N ATOM 1692 CA SER A 108 -12.623 0.657 1.730 1.00 0.00 C ATOM 1693 C SER A 108 -11.706 -0.519 1.986 1.00 0.00 C ATOM 1694 O SER A 108 -10.482 -0.367 2.045 1.00 0.00 O ATOM 1695 CB SER A 108 -12.640 1.061 0.263 1.00 0.00 C ATOM 1696 OG SER A 108 -13.444 2.212 0.081 1.00 0.00 O ATOM 0 H SER A 108 -11.241 2.113 2.271 1.00 0.00 H new ATOM 0 HA SER A 108 -13.650 0.389 1.979 1.00 0.00 H new ATOM 0 HB2 SER A 108 -11.624 1.261 -0.078 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.024 0.241 -0.343 1.00 0.00 H new ATOM 0 HG SER A 108 -13.119 2.933 0.660 1.00 0.00 H new ATOM 1702 N VAL A 109 -12.331 -1.676 2.138 1.00 0.00 N ATOM 1703 CA VAL A 109 -11.679 -2.911 2.521 1.00 0.00 C ATOM 1704 C VAL A 109 -11.360 -3.690 1.251 1.00 0.00 C ATOM 1705 O VAL A 109 -12.254 -4.091 0.495 1.00 0.00 O ATOM 1706 CB VAL A 109 -12.550 -3.714 3.511 1.00 0.00 C ATOM 1707 CG1 VAL A 109 -11.762 -4.901 4.084 1.00 0.00 C ATOM 1708 CG2 VAL A 109 -13.051 -2.851 4.684 1.00 0.00 C ATOM 0 H VAL A 109 -13.335 -1.781 1.993 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.748 -2.705 3.049 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.412 -4.067 2.945 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -12.393 -5.455 4.780 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.453 -5.559 3.272 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -10.880 -4.533 4.608 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -13.659 -3.462 5.352 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.198 -2.452 5.233 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -13.652 -2.027 4.299 1.00 0.00 H new ATOM 1718 N VAL A 110 -10.075 -3.883 1.000 1.00 0.00 N ATOM 1719 CA VAL A 110 -9.580 -4.705 -0.072 1.00 0.00 C ATOM 1720 C VAL A 110 -9.367 -6.062 0.590 1.00 0.00 C ATOM 1721 O VAL A 110 -8.422 -6.264 1.352 1.00 0.00 O ATOM 1722 CB VAL A 110 -8.283 -4.098 -0.648 1.00 0.00 C ATOM 1723 CG1 VAL A 110 -7.659 -5.021 -1.706 1.00 0.00 C ATOM 1724 CG2 VAL A 110 -8.563 -2.728 -1.285 1.00 0.00 C ATOM 0 H VAL A 110 -9.334 -3.457 1.557 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.253 -4.784 -0.926 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.584 -3.982 0.180 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -6.747 -4.566 -2.093 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.421 -5.984 -1.254 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.366 -5.168 -2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.636 -2.317 -1.685 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.287 -2.843 -2.092 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.964 -2.051 -0.531 1.00 0.00 H new ATOM 1734 N GLN A 111 -10.290 -6.987 0.332 1.00 0.00 N ATOM 1735 CA GLN A 111 -10.147 -8.361 0.773 1.00 0.00 C ATOM 1736 C GLN A 111 -9.259 -8.983 -0.298 1.00 0.00 C ATOM 1737 O GLN A 111 -9.627 -8.947 -1.478 1.00 0.00 O ATOM 1738 CB GLN A 111 -11.519 -9.048 0.932 1.00 0.00 C ATOM 1739 CG GLN A 111 -11.429 -10.550 1.270 1.00 0.00 C ATOM 1740 CD GLN A 111 -11.661 -11.523 0.102 1.00 0.00 C ATOM 1741 OE1 GLN A 111 -12.126 -12.641 0.307 1.00 0.00 O ATOM 1742 NE2 GLN A 111 -11.318 -11.196 -1.135 1.00 0.00 N ATOM 0 H GLN A 111 -11.149 -6.801 -0.185 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.703 -8.464 1.763 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.079 -8.541 1.718 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.085 -8.927 0.008 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.443 -10.748 1.691 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.158 -10.770 2.050 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -10.930 -10.273 -1.329 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.442 -11.867 -1.893 1.00 0.00 H new ATOM 1751 N VAL A 112 -8.095 -9.495 0.084 1.00 0.00 N ATOM 1752 CA VAL A 112 -7.206 -10.230 -0.795 1.00 0.00 C ATOM 1753 C VAL A 112 -7.573 -11.695 -0.561 1.00 0.00 C ATOM 1754 O VAL A 112 -7.394 -12.182 0.551 1.00 0.00 O ATOM 1755 CB VAL A 112 -5.718 -9.953 -0.470 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.854 -10.300 -1.692 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -5.435 -8.485 -0.100 1.00 0.00 C ATOM 0 H VAL A 112 -7.739 -9.406 1.036 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.322 -9.936 -1.838 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.475 -10.572 0.394 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.806 -10.105 -1.464 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.981 -11.354 -1.940 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.161 -9.688 -2.540 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.374 -8.362 0.116 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -5.713 -7.840 -0.933 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -6.018 -8.213 0.780 1.00 0.00 H new ATOM 1767 N GLY A 113 -8.129 -12.393 -1.548 1.00 0.00 N ATOM 1768 CA GLY A 113 -8.442 -13.800 -1.474 1.00 0.00 C ATOM 1769 C GLY A 113 -7.280 -14.608 -2.009 1.00 0.00 C ATOM 1770 O GLY A 113 -6.604 -14.145 -2.923 1.00 0.00 O ATOM 0 H GLY A 113 -8.378 -11.974 -2.444 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.650 -14.083 -0.442 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.342 -14.013 -2.050 1.00 0.00 H new ATOM 1774 N PHE A 114 -7.064 -15.822 -1.506 1.00 0.00 N ATOM 1775 CA PHE A 114 -5.927 -16.645 -1.891 1.00 0.00 C ATOM 1776 C PHE A 114 -6.391 -18.070 -2.247 1.00 0.00 C ATOM 1777 O PHE A 114 -6.180 -19.001 -1.452 1.00 0.00 O ATOM 1778 CB PHE A 114 -4.889 -16.674 -0.744 1.00 0.00 C ATOM 1779 CG PHE A 114 -4.613 -15.377 -0.017 1.00 0.00 C ATOM 1780 CD1 PHE A 114 -4.171 -14.246 -0.720 1.00 0.00 C ATOM 1781 CD2 PHE A 114 -4.743 -15.325 1.385 1.00 0.00 C ATOM 1782 CE1 PHE A 114 -3.867 -13.068 -0.021 1.00 0.00 C ATOM 1783 CE2 PHE A 114 -4.422 -14.150 2.080 1.00 0.00 C ATOM 1784 CZ PHE A 114 -3.995 -13.013 1.376 1.00 0.00 C ATOM 0 H PHE A 114 -7.676 -16.261 -0.818 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.457 -16.213 -2.775 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -5.221 -17.407 -0.009 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.946 -17.037 -1.153 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.065 -14.282 -1.794 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -5.091 -16.193 1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.532 -12.196 -0.562 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -4.503 -14.120 3.157 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.766 -12.101 1.906 1.00 0.00 H new ATOM 1794 N PRO A 115 -7.038 -18.279 -3.406 1.00 0.00 N ATOM 1795 CA PRO A 115 -7.387 -19.611 -3.877 1.00 0.00 C ATOM 1796 C PRO A 115 -6.103 -20.416 -4.120 1.00 0.00 C ATOM 1797 O PRO A 115 -5.270 -20.041 -4.951 1.00 0.00 O ATOM 1798 CB PRO A 115 -8.221 -19.411 -5.149 1.00 0.00 C ATOM 1799 CG PRO A 115 -7.865 -17.997 -5.609 1.00 0.00 C ATOM 1800 CD PRO A 115 -7.619 -17.276 -4.287 1.00 0.00 C ATOM 0 HA PRO A 115 -7.969 -20.180 -3.152 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -7.973 -20.152 -5.909 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -9.288 -19.508 -4.946 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -6.982 -17.988 -6.248 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -8.674 -17.539 -6.178 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -6.944 -16.430 -4.420 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.548 -16.881 -3.875 1.00 0.00 H new ATOM 1808 N CYS A 116 -5.929 -21.494 -3.346 1.00 0.00 N ATOM 1809 CA CYS A 116 -4.845 -22.451 -3.517 1.00 0.00 C ATOM 1810 C CYS A 116 -5.362 -23.579 -4.395 1.00 0.00 C ATOM 1811 O CYS A 116 -6.537 -23.928 -4.289 1.00 0.00 O ATOM 1812 CB CYS A 116 -4.371 -23.005 -2.166 1.00 0.00 C ATOM 1813 SG CYS A 116 -2.755 -23.805 -2.281 1.00 0.00 S ATOM 0 H CYS A 116 -6.552 -21.724 -2.572 1.00 0.00 H new ATOM 0 HA CYS A 116 -3.989 -21.959 -3.980 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -4.321 -22.193 -1.440 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -5.103 -23.721 -1.793 1.00 0.00 H new ATOM 1818 N LEU A 117 -4.498 -24.188 -5.212 1.00 0.00 N ATOM 1819 CA LEU A 117 -4.944 -25.226 -6.141 1.00 0.00 C ATOM 1820 C LEU A 117 -5.252 -26.547 -5.417 1.00 0.00 C ATOM 1821 O LEU A 117 -5.853 -27.438 -6.019 1.00 0.00 O ATOM 1822 CB LEU A 117 -3.941 -25.456 -7.289 1.00 0.00 C ATOM 1823 CG LEU A 117 -3.378 -24.220 -8.030 1.00 0.00 C ATOM 1824 CD1 LEU A 117 -2.834 -24.653 -9.391 1.00 0.00 C ATOM 1825 CD2 LEU A 117 -4.324 -23.029 -8.228 1.00 0.00 C ATOM 0 H LEU A 117 -3.499 -23.983 -5.249 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.870 -24.860 -6.584 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.097 -26.015 -6.886 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.423 -26.096 -8.028 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.605 -23.842 -7.361 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -2.436 -23.785 -9.917 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.040 -25.386 -9.249 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.637 -25.097 -9.979 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.802 -22.234 -8.760 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.191 -23.345 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.653 -22.660 -7.256 1.00 0.00 H new ATOM 1837 N GLY A 118 -4.829 -26.680 -4.152 1.00 0.00 N ATOM 1838 CA GLY A 118 -5.130 -27.795 -3.268 1.00 0.00 C ATOM 1839 C GLY A 118 -4.571 -29.136 -3.734 1.00 0.00 C ATOM 1840 O GLY A 118 -5.219 -30.155 -3.520 1.00 0.00 O ATOM 0 H GLY A 118 -4.241 -25.976 -3.705 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.734 -27.574 -2.277 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.212 -27.881 -3.167 1.00 0.00 H new ATOM 1844 N LYS A 119 -3.393 -29.170 -4.379 1.00 0.00 N ATOM 1845 CA LYS A 119 -2.868 -30.416 -4.968 1.00 0.00 C ATOM 1846 C LYS A 119 -1.592 -30.883 -4.293 1.00 0.00 C ATOM 1847 O LYS A 119 -1.501 -32.052 -3.942 1.00 0.00 O ATOM 1848 CB LYS A 119 -2.764 -30.346 -6.500 1.00 0.00 C ATOM 1849 CG LYS A 119 -4.088 -29.795 -7.041 1.00 0.00 C ATOM 1850 CD LYS A 119 -4.517 -30.235 -8.439 1.00 0.00 C ATOM 1851 CE LYS A 119 -5.780 -29.465 -8.875 1.00 0.00 C ATOM 1852 NZ LYS A 119 -6.838 -29.477 -7.843 1.00 0.00 N ATOM 0 H LYS A 119 -2.790 -28.357 -4.506 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.605 -31.193 -4.765 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.935 -29.704 -6.797 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.565 -31.335 -6.914 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.878 -30.074 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.027 -28.707 -7.035 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -3.709 -30.055 -9.149 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.715 -31.307 -8.446 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.512 -28.433 -9.103 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.169 -29.903 -9.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.760 -29.293 -8.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.858 -30.407 -7.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.642 -28.740 -7.136 1.00 0.00 H new ATOM 1866 N GLN A 120 -0.599 -30.008 -4.143 1.00 0.00 N ATOM 1867 CA GLN A 120 0.601 -30.335 -3.391 1.00 0.00 C ATOM 1868 C GLN A 120 0.407 -29.797 -1.976 1.00 0.00 C ATOM 1869 O GLN A 120 -0.184 -28.734 -1.773 1.00 0.00 O ATOM 1870 CB GLN A 120 1.820 -29.713 -4.078 1.00 0.00 C ATOM 1871 CG GLN A 120 3.193 -30.004 -3.442 1.00 0.00 C ATOM 1872 CD GLN A 120 3.458 -31.484 -3.188 1.00 0.00 C ATOM 1873 OE1 GLN A 120 3.566 -32.277 -4.113 1.00 0.00 O ATOM 1874 NE2 GLN A 120 3.572 -31.881 -1.930 1.00 0.00 N ATOM 0 H GLN A 120 -0.606 -29.066 -4.535 1.00 0.00 H new ATOM 0 HA GLN A 120 0.772 -31.411 -3.348 1.00 0.00 H new ATOM 0 HB2 GLN A 120 1.843 -30.060 -5.111 1.00 0.00 H new ATOM 0 HB3 GLN A 120 1.680 -28.632 -4.107 1.00 0.00 H new ATOM 0 HG2 GLN A 120 3.974 -29.612 -4.094 1.00 0.00 H new ATOM 0 HG3 GLN A 120 3.266 -29.465 -2.497 1.00 0.00 H new ATOM 0 HE21 GLN A 120 3.479 -31.205 -1.172 1.00 0.00 H new ATOM 0 HE22 GLN A 120 3.753 -32.862 -1.719 1.00 0.00 H new ATOM 1883 N ASP A 121 0.986 -30.509 -1.021 1.00 0.00 N ATOM 1884 CA ASP A 121 1.026 -30.142 0.391 1.00 0.00 C ATOM 1885 C ASP A 121 2.336 -29.395 0.628 1.00 0.00 C ATOM 1886 O ASP A 121 3.366 -29.789 0.065 1.00 0.00 O ATOM 1887 CB ASP A 121 1.012 -31.380 1.305 1.00 0.00 C ATOM 1888 CG ASP A 121 -0.156 -32.325 1.052 1.00 0.00 C ATOM 1889 OD1 ASP A 121 -0.015 -33.220 0.187 1.00 0.00 O ATOM 1890 OD2 ASP A 121 -1.189 -32.130 1.725 1.00 0.00 O ATOM 0 H ASP A 121 1.459 -31.392 -1.213 1.00 0.00 H new ATOM 0 HA ASP A 121 0.149 -29.538 0.624 1.00 0.00 H new ATOM 0 HB2 ASP A 121 1.945 -31.928 1.171 1.00 0.00 H new ATOM 0 HB3 ASP A 121 0.982 -31.051 2.344 1.00 0.00 H new ATOM 1895 N GLY A 122 2.341 -28.356 1.467 1.00 0.00 N ATOM 1896 CA GLY A 122 3.544 -27.569 1.737 1.00 0.00 C ATOM 1897 C GLY A 122 3.217 -26.098 1.947 1.00 0.00 C ATOM 1898 O GLY A 122 2.111 -25.752 2.363 1.00 0.00 O ATOM 0 H GLY A 122 1.515 -28.039 1.975 1.00 0.00 H new ATOM 0 HA2 GLY A 122 4.044 -27.961 2.623 1.00 0.00 H new ATOM 0 HA3 GLY A 122 4.241 -27.672 0.905 1.00 0.00 H new ATOM 1902 N VAL A 123 4.192 -25.224 1.688 1.00 0.00 N ATOM 1903 CA VAL A 123 4.054 -23.781 1.851 1.00 0.00 C ATOM 1904 C VAL A 123 4.530 -23.093 0.571 1.00 0.00 C ATOM 1905 O VAL A 123 5.693 -23.227 0.194 1.00 0.00 O ATOM 1906 CB VAL A 123 4.833 -23.279 3.091 1.00 0.00 C ATOM 1907 CG1 VAL A 123 4.495 -21.810 3.394 1.00 0.00 C ATOM 1908 CG2 VAL A 123 4.556 -24.098 4.361 1.00 0.00 C ATOM 0 H VAL A 123 5.113 -25.507 1.354 1.00 0.00 H new ATOM 0 HA VAL A 123 3.006 -23.533 2.021 1.00 0.00 H new ATOM 0 HB VAL A 123 5.885 -23.393 2.832 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.055 -21.481 4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.763 -21.191 2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.427 -21.715 3.590 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.135 -23.691 5.190 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.494 -24.049 4.601 1.00 0.00 H new ATOM 0 HG23 VAL A 123 4.843 -25.136 4.194 1.00 0.00 H new ATOM 1918 N ALA A 124 3.615 -22.398 -0.103 1.00 0.00 N ATOM 1919 CA ALA A 124 3.884 -21.566 -1.265 1.00 0.00 C ATOM 1920 C ALA A 124 4.142 -20.136 -0.811 1.00 0.00 C ATOM 1921 O ALA A 124 3.971 -19.795 0.359 1.00 0.00 O ATOM 1922 CB ALA A 124 2.660 -21.540 -2.194 1.00 0.00 C ATOM 0 H ALA A 124 2.629 -22.402 0.159 1.00 0.00 H new ATOM 0 HA ALA A 124 4.748 -21.975 -1.789 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.874 -20.914 -3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.433 -22.553 -2.526 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.803 -21.134 -1.656 1.00 0.00 H new ATOM 1928 N ALA A 125 4.498 -19.291 -1.773 1.00 0.00 N ATOM 1929 CA ALA A 125 4.663 -17.856 -1.624 1.00 0.00 C ATOM 1930 C ALA A 125 3.844 -17.185 -2.727 1.00 0.00 C ATOM 1931 O ALA A 125 3.603 -17.805 -3.768 1.00 0.00 O ATOM 1932 CB ALA A 125 6.144 -17.462 -1.689 1.00 0.00 C ATOM 0 H ALA A 125 4.688 -19.608 -2.724 1.00 0.00 H new ATOM 0 HA ALA A 125 4.307 -17.527 -0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.239 -16.382 -1.575 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.689 -17.961 -0.887 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.559 -17.763 -2.651 1.00 0.00 H new ATOM 1938 N PHE A 126 3.426 -15.940 -2.511 1.00 0.00 N ATOM 1939 CA PHE A 126 2.751 -15.110 -3.502 1.00 0.00 C ATOM 1940 C PHE A 126 3.155 -13.656 -3.256 1.00 0.00 C ATOM 1941 O PHE A 126 3.566 -13.304 -2.146 1.00 0.00 O ATOM 1942 CB PHE A 126 1.230 -15.339 -3.490 1.00 0.00 C ATOM 1943 CG PHE A 126 0.475 -14.896 -2.254 1.00 0.00 C ATOM 1944 CD1 PHE A 126 0.065 -13.556 -2.132 1.00 0.00 C ATOM 1945 CD2 PHE A 126 0.125 -15.830 -1.259 1.00 0.00 C ATOM 1946 CE1 PHE A 126 -0.674 -13.147 -1.012 1.00 0.00 C ATOM 1947 CE2 PHE A 126 -0.618 -15.419 -0.138 1.00 0.00 C ATOM 1948 CZ PHE A 126 -1.006 -14.074 -0.010 1.00 0.00 C ATOM 0 H PHE A 126 3.552 -15.468 -1.615 1.00 0.00 H new ATOM 0 HA PHE A 126 3.062 -15.387 -4.509 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.803 -14.823 -4.350 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.047 -16.404 -3.635 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.319 -12.842 -2.901 1.00 0.00 H new ATOM 0 HD2 PHE A 126 0.427 -16.862 -1.357 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -0.988 -12.118 -0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.890 -16.135 0.623 1.00 0.00 H new ATOM 0 HZ PHE A 126 -1.560 -13.753 0.860 1.00 0.00 H new ATOM 1958 N GLU A 127 3.034 -12.811 -4.276 1.00 0.00 N ATOM 1959 CA GLU A 127 3.485 -11.433 -4.287 1.00 0.00 C ATOM 1960 C GLU A 127 2.350 -10.465 -4.608 1.00 0.00 C ATOM 1961 O GLU A 127 1.419 -10.815 -5.343 1.00 0.00 O ATOM 1962 CB GLU A 127 4.592 -11.299 -5.352 1.00 0.00 C ATOM 1963 CG GLU A 127 4.220 -11.866 -6.743 1.00 0.00 C ATOM 1964 CD GLU A 127 5.158 -11.429 -7.872 1.00 0.00 C ATOM 1965 OE1 GLU A 127 6.373 -11.276 -7.631 1.00 0.00 O ATOM 1966 OE2 GLU A 127 4.646 -11.242 -9.004 1.00 0.00 O ATOM 0 H GLU A 127 2.598 -13.087 -5.156 1.00 0.00 H new ATOM 0 HA GLU A 127 3.859 -11.179 -3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 127 4.848 -10.245 -5.460 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.486 -11.809 -4.994 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.217 -12.955 -6.690 1.00 0.00 H new ATOM 0 HG3 GLU A 127 3.205 -11.556 -6.989 1.00 0.00 H new ATOM 1973 N VAL A 128 2.457 -9.244 -4.073 1.00 0.00 N ATOM 1974 CA VAL A 128 1.580 -8.111 -4.341 1.00 0.00 C ATOM 1975 C VAL A 128 2.496 -6.875 -4.388 1.00 0.00 C ATOM 1976 O VAL A 128 3.465 -6.804 -3.635 1.00 0.00 O ATOM 1977 CB VAL A 128 0.470 -7.993 -3.269 1.00 0.00 C ATOM 1978 CG1 VAL A 128 -0.457 -6.799 -3.549 1.00 0.00 C ATOM 1979 CG2 VAL A 128 -0.411 -9.255 -3.190 1.00 0.00 C ATOM 0 H VAL A 128 3.196 -9.013 -3.409 1.00 0.00 H new ATOM 0 HA VAL A 128 1.045 -8.225 -5.284 1.00 0.00 H new ATOM 0 HB VAL A 128 0.995 -7.857 -2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.225 -6.746 -2.777 1.00 0.00 H new ATOM 0 HG12 VAL A 128 0.125 -5.878 -3.546 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.930 -6.926 -4.523 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.173 -9.119 -2.423 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.892 -9.424 -4.153 1.00 0.00 H new ATOM 0 HG23 VAL A 128 0.208 -10.116 -2.938 1.00 0.00 H new ATOM 1989 N ASP A 129 2.226 -5.909 -5.266 1.00 0.00 N ATOM 1990 CA ASP A 129 2.929 -4.628 -5.348 1.00 0.00 C ATOM 1991 C ASP A 129 2.037 -3.658 -6.118 1.00 0.00 C ATOM 1992 O ASP A 129 1.450 -4.061 -7.123 1.00 0.00 O ATOM 1993 CB ASP A 129 4.257 -4.790 -6.088 1.00 0.00 C ATOM 1994 CG ASP A 129 5.043 -3.490 -6.041 1.00 0.00 C ATOM 1995 OD1 ASP A 129 5.358 -3.054 -4.917 1.00 0.00 O ATOM 1996 OD2 ASP A 129 5.374 -2.975 -7.130 1.00 0.00 O ATOM 0 H ASP A 129 1.487 -5.999 -5.963 1.00 0.00 H new ATOM 0 HA ASP A 129 3.140 -4.256 -4.345 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.839 -5.593 -5.635 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.073 -5.075 -7.124 1.00 0.00 H new ATOM 2001 N VAL A 130 1.888 -2.408 -5.674 1.00 0.00 N ATOM 2002 CA VAL A 130 0.956 -1.456 -6.269 1.00 0.00 C ATOM 2003 C VAL A 130 1.635 -0.102 -6.396 1.00 0.00 C ATOM 2004 O VAL A 130 2.350 0.348 -5.496 1.00 0.00 O ATOM 2005 CB VAL A 130 -0.326 -1.386 -5.407 1.00 0.00 C ATOM 2006 CG1 VAL A 130 -1.459 -0.546 -6.008 1.00 0.00 C ATOM 2007 CG2 VAL A 130 -0.907 -2.787 -5.239 1.00 0.00 C ATOM 0 H VAL A 130 2.415 -2.029 -4.887 1.00 0.00 H new ATOM 0 HA VAL A 130 0.665 -1.778 -7.269 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.003 -0.924 -4.474 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.316 -0.555 -5.334 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.117 0.480 -6.147 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.751 -0.965 -6.971 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.810 -2.736 -4.631 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -1.151 -3.199 -6.218 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.175 -3.428 -4.748 1.00 0.00 H new ATOM 2017 N ILE A 131 1.393 0.556 -7.516 1.00 0.00 N ATOM 2018 CA ILE A 131 1.833 1.907 -7.778 1.00 0.00 C ATOM 2019 C ILE A 131 0.601 2.794 -7.695 1.00 0.00 C ATOM 2020 O ILE A 131 -0.544 2.341 -7.752 1.00 0.00 O ATOM 2021 CB ILE A 131 2.601 2.035 -9.109 1.00 0.00 C ATOM 2022 CG1 ILE A 131 1.728 1.767 -10.348 1.00 0.00 C ATOM 2023 CG2 ILE A 131 3.881 1.189 -9.073 1.00 0.00 C ATOM 2024 CD1 ILE A 131 1.536 0.274 -10.694 1.00 0.00 C ATOM 0 H ILE A 131 0.868 0.148 -8.290 1.00 0.00 H new ATOM 0 HA ILE A 131 2.564 2.225 -7.035 1.00 0.00 H new ATOM 0 HB ILE A 131 2.899 3.078 -9.214 1.00 0.00 H new ATOM 0 HG12 ILE A 131 0.748 2.218 -10.189 1.00 0.00 H new ATOM 0 HG13 ILE A 131 2.175 2.270 -11.206 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.411 1.291 -10.020 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.521 1.532 -8.260 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.621 0.143 -8.913 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.908 0.184 -11.580 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.507 -0.182 -10.889 1.00 0.00 H new ATOM 0 HD13 ILE A 131 1.058 -0.235 -9.857 1.00 0.00 H new ATOM 2036 N VAL A 132 0.851 4.080 -7.572 1.00 0.00 N ATOM 2037 CA VAL A 132 -0.146 5.092 -7.346 1.00 0.00 C ATOM 2038 C VAL A 132 0.249 6.313 -8.152 1.00 0.00 C ATOM 2039 O VAL A 132 1.420 6.705 -8.212 1.00 0.00 O ATOM 2040 CB VAL A 132 -0.266 5.338 -5.831 1.00 0.00 C ATOM 2041 CG1 VAL A 132 -0.878 6.700 -5.500 1.00 0.00 C ATOM 2042 CG2 VAL A 132 -1.097 4.240 -5.144 1.00 0.00 C ATOM 0 H VAL A 132 1.796 4.460 -7.630 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.140 4.795 -7.681 1.00 0.00 H new ATOM 0 HB VAL A 132 0.755 5.318 -5.451 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -0.938 6.819 -4.418 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.254 7.490 -5.918 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -1.878 6.763 -5.928 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.160 4.447 -4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.100 4.222 -5.570 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.620 3.272 -5.299 1.00 0.00 H new ATOM 2052 N MET A 133 -0.754 6.910 -8.777 1.00 0.00 N ATOM 2053 CA MET A 133 -0.635 8.047 -9.663 1.00 0.00 C ATOM 2054 C MET A 133 -1.773 9.009 -9.365 1.00 0.00 C ATOM 2055 O MET A 133 -2.624 8.751 -8.512 1.00 0.00 O ATOM 2056 CB MET A 133 -0.749 7.596 -11.136 1.00 0.00 C ATOM 2057 CG MET A 133 0.138 6.412 -11.553 1.00 0.00 C ATOM 2058 SD MET A 133 -0.738 4.967 -12.208 1.00 0.00 S ATOM 2059 CE MET A 133 -1.980 4.658 -10.921 1.00 0.00 C ATOM 0 H MET A 133 -1.719 6.596 -8.672 1.00 0.00 H new ATOM 0 HA MET A 133 0.333 8.523 -9.508 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.788 7.332 -11.334 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.508 8.446 -11.774 1.00 0.00 H new ATOM 0 HG2 MET A 133 0.844 6.759 -12.307 1.00 0.00 H new ATOM 0 HG3 MET A 133 0.723 6.098 -10.689 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.515 3.735 -11.146 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.486 4.565 -9.954 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.686 5.488 -10.890 1.00 0.00 H new ATOM 2069 N ASN A 134 -1.751 10.169 -10.005 1.00 0.00 N ATOM 2070 CA ASN A 134 -2.857 11.112 -9.929 1.00 0.00 C ATOM 2071 C ASN A 134 -3.803 10.703 -11.081 1.00 0.00 C ATOM 2072 O ASN A 134 -3.479 9.792 -11.849 1.00 0.00 O ATOM 2073 CB ASN A 134 -2.343 12.562 -9.989 1.00 0.00 C ATOM 2074 CG ASN A 134 -1.716 12.975 -11.317 1.00 0.00 C ATOM 2075 OD1 ASN A 134 -1.541 12.183 -12.231 1.00 0.00 O ATOM 2076 ND2 ASN A 134 -1.348 14.237 -11.454 1.00 0.00 N ATOM 0 H ASN A 134 -0.973 10.481 -10.587 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.401 11.079 -8.985 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -3.174 13.234 -9.773 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -1.606 12.702 -9.198 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.917 14.551 -12.324 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -1.495 14.897 -10.690 1.00 0.00 H new ATOM 2083 N SER A 135 -4.974 11.329 -11.236 1.00 0.00 N ATOM 2084 CA SER A 135 -5.890 10.951 -12.323 1.00 0.00 C ATOM 2085 C SER A 135 -5.295 11.249 -13.713 1.00 0.00 C ATOM 2086 O SER A 135 -5.788 10.719 -14.706 1.00 0.00 O ATOM 2087 CB SER A 135 -7.236 11.664 -12.144 1.00 0.00 C ATOM 2088 OG SER A 135 -8.235 11.018 -12.908 1.00 0.00 O ATOM 0 H SER A 135 -5.308 12.085 -10.638 1.00 0.00 H new ATOM 0 HA SER A 135 -6.044 9.873 -12.269 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.518 11.666 -11.091 1.00 0.00 H new ATOM 0 HB3 SER A 135 -7.148 12.706 -12.453 1.00 0.00 H new ATOM 0 HG SER A 135 -7.827 10.607 -13.699 1.00 0.00 H new ATOM 2094 N GLU A 136 -4.230 12.052 -13.786 1.00 0.00 N ATOM 2095 CA GLU A 136 -3.491 12.378 -15.000 1.00 0.00 C ATOM 2096 C GLU A 136 -2.513 11.242 -15.363 1.00 0.00 C ATOM 2097 O GLU A 136 -1.751 11.363 -16.324 1.00 0.00 O ATOM 2098 CB GLU A 136 -2.752 13.726 -14.862 1.00 0.00 C ATOM 2099 CG GLU A 136 -3.506 14.841 -14.113 1.00 0.00 C ATOM 2100 CD GLU A 136 -4.977 14.990 -14.508 1.00 0.00 C ATOM 2101 OE1 GLU A 136 -5.230 15.427 -15.651 1.00 0.00 O ATOM 2102 OE2 GLU A 136 -5.824 14.681 -13.637 1.00 0.00 O ATOM 0 H GLU A 136 -3.845 12.511 -12.961 1.00 0.00 H new ATOM 0 HA GLU A 136 -4.209 12.481 -15.814 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.807 13.548 -14.350 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -2.510 14.088 -15.861 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.449 14.645 -13.042 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -2.998 15.789 -14.291 1.00 0.00 H new ATOM 2109 N GLY A 137 -2.415 10.194 -14.535 1.00 0.00 N ATOM 2110 CA GLY A 137 -1.558 9.034 -14.748 1.00 0.00 C ATOM 2111 C GLY A 137 -0.108 9.280 -14.337 1.00 0.00 C ATOM 2112 O GLY A 137 0.747 8.426 -14.560 1.00 0.00 O ATOM 0 H GLY A 137 -2.952 10.134 -13.670 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.952 8.189 -14.183 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.589 8.755 -15.801 1.00 0.00 H new ATOM 2116 N ASN A 138 0.203 10.434 -13.739 1.00 0.00 N ATOM 2117 CA ASN A 138 1.557 10.737 -13.291 1.00 0.00 C ATOM 2118 C ASN A 138 1.758 10.044 -11.950 1.00 0.00 C ATOM 2119 O ASN A 138 1.030 10.322 -10.994 1.00 0.00 O ATOM 2120 CB ASN A 138 1.808 12.238 -13.127 1.00 0.00 C ATOM 2121 CG ASN A 138 1.867 13.033 -14.429 1.00 0.00 C ATOM 2122 OD1 ASN A 138 0.931 12.862 -15.351 1.00 0.00 O flip ATOM 2123 ND2 ASN A 138 2.766 13.843 -14.616 1.00 0.00 N flip ATOM 0 H ASN A 138 -0.473 11.175 -13.555 1.00 0.00 H new ATOM 0 HA ASN A 138 2.259 10.384 -14.046 1.00 0.00 H new ATOM 0 HB2 ASN A 138 1.020 12.656 -12.500 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.748 12.377 -12.592 1.00 0.00 H new ATOM 0 HD21 ASN A 138 3.488 13.976 -13.908 1.00 0.00 H new ATOM 0 HD22 ASN A 138 2.793 14.384 -15.480 1.00 0.00 H new ATOM 2130 N THR A 139 2.715 9.123 -11.898 1.00 0.00 N ATOM 2131 CA THR A 139 3.048 8.315 -10.731 1.00 0.00 C ATOM 2132 C THR A 139 3.572 9.239 -9.625 1.00 0.00 C ATOM 2133 O THR A 139 4.286 10.202 -9.909 1.00 0.00 O ATOM 2134 CB THR A 139 4.109 7.277 -11.129 1.00 0.00 C ATOM 2135 OG1 THR A 139 3.860 6.759 -12.426 1.00 0.00 O ATOM 2136 CG2 THR A 139 4.164 6.096 -10.153 1.00 0.00 C ATOM 0 H THR A 139 3.305 8.911 -12.703 1.00 0.00 H new ATOM 0 HA THR A 139 2.168 7.788 -10.361 1.00 0.00 H new ATOM 0 HB THR A 139 5.062 7.805 -11.108 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.551 6.102 -12.654 1.00 0.00 H new ATOM 0 HG21 THR A 139 4.929 5.391 -10.478 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.407 6.460 -9.155 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.195 5.596 -10.131 1.00 0.00 H new ATOM 2144 N ILE A 140 3.233 8.936 -8.372 1.00 0.00 N ATOM 2145 CA ILE A 140 3.558 9.747 -7.202 1.00 0.00 C ATOM 2146 C ILE A 140 3.967 8.923 -5.979 1.00 0.00 C ATOM 2147 O ILE A 140 4.847 9.338 -5.229 1.00 0.00 O ATOM 2148 CB ILE A 140 2.436 10.728 -6.856 1.00 0.00 C ATOM 2149 CG1 ILE A 140 1.037 10.080 -6.777 1.00 0.00 C ATOM 2150 CG2 ILE A 140 2.566 11.969 -7.775 1.00 0.00 C ATOM 2151 CD1 ILE A 140 -0.065 11.036 -7.206 1.00 0.00 C ATOM 0 H ILE A 140 2.709 8.093 -8.138 1.00 0.00 H new ATOM 0 HA ILE A 140 4.437 10.325 -7.488 1.00 0.00 H new ATOM 0 HB ILE A 140 2.555 11.076 -5.830 1.00 0.00 H new ATOM 0 HG12 ILE A 140 1.013 9.193 -7.410 1.00 0.00 H new ATOM 0 HG13 ILE A 140 0.850 9.747 -5.756 1.00 0.00 H new ATOM 0 HG21 ILE A 140 1.773 12.679 -7.541 1.00 0.00 H new ATOM 0 HG22 ILE A 140 3.535 12.441 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE A 140 2.482 11.661 -8.817 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -1.030 10.535 -7.133 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -0.061 11.911 -6.556 1.00 0.00 H new ATOM 0 HD13 ILE A 140 0.105 11.348 -8.236 1.00 0.00 H new ATOM 2163 N LEU A 141 3.334 7.772 -5.766 1.00 0.00 N ATOM 2164 CA LEU A 141 3.577 6.873 -4.635 1.00 0.00 C ATOM 2165 C LEU A 141 3.760 5.469 -5.219 1.00 0.00 C ATOM 2166 O LEU A 141 3.100 5.121 -6.198 1.00 0.00 O ATOM 2167 CB LEU A 141 2.410 7.051 -3.632 1.00 0.00 C ATOM 2168 CG LEU A 141 2.340 6.198 -2.347 1.00 0.00 C ATOM 2169 CD1 LEU A 141 1.964 4.731 -2.571 1.00 0.00 C ATOM 2170 CD2 LEU A 141 3.627 6.308 -1.530 1.00 0.00 C ATOM 0 H LEU A 141 2.612 7.425 -6.397 1.00 0.00 H new ATOM 0 HA LEU A 141 4.481 7.086 -4.064 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.408 8.097 -3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.485 6.879 -4.182 1.00 0.00 H new ATOM 0 HG LEU A 141 1.516 6.627 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.940 4.211 -1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 141 0.981 4.675 -3.039 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.703 4.261 -3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 141 3.542 5.695 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.469 5.960 -2.129 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.789 7.347 -1.245 1.00 0.00 H new ATOM 2182 N GLN A 142 4.685 4.670 -4.684 1.00 0.00 N ATOM 2183 CA GLN A 142 4.995 3.345 -5.207 1.00 0.00 C ATOM 2184 C GLN A 142 5.379 2.435 -4.056 1.00 0.00 C ATOM 2185 O GLN A 142 6.244 2.767 -3.248 1.00 0.00 O ATOM 2186 CB GLN A 142 6.067 3.462 -6.294 1.00 0.00 C ATOM 2187 CG GLN A 142 6.692 2.170 -6.855 1.00 0.00 C ATOM 2188 CD GLN A 142 8.195 2.035 -6.600 1.00 0.00 C ATOM 2189 OE1 GLN A 142 8.989 2.884 -6.987 1.00 0.00 O ATOM 2190 NE2 GLN A 142 8.634 0.940 -6.005 1.00 0.00 N ATOM 0 H GLN A 142 5.242 4.929 -3.870 1.00 0.00 H new ATOM 0 HA GLN A 142 4.126 2.893 -5.685 1.00 0.00 H new ATOM 0 HB2 GLN A 142 5.632 4.010 -7.130 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.876 4.076 -5.897 1.00 0.00 H new ATOM 0 HG2 GLN A 142 6.182 1.313 -6.415 1.00 0.00 H new ATOM 0 HG3 GLN A 142 6.513 2.130 -7.929 1.00 0.00 H new ATOM 0 HE21 GLN A 142 7.972 0.234 -5.683 1.00 0.00 H new ATOM 0 HE22 GLN A 142 9.635 0.801 -5.867 1.00 0.00 H new ATOM 2199 N THR A 143 4.687 1.305 -3.990 1.00 0.00 N ATOM 2200 CA THR A 143 4.979 0.232 -3.042 1.00 0.00 C ATOM 2201 C THR A 143 6.333 -0.359 -3.448 1.00 0.00 C ATOM 2202 O THR A 143 6.644 -0.384 -4.641 1.00 0.00 O ATOM 2203 CB THR A 143 3.848 -0.814 -3.088 1.00 0.00 C ATOM 2204 OG1 THR A 143 2.601 -0.174 -2.906 1.00 0.00 O ATOM 2205 CG2 THR A 143 3.925 -1.907 -2.022 1.00 0.00 C ATOM 0 H THR A 143 3.896 1.103 -4.601 1.00 0.00 H new ATOM 0 HA THR A 143 5.033 0.592 -2.014 1.00 0.00 H new ATOM 0 HB THR A 143 3.960 -1.288 -4.063 1.00 0.00 H new ATOM 0 HG1 THR A 143 2.309 0.221 -3.754 1.00 0.00 H new ATOM 0 HG21 THR A 143 3.085 -2.591 -2.141 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.859 -2.457 -2.132 1.00 0.00 H new ATOM 0 HG23 THR A 143 3.886 -1.453 -1.032 1.00 0.00 H new ATOM 2213 N PRO A 144 7.204 -0.760 -2.509 1.00 0.00 N ATOM 2214 CA PRO A 144 8.424 -1.433 -2.884 1.00 0.00 C ATOM 2215 C PRO A 144 8.125 -2.912 -3.083 1.00 0.00 C ATOM 2216 O PRO A 144 7.369 -3.526 -2.320 1.00 0.00 O ATOM 2217 CB PRO A 144 9.366 -1.263 -1.712 1.00 0.00 C ATOM 2218 CG PRO A 144 8.413 -1.243 -0.508 1.00 0.00 C ATOM 2219 CD PRO A 144 7.088 -0.694 -1.062 1.00 0.00 C ATOM 0 HA PRO A 144 8.851 -1.033 -3.804 1.00 0.00 H new ATOM 0 HB2 PRO A 144 10.082 -2.082 -1.647 1.00 0.00 H new ATOM 0 HB3 PRO A 144 9.942 -0.341 -1.787 1.00 0.00 H new ATOM 0 HG2 PRO A 144 8.283 -2.241 -0.090 1.00 0.00 H new ATOM 0 HG3 PRO A 144 8.799 -0.611 0.291 1.00 0.00 H new ATOM 0 HD2 PRO A 144 6.243 -1.286 -0.710 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.920 0.331 -0.730 1.00 0.00 H new ATOM 2227 N GLN A 145 8.855 -3.518 -4.011 1.00 0.00 N ATOM 2228 CA GLN A 145 8.639 -4.907 -4.317 1.00 0.00 C ATOM 2229 C GLN A 145 9.277 -5.634 -3.140 1.00 0.00 C ATOM 2230 O GLN A 145 10.499 -5.634 -3.012 1.00 0.00 O ATOM 2231 CB GLN A 145 9.259 -5.253 -5.668 1.00 0.00 C ATOM 2232 CG GLN A 145 8.529 -4.477 -6.777 1.00 0.00 C ATOM 2233 CD GLN A 145 8.936 -2.999 -6.888 1.00 0.00 C ATOM 2234 OE1 GLN A 145 10.092 -2.640 -6.673 1.00 0.00 O ATOM 2235 NE2 GLN A 145 8.008 -2.102 -7.165 1.00 0.00 N ATOM 0 H GLN A 145 9.591 -3.067 -4.554 1.00 0.00 H new ATOM 0 HA GLN A 145 7.591 -5.188 -4.425 1.00 0.00 H new ATOM 0 HB2 GLN A 145 10.319 -5.001 -5.670 1.00 0.00 H new ATOM 0 HB3 GLN A 145 9.186 -6.325 -5.850 1.00 0.00 H new ATOM 0 HG2 GLN A 145 8.719 -4.967 -7.732 1.00 0.00 H new ATOM 0 HG3 GLN A 145 7.455 -4.534 -6.598 1.00 0.00 H new ATOM 0 HE21 GLN A 145 7.049 -2.399 -7.344 1.00 0.00 H new ATOM 0 HE22 GLN A 145 8.250 -1.112 -7.201 1.00 0.00 H new ATOM 2244 N ASN A 146 8.458 -6.293 -2.322 1.00 0.00 N ATOM 2245 CA ASN A 146 8.783 -6.957 -1.058 1.00 0.00 C ATOM 2246 C ASN A 146 7.544 -7.468 -0.344 1.00 0.00 C ATOM 2247 O ASN A 146 7.689 -8.342 0.512 1.00 0.00 O ATOM 2248 CB ASN A 146 9.493 -6.046 -0.029 1.00 0.00 C ATOM 2249 CG ASN A 146 10.987 -5.896 -0.240 1.00 0.00 C ATOM 2250 OD1 ASN A 146 11.715 -6.877 -0.096 1.00 0.00 O ATOM 2251 ND2 ASN A 146 11.485 -4.697 -0.487 1.00 0.00 N ATOM 0 H ASN A 146 7.467 -6.385 -2.544 1.00 0.00 H new ATOM 0 HA ASN A 146 9.445 -7.765 -1.369 1.00 0.00 H new ATOM 0 HB2 ASN A 146 9.034 -5.058 -0.062 1.00 0.00 H new ATOM 0 HB3 ASN A 146 9.319 -6.445 0.970 1.00 0.00 H new ATOM 0 HD21 ASN A 146 12.494 -4.570 -0.562 1.00 0.00 H new ATOM 0 HD22 ASN A 146 10.860 -3.899 -0.602 1.00 0.00 H new ATOM 2258 N ALA A 147 6.370 -6.888 -0.614 1.00 0.00 N ATOM 2259 CA ALA A 147 5.108 -7.288 -0.018 1.00 0.00 C ATOM 2260 C ALA A 147 4.757 -8.698 -0.523 1.00 0.00 C ATOM 2261 O ALA A 147 4.109 -8.884 -1.556 1.00 0.00 O ATOM 2262 CB ALA A 147 4.059 -6.204 -0.302 1.00 0.00 C ATOM 0 H ALA A 147 6.277 -6.111 -1.268 1.00 0.00 H new ATOM 0 HA ALA A 147 5.158 -7.365 1.068 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.107 -6.494 0.141 1.00 0.00 H new ATOM 0 HB2 ALA A 147 4.387 -5.258 0.130 1.00 0.00 H new ATOM 0 HB3 ALA A 147 3.938 -6.088 -1.379 1.00 0.00 H new ATOM 2268 N ILE A 148 5.269 -9.699 0.195 1.00 0.00 N ATOM 2269 CA ILE A 148 5.186 -11.111 -0.132 1.00 0.00 C ATOM 2270 C ILE A 148 4.640 -11.802 1.099 1.00 0.00 C ATOM 2271 O ILE A 148 4.913 -11.399 2.234 1.00 0.00 O ATOM 2272 CB ILE A 148 6.560 -11.660 -0.591 1.00 0.00 C ATOM 2273 CG1 ILE A 148 6.893 -10.971 -1.939 1.00 0.00 C ATOM 2274 CG2 ILE A 148 6.611 -13.205 -0.666 1.00 0.00 C ATOM 2275 CD1 ILE A 148 7.726 -11.800 -2.907 1.00 0.00 C ATOM 0 H ILE A 148 5.777 -9.531 1.063 1.00 0.00 H new ATOM 0 HA ILE A 148 4.522 -11.295 -0.977 1.00 0.00 H new ATOM 0 HB ILE A 148 7.322 -11.422 0.151 1.00 0.00 H new ATOM 0 HG12 ILE A 148 5.958 -10.700 -2.430 1.00 0.00 H new ATOM 0 HG13 ILE A 148 7.425 -10.042 -1.732 1.00 0.00 H new ATOM 0 HG21 ILE A 148 7.601 -13.521 -0.994 1.00 0.00 H new ATOM 0 HG22 ILE A 148 6.404 -13.624 0.319 1.00 0.00 H new ATOM 0 HG23 ILE A 148 5.864 -13.560 -1.376 1.00 0.00 H new ATOM 0 HD11 ILE A 148 7.903 -11.227 -3.817 1.00 0.00 H new ATOM 0 HD12 ILE A 148 8.681 -12.049 -2.444 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.192 -12.717 -3.153 1.00 0.00 H new ATOM 2287 N PHE A 149 3.895 -12.863 0.834 1.00 0.00 N ATOM 2288 CA PHE A 149 3.202 -13.660 1.825 1.00 0.00 C ATOM 2289 C PHE A 149 3.466 -15.128 1.493 1.00 0.00 C ATOM 2290 O PHE A 149 3.946 -15.443 0.399 1.00 0.00 O ATOM 2291 CB PHE A 149 1.698 -13.353 1.852 1.00 0.00 C ATOM 2292 CG PHE A 149 1.224 -11.915 1.689 1.00 0.00 C ATOM 2293 CD1 PHE A 149 1.392 -11.238 0.462 1.00 0.00 C ATOM 2294 CD2 PHE A 149 0.476 -11.301 2.713 1.00 0.00 C ATOM 2295 CE1 PHE A 149 0.845 -9.960 0.270 1.00 0.00 C ATOM 2296 CE2 PHE A 149 -0.115 -10.043 2.500 1.00 0.00 C ATOM 2297 CZ PHE A 149 0.069 -9.371 1.279 1.00 0.00 C ATOM 0 H PHE A 149 3.753 -13.204 -0.117 1.00 0.00 H new ATOM 0 HA PHE A 149 3.572 -13.423 2.822 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.230 -13.943 1.064 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.306 -13.721 2.800 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.947 -11.708 -0.337 1.00 0.00 H new ATOM 0 HD2 PHE A 149 0.356 -11.798 3.664 1.00 0.00 H new ATOM 0 HE1 PHE A 149 1.022 -9.430 -0.654 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -0.713 -9.591 3.278 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.386 -8.405 1.118 1.00 0.00 H new ATOM 2307 N PHE A 150 3.131 -16.032 2.413 1.00 0.00 N ATOM 2308 CA PHE A 150 3.438 -17.448 2.315 1.00 0.00 C ATOM 2309 C PHE A 150 2.213 -18.260 2.705 1.00 0.00 C ATOM 2310 O PHE A 150 1.831 -18.243 3.869 1.00 0.00 O ATOM 2311 CB PHE A 150 4.634 -17.732 3.244 1.00 0.00 C ATOM 2312 CG PHE A 150 5.895 -17.019 2.791 1.00 0.00 C ATOM 2313 CD1 PHE A 150 6.145 -15.699 3.217 1.00 0.00 C ATOM 2314 CD2 PHE A 150 6.737 -17.612 1.833 1.00 0.00 C ATOM 2315 CE1 PHE A 150 7.181 -14.949 2.637 1.00 0.00 C ATOM 2316 CE2 PHE A 150 7.788 -16.867 1.266 1.00 0.00 C ATOM 2317 CZ PHE A 150 7.983 -15.525 1.636 1.00 0.00 C ATOM 0 H PHE A 150 2.627 -15.788 3.265 1.00 0.00 H new ATOM 0 HA PHE A 150 3.703 -17.730 1.296 1.00 0.00 H new ATOM 0 HB2 PHE A 150 4.386 -17.419 4.258 1.00 0.00 H new ATOM 0 HB3 PHE A 150 4.818 -18.806 3.278 1.00 0.00 H new ATOM 0 HD1 PHE A 150 5.536 -15.262 3.994 1.00 0.00 H new ATOM 0 HD2 PHE A 150 6.577 -18.637 1.533 1.00 0.00 H new ATOM 0 HE1 PHE A 150 7.361 -13.934 2.959 1.00 0.00 H new ATOM 0 HE2 PHE A 150 8.447 -17.328 0.545 1.00 0.00 H new ATOM 0 HZ PHE A 150 8.748 -14.937 1.152 1.00 0.00 H new ATOM 2327 N LYS A 151 1.596 -19.003 1.781 1.00 0.00 N ATOM 2328 CA LYS A 151 0.378 -19.755 2.087 1.00 0.00 C ATOM 2329 C LYS A 151 0.716 -21.227 2.229 1.00 0.00 C ATOM 2330 O LYS A 151 1.249 -21.843 1.313 1.00 0.00 O ATOM 2331 CB LYS A 151 -0.757 -19.487 1.085 1.00 0.00 C ATOM 2332 CG LYS A 151 -2.049 -20.154 1.597 1.00 0.00 C ATOM 2333 CD LYS A 151 -3.330 -19.575 0.984 1.00 0.00 C ATOM 2334 CE LYS A 151 -4.522 -20.367 1.540 1.00 0.00 C ATOM 2335 NZ LYS A 151 -5.825 -19.727 1.267 1.00 0.00 N ATOM 0 H LYS A 151 1.920 -19.099 0.818 1.00 0.00 H new ATOM 0 HA LYS A 151 -0.016 -19.404 3.041 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.909 -18.414 0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.493 -19.882 0.104 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -2.005 -21.222 1.382 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -2.096 -20.049 2.681 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.426 -18.518 1.231 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.298 -19.647 -0.103 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.518 -21.368 1.108 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.401 -20.485 2.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -6.588 -20.422 1.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.964 -18.931 1.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.842 -19.378 0.288 1.00 0.00 H new ATOM 2349 N THR A 152 0.395 -21.782 3.387 1.00 0.00 N ATOM 2350 CA THR A 152 0.512 -23.189 3.697 1.00 0.00 C ATOM 2351 C THR A 152 -0.755 -23.832 3.155 1.00 0.00 C ATOM 2352 O THR A 152 -1.838 -23.493 3.642 1.00 0.00 O ATOM 2353 CB THR A 152 0.570 -23.357 5.224 1.00 0.00 C ATOM 2354 OG1 THR A 152 1.561 -22.513 5.783 1.00 0.00 O ATOM 2355 CG2 THR A 152 0.807 -24.801 5.671 1.00 0.00 C ATOM 0 H THR A 152 0.030 -21.236 4.167 1.00 0.00 H new ATOM 0 HA THR A 152 1.406 -23.639 3.266 1.00 0.00 H new ATOM 0 HB THR A 152 -0.414 -23.069 5.593 1.00 0.00 H new ATOM 0 HG1 THR A 152 1.582 -22.633 6.755 1.00 0.00 H new ATOM 0 HG21 THR A 152 0.836 -24.845 6.760 1.00 0.00 H new ATOM 0 HG22 THR A 152 -0.002 -25.433 5.304 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.756 -25.156 5.268 1.00 0.00 H new ATOM 2363 N CYS A 153 -0.639 -24.713 2.163 1.00 0.00 N ATOM 2364 CA CYS A 153 -1.765 -25.484 1.651 1.00 0.00 C ATOM 2365 C CYS A 153 -1.535 -26.970 1.889 1.00 0.00 C ATOM 2366 O CYS A 153 -0.430 -27.406 2.220 1.00 0.00 O ATOM 2367 CB CYS A 153 -2.039 -25.234 0.168 1.00 0.00 C ATOM 2368 SG CYS A 153 -1.945 -23.544 -0.439 1.00 0.00 S ATOM 0 H CYS A 153 0.243 -24.911 1.691 1.00 0.00 H new ATOM 0 HA CYS A 153 -2.646 -25.148 2.198 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -1.334 -25.834 -0.407 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -3.036 -25.613 -0.055 1.00 0.00 H new ATOM 2373 N LEU A 154 -2.607 -27.736 1.725 1.00 0.00 N ATOM 2374 CA LEU A 154 -2.611 -29.181 1.769 1.00 0.00 C ATOM 2375 C LEU A 154 -3.430 -29.675 0.580 1.00 0.00 C ATOM 2376 O LEU A 154 -4.174 -28.900 -0.030 1.00 0.00 O ATOM 2377 CB LEU A 154 -3.076 -29.688 3.144 1.00 0.00 C ATOM 2378 CG LEU A 154 -4.501 -29.320 3.600 1.00 0.00 C ATOM 2379 CD1 LEU A 154 -5.595 -30.148 2.921 1.00 0.00 C ATOM 2380 CD2 LEU A 154 -4.593 -29.541 5.116 1.00 0.00 C ATOM 0 H LEU A 154 -3.532 -27.344 1.551 1.00 0.00 H new ATOM 0 HA LEU A 154 -1.608 -29.596 1.667 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -2.994 -30.775 3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -2.378 -29.314 3.893 1.00 0.00 H new ATOM 0 HG LEU A 154 -4.670 -28.280 3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.571 -29.834 3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.549 -29.996 1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -5.444 -31.204 3.146 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -5.595 -29.286 5.461 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -4.386 -30.586 5.345 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -3.864 -28.908 5.621 1.00 0.00 H new ATOM 2392 N GLN A 155 -3.245 -30.942 0.255 1.00 0.00 N ATOM 2393 CA GLN A 155 -3.885 -31.687 -0.811 1.00 0.00 C ATOM 2394 C GLN A 155 -5.336 -31.987 -0.424 1.00 0.00 C ATOM 2395 O GLN A 155 -5.581 -32.692 0.557 1.00 0.00 O ATOM 2396 CB GLN A 155 -3.024 -32.936 -1.001 1.00 0.00 C ATOM 2397 CG GLN A 155 -3.464 -33.928 -2.079 1.00 0.00 C ATOM 2398 CD GLN A 155 -2.455 -35.074 -2.268 1.00 0.00 C ATOM 2399 OE1 GLN A 155 -2.716 -36.020 -3.005 1.00 0.00 O ATOM 2400 NE2 GLN A 155 -1.292 -35.065 -1.623 1.00 0.00 N ATOM 0 H GLN A 155 -2.588 -31.524 0.775 1.00 0.00 H new ATOM 0 HA GLN A 155 -3.947 -31.143 -1.753 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -2.008 -32.615 -1.231 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.983 -33.466 -0.050 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.436 -34.343 -1.812 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.592 -33.400 -3.024 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -1.057 -34.287 -1.006 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -0.635 -35.836 -1.745 1.00 0.00 H new ATOM 2409 N ALA A 156 -6.291 -31.417 -1.161 1.00 0.00 N ATOM 2410 CA ALA A 156 -7.724 -31.569 -0.947 1.00 0.00 C ATOM 2411 C ALA A 156 -8.485 -31.123 -2.198 1.00 0.00 C ATOM 2412 O ALA A 156 -8.399 -29.954 -2.583 1.00 0.00 O ATOM 2413 CB ALA A 156 -8.172 -30.717 0.249 1.00 0.00 C ATOM 0 H ALA A 156 -6.074 -30.813 -1.954 1.00 0.00 H new ATOM 0 HA ALA A 156 -7.939 -32.618 -0.743 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -9.245 -30.838 0.400 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -7.641 -31.039 1.145 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -7.949 -29.668 0.052 1.00 0.00 H new ATOM 2419 N GLU A 157 -9.228 -32.042 -2.809 1.00 0.00 N ATOM 2420 CA GLU A 157 -10.140 -31.875 -3.925 1.00 0.00 C ATOM 2421 C GLU A 157 -11.243 -32.914 -3.724 1.00 0.00 C ATOM 2422 O GLU A 157 -10.926 -33.958 -3.102 1.00 0.00 O ATOM 2423 CB GLU A 157 -9.359 -32.081 -5.230 1.00 0.00 C ATOM 2424 CG GLU A 157 -10.125 -31.627 -6.490 1.00 0.00 C ATOM 2425 CD GLU A 157 -9.185 -31.214 -7.636 1.00 0.00 C ATOM 2426 OE1 GLU A 157 -8.119 -31.845 -7.844 1.00 0.00 O ATOM 2427 OE2 GLU A 157 -9.398 -30.144 -8.259 1.00 0.00 O ATOM 2428 OXT GLU A 157 -12.390 -32.633 -4.128 1.00 0.00 O ATOM 0 H GLU A 157 -9.200 -33.014 -2.501 1.00 0.00 H new ATOM 0 HA GLU A 157 -10.585 -30.881 -3.979 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -8.419 -31.533 -5.170 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -9.107 -33.137 -5.329 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -10.772 -32.436 -6.829 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -10.772 -30.788 -6.235 1.00 0.00 H new TER 2435 GLU A 157