USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1038 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 85 SER OG : rot 130:sc= 1.08 USER MOD Set 1.2: A 87 ASN : amide:sc= -0.42 K(o=0.66,f=-4.3!) USER MOD Set 2.1: A 63 SER OG : rot -41:sc= 1.26 USER MOD Set 2.2: A 66 ASN : amide:sc= 1.45 K(o=2.7,f=-4.1!) USER MOD Set 3.1: A -2 HIS : no HD1:sc= -1.52 K(o=-3.1,f=-0.9) USER MOD Set 3.2: A -4 HIS : no HE2:sc= -1.53 K(o=-3.1,f=-0.9) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.088) USER MOD Single : A -3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= -0.0143 X(o=-0.014,f=-0.045) USER MOD Single : A -5 HIS N :NH3+ -109:sc= 0.037 (180deg=-0.00862) USER MOD Single : A 11 MET CE :methyl -144:sc= -0.217 (180deg=-1.31) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0431) USER MOD Single : A 22 GLN : amide:sc= 0.0517 X(o=0.052,f=-0.27) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 MET CE :methyl 137:sc= -0.142 (180deg=-1.04) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0.00838 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.364 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -3.29 X(o=-3.3,f=-3.5!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -0.868 K(o=-0.87,f=-2.7!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -75:sc= 0.428 USER MOD Single : A 77 HIS : no HD1:sc= -1.99 K(o=-2,f=-4.4!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 166:sc= 0.0271 USER MOD Single : A 101 ASN : amide:sc= -2.46 K(o=-2.5,f=-5.4!) USER MOD Single : A 106 LYS NZ :NH3+ 139:sc= -0.146 (180deg=-0.867) USER MOD Single : A 109 HIS : no HD1:sc= -0.0586 X(o=-0.059,f=-0.24) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 155:sc= 1.17 (180deg=0.468) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -20:sc= -0.831 USER MOD Single : A 136 ASN : amide:sc= -0.017 K(o=-0.017,f=-1.4) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 46.514 -23.729 -1.627 1.00 0.00 N ATOM 2 CA HIS A -5 47.695 -23.045 -2.225 1.00 0.00 C ATOM 3 C HIS A -5 47.281 -22.364 -3.525 1.00 0.00 C ATOM 4 O HIS A -5 46.365 -22.819 -4.211 1.00 0.00 O ATOM 5 CB HIS A -5 48.791 -24.076 -2.501 1.00 0.00 C ATOM 6 CG HIS A -5 49.333 -24.723 -1.256 1.00 0.00 C ATOM 7 ND1 HIS A -5 48.809 -25.900 -0.747 1.00 0.00 N ATOM 8 CD2 HIS A -5 50.354 -24.368 -0.407 1.00 0.00 C ATOM 9 CE1 HIS A -5 49.508 -26.209 0.360 1.00 0.00 C ATOM 10 NE2 HIS A -5 50.462 -25.310 0.613 1.00 0.00 N ATOM 0 H1 HIS A -5 46.211 -23.217 -0.774 1.00 0.00 H new ATOM 0 H2 HIS A -5 45.736 -23.744 -2.316 1.00 0.00 H new ATOM 0 H3 HIS A -5 46.770 -24.704 -1.373 1.00 0.00 H new ATOM 0 HA HIS A -5 48.076 -22.293 -1.533 1.00 0.00 H new ATOM 0 HB2 HIS A -5 48.394 -24.849 -3.159 1.00 0.00 H new ATOM 0 HB3 HIS A -5 49.609 -23.591 -3.035 1.00 0.00 H new ATOM 0 HD2 HIS A -5 50.977 -23.492 -0.514 1.00 0.00 H new ATOM 0 HE1 HIS A -5 49.320 -27.080 0.971 1.00 0.00 H new ATOM 0 HE2 HIS A -5 51.127 -25.313 1.387 1.00 0.00 H new ATOM 20 N HIS A -4 47.962 -21.271 -3.857 1.00 0.00 N ATOM 21 CA HIS A -4 47.666 -20.527 -5.079 1.00 0.00 C ATOM 22 C HIS A -4 48.921 -20.388 -5.933 1.00 0.00 C ATOM 23 O HIS A -4 50.001 -20.091 -5.423 1.00 0.00 O ATOM 24 CB HIS A -4 47.131 -19.138 -4.725 1.00 0.00 C ATOM 25 CG HIS A -4 46.696 -18.341 -5.924 1.00 0.00 C ATOM 26 ND1 HIS A -4 45.616 -18.716 -6.708 1.00 0.00 N ATOM 27 CD2 HIS A -4 47.183 -17.186 -6.484 1.00 0.00 C ATOM 28 CE1 HIS A -4 45.490 -17.804 -7.687 1.00 0.00 C ATOM 29 NE2 HIS A -4 46.420 -16.848 -7.598 1.00 0.00 N ATOM 0 H HIS A -4 48.721 -20.881 -3.299 1.00 0.00 H new ATOM 0 HA HIS A -4 46.912 -21.073 -5.645 1.00 0.00 H new ATOM 0 HB2 HIS A -4 46.287 -19.245 -4.044 1.00 0.00 H new ATOM 0 HB3 HIS A -4 47.904 -18.585 -4.191 1.00 0.00 H new ATOM 0 HD1 HIS A -4 45.025 -19.535 -6.567 1.00 0.00 H new ATOM 0 HD2 HIS A -4 48.029 -16.625 -6.116 1.00 0.00 H new ATOM 0 HE1 HIS A -4 44.729 -17.839 -8.453 1.00 0.00 H new ATOM 37 N HIS A -3 48.772 -20.604 -7.238 1.00 0.00 N ATOM 38 CA HIS A -3 49.901 -20.519 -8.163 1.00 0.00 C ATOM 39 C HIS A -3 49.633 -19.477 -9.243 1.00 0.00 C ATOM 40 O HIS A -3 48.499 -19.308 -9.691 1.00 0.00 O ATOM 41 CB HIS A -3 50.138 -21.881 -8.816 1.00 0.00 C ATOM 42 CG HIS A -3 50.539 -22.952 -7.839 1.00 0.00 C ATOM 43 ND1 HIS A -3 49.611 -23.776 -7.224 1.00 0.00 N ATOM 44 CD2 HIS A -3 51.766 -23.346 -7.361 1.00 0.00 C ATOM 45 CE1 HIS A -3 50.285 -24.616 -6.419 1.00 0.00 C ATOM 46 NE2 HIS A -3 51.601 -24.399 -6.463 1.00 0.00 N ATOM 0 H HIS A -3 47.883 -20.839 -7.679 1.00 0.00 H new ATOM 0 HA HIS A -3 50.787 -20.222 -7.601 1.00 0.00 H new ATOM 0 HB2 HIS A -3 49.229 -22.192 -9.331 1.00 0.00 H new ATOM 0 HB3 HIS A -3 50.915 -21.782 -9.574 1.00 0.00 H new ATOM 0 HD2 HIS A -3 52.713 -22.907 -7.639 1.00 0.00 H new ATOM 0 HE1 HIS A -3 49.817 -25.375 -5.810 1.00 0.00 H new ATOM 0 HE2 HIS A -3 52.329 -24.896 -5.950 1.00 0.00 H new ATOM 54 N HIS A -2 50.688 -18.778 -9.657 1.00 0.00 N ATOM 55 CA HIS A -2 50.570 -17.756 -10.694 1.00 0.00 C ATOM 56 C HIS A -2 51.328 -18.180 -11.948 1.00 0.00 C ATOM 57 O HIS A -2 52.417 -18.747 -11.865 1.00 0.00 O ATOM 58 CB HIS A -2 51.135 -16.429 -10.184 1.00 0.00 C ATOM 59 CG HIS A -2 50.378 -15.865 -9.013 1.00 0.00 C ATOM 60 ND1 HIS A -2 49.135 -15.269 -9.155 1.00 0.00 N ATOM 61 CD2 HIS A -2 50.677 -15.795 -7.674 1.00 0.00 C ATOM 62 CE1 HIS A -2 48.734 -14.870 -7.935 1.00 0.00 C ATOM 63 NE2 HIS A -2 49.636 -15.166 -6.995 1.00 0.00 N ATOM 0 H HIS A -2 51.632 -18.900 -9.291 1.00 0.00 H new ATOM 0 HA HIS A -2 49.515 -17.633 -10.940 1.00 0.00 H new ATOM 0 HB2 HIS A -2 52.177 -16.573 -9.898 1.00 0.00 H new ATOM 0 HB3 HIS A -2 51.125 -15.703 -10.997 1.00 0.00 H new ATOM 0 HD2 HIS A -2 51.581 -16.170 -7.218 1.00 0.00 H new ATOM 0 HE1 HIS A -2 47.797 -14.371 -7.739 1.00 0.00 H new ATOM 0 HE2 HIS A -2 49.575 -14.973 -5.995 1.00 0.00 H new ATOM 71 N HIS A -1 50.743 -17.901 -13.110 1.00 0.00 N ATOM 72 CA HIS A -1 51.366 -18.254 -14.384 1.00 0.00 C ATOM 73 C HIS A -1 51.621 -17.003 -15.218 1.00 0.00 C ATOM 74 O HIS A -1 50.749 -16.146 -15.353 1.00 0.00 O ATOM 75 CB HIS A -1 50.454 -19.205 -15.160 1.00 0.00 C ATOM 76 CG HIS A -1 51.034 -19.652 -16.474 1.00 0.00 C ATOM 77 ND1 HIS A -1 50.745 -19.008 -17.667 1.00 0.00 N ATOM 78 CD2 HIS A -1 51.889 -20.678 -16.799 1.00 0.00 C ATOM 79 CE1 HIS A -1 51.413 -19.646 -18.644 1.00 0.00 C ATOM 80 NE2 HIS A -1 52.127 -20.670 -18.171 1.00 0.00 N ATOM 0 H HIS A -1 49.841 -17.433 -13.196 1.00 0.00 H new ATOM 0 HA HIS A -1 52.318 -18.744 -14.181 1.00 0.00 H new ATOM 0 HB2 HIS A -1 50.249 -20.081 -14.545 1.00 0.00 H new ATOM 0 HB3 HIS A -1 49.499 -18.712 -15.342 1.00 0.00 H new ATOM 0 HD2 HIS A -1 52.311 -21.382 -16.098 1.00 0.00 H new ATOM 0 HE1 HIS A -1 51.376 -19.364 -19.686 1.00 0.00 H new ATOM 0 HE2 HIS A -1 52.720 -21.309 -18.701 1.00 0.00 H new ATOM 88 N HIS A 0 52.826 -16.906 -15.775 1.00 0.00 N ATOM 89 CA HIS A 0 53.200 -15.755 -16.594 1.00 0.00 C ATOM 90 C HIS A 0 53.665 -16.209 -17.972 1.00 0.00 C ATOM 91 O HIS A 0 54.410 -17.180 -18.098 1.00 0.00 O ATOM 92 CB HIS A 0 54.322 -14.973 -15.908 1.00 0.00 C ATOM 93 CG HIS A 0 54.720 -13.725 -16.648 1.00 0.00 C ATOM 94 ND1 HIS A 0 53.864 -12.644 -16.788 1.00 0.00 N ATOM 95 CD2 HIS A 0 55.879 -13.370 -17.293 1.00 0.00 C ATOM 96 CE1 HIS A 0 54.512 -11.700 -17.492 1.00 0.00 C ATOM 97 NE2 HIS A 0 55.745 -12.090 -17.826 1.00 0.00 N ATOM 0 H HIS A 0 53.559 -17.609 -15.675 1.00 0.00 H new ATOM 0 HA HIS A 0 52.326 -15.114 -16.710 1.00 0.00 H new ATOM 0 HB2 HIS A 0 54.004 -14.703 -14.901 1.00 0.00 H new ATOM 0 HB3 HIS A 0 55.194 -15.619 -15.804 1.00 0.00 H new ATOM 0 HD2 HIS A 0 56.760 -13.989 -17.375 1.00 0.00 H new ATOM 0 HE1 HIS A 0 54.087 -10.743 -17.756 1.00 0.00 H new ATOM 0 HE2 HIS A 0 56.439 -11.564 -18.357 1.00 0.00 H new ATOM 105 N SER A 1 53.220 -15.498 -19.006 1.00 0.00 N ATOM 106 CA SER A 1 53.592 -15.829 -20.379 1.00 0.00 C ATOM 107 C SER A 1 54.402 -14.694 -20.999 1.00 0.00 C ATOM 108 O SER A 1 54.142 -13.520 -20.740 1.00 0.00 O ATOM 109 CB SER A 1 52.334 -16.072 -21.213 1.00 0.00 C ATOM 110 OG SER A 1 52.712 -16.504 -22.513 1.00 0.00 O ATOM 0 H SER A 1 52.603 -14.691 -18.919 1.00 0.00 H new ATOM 0 HA SER A 1 54.201 -16.733 -20.366 1.00 0.00 H new ATOM 0 HB2 SER A 1 51.706 -16.824 -20.735 1.00 0.00 H new ATOM 0 HB3 SER A 1 51.744 -15.158 -21.278 1.00 0.00 H new ATOM 0 HG SER A 1 51.909 -16.663 -23.051 1.00 0.00 H new ATOM 116 N SER A 2 55.383 -15.055 -21.821 1.00 0.00 N ATOM 117 CA SER A 2 56.226 -14.058 -22.469 1.00 0.00 C ATOM 118 C SER A 2 55.392 -13.153 -23.369 1.00 0.00 C ATOM 119 O SER A 2 54.325 -13.545 -23.842 1.00 0.00 O ATOM 120 CB SER A 2 57.307 -14.751 -23.301 1.00 0.00 C ATOM 121 OG SER A 2 58.067 -15.606 -22.458 1.00 0.00 O ATOM 0 H SER A 2 55.612 -16.022 -22.052 1.00 0.00 H new ATOM 0 HA SER A 2 56.695 -13.449 -21.696 1.00 0.00 H new ATOM 0 HB2 SER A 2 56.850 -15.326 -24.106 1.00 0.00 H new ATOM 0 HB3 SER A 2 57.956 -14.009 -23.767 1.00 0.00 H new ATOM 0 HG SER A 2 58.760 -16.054 -22.986 1.00 0.00 H new ATOM 127 N GLY A 3 55.886 -11.941 -23.602 1.00 0.00 N ATOM 128 CA GLY A 3 55.176 -10.986 -24.445 1.00 0.00 C ATOM 129 C GLY A 3 56.042 -9.764 -24.731 1.00 0.00 C ATOM 130 O GLY A 3 57.214 -9.722 -24.359 1.00 0.00 O ATOM 0 H GLY A 3 56.769 -11.599 -23.222 1.00 0.00 H new ATOM 0 HA2 GLY A 3 54.892 -11.463 -25.383 1.00 0.00 H new ATOM 0 HA3 GLY A 3 54.254 -10.676 -23.953 1.00 0.00 H new ATOM 134 N LEU A 4 55.455 -8.773 -25.395 1.00 0.00 N ATOM 135 CA LEU A 4 56.184 -7.554 -25.729 1.00 0.00 C ATOM 136 C LEU A 4 55.868 -6.451 -24.725 1.00 0.00 C ATOM 137 O LEU A 4 54.704 -6.173 -24.439 1.00 0.00 O ATOM 138 CB LEU A 4 55.808 -7.091 -27.137 1.00 0.00 C ATOM 139 CG LEU A 4 56.685 -5.904 -27.542 1.00 0.00 C ATOM 140 CD1 LEU A 4 58.113 -6.388 -27.795 1.00 0.00 C ATOM 141 CD2 LEU A 4 56.128 -5.274 -28.820 1.00 0.00 C ATOM 0 H LEU A 4 54.485 -8.789 -25.710 1.00 0.00 H new ATOM 0 HA LEU A 4 57.252 -7.768 -25.692 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.937 -7.909 -27.846 1.00 0.00 H new ATOM 0 HB3 LEU A 4 54.756 -6.806 -27.168 1.00 0.00 H new ATOM 0 HG LEU A 4 56.688 -5.164 -26.741 1.00 0.00 H new ATOM 0 HD11 LEU A 4 58.738 -5.543 -28.084 1.00 0.00 H new ATOM 0 HD12 LEU A 4 58.511 -6.840 -26.886 1.00 0.00 H new ATOM 0 HD13 LEU A 4 58.110 -7.127 -28.596 1.00 0.00 H new ATOM 0 HD21 LEU A 4 56.751 -4.428 -29.110 1.00 0.00 H new ATOM 0 HD22 LEU A 4 56.126 -6.015 -29.620 1.00 0.00 H new ATOM 0 HD23 LEU A 4 55.109 -4.930 -28.642 1.00 0.00 H new ATOM 153 N VAL A 5 56.913 -5.825 -24.193 1.00 0.00 N ATOM 154 CA VAL A 5 56.737 -4.749 -23.224 1.00 0.00 C ATOM 155 C VAL A 5 56.085 -3.543 -23.911 1.00 0.00 C ATOM 156 O VAL A 5 56.402 -3.269 -25.072 1.00 0.00 O ATOM 157 CB VAL A 5 58.102 -4.351 -22.648 1.00 0.00 C ATOM 158 CG1 VAL A 5 57.936 -3.247 -21.600 1.00 0.00 C ATOM 159 CG2 VAL A 5 58.757 -5.568 -21.989 1.00 0.00 C ATOM 0 H VAL A 5 57.885 -6.042 -24.415 1.00 0.00 H new ATOM 0 HA VAL A 5 56.093 -5.088 -22.413 1.00 0.00 H new ATOM 0 HB VAL A 5 58.729 -3.985 -23.461 1.00 0.00 H new ATOM 0 HG11 VAL A 5 58.913 -2.975 -21.200 1.00 0.00 H new ATOM 0 HG12 VAL A 5 57.477 -2.373 -22.062 1.00 0.00 H new ATOM 0 HG13 VAL A 5 57.300 -3.606 -20.791 1.00 0.00 H new ATOM 0 HG21 VAL A 5 59.727 -5.283 -21.581 1.00 0.00 H new ATOM 0 HG22 VAL A 5 58.118 -5.934 -21.185 1.00 0.00 H new ATOM 0 HG23 VAL A 5 58.893 -6.354 -22.731 1.00 0.00 H new ATOM 169 N PRO A 6 55.200 -2.819 -23.257 1.00 0.00 N ATOM 170 CA PRO A 6 54.546 -1.635 -23.879 1.00 0.00 C ATOM 171 C PRO A 6 55.352 -0.356 -23.672 1.00 0.00 C ATOM 172 O PRO A 6 55.756 -0.040 -22.553 1.00 0.00 O ATOM 173 CB PRO A 6 53.200 -1.558 -23.161 1.00 0.00 C ATOM 174 CG PRO A 6 53.435 -2.139 -21.804 1.00 0.00 C ATOM 175 CD PRO A 6 54.696 -3.008 -21.883 1.00 0.00 C ATOM 0 HA PRO A 6 54.455 -1.734 -24.961 1.00 0.00 H new ATOM 0 HB2 PRO A 6 52.851 -0.528 -23.091 1.00 0.00 H new ATOM 0 HB3 PRO A 6 52.436 -2.118 -23.700 1.00 0.00 H new ATOM 0 HG2 PRO A 6 53.561 -1.347 -21.065 1.00 0.00 H new ATOM 0 HG3 PRO A 6 52.578 -2.735 -21.489 1.00 0.00 H new ATOM 0 HD2 PRO A 6 55.436 -2.699 -21.145 1.00 0.00 H new ATOM 0 HD3 PRO A 6 54.467 -4.055 -21.686 1.00 0.00 H new ATOM 183 N ARG A 7 55.583 0.375 -24.757 1.00 0.00 N ATOM 184 CA ARG A 7 56.352 1.611 -24.684 1.00 0.00 C ATOM 185 C ARG A 7 55.670 2.615 -23.761 1.00 0.00 C ATOM 186 O ARG A 7 54.442 2.689 -23.707 1.00 0.00 O ATOM 187 CB ARG A 7 56.501 2.217 -26.081 1.00 0.00 C ATOM 188 CG ARG A 7 57.297 1.261 -26.972 1.00 0.00 C ATOM 189 CD ARG A 7 57.470 1.879 -28.359 1.00 0.00 C ATOM 190 NE ARG A 7 58.372 3.034 -28.291 1.00 0.00 N ATOM 191 CZ ARG A 7 58.356 4.038 -29.181 1.00 0.00 C ATOM 192 NH1 ARG A 7 57.522 4.065 -30.193 1.00 0.00 N ATOM 193 NH2 ARG A 7 59.200 5.023 -29.034 1.00 0.00 N ATOM 0 H ARG A 7 55.251 0.135 -25.691 1.00 0.00 H new ATOM 0 HA ARG A 7 57.338 1.379 -24.282 1.00 0.00 H new ATOM 0 HB2 ARG A 7 55.518 2.402 -26.515 1.00 0.00 H new ATOM 0 HB3 ARG A 7 57.008 3.180 -26.019 1.00 0.00 H new ATOM 0 HG2 ARG A 7 58.272 1.060 -26.528 1.00 0.00 H new ATOM 0 HG3 ARG A 7 56.780 0.305 -27.051 1.00 0.00 H new ATOM 0 HD2 ARG A 7 57.870 1.136 -29.049 1.00 0.00 H new ATOM 0 HD3 ARG A 7 56.501 2.188 -28.751 1.00 0.00 H new ATOM 0 HE ARG A 7 59.047 3.076 -27.527 1.00 0.00 H new ATOM 0 HH11 ARG A 7 56.855 3.305 -30.324 1.00 0.00 H new ATOM 0 HH12 ARG A 7 57.541 4.846 -30.849 1.00 0.00 H new ATOM 0 HH21 ARG A 7 59.856 5.020 -28.253 1.00 0.00 H new ATOM 0 HH22 ARG A 7 59.203 5.795 -29.700 1.00 0.00 H new ATOM 207 N GLY A 8 56.475 3.387 -23.038 1.00 0.00 N ATOM 208 CA GLY A 8 55.939 4.389 -22.125 1.00 0.00 C ATOM 209 C GLY A 8 55.690 5.709 -22.846 1.00 0.00 C ATOM 210 O GLY A 8 55.857 5.803 -24.062 1.00 0.00 O ATOM 0 H GLY A 8 57.493 3.339 -23.066 1.00 0.00 H new ATOM 0 HA2 GLY A 8 55.008 4.028 -21.689 1.00 0.00 H new ATOM 0 HA3 GLY A 8 56.636 4.546 -21.302 1.00 0.00 H new ATOM 214 N SER A 9 55.292 6.726 -22.089 1.00 0.00 N ATOM 215 CA SER A 9 55.034 8.041 -22.665 1.00 0.00 C ATOM 216 C SER A 9 56.308 8.611 -23.282 1.00 0.00 C ATOM 217 O SER A 9 57.415 8.222 -22.913 1.00 0.00 O ATOM 218 CB SER A 9 54.516 8.991 -21.586 1.00 0.00 C ATOM 219 OG SER A 9 53.341 8.442 -21.004 1.00 0.00 O ATOM 0 H SER A 9 55.142 6.666 -21.082 1.00 0.00 H new ATOM 0 HA SER A 9 54.280 7.936 -23.445 1.00 0.00 H new ATOM 0 HB2 SER A 9 55.278 9.142 -20.822 1.00 0.00 H new ATOM 0 HB3 SER A 9 54.300 9.968 -22.018 1.00 0.00 H new ATOM 0 HG SER A 9 53.006 9.047 -20.310 1.00 0.00 H new ATOM 225 N GLY A 10 56.142 9.536 -24.222 1.00 0.00 N ATOM 226 CA GLY A 10 57.287 10.148 -24.887 1.00 0.00 C ATOM 227 C GLY A 10 58.229 10.787 -23.874 1.00 0.00 C ATOM 228 O GLY A 10 57.789 11.339 -22.865 1.00 0.00 O ATOM 0 H GLY A 10 55.234 9.876 -24.538 1.00 0.00 H new ATOM 0 HA2 GLY A 10 57.824 9.394 -25.463 1.00 0.00 H new ATOM 0 HA3 GLY A 10 56.941 10.902 -25.594 1.00 0.00 H new ATOM 232 N MET A 11 59.528 10.710 -24.149 1.00 0.00 N ATOM 233 CA MET A 11 60.535 11.274 -23.254 1.00 0.00 C ATOM 234 C MET A 11 61.482 12.189 -24.022 1.00 0.00 C ATOM 235 O MET A 11 61.570 12.119 -25.249 1.00 0.00 O ATOM 236 CB MET A 11 61.335 10.148 -22.596 1.00 0.00 C ATOM 237 CG MET A 11 60.406 9.312 -21.713 1.00 0.00 C ATOM 238 SD MET A 11 61.379 8.118 -20.759 1.00 0.00 S ATOM 239 CE MET A 11 62.096 7.222 -22.158 1.00 0.00 C ATOM 0 H MET A 11 59.908 10.263 -24.983 1.00 0.00 H new ATOM 0 HA MET A 11 60.027 11.858 -22.486 1.00 0.00 H new ATOM 0 HB2 MET A 11 61.793 9.519 -23.359 1.00 0.00 H new ATOM 0 HB3 MET A 11 62.145 10.565 -21.998 1.00 0.00 H new ATOM 0 HG2 MET A 11 59.848 9.962 -21.039 1.00 0.00 H new ATOM 0 HG3 MET A 11 59.675 8.789 -22.330 1.00 0.00 H new ATOM 0 HE1 MET A 11 62.177 6.164 -21.909 1.00 0.00 H new ATOM 0 HE2 MET A 11 61.456 7.341 -23.033 1.00 0.00 H new ATOM 0 HE3 MET A 11 63.087 7.621 -22.376 1.00 0.00 H new ATOM 249 N LYS A 12 62.190 13.046 -23.293 1.00 0.00 N ATOM 250 CA LYS A 12 63.132 13.968 -23.915 1.00 0.00 C ATOM 251 C LYS A 12 64.507 13.320 -24.043 1.00 0.00 C ATOM 252 O LYS A 12 64.891 12.488 -23.221 1.00 0.00 O ATOM 253 CB LYS A 12 63.243 15.245 -23.080 1.00 0.00 C ATOM 254 CG LYS A 12 61.867 15.905 -22.970 1.00 0.00 C ATOM 255 CD LYS A 12 62.008 17.303 -22.361 1.00 0.00 C ATOM 256 CE LYS A 12 62.516 17.193 -20.922 1.00 0.00 C ATOM 257 NZ LYS A 12 62.090 18.395 -20.151 1.00 0.00 N ATOM 0 H LYS A 12 62.130 13.121 -22.278 1.00 0.00 H new ATOM 0 HA LYS A 12 62.765 14.217 -24.911 1.00 0.00 H new ATOM 0 HB2 LYS A 12 63.626 15.010 -22.087 1.00 0.00 H new ATOM 0 HB3 LYS A 12 63.952 15.933 -23.541 1.00 0.00 H new ATOM 0 HG2 LYS A 12 61.406 15.973 -23.956 1.00 0.00 H new ATOM 0 HG3 LYS A 12 61.209 15.294 -22.352 1.00 0.00 H new ATOM 0 HD2 LYS A 12 62.699 17.901 -22.956 1.00 0.00 H new ATOM 0 HD3 LYS A 12 61.046 17.816 -22.379 1.00 0.00 H new ATOM 0 HE2 LYS A 12 62.123 16.290 -20.455 1.00 0.00 H new ATOM 0 HE3 LYS A 12 63.603 17.109 -20.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 62.435 18.320 -19.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 62.485 19.249 -20.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 61.052 18.455 -20.148 1.00 0.00 H new ATOM 271 N GLU A 13 65.244 13.708 -25.079 1.00 0.00 N ATOM 272 CA GLU A 13 66.573 13.151 -25.310 1.00 0.00 C ATOM 273 C GLU A 13 67.469 13.377 -24.096 1.00 0.00 C ATOM 274 O GLU A 13 67.397 14.420 -23.445 1.00 0.00 O ATOM 275 CB GLU A 13 67.205 13.802 -26.541 1.00 0.00 C ATOM 276 CG GLU A 13 66.359 13.486 -27.780 1.00 0.00 C ATOM 277 CD GLU A 13 66.993 14.043 -29.059 1.00 0.00 C ATOM 278 OE1 GLU A 13 67.940 14.811 -28.971 1.00 0.00 O ATOM 279 OE2 GLU A 13 66.513 13.687 -30.123 1.00 0.00 O ATOM 0 H GLU A 13 64.947 14.400 -25.767 1.00 0.00 H new ATOM 0 HA GLU A 13 66.472 12.079 -25.477 1.00 0.00 H new ATOM 0 HB2 GLU A 13 67.273 14.881 -26.400 1.00 0.00 H new ATOM 0 HB3 GLU A 13 68.222 13.434 -26.678 1.00 0.00 H new ATOM 0 HG2 GLU A 13 66.240 12.407 -27.873 1.00 0.00 H new ATOM 0 HG3 GLU A 13 65.361 13.907 -27.656 1.00 0.00 H new ATOM 286 N THR A 14 68.313 12.393 -23.798 1.00 0.00 N ATOM 287 CA THR A 14 69.225 12.484 -22.660 1.00 0.00 C ATOM 288 C THR A 14 70.665 12.279 -23.116 1.00 0.00 C ATOM 289 O THR A 14 70.914 11.773 -24.210 1.00 0.00 O ATOM 290 CB THR A 14 68.868 11.427 -21.611 1.00 0.00 C ATOM 291 OG1 THR A 14 69.050 10.133 -22.166 1.00 0.00 O ATOM 292 CG2 THR A 14 67.412 11.599 -21.173 1.00 0.00 C ATOM 0 H THR A 14 68.385 11.524 -24.328 1.00 0.00 H new ATOM 0 HA THR A 14 69.127 13.477 -22.220 1.00 0.00 H new ATOM 0 HB THR A 14 69.517 11.547 -20.743 1.00 0.00 H new ATOM 0 HG1 THR A 14 68.824 9.455 -21.496 1.00 0.00 H new ATOM 0 HG21 THR A 14 67.165 10.844 -20.427 1.00 0.00 H new ATOM 0 HG22 THR A 14 67.276 12.592 -20.744 1.00 0.00 H new ATOM 0 HG23 THR A 14 66.756 11.484 -22.036 1.00 0.00 H new ATOM 300 N ALA A 15 71.612 12.673 -22.270 1.00 0.00 N ATOM 301 CA ALA A 15 73.025 12.524 -22.597 1.00 0.00 C ATOM 302 C ALA A 15 73.379 11.052 -22.782 1.00 0.00 C ATOM 303 O ALA A 15 72.836 10.183 -22.099 1.00 0.00 O ATOM 304 CB ALA A 15 73.885 13.122 -21.483 1.00 0.00 C ATOM 0 H ALA A 15 71.428 13.095 -21.360 1.00 0.00 H new ATOM 0 HA ALA A 15 73.221 13.053 -23.530 1.00 0.00 H new ATOM 0 HB1 ALA A 15 74.939 13.006 -21.735 1.00 0.00 H new ATOM 0 HB2 ALA A 15 73.652 14.181 -21.372 1.00 0.00 H new ATOM 0 HB3 ALA A 15 73.677 12.605 -20.546 1.00 0.00 H new ATOM 310 N ALA A 16 74.292 10.779 -23.708 1.00 0.00 N ATOM 311 CA ALA A 16 74.707 9.407 -23.976 1.00 0.00 C ATOM 312 C ALA A 16 75.371 8.797 -22.745 1.00 0.00 C ATOM 313 O ALA A 16 76.067 9.486 -21.998 1.00 0.00 O ATOM 314 CB ALA A 16 75.685 9.378 -25.152 1.00 0.00 C ATOM 0 H ALA A 16 74.756 11.484 -24.282 1.00 0.00 H new ATOM 0 HA ALA A 16 73.822 8.822 -24.225 1.00 0.00 H new ATOM 0 HB1 ALA A 16 75.990 8.350 -25.346 1.00 0.00 H new ATOM 0 HB2 ALA A 16 75.200 9.786 -26.039 1.00 0.00 H new ATOM 0 HB3 ALA A 16 76.563 9.978 -24.910 1.00 0.00 H new ATOM 320 N ALA A 17 75.152 7.503 -22.541 1.00 0.00 N ATOM 321 CA ALA A 17 75.736 6.810 -21.399 1.00 0.00 C ATOM 322 C ALA A 17 76.091 5.374 -21.768 1.00 0.00 C ATOM 323 O ALA A 17 75.494 4.789 -22.672 1.00 0.00 O ATOM 324 CB ALA A 17 74.750 6.810 -20.228 1.00 0.00 C ATOM 0 H ALA A 17 74.578 6.916 -23.147 1.00 0.00 H new ATOM 0 HA ALA A 17 76.646 7.333 -21.107 1.00 0.00 H new ATOM 0 HB1 ALA A 17 75.194 6.290 -19.379 1.00 0.00 H new ATOM 0 HB2 ALA A 17 74.521 7.837 -19.945 1.00 0.00 H new ATOM 0 HB3 ALA A 17 73.832 6.302 -20.525 1.00 0.00 H new ATOM 330 N LYS A 18 77.066 4.810 -21.061 1.00 0.00 N ATOM 331 CA LYS A 18 77.489 3.439 -21.321 1.00 0.00 C ATOM 332 C LYS A 18 76.497 2.448 -20.722 1.00 0.00 C ATOM 333 O LYS A 18 76.070 2.598 -19.578 1.00 0.00 O ATOM 334 CB LYS A 18 78.876 3.199 -20.722 1.00 0.00 C ATOM 335 CG LYS A 18 79.385 1.819 -21.142 1.00 0.00 C ATOM 336 CD LYS A 18 80.733 1.545 -20.476 1.00 0.00 C ATOM 337 CE LYS A 18 81.315 0.237 -21.015 1.00 0.00 C ATOM 338 NZ LYS A 18 80.556 -0.915 -20.449 1.00 0.00 N ATOM 0 H LYS A 18 77.574 5.277 -20.310 1.00 0.00 H new ATOM 0 HA LYS A 18 77.527 3.289 -22.400 1.00 0.00 H new ATOM 0 HB2 LYS A 18 79.567 3.971 -21.060 1.00 0.00 H new ATOM 0 HB3 LYS A 18 78.830 3.265 -19.635 1.00 0.00 H new ATOM 0 HG2 LYS A 18 78.665 1.052 -20.857 1.00 0.00 H new ATOM 0 HG3 LYS A 18 79.488 1.773 -22.226 1.00 0.00 H new ATOM 0 HD2 LYS A 18 81.420 2.368 -20.671 1.00 0.00 H new ATOM 0 HD3 LYS A 18 80.610 1.482 -19.395 1.00 0.00 H new ATOM 0 HE2 LYS A 18 81.260 0.223 -22.104 1.00 0.00 H new ATOM 0 HE3 LYS A 18 82.369 0.158 -20.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 81.032 -1.804 -20.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 80.516 -0.829 -19.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 79.590 -0.917 -20.834 1.00 0.00 H new ATOM 352 N PHE A 19 76.132 1.436 -21.504 1.00 0.00 N ATOM 353 CA PHE A 19 75.192 0.419 -21.044 1.00 0.00 C ATOM 354 C PHE A 19 75.925 -0.883 -20.734 1.00 0.00 C ATOM 355 O PHE A 19 76.748 -1.345 -21.522 1.00 0.00 O ATOM 356 CB PHE A 19 74.133 0.166 -22.117 1.00 0.00 C ATOM 357 CG PHE A 19 73.285 1.377 -22.422 1.00 0.00 C ATOM 358 CD1 PHE A 19 72.162 1.662 -21.636 1.00 0.00 C ATOM 359 CD2 PHE A 19 73.623 2.216 -23.491 1.00 0.00 C ATOM 360 CE1 PHE A 19 71.376 2.786 -21.920 1.00 0.00 C ATOM 361 CE2 PHE A 19 72.837 3.341 -23.775 1.00 0.00 C ATOM 362 CZ PHE A 19 71.714 3.625 -22.989 1.00 0.00 C ATOM 0 H PHE A 19 76.472 1.299 -22.456 1.00 0.00 H new ATOM 0 HA PHE A 19 74.710 0.778 -20.135 1.00 0.00 H new ATOM 0 HB2 PHE A 19 74.625 -0.163 -23.032 1.00 0.00 H new ATOM 0 HB3 PHE A 19 73.486 -0.649 -21.793 1.00 0.00 H new ATOM 0 HD1 PHE A 19 71.902 1.015 -20.811 1.00 0.00 H new ATOM 0 HD2 PHE A 19 74.490 1.996 -24.097 1.00 0.00 H new ATOM 0 HE1 PHE A 19 70.509 3.006 -21.314 1.00 0.00 H new ATOM 0 HE2 PHE A 19 73.097 3.988 -24.599 1.00 0.00 H new ATOM 0 HZ PHE A 19 71.108 4.492 -23.207 1.00 0.00 H new ATOM 372 N GLU A 20 75.618 -1.468 -19.579 1.00 0.00 N ATOM 373 CA GLU A 20 76.254 -2.717 -19.169 1.00 0.00 C ATOM 374 C GLU A 20 75.292 -3.889 -19.334 1.00 0.00 C ATOM 375 O GLU A 20 74.102 -3.774 -19.038 1.00 0.00 O ATOM 376 CB GLU A 20 76.693 -2.620 -17.706 1.00 0.00 C ATOM 377 CG GLU A 20 77.522 -3.857 -17.337 1.00 0.00 C ATOM 378 CD GLU A 20 77.916 -3.862 -15.855 1.00 0.00 C ATOM 379 OE1 GLU A 20 77.533 -2.954 -15.130 1.00 0.00 O ATOM 380 OE2 GLU A 20 78.604 -4.789 -15.462 1.00 0.00 O ATOM 0 H GLU A 20 74.937 -1.100 -18.914 1.00 0.00 H new ATOM 0 HA GLU A 20 77.125 -2.885 -19.803 1.00 0.00 H new ATOM 0 HB2 GLU A 20 77.281 -1.716 -17.551 1.00 0.00 H new ATOM 0 HB3 GLU A 20 75.820 -2.548 -17.057 1.00 0.00 H new ATOM 0 HG2 GLU A 20 76.951 -4.757 -17.563 1.00 0.00 H new ATOM 0 HG3 GLU A 20 78.422 -3.887 -17.952 1.00 0.00 H new ATOM 387 N ARG A 21 75.814 -5.015 -19.810 1.00 0.00 N ATOM 388 CA ARG A 21 74.995 -6.205 -19.999 1.00 0.00 C ATOM 389 C ARG A 21 74.432 -6.687 -18.666 1.00 0.00 C ATOM 390 O ARG A 21 75.055 -6.508 -17.619 1.00 0.00 O ATOM 391 CB ARG A 21 75.832 -7.319 -20.634 1.00 0.00 C ATOM 392 CG ARG A 21 76.269 -6.894 -22.038 1.00 0.00 C ATOM 393 CD ARG A 21 76.996 -8.053 -22.725 1.00 0.00 C ATOM 394 NE ARG A 21 78.143 -8.487 -21.919 1.00 0.00 N ATOM 395 CZ ARG A 21 79.365 -7.943 -22.018 1.00 0.00 C ATOM 396 NH1 ARG A 21 79.631 -6.967 -22.854 1.00 0.00 N ATOM 397 NH2 ARG A 21 80.321 -8.399 -21.256 1.00 0.00 N ATOM 0 H ARG A 21 76.794 -5.127 -20.070 1.00 0.00 H new ATOM 0 HA ARG A 21 74.166 -5.951 -20.659 1.00 0.00 H new ATOM 0 HB2 ARG A 21 76.706 -7.528 -20.017 1.00 0.00 H new ATOM 0 HB3 ARG A 21 75.251 -8.240 -20.686 1.00 0.00 H new ATOM 0 HG2 ARG A 21 75.400 -6.598 -22.626 1.00 0.00 H new ATOM 0 HG3 ARG A 21 76.925 -6.025 -21.978 1.00 0.00 H new ATOM 0 HD2 ARG A 21 76.309 -8.887 -22.870 1.00 0.00 H new ATOM 0 HD3 ARG A 21 77.335 -7.743 -23.714 1.00 0.00 H new ATOM 0 HE ARG A 21 78.004 -9.242 -21.248 1.00 0.00 H new ATOM 0 HH11 ARG A 21 78.896 -6.597 -23.457 1.00 0.00 H new ATOM 0 HH12 ARG A 21 80.573 -6.578 -22.901 1.00 0.00 H new ATOM 0 HH21 ARG A 21 80.132 -9.156 -20.599 1.00 0.00 H new ATOM 0 HH22 ARG A 21 81.257 -7.998 -21.317 1.00 0.00 H new ATOM 411 N GLN A 22 73.252 -7.295 -18.711 1.00 0.00 N ATOM 412 CA GLN A 22 72.615 -7.797 -17.498 1.00 0.00 C ATOM 413 C GLN A 22 72.864 -9.293 -17.342 1.00 0.00 C ATOM 414 O GLN A 22 72.932 -10.028 -18.327 1.00 0.00 O ATOM 415 CB GLN A 22 71.107 -7.531 -17.550 1.00 0.00 C ATOM 416 CG GLN A 22 70.833 -6.035 -17.748 1.00 0.00 C ATOM 417 CD GLN A 22 71.443 -5.216 -16.612 1.00 0.00 C ATOM 418 OE1 GLN A 22 71.248 -5.537 -15.440 1.00 0.00 O ATOM 419 NE2 GLN A 22 72.173 -4.171 -16.893 1.00 0.00 N ATOM 0 H GLN A 22 72.720 -7.452 -19.567 1.00 0.00 H new ATOM 0 HA GLN A 22 73.046 -7.277 -16.642 1.00 0.00 H new ATOM 0 HB2 GLN A 22 70.659 -8.100 -18.365 1.00 0.00 H new ATOM 0 HB3 GLN A 22 70.639 -7.874 -16.627 1.00 0.00 H new ATOM 0 HG2 GLN A 22 71.248 -5.708 -18.701 1.00 0.00 H new ATOM 0 HG3 GLN A 22 69.758 -5.860 -17.791 1.00 0.00 H new ATOM 0 HE21 GLN A 22 72.333 -3.907 -17.865 1.00 0.00 H new ATOM 0 HE22 GLN A 22 72.583 -3.618 -16.140 1.00 0.00 H new ATOM 428 N HIS A 23 72.999 -9.737 -16.095 1.00 0.00 N ATOM 429 CA HIS A 23 73.252 -11.146 -15.809 1.00 0.00 C ATOM 430 C HIS A 23 72.296 -11.653 -14.735 1.00 0.00 C ATOM 431 O HIS A 23 71.556 -10.876 -14.131 1.00 0.00 O ATOM 432 CB HIS A 23 74.695 -11.329 -15.334 1.00 0.00 C ATOM 433 CG HIS A 23 75.716 -10.827 -16.318 1.00 0.00 C ATOM 434 ND1 HIS A 23 75.957 -11.465 -17.524 1.00 0.00 N ATOM 435 CD2 HIS A 23 76.568 -9.749 -16.289 1.00 0.00 C ATOM 436 CE1 HIS A 23 76.916 -10.775 -18.165 1.00 0.00 C ATOM 437 NE2 HIS A 23 77.325 -9.719 -17.458 1.00 0.00 N ATOM 0 H HIS A 23 72.938 -9.143 -15.268 1.00 0.00 H new ATOM 0 HA HIS A 23 73.093 -11.718 -16.723 1.00 0.00 H new ATOM 0 HB2 HIS A 23 74.827 -10.806 -14.387 1.00 0.00 H new ATOM 0 HB3 HIS A 23 74.875 -12.387 -15.142 1.00 0.00 H new ATOM 0 HD2 HIS A 23 76.640 -9.034 -15.483 1.00 0.00 H new ATOM 0 HE1 HIS A 23 77.308 -11.043 -19.135 1.00 0.00 H new ATOM 0 HE2 HIS A 23 78.038 -9.037 -17.718 1.00 0.00 H new ATOM 445 N MET A 24 72.315 -12.962 -14.503 1.00 0.00 N ATOM 446 CA MET A 24 71.446 -13.561 -13.496 1.00 0.00 C ATOM 447 C MET A 24 72.095 -13.480 -12.118 1.00 0.00 C ATOM 448 O MET A 24 73.315 -13.573 -11.988 1.00 0.00 O ATOM 449 CB MET A 24 71.171 -15.024 -13.847 1.00 0.00 C ATOM 450 CG MET A 24 70.423 -15.098 -15.180 1.00 0.00 C ATOM 451 SD MET A 24 69.898 -16.804 -15.483 1.00 0.00 S ATOM 452 CE MET A 24 68.581 -16.859 -14.243 1.00 0.00 C ATOM 0 H MET A 24 72.917 -13.623 -14.994 1.00 0.00 H new ATOM 0 HA MET A 24 70.506 -13.010 -13.478 1.00 0.00 H new ATOM 0 HB2 MET A 24 72.109 -15.575 -13.913 1.00 0.00 H new ATOM 0 HB3 MET A 24 70.580 -15.493 -13.060 1.00 0.00 H new ATOM 0 HG2 MET A 24 69.556 -14.437 -15.160 1.00 0.00 H new ATOM 0 HG3 MET A 24 71.067 -14.755 -15.990 1.00 0.00 H new ATOM 0 HE1 MET A 24 67.706 -17.355 -14.663 1.00 0.00 H new ATOM 0 HE2 MET A 24 68.927 -17.412 -13.370 1.00 0.00 H new ATOM 0 HE3 MET A 24 68.316 -15.844 -13.948 1.00 0.00 H new ATOM 462 N ASP A 25 71.269 -13.305 -11.090 1.00 0.00 N ATOM 463 CA ASP A 25 71.776 -13.188 -9.728 1.00 0.00 C ATOM 464 C ASP A 25 72.441 -14.488 -9.288 1.00 0.00 C ATOM 465 O ASP A 25 71.962 -15.579 -9.598 1.00 0.00 O ATOM 466 CB ASP A 25 70.629 -12.851 -8.772 1.00 0.00 C ATOM 467 CG ASP A 25 70.029 -11.489 -9.114 1.00 0.00 C ATOM 468 OD1 ASP A 25 70.757 -10.638 -9.600 1.00 0.00 O ATOM 469 OD2 ASP A 25 68.842 -11.316 -8.883 1.00 0.00 O ATOM 0 H ASP A 25 70.254 -13.242 -11.174 1.00 0.00 H new ATOM 0 HA ASP A 25 72.517 -12.389 -9.704 1.00 0.00 H new ATOM 0 HB2 ASP A 25 69.859 -13.620 -8.834 1.00 0.00 H new ATOM 0 HB3 ASP A 25 70.994 -12.847 -7.745 1.00 0.00 H new ATOM 474 N SER A 26 73.548 -14.362 -8.562 1.00 0.00 N ATOM 475 CA SER A 26 74.275 -15.528 -8.071 1.00 0.00 C ATOM 476 C SER A 26 74.612 -15.361 -6.587 1.00 0.00 C ATOM 477 O SER A 26 74.562 -14.242 -6.073 1.00 0.00 O ATOM 478 CB SER A 26 75.564 -15.713 -8.871 1.00 0.00 C ATOM 479 OG SER A 26 75.316 -15.402 -10.236 1.00 0.00 O ATOM 0 H SER A 26 73.960 -13.466 -8.301 1.00 0.00 H new ATOM 0 HA SER A 26 73.643 -16.408 -8.193 1.00 0.00 H new ATOM 0 HB2 SER A 26 76.348 -15.067 -8.475 1.00 0.00 H new ATOM 0 HB3 SER A 26 75.920 -16.739 -8.778 1.00 0.00 H new ATOM 0 HG SER A 26 76.141 -15.518 -10.753 1.00 0.00 H new ATOM 485 N PRO A 27 74.953 -16.424 -5.889 1.00 0.00 N ATOM 486 CA PRO A 27 75.290 -16.329 -4.439 1.00 0.00 C ATOM 487 C PRO A 27 76.738 -15.905 -4.210 1.00 0.00 C ATOM 488 O PRO A 27 77.668 -16.667 -4.474 1.00 0.00 O ATOM 489 CB PRO A 27 75.048 -17.747 -3.923 1.00 0.00 C ATOM 490 CG PRO A 27 75.328 -18.639 -5.085 1.00 0.00 C ATOM 491 CD PRO A 27 75.060 -17.825 -6.353 1.00 0.00 C ATOM 0 HA PRO A 27 74.693 -15.574 -3.927 1.00 0.00 H new ATOM 0 HB2 PRO A 27 75.703 -17.977 -3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 27 74.024 -17.869 -3.571 1.00 0.00 H new ATOM 0 HG2 PRO A 27 76.360 -18.988 -5.063 1.00 0.00 H new ATOM 0 HG3 PRO A 27 74.692 -19.523 -5.054 1.00 0.00 H new ATOM 0 HD2 PRO A 27 75.868 -17.941 -7.076 1.00 0.00 H new ATOM 0 HD3 PRO A 27 74.143 -18.150 -6.845 1.00 0.00 H new ATOM 499 N ASP A 28 76.920 -14.685 -3.716 1.00 0.00 N ATOM 500 CA ASP A 28 78.258 -14.174 -3.440 1.00 0.00 C ATOM 501 C ASP A 28 78.230 -13.183 -2.281 1.00 0.00 C ATOM 502 O ASP A 28 77.167 -12.704 -1.887 1.00 0.00 O ATOM 503 CB ASP A 28 78.831 -13.499 -4.691 1.00 0.00 C ATOM 504 CG ASP A 28 77.937 -12.353 -5.174 1.00 0.00 C ATOM 505 OD1 ASP A 28 77.113 -11.879 -4.407 1.00 0.00 O ATOM 506 OD2 ASP A 28 78.093 -11.963 -6.319 1.00 0.00 O ATOM 0 H ASP A 28 76.164 -14.035 -3.500 1.00 0.00 H new ATOM 0 HA ASP A 28 78.895 -15.013 -3.161 1.00 0.00 H new ATOM 0 HB2 ASP A 28 79.828 -13.116 -4.474 1.00 0.00 H new ATOM 0 HB3 ASP A 28 78.939 -14.237 -5.486 1.00 0.00 H new ATOM 511 N LEU A 29 79.405 -12.878 -1.738 1.00 0.00 N ATOM 512 CA LEU A 29 79.506 -11.933 -0.630 1.00 0.00 C ATOM 513 C LEU A 29 80.035 -10.589 -1.123 1.00 0.00 C ATOM 514 O LEU A 29 81.080 -10.521 -1.768 1.00 0.00 O ATOM 515 CB LEU A 29 80.445 -12.489 0.444 1.00 0.00 C ATOM 516 CG LEU A 29 80.430 -11.569 1.666 1.00 0.00 C ATOM 517 CD1 LEU A 29 79.086 -11.699 2.386 1.00 0.00 C ATOM 518 CD2 LEU A 29 81.557 -11.973 2.619 1.00 0.00 C ATOM 0 H LEU A 29 80.296 -13.269 -2.045 1.00 0.00 H new ATOM 0 HA LEU A 29 78.513 -11.788 -0.205 1.00 0.00 H new ATOM 0 HB2 LEU A 29 80.133 -13.494 0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 29 81.458 -12.569 0.049 1.00 0.00 H new ATOM 0 HG LEU A 29 80.573 -10.537 1.346 1.00 0.00 H new ATOM 0 HD11 LEU A 29 79.075 -11.044 3.257 1.00 0.00 H new ATOM 0 HD12 LEU A 29 78.281 -11.415 1.708 1.00 0.00 H new ATOM 0 HD13 LEU A 29 78.943 -12.731 2.707 1.00 0.00 H new ATOM 0 HD21 LEU A 29 81.548 -11.319 3.491 1.00 0.00 H new ATOM 0 HD22 LEU A 29 81.411 -13.005 2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 29 82.515 -11.884 2.108 1.00 0.00 H new ATOM 530 N GLY A 30 79.305 -9.522 -0.813 1.00 0.00 N ATOM 531 CA GLY A 30 79.715 -8.184 -1.220 1.00 0.00 C ATOM 532 C GLY A 30 80.619 -7.547 -0.169 1.00 0.00 C ATOM 533 O GLY A 30 80.936 -8.166 0.847 1.00 0.00 O ATOM 0 H GLY A 30 78.433 -9.558 -0.285 1.00 0.00 H new ATOM 0 HA2 GLY A 30 80.240 -8.235 -2.174 1.00 0.00 H new ATOM 0 HA3 GLY A 30 78.834 -7.561 -1.374 1.00 0.00 H new ATOM 537 N THR A 31 81.028 -6.306 -0.420 1.00 0.00 N ATOM 538 CA THR A 31 81.882 -5.579 0.518 1.00 0.00 C ATOM 539 C THR A 31 81.240 -4.249 0.897 1.00 0.00 C ATOM 540 O THR A 31 80.384 -3.734 0.177 1.00 0.00 O ATOM 541 CB THR A 31 83.255 -5.321 -0.110 1.00 0.00 C ATOM 542 OG1 THR A 31 83.104 -4.481 -1.245 1.00 0.00 O ATOM 543 CG2 THR A 31 83.894 -6.646 -0.531 1.00 0.00 C ATOM 0 H THR A 31 80.784 -5.784 -1.261 1.00 0.00 H new ATOM 0 HA THR A 31 82.004 -6.186 1.415 1.00 0.00 H new ATOM 0 HB THR A 31 83.899 -4.833 0.622 1.00 0.00 H new ATOM 0 HG1 THR A 31 83.982 -4.313 -1.647 1.00 0.00 H new ATOM 0 HG21 THR A 31 84.870 -6.454 -0.977 1.00 0.00 H new ATOM 0 HG22 THR A 31 84.014 -7.286 0.343 1.00 0.00 H new ATOM 0 HG23 THR A 31 83.254 -7.143 -1.260 1.00 0.00 H new ATOM 551 N ASP A 32 81.658 -3.696 2.031 1.00 0.00 N ATOM 552 CA ASP A 32 81.119 -2.422 2.492 1.00 0.00 C ATOM 553 C ASP A 32 81.705 -1.267 1.684 1.00 0.00 C ATOM 554 O ASP A 32 82.905 -1.235 1.411 1.00 0.00 O ATOM 555 CB ASP A 32 81.439 -2.225 3.975 1.00 0.00 C ATOM 556 CG ASP A 32 80.756 -3.299 4.819 1.00 0.00 C ATOM 557 OD1 ASP A 32 79.694 -3.757 4.426 1.00 0.00 O ATOM 558 OD2 ASP A 32 81.307 -3.650 5.849 1.00 0.00 O ATOM 0 H ASP A 32 82.363 -4.106 2.643 1.00 0.00 H new ATOM 0 HA ASP A 32 80.038 -2.435 2.353 1.00 0.00 H new ATOM 0 HB2 ASP A 32 82.517 -2.265 4.128 1.00 0.00 H new ATOM 0 HB3 ASP A 32 81.108 -1.237 4.296 1.00 0.00 H new ATOM 563 N ASP A 33 80.851 -0.323 1.304 1.00 0.00 N ATOM 564 CA ASP A 33 81.300 0.837 0.542 1.00 0.00 C ATOM 565 C ASP A 33 82.085 1.792 1.435 1.00 0.00 C ATOM 566 O ASP A 33 81.697 2.048 2.575 1.00 0.00 O ATOM 567 CB ASP A 33 80.096 1.568 -0.057 1.00 0.00 C ATOM 568 CG ASP A 33 79.363 0.670 -1.052 1.00 0.00 C ATOM 569 OD1 ASP A 33 80.011 -0.159 -1.673 1.00 0.00 O ATOM 570 OD2 ASP A 33 78.159 0.823 -1.179 1.00 0.00 O ATOM 0 H ASP A 33 79.852 -0.337 1.509 1.00 0.00 H new ATOM 0 HA ASP A 33 81.950 0.491 -0.262 1.00 0.00 H new ATOM 0 HB2 ASP A 33 79.415 1.871 0.738 1.00 0.00 H new ATOM 0 HB3 ASP A 33 80.428 2.478 -0.556 1.00 0.00 H new ATOM 575 N ASP A 34 83.189 2.316 0.912 1.00 0.00 N ATOM 576 CA ASP A 34 84.016 3.242 1.675 1.00 0.00 C ATOM 577 C ASP A 34 83.350 4.610 1.762 1.00 0.00 C ATOM 578 O ASP A 34 82.874 5.145 0.760 1.00 0.00 O ATOM 579 CB ASP A 34 85.390 3.381 1.016 1.00 0.00 C ATOM 580 CG ASP A 34 86.133 2.046 1.035 1.00 0.00 C ATOM 581 OD1 ASP A 34 85.916 1.275 1.957 1.00 0.00 O ATOM 582 OD2 ASP A 34 86.911 1.814 0.124 1.00 0.00 O ATOM 0 H ASP A 34 83.529 2.117 -0.029 1.00 0.00 H new ATOM 0 HA ASP A 34 84.136 2.845 2.683 1.00 0.00 H new ATOM 0 HB2 ASP A 34 85.273 3.724 -0.012 1.00 0.00 H new ATOM 0 HB3 ASP A 34 85.976 4.137 1.539 1.00 0.00 H new ATOM 587 N ASP A 35 83.319 5.173 2.966 1.00 0.00 N ATOM 588 CA ASP A 35 82.721 6.487 3.170 1.00 0.00 C ATOM 589 C ASP A 35 83.408 7.215 4.323 1.00 0.00 C ATOM 590 O ASP A 35 84.166 6.614 5.083 1.00 0.00 O ATOM 591 CB ASP A 35 81.223 6.345 3.459 1.00 0.00 C ATOM 592 CG ASP A 35 80.986 5.573 4.755 1.00 0.00 C ATOM 593 OD1 ASP A 35 81.819 4.752 5.104 1.00 0.00 O ATOM 594 OD2 ASP A 35 79.965 5.812 5.381 1.00 0.00 O ATOM 0 H ASP A 35 83.698 4.743 3.810 1.00 0.00 H new ATOM 0 HA ASP A 35 82.854 7.072 2.260 1.00 0.00 H new ATOM 0 HB2 ASP A 35 80.768 7.333 3.532 1.00 0.00 H new ATOM 0 HB3 ASP A 35 80.736 5.830 2.631 1.00 0.00 H new ATOM 599 N LYS A 36 83.136 8.511 4.448 1.00 0.00 N ATOM 600 CA LYS A 36 83.719 9.311 5.522 1.00 0.00 C ATOM 601 C LYS A 36 82.670 10.225 6.155 1.00 0.00 C ATOM 602 O LYS A 36 81.979 10.970 5.462 1.00 0.00 O ATOM 603 CB LYS A 36 84.909 10.117 4.981 1.00 0.00 C ATOM 604 CG LYS A 36 84.445 11.195 3.992 1.00 0.00 C ATOM 605 CD LYS A 36 85.665 11.883 3.376 1.00 0.00 C ATOM 606 CE LYS A 36 85.222 13.149 2.641 1.00 0.00 C ATOM 607 NZ LYS A 36 86.244 13.514 1.620 1.00 0.00 N ATOM 0 H LYS A 36 82.518 9.028 3.822 1.00 0.00 H new ATOM 0 HA LYS A 36 84.080 8.643 6.304 1.00 0.00 H new ATOM 0 HB2 LYS A 36 85.442 10.584 5.809 1.00 0.00 H new ATOM 0 HB3 LYS A 36 85.612 9.446 4.488 1.00 0.00 H new ATOM 0 HG2 LYS A 36 83.834 10.746 3.209 1.00 0.00 H new ATOM 0 HG3 LYS A 36 83.821 11.928 4.503 1.00 0.00 H new ATOM 0 HD2 LYS A 36 86.385 12.135 4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 36 86.167 11.206 2.685 1.00 0.00 H new ATOM 0 HE2 LYS A 36 84.257 12.985 2.162 1.00 0.00 H new ATOM 0 HE3 LYS A 36 85.092 13.967 3.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 85.943 14.375 1.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 87.156 13.687 2.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 86.347 12.736 0.938 1.00 0.00 H new ATOM 621 N THR A 37 82.551 10.151 7.478 1.00 0.00 N ATOM 622 CA THR A 37 81.604 10.992 8.209 1.00 0.00 C ATOM 623 C THR A 37 82.301 11.682 9.376 1.00 0.00 C ATOM 624 O THR A 37 83.366 11.251 9.818 1.00 0.00 O ATOM 625 CB THR A 37 80.445 10.143 8.739 1.00 0.00 C ATOM 626 OG1 THR A 37 80.941 9.197 9.674 1.00 0.00 O ATOM 627 CG2 THR A 37 79.762 9.413 7.580 1.00 0.00 C ATOM 0 H THR A 37 83.096 9.520 8.065 1.00 0.00 H new ATOM 0 HA THR A 37 81.216 11.748 7.526 1.00 0.00 H new ATOM 0 HB THR A 37 79.718 10.791 9.229 1.00 0.00 H new ATOM 0 HG1 THR A 37 80.200 8.654 10.015 1.00 0.00 H new ATOM 0 HG21 THR A 37 78.939 8.811 7.964 1.00 0.00 H new ATOM 0 HG22 THR A 37 79.377 10.142 6.867 1.00 0.00 H new ATOM 0 HG23 THR A 37 80.484 8.765 7.082 1.00 0.00 H new ATOM 635 N GLY A 38 81.696 12.756 9.873 1.00 0.00 N ATOM 636 CA GLY A 38 82.257 13.477 11.008 1.00 0.00 C ATOM 637 C GLY A 38 81.782 12.868 12.324 1.00 0.00 C ATOM 638 O GLY A 38 80.840 12.075 12.345 1.00 0.00 O ATOM 0 H GLY A 38 80.825 13.143 9.511 1.00 0.00 H new ATOM 0 HA2 GLY A 38 83.346 13.449 10.961 1.00 0.00 H new ATOM 0 HA3 GLY A 38 81.963 14.526 10.960 1.00 0.00 H new ATOM 642 N GLY A 39 82.437 13.241 13.418 1.00 0.00 N ATOM 643 CA GLY A 39 82.059 12.730 14.730 1.00 0.00 C ATOM 644 C GLY A 39 82.784 13.479 15.842 1.00 0.00 C ATOM 645 O GLY A 39 83.549 14.408 15.584 1.00 0.00 O ATOM 0 H GLY A 39 83.225 13.889 13.423 1.00 0.00 H new ATOM 0 HA2 GLY A 39 80.982 12.827 14.865 1.00 0.00 H new ATOM 0 HA3 GLY A 39 82.293 11.667 14.791 1.00 0.00 H new ATOM 649 N GLY A 40 82.537 13.066 17.081 1.00 0.00 N ATOM 650 CA GLY A 40 83.190 13.683 18.230 1.00 0.00 C ATOM 651 C GLY A 40 84.526 13.007 18.519 1.00 0.00 C ATOM 652 O GLY A 40 84.989 12.170 17.744 1.00 0.00 O ATOM 0 H GLY A 40 81.893 12.311 17.315 1.00 0.00 H new ATOM 0 HA2 GLY A 40 83.348 14.744 18.038 1.00 0.00 H new ATOM 0 HA3 GLY A 40 82.543 13.610 19.104 1.00 0.00 H new ATOM 656 N ARG A 41 85.142 13.374 19.639 1.00 0.00 N ATOM 657 CA ARG A 41 86.419 12.784 20.024 1.00 0.00 C ATOM 658 C ARG A 41 86.292 11.269 20.143 1.00 0.00 C ATOM 659 O ARG A 41 85.241 10.754 20.526 1.00 0.00 O ATOM 660 CB ARG A 41 86.883 13.367 21.360 1.00 0.00 C ATOM 661 CG ARG A 41 87.115 14.871 21.210 1.00 0.00 C ATOM 662 CD ARG A 41 87.673 15.434 22.518 1.00 0.00 C ATOM 663 NE ARG A 41 87.709 16.899 22.464 1.00 0.00 N ATOM 664 CZ ARG A 41 86.611 17.668 22.499 1.00 0.00 C ATOM 665 NH1 ARG A 41 85.403 17.162 22.584 1.00 0.00 N ATOM 666 NH2 ARG A 41 86.747 18.965 22.447 1.00 0.00 N ATOM 0 H ARG A 41 84.781 14.071 20.291 1.00 0.00 H new ATOM 0 HA ARG A 41 87.154 13.017 19.253 1.00 0.00 H new ATOM 0 HB2 ARG A 41 86.135 13.179 22.130 1.00 0.00 H new ATOM 0 HB3 ARG A 41 87.802 12.877 21.683 1.00 0.00 H new ATOM 0 HG2 ARG A 41 87.811 15.063 20.393 1.00 0.00 H new ATOM 0 HG3 ARG A 41 86.180 15.370 20.956 1.00 0.00 H new ATOM 0 HD2 ARG A 41 87.055 15.109 23.355 1.00 0.00 H new ATOM 0 HD3 ARG A 41 88.676 15.044 22.692 1.00 0.00 H new ATOM 0 HE ARG A 41 88.618 17.357 22.396 1.00 0.00 H new ATOM 0 HH11 ARG A 41 85.275 16.151 22.626 1.00 0.00 H new ATOM 0 HH12 ARG A 41 84.592 17.780 22.608 1.00 0.00 H new ATOM 0 HH21 ARG A 41 87.677 19.378 22.381 1.00 0.00 H new ATOM 0 HH22 ARG A 41 85.923 19.566 22.472 1.00 0.00 H new ATOM 680 N ALA A 42 87.366 10.560 19.815 1.00 0.00 N ATOM 681 CA ALA A 42 87.353 9.103 19.870 1.00 0.00 C ATOM 682 C ALA A 42 88.691 8.570 20.373 1.00 0.00 C ATOM 683 O ALA A 42 89.715 9.247 20.283 1.00 0.00 O ATOM 684 CB ALA A 42 87.064 8.530 18.481 1.00 0.00 C ATOM 0 H ALA A 42 88.251 10.966 19.510 1.00 0.00 H new ATOM 0 HA ALA A 42 86.570 8.794 20.562 1.00 0.00 H new ATOM 0 HB1 ALA A 42 87.056 7.441 18.531 1.00 0.00 H new ATOM 0 HB2 ALA A 42 86.093 8.884 18.136 1.00 0.00 H new ATOM 0 HB3 ALA A 42 87.837 8.856 17.785 1.00 0.00 H new ATOM 690 N ASP A 43 88.672 7.351 20.902 1.00 0.00 N ATOM 691 CA ASP A 43 89.887 6.730 21.417 1.00 0.00 C ATOM 692 C ASP A 43 90.917 6.557 20.298 1.00 0.00 C ATOM 693 O ASP A 43 90.540 6.493 19.127 1.00 0.00 O ATOM 694 CB ASP A 43 89.556 5.365 22.024 1.00 0.00 C ATOM 695 CG ASP A 43 88.729 5.547 23.293 1.00 0.00 C ATOM 696 OD1 ASP A 43 87.665 6.135 23.204 1.00 0.00 O ATOM 697 OD2 ASP A 43 89.174 5.095 24.336 1.00 0.00 O ATOM 0 H ASP A 43 87.834 6.776 20.985 1.00 0.00 H new ATOM 0 HA ASP A 43 90.308 7.378 22.186 1.00 0.00 H new ATOM 0 HB2 ASP A 43 89.004 4.761 21.304 1.00 0.00 H new ATOM 0 HB3 ASP A 43 90.476 4.827 22.253 1.00 0.00 H new ATOM 702 N PRO A 44 92.194 6.479 20.615 1.00 0.00 N ATOM 703 CA PRO A 44 93.248 6.318 19.566 1.00 0.00 C ATOM 704 C PRO A 44 93.050 5.038 18.757 1.00 0.00 C ATOM 705 O PRO A 44 92.854 3.960 19.318 1.00 0.00 O ATOM 706 CB PRO A 44 94.571 6.284 20.341 1.00 0.00 C ATOM 707 CG PRO A 44 94.205 5.964 21.750 1.00 0.00 C ATOM 708 CD PRO A 44 92.800 6.523 21.962 1.00 0.00 C ATOM 0 HA PRO A 44 93.218 7.128 18.837 1.00 0.00 H new ATOM 0 HB2 PRO A 44 95.246 5.532 19.931 1.00 0.00 H new ATOM 0 HB3 PRO A 44 95.086 7.243 20.278 1.00 0.00 H new ATOM 0 HG2 PRO A 44 94.226 4.888 21.923 1.00 0.00 H new ATOM 0 HG3 PRO A 44 94.912 6.413 22.448 1.00 0.00 H new ATOM 0 HD2 PRO A 44 92.234 5.923 22.675 1.00 0.00 H new ATOM 0 HD3 PRO A 44 92.829 7.540 22.354 1.00 0.00 H new ATOM 716 N ALA A 45 93.102 5.168 17.435 1.00 0.00 N ATOM 717 CA ALA A 45 92.905 4.023 16.555 1.00 0.00 C ATOM 718 C ALA A 45 93.774 4.148 15.307 1.00 0.00 C ATOM 719 O ALA A 45 94.287 5.224 15.002 1.00 0.00 O ATOM 720 CB ALA A 45 91.434 3.924 16.147 1.00 0.00 C ATOM 0 H ALA A 45 93.278 6.049 16.953 1.00 0.00 H new ATOM 0 HA ALA A 45 93.194 3.121 17.095 1.00 0.00 H new ATOM 0 HB1 ALA A 45 91.296 3.066 15.489 1.00 0.00 H new ATOM 0 HB2 ALA A 45 90.817 3.802 17.037 1.00 0.00 H new ATOM 0 HB3 ALA A 45 91.140 4.833 15.623 1.00 0.00 H new ATOM 726 N HIS A 46 93.935 3.040 14.592 1.00 0.00 N ATOM 727 CA HIS A 46 94.742 3.037 13.376 1.00 0.00 C ATOM 728 C HIS A 46 93.873 3.345 12.161 1.00 0.00 C ATOM 729 O HIS A 46 92.652 3.194 12.206 1.00 0.00 O ATOM 730 CB HIS A 46 95.411 1.674 13.195 1.00 0.00 C ATOM 731 CG HIS A 46 96.341 1.308 14.321 1.00 0.00 C ATOM 732 ND1 HIS A 46 97.536 1.976 14.539 1.00 0.00 N ATOM 733 CD2 HIS A 46 96.264 0.348 15.300 1.00 0.00 C ATOM 734 CE1 HIS A 46 98.125 1.414 15.608 1.00 0.00 C ATOM 735 NE2 HIS A 46 97.394 0.417 16.112 1.00 0.00 N ATOM 0 H HIS A 46 93.521 2.139 14.830 1.00 0.00 H new ATOM 0 HA HIS A 46 95.509 3.806 13.468 1.00 0.00 H new ATOM 0 HB2 HIS A 46 94.640 0.908 13.107 1.00 0.00 H new ATOM 0 HB3 HIS A 46 95.969 1.673 12.259 1.00 0.00 H new ATOM 0 HD2 HIS A 46 95.452 -0.353 15.422 1.00 0.00 H new ATOM 0 HE1 HIS A 46 99.076 1.731 16.011 1.00 0.00 H new ATOM 0 HE2 HIS A 46 97.615 -0.168 16.918 1.00 0.00 H new ATOM 743 N ARG A 47 94.509 3.777 11.077 1.00 0.00 N ATOM 744 CA ARG A 47 93.778 4.137 9.867 1.00 0.00 C ATOM 745 C ARG A 47 94.526 3.674 8.621 1.00 0.00 C ATOM 746 O ARG A 47 95.732 3.432 8.661 1.00 0.00 O ATOM 747 CB ARG A 47 93.577 5.655 9.818 1.00 0.00 C ATOM 748 CG ARG A 47 94.937 6.360 9.833 1.00 0.00 C ATOM 749 CD ARG A 47 94.729 7.875 9.854 1.00 0.00 C ATOM 750 NE ARG A 47 94.219 8.299 11.160 1.00 0.00 N ATOM 751 CZ ARG A 47 95.008 8.553 12.216 1.00 0.00 C ATOM 752 NH1 ARG A 47 96.313 8.440 12.158 1.00 0.00 N ATOM 753 NH2 ARG A 47 94.458 8.925 13.340 1.00 0.00 N ATOM 0 H ARG A 47 95.521 3.886 11.011 1.00 0.00 H new ATOM 0 HA ARG A 47 92.808 3.640 9.889 1.00 0.00 H new ATOM 0 HB2 ARG A 47 93.025 5.929 8.919 1.00 0.00 H new ATOM 0 HB3 ARG A 47 92.980 5.980 10.670 1.00 0.00 H new ATOM 0 HG2 ARG A 47 95.509 6.049 10.707 1.00 0.00 H new ATOM 0 HG3 ARG A 47 95.516 6.074 8.955 1.00 0.00 H new ATOM 0 HD2 ARG A 47 95.671 8.381 9.642 1.00 0.00 H new ATOM 0 HD3 ARG A 47 94.028 8.164 9.071 1.00 0.00 H new ATOM 0 HE ARG A 47 93.211 8.407 11.273 1.00 0.00 H new ATOM 0 HH11 ARG A 47 96.762 8.150 11.289 1.00 0.00 H new ATOM 0 HH12 ARG A 47 96.879 8.642 12.982 1.00 0.00 H new ATOM 0 HH21 ARG A 47 93.444 9.018 13.405 1.00 0.00 H new ATOM 0 HH22 ARG A 47 95.042 9.122 14.153 1.00 0.00 H new ATOM 767 N SER A 48 93.799 3.551 7.514 1.00 0.00 N ATOM 768 CA SER A 48 94.402 3.120 6.259 1.00 0.00 C ATOM 769 C SER A 48 95.382 4.177 5.744 1.00 0.00 C ATOM 770 O SER A 48 95.229 5.357 6.063 1.00 0.00 O ATOM 771 CB SER A 48 93.313 2.879 5.213 1.00 0.00 C ATOM 772 OG SER A 48 92.226 2.193 5.819 1.00 0.00 O ATOM 0 H SER A 48 92.799 3.742 7.461 1.00 0.00 H new ATOM 0 HA SER A 48 94.946 2.192 6.438 1.00 0.00 H new ATOM 0 HB2 SER A 48 92.974 3.828 4.799 1.00 0.00 H new ATOM 0 HB3 SER A 48 93.711 2.294 4.384 1.00 0.00 H new ATOM 0 HG SER A 48 91.525 2.038 5.152 1.00 0.00 H new ATOM 778 N PRO A 49 96.377 3.797 4.965 1.00 0.00 N ATOM 779 CA PRO A 49 97.371 4.782 4.441 1.00 0.00 C ATOM 780 C PRO A 49 96.699 6.003 3.819 1.00 0.00 C ATOM 781 O PRO A 49 95.590 5.912 3.293 1.00 0.00 O ATOM 782 CB PRO A 49 98.162 4.001 3.390 1.00 0.00 C ATOM 783 CG PRO A 49 98.033 2.569 3.780 1.00 0.00 C ATOM 784 CD PRO A 49 96.687 2.432 4.488 1.00 0.00 C ATOM 0 HA PRO A 49 98.001 5.178 5.238 1.00 0.00 H new ATOM 0 HB2 PRO A 49 97.763 4.173 2.390 1.00 0.00 H new ATOM 0 HB3 PRO A 49 99.207 4.311 3.374 1.00 0.00 H new ATOM 0 HG2 PRO A 49 98.078 1.923 2.903 1.00 0.00 H new ATOM 0 HG3 PRO A 49 98.849 2.271 4.438 1.00 0.00 H new ATOM 0 HD2 PRO A 49 95.917 2.065 3.809 1.00 0.00 H new ATOM 0 HD3 PRO A 49 96.745 1.726 5.316 1.00 0.00 H new ATOM 792 N VAL A 50 97.380 7.142 3.883 1.00 0.00 N ATOM 793 CA VAL A 50 96.820 8.386 3.364 1.00 0.00 C ATOM 794 C VAL A 50 97.216 8.547 1.892 1.00 0.00 C ATOM 795 O VAL A 50 98.341 8.194 1.540 1.00 0.00 O ATOM 796 CB VAL A 50 97.359 9.565 4.187 1.00 0.00 C ATOM 797 CG1 VAL A 50 96.772 10.884 3.679 1.00 0.00 C ATOM 798 CG2 VAL A 50 96.974 9.381 5.658 1.00 0.00 C ATOM 0 H VAL A 50 98.313 7.231 4.285 1.00 0.00 H new ATOM 0 HA VAL A 50 95.733 8.363 3.439 1.00 0.00 H new ATOM 0 HB VAL A 50 98.444 9.594 4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 50 97.164 11.709 4.273 1.00 0.00 H new ATOM 0 HG12 VAL A 50 97.047 11.026 2.634 1.00 0.00 H new ATOM 0 HG13 VAL A 50 95.686 10.857 3.768 1.00 0.00 H new ATOM 0 HG21 VAL A 50 97.357 10.218 6.242 1.00 0.00 H new ATOM 0 HG22 VAL A 50 95.888 9.342 5.748 1.00 0.00 H new ATOM 0 HG23 VAL A 50 97.402 8.451 6.033 1.00 0.00 H new ATOM 808 N PRO A 51 96.366 9.082 1.038 1.00 0.00 N ATOM 809 CA PRO A 51 96.747 9.309 -0.391 1.00 0.00 C ATOM 810 C PRO A 51 98.056 10.084 -0.499 1.00 0.00 C ATOM 811 O PRO A 51 98.479 10.736 0.456 1.00 0.00 O ATOM 812 CB PRO A 51 95.584 10.114 -0.973 1.00 0.00 C ATOM 813 CG PRO A 51 94.413 9.786 -0.113 1.00 0.00 C ATOM 814 CD PRO A 51 94.969 9.499 1.281 1.00 0.00 C ATOM 0 HA PRO A 51 96.913 8.373 -0.925 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.798 11.183 -0.956 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.398 9.842 -2.012 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.706 10.615 -0.086 1.00 0.00 H new ATOM 0 HG3 PRO A 51 93.875 8.922 -0.502 1.00 0.00 H new ATOM 0 HD2 PRO A 51 94.923 10.383 1.917 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.401 8.715 1.782 1.00 0.00 H new ATOM 822 N LEU A 52 98.695 10.011 -1.662 1.00 0.00 N ATOM 823 CA LEU A 52 99.991 10.653 -1.847 1.00 0.00 C ATOM 824 C LEU A 52 99.863 12.172 -1.712 1.00 0.00 C ATOM 825 O LEU A 52 98.786 12.718 -1.959 1.00 0.00 O ATOM 826 CB LEU A 52 100.555 10.319 -3.229 1.00 0.00 C ATOM 827 CG LEU A 52 100.856 8.822 -3.323 1.00 0.00 C ATOM 828 CD1 LEU A 52 101.219 8.470 -4.767 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.033 8.477 -2.408 1.00 0.00 C ATOM 0 H LEU A 52 98.341 9.519 -2.483 1.00 0.00 H new ATOM 0 HA LEU A 52 100.666 10.280 -1.077 1.00 0.00 H new ATOM 0 HB2 LEU A 52 99.840 10.604 -4.001 1.00 0.00 H new ATOM 0 HB3 LEU A 52 101.464 10.893 -3.408 1.00 0.00 H new ATOM 0 HG LEU A 52 99.978 8.255 -3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 52 101.434 7.404 -4.838 1.00 0.00 H new ATOM 0 HD12 LEU A 52 100.384 8.716 -5.423 1.00 0.00 H new ATOM 0 HD13 LEU A 52 102.098 9.039 -5.070 1.00 0.00 H new ATOM 0 HD21 LEU A 52 102.246 7.410 -2.476 1.00 0.00 H new ATOM 0 HD22 LEU A 52 102.912 9.043 -2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 52 101.780 8.732 -1.379 1.00 0.00 H new ATOM 841 N PRO A 53 100.917 12.867 -1.331 1.00 0.00 N ATOM 842 CA PRO A 53 100.861 14.353 -1.203 1.00 0.00 C ATOM 843 C PRO A 53 100.851 15.034 -2.568 1.00 0.00 C ATOM 844 O PRO A 53 101.420 14.516 -3.534 1.00 0.00 O ATOM 845 CB PRO A 53 102.127 14.712 -0.423 1.00 0.00 C ATOM 846 CG PRO A 53 103.095 13.620 -0.728 1.00 0.00 C ATOM 847 CD PRO A 53 102.266 12.362 -0.987 1.00 0.00 C ATOM 0 HA PRO A 53 99.951 14.686 -0.704 1.00 0.00 H new ATOM 0 HB2 PRO A 53 102.518 15.682 -0.731 1.00 0.00 H new ATOM 0 HB3 PRO A 53 101.927 14.774 0.647 1.00 0.00 H new ATOM 0 HG2 PRO A 53 103.701 13.871 -1.599 1.00 0.00 H new ATOM 0 HG3 PRO A 53 103.782 13.467 0.105 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.687 11.770 -1.800 1.00 0.00 H new ATOM 0 HD3 PRO A 53 102.236 11.719 -0.107 1.00 0.00 H new ATOM 855 N SER A 54 100.232 16.212 -2.633 1.00 0.00 N ATOM 856 CA SER A 54 100.107 16.933 -3.896 1.00 0.00 C ATOM 857 C SER A 54 101.495 17.157 -4.512 1.00 0.00 C ATOM 858 O SER A 54 102.387 17.645 -3.817 1.00 0.00 O ATOM 859 CB SER A 54 99.435 18.285 -3.657 1.00 0.00 C ATOM 860 OG SER A 54 98.088 18.072 -3.256 1.00 0.00 O ATOM 0 H SER A 54 99.813 16.683 -1.832 1.00 0.00 H new ATOM 0 HA SER A 54 99.500 16.341 -4.581 1.00 0.00 H new ATOM 0 HB2 SER A 54 99.972 18.841 -2.889 1.00 0.00 H new ATOM 0 HB3 SER A 54 99.466 18.886 -4.566 1.00 0.00 H new ATOM 0 HG SER A 54 97.653 18.936 -3.100 1.00 0.00 H new ATOM 866 N PRO A 55 101.708 16.832 -5.769 1.00 0.00 N ATOM 867 CA PRO A 55 103.082 16.835 -6.345 1.00 0.00 C ATOM 868 C PRO A 55 103.568 18.227 -6.736 1.00 0.00 C ATOM 869 O PRO A 55 102.961 18.894 -7.573 1.00 0.00 O ATOM 870 CB PRO A 55 102.953 15.941 -7.577 1.00 0.00 C ATOM 871 CG PRO A 55 101.548 16.120 -8.042 1.00 0.00 C ATOM 872 CD PRO A 55 100.716 16.500 -6.813 1.00 0.00 C ATOM 0 HA PRO A 55 103.819 16.487 -5.621 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.664 16.231 -8.351 1.00 0.00 H new ATOM 0 HB3 PRO A 55 103.157 14.899 -7.331 1.00 0.00 H new ATOM 0 HG2 PRO A 55 101.490 16.898 -8.803 1.00 0.00 H new ATOM 0 HG3 PRO A 55 101.171 15.203 -8.494 1.00 0.00 H new ATOM 0 HD2 PRO A 55 100.065 17.349 -7.024 1.00 0.00 H new ATOM 0 HD3 PRO A 55 100.074 15.676 -6.500 1.00 0.00 H new ATOM 880 N THR A 56 104.667 18.656 -6.125 1.00 0.00 N ATOM 881 CA THR A 56 105.379 19.828 -6.619 1.00 0.00 C ATOM 882 C THR A 56 106.128 19.417 -7.882 1.00 0.00 C ATOM 883 O THR A 56 106.380 18.228 -8.085 1.00 0.00 O ATOM 884 CB THR A 56 106.367 20.344 -5.570 1.00 0.00 C ATOM 885 OG1 THR A 56 107.371 19.363 -5.344 1.00 0.00 O ATOM 886 CG2 THR A 56 105.632 20.637 -4.260 1.00 0.00 C ATOM 0 H THR A 56 105.079 18.218 -5.301 1.00 0.00 H new ATOM 0 HA THR A 56 104.673 20.630 -6.832 1.00 0.00 H new ATOM 0 HB THR A 56 106.828 21.263 -5.932 1.00 0.00 H new ATOM 0 HG1 THR A 56 108.005 19.693 -4.674 1.00 0.00 H new ATOM 0 HG21 THR A 56 106.342 21.004 -3.519 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.866 21.393 -4.434 1.00 0.00 H new ATOM 0 HG23 THR A 56 105.164 19.724 -3.893 1.00 0.00 H new ATOM 894 N SER A 57 106.521 20.379 -8.718 1.00 0.00 N ATOM 895 CA SER A 57 107.093 20.031 -10.021 1.00 0.00 C ATOM 896 C SER A 57 108.283 19.083 -9.864 1.00 0.00 C ATOM 897 O SER A 57 109.209 19.349 -9.100 1.00 0.00 O ATOM 898 CB SER A 57 107.546 21.300 -10.743 1.00 0.00 C ATOM 899 OG SER A 57 106.419 22.139 -10.963 1.00 0.00 O ATOM 0 H SER A 57 106.457 21.379 -8.525 1.00 0.00 H new ATOM 0 HA SER A 57 106.324 19.527 -10.606 1.00 0.00 H new ATOM 0 HB2 SER A 57 108.294 21.824 -10.148 1.00 0.00 H new ATOM 0 HB3 SER A 57 108.016 21.045 -11.693 1.00 0.00 H new ATOM 0 HG SER A 57 106.704 22.955 -11.424 1.00 0.00 H new ATOM 905 N ASN A 58 108.203 17.951 -10.558 1.00 0.00 N ATOM 906 CA ASN A 58 109.306 16.996 -10.647 1.00 0.00 C ATOM 907 C ASN A 58 109.685 16.380 -9.291 1.00 0.00 C ATOM 908 O ASN A 58 110.744 15.762 -9.179 1.00 0.00 O ATOM 909 CB ASN A 58 110.515 17.621 -11.374 1.00 0.00 C ATOM 910 CG ASN A 58 111.409 18.459 -10.459 1.00 0.00 C ATOM 911 OD1 ASN A 58 112.172 17.909 -9.666 1.00 0.00 O ATOM 912 ND2 ASN A 58 111.380 19.761 -10.545 1.00 0.00 N ATOM 0 H ASN A 58 107.371 17.669 -11.076 1.00 0.00 H new ATOM 0 HA ASN A 58 108.955 16.158 -11.249 1.00 0.00 H new ATOM 0 HB2 ASN A 58 111.111 16.826 -11.822 1.00 0.00 H new ATOM 0 HB3 ASN A 58 110.154 18.247 -12.190 1.00 0.00 H new ATOM 0 HD21 ASN A 58 111.991 20.325 -9.954 1.00 0.00 H new ATOM 0 HD22 ASN A 58 110.747 20.215 -11.203 1.00 0.00 H new ATOM 919 N LYS A 59 108.844 16.541 -8.265 1.00 0.00 N ATOM 920 CA LYS A 59 109.168 16.022 -6.935 1.00 0.00 C ATOM 921 C LYS A 59 107.918 15.556 -6.186 1.00 0.00 C ATOM 922 O LYS A 59 106.812 16.027 -6.448 1.00 0.00 O ATOM 923 CB LYS A 59 109.846 17.104 -6.089 1.00 0.00 C ATOM 924 CG LYS A 59 111.144 17.565 -6.754 1.00 0.00 C ATOM 925 CD LYS A 59 111.774 18.683 -5.921 1.00 0.00 C ATOM 926 CE LYS A 59 112.272 18.112 -4.591 1.00 0.00 C ATOM 927 NZ LYS A 59 113.111 19.129 -3.897 1.00 0.00 N ATOM 0 H LYS A 59 107.946 17.020 -8.328 1.00 0.00 H new ATOM 0 HA LYS A 59 109.836 15.174 -7.085 1.00 0.00 H new ATOM 0 HB2 LYS A 59 109.173 17.952 -5.964 1.00 0.00 H new ATOM 0 HB3 LYS A 59 110.058 16.716 -5.093 1.00 0.00 H new ATOM 0 HG2 LYS A 59 111.837 16.728 -6.843 1.00 0.00 H new ATOM 0 HG3 LYS A 59 110.941 17.920 -7.765 1.00 0.00 H new ATOM 0 HD2 LYS A 59 112.602 19.135 -6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 59 111.043 19.471 -5.739 1.00 0.00 H new ATOM 0 HE2 LYS A 59 111.426 17.833 -3.963 1.00 0.00 H new ATOM 0 HE3 LYS A 59 112.851 17.205 -4.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 113.450 18.742 -2.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 113.925 19.374 -4.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 112.544 19.982 -3.717 1.00 0.00 H new ATOM 941 N GLN A 60 108.112 14.626 -5.252 1.00 0.00 N ATOM 942 CA GLN A 60 107.064 14.259 -4.300 1.00 0.00 C ATOM 943 C GLN A 60 107.669 13.825 -2.970 1.00 0.00 C ATOM 944 O GLN A 60 108.779 13.297 -2.925 1.00 0.00 O ATOM 945 CB GLN A 60 106.185 13.116 -4.817 1.00 0.00 C ATOM 946 CG GLN A 60 105.314 13.599 -5.976 1.00 0.00 C ATOM 947 CD GLN A 60 104.278 12.532 -6.319 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.578 11.593 -7.056 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.075 12.602 -5.812 1.00 0.00 N ATOM 0 H GLN A 60 108.985 14.113 -5.134 1.00 0.00 H new ATOM 0 HA GLN A 60 106.448 15.149 -4.168 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.811 12.286 -5.145 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.554 12.740 -4.011 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.816 14.530 -5.706 1.00 0.00 H new ATOM 0 HG3 GLN A 60 105.935 13.810 -6.847 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.824 13.379 -5.201 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.388 11.880 -6.028 1.00 0.00 H new ATOM 958 N ASP A 61 106.928 14.042 -1.888 1.00 0.00 N ATOM 959 CA ASP A 61 107.334 13.536 -0.583 1.00 0.00 C ATOM 960 C ASP A 61 106.702 12.167 -0.351 1.00 0.00 C ATOM 961 O ASP A 61 105.482 12.020 -0.434 1.00 0.00 O ATOM 962 CB ASP A 61 106.894 14.502 0.519 1.00 0.00 C ATOM 963 CG ASP A 61 107.587 15.854 0.355 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.705 15.877 -0.136 1.00 0.00 O ATOM 965 OD2 ASP A 61 106.986 16.850 0.722 1.00 0.00 O ATOM 0 H ASP A 61 106.050 14.561 -1.889 1.00 0.00 H new ATOM 0 HA ASP A 61 108.420 13.446 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.813 14.635 0.484 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.132 14.081 1.496 1.00 0.00 H new ATOM 970 N ILE A 62 107.528 11.164 -0.059 1.00 0.00 N ATOM 971 CA ILE A 62 107.033 9.795 0.098 1.00 0.00 C ATOM 972 C ILE A 62 107.465 9.224 1.451 1.00 0.00 C ATOM 973 O ILE A 62 108.561 9.519 1.924 1.00 0.00 O ATOM 974 CB ILE A 62 107.547 8.946 -1.076 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.823 7.599 -1.088 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.062 8.721 -0.987 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.429 7.772 -1.701 1.00 0.00 C ATOM 0 H ILE A 62 108.534 11.270 0.073 1.00 0.00 H new ATOM 0 HA ILE A 62 105.943 9.784 0.083 1.00 0.00 H new ATOM 0 HB ILE A 62 107.343 9.486 -2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.396 6.871 -1.662 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.740 7.210 -0.073 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.390 8.117 -1.833 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.574 9.683 -1.007 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.299 8.203 -0.058 1.00 0.00 H new ATOM 0 HD11 ILE A 62 104.913 6.812 -1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.857 8.486 -1.108 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.524 8.142 -2.722 1.00 0.00 H new ATOM 989 N SER A 63 106.615 8.397 2.065 1.00 0.00 N ATOM 990 CA SER A 63 106.903 7.909 3.413 1.00 0.00 C ATOM 991 C SER A 63 106.309 6.527 3.671 1.00 0.00 C ATOM 992 O SER A 63 105.404 6.068 2.971 1.00 0.00 O ATOM 993 CB SER A 63 106.361 8.895 4.449 1.00 0.00 C ATOM 994 OG SER A 63 104.942 8.814 4.474 1.00 0.00 O ATOM 0 H SER A 63 105.742 8.058 1.661 1.00 0.00 H new ATOM 0 HA SER A 63 107.986 7.825 3.500 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.768 8.666 5.434 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.675 9.909 4.202 1.00 0.00 H new ATOM 0 HG SER A 63 104.603 8.736 3.558 1.00 0.00 H new ATOM 1000 N GLU A 64 106.825 5.876 4.711 1.00 0.00 N ATOM 1001 CA GLU A 64 106.365 4.547 5.092 1.00 0.00 C ATOM 1002 C GLU A 64 104.859 4.525 5.340 1.00 0.00 C ATOM 1003 O GLU A 64 104.190 3.546 5.015 1.00 0.00 O ATOM 1004 CB GLU A 64 107.105 4.089 6.353 1.00 0.00 C ATOM 1005 CG GLU A 64 106.823 5.054 7.512 1.00 0.00 C ATOM 1006 CD GLU A 64 107.637 4.698 8.762 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.300 3.670 8.772 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.579 5.467 9.707 1.00 0.00 O ATOM 0 H GLU A 64 107.564 6.251 5.305 1.00 0.00 H new ATOM 0 HA GLU A 64 106.579 3.866 4.268 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.789 3.082 6.624 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.177 4.045 6.159 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.059 6.072 7.203 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.760 5.032 7.752 1.00 0.00 H new ATOM 1015 N ALA A 65 104.321 5.612 5.885 1.00 0.00 N ATOM 1016 CA ALA A 65 102.905 5.653 6.236 1.00 0.00 C ATOM 1017 C ALA A 65 102.030 5.414 5.011 1.00 0.00 C ATOM 1018 O ALA A 65 101.030 4.698 5.084 1.00 0.00 O ATOM 1019 CB ALA A 65 102.559 7.011 6.850 1.00 0.00 C ATOM 0 H ALA A 65 104.837 6.467 6.091 1.00 0.00 H new ATOM 0 HA ALA A 65 102.713 4.861 6.960 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.501 7.034 7.109 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.156 7.167 7.748 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.773 7.801 6.130 1.00 0.00 H new ATOM 1025 N ASN A 66 102.404 6.014 3.887 1.00 0.00 N ATOM 1026 CA ASN A 66 101.589 5.922 2.678 1.00 0.00 C ATOM 1027 C ASN A 66 101.684 4.530 2.056 1.00 0.00 C ATOM 1028 O ASN A 66 100.674 3.938 1.678 1.00 0.00 O ATOM 1029 CB ASN A 66 102.034 6.955 1.637 1.00 0.00 C ATOM 1030 CG ASN A 66 102.168 8.347 2.252 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.268 8.762 2.616 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.112 9.099 2.377 1.00 0.00 N ATOM 0 H ASN A 66 103.257 6.564 3.786 1.00 0.00 H new ATOM 0 HA ASN A 66 100.558 6.119 2.971 1.00 0.00 H new ATOM 0 HB2 ASN A 66 102.989 6.652 1.208 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.312 6.985 0.821 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.196 10.034 2.777 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.201 8.753 2.075 1.00 0.00 H new ATOM 1039 N LEU A 67 102.906 4.021 1.938 1.00 0.00 N ATOM 1040 CA LEU A 67 103.125 2.728 1.289 1.00 0.00 C ATOM 1041 C LEU A 67 102.654 1.548 2.140 1.00 0.00 C ATOM 1042 O LEU A 67 102.336 0.490 1.598 1.00 0.00 O ATOM 1043 CB LEU A 67 104.606 2.558 0.939 1.00 0.00 C ATOM 1044 CG LEU A 67 104.916 3.331 -0.347 1.00 0.00 C ATOM 1045 CD1 LEU A 67 104.963 4.828 -0.041 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.261 2.874 -0.926 1.00 0.00 C ATOM 0 H LEU A 67 103.753 4.476 2.278 1.00 0.00 H new ATOM 0 HA LEU A 67 102.524 2.727 0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.228 2.924 1.756 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.841 1.502 0.807 1.00 0.00 H new ATOM 0 HG LEU A 67 104.134 3.135 -1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.184 5.379 -0.955 1.00 0.00 H new ATOM 0 HD12 LEU A 67 103.999 5.149 0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.740 5.024 0.698 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.471 3.430 -1.840 1.00 0.00 H new ATOM 0 HD22 LEU A 67 107.052 3.059 -0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 67 106.217 1.808 -1.151 1.00 0.00 H new ATOM 1058 N ALA A 68 102.619 1.716 3.462 1.00 0.00 N ATOM 1059 CA ALA A 68 102.244 0.630 4.370 1.00 0.00 C ATOM 1060 C ALA A 68 103.363 -0.425 4.378 1.00 0.00 C ATOM 1061 O ALA A 68 104.525 -0.062 4.210 1.00 0.00 O ATOM 1062 CB ALA A 68 100.872 0.052 3.973 1.00 0.00 C ATOM 0 H ALA A 68 102.846 2.594 3.929 1.00 0.00 H new ATOM 0 HA ALA A 68 102.135 1.003 5.388 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.605 -0.754 4.656 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.117 0.837 4.026 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.921 -0.336 2.956 1.00 0.00 H new ATOM 1068 N TYR A 69 103.048 -1.714 4.541 1.00 0.00 N ATOM 1069 CA TYR A 69 104.088 -2.744 4.623 1.00 0.00 C ATOM 1070 C TYR A 69 105.021 -2.733 3.406 1.00 0.00 C ATOM 1071 O TYR A 69 106.148 -3.222 3.482 1.00 0.00 O ATOM 1072 CB TYR A 69 103.436 -4.123 4.743 1.00 0.00 C ATOM 1073 CG TYR A 69 102.576 -4.277 5.975 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.168 -4.573 7.209 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.187 -4.123 5.884 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.371 -4.716 8.352 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.391 -4.266 7.026 1.00 0.00 C ATOM 1078 CZ TYR A 69 100.982 -4.563 8.260 1.00 0.00 C ATOM 1079 OH TYR A 69 100.197 -4.703 9.386 1.00 0.00 O ATOM 0 H TYR A 69 102.094 -2.066 4.618 1.00 0.00 H new ATOM 0 HA TYR A 69 104.691 -2.525 5.505 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.826 -4.306 3.858 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.215 -4.885 4.756 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.239 -4.691 7.279 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.730 -3.894 4.933 1.00 0.00 H new ATOM 0 HE1 TYR A 69 102.827 -4.944 9.304 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.320 -4.147 6.955 1.00 0.00 H new ATOM 0 HH TYR A 69 99.256 -4.564 9.148 1.00 0.00 H new ATOM 1089 N LEU A 70 104.557 -2.177 2.288 1.00 0.00 N ATOM 1090 CA LEU A 70 105.352 -2.135 1.061 1.00 0.00 C ATOM 1091 C LEU A 70 106.675 -1.385 1.251 1.00 0.00 C ATOM 1092 O LEU A 70 107.635 -1.628 0.520 1.00 0.00 O ATOM 1093 CB LEU A 70 104.547 -1.467 -0.056 1.00 0.00 C ATOM 1094 CG LEU A 70 103.232 -2.220 -0.281 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.394 -1.479 -1.324 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.527 -3.634 -0.787 1.00 0.00 C ATOM 0 H LEU A 70 103.635 -1.749 2.206 1.00 0.00 H new ATOM 0 HA LEU A 70 105.589 -3.165 0.794 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.340 -0.429 0.205 1.00 0.00 H new ATOM 0 HB3 LEU A 70 105.130 -1.454 -0.977 1.00 0.00 H new ATOM 0 HG LEU A 70 102.685 -2.277 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.458 -2.014 -1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 70 102.180 -0.471 -0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 70 102.946 -1.424 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.589 -4.167 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 70 104.076 -3.577 -1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 70 104.126 -4.167 -0.049 1.00 0.00 H new ATOM 1108 N TRP A 71 106.731 -0.476 2.225 1.00 0.00 N ATOM 1109 CA TRP A 71 107.925 0.334 2.444 1.00 0.00 C ATOM 1110 C TRP A 71 109.152 -0.568 2.654 1.00 0.00 C ATOM 1111 O TRP A 71 109.232 -1.238 3.684 1.00 0.00 O ATOM 1112 CB TRP A 71 107.724 1.193 3.693 1.00 0.00 C ATOM 1113 CG TRP A 71 108.692 2.328 3.804 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.645 2.440 4.755 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.819 3.507 2.955 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.335 3.621 4.557 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.872 4.311 3.456 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.131 3.953 1.816 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.227 5.518 2.842 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.485 5.162 1.197 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.529 5.942 1.707 1.00 0.00 C ATOM 0 H TRP A 71 105.966 -0.284 2.871 1.00 0.00 H new ATOM 0 HA TRP A 71 108.090 0.965 1.570 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.709 1.591 3.690 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.816 0.561 4.576 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.836 1.724 5.541 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.096 3.944 5.154 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.323 3.361 1.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.033 6.116 3.241 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 107.948 5.493 0.321 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.795 6.871 1.224 1.00 0.00 H new ATOM 1132 N PRO A 72 110.101 -0.615 1.739 1.00 0.00 N ATOM 1133 CA PRO A 72 111.265 -1.544 1.861 1.00 0.00 C ATOM 1134 C PRO A 72 112.460 -0.953 2.610 1.00 0.00 C ATOM 1135 O PRO A 72 113.394 -1.680 2.950 1.00 0.00 O ATOM 1136 CB PRO A 72 111.630 -1.815 0.403 1.00 0.00 C ATOM 1137 CG PRO A 72 111.319 -0.543 -0.310 1.00 0.00 C ATOM 1138 CD PRO A 72 110.216 0.158 0.486 1.00 0.00 C ATOM 0 HA PRO A 72 111.008 -2.429 2.443 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.683 -2.078 0.301 1.00 0.00 H new ATOM 0 HB3 PRO A 72 111.053 -2.647 -0.001 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.205 0.088 -0.378 1.00 0.00 H new ATOM 0 HG3 PRO A 72 110.991 -0.743 -1.330 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.473 1.198 0.686 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.274 0.162 -0.063 1.00 0.00 H new ATOM 1146 N LEU A 73 112.460 0.359 2.829 1.00 0.00 N ATOM 1147 CA LEU A 73 113.614 1.023 3.433 1.00 0.00 C ATOM 1148 C LEU A 73 113.509 1.076 4.953 1.00 0.00 C ATOM 1149 O LEU A 73 112.420 1.211 5.513 1.00 0.00 O ATOM 1150 CB LEU A 73 113.742 2.451 2.903 1.00 0.00 C ATOM 1151 CG LEU A 73 113.818 2.452 1.375 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.869 3.902 0.893 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.080 1.717 0.914 1.00 0.00 C ATOM 0 H LEU A 73 111.683 0.979 2.600 1.00 0.00 H new ATOM 0 HA LEU A 73 114.494 0.438 3.164 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.888 3.044 3.231 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.634 2.920 3.317 1.00 0.00 H new ATOM 0 HG LEU A 73 112.945 1.946 0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.924 3.922 -0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 73 112.971 4.426 1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.749 4.393 1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.127 1.722 -0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.960 2.217 1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.052 0.688 1.271 1.00 0.00 H new ATOM 1165 N THR A 74 114.661 0.968 5.607 1.00 0.00 N ATOM 1166 CA THR A 74 114.742 1.108 7.055 1.00 0.00 C ATOM 1167 C THR A 74 114.482 2.554 7.472 1.00 0.00 C ATOM 1168 O THR A 74 113.855 2.796 8.505 1.00 0.00 O ATOM 1169 CB THR A 74 116.125 0.675 7.549 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.113 1.526 6.989 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.394 -0.772 7.129 1.00 0.00 C ATOM 0 H THR A 74 115.556 0.783 5.153 1.00 0.00 H new ATOM 0 HA THR A 74 113.980 0.470 7.503 1.00 0.00 H new ATOM 0 HB THR A 74 116.159 0.744 8.636 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.250 1.293 6.047 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.379 -1.076 7.482 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.636 -1.424 7.563 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.359 -0.848 6.042 1.00 0.00 H new ATOM 1179 N VAL A 75 114.961 3.512 6.675 1.00 0.00 N ATOM 1180 CA VAL A 75 114.667 4.914 6.950 1.00 0.00 C ATOM 1181 C VAL A 75 113.171 5.127 6.784 1.00 0.00 C ATOM 1182 O VAL A 75 112.593 4.724 5.779 1.00 0.00 O ATOM 1183 CB VAL A 75 115.449 5.851 6.021 1.00 0.00 C ATOM 1184 CG1 VAL A 75 116.943 5.730 6.321 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.201 5.489 4.554 1.00 0.00 C ATOM 0 H VAL A 75 115.541 3.346 5.853 1.00 0.00 H new ATOM 0 HA VAL A 75 114.974 5.151 7.969 1.00 0.00 H new ATOM 0 HB VAL A 75 115.112 6.873 6.193 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.501 6.395 5.662 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.129 6.007 7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.265 4.702 6.156 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.765 6.166 3.912 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.524 4.464 4.373 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.138 5.580 4.332 1.00 0.00 H new ATOM 1195 N ASP A 76 112.542 5.735 7.779 1.00 0.00 N ATOM 1196 CA ASP A 76 111.084 5.776 7.826 1.00 0.00 C ATOM 1197 C ASP A 76 110.494 6.514 6.633 1.00 0.00 C ATOM 1198 O ASP A 76 109.401 6.172 6.180 1.00 0.00 O ATOM 1199 CB ASP A 76 110.615 6.430 9.128 1.00 0.00 C ATOM 1200 CG ASP A 76 111.026 5.586 10.332 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.109 4.376 10.192 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.253 6.165 11.382 1.00 0.00 O ATOM 0 H ASP A 76 113.009 6.202 8.556 1.00 0.00 H new ATOM 0 HA ASP A 76 110.729 4.746 7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.043 7.429 9.214 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.531 6.548 9.112 1.00 0.00 H new ATOM 1207 N HIS A 77 111.191 7.534 6.139 1.00 0.00 N ATOM 1208 CA HIS A 77 110.680 8.292 5.004 1.00 0.00 C ATOM 1209 C HIS A 77 111.822 8.796 4.136 1.00 0.00 C ATOM 1210 O HIS A 77 112.992 8.586 4.451 1.00 0.00 O ATOM 1211 CB HIS A 77 109.830 9.467 5.492 1.00 0.00 C ATOM 1212 CG HIS A 77 110.529 10.356 6.483 1.00 0.00 C ATOM 1213 ND1 HIS A 77 110.999 9.883 7.698 1.00 0.00 N ATOM 1214 CD2 HIS A 77 110.831 11.695 6.459 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.553 10.921 8.350 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.477 12.050 7.641 1.00 0.00 N ATOM 0 H HIS A 77 112.092 7.849 6.498 1.00 0.00 H new ATOM 0 HA HIS A 77 110.056 7.631 4.403 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.528 10.065 4.633 1.00 0.00 H new ATOM 0 HB3 HIS A 77 108.919 9.079 5.947 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.603 12.370 5.648 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.005 10.850 9.328 1.00 0.00 H new ATOM 0 HE2 HIS A 77 111.818 12.973 7.908 1.00 0.00 H new ATOM 1224 N GLY A 78 111.461 9.400 3.011 1.00 0.00 N ATOM 1225 CA GLY A 78 112.434 10.015 2.126 1.00 0.00 C ATOM 1226 C GLY A 78 111.718 10.799 1.034 1.00 0.00 C ATOM 1227 O GLY A 78 110.522 10.618 0.800 1.00 0.00 O ATOM 0 H GLY A 78 110.495 9.476 2.691 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.087 10.678 2.694 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.068 9.249 1.680 1.00 0.00 H new ATOM 1231 N THR A 79 112.444 11.698 0.387 1.00 0.00 N ATOM 1232 CA THR A 79 111.873 12.500 -0.689 1.00 0.00 C ATOM 1233 C THR A 79 112.429 12.043 -2.033 1.00 0.00 C ATOM 1234 O THR A 79 113.612 11.739 -2.147 1.00 0.00 O ATOM 1235 CB THR A 79 112.204 13.976 -0.469 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.026 14.296 0.905 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.251 14.825 -1.312 1.00 0.00 C ATOM 0 H THR A 79 113.426 11.891 0.586 1.00 0.00 H new ATOM 0 HA THR A 79 110.791 12.371 -0.689 1.00 0.00 H new ATOM 0 HB THR A 79 113.236 14.174 -0.759 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.239 15.241 1.051 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.477 15.881 -1.164 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.373 14.572 -2.365 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.223 14.628 -1.008 1.00 0.00 H new ATOM 1245 N ILE A 80 111.575 11.995 -3.050 1.00 0.00 N ATOM 1246 CA ILE A 80 112.000 11.559 -4.378 1.00 0.00 C ATOM 1247 C ILE A 80 112.019 12.746 -5.332 1.00 0.00 C ATOM 1248 O ILE A 80 111.131 13.599 -5.283 1.00 0.00 O ATOM 1249 CB ILE A 80 111.047 10.480 -4.902 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.614 11.024 -4.939 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.114 9.263 -3.976 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.679 9.988 -5.566 1.00 0.00 C ATOM 0 H ILE A 80 110.590 12.251 -2.983 1.00 0.00 H new ATOM 0 HA ILE A 80 113.005 11.142 -4.312 1.00 0.00 H new ATOM 0 HB ILE A 80 111.341 10.191 -5.911 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.281 11.263 -3.929 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.582 11.950 -5.513 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.438 8.490 -4.342 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.133 8.876 -3.957 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.819 9.556 -2.968 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.663 10.382 -5.589 1.00 0.00 H new ATOM 0 HD12 ILE A 80 109.007 9.770 -6.583 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.700 9.073 -4.974 1.00 0.00 H new ATOM 1264 N GLU A 81 113.041 12.808 -6.183 1.00 0.00 N ATOM 1265 CA GLU A 81 113.165 13.932 -7.105 1.00 0.00 C ATOM 1266 C GLU A 81 113.818 13.530 -8.423 1.00 0.00 C ATOM 1267 O GLU A 81 114.694 12.664 -8.467 1.00 0.00 O ATOM 1268 CB GLU A 81 113.974 15.053 -6.447 1.00 0.00 C ATOM 1269 CG GLU A 81 115.379 14.545 -6.099 1.00 0.00 C ATOM 1270 CD GLU A 81 116.189 15.591 -5.325 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.730 16.716 -5.178 1.00 0.00 O ATOM 1272 OE2 GLU A 81 117.272 15.246 -4.881 1.00 0.00 O ATOM 0 H GLU A 81 113.780 12.109 -6.253 1.00 0.00 H new ATOM 0 HA GLU A 81 112.158 14.281 -7.333 1.00 0.00 H new ATOM 0 HB2 GLU A 81 114.043 15.908 -7.120 1.00 0.00 H new ATOM 0 HB3 GLU A 81 113.468 15.398 -5.545 1.00 0.00 H new ATOM 0 HG2 GLU A 81 115.299 13.635 -5.505 1.00 0.00 H new ATOM 0 HG3 GLU A 81 115.907 14.282 -7.015 1.00 0.00 H new ATOM 1279 N CYS A 82 113.361 14.169 -9.493 1.00 0.00 N ATOM 1280 CA CYS A 82 113.972 14.011 -10.807 1.00 0.00 C ATOM 1281 C CYS A 82 114.719 15.288 -11.184 1.00 0.00 C ATOM 1282 O CYS A 82 114.137 16.372 -11.201 1.00 0.00 O ATOM 1283 CB CYS A 82 112.893 13.722 -11.854 1.00 0.00 C ATOM 1284 SG CYS A 82 112.435 11.972 -11.785 1.00 0.00 S ATOM 0 H CYS A 82 112.564 14.805 -9.476 1.00 0.00 H new ATOM 0 HA CYS A 82 114.672 13.177 -10.775 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.018 14.345 -11.671 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.260 13.973 -12.849 1.00 0.00 H new ATOM 1289 N LEU A 83 116.006 15.155 -11.486 1.00 0.00 N ATOM 1290 CA LEU A 83 116.821 16.317 -11.827 1.00 0.00 C ATOM 1291 C LEU A 83 116.707 16.649 -13.317 1.00 0.00 C ATOM 1292 O LEU A 83 116.387 15.770 -14.114 1.00 0.00 O ATOM 1293 CB LEU A 83 118.285 16.047 -11.475 1.00 0.00 C ATOM 1294 CG LEU A 83 118.444 15.995 -9.954 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.814 15.412 -9.604 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.331 17.410 -9.382 1.00 0.00 C ATOM 0 H LEU A 83 116.504 14.265 -11.502 1.00 0.00 H new ATOM 0 HA LEU A 83 116.456 17.168 -11.253 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.608 15.105 -11.917 1.00 0.00 H new ATOM 0 HB3 LEU A 83 118.920 16.829 -11.891 1.00 0.00 H new ATOM 0 HG LEU A 83 117.662 15.366 -9.528 1.00 0.00 H new ATOM 0 HD11 LEU A 83 119.928 15.375 -8.521 1.00 0.00 H new ATOM 0 HD12 LEU A 83 119.896 14.405 -10.012 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.596 16.040 -10.029 1.00 0.00 H new ATOM 0 HD21 LEU A 83 118.444 17.375 -8.298 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.113 18.038 -9.808 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.355 17.826 -9.632 1.00 0.00 H new ATOM 1308 N PRO A 84 116.963 17.878 -13.720 1.00 0.00 N ATOM 1309 CA PRO A 84 116.915 18.250 -15.171 1.00 0.00 C ATOM 1310 C PRO A 84 117.740 17.313 -16.062 1.00 0.00 C ATOM 1311 O PRO A 84 117.517 17.242 -17.270 1.00 0.00 O ATOM 1312 CB PRO A 84 117.484 19.669 -15.217 1.00 0.00 C ATOM 1313 CG PRO A 84 117.256 20.231 -13.857 1.00 0.00 C ATOM 1314 CD PRO A 84 117.310 19.051 -12.888 1.00 0.00 C ATOM 0 HA PRO A 84 115.898 18.176 -15.557 1.00 0.00 H new ATOM 0 HB2 PRO A 84 118.545 19.659 -15.465 1.00 0.00 H new ATOM 0 HB3 PRO A 84 116.985 20.268 -15.978 1.00 0.00 H new ATOM 0 HG2 PRO A 84 118.017 20.971 -13.610 1.00 0.00 H new ATOM 0 HG3 PRO A 84 116.291 20.735 -13.802 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.300 18.945 -12.445 1.00 0.00 H new ATOM 0 HD3 PRO A 84 116.605 19.178 -12.066 1.00 0.00 H new ATOM 1322 N SER A 85 118.689 16.598 -15.463 1.00 0.00 N ATOM 1323 CA SER A 85 119.554 15.681 -16.210 1.00 0.00 C ATOM 1324 C SER A 85 118.882 14.337 -16.533 1.00 0.00 C ATOM 1325 O SER A 85 119.533 13.446 -17.078 1.00 0.00 O ATOM 1326 CB SER A 85 120.829 15.424 -15.407 1.00 0.00 C ATOM 1327 OG SER A 85 120.501 14.695 -14.233 1.00 0.00 O ATOM 0 H SER A 85 118.881 16.634 -14.462 1.00 0.00 H new ATOM 0 HA SER A 85 119.777 16.162 -17.162 1.00 0.00 H new ATOM 0 HB2 SER A 85 121.546 14.865 -16.009 1.00 0.00 H new ATOM 0 HB3 SER A 85 121.303 16.369 -15.142 1.00 0.00 H new ATOM 0 HG SER A 85 121.091 13.917 -14.156 1.00 0.00 H new ATOM 1333 N ASP A 86 117.608 14.176 -16.169 1.00 0.00 N ATOM 1334 CA ASP A 86 116.883 12.922 -16.357 1.00 0.00 C ATOM 1335 C ASP A 86 117.509 11.803 -15.527 1.00 0.00 C ATOM 1336 O ASP A 86 117.594 10.657 -15.967 1.00 0.00 O ATOM 1337 CB ASP A 86 116.845 12.529 -17.840 1.00 0.00 C ATOM 1338 CG ASP A 86 116.161 13.618 -18.663 1.00 0.00 C ATOM 1339 OD1 ASP A 86 115.276 14.272 -18.135 1.00 0.00 O ATOM 1340 OD2 ASP A 86 116.535 13.783 -19.813 1.00 0.00 O ATOM 0 H ASP A 86 117.052 14.913 -15.736 1.00 0.00 H new ATOM 0 HA ASP A 86 115.859 13.073 -16.015 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.859 12.370 -18.207 1.00 0.00 H new ATOM 0 HB3 ASP A 86 116.312 11.586 -17.959 1.00 0.00 H new ATOM 1345 N ASN A 87 117.922 12.143 -14.309 1.00 0.00 N ATOM 1346 CA ASN A 87 118.419 11.153 -13.361 1.00 0.00 C ATOM 1347 C ASN A 87 117.473 11.079 -12.169 1.00 0.00 C ATOM 1348 O ASN A 87 117.121 12.107 -11.588 1.00 0.00 O ATOM 1349 CB ASN A 87 119.821 11.537 -12.881 1.00 0.00 C ATOM 1350 CG ASN A 87 120.801 11.535 -14.053 1.00 0.00 C ATOM 1351 OD1 ASN A 87 121.610 12.453 -14.186 1.00 0.00 O ATOM 1352 ND2 ASN A 87 120.781 10.552 -14.911 1.00 0.00 N ATOM 0 H ASN A 87 117.922 13.100 -13.956 1.00 0.00 H new ATOM 0 HA ASN A 87 118.470 10.181 -13.852 1.00 0.00 H new ATOM 0 HB2 ASN A 87 119.797 12.524 -12.420 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.156 10.836 -12.117 1.00 0.00 H new ATOM 0 HD21 ASN A 87 121.436 10.544 -15.693 1.00 0.00 H new ATOM 0 HD22 ASN A 87 120.110 9.792 -14.800 1.00 0.00 H new ATOM 1359 N ALA A 88 117.043 9.871 -11.829 1.00 0.00 N ATOM 1360 CA ALA A 88 116.132 9.685 -10.708 1.00 0.00 C ATOM 1361 C ALA A 88 116.912 9.310 -9.454 1.00 0.00 C ATOM 1362 O ALA A 88 117.643 8.318 -9.444 1.00 0.00 O ATOM 1363 CB ALA A 88 115.123 8.582 -11.033 1.00 0.00 C ATOM 0 H ALA A 88 117.308 9.011 -12.309 1.00 0.00 H new ATOM 0 HA ALA A 88 115.600 10.620 -10.531 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.445 8.449 -10.190 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.551 8.861 -11.918 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.653 7.649 -11.223 1.00 0.00 H new ATOM 1369 N VAL A 89 116.741 10.092 -8.390 1.00 0.00 N ATOM 1370 CA VAL A 89 117.447 9.829 -7.139 1.00 0.00 C ATOM 1371 C VAL A 89 116.504 9.902 -5.939 1.00 0.00 C ATOM 1372 O VAL A 89 115.455 10.549 -5.984 1.00 0.00 O ATOM 1373 CB VAL A 89 118.580 10.841 -6.946 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.603 10.688 -8.073 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.011 12.262 -6.966 1.00 0.00 C ATOM 0 H VAL A 89 116.126 10.905 -8.369 1.00 0.00 H new ATOM 0 HA VAL A 89 117.856 8.821 -7.201 1.00 0.00 H new ATOM 0 HB VAL A 89 119.065 10.658 -5.987 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.408 11.409 -7.934 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.013 9.678 -8.057 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.117 10.867 -9.032 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.820 12.980 -6.828 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.522 12.445 -7.923 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.285 12.375 -6.161 1.00 0.00 H new ATOM 1385 N PHE A 90 116.916 9.238 -4.865 1.00 0.00 N ATOM 1386 CA PHE A 90 116.164 9.201 -3.615 1.00 0.00 C ATOM 1387 C PHE A 90 116.947 9.913 -2.515 1.00 0.00 C ATOM 1388 O PHE A 90 118.115 9.614 -2.287 1.00 0.00 O ATOM 1389 CB PHE A 90 115.945 7.736 -3.225 1.00 0.00 C ATOM 1390 CG PHE A 90 115.240 7.526 -1.905 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.855 7.709 -1.808 1.00 0.00 C ATOM 1392 CD2 PHE A 90 115.974 7.127 -0.782 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.205 7.492 -0.585 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.325 6.912 0.440 1.00 0.00 C ATOM 1395 CZ PHE A 90 113.941 7.093 0.537 1.00 0.00 C ATOM 0 H PHE A 90 117.786 8.707 -4.836 1.00 0.00 H new ATOM 0 HA PHE A 90 115.206 9.704 -3.743 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.367 7.249 -4.010 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.913 7.237 -3.186 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.288 8.017 -2.674 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.042 6.985 -0.858 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.137 7.633 -0.508 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.892 6.607 1.307 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.440 6.925 1.479 1.00 0.00 H new ATOM 1405 N VAL A 91 116.305 10.854 -1.833 1.00 0.00 N ATOM 1406 CA VAL A 91 116.952 11.587 -0.746 1.00 0.00 C ATOM 1407 C VAL A 91 116.370 11.130 0.585 1.00 0.00 C ATOM 1408 O VAL A 91 115.154 11.094 0.751 1.00 0.00 O ATOM 1409 CB VAL A 91 116.715 13.096 -0.919 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.419 13.900 0.185 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.250 13.543 -2.283 1.00 0.00 C ATOM 0 H VAL A 91 115.339 11.129 -2.011 1.00 0.00 H new ATOM 0 HA VAL A 91 118.024 11.390 -0.766 1.00 0.00 H new ATOM 0 HB VAL A 91 115.643 13.282 -0.853 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.233 14.964 0.036 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.033 13.597 1.158 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.492 13.710 0.145 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.082 14.613 -2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.318 13.334 -2.341 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.731 13.001 -3.073 1.00 0.00 H new ATOM 1421 N ALA A 92 117.237 10.804 1.538 1.00 0.00 N ATOM 1422 CA ALA A 92 116.772 10.376 2.858 1.00 0.00 C ATOM 1423 C ALA A 92 116.859 11.527 3.865 1.00 0.00 C ATOM 1424 O ALA A 92 117.655 12.443 3.671 1.00 0.00 O ATOM 1425 CB ALA A 92 117.616 9.200 3.352 1.00 0.00 C ATOM 0 H ALA A 92 118.251 10.826 1.427 1.00 0.00 H new ATOM 0 HA ALA A 92 115.730 10.067 2.770 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.264 8.887 4.335 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.526 8.369 2.653 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.660 9.505 3.421 1.00 0.00 H new ATOM 1431 N PRO A 93 116.073 11.513 4.923 1.00 0.00 N ATOM 1432 CA PRO A 93 116.128 12.599 5.952 1.00 0.00 C ATOM 1433 C PRO A 93 117.549 12.917 6.412 1.00 0.00 C ATOM 1434 O PRO A 93 117.834 14.036 6.837 1.00 0.00 O ATOM 1435 CB PRO A 93 115.300 12.061 7.121 1.00 0.00 C ATOM 1436 CG PRO A 93 114.375 11.051 6.535 1.00 0.00 C ATOM 1437 CD PRO A 93 115.035 10.517 5.264 1.00 0.00 C ATOM 0 HA PRO A 93 115.748 13.536 5.545 1.00 0.00 H new ATOM 0 HB2 PRO A 93 115.941 11.610 7.879 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.745 12.863 7.608 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.191 10.242 7.242 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.409 11.501 6.307 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.472 9.533 5.430 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.310 10.411 4.457 1.00 0.00 H new ATOM 1445 N ASP A 94 118.435 11.933 6.325 1.00 0.00 N ATOM 1446 CA ASP A 94 119.812 12.118 6.779 1.00 0.00 C ATOM 1447 C ASP A 94 120.574 13.172 5.960 1.00 0.00 C ATOM 1448 O ASP A 94 121.656 13.599 6.362 1.00 0.00 O ATOM 1449 CB ASP A 94 120.553 10.772 6.726 1.00 0.00 C ATOM 1450 CG ASP A 94 120.454 10.117 5.342 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.026 10.775 4.408 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.822 8.957 5.233 1.00 0.00 O ATOM 0 H ASP A 94 118.231 11.007 5.949 1.00 0.00 H new ATOM 0 HA ASP A 94 119.770 12.487 7.804 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.602 10.925 6.981 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.137 10.099 7.476 1.00 0.00 H new ATOM 1457 N GLY A 95 120.021 13.596 4.822 1.00 0.00 N ATOM 1458 CA GLY A 95 120.706 14.553 3.948 1.00 0.00 C ATOM 1459 C GLY A 95 121.606 13.873 2.905 1.00 0.00 C ATOM 1460 O GLY A 95 122.377 14.545 2.219 1.00 0.00 O ATOM 0 H GLY A 95 119.107 13.295 4.485 1.00 0.00 H new ATOM 0 HA2 GLY A 95 119.964 15.165 3.436 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.309 15.226 4.557 1.00 0.00 H new ATOM 1464 N THR A 96 121.513 12.550 2.784 1.00 0.00 N ATOM 1465 CA THR A 96 122.315 11.795 1.836 1.00 0.00 C ATOM 1466 C THR A 96 121.483 11.496 0.599 1.00 0.00 C ATOM 1467 O THR A 96 120.296 11.186 0.707 1.00 0.00 O ATOM 1468 CB THR A 96 122.757 10.479 2.480 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.452 10.755 3.688 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.673 9.705 1.527 1.00 0.00 C ATOM 0 H THR A 96 120.880 11.977 3.341 1.00 0.00 H new ATOM 0 HA THR A 96 123.193 12.377 1.555 1.00 0.00 H new ATOM 0 HB THR A 96 121.876 9.873 2.693 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.734 9.913 4.103 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.981 8.771 1.997 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.137 9.487 0.603 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.554 10.305 1.302 1.00 0.00 H new ATOM 1478 N THR A 97 122.103 11.593 -0.571 1.00 0.00 N ATOM 1479 CA THR A 97 121.406 11.286 -1.813 1.00 0.00 C ATOM 1480 C THR A 97 121.850 9.928 -2.340 1.00 0.00 C ATOM 1481 O THR A 97 123.042 9.638 -2.437 1.00 0.00 O ATOM 1482 CB THR A 97 121.699 12.365 -2.858 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.381 13.641 -2.320 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.856 12.111 -4.109 1.00 0.00 C ATOM 0 H THR A 97 123.076 11.878 -0.685 1.00 0.00 H new ATOM 0 HA THR A 97 120.334 11.259 -1.616 1.00 0.00 H new ATOM 0 HB THR A 97 122.756 12.335 -3.124 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.570 14.334 -2.987 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.066 12.881 -4.852 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.102 11.132 -4.521 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.798 12.139 -3.847 1.00 0.00 H new ATOM 1492 N TYR A 98 120.868 9.103 -2.676 1.00 0.00 N ATOM 1493 CA TYR A 98 121.117 7.773 -3.213 1.00 0.00 C ATOM 1494 C TYR A 98 120.579 7.702 -4.638 1.00 0.00 C ATOM 1495 O TYR A 98 119.592 8.357 -4.960 1.00 0.00 O ATOM 1496 CB TYR A 98 120.403 6.729 -2.350 1.00 0.00 C ATOM 1497 CG TYR A 98 120.815 6.730 -0.893 1.00 0.00 C ATOM 1498 CD1 TYR A 98 121.898 5.951 -0.468 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.105 7.502 0.035 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.271 5.947 0.884 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.479 7.499 1.386 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.561 6.721 1.811 1.00 0.00 C ATOM 1503 OH TYR A 98 121.931 6.714 3.143 1.00 0.00 O ATOM 0 H TYR A 98 119.879 9.336 -2.584 1.00 0.00 H new ATOM 0 HA TYR A 98 122.188 7.573 -3.211 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.328 6.900 -2.411 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.593 5.740 -2.767 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.446 5.353 -1.181 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.267 8.101 -0.291 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.107 5.346 1.211 1.00 0.00 H new ATOM 0 HE2 TYR A 98 119.932 8.098 2.099 1.00 0.00 H new ATOM 0 HH TYR A 98 121.499 7.462 3.606 1.00 0.00 H new ATOM 1513 N ALA A 99 121.220 6.910 -5.488 1.00 0.00 N ATOM 1514 CA ALA A 99 120.790 6.790 -6.878 1.00 0.00 C ATOM 1515 C ALA A 99 119.724 5.707 -7.022 1.00 0.00 C ATOM 1516 O ALA A 99 119.911 4.577 -6.570 1.00 0.00 O ATOM 1517 CB ALA A 99 121.999 6.457 -7.759 1.00 0.00 C ATOM 0 H ALA A 99 122.033 6.345 -5.244 1.00 0.00 H new ATOM 0 HA ALA A 99 120.357 7.739 -7.196 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.679 6.367 -8.797 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.740 7.252 -7.675 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.439 5.515 -7.432 1.00 0.00 H new ATOM 1523 N LEU A 100 118.607 6.060 -7.652 1.00 0.00 N ATOM 1524 CA LEU A 100 117.529 5.102 -7.865 1.00 0.00 C ATOM 1525 C LEU A 100 117.752 4.333 -9.159 1.00 0.00 C ATOM 1526 O LEU A 100 117.707 3.102 -9.178 1.00 0.00 O ATOM 1527 CB LEU A 100 116.180 5.818 -7.951 1.00 0.00 C ATOM 1528 CG LEU A 100 115.730 6.274 -6.564 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.664 7.359 -6.723 1.00 0.00 C ATOM 1530 CD2 LEU A 100 115.128 5.084 -5.812 1.00 0.00 C ATOM 0 H LEU A 100 118.426 6.994 -8.021 1.00 0.00 H new ATOM 0 HA LEU A 100 117.524 4.413 -7.020 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.259 6.678 -8.616 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.433 5.150 -8.381 1.00 0.00 H new ATOM 0 HG LEU A 100 116.581 6.666 -6.007 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.335 7.693 -5.739 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.083 8.203 -7.271 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.814 6.956 -7.273 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.806 5.405 -4.822 1.00 0.00 H new ATOM 0 HD22 LEU A 100 114.271 4.699 -6.366 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.878 4.299 -5.713 1.00 0.00 H new ATOM 1542 N ASN A 101 117.989 5.068 -10.245 1.00 0.00 N ATOM 1543 CA ASN A 101 118.104 4.442 -11.566 1.00 0.00 C ATOM 1544 C ASN A 101 119.560 4.329 -12.023 1.00 0.00 C ATOM 1545 O ASN A 101 120.464 4.947 -11.460 1.00 0.00 O ATOM 1546 CB ASN A 101 117.262 5.211 -12.593 1.00 0.00 C ATOM 1547 CG ASN A 101 117.862 6.576 -12.918 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.889 6.960 -12.361 1.00 0.00 O ATOM 1549 ND2 ASN A 101 117.278 7.336 -13.804 1.00 0.00 N ATOM 0 H ASN A 101 118.104 6.081 -10.240 1.00 0.00 H new ATOM 0 HA ASN A 101 117.718 3.426 -11.486 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.181 4.624 -13.508 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.251 5.342 -12.207 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.673 8.248 -14.034 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.426 7.018 -14.266 1.00 0.00 H new ATOM 1556 N ASP A 102 119.770 3.531 -13.064 1.00 0.00 N ATOM 1557 CA ASP A 102 121.117 3.201 -13.517 1.00 0.00 C ATOM 1558 C ASP A 102 121.944 4.448 -13.818 1.00 0.00 C ATOM 1559 O ASP A 102 123.131 4.496 -13.500 1.00 0.00 O ATOM 1560 CB ASP A 102 121.041 2.332 -14.774 1.00 0.00 C ATOM 1561 CG ASP A 102 122.431 1.826 -15.143 1.00 0.00 C ATOM 1562 OD1 ASP A 102 122.844 0.826 -14.581 1.00 0.00 O ATOM 1563 OD2 ASP A 102 123.061 2.447 -15.983 1.00 0.00 O ATOM 0 H ASP A 102 119.024 3.100 -13.611 1.00 0.00 H new ATOM 0 HA ASP A 102 121.609 2.659 -12.709 1.00 0.00 H new ATOM 0 HB2 ASP A 102 120.372 1.489 -14.603 1.00 0.00 H new ATOM 0 HB3 ASP A 102 120.624 2.908 -15.600 1.00 0.00 H new ATOM 1568 N ARG A 103 121.327 5.454 -14.429 1.00 0.00 N ATOM 1569 CA ARG A 103 122.067 6.648 -14.833 1.00 0.00 C ATOM 1570 C ARG A 103 122.630 7.389 -13.622 1.00 0.00 C ATOM 1571 O ARG A 103 123.784 7.819 -13.631 1.00 0.00 O ATOM 1572 CB ARG A 103 121.163 7.555 -15.669 1.00 0.00 C ATOM 1573 CG ARG A 103 120.862 6.850 -16.995 1.00 0.00 C ATOM 1574 CD ARG A 103 120.041 7.765 -17.905 1.00 0.00 C ATOM 1575 NE ARG A 103 118.784 8.131 -17.252 1.00 0.00 N ATOM 1576 CZ ARG A 103 117.761 7.281 -17.087 1.00 0.00 C ATOM 1577 NH1 ARG A 103 117.807 6.036 -17.496 1.00 0.00 N ATOM 1578 NH2 ARG A 103 116.684 7.717 -16.496 1.00 0.00 N ATOM 0 H ARG A 103 120.332 5.470 -14.653 1.00 0.00 H new ATOM 0 HA ARG A 103 122.917 6.343 -15.443 1.00 0.00 H new ATOM 0 HB2 ARG A 103 120.237 7.766 -15.133 1.00 0.00 H new ATOM 0 HB3 ARG A 103 121.651 8.513 -15.851 1.00 0.00 H new ATOM 0 HG2 ARG A 103 121.794 6.575 -17.489 1.00 0.00 H new ATOM 0 HG3 ARG A 103 120.316 5.926 -16.808 1.00 0.00 H new ATOM 0 HD2 ARG A 103 120.612 8.663 -18.140 1.00 0.00 H new ATOM 0 HD3 ARG A 103 119.835 7.261 -18.850 1.00 0.00 H new ATOM 0 HE ARG A 103 118.681 9.084 -16.904 1.00 0.00 H new ATOM 0 HH11 ARG A 103 118.644 5.682 -17.959 1.00 0.00 H new ATOM 0 HH12 ARG A 103 117.006 5.422 -17.351 1.00 0.00 H new ATOM 0 HH21 ARG A 103 116.635 8.683 -16.173 1.00 0.00 H new ATOM 0 HH22 ARG A 103 115.890 7.092 -16.357 1.00 0.00 H new ATOM 1592 N ALA A 104 121.834 7.505 -12.564 1.00 0.00 N ATOM 1593 CA ALA A 104 122.312 8.123 -11.328 1.00 0.00 C ATOM 1594 C ALA A 104 123.500 7.348 -10.751 1.00 0.00 C ATOM 1595 O ALA A 104 124.419 7.938 -10.172 1.00 0.00 O ATOM 1596 CB ALA A 104 121.177 8.176 -10.305 1.00 0.00 C ATOM 0 H ALA A 104 120.866 7.184 -12.535 1.00 0.00 H new ATOM 0 HA ALA A 104 122.644 9.136 -11.555 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.537 8.637 -9.385 1.00 0.00 H new ATOM 0 HB2 ALA A 104 120.352 8.764 -10.707 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.831 7.164 -10.092 1.00 0.00 H new ATOM 1602 N GLU A 105 123.472 6.022 -10.882 1.00 0.00 N ATOM 1603 CA GLU A 105 124.598 5.203 -10.440 1.00 0.00 C ATOM 1604 C GLU A 105 125.849 5.540 -11.250 1.00 0.00 C ATOM 1605 O GLU A 105 126.940 5.664 -10.699 1.00 0.00 O ATOM 1606 CB GLU A 105 124.270 3.715 -10.595 1.00 0.00 C ATOM 1607 CG GLU A 105 123.082 3.352 -9.698 1.00 0.00 C ATOM 1608 CD GLU A 105 123.406 3.573 -8.219 1.00 0.00 C ATOM 1609 OE1 GLU A 105 124.575 3.674 -7.876 1.00 0.00 O ATOM 1610 OE2 GLU A 105 122.469 3.636 -7.441 1.00 0.00 O ATOM 0 H GLU A 105 122.694 5.499 -11.284 1.00 0.00 H new ATOM 0 HA GLU A 105 124.785 5.417 -9.388 1.00 0.00 H new ATOM 0 HB2 GLU A 105 124.034 3.491 -11.635 1.00 0.00 H new ATOM 0 HB3 GLU A 105 125.138 3.112 -10.328 1.00 0.00 H new ATOM 0 HG2 GLU A 105 122.218 3.955 -9.976 1.00 0.00 H new ATOM 0 HG3 GLU A 105 122.808 2.309 -9.859 1.00 0.00 H new ATOM 1617 N LYS A 106 125.680 5.726 -12.555 1.00 0.00 N ATOM 1618 CA LYS A 106 126.795 6.126 -13.415 1.00 0.00 C ATOM 1619 C LYS A 106 127.398 7.458 -12.961 1.00 0.00 C ATOM 1620 O LYS A 106 128.605 7.673 -13.077 1.00 0.00 O ATOM 1621 CB LYS A 106 126.321 6.249 -14.864 1.00 0.00 C ATOM 1622 CG LYS A 106 125.902 4.873 -15.384 1.00 0.00 C ATOM 1623 CD LYS A 106 125.290 5.012 -16.779 1.00 0.00 C ATOM 1624 CE LYS A 106 126.373 5.408 -17.786 1.00 0.00 C ATOM 1625 NZ LYS A 106 127.470 4.399 -17.765 1.00 0.00 N ATOM 0 H LYS A 106 124.790 5.608 -13.040 1.00 0.00 H new ATOM 0 HA LYS A 106 127.564 5.357 -13.343 1.00 0.00 H new ATOM 0 HB2 LYS A 106 125.483 6.943 -14.926 1.00 0.00 H new ATOM 0 HB3 LYS A 106 127.119 6.656 -15.485 1.00 0.00 H new ATOM 0 HG2 LYS A 106 126.766 4.209 -15.420 1.00 0.00 H new ATOM 0 HG3 LYS A 106 125.180 4.421 -14.703 1.00 0.00 H new ATOM 0 HD2 LYS A 106 124.829 4.071 -17.079 1.00 0.00 H new ATOM 0 HD3 LYS A 106 124.501 5.764 -16.766 1.00 0.00 H new ATOM 0 HE2 LYS A 106 125.946 5.475 -18.787 1.00 0.00 H new ATOM 0 HE3 LYS A 106 126.768 6.394 -17.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 127.785 4.209 -18.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 128.268 4.765 -17.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 127.123 3.518 -17.335 1.00 0.00 H new ATOM 1639 N ALA A 107 126.552 8.346 -12.442 1.00 0.00 N ATOM 1640 CA ALA A 107 127.005 9.637 -11.919 1.00 0.00 C ATOM 1641 C ALA A 107 127.811 9.510 -10.615 1.00 0.00 C ATOM 1642 O ALA A 107 128.280 10.515 -10.082 1.00 0.00 O ATOM 1643 CB ALA A 107 125.794 10.539 -11.671 1.00 0.00 C ATOM 0 H ALA A 107 125.546 8.196 -12.372 1.00 0.00 H new ATOM 0 HA ALA A 107 127.668 10.068 -12.669 1.00 0.00 H new ATOM 0 HB1 ALA A 107 126.130 11.500 -11.282 1.00 0.00 H new ATOM 0 HB2 ALA A 107 125.258 10.694 -12.607 1.00 0.00 H new ATOM 0 HB3 ALA A 107 125.130 10.066 -10.947 1.00 0.00 H new ATOM 1649 N GLY A 108 127.977 8.291 -10.103 1.00 0.00 N ATOM 1650 CA GLY A 108 128.768 8.069 -8.899 1.00 0.00 C ATOM 1651 C GLY A 108 128.017 8.410 -7.613 1.00 0.00 C ATOM 1652 O GLY A 108 128.645 8.693 -6.592 1.00 0.00 O ATOM 0 H GLY A 108 127.574 7.445 -10.505 1.00 0.00 H new ATOM 0 HA2 GLY A 108 129.079 7.025 -8.864 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.675 8.671 -8.952 1.00 0.00 H new ATOM 1656 N HIS A 109 126.684 8.389 -7.655 1.00 0.00 N ATOM 1657 CA HIS A 109 125.903 8.549 -6.433 1.00 0.00 C ATOM 1658 C HIS A 109 125.757 7.184 -5.747 1.00 0.00 C ATOM 1659 O HIS A 109 125.454 6.207 -6.437 1.00 0.00 O ATOM 1660 CB HIS A 109 124.517 9.103 -6.770 1.00 0.00 C ATOM 1661 CG HIS A 109 124.534 10.554 -7.166 1.00 0.00 C ATOM 1662 ND1 HIS A 109 125.429 11.460 -6.620 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.770 11.272 -8.054 1.00 0.00 C ATOM 1664 CE1 HIS A 109 125.187 12.659 -7.178 1.00 0.00 C ATOM 1665 NE2 HIS A 109 124.185 12.602 -8.059 1.00 0.00 N ATOM 0 H HIS A 109 126.134 8.265 -8.505 1.00 0.00 H new ATOM 0 HA HIS A 109 126.412 9.245 -5.766 1.00 0.00 H new ATOM 0 HB2 HIS A 109 124.087 8.517 -7.583 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.864 8.977 -5.907 1.00 0.00 H new ATOM 0 HD2 HIS A 109 122.970 10.867 -8.656 1.00 0.00 H new ATOM 0 HE1 HIS A 109 125.736 13.559 -6.942 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.805 13.368 -8.616 1.00 0.00 H new ATOM 1673 N PRO A 110 125.953 7.066 -4.447 1.00 0.00 N ATOM 1674 CA PRO A 110 125.856 5.733 -3.768 1.00 0.00 C ATOM 1675 C PRO A 110 124.459 5.124 -3.937 1.00 0.00 C ATOM 1676 O PRO A 110 123.489 5.871 -4.035 1.00 0.00 O ATOM 1677 CB PRO A 110 126.152 6.018 -2.289 1.00 0.00 C ATOM 1678 CG PRO A 110 126.789 7.365 -2.252 1.00 0.00 C ATOM 1679 CD PRO A 110 126.268 8.125 -3.469 1.00 0.00 C ATOM 0 HA PRO A 110 126.552 5.011 -4.195 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.237 6.002 -1.697 1.00 0.00 H new ATOM 0 HB3 PRO A 110 126.815 5.261 -1.870 1.00 0.00 H new ATOM 0 HG2 PRO A 110 126.536 7.889 -1.330 1.00 0.00 H new ATOM 0 HG3 PRO A 110 127.875 7.281 -2.283 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.385 8.715 -3.223 1.00 0.00 H new ATOM 0 HD3 PRO A 110 127.016 8.817 -3.857 1.00 0.00 H new ATOM 1687 N PRO A 111 124.322 3.815 -4.004 1.00 0.00 N ATOM 1688 CA PRO A 111 122.972 3.179 -4.119 1.00 0.00 C ATOM 1689 C PRO A 111 122.236 3.135 -2.781 1.00 0.00 C ATOM 1690 O PRO A 111 122.857 3.199 -1.720 1.00 0.00 O ATOM 1691 CB PRO A 111 123.270 1.773 -4.640 1.00 0.00 C ATOM 1692 CG PRO A 111 124.657 1.460 -4.188 1.00 0.00 C ATOM 1693 CD PRO A 111 125.384 2.790 -3.988 1.00 0.00 C ATOM 0 HA PRO A 111 122.310 3.742 -4.777 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.557 1.050 -4.245 1.00 0.00 H new ATOM 0 HB3 PRO A 111 123.194 1.734 -5.727 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.638 0.889 -3.259 1.00 0.00 H new ATOM 0 HG3 PRO A 111 125.173 0.848 -4.928 1.00 0.00 H new ATOM 0 HD2 PRO A 111 125.930 2.803 -3.045 1.00 0.00 H new ATOM 0 HD3 PRO A 111 126.112 2.964 -4.780 1.00 0.00 H new ATOM 1701 N ILE A 112 120.909 3.023 -2.835 1.00 0.00 N ATOM 1702 CA ILE A 112 120.104 2.963 -1.612 1.00 0.00 C ATOM 1703 C ILE A 112 120.444 1.734 -0.750 1.00 0.00 C ATOM 1704 O ILE A 112 120.048 1.695 0.413 1.00 0.00 O ATOM 1705 CB ILE A 112 118.600 2.983 -1.962 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.278 4.287 -2.700 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.744 2.921 -0.685 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.847 4.260 -3.251 1.00 0.00 C ATOM 0 H ILE A 112 120.372 2.972 -3.701 1.00 0.00 H new ATOM 0 HA ILE A 112 120.345 3.845 -1.018 1.00 0.00 H new ATOM 0 HB ILE A 112 118.375 2.118 -2.586 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.396 5.133 -2.022 1.00 0.00 H new ATOM 0 HG13 ILE A 112 118.985 4.432 -3.517 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.688 2.936 -0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.967 2.003 -0.142 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.970 3.780 -0.053 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.640 5.195 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.740 3.427 -3.946 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.143 4.138 -2.428 1.00 0.00 H new ATOM 1720 N THR A 113 121.205 0.770 -1.278 1.00 0.00 N ATOM 1721 CA THR A 113 121.424 -0.502 -0.583 1.00 0.00 C ATOM 1722 C THR A 113 121.718 -0.393 0.926 1.00 0.00 C ATOM 1723 O THR A 113 121.164 -1.204 1.671 1.00 0.00 O ATOM 1724 CB THR A 113 122.475 -1.363 -1.313 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.278 -2.723 -0.952 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.920 -0.972 -0.979 1.00 0.00 C ATOM 0 H THR A 113 121.677 0.845 -2.179 1.00 0.00 H new ATOM 0 HA THR A 113 120.460 -1.009 -0.625 1.00 0.00 H new ATOM 0 HB THR A 113 122.337 -1.200 -2.382 1.00 0.00 H new ATOM 0 HG1 THR A 113 122.939 -3.282 -1.411 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.607 -1.617 -1.526 1.00 0.00 H new ATOM 0 HG22 THR A 113 124.091 0.066 -1.265 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.090 -1.086 0.092 1.00 0.00 H new ATOM 1734 N PRO A 114 122.496 0.557 1.429 1.00 0.00 N ATOM 1735 CA PRO A 114 122.850 0.569 2.887 1.00 0.00 C ATOM 1736 C PRO A 114 121.616 0.655 3.786 1.00 0.00 C ATOM 1737 O PRO A 114 121.607 0.112 4.891 1.00 0.00 O ATOM 1738 CB PRO A 114 123.751 1.796 3.068 1.00 0.00 C ATOM 1739 CG PRO A 114 124.217 2.147 1.699 1.00 0.00 C ATOM 1740 CD PRO A 114 123.082 1.738 0.765 1.00 0.00 C ATOM 0 HA PRO A 114 123.347 -0.357 3.177 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.203 2.623 3.521 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.592 1.573 3.725 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.427 3.213 1.617 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.139 1.620 1.451 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.350 2.537 0.649 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.450 1.496 -0.232 1.00 0.00 H new ATOM 1748 N ILE A 115 120.577 1.337 3.311 1.00 0.00 N ATOM 1749 CA ILE A 115 119.337 1.482 4.083 1.00 0.00 C ATOM 1750 C ILE A 115 118.242 0.496 3.660 1.00 0.00 C ATOM 1751 O ILE A 115 117.114 0.610 4.130 1.00 0.00 O ATOM 1752 CB ILE A 115 118.781 2.913 3.989 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.726 3.388 2.529 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.655 3.865 4.811 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.935 4.699 2.415 1.00 0.00 C ATOM 0 H ILE A 115 120.564 1.797 2.401 1.00 0.00 H new ATOM 0 HA ILE A 115 119.613 1.257 5.113 1.00 0.00 H new ATOM 0 HB ILE A 115 117.767 2.913 4.388 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.738 3.534 2.150 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.261 2.622 1.909 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.256 4.877 4.741 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.658 3.548 5.854 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.674 3.849 4.424 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.908 5.018 1.373 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.917 4.542 2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.417 5.469 3.018 1.00 0.00 H new ATOM 1767 N ARG A 116 118.551 -0.462 2.787 1.00 0.00 N ATOM 1768 CA ARG A 116 117.554 -1.430 2.339 1.00 0.00 C ATOM 1769 C ARG A 116 117.319 -2.488 3.414 1.00 0.00 C ATOM 1770 O ARG A 116 118.259 -2.939 4.067 1.00 0.00 O ATOM 1771 CB ARG A 116 118.030 -2.096 1.047 1.00 0.00 C ATOM 1772 CG ARG A 116 116.912 -2.963 0.470 1.00 0.00 C ATOM 1773 CD ARG A 116 117.428 -3.700 -0.768 1.00 0.00 C ATOM 1774 NE ARG A 116 117.847 -2.737 -1.792 1.00 0.00 N ATOM 1775 CZ ARG A 116 118.580 -3.071 -2.865 1.00 0.00 C ATOM 1776 NH1 ARG A 116 118.982 -4.300 -3.083 1.00 0.00 N ATOM 1777 NH2 ARG A 116 118.904 -2.141 -3.721 1.00 0.00 N ATOM 0 H ARG A 116 119.477 -0.587 2.379 1.00 0.00 H new ATOM 0 HA ARG A 116 116.615 -0.909 2.153 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.325 -1.337 0.323 1.00 0.00 H new ATOM 0 HB3 ARG A 116 118.911 -2.707 1.245 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.570 -3.679 1.217 1.00 0.00 H new ATOM 0 HG3 ARG A 116 116.055 -2.343 0.207 1.00 0.00 H new ATOM 0 HD2 ARG A 116 118.267 -4.341 -0.496 1.00 0.00 H new ATOM 0 HD3 ARG A 116 116.648 -4.349 -1.166 1.00 0.00 H new ATOM 0 HE ARG A 116 117.566 -1.762 -1.683 1.00 0.00 H new ATOM 0 HH11 ARG A 116 118.739 -5.040 -2.425 1.00 0.00 H new ATOM 0 HH12 ARG A 116 119.538 -4.515 -3.910 1.00 0.00 H new ATOM 0 HH21 ARG A 116 118.601 -1.179 -3.568 1.00 0.00 H new ATOM 0 HH22 ARG A 116 119.461 -2.376 -4.543 1.00 0.00 H new ATOM 1791 N ALA A 117 116.061 -2.880 3.593 1.00 0.00 N ATOM 1792 CA ALA A 117 115.702 -3.824 4.644 1.00 0.00 C ATOM 1793 C ALA A 117 115.846 -5.269 4.181 1.00 0.00 C ATOM 1794 O ALA A 117 115.613 -5.587 3.015 1.00 0.00 O ATOM 1795 CB ALA A 117 114.251 -3.585 5.065 1.00 0.00 C ATOM 0 H ALA A 117 115.276 -2.559 3.026 1.00 0.00 H new ATOM 0 HA ALA A 117 116.381 -3.663 5.481 1.00 0.00 H new ATOM 0 HB1 ALA A 117 113.979 -4.290 5.851 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.143 -2.566 5.438 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.595 -3.728 4.207 1.00 0.00 H new ATOM 1801 N LYS A 118 116.226 -6.140 5.110 1.00 0.00 N ATOM 1802 CA LYS A 118 116.271 -7.571 4.834 1.00 0.00 C ATOM 1803 C LYS A 118 114.867 -8.158 4.947 1.00 0.00 C ATOM 1804 O LYS A 118 114.105 -7.788 5.840 1.00 0.00 O ATOM 1805 CB LYS A 118 117.198 -8.263 5.838 1.00 0.00 C ATOM 1806 CG LYS A 118 117.351 -9.744 5.480 1.00 0.00 C ATOM 1807 CD LYS A 118 118.275 -9.891 4.268 1.00 0.00 C ATOM 1808 CE LYS A 118 118.499 -11.375 3.972 1.00 0.00 C ATOM 1809 NZ LYS A 118 117.188 -12.042 3.733 1.00 0.00 N ATOM 0 H LYS A 118 116.506 -5.882 6.056 1.00 0.00 H new ATOM 0 HA LYS A 118 116.651 -7.730 3.825 1.00 0.00 H new ATOM 0 HB2 LYS A 118 118.174 -7.778 5.837 1.00 0.00 H new ATOM 0 HB3 LYS A 118 116.794 -8.164 6.846 1.00 0.00 H new ATOM 0 HG2 LYS A 118 117.759 -10.293 6.329 1.00 0.00 H new ATOM 0 HG3 LYS A 118 116.375 -10.177 5.260 1.00 0.00 H new ATOM 0 HD2 LYS A 118 117.835 -9.399 3.401 1.00 0.00 H new ATOM 0 HD3 LYS A 118 119.229 -9.401 4.463 1.00 0.00 H new ATOM 0 HE2 LYS A 118 119.141 -11.489 3.098 1.00 0.00 H new ATOM 0 HE3 LYS A 118 119.012 -11.849 4.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 117.330 -12.885 3.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 116.771 -12.324 4.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 116.547 -11.383 3.248 1.00 0.00 H new ATOM 1823 N GLY A 119 114.527 -9.071 4.042 1.00 0.00 N ATOM 1824 CA GLY A 119 113.208 -9.695 4.064 1.00 0.00 C ATOM 1825 C GLY A 119 113.264 -11.092 4.672 1.00 0.00 C ATOM 1826 O GLY A 119 114.343 -11.662 4.842 1.00 0.00 O ATOM 0 H GLY A 119 115.139 -9.393 3.292 1.00 0.00 H new ATOM 0 HA2 GLY A 119 112.520 -9.074 4.637 1.00 0.00 H new ATOM 0 HA3 GLY A 119 112.814 -9.754 3.049 1.00 0.00 H new ATOM 1830 N SER A 120 112.099 -11.641 4.997 1.00 0.00 N ATOM 1831 CA SER A 120 112.033 -12.990 5.552 1.00 0.00 C ATOM 1832 C SER A 120 112.674 -13.996 4.597 1.00 0.00 C ATOM 1833 O SER A 120 113.358 -14.924 5.029 1.00 0.00 O ATOM 1834 CB SER A 120 110.577 -13.380 5.804 1.00 0.00 C ATOM 1835 OG SER A 120 109.967 -12.398 6.631 1.00 0.00 O ATOM 0 H SER A 120 111.196 -11.180 4.888 1.00 0.00 H new ATOM 0 HA SER A 120 112.580 -13.002 6.494 1.00 0.00 H new ATOM 0 HB2 SER A 120 110.041 -13.461 4.859 1.00 0.00 H new ATOM 0 HB3 SER A 120 110.528 -14.358 6.283 1.00 0.00 H new ATOM 0 HG SER A 120 109.032 -12.643 6.794 1.00 0.00 H new ATOM 1841 N GLY A 121 112.447 -13.807 3.300 1.00 0.00 N ATOM 1842 CA GLY A 121 113.045 -14.672 2.292 1.00 0.00 C ATOM 1843 C GLY A 121 113.320 -13.891 1.012 1.00 0.00 C ATOM 1844 O GLY A 121 112.832 -12.774 0.840 1.00 0.00 O ATOM 0 H GLY A 121 111.856 -13.065 2.925 1.00 0.00 H new ATOM 0 HA2 GLY A 121 113.974 -15.096 2.673 1.00 0.00 H new ATOM 0 HA3 GLY A 121 112.378 -15.507 2.079 1.00 0.00 H new ATOM 1848 N GLY A 122 114.103 -14.483 0.118 1.00 0.00 N ATOM 1849 CA GLY A 122 114.425 -13.834 -1.149 1.00 0.00 C ATOM 1850 C GLY A 122 115.447 -12.711 -0.970 1.00 0.00 C ATOM 1851 O GLY A 122 115.406 -11.711 -1.685 1.00 0.00 O ATOM 0 H GLY A 122 114.524 -15.403 0.244 1.00 0.00 H new ATOM 0 HA2 GLY A 122 114.817 -14.574 -1.847 1.00 0.00 H new ATOM 0 HA3 GLY A 122 113.515 -13.429 -1.592 1.00 0.00 H new ATOM 1855 N GLY A 123 116.361 -12.878 -0.017 1.00 0.00 N ATOM 1856 CA GLY A 123 117.408 -11.887 0.203 1.00 0.00 C ATOM 1857 C GLY A 123 116.836 -10.573 0.726 1.00 0.00 C ATOM 1858 O GLY A 123 116.221 -10.523 1.790 1.00 0.00 O ATOM 0 H GLY A 123 116.397 -13.682 0.609 1.00 0.00 H new ATOM 0 HA2 GLY A 123 118.135 -12.277 0.915 1.00 0.00 H new ATOM 0 HA3 GLY A 123 117.941 -11.707 -0.730 1.00 0.00 H new ATOM 1862 N TYR A 124 117.051 -9.501 -0.028 1.00 0.00 N ATOM 1863 CA TYR A 124 116.612 -8.175 0.395 1.00 0.00 C ATOM 1864 C TYR A 124 115.328 -7.769 -0.320 1.00 0.00 C ATOM 1865 O TYR A 124 114.991 -8.307 -1.375 1.00 0.00 O ATOM 1866 CB TYR A 124 117.710 -7.154 0.104 1.00 0.00 C ATOM 1867 CG TYR A 124 118.822 -7.170 1.124 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.425 -8.382 1.480 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.262 -5.973 1.702 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.466 -8.398 2.416 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.301 -5.989 2.639 1.00 0.00 C ATOM 1872 CZ TYR A 124 120.903 -7.201 2.996 1.00 0.00 C ATOM 1873 OH TYR A 124 121.929 -7.217 3.919 1.00 0.00 O ATOM 0 H TYR A 124 117.524 -9.523 -0.931 1.00 0.00 H new ATOM 0 HA TYR A 124 116.412 -8.205 1.466 1.00 0.00 H new ATOM 0 HB2 TYR A 124 118.128 -7.351 -0.883 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.271 -6.157 0.071 1.00 0.00 H new ATOM 0 HD1 TYR A 124 119.087 -9.305 1.033 1.00 0.00 H new ATOM 0 HD2 TYR A 124 118.799 -5.037 1.425 1.00 0.00 H new ATOM 0 HE1 TYR A 124 120.932 -9.333 2.690 1.00 0.00 H new ATOM 0 HE2 TYR A 124 120.638 -5.066 3.087 1.00 0.00 H new ATOM 0 HH TYR A 124 122.110 -6.303 4.223 1.00 0.00 H new ATOM 1883 N ILE A 125 114.616 -6.814 0.271 1.00 0.00 N ATOM 1884 CA ILE A 125 113.332 -6.378 -0.266 1.00 0.00 C ATOM 1885 C ILE A 125 113.546 -5.431 -1.448 1.00 0.00 C ATOM 1886 O ILE A 125 114.354 -4.505 -1.382 1.00 0.00 O ATOM 1887 CB ILE A 125 112.530 -5.704 0.855 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.286 -6.722 1.976 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.178 -5.210 0.333 1.00 0.00 C ATOM 1890 CD1 ILE A 125 111.787 -6.011 3.237 1.00 0.00 C ATOM 0 H ILE A 125 114.906 -6.329 1.120 1.00 0.00 H new ATOM 0 HA ILE A 125 112.770 -7.236 -0.634 1.00 0.00 H new ATOM 0 HB ILE A 125 113.098 -4.851 1.227 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.553 -7.461 1.653 1.00 0.00 H new ATOM 0 HG13 ILE A 125 113.208 -7.261 2.194 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.626 -4.736 1.144 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.339 -4.488 -0.467 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.605 -6.055 -0.050 1.00 0.00 H new ATOM 0 HD11 ILE A 125 111.618 -6.744 4.025 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.534 -5.289 3.567 1.00 0.00 H new ATOM 0 HD13 ILE A 125 110.854 -5.492 3.017 1.00 0.00 H new ATOM 1902 N SER A 126 112.807 -5.680 -2.526 1.00 0.00 N ATOM 1903 CA SER A 126 112.964 -4.916 -3.761 1.00 0.00 C ATOM 1904 C SER A 126 112.578 -3.454 -3.579 1.00 0.00 C ATOM 1905 O SER A 126 111.611 -3.129 -2.890 1.00 0.00 O ATOM 1906 CB SER A 126 112.096 -5.532 -4.858 1.00 0.00 C ATOM 1907 OG SER A 126 112.491 -6.882 -5.062 1.00 0.00 O ATOM 0 H SER A 126 112.092 -6.406 -2.569 1.00 0.00 H new ATOM 0 HA SER A 126 114.017 -4.954 -4.041 1.00 0.00 H new ATOM 0 HB2 SER A 126 111.044 -5.487 -4.575 1.00 0.00 H new ATOM 0 HB3 SER A 126 112.202 -4.966 -5.783 1.00 0.00 H new ATOM 0 HG SER A 126 111.936 -7.283 -5.764 1.00 0.00 H new ATOM 1913 N LEU A 127 113.353 -2.581 -4.212 1.00 0.00 N ATOM 1914 CA LEU A 127 113.010 -1.160 -4.284 1.00 0.00 C ATOM 1915 C LEU A 127 112.215 -0.819 -5.557 1.00 0.00 C ATOM 1916 O LEU A 127 112.001 0.355 -5.855 1.00 0.00 O ATOM 1917 CB LEU A 127 114.287 -0.311 -4.266 1.00 0.00 C ATOM 1918 CG LEU A 127 115.141 -0.645 -3.039 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.436 0.168 -3.086 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.374 -0.293 -1.762 1.00 0.00 C ATOM 0 H LEU A 127 114.223 -2.829 -4.683 1.00 0.00 H new ATOM 0 HA LEU A 127 112.387 -0.939 -3.417 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.862 -0.490 -5.175 1.00 0.00 H new ATOM 0 HB3 LEU A 127 114.026 0.747 -4.257 1.00 0.00 H new ATOM 0 HG LEU A 127 115.372 -1.710 -3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 127 117.046 -0.068 -2.214 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.988 -0.080 -3.992 1.00 0.00 H new ATOM 0 HD13 LEU A 127 116.198 1.232 -3.085 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.986 -0.533 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 127 114.141 0.772 -1.759 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.448 -0.867 -1.724 1.00 0.00 H new ATOM 1932 N GLY A 128 111.778 -1.829 -6.314 1.00 0.00 N ATOM 1933 CA GLY A 128 111.123 -1.596 -7.599 1.00 0.00 C ATOM 1934 C GLY A 128 110.014 -0.548 -7.516 1.00 0.00 C ATOM 1935 O GLY A 128 109.941 0.346 -8.359 1.00 0.00 O ATOM 0 H GLY A 128 111.867 -2.812 -6.058 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.867 -1.274 -8.328 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.704 -2.534 -7.964 1.00 0.00 H new ATOM 1939 N ALA A 129 109.168 -0.639 -6.494 1.00 0.00 N ATOM 1940 CA ALA A 129 108.037 0.278 -6.376 1.00 0.00 C ATOM 1941 C ALA A 129 108.520 1.723 -6.298 1.00 0.00 C ATOM 1942 O ALA A 129 108.022 2.599 -7.008 1.00 0.00 O ATOM 1943 CB ALA A 129 107.219 -0.057 -5.128 1.00 0.00 C ATOM 0 H ALA A 129 109.241 -1.328 -5.745 1.00 0.00 H new ATOM 0 HA ALA A 129 107.411 0.165 -7.261 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.378 0.632 -5.048 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.846 -1.078 -5.201 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.849 0.036 -4.244 1.00 0.00 H new ATOM 1949 N LEU A 130 109.516 1.964 -5.454 1.00 0.00 N ATOM 1950 CA LEU A 130 110.044 3.312 -5.281 1.00 0.00 C ATOM 1951 C LEU A 130 110.570 3.852 -6.608 1.00 0.00 C ATOM 1952 O LEU A 130 110.323 5.004 -6.967 1.00 0.00 O ATOM 1953 CB LEU A 130 111.166 3.287 -4.243 1.00 0.00 C ATOM 1954 CG LEU A 130 111.652 4.710 -3.967 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.561 5.491 -3.232 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.911 4.652 -3.099 1.00 0.00 C ATOM 0 H LEU A 130 109.971 1.251 -4.884 1.00 0.00 H new ATOM 0 HA LEU A 130 109.244 3.967 -4.936 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.809 2.830 -3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.993 2.675 -4.603 1.00 0.00 H new ATOM 0 HG LEU A 130 111.878 5.208 -4.910 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.909 6.505 -3.036 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.663 5.528 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.333 4.997 -2.288 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.262 5.664 -2.899 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.681 4.155 -2.157 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.688 4.095 -3.622 1.00 0.00 H new ATOM 1968 N LEU A 131 111.269 3.001 -7.350 1.00 0.00 N ATOM 1969 CA LEU A 131 111.831 3.409 -8.632 1.00 0.00 C ATOM 1970 C LEU A 131 110.725 3.860 -9.577 1.00 0.00 C ATOM 1971 O LEU A 131 110.848 4.886 -10.243 1.00 0.00 O ATOM 1972 CB LEU A 131 112.605 2.241 -9.252 1.00 0.00 C ATOM 1973 CG LEU A 131 113.277 2.682 -10.557 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.431 3.635 -10.244 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.821 1.453 -11.288 1.00 0.00 C ATOM 0 H LEU A 131 111.459 2.033 -7.090 1.00 0.00 H new ATOM 0 HA LEU A 131 112.511 4.245 -8.469 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.358 1.882 -8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.928 1.409 -9.447 1.00 0.00 H new ATOM 0 HG LEU A 131 112.546 3.191 -11.186 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.907 3.947 -11.173 1.00 0.00 H new ATOM 0 HD12 LEU A 131 114.048 4.511 -9.721 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.162 3.127 -9.615 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.299 1.764 -12.217 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.551 0.947 -10.656 1.00 0.00 H new ATOM 0 HD23 LEU A 131 113.001 0.771 -11.513 1.00 0.00 H new ATOM 1987 N SER A 132 109.630 3.109 -9.609 1.00 0.00 N ATOM 1988 CA SER A 132 108.538 3.416 -10.525 1.00 0.00 C ATOM 1989 C SER A 132 108.003 4.819 -10.270 1.00 0.00 C ATOM 1990 O SER A 132 107.795 5.593 -11.203 1.00 0.00 O ATOM 1991 CB SER A 132 107.411 2.397 -10.357 1.00 0.00 C ATOM 1992 OG SER A 132 106.446 2.595 -11.382 1.00 0.00 O ATOM 0 H SER A 132 109.475 2.292 -9.018 1.00 0.00 H new ATOM 0 HA SER A 132 108.920 3.366 -11.545 1.00 0.00 H new ATOM 0 HB2 SER A 132 107.810 1.384 -10.407 1.00 0.00 H new ATOM 0 HB3 SER A 132 106.947 2.508 -9.377 1.00 0.00 H new ATOM 0 HG SER A 132 105.722 1.943 -11.280 1.00 0.00 H new ATOM 1998 N THR A 133 107.817 5.156 -8.998 1.00 0.00 N ATOM 1999 CA THR A 133 107.264 6.460 -8.649 1.00 0.00 C ATOM 2000 C THR A 133 108.164 7.578 -9.162 1.00 0.00 C ATOM 2001 O THR A 133 107.696 8.526 -9.799 1.00 0.00 O ATOM 2002 CB THR A 133 107.113 6.575 -7.130 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.357 5.474 -6.646 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.395 7.880 -6.782 1.00 0.00 C ATOM 0 H THR A 133 108.037 4.556 -8.203 1.00 0.00 H new ATOM 0 HA THR A 133 106.284 6.556 -9.117 1.00 0.00 H new ATOM 0 HB THR A 133 108.100 6.572 -6.667 1.00 0.00 H new ATOM 0 HG1 THR A 133 106.261 5.545 -5.673 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.289 7.959 -5.700 1.00 0.00 H new ATOM 0 HG22 THR A 133 106.976 8.725 -7.153 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.408 7.887 -7.245 1.00 0.00 H new ATOM 2012 N THR A 134 109.463 7.448 -8.914 1.00 0.00 N ATOM 2013 CA THR A 134 110.404 8.487 -9.319 1.00 0.00 C ATOM 2014 C THR A 134 110.413 8.650 -10.837 1.00 0.00 C ATOM 2015 O THR A 134 110.455 9.769 -11.346 1.00 0.00 O ATOM 2016 CB THR A 134 111.809 8.159 -8.816 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.748 7.868 -7.427 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.726 9.362 -9.045 1.00 0.00 C ATOM 0 H THR A 134 109.884 6.647 -8.442 1.00 0.00 H new ATOM 0 HA THR A 134 110.082 9.428 -8.874 1.00 0.00 H new ATOM 0 HB THR A 134 112.202 7.297 -9.356 1.00 0.00 H new ATOM 0 HG1 THR A 134 110.925 8.244 -7.050 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.729 9.129 -8.686 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.766 9.592 -10.110 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.338 10.224 -8.502 1.00 0.00 H new ATOM 2026 N LEU A 135 110.355 7.536 -11.561 1.00 0.00 N ATOM 2027 CA LEU A 135 110.362 7.585 -13.020 1.00 0.00 C ATOM 2028 C LEU A 135 109.161 8.367 -13.543 1.00 0.00 C ATOM 2029 O LEU A 135 109.279 9.122 -14.508 1.00 0.00 O ATOM 2030 CB LEU A 135 110.341 6.167 -13.596 1.00 0.00 C ATOM 2031 CG LEU A 135 111.652 5.454 -13.257 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.534 3.971 -13.614 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.794 6.077 -14.063 1.00 0.00 C ATOM 0 H LEU A 135 110.303 6.597 -11.166 1.00 0.00 H new ATOM 0 HA LEU A 135 111.274 8.091 -13.337 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.497 5.611 -13.188 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.205 6.205 -14.677 1.00 0.00 H new ATOM 0 HG LEU A 135 111.856 5.559 -12.191 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.468 3.463 -13.373 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.720 3.523 -13.044 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.330 3.868 -14.680 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.728 5.570 -13.822 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.588 5.971 -15.128 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.881 7.135 -13.814 1.00 0.00 H new ATOM 2045 N ASN A 136 108.007 8.182 -12.908 1.00 0.00 N ATOM 2046 CA ASN A 136 106.805 8.900 -13.318 1.00 0.00 C ATOM 2047 C ASN A 136 107.033 10.405 -13.231 1.00 0.00 C ATOM 2048 O ASN A 136 106.639 11.157 -14.122 1.00 0.00 O ATOM 2049 CB ASN A 136 105.628 8.505 -12.422 1.00 0.00 C ATOM 2050 CG ASN A 136 105.301 7.024 -12.599 1.00 0.00 C ATOM 2051 OD1 ASN A 136 105.630 6.429 -13.626 1.00 0.00 O ATOM 2052 ND2 ASN A 136 104.668 6.390 -11.651 1.00 0.00 N ATOM 0 H ASN A 136 107.879 7.550 -12.118 1.00 0.00 H new ATOM 0 HA ASN A 136 106.576 8.635 -14.350 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.872 8.709 -11.379 1.00 0.00 H new ATOM 0 HB3 ASN A 136 104.755 9.109 -12.669 1.00 0.00 H new ATOM 0 HD21 ASN A 136 104.445 5.401 -11.760 1.00 0.00 H new ATOM 0 HD22 ASN A 136 104.396 6.884 -10.801 1.00 0.00 H new ATOM 2059 N LEU A 137 107.674 10.835 -12.148 1.00 0.00 N ATOM 2060 CA LEU A 137 107.999 12.249 -11.978 1.00 0.00 C ATOM 2061 C LEU A 137 108.967 12.727 -13.059 1.00 0.00 C ATOM 2062 O LEU A 137 108.851 13.847 -13.555 1.00 0.00 O ATOM 2063 CB LEU A 137 108.618 12.481 -10.597 1.00 0.00 C ATOM 2064 CG LEU A 137 107.646 12.026 -9.506 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.318 12.159 -8.138 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.390 12.901 -9.534 1.00 0.00 C ATOM 0 H LEU A 137 107.976 10.233 -11.382 1.00 0.00 H new ATOM 0 HA LEU A 137 107.075 12.820 -12.066 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.556 11.932 -10.513 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.854 13.537 -10.468 1.00 0.00 H new ATOM 0 HG LEU A 137 107.370 10.987 -9.683 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.627 11.835 -7.360 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.213 11.537 -8.110 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.594 13.200 -7.968 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.701 12.573 -8.756 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.667 13.941 -9.359 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.907 12.813 -10.507 1.00 0.00 H new ATOM 2078 N CYS A 138 109.918 11.871 -13.421 1.00 0.00 N ATOM 2079 CA CYS A 138 110.879 12.208 -14.472 1.00 0.00 C ATOM 2080 C CYS A 138 110.188 12.490 -15.812 1.00 0.00 C ATOM 2081 O CYS A 138 110.733 13.211 -16.648 1.00 0.00 O ATOM 2082 CB CYS A 138 111.872 11.053 -14.650 1.00 0.00 C ATOM 2083 SG CYS A 138 113.239 11.191 -13.466 1.00 0.00 S ATOM 0 H CYS A 138 110.045 10.947 -13.008 1.00 0.00 H new ATOM 0 HA CYS A 138 111.400 13.115 -14.164 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.359 10.102 -14.511 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.264 11.058 -15.667 1.00 0.00 H new ATOM 2088 N GLY A 139 108.996 11.931 -16.020 1.00 0.00 N ATOM 2089 CA GLY A 139 108.264 12.150 -17.266 1.00 0.00 C ATOM 2090 C GLY A 139 108.760 11.254 -18.406 1.00 0.00 C ATOM 2091 O GLY A 139 108.570 11.583 -19.576 1.00 0.00 O ATOM 0 H GLY A 139 108.521 11.329 -15.348 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.203 11.964 -17.098 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.361 13.195 -17.561 1.00 0.00 H new ATOM 2095 N LYS A 140 109.391 10.128 -18.072 1.00 0.00 N ATOM 2096 CA LYS A 140 109.892 9.214 -19.092 1.00 0.00 C ATOM 2097 C LYS A 140 108.789 8.261 -19.544 1.00 0.00 C ATOM 2098 O LYS A 140 108.075 7.687 -18.721 1.00 0.00 O ATOM 2099 CB LYS A 140 111.071 8.410 -18.540 1.00 0.00 C ATOM 2100 CG LYS A 140 111.687 7.571 -19.660 1.00 0.00 C ATOM 2101 CD LYS A 140 112.930 6.850 -19.136 1.00 0.00 C ATOM 2102 CE LYS A 140 112.516 5.792 -18.110 1.00 0.00 C ATOM 2103 NZ LYS A 140 113.701 4.971 -17.736 1.00 0.00 N ATOM 0 H LYS A 140 109.565 9.831 -17.112 1.00 0.00 H new ATOM 0 HA LYS A 140 110.224 9.801 -19.949 1.00 0.00 H new ATOM 0 HB2 LYS A 140 111.820 9.083 -18.122 1.00 0.00 H new ATOM 0 HB3 LYS A 140 110.736 7.763 -17.729 1.00 0.00 H new ATOM 0 HG2 LYS A 140 110.961 6.846 -20.026 1.00 0.00 H new ATOM 0 HG3 LYS A 140 111.953 8.209 -20.503 1.00 0.00 H new ATOM 0 HD2 LYS A 140 113.466 6.381 -19.961 1.00 0.00 H new ATOM 0 HD3 LYS A 140 113.613 7.566 -18.679 1.00 0.00 H new ATOM 0 HE2 LYS A 140 112.099 6.272 -17.225 1.00 0.00 H new ATOM 0 HE3 LYS A 140 111.735 5.155 -18.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 113.419 4.252 -17.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 114.080 4.502 -18.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 114.433 5.585 -17.324 1.00 0.00 H new ATOM 2117 N GLY A 141 108.657 8.097 -20.856 1.00 0.00 N ATOM 2118 CA GLY A 141 107.638 7.210 -21.406 1.00 0.00 C ATOM 2119 C GLY A 141 108.037 5.749 -21.235 1.00 0.00 C ATOM 2120 O GLY A 141 107.199 4.972 -20.808 1.00 0.00 O ATOM 2121 OXT GLY A 141 109.177 5.427 -21.533 1.00 0.00 O ATOM 0 H GLY A 141 109.238 8.562 -21.554 1.00 0.00 H new ATOM 0 HA2 GLY A 141 106.685 7.391 -20.908 1.00 0.00 H new ATOM 0 HA3 GLY A 141 107.492 7.430 -22.464 1.00 0.00 H new TER 2125 GLY A 141