USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1421 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: B 33 LYS NZ :NH3+ -114:sc= -0.417 (180deg=-5.13!) USER MOD Set 1.2: B 50 GLN : amide:sc= 0.729 K(o=0.31,f=-17!) USER MOD Set 2.1: B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 30 SER OG : rot 120:sc= -2.32 USER MOD Set 3.1: B 25 HIS : no HD1:sc= -2.1 K(o=-2.1,f=-0.083) USER MOD Set 3.2: B 26 LYS NZ :NH3+ -158:sc= 0.019 (180deg=0) USER MOD Set 4.1: B 1 SER OG : rot 180:sc= 0.0319 USER MOD Set 4.2: B 5 LYS NZ :NH3+ -126:sc= -0.304 (180deg=-3.1!) USER MOD Set 5.1: A 33 LYS NZ :NH3+ -112:sc= -0.399 (180deg=-4.91!) USER MOD Set 5.2: A 50 GLN : amide:sc= 0.887 K(o=0.49,f=-17!) USER MOD Set 6.1: A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 30 SER OG : rot 110:sc= -2.29 USER MOD Set 7.1: A 25 HIS : no HD1:sc= -2.08 K(o=-2.1,f=-0.087) USER MOD Set 7.2: A 26 LYS NZ :NH3+ -157:sc= 0.0155 (180deg=0) USER MOD Set 8.1: A 1 SER OG : rot 180:sc= 0.0293 USER MOD Set 8.2: A 5 LYS NZ :NH3+ -125:sc= -0.32 (180deg=-3.14!) USER MOD Single : A 1 SER N :NH3+ -154:sc= -0.542 (180deg=-1.41) USER MOD Single : A 7 MET CE :methyl -153:sc= -0.467 (180deg=-1.77) USER MOD Single : A 15 HIS : no HD1:sc= -0.487 K(o=-0.49,f=-1.4) USER MOD Single : A 16 GLN : amide:sc= -1.24 K(o=-1.2,f=-6.2!) USER MOD Single : A 17 TYR OH : rot -157:sc= 0.501 USER MOD Single : A 18 SER OG : rot 79:sc= 1.14 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -156:sc= 0.782 (180deg=0.483) USER MOD Single : A 37 ASN : amide:sc= -0.794 K(o=-0.79,f=-9.3!) USER MOD Single : A 38 ASN : amide:sc= -0.0876 K(o=-0.088,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 149:sc= -2.92 (180deg=-3.6!) USER MOD Single : A 59 THR OG1 : rot -17:sc= -0.752 USER MOD Single : A 62 ASN : amide:sc=-0.00693 X(o=-0.0069,f=-0.11) USER MOD Single : A 68 CYS SG : rot 180:sc= -1.08 USER MOD Single : A 71 GLN : amide:sc= -1.19 K(o=-1.2,f=-1.9!) USER MOD Single : A 74 MET CE :methyl -176:sc= -1.49 (180deg=-1.53) USER MOD Single : A 79 MET CE :methyl 177:sc= -4.42! (180deg=-4.51!) USER MOD Single : A 81 THR OG1 : rot 121:sc= 1.15 USER MOD Single : A 82 THR OG1 : rot 105:sc= -1.83 USER MOD Single : A 84 CYS SG : rot -34:sc= 0.445 USER MOD Single : A 85 HIS : no HD1:sc= -1.14 X(o=-1.1,f=-0.84) USER MOD Single : B 1 SER N :NH3+ -154:sc= -0.769 (180deg=-1.61!) USER MOD Single : B 7 MET CE :methyl -144:sc= -0.477 (180deg=-1.86) USER MOD Single : B 15 HIS : no HD1:sc= -0.456 K(o=-0.46,f=-1.4) USER MOD Single : B 16 GLN : amide:sc= -1.27 K(o=-1.3,f=-6.1!) USER MOD Single : B 17 TYR OH : rot -157:sc= 0.527 USER MOD Single : B 18 SER OG : rot 60:sc= 1.11 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -161:sc= 0.781 (180deg=0.395) USER MOD Single : B 37 ASN : amide:sc= -0.936 K(o=-0.94,f=-8.9!) USER MOD Single : B 38 ASN : amide:sc= -0.0695 K(o=-0.069,f=-1.1) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 145:sc= -2.76! (180deg=-3.55!) USER MOD Single : B 59 THR OG1 : rot -14:sc= -0.751 USER MOD Single : B 62 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : B 68 CYS SG : rot 180:sc= -1.09 USER MOD Single : B 71 GLN : amide:sc= -1.19 K(o=-1.2,f=-1.8!) USER MOD Single : B 74 MET CE :methyl -179:sc= -1.54 (180deg=-1.55) USER MOD Single : B 79 MET CE :methyl 172:sc= -4.49! (180deg=-4.58!) USER MOD Single : B 81 THR OG1 : rot 125:sc= 1.12 USER MOD Single : B 82 THR OG1 : rot 101:sc= -1.33 USER MOD Single : B 84 CYS SG : rot -19:sc= 0.456 USER MOD Single : B 85 HIS : no HD1:sc= -0.955 X(o=-0.95,f=-0.6) USER MOD Single : C 3 THR OG1 : rot 180:sc= 0.0291 USER MOD Single : C 4 LYS NZ :NH3+ -155:sc= -0.0155 (180deg=-0.904) USER MOD Single : C 8 ASN : amide:sc= -0.651 X(o=-0.65,f=-0.4) USER MOD Single : C 9 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.00811) USER MOD Single : C 12 SER OG : rot -61:sc= 1.09 USER MOD Single : D 1 THR N :NH3+ -151:sc= 0.201 (180deg=-0.241) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0.133 USER MOD Single : D 3 THR OG1 : rot 180:sc= 0.0403 USER MOD Single : D 4 LYS NZ :NH3+ -155:sc= -0.0166 (180deg=-0.909) USER MOD Single : D 8 ASN : amide:sc= -0.549 X(o=-0.55,f=-0.34) USER MOD Single : D 9 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0077) USER MOD Single : D 12 SER OG : rot -64:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.355 -4.543 -11.812 1.00 0.00 N ATOM 2 CA SER A 1 -9.226 -5.511 -11.849 1.00 0.00 C ATOM 3 C SER A 1 -7.910 -4.849 -11.453 1.00 0.00 C ATOM 4 O SER A 1 -6.942 -5.528 -11.109 1.00 0.00 O ATOM 5 CB SER A 1 -9.123 -6.083 -13.263 1.00 0.00 C ATOM 6 OG SER A 1 -9.027 -5.049 -14.227 1.00 0.00 O ATOM 0 H1 SER A 1 -11.245 -5.054 -11.646 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.201 -3.859 -11.044 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.409 -4.038 -12.720 1.00 0.00 H new ATOM 0 HA SER A 1 -9.418 -6.308 -11.131 1.00 0.00 H new ATOM 0 HB2 SER A 1 -8.250 -6.732 -13.333 1.00 0.00 H new ATOM 0 HB3 SER A 1 -9.996 -6.700 -13.473 1.00 0.00 H new ATOM 0 HG SER A 1 -8.961 -5.442 -15.122 1.00 0.00 H new ATOM 14 N GLU A 2 -7.877 -3.520 -11.503 1.00 0.00 N ATOM 15 CA GLU A 2 -6.677 -2.770 -11.148 1.00 0.00 C ATOM 16 C GLU A 2 -6.202 -3.129 -9.747 1.00 0.00 C ATOM 17 O GLU A 2 -5.003 -3.204 -9.482 1.00 0.00 O ATOM 18 CB GLU A 2 -6.949 -1.269 -11.233 1.00 0.00 C ATOM 19 CG GLU A 2 -7.964 -0.776 -10.215 1.00 0.00 C ATOM 20 CD GLU A 2 -8.717 0.450 -10.690 1.00 0.00 C ATOM 21 OE1 GLU A 2 -8.087 1.522 -10.818 1.00 0.00 O ATOM 22 OE2 GLU A 2 -9.937 0.341 -10.935 1.00 0.00 O ATOM 0 H GLU A 2 -8.668 -2.941 -11.786 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.892 -3.035 -11.856 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -6.012 -0.730 -11.090 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.306 -1.029 -12.235 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -8.675 -1.574 -10.000 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.453 -0.545 -9.280 1.00 0.00 H new ATOM 29 N LEU A 3 -7.159 -3.344 -8.858 1.00 0.00 N ATOM 30 CA LEU A 3 -6.865 -3.695 -7.470 1.00 0.00 C ATOM 31 C LEU A 3 -5.802 -4.789 -7.387 1.00 0.00 C ATOM 32 O LEU A 3 -4.906 -4.734 -6.545 1.00 0.00 O ATOM 33 CB LEU A 3 -8.141 -4.153 -6.760 1.00 0.00 C ATOM 34 CG LEU A 3 -8.217 -3.797 -5.271 1.00 0.00 C ATOM 35 CD1 LEU A 3 -9.321 -2.782 -5.018 1.00 0.00 C ATOM 36 CD2 LEU A 3 -8.439 -5.047 -4.432 1.00 0.00 C ATOM 0 H LEU A 3 -8.154 -3.282 -9.072 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.476 -2.805 -6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.999 -3.713 -7.268 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.229 -5.234 -6.865 1.00 0.00 H new ATOM 0 HG LEU A 3 -7.267 -3.351 -4.978 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -9.359 -2.543 -3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.119 -1.875 -5.587 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -10.278 -3.200 -5.330 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -8.490 -4.773 -3.378 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -9.373 -5.523 -4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -7.613 -5.741 -4.587 1.00 0.00 H new ATOM 48 N GLU A 4 -5.908 -5.781 -8.266 1.00 0.00 N ATOM 49 CA GLU A 4 -4.956 -6.886 -8.289 1.00 0.00 C ATOM 50 C GLU A 4 -3.712 -6.521 -9.097 1.00 0.00 C ATOM 51 O GLU A 4 -2.622 -7.027 -8.837 1.00 0.00 O ATOM 52 CB GLU A 4 -5.608 -8.141 -8.870 1.00 0.00 C ATOM 53 CG GLU A 4 -6.052 -7.986 -10.316 1.00 0.00 C ATOM 54 CD GLU A 4 -5.990 -9.291 -11.087 1.00 0.00 C ATOM 55 OE1 GLU A 4 -6.357 -10.338 -10.514 1.00 0.00 O ATOM 56 OE2 GLU A 4 -5.575 -9.264 -12.266 1.00 0.00 O ATOM 0 H GLU A 4 -6.643 -5.842 -8.971 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.652 -7.088 -7.262 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -4.904 -8.970 -8.802 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.472 -8.406 -8.260 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.072 -7.602 -10.340 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.421 -7.246 -10.809 1.00 0.00 H new ATOM 63 N LYS A 5 -3.885 -5.640 -10.078 1.00 0.00 N ATOM 64 CA LYS A 5 -2.775 -5.210 -10.922 1.00 0.00 C ATOM 65 C LYS A 5 -1.817 -4.310 -10.149 1.00 0.00 C ATOM 66 O LYS A 5 -0.600 -4.459 -10.242 1.00 0.00 O ATOM 67 CB LYS A 5 -3.300 -4.475 -12.156 1.00 0.00 C ATOM 68 CG LYS A 5 -3.885 -5.400 -13.212 1.00 0.00 C ATOM 69 CD LYS A 5 -5.209 -4.873 -13.744 1.00 0.00 C ATOM 70 CE LYS A 5 -5.033 -3.541 -14.453 1.00 0.00 C ATOM 71 NZ LYS A 5 -6.249 -2.689 -14.348 1.00 0.00 N ATOM 0 H LYS A 5 -4.781 -5.211 -10.308 1.00 0.00 H new ATOM 0 HA LYS A 5 -2.230 -6.099 -11.241 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.064 -3.762 -11.846 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.487 -3.899 -12.599 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.178 -5.507 -14.035 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.032 -6.393 -12.786 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.640 -5.599 -14.433 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.913 -4.758 -12.920 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -4.182 -3.012 -14.025 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.803 -3.717 -15.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.562 -2.412 -15.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.007 -3.222 -13.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -6.029 -1.837 -13.794 1.00 0.00 H new ATOM 85 N ALA A 6 -2.375 -3.376 -9.386 1.00 0.00 N ATOM 86 CA ALA A 6 -1.570 -2.451 -8.596 1.00 0.00 C ATOM 87 C ALA A 6 -0.792 -3.186 -7.511 1.00 0.00 C ATOM 88 O ALA A 6 0.411 -2.984 -7.352 1.00 0.00 O ATOM 89 CB ALA A 6 -2.459 -1.381 -7.979 1.00 0.00 C ATOM 0 H ALA A 6 -3.382 -3.239 -9.298 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.849 -1.974 -9.260 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.849 -0.695 -7.391 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.966 -0.828 -8.770 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.200 -1.852 -7.333 1.00 0.00 H new ATOM 95 N MET A 7 -1.486 -4.042 -6.771 1.00 0.00 N ATOM 96 CA MET A 7 -0.859 -4.810 -5.703 1.00 0.00 C ATOM 97 C MET A 7 0.271 -5.678 -6.250 1.00 0.00 C ATOM 98 O MET A 7 1.365 -5.724 -5.686 1.00 0.00 O ATOM 99 CB MET A 7 -1.899 -5.688 -5.003 1.00 0.00 C ATOM 100 CG MET A 7 -2.382 -5.123 -3.677 1.00 0.00 C ATOM 101 SD MET A 7 -3.546 -6.217 -2.841 1.00 0.00 S ATOM 102 CE MET A 7 -5.091 -5.710 -3.594 1.00 0.00 C ATOM 0 H MET A 7 -2.483 -4.222 -6.891 1.00 0.00 H new ATOM 0 HA MET A 7 -0.439 -4.110 -4.981 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.755 -5.820 -5.665 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.472 -6.676 -4.833 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.525 -4.946 -3.028 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.856 -4.157 -3.849 1.00 0.00 H new ATOM 0 HE1 MET A 7 -5.913 -5.904 -2.905 1.00 0.00 H new ATOM 0 HE2 MET A 7 -5.052 -4.645 -3.822 1.00 0.00 H new ATOM 0 HE3 MET A 7 -5.249 -6.272 -4.514 1.00 0.00 H new ATOM 112 N VAL A 8 -0.006 -6.372 -7.349 1.00 0.00 N ATOM 113 CA VAL A 8 0.983 -7.246 -7.965 1.00 0.00 C ATOM 114 C VAL A 8 2.006 -6.456 -8.776 1.00 0.00 C ATOM 115 O VAL A 8 3.135 -6.905 -8.966 1.00 0.00 O ATOM 116 CB VAL A 8 0.322 -8.302 -8.871 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.352 -9.304 -9.368 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.806 -9.009 -8.133 1.00 0.00 C ATOM 0 H VAL A 8 -0.905 -6.346 -7.830 1.00 0.00 H new ATOM 0 HA VAL A 8 1.496 -7.753 -7.148 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.102 -7.794 -9.737 1.00 0.00 H new ATOM 0 HG11 VAL A 8 0.864 -10.041 -10.006 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.121 -8.783 -9.938 1.00 0.00 H new ATOM 0 HG13 VAL A 8 1.810 -9.808 -8.517 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.261 -9.751 -8.789 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.408 -9.503 -7.247 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.559 -8.279 -7.834 1.00 0.00 H new ATOM 128 N ALA A 9 1.620 -5.275 -9.241 1.00 0.00 N ATOM 129 CA ALA A 9 2.534 -4.441 -10.005 1.00 0.00 C ATOM 130 C ALA A 9 3.701 -4.028 -9.119 1.00 0.00 C ATOM 131 O ALA A 9 4.856 -3.984 -9.553 1.00 0.00 O ATOM 132 CB ALA A 9 1.814 -3.216 -10.551 1.00 0.00 C ATOM 0 H ALA A 9 0.691 -4.878 -9.104 1.00 0.00 H new ATOM 0 HA ALA A 9 2.914 -5.010 -10.853 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.515 -2.605 -11.119 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.999 -3.533 -11.201 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.412 -2.632 -9.724 1.00 0.00 H new ATOM 138 N LEU A 10 3.384 -3.750 -7.860 1.00 0.00 N ATOM 139 CA LEU A 10 4.394 -3.362 -6.888 1.00 0.00 C ATOM 140 C LEU A 10 5.359 -4.512 -6.653 1.00 0.00 C ATOM 141 O LEU A 10 6.536 -4.433 -7.004 1.00 0.00 O ATOM 142 CB LEU A 10 3.741 -2.969 -5.561 1.00 0.00 C ATOM 143 CG LEU A 10 2.947 -1.663 -5.582 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.708 -1.784 -4.708 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.819 -0.506 -5.116 1.00 0.00 C ATOM 0 H LEU A 10 2.434 -3.787 -7.490 1.00 0.00 H new ATOM 0 HA LEU A 10 4.938 -2.504 -7.284 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.075 -3.774 -5.251 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.519 -2.889 -4.802 1.00 0.00 H new ATOM 0 HG LEU A 10 2.629 -1.464 -6.605 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.152 -0.847 -4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.076 -2.590 -5.082 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.006 -2.002 -3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.240 0.417 -5.136 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.163 -0.696 -4.099 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.679 -0.409 -5.778 1.00 0.00 H new ATOM 157 N ILE A 11 4.838 -5.586 -6.063 1.00 0.00 N ATOM 158 CA ILE A 11 5.618 -6.777 -5.771 1.00 0.00 C ATOM 159 C ILE A 11 6.534 -7.133 -6.940 1.00 0.00 C ATOM 160 O ILE A 11 7.672 -7.547 -6.744 1.00 0.00 O ATOM 161 CB ILE A 11 4.677 -7.955 -5.479 1.00 0.00 C ATOM 162 CG1 ILE A 11 5.464 -9.246 -5.226 1.00 0.00 C ATOM 163 CG2 ILE A 11 3.714 -8.113 -6.633 1.00 0.00 C ATOM 164 CD1 ILE A 11 5.734 -10.040 -6.482 1.00 0.00 C ATOM 0 H ILE A 11 3.862 -5.651 -5.775 1.00 0.00 H new ATOM 0 HA ILE A 11 6.237 -6.574 -4.897 1.00 0.00 H new ATOM 0 HB ILE A 11 4.113 -7.748 -4.569 1.00 0.00 H new ATOM 0 HG12 ILE A 11 6.413 -8.997 -4.751 1.00 0.00 H new ATOM 0 HG13 ILE A 11 4.910 -9.869 -4.523 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.042 -8.948 -6.434 1.00 0.00 H new ATOM 0 HG22 ILE A 11 3.133 -7.198 -6.749 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.272 -8.307 -7.549 1.00 0.00 H new ATOM 0 HD11 ILE A 11 6.294 -10.940 -6.230 1.00 0.00 H new ATOM 0 HD12 ILE A 11 4.788 -10.319 -6.946 1.00 0.00 H new ATOM 0 HD13 ILE A 11 6.315 -9.434 -7.178 1.00 0.00 H new ATOM 176 N ASP A 12 6.028 -6.958 -8.157 1.00 0.00 N ATOM 177 CA ASP A 12 6.808 -7.253 -9.353 1.00 0.00 C ATOM 178 C ASP A 12 8.143 -6.515 -9.313 1.00 0.00 C ATOM 179 O ASP A 12 9.200 -7.107 -9.527 1.00 0.00 O ATOM 180 CB ASP A 12 6.028 -6.860 -10.609 1.00 0.00 C ATOM 181 CG ASP A 12 6.024 -7.959 -11.654 1.00 0.00 C ATOM 182 OD1 ASP A 12 7.056 -8.648 -11.795 1.00 0.00 O ATOM 183 OD2 ASP A 12 4.989 -8.132 -12.331 1.00 0.00 O ATOM 0 H ASP A 12 5.085 -6.615 -8.340 1.00 0.00 H new ATOM 0 HA ASP A 12 7.001 -8.325 -9.382 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.001 -6.619 -10.335 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.464 -5.957 -11.037 1.00 0.00 H new ATOM 188 N VAL A 13 8.081 -5.219 -9.029 1.00 0.00 N ATOM 189 CA VAL A 13 9.283 -4.393 -8.951 1.00 0.00 C ATOM 190 C VAL A 13 10.275 -4.941 -7.922 1.00 0.00 C ATOM 191 O VAL A 13 11.484 -4.963 -8.158 1.00 0.00 O ATOM 192 CB VAL A 13 8.931 -2.938 -8.586 1.00 0.00 C ATOM 193 CG1 VAL A 13 10.166 -2.054 -8.641 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.844 -2.406 -9.508 1.00 0.00 C ATOM 0 H VAL A 13 7.212 -4.716 -8.849 1.00 0.00 H new ATOM 0 HA VAL A 13 9.748 -4.417 -9.937 1.00 0.00 H new ATOM 0 HB VAL A 13 8.551 -2.923 -7.564 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.893 -1.031 -8.380 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.909 -2.423 -7.935 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.582 -2.072 -9.648 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.608 -1.377 -9.236 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.194 -2.437 -10.540 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.950 -3.022 -9.410 1.00 0.00 H new ATOM 204 N PHE A 14 9.753 -5.384 -6.782 1.00 0.00 N ATOM 205 CA PHE A 14 10.580 -5.935 -5.709 1.00 0.00 C ATOM 206 C PHE A 14 10.998 -7.365 -6.043 1.00 0.00 C ATOM 207 O PHE A 14 12.059 -7.827 -5.627 1.00 0.00 O ATOM 208 CB PHE A 14 9.815 -5.841 -4.366 1.00 0.00 C ATOM 209 CG PHE A 14 9.703 -7.118 -3.565 1.00 0.00 C ATOM 210 CD1 PHE A 14 9.185 -8.275 -4.128 1.00 0.00 C ATOM 211 CD2 PHE A 14 10.113 -7.155 -2.239 1.00 0.00 C ATOM 212 CE1 PHE A 14 9.081 -9.438 -3.392 1.00 0.00 C ATOM 213 CE2 PHE A 14 10.011 -8.315 -1.504 1.00 0.00 C ATOM 214 CZ PHE A 14 9.497 -9.457 -2.078 1.00 0.00 C ATOM 0 H PHE A 14 8.754 -5.372 -6.575 1.00 0.00 H new ATOM 0 HA PHE A 14 11.496 -5.353 -5.610 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.305 -5.091 -3.746 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.808 -5.477 -4.571 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.858 -8.266 -5.157 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.516 -6.265 -1.779 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.675 -10.331 -3.844 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.335 -8.330 -0.474 1.00 0.00 H new ATOM 0 HZ PHE A 14 9.420 -10.366 -1.499 1.00 0.00 H new ATOM 224 N HIS A 15 10.154 -8.059 -6.800 1.00 0.00 N ATOM 225 CA HIS A 15 10.429 -9.434 -7.198 1.00 0.00 C ATOM 226 C HIS A 15 11.327 -9.480 -8.430 1.00 0.00 C ATOM 227 O HIS A 15 11.908 -10.520 -8.743 1.00 0.00 O ATOM 228 CB HIS A 15 9.124 -10.177 -7.479 1.00 0.00 C ATOM 229 CG HIS A 15 9.145 -11.607 -7.036 1.00 0.00 C ATOM 230 ND1 HIS A 15 8.500 -12.055 -5.902 1.00 0.00 N ATOM 231 CD2 HIS A 15 9.739 -12.696 -7.582 1.00 0.00 C ATOM 232 CE1 HIS A 15 8.698 -13.355 -5.769 1.00 0.00 C ATOM 233 NE2 HIS A 15 9.445 -13.768 -6.775 1.00 0.00 N ATOM 0 H HIS A 15 9.271 -7.689 -7.151 1.00 0.00 H new ATOM 0 HA HIS A 15 10.949 -9.923 -6.375 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.306 -9.661 -6.977 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.916 -10.139 -8.548 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.333 -12.717 -8.484 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.314 -13.974 -4.972 1.00 0.00 H new ATOM 0 HE2 HIS A 15 9.754 -14.728 -6.929 1.00 0.00 H new ATOM 242 N GLN A 16 11.444 -8.352 -9.125 1.00 0.00 N ATOM 243 CA GLN A 16 12.275 -8.278 -10.311 1.00 0.00 C ATOM 244 C GLN A 16 13.731 -8.142 -9.911 1.00 0.00 C ATOM 245 O GLN A 16 14.595 -8.862 -10.412 1.00 0.00 O ATOM 246 CB GLN A 16 11.854 -7.097 -11.189 1.00 0.00 C ATOM 247 CG GLN A 16 11.455 -7.501 -12.600 1.00 0.00 C ATOM 248 CD GLN A 16 10.243 -8.410 -12.625 1.00 0.00 C ATOM 249 OE1 GLN A 16 10.086 -9.279 -11.767 1.00 0.00 O ATOM 250 NE2 GLN A 16 9.376 -8.213 -13.612 1.00 0.00 N ATOM 0 H GLN A 16 10.972 -7.480 -8.883 1.00 0.00 H new ATOM 0 HA GLN A 16 12.148 -9.195 -10.886 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.017 -6.584 -10.716 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.676 -6.383 -11.243 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.245 -6.605 -13.185 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.293 -8.006 -13.080 1.00 0.00 H new ATOM 0 HE21 GLN A 16 9.546 -7.481 -14.302 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.540 -8.794 -13.680 1.00 0.00 H new ATOM 259 N TYR A 17 14.004 -7.214 -9.000 1.00 0.00 N ATOM 260 CA TYR A 17 15.367 -7.001 -8.542 1.00 0.00 C ATOM 261 C TYR A 17 15.747 -7.975 -7.434 1.00 0.00 C ATOM 262 O TYR A 17 16.746 -8.688 -7.541 1.00 0.00 O ATOM 263 CB TYR A 17 15.564 -5.562 -8.079 1.00 0.00 C ATOM 264 CG TYR A 17 16.170 -4.684 -9.150 1.00 0.00 C ATOM 265 CD1 TYR A 17 15.469 -4.398 -10.314 1.00 0.00 C ATOM 266 CD2 TYR A 17 17.443 -4.149 -9.001 1.00 0.00 C ATOM 267 CE1 TYR A 17 16.021 -3.600 -11.300 1.00 0.00 C ATOM 268 CE2 TYR A 17 17.999 -3.350 -9.980 1.00 0.00 C ATOM 269 CZ TYR A 17 17.285 -3.079 -11.128 1.00 0.00 C ATOM 270 OH TYR A 17 17.836 -2.284 -12.106 1.00 0.00 O ATOM 0 H TYR A 17 13.307 -6.605 -8.570 1.00 0.00 H new ATOM 0 HA TYR A 17 16.028 -7.188 -9.388 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.603 -5.147 -7.775 1.00 0.00 H new ATOM 0 HB3 TYR A 17 16.208 -5.552 -7.199 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.478 -4.805 -10.452 1.00 0.00 H new ATOM 0 HD2 TYR A 17 18.007 -4.361 -8.105 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.464 -3.386 -12.200 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.989 -2.939 -9.847 1.00 0.00 H new ATOM 0 HH TYR A 17 18.813 -2.297 -12.027 1.00 0.00 H new ATOM 280 N SER A 18 14.954 -8.004 -6.370 1.00 0.00 N ATOM 281 CA SER A 18 15.225 -8.895 -5.248 1.00 0.00 C ATOM 282 C SER A 18 15.289 -10.348 -5.707 1.00 0.00 C ATOM 283 O SER A 18 14.304 -10.898 -6.201 1.00 0.00 O ATOM 284 CB SER A 18 14.154 -8.739 -4.167 1.00 0.00 C ATOM 285 OG SER A 18 14.695 -8.954 -2.874 1.00 0.00 O ATOM 0 H SER A 18 14.122 -7.424 -6.260 1.00 0.00 H new ATOM 0 HA SER A 18 16.194 -8.620 -4.831 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.721 -7.740 -4.222 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.345 -9.447 -4.348 1.00 0.00 H new ATOM 0 HG SER A 18 15.169 -8.148 -2.580 1.00 0.00 H new ATOM 291 N GLY A 19 16.454 -10.967 -5.541 1.00 0.00 N ATOM 292 CA GLY A 19 16.623 -12.350 -5.946 1.00 0.00 C ATOM 293 C GLY A 19 17.948 -12.594 -6.642 1.00 0.00 C ATOM 294 O GLY A 19 18.691 -13.504 -6.275 1.00 0.00 O ATOM 0 H GLY A 19 17.283 -10.535 -5.133 1.00 0.00 H new ATOM 0 HA2 GLY A 19 16.553 -12.993 -5.069 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.809 -12.632 -6.613 1.00 0.00 H new ATOM 355 N LYS A 24 16.675 -12.756 -1.672 1.00 0.00 N ATOM 356 CA LYS A 24 15.509 -12.846 -2.547 1.00 0.00 C ATOM 357 C LYS A 24 14.229 -12.528 -1.778 1.00 0.00 C ATOM 358 O LYS A 24 13.320 -13.355 -1.693 1.00 0.00 O ATOM 359 CB LYS A 24 15.413 -14.238 -3.177 1.00 0.00 C ATOM 360 CG LYS A 24 14.454 -14.308 -4.354 1.00 0.00 C ATOM 361 CD LYS A 24 14.734 -15.519 -5.228 1.00 0.00 C ATOM 362 CE LYS A 24 13.913 -16.722 -4.793 1.00 0.00 C ATOM 363 NZ LYS A 24 14.430 -17.989 -5.380 1.00 0.00 N ATOM 0 HA LYS A 24 15.627 -12.110 -3.342 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.404 -14.547 -3.508 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.094 -14.951 -2.416 1.00 0.00 H new ATOM 0 HG2 LYS A 24 13.429 -14.352 -3.987 1.00 0.00 H new ATOM 0 HG3 LYS A 24 14.541 -13.400 -4.950 1.00 0.00 H new ATOM 0 HD2 LYS A 24 14.508 -15.279 -6.267 1.00 0.00 H new ATOM 0 HD3 LYS A 24 15.795 -15.765 -5.181 1.00 0.00 H new ATOM 0 HE2 LYS A 24 13.924 -16.795 -3.705 1.00 0.00 H new ATOM 0 HE3 LYS A 24 12.875 -16.580 -5.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 13.843 -18.785 -5.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 14.396 -17.930 -6.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 15.413 -18.138 -5.074 1.00 0.00 H new ATOM 377 N HIS A 25 14.168 -11.321 -1.227 1.00 0.00 N ATOM 378 CA HIS A 25 13.002 -10.881 -0.466 1.00 0.00 C ATOM 379 C HIS A 25 13.169 -9.441 0.020 1.00 0.00 C ATOM 380 O HIS A 25 12.191 -8.725 0.209 1.00 0.00 O ATOM 381 CB HIS A 25 12.751 -11.803 0.726 1.00 0.00 C ATOM 382 CG HIS A 25 11.388 -11.634 1.316 1.00 0.00 C ATOM 383 ND1 HIS A 25 10.908 -12.410 2.350 1.00 0.00 N ATOM 384 CD2 HIS A 25 10.397 -10.766 1.006 1.00 0.00 C ATOM 385 CE1 HIS A 25 9.679 -12.026 2.650 1.00 0.00 C ATOM 386 NE2 HIS A 25 9.346 -11.030 1.849 1.00 0.00 N ATOM 0 H HIS A 25 14.913 -10.628 -1.293 1.00 0.00 H new ATOM 0 HA HIS A 25 12.142 -10.924 -1.134 1.00 0.00 H new ATOM 0 HB2 HIS A 25 12.879 -12.839 0.411 1.00 0.00 H new ATOM 0 HB3 HIS A 25 13.500 -11.608 1.493 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.427 -10.007 0.238 1.00 0.00 H new ATOM 0 HE1 HIS A 25 9.054 -12.454 3.419 1.00 0.00 H new ATOM 0 HE2 HIS A 25 8.453 -10.537 1.856 1.00 0.00 H new ATOM 395 N LYS A 26 14.411 -9.024 0.226 1.00 0.00 N ATOM 396 CA LYS A 26 14.701 -7.676 0.691 1.00 0.00 C ATOM 397 C LYS A 26 15.383 -6.876 -0.413 1.00 0.00 C ATOM 398 O LYS A 26 15.935 -7.444 -1.354 1.00 0.00 O ATOM 399 CB LYS A 26 15.607 -7.728 1.923 1.00 0.00 C ATOM 400 CG LYS A 26 14.911 -7.360 3.226 1.00 0.00 C ATOM 401 CD LYS A 26 14.590 -8.590 4.065 1.00 0.00 C ATOM 402 CE LYS A 26 13.951 -9.693 3.234 1.00 0.00 C ATOM 403 NZ LYS A 26 12.920 -10.444 4.002 1.00 0.00 N ATOM 0 H LYS A 26 15.237 -9.604 0.077 1.00 0.00 H new ATOM 0 HA LYS A 26 13.763 -7.190 0.957 1.00 0.00 H new ATOM 0 HB2 LYS A 26 16.018 -8.733 2.015 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.448 -7.052 1.770 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.547 -6.685 3.799 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.990 -6.820 3.006 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.505 -8.965 4.524 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.918 -8.311 4.876 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.495 -9.259 2.344 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.723 -10.383 2.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.792 -11.386 3.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 13.228 -10.545 4.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.019 -9.926 3.972 1.00 0.00 H new ATOM 417 N LEU A 27 15.346 -5.555 -0.289 1.00 0.00 N ATOM 418 CA LEU A 27 15.967 -4.681 -1.277 1.00 0.00 C ATOM 419 C LEU A 27 16.995 -3.786 -0.609 1.00 0.00 C ATOM 420 O LEU A 27 16.771 -3.264 0.480 1.00 0.00 O ATOM 421 CB LEU A 27 14.917 -3.834 -1.997 1.00 0.00 C ATOM 422 CG LEU A 27 14.066 -4.573 -3.044 1.00 0.00 C ATOM 423 CD1 LEU A 27 14.952 -5.408 -3.954 1.00 0.00 C ATOM 424 CD2 LEU A 27 13.005 -5.447 -2.380 1.00 0.00 C ATOM 0 H LEU A 27 14.894 -5.066 0.484 1.00 0.00 H new ATOM 0 HA LEU A 27 16.466 -5.305 -2.019 1.00 0.00 H new ATOM 0 HB2 LEU A 27 14.249 -3.405 -1.250 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.422 -3.002 -2.488 1.00 0.00 H new ATOM 0 HG LEU A 27 13.551 -3.825 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.335 -5.924 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.661 -4.758 -4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 27 15.497 -6.141 -3.359 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.421 -5.956 -3.147 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.490 -6.187 -1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.346 -4.824 -1.776 1.00 0.00 H new ATOM 436 N LYS A 28 18.129 -3.619 -1.266 1.00 0.00 N ATOM 437 CA LYS A 28 19.205 -2.798 -0.728 1.00 0.00 C ATOM 438 C LYS A 28 19.433 -1.556 -1.575 1.00 0.00 C ATOM 439 O LYS A 28 18.727 -1.316 -2.554 1.00 0.00 O ATOM 440 CB LYS A 28 20.498 -3.613 -0.641 1.00 0.00 C ATOM 441 CG LYS A 28 20.957 -4.174 -1.977 1.00 0.00 C ATOM 442 CD LYS A 28 21.970 -5.292 -1.795 1.00 0.00 C ATOM 443 CE LYS A 28 22.034 -6.192 -3.019 1.00 0.00 C ATOM 444 NZ LYS A 28 23.438 -6.465 -3.437 1.00 0.00 N ATOM 0 H LYS A 28 18.331 -4.040 -2.173 1.00 0.00 H new ATOM 0 HA LYS A 28 18.911 -2.477 0.271 1.00 0.00 H new ATOM 0 HB2 LYS A 28 21.287 -2.983 -0.231 1.00 0.00 H new ATOM 0 HB3 LYS A 28 20.352 -4.436 0.058 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.096 -4.549 -2.530 1.00 0.00 H new ATOM 0 HG3 LYS A 28 21.398 -3.377 -2.575 1.00 0.00 H new ATOM 0 HD2 LYS A 28 22.955 -4.865 -1.605 1.00 0.00 H new ATOM 0 HD3 LYS A 28 21.705 -5.885 -0.920 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.530 -7.134 -2.803 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.495 -5.723 -3.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 23.437 -7.082 -4.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 23.912 -5.569 -3.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 23.946 -6.935 -2.661 1.00 0.00 H new ATOM 458 N LYS A 29 20.431 -0.772 -1.186 1.00 0.00 N ATOM 459 CA LYS A 29 20.773 0.449 -1.900 1.00 0.00 C ATOM 460 C LYS A 29 20.938 0.179 -3.392 1.00 0.00 C ATOM 461 O LYS A 29 20.497 0.962 -4.229 1.00 0.00 O ATOM 462 CB LYS A 29 22.065 1.039 -1.332 1.00 0.00 C ATOM 463 CG LYS A 29 21.939 1.501 0.112 1.00 0.00 C ATOM 464 CD LYS A 29 22.328 0.401 1.087 1.00 0.00 C ATOM 465 CE LYS A 29 21.164 0.014 1.988 1.00 0.00 C ATOM 466 NZ LYS A 29 21.612 -0.282 3.377 1.00 0.00 N ATOM 0 H LYS A 29 21.020 -0.963 -0.375 1.00 0.00 H new ATOM 0 HA LYS A 29 19.960 1.163 -1.768 1.00 0.00 H new ATOM 0 HB2 LYS A 29 22.856 0.292 -1.398 1.00 0.00 H new ATOM 0 HB3 LYS A 29 22.372 1.883 -1.950 1.00 0.00 H new ATOM 0 HG2 LYS A 29 22.574 2.372 0.273 1.00 0.00 H new ATOM 0 HG3 LYS A 29 20.913 1.814 0.306 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.667 -0.474 0.533 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.166 0.735 1.698 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.434 0.824 2.007 1.00 0.00 H new ATOM 0 HE3 LYS A 29 20.660 -0.860 1.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.922 -0.908 3.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.540 -0.750 3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.688 0.605 3.914 1.00 0.00 H new ATOM 480 N SER A 30 21.576 -0.937 -3.715 1.00 0.00 N ATOM 481 CA SER A 30 21.803 -1.311 -5.103 1.00 0.00 C ATOM 482 C SER A 30 20.487 -1.568 -5.835 1.00 0.00 C ATOM 483 O SER A 30 20.220 -0.965 -6.875 1.00 0.00 O ATOM 484 CB SER A 30 22.691 -2.553 -5.179 1.00 0.00 C ATOM 485 OG SER A 30 22.007 -3.699 -4.703 1.00 0.00 O ATOM 0 H SER A 30 21.946 -1.600 -3.034 1.00 0.00 H new ATOM 0 HA SER A 30 22.306 -0.477 -5.593 1.00 0.00 H new ATOM 0 HB2 SER A 30 23.006 -2.716 -6.210 1.00 0.00 H new ATOM 0 HB3 SER A 30 23.595 -2.394 -4.590 1.00 0.00 H new ATOM 0 HG SER A 30 21.812 -4.299 -5.453 1.00 0.00 H new ATOM 491 N GLU A 31 19.673 -2.473 -5.296 1.00 0.00 N ATOM 492 CA GLU A 31 18.401 -2.808 -5.920 1.00 0.00 C ATOM 493 C GLU A 31 17.412 -1.650 -5.843 1.00 0.00 C ATOM 494 O GLU A 31 17.059 -1.059 -6.862 1.00 0.00 O ATOM 495 CB GLU A 31 17.800 -4.050 -5.261 1.00 0.00 C ATOM 496 CG GLU A 31 18.558 -5.331 -5.573 1.00 0.00 C ATOM 497 CD GLU A 31 18.862 -6.146 -4.331 1.00 0.00 C ATOM 498 OE1 GLU A 31 18.197 -5.924 -3.296 1.00 0.00 O ATOM 499 OE2 GLU A 31 19.765 -7.006 -4.391 1.00 0.00 O ATOM 0 H GLU A 31 19.872 -2.983 -4.435 1.00 0.00 H new ATOM 0 HA GLU A 31 18.595 -3.013 -6.973 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.779 -3.904 -4.181 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.766 -4.160 -5.588 1.00 0.00 H new ATOM 0 HG2 GLU A 31 17.972 -5.936 -6.266 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.492 -5.083 -6.078 1.00 0.00 H new ATOM 506 N LEU A 32 16.961 -1.340 -4.631 1.00 0.00 N ATOM 507 CA LEU A 32 15.995 -0.262 -4.415 1.00 0.00 C ATOM 508 C LEU A 32 16.309 0.967 -5.272 1.00 0.00 C ATOM 509 O LEU A 32 15.567 1.286 -6.201 1.00 0.00 O ATOM 510 CB LEU A 32 15.960 0.117 -2.931 1.00 0.00 C ATOM 511 CG LEU A 32 15.363 1.492 -2.619 1.00 0.00 C ATOM 512 CD1 LEU A 32 13.920 1.570 -3.092 1.00 0.00 C ATOM 513 CD2 LEU A 32 15.458 1.787 -1.129 1.00 0.00 C ATOM 0 H LEU A 32 17.249 -1.821 -3.779 1.00 0.00 H new ATOM 0 HA LEU A 32 15.014 -0.627 -4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.388 -0.639 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 32 16.977 0.084 -2.541 1.00 0.00 H new ATOM 0 HG LEU A 32 15.937 2.247 -3.156 1.00 0.00 H new ATOM 0 HD11 LEU A 32 13.514 2.555 -2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.881 1.405 -4.169 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.329 0.806 -2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.029 2.768 -0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 32 14.909 1.028 -0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 32 16.504 1.777 -0.822 1.00 0.00 H new ATOM 525 N LYS A 33 17.403 1.656 -4.951 1.00 0.00 N ATOM 526 CA LYS A 33 17.803 2.854 -5.694 1.00 0.00 C ATOM 527 C LYS A 33 17.648 2.655 -7.200 1.00 0.00 C ATOM 528 O LYS A 33 17.163 3.537 -7.907 1.00 0.00 O ATOM 529 CB LYS A 33 19.253 3.224 -5.383 1.00 0.00 C ATOM 530 CG LYS A 33 19.527 3.467 -3.910 1.00 0.00 C ATOM 531 CD LYS A 33 21.003 3.728 -3.662 1.00 0.00 C ATOM 532 CE LYS A 33 21.276 4.070 -2.206 1.00 0.00 C ATOM 533 NZ LYS A 33 22.734 4.188 -1.925 1.00 0.00 N ATOM 0 H LYS A 33 18.028 1.408 -4.184 1.00 0.00 H new ATOM 0 HA LYS A 33 17.145 3.663 -5.378 1.00 0.00 H new ATOM 0 HB2 LYS A 33 19.905 2.425 -5.736 1.00 0.00 H new ATOM 0 HB3 LYS A 33 19.516 4.121 -5.944 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.941 4.319 -3.564 1.00 0.00 H new ATOM 0 HG3 LYS A 33 19.205 2.602 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS A 33 21.581 2.848 -3.944 1.00 0.00 H new ATOM 0 HD3 LYS A 33 21.340 4.547 -4.298 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.781 5.008 -1.955 1.00 0.00 H new ATOM 0 HE3 LYS A 33 20.844 3.301 -1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.033 3.407 -1.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 23.264 4.144 -2.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 22.924 5.095 -1.454 1.00 0.00 H new ATOM 547 N GLU A 34 18.073 1.493 -7.685 1.00 0.00 N ATOM 548 CA GLU A 34 17.993 1.181 -9.107 1.00 0.00 C ATOM 549 C GLU A 34 16.577 1.382 -9.652 1.00 0.00 C ATOM 550 O GLU A 34 16.382 2.104 -10.628 1.00 0.00 O ATOM 551 CB GLU A 34 18.456 -0.256 -9.362 1.00 0.00 C ATOM 552 CG GLU A 34 19.774 -0.346 -10.114 1.00 0.00 C ATOM 553 CD GLU A 34 19.626 -0.047 -11.592 1.00 0.00 C ATOM 554 OE1 GLU A 34 19.212 1.082 -11.932 1.00 0.00 O ATOM 555 OE2 GLU A 34 19.924 -0.942 -12.412 1.00 0.00 O ATOM 0 H GLU A 34 18.477 0.751 -7.113 1.00 0.00 H new ATOM 0 HA GLU A 34 18.653 1.871 -9.633 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.556 -0.771 -8.407 1.00 0.00 H new ATOM 0 HB3 GLU A 34 17.687 -0.781 -9.929 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.486 0.353 -9.676 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.191 -1.345 -9.990 1.00 0.00 H new ATOM 562 N LEU A 35 15.595 0.734 -9.028 1.00 0.00 N ATOM 563 CA LEU A 35 14.202 0.842 -9.473 1.00 0.00 C ATOM 564 C LEU A 35 13.770 2.286 -9.616 1.00 0.00 C ATOM 565 O LEU A 35 12.995 2.629 -10.508 1.00 0.00 O ATOM 566 CB LEU A 35 13.255 0.112 -8.514 1.00 0.00 C ATOM 567 CG LEU A 35 13.483 -1.396 -8.390 1.00 0.00 C ATOM 568 CD1 LEU A 35 13.913 -1.985 -9.726 1.00 0.00 C ATOM 569 CD2 LEU A 35 14.516 -1.679 -7.313 1.00 0.00 C ATOM 0 H LEU A 35 15.734 0.131 -8.217 1.00 0.00 H new ATOM 0 HA LEU A 35 14.147 0.368 -10.453 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.351 0.560 -7.525 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.230 0.282 -8.843 1.00 0.00 H new ATOM 0 HG LEU A 35 12.545 -1.871 -8.102 1.00 0.00 H new ATOM 0 HD11 LEU A 35 14.070 -3.058 -9.617 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.136 -1.806 -10.470 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.841 -1.514 -10.050 1.00 0.00 H new ATOM 0 HD21 LEU A 35 14.672 -2.755 -7.232 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.457 -1.195 -7.575 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.162 -1.291 -6.358 1.00 0.00 H new ATOM 581 N ILE A 36 14.274 3.130 -8.739 1.00 0.00 N ATOM 582 CA ILE A 36 13.932 4.546 -8.782 1.00 0.00 C ATOM 583 C ILE A 36 14.328 5.138 -10.131 1.00 0.00 C ATOM 584 O ILE A 36 13.537 5.815 -10.780 1.00 0.00 O ATOM 585 CB ILE A 36 14.571 5.348 -7.613 1.00 0.00 C ATOM 586 CG1 ILE A 36 13.618 5.315 -6.407 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.891 6.784 -8.033 1.00 0.00 C ATOM 588 CD1 ILE A 36 13.612 6.577 -5.572 1.00 0.00 C ATOM 0 H ILE A 36 14.917 2.868 -7.992 1.00 0.00 H new ATOM 0 HA ILE A 36 12.852 4.627 -8.659 1.00 0.00 H new ATOM 0 HB ILE A 36 15.518 4.885 -7.334 1.00 0.00 H new ATOM 0 HG12 ILE A 36 12.606 5.128 -6.766 1.00 0.00 H new ATOM 0 HG13 ILE A 36 13.890 4.474 -5.769 1.00 0.00 H new ATOM 0 HG21 ILE A 36 15.336 7.318 -7.194 1.00 0.00 H new ATOM 0 HG22 ILE A 36 15.592 6.771 -8.868 1.00 0.00 H new ATOM 0 HG23 ILE A 36 13.973 7.287 -8.337 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.912 6.463 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 36 14.612 6.758 -5.178 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.308 7.421 -6.191 1.00 0.00 H new ATOM 600 N ASN A 37 15.545 4.854 -10.559 1.00 0.00 N ATOM 601 CA ASN A 37 16.023 5.339 -11.845 1.00 0.00 C ATOM 602 C ASN A 37 15.659 4.356 -12.956 1.00 0.00 C ATOM 603 O ASN A 37 15.831 4.649 -14.138 1.00 0.00 O ATOM 604 CB ASN A 37 17.537 5.557 -11.808 1.00 0.00 C ATOM 605 CG ASN A 37 18.286 4.330 -11.326 1.00 0.00 C ATOM 606 OD1 ASN A 37 18.249 3.991 -10.143 1.00 0.00 O ATOM 607 ND2 ASN A 37 18.973 3.657 -12.242 1.00 0.00 N ATOM 0 H ASN A 37 16.219 4.293 -10.039 1.00 0.00 H new ATOM 0 HA ASN A 37 15.539 6.294 -12.052 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.887 5.825 -12.805 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.764 6.398 -11.154 1.00 0.00 H new ATOM 0 HD21 ASN A 37 19.497 2.824 -11.976 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.976 3.973 -13.212 1.00 0.00 H new ATOM 614 N ASN A 38 15.153 3.185 -12.565 1.00 0.00 N ATOM 615 CA ASN A 38 14.764 2.162 -13.525 1.00 0.00 C ATOM 616 C ASN A 38 13.288 2.283 -13.894 1.00 0.00 C ATOM 617 O ASN A 38 12.878 1.845 -14.968 1.00 0.00 O ATOM 618 CB ASN A 38 15.046 0.761 -12.966 1.00 0.00 C ATOM 619 CG ASN A 38 15.292 -0.257 -14.063 1.00 0.00 C ATOM 620 OD1 ASN A 38 15.902 0.052 -15.086 1.00 0.00 O ATOM 621 ND2 ASN A 38 14.818 -1.479 -13.852 1.00 0.00 N ATOM 0 H ASN A 38 15.005 2.926 -11.590 1.00 0.00 H new ATOM 0 HA ASN A 38 15.359 2.313 -14.426 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.915 0.802 -12.310 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.202 0.439 -12.357 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.954 -2.207 -14.554 1.00 0.00 H new ATOM 0 HD22 ASN A 38 14.318 -1.690 -12.988 1.00 0.00 H new ATOM 628 N GLU A 39 12.485 2.866 -13.002 1.00 0.00 N ATOM 629 CA GLU A 39 11.056 3.008 -13.276 1.00 0.00 C ATOM 630 C GLU A 39 10.431 4.227 -12.589 1.00 0.00 C ATOM 631 O GLU A 39 9.417 4.102 -11.903 1.00 0.00 O ATOM 632 CB GLU A 39 10.315 1.739 -12.847 1.00 0.00 C ATOM 633 CG GLU A 39 10.453 1.425 -11.367 1.00 0.00 C ATOM 634 CD GLU A 39 9.465 0.374 -10.902 1.00 0.00 C ATOM 635 OE1 GLU A 39 9.465 -0.736 -11.474 1.00 0.00 O ATOM 636 OE2 GLU A 39 8.692 0.659 -9.963 1.00 0.00 O ATOM 0 H GLU A 39 12.791 3.240 -12.104 1.00 0.00 H new ATOM 0 HA GLU A 39 10.956 3.161 -14.350 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.258 1.846 -13.090 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.691 0.895 -13.426 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.467 1.080 -11.165 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.306 2.338 -10.790 1.00 0.00 H new ATOM 643 N LEU A 40 11.013 5.407 -12.798 1.00 0.00 N ATOM 644 CA LEU A 40 10.472 6.634 -12.215 1.00 0.00 C ATOM 645 C LEU A 40 10.951 7.858 -12.986 1.00 0.00 C ATOM 646 O LEU A 40 12.146 8.149 -13.032 1.00 0.00 O ATOM 647 CB LEU A 40 10.861 6.774 -10.741 1.00 0.00 C ATOM 648 CG LEU A 40 10.340 5.681 -9.808 1.00 0.00 C ATOM 649 CD1 LEU A 40 10.889 5.882 -8.403 1.00 0.00 C ATOM 650 CD2 LEU A 40 8.817 5.674 -9.789 1.00 0.00 C ATOM 0 H LEU A 40 11.852 5.539 -13.362 1.00 0.00 H new ATOM 0 HA LEU A 40 9.386 6.570 -12.282 1.00 0.00 H new ATOM 0 HB2 LEU A 40 11.949 6.796 -10.672 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.500 7.737 -10.379 1.00 0.00 H new ATOM 0 HG LEU A 40 10.682 4.715 -10.181 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.510 5.097 -7.749 1.00 0.00 H new ATOM 0 HD12 LEU A 40 11.978 5.839 -8.428 1.00 0.00 H new ATOM 0 HD13 LEU A 40 10.573 6.854 -8.024 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.465 4.889 -9.119 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.453 6.640 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 40 8.441 5.488 -10.795 1.00 0.00 H new ATOM 779 N LYS A 48 16.805 11.822 -4.519 1.00 0.00 N ATOM 780 CA LYS A 48 17.648 12.927 -4.073 1.00 0.00 C ATOM 781 C LYS A 48 19.123 12.541 -4.017 1.00 0.00 C ATOM 782 O LYS A 48 19.997 13.396 -4.165 1.00 0.00 O ATOM 783 CB LYS A 48 17.190 13.425 -2.702 1.00 0.00 C ATOM 784 CG LYS A 48 15.774 13.978 -2.699 1.00 0.00 C ATOM 785 CD LYS A 48 15.065 13.690 -1.385 1.00 0.00 C ATOM 786 CE LYS A 48 14.308 12.373 -1.440 1.00 0.00 C ATOM 787 NZ LYS A 48 12.854 12.577 -1.690 1.00 0.00 N ATOM 0 HA LYS A 48 17.543 13.726 -4.807 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.253 12.605 -1.987 1.00 0.00 H new ATOM 0 HB3 LYS A 48 17.875 14.200 -2.359 1.00 0.00 H new ATOM 0 HG2 LYS A 48 15.802 15.054 -2.870 1.00 0.00 H new ATOM 0 HG3 LYS A 48 15.209 13.539 -3.522 1.00 0.00 H new ATOM 0 HD2 LYS A 48 15.794 13.659 -0.576 1.00 0.00 H new ATOM 0 HD3 LYS A 48 14.372 14.500 -1.158 1.00 0.00 H new ATOM 0 HE2 LYS A 48 14.727 11.746 -2.227 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.443 11.837 -0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 12.374 11.655 -1.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 12.448 13.154 -0.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.723 13.065 -2.599 1.00 0.00 H new ATOM 801 N GLU A 49 19.404 11.258 -3.800 1.00 0.00 N ATOM 802 CA GLU A 49 20.785 10.786 -3.723 1.00 0.00 C ATOM 803 C GLU A 49 20.868 9.356 -3.201 1.00 0.00 C ATOM 804 O GLU A 49 19.860 8.738 -2.851 1.00 0.00 O ATOM 805 CB GLU A 49 21.611 11.701 -2.809 1.00 0.00 C ATOM 806 CG GLU A 49 22.741 12.420 -3.529 1.00 0.00 C ATOM 807 CD GLU A 49 22.898 13.860 -3.079 1.00 0.00 C ATOM 808 OE1 GLU A 49 22.395 14.198 -1.988 1.00 0.00 O ATOM 809 OE2 GLU A 49 23.523 14.647 -3.819 1.00 0.00 O ATOM 0 H GLU A 49 18.700 10.531 -3.675 1.00 0.00 H new ATOM 0 HA GLU A 49 21.188 10.807 -4.736 1.00 0.00 H new ATOM 0 HB2 GLU A 49 20.951 12.441 -2.357 1.00 0.00 H new ATOM 0 HB3 GLU A 49 22.029 11.107 -1.996 1.00 0.00 H new ATOM 0 HG2 GLU A 49 23.675 11.885 -3.356 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.555 12.397 -4.603 1.00 0.00 H new ATOM 816 N GLN A 50 22.093 8.848 -3.133 1.00 0.00 N ATOM 817 CA GLN A 50 22.346 7.505 -2.637 1.00 0.00 C ATOM 818 C GLN A 50 22.189 7.467 -1.117 1.00 0.00 C ATOM 819 O GLN A 50 21.955 6.410 -0.530 1.00 0.00 O ATOM 820 CB GLN A 50 23.757 7.059 -3.031 1.00 0.00 C ATOM 821 CG GLN A 50 23.799 6.205 -4.287 1.00 0.00 C ATOM 822 CD GLN A 50 24.894 5.157 -4.243 1.00 0.00 C ATOM 823 OE1 GLN A 50 24.759 4.129 -3.580 1.00 0.00 O ATOM 824 NE2 GLN A 50 25.988 5.415 -4.950 1.00 0.00 N ATOM 0 H GLN A 50 22.932 9.353 -3.418 1.00 0.00 H new ATOM 0 HA GLN A 50 21.622 6.822 -3.082 1.00 0.00 H new ATOM 0 HB2 GLN A 50 24.379 7.942 -3.181 1.00 0.00 H new ATOM 0 HB3 GLN A 50 24.195 6.498 -2.206 1.00 0.00 H new ATOM 0 HG2 GLN A 50 22.835 5.713 -4.420 1.00 0.00 H new ATOM 0 HG3 GLN A 50 23.951 6.848 -5.154 1.00 0.00 H new ATOM 0 HE21 GLN A 50 26.057 6.280 -5.485 1.00 0.00 H new ATOM 0 HE22 GLN A 50 26.759 4.748 -4.958 1.00 0.00 H new ATOM 833 N GLU A 51 22.325 8.634 -0.490 1.00 0.00 N ATOM 834 CA GLU A 51 22.206 8.751 0.958 1.00 0.00 C ATOM 835 C GLU A 51 20.746 8.814 1.397 1.00 0.00 C ATOM 836 O GLU A 51 20.377 8.249 2.427 1.00 0.00 O ATOM 837 CB GLU A 51 22.941 9.997 1.459 1.00 0.00 C ATOM 838 CG GLU A 51 22.783 11.213 0.560 1.00 0.00 C ATOM 839 CD GLU A 51 23.949 11.388 -0.393 1.00 0.00 C ATOM 840 OE1 GLU A 51 24.488 10.365 -0.866 1.00 0.00 O ATOM 841 OE2 GLU A 51 24.322 12.548 -0.667 1.00 0.00 O ATOM 0 H GLU A 51 22.519 9.515 -0.967 1.00 0.00 H new ATOM 0 HA GLU A 51 22.660 7.861 1.393 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.576 10.245 2.456 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.002 9.766 1.557 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.861 11.119 -0.013 1.00 0.00 H new ATOM 0 HG3 GLU A 51 22.685 12.106 1.177 1.00 0.00 H new ATOM 848 N VAL A 52 19.921 9.507 0.619 1.00 0.00 N ATOM 849 CA VAL A 52 18.508 9.636 0.950 1.00 0.00 C ATOM 850 C VAL A 52 17.831 8.273 0.933 1.00 0.00 C ATOM 851 O VAL A 52 17.031 7.958 1.811 1.00 0.00 O ATOM 852 CB VAL A 52 17.771 10.589 -0.017 1.00 0.00 C ATOM 853 CG1 VAL A 52 18.263 12.016 0.165 1.00 0.00 C ATOM 854 CG2 VAL A 52 17.954 10.137 -1.450 1.00 0.00 C ATOM 0 H VAL A 52 20.204 9.984 -0.237 1.00 0.00 H new ATOM 0 HA VAL A 52 18.452 10.062 1.952 1.00 0.00 H new ATOM 0 HB VAL A 52 16.706 10.562 0.215 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.733 12.674 -0.524 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.076 12.337 1.190 1.00 0.00 H new ATOM 0 HG13 VAL A 52 19.333 12.061 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.428 10.820 -2.117 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.015 10.133 -1.698 1.00 0.00 H new ATOM 0 HG23 VAL A 52 17.550 9.131 -1.569 1.00 0.00 H new ATOM 864 N VAL A 53 18.167 7.467 -0.070 1.00 0.00 N ATOM 865 CA VAL A 53 17.597 6.134 -0.206 1.00 0.00 C ATOM 866 C VAL A 53 18.001 5.237 0.957 1.00 0.00 C ATOM 867 O VAL A 53 17.158 4.566 1.551 1.00 0.00 O ATOM 868 CB VAL A 53 18.011 5.489 -1.538 1.00 0.00 C ATOM 869 CG1 VAL A 53 17.445 4.081 -1.671 1.00 0.00 C ATOM 870 CG2 VAL A 53 17.561 6.368 -2.679 1.00 0.00 C ATOM 0 H VAL A 53 18.833 7.716 -0.801 1.00 0.00 H new ATOM 0 HA VAL A 53 16.513 6.243 -0.194 1.00 0.00 H new ATOM 0 HB VAL A 53 19.097 5.399 -1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 53 17.756 3.652 -2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.817 3.461 -0.855 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.357 4.121 -1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 53 17.853 5.913 -3.626 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.477 6.478 -2.648 1.00 0.00 H new ATOM 0 HG23 VAL A 53 18.027 7.349 -2.588 1.00 0.00 H new ATOM 880 N ASP A 54 19.287 5.236 1.297 1.00 0.00 N ATOM 881 CA ASP A 54 19.765 4.424 2.408 1.00 0.00 C ATOM 882 C ASP A 54 18.960 4.751 3.657 1.00 0.00 C ATOM 883 O ASP A 54 18.610 3.867 4.440 1.00 0.00 O ATOM 884 CB ASP A 54 21.256 4.663 2.655 1.00 0.00 C ATOM 885 CG ASP A 54 21.854 3.646 3.607 1.00 0.00 C ATOM 886 OD1 ASP A 54 21.591 2.438 3.426 1.00 0.00 O ATOM 887 OD2 ASP A 54 22.586 4.057 4.531 1.00 0.00 O ATOM 0 H ASP A 54 20.008 5.782 0.825 1.00 0.00 H new ATOM 0 HA ASP A 54 19.632 3.371 2.159 1.00 0.00 H new ATOM 0 HB2 ASP A 54 21.790 4.625 1.705 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.398 5.664 3.061 1.00 0.00 H new ATOM 892 N LYS A 55 18.642 6.029 3.815 1.00 0.00 N ATOM 893 CA LYS A 55 17.845 6.481 4.937 1.00 0.00 C ATOM 894 C LYS A 55 16.378 6.181 4.665 1.00 0.00 C ATOM 895 O LYS A 55 15.613 5.895 5.583 1.00 0.00 O ATOM 896 CB LYS A 55 18.045 7.979 5.175 1.00 0.00 C ATOM 897 CG LYS A 55 18.099 8.354 6.647 1.00 0.00 C ATOM 898 CD LYS A 55 18.347 9.843 6.842 1.00 0.00 C ATOM 899 CE LYS A 55 19.631 10.294 6.162 1.00 0.00 C ATOM 900 NZ LYS A 55 19.913 11.735 6.406 1.00 0.00 N ATOM 0 H LYS A 55 18.927 6.770 3.175 1.00 0.00 H new ATOM 0 HA LYS A 55 18.164 5.952 5.835 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.970 8.296 4.693 1.00 0.00 H new ATOM 0 HB3 LYS A 55 17.233 8.527 4.698 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.161 8.076 7.128 1.00 0.00 H new ATOM 0 HG3 LYS A 55 18.890 7.786 7.138 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.505 10.408 6.441 1.00 0.00 H new ATOM 0 HD3 LYS A 55 18.402 10.066 7.907 1.00 0.00 H new ATOM 0 HE2 LYS A 55 20.465 9.694 6.527 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.555 10.116 5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.796 12.002 5.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.130 12.310 6.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 20.011 11.901 7.428 1.00 0.00 H new ATOM 914 N VAL A 56 15.998 6.231 3.385 1.00 0.00 N ATOM 915 CA VAL A 56 14.626 5.946 2.982 1.00 0.00 C ATOM 916 C VAL A 56 14.215 4.558 3.461 1.00 0.00 C ATOM 917 O VAL A 56 13.201 4.407 4.144 1.00 0.00 O ATOM 918 CB VAL A 56 14.441 6.046 1.449 1.00 0.00 C ATOM 919 CG1 VAL A 56 13.103 5.453 1.023 1.00 0.00 C ATOM 920 CG2 VAL A 56 14.555 7.495 0.986 1.00 0.00 C ATOM 0 H VAL A 56 16.623 6.466 2.614 1.00 0.00 H new ATOM 0 HA VAL A 56 13.987 6.698 3.445 1.00 0.00 H new ATOM 0 HB VAL A 56 15.235 5.469 0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 56 12.996 5.535 -0.059 1.00 0.00 H new ATOM 0 HG12 VAL A 56 13.061 4.403 1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 56 12.293 5.996 1.510 1.00 0.00 H new ATOM 0 HG21 VAL A 56 14.422 7.543 -0.095 1.00 0.00 H new ATOM 0 HG22 VAL A 56 13.786 8.094 1.473 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.539 7.884 1.248 1.00 0.00 H new ATOM 930 N MET A 57 15.014 3.545 3.125 1.00 0.00 N ATOM 931 CA MET A 57 14.713 2.189 3.564 1.00 0.00 C ATOM 932 C MET A 57 14.796 2.123 5.082 1.00 0.00 C ATOM 933 O MET A 57 14.067 1.368 5.727 1.00 0.00 O ATOM 934 CB MET A 57 15.664 1.170 2.926 1.00 0.00 C ATOM 935 CG MET A 57 17.129 1.569 2.983 1.00 0.00 C ATOM 936 SD MET A 57 17.941 1.460 1.376 1.00 0.00 S ATOM 937 CE MET A 57 17.537 -0.220 0.898 1.00 0.00 C ATOM 0 H MET A 57 15.859 3.637 2.561 1.00 0.00 H new ATOM 0 HA MET A 57 13.703 1.934 3.243 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.540 0.210 3.427 1.00 0.00 H new ATOM 0 HB3 MET A 57 15.378 1.025 1.884 1.00 0.00 H new ATOM 0 HG2 MET A 57 17.209 2.589 3.358 1.00 0.00 H new ATOM 0 HG3 MET A 57 17.649 0.926 3.693 1.00 0.00 H new ATOM 0 HE1 MET A 57 17.456 -0.280 -0.187 1.00 0.00 H new ATOM 0 HE2 MET A 57 18.321 -0.895 1.242 1.00 0.00 H new ATOM 0 HE3 MET A 57 16.587 -0.508 1.349 1.00 0.00 H new ATOM 947 N GLU A 58 15.671 2.952 5.647 1.00 0.00 N ATOM 948 CA GLU A 58 15.831 3.026 7.092 1.00 0.00 C ATOM 949 C GLU A 58 14.577 3.633 7.712 1.00 0.00 C ATOM 950 O GLU A 58 14.179 3.280 8.823 1.00 0.00 O ATOM 951 CB GLU A 58 17.062 3.868 7.443 1.00 0.00 C ATOM 952 CG GLU A 58 18.114 3.105 8.233 1.00 0.00 C ATOM 953 CD GLU A 58 19.104 4.024 8.923 1.00 0.00 C ATOM 954 OE1 GLU A 58 18.672 5.061 9.469 1.00 0.00 O ATOM 955 OE2 GLU A 58 20.312 3.706 8.919 1.00 0.00 O ATOM 0 H GLU A 58 16.279 3.581 5.123 1.00 0.00 H new ATOM 0 HA GLU A 58 15.975 2.022 7.492 1.00 0.00 H new ATOM 0 HB2 GLU A 58 17.511 4.242 6.523 1.00 0.00 H new ATOM 0 HB3 GLU A 58 16.745 4.737 8.020 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.622 2.481 8.979 1.00 0.00 H new ATOM 0 HG3 GLU A 58 18.652 2.435 7.562 1.00 0.00 H new ATOM 962 N THR A 59 13.951 4.542 6.967 1.00 0.00 N ATOM 963 CA THR A 59 12.728 5.203 7.407 1.00 0.00 C ATOM 964 C THR A 59 11.617 4.181 7.623 1.00 0.00 C ATOM 965 O THR A 59 10.689 4.407 8.399 1.00 0.00 O ATOM 966 CB THR A 59 12.288 6.233 6.358 1.00 0.00 C ATOM 967 OG1 THR A 59 13.410 6.816 5.726 1.00 0.00 O ATOM 968 CG2 THR A 59 11.449 7.361 6.920 1.00 0.00 C ATOM 0 H THR A 59 14.276 4.839 6.047 1.00 0.00 H new ATOM 0 HA THR A 59 12.926 5.709 8.352 1.00 0.00 H new ATOM 0 HB THR A 59 11.677 5.669 5.653 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.212 6.650 6.265 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.178 8.047 6.118 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.544 6.952 7.370 1.00 0.00 H new ATOM 0 HG23 THR A 59 12.021 7.897 7.678 1.00 0.00 H new ATOM 976 N LEU A 60 11.716 3.058 6.915 1.00 0.00 N ATOM 977 CA LEU A 60 10.719 1.998 7.008 1.00 0.00 C ATOM 978 C LEU A 60 11.296 0.733 7.636 1.00 0.00 C ATOM 979 O LEU A 60 10.556 -0.201 7.944 1.00 0.00 O ATOM 980 CB LEU A 60 10.173 1.675 5.617 1.00 0.00 C ATOM 981 CG LEU A 60 10.006 2.877 4.687 1.00 0.00 C ATOM 982 CD1 LEU A 60 10.399 2.510 3.265 1.00 0.00 C ATOM 983 CD2 LEU A 60 8.576 3.390 4.737 1.00 0.00 C ATOM 0 H LEU A 60 12.480 2.860 6.269 1.00 0.00 H new ATOM 0 HA LEU A 60 9.914 2.356 7.650 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.840 0.957 5.140 1.00 0.00 H new ATOM 0 HB3 LEU A 60 9.206 1.185 5.729 1.00 0.00 H new ATOM 0 HG LEU A 60 10.668 3.674 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.274 3.378 2.617 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.441 2.191 3.246 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.764 1.698 2.910 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.473 4.246 4.070 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.895 2.600 4.422 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.334 3.693 5.756 1.00 0.00 H new ATOM 995 N ASP A 61 12.617 0.699 7.813 1.00 0.00 N ATOM 996 CA ASP A 61 13.291 -0.463 8.395 1.00 0.00 C ATOM 997 C ASP A 61 12.520 -1.020 9.591 1.00 0.00 C ATOM 998 O ASP A 61 12.702 -0.571 10.723 1.00 0.00 O ATOM 999 CB ASP A 61 14.713 -0.092 8.823 1.00 0.00 C ATOM 1000 CG ASP A 61 15.477 -1.278 9.380 1.00 0.00 C ATOM 1001 OD1 ASP A 61 15.107 -2.427 9.060 1.00 0.00 O ATOM 1002 OD2 ASP A 61 16.446 -1.057 10.136 1.00 0.00 O ATOM 0 H ASP A 61 13.243 1.464 7.561 1.00 0.00 H new ATOM 0 HA ASP A 61 13.332 -1.237 7.629 1.00 0.00 H new ATOM 0 HB2 ASP A 61 15.252 0.315 7.968 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.669 0.695 9.576 1.00 0.00 H new ATOM 1007 N ASN A 62 11.662 -2.001 9.330 1.00 0.00 N ATOM 1008 CA ASN A 62 10.867 -2.620 10.384 1.00 0.00 C ATOM 1009 C ASN A 62 11.495 -3.936 10.830 1.00 0.00 C ATOM 1010 O ASN A 62 11.634 -4.197 12.025 1.00 0.00 O ATOM 1011 CB ASN A 62 9.435 -2.856 9.900 1.00 0.00 C ATOM 1012 CG ASN A 62 8.448 -1.888 10.522 1.00 0.00 C ATOM 1013 OD1 ASN A 62 8.383 -1.751 11.744 1.00 0.00 O ATOM 1014 ND2 ASN A 62 7.672 -1.211 9.683 1.00 0.00 N ATOM 0 H ASN A 62 11.500 -2.384 8.399 1.00 0.00 H new ATOM 0 HA ASN A 62 10.843 -1.942 11.237 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.400 -2.759 8.815 1.00 0.00 H new ATOM 0 HB3 ASN A 62 9.137 -3.877 10.138 1.00 0.00 H new ATOM 0 HD21 ASN A 62 6.988 -0.546 10.045 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.760 -1.356 8.677 1.00 0.00 H new ATOM 1021 N ASP A 63 11.871 -4.762 9.860 1.00 0.00 N ATOM 1022 CA ASP A 63 12.485 -6.052 10.149 1.00 0.00 C ATOM 1023 C ASP A 63 13.251 -6.575 8.938 1.00 0.00 C ATOM 1024 O ASP A 63 13.391 -7.785 8.756 1.00 0.00 O ATOM 1025 CB ASP A 63 11.420 -7.065 10.571 1.00 0.00 C ATOM 1026 CG ASP A 63 11.936 -8.051 11.600 1.00 0.00 C ATOM 1027 OD1 ASP A 63 12.651 -7.620 12.529 1.00 0.00 O ATOM 1028 OD2 ASP A 63 11.624 -9.255 11.478 1.00 0.00 O ATOM 0 H ASP A 63 11.761 -4.561 8.866 1.00 0.00 H new ATOM 0 HA ASP A 63 13.190 -5.914 10.969 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.560 -6.535 10.979 1.00 0.00 H new ATOM 0 HB3 ASP A 63 11.072 -7.609 9.693 1.00 0.00 H new ATOM 1033 N GLY A 64 13.747 -5.658 8.113 1.00 0.00 N ATOM 1034 CA GLY A 64 14.496 -6.050 6.935 1.00 0.00 C ATOM 1035 C GLY A 64 15.996 -5.938 7.133 1.00 0.00 C ATOM 1036 O GLY A 64 16.765 -6.076 6.182 1.00 0.00 O ATOM 0 H GLY A 64 13.643 -4.651 8.240 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.244 -7.078 6.674 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.197 -5.425 6.094 1.00 0.00 H new ATOM 1040 N ASP A 65 16.413 -5.685 8.371 1.00 0.00 N ATOM 1041 CA ASP A 65 17.830 -5.552 8.689 1.00 0.00 C ATOM 1042 C ASP A 65 18.453 -4.387 7.928 1.00 0.00 C ATOM 1043 O ASP A 65 19.657 -4.373 7.672 1.00 0.00 O ATOM 1044 CB ASP A 65 18.573 -6.849 8.360 1.00 0.00 C ATOM 1045 CG ASP A 65 18.374 -7.914 9.420 1.00 0.00 C ATOM 1046 OD1 ASP A 65 18.043 -7.553 10.569 1.00 0.00 O ATOM 1047 OD2 ASP A 65 18.548 -9.109 9.101 1.00 0.00 O ATOM 0 H ASP A 65 15.789 -5.568 9.169 1.00 0.00 H new ATOM 0 HA ASP A 65 17.919 -5.352 9.757 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.228 -7.228 7.398 1.00 0.00 H new ATOM 0 HB3 ASP A 65 19.637 -6.638 8.256 1.00 0.00 H new ATOM 1052 N GLY A 66 17.627 -3.407 7.572 1.00 0.00 N ATOM 1053 CA GLY A 66 18.119 -2.250 6.849 1.00 0.00 C ATOM 1054 C GLY A 66 17.755 -2.272 5.375 1.00 0.00 C ATOM 1055 O GLY A 66 18.002 -1.303 4.659 1.00 0.00 O ATOM 0 H GLY A 66 16.627 -3.395 7.772 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.715 -1.346 7.304 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.203 -2.200 6.949 1.00 0.00 H new ATOM 1059 N GLU A 67 17.167 -3.375 4.917 1.00 0.00 N ATOM 1060 CA GLU A 67 16.776 -3.503 3.524 1.00 0.00 C ATOM 1061 C GLU A 67 15.291 -3.210 3.354 1.00 0.00 C ATOM 1062 O GLU A 67 14.574 -2.994 4.331 1.00 0.00 O ATOM 1063 CB GLU A 67 17.090 -4.911 3.013 1.00 0.00 C ATOM 1064 CG GLU A 67 18.195 -4.946 1.972 1.00 0.00 C ATOM 1065 CD GLU A 67 19.422 -5.705 2.445 1.00 0.00 C ATOM 1066 OE1 GLU A 67 19.311 -6.927 2.671 1.00 0.00 O ATOM 1067 OE2 GLU A 67 20.491 -5.075 2.586 1.00 0.00 O ATOM 0 H GLU A 67 16.953 -4.189 5.493 1.00 0.00 H new ATOM 0 HA GLU A 67 17.344 -2.778 2.941 1.00 0.00 H new ATOM 0 HB2 GLU A 67 17.376 -5.539 3.856 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.185 -5.344 2.586 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.816 -5.409 1.061 1.00 0.00 H new ATOM 0 HG3 GLU A 67 18.480 -3.925 1.716 1.00 0.00 H new ATOM 1074 N CYS A 68 14.838 -3.203 2.109 1.00 0.00 N ATOM 1075 CA CYS A 68 13.438 -2.935 1.810 1.00 0.00 C ATOM 1076 C CYS A 68 12.757 -4.152 1.188 1.00 0.00 C ATOM 1077 O CYS A 68 12.647 -4.248 -0.031 1.00 0.00 O ATOM 1078 CB CYS A 68 13.328 -1.745 0.853 1.00 0.00 C ATOM 1079 SG CYS A 68 12.125 -0.494 1.360 1.00 0.00 S ATOM 0 H CYS A 68 15.419 -3.380 1.289 1.00 0.00 H new ATOM 0 HA CYS A 68 12.935 -2.704 2.749 1.00 0.00 H new ATOM 0 HB2 CYS A 68 14.307 -1.275 0.762 1.00 0.00 H new ATOM 0 HB3 CYS A 68 13.057 -2.113 -0.137 1.00 0.00 H new ATOM 0 HG CYS A 68 12.108 0.470 0.488 1.00 0.00 H new ATOM 1085 N ASP A 69 12.272 -5.065 2.023 1.00 0.00 N ATOM 1086 CA ASP A 69 11.581 -6.247 1.522 1.00 0.00 C ATOM 1087 C ASP A 69 10.134 -5.887 1.190 1.00 0.00 C ATOM 1088 O ASP A 69 9.793 -4.707 1.109 1.00 0.00 O ATOM 1089 CB ASP A 69 11.633 -7.393 2.538 1.00 0.00 C ATOM 1090 CG ASP A 69 11.419 -6.936 3.968 1.00 0.00 C ATOM 1091 OD1 ASP A 69 12.086 -5.969 4.391 1.00 0.00 O ATOM 1092 OD2 ASP A 69 10.584 -7.549 4.667 1.00 0.00 O ATOM 0 H ASP A 69 12.343 -5.011 3.039 1.00 0.00 H new ATOM 0 HA ASP A 69 12.084 -6.589 0.618 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.873 -8.131 2.282 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.599 -7.892 2.464 1.00 0.00 H new ATOM 1097 N PHE A 70 9.280 -6.889 1.005 1.00 0.00 N ATOM 1098 CA PHE A 70 7.880 -6.631 0.693 1.00 0.00 C ATOM 1099 C PHE A 70 7.152 -6.063 1.905 1.00 0.00 C ATOM 1100 O PHE A 70 6.055 -5.514 1.784 1.00 0.00 O ATOM 1101 CB PHE A 70 7.182 -7.906 0.222 1.00 0.00 C ATOM 1102 CG PHE A 70 5.928 -7.639 -0.558 1.00 0.00 C ATOM 1103 CD1 PHE A 70 5.953 -6.814 -1.667 1.00 0.00 C ATOM 1104 CD2 PHE A 70 4.726 -8.210 -0.177 1.00 0.00 C ATOM 1105 CE1 PHE A 70 4.800 -6.561 -2.388 1.00 0.00 C ATOM 1106 CE2 PHE A 70 3.569 -7.963 -0.892 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.606 -7.137 -1.998 1.00 0.00 C ATOM 0 H PHE A 70 9.530 -7.876 1.065 1.00 0.00 H new ATOM 0 HA PHE A 70 7.850 -5.897 -0.113 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.871 -8.483 -0.396 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.939 -8.521 1.089 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.884 -6.361 -1.974 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.692 -8.855 0.688 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.833 -5.915 -3.253 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.637 -8.415 -0.586 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.703 -6.941 -2.557 1.00 0.00 H new ATOM 1117 N GLN A 71 7.773 -6.190 3.070 1.00 0.00 N ATOM 1118 CA GLN A 71 7.185 -5.682 4.304 1.00 0.00 C ATOM 1119 C GLN A 71 7.329 -4.166 4.370 1.00 0.00 C ATOM 1120 O GLN A 71 6.426 -3.459 4.819 1.00 0.00 O ATOM 1121 CB GLN A 71 7.838 -6.344 5.525 1.00 0.00 C ATOM 1122 CG GLN A 71 9.065 -5.612 6.056 1.00 0.00 C ATOM 1123 CD GLN A 71 9.660 -6.286 7.275 1.00 0.00 C ATOM 1124 OE1 GLN A 71 10.656 -7.003 7.178 1.00 0.00 O ATOM 1125 NE2 GLN A 71 9.051 -6.058 8.433 1.00 0.00 N ATOM 0 H GLN A 71 8.681 -6.639 3.187 1.00 0.00 H new ATOM 0 HA GLN A 71 6.123 -5.929 4.312 1.00 0.00 H new ATOM 0 HB2 GLN A 71 7.099 -6.416 6.323 1.00 0.00 H new ATOM 0 HB3 GLN A 71 8.123 -7.363 5.262 1.00 0.00 H new ATOM 0 HG2 GLN A 71 9.819 -5.557 5.271 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.792 -4.587 6.308 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.228 -5.457 8.467 1.00 0.00 H new ATOM 0 HE22 GLN A 71 9.406 -6.484 9.289 1.00 0.00 H new ATOM 1134 N GLU A 72 8.468 -3.678 3.895 1.00 0.00 N ATOM 1135 CA GLU A 72 8.737 -2.247 3.874 1.00 0.00 C ATOM 1136 C GLU A 72 8.064 -1.621 2.657 1.00 0.00 C ATOM 1137 O GLU A 72 7.723 -0.439 2.653 1.00 0.00 O ATOM 1138 CB GLU A 72 10.245 -1.985 3.845 1.00 0.00 C ATOM 1139 CG GLU A 72 11.046 -2.929 4.732 1.00 0.00 C ATOM 1140 CD GLU A 72 11.775 -2.207 5.848 1.00 0.00 C ATOM 1141 OE1 GLU A 72 12.097 -1.013 5.672 1.00 0.00 O ATOM 1142 OE2 GLU A 72 12.024 -2.837 6.896 1.00 0.00 O ATOM 0 H GLU A 72 9.221 -4.254 3.519 1.00 0.00 H new ATOM 0 HA GLU A 72 8.332 -1.795 4.779 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.601 -2.075 2.819 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.433 -0.958 4.159 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.375 -3.672 5.163 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.769 -3.469 4.121 1.00 0.00 H new ATOM 1149 N PHE A 73 7.863 -2.448 1.634 1.00 0.00 N ATOM 1150 CA PHE A 73 7.214 -2.029 0.399 1.00 0.00 C ATOM 1151 C PHE A 73 5.852 -1.418 0.696 1.00 0.00 C ATOM 1152 O PHE A 73 5.607 -0.244 0.421 1.00 0.00 O ATOM 1153 CB PHE A 73 7.040 -3.250 -0.507 1.00 0.00 C ATOM 1154 CG PHE A 73 7.541 -3.091 -1.917 1.00 0.00 C ATOM 1155 CD1 PHE A 73 8.542 -2.185 -2.239 1.00 0.00 C ATOM 1156 CD2 PHE A 73 7.007 -3.877 -2.922 1.00 0.00 C ATOM 1157 CE1 PHE A 73 8.992 -2.068 -3.542 1.00 0.00 C ATOM 1158 CE2 PHE A 73 7.451 -3.766 -4.220 1.00 0.00 C ATOM 1159 CZ PHE A 73 8.446 -2.860 -4.533 1.00 0.00 C ATOM 0 H PHE A 73 8.146 -3.428 1.640 1.00 0.00 H new ATOM 0 HA PHE A 73 7.831 -1.279 -0.095 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.556 -4.095 -0.051 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.981 -3.505 -0.544 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.973 -1.566 -1.466 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.230 -4.589 -2.685 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.769 -1.358 -3.784 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.022 -4.386 -4.993 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.796 -2.771 -5.551 1.00 0.00 H new ATOM 1169 N MET A 74 4.968 -2.232 1.264 1.00 0.00 N ATOM 1170 CA MET A 74 3.627 -1.783 1.606 1.00 0.00 C ATOM 1171 C MET A 74 3.690 -0.646 2.618 1.00 0.00 C ATOM 1172 O MET A 74 3.085 0.405 2.421 1.00 0.00 O ATOM 1173 CB MET A 74 2.799 -2.942 2.165 1.00 0.00 C ATOM 1174 CG MET A 74 3.011 -4.261 1.435 1.00 0.00 C ATOM 1175 SD MET A 74 2.958 -4.087 -0.361 1.00 0.00 S ATOM 1176 CE MET A 74 1.431 -3.174 -0.567 1.00 0.00 C ATOM 0 H MET A 74 5.158 -3.207 1.497 1.00 0.00 H new ATOM 0 HA MET A 74 3.145 -1.418 0.699 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.046 -3.077 3.218 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.743 -2.677 2.117 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.974 -4.681 1.726 1.00 0.00 H new ATOM 0 HG3 MET A 74 2.246 -4.971 1.749 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.222 -3.050 -1.630 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.614 -3.721 -0.098 1.00 0.00 H new ATOM 0 HE3 MET A 74 1.527 -2.194 -0.099 1.00 0.00 H new ATOM 1186 N ALA A 75 4.437 -0.858 3.698 1.00 0.00 N ATOM 1187 CA ALA A 75 4.584 0.158 4.732 1.00 0.00 C ATOM 1188 C ALA A 75 5.166 1.448 4.153 1.00 0.00 C ATOM 1189 O ALA A 75 5.035 2.517 4.744 1.00 0.00 O ATOM 1190 CB ALA A 75 5.460 -0.360 5.862 1.00 0.00 C ATOM 0 H ALA A 75 4.948 -1.722 3.878 1.00 0.00 H new ATOM 0 HA ALA A 75 3.595 0.383 5.131 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.561 0.410 6.627 1.00 0.00 H new ATOM 0 HB2 ALA A 75 5.003 -1.248 6.299 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.445 -0.614 5.471 1.00 0.00 H new ATOM 1196 N PHE A 76 5.810 1.336 2.995 1.00 0.00 N ATOM 1197 CA PHE A 76 6.414 2.489 2.335 1.00 0.00 C ATOM 1198 C PHE A 76 5.393 3.225 1.478 1.00 0.00 C ATOM 1199 O PHE A 76 4.909 4.295 1.845 1.00 0.00 O ATOM 1200 CB PHE A 76 7.575 2.027 1.459 1.00 0.00 C ATOM 1201 CG PHE A 76 8.101 3.078 0.525 1.00 0.00 C ATOM 1202 CD1 PHE A 76 8.449 4.336 0.988 1.00 0.00 C ATOM 1203 CD2 PHE A 76 8.243 2.800 -0.820 1.00 0.00 C ATOM 1204 CE1 PHE A 76 8.931 5.298 0.121 1.00 0.00 C ATOM 1205 CE2 PHE A 76 8.724 3.755 -1.694 1.00 0.00 C ATOM 1206 CZ PHE A 76 9.069 5.007 -1.223 1.00 0.00 C ATOM 0 H PHE A 76 5.927 0.456 2.493 1.00 0.00 H new ATOM 0 HA PHE A 76 6.777 3.172 3.103 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.388 1.689 2.102 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.253 1.166 0.874 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.343 4.568 2.038 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.974 1.823 -1.193 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.199 6.276 0.493 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.830 3.524 -2.744 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.446 5.756 -1.903 1.00 0.00 H new ATOM 1216 N VAL A 77 5.077 2.639 0.329 1.00 0.00 N ATOM 1217 CA VAL A 77 4.123 3.231 -0.593 1.00 0.00 C ATOM 1218 C VAL A 77 2.814 3.578 0.105 1.00 0.00 C ATOM 1219 O VAL A 77 2.072 4.434 -0.359 1.00 0.00 O ATOM 1220 CB VAL A 77 3.826 2.282 -1.772 1.00 0.00 C ATOM 1221 CG1 VAL A 77 2.981 2.982 -2.827 1.00 0.00 C ATOM 1222 CG2 VAL A 77 5.121 1.759 -2.374 1.00 0.00 C ATOM 0 H VAL A 77 5.470 1.752 0.016 1.00 0.00 H new ATOM 0 HA VAL A 77 4.578 4.146 -0.971 1.00 0.00 H new ATOM 0 HB VAL A 77 3.258 1.432 -1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.783 2.295 -3.650 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.037 3.300 -2.385 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.517 3.853 -3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.892 1.091 -3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.718 2.596 -2.735 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.682 1.215 -1.614 1.00 0.00 H new ATOM 1232 N ALA A 78 2.532 2.905 1.215 1.00 0.00 N ATOM 1233 CA ALA A 78 1.294 3.153 1.956 1.00 0.00 C ATOM 1234 C ALA A 78 1.428 4.318 2.935 1.00 0.00 C ATOM 1235 O ALA A 78 0.569 5.199 2.978 1.00 0.00 O ATOM 1236 CB ALA A 78 0.860 1.895 2.695 1.00 0.00 C ATOM 0 H ALA A 78 3.135 2.190 1.621 1.00 0.00 H new ATOM 0 HA ALA A 78 0.532 3.427 1.227 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.062 2.094 3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.690 1.092 1.978 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.640 1.597 3.395 1.00 0.00 H new ATOM 1242 N MET A 79 2.499 4.322 3.722 1.00 0.00 N ATOM 1243 CA MET A 79 2.720 5.388 4.694 1.00 0.00 C ATOM 1244 C MET A 79 3.022 6.694 3.979 1.00 0.00 C ATOM 1245 O MET A 79 2.415 7.729 4.250 1.00 0.00 O ATOM 1246 CB MET A 79 3.878 5.035 5.630 1.00 0.00 C ATOM 1247 CG MET A 79 3.530 3.981 6.668 1.00 0.00 C ATOM 1248 SD MET A 79 4.779 3.841 7.964 1.00 0.00 S ATOM 1249 CE MET A 79 6.291 3.980 7.011 1.00 0.00 C ATOM 0 H MET A 79 3.224 3.604 3.707 1.00 0.00 H new ATOM 0 HA MET A 79 1.812 5.503 5.287 1.00 0.00 H new ATOM 0 HB2 MET A 79 4.719 4.681 5.034 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.208 5.939 6.141 1.00 0.00 H new ATOM 0 HG2 MET A 79 2.569 4.226 7.120 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.414 3.016 6.175 1.00 0.00 H new ATOM 0 HE1 MET A 79 7.148 3.965 7.684 1.00 0.00 H new ATOM 0 HE2 MET A 79 6.361 3.144 6.315 1.00 0.00 H new ATOM 0 HE3 MET A 79 6.285 4.916 6.453 1.00 0.00 H new ATOM 1259 N VAL A 80 3.969 6.621 3.059 1.00 0.00 N ATOM 1260 CA VAL A 80 4.379 7.772 2.275 1.00 0.00 C ATOM 1261 C VAL A 80 3.200 8.349 1.490 1.00 0.00 C ATOM 1262 O VAL A 80 3.042 9.568 1.390 1.00 0.00 O ATOM 1263 CB VAL A 80 5.508 7.368 1.309 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.980 8.555 0.486 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.668 6.755 2.080 1.00 0.00 C ATOM 0 H VAL A 80 4.474 5.763 2.835 1.00 0.00 H new ATOM 0 HA VAL A 80 4.742 8.541 2.956 1.00 0.00 H new ATOM 0 HB VAL A 80 5.113 6.622 0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.777 8.238 -0.186 1.00 0.00 H new ATOM 0 HG12 VAL A 80 5.147 8.947 -0.098 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.354 9.333 1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.459 6.474 1.385 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.054 7.482 2.795 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.323 5.870 2.614 1.00 0.00 H new ATOM 1275 N THR A 81 2.376 7.462 0.938 1.00 0.00 N ATOM 1276 CA THR A 81 1.209 7.867 0.160 1.00 0.00 C ATOM 1277 C THR A 81 0.118 8.460 1.054 1.00 0.00 C ATOM 1278 O THR A 81 -0.326 9.589 0.843 1.00 0.00 O ATOM 1279 CB THR A 81 0.669 6.654 -0.608 1.00 0.00 C ATOM 1280 OG1 THR A 81 1.491 6.368 -1.725 1.00 0.00 O ATOM 1281 CG2 THR A 81 -0.749 6.798 -1.118 1.00 0.00 C ATOM 0 H THR A 81 2.496 6.452 1.016 1.00 0.00 H new ATOM 0 HA THR A 81 1.512 8.643 -0.543 1.00 0.00 H new ATOM 0 HB THR A 81 0.674 5.849 0.127 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.845 5.458 -1.646 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.039 5.890 -1.647 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.423 6.960 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.807 7.648 -1.798 1.00 0.00 H new ATOM 1289 N THR A 82 -0.322 7.680 2.035 1.00 0.00 N ATOM 1290 CA THR A 82 -1.378 8.106 2.951 1.00 0.00 C ATOM 1291 C THR A 82 -1.130 9.503 3.515 1.00 0.00 C ATOM 1292 O THR A 82 -2.066 10.180 3.937 1.00 0.00 O ATOM 1293 CB THR A 82 -1.521 7.103 4.097 1.00 0.00 C ATOM 1294 OG1 THR A 82 -1.757 5.800 3.596 1.00 0.00 O ATOM 1295 CG2 THR A 82 -2.647 7.438 5.051 1.00 0.00 C ATOM 0 H THR A 82 0.038 6.743 2.218 1.00 0.00 H new ATOM 0 HA THR A 82 -2.303 8.144 2.376 1.00 0.00 H new ATOM 0 HB THR A 82 -0.578 7.153 4.642 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.942 5.263 3.686 1.00 0.00 H new ATOM 0 HG21 THR A 82 -2.692 6.686 5.839 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.469 8.418 5.494 1.00 0.00 H new ATOM 0 HG23 THR A 82 -3.592 7.451 4.508 1.00 0.00 H new ATOM 1303 N ALA A 83 0.125 9.929 3.533 1.00 0.00 N ATOM 1304 CA ALA A 83 0.463 11.243 4.061 1.00 0.00 C ATOM 1305 C ALA A 83 0.240 12.343 3.031 1.00 0.00 C ATOM 1306 O ALA A 83 -0.673 13.157 3.166 1.00 0.00 O ATOM 1307 CB ALA A 83 1.903 11.267 4.540 1.00 0.00 C ATOM 0 H ALA A 83 0.920 9.389 3.191 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.201 11.435 4.904 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.140 12.256 4.932 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.037 10.524 5.326 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.567 11.038 3.707 1.00 0.00 H new ATOM 1313 N CYS A 84 1.094 12.377 2.012 1.00 0.00 N ATOM 1314 CA CYS A 84 0.993 13.400 0.976 1.00 0.00 C ATOM 1315 C CYS A 84 0.049 12.989 -0.146 1.00 0.00 C ATOM 1316 O CYS A 84 -0.860 13.738 -0.499 1.00 0.00 O ATOM 1317 CB CYS A 84 2.377 13.740 0.411 1.00 0.00 C ATOM 1318 SG CYS A 84 3.369 12.304 -0.061 1.00 0.00 S ATOM 0 H CYS A 84 1.858 11.714 1.882 1.00 0.00 H new ATOM 0 HA CYS A 84 0.575 14.290 1.446 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.252 14.381 -0.461 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.927 14.317 1.154 1.00 0.00 H new ATOM 0 HG CYS A 84 3.112 11.316 0.743 1.00 0.00 H new ATOM 1324 N HIS A 85 0.255 11.800 -0.704 1.00 0.00 N ATOM 1325 CA HIS A 85 -0.599 11.314 -1.785 1.00 0.00 C ATOM 1326 C HIS A 85 -2.073 11.489 -1.425 1.00 0.00 C ATOM 1327 O HIS A 85 -2.932 11.585 -2.302 1.00 0.00 O ATOM 1328 CB HIS A 85 -0.302 9.844 -2.080 1.00 0.00 C ATOM 1329 CG HIS A 85 -0.630 9.437 -3.483 1.00 0.00 C ATOM 1330 ND1 HIS A 85 0.280 8.829 -4.323 1.00 0.00 N ATOM 1331 CD2 HIS A 85 -1.776 9.554 -4.195 1.00 0.00 C ATOM 1332 CE1 HIS A 85 -0.291 8.592 -5.491 1.00 0.00 C ATOM 1333 NE2 HIS A 85 -1.538 9.021 -5.438 1.00 0.00 N ATOM 0 H HIS A 85 0.999 11.159 -0.429 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.387 11.901 -2.678 1.00 0.00 H new ATOM 0 HB2 HIS A 85 0.754 9.650 -1.892 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.869 9.221 -1.388 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -2.704 9.986 -3.850 1.00 0.00 H new ATOM 0 HE1 HIS A 85 0.182 8.127 -6.343 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -2.216 8.966 -6.198 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.351 11.537 -0.125 1.00 0.00 N ATOM 1343 CA GLU A 86 -3.707 11.707 0.375 1.00 0.00 C ATOM 1344 C GLU A 86 -4.421 12.854 -0.334 1.00 0.00 C ATOM 1345 O GLU A 86 -5.408 12.646 -1.037 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.660 11.969 1.883 1.00 0.00 C ATOM 1347 CG GLU A 86 -4.994 12.394 2.482 1.00 0.00 C ATOM 1348 CD GLU A 86 -5.412 11.525 3.652 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -5.456 10.288 3.487 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -5.696 12.082 4.733 1.00 0.00 O ATOM 0 H GLU A 86 -1.644 11.459 0.606 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.267 10.794 0.175 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.319 11.065 2.388 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.920 12.744 2.083 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.926 13.431 2.811 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.763 12.353 1.711 1.00 0.00 H new ATOM 1357 N PHE A 87 -3.911 14.061 -0.143 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.493 15.242 -0.764 1.00 0.00 C ATOM 1359 C PHE A 87 -3.486 15.908 -1.695 1.00 0.00 C ATOM 1360 O PHE A 87 -3.862 16.551 -2.676 1.00 0.00 O ATOM 1361 CB PHE A 87 -4.967 16.227 0.306 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.465 16.335 0.398 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.256 15.200 0.516 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -7.081 17.576 0.367 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -8.630 15.304 0.600 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -8.457 17.684 0.451 1.00 0.00 C ATOM 1367 CZ PHE A 87 -9.232 16.548 0.567 1.00 0.00 C ATOM 0 H PHE A 87 -3.094 14.249 0.438 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.355 14.933 -1.356 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.572 15.918 1.274 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.552 17.212 0.092 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.791 14.225 0.542 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.480 18.469 0.276 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.234 14.414 0.691 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.925 18.657 0.426 1.00 0.00 H new ATOM 0 HZ PHE A 87 -10.307 16.631 0.632 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.202 15.740 -1.389 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.142 16.312 -2.207 1.00 0.00 C ATOM 1379 C PHE A 88 -0.887 15.449 -3.441 1.00 0.00 C ATOM 1380 O PHE A 88 -0.277 15.903 -4.410 1.00 0.00 O ATOM 1381 CB PHE A 88 0.148 16.464 -1.392 1.00 0.00 C ATOM 1382 CG PHE A 88 0.080 17.558 -0.365 1.00 0.00 C ATOM 1383 CD1 PHE A 88 -0.083 18.878 -0.751 1.00 0.00 C ATOM 1384 CD2 PHE A 88 0.180 17.266 0.986 1.00 0.00 C ATOM 1385 CE1 PHE A 88 -0.146 19.888 0.191 1.00 0.00 C ATOM 1386 CE2 PHE A 88 0.118 18.271 1.932 1.00 0.00 C ATOM 1387 CZ PHE A 88 -0.044 19.583 1.534 1.00 0.00 C ATOM 0 H PHE A 88 -1.873 15.212 -0.580 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.464 17.300 -2.535 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.367 15.520 -0.893 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.977 16.665 -2.071 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.162 19.121 -1.800 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.308 16.241 1.303 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.275 20.913 -0.123 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.196 18.030 2.982 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.091 20.370 2.272 1.00 0.00 H new ATOM 1447 N SER B 1 7.238 2.254 -14.459 1.00 0.00 N ATOM 1448 CA SER B 1 6.111 3.223 -14.400 1.00 0.00 C ATOM 1449 C SER B 1 4.937 2.664 -13.601 1.00 0.00 C ATOM 1450 O SER B 1 4.062 3.412 -13.163 1.00 0.00 O ATOM 1451 CB SER B 1 5.671 3.547 -15.829 1.00 0.00 C ATOM 1452 OG SER B 1 5.375 2.364 -16.551 1.00 0.00 O ATOM 0 H1 SER B 1 8.131 2.769 -14.595 1.00 0.00 H new ATOM 0 H2 SER B 1 7.280 1.716 -13.570 1.00 0.00 H new ATOM 0 H3 SER B 1 7.091 1.599 -15.253 1.00 0.00 H new ATOM 0 HA SER B 1 6.447 4.128 -13.894 1.00 0.00 H new ATOM 0 HB2 SER B 1 4.793 4.192 -15.805 1.00 0.00 H new ATOM 0 HB3 SER B 1 6.459 4.101 -16.339 1.00 0.00 H new ATOM 0 HG SER B 1 5.095 2.597 -17.461 1.00 0.00 H new ATOM 1460 N GLU B 2 4.922 1.349 -13.414 1.00 0.00 N ATOM 1461 CA GLU B 2 3.853 0.694 -12.668 1.00 0.00 C ATOM 1462 C GLU B 2 3.708 1.296 -11.278 1.00 0.00 C ATOM 1463 O GLU B 2 2.602 1.441 -10.759 1.00 0.00 O ATOM 1464 CB GLU B 2 4.130 -0.805 -12.555 1.00 0.00 C ATOM 1465 CG GLU B 2 5.364 -1.135 -11.729 1.00 0.00 C ATOM 1466 CD GLU B 2 6.009 -2.442 -12.144 1.00 0.00 C ATOM 1467 OE1 GLU B 2 5.391 -3.506 -11.926 1.00 0.00 O ATOM 1468 OE2 GLU B 2 7.133 -2.403 -12.688 1.00 0.00 O ATOM 0 H GLU B 2 5.638 0.715 -13.769 1.00 0.00 H new ATOM 0 HA GLU B 2 2.920 0.849 -13.210 1.00 0.00 H new ATOM 0 HB2 GLU B 2 3.263 -1.294 -12.110 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.251 -1.220 -13.556 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.090 -0.328 -11.828 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.088 -1.188 -10.676 1.00 0.00 H new ATOM 1475 N LEU B 3 4.841 1.642 -10.686 1.00 0.00 N ATOM 1476 CA LEU B 3 4.869 2.232 -9.350 1.00 0.00 C ATOM 1477 C LEU B 3 3.832 3.345 -9.211 1.00 0.00 C ATOM 1478 O LEU B 3 3.156 3.452 -8.188 1.00 0.00 O ATOM 1479 CB LEU B 3 6.265 2.782 -9.044 1.00 0.00 C ATOM 1480 CG LEU B 3 6.692 2.685 -7.576 1.00 0.00 C ATOM 1481 CD1 LEU B 3 7.848 1.707 -7.418 1.00 0.00 C ATOM 1482 CD2 LEU B 3 7.076 4.055 -7.038 1.00 0.00 C ATOM 0 H LEU B 3 5.761 1.525 -11.111 1.00 0.00 H new ATOM 0 HA LEU B 3 4.624 1.447 -8.634 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.992 2.246 -9.654 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.302 3.828 -9.349 1.00 0.00 H new ATOM 0 HG LEU B 3 5.846 2.314 -6.998 1.00 0.00 H new ATOM 0 HD11 LEU B 3 8.137 1.652 -6.368 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.539 0.720 -7.762 1.00 0.00 H new ATOM 0 HD13 LEU B 3 8.697 2.048 -8.011 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.376 3.965 -5.994 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.906 4.455 -7.621 1.00 0.00 H new ATOM 0 HD23 LEU B 3 6.222 4.728 -7.113 1.00 0.00 H new ATOM 1494 N GLU B 4 3.710 4.170 -10.246 1.00 0.00 N ATOM 1495 CA GLU B 4 2.754 5.272 -10.236 1.00 0.00 C ATOM 1496 C GLU B 4 1.368 4.798 -10.660 1.00 0.00 C ATOM 1497 O GLU B 4 0.355 5.364 -10.245 1.00 0.00 O ATOM 1498 CB GLU B 4 3.228 6.397 -11.160 1.00 0.00 C ATOM 1499 CG GLU B 4 3.327 5.988 -12.620 1.00 0.00 C ATOM 1500 CD GLU B 4 3.061 7.140 -13.568 1.00 0.00 C ATOM 1501 OE1 GLU B 4 3.529 8.263 -13.284 1.00 0.00 O ATOM 1502 OE2 GLU B 4 2.384 6.921 -14.595 1.00 0.00 O ATOM 0 H GLU B 4 4.261 4.097 -11.102 1.00 0.00 H new ATOM 0 HA GLU B 4 2.690 5.652 -9.217 1.00 0.00 H new ATOM 0 HB2 GLU B 4 2.542 7.239 -11.074 1.00 0.00 H new ATOM 0 HB3 GLU B 4 4.204 6.745 -10.823 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.321 5.585 -12.814 1.00 0.00 H new ATOM 0 HG3 GLU B 4 2.614 5.187 -12.818 1.00 0.00 H new ATOM 1509 N LYS B 5 1.326 3.759 -11.488 1.00 0.00 N ATOM 1510 CA LYS B 5 0.060 3.214 -11.966 1.00 0.00 C ATOM 1511 C LYS B 5 -0.675 2.477 -10.850 1.00 0.00 C ATOM 1512 O LYS B 5 -1.883 2.633 -10.684 1.00 0.00 O ATOM 1513 CB LYS B 5 0.300 2.267 -13.144 1.00 0.00 C ATOM 1514 CG LYS B 5 0.606 2.987 -14.449 1.00 0.00 C ATOM 1515 CD LYS B 5 1.779 2.350 -15.174 1.00 0.00 C ATOM 1516 CE LYS B 5 1.471 0.919 -15.584 1.00 0.00 C ATOM 1517 NZ LYS B 5 2.696 0.074 -15.619 1.00 0.00 N ATOM 0 H LYS B 5 2.153 3.278 -11.842 1.00 0.00 H new ATOM 0 HA LYS B 5 -0.561 4.047 -12.297 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.129 1.602 -12.902 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.581 1.641 -13.282 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.274 2.968 -15.092 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.828 4.034 -14.245 1.00 0.00 H new ATOM 0 HD2 LYS B 5 2.024 2.938 -16.058 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.657 2.364 -14.529 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.753 0.488 -14.886 1.00 0.00 H new ATOM 0 HE3 LYS B 5 1.001 0.917 -16.567 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.777 -0.382 -16.550 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 3.533 0.668 -15.451 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.636 -0.656 -14.880 1.00 0.00 H new ATOM 1531 N ALA B 6 0.063 1.677 -10.089 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.518 0.918 -8.988 1.00 0.00 C ATOM 1533 C ALA B 6 -1.038 1.843 -7.895 1.00 0.00 C ATOM 1534 O ALA B 6 -2.168 1.696 -7.428 1.00 0.00 O ATOM 1535 CB ALA B 6 0.509 -0.052 -8.421 1.00 0.00 C ATOM 0 H ALA B 6 1.066 1.537 -10.214 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.364 0.351 -9.375 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.064 -0.614 -7.599 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.827 -0.742 -9.202 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.372 0.504 -8.055 1.00 0.00 H new ATOM 1541 N MET B 7 -0.210 2.799 -7.493 1.00 0.00 N ATOM 1542 CA MET B 7 -0.587 3.751 -6.456 1.00 0.00 C ATOM 1543 C MET B 7 -1.830 4.534 -6.866 1.00 0.00 C ATOM 1544 O MET B 7 -2.765 4.698 -6.079 1.00 0.00 O ATOM 1545 CB MET B 7 0.568 4.716 -6.180 1.00 0.00 C ATOM 1546 CG MET B 7 1.358 4.382 -4.926 1.00 0.00 C ATOM 1547 SD MET B 7 2.659 5.584 -4.587 1.00 0.00 S ATOM 1548 CE MET B 7 4.000 4.920 -5.571 1.00 0.00 C ATOM 0 H MET B 7 0.728 2.936 -7.870 1.00 0.00 H new ATOM 0 HA MET B 7 -0.813 3.193 -5.547 1.00 0.00 H new ATOM 0 HB2 MET B 7 1.244 4.714 -7.035 1.00 0.00 H new ATOM 0 HB3 MET B 7 0.171 5.727 -6.090 1.00 0.00 H new ATOM 0 HG2 MET B 7 0.679 4.337 -4.074 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.802 3.392 -5.033 1.00 0.00 H new ATOM 0 HE1 MET B 7 4.945 5.078 -5.052 1.00 0.00 H new ATOM 0 HE2 MET B 7 3.845 3.852 -5.724 1.00 0.00 H new ATOM 0 HE3 MET B 7 4.027 5.425 -6.537 1.00 0.00 H new ATOM 1558 N VAL B 8 -1.831 5.024 -8.102 1.00 0.00 N ATOM 1559 CA VAL B 8 -2.953 5.799 -8.611 1.00 0.00 C ATOM 1560 C VAL B 8 -4.119 4.902 -9.015 1.00 0.00 C ATOM 1561 O VAL B 8 -5.271 5.334 -9.012 1.00 0.00 O ATOM 1562 CB VAL B 8 -2.543 6.671 -9.813 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -3.682 7.592 -10.222 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -1.289 7.472 -9.490 1.00 0.00 C ATOM 0 H VAL B 8 -1.068 4.897 -8.767 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.273 6.449 -7.796 1.00 0.00 H new ATOM 0 HB VAL B 8 -2.320 6.014 -10.654 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -3.372 8.199 -11.072 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -4.551 6.995 -10.500 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -3.941 8.243 -9.387 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.015 8.082 -10.351 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.481 8.119 -8.634 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.472 6.790 -9.254 1.00 0.00 H new ATOM 1574 N ALA B 9 -3.826 3.652 -9.346 1.00 0.00 N ATOM 1575 CA ALA B 9 -4.876 2.717 -9.723 1.00 0.00 C ATOM 1576 C ALA B 9 -5.796 2.484 -8.534 1.00 0.00 C ATOM 1577 O ALA B 9 -7.020 2.389 -8.674 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.276 1.403 -10.203 1.00 0.00 C ATOM 0 H ALA B 9 -2.882 3.266 -9.361 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.454 3.141 -10.544 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -5.077 0.717 -10.480 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.641 1.588 -11.069 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.681 0.961 -9.404 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.191 2.422 -7.353 1.00 0.00 N ATOM 1585 CA LEU B 10 -5.939 2.226 -6.122 1.00 0.00 C ATOM 1586 C LEU B 10 -6.847 3.417 -5.870 1.00 0.00 C ATOM 1587 O LEU B 10 -8.072 3.304 -5.923 1.00 0.00 O ATOM 1588 CB LEU B 10 -4.989 2.053 -4.936 1.00 0.00 C ATOM 1589 CG LEU B 10 -4.194 0.748 -4.916 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.789 0.993 -4.387 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.909 -0.295 -4.071 1.00 0.00 C ATOM 0 H LEU B 10 -4.183 2.505 -7.225 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.541 1.324 -6.228 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -4.286 2.886 -4.931 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.569 2.119 -4.015 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.118 0.371 -5.936 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.235 0.055 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.278 1.710 -5.029 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.846 1.390 -3.373 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.330 -1.219 -4.067 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -5.013 0.073 -3.050 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.897 -0.488 -4.490 1.00 0.00 H new ATOM 1603 N ILE B 11 -6.227 4.567 -5.610 1.00 0.00 N ATOM 1604 CA ILE B 11 -6.943 5.804 -5.354 1.00 0.00 C ATOM 1605 C ILE B 11 -8.112 5.972 -6.322 1.00 0.00 C ATOM 1606 O ILE B 11 -9.182 6.436 -5.941 1.00 0.00 O ATOM 1607 CB ILE B 11 -5.985 6.997 -5.496 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -6.718 8.327 -5.292 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -5.319 6.935 -6.851 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -7.289 8.899 -6.569 1.00 0.00 C ATOM 0 H ILE B 11 -5.212 4.662 -5.572 1.00 0.00 H new ATOM 0 HA ILE B 11 -7.338 5.765 -4.339 1.00 0.00 H new ATOM 0 HB ILE B 11 -5.221 6.939 -4.721 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -7.526 8.182 -4.574 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -6.029 9.050 -4.855 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.637 7.778 -6.960 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -4.761 6.003 -6.940 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.078 6.979 -7.632 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -7.794 9.840 -6.352 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -6.483 9.076 -7.281 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -8.002 8.194 -6.996 1.00 0.00 H new ATOM 1622 N ASP B 12 -7.899 5.581 -7.575 1.00 0.00 N ATOM 1623 CA ASP B 12 -8.941 5.682 -8.590 1.00 0.00 C ATOM 1624 C ASP B 12 -10.213 4.988 -8.114 1.00 0.00 C ATOM 1625 O ASP B 12 -11.304 5.556 -8.175 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.464 5.064 -9.907 1.00 0.00 C ATOM 1627 CG ASP B 12 -8.725 5.967 -11.097 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -9.777 6.641 -11.110 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -7.879 6.000 -12.015 1.00 0.00 O ATOM 0 H ASP B 12 -7.017 5.193 -7.910 1.00 0.00 H new ATOM 0 HA ASP B 12 -9.159 6.737 -8.758 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.396 4.854 -9.841 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.968 4.110 -10.061 1.00 0.00 H new ATOM 1634 N VAL B 13 -10.061 3.758 -7.636 1.00 0.00 N ATOM 1635 CA VAL B 13 -11.194 2.981 -7.141 1.00 0.00 C ATOM 1636 C VAL B 13 -11.932 3.719 -6.020 1.00 0.00 C ATOM 1637 O VAL B 13 -13.162 3.722 -5.969 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.736 1.605 -6.623 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -11.932 0.749 -6.237 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.881 0.901 -7.665 1.00 0.00 C ATOM 0 H VAL B 13 -9.164 3.276 -7.580 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.875 2.842 -7.981 1.00 0.00 H new ATOM 0 HB VAL B 13 -10.130 1.759 -5.730 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.585 -0.218 -5.874 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.499 1.249 -5.452 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.570 0.602 -7.108 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.566 -0.070 -7.282 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.461 0.760 -8.577 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -9.002 1.507 -7.884 1.00 0.00 H new ATOM 1650 N PHE B 14 -11.169 4.340 -5.124 1.00 0.00 N ATOM 1651 CA PHE B 14 -11.736 5.083 -4.000 1.00 0.00 C ATOM 1652 C PHE B 14 -12.250 6.443 -4.468 1.00 0.00 C ATOM 1653 O PHE B 14 -13.196 6.990 -3.903 1.00 0.00 O ATOM 1654 CB PHE B 14 -10.679 5.206 -2.875 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.411 6.600 -2.353 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -10.062 7.633 -3.211 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -10.503 6.872 -0.994 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.815 8.902 -2.729 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.258 8.138 -0.513 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.915 9.156 -1.379 1.00 0.00 C ATOM 0 H PHE B 14 -10.149 4.343 -5.155 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.592 4.545 -3.593 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -10.996 4.583 -2.039 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -9.740 4.792 -3.242 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.983 7.441 -4.271 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -10.770 6.082 -0.308 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.544 9.695 -3.410 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.334 8.335 0.546 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.725 10.149 -0.999 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.619 6.980 -5.508 1.00 0.00 N ATOM 1671 CA HIS B 15 -12.008 8.270 -6.061 1.00 0.00 C ATOM 1672 C HIS B 15 -13.169 8.122 -7.039 1.00 0.00 C ATOM 1673 O HIS B 15 -13.828 9.104 -7.383 1.00 0.00 O ATOM 1674 CB HIS B 15 -10.820 8.929 -6.759 1.00 0.00 C ATOM 1675 CG HIS B 15 -10.768 10.415 -6.575 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -9.887 11.038 -5.717 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -11.495 11.404 -7.148 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -10.075 12.345 -5.766 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -11.045 12.593 -6.628 1.00 0.00 N ATOM 0 H HIS B 15 -10.833 6.538 -5.985 1.00 0.00 H new ATOM 0 HA HIS B 15 -12.334 8.903 -5.236 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.897 8.491 -6.379 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.864 8.704 -7.825 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.282 11.281 -7.878 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -9.529 13.084 -5.198 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -11.402 13.518 -6.868 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.419 6.894 -7.484 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.500 6.634 -8.414 1.00 0.00 C ATOM 1690 C GLN B 16 -15.822 6.597 -7.670 1.00 0.00 C ATOM 1691 O GLN B 16 -16.792 7.238 -8.074 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.270 5.311 -9.151 1.00 0.00 C ATOM 1693 CG GLN B 16 -14.218 5.459 -10.663 1.00 0.00 C ATOM 1694 CD GLN B 16 -13.063 6.327 -11.124 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -12.730 7.327 -10.489 1.00 0.00 O ATOM 1696 NE2 GLN B 16 -12.445 5.947 -12.237 1.00 0.00 N ATOM 0 H GLN B 16 -12.885 6.068 -7.213 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.528 7.437 -9.151 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -13.335 4.869 -8.805 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.067 4.615 -8.889 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -14.131 4.472 -11.118 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.155 5.891 -11.015 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.754 5.111 -12.732 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -11.661 6.492 -12.596 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.855 5.844 -6.576 1.00 0.00 N ATOM 1706 CA TYR B 17 -17.071 5.740 -5.785 1.00 0.00 C ATOM 1707 C TYR B 17 -17.205 6.898 -4.803 1.00 0.00 C ATOM 1708 O TYR B 17 -18.216 7.600 -4.795 1.00 0.00 O ATOM 1709 CB TYR B 17 -17.125 4.406 -5.049 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.944 3.370 -5.783 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -17.526 2.874 -7.011 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -19.135 2.894 -5.253 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -18.274 1.930 -7.691 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -19.888 1.949 -5.925 1.00 0.00 C ATOM 1715 CZ TYR B 17 -19.453 1.470 -7.143 1.00 0.00 C ATOM 1716 OH TYR B 17 -20.199 0.531 -7.815 1.00 0.00 O ATOM 0 H TYR B 17 -15.065 5.305 -6.222 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.914 5.792 -6.474 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -16.111 4.031 -4.910 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -17.547 4.560 -4.056 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.602 3.231 -7.442 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -19.479 3.268 -4.300 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -17.937 1.555 -8.646 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -20.812 1.588 -5.498 1.00 0.00 H new ATOM 0 HH TYR B 17 -21.131 0.578 -7.515 1.00 0.00 H new ATOM 1726 N SER B 18 -16.186 7.093 -3.973 1.00 0.00 N ATOM 1727 CA SER B 18 -16.209 8.168 -2.988 1.00 0.00 C ATOM 1728 C SER B 18 -16.408 9.523 -3.663 1.00 0.00 C ATOM 1729 O SER B 18 -15.577 9.960 -4.458 1.00 0.00 O ATOM 1730 CB SER B 18 -14.913 8.180 -2.175 1.00 0.00 C ATOM 1731 OG SER B 18 -15.144 8.625 -0.849 1.00 0.00 O ATOM 0 H SER B 18 -15.339 6.525 -3.962 1.00 0.00 H new ATOM 0 HA SER B 18 -17.048 7.987 -2.316 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.483 7.178 -2.156 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.184 8.830 -2.658 1.00 0.00 H new ATOM 0 HG SER B 18 -15.779 8.023 -0.408 1.00 0.00 H new ATOM 1737 N GLY B 19 -17.516 10.183 -3.341 1.00 0.00 N ATOM 1738 CA GLY B 19 -17.803 11.480 -3.925 1.00 0.00 C ATOM 1739 C GLY B 19 -19.258 11.626 -4.326 1.00 0.00 C ATOM 1740 O GLY B 19 -19.916 12.600 -3.958 1.00 0.00 O ATOM 0 H GLY B 19 -18.220 9.843 -2.686 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -17.546 12.262 -3.210 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -17.171 11.629 -4.801 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.872 12.614 0.109 1.00 0.00 N ATOM 1802 CA LYS B 24 -15.942 12.530 -1.014 1.00 0.00 C ATOM 1803 C LYS B 24 -14.513 12.324 -0.520 1.00 0.00 C ATOM 1804 O LYS B 24 -13.626 13.134 -0.792 1.00 0.00 O ATOM 1805 CB LYS B 24 -16.025 13.791 -1.879 1.00 0.00 C ATOM 1806 CG LYS B 24 -15.367 13.639 -3.241 1.00 0.00 C ATOM 1807 CD LYS B 24 -15.866 14.687 -4.221 1.00 0.00 C ATOM 1808 CE LYS B 24 -14.993 15.930 -4.200 1.00 0.00 C ATOM 1809 NZ LYS B 24 -15.658 17.088 -4.859 1.00 0.00 N ATOM 0 HA LYS B 24 -16.225 11.671 -1.622 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -17.073 14.057 -2.019 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -15.554 14.618 -1.347 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -14.285 13.724 -3.135 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -15.571 12.644 -3.636 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -15.880 14.268 -5.227 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -16.893 14.958 -3.974 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -14.754 16.188 -3.168 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -14.049 15.719 -4.703 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -15.029 17.916 -4.823 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -15.864 16.852 -5.851 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -16.546 17.306 -4.364 1.00 0.00 H new ATOM 1823 N HIS B 25 -14.301 11.229 0.201 1.00 0.00 N ATOM 1824 CA HIS B 25 -12.980 10.902 0.734 1.00 0.00 C ATOM 1825 C HIS B 25 -12.999 9.572 1.485 1.00 0.00 C ATOM 1826 O HIS B 25 -11.989 8.879 1.561 1.00 0.00 O ATOM 1827 CB HIS B 25 -12.479 12.011 1.658 1.00 0.00 C ATOM 1828 CG HIS B 25 -11.013 11.920 1.935 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -10.323 12.849 2.684 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -10.102 10.994 1.554 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -9.050 12.499 2.750 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.890 11.378 2.074 1.00 0.00 N ATOM 0 H HIS B 25 -15.027 10.550 0.431 1.00 0.00 H new ATOM 0 HA HIS B 25 -12.299 10.811 -0.112 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -12.699 12.979 1.208 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -13.025 11.966 2.600 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.293 10.117 0.953 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -8.273 13.040 3.270 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -8.009 10.877 1.956 1.00 0.00 H new ATOM 1841 N LYS B 26 -14.150 9.220 2.041 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.296 7.978 2.785 1.00 0.00 C ATOM 1843 C LYS B 26 -15.198 7.012 2.024 1.00 0.00 C ATOM 1844 O LYS B 26 -15.965 7.422 1.153 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.893 8.258 4.166 1.00 0.00 C ATOM 1846 CG LYS B 26 -13.907 8.105 5.315 1.00 0.00 C ATOM 1847 CD LYS B 26 -13.425 9.455 5.833 1.00 0.00 C ATOM 1848 CE LYS B 26 -13.020 10.386 4.700 1.00 0.00 C ATOM 1849 NZ LYS B 26 -11.855 11.237 5.068 1.00 0.00 N ATOM 0 H LYS B 26 -15.000 9.781 1.990 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.311 7.527 2.906 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -15.293 9.272 4.178 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.733 7.582 4.330 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -14.379 7.552 6.127 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.051 7.517 4.983 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -14.215 9.921 6.421 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.577 9.306 6.501 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.774 9.797 3.817 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.864 11.022 4.434 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.838 12.083 4.463 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.937 11.526 6.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.976 10.698 4.935 1.00 0.00 H new ATOM 1863 N LEU B 27 -15.107 5.733 2.360 1.00 0.00 N ATOM 1864 CA LEU B 27 -15.921 4.715 1.708 1.00 0.00 C ATOM 1865 C LEU B 27 -16.748 3.967 2.740 1.00 0.00 C ATOM 1866 O LEU B 27 -16.265 3.637 3.821 1.00 0.00 O ATOM 1867 CB LEU B 27 -15.049 3.737 0.921 1.00 0.00 C ATOM 1868 CG LEU B 27 -14.480 4.269 -0.405 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -15.570 4.952 -1.215 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -13.311 5.223 -0.165 1.00 0.00 C ATOM 0 H LEU B 27 -14.479 5.375 3.079 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.591 5.212 1.007 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -14.217 3.430 1.555 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -15.637 2.843 0.710 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.104 3.418 -0.973 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.150 5.323 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -16.364 4.237 -1.432 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -15.978 5.786 -0.645 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -12.931 5.581 -1.122 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -13.649 6.070 0.431 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.517 4.699 0.367 1.00 0.00 H new ATOM 1882 N LYS B 28 -17.999 3.713 2.402 1.00 0.00 N ATOM 1883 CA LYS B 28 -18.903 3.018 3.308 1.00 0.00 C ATOM 1884 C LYS B 28 -19.295 1.653 2.763 1.00 0.00 C ATOM 1885 O LYS B 28 -18.829 1.235 1.703 1.00 0.00 O ATOM 1886 CB LYS B 28 -20.157 3.859 3.552 1.00 0.00 C ATOM 1887 CG LYS B 28 -20.925 4.193 2.283 1.00 0.00 C ATOM 1888 CD LYS B 28 -21.892 5.345 2.501 1.00 0.00 C ATOM 1889 CE LYS B 28 -22.257 6.022 1.188 1.00 0.00 C ATOM 1890 NZ LYS B 28 -23.725 6.246 1.068 1.00 0.00 N ATOM 0 H LYS B 28 -18.414 3.976 1.508 1.00 0.00 H new ATOM 0 HA LYS B 28 -18.378 2.869 4.251 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -20.816 3.323 4.235 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -19.871 4.787 4.048 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -20.223 4.451 1.490 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -21.475 3.314 1.948 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -22.796 4.976 2.985 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -21.444 6.075 3.176 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -21.737 6.977 1.115 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -21.914 5.408 0.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -23.932 6.709 0.160 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -24.220 5.333 1.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -24.048 6.853 1.848 1.00 0.00 H new ATOM 1904 N LYS B 29 -20.159 0.967 3.501 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.632 -0.352 3.107 1.00 0.00 C ATOM 1906 C LYS B 29 -21.142 -0.338 1.670 1.00 0.00 C ATOM 1907 O LYS B 29 -20.892 -1.262 0.901 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.743 -0.810 4.051 1.00 0.00 C ATOM 1909 CG LYS B 29 -21.277 -1.019 5.484 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.452 0.240 6.320 1.00 0.00 C ATOM 1911 CE LYS B 29 -20.121 0.752 6.845 1.00 0.00 C ATOM 1912 NZ LYS B 29 -20.239 1.291 8.228 1.00 0.00 N ATOM 0 H LYS B 29 -20.548 1.306 4.381 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.797 -1.050 3.168 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.544 -0.070 4.042 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -22.166 -1.742 3.676 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -21.840 -1.837 5.934 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -20.228 -1.315 5.486 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -21.928 1.014 5.718 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -22.118 0.032 7.157 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -19.390 -0.057 6.832 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -19.745 1.532 6.182 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.426 1.908 8.431 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -21.119 1.839 8.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -20.254 0.504 8.907 1.00 0.00 H new ATOM 1926 N SER B 30 -21.862 0.719 1.318 1.00 0.00 N ATOM 1927 CA SER B 30 -22.413 0.852 -0.024 1.00 0.00 C ATOM 1928 C SER B 30 -21.308 0.954 -1.073 1.00 0.00 C ATOM 1929 O SER B 30 -21.276 0.176 -2.027 1.00 0.00 O ATOM 1930 CB SER B 30 -23.321 2.080 -0.103 1.00 0.00 C ATOM 1931 OG SER B 30 -22.569 3.278 -0.004 1.00 0.00 O ATOM 0 H SER B 30 -22.078 1.496 1.942 1.00 0.00 H new ATOM 0 HA SER B 30 -22.998 -0.044 -0.234 1.00 0.00 H new ATOM 0 HB2 SER B 30 -23.871 2.069 -1.044 1.00 0.00 H new ATOM 0 HB3 SER B 30 -24.059 2.043 0.698 1.00 0.00 H new ATOM 0 HG SER B 30 -22.697 3.813 -0.815 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.411 1.921 -0.902 1.00 0.00 N ATOM 1938 CA GLU B 31 -19.325 2.121 -1.852 1.00 0.00 C ATOM 1939 C GLU B 31 -18.321 0.974 -1.809 1.00 0.00 C ATOM 1940 O GLU B 31 -18.201 0.210 -2.765 1.00 0.00 O ATOM 1941 CB GLU B 31 -18.614 3.444 -1.573 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.450 4.668 -1.915 1.00 0.00 C ATOM 1943 CD GLU B 31 -19.476 5.689 -0.795 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -18.585 5.635 0.080 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -20.387 6.543 -0.792 1.00 0.00 O ATOM 0 H GLU B 31 -20.415 2.574 -0.119 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.762 2.148 -2.850 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.340 3.484 -0.519 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.687 3.476 -2.145 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -19.053 5.134 -2.817 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -20.470 4.355 -2.140 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.594 0.867 -0.700 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.582 -0.176 -0.531 1.00 0.00 C ATOM 1954 C LEU B 32 -17.060 -1.528 -1.068 1.00 0.00 C ATOM 1955 O LEU B 32 -16.548 -2.016 -2.075 1.00 0.00 O ATOM 1956 CB LEU B 32 -16.198 -0.295 0.946 1.00 0.00 C ATOM 1957 CG LEU B 32 -15.516 -1.608 1.343 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -14.220 -1.794 0.567 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -15.255 -1.641 2.840 1.00 0.00 C ATOM 0 H LEU B 32 -17.687 1.493 0.100 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.706 0.112 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -15.533 0.531 1.199 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -17.098 -0.176 1.549 1.00 0.00 H new ATOM 0 HG LEU B 32 -16.184 -2.432 1.093 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -13.750 -2.732 0.863 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -14.436 -1.817 -0.501 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -13.545 -0.966 0.783 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -14.770 -2.581 3.104 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -14.607 -0.809 3.115 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -16.200 -1.557 3.376 1.00 0.00 H new ATOM 1971 N LYS B 33 -18.036 -2.130 -0.390 1.00 0.00 N ATOM 1972 CA LYS B 33 -18.571 -3.430 -0.803 1.00 0.00 C ATOM 1973 C LYS B 33 -18.774 -3.495 -2.315 1.00 0.00 C ATOM 1974 O LYS B 33 -18.448 -4.496 -2.953 1.00 0.00 O ATOM 1975 CB LYS B 33 -19.903 -3.713 -0.105 1.00 0.00 C ATOM 1976 CG LYS B 33 -19.822 -3.693 1.411 1.00 0.00 C ATOM 1977 CD LYS B 33 -21.195 -3.878 2.035 1.00 0.00 C ATOM 1978 CE LYS B 33 -21.115 -3.959 3.551 1.00 0.00 C ATOM 1979 NZ LYS B 33 -22.466 -3.999 4.179 1.00 0.00 N ATOM 0 H LYS B 33 -18.473 -1.741 0.446 1.00 0.00 H new ATOM 0 HA LYS B 33 -17.840 -4.185 -0.514 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -20.636 -2.974 -0.429 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -20.270 -4.688 -0.426 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -19.154 -4.484 1.753 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -19.393 -2.748 1.743 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -21.840 -3.048 1.748 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -21.653 -4.787 1.645 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -20.555 -4.849 3.838 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -20.563 -3.099 3.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -22.617 -3.133 4.734 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -23.192 -4.065 3.437 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -22.534 -4.827 4.805 1.00 0.00 H new ATOM 1993 N GLU B 34 -19.325 -2.425 -2.879 1.00 0.00 N ATOM 1994 CA GLU B 34 -19.583 -2.364 -4.314 1.00 0.00 C ATOM 1995 C GLU B 34 -18.329 -2.683 -5.129 1.00 0.00 C ATOM 1996 O GLU B 34 -18.350 -3.566 -5.985 1.00 0.00 O ATOM 1997 CB GLU B 34 -20.123 -0.983 -4.697 1.00 0.00 C ATOM 1998 CG GLU B 34 -21.581 -0.999 -5.126 1.00 0.00 C ATOM 1999 CD GLU B 34 -21.773 -1.549 -6.525 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -21.425 -2.727 -6.752 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -22.272 -0.802 -7.393 1.00 0.00 O ATOM 0 H GLU B 34 -19.601 -1.589 -2.365 1.00 0.00 H new ATOM 0 HA GLU B 34 -20.332 -3.121 -4.547 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -20.010 -0.309 -3.848 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.518 -0.578 -5.508 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -22.156 -1.600 -4.422 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -21.980 0.014 -5.080 1.00 0.00 H new ATOM 2008 N LEU B 35 -17.242 -1.957 -4.871 1.00 0.00 N ATOM 2009 CA LEU B 35 -15.989 -2.166 -5.601 1.00 0.00 C ATOM 2010 C LEU B 35 -15.571 -3.624 -5.590 1.00 0.00 C ATOM 2011 O LEU B 35 -15.017 -4.130 -6.566 1.00 0.00 O ATOM 2012 CB LEU B 35 -14.860 -1.303 -5.028 1.00 0.00 C ATOM 2013 CG LEU B 35 -15.085 0.208 -5.115 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -15.825 0.567 -6.394 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -15.846 0.692 -3.893 1.00 0.00 C ATOM 0 H LEU B 35 -17.202 -1.222 -4.165 1.00 0.00 H new ATOM 0 HA LEU B 35 -16.173 -1.866 -6.633 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.714 -1.573 -3.982 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.936 -1.547 -5.552 1.00 0.00 H new ATOM 0 HG LEU B 35 -14.116 0.707 -5.138 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -15.975 1.646 -6.437 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -15.239 0.248 -7.256 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -16.793 0.065 -6.408 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -16.001 1.769 -3.964 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -16.811 0.189 -3.843 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -15.272 0.467 -2.994 1.00 0.00 H new ATOM 2027 N ILE B 36 -15.840 -4.294 -4.489 1.00 0.00 N ATOM 2028 CA ILE B 36 -15.487 -5.703 -4.367 1.00 0.00 C ATOM 2029 C ILE B 36 -16.173 -6.509 -5.464 1.00 0.00 C ATOM 2030 O ILE B 36 -15.540 -7.303 -6.153 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.821 -6.279 -2.962 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -14.615 -6.059 -2.034 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -16.200 -7.758 -3.045 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -14.389 -7.158 -1.019 1.00 0.00 C ATOM 0 H ILE B 36 -16.298 -3.895 -3.669 1.00 0.00 H new ATOM 0 HA ILE B 36 -14.407 -5.783 -4.486 1.00 0.00 H new ATOM 0 HB ILE B 36 -16.686 -5.757 -2.554 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -13.718 -5.957 -2.645 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -14.749 -5.116 -1.504 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -16.428 -8.132 -2.047 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -17.075 -7.874 -3.684 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -15.368 -8.324 -3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -13.518 -6.917 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -15.266 -7.248 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -14.219 -8.102 -1.537 1.00 0.00 H new ATOM 2046 N ASN B 37 -17.461 -6.279 -5.641 1.00 0.00 N ATOM 2047 CA ASN B 37 -18.216 -6.968 -6.679 1.00 0.00 C ATOM 2048 C ASN B 37 -18.138 -6.197 -7.995 1.00 0.00 C ATOM 2049 O ASN B 37 -18.574 -6.687 -9.037 1.00 0.00 O ATOM 2050 CB ASN B 37 -19.674 -7.146 -6.254 1.00 0.00 C ATOM 2051 CG ASN B 37 -20.316 -5.841 -5.829 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -20.013 -5.304 -4.763 1.00 0.00 O ATOM 2053 ND2 ASN B 37 -21.211 -5.323 -6.663 1.00 0.00 N ATOM 0 H ASN B 37 -18.008 -5.623 -5.083 1.00 0.00 H new ATOM 0 HA ASN B 37 -17.776 -7.954 -6.826 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -20.241 -7.574 -7.081 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -19.725 -7.858 -5.430 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -21.677 -4.446 -6.430 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -21.432 -5.802 -7.536 1.00 0.00 H new ATOM 2060 N ASN B 38 -17.581 -4.987 -7.940 1.00 0.00 N ATOM 2061 CA ASN B 38 -17.446 -4.152 -9.124 1.00 0.00 C ATOM 2062 C ASN B 38 -16.095 -4.365 -9.798 1.00 0.00 C ATOM 2063 O ASN B 38 -15.954 -4.126 -10.998 1.00 0.00 O ATOM 2064 CB ASN B 38 -17.620 -2.672 -8.764 1.00 0.00 C ATOM 2065 CG ASN B 38 -18.136 -1.852 -9.931 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -18.960 -2.319 -10.717 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -17.652 -0.621 -10.049 1.00 0.00 N ATOM 0 H ASN B 38 -17.217 -4.567 -7.085 1.00 0.00 H new ATOM 0 HA ASN B 38 -18.230 -4.442 -9.823 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -18.312 -2.583 -7.926 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.664 -2.266 -8.432 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -17.962 -0.022 -10.814 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -16.970 -0.274 -9.374 1.00 0.00 H new ATOM 2074 N GLU B 39 -15.094 -4.800 -9.032 1.00 0.00 N ATOM 2075 CA GLU B 39 -13.765 -5.015 -9.601 1.00 0.00 C ATOM 2076 C GLU B 39 -12.973 -6.110 -8.879 1.00 0.00 C ATOM 2077 O GLU B 39 -11.830 -5.890 -8.479 1.00 0.00 O ATOM 2078 CB GLU B 39 -12.972 -3.707 -9.581 1.00 0.00 C ATOM 2079 CG GLU B 39 -12.770 -3.140 -8.186 1.00 0.00 C ATOM 2080 CD GLU B 39 -11.724 -2.044 -8.149 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -11.883 -1.047 -8.887 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -10.748 -2.179 -7.383 1.00 0.00 O ATOM 0 H GLU B 39 -15.175 -5.007 -8.036 1.00 0.00 H new ATOM 0 HA GLU B 39 -13.913 -5.353 -10.627 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.998 -3.875 -10.040 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -13.490 -2.968 -10.193 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -13.717 -2.746 -7.817 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.474 -3.943 -7.511 1.00 0.00 H new ATOM 2089 N LEU B 40 -13.562 -7.297 -8.742 1.00 0.00 N ATOM 2090 CA LEU B 40 -12.874 -8.416 -8.098 1.00 0.00 C ATOM 2091 C LEU B 40 -13.493 -9.745 -8.516 1.00 0.00 C ATOM 2092 O LEU B 40 -14.660 -10.016 -8.234 1.00 0.00 O ATOM 2093 CB LEU B 40 -12.909 -8.294 -6.574 1.00 0.00 C ATOM 2094 CG LEU B 40 -12.207 -7.067 -5.988 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -12.413 -7.013 -4.481 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -10.722 -7.087 -6.324 1.00 0.00 C ATOM 0 H LEU B 40 -14.506 -7.508 -9.065 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.834 -8.385 -8.424 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -13.951 -8.281 -6.253 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -12.455 -9.188 -6.146 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.644 -6.173 -6.432 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.909 -6.136 -4.076 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.479 -6.953 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.999 -7.912 -4.025 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -10.241 -6.206 -5.899 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.267 -7.986 -5.908 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -10.594 -7.083 -7.406 1.00 0.00 H new ATOM 2225 N LYS B 48 -17.140 -12.079 1.630 1.00 0.00 N ATOM 2226 CA LYS B 48 -17.833 -13.077 2.441 1.00 0.00 C ATOM 2227 C LYS B 48 -19.263 -12.658 2.771 1.00 0.00 C ATOM 2228 O LYS B 48 -20.128 -13.509 2.978 1.00 0.00 O ATOM 2229 CB LYS B 48 -17.059 -13.340 3.734 1.00 0.00 C ATOM 2230 CG LYS B 48 -15.670 -13.912 3.503 1.00 0.00 C ATOM 2231 CD LYS B 48 -14.681 -13.416 4.546 1.00 0.00 C ATOM 2232 CE LYS B 48 -13.986 -12.143 4.092 1.00 0.00 C ATOM 2233 NZ LYS B 48 -12.626 -12.417 3.551 1.00 0.00 N ATOM 0 HA LYS B 48 -17.884 -13.992 1.851 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -16.971 -12.408 4.292 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -17.629 -14.031 4.355 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -15.715 -15.001 3.532 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -15.322 -13.633 2.509 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -15.203 -13.232 5.485 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.937 -14.189 4.740 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.589 -11.653 3.328 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.911 -11.451 4.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.185 -11.524 3.252 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.042 -12.862 4.288 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.700 -13.057 2.735 1.00 0.00 H new ATOM 2247 N GLU B 49 -19.512 -11.350 2.824 1.00 0.00 N ATOM 2248 CA GLU B 49 -20.849 -10.846 3.137 1.00 0.00 C ATOM 2249 C GLU B 49 -20.838 -9.345 3.411 1.00 0.00 C ATOM 2250 O GLU B 49 -19.790 -8.696 3.406 1.00 0.00 O ATOM 2251 CB GLU B 49 -21.421 -11.574 4.361 1.00 0.00 C ATOM 2252 CG GLU B 49 -22.671 -12.383 4.057 1.00 0.00 C ATOM 2253 CD GLU B 49 -22.689 -13.721 4.770 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -21.939 -13.877 5.758 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -23.452 -14.612 4.343 1.00 0.00 O ATOM 0 H GLU B 49 -18.813 -10.626 2.656 1.00 0.00 H new ATOM 0 HA GLU B 49 -21.476 -11.034 2.265 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -20.658 -12.238 4.768 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -21.651 -10.841 5.135 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -23.550 -11.809 4.348 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -22.740 -12.548 2.982 1.00 0.00 H new ATOM 2262 N GLN B 50 -22.025 -8.809 3.672 1.00 0.00 N ATOM 2263 CA GLN B 50 -22.183 -7.396 3.977 1.00 0.00 C ATOM 2264 C GLN B 50 -21.679 -7.101 5.388 1.00 0.00 C ATOM 2265 O GLN B 50 -21.338 -5.965 5.716 1.00 0.00 O ATOM 2266 CB GLN B 50 -23.656 -6.998 3.849 1.00 0.00 C ATOM 2267 CG GLN B 50 -24.007 -6.371 2.510 1.00 0.00 C ATOM 2268 CD GLN B 50 -25.084 -5.310 2.627 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -24.819 -4.186 3.054 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -26.306 -5.663 2.248 1.00 0.00 N ATOM 0 H GLN B 50 -22.897 -9.338 3.678 1.00 0.00 H new ATOM 0 HA GLN B 50 -21.595 -6.813 3.268 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -24.276 -7.882 4.000 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -23.904 -6.295 4.645 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -23.111 -5.928 2.075 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -24.342 -7.150 1.825 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -26.480 -6.606 1.900 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -27.071 -4.991 2.304 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.641 -8.141 6.220 1.00 0.00 N ATOM 2280 CA GLU B 51 -21.187 -8.010 7.600 1.00 0.00 C ATOM 2281 C GLU B 51 -19.665 -8.024 7.693 1.00 0.00 C ATOM 2282 O GLU B 51 -19.078 -7.299 8.495 1.00 0.00 O ATOM 2283 CB GLU B 51 -21.759 -9.137 8.464 1.00 0.00 C ATOM 2284 CG GLU B 51 -21.788 -10.492 7.774 1.00 0.00 C ATOM 2285 CD GLU B 51 -23.139 -10.805 7.162 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -23.794 -9.868 6.659 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -23.543 -11.987 7.186 1.00 0.00 O ATOM 0 H GLU B 51 -21.921 -9.087 5.959 1.00 0.00 H new ATOM 0 HA GLU B 51 -21.547 -7.050 7.969 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -21.167 -9.218 9.376 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -22.773 -8.872 8.764 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.026 -10.515 6.995 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -21.531 -11.268 8.495 1.00 0.00 H new ATOM 2294 N VAL B 52 -19.028 -8.856 6.875 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.574 -8.954 6.886 1.00 0.00 C ATOM 2296 C VAL B 52 -16.949 -7.629 6.479 1.00 0.00 C ATOM 2297 O VAL B 52 -15.974 -7.183 7.080 1.00 0.00 O ATOM 2298 CB VAL B 52 -17.061 -10.075 5.953 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -17.468 -11.439 6.486 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -17.581 -9.871 4.545 1.00 0.00 C ATOM 0 H VAL B 52 -19.491 -9.467 6.202 1.00 0.00 H new ATOM 0 HA VAL B 52 -17.278 -9.202 7.905 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.972 -10.032 5.925 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -17.099 -12.216 5.817 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -17.043 -11.583 7.479 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -18.555 -11.497 6.545 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -17.210 -10.669 3.901 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -18.671 -9.888 4.554 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -17.236 -8.909 4.166 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.525 -7.000 5.458 1.00 0.00 N ATOM 2311 CA VAL B 53 -17.031 -5.722 4.967 1.00 0.00 C ATOM 2312 C VAL B 53 -17.173 -4.631 6.020 1.00 0.00 C ATOM 2313 O VAL B 53 -16.230 -3.883 6.277 1.00 0.00 O ATOM 2314 CB VAL B 53 -17.756 -5.308 3.677 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -17.265 -3.956 3.177 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -17.563 -6.377 2.630 1.00 0.00 C ATOM 0 H VAL B 53 -18.337 -7.358 4.955 1.00 0.00 H new ATOM 0 HA VAL B 53 -15.971 -5.848 4.745 1.00 0.00 H new ATOM 0 HB VAL B 53 -18.820 -5.204 3.888 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -17.797 -3.691 2.263 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -17.450 -3.198 3.938 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -16.196 -4.010 2.972 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -18.076 -6.086 1.714 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -16.499 -6.499 2.427 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -17.974 -7.319 2.992 1.00 0.00 H new ATOM 2326 N ASP B 54 -18.344 -4.547 6.644 1.00 0.00 N ATOM 2327 CA ASP B 54 -18.568 -3.547 7.680 1.00 0.00 C ATOM 2328 C ASP B 54 -17.489 -3.670 8.746 1.00 0.00 C ATOM 2329 O ASP B 54 -16.986 -2.672 9.262 1.00 0.00 O ATOM 2330 CB ASP B 54 -19.955 -3.710 8.303 1.00 0.00 C ATOM 2331 CG ASP B 54 -20.338 -2.533 9.178 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -20.150 -1.380 8.738 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -20.827 -2.764 10.304 1.00 0.00 O ATOM 0 H ASP B 54 -19.143 -5.152 6.453 1.00 0.00 H new ATOM 0 HA ASP B 54 -18.518 -2.556 7.230 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -20.695 -3.826 7.511 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -19.978 -4.624 8.897 1.00 0.00 H new ATOM 2338 N LYS B 55 -17.116 -4.908 9.042 1.00 0.00 N ATOM 2339 CA LYS B 55 -16.072 -5.176 10.009 1.00 0.00 C ATOM 2340 C LYS B 55 -14.714 -4.956 9.356 1.00 0.00 C ATOM 2341 O LYS B 55 -13.764 -4.530 10.008 1.00 0.00 O ATOM 2342 CB LYS B 55 -16.179 -6.607 10.540 1.00 0.00 C ATOM 2343 CG LYS B 55 -15.883 -6.723 12.025 1.00 0.00 C ATOM 2344 CD LYS B 55 -16.048 -8.151 12.526 1.00 0.00 C ATOM 2345 CE LYS B 55 -17.444 -8.686 12.249 1.00 0.00 C ATOM 2346 NZ LYS B 55 -17.632 -10.058 12.796 1.00 0.00 N ATOM 0 H LYS B 55 -17.526 -5.742 8.622 1.00 0.00 H new ATOM 0 HA LYS B 55 -16.185 -4.495 10.852 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -17.183 -6.984 10.347 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -15.488 -7.244 9.988 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -14.865 -6.385 12.220 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.550 -6.064 12.581 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -15.310 -8.793 12.045 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -15.851 -8.186 13.597 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -18.183 -8.016 12.688 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -17.622 -8.696 11.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -18.596 -10.386 12.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -16.944 -10.703 12.359 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -17.488 -10.044 13.826 1.00 0.00 H new ATOM 2360 N VAL B 56 -14.640 -5.231 8.051 1.00 0.00 N ATOM 2361 CA VAL B 56 -13.405 -5.047 7.298 1.00 0.00 C ATOM 2362 C VAL B 56 -12.924 -3.607 7.423 1.00 0.00 C ATOM 2363 O VAL B 56 -11.783 -3.361 7.817 1.00 0.00 O ATOM 2364 CB VAL B 56 -13.578 -5.412 5.804 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -12.389 -4.927 4.985 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -13.766 -6.918 5.636 1.00 0.00 C ATOM 0 H VAL B 56 -15.422 -5.581 7.498 1.00 0.00 H new ATOM 0 HA VAL B 56 -12.661 -5.722 7.722 1.00 0.00 H new ATOM 0 HB VAL B 56 -14.472 -4.910 5.435 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -12.534 -5.195 3.939 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -12.304 -3.844 5.073 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -11.477 -5.394 5.356 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -13.886 -7.154 4.579 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -12.893 -7.440 6.027 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -14.654 -7.237 6.182 1.00 0.00 H new ATOM 2376 N MET B 57 -13.801 -2.651 7.113 1.00 0.00 N ATOM 2377 CA MET B 57 -13.435 -1.245 7.230 1.00 0.00 C ATOM 2378 C MET B 57 -13.164 -0.918 8.692 1.00 0.00 C ATOM 2379 O MET B 57 -12.322 -0.078 9.010 1.00 0.00 O ATOM 2380 CB MET B 57 -14.529 -0.333 6.666 1.00 0.00 C ATOM 2381 CG MET B 57 -15.932 -0.688 7.130 1.00 0.00 C ATOM 2382 SD MET B 57 -17.096 -0.840 5.760 1.00 0.00 S ATOM 2383 CE MET B 57 -16.849 0.724 4.920 1.00 0.00 C ATOM 0 H MET B 57 -14.752 -2.822 6.785 1.00 0.00 H new ATOM 0 HA MET B 57 -12.533 -1.068 6.644 1.00 0.00 H new ATOM 0 HB2 MET B 57 -14.313 0.696 6.952 1.00 0.00 H new ATOM 0 HB3 MET B 57 -14.496 -0.375 5.577 1.00 0.00 H new ATOM 0 HG2 MET B 57 -15.902 -1.627 7.682 1.00 0.00 H new ATOM 0 HG3 MET B 57 -16.287 0.077 7.821 1.00 0.00 H new ATOM 0 HE1 MET B 57 -16.953 0.580 3.845 1.00 0.00 H new ATOM 0 HE2 MET B 57 -17.593 1.443 5.264 1.00 0.00 H new ATOM 0 HE3 MET B 57 -15.850 1.101 5.140 1.00 0.00 H new ATOM 2393 N GLU B 58 -13.866 -1.621 9.579 1.00 0.00 N ATOM 2394 CA GLU B 58 -13.686 -1.442 11.011 1.00 0.00 C ATOM 2395 C GLU B 58 -12.309 -1.958 11.419 1.00 0.00 C ATOM 2396 O GLU B 58 -11.673 -1.426 12.329 1.00 0.00 O ATOM 2397 CB GLU B 58 -14.784 -2.186 11.779 1.00 0.00 C ATOM 2398 CG GLU B 58 -15.641 -1.280 12.648 1.00 0.00 C ATOM 2399 CD GLU B 58 -16.424 -2.047 13.696 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -15.854 -2.982 14.296 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -17.606 -1.711 13.918 1.00 0.00 O ATOM 0 H GLU B 58 -14.565 -2.320 9.327 1.00 0.00 H new ATOM 0 HA GLU B 58 -13.756 -0.382 11.253 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -15.426 -2.705 11.067 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -14.323 -2.948 12.407 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -15.003 -0.546 13.141 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -16.334 -0.726 12.015 1.00 0.00 H new ATOM 2408 N THR B 59 -11.855 -2.994 10.717 1.00 0.00 N ATOM 2409 CA THR B 59 -10.550 -3.594 10.968 1.00 0.00 C ATOM 2410 C THR B 59 -9.441 -2.571 10.740 1.00 0.00 C ATOM 2411 O THR B 59 -8.353 -2.680 11.307 1.00 0.00 O ATOM 2412 CB THR B 59 -10.343 -4.796 10.038 1.00 0.00 C ATOM 2413 OG1 THR B 59 -11.568 -5.457 9.793 1.00 0.00 O ATOM 2414 CG2 THR B 59 -9.373 -5.826 10.574 1.00 0.00 C ATOM 0 H THR B 59 -12.379 -3.438 9.963 1.00 0.00 H new ATOM 0 HA THR B 59 -10.513 -3.927 12.005 1.00 0.00 H new ATOM 0 HB THR B 59 -9.925 -4.373 9.125 1.00 0.00 H new ATOM 0 HG1 THR B 59 -12.240 -5.149 10.436 1.00 0.00 H new ATOM 0 HG21 THR B 59 -9.280 -6.644 9.860 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.398 -5.363 10.725 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.742 -6.213 11.524 1.00 0.00 H new ATOM 2422 N LEU B 60 -9.725 -1.586 9.893 1.00 0.00 N ATOM 2423 CA LEU B 60 -8.756 -0.545 9.568 1.00 0.00 C ATOM 2424 C LEU B 60 -9.199 0.822 10.088 1.00 0.00 C ATOM 2425 O LEU B 60 -8.428 1.780 10.050 1.00 0.00 O ATOM 2426 CB LEU B 60 -8.553 -0.474 8.054 1.00 0.00 C ATOM 2427 CG LEU B 60 -8.583 -1.823 7.332 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -9.302 -1.698 5.999 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -7.169 -2.346 7.135 1.00 0.00 C ATOM 0 H LEU B 60 -10.622 -1.487 9.418 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.817 -0.805 10.056 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -9.326 0.166 7.629 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -7.596 0.007 7.853 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.131 -2.536 7.948 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.314 -2.667 5.500 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -10.326 -1.364 6.168 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -8.783 -0.973 5.372 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -7.205 -3.306 6.620 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -6.598 -1.635 6.538 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -6.689 -2.472 8.106 1.00 0.00 H new ATOM 2441 N ASP B 61 -10.444 0.911 10.559 1.00 0.00 N ATOM 2442 CA ASP B 61 -10.987 2.169 11.073 1.00 0.00 C ATOM 2443 C ASP B 61 -9.973 2.907 11.943 1.00 0.00 C ATOM 2444 O ASP B 61 -9.877 2.663 13.146 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.264 1.906 11.875 1.00 0.00 C ATOM 2446 CG ASP B 61 -12.903 3.183 12.382 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -12.642 4.253 11.794 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -13.665 3.114 13.370 1.00 0.00 O ATOM 0 H ASP B 61 -11.095 0.127 10.595 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.219 2.801 10.216 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -12.978 1.369 11.250 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -12.031 1.259 12.721 1.00 0.00 H new ATOM 2453 N ASN B 62 -9.218 3.812 11.326 1.00 0.00 N ATOM 2454 CA ASN B 62 -8.214 4.587 12.044 1.00 0.00 C ATOM 2455 C ASN B 62 -8.749 5.972 12.390 1.00 0.00 C ATOM 2456 O ASN B 62 -8.614 6.436 13.522 1.00 0.00 O ATOM 2457 CB ASN B 62 -6.938 4.709 11.208 1.00 0.00 C ATOM 2458 CG ASN B 62 -5.813 3.842 11.741 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -5.463 3.915 12.919 1.00 0.00 O ATOM 2460 ND2 ASN B 62 -5.241 3.016 10.873 1.00 0.00 N ATOM 0 H ASN B 62 -9.283 4.026 10.331 1.00 0.00 H new ATOM 0 HA ASN B 62 -7.979 4.065 12.972 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -7.154 4.427 10.177 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -6.615 5.750 11.193 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -4.479 2.408 11.173 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -5.564 2.989 9.906 1.00 0.00 H new ATOM 2467 N ASP B 63 -9.358 6.626 11.407 1.00 0.00 N ATOM 2468 CA ASP B 63 -9.915 7.959 11.606 1.00 0.00 C ATOM 2469 C ASP B 63 -10.951 8.281 10.534 1.00 0.00 C ATOM 2470 O ASP B 63 -11.156 9.444 10.185 1.00 0.00 O ATOM 2471 CB ASP B 63 -8.803 9.008 11.589 1.00 0.00 C ATOM 2472 CG ASP B 63 -9.086 10.166 12.525 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -9.557 9.917 13.654 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -8.837 11.324 12.129 1.00 0.00 O ATOM 0 H ASP B 63 -9.478 6.255 10.465 1.00 0.00 H new ATOM 0 HA ASP B 63 -10.407 7.978 12.579 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -7.860 8.539 11.871 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -8.680 9.386 10.574 1.00 0.00 H new ATOM 2479 N GLY B 64 -11.606 7.245 10.017 1.00 0.00 N ATOM 2480 CA GLY B 64 -12.615 7.444 8.993 1.00 0.00 C ATOM 2481 C GLY B 64 -14.026 7.397 9.551 1.00 0.00 C ATOM 2482 O GLY B 64 -14.998 7.384 8.795 1.00 0.00 O ATOM 0 H GLY B 64 -11.456 6.273 10.289 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -12.451 8.406 8.508 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.505 6.678 8.226 1.00 0.00 H new ATOM 2486 N ASP B 65 -14.140 7.369 10.876 1.00 0.00 N ATOM 2487 CA ASP B 65 -15.441 7.321 11.532 1.00 0.00 C ATOM 2488 C ASP B 65 -16.199 6.054 11.149 1.00 0.00 C ATOM 2489 O ASP B 65 -17.429 6.020 11.187 1.00 0.00 O ATOM 2490 CB ASP B 65 -16.268 8.556 11.169 1.00 0.00 C ATOM 2491 CG ASP B 65 -15.849 9.783 11.954 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -15.253 9.617 13.039 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -16.118 10.909 11.486 1.00 0.00 O ATOM 0 H ASP B 65 -13.346 7.379 11.516 1.00 0.00 H new ATOM 0 HA ASP B 65 -15.274 7.310 12.609 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -16.166 8.758 10.103 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -17.322 8.351 11.355 1.00 0.00 H new ATOM 2498 N GLY B 66 -15.457 5.012 10.785 1.00 0.00 N ATOM 2499 CA GLY B 66 -16.078 3.758 10.405 1.00 0.00 C ATOM 2500 C GLY B 66 -16.066 3.519 8.905 1.00 0.00 C ATOM 2501 O GLY B 66 -16.452 2.445 8.443 1.00 0.00 O ATOM 0 H GLY B 66 -14.438 5.015 10.747 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -15.560 2.938 10.902 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -17.108 3.747 10.761 1.00 0.00 H new ATOM 2505 N GLU B 67 -15.625 4.515 8.141 1.00 0.00 N ATOM 2506 CA GLU B 67 -15.570 4.395 6.694 1.00 0.00 C ATOM 2507 C GLU B 67 -14.159 4.048 6.238 1.00 0.00 C ATOM 2508 O GLU B 67 -13.230 3.989 7.044 1.00 0.00 O ATOM 2509 CB GLU B 67 -16.023 5.699 6.037 1.00 0.00 C ATOM 2510 CG GLU B 67 -17.340 5.578 5.291 1.00 0.00 C ATOM 2511 CD GLU B 67 -18.439 6.429 5.897 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -18.306 7.671 5.879 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -19.433 5.855 6.389 1.00 0.00 O ATOM 0 H GLU B 67 -15.302 5.412 8.503 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.242 3.592 6.391 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -16.118 6.468 6.803 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.252 6.034 5.344 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -17.192 5.871 4.252 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -17.655 4.535 5.287 1.00 0.00 H new ATOM 2520 N CYS B 68 -14.008 3.819 4.942 1.00 0.00 N ATOM 2521 CA CYS B 68 -12.709 3.475 4.377 1.00 0.00 C ATOM 2522 C CYS B 68 -12.216 4.553 3.415 1.00 0.00 C ATOM 2523 O CYS B 68 -12.394 4.435 2.207 1.00 0.00 O ATOM 2524 CB CYS B 68 -12.799 2.137 3.639 1.00 0.00 C ATOM 2525 SG CYS B 68 -11.485 0.969 4.060 1.00 0.00 S ATOM 0 H CYS B 68 -14.767 3.865 4.262 1.00 0.00 H new ATOM 0 HA CYS B 68 -11.998 3.398 5.199 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -13.763 1.677 3.859 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -12.773 2.324 2.566 1.00 0.00 H new ATOM 0 HG CYS B 68 -11.650 -0.131 3.387 1.00 0.00 H new ATOM 2531 N ASP B 69 -11.571 5.587 3.945 1.00 0.00 N ATOM 2532 CA ASP B 69 -11.039 6.651 3.102 1.00 0.00 C ATOM 2533 C ASP B 69 -9.702 6.211 2.510 1.00 0.00 C ATOM 2534 O ASP B 69 -9.364 5.029 2.557 1.00 0.00 O ATOM 2535 CB ASP B 69 -10.878 7.956 3.891 1.00 0.00 C ATOM 2536 CG ASP B 69 -10.329 7.747 5.289 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -10.859 6.880 6.015 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -9.369 8.455 5.659 1.00 0.00 O ATOM 0 H ASP B 69 -11.405 5.710 4.944 1.00 0.00 H new ATOM 0 HA ASP B 69 -11.745 6.842 2.294 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -10.214 8.624 3.343 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.845 8.454 3.959 1.00 0.00 H new ATOM 2543 N PHE B 70 -8.936 7.149 1.964 1.00 0.00 N ATOM 2544 CA PHE B 70 -7.641 6.815 1.385 1.00 0.00 C ATOM 2545 C PHE B 70 -6.640 6.448 2.472 1.00 0.00 C ATOM 2546 O PHE B 70 -5.590 5.867 2.197 1.00 0.00 O ATOM 2547 CB PHE B 70 -7.098 7.977 0.553 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.055 7.556 -0.438 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -6.319 6.553 -1.354 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -4.810 8.161 -0.452 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -5.358 6.159 -2.269 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -3.845 7.773 -1.363 1.00 0.00 C ATOM 2553 CZ PHE B 70 -4.120 6.770 -2.273 1.00 0.00 C ATOM 0 H PHE B 70 -9.186 8.136 1.910 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.784 5.954 0.732 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -7.923 8.453 0.023 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -6.674 8.727 1.221 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -7.286 6.072 -1.355 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -4.590 8.945 0.257 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -5.576 5.375 -2.979 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -2.878 8.253 -1.363 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.368 6.465 -2.986 1.00 0.00 H new ATOM 2563 N GLN B 71 -6.977 6.786 3.710 1.00 0.00 N ATOM 2564 CA GLN B 71 -6.108 6.486 4.843 1.00 0.00 C ATOM 2565 C GLN B 71 -6.201 5.007 5.200 1.00 0.00 C ATOM 2566 O GLN B 71 -5.203 4.369 5.541 1.00 0.00 O ATOM 2567 CB GLN B 71 -6.474 7.360 6.051 1.00 0.00 C ATOM 2568 CG GLN B 71 -7.527 6.755 6.969 1.00 0.00 C ATOM 2569 CD GLN B 71 -7.839 7.640 8.158 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -8.844 8.351 8.172 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -6.973 7.603 9.165 1.00 0.00 N ATOM 0 H GLN B 71 -7.843 7.266 3.956 1.00 0.00 H new ATOM 0 HA GLN B 71 -5.079 6.711 4.562 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -5.572 7.553 6.631 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -6.834 8.324 5.691 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -8.441 6.579 6.402 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -7.180 5.784 7.324 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -6.153 6.999 9.111 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -7.128 8.179 9.992 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.408 4.468 5.093 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.644 3.059 5.381 1.00 0.00 C ATOM 2582 C GLU B 72 -7.259 2.220 4.167 1.00 0.00 C ATOM 2583 O GLU B 72 -6.903 1.049 4.286 1.00 0.00 O ATOM 2584 CB GLU B 72 -9.112 2.826 5.748 1.00 0.00 C ATOM 2585 CG GLU B 72 -9.705 3.923 6.620 1.00 0.00 C ATOM 2586 CD GLU B 72 -10.141 3.418 7.982 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -10.470 2.219 8.094 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -10.153 4.225 8.935 1.00 0.00 O ATOM 0 H GLU B 72 -8.240 4.985 4.809 1.00 0.00 H new ATOM 0 HA GLU B 72 -7.030 2.761 6.231 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -9.698 2.745 4.832 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -9.200 1.872 6.268 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -8.968 4.716 6.750 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -10.561 4.364 6.110 1.00 0.00 H new ATOM 2595 N PHE B 73 -7.319 2.856 2.998 1.00 0.00 N ATOM 2596 CA PHE B 73 -6.965 2.219 1.737 1.00 0.00 C ATOM 2597 C PHE B 73 -5.557 1.641 1.809 1.00 0.00 C ATOM 2598 O PHE B 73 -5.359 0.432 1.691 1.00 0.00 O ATOM 2599 CB PHE B 73 -7.032 3.263 0.621 1.00 0.00 C ATOM 2600 CG PHE B 73 -7.843 2.873 -0.586 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -8.872 1.945 -0.508 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -7.573 3.464 -1.806 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -9.608 1.616 -1.629 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -8.303 3.142 -2.927 1.00 0.00 C ATOM 2605 CZ PHE B 73 -9.324 2.215 -2.842 1.00 0.00 C ATOM 0 H PHE B 73 -7.615 3.827 2.902 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.664 1.407 1.536 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -7.446 4.183 1.033 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.016 3.488 0.297 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.099 1.476 0.438 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.777 4.190 -1.881 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -10.405 0.891 -1.558 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.078 3.613 -3.872 1.00 0.00 H new ATOM 0 HZ PHE B 73 -9.898 1.959 -3.720 1.00 0.00 H new ATOM 2615 N MET B 74 -4.584 2.522 2.009 1.00 0.00 N ATOM 2616 CA MET B 74 -3.191 2.113 2.103 1.00 0.00 C ATOM 2617 C MET B 74 -2.992 1.168 3.281 1.00 0.00 C ATOM 2618 O MET B 74 -2.427 0.088 3.132 1.00 0.00 O ATOM 2619 CB MET B 74 -2.280 3.336 2.244 1.00 0.00 C ATOM 2620 CG MET B 74 -2.687 4.514 1.370 1.00 0.00 C ATOM 2621 SD MET B 74 -3.041 4.037 -0.333 1.00 0.00 S ATOM 2622 CE MET B 74 -1.586 3.068 -0.724 1.00 0.00 C ATOM 0 H MET B 74 -4.736 3.526 2.109 1.00 0.00 H new ATOM 0 HA MET B 74 -2.925 1.587 1.186 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.275 3.655 3.286 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.259 3.047 1.994 1.00 0.00 H new ATOM 0 HG2 MET B 74 -3.569 4.990 1.799 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.889 5.256 1.375 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.649 2.717 -1.754 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.695 3.685 -0.605 1.00 0.00 H new ATOM 0 HE3 MET B 74 -1.527 2.212 -0.052 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.473 1.578 4.452 1.00 0.00 N ATOM 2633 CA ALA B 75 -3.355 0.757 5.650 1.00 0.00 C ATOM 2634 C ALA B 75 -4.028 -0.601 5.453 1.00 0.00 C ATOM 2635 O ALA B 75 -3.741 -1.555 6.173 1.00 0.00 O ATOM 2636 CB ALA B 75 -3.958 1.479 6.846 1.00 0.00 C ATOM 0 H ALA B 75 -3.946 2.470 4.595 1.00 0.00 H new ATOM 0 HA ALA B 75 -2.296 0.585 5.841 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -3.863 0.854 7.734 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -3.432 2.420 7.006 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -5.012 1.681 6.656 1.00 0.00 H new ATOM 2642 N PHE B 76 -4.926 -0.678 4.474 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.641 -1.915 4.181 1.00 0.00 C ATOM 2644 C PHE B 76 -4.832 -2.807 3.250 1.00 0.00 C ATOM 2645 O PHE B 76 -4.254 -3.807 3.672 1.00 0.00 O ATOM 2646 CB PHE B 76 -6.985 -1.587 3.532 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.689 -2.773 2.940 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -7.893 -3.925 3.680 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -8.146 -2.727 1.637 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -8.543 -5.012 3.127 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -8.796 -3.808 1.076 1.00 0.00 C ATOM 2652 CZ PHE B 76 -8.996 -4.954 1.822 1.00 0.00 C ATOM 0 H PHE B 76 -5.176 0.105 3.869 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.800 -2.449 5.118 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.634 -1.129 4.278 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.826 -0.845 2.749 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.541 -3.975 4.700 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.993 -1.834 1.050 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -8.697 -5.906 3.714 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.148 -3.758 0.056 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.505 -5.802 1.387 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.804 -2.434 1.976 1.00 0.00 N ATOM 2663 CA VAL B 77 -4.077 -3.194 0.973 1.00 0.00 C ATOM 2664 C VAL B 77 -2.636 -3.441 1.396 1.00 0.00 C ATOM 2665 O VAL B 77 -2.004 -4.378 0.927 1.00 0.00 O ATOM 2666 CB VAL B 77 -4.082 -2.469 -0.388 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -3.492 -3.357 -1.473 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -5.492 -2.030 -0.753 1.00 0.00 C ATOM 0 H VAL B 77 -5.279 -1.607 1.615 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.588 -4.152 0.874 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.459 -1.579 -0.306 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.505 -2.826 -2.425 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.465 -3.613 -1.215 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.083 -4.269 -1.558 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.476 -1.520 -1.716 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -6.140 -2.904 -0.815 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -5.871 -1.351 0.011 1.00 0.00 H new ATOM 2678 N ALA B 78 -2.118 -2.593 2.280 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.737 -2.735 2.743 1.00 0.00 C ATOM 2680 C ALA B 78 -0.615 -3.712 3.912 1.00 0.00 C ATOM 2681 O ALA B 78 0.249 -4.588 3.906 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.168 -1.379 3.133 1.00 0.00 C ATOM 0 H ALA B 78 -2.625 -1.808 2.688 1.00 0.00 H new ATOM 0 HA ALA B 78 -0.161 -3.146 1.914 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.860 -1.500 3.475 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.187 -0.715 2.269 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -0.769 -0.949 3.934 1.00 0.00 H new ATOM 2688 N MET B 79 -1.475 -3.559 4.914 1.00 0.00 N ATOM 2689 CA MET B 79 -1.441 -4.438 6.080 1.00 0.00 C ATOM 2690 C MET B 79 -1.874 -5.840 5.689 1.00 0.00 C ATOM 2691 O MET B 79 -1.199 -6.825 5.987 1.00 0.00 O ATOM 2692 CB MET B 79 -2.358 -3.906 7.184 1.00 0.00 C ATOM 2693 CG MET B 79 -1.801 -2.697 7.918 1.00 0.00 C ATOM 2694 SD MET B 79 -2.719 -2.314 9.424 1.00 0.00 S ATOM 2695 CE MET B 79 -4.408 -2.584 8.884 1.00 0.00 C ATOM 0 H MET B 79 -2.199 -2.841 4.944 1.00 0.00 H new ATOM 0 HA MET B 79 -0.419 -4.467 6.457 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.321 -3.642 6.747 1.00 0.00 H new ATOM 0 HB3 MET B 79 -2.543 -4.703 7.904 1.00 0.00 H new ATOM 0 HG2 MET B 79 -0.756 -2.880 8.170 1.00 0.00 H new ATOM 0 HG3 MET B 79 -1.822 -1.832 7.254 1.00 0.00 H new ATOM 0 HE1 MET B 79 -5.078 -2.525 9.742 1.00 0.00 H new ATOM 0 HE2 MET B 79 -4.683 -1.822 8.155 1.00 0.00 H new ATOM 0 HE3 MET B 79 -4.490 -3.570 8.426 1.00 0.00 H new ATOM 2705 N VAL B 80 -3.009 -5.909 5.014 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.565 -7.168 4.557 1.00 0.00 C ATOM 2707 C VAL B 80 -2.589 -7.895 3.630 1.00 0.00 C ATOM 2708 O VAL B 80 -2.434 -9.116 3.705 1.00 0.00 O ATOM 2709 CB VAL B 80 -4.896 -6.915 3.825 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.521 -8.216 3.350 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -5.857 -6.155 4.728 1.00 0.00 C ATOM 0 H VAL B 80 -3.570 -5.093 4.768 1.00 0.00 H new ATOM 0 HA VAL B 80 -3.743 -7.801 5.427 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.688 -6.308 2.944 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -6.459 -8.003 2.837 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.839 -8.718 2.664 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.714 -8.861 4.207 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.794 -5.982 4.199 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -6.051 -6.740 5.627 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.416 -5.198 5.006 1.00 0.00 H new ATOM 2721 N THR B 81 -1.934 -7.132 2.760 1.00 0.00 N ATOM 2722 CA THR B 81 -0.971 -7.688 1.813 1.00 0.00 C ATOM 2723 C THR B 81 0.309 -8.139 2.517 1.00 0.00 C ATOM 2724 O THR B 81 0.717 -9.295 2.406 1.00 0.00 O ATOM 2725 CB THR B 81 -0.650 -6.635 0.744 1.00 0.00 C ATOM 2726 OG1 THR B 81 -1.715 -6.529 -0.183 1.00 0.00 O ATOM 2727 CG2 THR B 81 0.613 -6.894 -0.052 1.00 0.00 C ATOM 0 H THR B 81 -2.053 -6.121 2.691 1.00 0.00 H new ATOM 0 HA THR B 81 -1.412 -8.567 1.343 1.00 0.00 H new ATOM 0 HB THR B 81 -0.500 -5.717 1.312 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.018 -5.598 -0.228 1.00 0.00 H new ATOM 0 HG21 THR B 81 0.754 -6.096 -0.781 1.00 0.00 H new ATOM 0 HG22 THR B 81 1.469 -6.924 0.623 1.00 0.00 H new ATOM 0 HG23 THR B 81 0.527 -7.849 -0.571 1.00 0.00 H new ATOM 2735 N THR B 82 0.948 -7.210 3.221 1.00 0.00 N ATOM 2736 CA THR B 82 2.197 -7.493 3.926 1.00 0.00 C ATOM 2737 C THR B 82 2.116 -8.767 4.763 1.00 0.00 C ATOM 2738 O THR B 82 3.139 -9.379 5.067 1.00 0.00 O ATOM 2739 CB THR B 82 2.580 -6.310 4.816 1.00 0.00 C ATOM 2740 OG1 THR B 82 2.667 -5.118 4.056 1.00 0.00 O ATOM 2741 CG2 THR B 82 3.903 -6.499 5.527 1.00 0.00 C ATOM 0 H THR B 82 0.620 -6.249 3.320 1.00 0.00 H new ATOM 0 HA THR B 82 2.965 -7.648 3.168 1.00 0.00 H new ATOM 0 HB THR B 82 1.790 -6.244 5.564 1.00 0.00 H new ATOM 0 HG1 THR B 82 1.849 -4.592 4.177 1.00 0.00 H new ATOM 0 HG21 THR B 82 4.114 -5.624 6.141 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.852 -7.384 6.162 1.00 0.00 H new ATOM 0 HG23 THR B 82 4.697 -6.626 4.791 1.00 0.00 H new ATOM 2749 N ALA B 83 0.909 -9.159 5.145 1.00 0.00 N ATOM 2750 CA ALA B 83 0.730 -10.356 5.954 1.00 0.00 C ATOM 2751 C ALA B 83 0.731 -11.620 5.105 1.00 0.00 C ATOM 2752 O ALA B 83 1.668 -12.417 5.162 1.00 0.00 O ATOM 2753 CB ALA B 83 -0.558 -10.270 6.751 1.00 0.00 C ATOM 0 H ALA B 83 0.045 -8.670 4.910 1.00 0.00 H new ATOM 0 HA ALA B 83 1.576 -10.413 6.639 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -0.676 -11.173 7.350 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -0.522 -9.401 7.408 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -1.402 -10.174 6.069 1.00 0.00 H new ATOM 2759 N CYS B 84 -0.334 -11.812 4.334 1.00 0.00 N ATOM 2760 CA CYS B 84 -0.456 -13.001 3.494 1.00 0.00 C ATOM 2761 C CYS B 84 0.195 -12.808 2.130 1.00 0.00 C ATOM 2762 O CYS B 84 1.013 -13.623 1.709 1.00 0.00 O ATOM 2763 CB CYS B 84 -1.925 -13.406 3.331 1.00 0.00 C ATOM 2764 SG CYS B 84 -3.029 -12.052 2.863 1.00 0.00 S ATOM 0 H CYS B 84 -1.121 -11.166 4.272 1.00 0.00 H new ATOM 0 HA CYS B 84 0.077 -13.805 4.001 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -1.991 -14.189 2.576 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -2.276 -13.837 4.269 1.00 0.00 H new ATOM 0 HG CYS B 84 -2.465 -10.915 3.146 1.00 0.00 H new ATOM 2770 N HIS B 85 -0.161 -11.728 1.439 1.00 0.00 N ATOM 2771 CA HIS B 85 0.409 -11.452 0.123 1.00 0.00 C ATOM 2772 C HIS B 85 1.930 -11.592 0.155 1.00 0.00 C ATOM 2773 O HIS B 85 2.564 -11.853 -0.867 1.00 0.00 O ATOM 2774 CB HIS B 85 0.021 -10.049 -0.343 1.00 0.00 C ATOM 2775 CG HIS B 85 0.006 -9.895 -1.832 1.00 0.00 C ATOM 2776 ND1 HIS B 85 -1.086 -9.425 -2.530 1.00 0.00 N ATOM 2777 CD2 HIS B 85 0.958 -10.155 -2.760 1.00 0.00 C ATOM 2778 CE1 HIS B 85 -0.806 -9.401 -3.821 1.00 0.00 C ATOM 2779 NE2 HIS B 85 0.427 -9.839 -3.986 1.00 0.00 N ATOM 0 H HIS B 85 -0.835 -11.035 1.764 1.00 0.00 H new ATOM 0 HA HIS B 85 0.008 -12.180 -0.582 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -0.966 -9.805 0.049 1.00 0.00 H new ATOM 0 HB3 HIS B 85 0.720 -9.328 0.081 1.00 0.00 H new ATOM 0 HD2 HIS B 85 1.949 -10.539 -2.571 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -1.473 -9.078 -4.607 1.00 0.00 H new ATOM 0 HE2 HIS B 85 0.909 -9.929 -4.881 1.00 0.00 H new ATOM 2788 N GLU B 86 2.503 -11.421 1.345 1.00 0.00 N ATOM 2789 CA GLU B 86 3.942 -11.530 1.538 1.00 0.00 C ATOM 2790 C GLU B 86 4.495 -12.795 0.891 1.00 0.00 C ATOM 2791 O GLU B 86 5.288 -12.730 -0.049 1.00 0.00 O ATOM 2792 CB GLU B 86 4.250 -11.528 3.038 1.00 0.00 C ATOM 2793 CG GLU B 86 5.695 -11.869 3.374 1.00 0.00 C ATOM 2794 CD GLU B 86 6.355 -10.820 4.248 1.00 0.00 C ATOM 2795 OE1 GLU B 86 6.333 -9.631 3.868 1.00 0.00 O ATOM 2796 OE2 GLU B 86 6.895 -11.188 5.313 1.00 0.00 O ATOM 0 H GLU B 86 1.984 -11.204 2.196 1.00 0.00 H new ATOM 0 HA GLU B 86 4.423 -10.677 1.059 1.00 0.00 H new ATOM 0 HB2 GLU B 86 4.015 -10.545 3.445 1.00 0.00 H new ATOM 0 HB3 GLU B 86 3.594 -12.243 3.534 1.00 0.00 H new ATOM 0 HG2 GLU B 86 5.728 -12.833 3.882 1.00 0.00 H new ATOM 0 HG3 GLU B 86 6.263 -11.976 2.450 1.00 0.00 H new ATOM 2803 N PHE B 87 4.068 -13.943 1.398 1.00 0.00 N ATOM 2804 CA PHE B 87 4.515 -15.223 0.871 1.00 0.00 C ATOM 2805 C PHE B 87 3.333 -16.019 0.327 1.00 0.00 C ATOM 2806 O PHE B 87 3.485 -16.826 -0.590 1.00 0.00 O ATOM 2807 CB PHE B 87 5.245 -16.018 1.954 1.00 0.00 C ATOM 2808 CG PHE B 87 6.724 -16.140 1.715 1.00 0.00 C ATOM 2809 CD1 PHE B 87 7.495 -15.016 1.450 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.343 -17.379 1.754 1.00 0.00 C ATOM 2811 CE1 PHE B 87 8.854 -15.130 1.229 1.00 0.00 C ATOM 2812 CE2 PHE B 87 8.702 -17.497 1.535 1.00 0.00 C ATOM 2813 CZ PHE B 87 9.458 -16.371 1.271 1.00 0.00 C ATOM 0 H PHE B 87 3.411 -14.013 2.175 1.00 0.00 H new ATOM 0 HA PHE B 87 5.209 -15.037 0.051 1.00 0.00 H new ATOM 0 HB2 PHE B 87 5.079 -15.539 2.919 1.00 0.00 H new ATOM 0 HB3 PHE B 87 4.811 -17.016 2.015 1.00 0.00 H new ATOM 0 HD1 PHE B 87 7.028 -14.043 1.416 1.00 0.00 H new ATOM 0 HD2 PHE B 87 6.756 -18.263 1.958 1.00 0.00 H new ATOM 0 HE1 PHE B 87 9.444 -14.249 1.023 1.00 0.00 H new ATOM 0 HE2 PHE B 87 9.173 -18.468 1.570 1.00 0.00 H new ATOM 0 HZ PHE B 87 10.520 -16.461 1.098 1.00 0.00 H new ATOM 2823 N PHE B 88 2.151 -15.774 0.889 1.00 0.00 N ATOM 2824 CA PHE B 88 0.944 -16.458 0.449 1.00 0.00 C ATOM 2825 C PHE B 88 0.391 -15.813 -0.820 1.00 0.00 C ATOM 2826 O PHE B 88 -0.417 -16.415 -1.528 1.00 0.00 O ATOM 2827 CB PHE B 88 -0.118 -16.442 1.555 1.00 0.00 C ATOM 2828 CG PHE B 88 0.208 -17.344 2.711 1.00 0.00 C ATOM 2829 CD1 PHE B 88 0.307 -18.715 2.529 1.00 0.00 C ATOM 2830 CD2 PHE B 88 0.419 -16.823 3.977 1.00 0.00 C ATOM 2831 CE1 PHE B 88 0.606 -19.548 3.590 1.00 0.00 C ATOM 2832 CE2 PHE B 88 0.720 -17.651 5.042 1.00 0.00 C ATOM 2833 CZ PHE B 88 0.814 -19.015 4.848 1.00 0.00 C ATOM 0 H PHE B 88 2.007 -15.108 1.648 1.00 0.00 H new ATOM 0 HA PHE B 88 1.203 -17.494 0.228 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -0.234 -15.422 1.922 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -1.077 -16.740 1.131 1.00 0.00 H new ATOM 0 HD1 PHE B 88 0.149 -19.136 1.547 1.00 0.00 H new ATOM 0 HD2 PHE B 88 0.347 -15.757 4.134 1.00 0.00 H new ATOM 0 HE1 PHE B 88 0.677 -20.615 3.436 1.00 0.00 H new ATOM 0 HE2 PHE B 88 0.881 -17.232 6.024 1.00 0.00 H new ATOM 0 HZ PHE B 88 1.050 -19.664 5.678 1.00 0.00 H new ATOM 2909 N ARG C 2 -0.245 15.171 7.357 1.00 0.00 N ATOM 2910 CA ARG C 2 -0.549 16.016 6.208 1.00 0.00 C ATOM 2911 C ARG C 2 0.727 16.415 5.472 1.00 0.00 C ATOM 2912 O ARG C 2 0.989 15.941 4.366 1.00 0.00 O ATOM 2913 CB ARG C 2 -1.311 17.266 6.653 1.00 0.00 C ATOM 2914 CG ARG C 2 -1.773 18.141 5.498 1.00 0.00 C ATOM 2915 CD ARG C 2 -1.504 19.613 5.767 1.00 0.00 C ATOM 2916 NE ARG C 2 -2.508 20.201 6.651 1.00 0.00 N ATOM 2917 CZ ARG C 2 -2.644 21.510 6.853 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -1.843 22.371 6.238 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -3.585 21.960 7.673 1.00 0.00 N ATOM 0 HA ARG C 2 -1.176 15.444 5.524 1.00 0.00 H new ATOM 0 HB2 ARG C 2 -2.179 16.963 7.238 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -0.673 17.855 7.311 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -1.261 17.838 4.584 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -2.840 17.990 5.331 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -0.517 19.725 6.215 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -1.489 20.157 4.823 1.00 0.00 H new ATOM 0 HE ARG C 2 -3.142 19.571 7.142 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -1.118 22.031 5.606 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -1.952 23.373 6.397 1.00 0.00 H new ATOM 0 HH21 ARG C 2 -4.204 21.303 8.148 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -3.689 22.963 7.828 1.00 0.00 H new ATOM 2932 N THR C 3 1.517 17.287 6.091 1.00 0.00 N ATOM 2933 CA THR C 3 2.765 17.744 5.489 1.00 0.00 C ATOM 2934 C THR C 3 3.968 16.982 6.044 1.00 0.00 C ATOM 2935 O THR C 3 5.095 17.175 5.590 1.00 0.00 O ATOM 2936 CB THR C 3 2.948 19.246 5.718 1.00 0.00 C ATOM 2937 OG1 THR C 3 2.327 19.649 6.925 1.00 0.00 O ATOM 2938 CG2 THR C 3 2.378 20.096 4.602 1.00 0.00 C ATOM 0 H THR C 3 1.316 17.690 7.006 1.00 0.00 H new ATOM 0 HA THR C 3 2.706 17.548 4.418 1.00 0.00 H new ATOM 0 HB THR C 3 4.026 19.402 5.757 1.00 0.00 H new ATOM 0 HG1 THR C 3 2.457 20.612 7.054 1.00 0.00 H new ATOM 0 HG21 THR C 3 2.541 21.150 4.828 1.00 0.00 H new ATOM 0 HG22 THR C 3 2.873 19.845 3.664 1.00 0.00 H new ATOM 0 HG23 THR C 3 1.309 19.906 4.510 1.00 0.00 H new ATOM 2946 N LYS C 4 3.724 16.111 7.020 1.00 0.00 N ATOM 2947 CA LYS C 4 4.790 15.319 7.622 1.00 0.00 C ATOM 2948 C LYS C 4 5.140 14.115 6.745 1.00 0.00 C ATOM 2949 O LYS C 4 6.032 13.337 7.077 1.00 0.00 O ATOM 2950 CB LYS C 4 4.375 14.844 9.016 1.00 0.00 C ATOM 2951 CG LYS C 4 5.521 14.258 9.826 1.00 0.00 C ATOM 2952 CD LYS C 4 5.461 12.739 9.859 1.00 0.00 C ATOM 2953 CE LYS C 4 6.821 12.134 10.172 1.00 0.00 C ATOM 2954 NZ LYS C 4 6.700 10.877 10.961 1.00 0.00 N ATOM 0 H LYS C 4 2.798 15.937 7.410 1.00 0.00 H new ATOM 0 HA LYS C 4 5.673 15.952 7.708 1.00 0.00 H new ATOM 0 HB2 LYS C 4 3.946 15.683 9.564 1.00 0.00 H new ATOM 0 HB3 LYS C 4 3.591 14.094 8.916 1.00 0.00 H new ATOM 0 HG2 LYS C 4 6.471 14.576 9.397 1.00 0.00 H new ATOM 0 HG3 LYS C 4 5.485 14.647 10.844 1.00 0.00 H new ATOM 0 HD2 LYS C 4 4.738 12.419 10.609 1.00 0.00 H new ATOM 0 HD3 LYS C 4 5.109 12.367 8.897 1.00 0.00 H new ATOM 0 HE2 LYS C 4 7.350 11.929 9.241 1.00 0.00 H new ATOM 0 HE3 LYS C 4 7.420 12.855 10.728 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 7.573 10.723 11.505 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 5.894 10.953 11.614 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 6.548 10.076 10.316 1.00 0.00 H new ATOM 2968 N ILE C 5 4.415 13.966 5.632 1.00 0.00 N ATOM 2969 CA ILE C 5 4.609 12.863 4.686 1.00 0.00 C ATOM 2970 C ILE C 5 4.703 11.493 5.377 1.00 0.00 C ATOM 2971 O ILE C 5 5.045 10.493 4.748 1.00 0.00 O ATOM 2972 CB ILE C 5 5.830 13.079 3.759 1.00 0.00 C ATOM 2973 CG1 ILE C 5 7.071 13.528 4.545 1.00 0.00 C ATOM 2974 CG2 ILE C 5 5.486 14.094 2.674 1.00 0.00 C ATOM 2975 CD1 ILE C 5 7.051 14.994 4.913 1.00 0.00 C ATOM 0 H ILE C 5 3.673 14.611 5.361 1.00 0.00 H new ATOM 0 HA ILE C 5 3.712 12.862 4.066 1.00 0.00 H new ATOM 0 HB ILE C 5 6.071 12.123 3.293 1.00 0.00 H new ATOM 0 HG12 ILE C 5 7.150 12.934 5.455 1.00 0.00 H new ATOM 0 HG13 ILE C 5 7.962 13.322 3.952 1.00 0.00 H new ATOM 0 HG21 ILE C 5 6.350 14.241 2.026 1.00 0.00 H new ATOM 0 HG22 ILE C 5 4.648 13.725 2.083 1.00 0.00 H new ATOM 0 HG23 ILE C 5 5.214 15.043 3.136 1.00 0.00 H new ATOM 0 HD11 ILE C 5 7.957 15.243 5.466 1.00 0.00 H new ATOM 0 HD12 ILE C 5 7.003 15.596 4.006 1.00 0.00 H new ATOM 0 HD13 ILE C 5 6.179 15.202 5.533 1.00 0.00 H new ATOM 2987 N ASP C 6 4.357 11.451 6.663 1.00 0.00 N ATOM 2988 CA ASP C 6 4.361 10.215 7.450 1.00 0.00 C ATOM 2989 C ASP C 6 5.522 9.271 7.117 1.00 0.00 C ATOM 2990 O ASP C 6 5.397 8.058 7.290 1.00 0.00 O ATOM 2991 CB ASP C 6 3.035 9.473 7.264 1.00 0.00 C ATOM 2992 CG ASP C 6 2.765 8.485 8.383 1.00 0.00 C ATOM 2993 OD1 ASP C 6 3.253 8.715 9.509 1.00 0.00 O ATOM 2994 OD2 ASP C 6 2.065 7.483 8.132 1.00 0.00 O ATOM 0 H ASP C 6 4.065 12.274 7.191 1.00 0.00 H new ATOM 0 HA ASP C 6 4.493 10.520 8.488 1.00 0.00 H new ATOM 0 HB2 ASP C 6 2.221 10.196 7.216 1.00 0.00 H new ATOM 0 HB3 ASP C 6 3.048 8.944 6.311 1.00 0.00 H new ATOM 2999 N TRP C 7 6.656 9.808 6.673 1.00 0.00 N ATOM 3000 CA TRP C 7 7.809 8.960 6.372 1.00 0.00 C ATOM 3001 C TRP C 7 8.394 8.428 7.679 1.00 0.00 C ATOM 3002 O TRP C 7 8.295 7.239 7.972 1.00 0.00 O ATOM 3003 CB TRP C 7 8.878 9.729 5.592 1.00 0.00 C ATOM 3004 CG TRP C 7 8.651 9.753 4.107 1.00 0.00 C ATOM 3005 CD1 TRP C 7 7.594 10.305 3.455 1.00 0.00 C ATOM 3006 CD2 TRP C 7 9.501 9.206 3.092 1.00 0.00 C ATOM 3007 NE1 TRP C 7 7.742 10.161 2.098 1.00 0.00 N ATOM 3008 CE2 TRP C 7 8.904 9.484 1.850 1.00 0.00 C ATOM 3009 CE3 TRP C 7 10.709 8.515 3.112 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 9.477 9.094 0.642 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 11.280 8.127 1.915 1.00 0.00 C ATOM 3012 CH2 TRP C 7 10.664 8.419 0.693 1.00 0.00 C ATOM 0 H TRP C 7 6.802 10.805 6.516 1.00 0.00 H new ATOM 0 HA TRP C 7 7.478 8.130 5.748 1.00 0.00 H new ATOM 0 HB2 TRP C 7 8.915 10.754 5.960 1.00 0.00 H new ATOM 0 HB3 TRP C 7 9.852 9.283 5.793 1.00 0.00 H new ATOM 0 HD1 TRP C 7 6.757 10.788 3.936 1.00 0.00 H new ATOM 0 HE1 TRP C 7 7.092 10.503 1.390 1.00 0.00 H new ATOM 0 HE3 TRP C 7 11.193 8.285 4.050 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 9.000 9.317 -0.301 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 12.217 7.590 1.923 1.00 0.00 H new ATOM 0 HH2 TRP C 7 11.135 8.105 -0.227 1.00 0.00 H new ATOM 3023 N ASN C 8 8.971 9.344 8.469 1.00 0.00 N ATOM 3024 CA ASN C 8 9.559 9.033 9.781 1.00 0.00 C ATOM 3025 C ASN C 8 10.748 9.953 10.082 1.00 0.00 C ATOM 3026 O ASN C 8 10.561 11.068 10.562 1.00 0.00 O ATOM 3027 CB ASN C 8 9.974 7.557 9.911 1.00 0.00 C ATOM 3028 CG ASN C 8 10.681 7.266 11.222 1.00 0.00 C ATOM 3029 OD1 ASN C 8 10.110 7.438 12.300 1.00 0.00 O ATOM 3030 ND2 ASN C 8 11.929 6.822 11.136 1.00 0.00 N ATOM 0 H ASN C 8 9.044 10.329 8.214 1.00 0.00 H new ATOM 0 HA ASN C 8 8.778 9.212 10.520 1.00 0.00 H new ATOM 0 HB2 ASN C 8 9.089 6.926 9.831 1.00 0.00 H new ATOM 0 HB3 ASN C 8 10.630 7.293 9.082 1.00 0.00 H new ATOM 0 HD21 ASN C 8 12.454 6.609 11.984 1.00 0.00 H new ATOM 0 HD22 ASN C 8 12.363 6.694 10.222 1.00 0.00 H new ATOM 3037 N LYS C 9 11.969 9.479 9.831 1.00 0.00 N ATOM 3038 CA LYS C 9 13.165 10.269 10.111 1.00 0.00 C ATOM 3039 C LYS C 9 13.719 10.988 8.876 1.00 0.00 C ATOM 3040 O LYS C 9 14.108 12.153 8.957 1.00 0.00 O ATOM 3041 CB LYS C 9 14.252 9.378 10.716 1.00 0.00 C ATOM 3042 CG LYS C 9 15.344 10.153 11.433 1.00 0.00 C ATOM 3043 CD LYS C 9 16.487 10.506 10.494 1.00 0.00 C ATOM 3044 CE LYS C 9 17.724 9.672 10.782 1.00 0.00 C ATOM 3045 NZ LYS C 9 18.400 10.099 12.037 1.00 0.00 N ATOM 0 H LYS C 9 12.154 8.557 9.436 1.00 0.00 H new ATOM 0 HA LYS C 9 12.867 11.040 10.821 1.00 0.00 H new ATOM 0 HB2 LYS C 9 13.791 8.682 11.417 1.00 0.00 H new ATOM 0 HB3 LYS C 9 14.703 8.780 9.924 1.00 0.00 H new ATOM 0 HG2 LYS C 9 14.925 11.066 11.857 1.00 0.00 H new ATOM 0 HG3 LYS C 9 15.725 9.561 12.265 1.00 0.00 H new ATOM 0 HD2 LYS C 9 16.173 10.348 9.462 1.00 0.00 H new ATOM 0 HD3 LYS C 9 16.729 11.564 10.596 1.00 0.00 H new ATOM 0 HE2 LYS C 9 17.444 8.621 10.860 1.00 0.00 H new ATOM 0 HE3 LYS C 9 18.421 9.755 9.948 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 19.292 9.576 12.146 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 18.599 11.119 11.994 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 17.781 9.901 12.849 1.00 0.00 H new ATOM 3059 N ILE C 10 13.796 10.284 7.747 1.00 0.00 N ATOM 3060 CA ILE C 10 14.355 10.865 6.525 1.00 0.00 C ATOM 3061 C ILE C 10 13.673 12.179 6.132 1.00 0.00 C ATOM 3062 O ILE C 10 14.332 13.214 6.033 1.00 0.00 O ATOM 3063 CB ILE C 10 14.328 9.856 5.345 1.00 0.00 C ATOM 3064 CG1 ILE C 10 15.434 10.185 4.336 1.00 0.00 C ATOM 3065 CG2 ILE C 10 12.969 9.813 4.657 1.00 0.00 C ATOM 3066 CD1 ILE C 10 15.076 11.288 3.361 1.00 0.00 C ATOM 0 H ILE C 10 13.481 9.318 7.652 1.00 0.00 H new ATOM 0 HA ILE C 10 15.396 11.098 6.749 1.00 0.00 H new ATOM 0 HB ILE C 10 14.509 8.864 5.760 1.00 0.00 H new ATOM 0 HG12 ILE C 10 16.333 10.474 4.880 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.678 9.283 3.774 1.00 0.00 H new ATOM 0 HG21 ILE C 10 12.998 9.094 3.839 1.00 0.00 H new ATOM 0 HG22 ILE C 10 12.206 9.514 5.376 1.00 0.00 H new ATOM 0 HG23 ILE C 10 12.729 10.801 4.264 1.00 0.00 H new ATOM 0 HD11 ILE C 10 15.912 11.459 2.682 1.00 0.00 H new ATOM 0 HD12 ILE C 10 14.197 10.995 2.787 1.00 0.00 H new ATOM 0 HD13 ILE C 10 14.862 12.204 3.911 1.00 0.00 H new ATOM 3078 N LEU C 11 12.363 12.147 5.917 1.00 0.00 N ATOM 3079 CA LEU C 11 11.629 13.348 5.547 1.00 0.00 C ATOM 3080 C LEU C 11 11.048 14.017 6.788 1.00 0.00 C ATOM 3081 O LEU C 11 10.694 15.197 6.766 1.00 0.00 O ATOM 3082 CB LEU C 11 10.521 13.014 4.544 1.00 0.00 C ATOM 3083 CG LEU C 11 10.896 13.224 3.074 1.00 0.00 C ATOM 3084 CD1 LEU C 11 11.561 11.979 2.502 1.00 0.00 C ATOM 3085 CD2 LEU C 11 9.669 13.592 2.254 1.00 0.00 C ATOM 0 H LEU C 11 11.791 11.306 5.992 1.00 0.00 H new ATOM 0 HA LEU C 11 12.320 14.044 5.071 1.00 0.00 H new ATOM 0 HB2 LEU C 11 10.226 11.974 4.683 1.00 0.00 H new ATOM 0 HB3 LEU C 11 9.648 13.626 4.772 1.00 0.00 H new ATOM 0 HG LEU C 11 11.607 14.048 3.022 1.00 0.00 H new ATOM 0 HD11 LEU C 11 11.818 12.152 1.457 1.00 0.00 H new ATOM 0 HD12 LEU C 11 12.466 11.758 3.067 1.00 0.00 H new ATOM 0 HD13 LEU C 11 10.875 11.135 2.572 1.00 0.00 H new ATOM 0 HD21 LEU C 11 9.957 13.737 1.213 1.00 0.00 H new ATOM 0 HD22 LEU C 11 8.934 12.790 2.319 1.00 0.00 H new ATOM 0 HD23 LEU C 11 9.235 14.514 2.642 1.00 0.00 H new ATOM 3097 N SER C 12 10.956 13.250 7.870 1.00 0.00 N ATOM 3098 CA SER C 12 10.427 13.751 9.128 1.00 0.00 C ATOM 3099 C SER C 12 8.994 14.245 8.960 1.00 0.00 C ATOM 3100 O SER C 12 8.286 13.716 8.077 1.00 0.00 O ATOM 3101 CB SER C 12 11.312 14.877 9.668 1.00 0.00 C ATOM 3102 OG SER C 12 10.993 16.115 9.058 1.00 0.00 O ATOM 3103 OXT SER C 12 8.590 15.157 9.714 1.00 0.00 O ATOM 0 H SER C 12 11.244 12.272 7.897 1.00 0.00 H new ATOM 0 HA SER C 12 10.424 12.929 9.844 1.00 0.00 H new ATOM 0 HB2 SER C 12 11.185 14.957 10.748 1.00 0.00 H new ATOM 0 HB3 SER C 12 12.360 14.638 9.487 1.00 0.00 H new ATOM 0 HG SER C 12 11.141 16.051 8.091 1.00 0.00 H new ATOM 3110 N THR D 1 1.907 -12.217 11.885 1.00 0.00 N ATOM 3111 CA THR D 1 1.609 -11.547 10.592 1.00 0.00 C ATOM 3112 C THR D 1 1.576 -12.550 9.442 1.00 0.00 C ATOM 3113 O THR D 1 0.941 -12.312 8.417 1.00 0.00 O ATOM 3114 CB THR D 1 2.679 -10.485 10.332 1.00 0.00 C ATOM 3115 OG1 THR D 1 3.892 -10.824 10.981 1.00 0.00 O ATOM 3116 CG2 THR D 1 2.278 -9.103 10.804 1.00 0.00 C ATOM 0 H1 THR D 1 1.464 -11.685 12.662 1.00 0.00 H new ATOM 0 H2 THR D 1 1.529 -13.186 11.869 1.00 0.00 H new ATOM 0 H3 THR D 1 2.936 -12.249 12.030 1.00 0.00 H new ATOM 0 HA THR D 1 0.624 -11.083 10.652 1.00 0.00 H new ATOM 0 HB THR D 1 2.804 -10.461 9.249 1.00 0.00 H new ATOM 0 HG1 THR D 1 4.564 -10.133 10.801 1.00 0.00 H new ATOM 0 HG21 THR D 1 3.081 -8.398 10.589 1.00 0.00 H new ATOM 0 HG22 THR D 1 1.372 -8.790 10.285 1.00 0.00 H new ATOM 0 HG23 THR D 1 2.092 -9.125 11.878 1.00 0.00 H new ATOM 3126 N ARG D 2 2.266 -13.674 9.620 1.00 0.00 N ATOM 3127 CA ARG D 2 2.312 -14.709 8.593 1.00 0.00 C ATOM 3128 C ARG D 2 0.909 -15.204 8.254 1.00 0.00 C ATOM 3129 O ARG D 2 0.388 -14.923 7.175 1.00 0.00 O ATOM 3130 CB ARG D 2 3.182 -15.880 9.059 1.00 0.00 C ATOM 3131 CG ARG D 2 3.384 -16.948 7.995 1.00 0.00 C ATOM 3132 CD ARG D 2 3.215 -18.348 8.568 1.00 0.00 C ATOM 3133 NE ARG D 2 4.409 -18.794 9.281 1.00 0.00 N ATOM 3134 CZ ARG D 2 4.616 -20.051 9.668 1.00 0.00 C ATOM 3135 NH1 ARG D 2 3.712 -20.988 9.413 1.00 0.00 N ATOM 3136 NH2 ARG D 2 5.730 -20.371 10.313 1.00 0.00 N ATOM 0 H ARG D 2 2.799 -13.890 10.463 1.00 0.00 H new ATOM 0 HA ARG D 2 2.750 -14.275 7.694 1.00 0.00 H new ATOM 0 HB2 ARG D 2 4.155 -15.498 9.369 1.00 0.00 H new ATOM 0 HB3 ARG D 2 2.724 -16.335 9.937 1.00 0.00 H new ATOM 0 HG2 ARG D 2 2.669 -16.796 7.186 1.00 0.00 H new ATOM 0 HG3 ARG D 2 4.380 -16.849 7.563 1.00 0.00 H new ATOM 0 HD2 ARG D 2 2.361 -18.362 9.246 1.00 0.00 H new ATOM 0 HD3 ARG D 2 2.993 -19.046 7.761 1.00 0.00 H new ATOM 0 HE ARG D 2 5.127 -18.102 9.495 1.00 0.00 H new ATOM 0 HH11 ARG D 2 2.853 -20.747 8.918 1.00 0.00 H new ATOM 0 HH12 ARG D 2 3.876 -21.949 9.712 1.00 0.00 H new ATOM 0 HH21 ARG D 2 6.428 -19.654 10.512 1.00 0.00 H new ATOM 0 HH22 ARG D 2 5.889 -21.334 10.610 1.00 0.00 H new ATOM 3149 N THR D 3 0.303 -15.941 9.180 1.00 0.00 N ATOM 3150 CA THR D 3 -1.041 -16.470 8.972 1.00 0.00 C ATOM 3151 C THR D 3 -2.098 -15.601 9.651 1.00 0.00 C ATOM 3152 O THR D 3 -3.295 -15.847 9.511 1.00 0.00 O ATOM 3153 CB THR D 3 -1.134 -17.906 9.490 1.00 0.00 C ATOM 3154 OG1 THR D 3 -0.241 -18.108 10.571 1.00 0.00 O ATOM 3155 CG2 THR D 3 -0.820 -18.946 8.435 1.00 0.00 C ATOM 0 H THR D 3 0.719 -16.185 10.079 1.00 0.00 H new ATOM 0 HA THR D 3 -1.236 -16.461 7.900 1.00 0.00 H new ATOM 0 HB THR D 3 -2.170 -18.032 9.804 1.00 0.00 H new ATOM 0 HG1 THR D 3 -0.317 -19.032 10.889 1.00 0.00 H new ATOM 0 HG21 THR D 3 -0.905 -19.942 8.869 1.00 0.00 H new ATOM 0 HG22 THR D 3 -1.524 -18.850 7.608 1.00 0.00 H new ATOM 0 HG23 THR D 3 0.195 -18.796 8.067 1.00 0.00 H new ATOM 3163 N LYS D 4 -1.653 -14.580 10.379 1.00 0.00 N ATOM 3164 CA LYS D 4 -2.566 -13.674 11.067 1.00 0.00 C ATOM 3165 C LYS D 4 -3.135 -12.634 10.102 1.00 0.00 C ATOM 3166 O LYS D 4 -3.942 -11.792 10.494 1.00 0.00 O ATOM 3167 CB LYS D 4 -1.850 -12.976 12.224 1.00 0.00 C ATOM 3168 CG LYS D 4 -2.788 -12.237 13.165 1.00 0.00 C ATOM 3169 CD LYS D 4 -2.755 -10.737 12.921 1.00 0.00 C ATOM 3170 CE LYS D 4 -4.017 -10.061 13.434 1.00 0.00 C ATOM 3171 NZ LYS D 4 -3.744 -8.689 13.945 1.00 0.00 N ATOM 0 H LYS D 4 -0.665 -14.360 10.507 1.00 0.00 H new ATOM 0 HA LYS D 4 -3.392 -14.264 11.463 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -1.289 -13.717 12.793 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -1.125 -12.270 11.818 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -3.805 -12.606 13.031 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -2.507 -12.445 14.197 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -1.884 -10.306 13.415 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -2.645 -10.543 11.854 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -4.753 -10.010 12.632 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -4.454 -10.664 14.230 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -4.470 -8.427 14.642 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -2.807 -8.666 14.396 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -3.764 -8.014 13.154 1.00 0.00 H new ATOM 3185 N ILE D 5 -2.691 -12.692 8.842 1.00 0.00 N ATOM 3186 CA ILE D 5 -3.123 -11.764 7.791 1.00 0.00 C ATOM 3187 C ILE D 5 -3.084 -10.294 8.241 1.00 0.00 C ATOM 3188 O ILE D 5 -3.583 -9.411 7.547 1.00 0.00 O ATOM 3189 CB ILE D 5 -4.521 -12.113 7.225 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -5.536 -12.395 8.343 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -4.417 -13.305 6.280 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -5.400 -13.776 8.942 1.00 0.00 C ATOM 0 H ILE D 5 -2.018 -13.388 8.521 1.00 0.00 H new ATOM 0 HA ILE D 5 -2.396 -11.886 6.989 1.00 0.00 H new ATOM 0 HB ILE D 5 -4.884 -11.247 6.671 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -5.414 -11.652 9.131 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -6.544 -12.277 7.947 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -5.405 -13.544 5.886 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -3.748 -13.059 5.456 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -4.024 -14.166 6.822 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -6.147 -13.908 9.725 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -5.552 -14.526 8.166 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -4.403 -13.891 9.368 1.00 0.00 H new ATOM 3204 N ASP D 6 -2.450 -10.039 9.384 1.00 0.00 N ATOM 3205 CA ASP D 6 -2.297 -8.686 9.927 1.00 0.00 C ATOM 3206 C ASP D 6 -3.524 -7.791 9.716 1.00 0.00 C ATOM 3207 O ASP D 6 -3.387 -6.570 9.646 1.00 0.00 O ATOM 3208 CB ASP D 6 -1.067 -8.014 9.315 1.00 0.00 C ATOM 3209 CG ASP D 6 -0.565 -6.855 10.153 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -0.774 -6.877 11.385 1.00 0.00 O ATOM 3211 OD2 ASP D 6 0.036 -5.923 9.578 1.00 0.00 O ATOM 0 H ASP D 6 -2.026 -10.764 9.962 1.00 0.00 H new ATOM 0 HA ASP D 6 -2.178 -8.805 11.004 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -0.271 -8.751 9.205 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -1.312 -7.657 8.315 1.00 0.00 H new ATOM 3216 N TRP D 7 -4.719 -8.374 9.646 1.00 0.00 N ATOM 3217 CA TRP D 7 -5.926 -7.567 9.480 1.00 0.00 C ATOM 3218 C TRP D 7 -6.204 -6.808 10.775 1.00 0.00 C ATOM 3219 O TRP D 7 -6.065 -5.587 10.828 1.00 0.00 O ATOM 3220 CB TRP D 7 -7.131 -8.438 9.113 1.00 0.00 C ATOM 3221 CG TRP D 7 -7.255 -8.722 7.643 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -6.366 -9.398 6.868 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -8.328 -8.340 6.774 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -6.827 -9.486 5.578 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -8.028 -8.838 5.493 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -9.513 -7.633 6.954 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -8.874 -8.651 4.402 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -10.353 -7.445 5.874 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -10.030 -7.954 4.612 1.00 0.00 C ATOM 0 H TRP D 7 -4.877 -9.380 9.700 1.00 0.00 H new ATOM 0 HA TRP D 7 -5.764 -6.862 8.664 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.060 -9.384 9.650 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -8.041 -7.944 9.455 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -5.430 -9.808 7.218 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -6.351 -9.958 4.809 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -9.772 -7.237 7.925 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -8.625 -9.042 3.427 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -11.274 -6.896 6.006 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -10.708 -7.793 3.787 1.00 0.00 H new ATOM 3240 N ASN D 8 -6.563 -7.563 11.822 1.00 0.00 N ATOM 3241 CA ASN D 8 -6.836 -7.021 13.162 1.00 0.00 C ATOM 3242 C ASN D 8 -7.903 -7.852 13.884 1.00 0.00 C ATOM 3243 O ASN D 8 -7.586 -8.871 14.491 1.00 0.00 O ATOM 3244 CB ASN D 8 -7.241 -5.537 13.130 1.00 0.00 C ATOM 3245 CG ASN D 8 -7.631 -5.010 14.499 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -6.823 -5.007 15.428 1.00 0.00 O ATOM 3247 ND2 ASN D 8 -8.875 -4.564 14.630 1.00 0.00 N ATOM 0 H ASN D 8 -6.673 -8.575 11.763 1.00 0.00 H new ATOM 0 HA ASN D 8 -5.901 -7.086 13.719 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -6.412 -4.946 12.740 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -8.077 -5.407 12.443 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -9.194 -4.200 15.528 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -9.511 -4.585 13.833 1.00 0.00 H new ATOM 3254 N LYS D 9 -9.159 -7.403 13.847 1.00 0.00 N ATOM 3255 CA LYS D 9 -10.241 -8.111 14.527 1.00 0.00 C ATOM 3256 C LYS D 9 -11.050 -9.020 13.595 1.00 0.00 C ATOM 3257 O LYS D 9 -11.386 -10.146 13.963 1.00 0.00 O ATOM 3258 CB LYS D 9 -11.176 -7.108 15.205 1.00 0.00 C ATOM 3259 CG LYS D 9 -12.056 -7.727 16.279 1.00 0.00 C ATOM 3260 CD LYS D 9 -13.377 -8.213 15.704 1.00 0.00 C ATOM 3261 CE LYS D 9 -14.532 -7.318 16.124 1.00 0.00 C ATOM 3262 NZ LYS D 9 -14.889 -7.509 17.556 1.00 0.00 N ATOM 0 H LYS D 9 -9.449 -6.557 13.356 1.00 0.00 H new ATOM 0 HA LYS D 9 -9.771 -8.756 15.270 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -10.580 -6.311 15.650 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -11.811 -6.646 14.448 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -11.531 -8.561 16.745 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -12.247 -6.993 17.062 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -13.313 -8.240 14.616 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -13.566 -9.233 16.037 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -14.264 -6.275 15.952 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -15.401 -7.531 15.502 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -15.753 -6.972 17.773 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -15.054 -8.519 17.741 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -14.110 -7.170 18.156 1.00 0.00 H new ATOM 3276 N ILE D 10 -11.402 -8.519 12.412 1.00 0.00 N ATOM 3277 CA ILE D 10 -12.217 -9.290 11.472 1.00 0.00 C ATOM 3278 C ILE D 10 -11.617 -10.665 11.162 1.00 0.00 C ATOM 3279 O ILE D 10 -12.259 -11.689 11.398 1.00 0.00 O ATOM 3280 CB ILE D 10 -12.485 -8.499 10.162 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -13.789 -8.975 9.509 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -11.324 -8.601 9.181 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -13.642 -10.236 8.682 1.00 0.00 C ATOM 0 H ILE D 10 -11.139 -7.590 12.083 1.00 0.00 H new ATOM 0 HA ILE D 10 -13.172 -9.460 11.969 1.00 0.00 H new ATOM 0 HB ILE D 10 -12.585 -7.447 10.431 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -14.531 -9.149 10.289 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -14.176 -8.179 8.873 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -11.557 -8.032 8.281 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -10.422 -8.198 9.641 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -11.161 -9.646 8.918 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -14.608 -10.506 8.255 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -12.926 -10.063 7.879 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -13.286 -11.048 9.316 1.00 0.00 H new ATOM 3295 N LEU D 11 -10.393 -10.696 10.647 1.00 0.00 N ATOM 3296 CA LEU D 11 -9.739 -11.957 10.329 1.00 0.00 C ATOM 3297 C LEU D 11 -8.872 -12.414 11.497 1.00 0.00 C ATOM 3298 O LEU D 11 -8.510 -13.586 11.596 1.00 0.00 O ATOM 3299 CB LEU D 11 -8.901 -11.821 9.054 1.00 0.00 C ATOM 3300 CG LEU D 11 -9.604 -12.274 7.768 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -10.409 -11.132 7.163 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -8.593 -12.802 6.763 1.00 0.00 C ATOM 0 H LEU D 11 -9.837 -9.866 10.442 1.00 0.00 H new ATOM 0 HA LEU D 11 -10.506 -12.711 10.154 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -8.605 -10.778 8.941 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.986 -12.401 9.174 1.00 0.00 H new ATOM 0 HG LEU D 11 -10.291 -13.081 8.022 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -10.899 -11.475 6.252 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -11.162 -10.799 7.877 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -9.743 -10.303 6.926 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -9.111 -13.118 5.858 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -7.880 -12.015 6.517 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -8.062 -13.651 7.193 1.00 0.00 H new ATOM 3314 N SER D 12 -8.549 -11.474 12.380 1.00 0.00 N ATOM 3315 CA SER D 12 -7.731 -11.762 13.548 1.00 0.00 C ATOM 3316 C SER D 12 -6.367 -12.305 13.139 1.00 0.00 C ATOM 3317 O SER D 12 -5.895 -11.950 12.039 1.00 0.00 O ATOM 3318 CB SER D 12 -8.444 -12.761 14.462 1.00 0.00 C ATOM 3319 OG SER D 12 -8.249 -14.091 14.017 1.00 0.00 O ATOM 3320 OXT SER D 12 -5.780 -13.081 13.923 1.00 0.00 O ATOM 0 H SER D 12 -8.845 -10.501 12.306 1.00 0.00 H new ATOM 0 HA SER D 12 -7.578 -10.830 14.092 1.00 0.00 H new ATOM 0 HB2 SER D 12 -8.070 -12.657 15.481 1.00 0.00 H new ATOM 0 HB3 SER D 12 -9.510 -12.536 14.489 1.00 0.00 H new ATOM 0 HG SER D 12 -8.661 -14.205 13.135 1.00 0.00 H new