USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=57 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: A 74 MET CE :methyl -124:sc= -7.68! (180deg=-14!) USER MOD Set 1.2: B 81 THR OG1 : rot 170:sc= -2.58! USER MOD Set 1.3: B 85 HIS : no HE2:sc= -1.29 K(o=-12,f=-14!) USER MOD Set 2.1: A 81 THR OG1 : rot 170:sc= -2.6! USER MOD Set 2.2: A 85 HIS : no HE2:sc= -1.23 K(o=-12,f=-14!) USER MOD Set 2.3: B 74 MET CE :methyl -123:sc= -7.85! (180deg=-14.1!) USER MOD Set 3.1: B 57 MET CE :methyl -124:sc= -2 (180deg=-5.06!) USER MOD Set 3.2: B 68 CYS SG : rot 170:sc= -0.13 USER MOD Set 4.1: A 57 MET CE :methyl -125:sc= -1.99 (180deg=-5.03!) USER MOD Set 4.2: A 68 CYS SG : rot 170:sc= -0.181 USER MOD Single : A 1 SER N :NH3+ 179:sc= -0.0385 (180deg=-0.0429) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 152:sc= -0.235 (180deg=-1.21!) USER MOD Single : A 7 MET CE :methyl -138:sc= -3.16! (180deg=-7.06!) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 17 TYR OH : rot -140:sc= -3.42 USER MOD Single : A 18 SER OG : rot 0:sc= -0.266 USER MOD Single : A 24 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.22) USER MOD Single : A 25 HIS : no HE2:sc= -2.06 K(o=-2.1,f=-3.7) USER MOD Single : A 26 LYS NZ :NH3+ -141:sc= -1.78 (180deg=-4.92!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -116:sc= -3.06 (180deg=-5.14!) USER MOD Single : A 37 ASN : amide:sc= -0.135 X(o=-0.14,f=0) USER MOD Single : A 38 ASN : amide:sc= 0.0538 X(o=0.054,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0736) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 71:sc= -0.542 USER MOD Single : A 62 ASN : amide:sc= -0.0868 K(o=-0.087,f=-0.94) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.026 F(o=-0.58,f=-0.026) USER MOD Single : A 79 MET CE :methyl -164:sc= -0.356 (180deg=-0.476) USER MOD Single : A 82 THR OG1 : rot 35:sc= -1.57 USER MOD Single : A 84 CYS SG : rot 180:sc= -2.33 USER MOD Single : B 1 SER N :NH3+ 177:sc= -0.0434 (180deg=-0.0516) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 149:sc= -0.309 (180deg=-1.12!) USER MOD Single : B 7 MET CE :methyl -134:sc= -3.02! (180deg=-6.98!) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : B 17 TYR OH : rot -148:sc= -3.39 USER MOD Single : B 18 SER OG : rot 0:sc= -0.661 USER MOD Single : B 24 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.257) USER MOD Single : B 25 HIS : no HE2:sc= -2.08 K(o=-2.1,f=-3.7) USER MOD Single : B 26 LYS NZ :NH3+ -137:sc= -1.77! (180deg=-4.9!) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ -119:sc= -2.98 (180deg=-5.1!) USER MOD Single : B 37 ASN : amide:sc= -0.142 X(o=-0.14,f=0) USER MOD Single : B 38 ASN : amide:sc= 0.0555 X(o=0.055,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0848) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 71:sc= -0.615 USER MOD Single : B 62 ASN : amide:sc= -0.042 K(o=-0.042,f=-1) USER MOD Single : B 71 GLN : amide:sc= -0.523 X(o=-0.52,f=-0.047) USER MOD Single : B 79 MET CE :methyl -164:sc= -0.359 (180deg=-0.471) USER MOD Single : B 82 THR OG1 : rot 35:sc= -1.66 USER MOD Single : B 84 CYS SG : rot 180:sc= -2.27 USER MOD Single : C 3 THR OG1 : rot -7:sc= 1.02 USER MOD Single : C 4 LYS NZ :NH3+ -98:sc= -0.935! (180deg=-1.83!) USER MOD Single : C 8 ASN :FLIP amide:sc= 0.73 F(o=-1.2,f=0.73) USER MOD Single : C 9 LYS NZ :NH3+ 140:sc= -1.22 (180deg=-3.63!) USER MOD Single : C 12 SER OG : rot -57:sc= 1.06 USER MOD Single : D 1 THR N :NH3+ 171:sc= -0.128 (180deg=-0.314) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0.0451 USER MOD Single : D 3 THR OG1 : rot -0:sc= 1.03 USER MOD Single : D 4 LYS NZ :NH3+ -96:sc= -0.905! (180deg=-1.78!) USER MOD Single : D 8 ASN :FLIP amide:sc= 0.51 F(o=-1.3,f=0.51) USER MOD Single : D 9 LYS NZ :NH3+ 142:sc= -1.22 (180deg=-3.58!) USER MOD Single : D 12 SER OG : rot -62:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.260 -4.021 -12.377 1.00 0.00 N ATOM 2 CA SER A 1 -9.306 -4.892 -11.643 1.00 0.00 C ATOM 3 C SER A 1 -8.019 -4.143 -11.312 1.00 0.00 C ATOM 4 O SER A 1 -6.922 -4.687 -11.437 1.00 0.00 O ATOM 5 CB SER A 1 -8.998 -6.115 -12.509 1.00 0.00 C ATOM 6 OG SER A 1 -8.849 -7.278 -11.715 1.00 0.00 O ATOM 0 H1 SER A 1 -11.119 -4.561 -12.604 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.511 -3.204 -11.784 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.818 -3.687 -13.257 1.00 0.00 H new ATOM 0 HA SER A 1 -9.757 -5.203 -10.700 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.801 -6.264 -13.231 1.00 0.00 H new ATOM 0 HB3 SER A 1 -8.085 -5.940 -13.079 1.00 0.00 H new ATOM 0 HG SER A 1 -8.654 -8.046 -12.292 1.00 0.00 H new ATOM 14 N GLU A 2 -8.161 -2.890 -10.890 1.00 0.00 N ATOM 15 CA GLU A 2 -7.010 -2.066 -10.544 1.00 0.00 C ATOM 16 C GLU A 2 -6.259 -2.644 -9.350 1.00 0.00 C ATOM 17 O GLU A 2 -5.047 -2.471 -9.223 1.00 0.00 O ATOM 18 CB GLU A 2 -7.455 -0.634 -10.244 1.00 0.00 C ATOM 19 CG GLU A 2 -7.258 0.317 -11.412 1.00 0.00 C ATOM 20 CD GLU A 2 -8.152 1.539 -11.327 1.00 0.00 C ATOM 21 OE1 GLU A 2 -9.315 1.394 -10.894 1.00 0.00 O ATOM 22 OE2 GLU A 2 -7.689 2.639 -11.694 1.00 0.00 O ATOM 0 H GLU A 2 -9.062 -2.424 -10.780 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.333 -2.057 -11.398 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.508 -0.640 -9.964 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.899 -0.261 -9.384 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.216 0.635 -11.445 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.459 -0.212 -12.344 1.00 0.00 H new ATOM 29 N LEU A 3 -6.986 -3.331 -8.480 1.00 0.00 N ATOM 30 CA LEU A 3 -6.388 -3.938 -7.298 1.00 0.00 C ATOM 31 C LEU A 3 -5.357 -4.989 -7.696 1.00 0.00 C ATOM 32 O LEU A 3 -4.223 -4.973 -7.218 1.00 0.00 O ATOM 33 CB LEU A 3 -7.471 -4.567 -6.418 1.00 0.00 C ATOM 34 CG LEU A 3 -7.485 -4.083 -4.967 1.00 0.00 C ATOM 35 CD1 LEU A 3 -6.198 -4.480 -4.260 1.00 0.00 C ATOM 36 CD2 LEU A 3 -7.685 -2.576 -4.910 1.00 0.00 C ATOM 0 H LEU A 3 -7.991 -3.482 -8.570 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.883 -3.157 -6.730 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.445 -4.362 -6.863 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.340 -5.649 -6.423 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.319 -4.559 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -6.226 -4.127 -3.229 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -6.097 -5.565 -4.270 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.347 -4.032 -4.774 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -7.692 -2.249 -3.870 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.872 -2.081 -5.440 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -8.634 -2.317 -5.379 1.00 0.00 H new ATOM 48 N GLU A 4 -5.758 -5.898 -8.579 1.00 0.00 N ATOM 49 CA GLU A 4 -4.867 -6.954 -9.046 1.00 0.00 C ATOM 50 C GLU A 4 -3.643 -6.360 -9.735 1.00 0.00 C ATOM 51 O GLU A 4 -2.512 -6.772 -9.476 1.00 0.00 O ATOM 52 CB GLU A 4 -5.609 -7.886 -10.008 1.00 0.00 C ATOM 53 CG GLU A 4 -5.203 -9.344 -9.878 1.00 0.00 C ATOM 54 CD GLU A 4 -6.179 -10.283 -10.561 1.00 0.00 C ATOM 55 OE1 GLU A 4 -7.165 -10.690 -9.910 1.00 0.00 O ATOM 56 OE2 GLU A 4 -5.958 -10.610 -11.746 1.00 0.00 O ATOM 0 H GLU A 4 -6.693 -5.925 -8.985 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.534 -7.528 -8.182 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.681 -7.799 -9.830 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.428 -7.557 -11.031 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.211 -9.481 -10.308 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.132 -9.605 -8.822 1.00 0.00 H new ATOM 63 N LYS A 5 -3.878 -5.388 -10.611 1.00 0.00 N ATOM 64 CA LYS A 5 -2.795 -4.733 -11.334 1.00 0.00 C ATOM 65 C LYS A 5 -1.847 -4.034 -10.366 1.00 0.00 C ATOM 66 O LYS A 5 -0.645 -4.303 -10.355 1.00 0.00 O ATOM 67 CB LYS A 5 -3.358 -3.721 -12.335 1.00 0.00 C ATOM 68 CG LYS A 5 -3.514 -4.278 -13.741 1.00 0.00 C ATOM 69 CD LYS A 5 -4.952 -4.681 -14.026 1.00 0.00 C ATOM 70 CE LYS A 5 -5.734 -3.541 -14.660 1.00 0.00 C ATOM 71 NZ LYS A 5 -5.090 -3.053 -15.911 1.00 0.00 N ATOM 0 H LYS A 5 -4.809 -5.037 -10.837 1.00 0.00 H new ATOM 0 HA LYS A 5 -2.238 -5.496 -11.877 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.329 -3.374 -11.981 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.701 -2.852 -12.368 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.194 -3.530 -14.467 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.862 -5.142 -13.865 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.964 -5.546 -14.690 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.437 -4.985 -13.098 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.748 -3.875 -14.880 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.817 -2.718 -13.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.815 -2.658 -16.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.394 -2.316 -15.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.610 -3.844 -16.386 1.00 0.00 H new ATOM 85 N ALA A 6 -2.396 -3.137 -9.554 1.00 0.00 N ATOM 86 CA ALA A 6 -1.601 -2.399 -8.580 1.00 0.00 C ATOM 87 C ALA A 6 -0.884 -3.345 -7.625 1.00 0.00 C ATOM 88 O ALA A 6 0.306 -3.188 -7.355 1.00 0.00 O ATOM 89 CB ALA A 6 -2.481 -1.432 -7.805 1.00 0.00 C ATOM 0 H ALA A 6 -3.389 -2.904 -9.551 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.845 -1.831 -9.122 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.874 -0.888 -7.081 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.942 -0.726 -8.496 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.259 -1.988 -7.281 1.00 0.00 H new ATOM 95 N MET A 7 -1.617 -4.330 -7.114 1.00 0.00 N ATOM 96 CA MET A 7 -1.050 -5.302 -6.188 1.00 0.00 C ATOM 97 C MET A 7 0.158 -6.002 -6.804 1.00 0.00 C ATOM 98 O MET A 7 1.226 -6.069 -6.195 1.00 0.00 O ATOM 99 CB MET A 7 -2.104 -6.339 -5.793 1.00 0.00 C ATOM 100 CG MET A 7 -2.997 -5.893 -4.646 1.00 0.00 C ATOM 101 SD MET A 7 -3.995 -7.240 -3.981 1.00 0.00 S ATOM 102 CE MET A 7 -3.881 -6.911 -2.224 1.00 0.00 C ATOM 0 H MET A 7 -2.604 -4.475 -7.326 1.00 0.00 H new ATOM 0 HA MET A 7 -0.723 -4.766 -5.297 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.725 -6.562 -6.660 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.603 -7.266 -5.513 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.379 -5.476 -3.850 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.654 -5.095 -4.991 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.737 -7.848 -1.687 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.036 -6.249 -2.032 1.00 0.00 H new ATOM 0 HE3 MET A 7 -4.800 -6.435 -1.883 1.00 0.00 H new ATOM 112 N VAL A 8 -0.021 -6.523 -8.013 1.00 0.00 N ATOM 113 CA VAL A 8 1.052 -7.221 -8.710 1.00 0.00 C ATOM 114 C VAL A 8 2.100 -6.248 -9.236 1.00 0.00 C ATOM 115 O VAL A 8 3.266 -6.610 -9.396 1.00 0.00 O ATOM 116 CB VAL A 8 0.513 -8.068 -9.879 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.622 -8.919 -10.480 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.650 -8.937 -9.418 1.00 0.00 C ATOM 0 H VAL A 8 -0.899 -6.475 -8.530 1.00 0.00 H new ATOM 0 HA VAL A 8 1.517 -7.884 -7.980 1.00 0.00 H new ATOM 0 HB VAL A 8 0.147 -7.394 -10.653 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.221 -9.510 -11.304 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.417 -8.272 -10.850 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.023 -9.586 -9.717 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.018 -9.528 -10.257 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.314 -9.604 -8.624 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.452 -8.302 -9.043 1.00 0.00 H new ATOM 128 N ALA A 9 1.690 -5.011 -9.491 1.00 0.00 N ATOM 129 CA ALA A 9 2.616 -4.002 -9.980 1.00 0.00 C ATOM 130 C ALA A 9 3.686 -3.741 -8.932 1.00 0.00 C ATOM 131 O ALA A 9 4.865 -3.556 -9.248 1.00 0.00 O ATOM 132 CB ALA A 9 1.871 -2.718 -10.318 1.00 0.00 C ATOM 0 H ALA A 9 0.731 -4.686 -9.368 1.00 0.00 H new ATOM 0 HA ALA A 9 3.094 -4.366 -10.890 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.578 -1.973 -10.683 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.128 -2.921 -11.089 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.374 -2.340 -9.425 1.00 0.00 H new ATOM 138 N LEU A 10 3.260 -3.756 -7.675 1.00 0.00 N ATOM 139 CA LEU A 10 4.164 -3.543 -6.557 1.00 0.00 C ATOM 140 C LEU A 10 5.038 -4.770 -6.350 1.00 0.00 C ATOM 141 O LEU A 10 6.261 -4.669 -6.243 1.00 0.00 O ATOM 142 CB LEU A 10 3.370 -3.249 -5.283 1.00 0.00 C ATOM 143 CG LEU A 10 2.631 -1.909 -5.271 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.286 -2.051 -4.577 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.473 -0.835 -4.590 1.00 0.00 C ATOM 0 H LEU A 10 2.289 -3.914 -7.406 1.00 0.00 H new ATOM 0 HA LEU A 10 4.801 -2.687 -6.782 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.643 -4.048 -5.134 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.053 -3.277 -4.434 1.00 0.00 H new ATOM 0 HG LEU A 10 2.458 -1.604 -6.303 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.773 -1.089 -4.577 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.679 -2.786 -5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.440 -2.380 -3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.929 0.110 -4.592 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.680 -1.132 -3.562 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.413 -0.714 -5.128 1.00 0.00 H new ATOM 157 N ILE A 11 4.398 -5.934 -6.301 1.00 0.00 N ATOM 158 CA ILE A 11 5.099 -7.185 -6.115 1.00 0.00 C ATOM 159 C ILE A 11 6.121 -7.405 -7.223 1.00 0.00 C ATOM 160 O ILE A 11 7.282 -7.704 -6.957 1.00 0.00 O ATOM 161 CB ILE A 11 4.109 -8.362 -6.093 1.00 0.00 C ATOM 162 CG1 ILE A 11 3.026 -8.140 -5.035 1.00 0.00 C ATOM 163 CG2 ILE A 11 4.846 -9.654 -5.827 1.00 0.00 C ATOM 164 CD1 ILE A 11 1.719 -8.833 -5.349 1.00 0.00 C ATOM 0 H ILE A 11 3.386 -6.029 -6.389 1.00 0.00 H new ATOM 0 HA ILE A 11 5.619 -7.134 -5.158 1.00 0.00 H new ATOM 0 HB ILE A 11 3.625 -8.425 -7.068 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.393 -8.495 -4.072 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.844 -7.070 -4.932 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.137 -10.481 -5.813 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.583 -9.821 -6.613 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.351 -9.593 -4.863 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.000 -8.630 -4.555 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.328 -8.461 -6.296 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.885 -9.908 -5.422 1.00 0.00 H new ATOM 176 N ASP A 12 5.678 -7.256 -8.469 1.00 0.00 N ATOM 177 CA ASP A 12 6.551 -7.440 -9.626 1.00 0.00 C ATOM 178 C ASP A 12 7.885 -6.720 -9.443 1.00 0.00 C ATOM 179 O ASP A 12 8.950 -7.314 -9.614 1.00 0.00 O ATOM 180 CB ASP A 12 5.860 -6.936 -10.895 1.00 0.00 C ATOM 181 CG ASP A 12 6.496 -7.487 -12.156 1.00 0.00 C ATOM 182 OD1 ASP A 12 6.071 -8.569 -12.612 1.00 0.00 O ATOM 183 OD2 ASP A 12 7.419 -6.835 -12.688 1.00 0.00 O ATOM 0 H ASP A 12 4.717 -7.008 -8.704 1.00 0.00 H new ATOM 0 HA ASP A 12 6.753 -8.507 -9.721 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.807 -7.218 -10.869 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.898 -5.847 -10.918 1.00 0.00 H new ATOM 188 N VAL A 13 7.825 -5.435 -9.098 1.00 0.00 N ATOM 189 CA VAL A 13 9.034 -4.640 -8.897 1.00 0.00 C ATOM 190 C VAL A 13 10.018 -5.333 -7.953 1.00 0.00 C ATOM 191 O VAL A 13 11.194 -5.499 -8.277 1.00 0.00 O ATOM 192 CB VAL A 13 8.700 -3.246 -8.334 1.00 0.00 C ATOM 193 CG1 VAL A 13 9.937 -2.359 -8.328 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.574 -2.601 -9.131 1.00 0.00 C ATOM 0 H VAL A 13 6.954 -4.924 -8.952 1.00 0.00 H new ATOM 0 HA VAL A 13 9.499 -4.533 -9.877 1.00 0.00 H new ATOM 0 HB VAL A 13 8.362 -3.364 -7.304 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.680 -1.379 -7.927 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.708 -2.814 -7.707 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.310 -2.248 -9.346 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.353 -1.617 -8.718 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.879 -2.497 -10.172 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.683 -3.227 -9.074 1.00 0.00 H new ATOM 204 N PHE A 14 9.527 -5.730 -6.784 1.00 0.00 N ATOM 205 CA PHE A 14 10.356 -6.399 -5.786 1.00 0.00 C ATOM 206 C PHE A 14 10.648 -7.841 -6.200 1.00 0.00 C ATOM 207 O PHE A 14 11.708 -8.385 -5.885 1.00 0.00 O ATOM 208 CB PHE A 14 9.664 -6.332 -4.410 1.00 0.00 C ATOM 209 CG PHE A 14 9.542 -7.648 -3.680 1.00 0.00 C ATOM 210 CD1 PHE A 14 8.757 -8.672 -4.188 1.00 0.00 C ATOM 211 CD2 PHE A 14 10.209 -7.855 -2.481 1.00 0.00 C ATOM 212 CE1 PHE A 14 8.643 -9.875 -3.519 1.00 0.00 C ATOM 213 CE2 PHE A 14 10.098 -9.056 -1.808 1.00 0.00 C ATOM 214 CZ PHE A 14 9.315 -10.068 -2.328 1.00 0.00 C ATOM 0 H PHE A 14 8.555 -5.600 -6.503 1.00 0.00 H new ATOM 0 HA PHE A 14 11.315 -5.886 -5.714 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.216 -5.636 -3.779 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.665 -5.917 -4.545 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.228 -8.527 -5.118 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.822 -7.067 -2.069 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.029 -10.664 -3.927 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.623 -9.204 -0.876 1.00 0.00 H new ATOM 0 HZ PHE A 14 9.228 -11.009 -1.804 1.00 0.00 H new ATOM 224 N HIS A 15 9.706 -8.452 -6.911 1.00 0.00 N ATOM 225 CA HIS A 15 9.867 -9.825 -7.371 1.00 0.00 C ATOM 226 C HIS A 15 11.017 -9.930 -8.368 1.00 0.00 C ATOM 227 O HIS A 15 11.560 -11.013 -8.591 1.00 0.00 O ATOM 228 CB HIS A 15 8.574 -10.334 -8.012 1.00 0.00 C ATOM 229 CG HIS A 15 8.197 -11.717 -7.582 1.00 0.00 C ATOM 230 ND1 HIS A 15 8.594 -12.852 -8.259 1.00 0.00 N ATOM 231 CD2 HIS A 15 7.458 -12.148 -6.533 1.00 0.00 C ATOM 232 CE1 HIS A 15 8.113 -13.919 -7.645 1.00 0.00 C ATOM 233 NE2 HIS A 15 7.421 -13.519 -6.595 1.00 0.00 N ATOM 0 H HIS A 15 8.824 -8.017 -7.181 1.00 0.00 H new ATOM 0 HA HIS A 15 10.098 -10.445 -6.504 1.00 0.00 H new ATOM 0 HB2 HIS A 15 7.762 -9.651 -7.764 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.684 -10.317 -9.096 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.985 -11.528 -5.786 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.261 -14.944 -7.951 1.00 0.00 H new ATOM 0 HE2 HIS A 15 6.937 -14.129 -5.936 1.00 0.00 H new ATOM 242 N GLN A 16 11.394 -8.799 -8.958 1.00 0.00 N ATOM 243 CA GLN A 16 12.483 -8.769 -9.917 1.00 0.00 C ATOM 244 C GLN A 16 13.812 -8.662 -9.190 1.00 0.00 C ATOM 245 O GLN A 16 14.723 -9.459 -9.415 1.00 0.00 O ATOM 246 CB GLN A 16 12.315 -7.593 -10.881 1.00 0.00 C ATOM 247 CG GLN A 16 11.301 -7.850 -11.984 1.00 0.00 C ATOM 248 CD GLN A 16 11.952 -8.275 -13.286 1.00 0.00 C ATOM 249 OE1 GLN A 16 12.977 -9.114 -13.188 1.00 0.00 O flip ATOM 250 NE2 GLN A 16 11.539 -7.855 -14.366 1.00 0.00 N flip ATOM 0 H GLN A 16 10.958 -7.893 -8.786 1.00 0.00 H new ATOM 0 HA GLN A 16 12.466 -9.694 -10.493 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.010 -6.712 -10.316 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.280 -7.363 -11.333 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.605 -8.624 -11.660 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.716 -6.946 -12.153 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.748 -7.211 -14.394 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.987 -8.150 -15.233 1.00 0.00 H new ATOM 259 N TYR A 17 13.916 -7.674 -8.306 1.00 0.00 N ATOM 260 CA TYR A 17 15.138 -7.477 -7.540 1.00 0.00 C ATOM 261 C TYR A 17 15.163 -8.374 -6.311 1.00 0.00 C ATOM 262 O TYR A 17 15.927 -9.337 -6.245 1.00 0.00 O ATOM 263 CB TYR A 17 15.279 -6.020 -7.114 1.00 0.00 C ATOM 264 CG TYR A 17 16.081 -5.185 -8.084 1.00 0.00 C ATOM 265 CD1 TYR A 17 15.504 -4.694 -9.248 1.00 0.00 C ATOM 266 CD2 TYR A 17 17.414 -4.887 -7.836 1.00 0.00 C ATOM 267 CE1 TYR A 17 16.233 -3.928 -10.139 1.00 0.00 C ATOM 268 CE2 TYR A 17 18.151 -4.123 -8.721 1.00 0.00 C ATOM 269 CZ TYR A 17 17.556 -3.647 -9.871 1.00 0.00 C ATOM 270 OH TYR A 17 18.286 -2.886 -10.754 1.00 0.00 O ATOM 0 H TYR A 17 13.174 -7.003 -8.105 1.00 0.00 H new ATOM 0 HA TYR A 17 15.977 -7.742 -8.184 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.286 -5.584 -7.005 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.754 -5.980 -6.134 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.468 -4.914 -9.461 1.00 0.00 H new ATOM 0 HD2 TYR A 17 17.883 -5.258 -6.937 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.769 -3.552 -11.039 1.00 0.00 H new ATOM 0 HE2 TYR A 17 19.187 -3.900 -8.513 1.00 0.00 H new ATOM 0 HH TYR A 17 19.190 -3.255 -10.834 1.00 0.00 H new ATOM 280 N SER A 18 14.324 -8.041 -5.334 1.00 0.00 N ATOM 281 CA SER A 18 14.243 -8.804 -4.095 1.00 0.00 C ATOM 282 C SER A 18 14.195 -10.302 -4.374 1.00 0.00 C ATOM 283 O SER A 18 13.510 -10.750 -5.292 1.00 0.00 O ATOM 284 CB SER A 18 13.011 -8.385 -3.293 1.00 0.00 C ATOM 285 OG SER A 18 13.257 -8.465 -1.900 1.00 0.00 O ATOM 0 H SER A 18 13.689 -7.244 -5.378 1.00 0.00 H new ATOM 0 HA SER A 18 15.139 -8.592 -3.512 1.00 0.00 H new ATOM 0 HB2 SER A 18 12.730 -7.366 -3.558 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.168 -9.025 -3.554 1.00 0.00 H new ATOM 0 HG SER A 18 14.174 -8.774 -1.747 1.00 0.00 H new ATOM 291 N GLY A 19 14.937 -11.064 -3.575 1.00 0.00 N ATOM 292 CA GLY A 19 14.985 -12.509 -3.737 1.00 0.00 C ATOM 293 C GLY A 19 13.642 -13.115 -4.106 1.00 0.00 C ATOM 294 O GLY A 19 12.611 -12.754 -3.538 1.00 0.00 O ATOM 0 H GLY A 19 15.510 -10.704 -2.812 1.00 0.00 H new ATOM 0 HA2 GLY A 19 15.713 -12.757 -4.509 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.338 -12.961 -2.810 1.00 0.00 H new ATOM 355 N LYS A 24 16.221 -15.770 0.181 1.00 0.00 N ATOM 356 CA LYS A 24 16.279 -14.483 -0.503 1.00 0.00 C ATOM 357 C LYS A 24 14.911 -13.807 -0.516 1.00 0.00 C ATOM 358 O LYS A 24 14.079 -14.077 -1.383 1.00 0.00 O ATOM 359 CB LYS A 24 16.792 -14.674 -1.932 1.00 0.00 C ATOM 360 CG LYS A 24 17.693 -13.547 -2.411 1.00 0.00 C ATOM 361 CD LYS A 24 18.014 -13.681 -3.891 1.00 0.00 C ATOM 362 CE LYS A 24 18.349 -12.335 -4.512 1.00 0.00 C ATOM 363 NZ LYS A 24 19.283 -11.546 -3.661 1.00 0.00 N ATOM 0 HA LYS A 24 16.968 -13.836 0.040 1.00 0.00 H new ATOM 0 HB2 LYS A 24 17.339 -15.615 -1.990 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.940 -14.759 -2.607 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.207 -12.589 -2.228 1.00 0.00 H new ATOM 0 HG3 LYS A 24 18.618 -13.550 -1.835 1.00 0.00 H new ATOM 0 HD2 LYS A 24 18.854 -14.363 -4.022 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.163 -14.121 -4.411 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.796 -12.490 -5.494 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.431 -11.768 -4.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.645 -10.735 -4.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.779 -11.203 -2.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.078 -12.149 -3.367 1.00 0.00 H new ATOM 377 N HIS A 25 14.687 -12.926 0.455 1.00 0.00 N ATOM 378 CA HIS A 25 13.424 -12.204 0.565 1.00 0.00 C ATOM 379 C HIS A 25 13.636 -10.854 1.243 1.00 0.00 C ATOM 380 O HIS A 25 13.180 -10.628 2.363 1.00 0.00 O ATOM 381 CB HIS A 25 12.403 -13.031 1.348 1.00 0.00 C ATOM 382 CG HIS A 25 10.983 -12.740 0.970 1.00 0.00 C ATOM 383 ND1 HIS A 25 9.992 -13.699 0.972 1.00 0.00 N ATOM 384 CD2 HIS A 25 10.389 -11.589 0.575 1.00 0.00 C ATOM 385 CE1 HIS A 25 8.851 -13.152 0.595 1.00 0.00 C ATOM 386 NE2 HIS A 25 9.064 -11.872 0.350 1.00 0.00 N ATOM 0 H HIS A 25 15.367 -12.695 1.179 1.00 0.00 H new ATOM 0 HA HIS A 25 13.039 -12.032 -0.440 1.00 0.00 H new ATOM 0 HB2 HIS A 25 12.604 -14.090 1.186 1.00 0.00 H new ATOM 0 HB3 HIS A 25 12.533 -12.841 2.413 1.00 0.00 H new ATOM 0 HD1 HIS A 25 10.121 -14.679 1.225 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.868 -10.628 0.459 1.00 0.00 H new ATOM 0 HE1 HIS A 25 7.905 -13.664 0.503 1.00 0.00 H new ATOM 395 N LYS A 26 14.339 -9.965 0.550 1.00 0.00 N ATOM 396 CA LYS A 26 14.631 -8.634 1.065 1.00 0.00 C ATOM 397 C LYS A 26 15.325 -7.796 -0.007 1.00 0.00 C ATOM 398 O LYS A 26 15.673 -8.310 -1.071 1.00 0.00 O ATOM 399 CB LYS A 26 15.513 -8.730 2.312 1.00 0.00 C ATOM 400 CG LYS A 26 14.929 -8.043 3.539 1.00 0.00 C ATOM 401 CD LYS A 26 14.288 -9.038 4.496 1.00 0.00 C ATOM 402 CE LYS A 26 12.807 -8.751 4.688 1.00 0.00 C ATOM 403 NZ LYS A 26 12.431 -8.671 6.126 1.00 0.00 N ATOM 0 H LYS A 26 14.720 -10.146 -0.379 1.00 0.00 H new ATOM 0 HA LYS A 26 13.693 -8.151 1.337 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.683 -9.781 2.544 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.486 -8.291 2.091 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.716 -7.496 4.058 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.185 -7.310 3.225 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.417 -10.050 4.111 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.796 -8.997 5.460 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.554 -7.812 4.195 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.222 -9.533 4.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.503 -9.120 6.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 13.145 -9.164 6.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.381 -7.674 6.417 1.00 0.00 H new ATOM 417 N LEU A 27 15.539 -6.515 0.274 1.00 0.00 N ATOM 418 CA LEU A 27 16.211 -5.635 -0.681 1.00 0.00 C ATOM 419 C LEU A 27 17.226 -4.754 0.030 1.00 0.00 C ATOM 420 O LEU A 27 16.957 -4.227 1.110 1.00 0.00 O ATOM 421 CB LEU A 27 15.208 -4.777 -1.458 1.00 0.00 C ATOM 422 CG LEU A 27 14.252 -5.559 -2.374 1.00 0.00 C ATOM 423 CD1 LEU A 27 12.836 -5.574 -1.809 1.00 0.00 C ATOM 424 CD2 LEU A 27 14.254 -4.969 -3.777 1.00 0.00 C ATOM 0 H LEU A 27 15.261 -6.064 1.146 1.00 0.00 H new ATOM 0 HA LEU A 27 16.735 -6.265 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 27 14.615 -4.204 -0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.761 -4.059 -2.064 1.00 0.00 H new ATOM 0 HG LEU A 27 14.607 -6.588 -2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.183 -6.134 -2.478 1.00 0.00 H new ATOM 0 HD12 LEU A 27 12.841 -6.047 -0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.470 -4.551 -1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.572 -5.535 -4.411 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.931 -3.929 -3.735 1.00 0.00 H new ATOM 0 HD23 LEU A 27 15.261 -5.020 -4.192 1.00 0.00 H new ATOM 436 N LYS A 28 18.397 -4.612 -0.576 1.00 0.00 N ATOM 437 CA LYS A 28 19.472 -3.812 0.006 1.00 0.00 C ATOM 438 C LYS A 28 19.573 -2.438 -0.642 1.00 0.00 C ATOM 439 O LYS A 28 18.821 -2.110 -1.559 1.00 0.00 O ATOM 440 CB LYS A 28 20.812 -4.542 -0.128 1.00 0.00 C ATOM 441 CG LYS A 28 20.710 -6.055 0.007 1.00 0.00 C ATOM 442 CD LYS A 28 21.957 -6.745 -0.522 1.00 0.00 C ATOM 443 CE LYS A 28 21.755 -7.245 -1.943 1.00 0.00 C ATOM 444 NZ LYS A 28 22.456 -8.537 -2.184 1.00 0.00 N ATOM 0 H LYS A 28 18.629 -5.040 -1.472 1.00 0.00 H new ATOM 0 HA LYS A 28 19.235 -3.671 1.060 1.00 0.00 H new ATOM 0 HB2 LYS A 28 21.249 -4.303 -1.098 1.00 0.00 H new ATOM 0 HB3 LYS A 28 21.497 -4.165 0.632 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.563 -6.319 1.054 1.00 0.00 H new ATOM 0 HG3 LYS A 28 19.836 -6.412 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 28 22.797 -6.051 -0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 28 22.214 -7.582 0.127 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.689 -7.369 -2.136 1.00 0.00 H new ATOM 0 HE3 LYS A 28 22.121 -6.497 -2.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 22.293 -8.843 -3.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 23.476 -8.413 -2.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.089 -9.258 -1.531 1.00 0.00 H new ATOM 458 N LYS A 29 20.518 -1.642 -0.151 1.00 0.00 N ATOM 459 CA LYS A 29 20.742 -0.298 -0.665 1.00 0.00 C ATOM 460 C LYS A 29 20.934 -0.320 -2.177 1.00 0.00 C ATOM 461 O LYS A 29 20.620 0.650 -2.863 1.00 0.00 O ATOM 462 CB LYS A 29 21.968 0.324 0.006 1.00 0.00 C ATOM 463 CG LYS A 29 21.698 0.831 1.414 1.00 0.00 C ATOM 464 CD LYS A 29 22.738 0.320 2.399 1.00 0.00 C ATOM 465 CE LYS A 29 22.370 0.676 3.830 1.00 0.00 C ATOM 466 NZ LYS A 29 23.531 0.544 4.752 1.00 0.00 N ATOM 0 H LYS A 29 21.145 -1.909 0.608 1.00 0.00 H new ATOM 0 HA LYS A 29 19.863 0.305 -0.437 1.00 0.00 H new ATOM 0 HB2 LYS A 29 22.767 -0.416 0.042 1.00 0.00 H new ATOM 0 HB3 LYS A 29 22.327 1.151 -0.607 1.00 0.00 H new ATOM 0 HG2 LYS A 29 21.698 1.921 1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 29 20.706 0.512 1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.830 -0.762 2.304 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.712 0.746 2.156 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.994 1.698 3.864 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.562 0.028 4.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 23.238 0.796 5.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 23.875 -0.438 4.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 24.293 1.181 4.444 1.00 0.00 H new ATOM 480 N SER A 30 21.448 -1.433 -2.689 1.00 0.00 N ATOM 481 CA SER A 30 21.677 -1.578 -4.121 1.00 0.00 C ATOM 482 C SER A 30 20.385 -1.949 -4.841 1.00 0.00 C ATOM 483 O SER A 30 20.118 -1.472 -5.944 1.00 0.00 O ATOM 484 CB SER A 30 22.745 -2.641 -4.381 1.00 0.00 C ATOM 485 OG SER A 30 23.888 -2.424 -3.572 1.00 0.00 O ATOM 0 H SER A 30 21.713 -2.247 -2.134 1.00 0.00 H new ATOM 0 HA SER A 30 22.026 -0.621 -4.509 1.00 0.00 H new ATOM 0 HB2 SER A 30 22.335 -3.630 -4.178 1.00 0.00 H new ATOM 0 HB3 SER A 30 23.031 -2.624 -5.433 1.00 0.00 H new ATOM 0 HG SER A 30 24.555 -3.118 -3.756 1.00 0.00 H new ATOM 491 N GLU A 31 19.583 -2.801 -4.208 1.00 0.00 N ATOM 492 CA GLU A 31 18.318 -3.232 -4.788 1.00 0.00 C ATOM 493 C GLU A 31 17.306 -2.092 -4.798 1.00 0.00 C ATOM 494 O GLU A 31 16.878 -1.640 -5.858 1.00 0.00 O ATOM 495 CB GLU A 31 17.756 -4.424 -4.009 1.00 0.00 C ATOM 496 CG GLU A 31 18.619 -5.670 -4.099 1.00 0.00 C ATOM 497 CD GLU A 31 17.801 -6.935 -4.270 1.00 0.00 C ATOM 498 OE1 GLU A 31 17.525 -7.311 -5.428 1.00 0.00 O ATOM 499 OE2 GLU A 31 17.436 -7.548 -3.245 1.00 0.00 O ATOM 0 H GLU A 31 19.788 -3.205 -3.294 1.00 0.00 H new ATOM 0 HA GLU A 31 18.504 -3.535 -5.818 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.646 -4.143 -2.962 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.759 -4.655 -4.384 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.307 -5.571 -4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.226 -5.753 -3.197 1.00 0.00 H new ATOM 506 N LEU A 32 16.926 -1.631 -3.610 1.00 0.00 N ATOM 507 CA LEU A 32 15.961 -0.542 -3.481 1.00 0.00 C ATOM 508 C LEU A 32 16.343 0.640 -4.369 1.00 0.00 C ATOM 509 O LEU A 32 15.552 1.083 -5.202 1.00 0.00 O ATOM 510 CB LEU A 32 15.866 -0.089 -2.023 1.00 0.00 C ATOM 511 CG LEU A 32 14.622 0.736 -1.681 1.00 0.00 C ATOM 512 CD1 LEU A 32 14.061 0.324 -0.329 1.00 0.00 C ATOM 513 CD2 LEU A 32 14.946 2.222 -1.696 1.00 0.00 C ATOM 0 H LEU A 32 17.271 -1.994 -2.722 1.00 0.00 H new ATOM 0 HA LEU A 32 14.989 -0.914 -3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.886 -0.971 -1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 32 16.751 0.500 -1.783 1.00 0.00 H new ATOM 0 HG LEU A 32 13.863 0.543 -2.439 1.00 0.00 H new ATOM 0 HD11 LEU A 32 13.178 0.922 -0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.788 -0.731 -0.354 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.814 0.486 0.442 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.050 2.792 -1.451 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.723 2.432 -0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.298 2.508 -2.687 1.00 0.00 H new ATOM 525 N LYS A 33 17.561 1.144 -4.185 1.00 0.00 N ATOM 526 CA LYS A 33 18.054 2.277 -4.972 1.00 0.00 C ATOM 527 C LYS A 33 17.748 2.103 -6.459 1.00 0.00 C ATOM 528 O LYS A 33 17.348 3.049 -7.139 1.00 0.00 O ATOM 529 CB LYS A 33 19.566 2.437 -4.786 1.00 0.00 C ATOM 530 CG LYS A 33 19.977 3.220 -3.542 1.00 0.00 C ATOM 531 CD LYS A 33 18.936 3.137 -2.434 1.00 0.00 C ATOM 532 CE LYS A 33 19.413 3.835 -1.170 1.00 0.00 C ATOM 533 NZ LYS A 33 20.464 3.052 -0.464 1.00 0.00 N ATOM 0 H LYS A 33 18.226 0.788 -3.499 1.00 0.00 H new ATOM 0 HA LYS A 33 17.541 3.169 -4.614 1.00 0.00 H new ATOM 0 HB2 LYS A 33 20.019 1.447 -4.742 1.00 0.00 H new ATOM 0 HB3 LYS A 33 19.975 2.936 -5.664 1.00 0.00 H new ATOM 0 HG2 LYS A 33 20.928 2.837 -3.173 1.00 0.00 H new ATOM 0 HG3 LYS A 33 20.136 4.265 -3.810 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.005 3.591 -2.773 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.719 2.092 -2.214 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.804 4.820 -1.425 1.00 0.00 H new ATOM 0 HE3 LYS A 33 18.567 3.992 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.110 2.757 0.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.705 2.210 -1.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.312 3.641 -0.341 1.00 0.00 H new ATOM 547 N GLU A 34 17.951 0.890 -6.961 1.00 0.00 N ATOM 548 CA GLU A 34 17.710 0.601 -8.368 1.00 0.00 C ATOM 549 C GLU A 34 16.268 0.908 -8.763 1.00 0.00 C ATOM 550 O GLU A 34 16.021 1.835 -9.530 1.00 0.00 O ATOM 551 CB GLU A 34 18.044 -0.859 -8.680 1.00 0.00 C ATOM 552 CG GLU A 34 19.485 -1.071 -9.115 1.00 0.00 C ATOM 553 CD GLU A 34 19.768 -0.508 -10.495 1.00 0.00 C ATOM 554 OE1 GLU A 34 19.669 0.725 -10.665 1.00 0.00 O ATOM 555 OE2 GLU A 34 20.089 -1.301 -11.404 1.00 0.00 O ATOM 0 H GLU A 34 18.281 0.094 -6.416 1.00 0.00 H new ATOM 0 HA GLU A 34 18.363 1.247 -8.954 1.00 0.00 H new ATOM 0 HB2 GLU A 34 17.846 -1.466 -7.796 1.00 0.00 H new ATOM 0 HB3 GLU A 34 17.379 -1.216 -9.467 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.152 -0.601 -8.392 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.709 -2.138 -9.109 1.00 0.00 H new ATOM 562 N LEU A 35 15.323 0.121 -8.245 1.00 0.00 N ATOM 563 CA LEU A 35 13.899 0.304 -8.561 1.00 0.00 C ATOM 564 C LEU A 35 13.515 1.770 -8.609 1.00 0.00 C ATOM 565 O LEU A 35 12.655 2.175 -9.391 1.00 0.00 O ATOM 566 CB LEU A 35 13.016 -0.427 -7.547 1.00 0.00 C ATOM 567 CG LEU A 35 13.210 -1.942 -7.493 1.00 0.00 C ATOM 568 CD1 LEU A 35 13.537 -2.488 -8.876 1.00 0.00 C ATOM 569 CD2 LEU A 35 14.305 -2.290 -6.497 1.00 0.00 C ATOM 0 H LEU A 35 15.515 -0.650 -7.605 1.00 0.00 H new ATOM 0 HA LEU A 35 13.737 -0.123 -9.551 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.210 -0.016 -6.556 1.00 0.00 H new ATOM 0 HB3 LEU A 35 11.972 -0.218 -7.780 1.00 0.00 H new ATOM 0 HG LEU A 35 12.281 -2.406 -7.161 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.672 -3.568 -8.818 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.719 -2.260 -9.560 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.455 -2.027 -9.242 1.00 0.00 H new ATOM 0 HD21 LEU A 35 14.437 -3.371 -6.465 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.239 -1.819 -6.804 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.025 -1.929 -5.507 1.00 0.00 H new ATOM 581 N ILE A 36 14.168 2.559 -7.783 1.00 0.00 N ATOM 582 CA ILE A 36 13.908 3.989 -7.745 1.00 0.00 C ATOM 583 C ILE A 36 14.115 4.577 -9.129 1.00 0.00 C ATOM 584 O ILE A 36 13.166 5.000 -9.787 1.00 0.00 O ATOM 585 CB ILE A 36 14.803 4.724 -6.724 1.00 0.00 C ATOM 586 CG1 ILE A 36 14.559 4.157 -5.319 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.538 6.228 -6.767 1.00 0.00 C ATOM 588 CD1 ILE A 36 14.615 5.192 -4.218 1.00 0.00 C ATOM 0 H ILE A 36 14.882 2.239 -7.129 1.00 0.00 H new ATOM 0 HA ILE A 36 12.875 4.128 -7.426 1.00 0.00 H new ATOM 0 HB ILE A 36 15.850 4.565 -6.983 1.00 0.00 H new ATOM 0 HG12 ILE A 36 13.583 3.673 -5.299 1.00 0.00 H new ATOM 0 HG13 ILE A 36 15.302 3.385 -5.116 1.00 0.00 H new ATOM 0 HG21 ILE A 36 15.177 6.731 -6.041 1.00 0.00 H new ATOM 0 HG22 ILE A 36 14.755 6.607 -7.766 1.00 0.00 H new ATOM 0 HG23 ILE A 36 13.493 6.420 -6.525 1.00 0.00 H new ATOM 0 HD11 ILE A 36 14.433 4.711 -3.257 1.00 0.00 H new ATOM 0 HD12 ILE A 36 15.599 5.660 -4.208 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.854 5.952 -4.394 1.00 0.00 H new ATOM 600 N ASN A 37 15.357 4.569 -9.581 1.00 0.00 N ATOM 601 CA ASN A 37 15.675 5.075 -10.906 1.00 0.00 C ATOM 602 C ASN A 37 15.328 4.034 -11.972 1.00 0.00 C ATOM 603 O ASN A 37 15.376 4.322 -13.168 1.00 0.00 O ATOM 604 CB ASN A 37 17.155 5.451 -10.998 1.00 0.00 C ATOM 605 CG ASN A 37 17.558 6.473 -9.952 1.00 0.00 C ATOM 606 OD1 ASN A 37 17.588 7.675 -10.220 1.00 0.00 O ATOM 607 ND2 ASN A 37 17.874 6.000 -8.754 1.00 0.00 N ATOM 0 H ASN A 37 16.158 4.220 -9.054 1.00 0.00 H new ATOM 0 HA ASN A 37 15.078 5.970 -11.083 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.763 4.554 -10.879 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.365 5.849 -11.991 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.156 6.640 -8.011 1.00 0.00 H new ATOM 0 HD22 ASN A 37 17.835 4.996 -8.575 1.00 0.00 H new ATOM 614 N ASN A 38 14.974 2.824 -11.532 1.00 0.00 N ATOM 615 CA ASN A 38 14.619 1.755 -12.454 1.00 0.00 C ATOM 616 C ASN A 38 13.217 1.963 -13.004 1.00 0.00 C ATOM 617 O ASN A 38 12.987 1.790 -14.201 1.00 0.00 O ATOM 618 CB ASN A 38 14.715 0.378 -11.783 1.00 0.00 C ATOM 619 CG ASN A 38 15.081 -0.717 -12.766 1.00 0.00 C ATOM 620 OD1 ASN A 38 16.227 -0.817 -13.203 1.00 0.00 O ATOM 621 ND2 ASN A 38 14.104 -1.544 -13.121 1.00 0.00 N ATOM 0 H ASN A 38 14.927 2.566 -10.546 1.00 0.00 H new ATOM 0 HA ASN A 38 15.334 1.785 -13.277 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.461 0.414 -10.989 1.00 0.00 H new ATOM 0 HB3 ASN A 38 13.761 0.138 -11.314 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.290 -2.299 -13.781 1.00 0.00 H new ATOM 0 HD22 ASN A 38 13.168 -1.424 -12.733 1.00 0.00 H new ATOM 628 N GLU A 39 12.271 2.327 -12.136 1.00 0.00 N ATOM 629 CA GLU A 39 10.903 2.537 -12.599 1.00 0.00 C ATOM 630 C GLU A 39 10.013 3.233 -11.568 1.00 0.00 C ATOM 631 O GLU A 39 8.989 2.687 -11.157 1.00 0.00 O ATOM 632 CB GLU A 39 10.290 1.195 -12.997 1.00 0.00 C ATOM 633 CG GLU A 39 10.039 0.263 -11.823 1.00 0.00 C ATOM 634 CD GLU A 39 10.131 -1.200 -12.210 1.00 0.00 C ATOM 635 OE1 GLU A 39 10.929 -1.527 -13.114 1.00 0.00 O ATOM 636 OE2 GLU A 39 9.404 -2.020 -11.610 1.00 0.00 O ATOM 0 H GLU A 39 12.421 2.478 -11.139 1.00 0.00 H new ATOM 0 HA GLU A 39 10.957 3.204 -13.459 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.347 1.376 -13.513 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.953 0.700 -13.707 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.763 0.473 -11.036 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.051 0.464 -11.409 1.00 0.00 H new ATOM 643 N LEU A 40 10.378 4.450 -11.172 1.00 0.00 N ATOM 644 CA LEU A 40 9.562 5.201 -10.217 1.00 0.00 C ATOM 645 C LEU A 40 8.841 6.351 -10.912 1.00 0.00 C ATOM 646 O LEU A 40 7.644 6.272 -11.187 1.00 0.00 O ATOM 647 CB LEU A 40 10.408 5.747 -9.064 1.00 0.00 C ATOM 648 CG LEU A 40 10.600 4.795 -7.879 1.00 0.00 C ATOM 649 CD1 LEU A 40 11.155 5.549 -6.678 1.00 0.00 C ATOM 650 CD2 LEU A 40 9.293 4.107 -7.516 1.00 0.00 C ATOM 0 H LEU A 40 11.219 4.932 -11.490 1.00 0.00 H new ATOM 0 HA LEU A 40 8.825 4.510 -9.807 1.00 0.00 H new ATOM 0 HB2 LEU A 40 11.390 6.018 -9.453 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.946 6.664 -8.700 1.00 0.00 H new ATOM 0 HG LEU A 40 11.316 4.028 -8.172 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.286 4.859 -5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.117 5.990 -6.938 1.00 0.00 H new ATOM 0 HD13 LEU A 40 10.460 6.338 -6.391 1.00 0.00 H new ATOM 0 HD21 LEU A 40 9.457 3.437 -6.672 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.550 4.857 -7.245 1.00 0.00 H new ATOM 0 HD23 LEU A 40 8.934 3.533 -8.371 1.00 0.00 H new ATOM 779 N LYS A 48 15.363 12.944 -3.879 1.00 0.00 N ATOM 780 CA LYS A 48 15.791 14.305 -4.197 1.00 0.00 C ATOM 781 C LYS A 48 17.305 14.386 -4.377 1.00 0.00 C ATOM 782 O LYS A 48 17.815 15.307 -5.014 1.00 0.00 O ATOM 783 CB LYS A 48 15.347 15.270 -3.096 1.00 0.00 C ATOM 784 CG LYS A 48 13.918 15.044 -2.624 1.00 0.00 C ATOM 785 CD LYS A 48 13.873 14.570 -1.180 1.00 0.00 C ATOM 786 CE LYS A 48 12.891 13.422 -0.999 1.00 0.00 C ATOM 787 NZ LYS A 48 11.513 13.798 -1.422 1.00 0.00 N ATOM 0 HA LYS A 48 15.321 14.589 -5.139 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.021 15.171 -2.245 1.00 0.00 H new ATOM 0 HB3 LYS A 48 15.442 16.293 -3.461 1.00 0.00 H new ATOM 0 HG2 LYS A 48 13.352 15.970 -2.721 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.435 14.306 -3.265 1.00 0.00 H new ATOM 0 HD2 LYS A 48 14.868 14.251 -0.870 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.588 15.399 -0.533 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.227 12.562 -1.579 1.00 0.00 H new ATOM 0 HE3 LYS A 48 12.879 13.116 0.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 10.845 13.057 -1.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 11.247 14.699 -0.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 11.483 13.901 -2.456 1.00 0.00 H new ATOM 801 N GLU A 49 18.019 13.419 -3.811 1.00 0.00 N ATOM 802 CA GLU A 49 19.473 13.384 -3.908 1.00 0.00 C ATOM 803 C GLU A 49 19.999 11.984 -3.614 1.00 0.00 C ATOM 804 O GLU A 49 19.227 11.066 -3.347 1.00 0.00 O ATOM 805 CB GLU A 49 20.091 14.388 -2.934 1.00 0.00 C ATOM 806 CG GLU A 49 21.373 15.027 -3.448 1.00 0.00 C ATOM 807 CD GLU A 49 22.563 14.754 -2.549 1.00 0.00 C ATOM 808 OE1 GLU A 49 23.023 13.593 -2.509 1.00 0.00 O ATOM 809 OE2 GLU A 49 23.036 15.701 -1.885 1.00 0.00 O ATOM 0 H GLU A 49 17.614 12.648 -3.280 1.00 0.00 H new ATOM 0 HA GLU A 49 19.755 13.654 -4.926 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.364 15.172 -2.723 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.299 13.884 -1.990 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.585 14.652 -4.449 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.228 16.104 -3.535 1.00 0.00 H new ATOM 816 N GLN A 50 21.317 11.827 -3.659 1.00 0.00 N ATOM 817 CA GLN A 50 21.936 10.534 -3.391 1.00 0.00 C ATOM 818 C GLN A 50 21.964 10.253 -1.892 1.00 0.00 C ATOM 819 O GLN A 50 21.766 9.118 -1.455 1.00 0.00 O ATOM 820 CB GLN A 50 23.356 10.495 -3.963 1.00 0.00 C ATOM 821 CG GLN A 50 23.583 9.356 -4.944 1.00 0.00 C ATOM 822 CD GLN A 50 24.805 8.525 -4.602 1.00 0.00 C ATOM 823 OE1 GLN A 50 25.931 8.885 -4.944 1.00 0.00 O ATOM 824 NE2 GLN A 50 24.586 7.403 -3.926 1.00 0.00 N ATOM 0 H GLN A 50 21.975 12.575 -3.877 1.00 0.00 H new ATOM 0 HA GLN A 50 21.341 9.761 -3.877 1.00 0.00 H new ATOM 0 HB2 GLN A 50 23.564 11.441 -4.462 1.00 0.00 H new ATOM 0 HB3 GLN A 50 24.068 10.404 -3.142 1.00 0.00 H new ATOM 0 HG2 GLN A 50 22.703 8.713 -4.958 1.00 0.00 H new ATOM 0 HG3 GLN A 50 23.695 9.764 -5.949 1.00 0.00 H new ATOM 0 HE21 GLN A 50 23.635 7.143 -3.663 1.00 0.00 H new ATOM 0 HE22 GLN A 50 25.368 6.801 -3.670 1.00 0.00 H new ATOM 833 N GLU A 51 22.213 11.298 -1.109 1.00 0.00 N ATOM 834 CA GLU A 51 22.272 11.172 0.342 1.00 0.00 C ATOM 835 C GLU A 51 20.915 10.773 0.918 1.00 0.00 C ATOM 836 O GLU A 51 20.837 9.926 1.808 1.00 0.00 O ATOM 837 CB GLU A 51 22.741 12.484 0.977 1.00 0.00 C ATOM 838 CG GLU A 51 22.107 13.726 0.368 1.00 0.00 C ATOM 839 CD GLU A 51 21.426 14.601 1.402 1.00 0.00 C ATOM 840 OE1 GLU A 51 20.591 14.076 2.168 1.00 0.00 O ATOM 841 OE2 GLU A 51 21.729 15.812 1.447 1.00 0.00 O ATOM 0 H GLU A 51 22.377 12.243 -1.456 1.00 0.00 H new ATOM 0 HA GLU A 51 22.990 10.386 0.577 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.518 12.460 2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.824 12.556 0.880 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.874 14.306 -0.145 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.378 13.425 -0.385 1.00 0.00 H new ATOM 848 N VAL A 52 19.849 11.389 0.414 1.00 0.00 N ATOM 849 CA VAL A 52 18.507 11.086 0.896 1.00 0.00 C ATOM 850 C VAL A 52 18.133 9.634 0.613 1.00 0.00 C ATOM 851 O VAL A 52 17.547 8.965 1.462 1.00 0.00 O ATOM 852 CB VAL A 52 17.442 12.024 0.282 1.00 0.00 C ATOM 853 CG1 VAL A 52 17.892 13.475 0.371 1.00 0.00 C ATOM 854 CG2 VAL A 52 17.145 11.642 -1.161 1.00 0.00 C ATOM 0 H VAL A 52 19.888 12.095 -0.321 1.00 0.00 H new ATOM 0 HA VAL A 52 18.523 11.248 1.974 1.00 0.00 H new ATOM 0 HB VAL A 52 16.522 11.912 0.856 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.130 14.120 -0.066 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.041 13.746 1.416 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.828 13.600 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.393 12.317 -1.569 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.058 11.716 -1.752 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.771 10.619 -1.197 1.00 0.00 H new ATOM 864 N VAL A 53 18.472 9.147 -0.582 1.00 0.00 N ATOM 865 CA VAL A 53 18.156 7.768 -0.954 1.00 0.00 C ATOM 866 C VAL A 53 18.624 6.785 0.113 1.00 0.00 C ATOM 867 O VAL A 53 17.824 6.037 0.671 1.00 0.00 O ATOM 868 CB VAL A 53 18.789 7.352 -2.293 1.00 0.00 C ATOM 869 CG1 VAL A 53 18.146 6.068 -2.789 1.00 0.00 C ATOM 870 CG2 VAL A 53 18.671 8.460 -3.328 1.00 0.00 C ATOM 0 H VAL A 53 18.960 9.681 -1.301 1.00 0.00 H new ATOM 0 HA VAL A 53 17.071 7.736 -1.051 1.00 0.00 H new ATOM 0 HB VAL A 53 19.852 7.173 -2.134 1.00 0.00 H new ATOM 0 HG11 VAL A 53 18.598 5.778 -3.738 1.00 0.00 H new ATOM 0 HG12 VAL A 53 18.301 5.277 -2.056 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.077 6.227 -2.930 1.00 0.00 H new ATOM 0 HG21 VAL A 53 19.128 8.135 -4.263 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.619 8.688 -3.498 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.182 9.352 -2.966 1.00 0.00 H new ATOM 880 N ASP A 54 19.927 6.788 0.390 1.00 0.00 N ATOM 881 CA ASP A 54 20.491 5.889 1.392 1.00 0.00 C ATOM 882 C ASP A 54 19.656 5.923 2.665 1.00 0.00 C ATOM 883 O ASP A 54 19.346 4.883 3.246 1.00 0.00 O ATOM 884 CB ASP A 54 21.942 6.266 1.699 1.00 0.00 C ATOM 885 CG ASP A 54 22.857 5.059 1.744 1.00 0.00 C ATOM 886 OD1 ASP A 54 22.372 3.959 2.083 1.00 0.00 O ATOM 887 OD2 ASP A 54 24.059 5.213 1.442 1.00 0.00 O ATOM 0 H ASP A 54 20.607 7.399 -0.063 1.00 0.00 H new ATOM 0 HA ASP A 54 20.476 4.876 0.991 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.301 6.962 0.941 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.984 6.786 2.656 1.00 0.00 H new ATOM 892 N LYS A 55 19.274 7.124 3.077 1.00 0.00 N ATOM 893 CA LYS A 55 18.451 7.290 4.260 1.00 0.00 C ATOM 894 C LYS A 55 17.039 6.801 3.971 1.00 0.00 C ATOM 895 O LYS A 55 16.375 6.243 4.841 1.00 0.00 O ATOM 896 CB LYS A 55 18.427 8.755 4.702 1.00 0.00 C ATOM 897 CG LYS A 55 18.583 8.935 6.204 1.00 0.00 C ATOM 898 CD LYS A 55 18.622 10.405 6.590 1.00 0.00 C ATOM 899 CE LYS A 55 19.913 11.068 6.135 1.00 0.00 C ATOM 900 NZ LYS A 55 19.686 12.464 5.672 1.00 0.00 N ATOM 0 H LYS A 55 19.522 7.995 2.608 1.00 0.00 H new ATOM 0 HA LYS A 55 18.877 6.700 5.071 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.227 9.293 4.194 1.00 0.00 H new ATOM 0 HB3 LYS A 55 17.487 9.207 4.385 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.756 8.445 6.718 1.00 0.00 H new ATOM 0 HG3 LYS A 55 19.499 8.446 6.536 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.771 10.921 6.146 1.00 0.00 H new ATOM 0 HD3 LYS A 55 18.524 10.501 7.671 1.00 0.00 H new ATOM 0 HE2 LYS A 55 20.629 11.070 6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 55 20.356 10.485 5.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.590 12.881 5.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.022 12.461 4.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 19.287 13.027 6.450 1.00 0.00 H new ATOM 914 N VAL A 56 16.592 7.002 2.730 1.00 0.00 N ATOM 915 CA VAL A 56 15.263 6.569 2.318 1.00 0.00 C ATOM 916 C VAL A 56 15.101 5.071 2.542 1.00 0.00 C ATOM 917 O VAL A 56 14.213 4.643 3.278 1.00 0.00 O ATOM 918 CB VAL A 56 14.979 6.908 0.837 1.00 0.00 C ATOM 919 CG1 VAL A 56 13.640 6.330 0.399 1.00 0.00 C ATOM 920 CG2 VAL A 56 15.011 8.415 0.621 1.00 0.00 C ATOM 0 H VAL A 56 17.132 7.461 1.997 1.00 0.00 H new ATOM 0 HA VAL A 56 14.542 7.110 2.931 1.00 0.00 H new ATOM 0 HB VAL A 56 15.760 6.456 0.225 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.460 6.580 -0.646 1.00 0.00 H new ATOM 0 HG12 VAL A 56 13.656 5.246 0.515 1.00 0.00 H new ATOM 0 HG13 VAL A 56 12.844 6.749 1.015 1.00 0.00 H new ATOM 0 HG21 VAL A 56 14.809 8.637 -0.427 1.00 0.00 H new ATOM 0 HG22 VAL A 56 14.253 8.888 1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.994 8.800 0.890 1.00 0.00 H new ATOM 930 N MET A 57 15.973 4.269 1.928 1.00 0.00 N ATOM 931 CA MET A 57 15.904 2.824 2.113 1.00 0.00 C ATOM 932 C MET A 57 16.040 2.498 3.598 1.00 0.00 C ATOM 933 O MET A 57 15.438 1.548 4.100 1.00 0.00 O ATOM 934 CB MET A 57 16.989 2.111 1.284 1.00 0.00 C ATOM 935 CG MET A 57 18.181 1.603 2.090 1.00 0.00 C ATOM 936 SD MET A 57 17.833 0.063 2.968 1.00 0.00 S ATOM 937 CE MET A 57 17.911 -1.132 1.636 1.00 0.00 C ATOM 0 H MET A 57 16.720 4.589 1.311 1.00 0.00 H new ATOM 0 HA MET A 57 14.938 2.463 1.759 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.534 1.268 0.765 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.352 2.798 0.519 1.00 0.00 H new ATOM 0 HG2 MET A 57 19.027 1.450 1.420 1.00 0.00 H new ATOM 0 HG3 MET A 57 18.478 2.366 2.809 1.00 0.00 H new ATOM 0 HE1 MET A 57 16.983 -1.703 1.604 1.00 0.00 H new ATOM 0 HE2 MET A 57 18.050 -0.612 0.688 1.00 0.00 H new ATOM 0 HE3 MET A 57 18.748 -1.810 1.804 1.00 0.00 H new ATOM 947 N GLU A 58 16.831 3.311 4.290 1.00 0.00 N ATOM 948 CA GLU A 58 17.053 3.143 5.720 1.00 0.00 C ATOM 949 C GLU A 58 15.780 3.464 6.498 1.00 0.00 C ATOM 950 O GLU A 58 15.496 2.849 7.526 1.00 0.00 O ATOM 951 CB GLU A 58 18.199 4.048 6.182 1.00 0.00 C ATOM 952 CG GLU A 58 19.416 3.284 6.677 1.00 0.00 C ATOM 953 CD GLU A 58 20.129 3.992 7.812 1.00 0.00 C ATOM 954 OE1 GLU A 58 19.459 4.735 8.561 1.00 0.00 O ATOM 955 OE2 GLU A 58 21.355 3.804 7.953 1.00 0.00 O ATOM 0 H GLU A 58 17.332 4.099 3.879 1.00 0.00 H new ATOM 0 HA GLU A 58 17.323 2.105 5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 58 18.497 4.693 5.356 1.00 0.00 H new ATOM 0 HB3 GLU A 58 17.839 4.698 6.980 1.00 0.00 H new ATOM 0 HG2 GLU A 58 19.107 2.293 7.009 1.00 0.00 H new ATOM 0 HG3 GLU A 58 20.111 3.141 5.850 1.00 0.00 H new ATOM 962 N THR A 59 15.016 4.430 5.994 1.00 0.00 N ATOM 963 CA THR A 59 13.769 4.834 6.634 1.00 0.00 C ATOM 964 C THR A 59 12.717 3.730 6.525 1.00 0.00 C ATOM 965 O THR A 59 11.695 3.765 7.210 1.00 0.00 O ATOM 966 CB THR A 59 13.239 6.125 6.004 1.00 0.00 C ATOM 967 OG1 THR A 59 14.299 7.017 5.717 1.00 0.00 O ATOM 968 CG2 THR A 59 12.257 6.860 6.889 1.00 0.00 C ATOM 0 H THR A 59 15.240 4.947 5.144 1.00 0.00 H new ATOM 0 HA THR A 59 13.974 5.013 7.689 1.00 0.00 H new ATOM 0 HB THR A 59 12.727 5.812 5.094 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.825 6.670 4.966 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.920 7.765 6.385 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.400 6.218 7.094 1.00 0.00 H new ATOM 0 HG23 THR A 59 12.742 7.127 7.828 1.00 0.00 H new ATOM 976 N LEU A 60 12.973 2.754 5.657 1.00 0.00 N ATOM 977 CA LEU A 60 12.049 1.644 5.457 1.00 0.00 C ATOM 978 C LEU A 60 12.287 0.529 6.474 1.00 0.00 C ATOM 979 O LEU A 60 11.454 -0.363 6.631 1.00 0.00 O ATOM 980 CB LEU A 60 12.194 1.090 4.040 1.00 0.00 C ATOM 981 CG LEU A 60 11.229 1.685 3.012 1.00 0.00 C ATOM 982 CD1 LEU A 60 11.986 2.492 1.968 1.00 0.00 C ATOM 983 CD2 LEU A 60 10.415 0.585 2.349 1.00 0.00 C ATOM 0 H LEU A 60 13.814 2.711 5.081 1.00 0.00 H new ATOM 0 HA LEU A 60 11.037 2.023 5.599 1.00 0.00 H new ATOM 0 HB2 LEU A 60 13.215 1.264 3.701 1.00 0.00 H new ATOM 0 HB3 LEU A 60 12.048 0.010 4.071 1.00 0.00 H new ATOM 0 HG LEU A 60 10.545 2.356 3.532 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.281 2.906 1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.525 3.304 2.456 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.695 1.845 1.452 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.734 1.025 1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.086 -0.110 1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 60 9.841 0.051 3.106 1.00 0.00 H new ATOM 995 N ASP A 61 13.427 0.581 7.159 1.00 0.00 N ATOM 996 CA ASP A 61 13.771 -0.430 8.155 1.00 0.00 C ATOM 997 C ASP A 61 12.627 -0.651 9.141 1.00 0.00 C ATOM 998 O ASP A 61 12.521 0.044 10.151 1.00 0.00 O ATOM 999 CB ASP A 61 15.036 -0.017 8.910 1.00 0.00 C ATOM 1000 CG ASP A 61 16.022 -1.160 9.055 1.00 0.00 C ATOM 1001 OD1 ASP A 61 16.833 -1.363 8.128 1.00 0.00 O ATOM 1002 OD2 ASP A 61 15.981 -1.850 10.094 1.00 0.00 O ATOM 0 H ASP A 61 14.128 1.313 7.042 1.00 0.00 H new ATOM 0 HA ASP A 61 13.953 -1.368 7.630 1.00 0.00 H new ATOM 0 HB2 ASP A 61 15.516 0.809 8.385 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.762 0.350 9.899 1.00 0.00 H new ATOM 1007 N ASN A 62 11.773 -1.624 8.839 1.00 0.00 N ATOM 1008 CA ASN A 62 10.638 -1.939 9.700 1.00 0.00 C ATOM 1009 C ASN A 62 10.805 -3.319 10.329 1.00 0.00 C ATOM 1010 O ASN A 62 10.345 -3.562 11.445 1.00 0.00 O ATOM 1011 CB ASN A 62 9.334 -1.879 8.903 1.00 0.00 C ATOM 1012 CG ASN A 62 8.628 -0.544 9.049 1.00 0.00 C ATOM 1013 OD1 ASN A 62 9.248 0.465 9.386 1.00 0.00 O ATOM 1014 ND2 ASN A 62 7.325 -0.532 8.798 1.00 0.00 N ATOM 0 H ASN A 62 11.845 -2.207 8.005 1.00 0.00 H new ATOM 0 HA ASN A 62 10.598 -1.198 10.498 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.546 -2.061 7.850 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.670 -2.676 9.237 1.00 0.00 H new ATOM 0 HD21 ASN A 62 6.798 0.337 8.882 1.00 0.00 H new ATOM 0 HD22 ASN A 62 6.851 -1.392 8.521 1.00 0.00 H new ATOM 1021 N ASP A 63 11.466 -4.218 9.606 1.00 0.00 N ATOM 1022 CA ASP A 63 11.696 -5.574 10.091 1.00 0.00 C ATOM 1023 C ASP A 63 12.504 -6.383 9.080 1.00 0.00 C ATOM 1024 O ASP A 63 12.197 -7.546 8.816 1.00 0.00 O ATOM 1025 CB ASP A 63 10.363 -6.271 10.372 1.00 0.00 C ATOM 1026 CG ASP A 63 10.475 -7.312 11.468 1.00 0.00 C ATOM 1027 OD1 ASP A 63 11.446 -7.248 12.252 1.00 0.00 O ATOM 1028 OD2 ASP A 63 9.591 -8.192 11.544 1.00 0.00 O ATOM 0 H ASP A 63 11.852 -4.031 8.681 1.00 0.00 H new ATOM 0 HA ASP A 63 12.266 -5.510 11.018 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.620 -5.526 10.657 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.005 -6.746 9.459 1.00 0.00 H new ATOM 1033 N GLY A 64 13.539 -5.763 8.517 1.00 0.00 N ATOM 1034 CA GLY A 64 14.370 -6.449 7.546 1.00 0.00 C ATOM 1035 C GLY A 64 15.801 -6.616 8.017 1.00 0.00 C ATOM 1036 O GLY A 64 16.656 -7.083 7.264 1.00 0.00 O ATOM 0 H GLY A 64 13.815 -4.801 8.716 1.00 0.00 H new ATOM 0 HA2 GLY A 64 13.943 -7.430 7.337 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.363 -5.892 6.609 1.00 0.00 H new ATOM 1040 N ASP A 65 16.065 -6.234 9.261 1.00 0.00 N ATOM 1041 CA ASP A 65 17.405 -6.343 9.822 1.00 0.00 C ATOM 1042 C ASP A 65 18.388 -5.490 9.028 1.00 0.00 C ATOM 1043 O ASP A 65 19.588 -5.765 9.002 1.00 0.00 O ATOM 1044 CB ASP A 65 17.862 -7.805 9.828 1.00 0.00 C ATOM 1045 CG ASP A 65 18.004 -8.362 11.230 1.00 0.00 C ATOM 1046 OD1 ASP A 65 19.074 -8.161 11.844 1.00 0.00 O ATOM 1047 OD2 ASP A 65 17.046 -9.000 11.716 1.00 0.00 O ATOM 0 H ASP A 65 15.370 -5.847 9.899 1.00 0.00 H new ATOM 0 HA ASP A 65 17.378 -5.979 10.849 1.00 0.00 H new ATOM 0 HB2 ASP A 65 17.145 -8.409 9.271 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.817 -7.886 9.310 1.00 0.00 H new ATOM 1052 N GLY A 66 17.868 -4.452 8.380 1.00 0.00 N ATOM 1053 CA GLY A 66 18.707 -3.573 7.592 1.00 0.00 C ATOM 1054 C GLY A 66 18.252 -3.477 6.149 1.00 0.00 C ATOM 1055 O GLY A 66 18.380 -2.428 5.519 1.00 0.00 O ATOM 0 H GLY A 66 16.878 -4.205 8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.705 -2.578 8.037 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.735 -3.934 7.622 1.00 0.00 H new ATOM 1059 N GLU A 67 17.716 -4.575 5.625 1.00 0.00 N ATOM 1060 CA GLU A 67 17.237 -4.613 4.258 1.00 0.00 C ATOM 1061 C GLU A 67 15.738 -4.378 4.221 1.00 0.00 C ATOM 1062 O GLU A 67 15.096 -4.229 5.261 1.00 0.00 O ATOM 1063 CB GLU A 67 17.565 -5.962 3.622 1.00 0.00 C ATOM 1064 CG GLU A 67 18.745 -5.908 2.678 1.00 0.00 C ATOM 1065 CD GLU A 67 20.063 -5.723 3.402 1.00 0.00 C ATOM 1066 OE1 GLU A 67 20.449 -4.560 3.645 1.00 0.00 O ATOM 1067 OE2 GLU A 67 20.710 -6.741 3.727 1.00 0.00 O ATOM 0 H GLU A 67 17.605 -5.452 6.134 1.00 0.00 H new ATOM 0 HA GLU A 67 17.734 -3.824 3.693 1.00 0.00 H new ATOM 0 HB2 GLU A 67 17.772 -6.686 4.410 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.691 -6.322 3.079 1.00 0.00 H new ATOM 0 HG2 GLU A 67 18.781 -6.828 2.095 1.00 0.00 H new ATOM 0 HG3 GLU A 67 18.604 -5.089 1.973 1.00 0.00 H new ATOM 1074 N CYS A 68 15.186 -4.345 3.022 1.00 0.00 N ATOM 1075 CA CYS A 68 13.753 -4.127 2.861 1.00 0.00 C ATOM 1076 C CYS A 68 13.154 -5.106 1.861 1.00 0.00 C ATOM 1077 O CYS A 68 13.486 -5.064 0.684 1.00 0.00 O ATOM 1078 CB CYS A 68 13.481 -2.695 2.396 1.00 0.00 C ATOM 1079 SG CYS A 68 14.481 -1.440 3.231 1.00 0.00 S ATOM 0 H CYS A 68 15.700 -4.465 2.149 1.00 0.00 H new ATOM 0 HA CYS A 68 13.284 -4.291 3.831 1.00 0.00 H new ATOM 0 HB2 CYS A 68 13.663 -2.633 1.323 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.427 -2.468 2.555 1.00 0.00 H new ATOM 0 HG CYS A 68 14.337 -0.298 2.627 1.00 0.00 H new ATOM 1085 N ASP A 69 12.262 -5.978 2.321 1.00 0.00 N ATOM 1086 CA ASP A 69 11.631 -6.934 1.420 1.00 0.00 C ATOM 1087 C ASP A 69 10.370 -6.325 0.805 1.00 0.00 C ATOM 1088 O ASP A 69 10.266 -5.104 0.682 1.00 0.00 O ATOM 1089 CB ASP A 69 11.307 -8.246 2.134 1.00 0.00 C ATOM 1090 CG ASP A 69 10.294 -8.078 3.249 1.00 0.00 C ATOM 1091 OD1 ASP A 69 10.479 -7.176 4.091 1.00 0.00 O ATOM 1092 OD2 ASP A 69 9.315 -8.852 3.279 1.00 0.00 O ATOM 0 H ASP A 69 11.964 -6.042 3.294 1.00 0.00 H new ATOM 0 HA ASP A 69 12.336 -7.163 0.621 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.925 -8.964 1.408 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.225 -8.666 2.545 1.00 0.00 H new ATOM 1097 N PHE A 70 9.415 -7.166 0.416 1.00 0.00 N ATOM 1098 CA PHE A 70 8.179 -6.686 -0.186 1.00 0.00 C ATOM 1099 C PHE A 70 7.260 -6.056 0.862 1.00 0.00 C ATOM 1100 O PHE A 70 6.502 -5.136 0.560 1.00 0.00 O ATOM 1101 CB PHE A 70 7.463 -7.842 -0.903 1.00 0.00 C ATOM 1102 CG PHE A 70 5.972 -7.679 -1.013 1.00 0.00 C ATOM 1103 CD1 PHE A 70 5.144 -8.055 0.032 1.00 0.00 C ATOM 1104 CD2 PHE A 70 5.401 -7.157 -2.162 1.00 0.00 C ATOM 1105 CE1 PHE A 70 3.774 -7.912 -0.066 1.00 0.00 C ATOM 1106 CE2 PHE A 70 4.030 -7.012 -2.266 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.216 -7.390 -1.216 1.00 0.00 C ATOM 0 H PHE A 70 9.475 -8.180 0.507 1.00 0.00 H new ATOM 0 HA PHE A 70 8.430 -5.915 -0.914 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.880 -7.945 -1.905 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.676 -8.770 -0.372 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.575 -8.465 0.934 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.034 -6.860 -2.985 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.140 -8.208 0.756 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.596 -6.604 -3.167 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.145 -7.277 -1.294 1.00 0.00 H new ATOM 1117 N GLN A 71 7.324 -6.562 2.087 1.00 0.00 N ATOM 1118 CA GLN A 71 6.481 -6.051 3.167 1.00 0.00 C ATOM 1119 C GLN A 71 6.903 -4.647 3.600 1.00 0.00 C ATOM 1120 O GLN A 71 6.080 -3.859 4.065 1.00 0.00 O ATOM 1121 CB GLN A 71 6.510 -7.005 4.366 1.00 0.00 C ATOM 1122 CG GLN A 71 7.831 -7.014 5.121 1.00 0.00 C ATOM 1123 CD GLN A 71 7.659 -6.756 6.605 1.00 0.00 C ATOM 1124 OE1 GLN A 71 6.951 -5.684 6.942 1.00 0.00 O flip ATOM 1125 NE2 GLN A 71 8.155 -7.513 7.440 1.00 0.00 N flip ATOM 0 H GLN A 71 7.947 -7.322 2.360 1.00 0.00 H new ATOM 0 HA GLN A 71 5.462 -5.988 2.785 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.712 -6.729 5.055 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.296 -8.015 4.018 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.320 -7.978 4.978 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.491 -6.256 4.699 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.692 -8.326 7.137 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.029 -7.328 8.435 1.00 0.00 H new ATOM 1134 N GLU A 72 8.187 -4.339 3.451 1.00 0.00 N ATOM 1135 CA GLU A 72 8.707 -3.032 3.838 1.00 0.00 C ATOM 1136 C GLU A 72 8.342 -1.962 2.813 1.00 0.00 C ATOM 1137 O GLU A 72 7.815 -0.908 3.167 1.00 0.00 O ATOM 1138 CB GLU A 72 10.223 -3.098 4.005 1.00 0.00 C ATOM 1139 CG GLU A 72 10.671 -4.198 4.950 1.00 0.00 C ATOM 1140 CD GLU A 72 10.344 -3.891 6.399 1.00 0.00 C ATOM 1141 OE1 GLU A 72 9.172 -4.061 6.793 1.00 0.00 O ATOM 1142 OE2 GLU A 72 11.263 -3.480 7.138 1.00 0.00 O ATOM 0 H GLU A 72 8.886 -4.975 3.066 1.00 0.00 H new ATOM 0 HA GLU A 72 8.250 -2.759 4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.683 -3.255 3.030 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.584 -2.139 4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.193 -5.135 4.664 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.746 -4.345 4.847 1.00 0.00 H new ATOM 1149 N PHE A 73 8.626 -2.237 1.544 1.00 0.00 N ATOM 1150 CA PHE A 73 8.330 -1.291 0.473 1.00 0.00 C ATOM 1151 C PHE A 73 6.826 -1.073 0.343 1.00 0.00 C ATOM 1152 O PHE A 73 6.371 0.050 0.124 1.00 0.00 O ATOM 1153 CB PHE A 73 8.955 -1.773 -0.850 1.00 0.00 C ATOM 1154 CG PHE A 73 8.035 -2.551 -1.746 1.00 0.00 C ATOM 1155 CD1 PHE A 73 6.949 -1.947 -2.356 1.00 0.00 C ATOM 1156 CD2 PHE A 73 8.269 -3.891 -1.979 1.00 0.00 C ATOM 1157 CE1 PHE A 73 6.111 -2.670 -3.176 1.00 0.00 C ATOM 1158 CE2 PHE A 73 7.435 -4.624 -2.799 1.00 0.00 C ATOM 1159 CZ PHE A 73 6.353 -4.013 -3.399 1.00 0.00 C ATOM 0 H PHE A 73 9.060 -3.106 1.232 1.00 0.00 H new ATOM 0 HA PHE A 73 8.775 -0.327 0.721 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.321 -0.905 -1.398 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.821 -2.393 -0.619 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.757 -0.898 -2.187 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.116 -4.373 -1.513 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.266 -2.188 -3.644 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.629 -5.673 -2.970 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.697 -4.582 -4.041 1.00 0.00 H new ATOM 1169 N MET A 74 6.057 -2.145 0.493 1.00 0.00 N ATOM 1170 CA MET A 74 4.607 -2.049 0.405 1.00 0.00 C ATOM 1171 C MET A 74 4.078 -1.139 1.502 1.00 0.00 C ATOM 1172 O MET A 74 3.123 -0.389 1.301 1.00 0.00 O ATOM 1173 CB MET A 74 3.974 -3.434 0.513 1.00 0.00 C ATOM 1174 CG MET A 74 4.263 -4.315 -0.687 1.00 0.00 C ATOM 1175 SD MET A 74 3.149 -3.992 -2.067 1.00 0.00 S ATOM 1176 CE MET A 74 1.673 -4.841 -1.517 1.00 0.00 C ATOM 0 H MET A 74 6.411 -3.084 0.675 1.00 0.00 H new ATOM 0 HA MET A 74 4.342 -1.624 -0.563 1.00 0.00 H new ATOM 0 HB2 MET A 74 4.341 -3.926 1.414 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.895 -3.326 0.626 1.00 0.00 H new ATOM 0 HG2 MET A 74 5.292 -4.156 -1.010 1.00 0.00 H new ATOM 0 HG3 MET A 74 4.179 -5.361 -0.394 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.370 -5.569 -2.270 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.877 -5.354 -0.577 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.871 -4.118 -1.368 1.00 0.00 H new ATOM 1186 N ALA A 75 4.729 -1.193 2.659 1.00 0.00 N ATOM 1187 CA ALA A 75 4.351 -0.359 3.782 1.00 0.00 C ATOM 1188 C ALA A 75 4.731 1.083 3.495 1.00 0.00 C ATOM 1189 O ALA A 75 4.059 2.011 3.930 1.00 0.00 O ATOM 1190 CB ALA A 75 5.034 -0.844 5.052 1.00 0.00 C ATOM 0 H ALA A 75 5.522 -1.809 2.839 1.00 0.00 H new ATOM 0 HA ALA A 75 3.272 -0.421 3.927 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.741 -0.209 5.888 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.735 -1.872 5.256 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.115 -0.799 4.923 1.00 0.00 H new ATOM 1196 N PHE A 76 5.819 1.250 2.749 1.00 0.00 N ATOM 1197 CA PHE A 76 6.317 2.566 2.380 1.00 0.00 C ATOM 1198 C PHE A 76 5.346 3.291 1.467 1.00 0.00 C ATOM 1199 O PHE A 76 4.702 4.252 1.878 1.00 0.00 O ATOM 1200 CB PHE A 76 7.660 2.428 1.678 1.00 0.00 C ATOM 1201 CG PHE A 76 8.307 3.737 1.343 1.00 0.00 C ATOM 1202 CD1 PHE A 76 9.036 4.430 2.294 1.00 0.00 C ATOM 1203 CD2 PHE A 76 8.186 4.273 0.074 1.00 0.00 C ATOM 1204 CE1 PHE A 76 9.634 5.635 1.985 1.00 0.00 C ATOM 1205 CE2 PHE A 76 8.781 5.477 -0.244 1.00 0.00 C ATOM 1206 CZ PHE A 76 9.506 6.160 0.712 1.00 0.00 C ATOM 0 H PHE A 76 6.377 0.478 2.385 1.00 0.00 H new ATOM 0 HA PHE A 76 6.430 3.150 3.293 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.334 1.853 2.313 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.522 1.857 0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.138 4.023 3.289 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.619 3.743 -0.677 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.200 6.166 2.735 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.680 5.884 -1.239 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.972 7.103 0.466 1.00 0.00 H new ATOM 1216 N VAL A 77 5.240 2.830 0.221 1.00 0.00 N ATOM 1217 CA VAL A 77 4.336 3.455 -0.736 1.00 0.00 C ATOM 1218 C VAL A 77 2.970 3.691 -0.105 1.00 0.00 C ATOM 1219 O VAL A 77 2.258 4.629 -0.464 1.00 0.00 O ATOM 1220 CB VAL A 77 4.164 2.589 -1.998 1.00 0.00 C ATOM 1221 CG1 VAL A 77 3.365 3.337 -3.055 1.00 0.00 C ATOM 1222 CG2 VAL A 77 5.519 2.164 -2.543 1.00 0.00 C ATOM 0 H VAL A 77 5.764 2.035 -0.144 1.00 0.00 H new ATOM 0 HA VAL A 77 4.779 4.409 -1.023 1.00 0.00 H new ATOM 0 HB VAL A 77 3.610 1.690 -1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.254 2.709 -3.939 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.380 3.584 -2.659 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.888 4.254 -3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.377 1.553 -3.434 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.102 3.049 -2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.050 1.585 -1.787 1.00 0.00 H new ATOM 1232 N ALA A 78 2.619 2.830 0.846 1.00 0.00 N ATOM 1233 CA ALA A 78 1.338 2.931 1.538 1.00 0.00 C ATOM 1234 C ALA A 78 1.400 3.891 2.726 1.00 0.00 C ATOM 1235 O ALA A 78 0.452 4.631 2.983 1.00 0.00 O ATOM 1236 CB ALA A 78 0.882 1.556 1.997 1.00 0.00 C ATOM 0 H ALA A 78 3.204 2.054 1.155 1.00 0.00 H new ATOM 0 HA ALA A 78 0.615 3.336 0.830 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.075 1.643 2.512 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.770 0.902 1.132 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.623 1.135 2.677 1.00 0.00 H new ATOM 1242 N MET A 79 2.514 3.870 3.454 1.00 0.00 N ATOM 1243 CA MET A 79 2.678 4.736 4.618 1.00 0.00 C ATOM 1244 C MET A 79 3.022 6.157 4.188 1.00 0.00 C ATOM 1245 O MET A 79 2.503 7.132 4.734 1.00 0.00 O ATOM 1246 CB MET A 79 3.758 4.175 5.562 1.00 0.00 C ATOM 1247 CG MET A 79 5.186 4.333 5.067 1.00 0.00 C ATOM 1248 SD MET A 79 6.390 4.315 6.410 1.00 0.00 S ATOM 1249 CE MET A 79 7.575 3.129 5.784 1.00 0.00 C ATOM 0 H MET A 79 3.313 3.266 3.260 1.00 0.00 H new ATOM 0 HA MET A 79 1.732 4.765 5.159 1.00 0.00 H new ATOM 0 HB2 MET A 79 3.667 4.670 6.529 1.00 0.00 H new ATOM 0 HB3 MET A 79 3.561 3.116 5.727 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.415 3.529 4.367 1.00 0.00 H new ATOM 0 HG3 MET A 79 5.275 5.270 4.517 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.219 2.794 6.597 1.00 0.00 H new ATOM 0 HE2 MET A 79 7.046 2.274 5.363 1.00 0.00 H new ATOM 0 HE3 MET A 79 8.183 3.596 5.009 1.00 0.00 H new ATOM 1259 N VAL A 80 3.897 6.260 3.200 1.00 0.00 N ATOM 1260 CA VAL A 80 4.321 7.546 2.680 1.00 0.00 C ATOM 1261 C VAL A 80 3.151 8.285 2.031 1.00 0.00 C ATOM 1262 O VAL A 80 2.955 9.486 2.251 1.00 0.00 O ATOM 1263 CB VAL A 80 5.465 7.364 1.664 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.962 8.709 1.156 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.605 6.573 2.290 1.00 0.00 C ATOM 0 H VAL A 80 4.330 5.459 2.740 1.00 0.00 H new ATOM 0 HA VAL A 80 4.684 8.146 3.515 1.00 0.00 H new ATOM 0 HB VAL A 80 5.079 6.805 0.811 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.769 8.552 0.441 1.00 0.00 H new ATOM 0 HG12 VAL A 80 5.143 9.239 0.669 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.330 9.301 1.994 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.407 6.452 1.561 1.00 0.00 H new ATOM 0 HG22 VAL A 80 6.984 7.108 3.161 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.242 5.592 2.597 1.00 0.00 H new ATOM 1275 N THR A 81 2.369 7.558 1.242 1.00 0.00 N ATOM 1276 CA THR A 81 1.213 8.134 0.567 1.00 0.00 C ATOM 1277 C THR A 81 0.110 8.486 1.566 1.00 0.00 C ATOM 1278 O THR A 81 -0.537 9.525 1.452 1.00 0.00 O ATOM 1279 CB THR A 81 0.679 7.150 -0.480 1.00 0.00 C ATOM 1280 OG1 THR A 81 -0.249 7.784 -1.342 1.00 0.00 O ATOM 1281 CG2 THR A 81 -0.003 5.940 0.124 1.00 0.00 C ATOM 0 H THR A 81 2.515 6.566 1.054 1.00 0.00 H new ATOM 0 HA THR A 81 1.528 9.053 0.073 1.00 0.00 H new ATOM 0 HB THR A 81 1.558 6.813 -1.029 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.455 7.191 -2.094 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.357 5.286 -0.673 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.705 5.398 0.751 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.849 6.264 0.730 1.00 0.00 H new ATOM 1289 N THR A 82 -0.106 7.606 2.538 1.00 0.00 N ATOM 1290 CA THR A 82 -1.141 7.812 3.548 1.00 0.00 C ATOM 1291 C THR A 82 -0.979 9.148 4.271 1.00 0.00 C ATOM 1292 O THR A 82 -1.967 9.752 4.687 1.00 0.00 O ATOM 1293 CB THR A 82 -1.125 6.673 4.567 1.00 0.00 C ATOM 1294 OG1 THR A 82 0.202 6.264 4.842 1.00 0.00 O ATOM 1295 CG2 THR A 82 -1.897 5.452 4.114 1.00 0.00 C ATOM 0 H THR A 82 0.423 6.741 2.649 1.00 0.00 H new ATOM 0 HA THR A 82 -2.099 7.826 3.027 1.00 0.00 H new ATOM 0 HB THR A 82 -1.606 7.077 5.458 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.797 7.042 4.814 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.845 4.682 4.884 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.939 5.723 3.942 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.464 5.070 3.189 1.00 0.00 H new ATOM 1303 N ALA A 83 0.259 9.604 4.437 1.00 0.00 N ATOM 1304 CA ALA A 83 0.504 10.865 5.132 1.00 0.00 C ATOM 1305 C ALA A 83 0.202 12.076 4.252 1.00 0.00 C ATOM 1306 O ALA A 83 -0.664 12.885 4.586 1.00 0.00 O ATOM 1307 CB ALA A 83 1.934 10.938 5.651 1.00 0.00 C ATOM 0 H ALA A 83 1.098 9.128 4.105 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.180 10.892 5.980 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.087 11.888 6.164 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.111 10.118 6.346 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.629 10.861 4.815 1.00 0.00 H new ATOM 1313 N CYS A 84 0.927 12.223 3.145 1.00 0.00 N ATOM 1314 CA CYS A 84 0.720 13.374 2.265 1.00 0.00 C ATOM 1315 C CYS A 84 -0.375 13.138 1.227 1.00 0.00 C ATOM 1316 O CYS A 84 -1.265 13.972 1.066 1.00 0.00 O ATOM 1317 CB CYS A 84 2.030 13.788 1.584 1.00 0.00 C ATOM 1318 SG CYS A 84 2.568 12.701 0.240 1.00 0.00 S ATOM 0 H CYS A 84 1.651 11.573 2.839 1.00 0.00 H new ATOM 0 HA CYS A 84 0.381 14.191 2.901 1.00 0.00 H new ATOM 0 HB2 CYS A 84 1.914 14.798 1.191 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.817 13.827 2.337 1.00 0.00 H new ATOM 0 HG CYS A 84 3.681 13.149 -0.261 1.00 0.00 H new ATOM 1324 N HIS A 85 -0.320 12.011 0.521 1.00 0.00 N ATOM 1325 CA HIS A 85 -1.328 11.712 -0.494 1.00 0.00 C ATOM 1326 C HIS A 85 -2.734 11.878 0.074 1.00 0.00 C ATOM 1327 O HIS A 85 -3.693 12.092 -0.668 1.00 0.00 O ATOM 1328 CB HIS A 85 -1.142 10.298 -1.041 1.00 0.00 C ATOM 1329 CG HIS A 85 -1.356 10.199 -2.520 1.00 0.00 C ATOM 1330 ND1 HIS A 85 -0.327 10.022 -3.421 1.00 0.00 N ATOM 1331 CD2 HIS A 85 -2.492 10.257 -3.257 1.00 0.00 C ATOM 1332 CE1 HIS A 85 -0.818 9.977 -4.646 1.00 0.00 C ATOM 1333 NE2 HIS A 85 -2.130 10.115 -4.575 1.00 0.00 N ATOM 0 H HIS A 85 0.401 11.298 0.630 1.00 0.00 H new ATOM 0 HA HIS A 85 -1.201 12.420 -1.313 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.135 9.954 -0.803 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -1.836 9.627 -0.535 1.00 0.00 H new ATOM 0 HD1 HIS A 85 0.660 9.939 -3.179 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -3.495 10.390 -2.879 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.244 9.849 -5.552 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.844 11.786 1.397 1.00 0.00 N ATOM 1343 CA GLU A 86 -4.123 11.934 2.080 1.00 0.00 C ATOM 1344 C GLU A 86 -4.889 13.142 1.551 1.00 0.00 C ATOM 1345 O GLU A 86 -5.966 13.003 0.970 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.881 12.085 3.584 1.00 0.00 C ATOM 1347 CG GLU A 86 -5.141 12.354 4.394 1.00 0.00 C ATOM 1348 CD GLU A 86 -4.868 13.177 5.638 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -3.727 13.129 6.143 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -5.796 13.869 6.107 1.00 0.00 O ATOM 0 H GLU A 86 -2.056 11.608 2.020 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.724 11.044 1.892 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.409 11.176 3.958 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.176 12.900 3.747 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.866 12.876 3.769 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.593 11.405 4.682 1.00 0.00 H new ATOM 1357 N PHE A 87 -4.322 14.324 1.751 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.943 15.557 1.291 1.00 0.00 C ATOM 1359 C PHE A 87 -4.086 16.218 0.218 1.00 0.00 C ATOM 1360 O PHE A 87 -4.602 16.881 -0.681 1.00 0.00 O ATOM 1361 CB PHE A 87 -5.162 16.514 2.466 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.612 16.720 2.813 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.521 15.674 2.730 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -7.064 17.964 3.224 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -8.852 15.869 3.051 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -8.394 18.163 3.545 1.00 0.00 C ATOM 1367 CZ PHE A 87 -9.288 17.114 3.459 1.00 0.00 C ATOM 0 H PHE A 87 -3.431 14.454 2.230 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.913 15.315 0.856 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.639 16.128 3.341 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.714 17.478 2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.185 14.698 2.412 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.369 18.788 3.294 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.550 15.048 2.983 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.733 19.138 3.863 1.00 0.00 H new ATOM 0 HZ PHE A 87 -10.327 17.267 3.711 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.773 16.020 0.310 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.850 16.587 -0.664 1.00 0.00 C ATOM 1379 C PHE A 88 -1.944 15.835 -1.987 1.00 0.00 C ATOM 1380 O PHE A 88 -1.658 16.393 -3.048 1.00 0.00 O ATOM 1381 CB PHE A 88 -0.412 16.546 -0.135 1.00 0.00 C ATOM 1382 CG PHE A 88 -0.220 17.323 1.137 1.00 0.00 C ATOM 1383 CD1 PHE A 88 -0.570 16.775 2.361 1.00 0.00 C ATOM 1384 CD2 PHE A 88 0.311 18.603 1.107 1.00 0.00 C ATOM 1385 CE1 PHE A 88 -0.394 17.488 3.531 1.00 0.00 C ATOM 1386 CE2 PHE A 88 0.489 19.321 2.275 1.00 0.00 C ATOM 1387 CZ PHE A 88 0.137 18.763 3.488 1.00 0.00 C ATOM 0 H PHE A 88 -2.328 15.473 1.047 1.00 0.00 H new ATOM 0 HA PHE A 88 -2.128 17.628 -0.831 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.125 15.508 0.035 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.259 16.941 -0.898 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.985 15.779 2.401 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.589 19.044 0.161 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.671 17.049 4.478 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.903 20.318 2.239 1.00 0.00 H new ATOM 0 HZ PHE A 88 0.276 19.322 4.401 1.00 0.00 H new ATOM 1447 N SER B 1 6.999 1.618 -14.938 1.00 0.00 N ATOM 1448 CA SER B 1 6.225 2.622 -14.163 1.00 0.00 C ATOM 1449 C SER B 1 5.066 1.969 -13.416 1.00 0.00 C ATOM 1450 O SER B 1 3.960 2.506 -13.374 1.00 0.00 O ATOM 1451 CB SER B 1 5.699 3.684 -15.130 1.00 0.00 C ATOM 1452 OG SER B 1 5.715 4.970 -14.535 1.00 0.00 O ATOM 0 H1 SER B 1 7.749 2.097 -15.476 1.00 0.00 H new ATOM 0 H2 SER B 1 7.426 0.930 -14.286 1.00 0.00 H new ATOM 0 H3 SER B 1 6.364 1.123 -15.596 1.00 0.00 H new ATOM 0 HA SER B 1 6.877 3.080 -13.420 1.00 0.00 H new ATOM 0 HB2 SER B 1 6.308 3.691 -16.034 1.00 0.00 H new ATOM 0 HB3 SER B 1 4.682 3.433 -15.433 1.00 0.00 H new ATOM 0 HG SER B 1 5.375 5.631 -15.174 1.00 0.00 H new ATOM 1460 N GLU B 2 5.328 0.803 -12.832 1.00 0.00 N ATOM 1461 CA GLU B 2 4.307 0.075 -12.089 1.00 0.00 C ATOM 1462 C GLU B 2 3.845 0.865 -10.871 1.00 0.00 C ATOM 1463 O GLU B 2 2.699 0.742 -10.437 1.00 0.00 O ATOM 1464 CB GLU B 2 4.839 -1.293 -11.659 1.00 0.00 C ATOM 1465 CG GLU B 2 4.394 -2.426 -12.567 1.00 0.00 C ATOM 1466 CD GLU B 2 5.307 -3.634 -12.485 1.00 0.00 C ATOM 1467 OE1 GLU B 2 6.536 -3.442 -12.369 1.00 0.00 O ATOM 1468 OE2 GLU B 2 4.793 -4.772 -12.536 1.00 0.00 O ATOM 0 H GLU B 2 6.238 0.343 -12.860 1.00 0.00 H new ATOM 0 HA GLU B 2 3.449 -0.067 -12.746 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.928 -1.261 -11.638 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.507 -1.501 -10.642 1.00 0.00 H new ATOM 0 HG2 GLU B 2 3.380 -2.723 -12.300 1.00 0.00 H new ATOM 0 HG3 GLU B 2 4.361 -2.070 -13.597 1.00 0.00 H new ATOM 1475 N LEU B 3 4.740 1.676 -10.326 1.00 0.00 N ATOM 1476 CA LEU B 3 4.423 2.489 -9.159 1.00 0.00 C ATOM 1477 C LEU B 3 3.306 3.478 -9.479 1.00 0.00 C ATOM 1478 O LEU B 3 2.316 3.568 -8.754 1.00 0.00 O ATOM 1479 CB LEU B 3 5.669 3.237 -8.678 1.00 0.00 C ATOM 1480 CG LEU B 3 6.032 3.009 -7.210 1.00 0.00 C ATOM 1481 CD1 LEU B 3 4.938 3.548 -6.300 1.00 0.00 C ATOM 1482 CD2 LEU B 3 6.270 1.530 -6.942 1.00 0.00 C ATOM 0 H LEU B 3 5.692 1.789 -10.673 1.00 0.00 H new ATOM 0 HA LEU B 3 4.081 1.827 -8.363 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.515 2.938 -9.297 1.00 0.00 H new ATOM 0 HB3 LEU B 3 5.518 4.305 -8.838 1.00 0.00 H new ATOM 0 HG LEU B 3 6.954 3.549 -6.996 1.00 0.00 H new ATOM 0 HD11 LEU B 3 5.213 3.377 -5.259 1.00 0.00 H new ATOM 0 HD12 LEU B 3 4.816 4.617 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU B 3 4.000 3.036 -6.516 1.00 0.00 H new ATOM 0 HD21 LEU B 3 6.527 1.387 -5.892 1.00 0.00 H new ATOM 0 HD22 LEU B 3 5.365 0.968 -7.174 1.00 0.00 H new ATOM 0 HD23 LEU B 3 7.088 1.174 -7.568 1.00 0.00 H new ATOM 1494 N GLU B 4 3.471 4.212 -10.574 1.00 0.00 N ATOM 1495 CA GLU B 4 2.475 5.191 -10.996 1.00 0.00 C ATOM 1496 C GLU B 4 1.136 4.514 -11.266 1.00 0.00 C ATOM 1497 O GLU B 4 0.089 4.987 -10.825 1.00 0.00 O ATOM 1498 CB GLU B 4 2.953 5.927 -12.250 1.00 0.00 C ATOM 1499 CG GLU B 4 2.559 7.395 -12.280 1.00 0.00 C ATOM 1500 CD GLU B 4 3.329 8.183 -13.322 1.00 0.00 C ATOM 1501 OE1 GLU B 4 4.431 8.675 -13.001 1.00 0.00 O ATOM 1502 OE2 GLU B 4 2.830 8.306 -14.461 1.00 0.00 O ATOM 0 H GLU B 4 4.285 4.148 -11.186 1.00 0.00 H new ATOM 0 HA GLU B 4 2.342 5.913 -10.191 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.038 5.849 -12.316 1.00 0.00 H new ATOM 0 HB3 GLU B 4 2.544 5.431 -13.130 1.00 0.00 H new ATOM 0 HG2 GLU B 4 1.491 7.477 -12.483 1.00 0.00 H new ATOM 0 HG3 GLU B 4 2.731 7.834 -11.297 1.00 0.00 H new ATOM 1509 N LYS B 5 1.179 3.400 -11.992 1.00 0.00 N ATOM 1510 CA LYS B 5 -0.030 2.654 -12.317 1.00 0.00 C ATOM 1511 C LYS B 5 -0.710 2.152 -11.049 1.00 0.00 C ATOM 1512 O LYS B 5 -1.880 2.443 -10.803 1.00 0.00 O ATOM 1513 CB LYS B 5 0.305 1.475 -13.234 1.00 0.00 C ATOM 1514 CG LYS B 5 0.117 1.777 -14.712 1.00 0.00 C ATOM 1515 CD LYS B 5 1.440 2.094 -15.390 1.00 0.00 C ATOM 1516 CE LYS B 5 2.074 0.847 -15.983 1.00 0.00 C ATOM 1517 NZ LYS B 5 1.167 0.165 -16.946 1.00 0.00 N ATOM 0 H LYS B 5 2.038 2.996 -12.365 1.00 0.00 H new ATOM 0 HA LYS B 5 -0.716 3.323 -12.836 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.339 1.175 -13.062 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.322 0.626 -12.963 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.348 0.922 -15.202 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -0.564 2.620 -14.828 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.280 2.831 -16.177 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.122 2.542 -14.668 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.002 1.117 -16.487 1.00 0.00 H new ATOM 0 HE3 LYS B 5 2.336 0.157 -15.181 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 1.732 -0.306 -17.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.595 -0.543 -16.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 0.539 0.866 -17.388 1.00 0.00 H new ATOM 1531 N ALA B 6 0.031 1.396 -10.247 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.498 0.853 -9.002 1.00 0.00 C ATOM 1533 C ALA B 6 -0.991 1.965 -8.082 1.00 0.00 C ATOM 1534 O ALA B 6 -2.083 1.880 -7.519 1.00 0.00 O ATOM 1535 CB ALA B 6 0.561 0.017 -8.299 1.00 0.00 C ATOM 0 H ALA B 6 1.001 1.145 -10.437 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.348 0.215 -9.246 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.152 -0.382 -7.371 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.863 -0.806 -8.946 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.427 0.640 -8.076 1.00 0.00 H new ATOM 1541 N MET B 7 -0.179 3.006 -7.935 1.00 0.00 N ATOM 1542 CA MET B 7 -0.533 4.136 -7.083 1.00 0.00 C ATOM 1543 C MET B 7 -1.864 4.744 -7.511 1.00 0.00 C ATOM 1544 O MET B 7 -2.762 4.937 -6.691 1.00 0.00 O ATOM 1545 CB MET B 7 0.563 5.201 -7.129 1.00 0.00 C ATOM 1546 CG MET B 7 1.708 4.942 -6.164 1.00 0.00 C ATOM 1547 SD MET B 7 2.806 6.362 -5.993 1.00 0.00 S ATOM 1548 CE MET B 7 3.114 6.343 -4.228 1.00 0.00 C ATOM 0 H MET B 7 0.728 3.091 -8.394 1.00 0.00 H new ATOM 0 HA MET B 7 -0.632 3.770 -6.061 1.00 0.00 H new ATOM 0 HB2 MET B 7 0.960 5.258 -8.143 1.00 0.00 H new ATOM 0 HB3 MET B 7 0.123 6.172 -6.904 1.00 0.00 H new ATOM 0 HG2 MET B 7 1.302 4.681 -5.186 1.00 0.00 H new ATOM 0 HG3 MET B 7 2.283 4.083 -6.510 1.00 0.00 H new ATOM 0 HE1 MET B 7 3.011 7.352 -3.830 1.00 0.00 H new ATOM 0 HE2 MET B 7 2.395 5.685 -3.740 1.00 0.00 H new ATOM 0 HE3 MET B 7 4.124 5.980 -4.039 1.00 0.00 H new ATOM 1558 N VAL B 8 -1.984 5.045 -8.800 1.00 0.00 N ATOM 1559 CA VAL B 8 -3.205 5.635 -9.335 1.00 0.00 C ATOM 1560 C VAL B 8 -4.327 4.608 -9.427 1.00 0.00 C ATOM 1561 O VAL B 8 -5.504 4.962 -9.369 1.00 0.00 O ATOM 1562 CB VAL B 8 -2.972 6.256 -10.725 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -4.208 7.015 -11.187 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -1.751 7.169 -10.706 1.00 0.00 C ATOM 0 H VAL B 8 -1.251 4.890 -9.492 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.499 6.422 -8.641 1.00 0.00 H new ATOM 0 HB VAL B 8 -2.783 5.450 -11.435 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -4.023 7.446 -12.171 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -5.055 6.331 -11.244 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -4.432 7.812 -10.478 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.602 7.598 -11.697 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.907 7.970 -9.983 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.870 6.592 -10.425 1.00 0.00 H new ATOM 1574 N ALA B 9 -3.963 3.338 -9.552 1.00 0.00 N ATOM 1575 CA ALA B 9 -4.957 2.278 -9.630 1.00 0.00 C ATOM 1576 C ALA B 9 -5.747 2.225 -8.333 1.00 0.00 C ATOM 1577 O ALA B 9 -6.963 2.013 -8.329 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.287 0.941 -9.907 1.00 0.00 C ATOM 0 H ALA B 9 -2.995 3.020 -9.601 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.641 2.488 -10.452 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -5.044 0.159 -9.962 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.749 0.993 -10.854 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.587 0.712 -9.104 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.039 2.446 -7.233 1.00 0.00 N ATOM 1585 CA LEU B 10 -5.652 2.447 -5.915 1.00 0.00 C ATOM 1586 C LEU B 10 -6.479 3.710 -5.723 1.00 0.00 C ATOM 1587 O LEU B 10 -7.641 3.654 -5.316 1.00 0.00 O ATOM 1588 CB LEU B 10 -4.576 2.360 -4.831 1.00 0.00 C ATOM 1589 CG LEU B 10 -3.828 1.027 -4.761 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.362 1.259 -4.436 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.467 0.104 -3.729 1.00 0.00 C ATOM 0 H LEU B 10 -4.035 2.627 -7.230 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.306 1.579 -5.834 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.851 3.157 -4.996 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.041 2.548 -3.864 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.894 0.544 -5.736 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -1.844 0.301 -4.390 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -1.911 1.879 -5.211 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.278 1.764 -3.474 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.920 -0.838 -3.695 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.435 0.578 -2.748 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.504 -0.088 -4.005 1.00 0.00 H new ATOM 1603 N ILE B 11 -5.868 4.851 -6.025 1.00 0.00 N ATOM 1604 CA ILE B 11 -6.530 6.129 -5.899 1.00 0.00 C ATOM 1605 C ILE B 11 -7.788 6.179 -6.759 1.00 0.00 C ATOM 1606 O ILE B 11 -8.860 6.544 -6.284 1.00 0.00 O ATOM 1607 CB ILE B 11 -5.587 7.272 -6.311 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -4.282 7.212 -5.514 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -6.269 8.606 -6.107 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -3.101 7.815 -6.240 1.00 0.00 C ATOM 0 H ILE B 11 -4.907 4.908 -6.361 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.810 6.253 -4.853 1.00 0.00 H new ATOM 0 HB ILE B 11 -5.345 7.158 -7.368 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.420 7.733 -4.567 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.059 6.172 -5.276 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.593 9.409 -6.402 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -7.172 8.650 -6.716 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.534 8.722 -5.056 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.211 7.737 -5.615 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -2.936 7.279 -7.175 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -3.303 8.864 -6.454 1.00 0.00 H new ATOM 1622 N ASP B 12 -7.646 5.806 -8.028 1.00 0.00 N ATOM 1623 CA ASP B 12 -8.768 5.808 -8.964 1.00 0.00 C ATOM 1624 C ASP B 12 -10.009 5.158 -8.353 1.00 0.00 C ATOM 1625 O ASP B 12 -11.094 5.738 -8.369 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.384 5.080 -10.253 1.00 0.00 C ATOM 1627 CG ASP B 12 -9.308 5.418 -11.406 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -9.024 6.398 -12.127 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -10.317 4.705 -11.588 1.00 0.00 O ATOM 0 H ASP B 12 -6.762 5.497 -8.433 1.00 0.00 H new ATOM 0 HA ASP B 12 -9.006 6.847 -9.191 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.361 5.341 -10.523 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.404 4.004 -10.079 1.00 0.00 H new ATOM 1634 N VAL B 13 -9.843 3.952 -7.817 1.00 0.00 N ATOM 1635 CA VAL B 13 -10.956 3.227 -7.206 1.00 0.00 C ATOM 1636 C VAL B 13 -11.705 4.093 -6.190 1.00 0.00 C ATOM 1637 O VAL B 13 -12.929 4.226 -6.254 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.471 1.945 -6.504 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -11.654 1.099 -6.057 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.550 1.148 -7.420 1.00 0.00 C ATOM 0 H VAL B 13 -8.952 3.456 -7.793 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.634 2.962 -8.017 1.00 0.00 H new ATOM 0 HB VAL B 13 -9.904 2.231 -5.618 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.291 0.198 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.268 1.671 -5.362 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.251 0.821 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.218 0.246 -6.906 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.089 0.872 -8.327 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.684 1.755 -7.683 1.00 0.00 H new ATOM 1650 N PHE B 14 -10.963 4.675 -5.254 1.00 0.00 N ATOM 1651 CA PHE B 14 -11.549 5.522 -4.220 1.00 0.00 C ATOM 1652 C PHE B 14 -11.959 6.877 -4.795 1.00 0.00 C ATOM 1653 O PHE B 14 -12.924 7.490 -4.338 1.00 0.00 O ATOM 1654 CB PHE B 14 -10.552 5.678 -3.054 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.290 7.096 -2.610 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -9.667 8.001 -3.456 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -10.663 7.520 -1.342 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.425 9.299 -3.048 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.421 8.816 -0.931 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.803 9.707 -1.786 1.00 0.00 C ATOM 0 H PHE B 14 -9.950 4.575 -5.190 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.454 5.049 -3.839 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -10.926 5.112 -2.201 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -9.604 5.226 -3.346 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.367 7.688 -4.445 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -11.148 6.828 -0.669 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -8.940 9.994 -3.717 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.715 9.133 0.059 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.616 10.722 -1.467 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.222 7.337 -5.802 1.00 0.00 N ATOM 1671 CA HIS B 15 -11.514 8.614 -6.441 1.00 0.00 C ATOM 1672 C HIS B 15 -12.867 8.570 -7.144 1.00 0.00 C ATOM 1673 O HIS B 15 -13.468 9.609 -7.417 1.00 0.00 O ATOM 1674 CB HIS B 15 -10.416 8.978 -7.444 1.00 0.00 C ATOM 1675 CG HIS B 15 -9.978 10.407 -7.357 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -10.545 11.416 -8.108 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -9.021 10.996 -6.600 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -9.954 12.562 -7.817 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -9.028 12.335 -6.905 1.00 0.00 N ATOM 0 H HIS B 15 -10.419 6.844 -6.192 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.549 9.378 -5.665 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.554 8.331 -7.278 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.776 8.777 -8.453 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -8.373 10.504 -5.889 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -10.189 13.522 -8.252 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -8.416 13.040 -6.493 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.348 7.363 -7.426 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.630 7.191 -8.084 1.00 0.00 C ATOM 1690 C GLN B 16 -15.750 7.239 -7.059 1.00 0.00 C ATOM 1691 O GLN B 16 -16.704 8.003 -7.198 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.667 5.863 -8.843 1.00 0.00 C ATOM 1693 CG GLN B 16 -13.946 5.906 -10.180 1.00 0.00 C ATOM 1694 CD GLN B 16 -14.891 6.116 -11.346 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -15.883 6.980 -11.158 1.00 0.00 O flip ATOM 1696 NE2 GLN B 16 -14.733 5.509 -12.405 1.00 0.00 N flip ATOM 0 H GLN B 16 -12.865 6.491 -7.207 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.768 8.002 -8.799 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -14.219 5.087 -8.223 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.706 5.578 -9.009 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.209 6.709 -10.165 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -13.399 4.974 -10.324 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -13.958 4.854 -12.507 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -15.378 5.661 -13.181 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.624 6.420 -6.019 1.00 0.00 N ATOM 1706 CA TYR B 17 -16.628 6.383 -4.968 1.00 0.00 C ATOM 1707 C TYR B 17 -16.384 7.478 -3.940 1.00 0.00 C ATOM 1708 O TYR B 17 -17.130 8.455 -3.865 1.00 0.00 O ATOM 1709 CB TYR B 17 -16.637 5.024 -4.275 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.627 4.051 -4.872 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -17.327 3.355 -6.037 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -18.858 3.828 -4.273 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -18.230 2.464 -6.588 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -19.766 2.939 -4.816 1.00 0.00 C ATOM 1715 CZ TYR B 17 -19.447 2.260 -5.973 1.00 0.00 C ATOM 1716 OH TYR B 17 -20.347 1.374 -6.519 1.00 0.00 O ATOM 0 H TYR B 17 -14.842 5.779 -5.884 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.598 6.550 -5.435 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -15.638 4.592 -4.327 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.869 5.165 -3.219 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.374 3.512 -6.520 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -19.111 4.358 -3.367 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -17.983 1.931 -7.495 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -20.720 2.777 -4.337 1.00 0.00 H new ATOM 0 HH TYR B 17 -21.260 1.679 -6.335 1.00 0.00 H new ATOM 1726 N SER B 18 -15.334 7.300 -3.142 1.00 0.00 N ATOM 1727 CA SER B 18 -14.981 8.263 -2.106 1.00 0.00 C ATOM 1728 C SER B 18 -15.030 9.689 -2.641 1.00 0.00 C ATOM 1729 O SER B 18 -14.589 9.958 -3.758 1.00 0.00 O ATOM 1730 CB SER B 18 -13.587 7.962 -1.556 1.00 0.00 C ATOM 1731 OG SER B 18 -13.502 8.284 -0.178 1.00 0.00 O ATOM 0 H SER B 18 -14.711 6.494 -3.195 1.00 0.00 H new ATOM 0 HA SER B 18 -15.711 8.173 -1.302 1.00 0.00 H new ATOM 0 HB2 SER B 18 -13.355 6.907 -1.701 1.00 0.00 H new ATOM 0 HB3 SER B 18 -12.842 8.531 -2.112 1.00 0.00 H new ATOM 0 HG SER B 18 -14.364 8.634 0.130 1.00 0.00 H new ATOM 1737 N GLY B 19 -15.579 10.592 -1.834 1.00 0.00 N ATOM 1738 CA GLY B 19 -15.691 11.989 -2.227 1.00 0.00 C ATOM 1739 C GLY B 19 -14.485 12.494 -2.998 1.00 0.00 C ATOM 1740 O GLY B 19 -13.343 12.214 -2.632 1.00 0.00 O ATOM 0 H GLY B 19 -15.951 10.381 -0.908 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -16.584 12.117 -2.839 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.825 12.601 -1.335 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.044 15.899 1.251 1.00 0.00 N ATOM 1802 CA LYS B 24 -16.235 14.515 0.832 1.00 0.00 C ATOM 1803 C LYS B 24 -14.893 13.819 0.615 1.00 0.00 C ATOM 1804 O LYS B 24 -14.293 13.919 -0.455 1.00 0.00 O ATOM 1805 CB LYS B 24 -17.071 14.469 -0.448 1.00 0.00 C ATOM 1806 CG LYS B 24 -18.036 13.295 -0.503 1.00 0.00 C ATOM 1807 CD LYS B 24 -18.697 13.180 -1.868 1.00 0.00 C ATOM 1808 CE LYS B 24 -19.140 11.754 -2.153 1.00 0.00 C ATOM 1809 NZ LYS B 24 -19.833 11.143 -0.985 1.00 0.00 N ATOM 0 HA LYS B 24 -16.765 13.985 1.624 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -17.636 15.397 -0.537 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -16.402 14.419 -1.307 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -17.501 12.372 -0.278 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -18.801 13.415 0.264 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -19.559 13.846 -1.914 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -18.000 13.507 -2.640 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -19.807 11.747 -3.015 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -18.272 11.150 -2.416 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -20.365 10.305 -1.296 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -19.130 10.862 -0.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -20.489 11.835 -0.570 1.00 0.00 H new ATOM 1823 N HIS B 25 -14.432 13.113 1.644 1.00 0.00 N ATOM 1824 CA HIS B 25 -13.164 12.394 1.577 1.00 0.00 C ATOM 1825 C HIS B 25 -13.185 11.185 2.507 1.00 0.00 C ATOM 1826 O HIS B 25 -12.476 11.146 3.512 1.00 0.00 O ATOM 1827 CB HIS B 25 -12.004 13.321 1.945 1.00 0.00 C ATOM 1828 CG HIS B 25 -10.708 12.940 1.302 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -9.763 13.864 0.908 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -10.199 11.725 0.982 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -8.730 13.236 0.375 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.970 11.939 0.407 1.00 0.00 N ATOM 0 H HIS B 25 -14.919 13.024 2.536 1.00 0.00 H new ATOM 0 HA HIS B 25 -13.022 12.045 0.554 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -12.258 14.341 1.655 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -11.878 13.319 3.028 1.00 0.00 H new ATOM 0 HD1 HIS B 25 -9.848 14.875 1.012 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.671 10.768 1.148 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -7.841 13.705 -0.020 1.00 0.00 H new ATOM 1841 N LYS B 26 -14.011 10.205 2.161 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.147 8.988 2.952 1.00 0.00 C ATOM 1843 C LYS B 26 -15.056 7.994 2.231 1.00 0.00 C ATOM 1844 O LYS B 26 -15.654 8.325 1.208 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.715 9.316 4.335 1.00 0.00 C ATOM 1846 CG LYS B 26 -13.846 8.837 5.490 1.00 0.00 C ATOM 1847 CD LYS B 26 -13.020 9.969 6.085 1.00 0.00 C ATOM 1848 CE LYS B 26 -11.529 9.689 5.972 1.00 0.00 C ATOM 1849 NZ LYS B 26 -10.826 9.849 7.274 1.00 0.00 N ATOM 0 H LYS B 26 -14.602 10.231 1.330 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.162 8.538 3.077 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.847 10.395 4.416 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.704 8.866 4.427 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -14.478 8.403 6.264 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.181 8.047 5.141 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.256 10.902 5.573 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -13.288 10.104 7.133 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.379 8.675 5.602 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.089 10.364 5.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -9.931 10.357 7.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.426 10.390 7.928 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.629 8.912 7.680 1.00 0.00 H new ATOM 1863 N LEU B 27 -15.172 6.784 2.771 1.00 0.00 N ATOM 1864 CA LEU B 27 -16.031 5.768 2.165 1.00 0.00 C ATOM 1865 C LEU B 27 -16.834 5.044 3.234 1.00 0.00 C ATOM 1866 O LEU B 27 -16.310 4.705 4.295 1.00 0.00 O ATOM 1867 CB LEU B 27 -15.221 4.769 1.334 1.00 0.00 C ATOM 1868 CG LEU B 27 -14.521 5.362 0.100 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -13.013 5.444 0.308 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -14.840 4.540 -1.141 1.00 0.00 C ATOM 0 H LEU B 27 -14.688 6.484 3.618 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.721 6.276 1.491 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -14.467 4.313 1.976 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -15.886 3.970 1.006 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.898 6.375 -0.044 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -12.546 5.867 -0.581 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -12.798 6.079 1.168 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -12.615 4.445 0.486 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -14.336 4.974 -2.005 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -14.496 3.516 -0.997 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -15.917 4.541 -1.311 1.00 0.00 H new ATOM 1882 N LYS B 28 -18.111 4.823 2.951 1.00 0.00 N ATOM 1883 CA LYS B 28 -19.003 4.159 3.898 1.00 0.00 C ATOM 1884 C LYS B 28 -19.226 2.696 3.537 1.00 0.00 C ATOM 1885 O LYS B 28 -18.703 2.199 2.540 1.00 0.00 O ATOM 1886 CB LYS B 28 -20.353 4.883 3.958 1.00 0.00 C ATOM 1887 CG LYS B 28 -20.252 6.395 3.803 1.00 0.00 C ATOM 1888 CD LYS B 28 -21.602 7.010 3.470 1.00 0.00 C ATOM 1889 CE LYS B 28 -21.748 7.253 1.976 1.00 0.00 C ATOM 1890 NZ LYS B 28 -22.511 8.499 1.689 1.00 0.00 N ATOM 0 H LYS B 28 -18.555 5.093 2.073 1.00 0.00 H new ATOM 0 HA LYS B 28 -18.522 4.198 4.875 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -21.000 4.490 3.174 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -20.833 4.657 4.910 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -19.869 6.832 4.725 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -19.537 6.635 3.016 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -22.399 6.349 3.812 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -21.717 7.952 4.006 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -20.760 7.319 1.521 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -22.254 6.403 1.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -22.589 8.629 0.660 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -23.463 8.426 2.102 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -22.015 9.313 2.104 1.00 0.00 H new ATOM 1904 N LYS B 29 -20.014 2.017 4.366 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.325 0.609 4.156 1.00 0.00 C ATOM 1906 C LYS B 29 -20.865 0.375 2.751 1.00 0.00 C ATOM 1907 O LYS B 29 -20.700 -0.704 2.187 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.347 0.136 5.192 1.00 0.00 C ATOM 1909 CG LYS B 29 -20.745 -0.126 6.564 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.535 0.568 7.662 1.00 0.00 C ATOM 1911 CE LYS B 29 -20.835 0.455 9.007 1.00 0.00 C ATOM 1912 NZ LYS B 29 -21.751 0.768 10.138 1.00 0.00 N ATOM 0 H LYS B 29 -20.450 2.423 5.194 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.405 0.036 4.271 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.131 0.887 5.286 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.821 -0.777 4.832 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -20.723 -1.199 6.754 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -19.712 0.222 6.582 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -21.668 1.619 7.407 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -22.530 0.128 7.730 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -20.441 -0.554 9.128 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -19.983 1.135 9.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -21.236 0.680 11.037 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -22.107 1.740 10.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -22.551 0.104 10.131 1.00 0.00 H new ATOM 1926 N SER B 30 -21.507 1.393 2.190 1.00 0.00 N ATOM 1927 CA SER B 30 -22.067 1.296 0.848 1.00 0.00 C ATOM 1928 C SER B 30 -20.986 1.510 -0.206 1.00 0.00 C ATOM 1929 O SER B 30 -20.975 0.846 -1.243 1.00 0.00 O ATOM 1930 CB SER B 30 -23.188 2.320 0.666 1.00 0.00 C ATOM 1931 OG SER B 30 -24.105 2.269 1.745 1.00 0.00 O ATOM 0 H SER B 30 -21.653 2.295 2.644 1.00 0.00 H new ATOM 0 HA SER B 30 -22.478 0.295 0.722 1.00 0.00 H new ATOM 0 HB2 SER B 30 -22.762 3.321 0.593 1.00 0.00 H new ATOM 0 HB3 SER B 30 -23.712 2.128 -0.270 1.00 0.00 H new ATOM 0 HG SER B 30 -24.811 2.934 1.606 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.077 2.442 0.065 1.00 0.00 N ATOM 1938 CA GLU B 31 -18.993 2.741 -0.860 1.00 0.00 C ATOM 1939 C GLU B 31 -17.987 1.595 -0.910 1.00 0.00 C ATOM 1940 O GLU B 31 -17.809 0.959 -1.947 1.00 0.00 O ATOM 1941 CB GLU B 31 -18.286 4.035 -0.451 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.172 5.267 -0.550 1.00 0.00 C ATOM 1943 CD GLU B 31 -18.441 6.466 -1.122 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -18.450 6.632 -2.359 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -17.859 7.239 -0.332 1.00 0.00 O ATOM 0 H GLU B 31 -20.071 3.002 0.918 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.423 2.868 -1.853 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.928 3.936 0.574 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.409 4.176 -1.083 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.035 5.040 -1.176 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.553 5.517 0.440 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.330 1.338 0.218 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.340 0.267 0.302 1.00 0.00 C ATOM 1954 C LEU B 32 -16.894 -1.042 -0.256 1.00 0.00 C ATOM 1955 O LEU B 32 -16.312 -1.638 -1.161 1.00 0.00 O ATOM 1956 CB LEU B 32 -15.896 0.068 1.753 1.00 0.00 C ATOM 1957 CG LEU B 32 -14.591 -0.711 1.930 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -13.738 -0.085 3.023 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -14.880 -2.171 2.249 1.00 0.00 C ATOM 0 H LEU B 32 -17.465 1.856 1.086 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.480 0.558 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -15.783 1.046 2.220 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -16.688 -0.453 2.291 1.00 0.00 H new ATOM 0 HG LEU B 32 -14.035 -0.667 0.993 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -12.814 -0.653 3.134 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -13.501 0.944 2.755 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -14.287 -0.097 3.965 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -13.940 -2.710 2.372 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -15.458 -2.235 3.171 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -15.449 -2.616 1.433 1.00 0.00 H new ATOM 1971 N LYS B 33 -18.025 -1.482 0.292 1.00 0.00 N ATOM 1972 CA LYS B 33 -18.666 -2.723 -0.151 1.00 0.00 C ATOM 1973 C LYS B 33 -18.719 -2.812 -1.676 1.00 0.00 C ATOM 1974 O LYS B 33 -18.470 -3.870 -2.258 1.00 0.00 O ATOM 1975 CB LYS B 33 -20.090 -2.818 0.408 1.00 0.00 C ATOM 1976 CG LYS B 33 -20.182 -3.367 1.829 1.00 0.00 C ATOM 1977 CD LYS B 33 -18.912 -3.115 2.632 1.00 0.00 C ATOM 1978 CE LYS B 33 -19.066 -3.577 4.072 1.00 0.00 C ATOM 1979 NZ LYS B 33 -19.937 -2.661 4.860 1.00 0.00 N ATOM 0 H LYS B 33 -18.518 -0.999 1.043 1.00 0.00 H new ATOM 0 HA LYS B 33 -18.066 -3.551 0.226 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -20.541 -1.826 0.386 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -20.683 -3.452 -0.251 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -21.028 -2.907 2.339 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -20.377 -4.439 1.790 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -18.076 -3.638 2.168 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.672 -2.052 2.613 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.488 -4.582 4.088 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -18.084 -3.637 4.541 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.393 -2.258 5.650 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -20.278 -1.893 4.247 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.750 -3.191 5.234 1.00 0.00 H new ATOM 1993 N GLU B 34 -19.060 -1.701 -2.316 1.00 0.00 N ATOM 1994 CA GLU B 34 -19.160 -1.662 -3.769 1.00 0.00 C ATOM 1995 C GLU B 34 -17.844 -2.063 -4.432 1.00 0.00 C ATOM 1996 O GLU B 34 -17.765 -3.113 -5.065 1.00 0.00 O ATOM 1997 CB GLU B 34 -19.586 -0.272 -4.241 1.00 0.00 C ATOM 1998 CG GLU B 34 -21.093 -0.107 -4.357 1.00 0.00 C ATOM 1999 CD GLU B 34 -21.680 -0.892 -5.515 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -21.599 -2.139 -5.488 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -22.221 -0.262 -6.446 1.00 0.00 O ATOM 0 H GLU B 34 -19.272 -0.817 -1.853 1.00 0.00 H new ATOM 0 HA GLU B 34 -19.920 -2.385 -4.066 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.199 0.473 -3.546 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.131 -0.071 -5.211 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.563 -0.431 -3.428 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -21.330 0.949 -4.482 1.00 0.00 H new ATOM 2008 N LEU B 35 -16.819 -1.220 -4.292 1.00 0.00 N ATOM 2009 CA LEU B 35 -15.506 -1.482 -4.897 1.00 0.00 C ATOM 2010 C LEU B 35 -15.114 -2.943 -4.780 1.00 0.00 C ATOM 2011 O LEU B 35 -14.454 -3.494 -5.661 1.00 0.00 O ATOM 2012 CB LEU B 35 -14.426 -0.607 -4.258 1.00 0.00 C ATOM 2013 CG LEU B 35 -14.633 0.899 -4.420 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -15.284 1.205 -5.762 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -15.471 1.436 -3.271 1.00 0.00 C ATOM 0 H LEU B 35 -16.870 -0.348 -3.765 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.588 -1.234 -5.955 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.375 -0.839 -3.194 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.461 -0.874 -4.689 1.00 0.00 H new ATOM 0 HG LEU B 35 -13.663 1.395 -4.398 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -15.424 2.281 -5.861 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.643 0.847 -6.567 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -16.251 0.706 -5.819 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -15.613 2.510 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -16.441 0.940 -3.265 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -14.960 1.244 -2.327 1.00 0.00 H new ATOM 2027 N ILE B 36 -15.541 -3.564 -3.701 1.00 0.00 N ATOM 2028 CA ILE B 36 -15.249 -4.972 -3.480 1.00 0.00 C ATOM 2029 C ILE B 36 -15.763 -5.784 -4.655 1.00 0.00 C ATOM 2030 O ILE B 36 -14.986 -6.334 -5.434 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.866 -5.501 -2.168 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -15.311 -4.707 -0.978 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -15.589 -6.995 -2.012 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -15.088 -5.536 0.268 1.00 0.00 C ATOM 0 H ILE B 36 -16.090 -3.122 -2.963 1.00 0.00 H new ATOM 0 HA ILE B 36 -14.167 -5.076 -3.393 1.00 0.00 H new ATOM 0 HB ILE B 36 -16.947 -5.366 -2.200 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -14.366 -4.248 -1.270 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -16.000 -3.896 -0.743 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -16.031 -7.352 -1.082 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -16.025 -7.536 -2.852 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -14.513 -7.165 -1.991 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -14.695 -4.901 1.062 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -16.034 -5.974 0.588 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -14.374 -6.331 0.053 1.00 0.00 H new ATOM 2046 N ASN B 37 -17.076 -5.828 -4.799 1.00 0.00 N ATOM 2047 CA ASN B 37 -17.685 -6.547 -5.906 1.00 0.00 C ATOM 2048 C ASN B 37 -17.618 -5.714 -7.186 1.00 0.00 C ATOM 2049 O ASN B 37 -17.938 -6.201 -8.270 1.00 0.00 O ATOM 2050 CB ASN B 37 -19.137 -6.903 -5.584 1.00 0.00 C ATOM 2051 CG ASN B 37 -19.264 -7.722 -4.313 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -19.331 -8.950 -4.356 1.00 0.00 O ATOM 2053 ND2 ASN B 37 -19.301 -7.043 -3.173 1.00 0.00 N ATOM 0 H ASN B 37 -17.738 -5.377 -4.168 1.00 0.00 H new ATOM 0 HA ASN B 37 -17.128 -7.471 -6.060 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -19.719 -5.987 -5.482 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -19.565 -7.461 -6.417 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.388 -7.540 -2.286 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -19.242 -6.025 -3.184 1.00 0.00 H new ATOM 2060 N ASN B 38 -17.195 -4.453 -7.055 1.00 0.00 N ATOM 2061 CA ASN B 38 -17.088 -3.565 -8.205 1.00 0.00 C ATOM 2062 C ASN B 38 -15.849 -3.893 -9.023 1.00 0.00 C ATOM 2063 O ASN B 38 -15.908 -3.934 -10.251 1.00 0.00 O ATOM 2064 CB ASN B 38 -17.051 -2.092 -7.776 1.00 0.00 C ATOM 2065 CG ASN B 38 -17.659 -1.174 -8.819 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -18.878 -1.127 -8.986 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -16.809 -0.441 -9.529 1.00 0.00 N ATOM 0 H ASN B 38 -16.924 -4.031 -6.167 1.00 0.00 H new ATOM 0 HA ASN B 38 -17.974 -3.721 -8.820 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -17.589 -1.976 -6.835 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.019 -1.795 -7.591 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -17.159 0.193 -10.247 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -15.806 -0.512 -9.356 1.00 0.00 H new ATOM 2074 N GLU B 39 -14.719 -4.123 -8.351 1.00 0.00 N ATOM 2075 CA GLU B 39 -13.494 -4.437 -9.077 1.00 0.00 C ATOM 2076 C GLU B 39 -12.374 -4.965 -8.179 1.00 0.00 C ATOM 2077 O GLU B 39 -11.294 -4.377 -8.119 1.00 0.00 O ATOM 2078 CB GLU B 39 -13.017 -3.197 -9.833 1.00 0.00 C ATOM 2079 CG GLU B 39 -12.517 -2.083 -8.928 1.00 0.00 C ATOM 2080 CD GLU B 39 -12.726 -0.707 -9.527 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -13.721 -0.523 -10.262 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -11.897 0.189 -9.263 1.00 0.00 O ATOM 0 H GLU B 39 -14.629 -4.099 -7.335 1.00 0.00 H new ATOM 0 HA GLU B 39 -13.735 -5.240 -9.773 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -12.218 -3.484 -10.516 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -13.836 -2.817 -10.443 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -13.033 -2.140 -7.969 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.456 -2.231 -8.728 1.00 0.00 H new ATOM 2089 N LEU B 40 -12.612 -6.088 -7.506 1.00 0.00 N ATOM 2090 CA LEU B 40 -11.580 -6.680 -6.654 1.00 0.00 C ATOM 2091 C LEU B 40 -11.018 -7.947 -7.289 1.00 0.00 C ATOM 2092 O LEU B 40 -9.920 -7.941 -7.846 1.00 0.00 O ATOM 2093 CB LEU B 40 -12.120 -7.002 -5.258 1.00 0.00 C ATOM 2094 CG LEU B 40 -12.049 -5.857 -4.243 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -12.292 -6.382 -2.835 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -10.706 -5.145 -4.318 1.00 0.00 C ATOM 0 H LEU B 40 -13.494 -6.600 -7.531 1.00 0.00 H new ATOM 0 HA LEU B 40 -10.783 -5.943 -6.553 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -13.159 -7.316 -5.353 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.565 -7.852 -4.860 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.829 -5.137 -4.489 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -12.238 -5.557 -2.125 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.279 -6.842 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.533 -7.124 -2.587 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -10.682 -4.336 -3.587 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -9.906 -5.853 -4.102 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -10.567 -4.734 -5.318 1.00 0.00 H new ATOM 2225 N LYS B 48 -15.580 -13.098 2.098 1.00 0.00 N ATOM 2226 CA LYS B 48 -16.041 -14.483 2.128 1.00 0.00 C ATOM 2227 C LYS B 48 -17.555 -14.562 2.323 1.00 0.00 C ATOM 2228 O LYS B 48 -18.179 -15.570 1.991 1.00 0.00 O ATOM 2229 CB LYS B 48 -15.334 -15.254 3.244 1.00 0.00 C ATOM 2230 CG LYS B 48 -13.839 -14.981 3.322 1.00 0.00 C ATOM 2231 CD LYS B 48 -13.466 -14.266 4.613 1.00 0.00 C ATOM 2232 CE LYS B 48 -12.495 -13.126 4.359 1.00 0.00 C ATOM 2233 NZ LYS B 48 -11.246 -13.597 3.696 1.00 0.00 N ATOM 0 HA LYS B 48 -15.797 -14.935 1.166 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -15.792 -14.996 4.199 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -15.492 -16.322 3.093 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -13.293 -15.922 3.256 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -13.534 -14.375 2.469 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -14.367 -13.878 5.089 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.020 -14.977 5.308 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.975 -12.372 3.735 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.245 -12.645 5.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -10.544 -12.830 3.693 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -10.864 -14.413 4.215 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.457 -13.877 2.717 1.00 0.00 H new ATOM 2247 N GLU B 49 -18.136 -13.498 2.865 1.00 0.00 N ATOM 2248 CA GLU B 49 -19.573 -13.450 3.108 1.00 0.00 C ATOM 2249 C GLU B 49 -20.044 -12.010 3.272 1.00 0.00 C ATOM 2250 O GLU B 49 -19.250 -11.076 3.188 1.00 0.00 O ATOM 2251 CB GLU B 49 -19.926 -14.258 4.357 1.00 0.00 C ATOM 2252 CG GLU B 49 -21.279 -14.948 4.274 1.00 0.00 C ATOM 2253 CD GLU B 49 -22.232 -14.500 5.365 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -22.692 -13.341 5.312 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -22.516 -15.310 6.274 1.00 0.00 O ATOM 0 H GLU B 49 -17.633 -12.656 3.145 1.00 0.00 H new ATOM 0 HA GLU B 49 -20.079 -13.886 2.247 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -19.154 -15.009 4.524 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -19.918 -13.595 5.222 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -21.726 -14.746 3.301 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -21.137 -16.027 4.342 1.00 0.00 H new ATOM 2262 N GLN B 50 -21.338 -11.834 3.509 1.00 0.00 N ATOM 2263 CA GLN B 50 -21.904 -10.503 3.688 1.00 0.00 C ATOM 2264 C GLN B 50 -21.587 -9.968 5.082 1.00 0.00 C ATOM 2265 O GLN B 50 -21.314 -8.779 5.258 1.00 0.00 O ATOM 2266 CB GLN B 50 -23.419 -10.533 3.466 1.00 0.00 C ATOM 2267 CG GLN B 50 -23.891 -9.575 2.384 1.00 0.00 C ATOM 2268 CD GLN B 50 -25.016 -8.671 2.854 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -26.183 -9.062 2.853 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -24.667 -7.455 3.258 1.00 0.00 N ATOM 0 H GLN B 50 -22.014 -12.594 3.582 1.00 0.00 H new ATOM 0 HA GLN B 50 -21.455 -9.838 2.951 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -23.719 -11.546 3.200 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -23.921 -10.287 4.402 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -23.051 -8.963 2.055 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -24.227 -10.147 1.519 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -23.687 -7.174 3.241 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -25.379 -6.802 3.585 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.624 -10.857 6.068 1.00 0.00 N ATOM 2280 CA GLU B 51 -21.344 -10.483 7.448 1.00 0.00 C ATOM 2281 C GLU B 51 -19.899 -10.019 7.614 1.00 0.00 C ATOM 2282 O GLU B 51 -19.631 -9.033 8.301 1.00 0.00 O ATOM 2283 CB GLU B 51 -21.626 -11.656 8.392 1.00 0.00 C ATOM 2284 CG GLU B 51 -21.126 -12.997 7.874 1.00 0.00 C ATOM 2285 CD GLU B 51 -20.205 -13.697 8.855 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -19.225 -13.064 9.303 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -20.465 -14.875 9.176 1.00 0.00 O ATOM 0 H GLU B 51 -21.846 -11.844 5.936 1.00 0.00 H new ATOM 0 HA GLU B 51 -22.003 -9.653 7.705 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -21.161 -11.454 9.357 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -22.700 -11.721 8.564 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.979 -13.641 7.661 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -20.599 -12.844 6.932 1.00 0.00 H new ATOM 2294 N VAL B 52 -18.967 -10.734 6.988 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.557 -10.382 7.084 1.00 0.00 C ATOM 2296 C VAL B 52 -17.288 -9.008 6.476 1.00 0.00 C ATOM 2297 O VAL B 52 -16.535 -8.215 7.037 1.00 0.00 O ATOM 2298 CB VAL B 52 -16.646 -11.434 6.408 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -17.033 -12.837 6.848 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -16.703 -11.311 4.892 1.00 0.00 C ATOM 0 H VAL B 52 -19.163 -11.554 6.414 1.00 0.00 H new ATOM 0 HA VAL B 52 -17.317 -10.357 8.147 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.620 -11.245 6.722 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -16.381 -13.563 6.362 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.928 -12.921 7.930 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -18.068 -13.034 6.568 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -16.054 -12.062 4.441 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -17.727 -11.466 4.553 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -16.369 -10.317 4.595 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.907 -8.726 5.327 1.00 0.00 N ATOM 2311 CA VAL B 53 -17.716 -7.438 4.661 1.00 0.00 C ATOM 2312 C VAL B 53 -17.941 -6.279 5.622 1.00 0.00 C ATOM 2313 O VAL B 53 -17.047 -5.462 5.841 1.00 0.00 O ATOM 2314 CB VAL B 53 -18.652 -7.247 3.457 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -18.168 -6.080 2.610 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -18.757 -8.517 2.629 1.00 0.00 C ATOM 0 H VAL B 53 -18.538 -9.365 4.844 1.00 0.00 H new ATOM 0 HA VAL B 53 -16.685 -7.444 4.309 1.00 0.00 H new ATOM 0 HB VAL B 53 -19.652 -7.022 3.828 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -18.834 -5.948 1.758 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -18.164 -5.171 3.211 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -17.158 -6.283 2.253 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -19.426 -8.347 1.786 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -17.770 -8.793 2.259 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -19.150 -9.323 3.248 1.00 0.00 H new ATOM 2326 N ASP B 54 -19.142 -6.205 6.192 1.00 0.00 N ATOM 2327 CA ASP B 54 -19.474 -5.135 7.129 1.00 0.00 C ATOM 2328 C ASP B 54 -18.364 -4.969 8.157 1.00 0.00 C ATOM 2329 O ASP B 54 -17.947 -3.851 8.463 1.00 0.00 O ATOM 2330 CB ASP B 54 -20.805 -5.425 7.827 1.00 0.00 C ATOM 2331 CG ASP B 54 -21.708 -4.209 7.877 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -21.180 -3.078 7.899 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -22.944 -4.388 7.894 1.00 0.00 O ATOM 0 H ASP B 54 -19.897 -6.869 6.023 1.00 0.00 H new ATOM 0 HA ASP B 54 -19.574 -4.205 6.569 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -21.317 -6.233 7.305 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -20.612 -5.773 8.842 1.00 0.00 H new ATOM 2338 N LYS B 55 -17.873 -6.090 8.669 1.00 0.00 N ATOM 2339 CA LYS B 55 -16.793 -6.066 9.637 1.00 0.00 C ATOM 2340 C LYS B 55 -15.497 -5.664 8.947 1.00 0.00 C ATOM 2341 O LYS B 55 -14.661 -4.978 9.529 1.00 0.00 O ATOM 2342 CB LYS B 55 -16.636 -7.434 10.308 1.00 0.00 C ATOM 2343 CG LYS B 55 -16.432 -7.351 11.812 1.00 0.00 C ATOM 2344 CD LYS B 55 -16.352 -8.731 12.443 1.00 0.00 C ATOM 2345 CE LYS B 55 -17.699 -9.434 12.424 1.00 0.00 C ATOM 2346 NZ LYS B 55 -17.559 -10.895 12.166 1.00 0.00 N ATOM 0 H LYS B 55 -18.207 -7.023 8.429 1.00 0.00 H new ATOM 0 HA LYS B 55 -17.030 -5.335 10.410 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -17.522 -8.035 10.102 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -15.788 -7.953 9.862 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -15.517 -6.799 12.026 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -17.253 -6.792 12.261 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -15.619 -9.334 11.908 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -16.002 -8.642 13.471 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -18.202 -9.280 13.379 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -18.330 -8.988 11.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -18.500 -11.338 12.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -17.102 -11.042 11.244 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -16.978 -11.325 12.913 1.00 0.00 H new ATOM 2360 N VAL B 56 -15.349 -6.084 7.690 1.00 0.00 N ATOM 2361 CA VAL B 56 -14.162 -5.756 6.911 1.00 0.00 C ATOM 2362 C VAL B 56 -13.982 -4.246 6.831 1.00 0.00 C ATOM 2363 O VAL B 56 -12.955 -3.716 7.254 1.00 0.00 O ATOM 2364 CB VAL B 56 -14.226 -6.349 5.486 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -13.038 -5.884 4.653 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -14.278 -7.872 5.545 1.00 0.00 C ATOM 0 H VAL B 56 -16.037 -6.651 7.193 1.00 0.00 H new ATOM 0 HA VAL B 56 -13.307 -6.199 7.421 1.00 0.00 H new ATOM 0 HB VAL B 56 -15.137 -5.991 5.006 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -13.104 -6.314 3.654 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -13.047 -4.796 4.582 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -12.112 -6.209 5.127 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -14.323 -8.274 4.533 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -13.385 -8.247 6.045 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -15.163 -8.185 6.099 1.00 0.00 H new ATOM 2376 N MET B 57 -14.991 -3.543 6.308 1.00 0.00 N ATOM 2377 CA MET B 57 -14.909 -2.089 6.221 1.00 0.00 C ATOM 2378 C MET B 57 -14.701 -1.510 7.617 1.00 0.00 C ATOM 2379 O MET B 57 -14.017 -0.501 7.793 1.00 0.00 O ATOM 2380 CB MET B 57 -16.172 -1.507 5.559 1.00 0.00 C ATOM 2381 CG MET B 57 -17.151 -0.844 6.522 1.00 0.00 C ATOM 2382 SD MET B 57 -16.638 0.817 7.016 1.00 0.00 S ATOM 2383 CE MET B 57 -17.050 1.767 5.554 1.00 0.00 C ATOM 0 H MET B 57 -15.854 -3.949 5.947 1.00 0.00 H new ATOM 0 HA MET B 57 -14.060 -1.814 5.595 1.00 0.00 H new ATOM 0 HB2 MET B 57 -15.868 -0.775 4.811 1.00 0.00 H new ATOM 0 HB3 MET B 57 -16.690 -2.307 5.030 1.00 0.00 H new ATOM 0 HG2 MET B 57 -18.134 -0.791 6.053 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.255 -1.466 7.411 1.00 0.00 H new ATOM 0 HE1 MET B 57 -16.162 2.290 5.198 1.00 0.00 H new ATOM 0 HE2 MET B 57 -17.413 1.097 4.775 1.00 0.00 H new ATOM 0 HE3 MET B 57 -17.825 2.493 5.798 1.00 0.00 H new ATOM 2393 N GLU B 58 -15.291 -2.176 8.605 1.00 0.00 N ATOM 2394 CA GLU B 58 -15.176 -1.760 9.996 1.00 0.00 C ATOM 2395 C GLU B 58 -13.750 -1.970 10.497 1.00 0.00 C ATOM 2396 O GLU B 58 -13.244 -1.193 11.308 1.00 0.00 O ATOM 2397 CB GLU B 58 -16.163 -2.548 10.862 1.00 0.00 C ATOM 2398 CG GLU B 58 -17.247 -1.685 11.487 1.00 0.00 C ATOM 2399 CD GLU B 58 -17.658 -2.173 12.863 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -16.818 -2.791 13.550 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -18.822 -1.938 13.252 1.00 0.00 O ATOM 0 H GLU B 58 -15.858 -3.012 8.464 1.00 0.00 H new ATOM 0 HA GLU B 58 -15.415 -0.699 10.065 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -16.632 -3.321 10.253 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -15.613 -3.056 11.654 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -16.891 -0.657 11.561 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -18.119 -1.674 10.834 1.00 0.00 H new ATOM 2408 N THR B 59 -13.105 -3.024 10.003 1.00 0.00 N ATOM 2409 CA THR B 59 -11.735 -3.337 10.393 1.00 0.00 C ATOM 2410 C THR B 59 -10.760 -2.292 9.852 1.00 0.00 C ATOM 2411 O THR B 59 -9.605 -2.229 10.275 1.00 0.00 O ATOM 2412 CB THR B 59 -11.340 -4.729 9.888 1.00 0.00 C ATOM 2413 OG1 THR B 59 -12.421 -5.634 10.014 1.00 0.00 O ATOM 2414 CG2 THR B 59 -10.165 -5.321 10.631 1.00 0.00 C ATOM 0 H THR B 59 -13.511 -3.676 9.331 1.00 0.00 H new ATOM 0 HA THR B 59 -11.685 -3.326 11.482 1.00 0.00 H new ATOM 0 HB THR B 59 -11.060 -4.588 8.844 1.00 0.00 H new ATOM 0 HG1 THR B 59 -13.114 -5.409 9.359 1.00 0.00 H new ATOM 0 HG21 THR B 59 -9.937 -6.306 10.225 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.297 -4.671 10.516 1.00 0.00 H new ATOM 0 HG23 THR B 59 -10.412 -5.413 11.689 1.00 0.00 H new ATOM 2422 N LEU B 60 -11.232 -1.474 8.915 1.00 0.00 N ATOM 2423 CA LEU B 60 -10.403 -0.433 8.317 1.00 0.00 C ATOM 2424 C LEU B 60 -10.419 0.844 9.154 1.00 0.00 C ATOM 2425 O LEU B 60 -9.590 1.731 8.957 1.00 0.00 O ATOM 2426 CB LEU B 60 -10.888 -0.128 6.898 1.00 0.00 C ATOM 2427 CG LEU B 60 -10.177 -0.910 5.792 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -11.140 -1.869 5.109 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -9.562 0.041 4.779 1.00 0.00 C ATOM 0 H LEU B 60 -12.185 -1.513 8.554 1.00 0.00 H new ATOM 0 HA LEU B 60 -9.378 -0.802 8.282 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -11.956 -0.338 6.842 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -10.762 0.938 6.708 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.377 -1.495 6.245 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.615 -2.416 4.326 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -11.533 -2.574 5.842 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.963 -1.306 4.669 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.060 -0.532 3.999 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -10.346 0.653 4.332 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.838 0.686 5.278 1.00 0.00 H new ATOM 2441 N ASP B 61 -11.367 0.934 10.084 1.00 0.00 N ATOM 2442 CA ASP B 61 -11.488 2.108 10.944 1.00 0.00 C ATOM 2443 C ASP B 61 -10.149 2.471 11.582 1.00 0.00 C ATOM 2444 O ASP B 61 -9.797 1.959 12.644 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.533 1.857 12.034 1.00 0.00 C ATOM 2446 CG ASP B 61 -13.480 3.028 12.207 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -14.489 3.087 11.475 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -13.211 3.886 13.074 1.00 0.00 O ATOM 0 H ASP B 61 -12.062 0.209 10.261 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.806 2.946 10.323 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.106 0.964 11.786 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -12.028 1.659 12.979 1.00 0.00 H new ATOM 2453 N ASN B 62 -9.409 3.361 10.927 1.00 0.00 N ATOM 2454 CA ASN B 62 -8.112 3.794 11.431 1.00 0.00 C ATOM 2455 C ASN B 62 -8.153 5.265 11.835 1.00 0.00 C ATOM 2456 O ASN B 62 -7.449 5.687 12.752 1.00 0.00 O ATOM 2457 CB ASN B 62 -7.028 3.571 10.374 1.00 0.00 C ATOM 2458 CG ASN B 62 -6.282 2.267 10.578 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -6.785 1.343 11.219 1.00 0.00 O ATOM 2460 ND2 ASN B 62 -5.073 2.185 10.035 1.00 0.00 N ATOM 0 H ASN B 62 -9.686 3.795 10.047 1.00 0.00 H new ATOM 0 HA ASN B 62 -7.874 3.199 12.313 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -7.484 3.575 9.384 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -6.320 4.400 10.403 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -4.523 1.333 10.141 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -4.694 2.974 9.512 1.00 0.00 H new ATOM 2467 N ASP B 63 -8.985 6.039 11.145 1.00 0.00 N ATOM 2468 CA ASP B 63 -9.122 7.462 11.429 1.00 0.00 C ATOM 2469 C ASP B 63 -10.161 8.103 10.512 1.00 0.00 C ATOM 2470 O ASP B 63 -9.949 9.197 9.989 1.00 0.00 O ATOM 2471 CB ASP B 63 -7.774 8.170 11.266 1.00 0.00 C ATOM 2472 CG ASP B 63 -7.648 9.387 12.162 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -8.406 9.478 13.150 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -6.789 10.248 11.876 1.00 0.00 O ATOM 0 H ASP B 63 -9.575 5.703 10.384 1.00 0.00 H new ATOM 0 HA ASP B 63 -9.458 7.570 12.460 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -6.970 7.470 11.493 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -7.649 8.473 10.226 1.00 0.00 H new ATOM 2479 N GLY B 64 -11.286 7.418 10.321 1.00 0.00 N ATOM 2480 CA GLY B 64 -12.334 7.944 9.468 1.00 0.00 C ATOM 2481 C GLY B 64 -13.618 8.220 10.224 1.00 0.00 C ATOM 2482 O GLY B 64 -14.636 8.569 9.624 1.00 0.00 O ATOM 0 H GLY B 64 -11.489 6.511 10.741 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -11.988 8.865 8.999 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.535 7.234 8.666 1.00 0.00 H new ATOM 2486 N ASP B 65 -13.576 8.062 11.543 1.00 0.00 N ATOM 2487 CA ASP B 65 -14.750 8.294 12.374 1.00 0.00 C ATOM 2488 C ASP B 65 -15.874 7.338 11.990 1.00 0.00 C ATOM 2489 O ASP B 65 -17.051 7.630 12.198 1.00 0.00 O ATOM 2490 CB ASP B 65 -15.223 9.745 12.235 1.00 0.00 C ATOM 2491 CG ASP B 65 -15.043 10.537 13.515 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -15.935 10.466 14.387 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -14.012 11.228 13.645 1.00 0.00 O ATOM 0 H ASP B 65 -12.743 7.775 12.058 1.00 0.00 H new ATOM 0 HA ASP B 65 -14.477 8.111 13.413 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -14.669 10.229 11.431 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -16.275 9.756 11.949 1.00 0.00 H new ATOM 2498 N GLY B 66 -15.499 6.193 11.427 1.00 0.00 N ATOM 2499 CA GLY B 66 -16.481 5.209 11.019 1.00 0.00 C ATOM 2500 C GLY B 66 -16.375 4.859 9.549 1.00 0.00 C ATOM 2501 O GLY B 66 -16.624 3.718 9.158 1.00 0.00 O ATOM 0 H GLY B 66 -14.530 5.930 11.247 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.354 4.305 11.615 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -17.481 5.590 11.227 1.00 0.00 H new ATOM 2505 N GLU B 67 -15.998 5.838 8.733 1.00 0.00 N ATOM 2506 CA GLU B 67 -15.852 5.632 7.308 1.00 0.00 C ATOM 2507 C GLU B 67 -14.399 5.362 6.962 1.00 0.00 C ATOM 2508 O GLU B 67 -13.529 5.380 7.833 1.00 0.00 O ATOM 2509 CB GLU B 67 -16.347 6.858 6.543 1.00 0.00 C ATOM 2510 CG GLU B 67 -17.714 6.667 5.925 1.00 0.00 C ATOM 2511 CD GLU B 67 -18.823 6.636 6.959 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -19.119 5.541 7.480 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -19.396 7.708 7.246 1.00 0.00 O ATOM 0 H GLU B 67 -15.788 6.787 9.043 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.451 4.768 7.020 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -16.378 7.712 7.220 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.632 7.100 5.757 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -17.905 7.474 5.217 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -17.725 5.736 5.358 1.00 0.00 H new ATOM 2520 N CYS B 68 -14.142 5.113 5.691 1.00 0.00 N ATOM 2521 CA CYS B 68 -12.782 4.840 5.238 1.00 0.00 C ATOM 2522 C CYS B 68 -12.455 5.620 3.975 1.00 0.00 C ATOM 2523 O CYS B 68 -13.051 5.384 2.933 1.00 0.00 O ATOM 2524 CB CYS B 68 -12.599 3.345 4.976 1.00 0.00 C ATOM 2525 SG CYS B 68 -13.347 2.273 6.225 1.00 0.00 S ATOM 0 H CYS B 68 -14.848 5.093 4.955 1.00 0.00 H new ATOM 0 HA CYS B 68 -12.101 5.157 6.027 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -13.027 3.104 4.003 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -11.533 3.126 4.918 1.00 0.00 H new ATOM 0 HG CYS B 68 -13.326 1.042 5.809 1.00 0.00 H new ATOM 2531 N ASP B 69 -11.498 6.539 4.055 1.00 0.00 N ATOM 2532 CA ASP B 69 -11.113 7.313 2.882 1.00 0.00 C ATOM 2533 C ASP B 69 -10.019 6.581 2.104 1.00 0.00 C ATOM 2534 O ASP B 69 -9.922 5.356 2.171 1.00 0.00 O ATOM 2535 CB ASP B 69 -10.658 8.722 3.265 1.00 0.00 C ATOM 2536 CG ASP B 69 -9.410 8.727 4.123 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -9.373 7.985 5.126 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -8.467 9.474 3.791 1.00 0.00 O ATOM 0 H ASP B 69 -10.982 6.763 4.906 1.00 0.00 H new ATOM 0 HA ASP B 69 -11.989 7.417 2.242 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -10.471 9.297 2.358 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.463 9.225 3.801 1.00 0.00 H new ATOM 2543 N PHE B 70 -9.200 7.322 1.363 1.00 0.00 N ATOM 2544 CA PHE B 70 -8.128 6.721 0.581 1.00 0.00 C ATOM 2545 C PHE B 70 -6.978 6.261 1.477 1.00 0.00 C ATOM 2546 O PHE B 70 -6.294 5.287 1.169 1.00 0.00 O ATOM 2547 CB PHE B 70 -7.623 7.721 -0.471 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.197 7.512 -0.897 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -5.155 8.043 -0.155 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -5.899 6.788 -2.041 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -3.843 7.856 -0.544 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -4.588 6.599 -2.436 1.00 0.00 C ATOM 2553 CZ PHE B 70 -3.559 7.134 -1.686 1.00 0.00 C ATOM 0 H PHE B 70 -9.259 8.338 1.289 1.00 0.00 H new ATOM 0 HA PHE B 70 -8.526 5.841 0.075 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -8.264 7.659 -1.350 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -7.726 8.730 -0.073 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -5.371 8.610 0.738 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -6.700 6.367 -2.630 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.040 8.274 0.045 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -4.369 6.034 -3.330 1.00 0.00 H new ATOM 0 HZ PHE B 70 -2.534 6.988 -1.992 1.00 0.00 H new ATOM 2563 N GLN B 71 -6.763 6.972 2.577 1.00 0.00 N ATOM 2564 CA GLN B 71 -5.681 6.636 3.501 1.00 0.00 C ATOM 2565 C GLN B 71 -5.962 5.336 4.256 1.00 0.00 C ATOM 2566 O GLN B 71 -5.036 4.623 4.645 1.00 0.00 O ATOM 2567 CB GLN B 71 -5.448 7.782 4.491 1.00 0.00 C ATOM 2568 CG GLN B 71 -6.557 7.949 5.521 1.00 0.00 C ATOM 2569 CD GLN B 71 -6.037 7.946 6.945 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -6.339 8.844 7.731 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -5.248 6.933 7.287 1.00 0.00 N ATOM 0 H GLN B 71 -7.319 7.781 2.852 1.00 0.00 H new ATOM 0 HA GLN B 71 -4.779 6.487 2.908 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -4.506 7.612 5.012 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -5.341 8.713 3.934 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -7.084 8.884 5.333 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -7.283 7.144 5.402 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -5.023 6.209 6.605 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -4.868 6.879 8.232 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.238 5.034 4.466 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.627 3.824 5.182 1.00 0.00 C ATOM 2582 C GLU B 72 -7.490 2.587 4.300 1.00 0.00 C ATOM 2583 O GLU B 72 -6.874 1.597 4.696 1.00 0.00 O ATOM 2584 CB GLU B 72 -9.063 3.950 5.686 1.00 0.00 C ATOM 2585 CG GLU B 72 -9.298 5.205 6.506 1.00 0.00 C ATOM 2586 CD GLU B 72 -8.637 5.144 7.868 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -7.408 5.353 7.941 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -9.348 4.886 8.861 1.00 0.00 O ATOM 0 H GLU B 72 -8.020 5.609 4.152 1.00 0.00 H new ATOM 0 HA GLU B 72 -6.955 3.708 6.032 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -9.742 3.948 4.834 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -9.307 3.077 6.291 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -8.917 6.068 5.960 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -10.370 5.356 6.633 1.00 0.00 H new ATOM 2595 N PHE B 73 -8.069 2.646 3.105 1.00 0.00 N ATOM 2596 CA PHE B 73 -8.012 1.524 2.174 1.00 0.00 C ATOM 2597 C PHE B 73 -6.576 1.255 1.735 1.00 0.00 C ATOM 2598 O PHE B 73 -6.163 0.102 1.611 1.00 0.00 O ATOM 2599 CB PHE B 73 -8.939 1.785 0.971 1.00 0.00 C ATOM 2600 CG PHE B 73 -8.270 2.376 -0.236 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -7.344 1.654 -0.968 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -8.578 3.662 -0.635 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -6.736 2.209 -2.075 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -7.974 4.225 -1.741 1.00 0.00 C ATOM 2605 CZ PHE B 73 -7.051 3.498 -2.462 1.00 0.00 C ATOM 0 H PHE B 73 -8.582 3.457 2.759 1.00 0.00 H new ATOM 0 HA PHE B 73 -8.366 0.626 2.681 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -9.407 0.844 0.683 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -9.739 2.455 1.288 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -7.095 0.646 -0.670 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -9.301 4.235 -0.074 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -6.014 1.637 -2.639 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.224 5.232 -2.041 1.00 0.00 H new ATOM 0 HZ PHE B 73 -6.575 3.935 -3.327 1.00 0.00 H new ATOM 2615 N MET B 74 -5.816 2.320 1.515 1.00 0.00 N ATOM 2616 CA MET B 74 -4.424 2.182 1.107 1.00 0.00 C ATOM 2617 C MET B 74 -3.636 1.463 2.191 1.00 0.00 C ATOM 2618 O MET B 74 -2.739 0.669 1.903 1.00 0.00 O ATOM 2619 CB MET B 74 -3.811 3.550 0.825 1.00 0.00 C ATOM 2620 CG MET B 74 -4.392 4.218 -0.407 1.00 0.00 C ATOM 2621 SD MET B 74 -3.625 3.640 -1.932 1.00 0.00 S ATOM 2622 CE MET B 74 -2.078 4.539 -1.896 1.00 0.00 C ATOM 0 H MET B 74 -6.137 3.283 1.611 1.00 0.00 H new ATOM 0 HA MET B 74 -4.384 1.593 0.190 1.00 0.00 H new ATOM 0 HB2 MET B 74 -3.966 4.196 1.689 1.00 0.00 H new ATOM 0 HB3 MET B 74 -2.734 3.440 0.698 1.00 0.00 H new ATOM 0 HG2 MET B 74 -5.464 4.027 -0.448 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.263 5.297 -0.326 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.982 5.134 -2.804 1.00 0.00 H new ATOM 0 HE2 MET B 74 -2.060 5.197 -1.027 1.00 0.00 H new ATOM 0 HE3 MET B 74 -1.249 3.834 -1.835 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.998 1.728 3.440 1.00 0.00 N ATOM 2633 CA ALA B 75 -3.352 1.091 4.570 1.00 0.00 C ATOM 2634 C ALA B 75 -3.759 -0.370 4.632 1.00 0.00 C ATOM 2635 O ALA B 75 -2.986 -1.225 5.049 1.00 0.00 O ATOM 2636 CB ALA B 75 -3.729 1.800 5.862 1.00 0.00 C ATOM 0 H ALA B 75 -4.739 2.383 3.692 1.00 0.00 H new ATOM 0 HA ALA B 75 -2.271 1.155 4.446 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -3.237 1.311 6.702 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -3.411 2.842 5.812 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -4.809 1.756 5.999 1.00 0.00 H new ATOM 2642 N PHE B 76 -4.988 -0.640 4.201 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.532 -1.990 4.191 1.00 0.00 C ATOM 2644 C PHE B 76 -4.787 -2.881 3.214 1.00 0.00 C ATOM 2645 O PHE B 76 -4.046 -3.771 3.622 1.00 0.00 O ATOM 2646 CB PHE B 76 -7.004 -1.947 3.809 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.685 -3.280 3.864 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -8.157 -3.783 5.064 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -7.854 -4.027 2.713 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -8.788 -5.012 5.115 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -8.483 -5.257 2.755 1.00 0.00 C ATOM 2652 CZ PHE B 76 -8.951 -5.750 3.957 1.00 0.00 C ATOM 0 H PHE B 76 -5.631 0.070 3.850 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.416 -2.406 5.192 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.522 -1.258 4.476 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.096 -1.545 2.800 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.031 -3.209 5.970 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.490 -3.645 1.770 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -9.153 -5.395 6.057 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.608 -5.832 1.849 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.444 -6.710 3.993 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.985 -2.642 1.918 1.00 0.00 N ATOM 2663 CA VAL B 77 -4.317 -3.440 0.899 1.00 0.00 C ATOM 2664 C VAL B 77 -2.837 -3.595 1.224 1.00 0.00 C ATOM 2665 O VAL B 77 -2.211 -4.596 0.875 1.00 0.00 O ATOM 2666 CB VAL B 77 -4.463 -2.809 -0.499 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -3.919 -3.744 -1.569 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -5.917 -2.456 -0.776 1.00 0.00 C ATOM 0 H VAL B 77 -5.596 -1.910 1.555 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.796 -4.419 0.893 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.879 -1.889 -0.525 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.031 -3.280 -2.549 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.864 -3.940 -1.379 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.472 -4.683 -1.547 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.001 -2.011 -1.768 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -6.526 -3.359 -0.730 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.267 -1.744 -0.029 1.00 0.00 H new ATOM 2678 N ALA B 78 -2.291 -2.591 1.902 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.882 -2.598 2.284 1.00 0.00 C ATOM 2680 C ALA B 78 -0.646 -3.338 3.599 1.00 0.00 C ATOM 2681 O ALA B 78 0.352 -4.043 3.750 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.359 -1.175 2.379 1.00 0.00 C ATOM 0 H ALA B 78 -2.803 -1.760 2.199 1.00 0.00 H new ATOM 0 HA ALA B 78 -0.335 -3.134 1.508 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.693 -1.192 2.665 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.464 -0.683 1.412 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -0.930 -0.627 3.129 1.00 0.00 H new ATOM 2688 N MET B 79 -1.557 -3.168 4.553 1.00 0.00 N ATOM 2689 CA MET B 79 -1.428 -3.818 5.854 1.00 0.00 C ATOM 2690 C MET B 79 -1.834 -5.284 5.766 1.00 0.00 C ATOM 2691 O MET B 79 -1.181 -6.163 6.335 1.00 0.00 O ATOM 2692 CB MET B 79 -2.267 -3.083 6.913 1.00 0.00 C ATOM 2693 CG MET B 79 -3.769 -3.292 6.801 1.00 0.00 C ATOM 2694 SD MET B 79 -4.625 -3.019 8.364 1.00 0.00 S ATOM 2695 CE MET B 79 -5.948 -1.933 7.839 1.00 0.00 C ATOM 0 H MET B 79 -2.390 -2.588 4.451 1.00 0.00 H new ATOM 0 HA MET B 79 -0.382 -3.773 6.156 1.00 0.00 H new ATOM 0 HB2 MET B 79 -1.943 -3.408 7.902 1.00 0.00 H new ATOM 0 HB3 MET B 79 -2.058 -2.016 6.844 1.00 0.00 H new ATOM 0 HG2 MET B 79 -4.171 -2.615 6.048 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.966 -4.307 6.455 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.390 -1.450 8.711 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.550 -1.174 7.166 1.00 0.00 H new ATOM 0 HE3 MET B 79 -6.711 -2.513 7.320 1.00 0.00 H new ATOM 2705 N VAL B 80 -2.913 -5.538 5.044 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.421 -6.885 4.867 1.00 0.00 C ATOM 2707 C VAL B 80 -2.420 -7.749 4.100 1.00 0.00 C ATOM 2708 O VAL B 80 -2.155 -8.898 4.471 1.00 0.00 O ATOM 2709 CB VAL B 80 -4.775 -6.858 4.130 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.350 -8.259 3.992 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -5.752 -5.946 4.860 1.00 0.00 C ATOM 0 H VAL B 80 -3.458 -4.819 4.567 1.00 0.00 H new ATOM 0 HA VAL B 80 -3.567 -7.323 5.854 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.611 -6.464 3.127 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -6.305 -8.210 3.469 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.657 -8.882 3.426 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.500 -8.690 4.982 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.705 -5.935 4.330 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -5.905 -6.314 5.874 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.347 -4.935 4.899 1.00 0.00 H new ATOM 2721 N THR B 81 -1.860 -7.184 3.036 1.00 0.00 N ATOM 2722 CA THR B 81 -0.882 -7.891 2.219 1.00 0.00 C ATOM 2723 C THR B 81 0.430 -8.090 2.977 1.00 0.00 C ATOM 2724 O THR B 81 1.054 -9.146 2.895 1.00 0.00 O ATOM 2725 CB THR B 81 -0.628 -7.115 0.923 1.00 0.00 C ATOM 2726 OG1 THR B 81 0.086 -7.905 -0.010 1.00 0.00 O ATOM 2727 CG2 THR B 81 0.151 -5.833 1.134 1.00 0.00 C ATOM 0 H THR B 81 -2.067 -6.237 2.719 1.00 0.00 H new ATOM 0 HA THR B 81 -1.285 -8.875 1.979 1.00 0.00 H new ATOM 0 HB THR B 81 -1.618 -6.861 0.544 1.00 0.00 H new ATOM 0 HG1 THR B 81 0.097 -7.454 -0.880 1.00 0.00 H new ATOM 0 HG21 THR B 81 0.296 -5.333 0.176 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.403 -5.177 1.805 1.00 0.00 H new ATOM 0 HG23 THR B 81 1.122 -6.065 1.572 1.00 0.00 H new ATOM 2735 N THR B 82 0.850 -7.060 3.707 1.00 0.00 N ATOM 2736 CA THR B 82 2.096 -7.112 4.466 1.00 0.00 C ATOM 2737 C THR B 82 2.135 -8.301 5.425 1.00 0.00 C ATOM 2738 O THR B 82 3.204 -8.844 5.696 1.00 0.00 O ATOM 2739 CB THR B 82 2.295 -5.813 5.250 1.00 0.00 C ATOM 2740 OG1 THR B 82 1.062 -5.337 5.752 1.00 0.00 O ATOM 2741 CG2 THR B 82 2.917 -4.706 4.426 1.00 0.00 C ATOM 0 H THR B 82 0.345 -6.178 3.789 1.00 0.00 H new ATOM 0 HA THR B 82 2.906 -7.235 3.747 1.00 0.00 H new ATOM 0 HB THR B 82 2.978 -6.066 6.061 1.00 0.00 H new ATOM 0 HG1 THR B 82 0.494 -6.097 5.997 1.00 0.00 H new ATOM 0 HG21 THR B 82 3.030 -3.814 5.042 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.895 -5.026 4.067 1.00 0.00 H new ATOM 0 HG23 THR B 82 2.274 -4.480 3.575 1.00 0.00 H new ATOM 2749 N ALA B 83 0.979 -8.695 5.952 1.00 0.00 N ATOM 2750 CA ALA B 83 0.930 -9.812 6.891 1.00 0.00 C ATOM 2751 C ALA B 83 1.043 -11.163 6.187 1.00 0.00 C ATOM 2752 O ALA B 83 1.979 -11.919 6.443 1.00 0.00 O ATOM 2753 CB ALA B 83 -0.338 -9.764 7.735 1.00 0.00 C ATOM 0 H ALA B 83 0.076 -8.265 5.749 1.00 0.00 H new ATOM 0 HA ALA B 83 1.794 -9.707 7.547 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -0.348 -10.608 8.425 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -0.364 -8.832 8.300 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -1.211 -9.818 7.084 1.00 0.00 H new ATOM 2759 N CYS B 84 0.080 -11.482 5.321 1.00 0.00 N ATOM 2760 CA CYS B 84 0.101 -12.772 4.629 1.00 0.00 C ATOM 2761 C CYS B 84 0.917 -12.739 3.339 1.00 0.00 C ATOM 2762 O CYS B 84 1.762 -13.608 3.119 1.00 0.00 O ATOM 2763 CB CYS B 84 -1.324 -13.269 4.354 1.00 0.00 C ATOM 2764 SG CYS B 84 -2.183 -12.418 3.006 1.00 0.00 S ATOM 0 H CYS B 84 -0.709 -10.880 5.085 1.00 0.00 H new ATOM 0 HA CYS B 84 0.597 -13.475 5.298 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -1.284 -14.334 4.124 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -1.913 -13.162 5.265 1.00 0.00 H new ATOM 0 HG CYS B 84 -3.373 -12.921 2.864 1.00 0.00 H new ATOM 2770 N HIS B 85 0.676 -11.749 2.483 1.00 0.00 N ATOM 2771 CA HIS B 85 1.412 -11.651 1.224 1.00 0.00 C ATOM 2772 C HIS B 85 2.916 -11.746 1.466 1.00 0.00 C ATOM 2773 O HIS B 85 3.678 -12.106 0.570 1.00 0.00 O ATOM 2774 CB HIS B 85 1.074 -10.349 0.501 1.00 0.00 C ATOM 2775 CG HIS B 85 0.936 -10.509 -0.982 1.00 0.00 C ATOM 2776 ND1 HIS B 85 -0.279 -10.469 -1.634 1.00 0.00 N ATOM 2777 CD2 HIS B 85 1.868 -10.716 -1.943 1.00 0.00 C ATOM 2778 CE1 HIS B 85 -0.087 -10.644 -2.929 1.00 0.00 C ATOM 2779 NE2 HIS B 85 1.206 -10.796 -3.143 1.00 0.00 N ATOM 0 H HIS B 85 -0.013 -11.012 2.634 1.00 0.00 H new ATOM 0 HA HIS B 85 1.111 -12.487 0.592 1.00 0.00 H new ATOM 0 HB2 HIS B 85 0.143 -9.950 0.904 1.00 0.00 H new ATOM 0 HB3 HIS B 85 1.852 -9.614 0.709 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -1.184 -10.327 -1.186 1.00 0.00 H new ATOM 0 HD2 HIS B 85 2.934 -10.802 -1.793 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -0.858 -10.660 -3.685 1.00 0.00 H new ATOM 2788 N GLU B 86 3.330 -11.430 2.691 1.00 0.00 N ATOM 2789 CA GLU B 86 4.735 -11.487 3.072 1.00 0.00 C ATOM 2790 C GLU B 86 5.381 -12.782 2.594 1.00 0.00 C ATOM 2791 O GLU B 86 6.289 -12.767 1.763 1.00 0.00 O ATOM 2792 CB GLU B 86 4.854 -11.371 4.594 1.00 0.00 C ATOM 2793 CG GLU B 86 6.274 -11.524 5.121 1.00 0.00 C ATOM 2794 CD GLU B 86 6.316 -12.115 6.516 1.00 0.00 C ATOM 2795 OE1 GLU B 86 5.324 -11.957 7.258 1.00 0.00 O ATOM 2796 OE2 GLU B 86 7.341 -12.735 6.868 1.00 0.00 O ATOM 0 H GLU B 86 2.706 -11.130 3.440 1.00 0.00 H new ATOM 0 HA GLU B 86 5.258 -10.656 2.598 1.00 0.00 H new ATOM 0 HB2 GLU B 86 4.465 -10.401 4.905 1.00 0.00 H new ATOM 0 HB3 GLU B 86 4.223 -12.130 5.056 1.00 0.00 H new ATOM 0 HG2 GLU B 86 6.843 -12.161 4.443 1.00 0.00 H new ATOM 0 HG3 GLU B 86 6.762 -10.549 5.128 1.00 0.00 H new ATOM 2803 N PHE B 87 4.900 -13.900 3.121 1.00 0.00 N ATOM 2804 CA PHE B 87 5.422 -15.207 2.748 1.00 0.00 C ATOM 2805 C PHE B 87 4.349 -16.023 2.034 1.00 0.00 C ATOM 2806 O PHE B 87 4.654 -16.842 1.167 1.00 0.00 O ATOM 2807 CB PHE B 87 5.929 -15.951 3.984 1.00 0.00 C ATOM 2808 CG PHE B 87 7.423 -16.125 4.014 1.00 0.00 C ATOM 2809 CD1 PHE B 87 8.268 -15.129 3.543 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.984 -17.290 4.514 1.00 0.00 C ATOM 2811 CE1 PHE B 87 9.640 -15.293 3.572 1.00 0.00 C ATOM 2812 CE2 PHE B 87 9.355 -17.459 4.546 1.00 0.00 C ATOM 2813 CZ PHE B 87 10.184 -16.459 4.075 1.00 0.00 C ATOM 0 H PHE B 87 4.148 -13.927 3.809 1.00 0.00 H new ATOM 0 HA PHE B 87 6.259 -15.065 2.064 1.00 0.00 H new ATOM 0 HB2 PHE B 87 5.617 -15.409 4.877 1.00 0.00 H new ATOM 0 HB3 PHE B 87 5.457 -16.933 4.026 1.00 0.00 H new ATOM 0 HD1 PHE B 87 7.848 -14.215 3.149 1.00 0.00 H new ATOM 0 HD2 PHE B 87 7.341 -18.075 4.883 1.00 0.00 H new ATOM 0 HE1 PHE B 87 10.286 -14.511 3.202 1.00 0.00 H new ATOM 0 HE2 PHE B 87 9.778 -18.372 4.939 1.00 0.00 H new ATOM 0 HZ PHE B 87 11.256 -16.589 4.100 1.00 0.00 H new ATOM 2823 N PHE B 88 3.091 -15.787 2.396 1.00 0.00 N ATOM 2824 CA PHE B 88 1.978 -16.492 1.777 1.00 0.00 C ATOM 2825 C PHE B 88 1.744 -15.981 0.359 1.00 0.00 C ATOM 2826 O PHE B 88 1.230 -16.706 -0.493 1.00 0.00 O ATOM 2827 CB PHE B 88 0.703 -16.332 2.614 1.00 0.00 C ATOM 2828 CG PHE B 88 0.829 -16.875 4.008 1.00 0.00 C ATOM 2829 CD1 PHE B 88 1.444 -16.132 5.003 1.00 0.00 C ATOM 2830 CD2 PHE B 88 0.332 -18.130 4.324 1.00 0.00 C ATOM 2831 CE1 PHE B 88 1.562 -16.630 6.287 1.00 0.00 C ATOM 2832 CE2 PHE B 88 0.446 -18.632 5.606 1.00 0.00 C ATOM 2833 CZ PHE B 88 1.062 -17.882 6.588 1.00 0.00 C ATOM 0 H PHE B 88 2.820 -15.114 3.113 1.00 0.00 H new ATOM 0 HA PHE B 88 2.231 -17.551 1.730 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.443 -15.275 2.667 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -0.120 -16.838 2.109 1.00 0.00 H new ATOM 0 HD1 PHE B 88 1.836 -15.152 4.773 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -0.150 -18.722 3.560 1.00 0.00 H new ATOM 0 HE1 PHE B 88 2.044 -16.041 7.053 1.00 0.00 H new ATOM 0 HE2 PHE B 88 0.053 -19.611 5.840 1.00 0.00 H new ATOM 0 HZ PHE B 88 1.153 -18.274 7.590 1.00 0.00 H new ATOM 2909 N ARG C 2 0.732 14.697 8.108 1.00 0.00 N ATOM 2910 CA ARG C 2 0.351 15.623 7.048 1.00 0.00 C ATOM 2911 C ARG C 2 1.561 15.996 6.201 1.00 0.00 C ATOM 2912 O ARG C 2 1.662 15.606 5.037 1.00 0.00 O ATOM 2913 CB ARG C 2 -0.277 16.885 7.646 1.00 0.00 C ATOM 2914 CG ARG C 2 -1.571 16.623 8.400 1.00 0.00 C ATOM 2915 CD ARG C 2 -2.195 17.916 8.899 1.00 0.00 C ATOM 2916 NE ARG C 2 -3.232 17.673 9.899 1.00 0.00 N ATOM 2917 CZ ARG C 2 -2.981 17.409 11.179 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -1.729 17.351 11.617 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -3.982 17.203 12.022 1.00 0.00 N ATOM 0 HA ARG C 2 -0.382 15.130 6.410 1.00 0.00 H new ATOM 0 HB2 ARG C 2 0.439 17.352 8.322 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -0.471 17.598 6.845 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -2.275 16.106 7.748 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -1.374 15.963 9.245 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -1.420 18.551 9.328 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -2.623 18.460 8.057 1.00 0.00 H new ATOM 0 HE ARG C 2 -4.206 17.708 9.598 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -0.955 17.509 10.972 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -1.541 17.148 12.599 1.00 0.00 H new ATOM 0 HH21 ARG C 2 -4.945 17.247 11.690 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -3.789 17.001 13.003 1.00 0.00 H new ATOM 2932 N THR C 3 2.480 16.750 6.794 1.00 0.00 N ATOM 2933 CA THR C 3 3.689 17.174 6.099 1.00 0.00 C ATOM 2934 C THR C 3 4.876 16.275 6.448 1.00 0.00 C ATOM 2935 O THR C 3 5.991 16.500 5.979 1.00 0.00 O ATOM 2936 CB THR C 3 4.017 18.628 6.446 1.00 0.00 C ATOM 2937 OG1 THR C 3 5.304 18.979 5.972 1.00 0.00 O ATOM 2938 CG2 THR C 3 3.980 18.911 7.932 1.00 0.00 C ATOM 0 H THR C 3 2.410 17.081 7.756 1.00 0.00 H new ATOM 0 HA THR C 3 3.504 17.092 5.028 1.00 0.00 H new ATOM 0 HB THR C 3 3.243 19.223 5.961 1.00 0.00 H new ATOM 0 HG1 THR C 3 5.755 18.180 5.627 1.00 0.00 H new ATOM 0 HG21 THR C 3 4.222 19.959 8.109 1.00 0.00 H new ATOM 0 HG22 THR C 3 2.983 18.698 8.318 1.00 0.00 H new ATOM 0 HG23 THR C 3 4.709 18.280 8.441 1.00 0.00 H new ATOM 2946 N LYS C 4 4.632 15.260 7.275 1.00 0.00 N ATOM 2947 CA LYS C 4 5.684 14.335 7.685 1.00 0.00 C ATOM 2948 C LYS C 4 5.779 13.138 6.731 1.00 0.00 C ATOM 2949 O LYS C 4 6.696 12.325 6.829 1.00 0.00 O ATOM 2950 CB LYS C 4 5.433 13.867 9.124 1.00 0.00 C ATOM 2951 CG LYS C 4 4.386 12.766 9.259 1.00 0.00 C ATOM 2952 CD LYS C 4 4.906 11.556 10.037 1.00 0.00 C ATOM 2953 CE LYS C 4 6.316 11.145 9.622 1.00 0.00 C ATOM 2954 NZ LYS C 4 6.697 9.818 10.181 1.00 0.00 N ATOM 0 H LYS C 4 3.715 15.058 7.674 1.00 0.00 H new ATOM 0 HA LYS C 4 6.639 14.860 7.644 1.00 0.00 H new ATOM 0 HB2 LYS C 4 6.373 13.510 9.546 1.00 0.00 H new ATOM 0 HB3 LYS C 4 5.120 14.723 9.721 1.00 0.00 H new ATOM 0 HG2 LYS C 4 3.505 13.166 9.762 1.00 0.00 H new ATOM 0 HG3 LYS C 4 4.069 12.447 8.266 1.00 0.00 H new ATOM 0 HD2 LYS C 4 4.898 11.785 11.103 1.00 0.00 H new ATOM 0 HD3 LYS C 4 4.229 10.715 9.887 1.00 0.00 H new ATOM 0 HE2 LYS C 4 6.379 11.112 8.534 1.00 0.00 H new ATOM 0 HE3 LYS C 4 7.028 11.899 9.960 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 7.267 9.954 11.040 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 5.838 9.281 10.417 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 7.252 9.291 9.477 1.00 0.00 H new ATOM 2968 N ILE C 5 4.814 13.045 5.813 1.00 0.00 N ATOM 2969 CA ILE C 5 4.748 11.963 4.823 1.00 0.00 C ATOM 2970 C ILE C 5 4.913 10.574 5.448 1.00 0.00 C ATOM 2971 O ILE C 5 5.067 9.582 4.744 1.00 0.00 O ATOM 2972 CB ILE C 5 5.750 12.135 3.652 1.00 0.00 C ATOM 2973 CG1 ILE C 5 6.981 12.968 4.041 1.00 0.00 C ATOM 2974 CG2 ILE C 5 5.048 12.769 2.460 1.00 0.00 C ATOM 2975 CD1 ILE C 5 6.665 14.417 4.342 1.00 0.00 C ATOM 0 H ILE C 5 4.053 13.719 5.734 1.00 0.00 H new ATOM 0 HA ILE C 5 3.742 12.037 4.411 1.00 0.00 H new ATOM 0 HB ILE C 5 6.109 11.140 3.388 1.00 0.00 H new ATOM 0 HG12 ILE C 5 7.451 12.519 4.916 1.00 0.00 H new ATOM 0 HG13 ILE C 5 7.709 12.925 3.231 1.00 0.00 H new ATOM 0 HG21 ILE C 5 5.757 12.887 1.641 1.00 0.00 H new ATOM 0 HG22 ILE C 5 4.226 12.129 2.139 1.00 0.00 H new ATOM 0 HG23 ILE C 5 4.657 13.746 2.745 1.00 0.00 H new ATOM 0 HD11 ILE C 5 7.582 14.942 4.609 1.00 0.00 H new ATOM 0 HD12 ILE C 5 6.223 14.884 3.462 1.00 0.00 H new ATOM 0 HD13 ILE C 5 5.962 14.471 5.173 1.00 0.00 H new ATOM 2987 N ASP C 6 4.829 10.512 6.766 1.00 0.00 N ATOM 2988 CA ASP C 6 4.913 9.253 7.509 1.00 0.00 C ATOM 2989 C ASP C 6 6.051 8.328 7.064 1.00 0.00 C ATOM 2990 O ASP C 6 5.863 7.113 7.007 1.00 0.00 O ATOM 2991 CB ASP C 6 3.585 8.501 7.402 1.00 0.00 C ATOM 2992 CG ASP C 6 3.413 7.475 8.503 1.00 0.00 C ATOM 2993 OD1 ASP C 6 4.156 7.545 9.504 1.00 0.00 O ATOM 2994 OD2 ASP C 6 2.532 6.599 8.365 1.00 0.00 O ATOM 0 H ASP C 6 4.700 11.332 7.358 1.00 0.00 H new ATOM 0 HA ASP C 6 5.130 9.533 8.540 1.00 0.00 H new ATOM 0 HB2 ASP C 6 2.762 9.215 7.442 1.00 0.00 H new ATOM 0 HB3 ASP C 6 3.529 8.004 6.434 1.00 0.00 H new ATOM 2999 N TRP C 7 7.239 8.868 6.792 1.00 0.00 N ATOM 3000 CA TRP C 7 8.361 8.008 6.416 1.00 0.00 C ATOM 3001 C TRP C 7 8.939 7.370 7.674 1.00 0.00 C ATOM 3002 O TRP C 7 8.796 6.169 7.896 1.00 0.00 O ATOM 3003 CB TRP C 7 9.465 8.787 5.704 1.00 0.00 C ATOM 3004 CG TRP C 7 9.100 9.258 4.331 1.00 0.00 C ATOM 3005 CD1 TRP C 7 7.938 9.854 3.955 1.00 0.00 C ATOM 3006 CD2 TRP C 7 9.909 9.180 3.153 1.00 0.00 C ATOM 3007 NE1 TRP C 7 7.979 10.169 2.617 1.00 0.00 N ATOM 3008 CE2 TRP C 7 9.178 9.764 2.104 1.00 0.00 C ATOM 3009 CE3 TRP C 7 11.180 8.678 2.885 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 9.679 9.860 0.809 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 11.679 8.773 1.601 1.00 0.00 C ATOM 3012 CH2 TRP C 7 10.930 9.363 0.576 1.00 0.00 C ATOM 0 H TRP C 7 7.447 9.866 6.823 1.00 0.00 H new ATOM 0 HA TRP C 7 7.987 7.250 5.728 1.00 0.00 H new ATOM 0 HB2 TRP C 7 9.734 9.651 6.312 1.00 0.00 H new ATOM 0 HB3 TRP C 7 10.352 8.157 5.635 1.00 0.00 H new ATOM 0 HD1 TRP C 7 7.104 10.052 4.612 1.00 0.00 H new ATOM 0 HE1 TRP C 7 7.235 10.630 2.093 1.00 0.00 H new ATOM 0 HE3 TRP C 7 11.766 8.222 3.669 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 9.100 10.311 0.017 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 12.664 8.386 1.384 1.00 0.00 H new ATOM 0 HH2 TRP C 7 11.349 9.426 -0.417 1.00 0.00 H new ATOM 3023 N ASN C 8 9.569 8.210 8.501 1.00 0.00 N ATOM 3024 CA ASN C 8 10.167 7.790 9.771 1.00 0.00 C ATOM 3025 C ASN C 8 11.277 8.759 10.193 1.00 0.00 C ATOM 3026 O ASN C 8 11.028 9.708 10.933 1.00 0.00 O ATOM 3027 CB ASN C 8 10.712 6.354 9.703 1.00 0.00 C ATOM 3028 CG ASN C 8 9.845 5.373 10.470 1.00 0.00 C ATOM 3029 OD1 ASN C 8 10.195 5.133 11.729 1.00 0.00 O flip ATOM 3030 ND2 ASN C 8 8.873 4.835 9.940 1.00 0.00 N flip ATOM 0 H ASN C 8 9.679 9.205 8.307 1.00 0.00 H new ATOM 0 HA ASN C 8 9.376 7.808 10.521 1.00 0.00 H new ATOM 0 HB2 ASN C 8 10.776 6.041 8.661 1.00 0.00 H new ATOM 0 HB3 ASN C 8 11.725 6.332 10.106 1.00 0.00 H new ATOM 0 HD21 ASN C 8 8.639 5.047 8.970 1.00 0.00 H new ATOM 0 HD22 ASN C 8 8.302 4.177 10.471 1.00 0.00 H new ATOM 3037 N LYS C 9 12.504 8.507 9.735 1.00 0.00 N ATOM 3038 CA LYS C 9 13.644 9.353 10.084 1.00 0.00 C ATOM 3039 C LYS C 9 13.966 10.392 9.004 1.00 0.00 C ATOM 3040 O LYS C 9 14.111 11.577 9.302 1.00 0.00 O ATOM 3041 CB LYS C 9 14.877 8.488 10.348 1.00 0.00 C ATOM 3042 CG LYS C 9 16.009 9.236 11.034 1.00 0.00 C ATOM 3043 CD LYS C 9 17.022 9.760 10.028 1.00 0.00 C ATOM 3044 CE LYS C 9 18.448 9.555 10.514 1.00 0.00 C ATOM 3045 NZ LYS C 9 19.401 10.495 9.860 1.00 0.00 N ATOM 0 H LYS C 9 12.733 7.724 9.122 1.00 0.00 H new ATOM 0 HA LYS C 9 13.367 9.899 10.986 1.00 0.00 H new ATOM 0 HB2 LYS C 9 14.588 7.637 10.965 1.00 0.00 H new ATOM 0 HB3 LYS C 9 15.239 8.087 9.401 1.00 0.00 H new ATOM 0 HG2 LYS C 9 15.601 10.068 11.608 1.00 0.00 H new ATOM 0 HG3 LYS C 9 16.507 8.574 11.742 1.00 0.00 H new ATOM 0 HD2 LYS C 9 16.885 9.251 9.074 1.00 0.00 H new ATOM 0 HD3 LYS C 9 16.846 10.821 9.852 1.00 0.00 H new ATOM 0 HE2 LYS C 9 18.486 9.693 11.594 1.00 0.00 H new ATOM 0 HE3 LYS C 9 18.756 8.529 10.313 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 20.092 10.832 10.560 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 19.900 10.004 9.090 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 18.878 11.306 9.472 1.00 0.00 H new ATOM 3059 N ILE C 10 14.119 9.939 7.759 1.00 0.00 N ATOM 3060 CA ILE C 10 14.474 10.836 6.656 1.00 0.00 C ATOM 3061 C ILE C 10 13.517 12.024 6.535 1.00 0.00 C ATOM 3062 O ILE C 10 13.953 13.174 6.542 1.00 0.00 O ATOM 3063 CB ILE C 10 14.566 10.080 5.306 1.00 0.00 C ATOM 3064 CG1 ILE C 10 15.461 10.849 4.329 1.00 0.00 C ATOM 3065 CG2 ILE C 10 13.193 9.836 4.700 1.00 0.00 C ATOM 3066 CD1 ILE C 10 14.794 12.058 3.703 1.00 0.00 C ATOM 0 H ILE C 10 14.004 8.962 7.489 1.00 0.00 H new ATOM 0 HA ILE C 10 15.461 11.231 6.897 1.00 0.00 H new ATOM 0 HB ILE C 10 15.011 9.104 5.501 1.00 0.00 H new ATOM 0 HG12 ILE C 10 16.359 11.174 4.854 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.782 10.173 3.537 1.00 0.00 H new ATOM 0 HG21 ILE C 10 13.302 9.304 3.755 1.00 0.00 H new ATOM 0 HG22 ILE C 10 12.593 9.238 5.386 1.00 0.00 H new ATOM 0 HG23 ILE C 10 12.698 10.791 4.524 1.00 0.00 H new ATOM 0 HD11 ILE C 10 15.492 12.548 3.024 1.00 0.00 H new ATOM 0 HD12 ILE C 10 13.911 11.740 3.148 1.00 0.00 H new ATOM 0 HD13 ILE C 10 14.498 12.756 4.486 1.00 0.00 H new ATOM 3078 N LEU C 11 12.221 11.754 6.431 1.00 0.00 N ATOM 3079 CA LEU C 11 11.239 12.819 6.318 1.00 0.00 C ATOM 3080 C LEU C 11 10.809 13.283 7.705 1.00 0.00 C ATOM 3081 O LEU C 11 10.358 14.414 7.885 1.00 0.00 O ATOM 3082 CB LEU C 11 10.030 12.334 5.517 1.00 0.00 C ATOM 3083 CG LEU C 11 10.036 12.687 4.025 1.00 0.00 C ATOM 3084 CD1 LEU C 11 9.713 14.157 3.824 1.00 0.00 C ATOM 3085 CD2 LEU C 11 11.370 12.341 3.376 1.00 0.00 C ATOM 0 H LEU C 11 11.830 10.812 6.423 1.00 0.00 H new ATOM 0 HA LEU C 11 11.688 13.662 5.793 1.00 0.00 H new ATOM 0 HB2 LEU C 11 9.963 11.250 5.615 1.00 0.00 H new ATOM 0 HB3 LEU C 11 9.129 12.751 5.967 1.00 0.00 H new ATOM 0 HG LEU C 11 9.265 12.089 3.540 1.00 0.00 H new ATOM 0 HD11 LEU C 11 9.722 14.389 2.759 1.00 0.00 H new ATOM 0 HD12 LEU C 11 8.726 14.372 4.234 1.00 0.00 H new ATOM 0 HD13 LEU C 11 10.459 14.766 4.334 1.00 0.00 H new ATOM 0 HD21 LEU C 11 11.339 12.604 2.319 1.00 0.00 H new ATOM 0 HD22 LEU C 11 12.168 12.899 3.866 1.00 0.00 H new ATOM 0 HD23 LEU C 11 11.558 11.272 3.479 1.00 0.00 H new ATOM 3097 N SER C 12 10.964 12.394 8.684 1.00 0.00 N ATOM 3098 CA SER C 12 10.607 12.692 10.063 1.00 0.00 C ATOM 3099 C SER C 12 9.141 13.096 10.178 1.00 0.00 C ATOM 3100 O SER C 12 8.505 13.322 9.127 1.00 0.00 O ATOM 3101 CB SER C 12 11.500 13.806 10.613 1.00 0.00 C ATOM 3102 OG SER C 12 11.044 15.080 10.190 1.00 0.00 O ATOM 3103 OXT SER C 12 8.640 13.180 11.318 1.00 0.00 O ATOM 0 H SER C 12 11.338 11.455 8.542 1.00 0.00 H new ATOM 0 HA SER C 12 10.759 11.787 10.652 1.00 0.00 H new ATOM 0 HB2 SER C 12 11.511 13.763 11.702 1.00 0.00 H new ATOM 0 HB3 SER C 12 12.526 13.653 10.277 1.00 0.00 H new ATOM 0 HG SER C 12 11.009 15.106 9.211 1.00 0.00 H new ATOM 3110 N THR D 1 1.756 -11.300 12.497 1.00 0.00 N ATOM 3111 CA THR D 1 1.440 -10.750 11.152 1.00 0.00 C ATOM 3112 C THR D 1 1.620 -11.806 10.067 1.00 0.00 C ATOM 3113 O THR D 1 1.874 -11.483 8.907 1.00 0.00 O ATOM 3114 CB THR D 1 2.360 -9.554 10.883 1.00 0.00 C ATOM 3115 OG1 THR D 1 2.942 -9.084 12.087 1.00 0.00 O ATOM 3116 CG2 THR D 1 1.651 -8.387 10.232 1.00 0.00 C ATOM 0 H1 THR D 1 1.774 -10.527 13.193 1.00 0.00 H new ATOM 0 H2 THR D 1 1.030 -11.993 12.768 1.00 0.00 H new ATOM 0 H3 THR D 1 2.686 -11.765 12.472 1.00 0.00 H new ATOM 0 HA THR D 1 0.397 -10.434 11.133 1.00 0.00 H new ATOM 0 HB THR D 1 3.120 -9.927 10.196 1.00 0.00 H new ATOM 0 HG1 THR D 1 3.527 -8.322 11.892 1.00 0.00 H new ATOM 0 HG21 THR D 1 2.360 -7.575 10.070 1.00 0.00 H new ATOM 0 HG22 THR D 1 1.235 -8.702 9.275 1.00 0.00 H new ATOM 0 HG23 THR D 1 0.847 -8.042 10.881 1.00 0.00 H new ATOM 3126 N ARG D 2 1.482 -13.072 10.449 1.00 0.00 N ATOM 3127 CA ARG D 2 1.623 -14.174 9.506 1.00 0.00 C ATOM 3128 C ARG D 2 0.255 -14.661 9.041 1.00 0.00 C ATOM 3129 O ARG D 2 -0.122 -14.474 7.885 1.00 0.00 O ATOM 3130 CB ARG D 2 2.399 -15.326 10.148 1.00 0.00 C ATOM 3131 CG ARG D 2 3.827 -14.966 10.522 1.00 0.00 C ATOM 3132 CD ARG D 2 4.577 -16.167 11.076 1.00 0.00 C ATOM 3133 NE ARG D 2 5.814 -15.778 11.749 1.00 0.00 N ATOM 3134 CZ ARG D 2 5.863 -15.293 12.988 1.00 0.00 C ATOM 3135 NH1 ARG D 2 4.748 -15.133 13.690 1.00 0.00 N ATOM 3136 NH2 ARG D 2 7.030 -14.967 13.525 1.00 0.00 N ATOM 0 H ARG D 2 1.273 -13.359 11.405 1.00 0.00 H new ATOM 0 HA ARG D 2 2.177 -13.814 8.639 1.00 0.00 H new ATOM 0 HB2 ARG D 2 1.870 -15.655 11.043 1.00 0.00 H new ATOM 0 HB3 ARG D 2 2.415 -16.170 9.459 1.00 0.00 H new ATOM 0 HG2 ARG D 2 4.348 -14.583 9.645 1.00 0.00 H new ATOM 0 HG3 ARG D 2 3.820 -14.167 11.263 1.00 0.00 H new ATOM 0 HD2 ARG D 2 3.936 -16.703 11.777 1.00 0.00 H new ATOM 0 HD3 ARG D 2 4.808 -16.856 10.264 1.00 0.00 H new ATOM 0 HE ARG D 2 6.691 -15.884 11.240 1.00 0.00 H new ATOM 0 HH11 ARG D 2 3.848 -15.382 13.281 1.00 0.00 H new ATOM 0 HH12 ARG D 2 4.792 -14.761 14.639 1.00 0.00 H new ATOM 0 HH21 ARG D 2 7.889 -15.088 12.989 1.00 0.00 H new ATOM 0 HH22 ARG D 2 7.069 -14.595 14.474 1.00 0.00 H new ATOM 3149 N THR D 3 -0.483 -15.281 9.955 1.00 0.00 N ATOM 3150 CA THR D 3 -1.813 -15.794 9.645 1.00 0.00 C ATOM 3151 C THR D 3 -2.903 -14.824 10.102 1.00 0.00 C ATOM 3152 O THR D 3 -4.092 -15.104 9.952 1.00 0.00 O ATOM 3153 CB THR D 3 -2.020 -17.159 10.304 1.00 0.00 C ATOM 3154 OG1 THR D 3 -3.376 -17.560 10.212 1.00 0.00 O ATOM 3155 CG2 THR D 3 -1.632 -17.182 11.767 1.00 0.00 C ATOM 0 H THR D 3 -0.183 -15.441 10.917 1.00 0.00 H new ATOM 0 HA THR D 3 -1.886 -15.902 8.563 1.00 0.00 H new ATOM 0 HB THR D 3 -1.368 -17.844 9.761 1.00 0.00 H new ATOM 0 HG1 THR D 3 -3.891 -16.868 9.748 1.00 0.00 H new ATOM 0 HG21 THR D 3 -1.803 -18.179 12.173 1.00 0.00 H new ATOM 0 HG22 THR D 3 -0.577 -16.925 11.868 1.00 0.00 H new ATOM 0 HG23 THR D 3 -2.235 -16.458 12.315 1.00 0.00 H new ATOM 3163 N LYS D 4 -2.493 -13.687 10.662 1.00 0.00 N ATOM 3164 CA LYS D 4 -3.439 -12.684 11.140 1.00 0.00 C ATOM 3165 C LYS D 4 -3.777 -11.667 10.045 1.00 0.00 C ATOM 3166 O LYS D 4 -4.662 -10.830 10.212 1.00 0.00 O ATOM 3167 CB LYS D 4 -2.867 -11.981 12.379 1.00 0.00 C ATOM 3168 CG LYS D 4 -1.840 -10.895 12.075 1.00 0.00 C ATOM 3169 CD LYS D 4 -2.189 -9.559 12.732 1.00 0.00 C ATOM 3170 CE LYS D 4 -3.665 -9.195 12.594 1.00 0.00 C ATOM 3171 NZ LYS D 4 -3.930 -7.784 12.990 1.00 0.00 N ATOM 0 H LYS D 4 -1.513 -13.439 10.795 1.00 0.00 H new ATOM 0 HA LYS D 4 -4.367 -13.187 11.413 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -3.689 -11.538 12.941 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -2.406 -12.729 13.024 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -0.859 -11.221 12.420 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -1.769 -10.758 10.996 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -1.928 -9.601 13.789 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -1.583 -8.771 12.285 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -3.981 -9.348 11.562 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -4.263 -9.864 13.213 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -4.248 -7.755 13.980 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -3.058 -7.226 12.890 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -4.669 -7.384 12.377 1.00 0.00 H new ATOM 3185 N ILE D 5 -3.057 -11.753 8.924 1.00 0.00 N ATOM 3186 CA ILE D 5 -3.246 -10.859 7.776 1.00 0.00 C ATOM 3187 C ILE D 5 -3.288 -9.380 8.174 1.00 0.00 C ATOM 3188 O ILE D 5 -3.622 -8.519 7.366 1.00 0.00 O ATOM 3189 CB ILE D 5 -4.491 -11.208 6.919 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -5.578 -11.936 7.722 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -4.074 -12.052 5.723 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -5.171 -13.318 8.184 1.00 0.00 C ATOM 0 H ILE D 5 -2.323 -12.447 8.785 1.00 0.00 H new ATOM 0 HA ILE D 5 -2.363 -11.024 7.159 1.00 0.00 H new ATOM 0 HB ILE D 5 -4.923 -10.266 6.580 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -5.839 -11.334 8.592 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -6.476 -12.017 7.110 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -4.952 -12.294 5.125 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -3.363 -11.494 5.114 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -3.608 -12.973 6.073 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -5.989 -13.770 8.744 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -4.939 -13.937 7.318 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -4.291 -13.244 8.823 1.00 0.00 H new ATOM 3204 N ASP D 6 -2.899 -9.094 9.405 1.00 0.00 N ATOM 3205 CA ASP D 6 -2.833 -7.725 9.919 1.00 0.00 C ATOM 3206 C ASP D 6 -4.063 -6.866 9.601 1.00 0.00 C ATOM 3207 O ASP D 6 -3.917 -5.683 9.294 1.00 0.00 O ATOM 3208 CB ASP D 6 -1.583 -7.030 9.377 1.00 0.00 C ATOM 3209 CG ASP D 6 -1.178 -5.833 10.214 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -1.665 -5.716 11.358 1.00 0.00 O ATOM 3211 OD2 ASP D 6 -0.372 -5.012 9.726 1.00 0.00 O ATOM 0 H ASP D 6 -2.618 -9.803 10.083 1.00 0.00 H new ATOM 0 HA ASP D 6 -2.798 -7.819 11.004 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -0.759 -7.743 9.345 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -1.765 -6.708 8.352 1.00 0.00 H new ATOM 3216 N TRP D 7 -5.270 -7.419 9.711 1.00 0.00 N ATOM 3217 CA TRP D 7 -6.466 -6.613 9.466 1.00 0.00 C ATOM 3218 C TRP D 7 -6.746 -5.758 10.694 1.00 0.00 C ATOM 3219 O TRP D 7 -6.579 -4.540 10.668 1.00 0.00 O ATOM 3220 CB TRP D 7 -7.690 -7.482 9.176 1.00 0.00 C ATOM 3221 CG TRP D 7 -7.646 -8.190 7.859 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -6.593 -8.864 7.330 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -8.709 -8.296 6.906 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -6.938 -9.403 6.112 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -8.233 -9.066 5.831 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -10.017 -7.822 6.861 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -9.020 -9.375 4.727 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -10.800 -8.125 5.764 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -10.300 -8.898 4.711 1.00 0.00 C ATOM 0 H TRP D 7 -5.445 -8.392 9.961 1.00 0.00 H new ATOM 0 HA TRP D 7 -6.280 -5.991 8.591 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.791 -8.222 9.970 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -8.581 -6.856 9.209 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -5.625 -8.963 7.798 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -6.328 -9.962 5.516 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -10.413 -7.227 7.671 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -8.634 -9.970 3.913 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -11.815 -7.759 5.719 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -10.938 -9.122 3.869 1.00 0.00 H new ATOM 3240 N ASN D 8 -7.148 -6.430 11.778 1.00 0.00 N ATOM 3241 CA ASN D 8 -7.440 -5.785 13.061 1.00 0.00 C ATOM 3242 C ASN D 8 -8.401 -6.644 13.891 1.00 0.00 C ATOM 3243 O ASN D 8 -7.967 -7.457 14.704 1.00 0.00 O ATOM 3244 CB ASN D 8 -8.015 -4.372 12.876 1.00 0.00 C ATOM 3245 CG ASN D 8 -7.013 -3.292 13.241 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -7.064 -2.832 14.485 1.00 0.00 O flip ATOM 3247 ND2 ASN D 8 -6.202 -2.874 12.413 1.00 0.00 N flip ATOM 0 H ASN D 8 -7.280 -7.441 11.789 1.00 0.00 H new ATOM 0 HA ASN D 8 -6.495 -5.690 13.596 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -8.326 -4.241 11.840 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -8.907 -4.261 13.493 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -6.197 -3.255 11.467 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -5.536 -2.147 12.674 1.00 0.00 H new ATOM 3254 N LYS D 9 -9.707 -6.449 13.696 1.00 0.00 N ATOM 3255 CA LYS D 9 -10.715 -7.198 14.442 1.00 0.00 C ATOM 3256 C LYS D 9 -11.261 -8.400 13.662 1.00 0.00 C ATOM 3257 O LYS D 9 -11.309 -9.513 14.185 1.00 0.00 O ATOM 3258 CB LYS D 9 -11.871 -6.275 14.833 1.00 0.00 C ATOM 3259 CG LYS D 9 -12.795 -6.871 15.883 1.00 0.00 C ATOM 3260 CD LYS D 9 -14.006 -7.539 15.248 1.00 0.00 C ATOM 3261 CE LYS D 9 -15.282 -7.223 16.012 1.00 0.00 C ATOM 3262 NZ LYS D 9 -16.341 -8.242 15.770 1.00 0.00 N ATOM 0 H LYS D 9 -10.089 -5.779 13.028 1.00 0.00 H new ATOM 0 HA LYS D 9 -10.223 -7.586 15.334 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -11.465 -5.336 15.209 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -12.452 -6.037 13.942 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -12.247 -7.601 16.479 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -13.126 -6.087 16.564 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -14.107 -7.205 14.215 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -13.855 -8.618 15.221 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -15.063 -7.173 17.079 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -15.649 -6.240 15.715 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -16.864 -8.415 16.652 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -16.997 -7.895 15.041 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -15.903 -9.128 15.448 1.00 0.00 H new ATOM 3276 N ILE D 10 -11.709 -8.165 12.428 1.00 0.00 N ATOM 3277 CA ILE D 10 -12.294 -9.229 11.611 1.00 0.00 C ATOM 3278 C ILE D 10 -11.368 -10.441 11.475 1.00 0.00 C ATOM 3279 O ILE D 10 -11.768 -11.565 11.782 1.00 0.00 O ATOM 3280 CB ILE D 10 -12.714 -8.716 10.210 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -13.798 -9.623 9.616 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -11.527 -8.608 9.268 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -13.271 -10.934 9.068 1.00 0.00 C ATOM 0 H ILE D 10 -11.678 -7.252 11.974 1.00 0.00 H new ATOM 0 HA ILE D 10 -13.189 -9.554 12.141 1.00 0.00 H new ATOM 0 HB ILE D 10 -13.121 -7.712 10.332 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -14.542 -9.835 10.384 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -14.309 -9.086 8.817 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -11.865 -8.245 8.297 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -10.797 -7.913 9.681 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -11.067 -9.589 9.149 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -14.098 -11.519 8.666 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -12.550 -10.733 8.276 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -12.786 -11.494 9.868 1.00 0.00 H new ATOM 3295 N LEU D 11 -10.137 -10.221 11.026 1.00 0.00 N ATOM 3296 CA LEU D 11 -9.188 -11.310 10.871 1.00 0.00 C ATOM 3297 C LEU D 11 -8.436 -11.536 12.178 1.00 0.00 C ATOM 3298 O LEU D 11 -7.933 -12.628 12.440 1.00 0.00 O ATOM 3299 CB LEU D 11 -8.211 -10.994 9.739 1.00 0.00 C ATOM 3300 CG LEU D 11 -8.558 -11.598 8.373 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -8.262 -13.088 8.358 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -10.013 -11.340 8.005 1.00 0.00 C ATOM 0 H LEU D 11 -9.777 -9.303 10.765 1.00 0.00 H new ATOM 0 HA LEU D 11 -9.729 -12.222 10.619 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -8.147 -9.911 9.631 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.221 -11.345 10.030 1.00 0.00 H new ATOM 0 HG LEU D 11 -7.933 -11.110 7.625 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -8.515 -13.499 7.381 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -7.203 -13.251 8.557 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -8.856 -13.585 9.125 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -10.226 -11.781 7.031 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -10.663 -11.788 8.756 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -10.193 -10.266 7.964 1.00 0.00 H new ATOM 3314 N SER D 12 -8.376 -10.490 12.998 1.00 0.00 N ATOM 3315 CA SER D 12 -7.702 -10.555 14.285 1.00 0.00 C ATOM 3316 C SER D 12 -6.241 -10.962 14.122 1.00 0.00 C ATOM 3317 O SER D 12 -5.865 -11.380 13.007 1.00 0.00 O ATOM 3318 CB SER D 12 -8.418 -11.539 15.211 1.00 0.00 C ATOM 3319 OG SER D 12 -8.050 -12.876 14.918 1.00 0.00 O ATOM 3320 OXT SER D 12 -5.486 -10.861 15.111 1.00 0.00 O ATOM 0 H SER D 12 -8.791 -9.582 12.789 1.00 0.00 H new ATOM 0 HA SER D 12 -7.732 -9.560 14.729 1.00 0.00 H new ATOM 0 HB2 SER D 12 -8.174 -11.310 16.248 1.00 0.00 H new ATOM 0 HB3 SER D 12 -9.497 -11.424 15.105 1.00 0.00 H new ATOM 0 HG SER D 12 -8.316 -13.095 14.001 1.00 0.00 H new