USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1421 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 81 THR OG1 : rot 81:sc= -1.86! USER MOD Set 1.2: B 85 HIS : no HD1:sc= -0.835 K(o=-2.7,f=-7!) USER MOD Set 2.1: B 62 ASN :FLIP amide:sc= -0.786 F(o=-6.5!,f=-3.2) USER MOD Set 2.2: B 71 GLN : amide:sc= -2.42 K(o=-3.2,f=-4.1!) USER MOD Set 3.1: B 57 MET CE :methyl 142:sc= -2.54 (180deg=-6.84!) USER MOD Set 3.2: B 68 CYS SG : rot 38:sc= -2.45 USER MOD Set 4.1: B 25 HIS : no HE2:sc= -5.64 K(o=-4.8,f=-5.7!) USER MOD Set 4.2: B 26 LYS NZ :NH3+ 172:sc= 0.881 (180deg=0.804) USER MOD Set 5.1: A 81 THR OG1 : rot 83:sc= -1.85! USER MOD Set 5.2: A 85 HIS : no HD1:sc= -1.12 K(o=-3,f=-7.3!) USER MOD Set 6.1: A 62 ASN :FLIP amide:sc= -0.707 F(o=-6.5!,f=-3.1) USER MOD Set 6.2: A 71 GLN : amide:sc= -2.42 K(o=-3.1,f=-4!) USER MOD Set 7.1: A 57 MET CE :methyl 142:sc= -2.55 (180deg=-6.81!) USER MOD Set 7.2: A 68 CYS SG : rot 37:sc= -2.46 USER MOD Set 8.1: A 25 HIS : no HE2:sc= -5.65 K(o=-4.7,f=-5.7!) USER MOD Set 8.2: A 26 LYS NZ :NH3+ 173:sc= 0.906 (180deg=0.811) USER MOD Single : A 1 SER N :NH3+ 170:sc= -0.0398 (180deg=-0.186) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0609) USER MOD Single : A 7 MET CE :methyl 162:sc= -0.0122 (180deg=-0.303) USER MOD Single : A 15 HIS : no HD1:sc= -0.0077 X(o=-0.0077,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 30:sc= -0.834 USER MOD Single : A 18 SER OG : rot -72:sc= 0.989 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.521) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 150:sc= -2.28 (180deg=-3.37) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 38 ASN : amide:sc= -0.121 K(o=-0.12,f=-0.73) USER MOD Single : A 48 LYS NZ :NH3+ -137:sc= -0.365 (180deg=-1.74) USER MOD Single : A 50 GLN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -155:sc= -0.0887 (180deg=-0.438) USER MOD Single : A 59 THR OG1 : rot 60:sc= -0.0968! USER MOD Single : A 74 MET CE :methyl -145:sc= -3.09! (180deg=-5.99!) USER MOD Single : A 79 MET CE :methyl -141:sc= -5.33! (180deg=-8.17!) USER MOD Single : A 82 THR OG1 : rot -88:sc= 0.256 USER MOD Single : A 84 CYS SG : rot -44:sc= -0.142 USER MOD Single : B 1 SER N :NH3+ 171:sc= -0.0629 (180deg=-0.213) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0596) USER MOD Single : B 7 MET CE :methyl 160:sc=-0.00905 (180deg=-0.296) USER MOD Single : B 15 HIS : no HD1:sc= -0.0108 X(o=-0.011,f=0) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 TYR OH : rot 61:sc= -0.785 USER MOD Single : B 18 SER OG : rot -88:sc= 1.01 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.493) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 149:sc= -2.21 (180deg=-3.38) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.00014) USER MOD Single : B 38 ASN : amide:sc= -0.17 K(o=-0.17,f=-0.71) USER MOD Single : B 48 LYS NZ :NH3+ -137:sc= -0.376 (180deg=-1.67) USER MOD Single : B 50 GLN : amide:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : B 55 LYS NZ :NH3+ -155:sc= -0.105 (180deg=-0.469) USER MOD Single : B 59 THR OG1 : rot 61:sc= 0.138! USER MOD Single : B 74 MET CE :methyl -147:sc= -2.94! (180deg=-5.78!) USER MOD Single : B 79 MET CE :methyl -144:sc= -5.12! (180deg=-8.11!) USER MOD Single : B 82 THR OG1 : rot -100:sc= 0.192 USER MOD Single : B 84 CYS SG : rot -41:sc= -0.157 USER MOD Single : C 3 THR OG1 : rot -33:sc= 0.268 USER MOD Single : C 4 LYS NZ :NH3+ 175:sc= 1.14 (180deg=1.1) USER MOD Single : C 8 ASN :FLIP amide:sc= 0.466 F(o=-1.1,f=0.47) USER MOD Single : C 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 12 SER OG : rot -65:sc= 1.18 USER MOD Single : D 1 THR N :NH3+ 172:sc= -0.0537 (180deg=-0.191) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0 USER MOD Single : D 3 THR OG1 : rot -34:sc= 0.323 USER MOD Single : D 4 LYS NZ :NH3+ -174:sc= 1.16 (180deg=1.05) USER MOD Single : D 8 ASN :FLIP amide:sc= 0.333 F(o=-1.1,f=0.33) USER MOD Single : D 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 12 SER OG : rot -64:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -9.620 -4.372 -13.954 1.00 0.00 N ATOM 2 CA SER A 1 -8.714 -5.370 -13.328 1.00 0.00 C ATOM 3 C SER A 1 -7.458 -4.707 -12.769 1.00 0.00 C ATOM 4 O SER A 1 -6.413 -5.344 -12.641 1.00 0.00 O ATOM 5 CB SER A 1 -8.335 -6.411 -14.383 1.00 0.00 C ATOM 6 OG SER A 1 -9.435 -7.250 -14.691 1.00 0.00 O ATOM 0 H1 SER A 1 -10.376 -4.865 -14.470 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.040 -3.772 -13.215 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.079 -3.779 -14.615 1.00 0.00 H new ATOM 0 HA SER A 1 -9.230 -5.846 -12.494 1.00 0.00 H new ATOM 0 HB2 SER A 1 -7.993 -5.908 -15.288 1.00 0.00 H new ATOM 0 HB3 SER A 1 -7.504 -7.015 -14.020 1.00 0.00 H new ATOM 0 HG SER A 1 -9.167 -7.905 -15.369 1.00 0.00 H new ATOM 14 N GLU A 2 -7.567 -3.424 -12.438 1.00 0.00 N ATOM 15 CA GLU A 2 -6.439 -2.676 -11.892 1.00 0.00 C ATOM 16 C GLU A 2 -5.982 -3.274 -10.569 1.00 0.00 C ATOM 17 O GLU A 2 -4.791 -3.295 -10.256 1.00 0.00 O ATOM 18 CB GLU A 2 -6.821 -1.205 -11.701 1.00 0.00 C ATOM 19 CG GLU A 2 -7.836 -0.959 -10.593 1.00 0.00 C ATOM 20 CD GLU A 2 -9.261 -1.237 -11.030 1.00 0.00 C ATOM 21 OE1 GLU A 2 -9.744 -0.546 -11.951 1.00 0.00 O ATOM 22 OE2 GLU A 2 -9.893 -2.146 -10.452 1.00 0.00 O ATOM 0 H GLU A 2 -8.424 -2.881 -12.538 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.613 -2.739 -12.601 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -5.919 -0.633 -11.485 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.224 -0.822 -12.638 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -7.593 -1.590 -9.738 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.759 0.076 -10.259 1.00 0.00 H new ATOM 29 N LEU A 3 -6.946 -3.752 -9.801 1.00 0.00 N ATOM 30 CA LEU A 3 -6.680 -4.356 -8.497 1.00 0.00 C ATOM 31 C LEU A 3 -5.534 -5.363 -8.568 1.00 0.00 C ATOM 32 O LEU A 3 -4.655 -5.379 -7.706 1.00 0.00 O ATOM 33 CB LEU A 3 -7.940 -5.042 -7.963 1.00 0.00 C ATOM 34 CG LEU A 3 -8.737 -5.842 -8.998 1.00 0.00 C ATOM 35 CD1 LEU A 3 -9.296 -7.115 -8.377 1.00 0.00 C ATOM 36 CD2 LEU A 3 -9.857 -4.993 -9.585 1.00 0.00 C ATOM 0 H LEU A 3 -7.933 -3.735 -10.058 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.386 -3.556 -7.817 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.653 -5.712 -7.152 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.593 -4.282 -7.533 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.063 -6.124 -9.807 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -9.859 -7.669 -9.128 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.475 -7.732 -8.010 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -9.954 -6.857 -7.548 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -10.412 -5.579 -10.318 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -10.530 -4.678 -8.788 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -9.432 -4.114 -10.070 1.00 0.00 H new ATOM 48 N GLU A 4 -5.552 -6.203 -9.597 1.00 0.00 N ATOM 49 CA GLU A 4 -4.517 -7.215 -9.775 1.00 0.00 C ATOM 50 C GLU A 4 -3.268 -6.611 -10.405 1.00 0.00 C ATOM 51 O GLU A 4 -2.146 -6.952 -10.030 1.00 0.00 O ATOM 52 CB GLU A 4 -5.041 -8.360 -10.644 1.00 0.00 C ATOM 53 CG GLU A 4 -5.709 -9.470 -9.847 1.00 0.00 C ATOM 54 CD GLU A 4 -7.030 -9.906 -10.449 1.00 0.00 C ATOM 55 OE1 GLU A 4 -7.716 -9.056 -11.055 1.00 0.00 O ATOM 56 OE2 GLU A 4 -7.380 -11.097 -10.313 1.00 0.00 O ATOM 0 H GLU A 4 -6.271 -6.203 -10.320 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.251 -7.606 -8.793 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.755 -7.961 -11.365 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -4.213 -8.781 -11.214 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.038 -10.327 -9.793 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.875 -9.129 -8.825 1.00 0.00 H new ATOM 63 N LYS A 5 -3.468 -5.714 -11.364 1.00 0.00 N ATOM 64 CA LYS A 5 -2.356 -5.064 -12.045 1.00 0.00 C ATOM 65 C LYS A 5 -1.487 -4.296 -11.053 1.00 0.00 C ATOM 66 O LYS A 5 -0.265 -4.433 -11.049 1.00 0.00 O ATOM 67 CB LYS A 5 -2.877 -4.116 -13.128 1.00 0.00 C ATOM 68 CG LYS A 5 -2.868 -4.724 -14.523 1.00 0.00 C ATOM 69 CD LYS A 5 -4.276 -4.874 -15.077 1.00 0.00 C ATOM 70 CE LYS A 5 -4.884 -3.525 -15.422 1.00 0.00 C ATOM 71 NZ LYS A 5 -6.159 -3.667 -16.179 1.00 0.00 N ATOM 0 H LYS A 5 -4.390 -5.421 -11.687 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.746 -5.837 -12.513 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.894 -3.816 -12.878 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.269 -3.211 -13.131 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.279 -4.096 -15.191 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.383 -5.699 -14.492 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.253 -5.503 -15.967 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.904 -5.381 -14.345 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.067 -2.964 -14.505 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.173 -2.947 -16.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.462 -2.735 -16.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -6.014 -4.307 -16.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -6.892 -4.059 -15.554 1.00 0.00 H new ATOM 85 N ALA A 6 -2.129 -3.488 -10.214 1.00 0.00 N ATOM 86 CA ALA A 6 -1.416 -2.697 -9.217 1.00 0.00 C ATOM 87 C ALA A 6 -0.735 -3.589 -8.188 1.00 0.00 C ATOM 88 O ALA A 6 0.440 -3.403 -7.872 1.00 0.00 O ATOM 89 CB ALA A 6 -2.373 -1.733 -8.532 1.00 0.00 C ATOM 0 H ALA A 6 -3.141 -3.364 -10.205 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.641 -2.126 -9.728 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.830 -1.148 -7.790 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.809 -1.064 -9.274 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.167 -2.296 -8.041 1.00 0.00 H new ATOM 95 N MET A 7 -1.479 -4.558 -7.665 1.00 0.00 N ATOM 96 CA MET A 7 -0.946 -5.478 -6.667 1.00 0.00 C ATOM 97 C MET A 7 0.298 -6.191 -7.188 1.00 0.00 C ATOM 98 O MET A 7 1.327 -6.235 -6.515 1.00 0.00 O ATOM 99 CB MET A 7 -2.008 -6.506 -6.272 1.00 0.00 C ATOM 100 CG MET A 7 -1.852 -7.027 -4.852 1.00 0.00 C ATOM 101 SD MET A 7 -2.119 -5.747 -3.610 1.00 0.00 S ATOM 102 CE MET A 7 -3.585 -6.370 -2.792 1.00 0.00 C ATOM 0 H MET A 7 -2.453 -4.727 -7.916 1.00 0.00 H new ATOM 0 HA MET A 7 -0.667 -4.896 -5.789 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.995 -6.056 -6.379 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.964 -7.346 -6.965 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.559 -7.840 -4.688 1.00 0.00 H new ATOM 0 HG3 MET A 7 -0.852 -7.444 -4.730 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.694 -5.885 -1.822 1.00 0.00 H new ATOM 0 HE2 MET A 7 -4.461 -6.158 -3.404 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.493 -7.447 -2.651 1.00 0.00 H new ATOM 112 N VAL A 8 0.196 -6.751 -8.390 1.00 0.00 N ATOM 113 CA VAL A 8 1.313 -7.465 -8.997 1.00 0.00 C ATOM 114 C VAL A 8 2.333 -6.505 -9.596 1.00 0.00 C ATOM 115 O VAL A 8 3.497 -6.860 -9.768 1.00 0.00 O ATOM 116 CB VAL A 8 0.831 -8.436 -10.093 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.984 -9.291 -10.595 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.303 -9.309 -9.576 1.00 0.00 C ATOM 0 H VAL A 8 -0.648 -6.724 -8.962 1.00 0.00 H new ATOM 0 HA VAL A 8 1.788 -8.034 -8.198 1.00 0.00 H new ATOM 0 HB VAL A 8 0.453 -7.848 -10.930 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.624 -9.970 -11.368 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.760 -8.648 -11.010 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.396 -9.869 -9.768 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.629 -9.987 -10.365 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.045 -9.888 -8.720 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.138 -8.678 -9.272 1.00 0.00 H new ATOM 128 N ALA A 9 1.905 -5.282 -9.898 1.00 0.00 N ATOM 129 CA ALA A 9 2.812 -4.288 -10.456 1.00 0.00 C ATOM 130 C ALA A 9 3.901 -3.978 -9.443 1.00 0.00 C ATOM 131 O ALA A 9 5.076 -3.825 -9.787 1.00 0.00 O ATOM 132 CB ALA A 9 2.056 -3.023 -10.830 1.00 0.00 C ATOM 0 H ALA A 9 0.946 -4.960 -9.767 1.00 0.00 H new ATOM 0 HA ALA A 9 3.267 -4.687 -11.363 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.751 -2.293 -11.245 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.294 -3.261 -11.572 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.581 -2.607 -9.942 1.00 0.00 H new ATOM 138 N LEU A 10 3.493 -3.917 -8.184 1.00 0.00 N ATOM 139 CA LEU A 10 4.411 -3.653 -7.088 1.00 0.00 C ATOM 140 C LEU A 10 5.342 -4.841 -6.900 1.00 0.00 C ATOM 141 O LEU A 10 6.562 -4.692 -6.805 1.00 0.00 O ATOM 142 CB LEU A 10 3.624 -3.404 -5.801 1.00 0.00 C ATOM 143 CG LEU A 10 2.847 -2.088 -5.758 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.531 -2.272 -5.022 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.681 -0.996 -5.099 1.00 0.00 C ATOM 0 H LEU A 10 2.523 -4.048 -7.896 1.00 0.00 H new ATOM 0 HA LEU A 10 5.002 -2.768 -7.322 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.923 -4.226 -5.658 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.317 -3.426 -4.960 1.00 0.00 H new ATOM 0 HG LEU A 10 2.629 -1.783 -6.781 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.991 -1.326 -5.001 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.929 -3.022 -5.535 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.728 -2.601 -4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.112 -0.067 -5.077 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.930 -1.293 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.599 -0.846 -5.668 1.00 0.00 H new ATOM 157 N ILE A 11 4.744 -6.024 -6.855 1.00 0.00 N ATOM 158 CA ILE A 11 5.481 -7.255 -6.683 1.00 0.00 C ATOM 159 C ILE A 11 6.414 -7.506 -7.864 1.00 0.00 C ATOM 160 O ILE A 11 7.546 -7.952 -7.690 1.00 0.00 O ATOM 161 CB ILE A 11 4.517 -8.443 -6.536 1.00 0.00 C ATOM 162 CG1 ILE A 11 3.442 -8.148 -5.487 1.00 0.00 C ATOM 163 CG2 ILE A 11 5.285 -9.682 -6.156 1.00 0.00 C ATOM 164 CD1 ILE A 11 2.202 -9.005 -5.637 1.00 0.00 C ATOM 0 H ILE A 11 3.735 -6.150 -6.937 1.00 0.00 H new ATOM 0 HA ILE A 11 6.079 -7.158 -5.777 1.00 0.00 H new ATOM 0 HB ILE A 11 4.023 -8.606 -7.494 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.863 -8.302 -4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.159 -7.098 -5.554 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.596 -10.520 -6.053 1.00 0.00 H new ATOM 0 HG22 ILE A 11 6.018 -9.908 -6.931 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.798 -9.516 -5.209 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.482 -8.743 -4.861 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.757 -8.833 -6.617 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.473 -10.056 -5.540 1.00 0.00 H new ATOM 176 N ASP A 12 5.934 -7.215 -9.067 1.00 0.00 N ATOM 177 CA ASP A 12 6.730 -7.411 -10.273 1.00 0.00 C ATOM 178 C ASP A 12 8.065 -6.678 -10.169 1.00 0.00 C ATOM 179 O ASP A 12 9.096 -7.177 -10.621 1.00 0.00 O ATOM 180 CB ASP A 12 5.959 -6.925 -11.503 1.00 0.00 C ATOM 181 CG ASP A 12 5.375 -8.070 -12.307 1.00 0.00 C ATOM 182 OD1 ASP A 12 6.121 -9.027 -12.605 1.00 0.00 O ATOM 183 OD2 ASP A 12 4.172 -8.010 -12.640 1.00 0.00 O ATOM 0 H ASP A 12 4.999 -6.843 -9.234 1.00 0.00 H new ATOM 0 HA ASP A 12 6.930 -8.477 -10.378 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.156 -6.260 -11.186 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.624 -6.340 -12.138 1.00 0.00 H new ATOM 188 N VAL A 13 8.036 -5.490 -9.574 1.00 0.00 N ATOM 189 CA VAL A 13 9.243 -4.685 -9.413 1.00 0.00 C ATOM 190 C VAL A 13 10.271 -5.378 -8.516 1.00 0.00 C ATOM 191 O VAL A 13 11.416 -5.584 -8.917 1.00 0.00 O ATOM 192 CB VAL A 13 8.916 -3.298 -8.826 1.00 0.00 C ATOM 193 CG1 VAL A 13 10.152 -2.412 -8.825 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.781 -2.642 -9.603 1.00 0.00 C ATOM 0 H VAL A 13 7.191 -5.063 -9.195 1.00 0.00 H new ATOM 0 HA VAL A 13 9.670 -4.564 -10.409 1.00 0.00 H new ATOM 0 HB VAL A 13 8.591 -3.429 -7.794 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.901 -1.437 -8.407 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.932 -2.876 -8.221 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.511 -2.287 -9.847 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.564 -1.664 -9.174 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.075 -2.524 -10.646 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.891 -3.269 -9.546 1.00 0.00 H new ATOM 204 N PHE A 14 9.858 -5.727 -7.299 1.00 0.00 N ATOM 205 CA PHE A 14 10.752 -6.384 -6.345 1.00 0.00 C ATOM 206 C PHE A 14 11.024 -7.835 -6.746 1.00 0.00 C ATOM 207 O PHE A 14 12.082 -8.385 -6.436 1.00 0.00 O ATOM 208 CB PHE A 14 10.162 -6.295 -4.926 1.00 0.00 C ATOM 209 CG PHE A 14 9.829 -7.619 -4.293 1.00 0.00 C ATOM 210 CD1 PHE A 14 8.910 -8.469 -4.882 1.00 0.00 C ATOM 211 CD2 PHE A 14 10.441 -8.015 -3.114 1.00 0.00 C ATOM 212 CE1 PHE A 14 8.605 -9.686 -4.315 1.00 0.00 C ATOM 213 CE2 PHE A 14 10.139 -9.235 -2.542 1.00 0.00 C ATOM 214 CZ PHE A 14 9.221 -10.072 -3.142 1.00 0.00 C ATOM 0 H PHE A 14 8.913 -5.567 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 14 11.711 -5.865 -6.354 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.872 -5.771 -4.286 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.257 -5.688 -4.962 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.425 -8.173 -5.800 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.160 -7.364 -2.639 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.885 -10.338 -4.787 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.622 -9.534 -1.624 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.985 -11.026 -2.695 1.00 0.00 H new ATOM 224 N HIS A 15 10.068 -8.451 -7.432 1.00 0.00 N ATOM 225 CA HIS A 15 10.214 -9.836 -7.866 1.00 0.00 C ATOM 226 C HIS A 15 11.249 -9.959 -8.979 1.00 0.00 C ATOM 227 O HIS A 15 11.794 -11.039 -9.215 1.00 0.00 O ATOM 228 CB HIS A 15 8.868 -10.391 -8.340 1.00 0.00 C ATOM 229 CG HIS A 15 8.823 -11.886 -8.394 1.00 0.00 C ATOM 230 ND1 HIS A 15 8.420 -12.588 -9.510 1.00 0.00 N ATOM 231 CD2 HIS A 15 9.129 -12.817 -7.458 1.00 0.00 C ATOM 232 CE1 HIS A 15 8.479 -13.884 -9.259 1.00 0.00 C ATOM 233 NE2 HIS A 15 8.907 -14.049 -8.021 1.00 0.00 N ATOM 0 H HIS A 15 9.186 -8.015 -7.699 1.00 0.00 H new ATOM 0 HA HIS A 15 10.560 -10.419 -7.012 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.083 -10.036 -7.673 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.649 -9.993 -9.331 1.00 0.00 H new ATOM 0 HD2 HIS A 15 9.482 -12.625 -6.455 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.221 -14.674 -9.949 1.00 0.00 H new ATOM 0 HE2 HIS A 15 9.050 -14.947 -7.558 1.00 0.00 H new ATOM 242 N GLN A 16 11.524 -8.851 -9.660 1.00 0.00 N ATOM 243 CA GLN A 16 12.499 -8.844 -10.741 1.00 0.00 C ATOM 244 C GLN A 16 13.907 -8.662 -10.192 1.00 0.00 C ATOM 245 O GLN A 16 14.851 -9.312 -10.643 1.00 0.00 O ATOM 246 CB GLN A 16 12.178 -7.732 -11.741 1.00 0.00 C ATOM 247 CG GLN A 16 12.742 -7.982 -13.130 1.00 0.00 C ATOM 248 CD GLN A 16 11.673 -8.369 -14.133 1.00 0.00 C ATOM 249 OE1 GLN A 16 11.538 -9.538 -14.495 1.00 0.00 O ATOM 250 NE2 GLN A 16 10.905 -7.386 -14.588 1.00 0.00 N ATOM 0 H GLN A 16 11.085 -7.948 -9.481 1.00 0.00 H new ATOM 0 HA GLN A 16 12.447 -9.804 -11.254 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.096 -7.620 -11.812 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.572 -6.789 -11.362 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.253 -7.084 -13.478 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.489 -8.774 -13.077 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.052 -6.431 -14.261 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.168 -7.586 -15.265 1.00 0.00 H new ATOM 259 N TYR A 17 14.044 -7.771 -9.215 1.00 0.00 N ATOM 260 CA TYR A 17 15.341 -7.500 -8.607 1.00 0.00 C ATOM 261 C TYR A 17 15.671 -8.521 -7.522 1.00 0.00 C ATOM 262 O TYR A 17 16.702 -9.190 -7.580 1.00 0.00 O ATOM 263 CB TYR A 17 15.369 -6.087 -8.024 1.00 0.00 C ATOM 264 CG TYR A 17 16.107 -5.098 -8.897 1.00 0.00 C ATOM 265 CD1 TYR A 17 15.615 -4.744 -10.147 1.00 0.00 C ATOM 266 CD2 TYR A 17 17.296 -4.520 -8.473 1.00 0.00 C ATOM 267 CE1 TYR A 17 16.287 -3.841 -10.950 1.00 0.00 C ATOM 268 CE2 TYR A 17 17.974 -3.617 -9.269 1.00 0.00 C ATOM 269 CZ TYR A 17 17.466 -3.281 -10.506 1.00 0.00 C ATOM 270 OH TYR A 17 18.140 -2.384 -11.302 1.00 0.00 O ATOM 0 H TYR A 17 13.274 -7.225 -8.828 1.00 0.00 H new ATOM 0 HA TYR A 17 16.098 -7.580 -9.387 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.346 -5.741 -7.878 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.839 -6.116 -7.041 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.692 -5.182 -10.498 1.00 0.00 H new ATOM 0 HD2 TYR A 17 17.698 -4.781 -7.505 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.891 -3.576 -11.919 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.898 -3.176 -8.924 1.00 0.00 H new ATOM 0 HH TYR A 17 17.500 -1.899 -11.864 1.00 0.00 H new ATOM 280 N SER A 18 14.792 -8.633 -6.531 1.00 0.00 N ATOM 281 CA SER A 18 14.993 -9.569 -5.429 1.00 0.00 C ATOM 282 C SER A 18 15.337 -10.966 -5.941 1.00 0.00 C ATOM 283 O SER A 18 16.238 -11.623 -5.420 1.00 0.00 O ATOM 284 CB SER A 18 13.739 -9.628 -4.553 1.00 0.00 C ATOM 285 OG SER A 18 12.760 -10.477 -5.123 1.00 0.00 O ATOM 0 H SER A 18 13.933 -8.087 -6.468 1.00 0.00 H new ATOM 0 HA SER A 18 15.833 -9.211 -4.834 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.003 -9.988 -3.558 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.329 -8.625 -4.431 1.00 0.00 H new ATOM 0 HG SER A 18 12.375 -10.047 -5.915 1.00 0.00 H new ATOM 291 N GLY A 19 14.612 -11.412 -6.962 1.00 0.00 N ATOM 292 CA GLY A 19 14.849 -12.729 -7.528 1.00 0.00 C ATOM 293 C GLY A 19 16.318 -13.012 -7.786 1.00 0.00 C ATOM 294 O GLY A 19 16.750 -14.163 -7.748 1.00 0.00 O ATOM 0 H GLY A 19 13.863 -10.884 -7.409 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.453 -13.485 -6.850 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.298 -12.820 -8.464 1.00 0.00 H new ATOM 355 N LYS A 24 15.634 -13.907 -2.635 1.00 0.00 N ATOM 356 CA LYS A 24 14.520 -13.528 -3.499 1.00 0.00 C ATOM 357 C LYS A 24 13.328 -13.063 -2.667 1.00 0.00 C ATOM 358 O LYS A 24 12.291 -13.726 -2.622 1.00 0.00 O ATOM 359 CB LYS A 24 14.115 -14.703 -4.392 1.00 0.00 C ATOM 360 CG LYS A 24 15.288 -15.353 -5.109 1.00 0.00 C ATOM 361 CD LYS A 24 15.373 -16.841 -4.812 1.00 0.00 C ATOM 362 CE LYS A 24 16.663 -17.442 -5.346 1.00 0.00 C ATOM 363 NZ LYS A 24 16.448 -18.797 -5.923 1.00 0.00 N ATOM 0 HA LYS A 24 14.843 -12.702 -4.132 1.00 0.00 H new ATOM 0 HB2 LYS A 24 13.610 -15.454 -3.784 1.00 0.00 H new ATOM 0 HB3 LYS A 24 13.395 -14.355 -5.132 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.187 -15.202 -6.184 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.215 -14.867 -4.804 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.313 -17.002 -3.736 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.520 -17.352 -5.259 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.081 -16.785 -6.109 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.396 -17.502 -4.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 17.352 -19.171 -6.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 16.073 -19.431 -5.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 15.768 -18.736 -6.708 1.00 0.00 H new ATOM 377 N HIS A 25 13.489 -11.921 -2.007 1.00 0.00 N ATOM 378 CA HIS A 25 12.432 -11.363 -1.167 1.00 0.00 C ATOM 379 C HIS A 25 12.876 -10.047 -0.528 1.00 0.00 C ATOM 380 O HIS A 25 12.064 -9.163 -0.263 1.00 0.00 O ATOM 381 CB HIS A 25 12.044 -12.360 -0.077 1.00 0.00 C ATOM 382 CG HIS A 25 10.633 -12.210 0.390 1.00 0.00 C ATOM 383 ND1 HIS A 25 9.852 -13.276 0.778 1.00 0.00 N ATOM 384 CD2 HIS A 25 9.860 -11.108 0.530 1.00 0.00 C ATOM 385 CE1 HIS A 25 8.660 -12.838 1.136 1.00 0.00 C ATOM 386 NE2 HIS A 25 8.637 -11.526 0.995 1.00 0.00 N ATOM 0 H HIS A 25 14.342 -11.362 -2.037 1.00 0.00 H new ATOM 0 HA HIS A 25 11.567 -11.165 -1.800 1.00 0.00 H new ATOM 0 HB2 HIS A 25 12.189 -13.373 -0.453 1.00 0.00 H new ATOM 0 HB3 HIS A 25 12.715 -12.237 0.773 1.00 0.00 H new ATOM 0 HD1 HIS A 25 10.149 -14.252 0.787 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.150 -10.090 0.316 1.00 0.00 H new ATOM 0 HE1 HIS A 25 7.841 -13.450 1.485 1.00 0.00 H new ATOM 395 N LYS A 26 14.172 -9.932 -0.275 1.00 0.00 N ATOM 396 CA LYS A 26 14.739 -8.743 0.340 1.00 0.00 C ATOM 397 C LYS A 26 15.607 -7.991 -0.665 1.00 0.00 C ATOM 398 O LYS A 26 16.055 -8.562 -1.659 1.00 0.00 O ATOM 399 CB LYS A 26 15.570 -9.142 1.559 1.00 0.00 C ATOM 400 CG LYS A 26 14.918 -8.796 2.890 1.00 0.00 C ATOM 401 CD LYS A 26 14.326 -10.026 3.557 1.00 0.00 C ATOM 402 CE LYS A 26 13.251 -10.662 2.693 1.00 0.00 C ATOM 403 NZ LYS A 26 11.978 -10.857 3.441 1.00 0.00 N ATOM 0 H LYS A 26 14.856 -10.657 -0.490 1.00 0.00 H new ATOM 0 HA LYS A 26 13.929 -8.086 0.658 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.755 -10.216 1.525 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.541 -8.649 1.502 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.657 -8.342 3.551 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.135 -8.055 2.731 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.116 -10.752 3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.903 -9.750 4.523 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.067 -10.033 1.822 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.605 -11.624 2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.237 -11.182 2.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.119 -11.569 4.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.688 -9.957 3.873 1.00 0.00 H new ATOM 417 N LEU A 27 15.843 -6.709 -0.401 1.00 0.00 N ATOM 418 CA LEU A 27 16.655 -5.881 -1.288 1.00 0.00 C ATOM 419 C LEU A 27 17.644 -5.047 -0.493 1.00 0.00 C ATOM 420 O LEU A 27 17.291 -4.431 0.505 1.00 0.00 O ATOM 421 CB LEU A 27 15.792 -4.953 -2.156 1.00 0.00 C ATOM 422 CG LEU A 27 14.720 -5.616 -3.049 1.00 0.00 C ATOM 423 CD1 LEU A 27 15.214 -6.932 -3.635 1.00 0.00 C ATOM 424 CD2 LEU A 27 13.414 -5.823 -2.282 1.00 0.00 C ATOM 0 H LEU A 27 15.484 -6.221 0.419 1.00 0.00 H new ATOM 0 HA LEU A 27 17.197 -6.562 -1.945 1.00 0.00 H new ATOM 0 HB2 LEU A 27 15.291 -4.244 -1.497 1.00 0.00 H new ATOM 0 HB3 LEU A 27 16.457 -4.376 -2.799 1.00 0.00 H new ATOM 0 HG LEU A 27 14.524 -4.936 -3.878 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.433 -7.369 -4.257 1.00 0.00 H new ATOM 0 HD12 LEU A 27 16.102 -6.750 -4.241 1.00 0.00 H new ATOM 0 HD13 LEU A 27 15.461 -7.620 -2.827 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.678 -6.291 -2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.596 -6.466 -1.421 1.00 0.00 H new ATOM 0 HD23 LEU A 27 13.035 -4.859 -1.941 1.00 0.00 H new ATOM 436 N LYS A 28 18.886 -5.033 -0.952 1.00 0.00 N ATOM 437 CA LYS A 28 19.942 -4.281 -0.283 1.00 0.00 C ATOM 438 C LYS A 28 19.965 -2.827 -0.739 1.00 0.00 C ATOM 439 O LYS A 28 19.232 -2.437 -1.647 1.00 0.00 O ATOM 440 CB LYS A 28 21.302 -4.931 -0.543 1.00 0.00 C ATOM 441 CG LYS A 28 21.672 -5.005 -2.015 1.00 0.00 C ATOM 442 CD LYS A 28 22.363 -6.317 -2.351 1.00 0.00 C ATOM 443 CE LYS A 28 23.315 -6.161 -3.525 1.00 0.00 C ATOM 444 NZ LYS A 28 23.358 -7.385 -4.372 1.00 0.00 N ATOM 0 H LYS A 28 19.190 -5.534 -1.787 1.00 0.00 H new ATOM 0 HA LYS A 28 19.734 -4.297 0.787 1.00 0.00 H new ATOM 0 HB2 LYS A 28 22.071 -4.369 -0.012 1.00 0.00 H new ATOM 0 HB3 LYS A 28 21.299 -5.939 -0.127 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.773 -4.900 -2.623 1.00 0.00 H new ATOM 0 HG3 LYS A 28 22.328 -4.172 -2.269 1.00 0.00 H new ATOM 0 HD2 LYS A 28 22.913 -6.673 -1.480 1.00 0.00 H new ATOM 0 HD3 LYS A 28 21.615 -7.074 -2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 28 23.006 -5.310 -4.132 1.00 0.00 H new ATOM 0 HE3 LYS A 28 24.316 -5.941 -3.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 24.019 -7.238 -5.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 23.677 -8.192 -3.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.408 -7.581 -4.747 1.00 0.00 H new ATOM 458 N LYS A 29 20.818 -2.031 -0.100 1.00 0.00 N ATOM 459 CA LYS A 29 20.946 -0.616 -0.432 1.00 0.00 C ATOM 460 C LYS A 29 21.175 -0.427 -1.929 1.00 0.00 C ATOM 461 O LYS A 29 20.813 0.603 -2.495 1.00 0.00 O ATOM 462 CB LYS A 29 22.098 0.011 0.355 1.00 0.00 C ATOM 463 CG LYS A 29 21.850 0.066 1.854 1.00 0.00 C ATOM 464 CD LYS A 29 23.101 -0.298 2.640 1.00 0.00 C ATOM 465 CE LYS A 29 23.041 -1.728 3.152 1.00 0.00 C ATOM 466 NZ LYS A 29 23.574 -2.697 2.155 1.00 0.00 N ATOM 0 H LYS A 29 21.432 -2.343 0.652 1.00 0.00 H new ATOM 0 HA LYS A 29 20.015 -0.118 -0.159 1.00 0.00 H new ATOM 0 HB2 LYS A 29 23.008 -0.558 0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 29 22.272 1.022 -0.014 1.00 0.00 H new ATOM 0 HG2 LYS A 29 21.522 1.067 2.133 1.00 0.00 H new ATOM 0 HG3 LYS A 29 21.043 -0.618 2.116 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.979 -0.174 2.006 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.216 0.386 3.481 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.613 -1.807 4.077 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.009 -1.985 3.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 22.830 -3.378 1.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 23.881 -2.185 1.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 24.384 -3.206 2.564 1.00 0.00 H new ATOM 480 N SER A 30 21.775 -1.430 -2.561 1.00 0.00 N ATOM 481 CA SER A 30 22.047 -1.376 -3.992 1.00 0.00 C ATOM 482 C SER A 30 20.815 -1.786 -4.792 1.00 0.00 C ATOM 483 O SER A 30 20.540 -1.231 -5.856 1.00 0.00 O ATOM 484 CB SER A 30 23.226 -2.285 -4.345 1.00 0.00 C ATOM 485 OG SER A 30 24.462 -1.624 -4.135 1.00 0.00 O ATOM 0 H SER A 30 22.082 -2.289 -2.105 1.00 0.00 H new ATOM 0 HA SER A 30 22.303 -0.348 -4.251 1.00 0.00 H new ATOM 0 HB2 SER A 30 23.186 -3.189 -3.738 1.00 0.00 H new ATOM 0 HB3 SER A 30 23.149 -2.597 -5.387 1.00 0.00 H new ATOM 0 HG SER A 30 25.199 -2.227 -4.366 1.00 0.00 H new ATOM 491 N GLU A 31 20.071 -2.759 -4.270 1.00 0.00 N ATOM 492 CA GLU A 31 18.867 -3.237 -4.937 1.00 0.00 C ATOM 493 C GLU A 31 17.746 -2.210 -4.829 1.00 0.00 C ATOM 494 O GLU A 31 17.295 -1.661 -5.832 1.00 0.00 O ATOM 495 CB GLU A 31 18.417 -4.566 -4.329 1.00 0.00 C ATOM 496 CG GLU A 31 19.330 -5.733 -4.670 1.00 0.00 C ATOM 497 CD GLU A 31 19.065 -6.295 -6.053 1.00 0.00 C ATOM 498 OE1 GLU A 31 17.909 -6.685 -6.323 1.00 0.00 O ATOM 499 OE2 GLU A 31 20.013 -6.344 -6.866 1.00 0.00 O ATOM 0 H GLU A 31 20.282 -3.229 -3.390 1.00 0.00 H new ATOM 0 HA GLU A 31 19.099 -3.388 -5.991 1.00 0.00 H new ATOM 0 HB2 GLU A 31 18.365 -4.461 -3.245 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.409 -4.791 -4.676 1.00 0.00 H new ATOM 0 HG2 GLU A 31 20.368 -5.408 -4.607 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.197 -6.522 -3.930 1.00 0.00 H new ATOM 506 N LEU A 32 17.302 -1.953 -3.601 1.00 0.00 N ATOM 507 CA LEU A 32 16.232 -0.989 -3.355 1.00 0.00 C ATOM 508 C LEU A 32 16.490 0.322 -4.094 1.00 0.00 C ATOM 509 O LEU A 32 15.597 0.862 -4.749 1.00 0.00 O ATOM 510 CB LEU A 32 16.092 -0.728 -1.852 1.00 0.00 C ATOM 511 CG LEU A 32 15.017 0.290 -1.455 1.00 0.00 C ATOM 512 CD1 LEU A 32 15.525 1.710 -1.653 1.00 0.00 C ATOM 513 CD2 LEU A 32 13.738 0.063 -2.250 1.00 0.00 C ATOM 0 H LEU A 32 17.667 -2.399 -2.760 1.00 0.00 H new ATOM 0 HA LEU A 32 15.302 -1.413 -3.733 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.873 -1.673 -1.356 1.00 0.00 H new ATOM 0 HB3 LEU A 32 17.053 -0.383 -1.470 1.00 0.00 H new ATOM 0 HG LEU A 32 14.790 0.150 -0.398 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.748 2.418 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.408 1.870 -1.034 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.784 1.861 -2.701 1.00 0.00 H new ATOM 0 HD21 LEU A 32 12.989 0.797 -1.952 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.947 0.170 -3.314 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.361 -0.941 -2.054 1.00 0.00 H new ATOM 525 N LYS A 33 17.715 0.828 -3.989 1.00 0.00 N ATOM 526 CA LYS A 33 18.090 2.074 -4.652 1.00 0.00 C ATOM 527 C LYS A 33 17.821 1.996 -6.151 1.00 0.00 C ATOM 528 O LYS A 33 17.388 2.970 -6.767 1.00 0.00 O ATOM 529 CB LYS A 33 19.573 2.380 -4.413 1.00 0.00 C ATOM 530 CG LYS A 33 19.867 3.120 -3.114 1.00 0.00 C ATOM 531 CD LYS A 33 18.847 2.806 -2.029 1.00 0.00 C ATOM 532 CE LYS A 33 19.269 3.383 -0.686 1.00 0.00 C ATOM 533 NZ LYS A 33 20.445 2.669 -0.116 1.00 0.00 N ATOM 0 H LYS A 33 18.466 0.395 -3.451 1.00 0.00 H new ATOM 0 HA LYS A 33 17.483 2.874 -4.228 1.00 0.00 H new ATOM 0 HB2 LYS A 33 20.129 1.442 -4.415 1.00 0.00 H new ATOM 0 HB3 LYS A 33 19.947 2.974 -5.247 1.00 0.00 H new ATOM 0 HG2 LYS A 33 20.863 2.851 -2.762 1.00 0.00 H new ATOM 0 HG3 LYS A 33 19.875 4.193 -3.303 1.00 0.00 H new ATOM 0 HD2 LYS A 33 17.876 3.212 -2.312 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.728 1.726 -1.941 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.509 4.440 -0.805 1.00 0.00 H new ATOM 0 HE3 LYS A 33 18.435 3.322 0.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.002 3.327 0.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.118 1.878 0.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.037 2.303 -0.889 1.00 0.00 H new ATOM 547 N GLU A 34 18.090 0.831 -6.732 1.00 0.00 N ATOM 548 CA GLU A 34 17.886 0.628 -8.160 1.00 0.00 C ATOM 549 C GLU A 34 16.416 0.780 -8.540 1.00 0.00 C ATOM 550 O GLU A 34 16.070 1.619 -9.368 1.00 0.00 O ATOM 551 CB GLU A 34 18.392 -0.753 -8.580 1.00 0.00 C ATOM 552 CG GLU A 34 19.908 -0.876 -8.570 1.00 0.00 C ATOM 553 CD GLU A 34 20.493 -0.991 -9.963 1.00 0.00 C ATOM 554 OE1 GLU A 34 20.099 -0.193 -10.840 1.00 0.00 O ATOM 555 OE2 GLU A 34 21.344 -1.880 -10.179 1.00 0.00 O ATOM 0 H GLU A 34 18.449 0.015 -6.236 1.00 0.00 H new ATOM 0 HA GLU A 34 18.454 1.394 -8.687 1.00 0.00 H new ATOM 0 HB2 GLU A 34 17.971 -1.504 -7.911 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.024 -0.976 -9.582 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.336 -0.007 -8.071 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.194 -1.751 -7.987 1.00 0.00 H new ATOM 562 N LEU A 35 15.555 -0.041 -7.939 1.00 0.00 N ATOM 563 CA LEU A 35 14.121 0.004 -8.233 1.00 0.00 C ATOM 564 C LEU A 35 13.601 1.423 -8.236 1.00 0.00 C ATOM 565 O LEU A 35 12.735 1.778 -9.031 1.00 0.00 O ATOM 566 CB LEU A 35 13.325 -0.838 -7.235 1.00 0.00 C ATOM 567 CG LEU A 35 13.657 -2.330 -7.238 1.00 0.00 C ATOM 568 CD1 LEU A 35 14.031 -2.795 -8.640 1.00 0.00 C ATOM 569 CD2 LEU A 35 14.780 -2.613 -6.253 1.00 0.00 C ATOM 0 H LEU A 35 15.823 -0.742 -7.249 1.00 0.00 H new ATOM 0 HA LEU A 35 13.987 -0.415 -9.230 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.497 -0.445 -6.233 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.263 -0.717 -7.447 1.00 0.00 H new ATOM 0 HG LEU A 35 12.774 -2.888 -6.927 1.00 0.00 H new ATOM 0 HD11 LEU A 35 14.264 -3.860 -8.620 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.195 -2.619 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.902 -2.240 -8.987 1.00 0.00 H new ATOM 0 HD21 LEU A 35 15.011 -3.678 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.667 -2.047 -6.540 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.469 -2.317 -5.251 1.00 0.00 H new ATOM 581 N ILE A 36 14.147 2.239 -7.358 1.00 0.00 N ATOM 582 CA ILE A 36 13.742 3.633 -7.285 1.00 0.00 C ATOM 583 C ILE A 36 13.943 4.284 -8.648 1.00 0.00 C ATOM 584 O ILE A 36 12.983 4.683 -9.303 1.00 0.00 O ATOM 585 CB ILE A 36 14.519 4.405 -6.191 1.00 0.00 C ATOM 586 CG1 ILE A 36 13.893 4.109 -4.820 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.535 5.905 -6.483 1.00 0.00 C ATOM 588 CD1 ILE A 36 13.981 5.253 -3.831 1.00 0.00 C ATOM 0 H ILE A 36 14.867 1.967 -6.689 1.00 0.00 H new ATOM 0 HA ILE A 36 12.688 3.671 -7.010 1.00 0.00 H new ATOM 0 HB ILE A 36 15.556 4.070 -6.185 1.00 0.00 H new ATOM 0 HG12 ILE A 36 12.844 3.848 -4.962 1.00 0.00 H new ATOM 0 HG13 ILE A 36 14.384 3.236 -4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 36 15.087 6.422 -5.699 1.00 0.00 H new ATOM 0 HG22 ILE A 36 15.017 6.083 -7.444 1.00 0.00 H new ATOM 0 HG23 ILE A 36 13.512 6.280 -6.515 1.00 0.00 H new ATOM 0 HD11 ILE A 36 13.515 4.958 -2.891 1.00 0.00 H new ATOM 0 HD12 ILE A 36 15.027 5.502 -3.655 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.464 6.123 -4.235 1.00 0.00 H new ATOM 600 N ASN A 37 15.193 4.351 -9.085 1.00 0.00 N ATOM 601 CA ASN A 37 15.510 4.919 -10.388 1.00 0.00 C ATOM 602 C ASN A 37 15.046 3.984 -11.509 1.00 0.00 C ATOM 603 O ASN A 37 15.036 4.364 -12.680 1.00 0.00 O ATOM 604 CB ASN A 37 17.015 5.172 -10.508 1.00 0.00 C ATOM 605 CG ASN A 37 17.458 6.393 -9.726 1.00 0.00 C ATOM 606 OD1 ASN A 37 17.076 7.520 -10.042 1.00 0.00 O ATOM 607 ND2 ASN A 37 18.272 6.175 -8.699 1.00 0.00 N ATOM 0 H ASN A 37 16.002 4.020 -8.558 1.00 0.00 H new ATOM 0 HA ASN A 37 14.984 5.869 -10.484 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.558 4.297 -10.150 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.277 5.301 -11.558 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.605 6.958 -8.137 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.564 5.224 -8.472 1.00 0.00 H new ATOM 614 N ASN A 38 14.663 2.759 -11.141 1.00 0.00 N ATOM 615 CA ASN A 38 14.200 1.773 -12.112 1.00 0.00 C ATOM 616 C ASN A 38 12.683 1.832 -12.282 1.00 0.00 C ATOM 617 O ASN A 38 12.146 1.334 -13.273 1.00 0.00 O ATOM 618 CB ASN A 38 14.620 0.358 -11.687 1.00 0.00 C ATOM 619 CG ASN A 38 14.856 -0.554 -12.876 1.00 0.00 C ATOM 620 OD1 ASN A 38 15.435 -0.144 -13.881 1.00 0.00 O ATOM 621 ND2 ASN A 38 14.408 -1.799 -12.765 1.00 0.00 N ATOM 0 H ASN A 38 14.666 2.429 -10.176 1.00 0.00 H new ATOM 0 HA ASN A 38 14.664 2.011 -13.069 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.530 0.416 -11.090 1.00 0.00 H new ATOM 0 HB3 ASN A 38 13.847 -0.072 -11.050 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.539 -2.458 -13.532 1.00 0.00 H new ATOM 0 HD22 ASN A 38 13.933 -2.096 -11.913 1.00 0.00 H new ATOM 628 N GLU A 39 11.989 2.428 -11.313 1.00 0.00 N ATOM 629 CA GLU A 39 10.534 2.522 -11.380 1.00 0.00 C ATOM 630 C GLU A 39 10.005 3.800 -10.723 1.00 0.00 C ATOM 631 O GLU A 39 9.082 3.749 -9.911 1.00 0.00 O ATOM 632 CB GLU A 39 9.899 1.293 -10.725 1.00 0.00 C ATOM 633 CG GLU A 39 10.077 1.240 -9.215 1.00 0.00 C ATOM 634 CD GLU A 39 8.786 0.927 -8.485 1.00 0.00 C ATOM 635 OE1 GLU A 39 7.854 0.399 -9.127 1.00 0.00 O ATOM 636 OE2 GLU A 39 8.707 1.211 -7.271 1.00 0.00 O ATOM 0 H GLU A 39 12.406 2.848 -10.482 1.00 0.00 H new ATOM 0 HA GLU A 39 10.258 2.560 -12.434 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.834 1.279 -10.956 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.332 0.394 -11.164 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.822 0.484 -8.967 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.465 2.197 -8.865 1.00 0.00 H new ATOM 643 N LEU A 40 10.577 4.944 -11.090 1.00 0.00 N ATOM 644 CA LEU A 40 10.136 6.227 -10.543 1.00 0.00 C ATOM 645 C LEU A 40 10.447 7.365 -11.510 1.00 0.00 C ATOM 646 O LEU A 40 11.498 7.997 -11.423 1.00 0.00 O ATOM 647 CB LEU A 40 10.793 6.506 -9.188 1.00 0.00 C ATOM 648 CG LEU A 40 10.360 5.585 -8.045 1.00 0.00 C ATOM 649 CD1 LEU A 40 11.064 5.974 -6.751 1.00 0.00 C ATOM 650 CD2 LEU A 40 8.847 5.630 -7.863 1.00 0.00 C ATOM 0 H LEU A 40 11.343 5.010 -11.760 1.00 0.00 H new ATOM 0 HA LEU A 40 9.057 6.168 -10.401 1.00 0.00 H new ATOM 0 HB2 LEU A 40 11.874 6.428 -9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.577 7.536 -8.904 1.00 0.00 H new ATOM 0 HG LEU A 40 10.645 4.564 -8.300 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.744 5.309 -5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.143 5.890 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 40 10.809 7.002 -6.493 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.559 4.969 -7.046 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.539 6.649 -7.631 1.00 0.00 H new ATOM 0 HD23 LEU A 40 8.360 5.304 -8.782 1.00 0.00 H new ATOM 779 N LYS A 48 15.231 12.602 -3.538 1.00 0.00 N ATOM 780 CA LYS A 48 15.717 13.945 -3.842 1.00 0.00 C ATOM 781 C LYS A 48 17.244 14.001 -3.846 1.00 0.00 C ATOM 782 O LYS A 48 17.834 14.966 -4.333 1.00 0.00 O ATOM 783 CB LYS A 48 15.156 14.960 -2.839 1.00 0.00 C ATOM 784 CG LYS A 48 15.222 14.498 -1.393 1.00 0.00 C ATOM 785 CD LYS A 48 13.862 14.035 -0.892 1.00 0.00 C ATOM 786 CE LYS A 48 13.993 13.142 0.332 1.00 0.00 C ATOM 787 NZ LYS A 48 14.243 13.930 1.571 1.00 0.00 N ATOM 0 HA LYS A 48 15.367 14.202 -4.842 1.00 0.00 H new ATOM 0 HB2 LYS A 48 15.707 15.895 -2.937 1.00 0.00 H new ATOM 0 HB3 LYS A 48 14.118 15.173 -3.095 1.00 0.00 H new ATOM 0 HG2 LYS A 48 15.941 13.683 -1.303 1.00 0.00 H new ATOM 0 HG3 LYS A 48 15.584 15.313 -0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 48 13.249 14.902 -0.647 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.346 13.494 -1.685 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.082 12.556 0.453 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.809 12.436 0.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 14.978 13.462 2.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 14.560 14.887 1.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 13.366 13.992 2.126 1.00 0.00 H new ATOM 801 N GLU A 49 17.881 12.966 -3.305 1.00 0.00 N ATOM 802 CA GLU A 49 19.336 12.907 -3.254 1.00 0.00 C ATOM 803 C GLU A 49 19.808 11.502 -2.888 1.00 0.00 C ATOM 804 O GLU A 49 19.004 10.631 -2.558 1.00 0.00 O ATOM 805 CB GLU A 49 19.874 13.922 -2.243 1.00 0.00 C ATOM 806 CG GLU A 49 21.048 14.735 -2.764 1.00 0.00 C ATOM 807 CD GLU A 49 21.374 15.920 -1.877 1.00 0.00 C ATOM 808 OE1 GLU A 49 20.443 16.467 -1.250 1.00 0.00 O ATOM 809 OE2 GLU A 49 22.562 16.302 -1.809 1.00 0.00 O ATOM 0 H GLU A 49 17.411 12.158 -2.896 1.00 0.00 H new ATOM 0 HA GLU A 49 19.722 13.154 -4.243 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.070 14.601 -1.959 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.180 13.395 -1.339 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.925 14.092 -2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.822 15.090 -3.770 1.00 0.00 H new ATOM 816 N GLN A 50 21.118 11.287 -2.951 1.00 0.00 N ATOM 817 CA GLN A 50 21.693 9.987 -2.626 1.00 0.00 C ATOM 818 C GLN A 50 21.667 9.741 -1.122 1.00 0.00 C ATOM 819 O GLN A 50 21.461 8.614 -0.667 1.00 0.00 O ATOM 820 CB GLN A 50 23.129 9.898 -3.145 1.00 0.00 C ATOM 821 CG GLN A 50 23.545 8.490 -3.539 1.00 0.00 C ATOM 822 CD GLN A 50 24.986 8.417 -4.003 1.00 0.00 C ATOM 823 OE1 GLN A 50 25.280 7.886 -5.075 1.00 0.00 O ATOM 824 NE2 GLN A 50 25.896 8.952 -3.197 1.00 0.00 N ATOM 0 H GLN A 50 21.800 11.995 -3.224 1.00 0.00 H new ATOM 0 HA GLN A 50 21.090 9.219 -3.111 1.00 0.00 H new ATOM 0 HB2 GLN A 50 23.236 10.555 -4.008 1.00 0.00 H new ATOM 0 HB3 GLN A 50 23.808 10.267 -2.377 1.00 0.00 H new ATOM 0 HG2 GLN A 50 23.407 7.823 -2.688 1.00 0.00 H new ATOM 0 HG3 GLN A 50 22.892 8.131 -4.335 1.00 0.00 H new ATOM 0 HE21 GLN A 50 25.609 9.382 -2.318 1.00 0.00 H new ATOM 0 HE22 GLN A 50 26.882 8.933 -3.457 1.00 0.00 H new ATOM 833 N GLU A 51 21.880 10.803 -0.352 1.00 0.00 N ATOM 834 CA GLU A 51 21.887 10.705 1.102 1.00 0.00 C ATOM 835 C GLU A 51 20.507 10.338 1.642 1.00 0.00 C ATOM 836 O GLU A 51 20.389 9.522 2.556 1.00 0.00 O ATOM 837 CB GLU A 51 22.358 12.021 1.729 1.00 0.00 C ATOM 838 CG GLU A 51 21.786 13.262 1.063 1.00 0.00 C ATOM 839 CD GLU A 51 21.227 14.256 2.063 1.00 0.00 C ATOM 840 OE1 GLU A 51 22.030 14.970 2.701 1.00 0.00 O ATOM 841 OE2 GLU A 51 19.989 14.323 2.207 1.00 0.00 O ATOM 0 H GLU A 51 22.050 11.742 -0.712 1.00 0.00 H new ATOM 0 HA GLU A 51 22.583 9.911 1.374 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.083 12.028 2.784 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.446 12.065 1.683 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.565 13.745 0.473 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.998 12.967 0.370 1.00 0.00 H new ATOM 848 N VAL A 52 19.466 10.946 1.081 1.00 0.00 N ATOM 849 CA VAL A 52 18.103 10.675 1.524 1.00 0.00 C ATOM 850 C VAL A 52 17.718 9.221 1.277 1.00 0.00 C ATOM 851 O VAL A 52 17.068 8.598 2.115 1.00 0.00 O ATOM 852 CB VAL A 52 17.075 11.599 0.836 1.00 0.00 C ATOM 853 CG1 VAL A 52 17.362 13.055 1.169 1.00 0.00 C ATOM 854 CG2 VAL A 52 17.070 11.384 -0.669 1.00 0.00 C ATOM 0 H VAL A 52 19.539 11.625 0.324 1.00 0.00 H new ATOM 0 HA VAL A 52 18.084 10.874 2.595 1.00 0.00 H new ATOM 0 HB VAL A 52 16.085 11.346 1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.628 13.692 0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.302 13.200 2.248 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.362 13.317 0.822 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.337 12.047 -1.129 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.059 11.602 -1.071 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.810 10.348 -0.888 1.00 0.00 H new ATOM 864 N VAL A 53 18.116 8.680 0.126 1.00 0.00 N ATOM 865 CA VAL A 53 17.795 7.294 -0.212 1.00 0.00 C ATOM 866 C VAL A 53 18.249 6.345 0.888 1.00 0.00 C ATOM 867 O VAL A 53 17.446 5.593 1.440 1.00 0.00 O ATOM 868 CB VAL A 53 18.427 6.843 -1.543 1.00 0.00 C ATOM 869 CG1 VAL A 53 17.687 5.629 -2.081 1.00 0.00 C ATOM 870 CG2 VAL A 53 18.438 7.973 -2.564 1.00 0.00 C ATOM 0 H VAL A 53 18.657 9.176 -0.583 1.00 0.00 H new ATOM 0 HA VAL A 53 16.711 7.257 -0.317 1.00 0.00 H new ATOM 0 HB VAL A 53 19.465 6.568 -1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 53 18.139 5.315 -3.022 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.750 4.815 -1.359 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.641 5.885 -2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 53 18.890 7.621 -3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.416 8.297 -2.759 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.016 8.811 -2.173 1.00 0.00 H new ATOM 880 N ASP A 54 19.540 6.386 1.213 1.00 0.00 N ATOM 881 CA ASP A 54 20.084 5.526 2.260 1.00 0.00 C ATOM 882 C ASP A 54 19.232 5.633 3.519 1.00 0.00 C ATOM 883 O ASP A 54 18.957 4.635 4.186 1.00 0.00 O ATOM 884 CB ASP A 54 21.534 5.906 2.567 1.00 0.00 C ATOM 885 CG ASP A 54 22.524 4.898 2.016 1.00 0.00 C ATOM 886 OD1 ASP A 54 22.545 3.753 2.515 1.00 0.00 O ATOM 887 OD2 ASP A 54 23.278 5.253 1.085 1.00 0.00 O ATOM 0 H ASP A 54 20.223 7.000 0.770 1.00 0.00 H new ATOM 0 HA ASP A 54 20.066 4.495 1.908 1.00 0.00 H new ATOM 0 HB2 ASP A 54 21.747 6.888 2.145 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.665 5.988 3.646 1.00 0.00 H new ATOM 892 N LYS A 55 18.799 6.851 3.820 1.00 0.00 N ATOM 893 CA LYS A 55 17.956 7.098 4.977 1.00 0.00 C ATOM 894 C LYS A 55 16.546 6.589 4.704 1.00 0.00 C ATOM 895 O LYS A 55 15.841 6.156 5.614 1.00 0.00 O ATOM 896 CB LYS A 55 17.925 8.591 5.308 1.00 0.00 C ATOM 897 CG LYS A 55 17.890 8.882 6.798 1.00 0.00 C ATOM 898 CD LYS A 55 17.842 10.376 7.074 1.00 0.00 C ATOM 899 CE LYS A 55 19.235 10.949 7.275 1.00 0.00 C ATOM 900 NZ LYS A 55 19.877 10.428 8.514 1.00 0.00 N ATOM 0 H LYS A 55 19.020 7.684 3.275 1.00 0.00 H new ATOM 0 HA LYS A 55 18.368 6.565 5.834 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.803 9.069 4.873 1.00 0.00 H new ATOM 0 HB3 LYS A 55 17.051 9.041 4.838 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.019 8.401 7.243 1.00 0.00 H new ATOM 0 HG3 LYS A 55 18.771 8.451 7.274 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.354 10.885 6.243 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.238 10.564 7.962 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.856 10.704 6.414 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.176 12.036 7.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.590 11.108 8.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.154 10.295 9.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 20.336 9.517 8.311 1.00 0.00 H new ATOM 914 N VAL A 56 16.146 6.629 3.432 1.00 0.00 N ATOM 915 CA VAL A 56 14.830 6.155 3.029 1.00 0.00 C ATOM 916 C VAL A 56 14.721 4.656 3.269 1.00 0.00 C ATOM 917 O VAL A 56 13.866 4.200 4.027 1.00 0.00 O ATOM 918 CB VAL A 56 14.543 6.462 1.543 1.00 0.00 C ATOM 919 CG1 VAL A 56 13.209 5.864 1.117 1.00 0.00 C ATOM 920 CG2 VAL A 56 14.565 7.964 1.291 1.00 0.00 C ATOM 0 H VAL A 56 16.718 6.986 2.666 1.00 0.00 H new ATOM 0 HA VAL A 56 14.091 6.682 3.632 1.00 0.00 H new ATOM 0 HB VAL A 56 15.328 6.003 0.942 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.027 6.092 0.067 1.00 0.00 H new ATOM 0 HG12 VAL A 56 13.234 4.783 1.254 1.00 0.00 H new ATOM 0 HG13 VAL A 56 12.410 6.288 1.725 1.00 0.00 H new ATOM 0 HG21 VAL A 56 14.361 8.159 0.238 1.00 0.00 H new ATOM 0 HG22 VAL A 56 13.804 8.447 1.904 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.546 8.362 1.550 1.00 0.00 H new ATOM 930 N MET A 57 15.605 3.888 2.633 1.00 0.00 N ATOM 931 CA MET A 57 15.606 2.441 2.805 1.00 0.00 C ATOM 932 C MET A 57 15.861 2.091 4.269 1.00 0.00 C ATOM 933 O MET A 57 15.410 1.057 4.762 1.00 0.00 O ATOM 934 CB MET A 57 16.661 1.789 1.903 1.00 0.00 C ATOM 935 CG MET A 57 18.085 1.914 2.427 1.00 0.00 C ATOM 936 SD MET A 57 18.703 0.377 3.141 1.00 0.00 S ATOM 937 CE MET A 57 18.366 -0.780 1.815 1.00 0.00 C ATOM 0 H MET A 57 16.322 4.242 2.000 1.00 0.00 H new ATOM 0 HA MET A 57 14.629 2.054 2.516 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.420 0.733 1.784 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.608 2.242 0.913 1.00 0.00 H new ATOM 0 HG2 MET A 57 18.741 2.221 1.613 1.00 0.00 H new ATOM 0 HG3 MET A 57 18.122 2.701 3.181 1.00 0.00 H new ATOM 0 HE1 MET A 57 19.181 -1.500 1.744 1.00 0.00 H new ATOM 0 HE2 MET A 57 17.434 -1.307 2.020 1.00 0.00 H new ATOM 0 HE3 MET A 57 18.277 -0.238 0.873 1.00 0.00 H new ATOM 947 N GLU A 58 16.582 2.973 4.957 1.00 0.00 N ATOM 948 CA GLU A 58 16.896 2.783 6.366 1.00 0.00 C ATOM 949 C GLU A 58 15.690 3.136 7.231 1.00 0.00 C ATOM 950 O GLU A 58 15.478 2.549 8.292 1.00 0.00 O ATOM 951 CB GLU A 58 18.098 3.649 6.756 1.00 0.00 C ATOM 952 CG GLU A 58 18.484 3.536 8.223 1.00 0.00 C ATOM 953 CD GLU A 58 18.917 4.863 8.815 1.00 0.00 C ATOM 954 OE1 GLU A 58 18.074 5.779 8.899 1.00 0.00 O ATOM 955 OE2 GLU A 58 20.101 4.984 9.195 1.00 0.00 O ATOM 0 H GLU A 58 16.961 3.831 4.556 1.00 0.00 H new ATOM 0 HA GLU A 58 17.146 1.735 6.531 1.00 0.00 H new ATOM 0 HB2 GLU A 58 18.953 3.366 6.142 1.00 0.00 H new ATOM 0 HB3 GLU A 58 17.873 4.691 6.528 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.637 3.149 8.789 1.00 0.00 H new ATOM 0 HG3 GLU A 58 19.294 2.814 8.327 1.00 0.00 H new ATOM 962 N THR A 59 14.900 4.094 6.758 1.00 0.00 N ATOM 963 CA THR A 59 13.704 4.533 7.472 1.00 0.00 C ATOM 964 C THR A 59 12.570 3.522 7.300 1.00 0.00 C ATOM 965 O THR A 59 11.594 3.538 8.049 1.00 0.00 O ATOM 966 CB THR A 59 13.269 5.915 6.967 1.00 0.00 C ATOM 967 OG1 THR A 59 14.225 6.895 7.327 1.00 0.00 O ATOM 968 CG2 THR A 59 11.930 6.369 7.511 1.00 0.00 C ATOM 0 H THR A 59 15.067 4.584 5.879 1.00 0.00 H new ATOM 0 HA THR A 59 13.939 4.603 8.534 1.00 0.00 H new ATOM 0 HB THR A 59 13.183 5.810 5.885 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.093 6.665 6.935 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.689 7.354 7.110 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.158 5.659 7.216 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.978 6.422 8.599 1.00 0.00 H new ATOM 976 N LEU A 60 12.709 2.645 6.309 1.00 0.00 N ATOM 977 CA LEU A 60 11.703 1.626 6.037 1.00 0.00 C ATOM 978 C LEU A 60 12.123 0.268 6.593 1.00 0.00 C ATOM 979 O LEU A 60 11.329 -0.674 6.608 1.00 0.00 O ATOM 980 CB LEU A 60 11.467 1.511 4.533 1.00 0.00 C ATOM 981 CG LEU A 60 10.460 2.505 3.960 1.00 0.00 C ATOM 982 CD1 LEU A 60 10.662 2.662 2.459 1.00 0.00 C ATOM 983 CD2 LEU A 60 9.041 2.054 4.273 1.00 0.00 C ATOM 0 H LEU A 60 13.512 2.621 5.680 1.00 0.00 H new ATOM 0 HA LEU A 60 10.780 1.929 6.531 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.419 1.645 4.020 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.124 0.501 4.310 1.00 0.00 H new ATOM 0 HG LEU A 60 10.622 3.477 4.426 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.936 3.374 2.067 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.670 3.027 2.264 1.00 0.00 H new ATOM 0 HD13 LEU A 60 10.525 1.697 1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.332 2.771 3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.865 1.073 3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.908 1.994 5.353 1.00 0.00 H new ATOM 995 N ASP A 61 13.375 0.171 7.040 1.00 0.00 N ATOM 996 CA ASP A 61 13.911 -1.072 7.591 1.00 0.00 C ATOM 997 C ASP A 61 12.874 -1.807 8.441 1.00 0.00 C ATOM 998 O ASP A 61 12.656 -1.472 9.605 1.00 0.00 O ATOM 999 CB ASP A 61 15.161 -0.778 8.424 1.00 0.00 C ATOM 1000 CG ASP A 61 14.863 0.097 9.627 1.00 0.00 C ATOM 1001 OD1 ASP A 61 13.951 0.945 9.534 1.00 0.00 O ATOM 1002 OD2 ASP A 61 15.543 -0.066 10.662 1.00 0.00 O ATOM 0 H ASP A 61 14.040 0.944 7.031 1.00 0.00 H new ATOM 0 HA ASP A 61 14.175 -1.721 6.756 1.00 0.00 H new ATOM 0 HB2 ASP A 61 15.599 -1.718 8.761 1.00 0.00 H new ATOM 0 HB3 ASP A 61 15.905 -0.287 7.797 1.00 0.00 H new ATOM 1007 N ASN A 62 12.236 -2.811 7.844 1.00 0.00 N ATOM 1008 CA ASN A 62 11.220 -3.595 8.539 1.00 0.00 C ATOM 1009 C ASN A 62 11.850 -4.526 9.574 1.00 0.00 C ATOM 1010 O ASN A 62 11.143 -5.156 10.362 1.00 0.00 O ATOM 1011 CB ASN A 62 10.416 -4.417 7.532 1.00 0.00 C ATOM 1012 CG ASN A 62 9.032 -4.767 8.043 1.00 0.00 C ATOM 1013 OD1 ASN A 62 8.044 -4.721 7.157 1.00 0.00 O flip ATOM 1014 ND2 ASN A 62 8.852 -5.075 9.221 1.00 0.00 N flip ATOM 0 H ASN A 62 12.405 -3.100 6.881 1.00 0.00 H new ATOM 0 HA ASN A 62 10.558 -2.902 9.059 1.00 0.00 H new ATOM 0 HB2 ASN A 62 10.325 -3.858 6.601 1.00 0.00 H new ATOM 0 HB3 ASN A 62 10.958 -5.334 7.301 1.00 0.00 H new ATOM 0 HD21 ASN A 62 9.640 -5.098 9.868 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.915 -5.308 9.550 1.00 0.00 H new ATOM 1021 N ASP A 63 13.179 -4.615 9.559 1.00 0.00 N ATOM 1022 CA ASP A 63 13.911 -5.474 10.488 1.00 0.00 C ATOM 1023 C ASP A 63 13.887 -6.921 10.010 1.00 0.00 C ATOM 1024 O ASP A 63 13.928 -7.853 10.813 1.00 0.00 O ATOM 1025 CB ASP A 63 13.330 -5.377 11.903 1.00 0.00 C ATOM 1026 CG ASP A 63 14.407 -5.300 12.966 1.00 0.00 C ATOM 1027 OD1 ASP A 63 15.360 -4.512 12.790 1.00 0.00 O ATOM 1028 OD2 ASP A 63 14.298 -6.027 13.976 1.00 0.00 O ATOM 0 H ASP A 63 13.773 -4.100 8.910 1.00 0.00 H new ATOM 0 HA ASP A 63 14.945 -5.129 10.518 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.692 -4.496 11.971 1.00 0.00 H new ATOM 0 HB3 ASP A 63 12.697 -6.244 12.093 1.00 0.00 H new ATOM 1033 N GLY A 64 13.821 -7.099 8.694 1.00 0.00 N ATOM 1034 CA GLY A 64 13.795 -8.430 8.124 1.00 0.00 C ATOM 1035 C GLY A 64 15.184 -8.985 7.888 1.00 0.00 C ATOM 1036 O GLY A 64 15.421 -10.180 8.064 1.00 0.00 O ATOM 0 H GLY A 64 13.785 -6.341 8.012 1.00 0.00 H new ATOM 0 HA2 GLY A 64 13.249 -9.097 8.791 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.251 -8.407 7.180 1.00 0.00 H new ATOM 1040 N ASP A 65 16.106 -8.115 7.488 1.00 0.00 N ATOM 1041 CA ASP A 65 17.482 -8.528 7.229 1.00 0.00 C ATOM 1042 C ASP A 65 18.373 -7.321 6.946 1.00 0.00 C ATOM 1043 O ASP A 65 19.267 -7.381 6.103 1.00 0.00 O ATOM 1044 CB ASP A 65 17.528 -9.501 6.048 1.00 0.00 C ATOM 1045 CG ASP A 65 17.526 -10.951 6.492 1.00 0.00 C ATOM 1046 OD1 ASP A 65 18.548 -11.401 7.051 1.00 0.00 O ATOM 1047 OD2 ASP A 65 16.502 -11.635 6.282 1.00 0.00 O ATOM 0 H ASP A 65 15.927 -7.122 7.336 1.00 0.00 H new ATOM 0 HA ASP A 65 17.858 -9.029 8.121 1.00 0.00 H new ATOM 0 HB2 ASP A 65 16.671 -9.321 5.399 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.422 -9.307 5.455 1.00 0.00 H new ATOM 1052 N GLY A 66 18.122 -6.226 7.656 1.00 0.00 N ATOM 1053 CA GLY A 66 18.909 -5.022 7.464 1.00 0.00 C ATOM 1054 C GLY A 66 18.838 -4.498 6.042 1.00 0.00 C ATOM 1055 O GLY A 66 19.682 -3.706 5.623 1.00 0.00 O ATOM 0 H GLY A 66 17.388 -6.151 8.360 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.558 -4.250 8.149 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.948 -5.227 7.720 1.00 0.00 H new ATOM 1059 N GLU A 67 17.829 -4.942 5.299 1.00 0.00 N ATOM 1060 CA GLU A 67 17.644 -4.520 3.924 1.00 0.00 C ATOM 1061 C GLU A 67 16.157 -4.289 3.654 1.00 0.00 C ATOM 1062 O GLU A 67 15.346 -4.338 4.578 1.00 0.00 O ATOM 1063 CB GLU A 67 18.241 -5.553 2.972 1.00 0.00 C ATOM 1064 CG GLU A 67 17.429 -6.825 2.866 1.00 0.00 C ATOM 1065 CD GLU A 67 18.282 -8.072 3.003 1.00 0.00 C ATOM 1066 OE1 GLU A 67 19.508 -7.979 2.782 1.00 0.00 O ATOM 1067 OE2 GLU A 67 17.725 -9.141 3.329 1.00 0.00 O ATOM 0 H GLU A 67 17.124 -5.599 5.634 1.00 0.00 H new ATOM 0 HA GLU A 67 18.167 -3.579 3.754 1.00 0.00 H new ATOM 0 HB2 GLU A 67 18.335 -5.109 1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 67 19.248 -5.802 3.306 1.00 0.00 H new ATOM 0 HG2 GLU A 67 16.661 -6.827 3.639 1.00 0.00 H new ATOM 0 HG3 GLU A 67 16.914 -6.845 1.905 1.00 0.00 H new ATOM 1074 N CYS A 68 15.800 -4.006 2.407 1.00 0.00 N ATOM 1075 CA CYS A 68 14.404 -3.736 2.073 1.00 0.00 C ATOM 1076 C CYS A 68 13.776 -4.856 1.254 1.00 0.00 C ATOM 1077 O CYS A 68 14.204 -5.126 0.141 1.00 0.00 O ATOM 1078 CB CYS A 68 14.298 -2.423 1.298 1.00 0.00 C ATOM 1079 SG CYS A 68 14.412 -0.943 2.331 1.00 0.00 S ATOM 0 H CYS A 68 16.446 -3.957 1.619 1.00 0.00 H new ATOM 0 HA CYS A 68 13.858 -3.666 3.014 1.00 0.00 H new ATOM 0 HB2 CYS A 68 15.089 -2.391 0.548 1.00 0.00 H new ATOM 0 HB3 CYS A 68 13.349 -2.406 0.761 1.00 0.00 H new ATOM 0 HG CYS A 68 15.280 -1.141 3.279 1.00 0.00 H new ATOM 1085 N ASP A 69 12.738 -5.480 1.800 1.00 0.00 N ATOM 1086 CA ASP A 69 12.032 -6.552 1.099 1.00 0.00 C ATOM 1087 C ASP A 69 10.737 -6.011 0.494 1.00 0.00 C ATOM 1088 O ASP A 69 10.535 -4.799 0.435 1.00 0.00 O ATOM 1089 CB ASP A 69 11.739 -7.735 2.033 1.00 0.00 C ATOM 1090 CG ASP A 69 11.837 -7.381 3.506 1.00 0.00 C ATOM 1091 OD1 ASP A 69 11.457 -6.249 3.872 1.00 0.00 O ATOM 1092 OD2 ASP A 69 12.290 -8.237 4.293 1.00 0.00 O ATOM 0 H ASP A 69 12.365 -5.264 2.725 1.00 0.00 H new ATOM 0 HA ASP A 69 12.675 -6.918 0.299 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.738 -8.114 1.824 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.438 -8.543 1.814 1.00 0.00 H new ATOM 1097 N PHE A 70 9.861 -6.900 0.041 1.00 0.00 N ATOM 1098 CA PHE A 70 8.595 -6.477 -0.554 1.00 0.00 C ATOM 1099 C PHE A 70 7.628 -5.964 0.511 1.00 0.00 C ATOM 1100 O PHE A 70 6.606 -5.358 0.194 1.00 0.00 O ATOM 1101 CB PHE A 70 7.972 -7.638 -1.349 1.00 0.00 C ATOM 1102 CG PHE A 70 6.467 -7.684 -1.345 1.00 0.00 C ATOM 1103 CD1 PHE A 70 5.782 -8.300 -0.310 1.00 0.00 C ATOM 1104 CD2 PHE A 70 5.743 -7.123 -2.384 1.00 0.00 C ATOM 1105 CE1 PHE A 70 4.401 -8.356 -0.312 1.00 0.00 C ATOM 1106 CE2 PHE A 70 4.363 -7.173 -2.391 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.690 -7.791 -1.354 1.00 0.00 C ATOM 0 H PHE A 70 10.000 -7.910 0.073 1.00 0.00 H new ATOM 0 HA PHE A 70 8.795 -5.653 -1.238 1.00 0.00 H new ATOM 0 HB2 PHE A 70 8.315 -7.575 -2.382 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.349 -8.577 -0.945 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.333 -8.741 0.507 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.264 -6.641 -3.198 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.878 -8.840 0.499 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.810 -6.730 -3.206 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.611 -7.832 -1.358 1.00 0.00 H new ATOM 1117 N GLN A 71 7.952 -6.214 1.770 1.00 0.00 N ATOM 1118 CA GLN A 71 7.099 -5.781 2.872 1.00 0.00 C ATOM 1119 C GLN A 71 7.344 -4.319 3.245 1.00 0.00 C ATOM 1120 O GLN A 71 6.435 -3.631 3.711 1.00 0.00 O ATOM 1121 CB GLN A 71 7.325 -6.672 4.095 1.00 0.00 C ATOM 1122 CG GLN A 71 8.733 -6.585 4.658 1.00 0.00 C ATOM 1123 CD GLN A 71 8.851 -7.207 6.035 1.00 0.00 C ATOM 1124 OE1 GLN A 71 7.847 -7.518 6.676 1.00 0.00 O ATOM 1125 NE2 GLN A 71 10.082 -7.391 6.498 1.00 0.00 N ATOM 0 H GLN A 71 8.795 -6.712 2.056 1.00 0.00 H new ATOM 0 HA GLN A 71 6.065 -5.871 2.538 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.614 -6.394 4.873 1.00 0.00 H new ATOM 0 HB3 GLN A 71 7.114 -7.707 3.825 1.00 0.00 H new ATOM 0 HG2 GLN A 71 9.423 -7.084 3.978 1.00 0.00 H new ATOM 0 HG3 GLN A 71 9.036 -5.539 4.709 1.00 0.00 H new ATOM 0 HE21 GLN A 71 10.886 -7.118 5.932 1.00 0.00 H new ATOM 0 HE22 GLN A 71 10.224 -7.805 7.419 1.00 0.00 H new ATOM 1134 N GLU A 72 8.573 -3.846 3.050 1.00 0.00 N ATOM 1135 CA GLU A 72 8.916 -2.466 3.389 1.00 0.00 C ATOM 1136 C GLU A 72 8.505 -1.489 2.289 1.00 0.00 C ATOM 1137 O GLU A 72 8.109 -0.358 2.573 1.00 0.00 O ATOM 1138 CB GLU A 72 10.416 -2.337 3.664 1.00 0.00 C ATOM 1139 CG GLU A 72 11.283 -2.456 2.421 1.00 0.00 C ATOM 1140 CD GLU A 72 11.332 -1.175 1.609 1.00 0.00 C ATOM 1141 OE1 GLU A 72 11.240 -0.086 2.211 1.00 0.00 O ATOM 1142 OE2 GLU A 72 11.461 -1.263 0.369 1.00 0.00 O ATOM 0 H GLU A 72 9.342 -4.392 2.662 1.00 0.00 H new ATOM 0 HA GLU A 72 8.360 -2.209 4.291 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.607 -1.374 4.137 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.712 -3.107 4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 72 12.295 -2.732 2.716 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.902 -3.263 1.795 1.00 0.00 H new ATOM 1149 N PHE A 73 8.613 -1.918 1.036 1.00 0.00 N ATOM 1150 CA PHE A 73 8.263 -1.060 -0.090 1.00 0.00 C ATOM 1151 C PHE A 73 6.753 -1.025 -0.299 1.00 0.00 C ATOM 1152 O PHE A 73 6.211 -0.036 -0.793 1.00 0.00 O ATOM 1153 CB PHE A 73 9.011 -1.515 -1.357 1.00 0.00 C ATOM 1154 CG PHE A 73 8.238 -2.418 -2.273 1.00 0.00 C ATOM 1155 CD1 PHE A 73 7.141 -1.952 -2.978 1.00 0.00 C ATOM 1156 CD2 PHE A 73 8.620 -3.736 -2.431 1.00 0.00 C ATOM 1157 CE1 PHE A 73 6.439 -2.790 -3.821 1.00 0.00 C ATOM 1158 CE2 PHE A 73 7.922 -4.582 -3.270 1.00 0.00 C ATOM 1159 CZ PHE A 73 6.829 -4.107 -3.967 1.00 0.00 C ATOM 0 H PHE A 73 8.938 -2.849 0.775 1.00 0.00 H new ATOM 0 HA PHE A 73 8.577 -0.040 0.132 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.313 -0.630 -1.917 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.924 -2.028 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.832 -0.923 -2.867 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.477 -4.110 -1.891 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.585 -2.416 -4.366 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.230 -5.611 -3.381 1.00 0.00 H new ATOM 0 HZ PHE A 73 6.280 -4.764 -4.625 1.00 0.00 H new ATOM 1169 N MET A 74 6.075 -2.096 0.094 1.00 0.00 N ATOM 1170 CA MET A 74 4.628 -2.161 -0.040 1.00 0.00 C ATOM 1171 C MET A 74 3.968 -1.189 0.929 1.00 0.00 C ATOM 1172 O MET A 74 3.181 -0.331 0.526 1.00 0.00 O ATOM 1173 CB MET A 74 4.133 -3.579 0.223 1.00 0.00 C ATOM 1174 CG MET A 74 4.282 -4.495 -0.976 1.00 0.00 C ATOM 1175 SD MET A 74 3.286 -3.973 -2.388 1.00 0.00 S ATOM 1176 CE MET A 74 1.763 -3.483 -1.581 1.00 0.00 C ATOM 0 H MET A 74 6.502 -2.926 0.505 1.00 0.00 H new ATOM 0 HA MET A 74 4.360 -1.882 -1.059 1.00 0.00 H new ATOM 0 HB2 MET A 74 4.684 -3.999 1.064 1.00 0.00 H new ATOM 0 HB3 MET A 74 3.084 -3.542 0.516 1.00 0.00 H new ATOM 0 HG2 MET A 74 5.331 -4.531 -1.271 1.00 0.00 H new ATOM 0 HG3 MET A 74 3.996 -5.508 -0.691 1.00 0.00 H new ATOM 0 HE1 MET A 74 0.916 -3.730 -2.221 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.667 -4.012 -0.633 1.00 0.00 H new ATOM 0 HE3 MET A 74 1.778 -2.409 -1.398 1.00 0.00 H new ATOM 1186 N ALA A 75 4.310 -1.318 2.206 1.00 0.00 N ATOM 1187 CA ALA A 75 3.764 -0.437 3.227 1.00 0.00 C ATOM 1188 C ALA A 75 4.211 1.000 2.983 1.00 0.00 C ATOM 1189 O ALA A 75 3.552 1.942 3.405 1.00 0.00 O ATOM 1190 CB ALA A 75 4.192 -0.901 4.612 1.00 0.00 C ATOM 0 H ALA A 75 4.960 -2.022 2.556 1.00 0.00 H new ATOM 0 HA ALA A 75 2.676 -0.474 3.172 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.776 -0.232 5.365 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.828 -1.914 4.785 1.00 0.00 H new ATOM 0 HB3 ALA A 75 5.280 -0.891 4.679 1.00 0.00 H new ATOM 1196 N PHE A 76 5.338 1.149 2.291 1.00 0.00 N ATOM 1197 CA PHE A 76 5.888 2.464 1.975 1.00 0.00 C ATOM 1198 C PHE A 76 4.932 3.264 1.108 1.00 0.00 C ATOM 1199 O PHE A 76 4.276 4.190 1.582 1.00 0.00 O ATOM 1200 CB PHE A 76 7.217 2.298 1.244 1.00 0.00 C ATOM 1201 CG PHE A 76 7.808 3.583 0.738 1.00 0.00 C ATOM 1202 CD1 PHE A 76 8.458 4.453 1.597 1.00 0.00 C ATOM 1203 CD2 PHE A 76 7.711 3.915 -0.600 1.00 0.00 C ATOM 1204 CE1 PHE A 76 9.003 5.634 1.126 1.00 0.00 C ATOM 1205 CE2 PHE A 76 8.252 5.094 -1.078 1.00 0.00 C ATOM 1206 CZ PHE A 76 8.899 5.954 -0.213 1.00 0.00 C ATOM 0 H PHE A 76 5.891 0.369 1.936 1.00 0.00 H new ATOM 0 HA PHE A 76 6.040 3.005 2.909 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.931 1.823 1.916 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.073 1.621 0.402 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.540 4.207 2.645 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.206 3.245 -1.281 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.509 6.305 1.805 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.169 5.342 -2.126 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.323 6.876 -0.583 1.00 0.00 H new ATOM 1216 N VAL A 77 4.856 2.901 -0.172 1.00 0.00 N ATOM 1217 CA VAL A 77 3.975 3.591 -1.105 1.00 0.00 C ATOM 1218 C VAL A 77 2.606 3.820 -0.481 1.00 0.00 C ATOM 1219 O VAL A 77 1.924 4.795 -0.791 1.00 0.00 O ATOM 1220 CB VAL A 77 3.795 2.794 -2.408 1.00 0.00 C ATOM 1221 CG1 VAL A 77 5.026 2.923 -3.292 1.00 0.00 C ATOM 1222 CG2 VAL A 77 3.497 1.333 -2.104 1.00 0.00 C ATOM 0 H VAL A 77 5.392 2.136 -0.582 1.00 0.00 H new ATOM 0 HA VAL A 77 4.443 4.548 -1.336 1.00 0.00 H new ATOM 0 HB VAL A 77 2.945 3.209 -2.950 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.877 2.352 -4.208 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.187 3.972 -3.541 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.897 2.538 -2.762 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.373 0.785 -3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.324 0.903 -1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.581 1.263 -1.518 1.00 0.00 H new ATOM 1232 N ALA A 78 2.218 2.908 0.402 1.00 0.00 N ATOM 1233 CA ALA A 78 0.928 2.994 1.076 1.00 0.00 C ATOM 1234 C ALA A 78 0.986 3.884 2.318 1.00 0.00 C ATOM 1235 O ALA A 78 0.013 4.561 2.645 1.00 0.00 O ATOM 1236 CB ALA A 78 0.440 1.604 1.450 1.00 0.00 C ATOM 0 H ALA A 78 2.779 2.099 0.668 1.00 0.00 H new ATOM 0 HA ALA A 78 0.225 3.451 0.380 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.524 1.680 1.953 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.333 1.001 0.548 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.161 1.133 2.118 1.00 0.00 H new ATOM 1242 N MET A 79 2.121 3.870 3.012 1.00 0.00 N ATOM 1243 CA MET A 79 2.283 4.671 4.224 1.00 0.00 C ATOM 1244 C MET A 79 2.665 6.111 3.891 1.00 0.00 C ATOM 1245 O MET A 79 2.167 7.059 4.505 1.00 0.00 O ATOM 1246 CB MET A 79 3.331 4.031 5.155 1.00 0.00 C ATOM 1247 CG MET A 79 4.775 4.168 4.692 1.00 0.00 C ATOM 1248 SD MET A 79 5.909 4.548 6.043 1.00 0.00 S ATOM 1249 CE MET A 79 7.425 4.846 5.137 1.00 0.00 C ATOM 0 H MET A 79 2.939 3.316 2.758 1.00 0.00 H new ATOM 0 HA MET A 79 1.324 4.694 4.742 1.00 0.00 H new ATOM 0 HB2 MET A 79 3.239 4.480 6.144 1.00 0.00 H new ATOM 0 HB3 MET A 79 3.099 2.971 5.263 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.087 3.241 4.211 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.837 4.954 3.939 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.267 4.426 5.688 1.00 0.00 H new ATOM 0 HE2 MET A 79 7.361 4.375 4.156 1.00 0.00 H new ATOM 0 HE3 MET A 79 7.571 5.919 5.015 1.00 0.00 H new ATOM 1259 N VAL A 80 3.546 6.265 2.916 1.00 0.00 N ATOM 1260 CA VAL A 80 4.002 7.579 2.497 1.00 0.00 C ATOM 1261 C VAL A 80 2.890 8.336 1.777 1.00 0.00 C ATOM 1262 O VAL A 80 2.750 9.551 1.931 1.00 0.00 O ATOM 1263 CB VAL A 80 5.240 7.456 1.589 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.746 8.827 1.163 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.335 6.677 2.301 1.00 0.00 C ATOM 0 H VAL A 80 3.961 5.491 2.398 1.00 0.00 H new ATOM 0 HA VAL A 80 4.278 8.142 3.389 1.00 0.00 H new ATOM 0 HB VAL A 80 4.952 6.914 0.688 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.620 8.709 0.523 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.962 9.350 0.614 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.018 9.405 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.206 6.596 1.650 1.00 0.00 H new ATOM 0 HG22 VAL A 80 6.614 7.197 3.218 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.971 5.679 2.546 1.00 0.00 H new ATOM 1275 N THR A 81 2.092 7.608 1.001 1.00 0.00 N ATOM 1276 CA THR A 81 0.986 8.211 0.269 1.00 0.00 C ATOM 1277 C THR A 81 -0.156 8.577 1.219 1.00 0.00 C ATOM 1278 O THR A 81 -0.692 9.683 1.165 1.00 0.00 O ATOM 1279 CB THR A 81 0.487 7.255 -0.821 1.00 0.00 C ATOM 1280 OG1 THR A 81 -0.308 7.942 -1.772 1.00 0.00 O ATOM 1281 CG2 THR A 81 -0.334 6.097 -0.288 1.00 0.00 C ATOM 0 H THR A 81 2.191 6.602 0.864 1.00 0.00 H new ATOM 0 HA THR A 81 1.344 9.125 -0.204 1.00 0.00 H new ATOM 0 HB THR A 81 1.392 6.854 -1.277 1.00 0.00 H new ATOM 0 HG1 THR A 81 0.273 8.377 -2.430 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.652 5.464 -1.117 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.270 5.511 0.405 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.211 6.482 0.232 1.00 0.00 H new ATOM 1289 N THR A 82 -0.522 7.636 2.087 1.00 0.00 N ATOM 1290 CA THR A 82 -1.602 7.850 3.045 1.00 0.00 C ATOM 1291 C THR A 82 -1.385 9.120 3.860 1.00 0.00 C ATOM 1292 O THR A 82 -2.343 9.755 4.296 1.00 0.00 O ATOM 1293 CB THR A 82 -1.731 6.651 3.985 1.00 0.00 C ATOM 1294 OG1 THR A 82 -0.455 6.198 4.398 1.00 0.00 O ATOM 1295 CG2 THR A 82 -2.459 5.478 3.364 1.00 0.00 C ATOM 0 H THR A 82 -0.085 6.716 2.146 1.00 0.00 H new ATOM 0 HA THR A 82 -2.524 7.963 2.475 1.00 0.00 H new ATOM 0 HB THR A 82 -2.315 7.010 4.833 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.117 5.541 3.755 1.00 0.00 H new ATOM 0 HG21 THR A 82 -2.515 4.662 4.084 1.00 0.00 H new ATOM 0 HG22 THR A 82 -3.467 5.783 3.082 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.920 5.143 2.478 1.00 0.00 H new ATOM 1303 N ALA A 83 -0.126 9.483 4.080 1.00 0.00 N ATOM 1304 CA ALA A 83 0.184 10.677 4.857 1.00 0.00 C ATOM 1305 C ALA A 83 -0.047 11.957 4.058 1.00 0.00 C ATOM 1306 O ALA A 83 -0.960 12.726 4.358 1.00 0.00 O ATOM 1307 CB ALA A 83 1.616 10.631 5.364 1.00 0.00 C ATOM 0 H ALA A 83 0.688 8.974 3.736 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.497 10.690 5.708 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.827 11.531 5.941 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.750 9.754 5.998 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.300 10.575 4.517 1.00 0.00 H new ATOM 1313 N CYS A 84 0.796 12.196 3.056 1.00 0.00 N ATOM 1314 CA CYS A 84 0.684 13.406 2.244 1.00 0.00 C ATOM 1315 C CYS A 84 -0.280 13.236 1.075 1.00 0.00 C ATOM 1316 O CYS A 84 -1.217 14.020 0.923 1.00 0.00 O ATOM 1317 CB CYS A 84 2.062 13.834 1.733 1.00 0.00 C ATOM 1318 SG CYS A 84 2.620 15.432 2.369 1.00 0.00 S ATOM 0 H CYS A 84 1.558 11.574 2.788 1.00 0.00 H new ATOM 0 HA CYS A 84 0.277 14.186 2.888 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.792 13.072 2.005 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.037 13.877 0.644 1.00 0.00 H new ATOM 0 HG CYS A 84 1.642 16.286 2.314 1.00 0.00 H new ATOM 1324 N HIS A 85 -0.051 12.221 0.243 1.00 0.00 N ATOM 1325 CA HIS A 85 -0.915 11.973 -0.912 1.00 0.00 C ATOM 1326 C HIS A 85 -2.386 12.090 -0.522 1.00 0.00 C ATOM 1327 O HIS A 85 -3.239 12.418 -1.346 1.00 0.00 O ATOM 1328 CB HIS A 85 -0.640 10.586 -1.496 1.00 0.00 C ATOM 1329 CG HIS A 85 -1.045 10.436 -2.933 1.00 0.00 C ATOM 1330 ND1 HIS A 85 -0.396 9.592 -3.811 1.00 0.00 N ATOM 1331 CD2 HIS A 85 -2.045 11.013 -3.643 1.00 0.00 C ATOM 1332 CE1 HIS A 85 -0.979 9.659 -4.996 1.00 0.00 C ATOM 1333 NE2 HIS A 85 -1.981 10.513 -4.919 1.00 0.00 N ATOM 0 H HIS A 85 0.720 11.561 0.345 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.694 12.726 -1.668 1.00 0.00 H new ATOM 0 HB2 HIS A 85 0.424 10.370 -1.405 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -1.169 9.841 -0.901 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -2.760 11.733 -3.273 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.685 9.108 -5.877 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -2.607 10.762 -5.685 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.670 11.820 0.747 1.00 0.00 N ATOM 1343 CA GLU A 86 -4.027 11.888 1.269 1.00 0.00 C ATOM 1344 C GLU A 86 -4.751 13.150 0.805 1.00 0.00 C ATOM 1345 O GLU A 86 -5.727 13.075 0.060 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.979 11.840 2.800 1.00 0.00 C ATOM 1347 CG GLU A 86 -5.280 12.243 3.481 1.00 0.00 C ATOM 1348 CD GLU A 86 -6.421 11.294 3.170 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -6.152 10.193 2.644 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -7.584 11.652 3.452 1.00 0.00 O ATOM 0 H GLU A 86 -1.970 11.550 1.438 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.585 11.034 0.885 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.717 10.829 3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.182 12.497 3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.125 12.278 4.559 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.554 13.250 3.166 1.00 0.00 H new ATOM 1357 N PHE A 87 -4.265 14.302 1.244 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.870 15.575 0.873 1.00 0.00 C ATOM 1359 C PHE A 87 -3.886 16.435 0.087 1.00 0.00 C ATOM 1360 O PHE A 87 -4.287 17.269 -0.724 1.00 0.00 O ATOM 1361 CB PHE A 87 -5.345 16.320 2.123 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.812 16.647 2.108 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.758 15.671 2.379 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -7.243 17.934 1.824 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -9.107 15.973 2.365 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -8.589 18.240 1.811 1.00 0.00 C ATOM 1367 CZ PHE A 87 -9.523 17.259 2.081 1.00 0.00 C ATOM 0 H PHE A 87 -3.454 14.382 1.857 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.730 15.372 0.235 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.125 15.714 3.002 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.776 17.245 2.223 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.438 14.664 2.603 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.518 18.705 1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.835 15.204 2.576 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.912 19.247 1.590 1.00 0.00 H new ATOM 0 HZ PHE A 87 -10.576 17.497 2.070 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.598 16.222 0.330 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.560 16.974 -0.358 1.00 0.00 C ATOM 1379 C PHE A 88 -1.242 16.355 -1.716 1.00 0.00 C ATOM 1380 O PHE A 88 -0.611 16.991 -2.561 1.00 0.00 O ATOM 1381 CB PHE A 88 -0.292 17.034 0.497 1.00 0.00 C ATOM 1382 CG PHE A 88 -0.545 17.463 1.914 1.00 0.00 C ATOM 1383 CD1 PHE A 88 -0.982 16.550 2.860 1.00 0.00 C ATOM 1384 CD2 PHE A 88 -0.344 18.778 2.301 1.00 0.00 C ATOM 1385 CE1 PHE A 88 -1.215 16.941 4.165 1.00 0.00 C ATOM 1386 CE2 PHE A 88 -0.575 19.175 3.604 1.00 0.00 C ATOM 1387 CZ PHE A 88 -1.012 18.256 4.537 1.00 0.00 C ATOM 0 H PHE A 88 -2.249 15.535 0.998 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.931 17.986 -0.520 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.180 16.052 0.502 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.415 17.725 0.037 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.142 15.521 2.574 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -0.003 19.501 1.575 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -1.555 16.220 4.893 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -0.414 20.203 3.892 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.195 18.564 5.556 1.00 0.00 H new ATOM 1447 N SER B 1 6.003 1.709 -16.354 1.00 0.00 N ATOM 1448 CA SER B 1 5.246 2.819 -15.715 1.00 0.00 C ATOM 1449 C SER B 1 4.170 2.287 -14.773 1.00 0.00 C ATOM 1450 O SER B 1 3.169 2.957 -14.517 1.00 0.00 O ATOM 1451 CB SER B 1 4.611 3.671 -16.816 1.00 0.00 C ATOM 1452 OG SER B 1 5.591 4.421 -17.510 1.00 0.00 O ATOM 0 H1 SER B 1 6.620 2.093 -17.098 1.00 0.00 H new ATOM 0 H2 SER B 1 6.583 1.227 -15.638 1.00 0.00 H new ATOM 0 H3 SER B 1 5.336 1.030 -16.773 1.00 0.00 H new ATOM 0 HA SER B 1 5.931 3.422 -15.119 1.00 0.00 H new ATOM 0 HB2 SER B 1 4.078 3.028 -17.516 1.00 0.00 H new ATOM 0 HB3 SER B 1 3.875 4.345 -16.379 1.00 0.00 H new ATOM 0 HG SER B 1 5.160 4.955 -18.209 1.00 0.00 H new ATOM 1460 N GLU B 2 4.381 1.079 -14.260 1.00 0.00 N ATOM 1461 CA GLU B 2 3.427 0.459 -13.347 1.00 0.00 C ATOM 1462 C GLU B 2 3.279 1.286 -12.077 1.00 0.00 C ATOM 1463 O GLU B 2 2.195 1.386 -11.504 1.00 0.00 O ATOM 1464 CB GLU B 2 3.873 -0.965 -12.999 1.00 0.00 C ATOM 1465 CG GLU B 2 5.124 -1.037 -12.133 1.00 0.00 C ATOM 1466 CD GLU B 2 6.400 -0.867 -12.934 1.00 0.00 C ATOM 1467 OE1 GLU B 2 6.667 -1.716 -13.810 1.00 0.00 O ATOM 1468 OE2 GLU B 2 7.132 0.114 -12.685 1.00 0.00 O ATOM 0 H GLU B 2 5.204 0.510 -14.461 1.00 0.00 H new ATOM 0 HA GLU B 2 2.458 0.415 -13.844 1.00 0.00 H new ATOM 0 HB2 GLU B 2 3.058 -1.472 -12.482 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.054 -1.513 -13.924 1.00 0.00 H new ATOM 0 HG2 GLU B 2 5.075 -0.264 -11.366 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.149 -1.997 -11.617 1.00 0.00 H new ATOM 1475 N LEU B 3 4.386 1.869 -11.649 1.00 0.00 N ATOM 1476 CA LEU B 3 4.419 2.692 -10.443 1.00 0.00 C ATOM 1477 C LEU B 3 3.268 3.695 -10.416 1.00 0.00 C ATOM 1478 O LEU B 3 2.615 3.877 -9.389 1.00 0.00 O ATOM 1479 CB LEU B 3 5.755 3.432 -10.344 1.00 0.00 C ATOM 1480 CG LEU B 3 6.273 4.027 -11.658 1.00 0.00 C ATOM 1481 CD1 LEU B 3 6.935 5.375 -11.411 1.00 0.00 C ATOM 1482 CD2 LEU B 3 7.242 3.067 -12.335 1.00 0.00 C ATOM 0 H LEU B 3 5.286 1.788 -12.123 1.00 0.00 H new ATOM 0 HA LEU B 3 4.308 2.027 -9.586 1.00 0.00 H new ATOM 0 HB2 LEU B 3 5.653 4.236 -9.615 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.505 2.743 -9.955 1.00 0.00 H new ATOM 0 HG LEU B 3 5.424 4.181 -12.324 1.00 0.00 H new ATOM 0 HD11 LEU B 3 7.296 5.781 -12.356 1.00 0.00 H new ATOM 0 HD12 LEU B 3 6.210 6.062 -10.974 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.773 5.249 -10.726 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.599 3.507 -13.266 1.00 0.00 H new ATOM 0 HD22 LEU B 3 8.089 2.879 -11.675 1.00 0.00 H new ATOM 0 HD23 LEU B 3 6.733 2.127 -12.549 1.00 0.00 H new ATOM 1494 N GLU B 4 3.029 4.347 -11.549 1.00 0.00 N ATOM 1495 CA GLU B 4 1.961 5.334 -11.652 1.00 0.00 C ATOM 1496 C GLU B 4 0.611 4.657 -11.859 1.00 0.00 C ATOM 1497 O GLU B 4 -0.399 5.079 -11.297 1.00 0.00 O ATOM 1498 CB GLU B 4 2.243 6.301 -12.803 1.00 0.00 C ATOM 1499 CG GLU B 4 3.056 7.517 -12.388 1.00 0.00 C ATOM 1500 CD GLU B 4 4.192 7.816 -13.346 1.00 0.00 C ATOM 1501 OE1 GLU B 4 4.734 6.861 -13.940 1.00 0.00 O ATOM 1502 OE2 GLU B 4 4.539 9.006 -13.503 1.00 0.00 O ATOM 0 H GLU B 4 3.561 4.210 -12.409 1.00 0.00 H new ATOM 0 HA GLU B 4 1.925 5.893 -10.717 1.00 0.00 H new ATOM 0 HB2 GLU B 4 2.776 5.769 -13.591 1.00 0.00 H new ATOM 0 HB3 GLU B 4 1.296 6.634 -13.227 1.00 0.00 H new ATOM 0 HG2 GLU B 4 2.399 8.385 -12.328 1.00 0.00 H new ATOM 0 HG3 GLU B 4 3.462 7.354 -11.389 1.00 0.00 H new ATOM 1509 N LYS B 5 0.601 3.603 -12.670 1.00 0.00 N ATOM 1510 CA LYS B 5 -0.627 2.869 -12.950 1.00 0.00 C ATOM 1511 C LYS B 5 -1.224 2.301 -11.665 1.00 0.00 C ATOM 1512 O LYS B 5 -2.414 2.463 -11.399 1.00 0.00 O ATOM 1513 CB LYS B 5 -0.355 1.739 -13.946 1.00 0.00 C ATOM 1514 CG LYS B 5 -0.701 2.099 -15.383 1.00 0.00 C ATOM 1515 CD LYS B 5 0.535 2.122 -16.268 1.00 0.00 C ATOM 1516 CE LYS B 5 1.073 0.721 -16.509 1.00 0.00 C ATOM 1517 NZ LYS B 5 2.132 0.705 -17.555 1.00 0.00 N ATOM 0 H LYS B 5 1.428 3.239 -13.143 1.00 0.00 H new ATOM 0 HA LYS B 5 -1.345 3.562 -13.388 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.698 1.464 -13.892 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.929 0.860 -13.652 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -1.418 1.378 -15.777 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -1.185 3.075 -15.408 1.00 0.00 H new ATOM 0 HD2 LYS B 5 0.292 2.589 -17.223 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.307 2.734 -15.801 1.00 0.00 H new ATOM 0 HE2 LYS B 5 1.476 0.322 -15.578 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.256 0.065 -16.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.364 -0.279 -17.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 1.790 1.200 -18.403 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.983 1.183 -17.195 1.00 0.00 H new ATOM 1531 N ALA B 6 -0.389 1.637 -10.874 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.831 1.043 -9.617 1.00 0.00 C ATOM 1533 C ALA B 6 -1.271 2.113 -8.626 1.00 0.00 C ATOM 1534 O ALA B 6 -2.336 2.009 -8.017 1.00 0.00 O ATOM 1535 CB ALA B 6 0.279 0.192 -9.019 1.00 0.00 C ATOM 0 H ALA B 6 0.600 1.496 -11.081 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.691 0.407 -9.827 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.063 -0.246 -8.081 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.543 -0.604 -9.716 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.154 0.815 -8.831 1.00 0.00 H new ATOM 1541 N MET B 7 -0.446 3.141 -8.466 1.00 0.00 N ATOM 1542 CA MET B 7 -0.750 4.230 -7.545 1.00 0.00 C ATOM 1543 C MET B 7 -2.095 4.869 -7.876 1.00 0.00 C ATOM 1544 O MET B 7 -2.938 5.048 -6.998 1.00 0.00 O ATOM 1545 CB MET B 7 0.355 5.288 -7.591 1.00 0.00 C ATOM 1546 CG MET B 7 0.523 6.048 -6.285 1.00 0.00 C ATOM 1547 SD MET B 7 1.099 4.996 -4.939 1.00 0.00 S ATOM 1548 CE MET B 7 2.703 5.721 -4.606 1.00 0.00 C ATOM 0 H MET B 7 0.439 3.243 -8.962 1.00 0.00 H new ATOM 0 HA MET B 7 -0.806 3.814 -6.539 1.00 0.00 H new ATOM 0 HB2 MET B 7 1.299 4.805 -7.845 1.00 0.00 H new ATOM 0 HB3 MET B 7 0.135 5.997 -8.389 1.00 0.00 H new ATOM 0 HG2 MET B 7 1.231 6.864 -6.432 1.00 0.00 H new ATOM 0 HG3 MET B 7 -0.429 6.499 -6.006 1.00 0.00 H new ATOM 0 HE1 MET B 7 3.030 5.437 -3.606 1.00 0.00 H new ATOM 0 HE2 MET B 7 3.424 5.361 -5.339 1.00 0.00 H new ATOM 0 HE3 MET B 7 2.632 6.807 -4.670 1.00 0.00 H new ATOM 1558 N VAL B 8 -2.288 5.211 -9.145 1.00 0.00 N ATOM 1559 CA VAL B 8 -3.530 5.834 -9.588 1.00 0.00 C ATOM 1560 C VAL B 8 -4.643 4.805 -9.758 1.00 0.00 C ATOM 1561 O VAL B 8 -5.822 5.150 -9.712 1.00 0.00 O ATOM 1562 CB VAL B 8 -3.338 6.592 -10.917 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -4.593 7.372 -11.275 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -2.133 7.518 -10.836 1.00 0.00 C ATOM 0 H VAL B 8 -1.601 5.067 -9.885 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.816 6.542 -8.811 1.00 0.00 H new ATOM 0 HB VAL B 8 -3.155 5.862 -11.705 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -4.437 7.900 -12.216 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -5.432 6.684 -11.380 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -4.811 8.092 -10.487 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.014 8.044 -11.783 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -2.284 8.242 -10.035 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -1.237 6.932 -10.631 1.00 0.00 H new ATOM 1574 N ALA B 9 -4.272 3.541 -9.937 1.00 0.00 N ATOM 1575 CA ALA B 9 -5.264 2.486 -10.088 1.00 0.00 C ATOM 1576 C ALA B 9 -6.080 2.376 -8.812 1.00 0.00 C ATOM 1577 O ALA B 9 -7.299 2.190 -8.840 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.591 1.159 -10.406 1.00 0.00 C ATOM 0 H ALA B 9 -3.303 3.226 -9.981 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.926 2.734 -10.918 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -5.349 0.383 -10.515 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -4.028 1.250 -11.335 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.913 0.892 -9.596 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.388 2.524 -7.691 1.00 0.00 N ATOM 1585 CA LEU B 10 -6.018 2.471 -6.383 1.00 0.00 C ATOM 1586 C LEU B 10 -6.903 3.693 -6.190 1.00 0.00 C ATOM 1587 O LEU B 10 -8.064 3.587 -5.788 1.00 0.00 O ATOM 1588 CB LEU B 10 -4.948 2.430 -5.293 1.00 0.00 C ATOM 1589 CG LEU B 10 -4.156 1.124 -5.206 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.708 1.407 -4.840 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.791 0.180 -4.194 1.00 0.00 C ATOM 0 H LEU B 10 -4.381 2.683 -7.664 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.629 1.571 -6.316 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -4.249 3.249 -5.461 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.426 2.611 -4.330 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.177 0.641 -6.183 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.157 0.468 -4.782 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.258 2.045 -5.601 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.669 1.911 -3.874 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.214 -0.743 -4.146 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.801 0.653 -3.212 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.813 -0.046 -4.499 1.00 0.00 H new ATOM 1603 N ILE B 11 -6.336 4.854 -6.488 1.00 0.00 N ATOM 1604 CA ILE B 11 -7.038 6.109 -6.363 1.00 0.00 C ATOM 1605 C ILE B 11 -8.225 6.174 -7.319 1.00 0.00 C ATOM 1606 O ILE B 11 -9.293 6.666 -6.964 1.00 0.00 O ATOM 1607 CB ILE B 11 -6.090 7.285 -6.652 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -4.794 7.152 -5.849 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -6.774 8.587 -6.321 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -3.642 7.945 -6.429 1.00 0.00 C ATOM 0 H ILE B 11 -5.377 4.945 -6.822 1.00 0.00 H new ATOM 0 HA ILE B 11 -7.407 6.180 -5.340 1.00 0.00 H new ATOM 0 HB ILE B 11 -5.836 7.271 -7.712 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.974 7.482 -4.826 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.513 6.100 -5.799 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -6.097 9.416 -6.528 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -7.672 8.691 -6.930 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -7.048 8.596 -5.266 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.756 7.805 -5.810 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.436 7.599 -7.442 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -3.904 9.003 -6.453 1.00 0.00 H new ATOM 1622 N ASP B 12 -8.034 5.671 -8.533 1.00 0.00 N ATOM 1623 CA ASP B 12 -9.094 5.673 -9.534 1.00 0.00 C ATOM 1624 C ASP B 12 -10.352 4.996 -8.997 1.00 0.00 C ATOM 1625 O ASP B 12 -11.470 5.432 -9.274 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.622 4.967 -10.808 1.00 0.00 C ATOM 1627 CG ASP B 12 -8.265 5.944 -11.911 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -9.079 6.851 -12.187 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -7.172 5.803 -12.499 1.00 0.00 O ATOM 0 H ASP B 12 -7.156 5.257 -8.848 1.00 0.00 H new ATOM 0 HA ASP B 12 -9.335 6.709 -9.770 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.754 4.350 -10.578 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -9.406 4.296 -11.160 1.00 0.00 H new ATOM 1634 N VAL B 13 -10.160 3.928 -8.230 1.00 0.00 N ATOM 1635 CA VAL B 13 -11.280 3.189 -7.656 1.00 0.00 C ATOM 1636 C VAL B 13 -12.083 4.046 -6.676 1.00 0.00 C ATOM 1637 O VAL B 13 -13.294 4.204 -6.828 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.796 1.916 -6.933 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -11.981 1.068 -6.489 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.862 1.113 -7.827 1.00 0.00 C ATOM 0 H VAL B 13 -9.241 3.555 -7.991 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.926 2.909 -8.488 1.00 0.00 H new ATOM 0 HB VAL B 13 -10.241 2.217 -6.045 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.619 0.174 -5.981 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.606 1.645 -5.807 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.567 0.777 -7.361 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.532 0.219 -7.298 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.389 0.823 -8.736 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.996 1.721 -8.088 1.00 0.00 H new ATOM 1650 N PHE B 14 -11.405 4.589 -5.668 1.00 0.00 N ATOM 1651 CA PHE B 14 -12.065 5.420 -4.659 1.00 0.00 C ATOM 1652 C PHE B 14 -12.453 6.785 -5.229 1.00 0.00 C ATOM 1653 O PHE B 14 -13.419 7.401 -4.778 1.00 0.00 O ATOM 1654 CB PHE B 14 -11.158 5.563 -3.423 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.714 6.969 -3.123 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -9.975 7.685 -4.048 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -11.041 7.574 -1.921 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.570 8.977 -3.784 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.639 8.866 -1.653 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.903 9.570 -2.585 1.00 0.00 C ATOM 0 H PHE B 14 -10.402 4.470 -5.526 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.989 4.929 -4.354 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -11.688 5.171 -2.554 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -10.274 4.941 -3.565 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.712 7.226 -4.990 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -11.616 7.029 -1.187 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -8.993 9.523 -4.516 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.901 9.328 -0.712 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.589 10.582 -2.375 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.696 7.254 -6.214 1.00 0.00 N ATOM 1671 CA HIS B 15 -11.967 8.546 -6.834 1.00 0.00 C ATOM 1672 C HIS B 15 -13.237 8.498 -7.678 1.00 0.00 C ATOM 1673 O HIS B 15 -13.843 9.533 -7.961 1.00 0.00 O ATOM 1674 CB HIS B 15 -10.781 8.984 -7.697 1.00 0.00 C ATOM 1675 CG HIS B 15 -10.780 10.447 -8.016 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -10.664 10.938 -9.299 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -10.877 11.530 -7.209 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -10.689 12.258 -9.267 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -10.818 12.642 -8.010 1.00 0.00 N ATOM 0 H HIS B 15 -10.891 6.760 -6.600 1.00 0.00 H new ATOM 0 HA HIS B 15 -12.115 9.274 -6.036 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.854 8.733 -7.181 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.791 8.418 -8.628 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -10.981 11.520 -6.134 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -10.616 12.912 -10.123 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -10.866 13.608 -7.687 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.641 7.295 -8.076 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.840 7.125 -8.881 1.00 0.00 C ATOM 1690 C GLN B 16 -16.078 7.068 -7.994 1.00 0.00 C ATOM 1691 O GLN B 16 -17.113 7.651 -8.318 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.739 5.850 -9.721 1.00 0.00 C ATOM 1693 CG GLN B 16 -15.617 5.869 -10.962 1.00 0.00 C ATOM 1694 CD GLN B 16 -14.819 6.056 -12.238 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -14.798 7.142 -12.817 1.00 0.00 O ATOM 1696 NE2 GLN B 16 -14.159 4.993 -12.686 1.00 0.00 N ATOM 0 H GLN B 16 -13.155 6.427 -7.853 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.929 7.982 -9.548 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -13.702 5.704 -10.022 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.015 4.995 -9.104 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -16.176 4.935 -11.021 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -16.347 6.673 -10.874 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -14.204 4.112 -12.174 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.607 5.058 -13.541 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.964 6.361 -6.875 1.00 0.00 N ATOM 1706 CA TYR B 17 -17.077 6.225 -5.943 1.00 0.00 C ATOM 1707 C TYR B 17 -17.164 7.424 -5.004 1.00 0.00 C ATOM 1708 O TYR B 17 -18.194 8.094 -4.933 1.00 0.00 O ATOM 1709 CB TYR B 17 -16.940 4.934 -5.137 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.840 3.824 -5.630 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -17.646 3.252 -6.881 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -18.885 3.353 -4.846 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -18.469 2.239 -7.337 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -19.712 2.340 -5.295 1.00 0.00 C ATOM 1715 CZ TYR B 17 -19.501 1.787 -6.540 1.00 0.00 C ATOM 1716 OH TYR B 17 -20.324 0.781 -6.990 1.00 0.00 O ATOM 0 H TYR B 17 -15.114 5.874 -6.592 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.997 6.185 -6.526 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -15.904 4.597 -5.176 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -17.168 5.140 -4.091 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.840 3.604 -7.507 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -19.054 3.785 -3.871 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -18.305 1.804 -8.312 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -20.520 1.984 -4.673 1.00 0.00 H new ATOM 0 HH TYR B 17 -19.794 -0.027 -7.153 1.00 0.00 H new ATOM 1726 N SER B 18 -16.081 7.685 -4.280 1.00 0.00 N ATOM 1727 CA SER B 18 -16.038 8.800 -3.338 1.00 0.00 C ATOM 1728 C SER B 18 -16.520 10.095 -3.988 1.00 0.00 C ATOM 1729 O SER B 18 -17.289 10.851 -3.392 1.00 0.00 O ATOM 1730 CB SER B 18 -14.616 8.984 -2.804 1.00 0.00 C ATOM 1731 OG SER B 18 -13.813 9.702 -3.724 1.00 0.00 O ATOM 0 H SER B 18 -15.220 7.140 -4.327 1.00 0.00 H new ATOM 0 HA SER B 18 -16.708 8.565 -2.511 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.648 9.515 -1.853 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.168 8.009 -2.610 1.00 0.00 H new ATOM 0 HG SER B 18 -13.405 9.077 -4.359 1.00 0.00 H new ATOM 1737 N GLY B 19 -16.063 10.345 -5.212 1.00 0.00 N ATOM 1738 CA GLY B 19 -16.453 11.551 -5.925 1.00 0.00 C ATOM 1739 C GLY B 19 -17.947 11.814 -5.876 1.00 0.00 C ATOM 1740 O GLY B 19 -18.382 12.965 -5.937 1.00 0.00 O ATOM 0 H GLY B 19 -15.428 9.733 -5.724 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.926 12.405 -5.499 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -16.138 11.469 -6.965 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.097 13.566 -1.261 1.00 0.00 N ATOM 1802 CA LYS B 24 -15.208 13.021 -2.282 1.00 0.00 C ATOM 1803 C LYS B 24 -13.846 12.683 -1.685 1.00 0.00 C ATOM 1804 O LYS B 24 -12.841 13.322 -1.998 1.00 0.00 O ATOM 1805 CB LYS B 24 -15.046 14.017 -3.433 1.00 0.00 C ATOM 1806 CG LYS B 24 -16.367 14.558 -3.957 1.00 0.00 C ATOM 1807 CD LYS B 24 -16.412 16.078 -3.908 1.00 0.00 C ATOM 1808 CE LYS B 24 -17.802 16.604 -4.222 1.00 0.00 C ATOM 1809 NZ LYS B 24 -17.755 17.836 -5.057 1.00 0.00 N ATOM 0 HA LYS B 24 -15.653 12.105 -2.669 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -14.429 14.850 -3.098 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.511 13.532 -4.250 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -16.516 14.222 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -17.187 14.150 -3.366 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.107 16.420 -2.919 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.697 16.487 -4.622 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -18.372 15.834 -4.742 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -18.328 16.816 -3.291 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -18.724 18.163 -5.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -17.233 18.579 -4.550 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -17.275 17.628 -5.956 1.00 0.00 H new ATOM 1823 N HIS B 25 -13.824 11.674 -0.819 1.00 0.00 N ATOM 1824 CA HIS B 25 -12.589 11.247 -0.167 1.00 0.00 C ATOM 1825 C HIS B 25 -12.845 10.070 0.775 1.00 0.00 C ATOM 1826 O HIS B 25 -11.976 9.228 0.991 1.00 0.00 O ATOM 1827 CB HIS B 25 -11.977 12.409 0.614 1.00 0.00 C ATOM 1828 CG HIS B 25 -10.494 12.311 0.758 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -9.666 13.412 0.766 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -9.687 11.233 0.901 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -8.414 13.018 0.905 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.398 11.700 0.990 1.00 0.00 N ATOM 0 H HIS B 25 -14.648 11.136 -0.552 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.892 10.925 -0.941 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -12.225 13.345 0.113 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -12.429 12.449 1.605 1.00 0.00 H new ATOM 0 HD1 HIS B 25 -9.973 14.381 0.678 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -9.998 10.200 0.938 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -7.549 13.664 0.943 1.00 0.00 H new ATOM 1841 N LYS B 26 -14.043 10.028 1.340 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.426 8.973 2.264 1.00 0.00 C ATOM 1843 C LYS B 26 -15.490 8.078 1.635 1.00 0.00 C ATOM 1844 O LYS B 26 -16.169 8.478 0.691 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.957 9.592 3.557 1.00 0.00 C ATOM 1846 CG LYS B 26 -14.007 9.467 4.738 1.00 0.00 C ATOM 1847 CD LYS B 26 -13.299 10.782 5.026 1.00 0.00 C ATOM 1848 CE LYS B 26 -12.469 11.237 3.838 1.00 0.00 C ATOM 1849 NZ LYS B 26 -11.062 11.531 4.224 1.00 0.00 N ATOM 0 H LYS B 26 -14.773 10.721 1.171 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.551 8.364 2.490 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -15.167 10.647 3.383 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.904 9.116 3.813 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -14.562 9.151 5.621 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.268 8.693 4.532 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -14.035 11.547 5.272 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.656 10.667 5.898 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.481 10.464 3.070 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -12.919 12.128 3.401 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -10.497 11.706 3.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.038 12.373 4.834 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.667 10.719 4.740 1.00 0.00 H new ATOM 1863 N LEU B 27 -15.630 6.865 2.163 1.00 0.00 N ATOM 1864 CA LEU B 27 -16.611 5.914 1.645 1.00 0.00 C ATOM 1865 C LEU B 27 -17.370 5.250 2.781 1.00 0.00 C ATOM 1866 O LEU B 27 -16.781 4.807 3.759 1.00 0.00 O ATOM 1867 CB LEU B 27 -15.955 4.833 0.773 1.00 0.00 C ATOM 1868 CG LEU B 27 -15.136 5.311 -0.446 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -15.780 6.516 -1.118 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -13.692 5.619 -0.053 1.00 0.00 C ATOM 0 H LEU B 27 -15.078 6.517 2.947 1.00 0.00 H new ATOM 0 HA LEU B 27 -17.305 6.482 1.025 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -15.299 4.238 1.409 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -16.739 4.167 0.413 1.00 0.00 H new ATOM 0 HG LEU B 27 -15.126 4.495 -1.169 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.175 6.823 -1.971 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -16.781 6.251 -1.459 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -15.846 7.338 -0.405 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.139 5.953 -0.931 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -13.680 6.404 0.704 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -13.225 4.720 0.349 1.00 0.00 H new ATOM 1882 N LYS B 28 -18.684 5.183 2.635 1.00 0.00 N ATOM 1883 CA LYS B 28 -19.539 4.579 3.651 1.00 0.00 C ATOM 1884 C LYS B 28 -19.639 3.070 3.469 1.00 0.00 C ATOM 1885 O LYS B 28 -19.130 2.514 2.495 1.00 0.00 O ATOM 1886 CB LYS B 28 -20.936 5.202 3.608 1.00 0.00 C ATOM 1887 CG LYS B 28 -21.640 5.030 2.272 1.00 0.00 C ATOM 1888 CD LYS B 28 -22.417 6.279 1.887 1.00 0.00 C ATOM 1889 CE LYS B 28 -23.613 5.943 1.013 1.00 0.00 C ATOM 1890 NZ LYS B 28 -23.878 7.005 0.002 1.00 0.00 N ATOM 0 H LYS B 28 -19.185 5.540 1.821 1.00 0.00 H new ATOM 0 HA LYS B 28 -19.087 4.774 4.623 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -21.548 4.755 4.391 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -20.857 6.266 3.833 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -20.906 4.804 1.499 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -22.319 4.179 2.324 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -22.756 6.790 2.788 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -21.760 6.969 1.357 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -23.437 4.995 0.506 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -24.495 5.810 1.640 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -24.702 6.738 -0.574 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -24.071 7.905 0.486 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -23.046 7.114 -0.613 1.00 0.00 H new ATOM 1904 N LYS B 29 -20.301 2.412 4.417 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.475 0.965 4.371 1.00 0.00 C ATOM 1906 C LYS B 29 -21.044 0.526 3.026 1.00 0.00 C ATOM 1907 O LYS B 29 -20.804 -0.594 2.576 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.398 0.505 5.502 1.00 0.00 C ATOM 1909 CG LYS B 29 -20.807 0.704 6.889 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.846 1.222 7.871 1.00 0.00 C ATOM 1911 CE LYS B 29 -21.697 2.719 8.100 1.00 0.00 C ATOM 1912 NZ LYS B 29 -22.469 3.513 7.104 1.00 0.00 N ATOM 0 H LYS B 29 -20.727 2.861 5.228 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.496 0.503 4.498 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.340 1.050 5.436 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.631 -0.551 5.363 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -20.402 -0.241 7.252 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -19.976 1.407 6.834 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -22.845 1.008 7.492 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -21.746 0.696 8.820 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -22.037 2.968 9.105 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -20.643 2.992 8.043 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -21.822 4.136 6.580 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -22.943 2.869 6.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -23.182 4.089 7.596 1.00 0.00 H new ATOM 1926 N SER B 30 -21.795 1.418 2.388 1.00 0.00 N ATOM 1927 CA SER B 30 -22.393 1.124 1.092 1.00 0.00 C ATOM 1928 C SER B 30 -21.390 1.365 -0.031 1.00 0.00 C ATOM 1929 O SER B 30 -21.361 0.630 -1.018 1.00 0.00 O ATOM 1930 CB SER B 30 -23.640 1.983 0.873 1.00 0.00 C ATOM 1931 OG SER B 30 -24.779 1.393 1.477 1.00 0.00 O ATOM 0 H SER B 30 -22.003 2.349 2.748 1.00 0.00 H new ATOM 0 HA SER B 30 -22.682 0.073 1.081 1.00 0.00 H new ATOM 0 HB2 SER B 30 -23.478 2.977 1.289 1.00 0.00 H new ATOM 0 HB3 SER B 30 -23.815 2.109 -0.195 1.00 0.00 H new ATOM 0 HG SER B 30 -25.562 1.962 1.324 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.566 2.398 0.126 1.00 0.00 N ATOM 1938 CA GLU B 31 -19.561 2.729 -0.876 1.00 0.00 C ATOM 1939 C GLU B 31 -18.425 1.713 -0.856 1.00 0.00 C ATOM 1940 O GLU B 31 -18.209 0.990 -1.828 1.00 0.00 O ATOM 1941 CB GLU B 31 -19.009 4.133 -0.626 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.999 5.242 -0.941 1.00 0.00 C ATOM 1943 CD GLU B 31 -20.076 5.553 -2.422 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -19.024 5.867 -3.018 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -21.187 5.481 -2.987 1.00 0.00 O ATOM 0 H GLU B 31 -20.576 3.018 0.936 1.00 0.00 H new ATOM 0 HA GLU B 31 -20.034 2.701 -1.858 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.705 4.214 0.418 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -18.113 4.275 -1.230 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.987 4.954 -0.582 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.713 6.143 -0.399 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.700 1.662 0.259 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.583 0.733 0.409 1.00 0.00 C ATOM 1954 C LEU B 32 -16.980 -0.681 -0.014 1.00 0.00 C ATOM 1955 O LEU B 32 -16.254 -1.343 -0.755 1.00 0.00 O ATOM 1956 CB LEU B 32 -16.091 0.731 1.861 1.00 0.00 C ATOM 1957 CG LEU B 32 -14.932 -0.226 2.164 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -15.444 -1.648 2.337 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -13.880 -0.166 1.065 1.00 0.00 C ATOM 0 H LEU B 32 -17.866 2.254 1.073 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.775 1.066 -0.243 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -15.782 1.743 2.123 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -16.929 0.476 2.510 1.00 0.00 H new ATOM 0 HG LEU B 32 -14.467 0.088 3.098 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -14.607 -2.313 2.551 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -16.154 -1.681 3.163 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -15.938 -1.971 1.421 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -13.067 -0.853 1.301 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -14.331 -0.450 0.114 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -13.488 0.848 0.992 1.00 0.00 H new ATOM 1971 N LYS B 33 -18.136 -1.135 0.461 1.00 0.00 N ATOM 1972 CA LYS B 33 -18.629 -2.468 0.128 1.00 0.00 C ATOM 1973 C LYS B 33 -18.720 -2.655 -1.382 1.00 0.00 C ATOM 1974 O LYS B 33 -18.423 -3.728 -1.906 1.00 0.00 O ATOM 1975 CB LYS B 33 -20.009 -2.698 0.755 1.00 0.00 C ATOM 1976 CG LYS B 33 -19.976 -3.198 2.196 1.00 0.00 C ATOM 1977 CD LYS B 33 -18.737 -2.723 2.942 1.00 0.00 C ATOM 1978 CE LYS B 33 -18.822 -3.052 4.425 1.00 0.00 C ATOM 1979 NZ LYS B 33 -19.847 -2.226 5.122 1.00 0.00 N ATOM 0 H LYS B 33 -18.748 -0.600 1.077 1.00 0.00 H new ATOM 0 HA LYS B 33 -17.923 -3.195 0.529 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -20.569 -1.764 0.721 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -20.555 -3.419 0.146 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -20.868 -2.852 2.719 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -20.006 -4.288 2.201 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.851 -3.192 2.514 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.623 -1.647 2.812 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.062 -4.108 4.549 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -17.849 -2.890 4.889 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -20.252 -2.769 5.911 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.404 -1.360 5.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.602 -1.972 4.453 1.00 0.00 H new ATOM 1993 N GLU B 34 -19.141 -1.603 -2.077 1.00 0.00 N ATOM 1994 CA GLU B 34 -19.281 -1.651 -3.526 1.00 0.00 C ATOM 1995 C GLU B 34 -17.938 -1.897 -4.206 1.00 0.00 C ATOM 1996 O GLU B 34 -17.778 -2.872 -4.936 1.00 0.00 O ATOM 1997 CB GLU B 34 -19.899 -0.353 -4.046 1.00 0.00 C ATOM 1998 CG GLU B 34 -21.373 -0.199 -3.703 1.00 0.00 C ATOM 1999 CD GLU B 34 -22.270 -0.313 -4.920 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -22.077 -1.258 -5.714 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -23.165 0.544 -5.080 1.00 0.00 O ATOM 0 H GLU B 34 -19.391 -0.707 -1.659 1.00 0.00 H new ATOM 0 HA GLU B 34 -19.942 -2.483 -3.767 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.348 0.492 -3.633 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.781 -0.312 -5.129 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.655 -0.961 -2.976 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -21.532 0.769 -3.228 1.00 0.00 H new ATOM 2008 N LEU B 35 -16.976 -1.003 -3.973 1.00 0.00 N ATOM 2009 CA LEU B 35 -15.650 -1.128 -4.582 1.00 0.00 C ATOM 2010 C LEU B 35 -15.117 -2.537 -4.462 1.00 0.00 C ATOM 2011 O LEU B 35 -14.453 -3.040 -5.364 1.00 0.00 O ATOM 2012 CB LEU B 35 -14.661 -0.143 -3.957 1.00 0.00 C ATOM 2013 CG LEU B 35 -15.014 1.333 -4.139 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -15.717 1.558 -5.473 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -15.881 1.805 -2.982 1.00 0.00 C ATOM 0 H LEU B 35 -17.089 -0.188 -3.370 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.760 -0.890 -5.640 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.587 -0.354 -2.890 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.675 -0.320 -4.386 1.00 0.00 H new ATOM 0 HG LEU B 35 -14.094 1.917 -4.145 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -15.960 2.615 -5.583 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -15.060 1.250 -6.287 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -16.634 0.970 -5.505 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -16.128 2.858 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -16.799 1.217 -2.952 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -15.338 1.679 -2.045 1.00 0.00 H new ATOM 2027 N ILE B 36 -15.426 -3.177 -3.354 1.00 0.00 N ATOM 2028 CA ILE B 36 -14.987 -4.547 -3.139 1.00 0.00 C ATOM 2029 C ILE B 36 -15.488 -5.417 -4.285 1.00 0.00 C ATOM 2030 O ILE B 36 -14.700 -5.943 -5.068 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.472 -5.103 -1.778 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -14.547 -4.589 -0.664 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -15.525 -6.630 -1.797 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -14.379 -5.544 0.501 1.00 0.00 C ATOM 0 H ILE B 36 -15.974 -2.778 -2.592 1.00 0.00 H new ATOM 0 HA ILE B 36 -13.897 -4.560 -3.115 1.00 0.00 H new ATOM 0 HB ILE B 36 -16.486 -4.751 -1.586 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -13.566 -4.380 -1.091 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -14.940 -3.644 -0.289 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -15.869 -6.994 -0.829 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -16.214 -6.961 -2.574 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -14.530 -7.026 -2.001 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -13.711 -5.102 1.240 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -15.350 -5.735 0.958 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -13.955 -6.482 0.144 1.00 0.00 H new ATOM 2046 N ASN B 37 -16.804 -5.533 -4.400 1.00 0.00 N ATOM 2047 CA ASN B 37 -17.405 -6.309 -5.475 1.00 0.00 C ATOM 2048 C ASN B 37 -17.234 -5.590 -6.817 1.00 0.00 C ATOM 2049 O ASN B 37 -17.491 -6.165 -7.874 1.00 0.00 O ATOM 2050 CB ASN B 37 -18.889 -6.549 -5.195 1.00 0.00 C ATOM 2051 CG ASN B 37 -19.113 -7.608 -4.133 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -18.792 -8.780 -4.331 1.00 0.00 O ATOM 2053 ND2 ASN B 37 -19.669 -7.199 -2.998 1.00 0.00 N ATOM 0 H ASN B 37 -17.474 -5.101 -3.764 1.00 0.00 H new ATOM 0 HA ASN B 37 -16.897 -7.272 -5.527 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -19.351 -5.615 -4.876 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -19.386 -6.852 -6.117 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.846 -7.866 -2.247 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -19.919 -6.218 -2.877 1.00 0.00 H new ATOM 2060 N ASN B 38 -16.800 -4.329 -6.764 1.00 0.00 N ATOM 2061 CA ASN B 38 -16.597 -3.533 -7.972 1.00 0.00 C ATOM 2062 C ASN B 38 -15.161 -3.652 -8.479 1.00 0.00 C ATOM 2063 O ASN B 38 -14.881 -3.341 -9.637 1.00 0.00 O ATOM 2064 CB ASN B 38 -16.936 -2.059 -7.711 1.00 0.00 C ATOM 2065 CG ASN B 38 -17.462 -1.362 -8.950 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -18.251 -1.925 -9.706 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -17.025 -0.125 -9.162 1.00 0.00 N ATOM 0 H ASN B 38 -16.583 -3.839 -5.896 1.00 0.00 H new ATOM 0 HA ASN B 38 -17.266 -3.922 -8.739 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -17.680 -1.995 -6.917 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.045 -1.541 -7.356 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -17.345 0.396 -9.979 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -16.370 0.304 -8.508 1.00 0.00 H new ATOM 2074 N GLU B 39 -14.248 -4.088 -7.611 1.00 0.00 N ATOM 2075 CA GLU B 39 -12.848 -4.221 -8.000 1.00 0.00 C ATOM 2076 C GLU B 39 -12.154 -5.378 -7.274 1.00 0.00 C ATOM 2077 O GLU B 39 -11.067 -5.209 -6.723 1.00 0.00 O ATOM 2078 CB GLU B 39 -12.102 -2.911 -7.732 1.00 0.00 C ATOM 2079 CG GLU B 39 -11.924 -2.598 -6.255 1.00 0.00 C ATOM 2080 CD GLU B 39 -10.504 -2.190 -5.910 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -9.759 -1.799 -6.834 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -10.138 -2.262 -4.718 1.00 0.00 O ATOM 0 H GLU B 39 -14.451 -4.352 -6.647 1.00 0.00 H new ATOM 0 HA GLU B 39 -12.826 -4.444 -9.067 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.121 -2.959 -8.205 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -12.644 -2.092 -8.205 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -12.607 -1.796 -5.973 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.199 -3.473 -5.667 1.00 0.00 H new ATOM 2089 N LEU B 40 -12.773 -6.556 -7.295 1.00 0.00 N ATOM 2090 CA LEU B 40 -12.190 -7.735 -6.655 1.00 0.00 C ATOM 2091 C LEU B 40 -12.694 -9.016 -7.311 1.00 0.00 C ATOM 2092 O LEU B 40 -13.684 -9.602 -6.874 1.00 0.00 O ATOM 2093 CB LEU B 40 -12.507 -7.764 -5.156 1.00 0.00 C ATOM 2094 CG LEU B 40 -11.837 -6.669 -4.320 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -12.211 -6.815 -2.851 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -10.323 -6.714 -4.493 1.00 0.00 C ATOM 0 H LEU B 40 -13.673 -6.720 -7.745 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.109 -7.674 -6.783 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -13.587 -7.685 -5.029 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -12.210 -8.734 -4.758 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.194 -5.701 -4.672 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.726 -6.029 -2.272 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.292 -6.732 -2.741 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.883 -7.789 -2.487 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -9.865 -5.929 -3.892 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -9.948 -7.685 -4.169 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -10.072 -6.560 -5.543 1.00 0.00 H new ATOM 2225 N LYS B 48 -15.376 -12.704 2.335 1.00 0.00 N ATOM 2226 CA LYS B 48 -15.892 -14.071 2.389 1.00 0.00 C ATOM 2227 C LYS B 48 -17.377 -14.096 2.752 1.00 0.00 C ATOM 2228 O LYS B 48 -18.044 -15.117 2.589 1.00 0.00 O ATOM 2229 CB LYS B 48 -15.093 -14.910 3.391 1.00 0.00 C ATOM 2230 CG LYS B 48 -14.828 -14.205 4.711 1.00 0.00 C ATOM 2231 CD LYS B 48 -13.398 -13.691 4.794 1.00 0.00 C ATOM 2232 CE LYS B 48 -13.257 -12.599 5.843 1.00 0.00 C ATOM 2233 NZ LYS B 48 -13.195 -13.156 7.223 1.00 0.00 N ATOM 0 HA LYS B 48 -15.779 -14.503 1.394 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -15.633 -15.836 3.587 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.140 -15.186 2.940 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -15.522 -13.372 4.825 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -15.017 -14.892 5.536 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -12.727 -14.516 5.034 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.092 -13.304 3.822 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.355 -12.020 5.645 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -14.100 -11.912 5.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.787 -12.581 7.856 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -13.544 -14.136 7.218 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.211 -13.141 7.560 1.00 0.00 H new ATOM 2247 N GLU B 49 -17.891 -12.970 3.241 1.00 0.00 N ATOM 2248 CA GLU B 49 -19.294 -12.873 3.619 1.00 0.00 C ATOM 2249 C GLU B 49 -19.697 -11.416 3.838 1.00 0.00 C ATOM 2250 O GLU B 49 -18.855 -10.519 3.816 1.00 0.00 O ATOM 2251 CB GLU B 49 -19.560 -13.688 4.886 1.00 0.00 C ATOM 2252 CG GLU B 49 -20.806 -14.554 4.801 1.00 0.00 C ATOM 2253 CD GLU B 49 -20.893 -15.563 5.930 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -19.829 -16.013 6.407 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -22.024 -15.902 6.337 1.00 0.00 O ATOM 0 H GLU B 49 -17.355 -12.114 3.384 1.00 0.00 H new ATOM 0 HA GLU B 49 -19.895 -13.278 2.805 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -18.698 -14.324 5.086 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -19.657 -13.008 5.732 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -21.689 -13.916 4.820 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -20.814 -15.081 3.847 1.00 0.00 H new ATOM 2262 N GLN B 50 -20.988 -11.189 4.046 1.00 0.00 N ATOM 2263 CA GLN B 50 -21.498 -9.841 4.268 1.00 0.00 C ATOM 2264 C GLN B 50 -21.126 -9.340 5.659 1.00 0.00 C ATOM 2265 O GLN B 50 -20.843 -8.157 5.852 1.00 0.00 O ATOM 2266 CB GLN B 50 -23.017 -9.812 4.092 1.00 0.00 C ATOM 2267 CG GLN B 50 -23.543 -8.484 3.570 1.00 0.00 C ATOM 2268 CD GLN B 50 -25.054 -8.462 3.450 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -25.599 -8.118 2.402 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -25.738 -8.831 4.526 1.00 0.00 N ATOM 0 H GLN B 50 -21.700 -11.919 4.066 1.00 0.00 H new ATOM 0 HA GLN B 50 -21.041 -9.181 3.530 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -23.310 -10.605 3.404 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -23.490 -10.030 5.050 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -23.224 -7.683 4.237 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -23.102 -8.281 2.594 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -25.244 -9.109 5.374 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -26.758 -8.837 4.505 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.132 -10.251 6.628 1.00 0.00 N ATOM 2280 CA GLU B 51 -20.801 -9.903 8.006 1.00 0.00 C ATOM 2281 C GLU B 51 -19.342 -9.477 8.137 1.00 0.00 C ATOM 2282 O GLU B 51 -19.029 -8.519 8.844 1.00 0.00 O ATOM 2283 CB GLU B 51 -21.086 -11.081 8.941 1.00 0.00 C ATOM 2284 CG GLU B 51 -20.660 -12.430 8.383 1.00 0.00 C ATOM 2285 CD GLU B 51 -19.863 -13.250 9.379 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -20.480 -13.827 10.300 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -18.624 -13.316 9.239 1.00 0.00 O ATOM 0 H GLU B 51 -21.362 -11.234 6.485 1.00 0.00 H new ATOM 0 HA GLU B 51 -21.430 -9.060 8.292 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -20.573 -10.913 9.888 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -22.154 -11.110 9.158 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.545 -12.991 8.083 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -20.062 -12.275 7.485 1.00 0.00 H new ATOM 2294 N VAL B 52 -18.448 -10.194 7.461 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.025 -9.879 7.520 1.00 0.00 C ATOM 2296 C VAL B 52 -16.737 -8.497 6.943 1.00 0.00 C ATOM 2297 O VAL B 52 -15.923 -7.753 7.485 1.00 0.00 O ATOM 2298 CB VAL B 52 -16.167 -10.929 6.780 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -16.339 -12.299 7.416 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -16.519 -10.975 5.302 1.00 0.00 C ATOM 0 H VAL B 52 -18.682 -10.992 6.870 1.00 0.00 H new ATOM 0 HA VAL B 52 -16.753 -9.891 8.575 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.121 -10.636 6.867 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -15.728 -13.027 6.883 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.026 -12.258 8.459 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -17.386 -12.596 7.363 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -15.901 -11.722 4.804 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -17.570 -11.238 5.186 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -16.338 -9.998 4.854 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.405 -8.154 5.841 1.00 0.00 N ATOM 2311 CA VAL B 53 -17.200 -6.854 5.205 1.00 0.00 C ATOM 2312 C VAL B 53 -17.404 -5.720 6.201 1.00 0.00 C ATOM 2313 O VAL B 53 -16.510 -4.901 6.411 1.00 0.00 O ATOM 2314 CB VAL B 53 -18.133 -6.625 4.002 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -17.566 -5.536 3.105 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -18.361 -7.913 3.222 1.00 0.00 C ATOM 0 H VAL B 53 -18.086 -8.753 5.374 1.00 0.00 H new ATOM 0 HA VAL B 53 -16.171 -6.859 4.845 1.00 0.00 H new ATOM 0 HB VAL B 53 -19.103 -6.299 4.377 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -18.232 -5.380 2.256 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -17.476 -4.609 3.671 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -16.583 -5.837 2.744 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -19.024 -7.716 2.380 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -17.407 -8.288 2.853 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -18.816 -8.658 3.875 1.00 0.00 H new ATOM 2326 N ASP B 54 -18.581 -5.678 6.821 1.00 0.00 N ATOM 2327 CA ASP B 54 -18.883 -4.641 7.803 1.00 0.00 C ATOM 2328 C ASP B 54 -17.759 -4.547 8.826 1.00 0.00 C ATOM 2329 O ASP B 54 -17.356 -3.456 9.229 1.00 0.00 O ATOM 2330 CB ASP B 54 -20.214 -4.932 8.501 1.00 0.00 C ATOM 2331 CG ASP B 54 -21.325 -4.013 8.031 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -21.253 -2.799 8.316 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -22.267 -4.507 7.376 1.00 0.00 O ATOM 0 H ASP B 54 -19.336 -6.345 6.662 1.00 0.00 H new ATOM 0 HA ASP B 54 -18.969 -3.686 7.285 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -20.500 -5.967 8.316 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -20.088 -4.824 9.578 1.00 0.00 H new ATOM 2338 N LYS B 55 -17.243 -5.705 9.224 1.00 0.00 N ATOM 2339 CA LYS B 55 -16.147 -5.766 10.175 1.00 0.00 C ATOM 2340 C LYS B 55 -14.850 -5.341 9.496 1.00 0.00 C ATOM 2341 O LYS B 55 -13.963 -4.773 10.129 1.00 0.00 O ATOM 2342 CB LYS B 55 -16.010 -7.180 10.741 1.00 0.00 C ATOM 2343 CG LYS B 55 -15.621 -7.212 12.209 1.00 0.00 C ATOM 2344 CD LYS B 55 -15.481 -8.636 12.718 1.00 0.00 C ATOM 2345 CE LYS B 55 -16.776 -9.138 13.335 1.00 0.00 C ATOM 2346 NZ LYS B 55 -17.121 -8.399 14.581 1.00 0.00 N ATOM 0 H LYS B 55 -17.570 -6.615 8.900 1.00 0.00 H new ATOM 0 HA LYS B 55 -16.357 -5.084 10.999 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -16.955 -7.707 10.613 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -15.262 -7.723 10.163 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -14.680 -6.681 12.348 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.374 -6.687 12.797 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -15.191 -9.290 11.896 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -14.682 -8.682 13.459 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -17.587 -9.032 12.614 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -16.684 -10.201 13.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -17.721 -8.997 15.184 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -16.249 -8.155 15.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -17.634 -7.528 14.337 1.00 0.00 H new ATOM 2360 N VAL B 56 -14.759 -5.607 8.194 1.00 0.00 N ATOM 2361 CA VAL B 56 -13.584 -5.237 7.419 1.00 0.00 C ATOM 2362 C VAL B 56 -13.452 -3.721 7.365 1.00 0.00 C ATOM 2363 O VAL B 56 -12.452 -3.159 7.812 1.00 0.00 O ATOM 2364 CB VAL B 56 -13.645 -5.799 5.983 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -12.460 -5.312 5.161 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -13.695 -7.321 6.004 1.00 0.00 C ATOM 0 H VAL B 56 -15.487 -6.078 7.657 1.00 0.00 H new ATOM 0 HA VAL B 56 -12.714 -5.668 7.915 1.00 0.00 H new ATOM 0 HB VAL B 56 -14.558 -5.433 5.513 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -12.524 -5.721 4.153 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -12.474 -4.223 5.113 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -11.532 -5.643 5.628 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -13.738 -7.698 4.982 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -12.803 -7.708 6.496 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -14.581 -7.648 6.549 1.00 0.00 H new ATOM 2376 N MET B 57 -14.476 -3.056 6.831 1.00 0.00 N ATOM 2377 CA MET B 57 -14.465 -1.601 6.747 1.00 0.00 C ATOM 2378 C MET B 57 -14.380 -0.999 8.148 1.00 0.00 C ATOM 2379 O MET B 57 -13.847 0.095 8.337 1.00 0.00 O ATOM 2380 CB MET B 57 -15.715 -1.092 6.019 1.00 0.00 C ATOM 2381 CG MET B 57 -16.975 -1.096 6.874 1.00 0.00 C ATOM 2382 SD MET B 57 -17.441 0.553 7.439 1.00 0.00 S ATOM 2383 CE MET B 57 -17.446 1.458 5.892 1.00 0.00 C ATOM 0 H MET B 57 -15.314 -3.498 6.454 1.00 0.00 H new ATOM 0 HA MET B 57 -13.590 -1.290 6.176 1.00 0.00 H new ATOM 0 HB2 MET B 57 -15.530 -0.077 5.668 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.885 -1.709 5.137 1.00 0.00 H new ATOM 0 HG2 MET B 57 -17.797 -1.524 6.300 1.00 0.00 H new ATOM 0 HG3 MET B 57 -16.820 -1.741 7.739 1.00 0.00 H new ATOM 0 HE1 MET B 57 -18.270 2.172 5.891 1.00 0.00 H new ATOM 0 HE2 MET B 57 -16.503 1.993 5.780 1.00 0.00 H new ATOM 0 HE3 MET B 57 -17.568 0.761 5.063 1.00 0.00 H new ATOM 2393 N GLU B 58 -14.901 -1.735 9.126 1.00 0.00 N ATOM 2394 CA GLU B 58 -14.881 -1.299 10.516 1.00 0.00 C ATOM 2395 C GLU B 58 -13.499 -1.523 11.122 1.00 0.00 C ATOM 2396 O GLU B 58 -13.056 -0.768 11.987 1.00 0.00 O ATOM 2397 CB GLU B 58 -15.941 -2.061 11.318 1.00 0.00 C ATOM 2398 CG GLU B 58 -15.975 -1.690 12.792 1.00 0.00 C ATOM 2399 CD GLU B 58 -16.231 -2.885 13.689 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -15.373 -3.791 13.730 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -17.290 -2.916 14.350 1.00 0.00 O ATOM 0 H GLU B 58 -15.345 -2.642 8.978 1.00 0.00 H new ATOM 0 HA GLU B 58 -15.107 -0.233 10.554 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -16.921 -1.870 10.881 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -15.754 -3.131 11.226 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -15.027 -1.229 13.069 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -16.752 -0.944 12.957 1.00 0.00 H new ATOM 2408 N THR B 59 -12.821 -2.565 10.650 1.00 0.00 N ATOM 2409 CA THR B 59 -11.484 -2.899 11.128 1.00 0.00 C ATOM 2410 C THR B 59 -10.443 -1.957 10.525 1.00 0.00 C ATOM 2411 O THR B 59 -9.318 -1.863 11.016 1.00 0.00 O ATOM 2412 CB THR B 59 -11.151 -4.356 10.782 1.00 0.00 C ATOM 2413 OG1 THR B 59 -11.976 -5.240 11.517 1.00 0.00 O ATOM 2414 CG2 THR B 59 -9.713 -4.737 11.066 1.00 0.00 C ATOM 0 H THR B 59 -13.179 -3.196 9.933 1.00 0.00 H new ATOM 0 HA THR B 59 -11.463 -2.780 12.211 1.00 0.00 H new ATOM 0 HB THR B 59 -11.323 -4.441 9.709 1.00 0.00 H new ATOM 0 HG1 THR B 59 -12.915 -5.073 11.293 1.00 0.00 H new ATOM 0 HG21 THR B 59 -9.553 -5.781 10.796 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.046 -4.105 10.480 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.503 -4.600 12.127 1.00 0.00 H new ATOM 2422 N LEU B 60 -10.828 -1.260 9.459 1.00 0.00 N ATOM 2423 CA LEU B 60 -9.933 -0.325 8.788 1.00 0.00 C ATOM 2424 C LEU B 60 -10.238 1.118 9.186 1.00 0.00 C ATOM 2425 O LEU B 60 -9.482 2.031 8.853 1.00 0.00 O ATOM 2426 CB LEU B 60 -10.057 -0.474 7.274 1.00 0.00 C ATOM 2427 CG LEU B 60 -9.191 -1.572 6.661 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -9.736 -1.981 5.300 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -7.748 -1.104 6.552 1.00 0.00 C ATOM 0 H LEU B 60 -11.756 -1.326 9.042 1.00 0.00 H new ATOM 0 HA LEU B 60 -8.914 -0.559 9.097 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -11.100 -0.675 7.028 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -9.796 0.476 6.808 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.218 -2.446 7.312 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.107 -2.764 4.877 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -10.754 -2.354 5.413 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -9.738 -1.118 4.634 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -7.141 -1.896 6.113 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -7.700 -0.217 5.920 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -7.368 -0.863 7.545 1.00 0.00 H new ATOM 2441 N ASP B 61 -11.354 1.316 9.889 1.00 0.00 N ATOM 2442 CA ASP B 61 -11.771 2.646 10.329 1.00 0.00 C ATOM 2443 C ASP B 61 -10.579 3.494 10.774 1.00 0.00 C ATOM 2444 O ASP B 61 -10.090 3.360 11.894 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.786 2.525 11.468 1.00 0.00 C ATOM 2446 CG ASP B 61 -12.197 1.864 12.700 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -11.316 0.994 12.543 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -12.621 2.217 13.822 1.00 0.00 O ATOM 0 H ASP B 61 -11.988 0.567 10.167 1.00 0.00 H new ATOM 0 HA ASP B 61 -12.235 3.148 9.480 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.152 3.517 11.731 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -13.645 1.949 11.125 1.00 0.00 H new ATOM 2453 N ASN B 62 -10.118 4.367 9.880 1.00 0.00 N ATOM 2454 CA ASN B 62 -8.986 5.238 10.173 1.00 0.00 C ATOM 2455 C ASN B 62 -9.375 6.345 11.151 1.00 0.00 C ATOM 2456 O ASN B 62 -8.517 7.087 11.632 1.00 0.00 O ATOM 2457 CB ASN B 62 -8.456 5.857 8.881 1.00 0.00 C ATOM 2458 CG ASN B 62 -6.998 6.261 8.988 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -6.244 6.044 7.916 1.00 0.00 O flip ATOM 2460 ND2 ASN B 62 -6.555 6.764 10.020 1.00 0.00 N flip ATOM 0 H ASN B 62 -10.512 4.488 8.947 1.00 0.00 H new ATOM 0 HA ASN B 62 -8.207 4.632 10.636 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -8.573 5.144 8.065 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -9.055 6.732 8.628 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -7.170 6.913 10.820 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -5.572 7.032 10.076 1.00 0.00 H new ATOM 2467 N ASP B 63 -10.672 6.459 11.433 1.00 0.00 N ATOM 2468 CA ASP B 63 -11.185 7.479 12.344 1.00 0.00 C ATOM 2469 C ASP B 63 -11.301 8.821 11.633 1.00 0.00 C ATOM 2470 O ASP B 63 -11.173 9.878 12.250 1.00 0.00 O ATOM 2471 CB ASP B 63 -10.287 7.615 13.579 1.00 0.00 C ATOM 2472 CG ASP B 63 -11.084 7.744 14.863 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -12.035 6.957 15.052 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -10.757 8.631 15.678 1.00 0.00 O ATOM 0 H ASP B 63 -11.391 5.852 11.040 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.176 7.166 12.672 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -9.633 6.746 13.647 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -9.645 8.489 13.464 1.00 0.00 H new ATOM 2479 N GLY B 64 -11.549 8.769 10.327 1.00 0.00 N ATOM 2480 CA GLY B 64 -11.683 9.983 9.548 1.00 0.00 C ATOM 2481 C GLY B 64 -13.101 10.516 9.552 1.00 0.00 C ATOM 2482 O GLY B 64 -13.315 11.729 9.570 1.00 0.00 O ATOM 0 H GLY B 64 -11.659 7.905 9.796 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -11.011 10.743 9.946 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -11.373 9.789 8.521 1.00 0.00 H new ATOM 2486 N ASP B 65 -14.073 9.610 9.533 1.00 0.00 N ATOM 2487 CA ASP B 65 -15.480 10.001 9.535 1.00 0.00 C ATOM 2488 C ASP B 65 -16.387 8.782 9.680 1.00 0.00 C ATOM 2489 O ASP B 65 -17.455 8.715 9.072 1.00 0.00 O ATOM 2490 CB ASP B 65 -15.819 10.758 8.248 1.00 0.00 C ATOM 2491 CG ASP B 65 -15.744 12.262 8.424 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -16.615 12.823 9.120 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -14.811 12.878 7.866 1.00 0.00 O ATOM 0 H ASP B 65 -13.914 8.603 9.516 1.00 0.00 H new ATOM 0 HA ASP B 65 -15.649 10.656 10.390 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -15.132 10.453 7.459 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -16.822 10.483 7.922 1.00 0.00 H new ATOM 2498 N GLY B 66 -15.954 7.820 10.489 1.00 0.00 N ATOM 2499 CA GLY B 66 -16.740 6.619 10.698 1.00 0.00 C ATOM 2500 C GLY B 66 -16.992 5.857 9.409 1.00 0.00 C ATOM 2501 O GLY B 66 -17.895 5.022 9.341 1.00 0.00 O ATOM 0 H GLY B 66 -15.073 7.851 11.003 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.224 5.970 11.405 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -17.695 6.888 11.150 1.00 0.00 H new ATOM 2505 N GLU B 67 -16.194 6.144 8.386 1.00 0.00 N ATOM 2506 CA GLU B 67 -16.327 5.490 7.099 1.00 0.00 C ATOM 2507 C GLU B 67 -14.941 5.185 6.533 1.00 0.00 C ATOM 2508 O GLU B 67 -13.936 5.374 7.220 1.00 0.00 O ATOM 2509 CB GLU B 67 -17.151 6.356 6.149 1.00 0.00 C ATOM 2510 CG GLU B 67 -16.412 7.573 5.640 1.00 0.00 C ATOM 2511 CD GLU B 67 -17.235 8.843 5.755 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -18.478 8.739 5.846 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -16.640 9.941 5.754 1.00 0.00 O ATOM 0 H GLU B 67 -15.443 6.833 8.430 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.857 4.545 7.220 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -17.464 5.750 5.299 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -18.057 6.680 6.661 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.485 7.692 6.201 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -16.135 7.416 4.597 1.00 0.00 H new ATOM 2520 N CYS B 68 -14.878 4.685 5.305 1.00 0.00 N ATOM 2521 CA CYS B 68 -13.593 4.332 4.705 1.00 0.00 C ATOM 2522 C CYS B 68 -13.198 5.281 3.581 1.00 0.00 C ATOM 2523 O CYS B 68 -13.879 5.366 2.570 1.00 0.00 O ATOM 2524 CB CYS B 68 -13.645 2.904 4.165 1.00 0.00 C ATOM 2525 SG CYS B 68 -13.484 1.626 5.434 1.00 0.00 S ATOM 0 H CYS B 68 -15.689 4.516 4.710 1.00 0.00 H new ATOM 0 HA CYS B 68 -12.840 4.413 5.489 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -14.589 2.761 3.638 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -12.848 2.775 3.432 1.00 0.00 H new ATOM 0 HG CYS B 68 -14.111 2.001 6.509 1.00 0.00 H new ATOM 2531 N ASP B 69 -12.075 5.969 3.755 1.00 0.00 N ATOM 2532 CA ASP B 69 -11.574 6.889 2.735 1.00 0.00 C ATOM 2533 C ASP B 69 -10.444 6.226 1.946 1.00 0.00 C ATOM 2534 O ASP B 69 -10.237 5.019 2.050 1.00 0.00 O ATOM 2535 CB ASP B 69 -11.094 8.208 3.357 1.00 0.00 C ATOM 2536 CG ASP B 69 -10.837 8.115 4.851 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -10.359 7.054 5.307 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -11.111 9.102 5.563 1.00 0.00 O ATOM 0 H ASP B 69 -11.493 5.909 4.591 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.394 7.124 2.056 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -10.178 8.524 2.858 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.840 8.981 3.172 1.00 0.00 H new ATOM 2543 N PHE B 70 -9.716 7.007 1.155 1.00 0.00 N ATOM 2544 CA PHE B 70 -8.617 6.462 0.363 1.00 0.00 C ATOM 2545 C PHE B 70 -7.417 6.119 1.244 1.00 0.00 C ATOM 2546 O PHE B 70 -6.486 5.446 0.806 1.00 0.00 O ATOM 2547 CB PHE B 70 -8.220 7.455 -0.743 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.758 7.470 -1.098 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -5.862 8.240 -0.374 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -6.285 6.723 -2.166 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -4.522 8.267 -0.709 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -4.945 6.743 -2.504 1.00 0.00 C ATOM 2553 CZ PHE B 70 -4.062 7.518 -1.775 1.00 0.00 C ATOM 0 H PHE B 70 -9.864 8.010 1.045 1.00 0.00 H new ATOM 0 HA PHE B 70 -8.956 5.537 -0.103 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -8.793 7.222 -1.641 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -8.512 8.458 -0.430 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -6.215 8.826 0.462 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -6.971 6.119 -2.740 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.834 8.873 -0.138 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -4.588 6.154 -3.336 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.015 7.538 -2.038 1.00 0.00 H new ATOM 2563 N GLN B 71 -7.443 6.587 2.482 1.00 0.00 N ATOM 2564 CA GLN B 71 -6.348 6.333 3.412 1.00 0.00 C ATOM 2565 C GLN B 71 -6.470 4.961 4.077 1.00 0.00 C ATOM 2566 O GLN B 71 -5.463 4.346 4.430 1.00 0.00 O ATOM 2567 CB GLN B 71 -6.300 7.424 4.483 1.00 0.00 C ATOM 2568 CG GLN B 71 -7.536 7.465 5.364 1.00 0.00 C ATOM 2569 CD GLN B 71 -7.341 8.316 6.604 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -6.222 8.713 6.928 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -8.433 8.602 7.303 1.00 0.00 N ATOM 0 H GLN B 71 -8.206 7.143 2.867 1.00 0.00 H new ATOM 0 HA GLN B 71 -5.423 6.344 2.836 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -5.422 7.268 5.110 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -6.177 8.392 3.998 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -8.375 7.856 4.788 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -7.799 6.450 5.662 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -9.341 8.251 6.997 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -8.364 9.172 8.146 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.700 4.488 4.259 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.925 3.195 4.901 1.00 0.00 C ATOM 2582 C GLU B 72 -7.763 2.034 3.921 1.00 0.00 C ATOM 2583 O GLU B 72 -7.289 0.962 4.294 1.00 0.00 O ATOM 2584 CB GLU B 72 -9.317 3.145 5.536 1.00 0.00 C ATOM 2585 CG GLU B 72 -10.453 3.067 4.529 1.00 0.00 C ATOM 2586 CD GLU B 72 -10.665 1.666 3.983 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -10.412 0.695 4.726 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -11.081 1.543 2.812 1.00 0.00 O ATOM 0 H GLU B 72 -8.550 4.975 3.974 1.00 0.00 H new ATOM 0 HA GLU B 72 -7.168 3.087 5.678 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -9.372 2.281 6.198 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -9.455 4.031 6.156 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -11.374 3.411 5.001 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -10.246 3.746 3.702 1.00 0.00 H new ATOM 2595 N PHE B 73 -8.170 2.244 2.672 1.00 0.00 N ATOM 2596 CA PHE B 73 -8.074 1.198 1.660 1.00 0.00 C ATOM 2597 C PHE B 73 -6.655 1.096 1.113 1.00 0.00 C ATOM 2598 O PHE B 73 -6.224 0.027 0.684 1.00 0.00 O ATOM 2599 CB PHE B 73 -9.108 1.445 0.545 1.00 0.00 C ATOM 2600 CG PHE B 73 -8.588 2.160 -0.670 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -7.677 1.559 -1.519 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -9.023 3.440 -0.957 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -7.209 2.223 -2.634 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -8.559 4.114 -2.069 1.00 0.00 C ATOM 2605 CZ PHE B 73 -7.649 3.504 -2.909 1.00 0.00 C ATOM 0 H PHE B 73 -8.567 3.123 2.339 1.00 0.00 H new ATOM 0 HA PHE B 73 -8.304 0.237 2.121 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -9.517 0.484 0.233 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -9.934 2.023 0.960 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -7.328 0.559 -1.307 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -9.736 3.920 -0.302 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -6.500 1.742 -3.291 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.907 5.114 -2.281 1.00 0.00 H new ATOM 0 HZ PHE B 73 -7.282 4.027 -3.780 1.00 0.00 H new ATOM 2615 N MET B 74 -5.926 2.204 1.147 1.00 0.00 N ATOM 2616 CA MET B 74 -4.551 2.216 0.670 1.00 0.00 C ATOM 2617 C MET B 74 -3.665 1.412 1.610 1.00 0.00 C ATOM 2618 O MET B 74 -2.975 0.482 1.188 1.00 0.00 O ATOM 2619 CB MET B 74 -4.038 3.647 0.562 1.00 0.00 C ATOM 2620 CG MET B 74 -4.482 4.346 -0.708 1.00 0.00 C ATOM 2621 SD MET B 74 -3.833 3.569 -2.203 1.00 0.00 S ATOM 2622 CE MET B 74 -2.155 3.194 -1.703 1.00 0.00 C ATOM 0 H MET B 74 -6.262 3.101 1.498 1.00 0.00 H new ATOM 0 HA MET B 74 -4.522 1.761 -0.320 1.00 0.00 H new ATOM 0 HB2 MET B 74 -4.386 4.217 1.423 1.00 0.00 H new ATOM 0 HB3 MET B 74 -2.949 3.640 0.603 1.00 0.00 H new ATOM 0 HG2 MET B 74 -5.571 4.352 -0.751 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.159 5.386 -0.676 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.492 3.276 -2.564 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.839 3.898 -0.933 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.112 2.180 -1.307 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.701 1.764 2.890 1.00 0.00 N ATOM 2633 CA ALA B 75 -2.914 1.062 3.890 1.00 0.00 C ATOM 2634 C ALA B 75 -3.376 -0.385 4.009 1.00 0.00 C ATOM 2635 O ALA B 75 -2.617 -1.255 4.420 1.00 0.00 O ATOM 2636 CB ALA B 75 -3.015 1.765 5.236 1.00 0.00 C ATOM 0 H ALA B 75 -4.266 2.530 3.257 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.870 1.067 3.576 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.420 1.226 5.973 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -2.641 2.785 5.143 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -4.056 1.788 5.557 1.00 0.00 H new ATOM 2642 N PHE B 76 -4.630 -0.630 3.635 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.212 -1.967 3.688 1.00 0.00 C ATOM 2644 C PHE B 76 -4.469 -2.924 2.771 1.00 0.00 C ATOM 2645 O PHE B 76 -3.701 -3.767 3.231 1.00 0.00 O ATOM 2646 CB PHE B 76 -6.678 -1.902 3.269 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.345 -3.242 3.144 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -7.759 -3.938 4.267 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -7.557 -3.801 1.897 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -8.373 -5.170 4.148 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -8.170 -5.033 1.769 1.00 0.00 C ATOM 2652 CZ PHE B 76 -8.580 -5.718 2.896 1.00 0.00 C ATOM 0 H PHE B 76 -5.267 0.088 3.289 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.131 -2.335 4.711 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.226 -1.303 3.997 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.748 -1.384 2.313 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.600 -3.513 5.247 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.240 -3.268 1.013 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -8.691 -5.704 5.031 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.328 -5.459 0.789 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.061 -6.680 2.799 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.702 -2.787 1.467 1.00 0.00 N ATOM 2663 CA VAL B 77 -4.049 -3.645 0.487 1.00 0.00 C ATOM 2664 C VAL B 77 -2.568 -3.792 0.803 1.00 0.00 C ATOM 2665 O VAL B 77 -1.957 -4.819 0.514 1.00 0.00 O ATOM 2666 CB VAL B 77 -4.195 -3.087 -0.940 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -5.596 -3.341 -1.476 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -3.864 -1.602 -0.971 1.00 0.00 C ATOM 0 H VAL B 77 -5.335 -2.093 1.069 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.539 -4.617 0.540 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.487 -3.607 -1.585 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -5.678 -2.939 -2.486 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -5.789 -4.414 -1.496 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -6.326 -2.853 -0.831 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.973 -1.226 -1.988 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -4.544 -1.064 -0.310 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -2.838 -1.451 -0.636 1.00 0.00 H new ATOM 2678 N ALA B 78 -2.004 -2.750 1.400 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.589 -2.746 1.759 1.00 0.00 C ATOM 2680 C ALA B 78 -0.338 -3.409 3.113 1.00 0.00 C ATOM 2681 O ALA B 78 0.698 -4.039 3.316 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.056 -1.322 1.765 1.00 0.00 C ATOM 0 H ALA B 78 -2.504 -1.896 1.647 1.00 0.00 H new ATOM 0 HA ALA B 78 -0.058 -3.330 1.007 1.00 0.00 H new ATOM 0 HB1 ALA B 78 1.000 -1.330 2.034 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.175 -0.885 0.774 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -0.611 -0.729 2.492 1.00 0.00 H new ATOM 2688 N MET B 79 -1.278 -3.252 4.041 1.00 0.00 N ATOM 2689 CA MET B 79 -1.137 -3.828 5.377 1.00 0.00 C ATOM 2690 C MET B 79 -1.557 -5.296 5.395 1.00 0.00 C ATOM 2691 O MET B 79 -0.910 -6.135 6.028 1.00 0.00 O ATOM 2692 CB MET B 79 -1.951 -3.017 6.403 1.00 0.00 C ATOM 2693 CG MET B 79 -3.461 -3.201 6.320 1.00 0.00 C ATOM 2694 SD MET B 79 -4.240 -3.320 7.942 1.00 0.00 S ATOM 2695 CE MET B 79 -5.919 -3.738 7.482 1.00 0.00 C ATOM 0 H MET B 79 -2.143 -2.733 3.894 1.00 0.00 H new ATOM 0 HA MET B 79 -0.084 -3.780 5.653 1.00 0.00 H new ATOM 0 HB2 MET B 79 -1.621 -3.293 7.405 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.722 -1.960 6.272 1.00 0.00 H new ATOM 0 HG2 MET B 79 -3.895 -2.363 5.774 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.682 -4.103 5.749 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.615 -3.254 8.167 1.00 0.00 H new ATOM 0 HE2 MET B 79 -6.114 -3.396 6.465 1.00 0.00 H new ATOM 0 HE3 MET B 79 -6.052 -4.819 7.533 1.00 0.00 H new ATOM 2705 N VAL B 80 -2.638 -5.598 4.694 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.152 -6.953 4.625 1.00 0.00 C ATOM 2707 C VAL B 80 -2.225 -7.846 3.806 1.00 0.00 C ATOM 2708 O VAL B 80 -2.027 -9.019 4.129 1.00 0.00 O ATOM 2709 CB VAL B 80 -4.571 -6.963 4.023 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.135 -8.375 3.968 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -5.486 -6.050 4.826 1.00 0.00 C ATOM 0 H VAL B 80 -3.179 -4.916 4.162 1.00 0.00 H new ATOM 0 HA VAL B 80 -3.200 -7.348 5.640 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.511 -6.590 3.000 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -6.137 -8.350 3.539 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.491 -9.000 3.350 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.182 -8.787 4.976 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.486 -6.064 4.392 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -5.533 -6.398 5.858 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.095 -5.033 4.804 1.00 0.00 H new ATOM 2721 N THR B 81 -1.645 -7.278 2.750 1.00 0.00 N ATOM 2722 CA THR B 81 -0.728 -8.021 1.896 1.00 0.00 C ATOM 2723 C THR B 81 0.611 -8.242 2.600 1.00 0.00 C ATOM 2724 O THR B 81 1.143 -9.352 2.613 1.00 0.00 O ATOM 2725 CB THR B 81 -0.517 -7.277 0.572 1.00 0.00 C ATOM 2726 OG1 THR B 81 0.047 -8.133 -0.406 1.00 0.00 O ATOM 2727 CG2 THR B 81 0.382 -6.062 0.691 1.00 0.00 C ATOM 0 H THR B 81 -1.795 -6.309 2.468 1.00 0.00 H new ATOM 0 HA THR B 81 -1.168 -8.996 1.686 1.00 0.00 H new ATOM 0 HB THR B 81 -1.512 -6.941 0.279 1.00 0.00 H new ATOM 0 HG1 THR B 81 -0.658 -8.686 -0.802 1.00 0.00 H new ATOM 0 HG21 THR B 81 0.484 -5.588 -0.285 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.055 -5.353 1.394 1.00 0.00 H new ATOM 0 HG23 THR B 81 1.364 -6.370 1.049 1.00 0.00 H new ATOM 2735 N THR B 82 1.150 -7.174 3.184 1.00 0.00 N ATOM 2736 CA THR B 82 2.429 -7.243 3.885 1.00 0.00 C ATOM 2737 C THR B 82 2.434 -8.350 4.936 1.00 0.00 C ATOM 2738 O THR B 82 3.480 -8.920 5.236 1.00 0.00 O ATOM 2739 CB THR B 82 2.749 -5.903 4.550 1.00 0.00 C ATOM 2740 OG1 THR B 82 1.596 -5.359 5.166 1.00 0.00 O ATOM 2741 CG2 THR B 82 3.288 -4.870 3.584 1.00 0.00 C ATOM 0 H THR B 82 0.720 -6.249 3.185 1.00 0.00 H new ATOM 0 HA THR B 82 3.194 -7.471 3.143 1.00 0.00 H new ATOM 0 HB THR B 82 3.521 -6.124 5.288 1.00 0.00 H new ATOM 0 HG1 THR B 82 1.210 -4.670 4.586 1.00 0.00 H new ATOM 0 HG21 THR B 82 3.494 -3.943 4.120 1.00 0.00 H new ATOM 0 HG22 THR B 82 4.208 -5.240 3.132 1.00 0.00 H new ATOM 0 HG23 THR B 82 2.550 -4.682 2.804 1.00 0.00 H new ATOM 2749 N ALA B 83 1.268 -8.643 5.501 1.00 0.00 N ATOM 2750 CA ALA B 83 1.173 -9.679 6.523 1.00 0.00 C ATOM 2751 C ALA B 83 1.237 -11.081 5.924 1.00 0.00 C ATOM 2752 O ALA B 83 2.210 -11.806 6.130 1.00 0.00 O ATOM 2753 CB ALA B 83 -0.101 -9.517 7.335 1.00 0.00 C ATOM 0 H ALA B 83 0.386 -8.185 5.273 1.00 0.00 H new ATOM 0 HA ALA B 83 2.034 -9.559 7.181 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -0.152 -10.300 8.092 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -0.101 -8.542 7.821 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -0.965 -9.593 6.675 1.00 0.00 H new ATOM 2759 N CYS B 84 0.188 -11.471 5.203 1.00 0.00 N ATOM 2760 CA CYS B 84 0.132 -12.805 4.608 1.00 0.00 C ATOM 2761 C CYS B 84 0.792 -12.859 3.234 1.00 0.00 C ATOM 2762 O CYS B 84 1.685 -13.676 3.007 1.00 0.00 O ATOM 2763 CB CYS B 84 -1.318 -13.287 4.514 1.00 0.00 C ATOM 2764 SG CYS B 84 -1.679 -14.738 5.529 1.00 0.00 S ATOM 0 H CYS B 84 -0.628 -10.888 5.017 1.00 0.00 H new ATOM 0 HA CYS B 84 0.695 -13.469 5.264 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -1.980 -12.474 4.812 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -1.546 -13.519 3.474 1.00 0.00 H new ATOM 0 HG CYS B 84 -0.694 -15.582 5.445 1.00 0.00 H new ATOM 2770 N HIS B 85 0.355 -11.996 2.318 1.00 0.00 N ATOM 2771 CA HIS B 85 0.920 -11.968 0.967 1.00 0.00 C ATOM 2772 C HIS B 85 2.444 -12.048 1.018 1.00 0.00 C ATOM 2773 O HIS B 85 3.086 -12.529 0.086 1.00 0.00 O ATOM 2774 CB HIS B 85 0.489 -10.697 0.235 1.00 0.00 C ATOM 2775 CG HIS B 85 0.544 -10.804 -1.260 1.00 0.00 C ATOM 2776 ND1 HIS B 85 -0.310 -10.111 -2.094 1.00 0.00 N ATOM 2777 CD2 HIS B 85 1.362 -11.515 -2.074 1.00 0.00 C ATOM 2778 CE1 HIS B 85 -0.019 -10.392 -3.353 1.00 0.00 C ATOM 2779 NE2 HIS B 85 0.991 -11.241 -3.366 1.00 0.00 N ATOM 0 H HIS B 85 -0.383 -11.311 2.483 1.00 0.00 H new ATOM 0 HA HIS B 85 0.543 -12.834 0.423 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -0.529 -10.446 0.534 1.00 0.00 H new ATOM 0 HB3 HIS B 85 1.127 -9.873 0.553 1.00 0.00 H new ATOM 0 HD2 HIS B 85 2.158 -12.175 -1.763 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -0.522 -9.995 -4.222 1.00 0.00 H new ATOM 0 HE2 HIS B 85 1.426 -11.631 -4.202 1.00 0.00 H new ATOM 2788 N GLU B 86 3.010 -11.570 2.120 1.00 0.00 N ATOM 2789 CA GLU B 86 4.453 -11.575 2.314 1.00 0.00 C ATOM 2790 C GLU B 86 5.073 -12.912 1.917 1.00 0.00 C ATOM 2791 O GLU B 86 5.848 -12.986 0.964 1.00 0.00 O ATOM 2792 CB GLU B 86 4.763 -11.264 3.783 1.00 0.00 C ATOM 2793 CG GLU B 86 6.195 -11.570 4.200 1.00 0.00 C ATOM 2794 CD GLU B 86 7.212 -10.713 3.473 1.00 0.00 C ATOM 2795 OE1 GLU B 86 6.806 -9.710 2.846 1.00 0.00 O ATOM 2796 OE2 GLU B 86 8.415 -11.043 3.530 1.00 0.00 O ATOM 0 H GLU B 86 2.485 -11.171 2.898 1.00 0.00 H new ATOM 0 HA GLU B 86 4.889 -10.811 1.670 1.00 0.00 H new ATOM 0 HB2 GLU B 86 4.560 -10.209 3.969 1.00 0.00 H new ATOM 0 HB3 GLU B 86 4.083 -11.836 4.415 1.00 0.00 H new ATOM 0 HG2 GLU B 86 6.297 -11.415 5.274 1.00 0.00 H new ATOM 0 HG3 GLU B 86 6.408 -12.621 4.008 1.00 0.00 H new ATOM 2803 N PHE B 87 4.727 -13.962 2.649 1.00 0.00 N ATOM 2804 CA PHE B 87 5.255 -15.292 2.371 1.00 0.00 C ATOM 2805 C PHE B 87 4.133 -16.254 1.996 1.00 0.00 C ATOM 2806 O PHE B 87 4.349 -17.224 1.270 1.00 0.00 O ATOM 2807 CB PHE B 87 6.024 -15.820 3.585 1.00 0.00 C ATOM 2808 CG PHE B 87 7.453 -16.175 3.284 1.00 0.00 C ATOM 2809 CD1 PHE B 87 8.417 -15.187 3.155 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.833 -17.500 3.133 1.00 0.00 C ATOM 2811 CE1 PHE B 87 9.732 -15.514 2.878 1.00 0.00 C ATOM 2812 CE2 PHE B 87 9.144 -17.832 2.857 1.00 0.00 C ATOM 2813 CZ PHE B 87 10.095 -16.838 2.730 1.00 0.00 C ATOM 0 H PHE B 87 4.084 -13.920 3.439 1.00 0.00 H new ATOM 0 HA PHE B 87 5.938 -15.219 1.525 1.00 0.00 H new ATOM 0 HB2 PHE B 87 6.004 -15.067 4.373 1.00 0.00 H new ATOM 0 HB3 PHE B 87 5.513 -16.701 3.973 1.00 0.00 H new ATOM 0 HD1 PHE B 87 8.138 -14.150 3.272 1.00 0.00 H new ATOM 0 HD2 PHE B 87 7.094 -18.282 3.233 1.00 0.00 H new ATOM 0 HE1 PHE B 87 10.474 -14.735 2.778 1.00 0.00 H new ATOM 0 HE2 PHE B 87 9.426 -18.868 2.740 1.00 0.00 H new ATOM 0 HZ PHE B 87 11.121 -17.096 2.515 1.00 0.00 H new ATOM 2823 N PHE B 88 2.933 -15.976 2.493 1.00 0.00 N ATOM 2824 CA PHE B 88 1.777 -16.814 2.207 1.00 0.00 C ATOM 2825 C PHE B 88 1.139 -16.431 0.875 1.00 0.00 C ATOM 2826 O PHE B 88 0.341 -17.188 0.323 1.00 0.00 O ATOM 2827 CB PHE B 88 0.747 -16.700 3.332 1.00 0.00 C ATOM 2828 CG PHE B 88 1.332 -16.884 4.703 1.00 0.00 C ATOM 2829 CD1 PHE B 88 1.960 -15.831 5.349 1.00 0.00 C ATOM 2830 CD2 PHE B 88 1.253 -18.108 5.345 1.00 0.00 C ATOM 2831 CE1 PHE B 88 2.499 -15.997 6.610 1.00 0.00 C ATOM 2832 CE2 PHE B 88 1.791 -18.280 6.606 1.00 0.00 C ATOM 2833 CZ PHE B 88 2.415 -17.223 7.240 1.00 0.00 C ATOM 0 H PHE B 88 2.736 -15.177 3.096 1.00 0.00 H new ATOM 0 HA PHE B 88 2.118 -17.847 2.139 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.269 -15.722 3.278 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -0.033 -17.445 3.176 1.00 0.00 H new ATOM 0 HD1 PHE B 88 2.029 -14.870 4.861 1.00 0.00 H new ATOM 0 HD2 PHE B 88 0.765 -18.938 4.855 1.00 0.00 H new ATOM 0 HE1 PHE B 88 2.986 -15.168 7.103 1.00 0.00 H new ATOM 0 HE2 PHE B 88 1.724 -19.240 7.096 1.00 0.00 H new ATOM 0 HZ PHE B 88 2.836 -17.355 8.226 1.00 0.00 H new ATOM 2909 N ARG C 2 0.172 14.026 8.628 1.00 0.00 N ATOM 2910 CA ARG C 2 -0.232 15.088 7.717 1.00 0.00 C ATOM 2911 C ARG C 2 0.965 15.604 6.925 1.00 0.00 C ATOM 2912 O ARG C 2 1.085 15.347 5.727 1.00 0.00 O ATOM 2913 CB ARG C 2 -0.882 16.235 8.495 1.00 0.00 C ATOM 2914 CG ARG C 2 -2.095 16.833 7.800 1.00 0.00 C ATOM 2915 CD ARG C 2 -2.314 18.280 8.211 1.00 0.00 C ATOM 2916 NE ARG C 2 -1.191 19.134 7.826 1.00 0.00 N ATOM 2917 CZ ARG C 2 -1.253 20.462 7.780 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -2.378 21.093 8.094 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -0.187 21.163 7.419 1.00 0.00 N ATOM 0 HA ARG C 2 -0.960 14.679 7.016 1.00 0.00 H new ATOM 0 HB2 ARG C 2 -1.180 15.872 9.479 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -0.142 17.019 8.655 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -1.962 16.777 6.720 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -2.981 16.246 8.043 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -3.228 18.654 7.750 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -2.457 18.333 9.290 1.00 0.00 H new ATOM 0 HE ARG C 2 -0.309 18.685 7.578 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -3.201 20.559 8.373 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -2.419 22.111 8.057 1.00 0.00 H new ATOM 0 HH21 ARG C 2 0.680 20.684 7.177 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -0.234 22.181 7.384 1.00 0.00 H new ATOM 2932 N THR C 3 1.851 16.329 7.601 1.00 0.00 N ATOM 2933 CA THR C 3 3.040 16.874 6.954 1.00 0.00 C ATOM 2934 C THR C 3 4.273 16.015 7.232 1.00 0.00 C ATOM 2935 O THR C 3 5.327 16.221 6.630 1.00 0.00 O ATOM 2936 CB THR C 3 3.286 18.310 7.418 1.00 0.00 C ATOM 2937 OG1 THR C 3 4.376 18.883 6.718 1.00 0.00 O ATOM 2938 CG2 THR C 3 3.582 18.418 8.897 1.00 0.00 C ATOM 0 H THR C 3 1.769 16.552 8.593 1.00 0.00 H new ATOM 0 HA THR C 3 2.863 16.870 5.878 1.00 0.00 H new ATOM 0 HB THR C 3 2.359 18.844 7.210 1.00 0.00 H new ATOM 0 HG1 THR C 3 5.040 18.189 6.522 1.00 0.00 H new ATOM 0 HG21 THR C 3 3.747 19.463 9.160 1.00 0.00 H new ATOM 0 HG22 THR C 3 2.738 18.029 9.466 1.00 0.00 H new ATOM 0 HG23 THR C 3 4.475 17.840 9.132 1.00 0.00 H new ATOM 2946 N LYS C 4 4.138 15.057 8.143 1.00 0.00 N ATOM 2947 CA LYS C 4 5.242 14.169 8.494 1.00 0.00 C ATOM 2948 C LYS C 4 5.379 13.034 7.476 1.00 0.00 C ATOM 2949 O LYS C 4 6.267 12.190 7.591 1.00 0.00 O ATOM 2950 CB LYS C 4 5.021 13.594 9.896 1.00 0.00 C ATOM 2951 CG LYS C 4 6.174 12.742 10.402 1.00 0.00 C ATOM 2952 CD LYS C 4 5.699 11.367 10.842 1.00 0.00 C ATOM 2953 CE LYS C 4 6.860 10.397 10.994 1.00 0.00 C ATOM 2954 NZ LYS C 4 7.543 10.553 12.307 1.00 0.00 N ATOM 0 H LYS C 4 3.274 14.875 8.653 1.00 0.00 H new ATOM 0 HA LYS C 4 6.165 14.748 8.483 1.00 0.00 H new ATOM 0 HB2 LYS C 4 4.856 14.416 10.593 1.00 0.00 H new ATOM 0 HB3 LYS C 4 4.112 12.992 9.892 1.00 0.00 H new ATOM 0 HG2 LYS C 4 6.922 12.636 9.616 1.00 0.00 H new ATOM 0 HG3 LYS C 4 6.660 13.245 11.238 1.00 0.00 H new ATOM 0 HD2 LYS C 4 5.168 11.451 11.790 1.00 0.00 H new ATOM 0 HD3 LYS C 4 4.990 10.976 10.113 1.00 0.00 H new ATOM 0 HE2 LYS C 4 6.495 9.375 10.893 1.00 0.00 H new ATOM 0 HE3 LYS C 4 7.577 10.560 10.190 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 8.273 9.819 12.408 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 7.986 11.492 12.358 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 6.847 10.456 13.074 1.00 0.00 H new ATOM 2968 N ILE C 5 4.475 13.013 6.492 1.00 0.00 N ATOM 2969 CA ILE C 5 4.447 11.986 5.444 1.00 0.00 C ATOM 2970 C ILE C 5 4.512 10.560 6.013 1.00 0.00 C ATOM 2971 O ILE C 5 4.581 9.586 5.263 1.00 0.00 O ATOM 2972 CB ILE C 5 5.542 12.170 4.362 1.00 0.00 C ATOM 2973 CG1 ILE C 5 6.808 12.849 4.902 1.00 0.00 C ATOM 2974 CG2 ILE C 5 4.985 12.968 3.192 1.00 0.00 C ATOM 2975 CD1 ILE C 5 6.621 14.309 5.247 1.00 0.00 C ATOM 0 H ILE C 5 3.738 13.712 6.399 1.00 0.00 H new ATOM 0 HA ILE C 5 3.481 12.124 4.958 1.00 0.00 H new ATOM 0 HB ILE C 5 5.833 11.173 4.032 1.00 0.00 H new ATOM 0 HG12 ILE C 5 7.143 12.316 5.792 1.00 0.00 H new ATOM 0 HG13 ILE C 5 7.601 12.760 4.159 1.00 0.00 H new ATOM 0 HG21 ILE C 5 5.760 13.094 2.436 1.00 0.00 H new ATOM 0 HG22 ILE C 5 4.138 12.436 2.759 1.00 0.00 H new ATOM 0 HG23 ILE C 5 4.658 13.947 3.542 1.00 0.00 H new ATOM 0 HD11 ILE C 5 7.560 14.717 5.622 1.00 0.00 H new ATOM 0 HD12 ILE C 5 6.317 14.857 4.356 1.00 0.00 H new ATOM 0 HD13 ILE C 5 5.852 14.406 6.013 1.00 0.00 H new ATOM 2987 N ASP C 6 4.442 10.450 7.335 1.00 0.00 N ATOM 2988 CA ASP C 6 4.445 9.162 8.026 1.00 0.00 C ATOM 2989 C ASP C 6 5.546 8.199 7.564 1.00 0.00 C ATOM 2990 O ASP C 6 5.289 7.002 7.426 1.00 0.00 O ATOM 2991 CB ASP C 6 3.082 8.489 7.862 1.00 0.00 C ATOM 2992 CG ASP C 6 2.810 7.464 8.945 1.00 0.00 C ATOM 2993 OD1 ASP C 6 3.462 7.536 10.009 1.00 0.00 O ATOM 2994 OD2 ASP C 6 1.944 6.589 8.732 1.00 0.00 O ATOM 0 H ASP C 6 4.381 11.253 7.961 1.00 0.00 H new ATOM 0 HA ASP C 6 4.654 9.384 9.073 1.00 0.00 H new ATOM 0 HB2 ASP C 6 2.300 9.248 7.880 1.00 0.00 H new ATOM 0 HB3 ASP C 6 3.034 8.005 6.887 1.00 0.00 H new ATOM 2999 N TRP C 7 6.775 8.681 7.370 1.00 0.00 N ATOM 3000 CA TRP C 7 7.861 7.778 6.982 1.00 0.00 C ATOM 3001 C TRP C 7 8.430 7.113 8.231 1.00 0.00 C ATOM 3002 O TRP C 7 8.229 5.920 8.454 1.00 0.00 O ATOM 3003 CB TRP C 7 8.988 8.512 6.253 1.00 0.00 C ATOM 3004 CG TRP C 7 8.631 9.000 4.883 1.00 0.00 C ATOM 3005 CD1 TRP C 7 7.499 9.660 4.521 1.00 0.00 C ATOM 3006 CD2 TRP C 7 9.418 8.874 3.691 1.00 0.00 C ATOM 3007 NE1 TRP C 7 7.540 9.973 3.183 1.00 0.00 N ATOM 3008 CE2 TRP C 7 8.708 9.499 2.654 1.00 0.00 C ATOM 3009 CE3 TRP C 7 10.655 8.300 3.403 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 9.195 9.570 1.353 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 11.138 8.367 2.112 1.00 0.00 C ATOM 3012 CH2 TRP C 7 10.411 9.002 1.100 1.00 0.00 C ATOM 0 H TRP C 7 7.039 9.661 7.471 1.00 0.00 H new ATOM 0 HA TRP C 7 7.447 7.036 6.299 1.00 0.00 H new ATOM 0 HB2 TRP C 7 9.300 9.364 6.858 1.00 0.00 H new ATOM 0 HB3 TRP C 7 9.847 7.845 6.174 1.00 0.00 H new ATOM 0 HD1 TRP C 7 6.685 9.903 5.188 1.00 0.00 H new ATOM 0 HE1 TRP C 7 6.817 10.477 2.669 1.00 0.00 H new ATOM 0 HE3 TRP C 7 11.226 7.811 4.178 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 8.632 10.057 0.571 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 12.094 7.921 1.879 1.00 0.00 H new ATOM 0 HH2 TRP C 7 10.818 9.044 0.101 1.00 0.00 H new ATOM 3023 N ASN C 8 9.117 7.919 9.052 1.00 0.00 N ATOM 3024 CA ASN C 8 9.714 7.463 10.312 1.00 0.00 C ATOM 3025 C ASN C 8 10.902 8.346 10.712 1.00 0.00 C ATOM 3026 O ASN C 8 10.732 9.324 11.436 1.00 0.00 O ATOM 3027 CB ASN C 8 10.148 5.990 10.246 1.00 0.00 C ATOM 3028 CG ASN C 8 9.224 5.080 11.034 1.00 0.00 C ATOM 3029 OD1 ASN C 8 9.745 4.490 12.104 1.00 0.00 O flip ATOM 3030 ND2 ASN C 8 8.055 4.911 10.687 1.00 0.00 N flip ATOM 0 H ASN C 8 9.274 8.908 8.859 1.00 0.00 H new ATOM 0 HA ASN C 8 8.940 7.548 11.075 1.00 0.00 H new ATOM 0 HB2 ASN C 8 10.171 5.667 9.205 1.00 0.00 H new ATOM 0 HB3 ASN C 8 11.163 5.895 10.632 1.00 0.00 H new ATOM 0 HD21 ASN C 8 7.696 5.384 9.858 1.00 0.00 H new ATOM 0 HD22 ASN C 8 7.446 4.298 11.229 1.00 0.00 H new ATOM 3037 N LYS C 9 12.107 7.988 10.260 1.00 0.00 N ATOM 3038 CA LYS C 9 13.313 8.746 10.597 1.00 0.00 C ATOM 3039 C LYS C 9 13.718 9.744 9.505 1.00 0.00 C ATOM 3040 O LYS C 9 14.008 10.904 9.797 1.00 0.00 O ATOM 3041 CB LYS C 9 14.473 7.787 10.870 1.00 0.00 C ATOM 3042 CG LYS C 9 15.593 8.405 11.691 1.00 0.00 C ATOM 3043 CD LYS C 9 16.681 8.988 10.803 1.00 0.00 C ATOM 3044 CE LYS C 9 17.709 9.761 11.612 1.00 0.00 C ATOM 3045 NZ LYS C 9 17.505 11.232 11.511 1.00 0.00 N ATOM 0 H LYS C 9 12.272 7.179 9.661 1.00 0.00 H new ATOM 0 HA LYS C 9 13.081 9.324 11.491 1.00 0.00 H new ATOM 0 HB2 LYS C 9 14.093 6.909 11.392 1.00 0.00 H new ATOM 0 HB3 LYS C 9 14.879 7.441 9.919 1.00 0.00 H new ATOM 0 HG2 LYS C 9 15.186 9.188 12.331 1.00 0.00 H new ATOM 0 HG3 LYS C 9 16.024 7.649 12.347 1.00 0.00 H new ATOM 0 HD2 LYS C 9 17.176 8.184 10.258 1.00 0.00 H new ATOM 0 HD3 LYS C 9 16.231 9.647 10.060 1.00 0.00 H new ATOM 0 HE2 LYS C 9 17.651 9.458 12.657 1.00 0.00 H new ATOM 0 HE3 LYS C 9 18.710 9.509 11.262 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 18.227 11.722 12.077 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 17.586 11.526 10.517 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 16.560 11.477 11.869 1.00 0.00 H new ATOM 3059 N ILE C 10 13.779 9.280 8.258 1.00 0.00 N ATOM 3060 CA ILE C 10 14.198 10.131 7.140 1.00 0.00 C ATOM 3061 C ILE C 10 13.391 11.427 7.061 1.00 0.00 C ATOM 3062 O ILE C 10 13.963 12.511 6.944 1.00 0.00 O ATOM 3063 CB ILE C 10 14.115 9.380 5.789 1.00 0.00 C ATOM 3064 CG1 ILE C 10 14.868 10.156 4.695 1.00 0.00 C ATOM 3065 CG2 ILE C 10 12.672 9.096 5.393 1.00 0.00 C ATOM 3066 CD1 ILE C 10 14.060 11.232 3.999 1.00 0.00 C ATOM 0 H ILE C 10 13.545 8.323 7.994 1.00 0.00 H new ATOM 0 HA ILE C 10 15.238 10.392 7.334 1.00 0.00 H new ATOM 0 HB ILE C 10 14.602 8.412 5.908 1.00 0.00 H new ATOM 0 HG12 ILE C 10 15.750 10.616 5.140 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.221 9.447 3.946 1.00 0.00 H new ATOM 0 HG21 ILE C 10 12.654 8.568 4.440 1.00 0.00 H new ATOM 0 HG22 ILE C 10 12.199 8.480 6.158 1.00 0.00 H new ATOM 0 HG23 ILE C 10 12.129 10.036 5.297 1.00 0.00 H new ATOM 0 HD11 ILE C 10 14.678 11.721 3.246 1.00 0.00 H new ATOM 0 HD12 ILE C 10 13.191 10.781 3.519 1.00 0.00 H new ATOM 0 HD13 ILE C 10 13.729 11.969 4.731 1.00 0.00 H new ATOM 3078 N LEU C 11 12.071 11.321 7.133 1.00 0.00 N ATOM 3079 CA LEU C 11 11.211 12.492 7.076 1.00 0.00 C ATOM 3080 C LEU C 11 10.931 12.984 8.488 1.00 0.00 C ATOM 3081 O LEU C 11 10.788 14.184 8.730 1.00 0.00 O ATOM 3082 CB LEU C 11 9.899 12.154 6.364 1.00 0.00 C ATOM 3083 CG LEU C 11 9.890 12.356 4.844 1.00 0.00 C ATOM 3084 CD1 LEU C 11 9.781 13.833 4.502 1.00 0.00 C ATOM 3085 CD2 LEU C 11 11.123 11.747 4.192 1.00 0.00 C ATOM 0 H LEU C 11 11.574 10.436 7.231 1.00 0.00 H new ATOM 0 HA LEU C 11 11.714 13.279 6.514 1.00 0.00 H new ATOM 0 HB2 LEU C 11 9.652 11.113 6.574 1.00 0.00 H new ATOM 0 HB3 LEU C 11 9.106 12.764 6.797 1.00 0.00 H new ATOM 0 HG LEU C 11 9.016 11.840 4.447 1.00 0.00 H new ATOM 0 HD11 LEU C 11 9.776 13.956 3.419 1.00 0.00 H new ATOM 0 HD12 LEU C 11 8.857 14.235 4.917 1.00 0.00 H new ATOM 0 HD13 LEU C 11 10.632 14.368 4.924 1.00 0.00 H new ATOM 0 HD21 LEU C 11 11.083 11.909 3.115 1.00 0.00 H new ATOM 0 HD22 LEU C 11 12.019 12.218 4.597 1.00 0.00 H new ATOM 0 HD23 LEU C 11 11.152 10.677 4.397 1.00 0.00 H new ATOM 3097 N SER C 12 10.866 12.037 9.418 1.00 0.00 N ATOM 3098 CA SER C 12 10.615 12.335 10.818 1.00 0.00 C ATOM 3099 C SER C 12 9.258 13.011 11.004 1.00 0.00 C ATOM 3100 O SER C 12 8.676 12.872 12.100 1.00 0.00 O ATOM 3101 CB SER C 12 11.725 13.223 11.382 1.00 0.00 C ATOM 3102 OG SER C 12 11.493 14.588 11.082 1.00 0.00 O ATOM 3103 OXT SER C 12 8.792 13.674 10.055 1.00 0.00 O ATOM 0 H SER C 12 10.986 11.044 9.220 1.00 0.00 H new ATOM 0 HA SER C 12 10.603 11.391 11.363 1.00 0.00 H new ATOM 0 HB2 SER C 12 11.786 13.091 12.462 1.00 0.00 H new ATOM 0 HB3 SER C 12 12.685 12.915 10.968 1.00 0.00 H new ATOM 0 HG SER C 12 11.538 14.722 10.112 1.00 0.00 H new ATOM 3110 N THR D 1 2.329 -10.247 12.445 1.00 0.00 N ATOM 3111 CA THR D 1 1.890 -9.940 11.059 1.00 0.00 C ATOM 3112 C THR D 1 2.110 -11.130 10.132 1.00 0.00 C ATOM 3113 O THR D 1 2.254 -10.966 8.920 1.00 0.00 O ATOM 3114 CB THR D 1 2.681 -8.731 10.557 1.00 0.00 C ATOM 3115 OG1 THR D 1 3.956 -8.677 11.173 1.00 0.00 O ATOM 3116 CG2 THR D 1 1.989 -7.411 10.817 1.00 0.00 C ATOM 0 H1 THR D 1 2.294 -9.381 13.020 1.00 0.00 H new ATOM 0 H2 THR D 1 1.698 -10.963 12.859 1.00 0.00 H new ATOM 0 H3 THR D 1 3.303 -10.612 12.428 1.00 0.00 H new ATOM 0 HA THR D 1 0.822 -9.720 11.063 1.00 0.00 H new ATOM 0 HB THR D 1 2.767 -8.870 9.479 1.00 0.00 H new ATOM 0 HG1 THR D 1 4.448 -7.898 10.838 1.00 0.00 H new ATOM 0 HG21 THR D 1 2.605 -6.596 10.436 1.00 0.00 H new ATOM 0 HG22 THR D 1 1.022 -7.402 10.314 1.00 0.00 H new ATOM 0 HG23 THR D 1 1.841 -7.283 11.889 1.00 0.00 H new ATOM 3126 N ARG D 2 2.134 -12.329 10.705 1.00 0.00 N ATOM 3127 CA ARG D 2 2.336 -13.541 9.921 1.00 0.00 C ATOM 3128 C ARG D 2 0.997 -14.161 9.531 1.00 0.00 C ATOM 3129 O ARG D 2 0.596 -14.111 8.369 1.00 0.00 O ATOM 3130 CB ARG D 2 3.173 -14.550 10.711 1.00 0.00 C ATOM 3131 CG ARG D 2 4.201 -15.284 9.865 1.00 0.00 C ATOM 3132 CD ARG D 2 4.540 -16.643 10.455 1.00 0.00 C ATOM 3133 NE ARG D 2 3.377 -17.527 10.496 1.00 0.00 N ATOM 3134 CZ ARG D 2 3.453 -18.844 10.666 1.00 0.00 C ATOM 3135 NH1 ARG D 2 4.632 -19.435 10.812 1.00 0.00 N ATOM 3136 NH2 ARG D 2 2.346 -19.574 10.691 1.00 0.00 N ATOM 0 H ARG D 2 2.016 -12.487 11.706 1.00 0.00 H new ATOM 0 HA ARG D 2 2.871 -13.274 9.010 1.00 0.00 H new ATOM 0 HB2 ARG D 2 3.686 -14.030 11.520 1.00 0.00 H new ATOM 0 HB3 ARG D 2 2.507 -15.279 11.172 1.00 0.00 H new ATOM 0 HG2 ARG D 2 3.817 -15.411 8.853 1.00 0.00 H new ATOM 0 HG3 ARG D 2 5.107 -14.683 9.789 1.00 0.00 H new ATOM 0 HD2 ARG D 2 5.329 -17.108 9.864 1.00 0.00 H new ATOM 0 HD3 ARG D 2 4.932 -16.513 11.464 1.00 0.00 H new ATOM 0 HE ARG D 2 2.453 -17.109 10.388 1.00 0.00 H new ATOM 0 HH11 ARG D 2 5.487 -18.879 10.794 1.00 0.00 H new ATOM 0 HH12 ARG D 2 4.683 -20.445 10.942 1.00 0.00 H new ATOM 0 HH21 ARG D 2 1.437 -19.125 10.580 1.00 0.00 H new ATOM 0 HH22 ARG D 2 2.404 -20.584 10.821 1.00 0.00 H new ATOM 3149 N THR D 3 0.309 -14.739 10.508 1.00 0.00 N ATOM 3150 CA THR D 3 -0.987 -15.363 10.262 1.00 0.00 C ATOM 3151 C THR D 3 -2.139 -14.445 10.668 1.00 0.00 C ATOM 3152 O THR D 3 -3.299 -14.729 10.374 1.00 0.00 O ATOM 3153 CB THR D 3 -1.088 -16.693 11.010 1.00 0.00 C ATOM 3154 OG1 THR D 3 -2.301 -17.355 10.694 1.00 0.00 O ATOM 3155 CG2 THR D 3 -1.028 -16.539 12.514 1.00 0.00 C ATOM 0 H THR D 3 0.625 -14.789 11.476 1.00 0.00 H new ATOM 0 HA THR D 3 -1.066 -15.547 9.191 1.00 0.00 H new ATOM 0 HB THR D 3 -0.225 -17.274 10.685 1.00 0.00 H new ATOM 0 HG1 THR D 3 -3.010 -16.692 10.558 1.00 0.00 H new ATOM 0 HG21 THR D 3 -1.105 -17.520 12.984 1.00 0.00 H new ATOM 0 HG22 THR D 3 -0.082 -16.075 12.795 1.00 0.00 H new ATOM 0 HG23 THR D 3 -1.853 -15.911 12.849 1.00 0.00 H new ATOM 3163 N LYS D 4 -1.814 -13.347 11.344 1.00 0.00 N ATOM 3164 CA LYS D 4 -2.823 -12.390 11.786 1.00 0.00 C ATOM 3165 C LYS D 4 -3.217 -11.442 10.648 1.00 0.00 C ATOM 3166 O LYS D 4 -4.070 -10.574 10.821 1.00 0.00 O ATOM 3167 CB LYS D 4 -2.292 -11.587 12.976 1.00 0.00 C ATOM 3168 CG LYS D 4 -3.312 -10.637 13.585 1.00 0.00 C ATOM 3169 CD LYS D 4 -2.775 -9.216 13.658 1.00 0.00 C ATOM 3170 CE LYS D 4 -3.888 -8.211 13.908 1.00 0.00 C ATOM 3171 NZ LYS D 4 -4.243 -8.125 15.351 1.00 0.00 N ATOM 0 H LYS D 4 -0.858 -13.098 11.598 1.00 0.00 H new ATOM 0 HA LYS D 4 -3.711 -12.944 12.091 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -1.951 -12.280 13.745 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -1.422 -11.013 12.655 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -4.225 -10.652 12.990 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -3.577 -10.979 14.585 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -2.035 -9.146 14.455 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -2.265 -8.971 12.727 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -3.578 -7.229 13.551 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -4.770 -8.495 13.333 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -5.071 -7.507 15.468 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -4.466 -9.075 15.711 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -3.440 -7.733 15.883 1.00 0.00 H new ATOM 3185 N ILE D 5 -2.567 -11.610 9.491 1.00 0.00 N ATOM 3186 CA ILE D 5 -2.807 -10.778 8.306 1.00 0.00 C ATOM 3187 C ILE D 5 -2.766 -9.276 8.621 1.00 0.00 C ATOM 3188 O ILE D 5 -3.028 -8.443 7.752 1.00 0.00 O ATOM 3189 CB ILE D 5 -4.121 -11.125 7.557 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -5.211 -11.673 8.488 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -3.836 -12.123 6.445 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -4.919 -13.057 9.024 1.00 0.00 C ATOM 0 H ILE D 5 -1.857 -12.329 9.349 1.00 0.00 H new ATOM 0 HA ILE D 5 -1.979 -11.015 7.638 1.00 0.00 H new ATOM 0 HB ILE D 5 -4.502 -10.195 7.135 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -5.337 -10.988 9.327 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -6.158 -11.695 7.949 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -4.763 -12.362 5.924 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -3.125 -11.690 5.741 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -3.415 -13.033 6.872 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -5.735 -13.375 9.673 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -4.823 -13.756 8.193 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -3.989 -13.038 9.592 1.00 0.00 H new ATOM 3204 N ASP D 6 -2.391 -8.941 9.851 1.00 0.00 N ATOM 3205 CA ASP D 6 -2.260 -7.555 10.291 1.00 0.00 C ATOM 3206 C ASP D 6 -3.456 -6.662 9.941 1.00 0.00 C ATOM 3207 O ASP D 6 -3.264 -5.514 9.543 1.00 0.00 O ATOM 3208 CB ASP D 6 -0.986 -6.948 9.700 1.00 0.00 C ATOM 3209 CG ASP D 6 -0.489 -5.758 10.498 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -0.874 -5.633 11.680 1.00 0.00 O ATOM 3211 OD2 ASP D 6 0.285 -4.951 9.941 1.00 0.00 O ATOM 0 H ASP D 6 -2.168 -9.625 10.574 1.00 0.00 H new ATOM 0 HA ASP D 6 -2.216 -7.591 11.380 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -0.207 -7.709 9.664 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -1.177 -6.639 8.672 1.00 0.00 H new ATOM 3216 N TRP D 7 -4.688 -7.146 10.125 1.00 0.00 N ATOM 3217 CA TRP D 7 -5.852 -6.300 9.853 1.00 0.00 C ATOM 3218 C TRP D 7 -6.127 -5.419 11.066 1.00 0.00 C ATOM 3219 O TRP D 7 -5.904 -4.210 11.028 1.00 0.00 O ATOM 3220 CB TRP D 7 -7.104 -7.125 9.545 1.00 0.00 C ATOM 3221 CG TRP D 7 -7.066 -7.848 8.233 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -6.037 -8.583 7.736 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -8.112 -7.912 7.255 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -6.383 -9.121 6.519 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -7.651 -8.721 6.204 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -9.394 -7.371 7.169 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -8.428 -9.005 5.085 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -10.164 -7.648 6.058 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -9.681 -8.462 5.029 1.00 0.00 C ATOM 0 H TRP D 7 -4.902 -8.089 10.451 1.00 0.00 H new ATOM 0 HA TRP D 7 -5.623 -5.695 8.976 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.249 -7.854 10.343 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -7.971 -6.464 9.556 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -5.085 -8.724 8.226 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -5.790 -9.721 5.945 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -9.779 -6.744 7.960 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -8.054 -9.632 4.289 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -11.156 -7.229 5.982 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -10.309 -8.665 4.174 1.00 0.00 H new ATOM 3240 N ASN D 8 -6.587 -6.058 12.150 1.00 0.00 N ATOM 3241 CA ASN D 8 -6.882 -5.379 13.419 1.00 0.00 C ATOM 3242 C ASN D 8 -7.926 -6.156 14.230 1.00 0.00 C ATOM 3243 O ASN D 8 -7.572 -6.999 15.052 1.00 0.00 O ATOM 3244 CB ASN D 8 -7.349 -3.931 13.203 1.00 0.00 C ATOM 3245 CG ASN D 8 -6.285 -2.919 13.585 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -6.554 -2.143 14.629 1.00 0.00 O flip ATOM 3247 ND2 ASN D 8 -5.233 -2.836 12.952 1.00 0.00 N flip ATOM 0 H ASN D 8 -6.765 -7.062 12.172 1.00 0.00 H new ATOM 0 HA ASN D 8 -5.950 -5.347 13.984 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -7.621 -3.792 12.157 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -8.248 -3.750 13.793 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -5.067 -3.452 12.156 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -4.527 -2.151 13.223 1.00 0.00 H new ATOM 3254 N LYS D 9 -9.209 -5.857 14.018 1.00 0.00 N ATOM 3255 CA LYS D 9 -10.287 -6.521 14.753 1.00 0.00 C ATOM 3256 C LYS D 9 -10.917 -7.683 13.974 1.00 0.00 C ATOM 3257 O LYS D 9 -11.107 -8.769 14.519 1.00 0.00 O ATOM 3258 CB LYS D 9 -11.370 -5.504 15.120 1.00 0.00 C ATOM 3259 CG LYS D 9 -12.256 -5.948 16.274 1.00 0.00 C ATOM 3260 CD LYS D 9 -13.508 -6.653 15.777 1.00 0.00 C ATOM 3261 CE LYS D 9 -14.303 -7.254 16.925 1.00 0.00 C ATOM 3262 NZ LYS D 9 -14.099 -8.726 17.032 1.00 0.00 N ATOM 0 H LYS D 9 -9.527 -5.160 13.344 1.00 0.00 H new ATOM 0 HA LYS D 9 -9.840 -6.943 15.653 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -10.895 -4.558 15.381 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -11.993 -5.318 14.245 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -11.696 -6.617 16.927 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -12.538 -5.081 16.872 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -14.133 -5.946 15.232 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -13.230 -7.439 15.075 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -14.007 -6.778 17.860 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -15.363 -7.044 16.782 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -14.658 -9.097 17.827 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -14.405 -9.184 16.150 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -13.091 -8.926 17.194 1.00 0.00 H new ATOM 3276 N ILE D 10 -11.276 -7.438 12.714 1.00 0.00 N ATOM 3277 CA ILE D 10 -11.926 -8.460 11.888 1.00 0.00 C ATOM 3278 C ILE D 10 -11.135 -9.766 11.847 1.00 0.00 C ATOM 3279 O ILE D 10 -11.696 -10.841 12.055 1.00 0.00 O ATOM 3280 CB ILE D 10 -12.177 -7.954 10.448 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -13.151 -8.890 9.709 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -10.873 -7.771 9.682 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -12.505 -10.086 9.039 1.00 0.00 C ATOM 0 H ILE D 10 -11.129 -6.545 12.243 1.00 0.00 H new ATOM 0 HA ILE D 10 -12.886 -8.663 12.362 1.00 0.00 H new ATOM 0 HB ILE D 10 -12.643 -6.970 10.511 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -13.896 -9.249 10.419 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -13.683 -8.313 8.953 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -11.090 -7.415 8.675 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -10.247 -7.043 10.198 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -10.348 -8.724 9.624 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -13.271 -10.684 8.546 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -11.781 -9.742 8.300 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -11.997 -10.693 9.789 1.00 0.00 H new ATOM 3295 N LEU D 11 -9.838 -9.676 11.589 1.00 0.00 N ATOM 3296 CA LEU D 11 -8.992 -10.858 11.535 1.00 0.00 C ATOM 3297 C LEU D 11 -8.379 -11.106 12.906 1.00 0.00 C ATOM 3298 O LEU D 11 -8.158 -12.248 13.310 1.00 0.00 O ATOM 3299 CB LEU D 11 -7.889 -10.673 10.489 1.00 0.00 C ATOM 3300 CG LEU D 11 -8.231 -11.135 9.067 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -8.175 -12.650 8.969 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -9.594 -10.620 8.626 1.00 0.00 C ATOM 0 H LEU D 11 -9.350 -8.798 11.414 1.00 0.00 H new ATOM 0 HA LEU D 11 -9.597 -11.719 11.250 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -7.623 -9.617 10.453 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.004 -11.214 10.823 1.00 0.00 H new ATOM 0 HG LEU D 11 -7.484 -10.715 8.394 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -8.421 -12.958 7.953 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -7.172 -12.994 9.220 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -8.893 -13.086 9.664 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -9.804 -10.966 7.614 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -10.361 -10.994 9.304 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -9.594 -9.530 8.644 1.00 0.00 H new ATOM 3314 N SER D 12 -8.118 -10.014 13.617 1.00 0.00 N ATOM 3315 CA SER D 12 -7.539 -10.073 14.950 1.00 0.00 C ATOM 3316 C SER D 12 -6.164 -10.735 14.928 1.00 0.00 C ATOM 3317 O SER D 12 -5.345 -10.422 15.816 1.00 0.00 O ATOM 3318 CB SER D 12 -8.470 -10.827 15.902 1.00 0.00 C ATOM 3319 OG SER D 12 -8.287 -12.228 15.795 1.00 0.00 O ATOM 3320 OXT SER D 12 -5.919 -11.560 14.023 1.00 0.00 O ATOM 0 H SER D 12 -8.302 -9.067 13.285 1.00 0.00 H new ATOM 0 HA SER D 12 -7.417 -9.050 15.306 1.00 0.00 H new ATOM 0 HB2 SER D 12 -8.280 -10.510 16.927 1.00 0.00 H new ATOM 0 HB3 SER D 12 -9.506 -10.575 15.677 1.00 0.00 H new ATOM 0 HG SER D 12 -8.539 -12.523 14.895 1.00 0.00 H new