USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1309 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 GLN : amide:sc= -6.41! C(o=-8.7!,f=-5.8!) USER MOD Set 1.2: A 109 ASN : amide:sc= -2.26 K(o=-8.7,f=-5.8) USER MOD Set 2.1: A 78 GLN : amide:sc= -0.533! C(o=-4.2!,f=-8.1!) USER MOD Set 2.2: A 95 CYS SG : rot -90:sc= -4.47! USER MOD Set 2.3: A 107 LYS NZ :NH3+ -126:sc= 0.842 (180deg=0) USER MOD Set 3.1: A 51 LYS NZ :NH3+ -176:sc= 0.931 (180deg=0) USER MOD Set 3.2: A 138 ASN : amide:sc= -2.39 K(o=-1.5,f=-8.5!) USER MOD Set 4.1: A 28 TYR OH : rot -148:sc= 0.351 USER MOD Set 4.2: A 32 GLN : amide:sc= 0.27 K(o=-4.4,f=-5.2) USER MOD Set 4.3: A 33 HIS : no HE2:sc= -5.06! C(o=-4.4!,f=-8.7!) USER MOD Single : A 11 MET CE :methyl -142:sc= -0.406 (180deg=-1.24!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -133:sc= 0.429 USER MOD Single : A 25 HIS : no HD1:sc= -1.94! X(o=-1.9!,f=-1.9) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -3.27! C(o=-3.3!,f=-3.5!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 134:sc= 1.17 USER MOD Single : A 41 TYR OH : rot 100:sc= -0.537 USER MOD Single : A 42 ASN : amide:sc= -14! C(o=-14!,f=-18!) USER MOD Single : A 45 SER OG : rot 92:sc= -1.75! USER MOD Single : A 46 LYS NZ :NH3+ 159:sc= -0.107 (180deg=-0.534) USER MOD Single : A 47 CYS SG : rot -21:sc= -0.0718 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 92:sc= 1.22 USER MOD Single : A 56 THR OG1 : rot 75:sc= -1.73! USER MOD Single : A 58 THR OG1 : rot -122:sc= -0.179 USER MOD Single : A 59 THR OG1 : rot 81:sc= 1.26 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -1.17 K(o=-1.2,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 167:sc= 1.26 (180deg=0.758) USER MOD Single : A 64 TYR OH : rot -158:sc= 0.925 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.13) USER MOD Single : A 70 THR OG1 : rot 51:sc= -1.67! USER MOD Single : A 76 SER OG : rot 180:sc= 0.0025 USER MOD Single : A 77 ASN : amide:sc= -2.3! C(o=-2.3!,f=-5.2!) USER MOD Single : A 86 ASN : amide:sc= -1.29! X(o=-1.3!,f=-0.97) USER MOD Single : A 91 LYS NZ :NH3+ 155:sc= 2.21 (180deg=0.979) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0229 USER MOD Single : A 97 LYS NZ :NH3+ -159:sc= -0.0944 (180deg=-0.54) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl 162:sc= -6.5! (180deg=-6.71!) USER MOD Single : A 111 ASN : amide:sc= -5.02! K(o=-5!,f=-1.3) USER MOD Single : A 114 ASN : amide:sc= -0.277 X(o=-0.28,f=0) USER MOD Single : A 116 HIS : no HD1:sc= -4.56! C(o=-4.6!,f=-12!) USER MOD Single : A 119 TYR OH : rot -179:sc= -2.58! USER MOD Single : A 121 TYR OH : rot -2:sc= -0.139 USER MOD Single : A 122 MET CE :methyl -128:sc= -10! (180deg=-13.8!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 163:sc= -0.0579 (180deg=-0.363) USER MOD Single : A 125 THR OG1 : rot 49:sc= 1.23 USER MOD Single : A 126 LYS NZ :NH3+ -164:sc= -0.0205 (180deg=-0.261) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.739 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 147:sc= -1.75! (180deg=-3.85!) USER MOD Single : A 140 THR OG1 : rot 70:sc= 0.281 USER MOD Single : A 141 SER OG : rot -111:sc= 1.7 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0.0372 USER MOD Single : A 161 LYS NZ :NH3+ 171:sc= 2.34 (180deg=2.32) USER MOD Single : A 166 LYS NZ :NH3+ 132:sc= 1.1 (180deg=0.298) USER MOD Single : A 173 SER OG : rot 5:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -5.281 20.495 -2.942 1.00 5.22 N ATOM 2 CA GLY A 10 -5.340 21.109 -1.593 1.00 4.42 C ATOM 3 C GLY A 10 -5.887 20.147 -0.560 1.00 3.29 C ATOM 4 O GLY A 10 -5.133 19.570 0.223 1.00 3.60 O ATOM 0 HA2 GLY A 10 -4.342 21.431 -1.297 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -5.966 22.001 -1.627 1.00 4.42 H new ATOM 10 N MET A 11 -7.198 19.968 -0.557 1.00 2.49 N ATOM 11 CA MET A 11 -7.830 19.019 0.347 1.00 1.84 C ATOM 12 C MET A 11 -8.549 17.943 -0.446 1.00 1.40 C ATOM 13 O MET A 11 -9.170 18.224 -1.472 1.00 2.20 O ATOM 14 CB MET A 11 -8.803 19.713 1.311 1.00 2.43 C ATOM 15 CG MET A 11 -9.915 20.508 0.641 1.00 3.11 C ATOM 16 SD MET A 11 -9.342 22.064 -0.075 1.00 4.02 S ATOM 17 CE MET A 11 -8.652 22.870 1.371 1.00 4.85 C ATOM 0 H MET A 11 -7.845 20.466 -1.169 1.00 2.49 H new ATOM 0 HA MET A 11 -7.046 18.559 0.948 1.00 1.84 H new ATOM 0 HB2 MET A 11 -9.254 18.958 1.955 1.00 2.43 H new ATOM 0 HB3 MET A 11 -8.235 20.384 1.956 1.00 2.43 H new ATOM 0 HG2 MET A 11 -10.367 19.900 -0.142 1.00 3.11 H new ATOM 0 HG3 MET A 11 -10.695 20.717 1.373 1.00 3.11 H new ATOM 0 HE1 MET A 11 -8.873 23.937 1.333 1.00 4.85 H new ATOM 0 HE2 MET A 11 -9.091 22.440 2.271 1.00 4.85 H new ATOM 0 HE3 MET A 11 -7.572 22.724 1.389 1.00 4.85 H new ATOM 27 N GLY A 12 -8.461 16.714 0.032 1.00 0.92 N ATOM 28 CA GLY A 12 -9.056 15.602 -0.670 1.00 0.85 C ATOM 29 C GLY A 12 -9.941 14.768 0.226 1.00 0.79 C ATOM 30 O GLY A 12 -9.779 14.768 1.447 1.00 1.55 O ATOM 0 H GLY A 12 -7.985 16.467 0.899 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -9.642 15.976 -1.510 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -8.268 14.974 -1.086 1.00 0.85 H new ATOM 34 N SER A 13 -10.877 14.060 -0.376 1.00 0.52 N ATOM 35 CA SER A 13 -11.795 13.214 0.372 1.00 0.53 C ATOM 36 C SER A 13 -11.478 11.745 0.132 1.00 0.41 C ATOM 37 O SER A 13 -11.980 10.866 0.839 1.00 0.53 O ATOM 38 CB SER A 13 -13.228 13.518 -0.055 1.00 0.79 C ATOM 39 OG SER A 13 -13.439 14.918 -0.166 1.00 1.58 O ATOM 0 H SER A 13 -11.024 14.052 -1.385 1.00 0.52 H new ATOM 0 HA SER A 13 -11.683 13.421 1.436 1.00 0.53 H new ATOM 0 HB2 SER A 13 -13.436 13.038 -1.011 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.925 13.098 0.671 1.00 0.79 H new ATOM 0 HG SER A 13 -14.364 15.089 -0.442 1.00 1.58 H new ATOM 45 N SER A 14 -10.607 11.489 -0.837 1.00 0.32 N ATOM 46 CA SER A 14 -10.306 10.164 -1.274 1.00 0.22 C ATOM 47 C SER A 14 -8.983 10.222 -1.976 1.00 0.21 C ATOM 48 O SER A 14 -8.589 11.251 -2.528 1.00 0.35 O ATOM 49 CB SER A 14 -11.379 9.621 -2.226 1.00 0.25 C ATOM 50 OG SER A 14 -12.690 9.940 -1.789 1.00 1.17 O ATOM 0 H SER A 14 -10.093 12.215 -1.336 1.00 0.32 H new ATOM 0 HA SER A 14 -10.276 9.492 -0.416 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.220 10.031 -3.223 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.277 8.539 -2.307 1.00 0.25 H new ATOM 0 HG SER A 14 -13.256 9.142 -1.843 1.00 1.17 H new ATOM 56 N ILE A 15 -8.314 9.115 -1.934 1.00 0.18 N ATOM 57 CA ILE A 15 -6.972 8.992 -2.425 1.00 0.18 C ATOM 58 C ILE A 15 -6.891 9.165 -3.946 1.00 0.17 C ATOM 59 O ILE A 15 -5.812 9.373 -4.494 1.00 0.19 O ATOM 60 CB ILE A 15 -6.447 7.618 -2.014 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.407 6.529 -2.503 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.287 7.562 -0.514 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.741 5.225 -2.867 1.00 0.38 C ATOM 0 H ILE A 15 -8.691 8.249 -1.549 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.362 9.786 -1.994 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.472 7.447 -2.471 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.148 6.340 -1.726 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.947 6.902 -3.373 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.912 6.580 -0.224 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.581 8.329 -0.195 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.252 7.737 -0.038 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.495 4.513 -3.202 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.021 5.395 -3.668 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.225 4.824 -1.995 1.00 0.38 H new ATOM 75 N PHE A 16 -8.041 9.117 -4.613 1.00 0.18 N ATOM 76 CA PHE A 16 -8.107 9.236 -6.069 1.00 0.19 C ATOM 77 C PHE A 16 -7.784 10.645 -6.538 1.00 0.21 C ATOM 78 O PHE A 16 -7.648 10.896 -7.738 1.00 0.30 O ATOM 79 CB PHE A 16 -9.482 8.848 -6.566 1.00 0.20 C ATOM 80 CG PHE A 16 -9.841 7.452 -6.211 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.097 6.413 -6.710 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.925 7.175 -5.405 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.425 5.112 -6.426 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.254 5.872 -5.109 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.500 4.840 -5.628 1.00 0.19 C ATOM 0 H PHE A 16 -8.949 8.995 -4.164 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.359 8.559 -6.481 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.222 9.528 -6.145 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.520 8.965 -7.649 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.241 6.622 -7.335 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.518 7.984 -5.004 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.835 4.304 -6.832 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.100 5.658 -4.472 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.760 3.816 -5.403 1.00 0.19 H new ATOM 95 N ASP A 17 -7.666 11.557 -5.584 1.00 0.21 N ATOM 96 CA ASP A 17 -7.260 12.923 -5.865 1.00 0.26 C ATOM 97 C ASP A 17 -5.840 12.894 -6.382 1.00 0.25 C ATOM 98 O ASP A 17 -5.403 13.757 -7.142 1.00 0.32 O ATOM 99 CB ASP A 17 -7.327 13.760 -4.584 1.00 0.32 C ATOM 100 CG ASP A 17 -7.064 15.236 -4.812 1.00 1.13 C ATOM 101 OD1 ASP A 17 -5.879 15.616 -4.918 1.00 2.11 O ATOM 102 OD2 ASP A 17 -8.033 16.018 -4.914 1.00 1.30 O ATOM 0 H ASP A 17 -7.848 11.370 -4.598 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.924 13.368 -6.606 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -8.312 13.640 -4.132 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.599 13.375 -3.870 1.00 0.32 H new ATOM 107 N PHE A 18 -5.137 11.851 -5.976 1.00 0.22 N ATOM 108 CA PHE A 18 -3.750 11.698 -6.307 1.00 0.23 C ATOM 109 C PHE A 18 -3.536 10.588 -7.292 1.00 0.26 C ATOM 110 O PHE A 18 -3.801 9.415 -7.025 1.00 0.29 O ATOM 111 CB PHE A 18 -2.943 11.465 -5.055 1.00 0.21 C ATOM 112 CG PHE A 18 -3.083 12.605 -4.115 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.614 13.858 -4.458 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.717 12.437 -2.911 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.767 14.924 -3.605 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.883 13.500 -2.061 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.406 14.746 -2.400 1.00 0.31 C ATOM 0 H PHE A 18 -5.520 11.094 -5.410 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.412 12.620 -6.780 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.273 10.546 -4.570 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.893 11.329 -5.314 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.121 14.001 -5.408 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -4.088 11.462 -2.631 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.387 15.897 -3.879 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.392 13.359 -1.119 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.533 15.579 -1.724 1.00 0.31 H new ATOM 127 N GLU A 19 -3.107 11.007 -8.451 1.00 0.35 N ATOM 128 CA GLU A 19 -2.626 10.124 -9.487 1.00 0.43 C ATOM 129 C GLU A 19 -1.635 9.114 -8.916 1.00 0.34 C ATOM 130 O GLU A 19 -0.821 9.437 -8.041 1.00 0.37 O ATOM 131 CB GLU A 19 -1.968 10.976 -10.567 1.00 0.63 C ATOM 132 CG GLU A 19 -1.314 10.203 -11.692 1.00 1.08 C ATOM 133 CD GLU A 19 -0.630 11.133 -12.667 1.00 2.04 C ATOM 134 OE1 GLU A 19 -1.314 11.665 -13.566 1.00 2.30 O ATOM 135 OE2 GLU A 19 0.584 11.368 -12.518 1.00 2.86 O ATOM 0 H GLU A 19 -3.080 11.993 -8.711 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.456 9.560 -9.913 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.722 11.638 -10.993 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.215 11.610 -10.098 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -0.586 9.503 -11.281 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -2.065 9.611 -12.215 1.00 1.08 H new ATOM 142 N VAL A 20 -1.709 7.901 -9.419 1.00 0.29 N ATOM 143 CA VAL A 20 -0.838 6.833 -8.980 1.00 0.26 C ATOM 144 C VAL A 20 0.099 6.485 -10.114 1.00 0.25 C ATOM 145 O VAL A 20 -0.165 6.833 -11.256 1.00 0.28 O ATOM 146 CB VAL A 20 -1.661 5.594 -8.523 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.789 4.373 -8.304 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.396 5.929 -7.250 1.00 0.49 C ATOM 0 H VAL A 20 -2.374 7.628 -10.143 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.258 7.160 -8.117 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.366 5.350 -9.318 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.409 3.535 -7.986 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.282 4.117 -9.234 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.048 4.588 -7.534 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.974 5.064 -6.925 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.678 6.197 -6.475 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.068 6.769 -7.428 1.00 0.49 H new ATOM 158 N LEU A 21 1.214 5.859 -9.802 1.00 0.28 N ATOM 159 CA LEU A 21 2.177 5.501 -10.816 1.00 0.35 C ATOM 160 C LEU A 21 2.464 4.016 -10.787 1.00 0.38 C ATOM 161 O LEU A 21 2.892 3.483 -9.765 1.00 0.58 O ATOM 162 CB LEU A 21 3.467 6.302 -10.625 1.00 0.45 C ATOM 163 CG LEU A 21 3.323 7.796 -10.891 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.641 8.513 -10.693 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.811 8.021 -12.297 1.00 0.68 C ATOM 0 H LEU A 21 1.474 5.588 -8.854 1.00 0.28 H new ATOM 0 HA LEU A 21 1.756 5.743 -11.792 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.822 6.159 -9.604 1.00 0.45 H new ATOM 0 HB3 LEU A 21 4.233 5.899 -11.288 1.00 0.45 H new ATOM 0 HG LEU A 21 2.607 8.205 -10.178 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.509 9.577 -10.889 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.981 8.373 -9.667 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.383 8.106 -11.380 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.710 9.091 -12.481 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.514 7.594 -13.013 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.840 7.540 -12.412 1.00 0.68 H new ATOM 177 N ASP A 22 2.209 3.350 -11.913 1.00 0.33 N ATOM 178 CA ASP A 22 2.575 1.947 -12.080 1.00 0.37 C ATOM 179 C ASP A 22 4.094 1.858 -11.971 1.00 0.35 C ATOM 180 O ASP A 22 4.760 2.892 -11.981 1.00 0.40 O ATOM 181 CB ASP A 22 2.064 1.429 -13.435 1.00 0.50 C ATOM 182 CG ASP A 22 1.906 -0.079 -13.489 1.00 1.16 C ATOM 183 OD1 ASP A 22 2.896 -0.791 -13.216 1.00 1.87 O ATOM 184 OD2 ASP A 22 0.797 -0.562 -13.795 1.00 1.48 O ATOM 0 H ASP A 22 1.749 3.763 -12.724 1.00 0.33 H new ATOM 0 HA ASP A 22 2.119 1.322 -11.312 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.103 1.895 -13.653 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.755 1.742 -14.218 1.00 0.50 H new ATOM 189 N ALA A 23 4.642 0.658 -11.900 1.00 0.39 N ATOM 190 CA ALA A 23 6.029 0.450 -11.458 1.00 0.42 C ATOM 191 C ALA A 23 7.069 1.280 -12.209 1.00 0.47 C ATOM 192 O ALA A 23 8.174 1.483 -11.701 1.00 0.59 O ATOM 193 CB ALA A 23 6.388 -1.021 -11.552 1.00 0.52 C ATOM 0 H ALA A 23 4.150 -0.202 -12.143 1.00 0.39 H new ATOM 0 HA ALA A 23 6.060 0.795 -10.424 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.417 -1.166 -11.223 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.718 -1.600 -10.916 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.287 -1.355 -12.585 1.00 0.52 H new ATOM 199 N ASP A 24 6.742 1.764 -13.395 1.00 0.46 N ATOM 200 CA ASP A 24 7.710 2.524 -14.178 1.00 0.54 C ATOM 201 C ASP A 24 7.427 4.029 -14.121 1.00 0.51 C ATOM 202 O ASP A 24 7.984 4.792 -14.901 1.00 0.62 O ATOM 203 CB ASP A 24 7.720 2.040 -15.630 1.00 0.69 C ATOM 204 CG ASP A 24 8.993 2.431 -16.357 1.00 1.43 C ATOM 205 OD1 ASP A 24 10.040 1.795 -16.103 1.00 1.51 O ATOM 206 OD2 ASP A 24 8.956 3.361 -17.187 1.00 2.34 O ATOM 0 H ASP A 24 5.829 1.649 -13.835 1.00 0.46 H new ATOM 0 HA ASP A 24 8.694 2.355 -13.740 1.00 0.54 H new ATOM 0 HB2 ASP A 24 7.611 0.956 -15.650 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.861 2.457 -16.156 1.00 0.69 H new ATOM 211 N HIS A 25 6.534 4.450 -13.210 1.00 0.43 N ATOM 212 CA HIS A 25 6.234 5.873 -13.002 1.00 0.44 C ATOM 213 C HIS A 25 5.352 6.374 -14.128 1.00 0.47 C ATOM 214 O HIS A 25 5.246 7.573 -14.385 1.00 0.54 O ATOM 215 CB HIS A 25 7.503 6.734 -12.879 1.00 0.54 C ATOM 216 CG HIS A 25 8.219 6.592 -11.571 1.00 0.64 C ATOM 217 ND1 HIS A 25 8.115 7.506 -10.544 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.063 5.635 -11.131 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.864 7.115 -9.533 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.454 5.982 -9.860 1.00 1.26 N ATOM 0 H HIS A 25 6.006 3.821 -12.605 1.00 0.43 H new ATOM 0 HA HIS A 25 5.706 5.966 -12.053 1.00 0.44 H new ATOM 0 HB2 HIS A 25 8.187 6.469 -13.685 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.233 7.781 -13.021 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.374 4.757 -11.678 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.976 7.636 -8.593 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.094 5.452 -9.268 1.00 1.26 H new ATOM 229 N LYS A 26 4.736 5.424 -14.807 1.00 0.48 N ATOM 230 CA LYS A 26 3.715 5.710 -15.789 1.00 0.53 C ATOM 231 C LYS A 26 2.386 5.746 -15.066 1.00 0.41 C ATOM 232 O LYS A 26 2.077 4.821 -14.313 1.00 0.38 O ATOM 233 CB LYS A 26 3.700 4.622 -16.863 1.00 0.67 C ATOM 234 CG LYS A 26 5.067 4.304 -17.459 1.00 1.00 C ATOM 235 CD LYS A 26 5.589 5.407 -18.375 1.00 2.12 C ATOM 236 CE LYS A 26 6.099 6.608 -17.596 1.00 3.15 C ATOM 237 NZ LYS A 26 6.644 7.662 -18.489 1.00 4.25 N ATOM 0 H LYS A 26 4.933 4.430 -14.690 1.00 0.48 H new ATOM 0 HA LYS A 26 3.910 6.664 -16.279 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.284 3.711 -16.433 1.00 0.67 H new ATOM 0 HB3 LYS A 26 3.030 4.931 -17.666 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.781 4.142 -16.651 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.004 3.372 -18.021 1.00 1.00 H new ATOM 0 HD2 LYS A 26 6.393 5.011 -18.996 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.793 5.725 -19.048 1.00 2.12 H new ATOM 0 HE2 LYS A 26 5.287 7.023 -16.999 1.00 3.15 H new ATOM 0 HE3 LYS A 26 6.874 6.286 -16.901 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 6.981 8.462 -17.916 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 7.436 7.274 -19.041 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 5.898 7.989 -19.136 1.00 4.25 H new ATOM 251 N PRO A 27 1.606 6.820 -15.241 1.00 0.41 N ATOM 252 CA PRO A 27 0.391 7.039 -14.455 1.00 0.37 C ATOM 253 C PRO A 27 -0.528 5.824 -14.419 1.00 0.32 C ATOM 254 O PRO A 27 -1.085 5.395 -15.432 1.00 0.36 O ATOM 255 CB PRO A 27 -0.271 8.217 -15.171 1.00 0.46 C ATOM 256 CG PRO A 27 0.878 8.968 -15.742 1.00 0.54 C ATOM 257 CD PRO A 27 1.848 7.915 -16.195 1.00 0.50 C ATOM 0 HA PRO A 27 0.611 7.228 -13.404 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -0.956 7.880 -15.949 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.849 8.832 -14.481 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.563 9.598 -16.574 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.328 9.625 -14.998 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.659 7.606 -17.223 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.878 8.268 -16.153 1.00 0.50 H new ATOM 265 N TYR A 28 -0.649 5.283 -13.222 1.00 0.28 N ATOM 266 CA TYR A 28 -1.566 4.198 -12.913 1.00 0.26 C ATOM 267 C TYR A 28 -2.987 4.704 -12.708 1.00 0.25 C ATOM 268 O TYR A 28 -3.211 5.808 -12.207 1.00 0.37 O ATOM 269 CB TYR A 28 -1.085 3.483 -11.649 1.00 0.30 C ATOM 270 CG TYR A 28 -1.884 2.269 -11.264 1.00 0.37 C ATOM 271 CD1 TYR A 28 -1.962 1.184 -12.115 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.567 2.211 -10.058 1.00 0.82 C ATOM 273 CE1 TYR A 28 -2.688 0.070 -11.784 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.304 1.099 -9.713 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.354 0.036 -10.528 1.00 0.92 C ATOM 276 OH TYR A 28 -4.083 -1.099 -10.237 1.00 1.20 O ATOM 0 H TYR A 28 -0.101 5.591 -12.418 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.579 3.508 -13.757 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.046 3.186 -11.791 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.104 4.190 -10.820 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -1.440 1.214 -13.060 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -2.520 3.050 -9.379 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -2.753 -0.766 -12.464 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.846 1.084 -8.779 1.00 1.10 H new ATOM 0 HH TYR A 28 -4.852 -0.860 -9.679 1.00 1.20 H new ATOM 286 N ASN A 29 -3.936 3.872 -13.099 1.00 0.34 N ATOM 287 CA ASN A 29 -5.340 4.144 -12.898 1.00 0.42 C ATOM 288 C ASN A 29 -5.753 3.659 -11.517 1.00 0.34 C ATOM 289 O ASN A 29 -6.097 2.493 -11.327 1.00 0.44 O ATOM 290 CB ASN A 29 -6.167 3.452 -13.988 1.00 0.67 C ATOM 291 CG ASN A 29 -7.656 3.716 -13.863 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.477 2.893 -14.265 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.014 4.863 -13.313 1.00 1.51 N ATOM 0 H ASN A 29 -3.749 2.985 -13.567 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.521 5.217 -12.963 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -5.825 3.791 -14.966 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -5.990 2.377 -13.943 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.002 5.092 -13.209 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.302 5.519 -12.992 1.00 1.51 H new ATOM 300 N LEU A 30 -5.684 4.554 -10.551 1.00 0.25 N ATOM 301 CA LEU A 30 -6.054 4.241 -9.181 1.00 0.20 C ATOM 302 C LEU A 30 -7.566 4.109 -9.068 1.00 0.19 C ATOM 303 O LEU A 30 -8.085 3.197 -8.423 1.00 0.19 O ATOM 304 CB LEU A 30 -5.586 5.362 -8.248 1.00 0.22 C ATOM 305 CG LEU A 30 -6.043 5.275 -6.813 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.467 4.049 -6.141 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.662 6.532 -6.055 1.00 0.28 C ATOM 0 H LEU A 30 -5.372 5.515 -10.691 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.581 3.301 -8.898 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.496 5.383 -8.259 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.927 6.313 -8.658 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.129 5.187 -6.805 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.809 4.006 -5.107 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.797 3.155 -6.670 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.378 4.101 -6.161 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -6.000 6.450 -5.022 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.579 6.654 -6.074 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.133 7.396 -6.524 1.00 0.28 H new ATOM 319 N VAL A 31 -8.254 5.016 -9.749 1.00 0.20 N ATOM 320 CA VAL A 31 -9.688 5.233 -9.566 1.00 0.19 C ATOM 321 C VAL A 31 -10.526 4.078 -10.101 1.00 0.20 C ATOM 322 O VAL A 31 -11.751 4.098 -10.013 1.00 0.23 O ATOM 323 CB VAL A 31 -10.129 6.528 -10.253 1.00 0.22 C ATOM 324 CG1 VAL A 31 -11.345 7.140 -9.590 1.00 1.02 C ATOM 325 CG2 VAL A 31 -8.995 7.525 -10.300 1.00 0.87 C ATOM 0 H VAL A 31 -7.833 5.627 -10.449 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.854 5.303 -8.491 1.00 0.19 H new ATOM 0 HB VAL A 31 -10.410 6.268 -11.273 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.621 8.056 -10.111 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -12.175 6.435 -9.631 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -11.115 7.370 -8.550 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.332 8.437 -10.793 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.674 7.759 -9.285 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -8.160 7.100 -10.856 1.00 0.87 H new ATOM 335 N GLN A 32 -9.877 3.071 -10.658 1.00 0.21 N ATOM 336 CA GLN A 32 -10.588 1.878 -11.089 1.00 0.23 C ATOM 337 C GLN A 32 -10.941 1.024 -9.876 1.00 0.22 C ATOM 338 O GLN A 32 -11.660 0.036 -9.979 1.00 0.28 O ATOM 339 CB GLN A 32 -9.758 1.078 -12.096 1.00 0.26 C ATOM 340 CG GLN A 32 -8.442 0.562 -11.541 1.00 0.29 C ATOM 341 CD GLN A 32 -7.638 -0.203 -12.575 1.00 0.35 C ATOM 342 OE1 GLN A 32 -8.193 -0.857 -13.455 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.323 -0.110 -12.487 1.00 0.75 N ATOM 0 H GLN A 32 -8.870 3.053 -10.822 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.509 2.180 -11.589 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.349 0.232 -12.447 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.553 1.706 -12.963 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.852 1.402 -11.174 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.640 -0.086 -10.687 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -5.900 0.443 -11.742 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -5.731 -0.591 -13.164 1.00 0.75 H new ATOM 352 N HIS A 33 -10.426 1.436 -8.723 1.00 0.17 N ATOM 353 CA HIS A 33 -10.743 0.801 -7.450 1.00 0.16 C ATOM 354 C HIS A 33 -11.781 1.636 -6.734 1.00 0.16 C ATOM 355 O HIS A 33 -11.843 1.682 -5.511 1.00 0.17 O ATOM 356 CB HIS A 33 -9.467 0.636 -6.614 1.00 0.16 C ATOM 357 CG HIS A 33 -8.433 -0.168 -7.334 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.641 -1.483 -7.664 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.208 0.163 -7.840 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.607 -1.941 -8.330 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.721 -0.963 -8.461 1.00 0.28 N ATOM 0 H HIS A 33 -9.777 2.219 -8.645 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.154 -0.195 -7.614 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.061 1.618 -6.373 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.712 0.151 -5.669 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.473 -2.023 -7.428 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.718 1.122 -7.767 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.496 -2.947 -8.708 1.00 0.27 H new ATOM 370 N LYS A 34 -12.580 2.323 -7.529 1.00 0.19 N ATOM 371 CA LYS A 34 -13.710 3.060 -7.021 1.00 0.19 C ATOM 372 C LYS A 34 -14.938 2.170 -7.018 1.00 0.21 C ATOM 373 O LYS A 34 -15.380 1.701 -8.070 1.00 0.33 O ATOM 374 CB LYS A 34 -13.975 4.294 -7.871 1.00 0.22 C ATOM 375 CG LYS A 34 -13.153 5.487 -7.471 1.00 0.28 C ATOM 376 CD LYS A 34 -14.013 6.721 -7.256 1.00 0.69 C ATOM 377 CE LYS A 34 -14.726 7.124 -8.529 1.00 1.01 C ATOM 378 NZ LYS A 34 -15.394 8.446 -8.399 1.00 1.56 N ATOM 0 H LYS A 34 -12.460 2.383 -8.540 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.486 3.381 -6.004 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.771 4.056 -8.915 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.032 4.552 -7.803 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.607 5.261 -6.555 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.411 5.692 -8.243 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.746 6.524 -6.473 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.390 7.545 -6.909 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.010 7.159 -9.350 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.467 6.367 -8.785 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -15.870 8.684 -9.293 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -16.096 8.406 -7.633 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -14.684 9.174 -8.181 1.00 1.56 H new ATOM 392 N GLY A 35 -15.479 1.936 -5.845 1.00 0.18 N ATOM 393 CA GLY A 35 -16.618 1.066 -5.721 1.00 0.20 C ATOM 394 C GLY A 35 -16.343 -0.059 -4.758 1.00 0.17 C ATOM 395 O GLY A 35 -17.205 -0.429 -3.961 1.00 0.20 O ATOM 0 H GLY A 35 -15.148 2.336 -4.967 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.480 1.638 -5.379 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.874 0.657 -6.698 1.00 0.20 H new ATOM 399 N SER A 36 -15.138 -0.605 -4.820 1.00 0.16 N ATOM 400 CA SER A 36 -14.708 -1.569 -3.848 1.00 0.16 C ATOM 401 C SER A 36 -13.391 -1.115 -3.271 1.00 0.14 C ATOM 402 O SER A 36 -12.522 -0.645 -4.002 1.00 0.16 O ATOM 403 CB SER A 36 -14.554 -2.937 -4.494 1.00 0.20 C ATOM 404 OG SER A 36 -15.764 -3.352 -5.106 1.00 0.29 O ATOM 0 H SER A 36 -14.447 -0.389 -5.539 1.00 0.16 H new ATOM 0 HA SER A 36 -15.452 -1.650 -3.055 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.759 -2.903 -5.239 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.255 -3.666 -3.741 1.00 0.20 H new ATOM 0 HG SER A 36 -15.574 -3.708 -5.999 1.00 0.29 H new ATOM 410 N PRO A 37 -13.257 -1.208 -1.946 1.00 0.12 N ATOM 411 CA PRO A 37 -12.029 -0.898 -1.233 1.00 0.12 C ATOM 412 C PRO A 37 -10.803 -1.479 -1.906 1.00 0.12 C ATOM 413 O PRO A 37 -10.879 -2.454 -2.643 1.00 0.15 O ATOM 414 CB PRO A 37 -12.249 -1.539 0.151 1.00 0.15 C ATOM 415 CG PRO A 37 -13.495 -2.325 0.016 1.00 0.18 C ATOM 416 CD PRO A 37 -14.296 -1.610 -1.016 1.00 0.15 C ATOM 0 HA PRO A 37 -11.840 0.175 -1.194 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.409 -2.176 0.429 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.344 -0.779 0.927 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.283 -3.350 -0.290 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.031 -2.379 0.963 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.039 -2.257 -1.483 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.832 -0.756 -0.603 1.00 0.15 H new ATOM 424 N LEU A 38 -9.689 -0.848 -1.638 1.00 0.14 N ATOM 425 CA LEU A 38 -8.397 -1.222 -2.173 1.00 0.13 C ATOM 426 C LEU A 38 -7.389 -1.012 -1.058 1.00 0.13 C ATOM 427 O LEU A 38 -7.600 -0.185 -0.193 1.00 0.20 O ATOM 428 CB LEU A 38 -8.030 -0.373 -3.401 1.00 0.16 C ATOM 429 CG LEU A 38 -8.155 1.145 -3.258 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.474 1.835 -4.418 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.611 1.589 -3.199 1.00 0.26 C ATOM 0 H LEU A 38 -9.650 -0.035 -1.023 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.408 -2.260 -2.507 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -7.001 -0.604 -3.677 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.661 -0.688 -4.232 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.672 1.423 -2.321 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.569 2.915 -4.306 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.418 1.564 -4.434 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.943 1.525 -5.352 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.657 2.673 -3.097 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.120 1.288 -4.115 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.099 1.123 -2.343 1.00 0.26 H new ATOM 443 N LEU A 39 -6.338 -1.776 -1.028 1.00 0.18 N ATOM 444 CA LEU A 39 -5.325 -1.590 -0.023 1.00 0.19 C ATOM 445 C LEU A 39 -4.011 -1.279 -0.666 1.00 0.18 C ATOM 446 O LEU A 39 -3.485 -2.067 -1.440 1.00 0.21 O ATOM 447 CB LEU A 39 -5.164 -2.812 0.856 1.00 0.23 C ATOM 448 CG LEU A 39 -5.782 -2.691 2.249 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.284 -2.854 2.191 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.178 -3.704 3.197 1.00 1.19 C ATOM 0 H LEU A 39 -6.156 -2.534 -1.686 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.646 -0.757 0.603 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.611 -3.667 0.349 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.101 -3.026 0.964 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.560 -1.692 2.626 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.699 -2.764 3.195 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.709 -2.081 1.552 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.528 -3.836 1.785 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.634 -3.598 4.181 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.360 -4.710 2.819 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -4.104 -3.535 3.274 1.00 1.19 H new ATOM 462 N ILE A 40 -3.501 -0.122 -0.362 1.00 0.19 N ATOM 463 CA ILE A 40 -2.230 0.297 -0.889 1.00 0.20 C ATOM 464 C ILE A 40 -1.144 0.161 0.173 1.00 0.18 C ATOM 465 O ILE A 40 -1.295 0.648 1.292 1.00 0.20 O ATOM 466 CB ILE A 40 -2.332 1.735 -1.379 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.729 1.971 -1.951 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.272 2.017 -2.429 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.863 3.314 -2.606 1.00 0.35 C ATOM 0 H ILE A 40 -3.949 0.556 0.254 1.00 0.19 H new ATOM 0 HA ILE A 40 -1.959 -0.342 -1.729 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.164 2.414 -0.543 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -3.957 1.192 -2.678 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.465 1.886 -1.151 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.361 3.049 -2.767 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.283 1.860 -1.999 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.411 1.345 -3.276 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.875 3.430 -2.995 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.664 4.097 -1.874 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.148 3.392 -3.425 1.00 0.35 H new ATOM 481 N TYR A 41 -0.062 -0.517 -0.184 1.00 0.18 N ATOM 482 CA TYR A 41 0.977 -0.873 0.763 1.00 0.19 C ATOM 483 C TYR A 41 2.296 -0.165 0.432 1.00 0.20 C ATOM 484 O TYR A 41 2.769 -0.260 -0.686 1.00 0.27 O ATOM 485 CB TYR A 41 1.251 -2.399 0.732 1.00 0.20 C ATOM 486 CG TYR A 41 0.091 -3.334 1.059 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.188 -3.104 0.582 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.304 -4.489 1.816 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.218 -3.983 0.845 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.732 -5.372 2.089 1.00 0.35 C ATOM 491 CZ TYR A 41 -1.988 -5.110 1.596 1.00 0.33 C ATOM 492 OH TYR A 41 -3.018 -5.984 1.844 1.00 0.42 O ATOM 0 H TYR A 41 0.117 -0.834 -1.137 1.00 0.18 H new ATOM 0 HA TYR A 41 0.622 -0.567 1.747 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.617 -2.654 -0.262 1.00 0.20 H new ATOM 0 HB3 TYR A 41 2.059 -2.609 1.433 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.383 -2.220 -0.007 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.293 -4.699 2.196 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.207 -3.785 0.460 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.553 -6.256 2.683 1.00 0.35 H new ATOM 0 HH TYR A 41 -2.955 -6.746 1.231 1.00 0.42 H new ATOM 502 N ASN A 42 2.905 0.505 1.405 1.00 0.28 N ATOM 503 CA ASN A 42 4.304 0.937 1.268 1.00 0.34 C ATOM 504 C ASN A 42 5.144 -0.296 1.489 1.00 0.37 C ATOM 505 O ASN A 42 5.262 -0.798 2.598 1.00 0.54 O ATOM 506 CB ASN A 42 4.667 2.005 2.303 1.00 0.46 C ATOM 507 CG ASN A 42 6.108 1.898 2.800 1.00 1.50 C ATOM 508 OD1 ASN A 42 7.038 2.406 2.192 1.00 2.27 O ATOM 509 ND2 ASN A 42 6.299 1.238 3.924 1.00 2.35 N ATOM 0 H ASN A 42 2.464 0.761 2.289 1.00 0.28 H new ATOM 0 HA ASN A 42 4.473 1.380 0.287 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.513 2.992 1.866 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.990 1.923 3.153 1.00 0.46 H new ATOM 0 HD21 ASN A 42 7.240 1.142 4.305 1.00 2.35 H new ATOM 0 HD22 ASN A 42 5.506 0.823 4.413 1.00 2.35 H new ATOM 516 N VAL A 43 5.685 -0.824 0.440 1.00 0.36 N ATOM 517 CA VAL A 43 6.203 -2.158 0.515 1.00 0.38 C ATOM 518 C VAL A 43 7.710 -2.228 0.358 1.00 0.42 C ATOM 519 O VAL A 43 8.292 -1.673 -0.580 1.00 0.50 O ATOM 520 CB VAL A 43 5.514 -3.048 -0.524 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.509 -2.374 -1.865 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.202 -4.376 -0.623 1.00 0.98 C ATOM 0 H VAL A 43 5.781 -0.365 -0.466 1.00 0.36 H new ATOM 0 HA VAL A 43 5.984 -2.523 1.518 1.00 0.38 H new ATOM 0 HB VAL A 43 4.485 -3.212 -0.204 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.016 -3.018 -2.594 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.972 -1.428 -1.795 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.535 -2.186 -2.182 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.697 -4.993 -1.366 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.240 -4.227 -0.920 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.170 -4.875 0.345 1.00 0.98 H new ATOM 532 N ALA A 44 8.332 -2.908 1.307 1.00 0.50 N ATOM 533 CA ALA A 44 9.717 -3.292 1.177 1.00 0.59 C ATOM 534 C ALA A 44 9.827 -4.332 0.075 1.00 0.58 C ATOM 535 O ALA A 44 9.351 -5.459 0.215 1.00 0.88 O ATOM 536 CB ALA A 44 10.247 -3.845 2.488 1.00 0.83 C ATOM 0 H ALA A 44 7.892 -3.204 2.178 1.00 0.50 H new ATOM 0 HA ALA A 44 10.318 -2.419 0.922 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.293 -4.128 2.367 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.164 -3.084 3.264 1.00 0.83 H new ATOM 0 HB3 ALA A 44 9.665 -4.721 2.775 1.00 0.83 H new ATOM 542 N SER A 45 10.408 -3.915 -1.030 1.00 0.57 N ATOM 543 CA SER A 45 10.524 -4.744 -2.223 1.00 0.63 C ATOM 544 C SER A 45 11.404 -5.975 -1.973 1.00 1.01 C ATOM 545 O SER A 45 11.949 -6.139 -0.884 1.00 1.78 O ATOM 546 CB SER A 45 11.068 -3.897 -3.375 1.00 0.73 C ATOM 547 OG SER A 45 10.460 -2.618 -3.380 1.00 1.62 O ATOM 0 H SER A 45 10.817 -2.986 -1.132 1.00 0.57 H new ATOM 0 HA SER A 45 9.535 -5.116 -2.489 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.149 -3.792 -3.278 1.00 0.73 H new ATOM 0 HB3 SER A 45 10.880 -4.399 -4.324 1.00 0.73 H new ATOM 0 HG SER A 45 11.004 -1.995 -2.855 1.00 1.62 H new ATOM 553 N LYS A 46 11.555 -6.813 -3.000 1.00 1.32 N ATOM 554 CA LYS A 46 12.166 -8.133 -2.852 1.00 1.69 C ATOM 555 C LYS A 46 13.580 -8.045 -2.288 1.00 1.14 C ATOM 556 O LYS A 46 14.538 -7.764 -3.008 1.00 1.47 O ATOM 557 CB LYS A 46 12.183 -8.859 -4.197 1.00 2.68 C ATOM 558 CG LYS A 46 12.476 -10.342 -4.075 1.00 3.45 C ATOM 559 CD LYS A 46 12.480 -11.026 -5.430 1.00 4.39 C ATOM 560 CE LYS A 46 12.481 -12.539 -5.286 1.00 5.19 C ATOM 561 NZ LYS A 46 11.240 -13.034 -4.628 1.00 5.84 N ATOM 0 H LYS A 46 11.259 -6.597 -3.952 1.00 1.32 H new ATOM 0 HA LYS A 46 11.561 -8.697 -2.142 1.00 1.69 H new ATOM 0 HB2 LYS A 46 11.218 -8.725 -4.686 1.00 2.68 H new ATOM 0 HB3 LYS A 46 12.933 -8.399 -4.841 1.00 2.68 H new ATOM 0 HG2 LYS A 46 13.443 -10.484 -3.593 1.00 3.45 H new ATOM 0 HG3 LYS A 46 11.729 -10.809 -3.434 1.00 3.45 H new ATOM 0 HD2 LYS A 46 11.605 -10.714 -6.000 1.00 4.39 H new ATOM 0 HD3 LYS A 46 13.357 -10.712 -5.995 1.00 4.39 H new ATOM 0 HE2 LYS A 46 12.578 -12.997 -6.270 1.00 5.19 H new ATOM 0 HE3 LYS A 46 13.349 -12.848 -4.704 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 11.103 -14.039 -4.857 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 11.325 -12.923 -3.598 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 10.424 -12.486 -4.969 1.00 5.84 H new ATOM 575 N CYS A 47 13.688 -8.293 -0.996 1.00 1.21 N ATOM 576 CA CYS A 47 14.956 -8.251 -0.298 1.00 1.53 C ATOM 577 C CYS A 47 14.984 -9.370 0.736 1.00 1.99 C ATOM 578 O CYS A 47 14.173 -10.296 0.658 1.00 2.46 O ATOM 579 CB CYS A 47 15.161 -6.889 0.370 1.00 2.04 C ATOM 580 SG CYS A 47 14.096 -6.602 1.806 1.00 3.55 S ATOM 0 H CYS A 47 12.895 -8.530 -0.400 1.00 1.21 H new ATOM 0 HA CYS A 47 15.769 -8.393 -1.010 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.202 -6.802 0.680 1.00 2.04 H new ATOM 0 HB3 CYS A 47 14.980 -6.105 -0.365 1.00 2.04 H new ATOM 0 HG CYS A 47 13.066 -7.393 1.747 1.00 3.55 H new ATOM 586 N GLY A 48 15.922 -9.311 1.672 1.00 2.39 N ATOM 587 CA GLY A 48 16.013 -10.326 2.709 1.00 2.91 C ATOM 588 C GLY A 48 14.719 -10.512 3.500 1.00 2.40 C ATOM 589 O GLY A 48 14.528 -11.546 4.140 1.00 2.46 O ATOM 0 H GLY A 48 16.626 -8.575 1.733 1.00 2.39 H new ATOM 0 HA2 GLY A 48 16.289 -11.276 2.252 1.00 2.91 H new ATOM 0 HA3 GLY A 48 16.814 -10.059 3.398 1.00 2.91 H new ATOM 593 N TYR A 49 13.821 -9.531 3.458 1.00 2.15 N ATOM 594 CA TYR A 49 12.582 -9.609 4.223 1.00 1.79 C ATOM 595 C TYR A 49 11.352 -9.302 3.371 1.00 1.42 C ATOM 596 O TYR A 49 11.416 -8.546 2.404 1.00 1.67 O ATOM 597 CB TYR A 49 12.639 -8.674 5.434 1.00 2.10 C ATOM 598 CG TYR A 49 13.452 -9.241 6.571 1.00 2.40 C ATOM 599 CD1 TYR A 49 14.818 -9.015 6.657 1.00 3.01 C ATOM 600 CD2 TYR A 49 12.852 -10.024 7.546 1.00 2.66 C ATOM 601 CE1 TYR A 49 15.565 -9.556 7.684 1.00 3.74 C ATOM 602 CE2 TYR A 49 13.589 -10.563 8.578 1.00 3.26 C ATOM 603 CZ TYR A 49 14.944 -10.329 8.641 1.00 3.76 C ATOM 604 OH TYR A 49 15.683 -10.879 9.663 1.00 4.63 O ATOM 0 H TYR A 49 13.927 -8.680 2.907 1.00 2.15 H new ATOM 0 HA TYR A 49 12.485 -10.638 4.570 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.065 -7.718 5.130 1.00 2.10 H new ATOM 0 HB3 TYR A 49 11.625 -8.475 5.782 1.00 2.10 H new ATOM 0 HD1 TYR A 49 15.304 -8.406 5.909 1.00 3.01 H new ATOM 0 HD2 TYR A 49 11.790 -10.214 7.496 1.00 2.66 H new ATOM 0 HE1 TYR A 49 16.628 -9.375 7.737 1.00 3.74 H new ATOM 0 HE2 TYR A 49 13.106 -11.166 9.333 1.00 3.26 H new ATOM 0 HH TYR A 49 15.094 -11.394 10.252 1.00 4.63 H new ATOM 614 N THR A 50 10.240 -9.926 3.739 1.00 1.05 N ATOM 615 CA THR A 50 8.963 -9.718 3.071 1.00 0.81 C ATOM 616 C THR A 50 7.861 -9.439 4.101 1.00 0.77 C ATOM 617 O THR A 50 6.864 -8.772 3.815 1.00 1.44 O ATOM 618 CB THR A 50 8.573 -10.945 2.233 1.00 1.09 C ATOM 619 OG1 THR A 50 9.692 -11.380 1.450 1.00 1.93 O ATOM 620 CG2 THR A 50 7.415 -10.611 1.312 1.00 1.87 C ATOM 0 H THR A 50 10.199 -10.592 4.511 1.00 1.05 H new ATOM 0 HA THR A 50 9.071 -8.858 2.409 1.00 0.81 H new ATOM 0 HB THR A 50 8.271 -11.743 2.911 1.00 1.09 H new ATOM 0 HG1 THR A 50 9.436 -12.163 0.920 1.00 1.93 H new ATOM 0 HG21 THR A 50 7.151 -11.491 0.725 1.00 1.87 H new ATOM 0 HG22 THR A 50 6.556 -10.300 1.906 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.705 -9.802 0.642 1.00 1.87 H new ATOM 628 N LYS A 51 8.075 -9.967 5.316 1.00 0.61 N ATOM 629 CA LYS A 51 7.235 -9.719 6.471 1.00 0.56 C ATOM 630 C LYS A 51 5.809 -10.217 6.272 1.00 0.76 C ATOM 631 O LYS A 51 4.874 -9.572 6.707 1.00 1.55 O ATOM 632 CB LYS A 51 7.256 -8.228 6.820 1.00 0.59 C ATOM 633 CG LYS A 51 8.663 -7.681 7.030 1.00 1.22 C ATOM 634 CD LYS A 51 9.359 -8.355 8.202 1.00 1.39 C ATOM 635 CE LYS A 51 8.936 -7.750 9.530 1.00 1.46 C ATOM 636 NZ LYS A 51 9.621 -6.454 9.797 1.00 2.01 N ATOM 0 H LYS A 51 8.857 -10.591 5.515 1.00 0.61 H new ATOM 0 HA LYS A 51 7.644 -10.287 7.306 1.00 0.56 H new ATOM 0 HB2 LYS A 51 6.771 -7.667 6.021 1.00 0.59 H new ATOM 0 HB3 LYS A 51 6.671 -8.065 7.725 1.00 0.59 H new ATOM 0 HG2 LYS A 51 9.250 -7.829 6.124 1.00 1.22 H new ATOM 0 HG3 LYS A 51 8.613 -6.606 7.205 1.00 1.22 H new ATOM 0 HD2 LYS A 51 9.129 -9.421 8.198 1.00 1.39 H new ATOM 0 HD3 LYS A 51 10.439 -8.261 8.087 1.00 1.39 H new ATOM 0 HE2 LYS A 51 7.857 -7.596 9.531 1.00 1.46 H new ATOM 0 HE3 LYS A 51 9.159 -8.450 10.335 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 9.356 -6.109 10.742 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 10.651 -6.591 9.755 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 9.335 -5.756 9.081 1.00 2.01 H new ATOM 650 N GLY A 52 5.645 -11.358 5.601 1.00 0.45 N ATOM 651 CA GLY A 52 4.334 -11.980 5.487 1.00 0.51 C ATOM 652 C GLY A 52 3.405 -11.279 4.514 1.00 0.41 C ATOM 653 O GLY A 52 2.476 -11.897 3.982 1.00 0.41 O ATOM 0 H GLY A 52 6.398 -11.863 5.134 1.00 0.45 H new ATOM 0 HA2 GLY A 52 4.460 -13.016 5.172 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.865 -12.001 6.471 1.00 0.51 H new ATOM 657 N GLY A 53 3.664 -10.003 4.264 1.00 0.44 N ATOM 658 CA GLY A 53 2.784 -9.210 3.437 1.00 0.50 C ATOM 659 C GLY A 53 2.653 -9.732 2.023 1.00 0.36 C ATOM 660 O GLY A 53 1.685 -9.421 1.351 1.00 0.32 O ATOM 0 H GLY A 53 4.476 -9.501 4.624 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.796 -9.178 3.897 1.00 0.50 H new ATOM 0 HA3 GLY A 53 3.154 -8.185 3.405 1.00 0.50 H new ATOM 664 N TYR A 54 3.621 -10.515 1.559 1.00 0.37 N ATOM 665 CA TYR A 54 3.542 -11.095 0.220 1.00 0.36 C ATOM 666 C TYR A 54 2.300 -11.960 0.117 1.00 0.26 C ATOM 667 O TYR A 54 1.432 -11.734 -0.722 1.00 0.25 O ATOM 668 CB TYR A 54 4.767 -11.954 -0.072 1.00 0.45 C ATOM 669 CG TYR A 54 5.260 -11.854 -1.495 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.360 -11.854 -2.546 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.617 -11.766 -1.790 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.785 -11.771 -3.851 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.057 -11.680 -3.097 1.00 0.65 C ATOM 674 CZ TYR A 54 6.201 -11.653 -4.102 1.00 0.56 C ATOM 675 OH TYR A 54 6.563 -11.599 -5.431 1.00 0.70 O ATOM 0 H TYR A 54 4.461 -10.762 2.082 1.00 0.37 H new ATOM 0 HA TYR A 54 3.499 -10.282 -0.505 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.572 -11.662 0.602 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.529 -12.995 0.147 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.302 -11.921 -2.337 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.337 -11.765 -0.985 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.078 -11.794 -4.667 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.117 -11.634 -3.300 1.00 0.65 H new ATOM 0 HH TYR A 54 6.611 -10.664 -5.719 1.00 0.70 H new ATOM 685 N GLU A 55 2.221 -12.929 1.014 1.00 0.25 N ATOM 686 CA GLU A 55 1.108 -13.859 1.065 1.00 0.27 C ATOM 687 C GLU A 55 -0.194 -13.106 1.297 1.00 0.22 C ATOM 688 O GLU A 55 -1.256 -13.485 0.795 1.00 0.25 O ATOM 689 CB GLU A 55 1.333 -14.852 2.207 1.00 0.36 C ATOM 690 CG GLU A 55 2.713 -15.476 2.201 1.00 1.14 C ATOM 691 CD GLU A 55 2.913 -16.481 3.317 1.00 1.92 C ATOM 692 OE1 GLU A 55 2.833 -16.086 4.500 1.00 2.61 O ATOM 693 OE2 GLU A 55 3.158 -17.670 3.021 1.00 2.39 O ATOM 0 H GLU A 55 2.930 -13.092 1.729 1.00 0.25 H new ATOM 0 HA GLU A 55 1.044 -14.393 0.117 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.178 -14.342 3.158 1.00 0.36 H new ATOM 0 HB3 GLU A 55 0.585 -15.642 2.143 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.879 -15.968 1.243 1.00 1.14 H new ATOM 0 HG3 GLU A 55 3.462 -14.689 2.290 1.00 1.14 H new ATOM 700 N THR A 56 -0.081 -12.016 2.040 1.00 0.25 N ATOM 701 CA THR A 56 -1.221 -11.226 2.439 1.00 0.24 C ATOM 702 C THR A 56 -1.776 -10.480 1.244 1.00 0.21 C ATOM 703 O THR A 56 -2.916 -10.683 0.829 1.00 0.22 O ATOM 704 CB THR A 56 -0.810 -10.218 3.537 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.298 -10.917 4.678 1.00 0.33 O ATOM 706 CG2 THR A 56 -1.981 -9.351 3.955 1.00 0.25 C ATOM 0 H THR A 56 0.811 -11.658 2.382 1.00 0.25 H new ATOM 0 HA THR A 56 -1.988 -11.891 2.835 1.00 0.24 H new ATOM 0 HB THR A 56 -0.035 -9.572 3.125 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.603 -11.249 4.481 1.00 0.33 H new ATOM 0 HG21 THR A 56 -1.659 -8.653 4.728 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.347 -8.794 3.093 1.00 0.25 H new ATOM 0 HG23 THR A 56 -2.780 -9.982 4.345 1.00 0.25 H new ATOM 714 N ALA A 57 -0.925 -9.664 0.671 1.00 0.19 N ATOM 715 CA ALA A 57 -1.278 -8.800 -0.423 1.00 0.20 C ATOM 716 C ALA A 57 -1.697 -9.598 -1.650 1.00 0.19 C ATOM 717 O ALA A 57 -2.682 -9.258 -2.309 1.00 0.22 O ATOM 718 CB ALA A 57 -0.095 -7.910 -0.729 1.00 0.22 C ATOM 0 H ALA A 57 0.050 -9.582 0.959 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.136 -8.189 -0.141 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.344 -7.246 -1.557 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.150 -7.316 0.151 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.762 -8.525 -1.002 1.00 0.22 H new ATOM 724 N THR A 58 -0.961 -10.665 -1.944 1.00 0.17 N ATOM 725 CA THR A 58 -1.255 -11.493 -3.101 1.00 0.17 C ATOM 726 C THR A 58 -2.677 -12.059 -3.026 1.00 0.17 C ATOM 727 O THR A 58 -3.504 -11.833 -3.915 1.00 0.19 O ATOM 728 CB THR A 58 -0.257 -12.668 -3.226 1.00 0.20 C ATOM 729 OG1 THR A 58 1.014 -12.200 -3.696 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.785 -13.753 -4.156 1.00 0.26 C ATOM 0 H THR A 58 -0.158 -10.974 -1.396 1.00 0.17 H new ATOM 0 HA THR A 58 -1.163 -10.852 -3.978 1.00 0.17 H new ATOM 0 HB THR A 58 -0.135 -13.101 -2.233 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.248 -12.666 -4.526 1.00 0.24 H new ATOM 0 HG21 THR A 58 -0.058 -14.563 -4.220 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.726 -14.140 -3.766 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.949 -13.333 -5.148 1.00 0.26 H new ATOM 738 N THR A 59 -2.956 -12.770 -1.939 1.00 0.16 N ATOM 739 CA THR A 59 -4.215 -13.482 -1.779 1.00 0.17 C ATOM 740 C THR A 59 -5.381 -12.513 -1.628 1.00 0.16 C ATOM 741 O THR A 59 -6.485 -12.778 -2.098 1.00 0.19 O ATOM 742 CB THR A 59 -4.161 -14.412 -0.554 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.923 -15.135 -0.554 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.325 -15.394 -0.559 1.00 0.46 C ATOM 0 H THR A 59 -2.318 -12.868 -1.149 1.00 0.16 H new ATOM 0 HA THR A 59 -4.370 -14.079 -2.678 1.00 0.17 H new ATOM 0 HB THR A 59 -4.233 -13.799 0.345 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.214 -14.569 -0.183 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.261 -16.038 0.318 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.266 -14.844 -0.537 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.283 -16.004 -1.461 1.00 0.46 H new ATOM 752 N LEU A 60 -5.122 -11.375 -1.002 1.00 0.13 N ATOM 753 CA LEU A 60 -6.152 -10.386 -0.767 1.00 0.13 C ATOM 754 C LEU A 60 -6.595 -9.783 -2.070 1.00 0.13 C ATOM 755 O LEU A 60 -7.788 -9.695 -2.361 1.00 0.15 O ATOM 756 CB LEU A 60 -5.624 -9.304 0.148 1.00 0.13 C ATOM 757 CG LEU A 60 -5.691 -9.659 1.616 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.001 -8.599 2.447 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.144 -9.803 2.028 1.00 0.35 C ATOM 0 H LEU A 60 -4.201 -11.117 -0.648 1.00 0.13 H new ATOM 0 HA LEU A 60 -7.007 -10.869 -0.294 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.589 -9.090 -0.117 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.192 -8.389 -0.021 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.176 -10.605 1.785 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.058 -8.869 3.501 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -3.956 -8.525 2.147 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.492 -7.638 2.292 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.199 -10.059 3.086 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.666 -8.862 1.855 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.613 -10.592 1.439 1.00 0.35 H new ATOM 771 N TYR A 61 -5.620 -9.389 -2.862 1.00 0.14 N ATOM 772 CA TYR A 61 -5.890 -8.822 -4.154 1.00 0.15 C ATOM 773 C TYR A 61 -6.658 -9.810 -5.017 1.00 0.17 C ATOM 774 O TYR A 61 -7.637 -9.467 -5.630 1.00 0.22 O ATOM 775 CB TYR A 61 -4.603 -8.459 -4.864 1.00 0.17 C ATOM 776 CG TYR A 61 -4.878 -7.799 -6.181 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.919 -6.915 -6.345 1.00 0.16 C ATOM 778 CD2 TYR A 61 -4.080 -8.078 -7.266 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.174 -6.327 -7.566 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.316 -7.498 -8.490 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.404 -6.536 -8.589 1.00 0.23 C ATOM 782 OH TYR A 61 -5.615 -6.053 -9.869 1.00 0.28 O ATOM 0 H TYR A 61 -4.630 -9.454 -2.626 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.486 -7.922 -4.001 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -4.014 -7.791 -4.236 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -4.006 -9.357 -5.022 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.549 -6.677 -5.501 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.254 -8.765 -7.155 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -7.032 -5.680 -7.673 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.713 -7.748 -9.351 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.889 -6.352 -10.455 1.00 0.28 H new ATOM 792 N ASN A 62 -6.210 -11.045 -5.039 1.00 0.18 N ATOM 793 CA ASN A 62 -6.755 -12.038 -5.948 1.00 0.22 C ATOM 794 C ASN A 62 -8.125 -12.492 -5.515 1.00 0.20 C ATOM 795 O ASN A 62 -8.942 -12.885 -6.345 1.00 0.24 O ATOM 796 CB ASN A 62 -5.816 -13.237 -6.092 1.00 0.27 C ATOM 797 CG ASN A 62 -4.736 -12.979 -7.119 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.301 -13.887 -7.824 1.00 1.21 O ATOM 799 ND2 ASN A 62 -4.285 -11.737 -7.188 1.00 1.12 N ATOM 0 H ASN A 62 -5.465 -11.391 -4.435 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.850 -11.560 -6.923 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.357 -13.458 -5.128 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.391 -14.117 -6.381 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.544 -11.499 -7.848 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -4.678 -11.017 -6.582 1.00 1.12 H new ATOM 806 N LYS A 63 -8.401 -12.414 -4.226 1.00 0.18 N ATOM 807 CA LYS A 63 -9.667 -12.874 -3.736 1.00 0.20 C ATOM 808 C LYS A 63 -10.672 -11.756 -3.859 1.00 0.18 C ATOM 809 O LYS A 63 -11.873 -11.993 -3.965 1.00 0.22 O ATOM 810 CB LYS A 63 -9.543 -13.349 -2.285 1.00 0.26 C ATOM 811 CG LYS A 63 -10.837 -13.899 -1.703 1.00 0.29 C ATOM 812 CD LYS A 63 -10.583 -14.813 -0.513 1.00 0.64 C ATOM 813 CE LYS A 63 -10.035 -14.051 0.680 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.990 -14.893 1.906 1.00 1.54 N ATOM 0 H LYS A 63 -7.770 -12.041 -3.517 1.00 0.18 H new ATOM 0 HA LYS A 63 -10.004 -13.725 -4.328 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.775 -14.120 -2.230 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -9.204 -12.517 -1.668 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.476 -13.072 -1.395 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.377 -14.449 -2.474 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.512 -15.309 -0.231 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.879 -15.594 -0.799 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -9.032 -13.691 0.451 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.654 -13.173 0.865 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.415 -14.419 2.632 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.955 -15.033 2.266 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -9.568 -15.816 1.678 1.00 1.54 H new ATOM 828 N TYR A 64 -10.180 -10.522 -3.890 1.00 0.16 N ATOM 829 CA TYR A 64 -11.081 -9.410 -3.776 1.00 0.16 C ATOM 830 C TYR A 64 -11.031 -8.418 -4.922 1.00 0.17 C ATOM 831 O TYR A 64 -11.887 -7.535 -5.004 1.00 0.17 O ATOM 832 CB TYR A 64 -10.916 -8.769 -2.417 1.00 0.15 C ATOM 833 CG TYR A 64 -11.433 -9.683 -1.336 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.705 -10.229 -1.380 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.624 -9.979 -0.247 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.156 -11.050 -0.366 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.063 -10.795 0.766 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.437 -11.399 0.597 1.00 0.24 C ATOM 839 OH TYR A 64 -12.782 -12.147 1.717 1.00 0.31 O ATOM 0 H TYR A 64 -9.193 -10.283 -3.990 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.092 -9.809 -3.860 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.864 -8.545 -2.239 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.453 -7.821 -2.388 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.351 -10.010 -2.217 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.630 -9.559 -0.196 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.175 -11.407 -0.406 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.458 -10.995 1.638 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.145 -11.967 2.439 1.00 0.31 H new ATOM 849 N LYS A 65 -10.093 -8.578 -5.839 1.00 0.20 N ATOM 850 CA LYS A 65 -10.120 -7.786 -7.060 1.00 0.23 C ATOM 851 C LYS A 65 -11.324 -8.197 -7.861 1.00 0.20 C ATOM 852 O LYS A 65 -11.852 -7.425 -8.659 1.00 0.22 O ATOM 853 CB LYS A 65 -8.841 -7.924 -7.895 1.00 0.34 C ATOM 854 CG LYS A 65 -8.548 -9.311 -8.449 1.00 0.29 C ATOM 855 CD LYS A 65 -7.294 -9.280 -9.303 1.00 0.38 C ATOM 856 CE LYS A 65 -7.371 -10.263 -10.458 1.00 0.80 C ATOM 857 NZ LYS A 65 -6.184 -10.164 -11.346 1.00 1.35 N ATOM 0 H LYS A 65 -9.316 -9.235 -5.767 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.180 -6.733 -6.783 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.900 -7.227 -8.731 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.995 -7.615 -7.281 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.421 -10.019 -7.630 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.393 -9.659 -9.043 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -7.145 -8.273 -9.693 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.428 -9.514 -8.684 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -7.449 -11.278 -10.067 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.275 -10.074 -11.037 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.273 -10.850 -12.122 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -6.123 -9.203 -11.739 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.323 -10.369 -10.799 1.00 1.35 H new ATOM 871 N SER A 66 -11.765 -9.419 -7.595 1.00 0.23 N ATOM 872 CA SER A 66 -13.022 -9.919 -8.136 1.00 0.26 C ATOM 873 C SER A 66 -14.153 -8.902 -7.900 1.00 0.25 C ATOM 874 O SER A 66 -15.035 -8.734 -8.743 1.00 0.31 O ATOM 875 CB SER A 66 -13.368 -11.268 -7.493 1.00 0.32 C ATOM 876 OG SER A 66 -14.464 -11.886 -8.147 1.00 1.28 O ATOM 0 H SER A 66 -11.268 -10.086 -7.005 1.00 0.23 H new ATOM 0 HA SER A 66 -12.911 -10.061 -9.211 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.500 -11.926 -7.534 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.607 -11.120 -6.440 1.00 0.32 H new ATOM 0 HG SER A 66 -14.660 -12.744 -7.716 1.00 1.28 H new ATOM 882 N GLN A 67 -14.118 -8.217 -6.751 1.00 0.21 N ATOM 883 CA GLN A 67 -15.095 -7.170 -6.460 1.00 0.20 C ATOM 884 C GLN A 67 -14.600 -5.782 -6.896 1.00 0.20 C ATOM 885 O GLN A 67 -15.401 -4.923 -7.257 1.00 0.27 O ATOM 886 CB GLN A 67 -15.437 -7.164 -4.969 1.00 0.21 C ATOM 887 CG GLN A 67 -16.176 -8.412 -4.517 1.00 0.38 C ATOM 888 CD GLN A 67 -16.588 -8.360 -3.058 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.664 -7.867 -2.724 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.743 -8.876 -2.180 1.00 0.46 N ATOM 0 H GLN A 67 -13.428 -8.369 -6.015 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.993 -7.393 -7.036 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.517 -7.066 -4.393 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.047 -6.288 -4.747 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.064 -8.546 -5.135 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.541 -9.283 -4.679 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.860 -9.276 -2.497 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.975 -8.874 -1.187 1.00 0.46 H new ATOM 899 N GLY A 68 -13.286 -5.573 -6.866 1.00 0.17 N ATOM 900 CA GLY A 68 -12.716 -4.276 -7.190 1.00 0.18 C ATOM 901 C GLY A 68 -11.516 -3.958 -6.313 1.00 0.15 C ATOM 902 O GLY A 68 -10.821 -2.959 -6.519 1.00 0.17 O ATOM 0 H GLY A 68 -12.600 -6.287 -6.620 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.416 -4.261 -8.238 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.474 -3.503 -7.065 1.00 0.18 H new ATOM 906 N PHE A 69 -11.279 -4.827 -5.338 1.00 0.14 N ATOM 907 CA PHE A 69 -10.186 -4.658 -4.389 1.00 0.13 C ATOM 908 C PHE A 69 -8.844 -4.809 -5.068 1.00 0.14 C ATOM 909 O PHE A 69 -8.692 -5.609 -5.975 1.00 0.18 O ATOM 910 CB PHE A 69 -10.297 -5.695 -3.267 1.00 0.14 C ATOM 911 CG PHE A 69 -9.268 -5.533 -2.199 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.018 -4.309 -1.598 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.554 -6.621 -1.798 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.056 -4.197 -0.614 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.605 -6.528 -0.832 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.384 -5.154 -0.214 1.00 0.14 C ATOM 0 H PHE A 69 -11.837 -5.666 -5.183 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.260 -3.653 -3.975 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.288 -5.627 -2.818 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.209 -6.693 -3.696 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.579 -3.438 -1.901 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.747 -7.579 -2.259 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.882 -3.227 -0.173 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.033 -7.388 -0.516 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.648 -5.017 0.565 1.00 0.14 H new ATOM 926 N THR A 70 -7.874 -4.031 -4.644 1.00 0.13 N ATOM 927 CA THR A 70 -6.543 -4.202 -5.094 1.00 0.12 C ATOM 928 C THR A 70 -5.650 -4.180 -3.910 1.00 0.12 C ATOM 929 O THR A 70 -5.988 -3.623 -2.886 1.00 0.19 O ATOM 930 CB THR A 70 -6.123 -3.085 -6.044 1.00 0.15 C ATOM 931 OG1 THR A 70 -4.925 -3.433 -6.733 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.910 -1.790 -5.294 1.00 0.19 C ATOM 0 H THR A 70 -8.002 -3.268 -3.979 1.00 0.13 H new ATOM 0 HA THR A 70 -6.474 -5.148 -5.632 1.00 0.12 H new ATOM 0 HB THR A 70 -6.927 -2.949 -6.767 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.023 -4.323 -7.131 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.611 -1.009 -5.994 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.837 -1.499 -4.800 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.128 -1.927 -4.547 1.00 0.19 H new ATOM 940 N VAL A 71 -4.554 -4.829 -4.020 1.00 0.13 N ATOM 941 CA VAL A 71 -3.460 -4.493 -3.195 1.00 0.13 C ATOM 942 C VAL A 71 -2.456 -3.775 -4.048 1.00 0.13 C ATOM 943 O VAL A 71 -1.741 -4.385 -4.839 1.00 0.15 O ATOM 944 CB VAL A 71 -2.835 -5.716 -2.545 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.469 -5.364 -1.975 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.754 -6.243 -1.461 1.00 0.17 C ATOM 0 H VAL A 71 -4.391 -5.596 -4.673 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.803 -3.858 -2.378 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.699 -6.496 -3.295 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.030 -6.247 -1.511 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.819 -5.014 -2.777 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.578 -4.578 -1.227 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.303 -7.120 -0.997 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.907 -5.471 -0.707 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.714 -6.517 -1.899 1.00 0.17 H new ATOM 956 N LEU A 72 -2.443 -2.473 -3.932 1.00 0.17 N ATOM 957 CA LEU A 72 -1.482 -1.699 -4.658 1.00 0.22 C ATOM 958 C LEU A 72 -0.226 -1.648 -3.832 1.00 0.19 C ATOM 959 O LEU A 72 -0.254 -1.173 -2.714 1.00 0.28 O ATOM 960 CB LEU A 72 -1.966 -0.267 -4.890 1.00 0.43 C ATOM 961 CG LEU A 72 -3.281 -0.090 -5.625 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.701 1.362 -5.585 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.164 -0.550 -7.058 1.00 1.00 C ATOM 0 H LEU A 72 -3.082 -1.934 -3.347 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.318 -2.161 -5.631 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -2.053 0.221 -3.919 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.194 0.265 -5.446 1.00 0.43 H new ATOM 0 HG LEU A 72 -4.036 -0.700 -5.129 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.646 1.482 -6.115 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.823 1.677 -4.549 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.937 1.975 -6.063 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.120 -0.413 -7.563 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.397 0.035 -7.566 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.890 -1.605 -7.080 1.00 1.00 H new ATOM 975 N ALA A 73 0.864 -2.130 -4.355 1.00 0.22 N ATOM 976 CA ALA A 73 2.105 -2.049 -3.630 1.00 0.30 C ATOM 977 C ALA A 73 2.937 -0.886 -4.131 1.00 0.23 C ATOM 978 O ALA A 73 3.435 -0.900 -5.247 1.00 0.32 O ATOM 979 CB ALA A 73 2.869 -3.352 -3.735 1.00 0.51 C ATOM 0 H ALA A 73 0.923 -2.579 -5.269 1.00 0.22 H new ATOM 0 HA ALA A 73 1.882 -1.875 -2.577 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.804 -3.271 -3.181 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.269 -4.160 -3.318 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.085 -3.564 -4.782 1.00 0.51 H new ATOM 985 N PHE A 74 3.087 0.102 -3.278 1.00 0.29 N ATOM 986 CA PHE A 74 3.897 1.260 -3.545 1.00 0.33 C ATOM 987 C PHE A 74 5.213 1.031 -2.857 1.00 0.35 C ATOM 988 O PHE A 74 5.342 1.280 -1.658 1.00 0.37 O ATOM 989 CB PHE A 74 3.255 2.521 -2.970 1.00 0.44 C ATOM 990 CG PHE A 74 2.369 3.294 -3.903 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.241 2.741 -4.498 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.667 4.615 -4.154 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.447 3.505 -5.323 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.874 5.384 -4.972 1.00 0.43 C ATOM 995 CZ PHE A 74 0.760 4.825 -5.560 1.00 0.35 C ATOM 0 H PHE A 74 2.639 0.120 -2.362 1.00 0.29 H new ATOM 0 HA PHE A 74 4.011 1.399 -4.620 1.00 0.33 H new ATOM 0 HB2 PHE A 74 2.669 2.240 -2.095 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.049 3.183 -2.623 1.00 0.44 H new ATOM 0 HD1 PHE A 74 0.987 1.708 -4.312 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.542 5.056 -3.699 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.425 3.067 -5.786 1.00 0.41 H new ATOM 0 HE2 PHE A 74 2.122 6.419 -5.153 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.133 5.422 -6.206 1.00 0.35 H new ATOM 1005 N PRO A 75 6.205 0.523 -3.569 1.00 0.37 N ATOM 1006 CA PRO A 75 7.426 0.128 -2.935 1.00 0.46 C ATOM 1007 C PRO A 75 8.199 1.342 -2.488 1.00 0.61 C ATOM 1008 O PRO A 75 8.154 2.392 -3.114 1.00 1.30 O ATOM 1009 CB PRO A 75 8.174 -0.688 -3.986 1.00 0.54 C ATOM 1010 CG PRO A 75 7.457 -0.491 -5.282 1.00 0.44 C ATOM 1011 CD PRO A 75 6.239 0.374 -5.026 1.00 0.38 C ATOM 0 HA PRO A 75 7.264 -0.463 -2.033 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.210 -0.359 -4.064 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.194 -1.743 -3.713 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.114 -0.016 -6.011 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.159 -1.452 -5.701 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.325 1.340 -5.523 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.330 -0.097 -5.400 1.00 0.38 H new ATOM 1019 N SER A 76 8.824 1.222 -1.358 1.00 0.41 N ATOM 1020 CA SER A 76 9.560 2.328 -0.800 1.00 0.37 C ATOM 1021 C SER A 76 10.873 2.569 -1.506 1.00 0.50 C ATOM 1022 O SER A 76 11.634 1.645 -1.814 1.00 0.74 O ATOM 1023 CB SER A 76 9.757 2.099 0.697 1.00 0.53 C ATOM 1024 OG SER A 76 10.388 0.852 0.941 1.00 1.44 O ATOM 0 H SER A 76 8.843 0.370 -0.798 1.00 0.41 H new ATOM 0 HA SER A 76 8.976 3.236 -0.950 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.361 2.904 1.116 1.00 0.53 H new ATOM 0 HB3 SER A 76 8.792 2.128 1.203 1.00 0.53 H new ATOM 0 HG SER A 76 10.505 0.728 1.906 1.00 1.44 H new ATOM 1030 N ASN A 77 11.093 3.842 -1.796 1.00 0.52 N ATOM 1031 CA ASN A 77 12.332 4.299 -2.374 1.00 0.72 C ATOM 1032 C ASN A 77 13.437 4.192 -1.336 1.00 0.70 C ATOM 1033 O ASN A 77 13.700 5.134 -0.592 1.00 0.75 O ATOM 1034 CB ASN A 77 12.199 5.746 -2.859 1.00 0.93 C ATOM 1035 CG ASN A 77 13.349 6.158 -3.755 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.897 5.338 -4.486 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.725 7.428 -3.707 1.00 1.46 N ATOM 0 H ASN A 77 10.411 4.583 -1.634 1.00 0.52 H new ATOM 0 HA ASN A 77 12.578 3.675 -3.233 1.00 0.72 H new ATOM 0 HB2 ASN A 77 11.260 5.861 -3.400 1.00 0.93 H new ATOM 0 HB3 ASN A 77 12.154 6.413 -1.998 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.495 7.754 -4.291 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.244 8.079 -3.086 1.00 1.46 H new ATOM 1044 N GLN A 78 14.053 3.016 -1.286 1.00 0.85 N ATOM 1045 CA GLN A 78 15.181 2.729 -0.395 1.00 0.98 C ATOM 1046 C GLN A 78 16.331 3.699 -0.608 1.00 0.98 C ATOM 1047 O GLN A 78 17.284 3.737 0.163 1.00 1.12 O ATOM 1048 CB GLN A 78 15.665 1.289 -0.572 1.00 1.35 C ATOM 1049 CG GLN A 78 15.150 0.599 -1.825 1.00 2.07 C ATOM 1050 CD GLN A 78 15.819 1.076 -3.098 1.00 2.74 C ATOM 1051 OE1 GLN A 78 15.197 1.095 -4.158 1.00 3.34 O ATOM 1052 NE2 GLN A 78 17.090 1.437 -3.009 1.00 3.30 N ATOM 0 H GLN A 78 13.783 2.223 -1.868 1.00 0.85 H new ATOM 0 HA GLN A 78 14.822 2.856 0.626 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.755 1.286 -0.593 1.00 1.35 H new ATOM 0 HB3 GLN A 78 15.361 0.708 0.298 1.00 1.35 H new ATOM 0 HG2 GLN A 78 15.301 -0.476 -1.726 1.00 2.07 H new ATOM 0 HG3 GLN A 78 14.076 0.764 -1.905 1.00 2.07 H new ATOM 0 HE21 GLN A 78 17.567 1.406 -2.108 1.00 3.30 H new ATOM 0 HE22 GLN A 78 17.592 1.747 -3.841 1.00 3.30 H new ATOM 1061 N PHE A 79 16.232 4.462 -1.671 1.00 0.98 N ATOM 1062 CA PHE A 79 17.303 5.349 -2.102 1.00 1.19 C ATOM 1063 C PHE A 79 17.424 6.620 -1.246 1.00 1.20 C ATOM 1064 O PHE A 79 17.814 7.673 -1.752 1.00 1.54 O ATOM 1065 CB PHE A 79 17.075 5.728 -3.555 1.00 1.32 C ATOM 1066 CG PHE A 79 17.406 4.625 -4.523 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.711 4.184 -4.664 1.00 1.82 C ATOM 1068 CD2 PHE A 79 16.419 4.038 -5.298 1.00 2.02 C ATOM 1069 CE1 PHE A 79 19.025 3.179 -5.561 1.00 2.25 C ATOM 1070 CE2 PHE A 79 16.727 3.033 -6.193 1.00 2.64 C ATOM 1071 CZ PHE A 79 18.032 2.603 -6.326 1.00 2.68 C ATOM 0 H PHE A 79 15.406 4.490 -2.268 1.00 0.98 H new ATOM 0 HA PHE A 79 18.241 4.806 -1.981 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.032 6.016 -3.688 1.00 1.32 H new ATOM 0 HB3 PHE A 79 17.680 6.603 -3.793 1.00 1.32 H new ATOM 0 HD1 PHE A 79 19.493 4.630 -4.067 1.00 1.82 H new ATOM 0 HD2 PHE A 79 15.396 4.371 -5.201 1.00 2.02 H new ATOM 0 HE1 PHE A 79 20.047 2.845 -5.662 1.00 2.25 H new ATOM 0 HE2 PHE A 79 15.947 2.583 -6.789 1.00 2.64 H new ATOM 0 HZ PHE A 79 18.275 1.818 -7.027 1.00 2.68 H new ATOM 1081 N GLY A 80 17.095 6.529 0.035 1.00 1.10 N ATOM 1082 CA GLY A 80 17.210 7.681 0.912 1.00 1.22 C ATOM 1083 C GLY A 80 17.897 7.344 2.221 1.00 1.24 C ATOM 1084 O GLY A 80 18.942 6.688 2.234 1.00 1.98 O ATOM 0 H GLY A 80 16.751 5.680 0.484 1.00 1.10 H new ATOM 0 HA2 GLY A 80 17.768 8.467 0.404 1.00 1.22 H new ATOM 0 HA3 GLY A 80 16.216 8.078 1.118 1.00 1.22 H new ATOM 1088 N GLY A 81 17.310 7.800 3.321 1.00 1.18 N ATOM 1089 CA GLY A 81 17.806 7.461 4.639 1.00 1.21 C ATOM 1090 C GLY A 81 16.712 7.536 5.687 1.00 1.14 C ATOM 1091 O GLY A 81 16.950 7.948 6.822 1.00 1.49 O ATOM 0 H GLY A 81 16.489 8.406 3.321 1.00 1.18 H new ATOM 0 HA2 GLY A 81 18.225 6.455 4.622 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.615 8.139 4.909 1.00 1.21 H new ATOM 1095 N GLN A 82 15.504 7.143 5.296 1.00 0.86 N ATOM 1096 CA GLN A 82 14.342 7.213 6.181 1.00 0.82 C ATOM 1097 C GLN A 82 13.393 6.049 5.930 1.00 0.77 C ATOM 1098 O GLN A 82 12.350 5.964 6.560 1.00 0.91 O ATOM 1099 CB GLN A 82 13.565 8.547 6.013 1.00 0.80 C ATOM 1100 CG GLN A 82 13.024 8.812 4.603 1.00 0.75 C ATOM 1101 CD GLN A 82 14.117 8.914 3.557 1.00 1.09 C ATOM 1102 OE1 GLN A 82 15.155 9.532 3.784 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.926 8.241 2.442 1.00 1.14 N ATOM 0 H GLN A 82 15.302 6.771 4.368 1.00 0.86 H new ATOM 0 HA GLN A 82 14.724 7.159 7.200 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.729 8.553 6.713 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.222 9.370 6.294 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.338 8.011 4.327 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.448 9.737 4.609 1.00 0.75 H new ATOM 0 HE21 GLN A 82 13.050 7.741 2.292 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.654 8.220 1.728 1.00 1.14 H new ATOM 1112 N GLU A 83 13.791 5.130 5.063 1.00 0.75 N ATOM 1113 CA GLU A 83 12.889 4.097 4.559 1.00 0.74 C ATOM 1114 C GLU A 83 12.374 3.233 5.710 1.00 0.72 C ATOM 1115 O GLU A 83 13.120 2.902 6.636 1.00 0.88 O ATOM 1116 CB GLU A 83 13.591 3.193 3.528 1.00 0.87 C ATOM 1117 CG GLU A 83 14.320 3.912 2.394 1.00 1.16 C ATOM 1118 CD GLU A 83 15.466 4.763 2.869 1.00 2.33 C ATOM 1119 OE1 GLU A 83 16.501 4.193 3.233 1.00 3.07 O ATOM 1120 OE2 GLU A 83 15.354 5.999 2.842 1.00 2.83 O ATOM 0 H GLU A 83 14.739 5.076 4.690 1.00 0.75 H new ATOM 0 HA GLU A 83 12.054 4.602 4.073 1.00 0.74 H new ATOM 0 HB2 GLU A 83 14.309 2.565 4.055 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.846 2.528 3.091 1.00 0.87 H new ATOM 0 HG2 GLU A 83 14.694 3.173 1.686 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.610 4.539 1.855 1.00 1.16 H new ATOM 1127 N PRO A 84 11.084 2.870 5.673 1.00 0.63 N ATOM 1128 CA PRO A 84 10.439 2.129 6.746 1.00 0.75 C ATOM 1129 C PRO A 84 10.617 0.621 6.596 1.00 1.00 C ATOM 1130 O PRO A 84 10.737 0.101 5.483 1.00 1.75 O ATOM 1131 CB PRO A 84 8.983 2.523 6.569 1.00 1.02 C ATOM 1132 CG PRO A 84 8.814 2.669 5.108 1.00 0.72 C ATOM 1133 CD PRO A 84 10.141 3.138 4.569 1.00 0.61 C ATOM 0 HA PRO A 84 10.851 2.356 7.729 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.314 1.762 6.972 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.758 3.454 7.090 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.524 1.721 4.654 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.026 3.387 4.878 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.419 2.597 3.665 1.00 0.61 H new ATOM 0 HD3 PRO A 84 10.117 4.197 4.312 1.00 0.61 H new ATOM 1141 N GLY A 85 10.623 -0.079 7.719 1.00 1.45 N ATOM 1142 CA GLY A 85 10.886 -1.500 7.692 1.00 1.82 C ATOM 1143 C GLY A 85 12.368 -1.766 7.613 1.00 1.61 C ATOM 1144 O GLY A 85 12.807 -2.735 6.988 1.00 2.20 O ATOM 0 H GLY A 85 10.451 0.311 8.646 1.00 1.45 H new ATOM 0 HA2 GLY A 85 10.475 -1.968 8.586 1.00 1.82 H new ATOM 0 HA3 GLY A 85 10.384 -1.952 6.836 1.00 1.82 H new ATOM 1148 N ASN A 86 13.119 -0.873 8.250 1.00 1.49 N ATOM 1149 CA ASN A 86 14.580 -0.894 8.254 1.00 2.04 C ATOM 1150 C ASN A 86 15.123 -0.414 6.913 1.00 1.94 C ATOM 1151 O ASN A 86 15.230 -1.177 5.950 1.00 2.70 O ATOM 1152 CB ASN A 86 15.143 -2.278 8.600 1.00 2.78 C ATOM 1153 CG ASN A 86 16.648 -2.259 8.809 1.00 3.58 C ATOM 1154 OD1 ASN A 86 17.340 -3.225 8.498 1.00 4.07 O ATOM 1155 ND2 ASN A 86 17.165 -1.169 9.358 1.00 4.20 N ATOM 0 H ASN A 86 12.724 -0.101 8.787 1.00 1.49 H new ATOM 0 HA ASN A 86 14.910 -0.211 9.037 1.00 2.04 H new ATOM 0 HB2 ASN A 86 14.659 -2.648 9.504 1.00 2.78 H new ATOM 0 HB3 ASN A 86 14.900 -2.976 7.799 1.00 2.78 H new ATOM 0 HD21 ASN A 86 18.168 -1.114 9.535 1.00 4.20 H new ATOM 0 HD22 ASN A 86 16.560 -0.385 9.604 1.00 4.20 H new ATOM 1162 N GLU A 87 15.471 0.864 6.882 1.00 1.52 N ATOM 1163 CA GLU A 87 16.016 1.524 5.704 1.00 1.46 C ATOM 1164 C GLU A 87 17.254 0.791 5.196 1.00 1.60 C ATOM 1165 O GLU A 87 17.529 0.748 3.999 1.00 2.15 O ATOM 1166 CB GLU A 87 16.376 2.981 6.040 1.00 1.61 C ATOM 1167 CG GLU A 87 17.326 3.146 7.228 1.00 2.19 C ATOM 1168 CD GLU A 87 16.613 3.214 8.569 1.00 2.58 C ATOM 1169 OE1 GLU A 87 16.068 2.183 9.009 1.00 2.84 O ATOM 1170 OE2 GLU A 87 16.576 4.301 9.184 1.00 3.02 O ATOM 0 H GLU A 87 15.381 1.482 7.688 1.00 1.52 H new ATOM 0 HA GLU A 87 15.259 1.509 4.920 1.00 1.46 H new ATOM 0 HB2 GLU A 87 16.830 3.441 5.162 1.00 1.61 H new ATOM 0 HB3 GLU A 87 15.457 3.530 6.248 1.00 1.61 H new ATOM 0 HG2 GLU A 87 18.028 2.312 7.240 1.00 2.19 H new ATOM 0 HG3 GLU A 87 17.913 4.054 7.091 1.00 2.19 H new ATOM 1177 N GLU A 88 17.979 0.198 6.131 1.00 1.57 N ATOM 1178 CA GLU A 88 19.237 -0.463 5.844 1.00 1.77 C ATOM 1179 C GLU A 88 19.033 -1.725 5.005 1.00 1.62 C ATOM 1180 O GLU A 88 19.772 -1.957 4.049 1.00 1.62 O ATOM 1181 CB GLU A 88 19.932 -0.794 7.165 1.00 2.18 C ATOM 1182 CG GLU A 88 21.247 -1.529 7.018 1.00 2.68 C ATOM 1183 CD GLU A 88 22.011 -1.596 8.322 1.00 3.33 C ATOM 1184 OE1 GLU A 88 21.557 -2.312 9.238 1.00 3.66 O ATOM 1185 OE2 GLU A 88 23.083 -0.964 8.429 1.00 3.92 O ATOM 0 H GLU A 88 17.708 0.163 7.114 1.00 1.57 H new ATOM 0 HA GLU A 88 19.863 0.208 5.256 1.00 1.77 H new ATOM 0 HB2 GLU A 88 20.108 0.133 7.710 1.00 2.18 H new ATOM 0 HB3 GLU A 88 19.259 -1.398 7.773 1.00 2.18 H new ATOM 0 HG2 GLU A 88 21.058 -2.540 6.657 1.00 2.68 H new ATOM 0 HG3 GLU A 88 21.858 -1.031 6.266 1.00 2.68 H new ATOM 1192 N GLU A 89 18.013 -2.510 5.347 1.00 1.62 N ATOM 1193 CA GLU A 89 17.780 -3.811 4.718 1.00 1.59 C ATOM 1194 C GLU A 89 17.702 -3.702 3.194 1.00 1.49 C ATOM 1195 O GLU A 89 18.507 -4.298 2.480 1.00 1.59 O ATOM 1196 CB GLU A 89 16.492 -4.435 5.265 1.00 1.70 C ATOM 1197 CG GLU A 89 16.190 -5.815 4.701 1.00 1.75 C ATOM 1198 CD GLU A 89 17.334 -6.788 4.906 1.00 2.11 C ATOM 1199 OE1 GLU A 89 17.602 -7.165 6.063 1.00 2.45 O ATOM 1200 OE2 GLU A 89 17.959 -7.192 3.906 1.00 2.65 O ATOM 0 H GLU A 89 17.329 -2.266 6.063 1.00 1.62 H new ATOM 0 HA GLU A 89 18.628 -4.451 4.961 1.00 1.59 H new ATOM 0 HB2 GLU A 89 16.566 -4.505 6.350 1.00 1.70 H new ATOM 0 HB3 GLU A 89 15.656 -3.772 5.044 1.00 1.70 H new ATOM 0 HG2 GLU A 89 15.292 -6.210 5.176 1.00 1.75 H new ATOM 0 HG3 GLU A 89 15.976 -5.730 3.636 1.00 1.75 H new ATOM 1207 N ILE A 90 16.754 -2.912 2.704 1.00 1.43 N ATOM 1208 CA ILE A 90 16.524 -2.783 1.265 1.00 1.39 C ATOM 1209 C ILE A 90 17.565 -1.898 0.585 1.00 1.49 C ATOM 1210 O ILE A 90 17.374 -1.460 -0.551 1.00 1.57 O ATOM 1211 CB ILE A 90 15.116 -2.233 0.964 1.00 1.45 C ATOM 1212 CG1 ILE A 90 14.754 -1.114 1.940 1.00 1.74 C ATOM 1213 CG2 ILE A 90 14.086 -3.350 1.020 1.00 1.76 C ATOM 1214 CD1 ILE A 90 13.442 -0.433 1.609 1.00 2.15 C ATOM 0 H ILE A 90 16.129 -2.349 3.281 1.00 1.43 H new ATOM 0 HA ILE A 90 16.612 -3.790 0.858 1.00 1.39 H new ATOM 0 HB ILE A 90 15.117 -1.817 -0.044 1.00 1.45 H new ATOM 0 HG12 ILE A 90 14.698 -1.524 2.948 1.00 1.74 H new ATOM 0 HG13 ILE A 90 15.551 -0.371 1.942 1.00 1.74 H new ATOM 0 HG21 ILE A 90 13.097 -2.944 0.805 1.00 1.76 H new ATOM 0 HG22 ILE A 90 14.334 -4.111 0.281 1.00 1.76 H new ATOM 0 HG23 ILE A 90 14.087 -3.796 2.015 1.00 1.76 H new ATOM 0 HD11 ILE A 90 13.244 0.351 2.340 1.00 2.15 H new ATOM 0 HD12 ILE A 90 13.501 0.006 0.613 1.00 2.15 H new ATOM 0 HD13 ILE A 90 12.635 -1.165 1.635 1.00 2.15 H new ATOM 1226 N LYS A 91 18.666 -1.644 1.273 1.00 1.71 N ATOM 1227 CA LYS A 91 19.749 -0.863 0.706 1.00 1.89 C ATOM 1228 C LYS A 91 21.032 -1.676 0.674 1.00 1.98 C ATOM 1229 O LYS A 91 21.736 -1.708 -0.336 1.00 2.17 O ATOM 1230 CB LYS A 91 19.970 0.408 1.509 1.00 2.00 C ATOM 1231 CG LYS A 91 20.082 1.643 0.641 1.00 2.10 C ATOM 1232 CD LYS A 91 20.218 2.895 1.488 1.00 2.33 C ATOM 1233 CE LYS A 91 19.119 2.956 2.529 1.00 2.39 C ATOM 1234 NZ LYS A 91 19.128 4.226 3.292 1.00 2.79 N ATOM 0 H LYS A 91 18.832 -1.968 2.226 1.00 1.71 H new ATOM 0 HA LYS A 91 19.473 -0.594 -0.314 1.00 1.89 H new ATOM 0 HB2 LYS A 91 19.145 0.537 2.210 1.00 2.00 H new ATOM 0 HB3 LYS A 91 20.879 0.303 2.102 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.945 1.551 -0.019 1.00 2.10 H new ATOM 0 HG3 LYS A 91 19.201 1.725 0.004 1.00 2.10 H new ATOM 0 HD2 LYS A 91 21.192 2.905 1.978 1.00 2.33 H new ATOM 0 HD3 LYS A 91 20.173 3.778 0.851 1.00 2.33 H new ATOM 0 HE2 LYS A 91 18.152 2.837 2.039 1.00 2.39 H new ATOM 0 HE3 LYS A 91 19.231 2.120 3.220 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 18.175 4.415 3.663 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 19.799 4.151 4.083 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 19.417 5.005 2.666 1.00 2.79 H new ATOM 1248 N GLU A 92 21.337 -2.326 1.791 1.00 2.07 N ATOM 1249 CA GLU A 92 22.496 -3.201 1.864 1.00 2.27 C ATOM 1250 C GLU A 92 22.218 -4.477 1.094 1.00 2.10 C ATOM 1251 O GLU A 92 23.137 -5.189 0.690 1.00 2.26 O ATOM 1252 CB GLU A 92 22.856 -3.511 3.317 1.00 2.54 C ATOM 1253 CG GLU A 92 21.781 -4.275 4.069 1.00 2.47 C ATOM 1254 CD GLU A 92 22.274 -4.811 5.392 1.00 2.96 C ATOM 1255 OE1 GLU A 92 23.066 -4.117 6.065 1.00 3.20 O ATOM 1256 OE2 GLU A 92 21.881 -5.939 5.761 1.00 3.29 O ATOM 0 H GLU A 92 20.798 -2.263 2.655 1.00 2.07 H new ATOM 0 HA GLU A 92 23.350 -2.694 1.414 1.00 2.27 H new ATOM 0 HB2 GLU A 92 23.780 -4.089 3.336 1.00 2.54 H new ATOM 0 HB3 GLU A 92 23.055 -2.575 3.839 1.00 2.54 H new ATOM 0 HG2 GLU A 92 20.927 -3.620 4.241 1.00 2.47 H new ATOM 0 HG3 GLU A 92 21.429 -5.103 3.453 1.00 2.47 H new ATOM 1263 N PHE A 93 20.941 -4.755 0.885 1.00 1.86 N ATOM 1264 CA PHE A 93 20.541 -5.856 0.041 1.00 1.75 C ATOM 1265 C PHE A 93 19.816 -5.304 -1.166 1.00 1.59 C ATOM 1266 O PHE A 93 18.874 -4.521 -1.027 1.00 1.69 O ATOM 1267 CB PHE A 93 19.631 -6.825 0.785 1.00 1.73 C ATOM 1268 CG PHE A 93 19.580 -8.182 0.153 1.00 2.09 C ATOM 1269 CD1 PHE A 93 20.657 -9.042 0.264 1.00 2.34 C ATOM 1270 CD2 PHE A 93 18.464 -8.594 -0.553 1.00 2.65 C ATOM 1271 CE1 PHE A 93 20.623 -10.294 -0.315 1.00 2.87 C ATOM 1272 CE2 PHE A 93 18.423 -9.844 -1.137 1.00 3.40 C ATOM 1273 CZ PHE A 93 19.503 -10.696 -1.017 1.00 3.42 C ATOM 0 H PHE A 93 20.167 -4.229 1.291 1.00 1.86 H new ATOM 0 HA PHE A 93 21.432 -6.404 -0.265 1.00 1.75 H new ATOM 0 HB2 PHE A 93 19.977 -6.922 1.814 1.00 1.73 H new ATOM 0 HB3 PHE A 93 18.624 -6.411 0.825 1.00 1.73 H new ATOM 0 HD1 PHE A 93 21.535 -8.730 0.810 1.00 2.34 H new ATOM 0 HD2 PHE A 93 17.617 -7.931 -0.648 1.00 2.65 H new ATOM 0 HE1 PHE A 93 21.470 -10.958 -0.220 1.00 2.87 H new ATOM 0 HE2 PHE A 93 17.547 -10.155 -1.687 1.00 3.40 H new ATOM 0 HZ PHE A 93 19.472 -11.675 -1.471 1.00 3.42 H new ATOM 1283 N VAL A 94 20.262 -5.693 -2.347 1.00 1.62 N ATOM 1284 CA VAL A 94 19.663 -5.201 -3.570 1.00 1.68 C ATOM 1285 C VAL A 94 18.229 -5.686 -3.701 1.00 1.54 C ATOM 1286 O VAL A 94 17.973 -6.879 -3.873 1.00 1.74 O ATOM 1287 CB VAL A 94 20.469 -5.627 -4.813 1.00 2.11 C ATOM 1288 CG1 VAL A 94 19.770 -5.165 -6.080 1.00 2.63 C ATOM 1289 CG2 VAL A 94 21.886 -5.077 -4.747 1.00 2.56 C ATOM 0 H VAL A 94 21.034 -6.346 -2.483 1.00 1.62 H new ATOM 0 HA VAL A 94 19.671 -4.112 -3.514 1.00 1.68 H new ATOM 0 HB VAL A 94 20.529 -6.715 -4.831 1.00 2.11 H new ATOM 0 HG11 VAL A 94 20.351 -5.473 -6.949 1.00 2.63 H new ATOM 0 HG12 VAL A 94 18.777 -5.611 -6.131 1.00 2.63 H new ATOM 0 HG13 VAL A 94 19.680 -4.079 -6.070 1.00 2.63 H new ATOM 0 HG21 VAL A 94 22.439 -5.389 -5.633 1.00 2.56 H new ATOM 0 HG22 VAL A 94 21.852 -3.988 -4.705 1.00 2.56 H new ATOM 0 HG23 VAL A 94 22.384 -5.459 -3.856 1.00 2.56 H new ATOM 1299 N CYS A 95 17.297 -4.751 -3.609 1.00 1.47 N ATOM 1300 CA CYS A 95 15.895 -5.079 -3.713 1.00 1.46 C ATOM 1301 C CYS A 95 15.328 -4.630 -5.044 1.00 1.37 C ATOM 1302 O CYS A 95 15.387 -3.454 -5.413 1.00 1.52 O ATOM 1303 CB CYS A 95 15.107 -4.450 -2.560 1.00 1.77 C ATOM 1304 SG CYS A 95 15.221 -2.645 -2.477 1.00 2.83 S ATOM 0 H CYS A 95 17.492 -3.761 -3.463 1.00 1.47 H new ATOM 0 HA CYS A 95 15.799 -6.163 -3.651 1.00 1.46 H new ATOM 0 HB2 CYS A 95 14.058 -4.732 -2.656 1.00 1.77 H new ATOM 0 HB3 CYS A 95 15.465 -4.869 -1.620 1.00 1.77 H new ATOM 0 HG CYS A 95 16.235 -2.308 -1.737 1.00 2.83 H new ATOM 1310 N THR A 96 14.803 -5.586 -5.769 1.00 1.52 N ATOM 1311 CA THR A 96 14.036 -5.306 -6.951 1.00 1.59 C ATOM 1312 C THR A 96 12.580 -5.192 -6.569 1.00 1.08 C ATOM 1313 O THR A 96 12.186 -5.633 -5.488 1.00 1.31 O ATOM 1314 CB THR A 96 14.188 -6.417 -7.999 1.00 2.27 C ATOM 1315 OG1 THR A 96 14.061 -7.703 -7.374 1.00 2.76 O ATOM 1316 CG2 THR A 96 15.523 -6.316 -8.717 1.00 2.98 C ATOM 0 H THR A 96 14.897 -6.579 -5.554 1.00 1.52 H new ATOM 0 HA THR A 96 14.402 -4.375 -7.385 1.00 1.59 H new ATOM 0 HB THR A 96 13.396 -6.296 -8.738 1.00 2.27 H new ATOM 0 HG1 THR A 96 14.157 -8.406 -8.050 1.00 2.76 H new ATOM 0 HG21 THR A 96 15.602 -7.116 -9.453 1.00 2.98 H new ATOM 0 HG22 THR A 96 15.593 -5.352 -9.220 1.00 2.98 H new ATOM 0 HG23 THR A 96 16.333 -6.408 -7.994 1.00 2.98 H new ATOM 1324 N LYS A 97 11.789 -4.568 -7.419 1.00 1.14 N ATOM 1325 CA LYS A 97 10.354 -4.564 -7.219 1.00 1.11 C ATOM 1326 C LYS A 97 9.898 -6.008 -7.093 1.00 1.04 C ATOM 1327 O LYS A 97 10.175 -6.824 -7.970 1.00 1.76 O ATOM 1328 CB LYS A 97 9.608 -3.889 -8.376 1.00 1.47 C ATOM 1329 CG LYS A 97 9.945 -2.419 -8.603 1.00 1.47 C ATOM 1330 CD LYS A 97 11.307 -2.233 -9.255 1.00 1.89 C ATOM 1331 CE LYS A 97 11.513 -0.801 -9.722 1.00 2.34 C ATOM 1332 NZ LYS A 97 10.507 -0.393 -10.742 1.00 2.72 N ATOM 0 H LYS A 97 12.110 -4.063 -8.245 1.00 1.14 H new ATOM 0 HA LYS A 97 10.127 -3.994 -6.318 1.00 1.11 H new ATOM 0 HB2 LYS A 97 9.821 -4.439 -9.293 1.00 1.47 H new ATOM 0 HB3 LYS A 97 8.537 -3.975 -8.194 1.00 1.47 H new ATOM 0 HG2 LYS A 97 9.179 -1.966 -9.232 1.00 1.47 H new ATOM 0 HG3 LYS A 97 9.927 -1.893 -7.649 1.00 1.47 H new ATOM 0 HD2 LYS A 97 12.090 -2.501 -8.546 1.00 1.89 H new ATOM 0 HD3 LYS A 97 11.400 -2.910 -10.104 1.00 1.89 H new ATOM 0 HE2 LYS A 97 11.453 -0.129 -8.866 1.00 2.34 H new ATOM 0 HE3 LYS A 97 12.514 -0.697 -10.140 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 10.871 0.417 -11.284 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.325 -1.188 -11.388 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 9.622 -0.123 -10.268 1.00 2.72 H new ATOM 1346 N PHE A 98 9.212 -6.325 -6.004 1.00 0.89 N ATOM 1347 CA PHE A 98 8.855 -7.708 -5.696 1.00 0.92 C ATOM 1348 C PHE A 98 7.653 -8.157 -6.551 1.00 1.11 C ATOM 1349 O PHE A 98 6.807 -8.929 -6.106 1.00 2.12 O ATOM 1350 CB PHE A 98 8.565 -7.834 -4.182 1.00 1.15 C ATOM 1351 CG PHE A 98 7.159 -7.482 -3.795 1.00 0.75 C ATOM 1352 CD1 PHE A 98 6.678 -6.189 -3.912 1.00 0.96 C ATOM 1353 CD2 PHE A 98 6.301 -8.476 -3.369 1.00 1.02 C ATOM 1354 CE1 PHE A 98 5.360 -5.906 -3.617 1.00 0.87 C ATOM 1355 CE2 PHE A 98 4.996 -8.198 -3.063 1.00 0.94 C ATOM 1356 CZ PHE A 98 4.519 -6.918 -3.191 1.00 0.45 C ATOM 0 H PHE A 98 8.890 -5.644 -5.316 1.00 0.89 H new ATOM 0 HA PHE A 98 9.687 -8.368 -5.942 1.00 0.92 H new ATOM 0 HB2 PHE A 98 8.771 -8.857 -3.868 1.00 1.15 H new ATOM 0 HB3 PHE A 98 9.253 -7.188 -3.636 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.338 -5.398 -4.236 1.00 0.96 H new ATOM 0 HD2 PHE A 98 6.665 -9.489 -3.276 1.00 1.02 H new ATOM 0 HE1 PHE A 98 4.986 -4.898 -3.718 1.00 0.87 H new ATOM 0 HE2 PHE A 98 4.342 -8.986 -2.721 1.00 0.94 H new ATOM 0 HZ PHE A 98 3.487 -6.701 -2.959 1.00 0.45 H new ATOM 1366 N LYS A 99 7.651 -7.703 -7.807 1.00 0.80 N ATOM 1367 CA LYS A 99 6.524 -7.832 -8.741 1.00 0.78 C ATOM 1368 C LYS A 99 5.713 -9.098 -8.504 1.00 0.79 C ATOM 1369 O LYS A 99 6.196 -10.216 -8.702 1.00 1.43 O ATOM 1370 CB LYS A 99 7.051 -7.801 -10.174 1.00 1.02 C ATOM 1371 CG LYS A 99 7.866 -6.555 -10.486 1.00 1.34 C ATOM 1372 CD LYS A 99 8.597 -6.670 -11.814 1.00 1.63 C ATOM 1373 CE LYS A 99 9.618 -7.796 -11.790 1.00 2.05 C ATOM 1374 NZ LYS A 99 10.432 -7.840 -13.032 1.00 2.69 N ATOM 0 H LYS A 99 8.453 -7.223 -8.215 1.00 0.80 H new ATOM 0 HA LYS A 99 5.851 -6.992 -8.570 1.00 0.78 H new ATOM 0 HB2 LYS A 99 7.667 -8.683 -10.347 1.00 1.02 H new ATOM 0 HB3 LYS A 99 6.210 -7.860 -10.865 1.00 1.02 H new ATOM 0 HG2 LYS A 99 7.207 -5.687 -10.509 1.00 1.34 H new ATOM 0 HG3 LYS A 99 8.589 -6.385 -9.688 1.00 1.34 H new ATOM 0 HD2 LYS A 99 7.877 -6.847 -12.613 1.00 1.63 H new ATOM 0 HD3 LYS A 99 9.097 -5.728 -12.038 1.00 1.63 H new ATOM 0 HE2 LYS A 99 10.276 -7.670 -10.930 1.00 2.05 H new ATOM 0 HE3 LYS A 99 9.104 -8.748 -11.660 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 11.115 -8.622 -12.972 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 9.808 -7.987 -13.851 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 10.944 -6.942 -13.143 1.00 2.69 H new ATOM 1388 N ALA A 100 4.477 -8.899 -8.082 1.00 0.51 N ATOM 1389 CA ALA A 100 3.653 -9.982 -7.583 1.00 0.43 C ATOM 1390 C ALA A 100 2.360 -10.118 -8.366 1.00 0.40 C ATOM 1391 O ALA A 100 2.219 -9.579 -9.464 1.00 0.55 O ATOM 1392 CB ALA A 100 3.338 -9.735 -6.121 1.00 0.43 C ATOM 0 H ALA A 100 4.020 -7.987 -8.076 1.00 0.51 H new ATOM 0 HA ALA A 100 4.210 -10.912 -7.701 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.718 -10.547 -5.740 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.266 -9.689 -5.551 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.803 -8.791 -6.019 1.00 0.43 H new ATOM 1398 N GLU A 101 1.409 -10.817 -7.763 1.00 0.34 N ATOM 1399 CA GLU A 101 0.119 -11.072 -8.381 1.00 0.40 C ATOM 1400 C GLU A 101 -0.825 -9.888 -8.169 1.00 0.43 C ATOM 1401 O GLU A 101 -2.038 -10.016 -8.316 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.520 -12.342 -7.802 1.00 0.50 C ATOM 1403 CG GLU A 101 0.278 -13.625 -8.029 1.00 0.67 C ATOM 1404 CD GLU A 101 1.621 -13.634 -7.323 1.00 1.24 C ATOM 1405 OE1 GLU A 101 1.649 -13.557 -6.077 1.00 1.57 O ATOM 1406 OE2 GLU A 101 2.657 -13.701 -8.014 1.00 1.99 O ATOM 0 H GLU A 101 1.511 -11.222 -6.833 1.00 0.34 H new ATOM 0 HA GLU A 101 0.284 -11.211 -9.449 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.661 -12.204 -6.730 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.510 -12.465 -8.240 1.00 0.50 H new ATOM 0 HG2 GLU A 101 -0.310 -14.475 -7.685 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.438 -13.760 -9.099 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.257 -8.747 -7.819 1.00 0.38 N ATOM 1414 CA PHE A 102 -1.016 -7.541 -7.582 1.00 0.40 C ATOM 1415 C PHE A 102 -0.223 -6.334 -8.078 1.00 0.45 C ATOM 1416 O PHE A 102 0.968 -6.455 -8.372 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.398 -7.410 -6.101 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.305 -7.668 -5.140 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.008 -8.954 -4.757 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.408 -6.625 -4.608 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.991 -9.201 -3.853 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.415 -6.860 -3.706 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.707 -8.159 -3.328 1.00 0.44 C ATOM 0 H PHE A 102 0.749 -8.635 -7.692 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.951 -7.589 -8.141 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.780 -6.404 -5.929 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.214 -8.101 -5.891 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.568 -9.778 -5.173 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.176 -5.612 -4.901 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.213 -10.215 -3.555 1.00 0.59 H new ATOM 0 HE2 PHE A 102 1.977 -6.035 -3.293 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.499 -8.350 -2.619 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.884 -5.175 -8.203 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.301 -3.955 -8.781 1.00 0.39 C ATOM 1435 C PRO A 103 0.886 -3.427 -7.992 1.00 0.41 C ATOM 1436 O PRO A 103 0.716 -2.701 -7.018 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.472 -2.960 -8.748 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.683 -3.820 -8.650 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.268 -4.955 -7.787 1.00 0.27 C ATOM 0 HA PRO A 103 0.102 -4.131 -9.778 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.395 -2.283 -7.897 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.494 -2.342 -9.646 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.521 -3.276 -8.214 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.004 -4.166 -9.633 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.340 -4.708 -6.728 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.887 -5.837 -7.951 1.00 0.27 H new ATOM 1447 N ILE A 104 2.091 -3.791 -8.419 1.00 0.35 N ATOM 1448 CA ILE A 104 3.292 -3.270 -7.794 1.00 0.35 C ATOM 1449 C ILE A 104 3.681 -2.006 -8.536 1.00 0.33 C ATOM 1450 O ILE A 104 3.989 -2.041 -9.730 1.00 0.44 O ATOM 1451 CB ILE A 104 4.489 -4.259 -7.786 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.126 -5.626 -7.181 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.661 -3.644 -7.028 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.117 -5.563 -6.076 1.00 1.34 C ATOM 0 H ILE A 104 2.257 -4.439 -9.189 1.00 0.35 H new ATOM 0 HA ILE A 104 3.063 -3.084 -6.745 1.00 0.35 H new ATOM 0 HB ILE A 104 4.769 -4.437 -8.824 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.741 -6.270 -7.972 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.034 -6.095 -6.802 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.499 -4.342 -7.025 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.963 -2.717 -7.515 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.360 -3.434 -6.002 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.919 -6.569 -5.707 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.505 -4.948 -5.264 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.192 -5.126 -6.452 1.00 1.34 H new ATOM 1466 N MET A 105 3.640 -0.902 -7.829 1.00 0.29 N ATOM 1467 CA MET A 105 3.700 0.411 -8.435 1.00 0.30 C ATOM 1468 C MET A 105 5.120 0.934 -8.499 1.00 0.27 C ATOM 1469 O MET A 105 6.081 0.226 -8.187 1.00 0.35 O ATOM 1470 CB MET A 105 2.851 1.379 -7.617 1.00 0.43 C ATOM 1471 CG MET A 105 1.519 0.809 -7.170 1.00 1.50 C ATOM 1472 SD MET A 105 0.203 0.998 -8.392 1.00 2.49 S ATOM 1473 CE MET A 105 0.755 -0.089 -9.703 1.00 3.03 C ATOM 0 H MET A 105 3.564 -0.887 -6.812 1.00 0.29 H new ATOM 0 HA MET A 105 3.321 0.330 -9.454 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.416 1.687 -6.737 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.670 2.276 -8.209 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.644 -0.250 -6.944 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.216 1.298 -6.244 1.00 1.50 H new ATOM 0 HE1 MET A 105 -0.083 -0.321 -10.361 1.00 3.03 H new ATOM 0 HE2 MET A 105 1.541 0.402 -10.276 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.143 -1.012 -9.271 1.00 3.03 H new ATOM 1483 N ALA A 106 5.238 2.176 -8.928 1.00 0.33 N ATOM 1484 CA ALA A 106 6.499 2.877 -8.903 1.00 0.52 C ATOM 1485 C ALA A 106 6.843 3.205 -7.471 1.00 0.66 C ATOM 1486 O ALA A 106 5.993 3.708 -6.735 1.00 1.46 O ATOM 1487 CB ALA A 106 6.400 4.151 -9.716 1.00 0.70 C ATOM 0 H ALA A 106 4.462 2.723 -9.302 1.00 0.33 H new ATOM 0 HA ALA A 106 7.278 2.250 -9.336 1.00 0.52 H new ATOM 0 HB1 ALA A 106 7.356 4.674 -9.691 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.147 3.906 -10.747 1.00 0.70 H new ATOM 0 HB3 ALA A 106 5.625 4.792 -9.295 1.00 0.70 H new ATOM 1493 N LYS A 107 8.059 2.900 -7.059 1.00 0.40 N ATOM 1494 CA LYS A 107 8.484 3.265 -5.724 1.00 0.36 C ATOM 1495 C LYS A 107 8.475 4.747 -5.594 1.00 0.38 C ATOM 1496 O LYS A 107 8.998 5.478 -6.440 1.00 0.59 O ATOM 1497 CB LYS A 107 9.909 2.798 -5.391 1.00 0.49 C ATOM 1498 CG LYS A 107 10.171 1.325 -5.579 1.00 0.84 C ATOM 1499 CD LYS A 107 11.597 0.969 -5.198 1.00 0.83 C ATOM 1500 CE LYS A 107 11.834 -0.527 -5.278 1.00 0.95 C ATOM 1501 NZ LYS A 107 13.196 -0.898 -4.799 1.00 1.76 N ATOM 0 H LYS A 107 8.757 2.410 -7.618 1.00 0.40 H new ATOM 0 HA LYS A 107 7.789 2.778 -5.040 1.00 0.36 H new ATOM 0 HB2 LYS A 107 10.610 3.356 -6.012 1.00 0.49 H new ATOM 0 HB3 LYS A 107 10.125 3.058 -4.355 1.00 0.49 H new ATOM 0 HG2 LYS A 107 9.474 0.748 -4.971 1.00 0.84 H new ATOM 0 HG3 LYS A 107 9.990 1.050 -6.618 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.292 1.485 -5.861 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.803 1.318 -4.186 1.00 0.83 H new ATOM 0 HE2 LYS A 107 11.085 -1.046 -4.681 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.708 -0.861 -6.308 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 13.682 -1.455 -5.531 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 13.742 -0.035 -4.602 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 13.116 -1.463 -3.930 1.00 1.76 H new ATOM 1515 N ILE A 108 7.882 5.175 -4.532 1.00 0.31 N ATOM 1516 CA ILE A 108 7.959 6.527 -4.137 1.00 0.35 C ATOM 1517 C ILE A 108 8.539 6.499 -2.745 1.00 0.36 C ATOM 1518 O ILE A 108 8.611 5.433 -2.130 1.00 0.42 O ATOM 1519 CB ILE A 108 6.575 7.225 -4.171 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.749 6.900 -2.918 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.817 6.819 -5.438 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.329 5.460 -2.801 1.00 0.64 C ATOM 0 H ILE A 108 7.327 4.585 -3.912 1.00 0.31 H new ATOM 0 HA ILE A 108 8.579 7.107 -4.821 1.00 0.35 H new ATOM 0 HB ILE A 108 6.738 8.303 -4.183 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.330 7.168 -2.036 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.857 7.526 -2.914 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.846 7.313 -5.455 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.391 7.116 -6.316 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.674 5.738 -5.446 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.751 5.323 -1.887 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.718 5.188 -3.661 1.00 0.64 H new ATOM 0 HD13 ILE A 108 6.214 4.824 -2.769 1.00 0.64 H new ATOM 1534 N ASN A 109 8.986 7.613 -2.252 1.00 0.38 N ATOM 1535 CA ASN A 109 9.590 7.626 -0.936 1.00 0.44 C ATOM 1536 C ASN A 109 8.527 7.605 0.126 1.00 0.47 C ATOM 1537 O ASN A 109 8.326 8.599 0.823 1.00 0.76 O ATOM 1538 CB ASN A 109 10.475 8.834 -0.766 1.00 0.53 C ATOM 1539 CG ASN A 109 11.443 8.660 0.373 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.598 8.319 0.157 1.00 1.73 O ATOM 1541 ND2 ASN A 109 10.968 8.842 1.598 1.00 1.16 N ATOM 0 H ASN A 109 8.950 8.516 -2.724 1.00 0.38 H new ATOM 0 HA ASN A 109 10.206 6.733 -0.834 1.00 0.44 H new ATOM 0 HB2 ASN A 109 11.027 9.013 -1.689 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.858 9.715 -0.588 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.573 8.697 2.406 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.998 9.127 1.732 1.00 1.16 H new ATOM 1548 N VAL A 110 7.838 6.477 0.247 1.00 0.41 N ATOM 1549 CA VAL A 110 6.820 6.353 1.260 1.00 0.42 C ATOM 1550 C VAL A 110 7.480 6.366 2.620 1.00 0.44 C ATOM 1551 O VAL A 110 7.903 5.342 3.150 1.00 0.48 O ATOM 1552 CB VAL A 110 6.010 5.057 1.091 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.573 5.380 0.758 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.620 4.170 0.018 1.00 0.77 C ATOM 0 H VAL A 110 7.969 5.652 -0.338 1.00 0.41 H new ATOM 0 HA VAL A 110 6.130 7.191 1.163 1.00 0.42 H new ATOM 0 HB VAL A 110 6.037 4.511 2.034 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.010 4.454 0.641 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.137 5.971 1.564 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.534 5.949 -0.171 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.028 3.260 -0.082 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.629 4.703 -0.933 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.641 3.910 0.298 1.00 0.77 H new ATOM 1564 N ASN A 111 7.546 7.565 3.154 1.00 0.48 N ATOM 1565 CA ASN A 111 8.083 7.840 4.459 1.00 0.56 C ATOM 1566 C ASN A 111 8.061 9.342 4.626 1.00 0.62 C ATOM 1567 O ASN A 111 7.665 10.059 3.705 1.00 0.67 O ATOM 1568 CB ASN A 111 9.501 7.292 4.644 1.00 0.65 C ATOM 1569 CG ASN A 111 9.793 7.055 6.112 1.00 1.20 C ATOM 1570 OD1 ASN A 111 9.458 6.008 6.657 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.431 8.019 6.765 1.00 1.72 N ATOM 0 H ASN A 111 7.215 8.401 2.672 1.00 0.48 H new ATOM 0 HA ASN A 111 7.480 7.341 5.218 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.612 6.360 4.090 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.225 7.995 4.232 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.658 7.902 7.753 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.694 8.876 6.279 1.00 1.72 H new ATOM 1578 N GLY A 112 8.515 9.822 5.757 1.00 0.73 N ATOM 1579 CA GLY A 112 8.383 11.218 6.064 1.00 0.85 C ATOM 1580 C GLY A 112 9.398 12.148 5.416 1.00 0.93 C ATOM 1581 O GLY A 112 9.637 13.225 5.959 1.00 1.47 O ATOM 0 H GLY A 112 8.977 9.266 6.476 1.00 0.73 H new ATOM 0 HA2 GLY A 112 7.385 11.541 5.768 1.00 0.85 H new ATOM 0 HA3 GLY A 112 8.449 11.339 7.145 1.00 0.85 H new ATOM 1585 N GLU A 113 10.014 11.791 4.282 1.00 0.88 N ATOM 1586 CA GLU A 113 10.918 12.759 3.662 1.00 1.23 C ATOM 1587 C GLU A 113 10.308 13.375 2.398 1.00 1.10 C ATOM 1588 O GLU A 113 10.375 14.586 2.202 1.00 1.39 O ATOM 1589 CB GLU A 113 12.302 12.154 3.385 1.00 1.61 C ATOM 1590 CG GLU A 113 12.450 11.446 2.051 1.00 1.83 C ATOM 1591 CD GLU A 113 13.461 12.115 1.146 1.00 2.29 C ATOM 1592 OE1 GLU A 113 14.673 11.931 1.368 1.00 2.81 O ATOM 1593 OE2 GLU A 113 13.048 12.817 0.205 1.00 2.65 O ATOM 0 H GLU A 113 9.913 10.897 3.802 1.00 0.88 H new ATOM 0 HA GLU A 113 11.060 13.567 4.380 1.00 1.23 H new ATOM 0 HB2 GLU A 113 13.045 12.950 3.438 1.00 1.61 H new ATOM 0 HB3 GLU A 113 12.536 11.446 4.180 1.00 1.61 H new ATOM 0 HG2 GLU A 113 12.750 10.413 2.224 1.00 1.83 H new ATOM 0 HG3 GLU A 113 11.482 11.417 1.550 1.00 1.83 H new ATOM 1600 N ASN A 114 9.701 12.553 1.550 1.00 0.79 N ATOM 1601 CA ASN A 114 9.127 13.052 0.311 1.00 0.79 C ATOM 1602 C ASN A 114 7.728 12.509 0.139 1.00 0.79 C ATOM 1603 O ASN A 114 6.829 13.213 -0.323 1.00 1.22 O ATOM 1604 CB ASN A 114 9.996 12.638 -0.882 1.00 0.87 C ATOM 1605 CG ASN A 114 9.422 13.062 -2.228 1.00 1.45 C ATOM 1606 OD1 ASN A 114 9.522 12.326 -3.210 1.00 2.06 O ATOM 1607 ND2 ASN A 114 8.849 14.255 -2.301 1.00 2.16 N ATOM 0 H ASN A 114 9.595 11.549 1.697 1.00 0.79 H new ATOM 0 HA ASN A 114 9.087 14.140 0.356 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.989 13.073 -0.766 1.00 0.87 H new ATOM 0 HB3 ASN A 114 10.119 11.555 -0.873 1.00 0.87 H new ATOM 0 HD21 ASN A 114 8.475 14.588 -3.190 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.782 14.840 -1.468 1.00 2.16 H new ATOM 1614 N ALA A 115 7.554 11.253 0.569 1.00 0.59 N ATOM 1615 CA ALA A 115 6.295 10.555 0.436 1.00 0.61 C ATOM 1616 C ALA A 115 5.805 10.661 -0.997 1.00 0.68 C ATOM 1617 O ALA A 115 6.601 10.725 -1.936 1.00 1.26 O ATOM 1618 CB ALA A 115 5.281 11.109 1.423 1.00 0.86 C ATOM 0 H ALA A 115 8.288 10.704 1.016 1.00 0.59 H new ATOM 0 HA ALA A 115 6.432 9.499 0.669 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.337 10.575 1.313 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.654 10.980 2.439 1.00 0.86 H new ATOM 0 HB3 ALA A 115 5.123 12.169 1.226 1.00 0.86 H new ATOM 1624 N HIS A 116 4.510 10.631 -1.164 1.00 0.42 N ATOM 1625 CA HIS A 116 3.898 10.841 -2.435 1.00 0.35 C ATOM 1626 C HIS A 116 2.545 11.435 -2.179 1.00 0.29 C ATOM 1627 O HIS A 116 1.891 10.996 -1.256 1.00 0.29 O ATOM 1628 CB HIS A 116 3.808 9.501 -3.173 1.00 0.35 C ATOM 1629 CG HIS A 116 2.895 9.528 -4.337 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.557 9.571 -4.149 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.100 9.631 -5.668 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.954 9.728 -5.285 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.859 9.762 -6.245 1.00 0.32 N ATOM 0 H HIS A 116 3.848 10.457 -0.408 1.00 0.42 H new ATOM 0 HA HIS A 116 4.475 11.519 -3.064 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.804 9.213 -3.509 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.472 8.733 -2.476 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.052 9.614 -6.179 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.113 9.816 -5.424 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.670 9.867 -7.242 1.00 0.32 H new ATOM 1642 N PRO A 117 2.124 12.433 -2.978 1.00 0.31 N ATOM 1643 CA PRO A 117 0.847 13.132 -2.824 1.00 0.31 C ATOM 1644 C PRO A 117 -0.258 12.248 -2.242 1.00 0.26 C ATOM 1645 O PRO A 117 -0.962 12.643 -1.321 1.00 0.27 O ATOM 1646 CB PRO A 117 0.516 13.541 -4.265 1.00 0.37 C ATOM 1647 CG PRO A 117 1.790 13.428 -5.052 1.00 0.40 C ATOM 1648 CD PRO A 117 2.873 12.994 -4.103 1.00 0.38 C ATOM 0 HA PRO A 117 0.916 13.964 -2.123 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.255 12.894 -4.683 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.130 14.560 -4.299 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.678 12.706 -5.861 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.043 14.384 -5.511 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.533 12.255 -4.556 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.497 13.832 -3.794 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.364 11.032 -2.765 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.347 10.059 -2.320 1.00 0.23 C ATOM 1658 C LEU A 118 -1.102 9.623 -0.871 1.00 0.27 C ATOM 1659 O LEU A 118 -2.009 9.643 -0.049 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.297 8.877 -3.265 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.093 7.658 -2.854 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.566 7.985 -2.863 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.799 6.496 -3.785 1.00 0.27 C ATOM 0 H LEU A 118 0.237 10.693 -3.517 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.339 10.510 -2.337 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.652 9.204 -4.242 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.255 8.580 -3.388 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.803 7.367 -1.845 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.136 7.105 -2.566 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.763 8.797 -2.163 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.865 8.290 -3.866 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.379 5.627 -3.476 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -2.070 6.769 -4.805 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.736 6.256 -3.744 1.00 0.27 H new ATOM 1675 N TYR A 119 0.128 9.236 -0.564 1.00 0.32 N ATOM 1676 CA TYR A 119 0.489 8.830 0.789 1.00 0.42 C ATOM 1677 C TYR A 119 0.649 10.012 1.710 1.00 0.40 C ATOM 1678 O TYR A 119 0.366 9.902 2.895 1.00 0.41 O ATOM 1679 CB TYR A 119 1.758 8.008 0.791 1.00 0.57 C ATOM 1680 CG TYR A 119 1.504 6.574 0.451 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.341 6.185 -0.864 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.428 5.609 1.445 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.115 4.872 -1.188 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.200 4.288 1.132 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.046 3.922 -0.183 1.00 2.20 C ATOM 1686 OH TYR A 119 0.837 2.604 -0.492 1.00 3.04 O ATOM 0 H TYR A 119 0.895 9.194 -1.235 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.333 8.218 1.161 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.463 8.430 0.075 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.227 8.069 1.773 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.392 6.926 -1.648 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.549 5.898 2.478 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.992 4.581 -2.221 1.00 1.74 H new ATOM 0 HE2 TYR A 119 1.143 3.545 1.914 1.00 1.88 H new ATOM 0 HH TYR A 119 0.801 2.076 0.333 1.00 3.04 H new ATOM 1696 N GLU A 120 1.114 11.133 1.181 1.00 0.40 N ATOM 1697 CA GLU A 120 1.113 12.365 1.943 1.00 0.42 C ATOM 1698 C GLU A 120 -0.300 12.634 2.341 1.00 0.37 C ATOM 1699 O GLU A 120 -0.569 13.068 3.453 1.00 0.43 O ATOM 1700 CB GLU A 120 1.644 13.554 1.130 1.00 0.50 C ATOM 1701 CG GLU A 120 3.072 13.410 0.646 1.00 0.76 C ATOM 1702 CD GLU A 120 3.536 14.615 -0.146 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.881 15.641 0.476 1.00 1.93 O ATOM 1704 OE2 GLU A 120 3.560 14.545 -1.391 1.00 2.44 O ATOM 0 H GLU A 120 1.492 11.212 0.237 1.00 0.40 H new ATOM 0 HA GLU A 120 1.769 12.251 2.806 1.00 0.42 H new ATOM 0 HB2 GLU A 120 0.996 13.703 0.266 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.572 14.454 1.741 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.731 13.266 1.503 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.155 12.517 0.026 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.212 12.324 1.436 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.624 12.420 1.772 1.00 0.28 C ATOM 1713 C TYR A 121 -2.994 11.394 2.835 1.00 0.27 C ATOM 1714 O TYR A 121 -3.803 11.659 3.718 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.493 12.193 0.553 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.958 12.075 0.885 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.726 13.207 1.104 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.575 10.836 0.952 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -7.069 13.110 1.386 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.920 10.730 1.228 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.640 11.846 1.547 1.00 0.46 C ATOM 1722 OH TYR A 121 -9.010 11.767 1.709 1.00 0.56 O ATOM 0 H TYR A 121 -1.010 12.011 0.486 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.798 13.426 2.154 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.350 13.017 -0.146 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.167 11.285 0.046 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.263 14.181 1.053 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -4.993 9.941 0.786 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.674 14.000 1.482 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.405 9.766 1.192 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.391 12.670 1.717 1.00 0.56 H new ATOM 1732 N MET A 122 -2.371 10.238 2.755 1.00 0.27 N ATOM 1733 CA MET A 122 -2.785 9.087 3.537 1.00 0.29 C ATOM 1734 C MET A 122 -2.398 9.257 4.990 1.00 0.33 C ATOM 1735 O MET A 122 -3.243 9.182 5.877 1.00 0.35 O ATOM 1736 CB MET A 122 -2.183 7.810 2.981 1.00 0.33 C ATOM 1737 CG MET A 122 -2.913 7.337 1.752 1.00 0.71 C ATOM 1738 SD MET A 122 -2.246 5.821 1.075 1.00 0.56 S ATOM 1739 CE MET A 122 -3.467 5.552 -0.192 1.00 0.55 C ATOM 0 H MET A 122 -1.567 10.067 2.150 1.00 0.27 H new ATOM 0 HA MET A 122 -3.871 9.013 3.473 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.134 7.978 2.738 1.00 0.33 H new ATOM 0 HB3 MET A 122 -2.213 7.032 3.744 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.964 7.186 1.997 1.00 0.71 H new ATOM 0 HG3 MET A 122 -2.872 8.116 0.991 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.863 4.540 -0.107 1.00 0.55 H new ATOM 0 HE2 MET A 122 -4.278 6.270 -0.074 1.00 0.55 H new ATOM 0 HE3 MET A 122 -3.008 5.681 -1.172 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.116 9.500 5.228 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.636 9.728 6.577 1.00 0.45 C ATOM 1751 C LYS A 123 -1.126 11.062 7.115 1.00 0.47 C ATOM 1752 O LYS A 123 -1.196 11.248 8.327 1.00 0.54 O ATOM 1753 CB LYS A 123 0.890 9.605 6.706 1.00 0.53 C ATOM 1754 CG LYS A 123 1.669 9.777 5.416 1.00 0.48 C ATOM 1755 CD LYS A 123 3.168 9.889 5.665 1.00 1.00 C ATOM 1756 CE LYS A 123 3.516 11.041 6.602 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.417 12.373 5.942 1.00 1.46 N ATOM 0 H LYS A 123 -0.396 9.543 4.507 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.058 8.931 7.189 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.238 10.349 7.422 1.00 0.53 H new ATOM 0 HB3 LYS A 123 1.124 8.626 7.124 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.473 8.930 4.758 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.320 10.670 4.898 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.534 8.955 6.091 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.682 10.029 4.714 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.848 11.017 7.463 1.00 1.05 H new ATOM 0 HE3 LYS A 123 4.529 10.902 6.980 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.664 13.118 6.624 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 4.073 12.411 5.136 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.445 12.522 5.604 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.445 12.004 6.226 1.00 0.43 N ATOM 1772 CA LYS A 124 -2.023 13.256 6.683 1.00 0.50 C ATOM 1773 C LYS A 124 -3.462 13.022 7.133 1.00 0.49 C ATOM 1774 O LYS A 124 -3.964 13.701 8.029 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.954 14.371 5.627 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.205 14.523 4.783 1.00 0.59 C ATOM 1777 CD LYS A 124 -3.098 15.707 3.838 1.00 0.97 C ATOM 1778 CE LYS A 124 -4.411 15.961 3.122 1.00 1.41 C ATOM 1779 NZ LYS A 124 -5.496 16.349 4.062 1.00 1.99 N ATOM 0 H LYS A 124 -1.316 11.924 5.217 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.426 13.602 7.527 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.754 15.317 6.130 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.109 14.176 4.967 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -3.371 13.612 4.209 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -4.070 14.652 5.433 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.808 16.597 4.397 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -2.312 15.521 3.106 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.273 16.750 2.383 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -4.707 15.063 2.579 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -6.276 16.785 3.531 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -5.845 15.504 4.557 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -5.127 17.030 4.756 1.00 1.99 H new ATOM 1793 N THR A 125 -4.111 12.044 6.509 1.00 0.42 N ATOM 1794 CA THR A 125 -5.466 11.668 6.892 1.00 0.44 C ATOM 1795 C THR A 125 -5.449 10.839 8.172 1.00 0.44 C ATOM 1796 O THR A 125 -6.202 11.112 9.110 1.00 0.56 O ATOM 1797 CB THR A 125 -6.181 10.873 5.772 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.236 11.662 4.579 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.594 10.489 6.186 1.00 0.59 C ATOM 0 H THR A 125 -3.722 11.500 5.739 1.00 0.42 H new ATOM 0 HA THR A 125 -6.020 12.591 7.062 1.00 0.44 H new ATOM 0 HB THR A 125 -5.613 9.960 5.590 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.346 12.023 4.384 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.071 9.932 5.379 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.555 9.869 7.082 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.170 11.391 6.394 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.578 9.836 8.212 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.481 8.962 9.367 1.00 0.54 C ATOM 1809 C LYS A 126 -3.033 8.538 9.608 1.00 0.57 C ATOM 1810 O LYS A 126 -2.448 7.800 8.813 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.361 7.732 9.172 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.611 6.965 10.457 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.613 5.854 10.241 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.995 6.406 9.935 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.562 7.152 11.088 1.00 1.85 N ATOM 0 H LYS A 126 -3.931 9.611 7.456 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.828 9.512 10.241 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.317 8.041 8.749 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.891 7.068 8.446 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -4.673 6.547 10.823 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.978 7.646 11.225 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.283 5.219 9.419 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.659 5.226 11.130 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -7.939 7.065 9.069 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.663 5.586 9.669 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.585 7.277 10.951 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -8.392 6.618 11.964 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -8.106 8.084 11.157 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.452 8.998 10.728 1.00 0.77 N ATOM 1830 CA PRO A 127 -1.061 8.710 11.105 1.00 1.04 C ATOM 1831 C PRO A 127 -0.870 7.264 11.544 1.00 1.27 C ATOM 1832 O PRO A 127 -0.027 6.551 11.004 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.795 9.674 12.276 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.953 10.616 12.293 1.00 1.22 C ATOM 1835 CD PRO A 127 -3.105 9.846 11.729 1.00 0.95 C ATOM 0 HA PRO A 127 -0.376 8.845 10.268 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.716 9.133 13.219 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.144 10.210 12.137 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.167 10.956 13.306 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.745 11.504 11.696 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.613 9.257 12.492 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.853 10.501 11.282 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.661 6.828 12.513 1.00 1.55 N ATOM 1844 CA GLY A 128 -1.570 5.460 12.962 1.00 1.96 C ATOM 1845 C GLY A 128 -2.523 5.158 14.093 1.00 2.13 C ATOM 1846 O GLY A 128 -3.126 6.066 14.662 1.00 2.59 O ATOM 0 H GLY A 128 -2.360 7.396 12.992 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -1.780 4.792 12.126 1.00 1.96 H new ATOM 0 HA3 GLY A 128 -0.550 5.255 13.286 1.00 1.96 H new ATOM 1850 N ILE A 129 -2.671 3.874 14.401 1.00 2.17 N ATOM 1851 CA ILE A 129 -3.455 3.444 15.554 1.00 2.46 C ATOM 1852 C ILE A 129 -2.707 3.765 16.841 1.00 2.36 C ATOM 1853 O ILE A 129 -3.282 3.790 17.931 1.00 2.70 O ATOM 1854 CB ILE A 129 -3.762 1.931 15.499 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -2.494 1.144 15.139 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -4.881 1.652 14.508 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -2.711 -0.349 15.016 1.00 3.58 C ATOM 0 H ILE A 129 -2.257 3.110 13.866 1.00 2.17 H new ATOM 0 HA ILE A 129 -4.401 3.984 15.532 1.00 2.46 H new ATOM 0 HB ILE A 129 -4.096 1.603 16.483 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -2.099 1.522 14.196 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -1.735 1.329 15.899 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -5.085 0.582 14.481 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -5.781 2.185 14.815 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -4.581 1.989 13.516 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -1.769 -0.834 14.760 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -3.076 -0.743 15.965 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -3.445 -0.547 14.235 1.00 3.58 H new ATOM 1869 N LEU A 130 -1.416 4.014 16.691 1.00 2.12 N ATOM 1870 CA LEU A 130 -0.565 4.394 17.806 1.00 2.29 C ATOM 1871 C LEU A 130 0.041 5.765 17.532 1.00 2.20 C ATOM 1872 O LEU A 130 -0.196 6.346 16.468 1.00 2.44 O ATOM 1873 CB LEU A 130 0.541 3.348 18.045 1.00 2.58 C ATOM 1874 CG LEU A 130 1.588 3.186 16.931 1.00 2.89 C ATOM 1875 CD1 LEU A 130 2.772 2.376 17.437 1.00 3.36 C ATOM 1876 CD2 LEU A 130 0.991 2.511 15.704 1.00 3.47 C ATOM 0 H LEU A 130 -0.930 3.959 15.796 1.00 2.12 H new ATOM 0 HA LEU A 130 -1.171 4.440 18.711 1.00 2.29 H new ATOM 0 HB2 LEU A 130 1.062 3.607 18.967 1.00 2.58 H new ATOM 0 HB3 LEU A 130 0.066 2.381 18.209 1.00 2.58 H new ATOM 0 HG LEU A 130 1.925 4.182 16.644 1.00 2.89 H new ATOM 0 HD11 LEU A 130 3.507 2.268 16.639 1.00 3.36 H new ATOM 0 HD12 LEU A 130 3.228 2.889 18.284 1.00 3.36 H new ATOM 0 HD13 LEU A 130 2.430 1.390 17.751 1.00 3.36 H new ATOM 0 HD21 LEU A 130 1.757 2.411 14.935 1.00 3.47 H new ATOM 0 HD22 LEU A 130 0.620 1.523 15.977 1.00 3.47 H new ATOM 0 HD23 LEU A 130 0.168 3.115 15.321 1.00 3.47 H new ATOM 1888 N ALA A 131 0.809 6.281 18.485 1.00 2.45 N ATOM 1889 CA ALA A 131 1.410 7.603 18.358 1.00 2.67 C ATOM 1890 C ALA A 131 2.598 7.583 17.400 1.00 2.55 C ATOM 1891 O ALA A 131 3.756 7.654 17.817 1.00 3.21 O ATOM 1892 CB ALA A 131 1.831 8.124 19.721 1.00 3.28 C ATOM 0 H ALA A 131 1.031 5.801 19.357 1.00 2.45 H new ATOM 0 HA ALA A 131 0.660 8.276 17.942 1.00 2.67 H new ATOM 0 HB1 ALA A 131 2.278 9.112 19.611 1.00 3.28 H new ATOM 0 HB2 ALA A 131 0.958 8.191 20.370 1.00 3.28 H new ATOM 0 HB3 ALA A 131 2.559 7.443 20.162 1.00 3.28 H new ATOM 1898 N THR A 132 2.290 7.465 16.120 1.00 2.02 N ATOM 1899 CA THR A 132 3.286 7.458 15.062 1.00 2.10 C ATOM 1900 C THR A 132 2.650 8.002 13.790 1.00 1.56 C ATOM 1901 O THR A 132 1.433 8.167 13.729 1.00 2.12 O ATOM 1902 CB THR A 132 3.791 6.029 14.778 1.00 2.73 C ATOM 1903 OG1 THR A 132 3.849 5.273 15.993 1.00 3.34 O ATOM 1904 CG2 THR A 132 5.176 6.055 14.146 1.00 3.56 C ATOM 0 H THR A 132 1.332 7.370 15.782 1.00 2.02 H new ATOM 0 HA THR A 132 4.129 8.072 15.379 1.00 2.10 H new ATOM 0 HB THR A 132 3.092 5.562 14.085 1.00 2.73 H new ATOM 0 HG1 THR A 132 4.169 4.367 15.800 1.00 3.34 H new ATOM 0 HG21 THR A 132 5.508 5.034 13.956 1.00 3.56 H new ATOM 0 HG22 THR A 132 5.137 6.605 13.206 1.00 3.56 H new ATOM 0 HG23 THR A 132 5.876 6.544 14.823 1.00 3.56 H new ATOM 1912 N LYS A 133 3.460 8.281 12.781 1.00 1.29 N ATOM 1913 CA LYS A 133 2.936 8.714 11.501 1.00 1.47 C ATOM 1914 C LYS A 133 3.338 7.750 10.403 1.00 1.14 C ATOM 1915 O LYS A 133 4.201 6.890 10.603 1.00 1.58 O ATOM 1916 CB LYS A 133 3.439 10.106 11.139 1.00 2.24 C ATOM 1917 CG LYS A 133 3.047 11.183 12.138 1.00 3.04 C ATOM 1918 CD LYS A 133 3.225 12.576 11.555 1.00 3.81 C ATOM 1919 CE LYS A 133 2.643 13.639 12.470 1.00 4.63 C ATOM 1920 NZ LYS A 133 2.573 14.966 11.805 1.00 5.17 N ATOM 0 H LYS A 133 4.477 8.215 12.825 1.00 1.29 H new ATOM 0 HA LYS A 133 1.850 8.738 11.591 1.00 1.47 H new ATOM 0 HB2 LYS A 133 4.526 10.079 11.057 1.00 2.24 H new ATOM 0 HB3 LYS A 133 3.052 10.377 10.157 1.00 2.24 H new ATOM 0 HG2 LYS A 133 2.008 11.043 12.437 1.00 3.04 H new ATOM 0 HG3 LYS A 133 3.654 11.084 13.038 1.00 3.04 H new ATOM 0 HD2 LYS A 133 4.285 12.772 11.395 1.00 3.81 H new ATOM 0 HD3 LYS A 133 2.741 12.628 10.580 1.00 3.81 H new ATOM 0 HE2 LYS A 133 1.644 13.338 12.786 1.00 4.63 H new ATOM 0 HE3 LYS A 133 3.252 13.716 13.370 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 2.170 15.663 12.463 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 3.529 15.265 11.526 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 1.971 14.899 10.960 1.00 5.17 H new ATOM 1934 N ALA A 134 2.701 7.911 9.248 1.00 0.92 N ATOM 1935 CA ALA A 134 3.052 7.173 8.046 1.00 0.77 C ATOM 1936 C ALA A 134 2.738 5.691 8.172 1.00 0.81 C ATOM 1937 O ALA A 134 2.023 5.257 9.073 1.00 1.59 O ATOM 1938 CB ALA A 134 4.523 7.380 7.698 1.00 1.02 C ATOM 0 H ALA A 134 1.924 8.560 9.122 1.00 0.92 H new ATOM 0 HA ALA A 134 2.439 7.567 7.236 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.766 6.819 6.795 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.711 8.440 7.528 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.145 7.029 8.522 1.00 1.02 H new ATOM 1944 N ILE A 135 3.270 4.932 7.241 1.00 0.69 N ATOM 1945 CA ILE A 135 3.139 3.491 7.244 1.00 0.74 C ATOM 1946 C ILE A 135 3.983 2.877 8.368 1.00 1.09 C ATOM 1947 O ILE A 135 3.686 1.783 8.849 1.00 2.00 O ATOM 1948 CB ILE A 135 3.558 2.876 5.886 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.786 3.577 5.281 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.396 2.900 4.910 1.00 1.54 C ATOM 1951 CD1 ILE A 135 4.512 4.926 4.637 1.00 0.89 C ATOM 0 H ILE A 135 3.809 5.298 6.456 1.00 0.69 H new ATOM 0 HA ILE A 135 2.087 3.262 7.413 1.00 0.74 H new ATOM 0 HB ILE A 135 3.841 1.841 6.076 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.530 3.712 6.066 1.00 0.88 H new ATOM 0 HG13 ILE A 135 5.228 2.919 4.533 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.709 2.464 3.961 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.566 2.323 5.318 1.00 1.54 H new ATOM 0 HG23 ILE A 135 2.078 3.930 4.749 1.00 1.54 H new ATOM 0 HD11 ILE A 135 5.441 5.336 4.242 1.00 0.89 H new ATOM 0 HD12 ILE A 135 3.795 4.803 3.825 1.00 0.89 H new ATOM 0 HD13 ILE A 135 4.102 5.608 5.382 1.00 0.89 H new ATOM 1963 N LYS A 136 5.018 3.612 8.815 1.00 0.85 N ATOM 1964 CA LYS A 136 5.959 3.124 9.844 1.00 1.14 C ATOM 1965 C LYS A 136 6.908 2.042 9.310 1.00 0.75 C ATOM 1966 O LYS A 136 8.129 2.181 9.350 1.00 0.78 O ATOM 1967 CB LYS A 136 5.217 2.500 11.033 1.00 1.71 C ATOM 1968 CG LYS A 136 4.342 3.417 11.850 1.00 2.72 C ATOM 1969 CD LYS A 136 3.579 2.607 12.894 1.00 3.21 C ATOM 1970 CE LYS A 136 2.383 1.872 12.290 1.00 4.09 C ATOM 1971 NZ LYS A 136 2.788 0.727 11.422 1.00 4.81 N ATOM 0 H LYS A 136 5.226 4.552 8.478 1.00 0.85 H new ATOM 0 HA LYS A 136 6.525 4.005 10.148 1.00 1.14 H new ATOM 0 HB2 LYS A 136 4.597 1.686 10.656 1.00 1.71 H new ATOM 0 HB3 LYS A 136 5.957 2.055 11.699 1.00 1.71 H new ATOM 0 HG2 LYS A 136 4.952 4.176 12.340 1.00 2.72 H new ATOM 0 HG3 LYS A 136 3.642 3.941 11.200 1.00 2.72 H new ATOM 0 HD2 LYS A 136 4.253 1.885 13.355 1.00 3.21 H new ATOM 0 HD3 LYS A 136 3.233 3.271 13.686 1.00 3.21 H new ATOM 0 HE2 LYS A 136 1.744 1.505 13.093 1.00 4.09 H new ATOM 0 HE3 LYS A 136 1.789 2.574 11.705 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 2.078 -0.029 11.491 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 2.858 1.047 10.435 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 3.711 0.364 11.734 1.00 4.81 H new ATOM 1985 N TRP A 137 6.301 0.949 8.864 1.00 0.69 N ATOM 1986 CA TRP A 137 6.967 -0.335 8.627 1.00 0.45 C ATOM 1987 C TRP A 137 7.072 -0.641 7.137 1.00 0.43 C ATOM 1988 O TRP A 137 6.732 0.195 6.311 1.00 0.55 O ATOM 1989 CB TRP A 137 6.177 -1.475 9.296 1.00 0.42 C ATOM 1990 CG TRP A 137 6.547 -1.833 10.710 1.00 0.62 C ATOM 1991 CD1 TRP A 137 6.499 -3.073 11.279 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.988 -0.953 11.736 1.00 1.00 C ATOM 1993 NE1 TRP A 137 6.877 -2.996 12.596 1.00 1.11 N ATOM 1994 CE2 TRP A 137 7.194 -1.708 12.890 1.00 1.16 C ATOM 1995 CE3 TRP A 137 7.229 0.393 11.779 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 7.634 -1.147 14.075 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 7.670 0.971 12.952 1.00 1.97 C ATOM 1998 CH2 TRP A 137 7.875 0.197 14.093 1.00 1.97 C ATOM 0 H TRP A 137 5.304 0.926 8.650 1.00 0.69 H new ATOM 0 HA TRP A 137 7.968 -0.263 9.052 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.120 -1.207 9.281 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.288 -2.368 8.682 1.00 0.42 H new ATOM 0 HD1 TRP A 137 6.207 -3.979 10.769 1.00 0.93 H new ATOM 0 HE1 TRP A 137 6.914 -3.779 13.249 1.00 1.11 H new ATOM 0 HE3 TRP A 137 7.075 1.000 10.899 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 7.782 -1.752 14.957 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 7.858 2.034 12.986 1.00 1.97 H new ATOM 0 HH2 TRP A 137 8.228 0.665 15.000 1.00 1.97 H new ATOM 2009 N ASN A 138 7.670 -1.804 6.842 1.00 0.37 N ATOM 2010 CA ASN A 138 7.519 -2.556 5.562 1.00 0.38 C ATOM 2011 C ASN A 138 6.078 -2.493 5.024 1.00 0.31 C ATOM 2012 O ASN A 138 5.354 -1.557 5.295 1.00 0.30 O ATOM 2013 CB ASN A 138 7.902 -4.032 5.752 1.00 0.41 C ATOM 2014 CG ASN A 138 9.074 -4.241 6.689 1.00 1.06 C ATOM 2015 OD1 ASN A 138 8.892 -4.387 7.898 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.275 -4.275 6.141 1.00 1.40 N ATOM 0 H ASN A 138 8.294 -2.272 7.499 1.00 0.37 H new ATOM 0 HA ASN A 138 8.186 -2.082 4.842 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.039 -4.576 6.137 1.00 0.41 H new ATOM 0 HB3 ASN A 138 8.143 -4.464 4.781 1.00 0.41 H new ATOM 0 HD21 ASN A 138 11.098 -4.427 6.724 1.00 1.40 H new ATOM 0 HD22 ASN A 138 10.380 -4.149 5.134 1.00 1.40 H new ATOM 2023 N PHE A 139 5.688 -3.521 4.256 1.00 0.34 N ATOM 2024 CA PHE A 139 4.461 -3.544 3.424 1.00 0.36 C ATOM 2025 C PHE A 139 3.335 -2.611 3.907 1.00 0.32 C ATOM 2026 O PHE A 139 2.785 -1.918 3.080 1.00 0.57 O ATOM 2027 CB PHE A 139 3.930 -4.971 3.466 1.00 0.55 C ATOM 2028 CG PHE A 139 4.181 -5.813 2.254 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.458 -6.257 1.921 1.00 0.61 C ATOM 2030 CD2 PHE A 139 3.112 -6.206 1.475 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.644 -7.077 0.824 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.291 -7.024 0.390 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.559 -7.464 0.061 1.00 1.89 C ATOM 0 H PHE A 139 6.226 -4.385 4.190 1.00 0.34 H new ATOM 0 HA PHE A 139 4.739 -3.196 2.429 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.370 -5.473 4.328 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.854 -4.930 3.636 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.305 -5.960 2.521 1.00 0.61 H new ATOM 0 HD2 PHE A 139 2.119 -5.864 1.724 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.636 -7.415 0.564 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.442 -7.324 -0.207 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.702 -8.110 -0.792 1.00 1.89 H new ATOM 2043 N THR A 140 3.005 -2.604 5.211 1.00 0.25 N ATOM 2044 CA THR A 140 2.063 -1.647 5.812 1.00 0.25 C ATOM 2045 C THR A 140 1.034 -1.074 4.846 1.00 0.22 C ATOM 2046 O THR A 140 1.292 -0.125 4.099 1.00 0.29 O ATOM 2047 CB THR A 140 2.772 -0.481 6.499 1.00 0.37 C ATOM 2048 OG1 THR A 140 3.811 -0.971 7.352 1.00 0.48 O ATOM 2049 CG2 THR A 140 1.768 0.312 7.318 1.00 0.60 C ATOM 0 H THR A 140 3.389 -3.269 5.882 1.00 0.25 H new ATOM 0 HA THR A 140 1.532 -2.252 6.546 1.00 0.25 H new ATOM 0 HB THR A 140 3.213 0.165 5.740 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.537 -1.337 6.806 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.274 1.144 7.808 1.00 0.60 H new ATOM 0 HG22 THR A 140 0.987 0.698 6.662 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.321 -0.336 8.072 1.00 0.60 H new ATOM 2057 N SER A 141 -0.148 -1.616 4.928 1.00 0.19 N ATOM 2058 CA SER A 141 -1.214 -1.269 4.018 1.00 0.20 C ATOM 2059 C SER A 141 -1.954 -0.050 4.520 1.00 0.22 C ATOM 2060 O SER A 141 -1.740 0.370 5.643 1.00 0.39 O ATOM 2061 CB SER A 141 -2.181 -2.427 3.947 1.00 0.26 C ATOM 2062 OG SER A 141 -1.570 -3.614 4.413 1.00 0.62 O ATOM 0 H SER A 141 -0.405 -2.313 5.627 1.00 0.19 H new ATOM 0 HA SER A 141 -0.794 -1.054 3.036 1.00 0.20 H new ATOM 0 HB2 SER A 141 -3.065 -2.207 4.546 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.518 -2.564 2.920 1.00 0.26 H new ATOM 0 HG SER A 141 -1.441 -4.232 3.663 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.807 0.511 3.686 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.832 1.420 4.130 1.00 0.18 C ATOM 2070 C PHE A 142 -5.110 0.858 3.595 1.00 0.18 C ATOM 2071 O PHE A 142 -5.221 0.621 2.403 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.652 2.830 3.565 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.642 3.704 4.256 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -1.290 3.652 3.936 1.00 0.42 C ATOM 2075 CD2 PHE A 142 -3.066 4.625 5.200 1.00 0.35 C ATOM 2076 CE1 PHE A 142 -0.394 4.499 4.552 1.00 0.55 C ATOM 2077 CE2 PHE A 142 -2.171 5.476 5.809 1.00 0.50 C ATOM 2078 CZ PHE A 142 -0.834 5.412 5.485 1.00 0.57 C ATOM 0 H PHE A 142 -2.805 0.345 2.680 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.805 1.509 5.216 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.368 2.744 2.516 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.617 3.335 3.594 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -0.940 2.943 3.200 1.00 0.42 H new ATOM 0 HD2 PHE A 142 -4.113 4.676 5.462 1.00 0.35 H new ATOM 0 HE1 PHE A 142 0.656 4.447 4.303 1.00 0.55 H new ATOM 0 HE2 PHE A 142 -2.517 6.192 6.539 1.00 0.50 H new ATOM 0 HZ PHE A 142 -0.130 6.078 5.962 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.067 0.610 4.434 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.297 0.115 3.921 1.00 0.16 C ATOM 2090 C LEU A 143 -8.085 1.263 3.375 1.00 0.15 C ATOM 2091 O LEU A 143 -8.623 2.098 4.097 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.071 -0.668 4.952 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.584 -0.701 4.729 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.948 -1.495 3.485 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.294 -1.265 5.939 1.00 0.43 C ATOM 0 H LEU A 143 -6.022 0.738 5.445 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.090 -0.591 3.117 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.697 -1.692 4.966 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.872 -0.243 5.936 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.914 0.327 4.579 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.031 -1.497 3.358 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.481 -1.038 2.612 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.593 -2.520 3.591 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.369 -1.278 5.757 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -9.945 -2.281 6.125 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.081 -0.643 6.808 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.091 1.290 2.076 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.738 2.295 1.312 1.00 0.14 C ATOM 2109 C ILE A 144 -10.139 1.805 1.028 1.00 0.15 C ATOM 2110 O ILE A 144 -10.333 0.634 0.725 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.981 2.508 -0.004 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.496 2.768 0.236 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.606 3.634 -0.787 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.217 3.996 1.039 1.00 0.19 C ATOM 0 H ILE A 144 -7.626 0.584 1.506 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.762 3.242 1.850 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.057 1.591 -0.588 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.065 1.907 0.746 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.992 2.853 -0.727 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.060 3.776 -1.720 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.645 3.390 -1.009 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.566 4.552 -0.200 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.141 4.111 1.166 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.617 4.868 0.521 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.690 3.906 2.017 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.104 2.678 1.132 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.499 2.247 1.084 1.00 0.15 C ATOM 2128 C ASP A 145 -13.042 2.299 -0.347 1.00 0.14 C ATOM 2129 O ASP A 145 -12.299 2.618 -1.270 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.312 3.084 2.085 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.691 3.510 1.607 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -14.793 4.523 0.887 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.676 2.816 1.934 1.00 0.75 O ATOM 0 H ASP A 145 -10.967 3.682 1.249 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.585 1.202 1.384 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.426 2.511 3.005 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.740 3.978 2.335 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.310 1.927 -0.526 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.960 1.926 -1.836 1.00 0.17 C ATOM 2140 C ARG A 146 -14.709 3.226 -2.588 1.00 0.18 C ATOM 2141 O ARG A 146 -14.420 3.218 -3.780 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.468 1.739 -1.683 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.868 0.514 -0.883 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.370 0.316 -0.909 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.075 1.499 -0.415 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.117 2.063 -1.021 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.580 1.569 -2.166 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.677 3.142 -0.489 1.00 2.22 N ATOM 0 H ARG A 146 -14.915 1.618 0.234 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.533 1.099 -2.403 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.885 2.624 -1.203 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.916 1.673 -2.674 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.374 -0.368 -1.290 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.529 0.622 0.147 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.692 0.098 -1.927 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.635 -0.548 -0.299 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.745 1.920 0.453 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.136 0.752 -2.586 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.379 2.007 -2.624 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.308 3.533 0.378 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.476 3.580 -0.947 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.798 4.340 -1.882 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.654 5.644 -2.503 1.00 0.21 C ATOM 2164 C ASP A 147 -13.241 6.132 -2.335 1.00 0.18 C ATOM 2165 O ASP A 147 -12.981 7.322 -2.385 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.637 6.655 -1.905 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.052 6.451 -2.401 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.371 6.943 -3.505 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.854 5.807 -1.692 1.00 2.00 O ATOM 0 H ASP A 147 -14.970 4.367 -0.877 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.880 5.546 -3.565 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.621 6.573 -0.818 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.310 7.665 -2.153 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.331 5.194 -2.139 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.939 5.519 -1.993 1.00 0.16 C ATOM 2176 C GLY A 148 -10.619 6.328 -0.755 1.00 0.15 C ATOM 2177 O GLY A 148 -9.766 7.207 -0.807 1.00 0.17 O ATOM 0 H GLY A 148 -12.542 4.198 -2.078 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.362 4.595 -1.969 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.613 6.075 -2.872 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.268 6.057 0.363 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.877 6.732 1.588 1.00 0.18 C ATOM 2183 C VAL A 149 -10.176 5.779 2.562 1.00 0.17 C ATOM 2184 O VAL A 149 -10.773 4.845 3.090 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.042 7.490 2.273 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -13.223 6.591 2.564 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -11.561 8.169 3.547 1.00 1.12 C ATOM 0 H VAL A 149 -12.042 5.398 0.450 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.158 7.495 1.289 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.385 8.251 1.572 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -14.012 7.170 3.044 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -13.598 6.170 1.631 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -12.911 5.784 3.227 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -12.393 8.696 4.014 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -11.174 7.418 4.236 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -10.771 8.880 3.304 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.862 5.990 2.740 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.033 5.253 3.703 1.00 0.20 C ATOM 2199 C PRO A 150 -8.585 5.385 5.120 1.00 0.23 C ATOM 2200 O PRO A 150 -8.604 6.478 5.688 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.664 5.942 3.625 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.878 7.191 2.842 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.088 6.976 1.996 1.00 0.41 C ATOM 0 HA PRO A 150 -7.998 4.188 3.475 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.283 6.166 4.621 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.930 5.298 3.140 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.019 8.043 3.507 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.009 7.411 2.222 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.648 7.901 1.856 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.823 6.611 1.004 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.026 4.283 5.692 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.626 4.305 7.011 1.00 0.29 C ATOM 2213 C VAL A 151 -8.779 3.502 7.979 1.00 0.32 C ATOM 2214 O VAL A 151 -8.878 3.660 9.193 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.068 3.750 6.994 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.994 4.692 6.241 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.109 2.363 6.370 1.00 1.13 C ATOM 0 H VAL A 151 -8.980 3.359 5.263 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.671 5.344 7.336 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.411 3.673 8.026 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.005 4.284 6.240 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.996 5.667 6.729 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.645 4.801 5.214 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.135 1.994 6.370 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.742 2.414 5.345 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.480 1.685 6.947 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.922 2.663 7.424 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.053 1.809 8.223 1.00 0.20 C ATOM 2229 C GLU A 152 -5.672 1.770 7.618 1.00 0.20 C ATOM 2230 O GLU A 152 -5.453 2.244 6.510 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.550 0.362 8.298 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.030 0.211 8.539 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.465 0.683 9.911 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.855 0.250 10.913 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.433 1.461 9.998 1.00 1.17 O ATOM 0 H GLU A 152 -7.807 2.553 6.416 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.047 2.237 9.225 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.295 -0.143 7.366 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -7.013 -0.150 9.096 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.574 0.773 7.780 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.306 -0.837 8.419 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.751 1.253 8.384 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.473 0.809 7.870 1.00 0.24 C ATOM 2244 C ARG A 153 -2.985 -0.368 8.707 1.00 0.25 C ATOM 2245 O ARG A 153 -3.164 -0.385 9.928 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.455 1.950 7.844 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.212 1.698 8.680 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.462 2.991 8.957 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.342 4.164 9.108 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.373 4.252 9.956 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.696 3.243 10.758 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -3.075 5.365 10.002 1.00 1.85 N ATOM 0 H ARG A 153 -4.861 1.125 9.390 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.593 0.482 6.837 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.154 2.129 6.812 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.938 2.861 8.198 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.494 1.229 9.623 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.557 0.999 8.160 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.128 2.871 9.865 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.239 3.176 8.143 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.149 4.974 8.518 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -2.154 2.379 10.735 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -3.486 3.332 11.397 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.830 6.148 9.395 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.863 5.445 10.644 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.377 -1.341 8.051 1.00 0.24 N ATOM 2267 CA PHE A 154 -1.971 -2.579 8.703 1.00 0.22 C ATOM 2268 C PHE A 154 -0.457 -2.715 8.636 1.00 0.24 C ATOM 2269 O PHE A 154 0.156 -2.208 7.715 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.624 -3.781 8.008 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.131 -3.793 8.047 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.873 -3.046 7.141 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.805 -4.532 9.008 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.257 -3.039 7.194 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.185 -4.526 9.066 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.912 -3.853 8.080 1.00 0.22 C ATOM 0 H PHE A 154 -2.151 -1.298 7.057 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.292 -2.554 9.744 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.302 -3.800 6.967 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.255 -4.696 8.473 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.365 -2.464 6.386 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.244 -5.119 9.720 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.820 -2.392 6.537 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.698 -5.037 9.867 1.00 0.22 H new ATOM 0 HZ PHE A 154 -7.983 -3.974 8.017 1.00 0.22 H new ATOM 2286 N SER A 155 0.138 -3.388 9.606 1.00 0.22 N ATOM 2287 CA SER A 155 1.585 -3.626 9.611 1.00 0.25 C ATOM 2288 C SER A 155 1.932 -4.683 8.550 1.00 0.22 C ATOM 2289 O SER A 155 1.044 -5.383 8.077 1.00 0.26 O ATOM 2290 CB SER A 155 2.010 -4.102 11.000 1.00 0.35 C ATOM 2291 OG SER A 155 1.666 -3.137 11.984 1.00 1.11 O ATOM 0 H SER A 155 -0.355 -3.784 10.407 1.00 0.22 H new ATOM 0 HA SER A 155 2.117 -2.705 9.374 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.527 -5.052 11.229 1.00 0.35 H new ATOM 0 HB3 SER A 155 3.085 -4.280 11.017 1.00 0.35 H new ATOM 0 HG SER A 155 1.943 -3.458 12.868 1.00 1.11 H new ATOM 2297 N PRO A 156 3.211 -4.814 8.155 1.00 0.25 N ATOM 2298 CA PRO A 156 3.634 -5.788 7.137 1.00 0.29 C ATOM 2299 C PRO A 156 3.175 -7.210 7.454 1.00 0.39 C ATOM 2300 O PRO A 156 2.370 -7.780 6.720 1.00 0.78 O ATOM 2301 CB PRO A 156 5.165 -5.698 7.158 1.00 0.34 C ATOM 2302 CG PRO A 156 5.504 -4.946 8.399 1.00 0.36 C ATOM 2303 CD PRO A 156 4.341 -4.037 8.656 1.00 0.33 C ATOM 0 HA PRO A 156 3.197 -5.564 6.164 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.616 -6.690 7.165 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.540 -5.184 6.273 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.662 -5.625 9.237 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.425 -4.377 8.272 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.235 -3.805 9.716 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.445 -3.088 8.130 1.00 0.33 H new ATOM 2311 N GLY A 157 3.727 -7.780 8.523 1.00 0.36 N ATOM 2312 CA GLY A 157 3.272 -9.066 9.038 1.00 0.46 C ATOM 2313 C GLY A 157 1.793 -9.161 9.418 1.00 0.41 C ATOM 2314 O GLY A 157 1.410 -10.098 10.121 1.00 0.50 O ATOM 0 H GLY A 157 4.495 -7.367 9.051 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.482 -9.828 8.288 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.867 -9.312 9.917 1.00 0.46 H new ATOM 2318 N ALA A 158 0.954 -8.223 8.988 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.483 -8.419 9.101 1.00 0.31 C ATOM 2320 C ALA A 158 -0.910 -9.316 7.954 1.00 0.34 C ATOM 2321 O ALA A 158 -0.428 -9.160 6.833 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.234 -7.095 9.067 1.00 0.37 C ATOM 0 H ALA A 158 1.238 -7.338 8.567 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.722 -8.881 10.059 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.304 -7.282 9.154 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -0.906 -6.469 9.897 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.030 -6.585 8.126 1.00 0.37 H new ATOM 2328 N SER A 159 -1.783 -10.267 8.211 1.00 0.26 N ATOM 2329 CA SER A 159 -2.057 -11.269 7.230 1.00 0.30 C ATOM 2330 C SER A 159 -3.399 -11.008 6.582 1.00 0.23 C ATOM 2331 O SER A 159 -4.140 -10.109 6.986 1.00 0.22 O ATOM 2332 CB SER A 159 -2.009 -12.662 7.862 1.00 0.41 C ATOM 2333 OG SER A 159 -1.959 -13.678 6.868 1.00 1.42 O ATOM 0 H SER A 159 -2.304 -10.359 9.083 1.00 0.26 H new ATOM 0 HA SER A 159 -1.291 -11.227 6.456 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.136 -12.740 8.509 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.887 -12.809 8.491 1.00 0.41 H new ATOM 0 HG SER A 159 -1.927 -14.557 7.300 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.676 -11.800 5.573 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.881 -11.701 4.775 1.00 0.20 C ATOM 2341 C VAL A 160 -6.130 -11.483 5.639 1.00 0.21 C ATOM 2342 O VAL A 160 -6.847 -10.505 5.455 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.041 -13.001 3.982 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.293 -12.987 3.124 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.813 -13.265 3.126 1.00 0.26 C ATOM 0 H VAL A 160 -3.055 -12.552 5.274 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.785 -10.840 4.113 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.145 -13.811 4.704 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.370 -13.927 2.577 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.169 -12.865 3.761 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.240 -12.159 2.417 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.949 -14.194 2.571 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.674 -12.441 2.426 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.935 -13.350 3.766 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.357 -12.370 6.612 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.588 -12.344 7.401 1.00 0.31 C ATOM 2357 C LYS A 161 -7.628 -11.112 8.302 1.00 0.26 C ATOM 2358 O LYS A 161 -8.697 -10.577 8.597 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.723 -13.633 8.227 1.00 0.45 C ATOM 2360 CG LYS A 161 -7.375 -13.501 9.712 1.00 1.12 C ATOM 2361 CD LYS A 161 -8.612 -13.179 10.545 1.00 1.80 C ATOM 2362 CE LYS A 161 -8.279 -12.958 12.014 1.00 2.67 C ATOM 2363 NZ LYS A 161 -7.566 -11.671 12.252 1.00 3.46 N ATOM 0 H LYS A 161 -5.706 -13.112 6.870 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.435 -12.286 6.717 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -8.748 -13.993 8.142 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -7.080 -14.395 7.787 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -6.927 -14.429 10.067 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -6.630 -12.716 9.845 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -9.094 -12.286 10.146 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -9.329 -13.995 10.456 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -9.199 -12.973 12.598 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -7.662 -13.783 12.371 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -7.498 -11.496 13.275 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -6.610 -11.723 11.845 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.092 -10.895 11.802 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.448 -10.656 8.711 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.337 -9.543 9.641 1.00 0.27 C ATOM 2379 C ASP A 162 -6.736 -8.267 8.936 1.00 0.22 C ATOM 2380 O ASP A 162 -7.262 -7.335 9.539 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.907 -9.417 10.169 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.392 -10.707 10.767 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -5.050 -11.253 11.675 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.323 -11.175 10.331 1.00 1.40 O ATOM 0 H ASP A 162 -5.554 -11.043 8.410 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.999 -9.723 10.488 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.249 -9.110 9.356 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.870 -8.631 10.923 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.464 -8.247 7.649 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.847 -7.147 6.795 1.00 0.15 C ATOM 2391 C ILE A 163 -8.297 -7.289 6.350 1.00 0.14 C ATOM 2392 O ILE A 163 -9.063 -6.322 6.401 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.923 -7.080 5.564 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.562 -6.469 5.945 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.590 -6.301 4.441 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.553 -6.474 4.814 1.00 0.21 C ATOM 0 H ILE A 163 -5.969 -8.996 7.165 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.748 -6.223 7.364 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.742 -8.093 5.204 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.715 -5.443 6.279 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.150 -7.021 6.790 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.924 -6.263 3.579 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.521 -6.794 4.159 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.804 -5.287 4.779 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.619 -6.028 5.157 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.369 -7.500 4.495 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.944 -5.897 3.975 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.672 -8.500 5.934 1.00 0.13 N ATOM 2409 CA GLU A 164 -10.021 -8.761 5.441 1.00 0.13 C ATOM 2410 C GLU A 164 -11.071 -8.263 6.415 1.00 0.15 C ATOM 2411 O GLU A 164 -12.070 -7.691 6.018 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.276 -10.253 5.226 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.587 -10.870 4.032 1.00 0.20 C ATOM 2414 CD GLU A 164 -10.052 -12.293 3.798 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.251 -12.489 3.519 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.229 -13.224 3.892 1.00 0.67 O ATOM 0 H GLU A 164 -8.058 -9.315 5.930 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.094 -8.231 4.491 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.961 -10.789 6.121 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.350 -10.408 5.123 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.787 -10.270 3.144 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.508 -10.859 4.187 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.841 -8.488 7.692 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.828 -8.162 8.712 1.00 0.21 C ATOM 2425 C GLU A 165 -12.158 -6.666 8.736 1.00 0.21 C ATOM 2426 O GLU A 165 -13.212 -6.267 9.230 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.344 -8.645 10.081 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.148 -7.892 10.628 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.629 -8.506 11.912 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.223 -8.250 12.979 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -8.626 -9.246 11.865 1.00 0.83 O ATOM 0 H GLU A 165 -9.979 -8.896 8.053 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.753 -8.681 8.463 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.166 -8.562 10.792 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.090 -9.703 10.010 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.353 -7.884 9.883 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.425 -6.854 10.809 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.271 -5.842 8.194 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.563 -4.426 8.033 1.00 0.20 C ATOM 2440 C LYS A 166 -11.977 -4.132 6.595 1.00 0.19 C ATOM 2441 O LYS A 166 -12.707 -3.180 6.318 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.366 -3.562 8.440 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.181 -3.450 9.945 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.371 -2.755 10.586 1.00 0.58 C ATOM 2445 CE LYS A 166 -11.171 -2.531 12.076 1.00 1.09 C ATOM 2446 NZ LYS A 166 -9.976 -1.690 12.364 1.00 1.71 N ATOM 0 H LYS A 166 -10.350 -6.128 7.861 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.392 -4.174 8.694 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.460 -3.980 8.001 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.491 -2.563 8.022 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -10.060 -4.444 10.376 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.269 -2.894 10.163 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.537 -1.796 10.095 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -12.268 -3.354 10.428 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -12.058 -2.053 12.492 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -11.064 -3.494 12.575 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -10.233 -0.942 13.039 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -9.225 -2.282 12.772 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -9.635 -1.258 11.482 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.534 -4.990 5.697 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.745 -4.829 4.269 1.00 0.15 C ATOM 2462 C LEU A 167 -13.137 -5.288 3.836 1.00 0.15 C ATOM 2463 O LEU A 167 -13.842 -4.582 3.114 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.697 -5.650 3.529 1.00 0.13 C ATOM 2465 CG LEU A 167 -11.046 -5.964 2.087 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.863 -4.736 1.221 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.221 -7.128 1.580 1.00 0.16 C ATOM 0 H LEU A 167 -11.010 -5.831 5.941 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.659 -3.769 4.030 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.750 -5.111 3.551 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.543 -6.587 4.064 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.095 -6.256 2.036 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.117 -4.977 0.189 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.514 -3.938 1.578 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.825 -4.407 1.271 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.486 -7.338 0.544 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.162 -6.877 1.640 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.420 -8.009 2.191 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.506 -6.483 4.276 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.739 -7.140 3.859 1.00 0.19 C ATOM 2481 C ILE A 168 -15.980 -6.279 4.116 1.00 0.22 C ATOM 2482 O ILE A 168 -16.853 -6.208 3.257 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.902 -8.516 4.534 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.711 -9.415 4.187 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.210 -9.174 4.108 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.743 -10.753 4.885 1.00 0.24 C ATOM 0 H ILE A 168 -12.954 -7.029 4.938 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.654 -7.285 2.782 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.931 -8.372 5.614 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.690 -9.577 3.109 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.788 -8.899 4.450 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.305 -10.144 4.596 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -17.048 -8.539 4.397 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.214 -9.310 3.027 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.870 -11.337 4.593 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.733 -10.601 5.964 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.649 -11.289 4.603 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.099 -5.619 5.295 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.179 -4.654 5.542 1.00 0.29 C ATOM 2500 C PRO A 169 -17.312 -3.619 4.423 1.00 0.29 C ATOM 2501 O PRO A 169 -18.415 -3.181 4.103 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.752 -3.973 6.841 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.958 -5.004 7.560 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.253 -5.803 6.496 1.00 0.24 C ATOM 0 HA PRO A 169 -18.152 -5.142 5.594 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.158 -3.081 6.644 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.616 -3.658 7.426 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.242 -4.541 8.239 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.603 -5.642 8.164 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.239 -5.440 6.330 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.174 -6.854 6.772 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.189 -3.243 3.816 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.207 -2.261 2.741 1.00 0.22 C ATOM 2514 C LEU A 170 -16.476 -2.920 1.391 1.00 0.20 C ATOM 2515 O LEU A 170 -17.250 -2.394 0.592 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.909 -1.448 2.703 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.638 -0.598 3.934 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.243 -0.005 3.864 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.678 0.498 4.039 1.00 0.69 C ATOM 0 H LEU A 170 -15.263 -3.601 4.049 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.026 -1.571 2.946 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.074 -2.134 2.565 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.934 -0.796 1.830 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.699 -1.226 4.823 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.061 0.602 4.751 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.508 -0.809 3.817 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.157 0.618 2.974 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.480 1.104 4.923 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.635 1.127 3.150 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.669 0.052 4.120 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.844 -4.065 1.130 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.111 -4.811 -0.104 1.00 0.20 C ATOM 2533 C LEU A 171 -17.571 -5.185 -0.164 1.00 0.27 C ATOM 2534 O LEU A 171 -18.283 -4.903 -1.129 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.305 -6.106 -0.161 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.809 -5.934 -0.286 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.120 -7.282 -0.230 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.464 -5.221 -1.582 1.00 0.31 C ATOM 0 H LEU A 171 -15.153 -4.493 1.746 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.829 -4.169 -0.939 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.513 -6.683 0.740 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.658 -6.696 -1.007 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.459 -5.326 0.548 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -12.043 -7.144 -0.321 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.345 -7.766 0.720 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.476 -7.907 -1.049 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.383 -5.105 -1.657 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.825 -5.807 -2.427 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.936 -4.239 -1.594 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.990 -5.814 0.907 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.314 -6.358 1.003 1.00 0.39 C ATOM 2552 C GLY A 172 -20.375 -5.336 1.361 1.00 0.66 C ATOM 2553 O GLY A 172 -21.489 -5.706 1.729 1.00 1.12 O ATOM 0 H GLY A 172 -17.417 -5.961 1.738 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.576 -6.820 0.051 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.318 -7.149 1.753 1.00 0.39 H new ATOM 2557 N SER A 173 -20.053 -4.053 1.230 1.00 0.85 N ATOM 2558 CA SER A 173 -21.003 -2.994 1.558 1.00 1.33 C ATOM 2559 C SER A 173 -22.096 -2.904 0.488 1.00 1.84 C ATOM 2560 O SER A 173 -23.063 -2.161 0.631 1.00 2.43 O ATOM 2561 CB SER A 173 -20.277 -1.652 1.708 1.00 2.03 C ATOM 2562 OG SER A 173 -21.128 -0.655 2.256 1.00 2.64 O ATOM 0 H SER A 173 -19.146 -3.722 0.901 1.00 0.85 H new ATOM 0 HA SER A 173 -21.477 -3.235 2.510 1.00 1.33 H new ATOM 0 HB2 SER A 173 -19.405 -1.779 2.349 1.00 2.03 H new ATOM 0 HB3 SER A 173 -19.912 -1.324 0.735 1.00 2.03 H new ATOM 0 HG SER A 173 -21.987 -1.057 2.503 1.00 2.64 H new ATOM 2568 N ALA A 174 -21.943 -3.679 -0.579 1.00 2.40 N ATOM 2569 CA ALA A 174 -22.963 -3.757 -1.616 1.00 3.35 C ATOM 2570 C ALA A 174 -24.243 -4.376 -1.060 1.00 3.69 C ATOM 2571 O ALA A 174 -25.344 -4.099 -1.535 1.00 4.35 O ATOM 2572 CB ALA A 174 -22.452 -4.563 -2.798 1.00 4.30 C ATOM 0 H ALA A 174 -21.123 -4.262 -0.748 1.00 2.40 H new ATOM 0 HA ALA A 174 -23.190 -2.747 -1.957 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -23.224 -4.613 -3.565 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -21.563 -4.083 -3.208 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -22.201 -5.572 -2.469 1.00 4.30 H new ATOM 2578 N ARG A 175 -24.082 -5.210 -0.040 1.00 3.66 N ATOM 2579 CA ARG A 175 -25.214 -5.855 0.612 1.00 4.44 C ATOM 2580 C ARG A 175 -25.314 -5.372 2.055 1.00 4.81 C ATOM 2581 O ARG A 175 -25.992 -5.976 2.892 1.00 5.15 O ATOM 2582 CB ARG A 175 -25.055 -7.379 0.559 1.00 5.16 C ATOM 2583 CG ARG A 175 -23.969 -7.923 1.475 1.00 5.82 C ATOM 2584 CD ARG A 175 -23.586 -9.350 1.111 1.00 6.62 C ATOM 2585 NE ARG A 175 -24.750 -10.199 0.850 1.00 7.03 N ATOM 2586 CZ ARG A 175 -24.917 -11.417 1.365 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -24.098 -11.865 2.309 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -25.937 -12.172 0.968 1.00 8.45 N ATOM 0 H ARG A 175 -23.174 -5.456 0.355 1.00 3.66 H new ATOM 0 HA ARG A 175 -26.133 -5.591 0.089 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -26.005 -7.842 0.825 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -24.832 -7.675 -0.466 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -23.088 -7.284 1.415 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -24.315 -7.892 2.508 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -22.946 -9.336 0.228 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -23.000 -9.783 1.922 1.00 6.62 H new ATOM 0 HE ARG A 175 -25.479 -9.836 0.236 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -23.336 -11.276 2.644 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -24.231 -12.798 2.699 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -26.591 -11.819 0.270 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -26.065 -13.104 1.362 1.00 8.45 H new ATOM 2602 N LEU A 176 -24.632 -4.268 2.331 1.00 5.22 N ATOM 2603 CA LEU A 176 -24.574 -3.704 3.667 1.00 6.05 C ATOM 2604 C LEU A 176 -24.383 -2.192 3.573 1.00 6.72 C ATOM 2605 O LEU A 176 -25.400 -1.469 3.538 1.00 7.14 O ATOM 2606 CB LEU A 176 -23.428 -4.340 4.462 1.00 6.60 C ATOM 2607 CG LEU A 176 -23.353 -3.945 5.938 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -24.599 -4.408 6.680 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -22.099 -4.530 6.575 1.00 7.60 C ATOM 2610 OXT LEU A 176 -23.225 -1.737 3.498 1.00 7.13 O ATOM 0 H LEU A 176 -24.105 -3.741 1.634 1.00 5.22 H new ATOM 0 HA LEU A 176 -25.509 -3.914 4.187 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -23.522 -5.424 4.398 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -22.485 -4.073 3.984 1.00 6.60 H new ATOM 0 HG LEU A 176 -23.302 -2.858 6.006 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -24.527 -4.118 7.728 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -25.480 -3.946 6.235 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -24.683 -5.492 6.609 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -22.056 -4.242 7.625 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -22.125 -5.617 6.497 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -21.217 -4.150 6.059 1.00 7.60 H new TER 2622 LEU A 176