USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 741 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 113 LYS NZ :NH3+ 172:sc= -0.051 (180deg=-0.00786) USER MOD Set 1.2: A 126 MET CE :methyl -137:sc= -2.62 (180deg=-9.14!) USER MOD Single : A 96 TYR OH : rot 130:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -2.15 K(o=-2.1,f=-5.3!) USER MOD Single : A 105 CYS SG : rot 180:sc= -3.35! USER MOD Single : A 107 ASN : amide:sc= -0.531 X(o=-0.53,f=-0.52) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot -29:sc= 0.348 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -140:sc= 1.13 (180deg=-0.971) USER MOD Single : A 150 ASN : amide:sc= -0.533 X(o=-0.53,f=-0.22) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 SER OG : rot -91:sc= 1.22 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 121:sc= 1.11 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 90 8.102 9.492 9.642 1.00 0.96 N ATOM 12 CA ALA A 90 7.441 8.381 8.891 1.00 0.72 C ATOM 13 C ALA A 90 6.255 7.877 9.718 1.00 0.58 C ATOM 14 O ALA A 90 5.989 8.421 10.773 1.00 1.23 O ATOM 15 CB ALA A 90 8.524 7.306 8.747 1.00 1.03 C ATOM 0 HA ALA A 90 7.056 8.677 7.915 1.00 0.72 H new ATOM 0 HB1 ALA A 90 8.119 6.452 8.204 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.372 7.715 8.198 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.852 6.985 9.736 1.00 1.03 H new ATOM 21 N PRO A 91 5.562 6.863 9.241 1.00 0.79 N ATOM 22 CA PRO A 91 4.401 6.341 10.003 1.00 1.10 C ATOM 23 C PRO A 91 4.844 5.866 11.393 1.00 0.60 C ATOM 24 O PRO A 91 5.533 4.871 11.508 1.00 0.91 O ATOM 25 CB PRO A 91 3.897 5.181 9.141 1.00 1.98 C ATOM 26 CG PRO A 91 5.077 4.799 8.321 1.00 2.18 C ATOM 27 CD PRO A 91 5.760 6.097 8.001 1.00 1.62 C ATOM 0 HA PRO A 91 3.627 7.087 10.181 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.552 4.349 9.755 1.00 1.98 H new ATOM 0 HB3 PRO A 91 3.058 5.485 8.515 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.739 4.129 8.869 1.00 2.18 H new ATOM 0 HG3 PRO A 91 4.775 4.277 7.413 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.817 5.956 7.773 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.311 6.592 7.140 1.00 1.62 H new ATOM 35 N PRO A 92 4.433 6.588 12.419 1.00 0.59 N ATOM 36 CA PRO A 92 4.807 6.201 13.801 1.00 0.84 C ATOM 37 C PRO A 92 4.228 4.818 14.108 1.00 0.71 C ATOM 38 O PRO A 92 4.939 3.917 14.512 1.00 0.83 O ATOM 39 CB PRO A 92 4.202 7.309 14.666 1.00 1.49 C ATOM 40 CG PRO A 92 3.107 7.882 13.830 1.00 1.64 C ATOM 41 CD PRO A 92 3.592 7.796 12.407 1.00 1.21 C ATOM 0 HA PRO A 92 5.880 6.116 13.975 1.00 0.84 H new ATOM 0 HB2 PRO A 92 3.818 6.913 15.606 1.00 1.49 H new ATOM 0 HB3 PRO A 92 4.945 8.065 14.919 1.00 1.49 H new ATOM 0 HG2 PRO A 92 2.180 7.323 13.962 1.00 1.64 H new ATOM 0 HG3 PRO A 92 2.899 8.914 14.111 1.00 1.64 H new ATOM 0 HD2 PRO A 92 2.765 7.705 11.703 1.00 1.21 H new ATOM 0 HD3 PRO A 92 4.160 8.681 12.119 1.00 1.21 H new ATOM 49 N GLY A 93 2.952 4.631 13.878 1.00 0.65 N ATOM 50 CA GLY A 93 2.343 3.286 14.108 1.00 0.71 C ATOM 51 C GLY A 93 2.494 2.422 12.852 1.00 0.58 C ATOM 52 O GLY A 93 1.533 1.866 12.357 1.00 0.58 O ATOM 0 H GLY A 93 2.309 5.348 13.543 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.826 2.799 14.955 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.288 3.393 14.361 1.00 0.71 H new ATOM 56 N GLU A 94 3.690 2.307 12.337 1.00 0.56 N ATOM 57 CA GLU A 94 3.910 1.481 11.109 1.00 0.55 C ATOM 58 C GLU A 94 3.545 0.027 11.386 1.00 0.49 C ATOM 59 O GLU A 94 3.133 -0.693 10.498 1.00 0.53 O ATOM 60 CB GLU A 94 5.399 1.621 10.787 1.00 0.66 C ATOM 61 CG GLU A 94 5.694 0.980 9.426 1.00 1.09 C ATOM 62 CD GLU A 94 7.185 1.120 9.083 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.879 1.846 9.780 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.610 0.488 8.130 1.00 1.44 O ATOM 0 H GLU A 94 4.528 2.750 12.714 1.00 0.56 H new ATOM 0 HA GLU A 94 3.291 1.808 10.274 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.681 2.674 10.773 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.996 1.142 11.563 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.415 -0.074 9.445 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.090 1.456 8.654 1.00 1.09 H new ATOM 71 N ALA A 95 3.688 -0.414 12.611 1.00 0.49 N ATOM 72 CA ALA A 95 3.344 -1.832 12.937 1.00 0.50 C ATOM 73 C ALA A 95 1.881 -2.110 12.590 1.00 0.38 C ATOM 74 O ALA A 95 1.571 -3.097 11.947 1.00 0.36 O ATOM 75 CB ALA A 95 3.580 -1.977 14.443 1.00 0.61 C ATOM 0 H ALA A 95 4.026 0.143 13.396 1.00 0.49 H new ATOM 0 HA ALA A 95 3.948 -2.540 12.369 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.346 -2.996 14.751 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.624 -1.759 14.670 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.938 -1.279 14.981 1.00 0.61 H new ATOM 81 N TYR A 96 0.982 -1.240 12.983 1.00 0.38 N ATOM 82 CA TYR A 96 -0.453 -1.456 12.637 1.00 0.35 C ATOM 83 C TYR A 96 -0.622 -1.394 11.120 1.00 0.28 C ATOM 84 O TYR A 96 -1.258 -2.237 10.516 1.00 0.29 O ATOM 85 CB TYR A 96 -1.233 -0.333 13.327 1.00 0.42 C ATOM 86 CG TYR A 96 -2.706 -0.489 13.019 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.479 -1.409 13.737 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.296 0.282 12.009 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.839 -1.558 13.447 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.657 0.133 11.720 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.429 -0.787 12.439 1.00 1.77 C ATOM 92 OH TYR A 96 -6.772 -0.933 12.155 1.00 2.32 O ATOM 0 H TYR A 96 1.180 -0.398 13.523 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.816 -2.430 12.966 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.069 -0.368 14.404 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -0.878 0.638 12.982 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -3.025 -2.004 14.515 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.700 0.991 11.453 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.434 -2.268 14.001 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.112 0.728 10.942 1.00 1.93 H new ATOM 0 HH TYR A 96 -7.201 -0.052 12.140 1.00 2.32 H new ATOM 102 N LEU A 97 -0.055 -0.385 10.508 1.00 0.42 N ATOM 103 CA LEU A 97 -0.172 -0.236 9.028 1.00 0.55 C ATOM 104 C LEU A 97 0.432 -1.456 8.333 1.00 0.43 C ATOM 105 O LEU A 97 -0.108 -1.960 7.365 1.00 0.35 O ATOM 106 CB LEU A 97 0.612 1.036 8.686 1.00 0.90 C ATOM 107 CG LEU A 97 0.545 1.298 7.179 1.00 0.94 C ATOM 108 CD1 LEU A 97 -0.918 1.495 6.759 1.00 1.33 C ATOM 109 CD2 LEU A 97 1.346 2.561 6.848 1.00 1.75 C ATOM 0 H LEU A 97 0.486 0.344 10.973 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.208 -0.164 8.698 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.200 1.886 9.231 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.650 0.929 9.000 1.00 0.90 H new ATOM 0 HG LEU A 97 0.965 0.448 6.641 1.00 0.94 H new ATOM 0 HD11 LEU A 97 -0.967 1.682 5.686 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -1.489 0.598 6.997 1.00 1.33 H new ATOM 0 HD13 LEU A 97 -1.339 2.346 7.295 1.00 1.33 H new ATOM 0 HD21 LEU A 97 1.300 2.750 5.776 1.00 1.75 H new ATOM 0 HD22 LEU A 97 0.924 3.411 7.385 1.00 1.75 H new ATOM 0 HD23 LEU A 97 2.385 2.422 7.148 1.00 1.75 H new ATOM 121 N GLN A 98 1.542 -1.943 8.831 1.00 0.47 N ATOM 122 CA GLN A 98 2.175 -3.147 8.208 1.00 0.49 C ATOM 123 C GLN A 98 1.207 -4.332 8.266 1.00 0.38 C ATOM 124 O GLN A 98 1.099 -5.099 7.328 1.00 0.39 O ATOM 125 CB GLN A 98 3.427 -3.427 9.043 1.00 0.63 C ATOM 126 CG GLN A 98 4.529 -2.433 8.662 1.00 0.57 C ATOM 127 CD GLN A 98 5.686 -2.537 9.660 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.518 -3.029 10.758 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.862 -2.084 9.322 1.00 2.04 N ATOM 0 H GLN A 98 2.035 -1.561 9.638 1.00 0.47 H new ATOM 0 HA GLN A 98 2.424 -2.987 7.159 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.196 -3.340 10.105 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.769 -4.448 8.874 1.00 0.63 H new ATOM 0 HG2 GLN A 98 4.886 -2.641 7.653 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.131 -1.418 8.657 1.00 0.57 H new ATOM 0 HE21 GLN A 98 7.004 -1.671 8.400 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.640 -2.143 9.979 1.00 2.04 H new ATOM 138 N VAL A 99 0.500 -4.484 9.361 1.00 0.33 N ATOM 139 CA VAL A 99 -0.469 -5.619 9.477 1.00 0.31 C ATOM 140 C VAL A 99 -1.528 -5.513 8.371 1.00 0.24 C ATOM 141 O VAL A 99 -1.782 -6.465 7.655 1.00 0.30 O ATOM 142 CB VAL A 99 -1.102 -5.465 10.871 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.226 -6.492 11.062 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.028 -5.688 11.938 1.00 0.43 C ATOM 0 H VAL A 99 0.552 -3.873 10.176 1.00 0.33 H new ATOM 0 HA VAL A 99 0.008 -6.593 9.364 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.519 -4.462 10.963 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.665 -6.371 12.053 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.994 -6.337 10.304 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.819 -7.499 10.965 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.471 -5.580 12.928 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.386 -6.691 11.833 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.767 -4.952 11.814 1.00 0.43 H new ATOM 154 N ALA A 100 -2.130 -4.358 8.214 1.00 0.18 N ATOM 155 CA ALA A 100 -3.153 -4.197 7.139 1.00 0.18 C ATOM 156 C ALA A 100 -2.467 -4.308 5.782 1.00 0.14 C ATOM 157 O ALA A 100 -2.917 -5.022 4.914 1.00 0.14 O ATOM 158 CB ALA A 100 -3.747 -2.801 7.340 1.00 0.24 C ATOM 0 H ALA A 100 -1.957 -3.527 8.780 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.931 -4.959 7.179 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.508 -2.617 6.581 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.199 -2.737 8.330 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.958 -2.054 7.252 1.00 0.24 H new ATOM 164 N PHE A 101 -1.357 -3.632 5.612 1.00 0.15 N ATOM 165 CA PHE A 101 -0.602 -3.715 4.320 1.00 0.16 C ATOM 166 C PHE A 101 -0.205 -5.161 4.028 1.00 0.17 C ATOM 167 O PHE A 101 0.125 -5.486 2.920 1.00 0.20 O ATOM 168 CB PHE A 101 0.672 -2.878 4.531 1.00 0.19 C ATOM 169 CG PHE A 101 0.451 -1.378 4.329 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.823 -0.826 4.076 1.00 1.10 C ATOM 171 CD2 PHE A 101 1.564 -0.529 4.400 1.00 1.21 C ATOM 172 CE1 PHE A 101 -0.964 0.554 3.902 1.00 1.10 C ATOM 173 CE2 PHE A 101 1.415 0.849 4.224 1.00 1.26 C ATOM 174 CZ PHE A 101 0.154 1.389 3.977 1.00 0.43 C ATOM 0 H PHE A 101 -0.939 -3.023 6.315 1.00 0.15 H new ATOM 0 HA PHE A 101 -1.205 -3.356 3.486 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.049 -3.050 5.539 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.442 -3.221 3.840 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.689 -1.469 4.017 1.00 1.10 H new ATOM 0 HD2 PHE A 101 2.543 -0.943 4.592 1.00 1.21 H new ATOM 0 HE1 PHE A 101 -1.939 0.976 3.709 1.00 1.10 H new ATOM 0 HE2 PHE A 101 2.278 1.496 4.279 1.00 1.26 H new ATOM 0 HZ PHE A 101 0.041 2.455 3.843 1.00 0.43 H new ATOM 184 N ASP A 102 -0.208 -6.025 5.010 1.00 0.18 N ATOM 185 CA ASP A 102 0.202 -7.438 4.755 1.00 0.21 C ATOM 186 C ASP A 102 -0.959 -8.258 4.211 1.00 0.20 C ATOM 187 O ASP A 102 -0.840 -8.904 3.186 1.00 0.22 O ATOM 188 CB ASP A 102 0.632 -7.970 6.111 1.00 0.25 C ATOM 189 CG ASP A 102 1.336 -9.317 5.937 1.00 0.32 C ATOM 190 OD1 ASP A 102 0.662 -10.276 5.600 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.537 -9.365 6.145 1.00 1.13 O ATOM 0 H ASP A 102 -0.475 -5.815 5.972 1.00 0.18 H new ATOM 0 HA ASP A 102 0.997 -7.498 4.011 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.301 -7.259 6.596 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.236 -8.084 6.760 1.00 0.25 H new ATOM 196 N ILE A 103 -2.086 -8.246 4.887 1.00 0.18 N ATOM 197 CA ILE A 103 -3.247 -9.042 4.390 1.00 0.18 C ATOM 198 C ILE A 103 -3.644 -8.553 3.002 1.00 0.17 C ATOM 199 O ILE A 103 -3.907 -9.333 2.105 1.00 0.18 O ATOM 200 CB ILE A 103 -4.396 -8.824 5.399 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.713 -7.324 5.577 1.00 0.94 C ATOM 202 CG2 ILE A 103 -4.015 -9.434 6.747 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.847 -7.142 6.595 1.00 0.87 C ATOM 0 H ILE A 103 -2.247 -7.726 5.749 1.00 0.18 H new ATOM 0 HA ILE A 103 -3.006 -10.102 4.310 1.00 0.18 H new ATOM 0 HB ILE A 103 -5.289 -9.313 5.009 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.822 -6.794 5.914 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -5.000 -6.889 4.620 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.826 -9.280 7.458 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.837 -10.503 6.626 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -3.109 -8.955 7.120 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -6.063 -6.080 6.713 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.740 -7.657 6.241 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.545 -7.560 7.555 1.00 0.87 H new ATOM 215 N VAL A 104 -3.676 -7.266 2.825 1.00 0.16 N ATOM 216 CA VAL A 104 -4.064 -6.705 1.502 1.00 0.16 C ATOM 217 C VAL A 104 -2.986 -6.965 0.442 1.00 0.17 C ATOM 218 O VAL A 104 -3.286 -7.259 -0.701 1.00 0.18 O ATOM 219 CB VAL A 104 -4.243 -5.199 1.737 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.281 -4.956 2.841 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.901 -4.563 2.131 1.00 0.14 C ATOM 0 H VAL A 104 -3.450 -6.575 3.540 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.974 -7.172 1.125 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.595 -4.740 0.813 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.400 -3.884 2.999 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -6.237 -5.387 2.543 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.945 -5.424 3.766 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -3.039 -3.494 2.295 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.534 -5.026 3.047 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -2.177 -4.716 1.331 1.00 0.14 H new ATOM 231 N CYS A 105 -1.735 -6.829 0.809 1.00 0.18 N ATOM 232 CA CYS A 105 -0.635 -7.035 -0.187 1.00 0.19 C ATOM 233 C CYS A 105 -0.602 -8.474 -0.669 1.00 0.20 C ATOM 234 O CYS A 105 -0.600 -8.734 -1.855 1.00 0.21 O ATOM 235 CB CYS A 105 0.652 -6.678 0.560 1.00 0.22 C ATOM 236 SG CYS A 105 2.086 -6.879 -0.526 1.00 0.29 S ATOM 0 H CYS A 105 -1.428 -6.585 1.751 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.772 -6.420 -1.077 1.00 0.19 H new ATOM 0 HB2 CYS A 105 0.600 -5.650 0.918 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.760 -7.315 1.438 1.00 0.22 H new ATOM 0 HG CYS A 105 3.169 -6.570 0.123 1.00 0.29 H new ATOM 242 N ASP A 106 -0.578 -9.405 0.238 1.00 0.21 N ATOM 243 CA ASP A 106 -0.538 -10.835 -0.178 1.00 0.24 C ATOM 244 C ASP A 106 -1.816 -11.181 -0.955 1.00 0.25 C ATOM 245 O ASP A 106 -1.864 -12.161 -1.675 1.00 0.28 O ATOM 246 CB ASP A 106 -0.446 -11.632 1.117 1.00 0.25 C ATOM 247 CG ASP A 106 0.870 -11.308 1.832 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.837 -11.009 1.151 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.886 -11.363 3.051 1.00 1.05 O ATOM 0 H ASP A 106 -0.584 -9.242 1.245 1.00 0.21 H new ATOM 0 HA ASP A 106 0.303 -11.058 -0.834 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.290 -11.392 1.763 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.501 -12.699 0.903 1.00 0.25 H new ATOM 254 N ASN A 107 -2.844 -10.368 -0.834 1.00 0.24 N ATOM 255 CA ASN A 107 -4.104 -10.632 -1.585 1.00 0.26 C ATOM 256 C ASN A 107 -4.015 -9.943 -2.943 1.00 0.26 C ATOM 257 O ASN A 107 -4.426 -10.470 -3.959 1.00 0.29 O ATOM 258 CB ASN A 107 -5.189 -9.955 -0.753 1.00 0.25 C ATOM 259 CG ASN A 107 -6.504 -10.722 -0.897 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.215 -10.556 -1.868 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.859 -11.561 0.037 1.00 1.23 N ATOM 0 H ASN A 107 -2.858 -9.535 -0.246 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.295 -11.694 -1.742 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.889 -9.921 0.294 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.321 -8.924 -1.080 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.734 -12.078 -0.048 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -6.261 -11.700 0.852 1.00 1.23 H new ATOM 268 N VAL A 108 -3.476 -8.757 -2.946 1.00 0.23 N ATOM 269 CA VAL A 108 -3.336 -7.981 -4.204 1.00 0.24 C ATOM 270 C VAL A 108 -2.394 -6.801 -3.953 1.00 0.25 C ATOM 271 O VAL A 108 -2.807 -5.656 -3.918 1.00 0.42 O ATOM 272 CB VAL A 108 -4.765 -7.521 -4.523 1.00 0.23 C ATOM 273 CG1 VAL A 108 -5.284 -6.568 -3.446 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.794 -6.826 -5.887 1.00 0.27 C ATOM 0 H VAL A 108 -3.121 -8.286 -2.114 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.913 -8.547 -5.034 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.411 -8.398 -4.547 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -6.298 -6.256 -3.694 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -5.287 -7.076 -2.481 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.638 -5.692 -3.393 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.811 -6.502 -6.108 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.133 -5.960 -5.868 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.459 -7.521 -6.657 1.00 0.27 H new ATOM 284 N GLY A 109 -1.130 -7.073 -3.768 1.00 0.24 N ATOM 285 CA GLY A 109 -0.179 -5.964 -3.502 1.00 0.22 C ATOM 286 C GLY A 109 0.125 -5.147 -4.759 1.00 0.23 C ATOM 287 O GLY A 109 0.524 -4.001 -4.670 1.00 0.21 O ATOM 0 H GLY A 109 -0.721 -8.007 -3.790 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.594 -5.308 -2.736 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.750 -6.372 -3.103 1.00 0.22 H new ATOM 291 N ARG A 110 -0.057 -5.714 -5.919 1.00 0.27 N ATOM 292 CA ARG A 110 0.231 -4.954 -7.180 1.00 0.28 C ATOM 293 C ARG A 110 -0.665 -3.701 -7.262 1.00 0.27 C ATOM 294 O ARG A 110 -0.366 -2.740 -7.969 1.00 0.27 O ATOM 295 CB ARG A 110 -0.086 -5.924 -8.324 1.00 0.36 C ATOM 296 CG ARG A 110 0.787 -7.183 -8.211 1.00 0.55 C ATOM 297 CD ARG A 110 2.239 -6.864 -8.579 1.00 0.72 C ATOM 298 NE ARG A 110 2.278 -6.938 -10.066 1.00 1.08 N ATOM 299 CZ ARG A 110 2.790 -7.987 -10.651 1.00 1.39 C ATOM 300 NH1 ARG A 110 2.340 -9.180 -10.369 1.00 2.06 N ATOM 301 NH2 ARG A 110 3.755 -7.845 -11.518 1.00 1.68 N ATOM 0 H ARG A 110 -0.392 -6.668 -6.054 1.00 0.27 H new ATOM 0 HA ARG A 110 1.264 -4.609 -7.223 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -1.140 -6.200 -8.295 1.00 0.36 H new ATOM 0 HB3 ARG A 110 0.089 -5.436 -9.283 1.00 0.36 H new ATOM 0 HG2 ARG A 110 0.741 -7.575 -7.195 1.00 0.55 H new ATOM 0 HG3 ARG A 110 0.401 -7.961 -8.870 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.529 -5.875 -8.224 1.00 0.72 H new ATOM 0 HD3 ARG A 110 2.928 -7.579 -8.129 1.00 0.72 H new ATOM 0 HE ARG A 110 1.906 -6.171 -10.626 1.00 1.08 H new ATOM 0 HH11 ARG A 110 1.587 -9.294 -9.690 1.00 2.06 H new ATOM 0 HH12 ARG A 110 2.742 -9.998 -10.827 1.00 2.06 H new ATOM 0 HH21 ARG A 110 4.109 -6.914 -11.739 1.00 1.68 H new ATOM 0 HH22 ARG A 110 4.155 -8.665 -11.975 1.00 1.68 H new ATOM 315 N ASP A 111 -1.757 -3.695 -6.534 1.00 0.27 N ATOM 316 CA ASP A 111 -2.669 -2.515 -6.565 1.00 0.30 C ATOM 317 C ASP A 111 -1.963 -1.314 -5.923 1.00 0.31 C ATOM 318 O ASP A 111 -2.298 -0.177 -6.192 1.00 0.39 O ATOM 319 CB ASP A 111 -3.905 -2.945 -5.751 1.00 0.30 C ATOM 320 CG ASP A 111 -4.808 -3.835 -6.614 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.301 -4.458 -7.534 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.995 -3.885 -6.334 1.00 0.82 O ATOM 0 H ASP A 111 -2.053 -4.456 -5.922 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.950 -2.215 -7.575 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.594 -3.485 -4.857 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.456 -2.066 -5.417 1.00 0.30 H new ATOM 327 N TRP A 112 -0.961 -1.558 -5.107 1.00 0.27 N ATOM 328 CA TRP A 112 -0.205 -0.428 -4.487 1.00 0.29 C ATOM 329 C TRP A 112 0.613 0.263 -5.567 1.00 0.32 C ATOM 330 O TRP A 112 0.756 1.464 -5.559 1.00 0.31 O ATOM 331 CB TRP A 112 0.694 -1.040 -3.416 1.00 0.29 C ATOM 332 CG TRP A 112 -0.115 -1.948 -2.551 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.347 -3.088 -2.012 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.523 -1.847 -2.162 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.662 -3.676 -1.283 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.833 -2.963 -1.360 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.554 -0.911 -2.410 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.099 -3.156 -0.834 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.837 -1.109 -1.874 1.00 0.32 C ATOM 340 CH2 TRP A 112 -4.105 -2.236 -1.090 1.00 0.27 C ATOM 0 H TRP A 112 -0.638 -2.490 -4.847 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.863 0.317 -4.039 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.509 -1.594 -3.882 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.148 -0.253 -2.813 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.347 -3.479 -2.131 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.553 -4.538 -0.749 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -2.354 -0.039 -3.015 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.303 -4.023 -0.224 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.619 -0.389 -2.068 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -5.094 -2.390 -0.684 1.00 0.27 H new ATOM 351 N LYS A 113 1.128 -0.482 -6.521 1.00 0.37 N ATOM 352 CA LYS A 113 1.900 0.162 -7.627 1.00 0.40 C ATOM 353 C LYS A 113 0.972 1.115 -8.378 1.00 0.34 C ATOM 354 O LYS A 113 1.352 2.214 -8.736 1.00 0.30 O ATOM 355 CB LYS A 113 2.387 -0.977 -8.528 1.00 0.50 C ATOM 356 CG LYS A 113 3.673 -1.574 -7.945 1.00 0.72 C ATOM 357 CD LYS A 113 4.783 -0.517 -7.987 1.00 0.89 C ATOM 358 CE LYS A 113 6.154 -1.196 -7.970 1.00 1.51 C ATOM 359 NZ LYS A 113 6.436 -1.527 -9.395 1.00 1.66 N ATOM 0 H LYS A 113 1.046 -1.497 -6.579 1.00 0.37 H new ATOM 0 HA LYS A 113 2.750 0.743 -7.269 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.619 -1.747 -8.607 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.570 -0.605 -9.536 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.504 -1.901 -6.919 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.971 -2.454 -8.515 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.681 0.093 -8.884 1.00 0.89 H new ATOM 0 HD3 LYS A 113 4.690 0.154 -7.133 1.00 0.89 H new ATOM 0 HE2 LYS A 113 6.917 -0.535 -7.560 1.00 1.51 H new ATOM 0 HE3 LYS A 113 6.143 -2.093 -7.351 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 7.413 -1.871 -9.485 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 5.778 -2.265 -9.717 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 6.314 -0.676 -9.980 1.00 1.66 H new ATOM 373 N ARG A 114 -0.260 0.712 -8.585 1.00 0.35 N ATOM 374 CA ARG A 114 -1.236 1.622 -9.277 1.00 0.33 C ATOM 375 C ARG A 114 -1.416 2.902 -8.442 1.00 0.28 C ATOM 376 O ARG A 114 -1.313 4.015 -8.937 1.00 0.29 O ATOM 377 CB ARG A 114 -2.549 0.830 -9.310 1.00 0.37 C ATOM 378 CG ARG A 114 -3.657 1.665 -9.962 1.00 0.38 C ATOM 379 CD ARG A 114 -5.003 1.292 -9.335 1.00 0.43 C ATOM 380 NE ARG A 114 -6.009 2.098 -10.080 1.00 0.57 N ATOM 381 CZ ARG A 114 -6.802 2.914 -9.440 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.338 2.551 -8.306 1.00 1.62 N ATOM 383 NH2 ARG A 114 -7.062 4.094 -9.935 1.00 1.77 N ATOM 0 H ARG A 114 -0.631 -0.197 -8.309 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.907 1.916 -10.274 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.408 -0.097 -9.865 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.841 0.554 -8.297 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.459 2.728 -9.821 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.680 1.485 -11.037 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.202 0.225 -9.432 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -5.021 1.524 -8.270 1.00 0.43 H new ATOM 0 HE ARG A 114 -6.079 2.012 -11.094 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -7.137 1.629 -7.919 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -7.957 3.190 -7.807 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -6.646 4.378 -10.822 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -7.682 4.732 -9.435 1.00 1.77 H new ATOM 397 N LEU A 115 -1.674 2.735 -7.172 1.00 0.26 N ATOM 398 CA LEU A 115 -1.860 3.912 -6.272 1.00 0.25 C ATOM 399 C LEU A 115 -0.518 4.621 -6.073 1.00 0.25 C ATOM 400 O LEU A 115 -0.463 5.814 -5.854 1.00 0.26 O ATOM 401 CB LEU A 115 -2.371 3.332 -4.950 1.00 0.26 C ATOM 402 CG LEU A 115 -3.790 2.789 -5.142 1.00 0.25 C ATOM 403 CD1 LEU A 115 -4.204 1.994 -3.902 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.764 3.953 -5.346 1.00 0.23 C ATOM 0 H LEU A 115 -1.765 1.827 -6.716 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.556 4.646 -6.679 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.709 2.536 -4.610 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.366 4.101 -4.178 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.812 2.140 -6.017 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -5.214 1.607 -4.038 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.514 1.163 -3.755 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -4.179 2.645 -3.028 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.773 3.564 -5.482 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.741 4.604 -4.472 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.472 4.521 -6.229 1.00 0.23 H new ATOM 416 N ALA A 116 0.568 3.892 -6.162 1.00 0.26 N ATOM 417 CA ALA A 116 1.916 4.518 -5.990 1.00 0.28 C ATOM 418 C ALA A 116 2.090 5.604 -7.051 1.00 0.26 C ATOM 419 O ALA A 116 2.483 6.725 -6.762 1.00 0.27 O ATOM 420 CB ALA A 116 2.922 3.383 -6.209 1.00 0.31 C ATOM 0 H ALA A 116 0.579 2.889 -6.347 1.00 0.26 H new ATOM 0 HA ALA A 116 2.050 4.979 -5.011 1.00 0.28 H new ATOM 0 HB1 ALA A 116 3.935 3.769 -6.098 1.00 0.31 H new ATOM 0 HB2 ALA A 116 2.750 2.597 -5.473 1.00 0.31 H new ATOM 0 HB3 ALA A 116 2.797 2.974 -7.212 1.00 0.31 H new ATOM 426 N ARG A 117 1.752 5.288 -8.278 1.00 0.27 N ATOM 427 CA ARG A 117 1.848 6.305 -9.364 1.00 0.30 C ATOM 428 C ARG A 117 0.934 7.486 -9.013 1.00 0.32 C ATOM 429 O ARG A 117 1.286 8.636 -9.197 1.00 0.33 O ATOM 430 CB ARG A 117 1.349 5.602 -10.630 1.00 0.35 C ATOM 431 CG ARG A 117 2.360 4.542 -11.074 1.00 0.37 C ATOM 432 CD ARG A 117 3.681 5.215 -11.455 1.00 1.31 C ATOM 433 NE ARG A 117 4.391 4.215 -12.298 1.00 1.53 N ATOM 434 CZ ARG A 117 4.632 4.479 -13.553 1.00 1.93 C ATOM 435 NH1 ARG A 117 5.168 5.621 -13.886 1.00 2.61 N ATOM 436 NH2 ARG A 117 4.333 3.604 -14.474 1.00 2.24 N ATOM 0 H ARG A 117 1.415 4.371 -8.571 1.00 0.27 H new ATOM 0 HA ARG A 117 2.860 6.686 -9.498 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.382 5.137 -10.440 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.201 6.331 -11.426 1.00 0.35 H new ATOM 0 HG2 ARG A 117 2.525 3.824 -10.270 1.00 0.37 H new ATOM 0 HG3 ARG A 117 1.967 3.984 -11.924 1.00 0.37 H new ATOM 0 HD2 ARG A 117 3.509 6.142 -12.002 1.00 1.31 H new ATOM 0 HD3 ARG A 117 4.264 5.471 -10.570 1.00 1.31 H new ATOM 0 HE ARG A 117 4.688 3.326 -11.896 1.00 1.53 H new ATOM 0 HH11 ARG A 117 5.398 6.306 -13.166 1.00 2.61 H new ATOM 0 HH12 ARG A 117 5.357 5.829 -14.866 1.00 2.61 H new ATOM 0 HH21 ARG A 117 3.911 2.713 -14.213 1.00 2.24 H new ATOM 0 HH22 ARG A 117 4.522 3.811 -15.455 1.00 2.24 H new ATOM 450 N GLU A 118 -0.235 7.196 -8.481 1.00 0.34 N ATOM 451 CA GLU A 118 -1.176 8.291 -8.082 1.00 0.39 C ATOM 452 C GLU A 118 -0.538 9.115 -6.962 1.00 0.39 C ATOM 453 O GLU A 118 -0.623 10.328 -6.936 1.00 0.41 O ATOM 454 CB GLU A 118 -2.438 7.594 -7.577 1.00 0.43 C ATOM 455 CG GLU A 118 -3.139 6.897 -8.749 1.00 0.47 C ATOM 456 CD GLU A 118 -4.424 6.205 -8.270 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.799 6.397 -7.123 1.00 1.45 O ATOM 458 OE2 GLU A 118 -5.020 5.501 -9.068 1.00 0.76 O ATOM 0 H GLU A 118 -0.575 6.250 -8.307 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.403 8.964 -8.908 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.181 6.866 -6.808 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.109 8.320 -7.118 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -3.378 7.626 -9.523 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -2.469 6.164 -9.197 1.00 0.47 H new ATOM 465 N LEU A 119 0.117 8.448 -6.043 1.00 0.37 N ATOM 466 CA LEU A 119 0.796 9.158 -4.917 1.00 0.38 C ATOM 467 C LEU A 119 2.065 9.874 -5.410 1.00 0.36 C ATOM 468 O LEU A 119 2.713 10.576 -4.661 1.00 0.39 O ATOM 469 CB LEU A 119 1.132 8.048 -3.922 1.00 0.38 C ATOM 470 CG LEU A 119 -0.029 7.825 -2.930 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.028 8.890 -1.835 1.00 1.33 C ATOM 472 CD2 LEU A 119 -1.405 7.891 -3.622 1.00 0.58 C ATOM 0 H LEU A 119 0.210 7.432 -6.026 1.00 0.37 H new ATOM 0 HA LEU A 119 0.174 9.934 -4.471 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.338 7.123 -4.460 1.00 0.38 H new ATOM 0 HB3 LEU A 119 2.038 8.307 -3.375 1.00 0.38 H new ATOM 0 HG LEU A 119 0.087 6.827 -2.506 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.791 8.734 -1.133 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.978 8.817 -1.306 1.00 1.33 H new ATOM 0 HD13 LEU A 119 -0.062 9.879 -2.284 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -2.191 7.728 -2.885 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -1.535 8.871 -4.081 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.463 7.120 -4.390 1.00 0.58 H new ATOM 484 N LYS A 120 2.416 9.705 -6.670 1.00 0.34 N ATOM 485 CA LYS A 120 3.627 10.376 -7.240 1.00 0.35 C ATOM 486 C LYS A 120 4.889 9.944 -6.503 1.00 0.30 C ATOM 487 O LYS A 120 5.694 10.760 -6.096 1.00 0.33 O ATOM 488 CB LYS A 120 3.398 11.888 -7.096 1.00 0.48 C ATOM 489 CG LYS A 120 2.122 12.287 -7.841 1.00 1.05 C ATOM 490 CD LYS A 120 2.344 12.164 -9.350 1.00 1.11 C ATOM 491 CE LYS A 120 1.080 12.612 -10.087 1.00 2.02 C ATOM 492 NZ LYS A 120 1.423 12.519 -11.533 1.00 2.16 N ATOM 0 H LYS A 120 1.904 9.122 -7.332 1.00 0.34 H new ATOM 0 HA LYS A 120 3.769 10.100 -8.285 1.00 0.35 H new ATOM 0 HB2 LYS A 120 3.315 12.155 -6.042 1.00 0.48 H new ATOM 0 HB3 LYS A 120 4.251 12.435 -7.497 1.00 0.48 H new ATOM 0 HG2 LYS A 120 1.295 11.648 -7.532 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.846 13.310 -7.587 1.00 1.05 H new ATOM 0 HD2 LYS A 120 3.193 12.776 -9.655 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.584 11.133 -9.611 1.00 1.11 H new ATOM 0 HE2 LYS A 120 0.232 11.973 -9.841 1.00 2.02 H new ATOM 0 HE3 LYS A 120 0.803 13.630 -9.812 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 0.604 12.811 -12.104 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 2.229 13.143 -11.739 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.676 11.538 -11.767 1.00 2.16 H new ATOM 506 N VAL A 121 5.074 8.659 -6.353 1.00 0.29 N ATOM 507 CA VAL A 121 6.300 8.153 -5.668 1.00 0.33 C ATOM 508 C VAL A 121 7.509 8.381 -6.582 1.00 0.37 C ATOM 509 O VAL A 121 7.370 8.472 -7.788 1.00 0.42 O ATOM 510 CB VAL A 121 6.064 6.653 -5.438 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.870 6.463 -4.502 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.779 5.951 -6.772 1.00 1.29 C ATOM 0 H VAL A 121 4.429 7.938 -6.675 1.00 0.29 H new ATOM 0 HA VAL A 121 6.494 8.663 -4.724 1.00 0.33 H new ATOM 0 HB VAL A 121 6.958 6.219 -4.990 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.702 5.399 -4.338 1.00 1.65 H new ATOM 0 HG12 VAL A 121 5.075 6.949 -3.548 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.981 6.906 -4.952 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.613 4.888 -6.596 1.00 1.29 H new ATOM 0 HG22 VAL A 121 4.890 6.386 -7.229 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.631 6.080 -7.440 1.00 1.29 H new ATOM 522 N SER A 122 8.687 8.502 -6.022 1.00 0.45 N ATOM 523 CA SER A 122 9.903 8.756 -6.865 1.00 0.52 C ATOM 524 C SER A 122 10.025 7.724 -7.986 1.00 0.44 C ATOM 525 O SER A 122 10.091 6.533 -7.750 1.00 0.35 O ATOM 526 CB SER A 122 11.085 8.631 -5.904 1.00 0.63 C ATOM 527 OG SER A 122 12.289 8.918 -6.602 1.00 1.10 O ATOM 0 H SER A 122 8.862 8.436 -5.019 1.00 0.45 H new ATOM 0 HA SER A 122 9.857 9.733 -7.347 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.963 9.319 -5.068 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.124 7.625 -5.486 1.00 0.63 H new ATOM 0 HG SER A 122 13.049 8.841 -5.988 1.00 1.10 H new ATOM 533 N GLU A 123 10.075 8.190 -9.208 1.00 0.55 N ATOM 534 CA GLU A 123 10.216 7.261 -10.369 1.00 0.58 C ATOM 535 C GLU A 123 11.516 6.470 -10.226 1.00 0.52 C ATOM 536 O GLU A 123 11.606 5.324 -10.622 1.00 0.53 O ATOM 537 CB GLU A 123 10.245 8.160 -11.610 1.00 0.77 C ATOM 538 CG GLU A 123 10.388 7.299 -12.871 1.00 1.44 C ATOM 539 CD GLU A 123 10.375 8.188 -14.125 1.00 1.61 C ATOM 540 OE1 GLU A 123 10.005 9.348 -14.015 1.00 1.75 O ATOM 541 OE2 GLU A 123 10.717 7.684 -15.183 1.00 2.15 O ATOM 0 H GLU A 123 10.024 9.179 -9.452 1.00 0.55 H new ATOM 0 HA GLU A 123 9.404 6.537 -10.433 1.00 0.58 H new ATOM 0 HB2 GLU A 123 9.331 8.751 -11.664 1.00 0.77 H new ATOM 0 HB3 GLU A 123 11.075 8.863 -11.542 1.00 0.77 H new ATOM 0 HG2 GLU A 123 11.317 6.731 -12.829 1.00 1.44 H new ATOM 0 HG3 GLU A 123 9.574 6.576 -12.921 1.00 1.44 H new ATOM 548 N ALA A 124 12.524 7.085 -9.653 1.00 0.50 N ATOM 549 CA ALA A 124 13.832 6.379 -9.469 1.00 0.50 C ATOM 550 C ALA A 124 13.634 5.104 -8.641 1.00 0.39 C ATOM 551 O ALA A 124 14.008 4.023 -9.056 1.00 0.45 O ATOM 552 CB ALA A 124 14.724 7.368 -8.717 1.00 0.56 C ATOM 0 H ALA A 124 12.497 8.044 -9.305 1.00 0.50 H new ATOM 0 HA ALA A 124 14.271 6.079 -10.421 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.702 6.918 -8.546 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.840 8.276 -9.309 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.266 7.616 -7.759 1.00 0.56 H new ATOM 558 N LYS A 125 13.038 5.224 -7.479 1.00 0.31 N ATOM 559 CA LYS A 125 12.802 4.016 -6.628 1.00 0.34 C ATOM 560 C LYS A 125 11.927 3.004 -7.367 1.00 0.34 C ATOM 561 O LYS A 125 12.215 1.822 -7.382 1.00 0.39 O ATOM 562 CB LYS A 125 12.087 4.524 -5.377 1.00 0.42 C ATOM 563 CG LYS A 125 13.058 5.347 -4.529 1.00 0.54 C ATOM 564 CD LYS A 125 12.340 5.856 -3.277 1.00 0.75 C ATOM 565 CE LYS A 125 13.316 6.672 -2.426 1.00 0.75 C ATOM 566 NZ LYS A 125 13.172 8.074 -2.904 1.00 1.56 N ATOM 0 H LYS A 125 12.706 6.104 -7.084 1.00 0.31 H new ATOM 0 HA LYS A 125 13.736 3.511 -6.381 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.228 5.133 -5.659 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.705 3.683 -4.798 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.916 4.738 -4.246 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.441 6.187 -5.108 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.485 6.471 -3.559 1.00 0.75 H new ATOM 0 HD3 LYS A 125 11.952 5.016 -2.700 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.077 6.591 -1.366 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.339 6.317 -2.550 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 13.812 8.692 -2.365 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 13.413 8.123 -3.915 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 12.190 8.388 -2.767 1.00 1.56 H new ATOM 580 N MET A 126 10.862 3.457 -7.983 1.00 0.42 N ATOM 581 CA MET A 126 9.971 2.514 -8.727 1.00 0.56 C ATOM 582 C MET A 126 10.769 1.819 -9.836 1.00 0.57 C ATOM 583 O MET A 126 10.612 0.641 -10.081 1.00 0.66 O ATOM 584 CB MET A 126 8.863 3.391 -9.334 1.00 0.70 C ATOM 585 CG MET A 126 7.944 3.926 -8.229 1.00 1.10 C ATOM 586 SD MET A 126 7.028 2.554 -7.485 1.00 1.90 S ATOM 587 CE MET A 126 5.917 2.247 -8.880 1.00 2.03 C ATOM 0 H MET A 126 10.573 4.435 -8.003 1.00 0.42 H new ATOM 0 HA MET A 126 9.560 1.737 -8.082 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.307 4.222 -9.882 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.282 2.811 -10.051 1.00 0.70 H new ATOM 0 HG2 MET A 126 8.533 4.438 -7.468 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.250 4.658 -8.642 1.00 1.10 H new ATOM 0 HE1 MET A 126 4.905 2.081 -8.510 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.922 3.110 -9.546 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.253 1.365 -9.426 1.00 2.03 H new ATOM 597 N ASP A 127 11.622 2.554 -10.503 1.00 0.55 N ATOM 598 CA ASP A 127 12.443 1.955 -11.602 1.00 0.62 C ATOM 599 C ASP A 127 13.323 0.818 -11.068 1.00 0.54 C ATOM 600 O ASP A 127 13.458 -0.216 -11.697 1.00 0.59 O ATOM 601 CB ASP A 127 13.312 3.101 -12.132 1.00 0.71 C ATOM 602 CG ASP A 127 14.134 2.633 -13.344 1.00 1.04 C ATOM 603 OD1 ASP A 127 14.237 1.433 -13.554 1.00 1.60 O ATOM 604 OD2 ASP A 127 14.641 3.489 -14.049 1.00 1.71 O ATOM 0 H ASP A 127 11.787 3.546 -10.334 1.00 0.55 H new ATOM 0 HA ASP A 127 11.816 1.524 -12.382 1.00 0.62 H new ATOM 0 HB2 ASP A 127 12.681 3.943 -12.416 1.00 0.71 H new ATOM 0 HB3 ASP A 127 13.980 3.453 -11.346 1.00 0.71 H new ATOM 609 N GLY A 128 13.928 1.003 -9.920 1.00 0.46 N ATOM 610 CA GLY A 128 14.807 -0.066 -9.358 1.00 0.46 C ATOM 611 C GLY A 128 13.994 -1.210 -8.756 1.00 0.48 C ATOM 612 O GLY A 128 14.343 -2.365 -8.919 1.00 0.51 O ATOM 0 H GLY A 128 13.851 1.846 -9.350 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.455 -0.455 -10.144 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.455 0.361 -8.593 1.00 0.46 H new ATOM 616 N ILE A 129 12.931 -0.913 -8.048 1.00 0.54 N ATOM 617 CA ILE A 129 12.133 -2.014 -7.430 1.00 0.68 C ATOM 618 C ILE A 129 11.565 -2.941 -8.522 1.00 0.68 C ATOM 619 O ILE A 129 11.703 -4.147 -8.451 1.00 0.72 O ATOM 620 CB ILE A 129 11.046 -1.311 -6.575 1.00 0.86 C ATOM 621 CG1 ILE A 129 10.687 -2.225 -5.407 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.774 -0.991 -7.375 1.00 1.77 C ATOM 623 CD1 ILE A 129 11.881 -2.313 -4.457 1.00 2.01 C ATOM 0 H ILE A 129 12.586 0.031 -7.874 1.00 0.54 H new ATOM 0 HA ILE A 129 12.728 -2.669 -6.794 1.00 0.68 H new ATOM 0 HB ILE A 129 11.454 -0.361 -6.230 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.815 -1.837 -4.880 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.423 -3.217 -5.773 1.00 1.04 H new ATOM 0 HG21 ILE A 129 9.049 -0.500 -6.725 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.023 -0.330 -8.205 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.346 -1.915 -7.763 1.00 1.77 H new ATOM 0 HD11 ILE A 129 11.632 -2.965 -3.619 1.00 2.01 H new ATOM 0 HD12 ILE A 129 12.741 -2.719 -4.990 1.00 2.01 H new ATOM 0 HD13 ILE A 129 12.123 -1.318 -4.083 1.00 2.01 H new ATOM 635 N GLU A 130 10.937 -2.384 -9.528 1.00 0.70 N ATOM 636 CA GLU A 130 10.369 -3.231 -10.623 1.00 0.77 C ATOM 637 C GLU A 130 11.481 -3.974 -11.385 1.00 0.65 C ATOM 638 O GLU A 130 11.343 -5.135 -11.719 1.00 0.68 O ATOM 639 CB GLU A 130 9.607 -2.256 -11.540 1.00 0.85 C ATOM 640 CG GLU A 130 10.581 -1.335 -12.289 1.00 1.41 C ATOM 641 CD GLU A 130 9.795 -0.266 -13.049 1.00 1.66 C ATOM 642 OE1 GLU A 130 9.018 0.431 -12.418 1.00 2.01 O ATOM 643 OE2 GLU A 130 9.983 -0.163 -14.250 1.00 2.14 O ATOM 0 H GLU A 130 10.793 -1.380 -9.639 1.00 0.70 H new ATOM 0 HA GLU A 130 9.711 -4.008 -10.234 1.00 0.77 H new ATOM 0 HB2 GLU A 130 9.007 -2.817 -12.256 1.00 0.85 H new ATOM 0 HB3 GLU A 130 8.917 -1.657 -10.947 1.00 0.85 H new ATOM 0 HG2 GLU A 130 11.267 -0.864 -11.585 1.00 1.41 H new ATOM 0 HG3 GLU A 130 11.187 -1.917 -12.983 1.00 1.41 H new ATOM 650 N GLU A 131 12.570 -3.301 -11.679 1.00 0.59 N ATOM 651 CA GLU A 131 13.682 -3.956 -12.442 1.00 0.55 C ATOM 652 C GLU A 131 14.351 -5.051 -11.606 1.00 0.47 C ATOM 653 O GLU A 131 14.500 -6.175 -12.046 1.00 0.45 O ATOM 654 CB GLU A 131 14.677 -2.834 -12.746 1.00 0.63 C ATOM 655 CG GLU A 131 15.729 -3.340 -13.738 1.00 1.38 C ATOM 656 CD GLU A 131 15.061 -3.661 -15.081 1.00 1.89 C ATOM 657 OE1 GLU A 131 14.053 -3.042 -15.387 1.00 2.30 O ATOM 658 OE2 GLU A 131 15.565 -4.526 -15.777 1.00 2.50 O ATOM 0 H GLU A 131 12.736 -2.328 -11.424 1.00 0.59 H new ATOM 0 HA GLU A 131 13.316 -4.438 -13.349 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.154 -1.972 -13.162 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.159 -2.501 -11.827 1.00 0.63 H new ATOM 0 HG2 GLU A 131 16.504 -2.586 -13.877 1.00 1.38 H new ATOM 0 HG3 GLU A 131 16.218 -4.230 -13.342 1.00 1.38 H new ATOM 665 N LYS A 132 14.755 -4.725 -10.407 1.00 0.51 N ATOM 666 CA LYS A 132 15.422 -5.739 -9.533 1.00 0.53 C ATOM 667 C LYS A 132 14.411 -6.797 -9.085 1.00 0.54 C ATOM 668 O LYS A 132 14.729 -7.966 -8.982 1.00 0.63 O ATOM 669 CB LYS A 132 15.960 -4.955 -8.331 1.00 0.68 C ATOM 670 CG LYS A 132 17.129 -4.071 -8.778 1.00 1.39 C ATOM 671 CD LYS A 132 17.671 -3.286 -7.580 1.00 1.91 C ATOM 672 CE LYS A 132 18.839 -2.404 -8.031 1.00 2.62 C ATOM 673 NZ LYS A 132 19.677 -2.219 -6.813 1.00 2.69 N ATOM 0 H LYS A 132 14.652 -3.799 -9.993 1.00 0.51 H new ATOM 0 HA LYS A 132 16.221 -6.266 -10.054 1.00 0.53 H new ATOM 0 HB2 LYS A 132 15.169 -4.340 -7.901 1.00 0.68 H new ATOM 0 HB3 LYS A 132 16.288 -5.643 -7.552 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.919 -4.686 -9.209 1.00 1.39 H new ATOM 0 HG3 LYS A 132 16.800 -3.383 -9.557 1.00 1.39 H new ATOM 0 HD2 LYS A 132 16.882 -2.670 -7.149 1.00 1.91 H new ATOM 0 HD3 LYS A 132 18.001 -3.973 -6.801 1.00 1.91 H new ATOM 0 HE2 LYS A 132 19.406 -2.879 -8.831 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.485 -1.447 -8.416 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 20.498 -1.624 -7.044 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 19.113 -1.758 -6.070 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 20.005 -3.146 -6.474 1.00 2.69 H new ATOM 687 N TYR A 133 13.201 -6.388 -8.809 1.00 0.55 N ATOM 688 CA TYR A 133 12.160 -7.351 -8.356 1.00 0.65 C ATOM 689 C TYR A 133 10.884 -7.180 -9.198 1.00 0.54 C ATOM 690 O TYR A 133 9.951 -6.536 -8.768 1.00 0.66 O ATOM 691 CB TYR A 133 11.899 -6.969 -6.902 1.00 0.89 C ATOM 692 CG TYR A 133 13.156 -7.177 -6.092 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.432 -8.430 -5.534 1.00 2.20 C ATOM 694 CD2 TYR A 133 14.047 -6.114 -5.902 1.00 0.98 C ATOM 695 CE1 TYR A 133 14.599 -8.621 -4.786 1.00 2.44 C ATOM 696 CE2 TYR A 133 15.214 -6.305 -5.154 1.00 1.14 C ATOM 697 CZ TYR A 133 15.490 -7.558 -4.596 1.00 1.67 C ATOM 698 OH TYR A 133 16.640 -7.747 -3.858 1.00 1.95 O ATOM 0 H TYR A 133 12.889 -5.420 -8.879 1.00 0.55 H new ATOM 0 HA TYR A 133 12.471 -8.391 -8.460 1.00 0.65 H new ATOM 0 HB2 TYR A 133 11.582 -5.928 -6.840 1.00 0.89 H new ATOM 0 HB3 TYR A 133 11.088 -7.574 -6.496 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.744 -9.250 -5.681 1.00 2.20 H new ATOM 0 HD2 TYR A 133 13.834 -5.147 -6.333 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.812 -9.588 -4.355 1.00 2.44 H new ATOM 0 HE2 TYR A 133 15.902 -5.485 -5.007 1.00 1.14 H new ATOM 0 HH TYR A 133 17.148 -6.910 -3.824 1.00 1.95 H new ATOM 708 N PRO A 134 10.883 -7.749 -10.384 1.00 0.51 N ATOM 709 CA PRO A 134 9.706 -7.625 -11.271 1.00 0.53 C ATOM 710 C PRO A 134 8.641 -8.688 -10.959 1.00 0.47 C ATOM 711 O PRO A 134 7.515 -8.583 -11.409 1.00 0.54 O ATOM 712 CB PRO A 134 10.293 -7.852 -12.661 1.00 0.70 C ATOM 713 CG PRO A 134 11.533 -8.673 -12.455 1.00 0.76 C ATOM 714 CD PRO A 134 11.951 -8.543 -11.008 1.00 0.66 C ATOM 0 HA PRO A 134 9.200 -6.666 -11.159 1.00 0.53 H new ATOM 0 HB2 PRO A 134 9.583 -8.371 -13.305 1.00 0.70 H new ATOM 0 HB3 PRO A 134 10.528 -6.904 -13.145 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.343 -9.717 -12.703 1.00 0.76 H new ATOM 0 HG3 PRO A 134 12.331 -8.329 -13.113 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.048 -9.520 -10.534 1.00 0.66 H new ATOM 0 HD3 PRO A 134 12.918 -8.048 -10.917 1.00 0.66 H new ATOM 722 N ARG A 135 8.983 -9.719 -10.220 1.00 0.43 N ATOM 723 CA ARG A 135 7.975 -10.786 -9.919 1.00 0.48 C ATOM 724 C ARG A 135 7.670 -10.891 -8.413 1.00 0.43 C ATOM 725 O ARG A 135 6.802 -11.644 -8.010 1.00 0.60 O ATOM 726 CB ARG A 135 8.621 -12.077 -10.431 1.00 0.70 C ATOM 727 CG ARG A 135 7.633 -13.245 -10.321 1.00 0.91 C ATOM 728 CD ARG A 135 6.386 -12.951 -11.164 1.00 1.17 C ATOM 729 NE ARG A 135 5.603 -14.217 -11.152 1.00 1.44 N ATOM 730 CZ ARG A 135 5.253 -14.778 -12.278 1.00 2.17 C ATOM 731 NH1 ARG A 135 4.186 -14.369 -12.907 1.00 2.61 N ATOM 732 NH2 ARG A 135 5.973 -15.746 -12.776 1.00 3.07 N ATOM 0 H ARG A 135 9.908 -9.867 -9.816 1.00 0.43 H new ATOM 0 HA ARG A 135 7.016 -10.573 -10.392 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.931 -11.950 -11.468 1.00 0.70 H new ATOM 0 HB3 ARG A 135 9.520 -12.296 -9.854 1.00 0.70 H new ATOM 0 HG2 ARG A 135 8.105 -14.166 -10.662 1.00 0.91 H new ATOM 0 HG3 ARG A 135 7.351 -13.398 -9.279 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.810 -12.127 -10.742 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.656 -12.664 -12.180 1.00 1.17 H new ATOM 0 HE ARG A 135 5.340 -14.646 -10.265 1.00 1.44 H new ATOM 0 HH11 ARG A 135 3.625 -13.611 -12.519 1.00 2.61 H new ATOM 0 HH12 ARG A 135 3.913 -14.807 -13.787 1.00 2.61 H new ATOM 0 HH21 ARG A 135 6.809 -16.064 -12.286 1.00 3.07 H new ATOM 0 HH22 ARG A 135 5.700 -16.184 -13.656 1.00 3.07 H new ATOM 746 N SER A 136 8.369 -10.158 -7.576 1.00 0.51 N ATOM 747 CA SER A 136 8.105 -10.245 -6.104 1.00 0.44 C ATOM 748 C SER A 136 7.079 -9.210 -5.672 1.00 0.33 C ATOM 749 O SER A 136 7.320 -8.018 -5.705 1.00 0.30 O ATOM 750 CB SER A 136 9.454 -9.976 -5.440 1.00 0.50 C ATOM 751 OG SER A 136 10.225 -11.171 -5.443 1.00 0.90 O ATOM 0 H SER A 136 9.106 -9.507 -7.847 1.00 0.51 H new ATOM 0 HA SER A 136 7.697 -11.216 -5.824 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.984 -9.186 -5.973 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.306 -9.627 -4.418 1.00 0.50 H new ATOM 0 HG SER A 136 11.092 -11.002 -5.019 1.00 0.90 H new ATOM 757 N LEU A 137 5.933 -9.675 -5.250 1.00 0.31 N ATOM 758 CA LEU A 137 4.863 -8.747 -4.785 1.00 0.24 C ATOM 759 C LEU A 137 5.386 -7.958 -3.585 1.00 0.20 C ATOM 760 O LEU A 137 5.194 -6.767 -3.473 1.00 0.21 O ATOM 761 CB LEU A 137 3.704 -9.664 -4.359 1.00 0.23 C ATOM 762 CG LEU A 137 2.520 -8.826 -3.882 1.00 0.21 C ATOM 763 CD1 LEU A 137 1.927 -8.073 -5.074 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.458 -9.754 -3.274 1.00 0.27 C ATOM 0 H LEU A 137 5.692 -10.665 -5.208 1.00 0.31 H new ATOM 0 HA LEU A 137 4.552 -8.033 -5.547 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.401 -10.293 -5.196 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.032 -10.331 -3.562 1.00 0.23 H new ATOM 0 HG LEU A 137 2.849 -8.110 -3.128 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.081 -7.472 -4.740 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.686 -7.422 -5.507 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.591 -8.788 -5.825 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.610 -9.161 -2.931 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.122 -10.466 -4.028 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.887 -10.295 -2.430 1.00 0.27 H new ATOM 776 N SER A 138 6.051 -8.641 -2.695 1.00 0.24 N ATOM 777 CA SER A 138 6.613 -7.976 -1.476 1.00 0.26 C ATOM 778 C SER A 138 7.669 -6.919 -1.833 1.00 0.20 C ATOM 779 O SER A 138 7.651 -5.814 -1.324 1.00 0.22 O ATOM 780 CB SER A 138 7.253 -9.109 -0.675 1.00 0.38 C ATOM 781 OG SER A 138 7.884 -8.570 0.480 1.00 1.01 O ATOM 0 H SER A 138 6.233 -9.643 -2.757 1.00 0.24 H new ATOM 0 HA SER A 138 5.837 -7.448 -0.922 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.496 -9.837 -0.384 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.983 -9.637 -1.289 1.00 0.38 H new ATOM 0 HG SER A 138 8.294 -9.295 0.997 1.00 1.01 H new ATOM 787 N GLU A 139 8.610 -7.271 -2.670 1.00 0.24 N ATOM 788 CA GLU A 139 9.709 -6.315 -3.035 1.00 0.25 C ATOM 789 C GLU A 139 9.184 -5.096 -3.797 1.00 0.21 C ATOM 790 O GLU A 139 9.652 -3.991 -3.601 1.00 0.21 O ATOM 791 CB GLU A 139 10.650 -7.113 -3.940 1.00 0.39 C ATOM 792 CG GLU A 139 11.235 -8.293 -3.162 1.00 1.09 C ATOM 793 CD GLU A 139 12.310 -7.792 -2.194 1.00 2.02 C ATOM 794 OE1 GLU A 139 13.104 -6.960 -2.600 1.00 2.92 O ATOM 795 OE2 GLU A 139 12.323 -8.254 -1.065 1.00 2.24 O ATOM 0 H GLU A 139 8.668 -8.184 -3.121 1.00 0.24 H new ATOM 0 HA GLU A 139 10.196 -5.932 -2.138 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.109 -7.474 -4.815 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.452 -6.471 -4.303 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.446 -8.805 -2.611 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.664 -9.019 -3.852 1.00 1.09 H new ATOM 802 N ARG A 140 8.250 -5.294 -4.689 1.00 0.26 N ATOM 803 CA ARG A 140 7.736 -4.147 -5.502 1.00 0.33 C ATOM 804 C ARG A 140 6.915 -3.163 -4.663 1.00 0.29 C ATOM 805 O ARG A 140 7.168 -1.972 -4.670 1.00 0.35 O ATOM 806 CB ARG A 140 6.847 -4.793 -6.571 1.00 0.42 C ATOM 807 CG ARG A 140 7.719 -5.558 -7.566 1.00 1.07 C ATOM 808 CD ARG A 140 6.848 -6.079 -8.712 1.00 1.17 C ATOM 809 NE ARG A 140 6.449 -4.862 -9.474 1.00 0.98 N ATOM 810 CZ ARG A 140 5.408 -4.895 -10.261 1.00 1.13 C ATOM 811 NH1 ARG A 140 4.207 -4.811 -9.758 1.00 1.55 N ATOM 812 NH2 ARG A 140 5.570 -5.010 -11.550 1.00 1.60 N ATOM 0 H ARG A 140 7.820 -6.197 -4.891 1.00 0.26 H new ATOM 0 HA ARG A 140 8.558 -3.567 -5.921 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.131 -5.469 -6.104 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.270 -4.028 -7.090 1.00 0.42 H new ATOM 0 HG2 ARG A 140 8.501 -4.907 -7.956 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.216 -6.389 -7.066 1.00 1.07 H new ATOM 0 HD2 ARG A 140 7.400 -6.776 -9.342 1.00 1.17 H new ATOM 0 HD3 ARG A 140 5.976 -6.612 -8.334 1.00 1.17 H new ATOM 0 HE ARG A 140 6.990 -4.002 -9.381 1.00 0.98 H new ATOM 0 HH11 ARG A 140 4.082 -4.720 -8.750 1.00 1.55 H new ATOM 0 HH12 ARG A 140 3.394 -4.837 -10.373 1.00 1.55 H new ATOM 0 HH21 ARG A 140 6.509 -5.074 -11.942 1.00 1.60 H new ATOM 0 HH22 ARG A 140 4.757 -5.036 -12.166 1.00 1.60 H new ATOM 826 N VAL A 141 5.921 -3.643 -3.978 1.00 0.24 N ATOM 827 CA VAL A 141 5.048 -2.734 -3.167 1.00 0.27 C ATOM 828 C VAL A 141 5.768 -2.067 -1.983 1.00 0.25 C ATOM 829 O VAL A 141 5.512 -0.921 -1.686 1.00 0.29 O ATOM 830 CB VAL A 141 3.904 -3.606 -2.662 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.129 -4.173 -3.854 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.452 -4.753 -1.817 1.00 0.23 C ATOM 0 H VAL A 141 5.668 -4.630 -3.940 1.00 0.24 H new ATOM 0 HA VAL A 141 4.714 -1.905 -3.790 1.00 0.27 H new ATOM 0 HB VAL A 141 3.238 -2.999 -2.048 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.311 -4.796 -3.493 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.725 -3.353 -4.449 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.798 -4.773 -4.471 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.627 -5.370 -1.461 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.125 -5.361 -2.422 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.996 -4.348 -0.964 1.00 0.23 H new ATOM 842 N ARG A 142 6.623 -2.766 -1.277 1.00 0.21 N ATOM 843 CA ARG A 142 7.287 -2.143 -0.082 1.00 0.22 C ATOM 844 C ARG A 142 7.983 -0.823 -0.427 1.00 0.24 C ATOM 845 O ARG A 142 7.861 0.145 0.303 1.00 0.25 O ATOM 846 CB ARG A 142 8.300 -3.174 0.420 1.00 0.27 C ATOM 847 CG ARG A 142 7.580 -4.206 1.293 1.00 0.28 C ATOM 848 CD ARG A 142 8.597 -4.915 2.192 1.00 1.02 C ATOM 849 NE ARG A 142 7.825 -5.306 3.406 1.00 0.94 N ATOM 850 CZ ARG A 142 8.441 -5.510 4.540 1.00 1.48 C ATOM 851 NH1 ARG A 142 9.357 -4.673 4.950 1.00 2.24 N ATOM 852 NH2 ARG A 142 8.136 -6.548 5.268 1.00 2.10 N ATOM 0 H ARG A 142 6.890 -3.731 -1.471 1.00 0.21 H new ATOM 0 HA ARG A 142 6.547 -1.894 0.678 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.783 -3.667 -0.424 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.085 -2.681 0.993 1.00 0.27 H new ATOM 0 HG2 ARG A 142 6.820 -3.716 1.902 1.00 0.28 H new ATOM 0 HG3 ARG A 142 7.065 -4.933 0.665 1.00 0.28 H new ATOM 0 HD2 ARG A 142 9.023 -5.787 1.696 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.427 -4.256 2.446 1.00 1.02 H new ATOM 0 HE ARG A 142 6.812 -5.415 3.351 1.00 0.94 H new ATOM 0 HH11 ARG A 142 9.593 -3.858 4.384 1.00 2.24 H new ATOM 0 HH12 ARG A 142 9.836 -4.835 5.836 1.00 2.24 H new ATOM 0 HH21 ARG A 142 7.417 -7.199 4.952 1.00 2.10 H new ATOM 0 HH22 ARG A 142 8.616 -6.709 6.154 1.00 2.10 H new ATOM 866 N GLU A 143 8.703 -0.759 -1.518 1.00 0.26 N ATOM 867 CA GLU A 143 9.387 0.524 -1.875 1.00 0.31 C ATOM 868 C GLU A 143 8.343 1.621 -2.115 1.00 0.30 C ATOM 869 O GLU A 143 8.421 2.706 -1.562 1.00 0.31 O ATOM 870 CB GLU A 143 10.159 0.222 -3.159 1.00 0.36 C ATOM 871 CG GLU A 143 11.048 1.416 -3.516 1.00 0.44 C ATOM 872 CD GLU A 143 12.179 1.556 -2.488 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.468 0.584 -1.806 1.00 1.84 O ATOM 874 OE2 GLU A 143 12.738 2.636 -2.400 1.00 1.62 O ATOM 0 H GLU A 143 8.847 -1.529 -2.171 1.00 0.26 H new ATOM 0 HA GLU A 143 10.047 0.878 -1.083 1.00 0.31 H new ATOM 0 HB2 GLU A 143 10.769 -0.672 -3.027 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.464 0.017 -3.973 1.00 0.36 H new ATOM 0 HG2 GLU A 143 11.467 1.282 -4.513 1.00 0.44 H new ATOM 0 HG3 GLU A 143 10.453 2.329 -3.540 1.00 0.44 H new ATOM 881 N SER A 144 7.359 1.330 -2.923 1.00 0.29 N ATOM 882 CA SER A 144 6.284 2.333 -3.207 1.00 0.29 C ATOM 883 C SER A 144 5.457 2.592 -1.943 1.00 0.28 C ATOM 884 O SER A 144 5.033 3.702 -1.682 1.00 0.28 O ATOM 885 CB SER A 144 5.420 1.698 -4.297 1.00 0.29 C ATOM 886 OG SER A 144 4.851 0.493 -3.803 1.00 1.34 O ATOM 0 H SER A 144 7.250 0.436 -3.403 1.00 0.29 H new ATOM 0 HA SER A 144 6.690 3.294 -3.523 1.00 0.29 H new ATOM 0 HB2 SER A 144 4.633 2.388 -4.601 1.00 0.29 H new ATOM 0 HB3 SER A 144 6.023 1.493 -5.182 1.00 0.29 H new ATOM 0 HG SER A 144 5.443 0.106 -3.125 1.00 1.34 H new ATOM 892 N LEU A 145 5.232 1.570 -1.159 1.00 0.27 N ATOM 893 CA LEU A 145 4.442 1.737 0.099 1.00 0.28 C ATOM 894 C LEU A 145 5.242 2.544 1.118 1.00 0.30 C ATOM 895 O LEU A 145 4.697 3.353 1.840 1.00 0.30 O ATOM 896 CB LEU A 145 4.213 0.322 0.638 1.00 0.29 C ATOM 897 CG LEU A 145 3.187 -0.424 -0.221 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.166 -1.899 0.185 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.805 0.179 0.015 1.00 0.67 C ATOM 0 H LEU A 145 5.563 0.622 -1.336 1.00 0.27 H new ATOM 0 HA LEU A 145 3.505 2.263 -0.086 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.155 -0.226 0.647 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.864 0.372 1.669 1.00 0.29 H new ATOM 0 HG LEU A 145 3.455 -0.336 -1.274 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.437 -2.434 -0.424 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.154 -2.333 0.032 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.892 -1.983 1.237 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.070 -0.347 -0.593 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.541 0.082 1.068 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.816 1.233 -0.261 1.00 0.67 H new ATOM 911 N LYS A 146 6.528 2.310 1.189 1.00 0.33 N ATOM 912 CA LYS A 146 7.377 3.042 2.180 1.00 0.35 C ATOM 913 C LYS A 146 7.316 4.552 1.936 1.00 0.34 C ATOM 914 O LYS A 146 7.144 5.327 2.859 1.00 0.35 O ATOM 915 CB LYS A 146 8.798 2.517 1.951 1.00 0.41 C ATOM 916 CG LYS A 146 9.730 3.045 3.047 1.00 1.01 C ATOM 917 CD LYS A 146 10.559 4.210 2.503 1.00 1.15 C ATOM 918 CE LYS A 146 11.472 4.747 3.607 1.00 1.96 C ATOM 919 NZ LYS A 146 12.448 5.627 2.905 1.00 2.32 N ATOM 0 H LYS A 146 7.028 1.642 0.602 1.00 0.33 H new ATOM 0 HA LYS A 146 7.040 2.879 3.204 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.798 1.427 1.955 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.158 2.832 0.972 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.146 3.372 3.907 1.00 1.01 H new ATOM 0 HG3 LYS A 146 10.388 2.248 3.393 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.155 3.880 1.652 1.00 1.15 H new ATOM 0 HD3 LYS A 146 9.901 5.001 2.143 1.00 1.15 H new ATOM 0 HE2 LYS A 146 10.904 5.303 4.353 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.978 3.936 4.131 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 13.109 6.033 3.597 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 12.978 5.069 2.206 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 11.939 6.394 2.421 1.00 2.32 H new ATOM 933 N VAL A 147 7.464 4.983 0.710 1.00 0.32 N ATOM 934 CA VAL A 147 7.410 6.453 0.437 1.00 0.33 C ATOM 935 C VAL A 147 6.003 7.013 0.686 1.00 0.31 C ATOM 936 O VAL A 147 5.852 8.068 1.274 1.00 0.31 O ATOM 937 CB VAL A 147 7.846 6.634 -1.018 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.278 6.121 -1.171 1.00 0.40 C ATOM 939 CG2 VAL A 147 6.924 5.862 -1.972 1.00 0.36 C ATOM 0 H VAL A 147 7.618 4.390 -0.106 1.00 0.32 H new ATOM 0 HA VAL A 147 8.069 7.005 1.108 1.00 0.33 H new ATOM 0 HB VAL A 147 7.790 7.692 -1.272 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.600 6.245 -2.205 1.00 0.40 H new ATOM 0 HG12 VAL A 147 9.939 6.687 -0.515 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.317 5.065 -0.903 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.258 6.009 -2.999 1.00 0.36 H new ATOM 0 HG22 VAL A 147 6.956 4.800 -1.729 1.00 0.36 H new ATOM 0 HG23 VAL A 147 5.903 6.228 -1.867 1.00 0.36 H new ATOM 949 N TRP A 148 4.975 6.321 0.257 1.00 0.32 N ATOM 950 CA TRP A 148 3.584 6.828 0.488 1.00 0.33 C ATOM 951 C TRP A 148 3.290 6.869 2.001 1.00 0.32 C ATOM 952 O TRP A 148 2.848 7.877 2.520 1.00 0.32 O ATOM 953 CB TRP A 148 2.654 5.845 -0.274 1.00 0.36 C ATOM 954 CG TRP A 148 1.271 5.827 0.327 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.511 6.918 0.587 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.492 4.675 0.755 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.673 6.506 1.182 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.734 5.128 1.301 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.734 3.292 0.728 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.682 4.230 1.809 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.219 2.396 1.229 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.419 2.864 1.770 1.00 0.27 C ATOM 0 H TRP A 148 5.037 5.433 -0.240 1.00 0.32 H new ATOM 0 HA TRP A 148 3.435 7.845 0.126 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.594 6.136 -1.323 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.079 4.842 -0.245 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.782 7.940 0.367 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.408 7.141 1.494 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.660 2.917 0.319 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.609 4.595 2.227 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 -0.024 1.334 1.197 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.144 2.164 2.159 1.00 0.27 H new ATOM 973 N LYS A 149 3.520 5.783 2.703 1.00 0.36 N ATOM 974 CA LYS A 149 3.235 5.775 4.170 1.00 0.38 C ATOM 975 C LYS A 149 4.074 6.851 4.883 1.00 0.34 C ATOM 976 O LYS A 149 3.620 7.477 5.822 1.00 0.33 O ATOM 977 CB LYS A 149 3.566 4.351 4.666 1.00 0.52 C ATOM 978 CG LYS A 149 5.080 4.110 4.686 1.00 1.36 C ATOM 979 CD LYS A 149 5.367 2.686 5.166 1.00 2.07 C ATOM 980 CE LYS A 149 6.795 2.612 5.713 1.00 2.80 C ATOM 981 NZ LYS A 149 7.163 1.170 5.642 1.00 3.70 N ATOM 0 H LYS A 149 3.889 4.910 2.325 1.00 0.36 H new ATOM 0 HA LYS A 149 2.194 6.014 4.386 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.159 4.208 5.667 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.087 3.617 4.019 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.495 4.259 3.689 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.564 4.831 5.344 1.00 1.36 H new ATOM 0 HD2 LYS A 149 4.654 2.401 5.940 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.244 1.981 4.344 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.476 3.222 5.120 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.845 2.982 6.737 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 7.697 0.906 6.494 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 6.299 0.594 5.582 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 7.750 1.003 4.800 1.00 3.70 H new ATOM 995 N ASN A 150 5.293 7.068 4.440 1.00 0.37 N ATOM 996 CA ASN A 150 6.157 8.105 5.092 1.00 0.41 C ATOM 997 C ASN A 150 5.512 9.486 4.960 1.00 0.39 C ATOM 998 O ASN A 150 5.528 10.276 5.886 1.00 0.46 O ATOM 999 CB ASN A 150 7.487 8.066 4.336 1.00 0.50 C ATOM 1000 CG ASN A 150 8.462 9.064 4.967 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.470 10.228 4.620 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.296 8.649 5.879 1.00 1.27 N ATOM 0 H ASN A 150 5.724 6.574 3.659 1.00 0.37 H new ATOM 0 HA ASN A 150 6.292 7.911 6.156 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.907 7.061 4.369 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.328 8.311 3.286 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.956 9.302 6.302 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.289 7.671 6.170 1.00 1.27 H new ATOM 1009 N ALA A 151 4.945 9.781 3.817 1.00 0.38 N ATOM 1010 CA ALA A 151 4.298 11.115 3.628 1.00 0.49 C ATOM 1011 C ALA A 151 3.090 11.232 4.555 1.00 0.53 C ATOM 1012 O ALA A 151 2.965 12.180 5.308 1.00 0.72 O ATOM 1013 CB ALA A 151 3.859 11.151 2.161 1.00 0.57 C ATOM 0 H ALA A 151 4.902 9.159 3.010 1.00 0.38 H new ATOM 0 HA ALA A 151 4.970 11.941 3.862 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.375 12.104 1.949 1.00 0.57 H new ATOM 0 HB2 ALA A 151 4.731 11.036 1.517 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.158 10.338 1.971 1.00 0.57 H new ATOM 1019 N GLU A 152 2.209 10.266 4.515 1.00 0.40 N ATOM 1020 CA GLU A 152 1.015 10.304 5.405 1.00 0.50 C ATOM 1021 C GLU A 152 1.405 9.942 6.842 1.00 0.60 C ATOM 1022 O GLU A 152 1.793 8.823 7.121 1.00 1.48 O ATOM 1023 CB GLU A 152 0.050 9.262 4.831 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.831 9.913 3.761 1.00 0.77 C ATOM 1025 CD GLU A 152 0.005 10.230 2.518 1.00 1.10 C ATOM 1026 OE1 GLU A 152 0.956 9.510 2.264 1.00 1.81 O ATOM 1027 OE2 GLU A 152 -0.326 11.187 1.837 1.00 1.66 O ATOM 0 H GLU A 152 2.267 9.452 3.903 1.00 0.40 H new ATOM 0 HA GLU A 152 0.566 11.297 5.441 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.609 8.432 4.400 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.571 8.849 5.626 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.651 9.245 3.497 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -1.277 10.827 4.152 1.00 0.77 H new ATOM 1034 N LYS A 153 1.271 10.868 7.758 1.00 0.76 N ATOM 1035 CA LYS A 153 1.596 10.569 9.186 1.00 0.67 C ATOM 1036 C LYS A 153 0.339 10.008 9.852 1.00 0.64 C ATOM 1037 O LYS A 153 0.221 8.818 10.065 1.00 0.57 O ATOM 1038 CB LYS A 153 2.007 11.910 9.802 1.00 0.86 C ATOM 1039 CG LYS A 153 3.360 12.343 9.229 1.00 1.17 C ATOM 1040 CD LYS A 153 3.775 13.684 9.842 1.00 1.57 C ATOM 1041 CE LYS A 153 5.135 14.107 9.275 1.00 2.22 C ATOM 1042 NZ LYS A 153 5.113 15.596 9.277 1.00 2.51 N ATOM 0 H LYS A 153 0.950 11.819 7.578 1.00 0.76 H new ATOM 0 HA LYS A 153 2.394 9.836 9.308 1.00 0.67 H new ATOM 0 HB2 LYS A 153 1.251 12.666 9.590 1.00 0.86 H new ATOM 0 HB3 LYS A 153 2.072 11.820 10.886 1.00 0.86 H new ATOM 0 HG2 LYS A 153 4.115 11.586 9.441 1.00 1.17 H new ATOM 0 HG3 LYS A 153 3.295 12.433 8.145 1.00 1.17 H new ATOM 0 HD2 LYS A 153 3.025 14.444 9.622 1.00 1.57 H new ATOM 0 HD3 LYS A 153 3.832 13.598 10.927 1.00 1.57 H new ATOM 0 HE2 LYS A 153 5.953 13.724 9.886 1.00 2.22 H new ATOM 0 HE3 LYS A 153 5.280 13.717 8.268 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 6.013 15.957 8.901 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 4.330 15.932 8.682 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 4.981 15.940 10.250 1.00 2.51 H new ATOM 1056 N LYS A 154 -0.623 10.848 10.135 1.00 0.73 N ATOM 1057 CA LYS A 154 -1.901 10.347 10.726 1.00 0.77 C ATOM 1058 C LYS A 154 -2.635 9.525 9.660 1.00 0.62 C ATOM 1059 O LYS A 154 -3.312 8.551 9.950 1.00 0.60 O ATOM 1060 CB LYS A 154 -2.702 11.597 11.095 1.00 0.95 C ATOM 1061 CG LYS A 154 -2.046 12.295 12.289 1.00 1.29 C ATOM 1062 CD LYS A 154 -2.640 13.697 12.460 1.00 1.34 C ATOM 1063 CE LYS A 154 -4.137 13.595 12.773 1.00 2.02 C ATOM 1064 NZ LYS A 154 -4.515 14.944 13.280 1.00 2.51 N ATOM 0 H LYS A 154 -0.580 11.856 9.983 1.00 0.73 H new ATOM 0 HA LYS A 154 -1.750 9.713 11.600 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -2.747 12.276 10.244 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -3.729 11.324 11.340 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -2.203 11.710 13.195 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -0.969 12.362 12.136 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -2.126 14.223 13.265 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -2.489 14.279 11.551 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -4.710 13.332 11.884 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -4.333 12.824 13.518 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -5.528 14.955 13.517 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -3.958 15.164 14.131 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -4.323 15.657 12.547 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.482 9.913 8.417 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.151 9.179 7.305 1.00 0.47 C ATOM 1080 C ASN A 155 -2.436 7.852 7.026 1.00 0.37 C ATOM 1081 O ASN A 155 -2.884 7.071 6.208 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.041 10.101 6.088 1.00 0.51 C ATOM 1083 CG ASN A 155 -3.943 11.322 6.280 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -3.470 12.441 6.312 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.232 11.155 6.403 1.00 1.03 N ATOM 0 H ASN A 155 -1.918 10.712 8.127 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.186 8.939 7.547 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.007 10.419 5.953 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.329 9.563 5.185 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.842 11.964 6.526 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -5.629 10.216 6.376 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.346 7.567 7.715 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.651 6.267 7.489 1.00 0.33 C ATOM 1094 C ALA A 156 -1.487 5.122 8.069 1.00 0.28 C ATOM 1095 O ALA A 156 -1.151 3.968 7.894 1.00 0.28 O ATOM 1096 CB ALA A 156 0.687 6.357 8.229 1.00 0.41 C ATOM 0 H ALA A 156 -0.919 8.176 8.413 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.506 6.075 6.426 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.240 5.427 8.096 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.270 7.186 7.827 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.505 6.522 9.291 1.00 0.41 H new ATOM 1102 N SER A 157 -2.574 5.419 8.757 1.00 0.28 N ATOM 1103 CA SER A 157 -3.399 4.320 9.325 1.00 0.28 C ATOM 1104 C SER A 157 -4.354 3.796 8.259 1.00 0.22 C ATOM 1105 O SER A 157 -4.509 4.381 7.191 1.00 0.21 O ATOM 1106 CB SER A 157 -4.180 4.947 10.481 1.00 0.34 C ATOM 1107 OG SER A 157 -4.574 6.269 10.131 1.00 1.05 O ATOM 0 H SER A 157 -2.912 6.363 8.942 1.00 0.28 H new ATOM 0 HA SER A 157 -2.792 3.481 9.664 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.059 4.343 10.709 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.565 4.966 11.380 1.00 0.34 H new ATOM 0 HG SER A 157 -3.885 6.903 10.421 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.983 2.686 8.530 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.914 2.102 7.530 1.00 0.22 C ATOM 1115 C VAL A 158 -7.043 3.077 7.211 1.00 0.18 C ATOM 1116 O VAL A 158 -7.364 3.276 6.064 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.462 0.819 8.151 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.315 -0.164 8.393 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.165 1.120 9.479 1.00 0.27 C ATOM 0 H VAL A 158 -4.892 2.161 9.399 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.404 1.895 6.589 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.185 0.381 7.463 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.708 -1.079 8.836 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.831 -0.399 7.445 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.588 0.284 9.070 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.549 0.193 9.906 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.456 1.572 10.172 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.992 1.809 9.305 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.630 3.705 8.211 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.742 4.689 7.958 1.00 0.13 C ATOM 1131 C ALA A 159 -8.359 5.648 6.835 1.00 0.13 C ATOM 1132 O ALA A 159 -9.189 6.062 6.044 1.00 0.15 O ATOM 1133 CB ALA A 159 -8.918 5.446 9.275 1.00 0.12 C ATOM 0 H ALA A 159 -7.386 3.578 9.193 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.663 4.194 7.649 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.714 6.183 9.168 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.179 4.743 10.067 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -7.987 5.952 9.531 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.097 5.963 6.740 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.647 6.857 5.646 1.00 0.15 C ATOM 1141 C GLY A 160 -6.764 6.105 4.329 1.00 0.16 C ATOM 1142 O GLY A 160 -7.563 6.454 3.474 1.00 0.18 O ATOM 0 H GLY A 160 -6.364 5.640 7.371 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.255 7.761 5.621 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.617 7.171 5.813 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.968 5.078 4.151 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.034 4.316 2.876 1.00 0.18 C ATOM 1148 C LEU A 161 -7.424 3.716 2.647 1.00 0.20 C ATOM 1149 O LEU A 161 -7.976 3.897 1.598 1.00 0.28 O ATOM 1150 CB LEU A 161 -5.005 3.190 3.001 1.00 0.19 C ATOM 1151 CG LEU A 161 -5.008 2.346 1.711 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.290 3.107 0.587 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.311 1.004 1.972 1.00 0.27 C ATOM 0 H LEU A 161 -5.284 4.741 4.829 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.830 4.974 2.031 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.013 3.607 3.173 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.240 2.562 3.860 1.00 0.19 H new ATOM 0 HG LEU A 161 -6.037 2.158 1.405 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.296 2.505 -0.322 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.804 4.050 0.400 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.260 3.307 0.883 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.314 0.409 1.059 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.282 1.183 2.285 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.841 0.466 2.758 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.986 2.981 3.591 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.323 2.341 3.329 1.00 0.26 C ATOM 1167 C VAL A 162 -10.338 3.367 2.851 1.00 0.29 C ATOM 1168 O VAL A 162 -11.144 3.089 1.981 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.775 1.686 4.640 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.720 0.683 5.109 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.014 2.733 5.732 1.00 0.31 C ATOM 0 H VAL A 162 -7.585 2.801 4.511 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.241 1.596 2.538 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.716 1.169 4.453 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -9.046 0.221 6.041 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.587 -0.087 4.349 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.774 1.199 5.272 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.333 2.237 6.648 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.091 3.281 5.919 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.789 3.428 5.407 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.289 4.553 3.382 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.239 5.603 2.918 1.00 0.34 C ATOM 1183 C LYS A 163 -11.037 5.855 1.415 1.00 0.36 C ATOM 1184 O LYS A 163 -11.934 5.666 0.619 1.00 0.39 O ATOM 1185 CB LYS A 163 -10.893 6.854 3.729 1.00 0.33 C ATOM 1186 CG LYS A 163 -11.859 7.980 3.360 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.519 9.233 4.167 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.490 10.356 3.793 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.416 11.321 4.924 1.00 2.30 N ATOM 0 H LYS A 163 -9.638 4.842 4.112 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.280 5.314 3.061 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -10.958 6.639 4.796 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -9.866 7.160 3.527 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.794 8.194 2.293 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -12.885 7.673 3.561 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -11.584 9.021 5.234 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.493 9.542 3.966 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -12.205 10.827 2.852 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.503 9.975 3.664 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -13.055 12.120 4.741 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -12.699 10.846 5.805 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.441 11.672 5.018 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.850 6.253 1.026 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.575 6.505 -0.431 1.00 0.39 C ATOM 1205 C ALA A 164 -9.601 5.195 -1.228 1.00 0.39 C ATOM 1206 O ALA A 164 -10.064 5.129 -2.349 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.173 7.118 -0.466 1.00 0.44 C ATOM 0 H ALA A 164 -9.059 6.415 1.649 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.326 7.156 -0.878 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.895 7.333 -1.498 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.166 8.042 0.111 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.458 6.416 -0.036 1.00 0.44 H new ATOM 1213 N LEU A 165 -9.056 4.173 -0.646 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.954 2.833 -1.308 1.00 0.55 C ATOM 1215 C LEU A 165 -10.296 2.331 -1.858 1.00 0.45 C ATOM 1216 O LEU A 165 -10.448 2.134 -3.049 1.00 0.42 O ATOM 1217 CB LEU A 165 -8.489 1.931 -0.161 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.287 0.507 -0.626 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -6.997 0.453 -1.454 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -8.167 -0.408 0.601 1.00 1.24 C ATOM 0 H LEU A 165 -8.661 4.204 0.294 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.291 2.855 -2.173 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.557 2.316 0.252 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -9.226 1.952 0.642 1.00 0.80 H new ATOM 0 HG LEU A 165 -9.129 0.174 -1.233 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.830 -0.567 -1.801 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -7.088 1.118 -2.313 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -6.155 0.769 -0.837 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -8.021 -1.438 0.274 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -7.316 -0.095 1.206 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -9.079 -0.342 1.195 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.256 2.097 -1.001 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.575 1.578 -1.476 1.00 0.45 C ATOM 1234 C ARG A 166 -13.344 2.646 -2.251 1.00 0.41 C ATOM 1235 O ARG A 166 -14.111 2.336 -3.144 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.333 1.147 -0.213 1.00 0.52 C ATOM 1237 CG ARG A 166 -13.483 2.330 0.753 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.950 2.770 0.816 1.00 1.53 C ATOM 1239 NE ARG A 166 -15.462 2.216 2.100 1.00 2.29 N ATOM 1240 CZ ARG A 166 -16.561 1.514 2.118 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -16.703 0.503 1.304 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -17.518 1.822 2.949 1.00 3.25 N ATOM 0 H ARG A 166 -11.185 2.242 0.006 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.450 0.744 -2.166 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -14.317 0.765 -0.485 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.800 0.334 0.279 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -13.137 2.045 1.747 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -12.859 3.161 0.424 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -15.038 3.856 0.791 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -15.515 2.385 -0.033 1.00 1.53 H new ATOM 0 HE ARG A 166 -14.952 2.386 2.967 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -15.954 0.262 0.654 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -17.562 -0.046 1.318 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -17.407 2.612 3.585 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -18.378 1.273 2.963 1.00 3.25 H new ATOM 1256 N THR A 167 -13.144 3.897 -1.928 1.00 0.33 N ATOM 1257 CA THR A 167 -13.868 4.981 -2.664 1.00 0.36 C ATOM 1258 C THR A 167 -13.503 4.945 -4.144 1.00 0.35 C ATOM 1259 O THR A 167 -14.341 5.150 -5.004 1.00 0.41 O ATOM 1260 CB THR A 167 -13.408 6.290 -2.016 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.862 6.327 -0.672 1.00 0.44 O ATOM 1262 CG2 THR A 167 -13.973 7.499 -2.773 1.00 0.47 C ATOM 0 H THR A 167 -12.515 4.216 -1.191 1.00 0.33 H new ATOM 0 HA THR A 167 -14.950 4.868 -2.605 1.00 0.36 H new ATOM 0 HB THR A 167 -12.319 6.335 -2.050 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.093 6.401 -0.069 1.00 0.44 H new ATOM 0 HG21 THR A 167 -13.634 8.418 -2.296 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.625 7.477 -3.806 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.062 7.462 -2.756 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.259 4.703 -4.443 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.834 4.672 -5.866 1.00 0.36 C ATOM 1272 C CYS A 168 -12.208 3.342 -6.520 1.00 0.31 C ATOM 1273 O CYS A 168 -12.909 3.319 -7.512 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.313 4.839 -5.831 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.900 6.588 -5.615 1.00 1.38 S ATOM 0 H CYS A 168 -11.519 4.526 -3.763 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.322 5.453 -6.449 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.891 4.252 -5.015 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.874 4.463 -6.755 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.608 6.728 -5.583 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.752 2.234 -5.972 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.092 0.890 -6.593 1.00 0.31 C ATOM 1283 C ARG A 169 -11.511 -0.310 -5.825 1.00 0.26 C ATOM 1284 O ARG A 169 -11.859 -1.443 -6.105 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.474 0.909 -8.001 1.00 0.44 C ATOM 1286 CG ARG A 169 -12.087 -0.214 -8.841 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.472 -0.198 -10.245 1.00 0.84 C ATOM 1288 NE ARG A 169 -12.237 -1.216 -11.023 1.00 1.56 N ATOM 1289 CZ ARG A 169 -11.870 -1.520 -12.239 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -11.922 -0.618 -13.181 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -11.451 -2.725 -12.513 1.00 2.73 N ATOM 0 H ARG A 169 -11.169 2.193 -5.136 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.175 0.764 -6.585 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.654 1.873 -8.476 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.393 0.782 -7.937 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.907 -1.178 -8.365 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -13.168 -0.086 -8.905 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -11.556 0.789 -10.700 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -10.411 -0.444 -10.212 1.00 0.84 H new ATOM 0 HE ARG A 169 -13.047 -1.674 -10.605 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -12.249 0.324 -12.967 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -11.635 -0.855 -14.131 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -11.410 -3.430 -11.777 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -11.165 -2.962 -13.463 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.596 -0.094 -4.921 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.953 -1.243 -4.208 1.00 0.17 C ATOM 1307 C LEU A 170 -10.803 -1.758 -3.037 1.00 0.19 C ATOM 1308 O LEU A 170 -10.339 -1.868 -1.916 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.630 -0.672 -3.711 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.770 -0.237 -4.903 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.908 1.275 -5.118 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.304 -0.571 -4.613 1.00 0.25 C ATOM 0 H LEU A 170 -10.263 0.829 -4.642 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.830 -2.106 -4.863 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.814 0.178 -3.055 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.099 -1.420 -3.122 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.102 -0.762 -5.799 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.295 1.579 -5.966 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.951 1.520 -5.318 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.576 1.802 -4.223 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.687 -0.264 -5.457 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.981 -0.042 -3.716 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.199 -1.645 -4.459 1.00 0.25 H new ATOM 1324 N ASN A 171 -12.036 -2.086 -3.299 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.932 -2.614 -2.226 1.00 0.30 C ATOM 1326 C ASN A 171 -12.358 -3.913 -1.634 1.00 0.24 C ATOM 1327 O ASN A 171 -12.540 -4.207 -0.468 1.00 0.25 O ATOM 1328 CB ASN A 171 -14.256 -2.897 -2.934 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.409 -2.647 -1.970 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.987 -3.569 -1.430 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.766 -1.417 -1.739 1.00 0.59 N ATOM 0 H ASN A 171 -12.469 -2.011 -4.220 1.00 0.24 H new ATOM 0 HA ASN A 171 -13.042 -1.912 -1.399 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.356 -2.258 -3.811 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -14.279 -3.928 -3.287 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.537 -1.221 -1.100 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.275 -0.649 -2.197 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.698 -4.707 -2.445 1.00 0.21 N ATOM 1339 CA LEU A 172 -11.140 -6.017 -1.954 1.00 0.21 C ATOM 1340 C LEU A 172 -10.268 -5.839 -0.709 1.00 0.17 C ATOM 1341 O LEU A 172 -10.553 -6.375 0.350 1.00 0.21 O ATOM 1342 CB LEU A 172 -10.251 -6.513 -3.100 1.00 0.23 C ATOM 1343 CG LEU A 172 -11.115 -7.011 -4.258 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -10.248 -7.145 -5.511 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -11.700 -8.381 -3.902 1.00 0.85 C ATOM 0 H LEU A 172 -11.519 -4.507 -3.429 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.945 -6.701 -1.685 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -9.601 -5.707 -3.441 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -9.604 -7.316 -2.747 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.924 -6.304 -4.442 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -10.860 -7.500 -6.340 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -9.822 -6.174 -5.764 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -9.444 -7.856 -5.323 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -12.317 -8.739 -4.726 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -10.889 -9.087 -3.722 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -12.311 -8.293 -3.003 1.00 0.85 H new ATOM 1357 N VAL A 173 -9.204 -5.099 -0.837 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.290 -4.891 0.326 1.00 0.21 C ATOM 1359 C VAL A 173 -8.999 -4.126 1.437 1.00 0.22 C ATOM 1360 O VAL A 173 -8.746 -4.350 2.606 1.00 0.25 O ATOM 1361 CB VAL A 173 -7.075 -4.114 -0.197 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -6.217 -5.047 -1.045 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.505 -2.914 -1.053 1.00 0.34 C ATOM 0 H VAL A 173 -8.925 -4.627 -1.697 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.978 -5.844 0.754 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.511 -3.741 0.658 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.351 -4.503 -1.421 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.882 -5.887 -0.436 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.804 -5.419 -1.884 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.621 -2.385 -1.408 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -8.085 -3.265 -1.907 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.115 -2.239 -0.453 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.904 -3.245 1.091 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.648 -2.490 2.147 1.00 0.34 C ATOM 1375 C ALA A 174 -11.397 -3.488 3.041 1.00 0.29 C ATOM 1376 O ALA A 174 -11.402 -3.379 4.253 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.633 -1.600 1.384 1.00 0.43 C ATOM 0 H ALA A 174 -10.159 -3.017 0.130 1.00 0.27 H new ATOM 0 HA ALA A 174 -9.994 -1.899 2.788 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.217 -1.013 2.093 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.082 -0.929 0.725 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.302 -2.223 0.790 1.00 0.43 H new ATOM 1383 N ASP A 175 -12.022 -4.465 2.437 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.765 -5.494 3.226 1.00 0.23 C ATOM 1385 C ASP A 175 -11.829 -6.271 4.159 1.00 0.17 C ATOM 1386 O ASP A 175 -12.182 -6.561 5.287 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.381 -6.434 2.186 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.504 -5.715 1.429 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -15.070 -4.784 1.981 1.00 0.99 O ATOM 1390 OD2 ASP A 175 -14.784 -6.112 0.310 1.00 0.80 O ATOM 0 H ASP A 175 -12.050 -4.595 1.426 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.518 -5.033 3.865 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.615 -6.767 1.486 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.774 -7.325 2.676 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.653 -6.637 3.697 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.725 -7.428 4.574 1.00 0.20 C ATOM 1397 C LEU A 176 -9.331 -6.622 5.810 1.00 0.25 C ATOM 1398 O LEU A 176 -9.498 -7.073 6.928 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.476 -7.728 3.721 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.708 -8.833 2.647 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -10.188 -8.998 2.254 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.908 -8.473 1.393 1.00 1.09 C ATOM 0 H LEU A 176 -10.299 -6.426 2.764 1.00 0.14 H new ATOM 0 HA LEU A 176 -10.204 -8.343 4.923 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -8.156 -6.812 3.225 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.662 -8.036 4.378 1.00 0.28 H new ATOM 0 HG LEU A 176 -8.382 -9.778 3.082 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -10.280 -9.783 1.503 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.770 -9.269 3.135 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.563 -8.059 1.846 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -8.061 -9.238 0.632 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -8.244 -7.509 1.011 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.848 -8.415 1.642 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.818 -5.430 5.622 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.424 -4.597 6.798 1.00 0.41 C ATOM 1416 C VAL A 177 -9.663 -4.306 7.641 1.00 0.37 C ATOM 1417 O VAL A 177 -9.626 -4.367 8.856 1.00 0.39 O ATOM 1418 CB VAL A 177 -7.822 -3.310 6.222 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.583 -3.656 5.397 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -8.842 -2.596 5.329 1.00 0.52 C ATOM 0 H VAL A 177 -8.656 -5.001 4.711 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.702 -5.097 7.444 1.00 0.41 H new ATOM 0 HB VAL A 177 -7.549 -2.649 7.045 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.153 -2.743 4.986 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -5.848 -4.149 6.033 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.863 -4.324 4.582 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.399 -1.684 4.928 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.128 -3.252 4.507 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -9.725 -2.343 5.916 1.00 0.52 H new ATOM 1430 N GLU A 178 -10.774 -4.032 7.000 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.036 -3.784 7.761 1.00 0.39 C ATOM 1432 C GLU A 178 -12.384 -5.042 8.569 1.00 0.31 C ATOM 1433 O GLU A 178 -12.579 -4.995 9.769 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.086 -3.509 6.677 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.491 -3.473 7.285 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.532 -3.142 6.205 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.138 -2.776 5.107 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.710 -3.260 6.496 1.00 1.85 O ATOM 0 H GLU A 178 -10.860 -3.970 5.986 1.00 0.36 H new ATOM 0 HA GLU A 178 -11.968 -2.957 8.468 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -12.871 -2.559 6.188 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.035 -4.282 5.910 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -14.723 -4.436 7.740 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.532 -2.728 8.079 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.430 -6.168 7.905 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.737 -7.453 8.602 1.00 0.24 C ATOM 1447 C GLU A 179 -11.678 -7.720 9.671 1.00 0.25 C ATOM 1448 O GLU A 179 -11.979 -8.181 10.755 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.714 -8.519 7.503 1.00 0.31 C ATOM 1450 CG GLU A 179 -14.018 -8.445 6.705 1.00 1.03 C ATOM 1451 CD GLU A 179 -13.998 -9.489 5.588 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -14.420 -10.606 5.839 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -13.568 -9.152 4.497 1.00 1.92 O ATOM 0 H GLU A 179 -12.267 -6.253 6.902 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.700 -7.442 9.113 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.860 -8.361 6.844 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.598 -9.510 7.943 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -14.869 -8.619 7.363 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -14.141 -7.448 6.282 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.441 -7.410 9.373 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.352 -7.619 10.375 1.00 0.38 C ATOM 1462 C ALA A 180 -9.624 -6.747 11.604 1.00 0.44 C ATOM 1463 O ALA A 180 -9.437 -7.167 12.730 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.064 -7.176 9.675 1.00 0.50 C ATOM 0 H ALA A 180 -10.139 -7.021 8.480 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.284 -8.654 10.712 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.220 -7.302 10.353 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -7.907 -7.783 8.783 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.147 -6.127 9.390 1.00 0.50 H new