USER MOD reduce.3.24.130724 H: found=0, std=0, add=1110, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1105 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 77 SER OG : rot -151:sc= -1.75! USER MOD Set 1.2: A 79 SER OG : rot 37:sc= 1.1 USER MOD Set 1.3: A 110 GLN : amide:sc= -5.1! C(o=-5.7!,f=-13!) USER MOD Set 2.1: A 50 THR OG1 : rot -83:sc= 1.07 USER MOD Set 2.2: A 61 LYS NZ :NH3+ -154:sc= 1.72 (180deg=0.446) USER MOD Set 2.3: A 68 TYR OH : rot 30:sc= 0 USER MOD Set 2.4: A 75 THR OG1 : rot 76:sc= -2.03! USER MOD Set 3.1: A 47 THR OG1 : rot 70:sc= -1.26! USER MOD Set 3.2: A 48 HIS : no HD1:sc= -0.827 K(o=-2.1,f=-6.6!) USER MOD Set 4.1: A 23 THR OG1 : rot -124:sc= 1.1 USER MOD Set 4.2: A 57 MET CE :methyl -170:sc= -0.861 (180deg=-1.07) USER MOD Set 4.3: A 59 HIS : no HD1:sc= 0.358 K(o=0.6,f=-10!) USER MOD Set 5.1: A 13 HIS : no HD1:sc= -3.56 K(o=-8.1,f=-12!) USER MOD Set 5.2: A 103 THR OG1 : rot 128:sc= 1.06 USER MOD Set 5.3: A 104 SER OG : rot 180:sc= 0 USER MOD Set 5.4: A 105 GLN : amide:sc= -5.58! C(o=-8.1!,f=-8.4!) USER MOD Single : A 1 SER N :NH3+ 144:sc= 0.0467 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0313 USER MOD Single : A 2 SER OG : rot 91:sc= 1.27 USER MOD Single : A 6 LYS NZ :NH3+ -167:sc= -3.48! (180deg=-4.24!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 13:sc= 0.799 USER MOD Single : A 16 ASN : amide:sc= -0.548 X(o=-0.55,f=-0.7) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -91:sc= -4.36! USER MOD Single : A 32 SER OG : rot -151:sc= -0.505 USER MOD Single : A 35 GLN : amide:sc= -2.89! C(o=-2.9!,f=-5.3!) USER MOD Single : A 39 GLN : amide:sc= 0.55 K(o=0.55,f=-2.9!) USER MOD Single : A 41 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.26) USER MOD Single : A 51 TYR OH : rot 58:sc= -2.05! USER MOD Single : A 52 ASN : amide:sc= -0.624 K(o=-0.62,f=-9.9!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -161:sc= 1.14 (180deg=0.893) USER MOD Single : A 64 LYS NZ :NH3+ 166:sc= 1.24 (180deg=1.09) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.18) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= -0.371 USER MOD Single : A 91 TYR OH : rot 42:sc= 0.683 USER MOD Single : A 98 MET CE :methyl -163:sc= -0.381 (180deg=-0.919) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 158:sc= -0.222 (180deg=-1.03) USER MOD Single : A 106 SER OG : rot 180:sc= 0.032 USER MOD Single : A 118 SER OG : rot -61:sc= 1.14 USER MOD Single : A 123 THR OG1 : rot 100:sc= -0.0275 USER MOD Single : A 124 TYR OH : rot -166:sc= 0.613 USER MOD Single : A 125 ASN : amide:sc= -3.6! K(o=-3.6!,f=-1.2) USER MOD Single : A 127 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-1.8!) USER MOD Single : A 129 GLN : amide:sc= -0.275 K(o=-0.27,f=-1.7) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.497 USER MOD Single : A 134 LYS NZ :NH3+ 139:sc= 0.302 (180deg=-0.143) USER MOD Single : A 139 SER OG : rot 180:sc= 0.0211 USER MOD Single : A 142 LYS NZ :NH3+ -140:sc= 1.22 (180deg=0.123) USER MOD Single : A 150 THR OG1 : rot -150:sc= -0.0283 USER MOD Single : A 151 SER OG : rot 102:sc= -3.29! USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= -1.02 K(o=-1,f=-0.038) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 26.062 -2.692 12.923 1.00 3.53 N ATOM 2 CA SER A 1 25.702 -2.113 11.614 1.00 2.82 C ATOM 3 C SER A 1 24.367 -1.385 11.702 1.00 1.84 C ATOM 4 O SER A 1 23.350 -1.981 12.051 1.00 1.68 O ATOM 5 CB SER A 1 25.623 -3.225 10.569 1.00 3.37 C ATOM 6 OG SER A 1 26.807 -4.008 10.568 1.00 4.10 O ATOM 0 H1 SER A 1 26.542 -3.603 12.779 1.00 3.53 H new ATOM 0 H2 SER A 1 26.698 -2.042 13.427 1.00 3.53 H new ATOM 0 H3 SER A 1 25.200 -2.839 13.486 1.00 3.53 H new ATOM 0 HA SER A 1 26.468 -1.394 11.322 1.00 2.82 H new ATOM 0 HB2 SER A 1 24.762 -3.861 10.774 1.00 3.37 H new ATOM 0 HB3 SER A 1 25.469 -2.790 9.581 1.00 3.37 H new ATOM 0 HG SER A 1 26.732 -4.714 9.892 1.00 4.10 H new ATOM 14 N SER A 2 24.372 -0.095 11.388 1.00 1.72 N ATOM 15 CA SER A 2 23.157 0.702 11.432 1.00 1.06 C ATOM 16 C SER A 2 22.285 0.414 10.211 1.00 0.92 C ATOM 17 O SER A 2 21.067 0.605 10.242 1.00 1.65 O ATOM 18 CB SER A 2 23.508 2.187 11.519 1.00 1.60 C ATOM 19 OG SER A 2 24.480 2.538 10.547 1.00 2.37 O ATOM 0 H SER A 2 25.205 0.419 11.101 1.00 1.72 H new ATOM 0 HA SER A 2 22.588 0.432 12.321 1.00 1.06 H new ATOM 0 HB2 SER A 2 22.609 2.786 11.372 1.00 1.60 H new ATOM 0 HB3 SER A 2 23.885 2.417 12.515 1.00 1.60 H new ATOM 0 HG SER A 2 24.031 2.834 9.728 1.00 2.37 H new ATOM 25 N GLU A 3 22.917 -0.047 9.138 1.00 0.72 N ATOM 26 CA GLU A 3 22.200 -0.471 7.943 1.00 0.65 C ATOM 27 C GLU A 3 22.198 -1.996 7.849 1.00 0.56 C ATOM 28 O GLU A 3 23.179 -2.596 7.405 1.00 0.70 O ATOM 29 CB GLU A 3 22.828 0.126 6.676 1.00 1.06 C ATOM 30 CG GLU A 3 22.562 1.614 6.473 1.00 1.63 C ATOM 31 CD GLU A 3 23.453 2.510 7.309 1.00 1.81 C ATOM 32 OE1 GLU A 3 24.563 2.854 6.846 1.00 2.08 O ATOM 33 OE2 GLU A 3 23.048 2.890 8.423 1.00 2.19 O ATOM 0 H GLU A 3 23.931 -0.137 9.072 1.00 0.72 H new ATOM 0 HA GLU A 3 21.175 -0.109 8.019 1.00 0.65 H new ATOM 0 HB2 GLU A 3 23.905 -0.035 6.710 1.00 1.06 H new ATOM 0 HB3 GLU A 3 22.452 -0.418 5.810 1.00 1.06 H new ATOM 0 HG2 GLU A 3 22.701 1.859 5.420 1.00 1.63 H new ATOM 0 HG3 GLU A 3 21.520 1.824 6.715 1.00 1.63 H new ATOM 40 N PRO A 4 21.112 -2.650 8.292 1.00 0.41 N ATOM 41 CA PRO A 4 20.985 -4.099 8.242 1.00 0.39 C ATOM 42 C PRO A 4 20.384 -4.584 6.926 1.00 0.39 C ATOM 43 O PRO A 4 20.046 -3.785 6.047 1.00 0.50 O ATOM 44 CB PRO A 4 20.032 -4.416 9.405 1.00 0.39 C ATOM 45 CG PRO A 4 19.507 -3.096 9.897 1.00 0.44 C ATOM 46 CD PRO A 4 19.924 -2.053 8.896 1.00 0.41 C ATOM 0 HA PRO A 4 21.954 -4.592 8.317 1.00 0.39 H new ATOM 0 HB2 PRO A 4 19.216 -5.059 9.074 1.00 0.39 H new ATOM 0 HB3 PRO A 4 20.554 -4.947 10.201 1.00 0.39 H new ATOM 0 HG2 PRO A 4 18.422 -3.125 9.994 1.00 0.44 H new ATOM 0 HG3 PRO A 4 19.909 -2.865 10.884 1.00 0.44 H new ATOM 0 HD2 PRO A 4 19.145 -1.865 8.158 1.00 0.41 H new ATOM 0 HD3 PRO A 4 20.148 -1.099 9.374 1.00 0.41 H new ATOM 54 N ALA A 5 20.265 -5.896 6.798 1.00 0.37 N ATOM 55 CA ALA A 5 19.644 -6.513 5.636 1.00 0.45 C ATOM 56 C ALA A 5 18.142 -6.278 5.667 1.00 0.22 C ATOM 57 O ALA A 5 17.596 -5.934 6.713 1.00 0.43 O ATOM 58 CB ALA A 5 19.953 -8.001 5.606 1.00 0.76 C ATOM 0 H ALA A 5 20.596 -6.563 7.496 1.00 0.37 H new ATOM 0 HA ALA A 5 20.049 -6.060 4.731 1.00 0.45 H new ATOM 0 HB1 ALA A 5 19.483 -8.453 4.732 1.00 0.76 H new ATOM 0 HB2 ALA A 5 21.032 -8.148 5.554 1.00 0.76 H new ATOM 0 HB3 ALA A 5 19.566 -8.471 6.510 1.00 0.76 H new ATOM 64 N LYS A 6 17.495 -6.399 4.508 1.00 0.31 N ATOM 65 CA LYS A 6 16.037 -6.263 4.407 1.00 0.15 C ATOM 66 C LYS A 6 15.332 -7.096 5.489 1.00 0.14 C ATOM 67 O LYS A 6 15.169 -8.305 5.334 1.00 0.20 O ATOM 68 CB LYS A 6 15.528 -6.721 3.025 1.00 0.17 C ATOM 69 CG LYS A 6 16.483 -6.502 1.849 1.00 0.17 C ATOM 70 CD LYS A 6 16.940 -5.059 1.701 1.00 0.24 C ATOM 71 CE LYS A 6 15.791 -4.134 1.340 1.00 0.23 C ATOM 72 NZ LYS A 6 15.072 -4.604 0.131 1.00 0.66 N ATOM 0 H LYS A 6 17.958 -6.592 3.620 1.00 0.31 H new ATOM 0 HA LYS A 6 15.805 -5.207 4.547 1.00 0.15 H new ATOM 0 HB2 LYS A 6 15.291 -7.783 3.081 1.00 0.17 H new ATOM 0 HB3 LYS A 6 14.596 -6.198 2.812 1.00 0.17 H new ATOM 0 HG2 LYS A 6 17.357 -7.141 1.977 1.00 0.17 H new ATOM 0 HG3 LYS A 6 15.991 -6.816 0.928 1.00 0.17 H new ATOM 0 HD2 LYS A 6 17.395 -4.725 2.633 1.00 0.24 H new ATOM 0 HD3 LYS A 6 17.709 -4.999 0.931 1.00 0.24 H new ATOM 0 HE2 LYS A 6 15.095 -4.073 2.177 1.00 0.23 H new ATOM 0 HE3 LYS A 6 16.173 -3.128 1.169 1.00 0.23 H new ATOM 0 HZ1 LYS A 6 14.445 -3.850 -0.215 1.00 0.66 H new ATOM 0 HZ2 LYS A 6 15.760 -4.849 -0.609 1.00 0.66 H new ATOM 0 HZ3 LYS A 6 14.505 -5.443 0.368 1.00 0.66 H new ATOM 86 N LEU A 7 14.919 -6.446 6.579 1.00 0.14 N ATOM 87 CA LEU A 7 14.240 -7.137 7.675 1.00 0.14 C ATOM 88 C LEU A 7 12.739 -7.168 7.418 1.00 0.13 C ATOM 89 O LEU A 7 12.144 -6.142 7.099 1.00 0.10 O ATOM 90 CB LEU A 7 14.537 -6.438 9.003 1.00 0.15 C ATOM 91 CG LEU A 7 16.021 -6.334 9.367 1.00 0.19 C ATOM 92 CD1 LEU A 7 16.220 -5.383 10.537 1.00 0.20 C ATOM 93 CD2 LEU A 7 16.584 -7.706 9.700 1.00 0.24 C ATOM 0 H LEU A 7 15.043 -5.444 6.725 1.00 0.14 H new ATOM 0 HA LEU A 7 14.609 -8.161 7.731 1.00 0.14 H new ATOM 0 HB2 LEU A 7 14.116 -5.433 8.968 1.00 0.15 H new ATOM 0 HB3 LEU A 7 14.020 -6.972 9.800 1.00 0.15 H new ATOM 0 HG LEU A 7 16.558 -5.938 8.505 1.00 0.19 H new ATOM 0 HD11 LEU A 7 17.281 -5.323 10.780 1.00 0.20 H new ATOM 0 HD12 LEU A 7 15.853 -4.393 10.268 1.00 0.20 H new ATOM 0 HD13 LEU A 7 15.669 -5.751 11.403 1.00 0.20 H new ATOM 0 HD21 LEU A 7 17.639 -7.614 9.956 1.00 0.24 H new ATOM 0 HD22 LEU A 7 16.041 -8.127 10.546 1.00 0.24 H new ATOM 0 HD23 LEU A 7 16.476 -8.363 8.837 1.00 0.24 H new ATOM 105 N ASP A 8 12.141 -8.347 7.571 1.00 0.21 N ATOM 106 CA ASP A 8 10.743 -8.579 7.188 1.00 0.24 C ATOM 107 C ASP A 8 9.793 -7.615 7.895 1.00 0.21 C ATOM 108 O ASP A 8 9.701 -7.602 9.124 1.00 0.29 O ATOM 109 CB ASP A 8 10.345 -10.022 7.498 1.00 0.37 C ATOM 110 CG ASP A 8 9.071 -10.438 6.790 1.00 0.52 C ATOM 111 OD1 ASP A 8 8.033 -10.571 7.469 1.00 0.64 O ATOM 112 OD2 ASP A 8 9.089 -10.608 5.551 1.00 0.65 O ATOM 0 H ASP A 8 12.605 -9.167 7.961 1.00 0.21 H new ATOM 0 HA ASP A 8 10.662 -8.400 6.116 1.00 0.24 H new ATOM 0 HB2 ASP A 8 11.155 -10.690 7.204 1.00 0.37 H new ATOM 0 HB3 ASP A 8 10.213 -10.136 8.574 1.00 0.37 H new ATOM 117 N LEU A 9 9.087 -6.816 7.104 1.00 0.18 N ATOM 118 CA LEU A 9 8.192 -5.792 7.627 1.00 0.16 C ATOM 119 C LEU A 9 6.773 -6.332 7.794 1.00 0.18 C ATOM 120 O LEU A 9 6.507 -7.500 7.500 1.00 0.26 O ATOM 121 CB LEU A 9 8.159 -4.600 6.669 1.00 0.13 C ATOM 122 CG LEU A 9 7.854 -3.250 7.318 1.00 0.14 C ATOM 123 CD1 LEU A 9 9.097 -2.691 7.984 1.00 0.13 C ATOM 124 CD2 LEU A 9 7.302 -2.276 6.297 1.00 0.20 C ATOM 0 H LEU A 9 9.119 -6.860 6.085 1.00 0.18 H new ATOM 0 HA LEU A 9 8.567 -5.483 8.603 1.00 0.16 H new ATOM 0 HB2 LEU A 9 9.123 -4.533 6.165 1.00 0.13 H new ATOM 0 HB3 LEU A 9 7.410 -4.793 5.901 1.00 0.13 H new ATOM 0 HG LEU A 9 7.093 -3.399 8.084 1.00 0.14 H new ATOM 0 HD11 LEU A 9 8.864 -1.730 8.441 1.00 0.13 H new ATOM 0 HD12 LEU A 9 9.441 -3.384 8.752 1.00 0.13 H new ATOM 0 HD13 LEU A 9 9.880 -2.557 7.238 1.00 0.13 H new ATOM 0 HD21 LEU A 9 7.092 -1.322 6.781 1.00 0.20 H new ATOM 0 HD22 LEU A 9 8.034 -2.127 5.503 1.00 0.20 H new ATOM 0 HD23 LEU A 9 6.382 -2.677 5.872 1.00 0.20 H new ATOM 136 N SER A 10 5.868 -5.484 8.266 1.00 0.18 N ATOM 137 CA SER A 10 4.461 -5.832 8.345 1.00 0.21 C ATOM 138 C SER A 10 3.845 -5.859 6.945 1.00 0.19 C ATOM 139 O SER A 10 3.282 -6.872 6.524 1.00 0.24 O ATOM 140 CB SER A 10 3.721 -4.832 9.242 1.00 0.25 C ATOM 141 OG SER A 10 2.352 -5.174 9.378 1.00 1.21 O ATOM 0 H SER A 10 6.088 -4.546 8.601 1.00 0.18 H new ATOM 0 HA SER A 10 4.365 -6.826 8.782 1.00 0.21 H new ATOM 0 HB2 SER A 10 4.191 -4.806 10.225 1.00 0.25 H new ATOM 0 HB3 SER A 10 3.807 -3.830 8.821 1.00 0.25 H new ATOM 0 HG SER A 10 1.907 -4.520 9.956 1.00 1.21 H new ATOM 147 N CYS A 11 3.968 -4.755 6.214 1.00 0.15 N ATOM 148 CA CYS A 11 3.461 -4.697 4.857 1.00 0.15 C ATOM 149 C CYS A 11 4.615 -4.755 3.874 1.00 0.14 C ATOM 150 O CYS A 11 5.481 -3.885 3.857 1.00 0.12 O ATOM 151 CB CYS A 11 2.622 -3.433 4.627 1.00 0.17 C ATOM 152 SG CYS A 11 3.521 -1.855 4.826 1.00 0.19 S ATOM 0 H CYS A 11 4.412 -3.897 6.540 1.00 0.15 H new ATOM 0 HA CYS A 11 2.811 -5.557 4.698 1.00 0.15 H new ATOM 0 HB2 CYS A 11 2.206 -3.471 3.620 1.00 0.17 H new ATOM 0 HB3 CYS A 11 1.781 -3.443 5.320 1.00 0.17 H new ATOM 157 N VAL A 12 4.665 -5.829 3.115 1.00 0.15 N ATOM 158 CA VAL A 12 5.626 -5.965 2.036 1.00 0.13 C ATOM 159 C VAL A 12 5.154 -7.021 1.041 1.00 0.16 C ATOM 160 O VAL A 12 4.808 -8.141 1.419 1.00 0.21 O ATOM 161 CB VAL A 12 7.058 -6.273 2.559 1.00 0.11 C ATOM 162 CG1 VAL A 12 7.018 -7.012 3.887 1.00 0.12 C ATOM 163 CG2 VAL A 12 7.855 -7.070 1.542 1.00 0.12 C ATOM 0 H VAL A 12 4.044 -6.631 3.226 1.00 0.15 H new ATOM 0 HA VAL A 12 5.687 -5.006 1.521 1.00 0.13 H new ATOM 0 HB VAL A 12 7.555 -5.316 2.715 1.00 0.11 H new ATOM 0 HG11 VAL A 12 8.035 -7.211 4.223 1.00 0.12 H new ATOM 0 HG12 VAL A 12 6.504 -6.400 4.628 1.00 0.12 H new ATOM 0 HG13 VAL A 12 6.486 -7.955 3.763 1.00 0.12 H new ATOM 0 HG21 VAL A 12 8.851 -7.270 1.936 1.00 0.12 H new ATOM 0 HG22 VAL A 12 7.348 -8.014 1.341 1.00 0.12 H new ATOM 0 HG23 VAL A 12 7.939 -6.499 0.617 1.00 0.12 H new ATOM 173 N HIS A 13 5.091 -6.619 -0.229 1.00 0.17 N ATOM 174 CA HIS A 13 4.699 -7.505 -1.326 1.00 0.24 C ATOM 175 C HIS A 13 5.444 -8.826 -1.282 1.00 0.37 C ATOM 176 O HIS A 13 4.825 -9.879 -1.320 1.00 0.98 O ATOM 177 CB HIS A 13 4.978 -6.837 -2.666 1.00 0.32 C ATOM 178 CG HIS A 13 3.810 -6.101 -3.215 1.00 0.47 C ATOM 179 ND1 HIS A 13 2.826 -6.703 -3.963 1.00 0.68 N ATOM 180 CD2 HIS A 13 3.476 -4.800 -3.134 1.00 0.83 C ATOM 181 CE1 HIS A 13 1.943 -5.798 -4.315 1.00 1.01 C ATOM 182 NE2 HIS A 13 2.313 -4.635 -3.821 1.00 1.09 N ATOM 0 H HIS A 13 5.311 -5.668 -0.527 1.00 0.17 H new ATOM 0 HA HIS A 13 3.633 -7.701 -1.211 1.00 0.24 H new ATOM 0 HB2 HIS A 13 5.812 -6.145 -2.551 1.00 0.32 H new ATOM 0 HB3 HIS A 13 5.289 -7.596 -3.384 1.00 0.32 H new ATOM 0 HD2 HIS A 13 4.029 -4.029 -2.619 1.00 0.83 H new ATOM 0 HE1 HIS A 13 1.060 -5.977 -4.911 1.00 1.01 H new ATOM 0 HE2 HIS A 13 1.810 -3.755 -3.935 1.00 1.09 H new ATOM 190 N SER A 14 6.780 -8.726 -1.233 1.00 0.37 N ATOM 191 CA SER A 14 7.720 -9.864 -1.184 1.00 0.35 C ATOM 192 C SER A 14 7.636 -10.791 -2.407 1.00 0.52 C ATOM 193 O SER A 14 8.645 -11.374 -2.808 1.00 1.14 O ATOM 194 CB SER A 14 7.613 -10.654 0.137 1.00 0.30 C ATOM 195 OG SER A 14 6.301 -11.110 0.402 1.00 1.16 O ATOM 0 H SER A 14 7.255 -7.823 -1.226 1.00 0.37 H new ATOM 0 HA SER A 14 8.712 -9.414 -1.220 1.00 0.35 H new ATOM 0 HB2 SER A 14 8.288 -11.509 0.099 1.00 0.30 H new ATOM 0 HB3 SER A 14 7.945 -10.022 0.960 1.00 0.30 H new ATOM 0 HG SER A 14 5.751 -11.009 -0.403 1.00 1.16 H new ATOM 201 N ASP A 15 6.463 -10.912 -3.011 1.00 0.25 N ATOM 202 CA ASP A 15 6.295 -11.697 -4.229 1.00 0.31 C ATOM 203 C ASP A 15 6.714 -10.899 -5.460 1.00 0.28 C ATOM 204 O ASP A 15 5.959 -10.773 -6.423 1.00 0.55 O ATOM 205 CB ASP A 15 4.847 -12.170 -4.377 1.00 0.48 C ATOM 206 CG ASP A 15 4.513 -13.329 -3.459 1.00 1.66 C ATOM 207 OD1 ASP A 15 4.608 -14.494 -3.897 1.00 2.50 O ATOM 208 OD2 ASP A 15 4.158 -13.080 -2.286 1.00 2.26 O ATOM 0 H ASP A 15 5.606 -10.473 -2.675 1.00 0.25 H new ATOM 0 HA ASP A 15 6.941 -12.571 -4.149 1.00 0.31 H new ATOM 0 HB2 ASP A 15 4.174 -11.339 -4.165 1.00 0.48 H new ATOM 0 HB3 ASP A 15 4.670 -12.468 -5.410 1.00 0.48 H new ATOM 213 N ASN A 16 7.927 -10.352 -5.380 1.00 0.23 N ATOM 214 CA ASN A 16 8.572 -9.593 -6.459 1.00 0.21 C ATOM 215 C ASN A 16 7.638 -8.584 -7.138 1.00 0.19 C ATOM 216 O ASN A 16 7.087 -8.836 -8.206 1.00 0.22 O ATOM 217 CB ASN A 16 9.250 -10.526 -7.489 1.00 0.23 C ATOM 218 CG ASN A 16 8.353 -11.577 -8.107 1.00 1.06 C ATOM 219 OD1 ASN A 16 7.719 -11.350 -9.137 1.00 2.09 O ATOM 220 ND2 ASN A 16 8.327 -12.746 -7.506 1.00 0.95 N ATOM 0 H ASN A 16 8.505 -10.425 -4.543 1.00 0.23 H new ATOM 0 HA ASN A 16 9.352 -9.001 -5.980 1.00 0.21 H new ATOM 0 HB2 ASN A 16 9.667 -9.914 -8.289 1.00 0.23 H new ATOM 0 HB3 ASN A 16 10.087 -11.028 -7.003 1.00 0.23 H new ATOM 0 HD21 ASN A 16 7.767 -13.506 -7.892 1.00 0.95 H new ATOM 0 HD22 ASN A 16 8.867 -12.893 -6.653 1.00 0.95 H new ATOM 227 N LYS A 17 7.497 -7.411 -6.525 1.00 0.19 N ATOM 228 CA LYS A 17 6.648 -6.361 -7.078 1.00 0.19 C ATOM 229 C LYS A 17 7.212 -4.966 -6.834 1.00 0.21 C ATOM 230 O LYS A 17 7.756 -4.673 -5.768 1.00 0.28 O ATOM 231 CB LYS A 17 5.236 -6.441 -6.490 1.00 0.23 C ATOM 232 CG LYS A 17 4.321 -7.449 -7.166 1.00 0.25 C ATOM 233 CD LYS A 17 4.026 -7.039 -8.600 1.00 0.25 C ATOM 234 CE LYS A 17 2.850 -7.806 -9.184 1.00 0.43 C ATOM 235 NZ LYS A 17 3.112 -9.265 -9.282 1.00 0.93 N ATOM 0 H LYS A 17 7.958 -7.165 -5.649 1.00 0.19 H new ATOM 0 HA LYS A 17 6.613 -6.528 -8.155 1.00 0.19 H new ATOM 0 HB2 LYS A 17 5.312 -6.692 -5.432 1.00 0.23 H new ATOM 0 HB3 LYS A 17 4.776 -5.455 -6.551 1.00 0.23 H new ATOM 0 HG2 LYS A 17 4.787 -8.434 -7.154 1.00 0.25 H new ATOM 0 HG3 LYS A 17 3.388 -7.531 -6.608 1.00 0.25 H new ATOM 0 HD2 LYS A 17 3.814 -5.970 -8.635 1.00 0.25 H new ATOM 0 HD3 LYS A 17 4.910 -7.209 -9.214 1.00 0.25 H new ATOM 0 HE2 LYS A 17 1.969 -7.640 -8.565 1.00 0.43 H new ATOM 0 HE3 LYS A 17 2.622 -7.414 -10.175 1.00 0.43 H new ATOM 0 HZ1 LYS A 17 2.280 -9.741 -9.686 1.00 0.93 H new ATOM 0 HZ2 LYS A 17 3.936 -9.429 -9.895 1.00 0.93 H new ATOM 0 HZ3 LYS A 17 3.304 -9.648 -8.334 1.00 0.93 H new ATOM 249 N GLY A 18 7.049 -4.110 -7.835 1.00 0.19 N ATOM 250 CA GLY A 18 7.475 -2.723 -7.737 1.00 0.20 C ATOM 251 C GLY A 18 6.307 -1.781 -7.922 1.00 0.15 C ATOM 252 O GLY A 18 5.184 -2.232 -8.125 1.00 0.15 O ATOM 0 H GLY A 18 6.622 -4.356 -8.728 1.00 0.19 H new ATOM 0 HA2 GLY A 18 7.936 -2.549 -6.765 1.00 0.20 H new ATOM 0 HA3 GLY A 18 8.234 -2.518 -8.492 1.00 0.20 H new ATOM 256 N SER A 19 6.555 -0.477 -7.857 1.00 0.19 N ATOM 257 CA SER A 19 5.510 0.496 -8.092 1.00 0.18 C ATOM 258 C SER A 19 6.035 1.681 -8.876 1.00 0.22 C ATOM 259 O SER A 19 7.088 2.222 -8.557 1.00 0.36 O ATOM 260 CB SER A 19 4.931 0.965 -6.767 1.00 0.21 C ATOM 261 OG SER A 19 4.100 -0.020 -6.204 1.00 1.22 O ATOM 0 H SER A 19 7.469 -0.077 -7.644 1.00 0.19 H new ATOM 0 HA SER A 19 4.726 0.019 -8.681 1.00 0.18 H new ATOM 0 HB2 SER A 19 5.740 1.202 -6.076 1.00 0.21 H new ATOM 0 HB3 SER A 19 4.362 1.882 -6.919 1.00 0.21 H new ATOM 0 HG SER A 19 3.177 0.120 -6.503 1.00 1.22 H new ATOM 267 N ARG A 20 5.308 2.064 -9.910 1.00 0.18 N ATOM 268 CA ARG A 20 5.692 3.201 -10.725 1.00 0.20 C ATOM 269 C ARG A 20 5.257 4.483 -10.042 1.00 0.17 C ATOM 270 O ARG A 20 4.074 4.665 -9.741 1.00 0.16 O ATOM 271 CB ARG A 20 5.068 3.102 -12.111 1.00 0.24 C ATOM 272 CG ARG A 20 5.116 1.699 -12.675 1.00 0.31 C ATOM 273 CD ARG A 20 4.995 1.704 -14.181 1.00 0.40 C ATOM 274 NE ARG A 20 5.115 0.361 -14.749 1.00 0.58 N ATOM 275 CZ ARG A 20 4.079 -0.431 -15.030 1.00 0.97 C ATOM 276 NH1 ARG A 20 2.848 -0.077 -14.675 1.00 2.03 N ATOM 277 NH2 ARG A 20 4.280 -1.601 -15.629 1.00 0.92 N ATOM 0 H ARG A 20 4.447 1.603 -10.205 1.00 0.18 H new ATOM 0 HA ARG A 20 6.776 3.205 -10.840 1.00 0.20 H new ATOM 0 HB2 ARG A 20 4.031 3.434 -12.062 1.00 0.24 H new ATOM 0 HB3 ARG A 20 5.588 3.779 -12.788 1.00 0.24 H new ATOM 0 HG2 ARG A 20 6.052 1.221 -12.386 1.00 0.31 H new ATOM 0 HG3 ARG A 20 4.309 1.105 -12.246 1.00 0.31 H new ATOM 0 HD2 ARG A 20 4.034 2.132 -14.465 1.00 0.40 H new ATOM 0 HD3 ARG A 20 5.768 2.346 -14.604 1.00 0.40 H new ATOM 0 HE ARG A 20 6.052 0.007 -14.943 1.00 0.58 H new ATOM 0 HH11 ARG A 20 2.692 0.804 -14.185 1.00 2.03 H new ATOM 0 HH12 ARG A 20 2.059 -0.686 -14.892 1.00 2.03 H new ATOM 0 HH21 ARG A 20 5.226 -1.893 -15.874 1.00 0.92 H new ATOM 0 HH22 ARG A 20 3.488 -2.207 -15.844 1.00 0.92 H new ATOM 291 N ALA A 21 6.219 5.354 -9.799 1.00 0.17 N ATOM 292 CA ALA A 21 5.998 6.596 -9.079 1.00 0.15 C ATOM 293 C ALA A 21 7.341 7.286 -8.895 1.00 0.17 C ATOM 294 O ALA A 21 8.376 6.618 -8.902 1.00 0.20 O ATOM 295 CB ALA A 21 5.330 6.320 -7.733 1.00 0.17 C ATOM 0 H ALA A 21 7.185 5.219 -10.098 1.00 0.17 H new ATOM 0 HA ALA A 21 5.330 7.246 -9.644 1.00 0.15 H new ATOM 0 HB1 ALA A 21 5.171 7.261 -7.206 1.00 0.17 H new ATOM 0 HB2 ALA A 21 4.370 5.829 -7.897 1.00 0.17 H new ATOM 0 HB3 ALA A 21 5.971 5.673 -7.135 1.00 0.17 H new ATOM 301 N PRO A 22 7.364 8.617 -8.728 1.00 0.17 N ATOM 302 CA PRO A 22 8.613 9.368 -8.685 1.00 0.18 C ATOM 303 C PRO A 22 9.416 9.033 -7.446 1.00 0.16 C ATOM 304 O PRO A 22 8.900 9.103 -6.328 1.00 0.16 O ATOM 305 CB PRO A 22 8.168 10.835 -8.647 1.00 0.21 C ATOM 306 CG PRO A 22 6.718 10.816 -9.004 1.00 0.22 C ATOM 307 CD PRO A 22 6.204 9.495 -8.524 1.00 0.21 C ATOM 0 HA PRO A 22 9.256 9.138 -9.534 1.00 0.18 H new ATOM 0 HB2 PRO A 22 8.324 11.268 -7.659 1.00 0.21 H new ATOM 0 HB3 PRO A 22 8.739 11.438 -9.353 1.00 0.21 H new ATOM 0 HG2 PRO A 22 6.186 11.640 -8.528 1.00 0.22 H new ATOM 0 HG3 PRO A 22 6.577 10.924 -10.079 1.00 0.22 H new ATOM 0 HD2 PRO A 22 5.901 9.532 -7.478 1.00 0.21 H new ATOM 0 HD3 PRO A 22 5.337 9.164 -9.096 1.00 0.21 H new ATOM 315 N THR A 23 10.666 8.650 -7.640 1.00 0.16 N ATOM 316 CA THR A 23 11.534 8.389 -6.519 1.00 0.15 C ATOM 317 C THR A 23 11.930 9.708 -5.880 1.00 0.14 C ATOM 318 O THR A 23 12.741 10.467 -6.419 1.00 0.18 O ATOM 319 CB THR A 23 12.786 7.601 -6.932 1.00 0.17 C ATOM 320 OG1 THR A 23 12.394 6.393 -7.601 1.00 0.18 O ATOM 321 CG2 THR A 23 13.633 7.258 -5.714 1.00 0.17 C ATOM 0 H THR A 23 11.094 8.516 -8.556 1.00 0.16 H new ATOM 0 HA THR A 23 10.991 7.774 -5.802 1.00 0.15 H new ATOM 0 HB THR A 23 13.380 8.219 -7.605 1.00 0.17 H new ATOM 0 HG1 THR A 23 12.788 5.622 -7.141 1.00 0.18 H new ATOM 0 HG21 THR A 23 14.515 6.700 -6.029 1.00 0.17 H new ATOM 0 HG22 THR A 23 13.944 8.177 -5.217 1.00 0.17 H new ATOM 0 HG23 THR A 23 13.048 6.651 -5.023 1.00 0.17 H new ATOM 329 N ILE A 24 11.317 9.977 -4.747 1.00 0.12 N ATOM 330 CA ILE A 24 11.519 11.215 -4.028 1.00 0.12 C ATOM 331 C ILE A 24 12.947 11.315 -3.518 1.00 0.14 C ATOM 332 O ILE A 24 13.402 10.470 -2.746 1.00 0.15 O ATOM 333 CB ILE A 24 10.549 11.316 -2.844 1.00 0.11 C ATOM 334 CG1 ILE A 24 9.142 10.938 -3.286 1.00 0.11 C ATOM 335 CG2 ILE A 24 10.566 12.720 -2.273 1.00 0.13 C ATOM 336 CD1 ILE A 24 8.157 10.860 -2.144 1.00 0.13 C ATOM 0 H ILE A 24 10.661 9.339 -4.297 1.00 0.12 H new ATOM 0 HA ILE A 24 11.329 12.036 -4.719 1.00 0.12 H new ATOM 0 HB ILE A 24 10.867 10.622 -2.066 1.00 0.11 H new ATOM 0 HG12 ILE A 24 8.788 11.670 -4.012 1.00 0.11 H new ATOM 0 HG13 ILE A 24 9.175 9.974 -3.794 1.00 0.11 H new ATOM 0 HG21 ILE A 24 9.874 12.780 -1.433 1.00 0.13 H new ATOM 0 HG22 ILE A 24 11.572 12.962 -1.931 1.00 0.13 H new ATOM 0 HG23 ILE A 24 10.264 13.430 -3.043 1.00 0.13 H new ATOM 0 HD11 ILE A 24 7.175 10.586 -2.529 1.00 0.13 H new ATOM 0 HD12 ILE A 24 8.489 10.108 -1.428 1.00 0.13 H new ATOM 0 HD13 ILE A 24 8.096 11.829 -1.650 1.00 0.13 H new ATOM 348 N GLY A 25 13.645 12.348 -3.955 1.00 0.14 N ATOM 349 CA GLY A 25 15.028 12.523 -3.572 1.00 0.16 C ATOM 350 C GLY A 25 15.927 11.456 -4.166 1.00 0.16 C ATOM 351 O GLY A 25 16.064 11.358 -5.386 1.00 0.24 O ATOM 0 H GLY A 25 13.277 13.072 -4.571 1.00 0.14 H new ATOM 0 HA2 GLY A 25 15.371 13.506 -3.895 1.00 0.16 H new ATOM 0 HA3 GLY A 25 15.108 12.499 -2.485 1.00 0.16 H new ATOM 355 N GLU A 26 16.529 10.654 -3.304 1.00 0.17 N ATOM 356 CA GLU A 26 17.424 9.588 -3.732 1.00 0.16 C ATOM 357 C GLU A 26 17.017 8.268 -3.080 1.00 0.16 C ATOM 358 O GLU A 26 16.398 8.267 -2.012 1.00 0.21 O ATOM 359 CB GLU A 26 18.860 9.933 -3.336 1.00 0.26 C ATOM 360 CG GLU A 26 19.055 10.049 -1.833 1.00 1.20 C ATOM 361 CD GLU A 26 20.462 10.444 -1.452 1.00 1.83 C ATOM 362 OE1 GLU A 26 20.728 11.658 -1.328 1.00 2.41 O ATOM 363 OE2 GLU A 26 21.306 9.546 -1.262 1.00 2.09 O ATOM 0 H GLU A 26 16.413 10.721 -2.293 1.00 0.17 H new ATOM 0 HA GLU A 26 17.360 9.485 -4.815 1.00 0.16 H new ATOM 0 HB2 GLU A 26 19.531 9.167 -3.725 1.00 0.26 H new ATOM 0 HB3 GLU A 26 19.144 10.874 -3.806 1.00 0.26 H new ATOM 0 HG2 GLU A 26 18.356 10.786 -1.437 1.00 1.20 H new ATOM 0 HG3 GLU A 26 18.812 9.095 -1.365 1.00 1.20 H new ATOM 370 N PRO A 27 17.330 7.125 -3.713 1.00 0.13 N ATOM 371 CA PRO A 27 17.124 5.823 -3.104 1.00 0.13 C ATOM 372 C PRO A 27 18.211 5.485 -2.101 1.00 0.14 C ATOM 373 O PRO A 27 19.341 5.961 -2.198 1.00 0.20 O ATOM 374 CB PRO A 27 17.175 4.835 -4.268 1.00 0.14 C ATOM 375 CG PRO A 27 17.324 5.660 -5.503 1.00 0.14 C ATOM 376 CD PRO A 27 17.872 6.994 -5.067 1.00 0.14 C ATOM 0 HA PRO A 27 16.183 5.794 -2.555 1.00 0.13 H new ATOM 0 HB2 PRO A 27 18.011 4.144 -4.157 1.00 0.14 H new ATOM 0 HB3 PRO A 27 16.267 4.233 -4.308 1.00 0.14 H new ATOM 0 HG2 PRO A 27 17.997 5.178 -6.212 1.00 0.14 H new ATOM 0 HG3 PRO A 27 16.365 5.781 -6.006 1.00 0.14 H new ATOM 0 HD2 PRO A 27 18.962 7.007 -5.072 1.00 0.14 H new ATOM 0 HD3 PRO A 27 17.540 7.803 -5.718 1.00 0.14 H new ATOM 384 N VAL A 28 17.862 4.640 -1.154 1.00 0.13 N ATOM 385 CA VAL A 28 18.778 4.255 -0.093 1.00 0.13 C ATOM 386 C VAL A 28 19.188 2.802 -0.251 1.00 0.13 C ATOM 387 O VAL A 28 18.395 1.907 0.011 1.00 0.10 O ATOM 388 CB VAL A 28 18.131 4.410 1.290 1.00 0.13 C ATOM 389 CG1 VAL A 28 19.168 4.833 2.315 1.00 0.16 C ATOM 390 CG2 VAL A 28 16.972 5.389 1.240 1.00 0.14 C ATOM 0 H VAL A 28 16.943 4.202 -1.095 1.00 0.13 H new ATOM 0 HA VAL A 28 19.645 4.911 -0.168 1.00 0.13 H new ATOM 0 HB VAL A 28 17.730 3.443 1.594 1.00 0.13 H new ATOM 0 HG11 VAL A 28 18.693 4.939 3.291 1.00 0.16 H new ATOM 0 HG12 VAL A 28 19.952 4.078 2.373 1.00 0.16 H new ATOM 0 HG13 VAL A 28 19.604 5.787 2.019 1.00 0.16 H new ATOM 0 HG21 VAL A 28 16.531 5.481 2.232 1.00 0.14 H new ATOM 0 HG22 VAL A 28 17.333 6.364 0.911 1.00 0.14 H new ATOM 0 HG23 VAL A 28 16.219 5.026 0.540 1.00 0.14 H new ATOM 400 N PRO A 29 20.412 2.537 -0.689 1.00 0.17 N ATOM 401 CA PRO A 29 20.881 1.176 -0.888 1.00 0.17 C ATOM 402 C PRO A 29 21.401 0.545 0.390 1.00 0.17 C ATOM 403 O PRO A 29 21.868 1.243 1.294 1.00 0.20 O ATOM 404 CB PRO A 29 21.997 1.361 -1.886 1.00 0.20 C ATOM 405 CG PRO A 29 22.600 2.671 -1.507 1.00 0.23 C ATOM 406 CD PRO A 29 21.452 3.528 -1.021 1.00 0.21 C ATOM 0 HA PRO A 29 20.088 0.505 -1.219 1.00 0.17 H new ATOM 0 HB2 PRO A 29 22.726 0.553 -1.825 1.00 0.20 H new ATOM 0 HB3 PRO A 29 21.621 1.375 -2.909 1.00 0.20 H new ATOM 0 HG2 PRO A 29 23.351 2.545 -0.727 1.00 0.23 H new ATOM 0 HG3 PRO A 29 23.099 3.133 -2.359 1.00 0.23 H new ATOM 0 HD2 PRO A 29 21.733 4.124 -0.153 1.00 0.21 H new ATOM 0 HD3 PRO A 29 21.115 4.224 -1.789 1.00 0.21 H new ATOM 414 N ASP A 30 21.300 -0.776 0.453 1.00 0.17 N ATOM 415 CA ASP A 30 21.798 -1.542 1.584 1.00 0.20 C ATOM 416 C ASP A 30 21.058 -1.147 2.865 1.00 0.18 C ATOM 417 O ASP A 30 21.668 -0.831 3.885 1.00 0.28 O ATOM 418 CB ASP A 30 23.312 -1.330 1.718 1.00 0.27 C ATOM 419 CG ASP A 30 23.992 -2.393 2.558 1.00 0.37 C ATOM 420 OD1 ASP A 30 24.368 -3.451 2.013 1.00 0.47 O ATOM 421 OD2 ASP A 30 24.146 -2.176 3.780 1.00 0.48 O ATOM 0 H ASP A 30 20.871 -1.344 -0.278 1.00 0.17 H new ATOM 0 HA ASP A 30 21.613 -2.603 1.416 1.00 0.20 H new ATOM 0 HB2 ASP A 30 23.760 -1.320 0.724 1.00 0.27 H new ATOM 0 HB3 ASP A 30 23.497 -0.352 2.162 1.00 0.27 H new ATOM 426 N VAL A 31 19.727 -1.171 2.801 1.00 0.12 N ATOM 427 CA VAL A 31 18.893 -0.773 3.932 1.00 0.12 C ATOM 428 C VAL A 31 17.808 -1.799 4.160 1.00 0.12 C ATOM 429 O VAL A 31 17.465 -2.567 3.266 1.00 0.13 O ATOM 430 CB VAL A 31 18.246 0.623 3.741 1.00 0.12 C ATOM 431 CG1 VAL A 31 19.315 1.653 3.443 1.00 0.14 C ATOM 432 CG2 VAL A 31 17.166 0.623 2.658 1.00 0.10 C ATOM 0 H VAL A 31 19.203 -1.463 1.976 1.00 0.12 H new ATOM 0 HA VAL A 31 19.549 -0.713 4.800 1.00 0.12 H new ATOM 0 HB VAL A 31 17.748 0.886 4.674 1.00 0.12 H new ATOM 0 HG11 VAL A 31 18.851 2.631 3.310 1.00 0.14 H new ATOM 0 HG12 VAL A 31 20.021 1.696 4.273 1.00 0.14 H new ATOM 0 HG13 VAL A 31 19.844 1.375 2.531 1.00 0.14 H new ATOM 0 HG21 VAL A 31 16.745 1.624 2.564 1.00 0.10 H new ATOM 0 HG22 VAL A 31 17.605 0.323 1.706 1.00 0.10 H new ATOM 0 HG23 VAL A 31 16.377 -0.078 2.931 1.00 0.10 H new ATOM 442 N SER A 32 17.271 -1.803 5.358 1.00 0.16 N ATOM 443 CA SER A 32 16.264 -2.764 5.735 1.00 0.16 C ATOM 444 C SER A 32 14.889 -2.301 5.268 1.00 0.16 C ATOM 445 O SER A 32 14.730 -1.142 4.877 1.00 0.18 O ATOM 446 CB SER A 32 16.294 -2.946 7.249 1.00 0.18 C ATOM 447 OG SER A 32 15.185 -3.692 7.711 1.00 0.19 O ATOM 0 H SER A 32 17.519 -1.143 6.095 1.00 0.16 H new ATOM 0 HA SER A 32 16.471 -3.721 5.257 1.00 0.16 H new ATOM 0 HB2 SER A 32 17.216 -3.451 7.536 1.00 0.18 H new ATOM 0 HB3 SER A 32 16.302 -1.969 7.732 1.00 0.18 H new ATOM 0 HG SER A 32 14.967 -3.420 8.627 1.00 0.19 H new ATOM 453 N LEU A 33 13.897 -3.188 5.298 1.00 0.14 N ATOM 454 CA LEU A 33 12.533 -2.791 4.978 1.00 0.14 C ATOM 455 C LEU A 33 12.097 -1.764 5.992 1.00 0.13 C ATOM 456 O LEU A 33 11.521 -0.736 5.657 1.00 0.13 O ATOM 457 CB LEU A 33 11.569 -3.982 5.021 1.00 0.14 C ATOM 458 CG LEU A 33 12.001 -5.224 4.243 1.00 0.14 C ATOM 459 CD1 LEU A 33 10.832 -6.186 4.097 1.00 0.16 C ATOM 460 CD2 LEU A 33 12.557 -4.837 2.892 1.00 0.14 C ATOM 0 H LEU A 33 14.011 -4.173 5.537 1.00 0.14 H new ATOM 0 HA LEU A 33 12.513 -2.386 3.966 1.00 0.14 H new ATOM 0 HB2 LEU A 33 11.419 -4.265 6.063 1.00 0.14 H new ATOM 0 HB3 LEU A 33 10.603 -3.655 4.637 1.00 0.14 H new ATOM 0 HG LEU A 33 12.791 -5.729 4.799 1.00 0.14 H new ATOM 0 HD11 LEU A 33 11.153 -7.067 3.541 1.00 0.16 H new ATOM 0 HD12 LEU A 33 10.483 -6.488 5.085 1.00 0.16 H new ATOM 0 HD13 LEU A 33 10.021 -5.694 3.561 1.00 0.16 H new ATOM 0 HD21 LEU A 33 12.859 -5.734 2.352 1.00 0.14 H new ATOM 0 HD22 LEU A 33 11.792 -4.311 2.321 1.00 0.14 H new ATOM 0 HD23 LEU A 33 13.421 -4.186 3.027 1.00 0.14 H new ATOM 472 N GLU A 34 12.450 -2.044 7.232 1.00 0.14 N ATOM 473 CA GLU A 34 12.102 -1.192 8.350 1.00 0.14 C ATOM 474 C GLU A 34 12.810 0.150 8.230 1.00 0.14 C ATOM 475 O GLU A 34 12.236 1.197 8.522 1.00 0.19 O ATOM 476 CB GLU A 34 12.484 -1.884 9.658 1.00 0.15 C ATOM 477 CG GLU A 34 12.329 -3.396 9.612 1.00 0.16 C ATOM 478 CD GLU A 34 12.435 -4.028 10.982 1.00 0.23 C ATOM 479 OE1 GLU A 34 11.429 -4.592 11.464 1.00 0.43 O ATOM 480 OE2 GLU A 34 13.519 -3.954 11.590 1.00 0.43 O ATOM 0 H GLU A 34 12.987 -2.871 7.492 1.00 0.14 H new ATOM 0 HA GLU A 34 11.027 -1.013 8.344 1.00 0.14 H new ATOM 0 HB2 GLU A 34 13.518 -1.640 9.900 1.00 0.15 H new ATOM 0 HB3 GLU A 34 11.866 -1.488 10.464 1.00 0.15 H new ATOM 0 HG2 GLU A 34 11.363 -3.646 9.173 1.00 0.16 H new ATOM 0 HG3 GLU A 34 13.094 -3.817 8.960 1.00 0.16 H new ATOM 487 N GLN A 35 14.053 0.110 7.770 1.00 0.13 N ATOM 488 CA GLN A 35 14.832 1.324 7.577 1.00 0.14 C ATOM 489 C GLN A 35 14.283 2.139 6.415 1.00 0.12 C ATOM 490 O GLN A 35 14.204 3.362 6.484 1.00 0.15 O ATOM 491 CB GLN A 35 16.304 0.995 7.336 1.00 0.17 C ATOM 492 CG GLN A 35 17.162 2.235 7.161 1.00 0.24 C ATOM 493 CD GLN A 35 18.622 2.006 7.490 1.00 0.69 C ATOM 494 OE1 GLN A 35 19.501 2.612 6.883 1.00 1.45 O ATOM 495 NE2 GLN A 35 18.893 1.171 8.483 1.00 0.67 N ATOM 0 H GLN A 35 14.543 -0.750 7.524 1.00 0.13 H new ATOM 0 HA GLN A 35 14.754 1.918 8.488 1.00 0.14 H new ATOM 0 HB2 GLN A 35 16.683 0.411 8.175 1.00 0.17 H new ATOM 0 HB3 GLN A 35 16.391 0.370 6.447 1.00 0.17 H new ATOM 0 HG2 GLN A 35 17.079 2.583 6.131 1.00 0.24 H new ATOM 0 HG3 GLN A 35 16.774 3.030 7.798 1.00 0.24 H new ATOM 0 HE21 GLN A 35 18.135 0.686 8.963 1.00 0.67 H new ATOM 0 HE22 GLN A 35 19.860 1.013 8.767 1.00 0.67 H new ATOM 504 N CYS A 36 13.891 1.457 5.353 1.00 0.10 N ATOM 505 CA CYS A 36 13.315 2.128 4.201 1.00 0.09 C ATOM 506 C CYS A 36 11.919 2.642 4.539 1.00 0.10 C ATOM 507 O CYS A 36 11.479 3.679 4.038 1.00 0.10 O ATOM 508 CB CYS A 36 13.263 1.190 3.003 1.00 0.08 C ATOM 509 SG CYS A 36 12.343 1.869 1.586 1.00 0.08 S ATOM 0 H CYS A 36 13.961 0.443 5.264 1.00 0.10 H new ATOM 0 HA CYS A 36 13.948 2.976 3.940 1.00 0.09 H new ATOM 0 HB2 CYS A 36 14.281 0.959 2.688 1.00 0.08 H new ATOM 0 HB3 CYS A 36 12.803 0.250 3.308 1.00 0.08 H new ATOM 514 N ALA A 37 11.226 1.915 5.405 1.00 0.11 N ATOM 515 CA ALA A 37 9.939 2.355 5.911 1.00 0.12 C ATOM 516 C ALA A 37 10.116 3.632 6.719 1.00 0.14 C ATOM 517 O ALA A 37 9.301 4.552 6.643 1.00 0.16 O ATOM 518 CB ALA A 37 9.296 1.258 6.753 1.00 0.14 C ATOM 0 H ALA A 37 11.537 1.015 5.771 1.00 0.11 H new ATOM 0 HA ALA A 37 9.275 2.564 5.072 1.00 0.12 H new ATOM 0 HB1 ALA A 37 8.331 1.603 7.125 1.00 0.14 H new ATOM 0 HB2 ALA A 37 9.151 0.368 6.141 1.00 0.14 H new ATOM 0 HB3 ALA A 37 9.945 1.018 7.595 1.00 0.14 H new ATOM 524 N ALA A 38 11.209 3.685 7.470 1.00 0.15 N ATOM 525 CA ALA A 38 11.571 4.872 8.226 1.00 0.16 C ATOM 526 C ALA A 38 11.979 5.992 7.280 1.00 0.15 C ATOM 527 O ALA A 38 11.790 7.170 7.574 1.00 0.19 O ATOM 528 CB ALA A 38 12.705 4.555 9.188 1.00 0.19 C ATOM 0 H ALA A 38 11.864 2.910 7.570 1.00 0.15 H new ATOM 0 HA ALA A 38 10.706 5.199 8.802 1.00 0.16 H new ATOM 0 HB1 ALA A 38 12.968 5.452 9.749 1.00 0.19 H new ATOM 0 HB2 ALA A 38 12.388 3.774 9.880 1.00 0.19 H new ATOM 0 HB3 ALA A 38 13.573 4.211 8.626 1.00 0.19 H new ATOM 534 N GLN A 39 12.528 5.604 6.138 1.00 0.11 N ATOM 535 CA GLN A 39 12.953 6.545 5.114 1.00 0.10 C ATOM 536 C GLN A 39 11.760 7.305 4.553 1.00 0.10 C ATOM 537 O GLN A 39 11.803 8.524 4.415 1.00 0.11 O ATOM 538 CB GLN A 39 13.681 5.789 3.998 1.00 0.09 C ATOM 539 CG GLN A 39 14.094 6.643 2.814 1.00 0.10 C ATOM 540 CD GLN A 39 14.980 7.812 3.209 1.00 0.13 C ATOM 541 OE1 GLN A 39 16.200 7.682 3.285 1.00 0.43 O ATOM 542 NE2 GLN A 39 14.377 8.963 3.454 1.00 0.47 N ATOM 0 H GLN A 39 12.691 4.627 5.896 1.00 0.11 H new ATOM 0 HA GLN A 39 13.634 7.271 5.559 1.00 0.10 H new ATOM 0 HB2 GLN A 39 14.571 5.320 4.417 1.00 0.09 H new ATOM 0 HB3 GLN A 39 13.035 4.986 3.641 1.00 0.09 H new ATOM 0 HG2 GLN A 39 14.622 6.022 2.091 1.00 0.10 H new ATOM 0 HG3 GLN A 39 13.201 7.022 2.317 1.00 0.10 H new ATOM 0 HE21 GLN A 39 13.362 9.033 3.381 1.00 0.47 H new ATOM 0 HE22 GLN A 39 14.927 9.781 3.716 1.00 0.47 H new ATOM 551 N CYS A 40 10.692 6.587 4.252 1.00 0.10 N ATOM 552 CA CYS A 40 9.486 7.207 3.715 1.00 0.11 C ATOM 553 C CYS A 40 8.820 8.082 4.768 1.00 0.14 C ATOM 554 O CYS A 40 8.039 8.976 4.451 1.00 0.17 O ATOM 555 CB CYS A 40 8.530 6.130 3.209 1.00 0.12 C ATOM 556 SG CYS A 40 6.937 6.743 2.565 1.00 0.16 S ATOM 0 H CYS A 40 10.632 5.575 4.369 1.00 0.10 H new ATOM 0 HA CYS A 40 9.759 7.847 2.876 1.00 0.11 H new ATOM 0 HB2 CYS A 40 9.029 5.566 2.421 1.00 0.12 H new ATOM 0 HB3 CYS A 40 8.330 5.433 4.023 1.00 0.12 H new ATOM 561 N LYS A 41 9.149 7.828 6.026 1.00 0.14 N ATOM 562 CA LYS A 41 8.673 8.666 7.109 1.00 0.18 C ATOM 563 C LYS A 41 9.581 9.880 7.269 1.00 0.19 C ATOM 564 O LYS A 41 9.139 10.948 7.687 1.00 0.27 O ATOM 565 CB LYS A 41 8.611 7.869 8.411 1.00 0.20 C ATOM 566 CG LYS A 41 7.627 6.713 8.370 1.00 0.22 C ATOM 567 CD LYS A 41 7.708 5.868 9.629 1.00 0.28 C ATOM 568 CE LYS A 41 6.791 4.661 9.551 1.00 0.32 C ATOM 569 NZ LYS A 41 5.352 5.039 9.614 1.00 1.15 N ATOM 0 H LYS A 41 9.741 7.051 6.318 1.00 0.14 H new ATOM 0 HA LYS A 41 7.667 9.011 6.870 1.00 0.18 H new ATOM 0 HB2 LYS A 41 9.604 7.482 8.638 1.00 0.20 H new ATOM 0 HB3 LYS A 41 8.337 8.540 9.225 1.00 0.20 H new ATOM 0 HG2 LYS A 41 6.614 7.100 8.255 1.00 0.22 H new ATOM 0 HG3 LYS A 41 7.832 6.090 7.499 1.00 0.22 H new ATOM 0 HD2 LYS A 41 8.735 5.536 9.780 1.00 0.28 H new ATOM 0 HD3 LYS A 41 7.439 6.475 10.493 1.00 0.28 H new ATOM 0 HE2 LYS A 41 6.982 4.122 8.623 1.00 0.32 H new ATOM 0 HE3 LYS A 41 7.021 3.979 10.370 1.00 0.32 H new ATOM 0 HZ1 LYS A 41 4.765 4.186 9.523 1.00 1.15 H new ATOM 0 HZ2 LYS A 41 5.154 5.500 10.525 1.00 1.15 H new ATOM 0 HZ3 LYS A 41 5.131 5.695 8.838 1.00 1.15 H new ATOM 583 N ALA A 42 10.852 9.707 6.915 1.00 0.16 N ATOM 584 CA ALA A 42 11.824 10.781 7.004 1.00 0.17 C ATOM 585 C ALA A 42 11.628 11.788 5.878 1.00 0.16 C ATOM 586 O ALA A 42 11.853 12.985 6.058 1.00 0.19 O ATOM 587 CB ALA A 42 13.233 10.213 6.962 1.00 0.17 C ATOM 0 H ALA A 42 11.229 8.827 6.563 1.00 0.16 H new ATOM 0 HA ALA A 42 11.677 11.299 7.952 1.00 0.17 H new ATOM 0 HB1 ALA A 42 13.955 11.026 7.029 1.00 0.17 H new ATOM 0 HB2 ALA A 42 13.375 9.531 7.800 1.00 0.17 H new ATOM 0 HB3 ALA A 42 13.380 9.674 6.026 1.00 0.17 H new ATOM 593 N VAL A 43 11.201 11.305 4.717 1.00 0.14 N ATOM 594 CA VAL A 43 10.944 12.186 3.589 1.00 0.15 C ATOM 595 C VAL A 43 9.468 12.551 3.522 1.00 0.18 C ATOM 596 O VAL A 43 8.598 11.686 3.414 1.00 0.21 O ATOM 597 CB VAL A 43 11.399 11.574 2.240 1.00 0.13 C ATOM 598 CG1 VAL A 43 10.855 10.169 2.051 1.00 0.13 C ATOM 599 CG2 VAL A 43 10.979 12.463 1.083 1.00 0.16 C ATOM 0 H VAL A 43 11.027 10.317 4.535 1.00 0.14 H new ATOM 0 HA VAL A 43 11.535 13.087 3.753 1.00 0.15 H new ATOM 0 HB VAL A 43 12.487 11.509 2.259 1.00 0.13 H new ATOM 0 HG11 VAL A 43 11.195 9.773 1.094 1.00 0.13 H new ATOM 0 HG12 VAL A 43 11.213 9.529 2.857 1.00 0.13 H new ATOM 0 HG13 VAL A 43 9.765 10.196 2.066 1.00 0.13 H new ATOM 0 HG21 VAL A 43 11.307 12.017 0.144 1.00 0.16 H new ATOM 0 HG22 VAL A 43 9.894 12.564 1.077 1.00 0.16 H new ATOM 0 HG23 VAL A 43 11.434 13.447 1.196 1.00 0.16 H new ATOM 609 N ASP A 44 9.192 13.836 3.606 1.00 0.27 N ATOM 610 CA ASP A 44 7.826 14.320 3.565 1.00 0.34 C ATOM 611 C ASP A 44 7.344 14.402 2.135 1.00 0.32 C ATOM 612 O ASP A 44 7.995 15.005 1.276 1.00 0.39 O ATOM 613 CB ASP A 44 7.707 15.679 4.251 1.00 0.49 C ATOM 614 CG ASP A 44 8.109 15.630 5.712 1.00 0.57 C ATOM 615 OD1 ASP A 44 9.266 15.989 6.027 1.00 0.63 O ATOM 616 OD2 ASP A 44 7.278 15.229 6.554 1.00 0.70 O ATOM 0 H ASP A 44 9.897 14.567 3.703 1.00 0.27 H new ATOM 0 HA ASP A 44 7.196 13.615 4.107 1.00 0.34 H new ATOM 0 HB2 ASP A 44 8.334 16.402 3.729 1.00 0.49 H new ATOM 0 HB3 ASP A 44 6.679 16.033 4.172 1.00 0.49 H new ATOM 621 N GLY A 45 6.207 13.788 1.883 1.00 0.29 N ATOM 622 CA GLY A 45 5.673 13.739 0.546 1.00 0.27 C ATOM 623 C GLY A 45 5.701 12.337 -0.018 1.00 0.22 C ATOM 624 O GLY A 45 5.535 12.138 -1.220 1.00 0.21 O ATOM 0 H GLY A 45 5.639 13.318 2.588 1.00 0.29 H new ATOM 0 HA2 GLY A 45 4.648 14.109 0.550 1.00 0.27 H new ATOM 0 HA3 GLY A 45 6.248 14.402 -0.100 1.00 0.27 H new ATOM 628 N CYS A 46 5.875 11.359 0.859 1.00 0.19 N ATOM 629 CA CYS A 46 5.982 9.968 0.445 1.00 0.15 C ATOM 630 C CYS A 46 4.757 9.197 0.908 1.00 0.14 C ATOM 631 O CYS A 46 4.277 9.382 2.021 1.00 0.19 O ATOM 632 CB CYS A 46 7.253 9.333 1.030 1.00 0.14 C ATOM 633 SG CYS A 46 7.398 7.537 0.756 1.00 0.13 S ATOM 0 H CYS A 46 5.945 11.504 1.866 1.00 0.19 H new ATOM 0 HA CYS A 46 6.041 9.928 -0.643 1.00 0.15 H new ATOM 0 HB2 CYS A 46 8.123 9.825 0.595 1.00 0.14 H new ATOM 0 HB3 CYS A 46 7.280 9.527 2.102 1.00 0.14 H new ATOM 638 N THR A 47 4.231 8.360 0.035 1.00 0.12 N ATOM 639 CA THR A 47 3.056 7.575 0.365 1.00 0.12 C ATOM 640 C THR A 47 3.405 6.103 0.435 1.00 0.12 C ATOM 641 O THR A 47 2.800 5.336 1.181 1.00 0.13 O ATOM 642 CB THR A 47 1.948 7.780 -0.675 1.00 0.13 C ATOM 643 OG1 THR A 47 2.420 7.368 -1.967 1.00 0.18 O ATOM 644 CG2 THR A 47 1.534 9.242 -0.720 1.00 0.12 C ATOM 0 H THR A 47 4.596 8.206 -0.905 1.00 0.12 H new ATOM 0 HA THR A 47 2.697 7.911 1.337 1.00 0.12 H new ATOM 0 HB THR A 47 1.083 7.179 -0.396 1.00 0.13 H new ATOM 0 HG1 THR A 47 2.525 6.394 -1.981 1.00 0.18 H new ATOM 0 HG21 THR A 47 0.747 9.375 -1.462 1.00 0.12 H new ATOM 0 HG22 THR A 47 1.164 9.546 0.259 1.00 0.12 H new ATOM 0 HG23 THR A 47 2.394 9.855 -0.989 1.00 0.12 H new ATOM 652 N HIS A 48 4.392 5.718 -0.350 1.00 0.13 N ATOM 653 CA HIS A 48 4.829 4.335 -0.390 1.00 0.14 C ATOM 654 C HIS A 48 6.258 4.263 -0.869 1.00 0.13 C ATOM 655 O HIS A 48 6.801 5.227 -1.401 1.00 0.20 O ATOM 656 CB HIS A 48 3.928 3.485 -1.295 1.00 0.15 C ATOM 657 CG HIS A 48 4.009 3.830 -2.748 1.00 0.14 C ATOM 658 ND1 HIS A 48 3.424 4.952 -3.290 1.00 0.17 N ATOM 659 CD2 HIS A 48 4.626 3.197 -3.772 1.00 0.16 C ATOM 660 CE1 HIS A 48 3.676 4.992 -4.582 1.00 0.17 C ATOM 661 NE2 HIS A 48 4.405 3.941 -4.903 1.00 0.17 N ATOM 0 H HIS A 48 4.907 6.343 -0.969 1.00 0.13 H new ATOM 0 HA HIS A 48 4.762 3.932 0.620 1.00 0.14 H new ATOM 0 HB2 HIS A 48 4.193 2.435 -1.168 1.00 0.15 H new ATOM 0 HB3 HIS A 48 2.895 3.595 -0.965 1.00 0.15 H new ATOM 0 HD2 HIS A 48 5.188 2.277 -3.710 1.00 0.16 H new ATOM 0 HE1 HIS A 48 3.341 5.758 -5.265 1.00 0.17 H new ATOM 0 HE2 HIS A 48 4.748 3.718 -5.838 1.00 0.17 H new ATOM 669 N PHE A 49 6.837 3.106 -0.707 1.00 0.13 N ATOM 670 CA PHE A 49 8.229 2.886 -1.037 1.00 0.13 C ATOM 671 C PHE A 49 8.372 1.579 -1.791 1.00 0.13 C ATOM 672 O PHE A 49 7.407 0.827 -1.941 1.00 0.18 O ATOM 673 CB PHE A 49 9.074 2.860 0.247 1.00 0.13 C ATOM 674 CG PHE A 49 8.329 2.276 1.420 1.00 0.14 C ATOM 675 CD1 PHE A 49 7.699 1.053 1.316 1.00 0.21 C ATOM 676 CD2 PHE A 49 8.302 2.932 2.637 1.00 0.18 C ATOM 677 CE1 PHE A 49 7.055 0.491 2.399 1.00 0.27 C ATOM 678 CE2 PHE A 49 7.657 2.380 3.719 1.00 0.22 C ATOM 679 CZ PHE A 49 6.886 1.247 3.553 1.00 0.25 C ATOM 0 H PHE A 49 6.360 2.282 -0.341 1.00 0.13 H new ATOM 0 HA PHE A 49 8.584 3.699 -1.670 1.00 0.13 H new ATOM 0 HB2 PHE A 49 9.979 2.279 0.070 1.00 0.13 H new ATOM 0 HB3 PHE A 49 9.389 3.875 0.490 1.00 0.13 H new ATOM 0 HD1 PHE A 49 7.710 0.528 0.372 1.00 0.21 H new ATOM 0 HD2 PHE A 49 8.793 3.889 2.739 1.00 0.18 H new ATOM 0 HE1 PHE A 49 6.687 -0.523 2.351 1.00 0.27 H new ATOM 0 HE2 PHE A 49 7.753 2.831 4.695 1.00 0.22 H new ATOM 0 HZ PHE A 49 6.167 0.954 4.304 1.00 0.25 H new ATOM 689 N THR A 50 9.559 1.325 -2.282 1.00 0.11 N ATOM 690 CA THR A 50 9.860 0.066 -2.921 1.00 0.11 C ATOM 691 C THR A 50 11.239 -0.403 -2.495 1.00 0.10 C ATOM 692 O THR A 50 12.256 0.179 -2.883 1.00 0.11 O ATOM 693 CB THR A 50 9.796 0.174 -4.459 1.00 0.14 C ATOM 694 OG1 THR A 50 8.532 0.733 -4.857 1.00 0.15 O ATOM 695 CG2 THR A 50 9.968 -1.193 -5.106 1.00 0.19 C ATOM 0 H THR A 50 10.340 1.980 -2.251 1.00 0.11 H new ATOM 0 HA THR A 50 9.107 -0.658 -2.609 1.00 0.11 H new ATOM 0 HB THR A 50 10.607 0.823 -4.789 1.00 0.14 H new ATOM 0 HG1 THR A 50 7.854 0.026 -4.879 1.00 0.15 H new ATOM 0 HG21 THR A 50 9.919 -1.091 -6.190 1.00 0.19 H new ATOM 0 HG22 THR A 50 10.935 -1.610 -4.824 1.00 0.19 H new ATOM 0 HG23 THR A 50 9.173 -1.858 -4.768 1.00 0.19 H new ATOM 703 N TYR A 51 11.269 -1.430 -1.664 1.00 0.11 N ATOM 704 CA TYR A 51 12.517 -2.023 -1.252 1.00 0.13 C ATOM 705 C TYR A 51 12.938 -3.032 -2.273 1.00 0.18 C ATOM 706 O TYR A 51 12.284 -4.053 -2.461 1.00 0.41 O ATOM 707 CB TYR A 51 12.419 -2.767 0.078 1.00 0.20 C ATOM 708 CG TYR A 51 11.345 -2.324 1.036 1.00 0.11 C ATOM 709 CD1 TYR A 51 11.447 -1.130 1.706 1.00 0.23 C ATOM 710 CD2 TYR A 51 10.269 -3.152 1.325 1.00 0.09 C ATOM 711 CE1 TYR A 51 10.507 -0.760 2.645 1.00 0.33 C ATOM 712 CE2 TYR A 51 9.316 -2.788 2.248 1.00 0.18 C ATOM 713 CZ TYR A 51 9.447 -1.594 2.910 1.00 0.31 C ATOM 714 OH TYR A 51 8.530 -1.244 3.857 1.00 0.46 O ATOM 0 H TYR A 51 10.439 -1.867 -1.264 1.00 0.11 H new ATOM 0 HA TYR A 51 13.226 -1.202 -1.146 1.00 0.13 H new ATOM 0 HB2 TYR A 51 12.265 -3.824 -0.137 1.00 0.20 H new ATOM 0 HB3 TYR A 51 13.380 -2.681 0.585 1.00 0.20 H new ATOM 0 HD1 TYR A 51 12.276 -0.471 1.495 1.00 0.23 H new ATOM 0 HD2 TYR A 51 10.178 -4.100 0.816 1.00 0.09 H new ATOM 0 HE1 TYR A 51 10.603 0.179 3.169 1.00 0.33 H new ATOM 0 HE2 TYR A 51 8.475 -3.435 2.449 1.00 0.18 H new ATOM 0 HH TYR A 51 8.134 -0.378 3.625 1.00 0.46 H new ATOM 724 N ASN A 52 14.034 -2.774 -2.915 1.00 0.10 N ATOM 725 CA ASN A 52 14.586 -3.756 -3.792 1.00 0.12 C ATOM 726 C ASN A 52 15.375 -4.729 -2.948 1.00 0.13 C ATOM 727 O ASN A 52 16.357 -4.350 -2.342 1.00 0.17 O ATOM 728 CB ASN A 52 15.480 -3.101 -4.817 1.00 0.14 C ATOM 729 CG ASN A 52 15.650 -3.978 -6.041 1.00 0.15 C ATOM 730 OD1 ASN A 52 16.575 -4.775 -6.114 1.00 0.17 O ATOM 731 ND2 ASN A 52 14.736 -3.864 -6.991 1.00 0.16 N ATOM 0 H ASN A 52 14.559 -1.902 -2.850 1.00 0.10 H new ATOM 0 HA ASN A 52 13.793 -4.276 -4.330 1.00 0.12 H new ATOM 0 HB2 ASN A 52 15.057 -2.141 -5.111 1.00 0.14 H new ATOM 0 HB3 ASN A 52 16.455 -2.897 -4.375 1.00 0.14 H new ATOM 0 HD21 ASN A 52 14.788 -4.453 -7.822 1.00 0.16 H new ATOM 0 HD22 ASN A 52 13.980 -3.187 -6.892 1.00 0.16 H new ATOM 738 N ASP A 53 14.899 -5.946 -2.824 1.00 0.12 N ATOM 739 CA ASP A 53 15.576 -6.951 -2.023 1.00 0.14 C ATOM 740 C ASP A 53 16.842 -7.434 -2.723 1.00 0.17 C ATOM 741 O ASP A 53 17.780 -7.905 -2.081 1.00 0.23 O ATOM 742 CB ASP A 53 14.611 -8.103 -1.742 1.00 0.14 C ATOM 743 CG ASP A 53 15.271 -9.288 -1.071 1.00 0.25 C ATOM 744 OD1 ASP A 53 15.466 -9.241 0.159 1.00 0.36 O ATOM 745 OD2 ASP A 53 15.575 -10.278 -1.764 1.00 0.30 O ATOM 0 H ASP A 53 14.040 -6.270 -3.269 1.00 0.12 H new ATOM 0 HA ASP A 53 15.883 -6.516 -1.072 1.00 0.14 H new ATOM 0 HB2 ASP A 53 13.800 -7.742 -1.110 1.00 0.14 H new ATOM 0 HB3 ASP A 53 14.163 -8.429 -2.680 1.00 0.14 H new ATOM 750 N ASP A 54 16.875 -7.264 -4.036 1.00 0.18 N ATOM 751 CA ASP A 54 18.032 -7.652 -4.839 1.00 0.22 C ATOM 752 C ASP A 54 19.158 -6.621 -4.707 1.00 0.25 C ATOM 753 O ASP A 54 20.329 -6.979 -4.583 1.00 0.37 O ATOM 754 CB ASP A 54 17.617 -7.798 -6.307 1.00 0.23 C ATOM 755 CG ASP A 54 18.742 -8.293 -7.192 1.00 0.31 C ATOM 756 OD1 ASP A 54 19.391 -7.456 -7.855 1.00 0.46 O ATOM 757 OD2 ASP A 54 18.998 -9.513 -7.214 1.00 0.31 O ATOM 0 H ASP A 54 16.110 -6.857 -4.574 1.00 0.18 H new ATOM 0 HA ASP A 54 18.404 -8.609 -4.473 1.00 0.22 H new ATOM 0 HB2 ASP A 54 16.777 -8.490 -6.375 1.00 0.23 H new ATOM 0 HB3 ASP A 54 17.267 -6.835 -6.678 1.00 0.23 H new ATOM 762 N SER A 55 18.789 -5.343 -4.715 1.00 0.17 N ATOM 763 CA SER A 55 19.745 -4.248 -4.619 1.00 0.19 C ATOM 764 C SER A 55 19.744 -3.644 -3.222 1.00 0.19 C ATOM 765 O SER A 55 20.430 -2.658 -2.955 1.00 0.24 O ATOM 766 CB SER A 55 19.393 -3.183 -5.649 1.00 0.21 C ATOM 767 OG SER A 55 19.544 -3.673 -6.972 1.00 0.28 O ATOM 0 H SER A 55 17.818 -5.039 -4.788 1.00 0.17 H new ATOM 0 HA SER A 55 20.744 -4.636 -4.817 1.00 0.19 H new ATOM 0 HB2 SER A 55 18.365 -2.853 -5.497 1.00 0.21 H new ATOM 0 HB3 SER A 55 20.032 -2.312 -5.507 1.00 0.21 H new ATOM 0 HG SER A 55 19.309 -2.968 -7.611 1.00 0.28 H new ATOM 773 N LYS A 56 18.973 -4.272 -2.334 1.00 0.16 N ATOM 774 CA LYS A 56 18.728 -3.780 -0.980 1.00 0.16 C ATOM 775 C LYS A 56 18.465 -2.275 -0.943 1.00 0.14 C ATOM 776 O LYS A 56 18.720 -1.622 0.065 1.00 0.17 O ATOM 777 CB LYS A 56 19.904 -4.147 -0.098 1.00 0.21 C ATOM 778 CG LYS A 56 20.201 -5.631 -0.101 1.00 0.29 C ATOM 779 CD LYS A 56 21.611 -5.908 0.363 1.00 0.50 C ATOM 780 CE LYS A 56 21.777 -5.603 1.843 1.00 1.20 C ATOM 781 NZ LYS A 56 23.180 -5.773 2.300 1.00 1.31 N ATOM 0 H LYS A 56 18.495 -5.149 -2.539 1.00 0.16 H new ATOM 0 HA LYS A 56 17.822 -4.256 -0.604 1.00 0.16 H new ATOM 0 HB2 LYS A 56 20.787 -3.604 -0.434 1.00 0.21 H new ATOM 0 HB3 LYS A 56 19.701 -3.824 0.923 1.00 0.21 H new ATOM 0 HG2 LYS A 56 19.494 -6.147 0.548 1.00 0.29 H new ATOM 0 HG3 LYS A 56 20.061 -6.030 -1.106 1.00 0.29 H new ATOM 0 HD2 LYS A 56 21.859 -6.953 0.175 1.00 0.50 H new ATOM 0 HD3 LYS A 56 22.311 -5.305 -0.215 1.00 0.50 H new ATOM 0 HE2 LYS A 56 21.455 -4.580 2.039 1.00 1.20 H new ATOM 0 HE3 LYS A 56 21.127 -6.259 2.422 1.00 1.20 H new ATOM 0 HZ1 LYS A 56 23.198 -5.874 3.335 1.00 1.31 H new ATOM 0 HZ2 LYS A 56 23.587 -6.624 1.862 1.00 1.31 H new ATOM 0 HZ3 LYS A 56 23.738 -4.940 2.024 1.00 1.31 H new ATOM 795 N MET A 57 17.906 -1.740 -2.021 1.00 0.12 N ATOM 796 CA MET A 57 17.777 -0.302 -2.168 1.00 0.13 C ATOM 797 C MET A 57 16.359 0.146 -1.838 1.00 0.13 C ATOM 798 O MET A 57 15.399 -0.600 -2.033 1.00 0.22 O ATOM 799 CB MET A 57 18.165 0.118 -3.585 1.00 0.13 C ATOM 800 CG MET A 57 17.052 0.009 -4.603 1.00 0.14 C ATOM 801 SD MET A 57 17.617 0.318 -6.287 1.00 0.24 S ATOM 802 CE MET A 57 18.526 1.851 -6.084 1.00 1.62 C ATOM 0 H MET A 57 17.537 -2.281 -2.803 1.00 0.12 H new ATOM 0 HA MET A 57 18.454 0.184 -1.466 1.00 0.13 H new ATOM 0 HB2 MET A 57 18.517 1.149 -3.560 1.00 0.13 H new ATOM 0 HB3 MET A 57 19.003 -0.497 -3.915 1.00 0.13 H new ATOM 0 HG2 MET A 57 16.612 -0.987 -4.549 1.00 0.14 H new ATOM 0 HG3 MET A 57 16.265 0.720 -4.352 1.00 0.14 H new ATOM 0 HE1 MET A 57 18.781 2.255 -7.064 1.00 1.62 H new ATOM 0 HE2 MET A 57 17.911 2.570 -5.543 1.00 1.62 H new ATOM 0 HE3 MET A 57 19.440 1.660 -5.522 1.00 1.62 H new ATOM 812 N CYS A 58 16.245 1.353 -1.327 1.00 0.08 N ATOM 813 CA CYS A 58 14.967 1.914 -0.944 1.00 0.07 C ATOM 814 C CYS A 58 14.542 3.005 -1.905 1.00 0.07 C ATOM 815 O CYS A 58 15.169 4.057 -1.968 1.00 0.09 O ATOM 816 CB CYS A 58 15.045 2.496 0.460 1.00 0.08 C ATOM 817 SG CYS A 58 13.536 3.374 0.966 1.00 0.08 S ATOM 0 H CYS A 58 17.038 1.974 -1.165 1.00 0.08 H new ATOM 0 HA CYS A 58 14.232 1.110 -0.970 1.00 0.07 H new ATOM 0 HB2 CYS A 58 15.242 1.691 1.168 1.00 0.08 H new ATOM 0 HB3 CYS A 58 15.890 3.182 0.514 1.00 0.08 H new ATOM 822 N HIS A 59 13.491 2.758 -2.656 1.00 0.08 N ATOM 823 CA HIS A 59 12.936 3.779 -3.526 1.00 0.08 C ATOM 824 C HIS A 59 11.684 4.386 -2.900 1.00 0.08 C ATOM 825 O HIS A 59 10.594 3.832 -3.032 1.00 0.09 O ATOM 826 CB HIS A 59 12.587 3.193 -4.898 1.00 0.10 C ATOM 827 CG HIS A 59 13.685 3.270 -5.916 1.00 0.12 C ATOM 828 ND1 HIS A 59 13.684 4.168 -6.960 1.00 0.16 N ATOM 829 CD2 HIS A 59 14.801 2.525 -6.073 1.00 0.14 C ATOM 830 CE1 HIS A 59 14.745 3.969 -7.713 1.00 0.18 C ATOM 831 NE2 HIS A 59 15.442 2.976 -7.199 1.00 0.17 N ATOM 0 H HIS A 59 13.003 1.863 -2.684 1.00 0.08 H new ATOM 0 HA HIS A 59 13.689 4.557 -3.655 1.00 0.08 H new ATOM 0 HB2 HIS A 59 12.304 2.148 -4.769 1.00 0.10 H new ATOM 0 HB3 HIS A 59 11.713 3.715 -5.288 1.00 0.10 H new ATOM 0 HD2 HIS A 59 15.129 1.722 -5.430 1.00 0.14 H new ATOM 0 HE1 HIS A 59 15.001 4.526 -8.602 1.00 0.18 H new ATOM 0 HE2 HIS A 59 16.314 2.604 -7.576 1.00 0.17 H new ATOM 839 N VAL A 60 11.845 5.511 -2.212 1.00 0.07 N ATOM 840 CA VAL A 60 10.701 6.249 -1.681 1.00 0.07 C ATOM 841 C VAL A 60 9.956 6.908 -2.827 1.00 0.08 C ATOM 842 O VAL A 60 10.565 7.554 -3.676 1.00 0.09 O ATOM 843 CB VAL A 60 11.107 7.329 -0.644 1.00 0.07 C ATOM 844 CG1 VAL A 60 11.130 6.745 0.761 1.00 0.08 C ATOM 845 CG2 VAL A 60 12.464 7.929 -0.987 1.00 0.09 C ATOM 0 H VAL A 60 12.752 5.932 -2.009 1.00 0.07 H new ATOM 0 HA VAL A 60 10.065 5.531 -1.164 1.00 0.07 H new ATOM 0 HB VAL A 60 10.361 8.123 -0.678 1.00 0.07 H new ATOM 0 HG11 VAL A 60 11.417 7.519 1.472 1.00 0.08 H new ATOM 0 HG12 VAL A 60 10.139 6.369 1.015 1.00 0.08 H new ATOM 0 HG13 VAL A 60 11.850 5.928 0.804 1.00 0.08 H new ATOM 0 HG21 VAL A 60 12.726 8.683 -0.245 1.00 0.09 H new ATOM 0 HG22 VAL A 60 13.219 7.143 -0.988 1.00 0.09 H new ATOM 0 HG23 VAL A 60 12.419 8.390 -1.974 1.00 0.09 H new ATOM 855 N LYS A 61 8.649 6.734 -2.867 1.00 0.09 N ATOM 856 CA LYS A 61 7.874 7.178 -4.011 1.00 0.11 C ATOM 857 C LYS A 61 6.660 7.994 -3.592 1.00 0.11 C ATOM 858 O LYS A 61 6.245 7.985 -2.429 1.00 0.11 O ATOM 859 CB LYS A 61 7.457 5.973 -4.848 1.00 0.14 C ATOM 860 CG LYS A 61 8.621 5.352 -5.605 1.00 0.13 C ATOM 861 CD LYS A 61 8.241 4.030 -6.247 1.00 0.22 C ATOM 862 CE LYS A 61 9.391 3.458 -7.071 1.00 0.20 C ATOM 863 NZ LYS A 61 9.363 1.977 -7.136 1.00 1.22 N ATOM 0 H LYS A 61 8.104 6.292 -2.127 1.00 0.09 H new ATOM 0 HA LYS A 61 8.503 7.833 -4.614 1.00 0.11 H new ATOM 0 HB2 LYS A 61 7.010 5.221 -4.197 1.00 0.14 H new ATOM 0 HB3 LYS A 61 6.688 6.278 -5.558 1.00 0.14 H new ATOM 0 HG2 LYS A 61 8.963 6.044 -6.375 1.00 0.13 H new ATOM 0 HG3 LYS A 61 9.456 5.197 -4.922 1.00 0.13 H new ATOM 0 HD2 LYS A 61 7.956 3.317 -5.473 1.00 0.22 H new ATOM 0 HD3 LYS A 61 7.369 4.172 -6.886 1.00 0.22 H new ATOM 0 HE2 LYS A 61 9.346 3.863 -8.082 1.00 0.20 H new ATOM 0 HE3 LYS A 61 10.338 3.781 -6.640 1.00 0.20 H new ATOM 0 HZ1 LYS A 61 10.326 1.618 -7.297 1.00 1.22 H new ATOM 0 HZ2 LYS A 61 8.997 1.597 -6.240 1.00 1.22 H new ATOM 0 HZ3 LYS A 61 8.746 1.675 -7.917 1.00 1.22 H new ATOM 877 N GLU A 62 6.074 8.667 -4.568 1.00 0.10 N ATOM 878 CA GLU A 62 4.991 9.605 -4.314 1.00 0.11 C ATOM 879 C GLU A 62 3.634 8.949 -4.508 1.00 0.12 C ATOM 880 O GLU A 62 3.551 7.816 -4.974 1.00 0.12 O ATOM 881 CB GLU A 62 5.103 10.850 -5.199 1.00 0.12 C ATOM 882 CG GLU A 62 6.475 11.501 -5.160 1.00 0.12 C ATOM 883 CD GLU A 62 6.451 12.954 -5.581 1.00 0.17 C ATOM 884 OE1 GLU A 62 6.872 13.260 -6.715 1.00 0.39 O ATOM 885 OE2 GLU A 62 6.020 13.804 -4.773 1.00 0.40 O ATOM 0 H GLU A 62 6.332 8.581 -5.551 1.00 0.10 H new ATOM 0 HA GLU A 62 5.080 9.917 -3.273 1.00 0.11 H new ATOM 0 HB2 GLU A 62 4.869 10.577 -6.228 1.00 0.12 H new ATOM 0 HB3 GLU A 62 4.355 11.578 -4.884 1.00 0.12 H new ATOM 0 HG2 GLU A 62 6.878 11.428 -4.150 1.00 0.12 H new ATOM 0 HG3 GLU A 62 7.151 10.950 -5.813 1.00 0.12 H new ATOM 892 N GLY A 63 2.597 9.676 -4.115 1.00 0.13 N ATOM 893 CA GLY A 63 1.239 9.153 -3.982 1.00 0.13 C ATOM 894 C GLY A 63 0.784 8.148 -5.026 1.00 0.14 C ATOM 895 O GLY A 63 1.051 8.286 -6.223 1.00 0.18 O ATOM 0 H GLY A 63 2.675 10.664 -3.875 1.00 0.13 H new ATOM 0 HA2 GLY A 63 1.150 8.687 -3.001 1.00 0.13 H new ATOM 0 HA3 GLY A 63 0.548 9.996 -3.999 1.00 0.13 H new ATOM 899 N LYS A 64 0.069 7.135 -4.516 1.00 0.16 N ATOM 900 CA LYS A 64 -0.512 6.053 -5.306 1.00 0.16 C ATOM 901 C LYS A 64 0.531 5.096 -5.865 1.00 0.15 C ATOM 902 O LYS A 64 1.436 5.485 -6.604 1.00 0.17 O ATOM 903 CB LYS A 64 -1.398 6.594 -6.417 1.00 0.19 C ATOM 904 CG LYS A 64 -2.730 7.116 -5.915 1.00 0.30 C ATOM 905 CD LYS A 64 -3.343 8.115 -6.875 1.00 0.73 C ATOM 906 CE LYS A 64 -2.716 9.487 -6.712 1.00 0.54 C ATOM 907 NZ LYS A 64 -3.395 10.511 -7.546 1.00 1.10 N ATOM 0 H LYS A 64 -0.123 7.048 -3.518 1.00 0.16 H new ATOM 0 HA LYS A 64 -1.130 5.475 -4.618 1.00 0.16 H new ATOM 0 HB2 LYS A 64 -0.872 7.396 -6.935 1.00 0.19 H new ATOM 0 HB3 LYS A 64 -1.576 5.805 -7.148 1.00 0.19 H new ATOM 0 HG2 LYS A 64 -3.416 6.281 -5.772 1.00 0.30 H new ATOM 0 HG3 LYS A 64 -2.592 7.586 -4.941 1.00 0.30 H new ATOM 0 HD2 LYS A 64 -3.207 7.769 -7.900 1.00 0.73 H new ATOM 0 HD3 LYS A 64 -4.417 8.180 -6.700 1.00 0.73 H new ATOM 0 HE2 LYS A 64 -2.761 9.784 -5.664 1.00 0.54 H new ATOM 0 HE3 LYS A 64 -1.662 9.439 -6.984 1.00 0.54 H new ATOM 0 HZ1 LYS A 64 -3.103 11.460 -7.237 1.00 1.10 H new ATOM 0 HZ2 LYS A 64 -3.133 10.376 -8.543 1.00 1.10 H new ATOM 0 HZ3 LYS A 64 -4.425 10.415 -7.443 1.00 1.10 H new ATOM 921 N PRO A 65 0.414 3.817 -5.495 1.00 0.17 N ATOM 922 CA PRO A 65 1.271 2.768 -6.002 1.00 0.19 C ATOM 923 C PRO A 65 0.811 2.273 -7.360 1.00 0.22 C ATOM 924 O PRO A 65 -0.381 2.255 -7.665 1.00 0.52 O ATOM 925 CB PRO A 65 1.167 1.666 -4.953 1.00 0.32 C ATOM 926 CG PRO A 65 -0.126 1.895 -4.242 1.00 0.35 C ATOM 927 CD PRO A 65 -0.585 3.299 -4.553 1.00 0.19 C ATOM 0 HA PRO A 65 2.294 3.112 -6.154 1.00 0.19 H new ATOM 0 HB2 PRO A 65 1.187 0.681 -5.419 1.00 0.32 H new ATOM 0 HB3 PRO A 65 2.007 1.707 -4.259 1.00 0.32 H new ATOM 0 HG2 PRO A 65 -0.873 1.169 -4.565 1.00 0.35 H new ATOM 0 HG3 PRO A 65 0.001 1.765 -3.167 1.00 0.35 H new ATOM 0 HD2 PRO A 65 -1.582 3.301 -4.992 1.00 0.19 H new ATOM 0 HD3 PRO A 65 -0.633 3.909 -3.651 1.00 0.19 H new ATOM 935 N ASP A 66 1.772 1.880 -8.161 1.00 0.22 N ATOM 936 CA ASP A 66 1.521 1.445 -9.520 1.00 0.21 C ATOM 937 C ASP A 66 2.282 0.151 -9.750 1.00 0.20 C ATOM 938 O ASP A 66 3.383 0.149 -10.299 1.00 0.19 O ATOM 939 CB ASP A 66 1.978 2.529 -10.491 1.00 0.21 C ATOM 940 CG ASP A 66 1.430 2.347 -11.893 1.00 0.25 C ATOM 941 OD1 ASP A 66 0.495 3.089 -12.266 1.00 0.40 O ATOM 942 OD2 ASP A 66 1.927 1.475 -12.632 1.00 0.34 O ATOM 0 H ASP A 66 2.755 1.852 -7.890 1.00 0.22 H new ATOM 0 HA ASP A 66 0.457 1.272 -9.684 1.00 0.21 H new ATOM 0 HB2 ASP A 66 1.668 3.502 -10.111 1.00 0.21 H new ATOM 0 HB3 ASP A 66 3.067 2.535 -10.532 1.00 0.21 H new ATOM 947 N LEU A 67 1.697 -0.933 -9.280 1.00 0.21 N ATOM 948 CA LEU A 67 2.377 -2.210 -9.183 1.00 0.20 C ATOM 949 C LEU A 67 2.785 -2.792 -10.529 1.00 0.22 C ATOM 950 O LEU A 67 2.032 -2.758 -11.502 1.00 0.27 O ATOM 951 CB LEU A 67 1.490 -3.177 -8.417 1.00 0.23 C ATOM 952 CG LEU A 67 1.241 -2.757 -6.971 1.00 0.26 C ATOM 953 CD1 LEU A 67 0.306 -3.719 -6.276 1.00 0.31 C ATOM 954 CD2 LEU A 67 2.562 -2.666 -6.237 1.00 0.28 C ATOM 0 H LEU A 67 0.731 -0.953 -8.953 1.00 0.21 H new ATOM 0 HA LEU A 67 3.313 -2.045 -8.650 1.00 0.20 H new ATOM 0 HB2 LEU A 67 0.533 -3.266 -8.931 1.00 0.23 H new ATOM 0 HB3 LEU A 67 1.950 -4.165 -8.426 1.00 0.23 H new ATOM 0 HG LEU A 67 0.762 -1.778 -6.968 1.00 0.26 H new ATOM 0 HD11 LEU A 67 0.148 -3.394 -5.248 1.00 0.31 H new ATOM 0 HD12 LEU A 67 -0.649 -3.741 -6.801 1.00 0.31 H new ATOM 0 HD13 LEU A 67 0.744 -4.717 -6.277 1.00 0.31 H new ATOM 0 HD21 LEU A 67 2.384 -2.366 -5.204 1.00 0.28 H new ATOM 0 HD22 LEU A 67 3.055 -3.638 -6.253 1.00 0.28 H new ATOM 0 HD23 LEU A 67 3.199 -1.928 -6.725 1.00 0.28 H new ATOM 966 N TYR A 68 4.000 -3.322 -10.552 1.00 0.19 N ATOM 967 CA TYR A 68 4.558 -3.966 -11.734 1.00 0.21 C ATOM 968 C TYR A 68 5.487 -5.097 -11.321 1.00 0.22 C ATOM 969 O TYR A 68 5.873 -5.196 -10.153 1.00 0.21 O ATOM 970 CB TYR A 68 5.328 -2.962 -12.602 1.00 0.22 C ATOM 971 CG TYR A 68 6.498 -2.298 -11.904 1.00 0.21 C ATOM 972 CD1 TYR A 68 6.387 -1.010 -11.423 1.00 0.22 C ATOM 973 CD2 TYR A 68 7.709 -2.957 -11.726 1.00 0.25 C ATOM 974 CE1 TYR A 68 7.440 -0.391 -10.785 1.00 0.24 C ATOM 975 CE2 TYR A 68 8.769 -2.342 -11.082 1.00 0.28 C ATOM 976 CZ TYR A 68 8.627 -1.059 -10.615 1.00 0.27 C ATOM 977 OH TYR A 68 9.670 -0.439 -9.963 1.00 0.33 O ATOM 0 H TYR A 68 4.629 -3.318 -9.749 1.00 0.19 H new ATOM 0 HA TYR A 68 3.731 -4.366 -12.320 1.00 0.21 H new ATOM 0 HB2 TYR A 68 5.695 -3.475 -13.491 1.00 0.22 H new ATOM 0 HB3 TYR A 68 4.638 -2.190 -12.942 1.00 0.22 H new ATOM 0 HD1 TYR A 68 5.457 -0.476 -11.549 1.00 0.22 H new ATOM 0 HD2 TYR A 68 7.825 -3.965 -12.096 1.00 0.25 H new ATOM 0 HE1 TYR A 68 7.331 0.619 -10.419 1.00 0.24 H new ATOM 0 HE2 TYR A 68 9.702 -2.869 -10.948 1.00 0.28 H new ATOM 0 HH TYR A 68 9.314 0.194 -9.305 1.00 0.33 H new ATOM 987 N ASP A 69 5.859 -5.926 -12.287 1.00 0.28 N ATOM 988 CA ASP A 69 6.760 -7.044 -12.047 1.00 0.31 C ATOM 989 C ASP A 69 8.165 -6.553 -11.725 1.00 0.25 C ATOM 990 O ASP A 69 8.818 -5.915 -12.553 1.00 0.31 O ATOM 991 CB ASP A 69 6.801 -7.964 -13.268 1.00 0.44 C ATOM 992 CG ASP A 69 7.824 -9.072 -13.124 1.00 1.40 C ATOM 993 OD1 ASP A 69 8.927 -8.951 -13.700 1.00 2.32 O ATOM 994 OD2 ASP A 69 7.531 -10.073 -12.438 1.00 1.40 O ATOM 0 H ASP A 69 5.546 -5.843 -13.254 1.00 0.28 H new ATOM 0 HA ASP A 69 6.383 -7.602 -11.190 1.00 0.31 H new ATOM 0 HB2 ASP A 69 5.815 -8.402 -13.422 1.00 0.44 H new ATOM 0 HB3 ASP A 69 7.031 -7.375 -14.156 1.00 0.44 H new ATOM 999 N LEU A 70 8.618 -6.847 -10.518 1.00 0.21 N ATOM 1000 CA LEU A 70 9.938 -6.433 -10.068 1.00 0.18 C ATOM 1001 C LEU A 70 10.603 -7.554 -9.286 1.00 0.17 C ATOM 1002 O LEU A 70 10.255 -7.797 -8.142 1.00 0.17 O ATOM 1003 CB LEU A 70 9.822 -5.171 -9.208 1.00 0.15 C ATOM 1004 CG LEU A 70 11.107 -4.717 -8.510 1.00 0.16 C ATOM 1005 CD1 LEU A 70 12.274 -4.681 -9.486 1.00 0.21 C ATOM 1006 CD2 LEU A 70 10.913 -3.350 -7.877 1.00 0.17 C ATOM 0 H LEU A 70 8.086 -7.375 -9.826 1.00 0.21 H new ATOM 0 HA LEU A 70 10.556 -6.208 -10.937 1.00 0.18 H new ATOM 0 HB2 LEU A 70 9.467 -4.356 -9.839 1.00 0.15 H new ATOM 0 HB3 LEU A 70 9.059 -5.341 -8.448 1.00 0.15 H new ATOM 0 HG LEU A 70 11.337 -5.439 -7.727 1.00 0.16 H new ATOM 0 HD11 LEU A 70 13.174 -4.355 -8.965 1.00 0.21 H new ATOM 0 HD12 LEU A 70 12.434 -5.677 -9.899 1.00 0.21 H new ATOM 0 HD13 LEU A 70 12.051 -3.985 -10.294 1.00 0.21 H new ATOM 0 HD21 LEU A 70 11.836 -3.042 -7.385 1.00 0.17 H new ATOM 0 HD22 LEU A 70 10.654 -2.625 -8.649 1.00 0.17 H new ATOM 0 HD23 LEU A 70 10.110 -3.400 -7.142 1.00 0.17 H new ATOM 1018 N THR A 71 11.547 -8.238 -9.917 1.00 0.26 N ATOM 1019 CA THR A 71 12.269 -9.329 -9.274 1.00 0.29 C ATOM 1020 C THR A 71 12.955 -8.858 -7.994 1.00 0.22 C ATOM 1021 O THR A 71 13.712 -7.886 -8.006 1.00 0.26 O ATOM 1022 CB THR A 71 13.326 -9.917 -10.217 1.00 0.42 C ATOM 1023 OG1 THR A 71 12.728 -10.219 -11.487 1.00 0.48 O ATOM 1024 CG2 THR A 71 13.929 -11.176 -9.619 1.00 0.49 C ATOM 0 H THR A 71 11.833 -8.056 -10.879 1.00 0.26 H new ATOM 0 HA THR A 71 11.536 -10.097 -9.026 1.00 0.29 H new ATOM 0 HB THR A 71 14.119 -9.183 -10.356 1.00 0.42 H new ATOM 0 HG1 THR A 71 13.406 -10.593 -12.087 1.00 0.48 H new ATOM 0 HG21 THR A 71 14.677 -11.580 -10.301 1.00 0.49 H new ATOM 0 HG22 THR A 71 14.399 -10.937 -8.665 1.00 0.49 H new ATOM 0 HG23 THR A 71 13.144 -11.916 -9.461 1.00 0.49 H new ATOM 1032 N GLY A 72 12.676 -9.546 -6.890 1.00 0.17 N ATOM 1033 CA GLY A 72 13.210 -9.136 -5.606 1.00 0.12 C ATOM 1034 C GLY A 72 12.542 -7.873 -5.108 1.00 0.13 C ATOM 1035 O GLY A 72 12.964 -7.273 -4.122 1.00 0.14 O ATOM 0 H GLY A 72 12.089 -10.380 -6.863 1.00 0.17 H new ATOM 0 HA2 GLY A 72 13.068 -9.936 -4.879 1.00 0.12 H new ATOM 0 HA3 GLY A 72 14.284 -8.971 -5.693 1.00 0.12 H new ATOM 1039 N GLY A 73 11.497 -7.467 -5.805 1.00 0.15 N ATOM 1040 CA GLY A 73 10.801 -6.252 -5.464 1.00 0.16 C ATOM 1041 C GLY A 73 9.901 -6.397 -4.266 1.00 0.14 C ATOM 1042 O GLY A 73 9.008 -7.246 -4.229 1.00 0.15 O ATOM 0 H GLY A 73 11.116 -7.964 -6.610 1.00 0.15 H new ATOM 0 HA2 GLY A 73 11.531 -5.466 -5.268 1.00 0.16 H new ATOM 0 HA3 GLY A 73 10.207 -5.930 -6.319 1.00 0.16 H new ATOM 1046 N LYS A 74 10.149 -5.569 -3.288 1.00 0.15 N ATOM 1047 CA LYS A 74 9.295 -5.483 -2.118 1.00 0.13 C ATOM 1048 C LYS A 74 8.694 -4.086 -2.015 1.00 0.12 C ATOM 1049 O LYS A 74 9.341 -3.156 -1.560 1.00 0.12 O ATOM 1050 CB LYS A 74 10.093 -5.795 -0.844 1.00 0.13 C ATOM 1051 CG LYS A 74 10.616 -7.222 -0.733 1.00 0.18 C ATOM 1052 CD LYS A 74 11.544 -7.363 0.470 1.00 0.22 C ATOM 1053 CE LYS A 74 12.110 -8.772 0.617 1.00 0.33 C ATOM 1054 NZ LYS A 74 11.084 -9.763 1.042 1.00 0.38 N ATOM 0 H LYS A 74 10.946 -4.933 -3.272 1.00 0.15 H new ATOM 0 HA LYS A 74 8.495 -6.216 -2.220 1.00 0.13 H new ATOM 0 HB2 LYS A 74 10.940 -5.111 -0.789 1.00 0.13 H new ATOM 0 HB3 LYS A 74 9.461 -5.590 0.020 1.00 0.13 H new ATOM 0 HG2 LYS A 74 9.780 -7.915 -0.637 1.00 0.18 H new ATOM 0 HG3 LYS A 74 11.150 -7.491 -1.644 1.00 0.18 H new ATOM 0 HD2 LYS A 74 12.366 -6.654 0.374 1.00 0.22 H new ATOM 0 HD3 LYS A 74 10.999 -7.099 1.376 1.00 0.22 H new ATOM 0 HE2 LYS A 74 12.541 -9.087 -0.333 1.00 0.33 H new ATOM 0 HE3 LYS A 74 12.920 -8.759 1.346 1.00 0.33 H new ATOM 0 HZ1 LYS A 74 11.522 -10.702 1.126 1.00 0.38 H new ATOM 0 HZ2 LYS A 74 10.689 -9.481 1.962 1.00 0.38 H new ATOM 0 HZ3 LYS A 74 10.322 -9.799 0.335 1.00 0.38 H new ATOM 1068 N THR A 75 7.453 -3.949 -2.434 1.00 0.14 N ATOM 1069 CA THR A 75 6.753 -2.677 -2.344 1.00 0.15 C ATOM 1070 C THR A 75 5.684 -2.746 -1.266 1.00 0.16 C ATOM 1071 O THR A 75 5.199 -3.836 -0.961 1.00 0.22 O ATOM 1072 CB THR A 75 6.103 -2.316 -3.698 1.00 0.19 C ATOM 1073 OG1 THR A 75 7.114 -2.135 -4.691 1.00 0.26 O ATOM 1074 CG2 THR A 75 5.246 -1.056 -3.601 1.00 0.23 C ATOM 0 H THR A 75 6.903 -4.705 -2.843 1.00 0.14 H new ATOM 0 HA THR A 75 7.477 -1.904 -2.086 1.00 0.15 H new ATOM 0 HB THR A 75 5.450 -3.142 -3.980 1.00 0.19 H new ATOM 0 HG1 THR A 75 7.455 -3.009 -4.974 1.00 0.26 H new ATOM 0 HG21 THR A 75 4.808 -0.838 -4.575 1.00 0.23 H new ATOM 0 HG22 THR A 75 4.451 -1.212 -2.872 1.00 0.23 H new ATOM 0 HG23 THR A 75 5.867 -0.217 -3.287 1.00 0.23 H new ATOM 1082 N ALA A 76 5.373 -1.603 -0.661 1.00 0.14 N ATOM 1083 CA ALA A 76 4.265 -1.493 0.268 1.00 0.13 C ATOM 1084 C ALA A 76 3.985 -0.029 0.576 1.00 0.13 C ATOM 1085 O ALA A 76 4.714 0.863 0.124 1.00 0.15 O ATOM 1086 CB ALA A 76 4.555 -2.267 1.542 1.00 0.14 C ATOM 0 H ALA A 76 5.884 -0.732 -0.804 1.00 0.14 H new ATOM 0 HA ALA A 76 3.377 -1.926 -0.193 1.00 0.13 H new ATOM 0 HB1 ALA A 76 3.711 -2.172 2.226 1.00 0.14 H new ATOM 0 HB2 ALA A 76 4.710 -3.319 1.301 1.00 0.14 H new ATOM 0 HB3 ALA A 76 5.452 -1.867 2.015 1.00 0.14 H new ATOM 1092 N SER A 77 2.928 0.211 1.329 1.00 0.14 N ATOM 1093 CA SER A 77 2.586 1.550 1.784 1.00 0.13 C ATOM 1094 C SER A 77 3.429 1.932 2.989 1.00 0.15 C ATOM 1095 O SER A 77 3.943 1.072 3.699 1.00 0.18 O ATOM 1096 CB SER A 77 1.107 1.611 2.161 1.00 0.15 C ATOM 1097 OG SER A 77 0.754 2.870 2.720 1.00 0.27 O ATOM 0 H SER A 77 2.282 -0.513 1.643 1.00 0.14 H new ATOM 0 HA SER A 77 2.785 2.251 0.973 1.00 0.13 H new ATOM 0 HB2 SER A 77 0.499 1.423 1.276 1.00 0.15 H new ATOM 0 HB3 SER A 77 0.882 0.820 2.876 1.00 0.15 H new ATOM 0 HG SER A 77 0.012 2.752 3.349 1.00 0.27 H new ATOM 1103 N ARG A 78 3.542 3.233 3.218 1.00 0.15 N ATOM 1104 CA ARG A 78 4.293 3.763 4.348 1.00 0.18 C ATOM 1105 C ARG A 78 3.648 3.360 5.667 1.00 0.18 C ATOM 1106 O ARG A 78 4.296 3.346 6.714 1.00 0.21 O ATOM 1107 CB ARG A 78 4.359 5.284 4.259 1.00 0.18 C ATOM 1108 CG ARG A 78 2.991 5.948 4.223 1.00 0.14 C ATOM 1109 CD ARG A 78 3.098 7.452 4.386 1.00 0.19 C ATOM 1110 NE ARG A 78 3.907 7.824 5.550 1.00 0.21 N ATOM 1111 CZ ARG A 78 4.698 8.896 5.608 1.00 0.40 C ATOM 1112 NH1 ARG A 78 4.867 9.667 4.548 1.00 0.60 N ATOM 1113 NH2 ARG A 78 5.336 9.187 6.732 1.00 0.43 N ATOM 0 H ARG A 78 3.117 3.949 2.628 1.00 0.15 H new ATOM 0 HA ARG A 78 5.300 3.348 4.312 1.00 0.18 H new ATOM 0 HB2 ARG A 78 4.918 5.666 5.113 1.00 0.18 H new ATOM 0 HB3 ARG A 78 4.914 5.564 3.364 1.00 0.18 H new ATOM 0 HG2 ARG A 78 2.498 5.718 3.278 1.00 0.14 H new ATOM 0 HG3 ARG A 78 2.366 5.539 5.017 1.00 0.14 H new ATOM 0 HD2 ARG A 78 3.538 7.883 3.487 1.00 0.19 H new ATOM 0 HD3 ARG A 78 2.100 7.877 4.488 1.00 0.19 H new ATOM 0 HE ARG A 78 3.862 7.222 6.372 1.00 0.21 H new ATOM 0 HH11 ARG A 78 4.390 9.445 3.674 1.00 0.60 H new ATOM 0 HH12 ARG A 78 5.474 10.485 4.604 1.00 0.60 H new ATOM 0 HH21 ARG A 78 5.222 8.591 7.552 1.00 0.43 H new ATOM 0 HH22 ARG A 78 5.941 10.007 6.777 1.00 0.43 H new ATOM 1127 N SER A 79 2.363 3.054 5.608 1.00 0.17 N ATOM 1128 CA SER A 79 1.621 2.630 6.778 1.00 0.20 C ATOM 1129 C SER A 79 1.034 1.243 6.547 1.00 0.20 C ATOM 1130 O SER A 79 0.125 1.063 5.737 1.00 0.31 O ATOM 1131 CB SER A 79 0.514 3.643 7.096 1.00 0.22 C ATOM 1132 OG SER A 79 -0.236 3.271 8.244 1.00 1.00 O ATOM 0 H SER A 79 1.809 3.093 4.752 1.00 0.17 H new ATOM 0 HA SER A 79 2.297 2.581 7.632 1.00 0.20 H new ATOM 0 HB2 SER A 79 0.957 4.626 7.256 1.00 0.22 H new ATOM 0 HB3 SER A 79 -0.154 3.730 6.239 1.00 0.22 H new ATOM 0 HG SER A 79 0.360 2.862 8.906 1.00 1.00 H new ATOM 1138 N CYS A 80 1.581 0.259 7.244 1.00 0.15 N ATOM 1139 CA CYS A 80 1.067 -1.101 7.180 1.00 0.16 C ATOM 1140 C CYS A 80 -0.074 -1.255 8.172 1.00 0.18 C ATOM 1141 O CYS A 80 -0.771 -2.270 8.193 1.00 0.29 O ATOM 1142 CB CYS A 80 2.174 -2.103 7.512 1.00 0.19 C ATOM 1143 SG CYS A 80 3.800 -1.672 6.824 1.00 0.20 S ATOM 0 H CYS A 80 2.383 0.377 7.863 1.00 0.15 H new ATOM 0 HA CYS A 80 0.707 -1.298 6.170 1.00 0.16 H new ATOM 0 HB2 CYS A 80 2.261 -2.186 8.595 1.00 0.19 H new ATOM 0 HB3 CYS A 80 1.883 -3.085 7.140 1.00 0.19 H new ATOM 1148 N ASP A 81 -0.248 -0.221 8.989 1.00 0.20 N ATOM 1149 CA ASP A 81 -1.234 -0.212 10.059 1.00 0.23 C ATOM 1150 C ASP A 81 -2.633 -0.459 9.519 1.00 0.20 C ATOM 1151 O ASP A 81 -3.066 0.191 8.570 1.00 0.24 O ATOM 1152 CB ASP A 81 -1.208 1.135 10.786 1.00 0.31 C ATOM 1153 CG ASP A 81 0.179 1.526 11.246 1.00 0.99 C ATOM 1154 OD1 ASP A 81 0.953 2.071 10.432 1.00 1.78 O ATOM 1155 OD2 ASP A 81 0.501 1.290 12.433 1.00 1.03 O ATOM 0 H ASP A 81 0.296 0.639 8.925 1.00 0.20 H new ATOM 0 HA ASP A 81 -0.980 -1.013 10.753 1.00 0.23 H new ATOM 0 HB2 ASP A 81 -1.597 1.908 10.123 1.00 0.31 H new ATOM 0 HB3 ASP A 81 -1.873 1.090 11.649 1.00 0.31 H new ATOM 1160 N ARG A 82 -3.339 -1.396 10.128 1.00 0.19 N ATOM 1161 CA ARG A 82 -4.722 -1.662 9.765 1.00 0.18 C ATOM 1162 C ARG A 82 -5.661 -0.999 10.764 1.00 0.18 C ATOM 1163 O ARG A 82 -6.845 -1.326 10.838 1.00 0.29 O ATOM 1164 CB ARG A 82 -4.996 -3.167 9.700 1.00 0.25 C ATOM 1165 CG ARG A 82 -4.277 -3.881 8.565 1.00 0.37 C ATOM 1166 CD ARG A 82 -4.815 -5.296 8.382 1.00 0.53 C ATOM 1167 NE ARG A 82 -4.295 -5.945 7.177 1.00 1.31 N ATOM 1168 CZ ARG A 82 -4.902 -6.963 6.553 1.00 1.74 C ATOM 1169 NH1 ARG A 82 -6.043 -7.456 7.019 1.00 1.65 N ATOM 1170 NH2 ARG A 82 -4.366 -7.496 5.464 1.00 2.65 N ATOM 0 H ARG A 82 -2.978 -1.986 10.877 1.00 0.19 H new ATOM 0 HA ARG A 82 -4.900 -1.243 8.774 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -4.700 -3.621 10.646 1.00 0.25 H new ATOM 0 HB3 ARG A 82 -6.069 -3.326 9.593 1.00 0.25 H new ATOM 0 HG2 ARG A 82 -4.402 -3.318 7.640 1.00 0.37 H new ATOM 0 HG3 ARG A 82 -3.208 -3.919 8.774 1.00 0.37 H new ATOM 0 HD2 ARG A 82 -4.554 -5.895 9.254 1.00 0.53 H new ATOM 0 HD3 ARG A 82 -5.903 -5.263 8.332 1.00 0.53 H new ATOM 0 HE ARG A 82 -3.417 -5.601 6.789 1.00 1.31 H new ATOM 0 HH11 ARG A 82 -6.465 -7.059 7.859 1.00 1.65 H new ATOM 0 HH12 ARG A 82 -6.498 -8.231 6.537 1.00 1.65 H new ATOM 0 HH21 ARG A 82 -3.487 -7.131 5.097 1.00 2.65 H new ATOM 0 HH22 ARG A 82 -4.833 -8.271 4.993 1.00 2.65 H new ATOM 1184 N SER A 83 -5.116 -0.051 11.517 1.00 0.18 N ATOM 1185 CA SER A 83 -5.851 0.628 12.578 1.00 0.26 C ATOM 1186 C SER A 83 -7.077 1.378 12.052 1.00 0.23 C ATOM 1187 O SER A 83 -8.120 1.399 12.701 1.00 0.27 O ATOM 1188 CB SER A 83 -4.917 1.597 13.301 1.00 0.40 C ATOM 1189 OG SER A 83 -3.766 0.924 13.789 1.00 1.28 O ATOM 0 H SER A 83 -4.153 0.269 11.410 1.00 0.18 H new ATOM 0 HA SER A 83 -6.214 -0.133 13.269 1.00 0.26 H new ATOM 0 HB2 SER A 83 -4.616 2.394 12.621 1.00 0.40 H new ATOM 0 HB3 SER A 83 -5.446 2.068 14.129 1.00 0.40 H new ATOM 0 HG SER A 83 -3.182 1.564 14.246 1.00 1.28 H new ATOM 1195 N CYS A 84 -6.964 1.977 10.872 1.00 0.20 N ATOM 1196 CA CYS A 84 -8.055 2.781 10.337 1.00 0.20 C ATOM 1197 C CYS A 84 -8.891 1.972 9.352 1.00 0.18 C ATOM 1198 O CYS A 84 -9.809 2.500 8.720 1.00 0.22 O ATOM 1199 CB CYS A 84 -7.532 4.063 9.666 1.00 0.25 C ATOM 1200 SG CYS A 84 -6.578 3.814 8.129 1.00 0.28 S ATOM 0 H CYS A 84 -6.139 1.922 10.275 1.00 0.20 H new ATOM 0 HA CYS A 84 -8.688 3.073 11.175 1.00 0.20 H new ATOM 0 HB2 CYS A 84 -8.382 4.709 9.445 1.00 0.25 H new ATOM 0 HB3 CYS A 84 -6.904 4.596 10.380 1.00 0.25 H new ATOM 1205 N PHE A 85 -8.587 0.684 9.237 1.00 0.16 N ATOM 1206 CA PHE A 85 -9.293 -0.178 8.305 1.00 0.16 C ATOM 1207 C PHE A 85 -10.545 -0.769 8.942 1.00 0.17 C ATOM 1208 O PHE A 85 -10.704 -0.779 10.164 1.00 0.21 O ATOM 1209 CB PHE A 85 -8.403 -1.331 7.829 1.00 0.15 C ATOM 1210 CG PHE A 85 -7.177 -0.930 7.053 1.00 0.15 C ATOM 1211 CD1 PHE A 85 -6.960 0.380 6.656 1.00 0.17 C ATOM 1212 CD2 PHE A 85 -6.235 -1.887 6.721 1.00 0.16 C ATOM 1213 CE1 PHE A 85 -5.822 0.721 5.947 1.00 0.18 C ATOM 1214 CE2 PHE A 85 -5.101 -1.552 6.013 1.00 0.18 C ATOM 1215 CZ PHE A 85 -4.892 -0.250 5.627 1.00 0.18 C ATOM 0 H PHE A 85 -7.858 0.218 9.777 1.00 0.16 H new ATOM 0 HA PHE A 85 -9.572 0.443 7.454 1.00 0.16 H new ATOM 0 HB2 PHE A 85 -8.088 -1.906 8.700 1.00 0.15 H new ATOM 0 HB3 PHE A 85 -9.003 -1.996 7.208 1.00 0.15 H new ATOM 0 HD1 PHE A 85 -7.686 1.141 6.902 1.00 0.17 H new ATOM 0 HD2 PHE A 85 -6.391 -2.913 7.021 1.00 0.16 H new ATOM 0 HE1 PHE A 85 -5.661 1.745 5.644 1.00 0.18 H new ATOM 0 HE2 PHE A 85 -4.377 -2.313 5.762 1.00 0.18 H new ATOM 0 HZ PHE A 85 -4.002 0.014 5.074 1.00 0.18 H new ATOM 1225 N GLU A 86 -11.417 -1.257 8.086 1.00 0.16 N ATOM 1226 CA GLU A 86 -12.596 -1.997 8.481 1.00 0.17 C ATOM 1227 C GLU A 86 -12.493 -3.394 7.884 1.00 0.16 C ATOM 1228 O GLU A 86 -12.493 -3.542 6.665 1.00 0.17 O ATOM 1229 CB GLU A 86 -13.863 -1.319 7.947 1.00 0.20 C ATOM 1230 CG GLU A 86 -13.937 0.179 8.187 1.00 0.34 C ATOM 1231 CD GLU A 86 -15.248 0.767 7.697 1.00 1.22 C ATOM 1232 OE1 GLU A 86 -15.225 1.543 6.716 1.00 2.18 O ATOM 1233 OE2 GLU A 86 -16.305 0.456 8.285 1.00 1.18 O ATOM 0 H GLU A 86 -11.324 -1.148 7.076 1.00 0.16 H new ATOM 0 HA GLU A 86 -12.656 -2.036 9.569 1.00 0.17 H new ATOM 0 HB2 GLU A 86 -13.932 -1.504 6.875 1.00 0.20 H new ATOM 0 HB3 GLU A 86 -14.731 -1.789 8.409 1.00 0.20 H new ATOM 0 HG2 GLU A 86 -13.824 0.382 9.252 1.00 0.34 H new ATOM 0 HG3 GLU A 86 -13.107 0.669 7.679 1.00 0.34 H new ATOM 1240 N GLN A 87 -12.368 -4.415 8.707 1.00 0.17 N ATOM 1241 CA GLN A 87 -12.265 -5.761 8.178 1.00 0.18 C ATOM 1242 C GLN A 87 -13.631 -6.413 8.048 1.00 0.14 C ATOM 1243 O GLN A 87 -14.557 -6.113 8.806 1.00 0.16 O ATOM 1244 CB GLN A 87 -11.333 -6.623 9.021 1.00 0.27 C ATOM 1245 CG GLN A 87 -9.893 -6.140 8.972 1.00 0.36 C ATOM 1246 CD GLN A 87 -8.877 -7.195 9.379 1.00 0.55 C ATOM 1247 OE1 GLN A 87 -7.822 -6.871 9.929 1.00 0.70 O ATOM 1248 NE2 GLN A 87 -9.160 -8.455 9.081 1.00 0.87 N ATOM 0 H GLN A 87 -12.336 -4.343 9.724 1.00 0.17 H new ATOM 0 HA GLN A 87 -11.835 -5.681 7.180 1.00 0.18 H new ATOM 0 HB2 GLN A 87 -11.678 -6.622 10.055 1.00 0.27 H new ATOM 0 HB3 GLN A 87 -11.380 -7.654 8.670 1.00 0.27 H new ATOM 0 HG2 GLN A 87 -9.667 -5.803 7.960 1.00 0.36 H new ATOM 0 HG3 GLN A 87 -9.787 -5.275 9.627 1.00 0.36 H new ATOM 0 HE21 GLN A 87 -10.043 -8.685 8.626 1.00 0.87 H new ATOM 0 HE22 GLN A 87 -8.495 -9.194 9.307 1.00 0.87 H new ATOM 1257 N HIS A 88 -13.732 -7.295 7.059 1.00 0.14 N ATOM 1258 CA HIS A 88 -14.954 -8.031 6.754 1.00 0.16 C ATOM 1259 C HIS A 88 -16.050 -7.103 6.262 1.00 0.15 C ATOM 1260 O HIS A 88 -17.185 -7.162 6.729 1.00 0.18 O ATOM 1261 CB HIS A 88 -15.479 -8.818 7.949 1.00 0.20 C ATOM 1262 CG HIS A 88 -14.456 -9.663 8.645 1.00 0.25 C ATOM 1263 ND1 HIS A 88 -14.433 -9.837 10.013 1.00 0.42 N ATOM 1264 CD2 HIS A 88 -13.423 -10.388 8.159 1.00 0.37 C ATOM 1265 CE1 HIS A 88 -13.433 -10.633 10.336 1.00 0.43 C ATOM 1266 NE2 HIS A 88 -12.806 -10.980 9.230 1.00 0.37 N ATOM 0 H HIS A 88 -12.956 -7.522 6.438 1.00 0.14 H new ATOM 0 HA HIS A 88 -14.685 -8.736 5.967 1.00 0.16 H new ATOM 0 HB2 HIS A 88 -15.902 -8.118 8.669 1.00 0.20 H new ATOM 0 HB3 HIS A 88 -16.293 -9.461 7.613 1.00 0.20 H new ATOM 0 HD2 HIS A 88 -13.138 -10.483 7.122 1.00 0.37 H new ATOM 0 HE1 HIS A 88 -13.172 -10.947 11.336 1.00 0.43 H new ATOM 0 HE2 HIS A 88 -11.991 -11.592 9.179 1.00 0.37 H new ATOM 1274 N VAL A 89 -15.712 -6.254 5.320 1.00 0.14 N ATOM 1275 CA VAL A 89 -16.667 -5.322 4.759 1.00 0.14 C ATOM 1276 C VAL A 89 -16.209 -4.873 3.383 1.00 0.15 C ATOM 1277 O VAL A 89 -15.032 -4.588 3.170 1.00 0.17 O ATOM 1278 CB VAL A 89 -16.876 -4.115 5.695 1.00 0.16 C ATOM 1279 CG1 VAL A 89 -15.583 -3.769 6.390 1.00 0.15 C ATOM 1280 CG2 VAL A 89 -17.414 -2.905 4.948 1.00 0.20 C ATOM 0 H VAL A 89 -14.775 -6.188 4.922 1.00 0.14 H new ATOM 0 HA VAL A 89 -17.627 -5.828 4.656 1.00 0.14 H new ATOM 0 HB VAL A 89 -17.621 -4.398 6.439 1.00 0.16 H new ATOM 0 HG11 VAL A 89 -15.741 -2.915 7.049 1.00 0.15 H new ATOM 0 HG12 VAL A 89 -15.246 -4.623 6.977 1.00 0.15 H new ATOM 0 HG13 VAL A 89 -14.826 -3.518 5.647 1.00 0.15 H new ATOM 0 HG21 VAL A 89 -17.547 -2.077 5.644 1.00 0.20 H new ATOM 0 HG22 VAL A 89 -16.708 -2.615 4.169 1.00 0.20 H new ATOM 0 HG23 VAL A 89 -18.373 -3.155 4.494 1.00 0.20 H new ATOM 1290 N SER A 90 -17.137 -4.844 2.450 1.00 0.17 N ATOM 1291 CA SER A 90 -16.811 -4.553 1.073 1.00 0.20 C ATOM 1292 C SER A 90 -17.664 -3.415 0.536 1.00 0.22 C ATOM 1293 O SER A 90 -18.881 -3.394 0.727 1.00 0.21 O ATOM 1294 CB SER A 90 -17.015 -5.811 0.225 1.00 0.22 C ATOM 1295 OG SER A 90 -16.671 -5.592 -1.130 1.00 0.30 O ATOM 0 H SER A 90 -18.127 -5.019 2.623 1.00 0.17 H new ATOM 0 HA SER A 90 -15.768 -4.242 1.021 1.00 0.20 H new ATOM 0 HB2 SER A 90 -16.409 -6.623 0.627 1.00 0.22 H new ATOM 0 HB3 SER A 90 -18.056 -6.128 0.289 1.00 0.22 H new ATOM 0 HG SER A 90 -16.812 -6.416 -1.641 1.00 0.30 H new ATOM 1301 N TYR A 91 -17.017 -2.448 -0.093 1.00 0.28 N ATOM 1302 CA TYR A 91 -17.725 -1.451 -0.869 1.00 0.28 C ATOM 1303 C TYR A 91 -17.427 -1.700 -2.342 1.00 0.32 C ATOM 1304 O TYR A 91 -16.268 -1.656 -2.759 1.00 0.38 O ATOM 1305 CB TYR A 91 -17.286 -0.032 -0.486 1.00 0.33 C ATOM 1306 CG TYR A 91 -17.303 0.267 1.003 1.00 0.33 C ATOM 1307 CD1 TYR A 91 -16.257 -0.130 1.821 1.00 0.32 C ATOM 1308 CD2 TYR A 91 -18.378 0.924 1.596 1.00 0.39 C ATOM 1309 CE1 TYR A 91 -16.277 0.115 3.180 1.00 0.36 C ATOM 1310 CE2 TYR A 91 -18.401 1.176 2.956 1.00 0.43 C ATOM 1311 CZ TYR A 91 -17.320 0.861 3.725 1.00 0.39 C ATOM 1312 OH TYR A 91 -17.363 1.017 5.099 1.00 0.46 O ATOM 0 H TYR A 91 -16.003 -2.335 -0.080 1.00 0.28 H new ATOM 0 HA TYR A 91 -18.794 -1.532 -0.669 1.00 0.28 H new ATOM 0 HB2 TYR A 91 -16.277 0.134 -0.863 1.00 0.33 H new ATOM 0 HB3 TYR A 91 -17.936 0.682 -0.992 1.00 0.33 H new ATOM 0 HD1 TYR A 91 -15.410 -0.641 1.387 1.00 0.32 H new ATOM 0 HD2 TYR A 91 -19.208 1.242 0.983 1.00 0.39 H new ATOM 0 HE1 TYR A 91 -15.491 -0.268 3.814 1.00 0.36 H new ATOM 0 HE2 TYR A 91 -19.274 1.622 3.408 1.00 0.43 H new ATOM 0 HH TYR A 91 -16.461 1.197 5.436 1.00 0.46 H new ATOM 1322 N GLU A 92 -18.459 -1.951 -3.132 1.00 0.30 N ATOM 1323 CA GLU A 92 -18.264 -2.274 -4.539 1.00 0.36 C ATOM 1324 C GLU A 92 -19.213 -1.482 -5.422 1.00 0.32 C ATOM 1325 O GLU A 92 -18.792 -0.875 -6.403 1.00 0.32 O ATOM 1326 CB GLU A 92 -18.444 -3.776 -4.782 1.00 0.45 C ATOM 1327 CG GLU A 92 -17.392 -4.634 -4.097 1.00 0.51 C ATOM 1328 CD GLU A 92 -17.656 -6.119 -4.236 1.00 0.68 C ATOM 1329 OE1 GLU A 92 -18.542 -6.639 -3.525 1.00 0.91 O ATOM 1330 OE2 GLU A 92 -16.989 -6.776 -5.066 1.00 1.12 O ATOM 0 H GLU A 92 -19.433 -1.938 -2.828 1.00 0.30 H new ATOM 0 HA GLU A 92 -17.243 -1.998 -4.802 1.00 0.36 H new ATOM 0 HB2 GLU A 92 -19.431 -4.077 -4.431 1.00 0.45 H new ATOM 0 HB3 GLU A 92 -18.415 -3.968 -5.855 1.00 0.45 H new ATOM 0 HG2 GLU A 92 -16.413 -4.404 -4.518 1.00 0.51 H new ATOM 0 HG3 GLU A 92 -17.353 -4.375 -3.039 1.00 0.51 H new ATOM 1337 N GLY A 93 -20.488 -1.472 -5.053 1.00 0.31 N ATOM 1338 CA GLY A 93 -21.487 -0.755 -5.827 1.00 0.30 C ATOM 1339 C GLY A 93 -21.267 0.742 -5.819 1.00 0.28 C ATOM 1340 O GLY A 93 -21.885 1.473 -6.592 1.00 0.28 O ATOM 0 H GLY A 93 -20.851 -1.950 -4.228 1.00 0.31 H new ATOM 0 HA2 GLY A 93 -21.471 -1.115 -6.856 1.00 0.30 H new ATOM 0 HA3 GLY A 93 -22.477 -0.975 -5.428 1.00 0.30 H new ATOM 1344 N ALA A 94 -20.400 1.199 -4.931 1.00 0.28 N ATOM 1345 CA ALA A 94 -20.071 2.606 -4.836 1.00 0.28 C ATOM 1346 C ALA A 94 -19.286 3.044 -6.067 1.00 0.29 C ATOM 1347 O ALA A 94 -18.445 2.292 -6.567 1.00 0.33 O ATOM 1348 CB ALA A 94 -19.272 2.864 -3.567 1.00 0.28 C ATOM 0 H ALA A 94 -19.909 0.607 -4.261 1.00 0.28 H new ATOM 0 HA ALA A 94 -20.991 3.189 -4.792 1.00 0.28 H new ATOM 0 HB1 ALA A 94 -19.027 3.924 -3.500 1.00 0.28 H new ATOM 0 HB2 ALA A 94 -19.864 2.573 -2.699 1.00 0.28 H new ATOM 0 HB3 ALA A 94 -18.352 2.280 -3.591 1.00 0.28 H new ATOM 1354 N PRO A 95 -19.567 4.254 -6.578 1.00 0.33 N ATOM 1355 CA PRO A 95 -18.871 4.804 -7.744 1.00 0.37 C ATOM 1356 C PRO A 95 -17.359 4.720 -7.596 1.00 0.32 C ATOM 1357 O PRO A 95 -16.785 5.276 -6.656 1.00 0.31 O ATOM 1358 CB PRO A 95 -19.324 6.263 -7.769 1.00 0.47 C ATOM 1359 CG PRO A 95 -20.663 6.248 -7.122 1.00 0.52 C ATOM 1360 CD PRO A 95 -20.593 5.182 -6.064 1.00 0.43 C ATOM 0 HA PRO A 95 -19.103 4.257 -8.658 1.00 0.37 H new ATOM 0 HB2 PRO A 95 -18.628 6.904 -7.227 1.00 0.47 H new ATOM 0 HB3 PRO A 95 -19.380 6.644 -8.789 1.00 0.47 H new ATOM 0 HG2 PRO A 95 -20.897 7.219 -6.685 1.00 0.52 H new ATOM 0 HG3 PRO A 95 -21.446 6.028 -7.848 1.00 0.52 H new ATOM 0 HD2 PRO A 95 -20.311 5.595 -5.096 1.00 0.43 H new ATOM 0 HD3 PRO A 95 -21.554 4.685 -5.931 1.00 0.43 H new ATOM 1368 N ASP A 96 -16.722 4.006 -8.515 1.00 0.33 N ATOM 1369 CA ASP A 96 -15.283 3.831 -8.479 1.00 0.33 C ATOM 1370 C ASP A 96 -14.589 5.123 -8.825 1.00 0.35 C ATOM 1371 O ASP A 96 -14.999 5.844 -9.733 1.00 0.48 O ATOM 1372 CB ASP A 96 -14.816 2.738 -9.438 1.00 0.43 C ATOM 1373 CG ASP A 96 -15.934 2.153 -10.271 1.00 0.51 C ATOM 1374 OD1 ASP A 96 -16.523 1.136 -9.851 1.00 0.71 O ATOM 1375 OD2 ASP A 96 -16.219 2.700 -11.353 1.00 0.59 O ATOM 0 H ASP A 96 -17.184 3.539 -9.295 1.00 0.33 H new ATOM 0 HA ASP A 96 -15.023 3.529 -7.464 1.00 0.33 H new ATOM 0 HB2 ASP A 96 -14.055 3.148 -10.102 1.00 0.43 H new ATOM 0 HB3 ASP A 96 -14.344 1.940 -8.865 1.00 0.43 H new ATOM 1380 N VAL A 97 -13.541 5.408 -8.091 1.00 0.28 N ATOM 1381 CA VAL A 97 -12.794 6.633 -8.274 1.00 0.29 C ATOM 1382 C VAL A 97 -11.405 6.330 -8.817 1.00 0.29 C ATOM 1383 O VAL A 97 -10.730 7.205 -9.359 1.00 0.32 O ATOM 1384 CB VAL A 97 -12.701 7.398 -6.942 1.00 0.28 C ATOM 1385 CG1 VAL A 97 -14.092 7.779 -6.467 1.00 0.30 C ATOM 1386 CG2 VAL A 97 -12.002 6.551 -5.891 1.00 0.24 C ATOM 0 H VAL A 97 -13.182 4.802 -7.353 1.00 0.28 H new ATOM 0 HA VAL A 97 -13.315 7.259 -8.999 1.00 0.29 H new ATOM 0 HB VAL A 97 -12.118 8.305 -7.099 1.00 0.28 H new ATOM 0 HG11 VAL A 97 -14.019 8.320 -5.524 1.00 0.30 H new ATOM 0 HG12 VAL A 97 -14.570 8.413 -7.213 1.00 0.30 H new ATOM 0 HG13 VAL A 97 -14.687 6.877 -6.323 1.00 0.30 H new ATOM 0 HG21 VAL A 97 -11.945 7.107 -4.955 1.00 0.24 H new ATOM 0 HG22 VAL A 97 -12.564 5.631 -5.733 1.00 0.24 H new ATOM 0 HG23 VAL A 97 -10.995 6.307 -6.231 1.00 0.24 H new ATOM 1396 N MET A 98 -10.997 5.073 -8.684 1.00 0.27 N ATOM 1397 CA MET A 98 -9.700 4.619 -9.168 1.00 0.27 C ATOM 1398 C MET A 98 -9.828 3.203 -9.698 1.00 0.27 C ATOM 1399 O MET A 98 -10.785 2.498 -9.369 1.00 0.27 O ATOM 1400 CB MET A 98 -8.662 4.638 -8.045 1.00 0.26 C ATOM 1401 CG MET A 98 -8.436 6.001 -7.423 1.00 0.36 C ATOM 1402 SD MET A 98 -7.434 7.081 -8.460 1.00 1.01 S ATOM 1403 CE MET A 98 -5.867 6.214 -8.426 1.00 0.65 C ATOM 0 H MET A 98 -11.554 4.343 -8.239 1.00 0.27 H new ATOM 0 HA MET A 98 -9.373 5.292 -9.961 1.00 0.27 H new ATOM 0 HB2 MET A 98 -8.976 3.944 -7.265 1.00 0.26 H new ATOM 0 HB3 MET A 98 -7.714 4.270 -8.437 1.00 0.26 H new ATOM 0 HG2 MET A 98 -9.400 6.475 -7.236 1.00 0.36 H new ATOM 0 HG3 MET A 98 -7.949 5.878 -6.456 1.00 0.36 H new ATOM 0 HE1 MET A 98 -5.073 6.884 -8.755 1.00 0.65 H new ATOM 0 HE2 MET A 98 -5.659 5.877 -7.410 1.00 0.65 H new ATOM 0 HE3 MET A 98 -5.914 5.352 -9.092 1.00 0.65 H new ATOM 1413 N THR A 99 -8.868 2.792 -10.508 1.00 0.31 N ATOM 1414 CA THR A 99 -8.832 1.443 -11.028 1.00 0.32 C ATOM 1415 C THR A 99 -8.356 0.481 -9.947 1.00 0.28 C ATOM 1416 O THR A 99 -7.421 0.790 -9.206 1.00 0.30 O ATOM 1417 CB THR A 99 -7.883 1.353 -12.233 1.00 0.38 C ATOM 1418 OG1 THR A 99 -8.232 2.338 -13.216 1.00 0.45 O ATOM 1419 CG2 THR A 99 -7.931 -0.030 -12.853 1.00 0.41 C ATOM 0 H THR A 99 -8.097 3.383 -10.820 1.00 0.31 H new ATOM 0 HA THR A 99 -9.839 1.173 -11.345 1.00 0.32 H new ATOM 0 HB THR A 99 -6.869 1.543 -11.881 1.00 0.38 H new ATOM 0 HG1 THR A 99 -7.619 2.271 -13.978 1.00 0.45 H new ATOM 0 HG21 THR A 99 -7.251 -0.071 -13.704 1.00 0.41 H new ATOM 0 HG22 THR A 99 -7.630 -0.771 -12.113 1.00 0.41 H new ATOM 0 HG23 THR A 99 -8.946 -0.243 -13.188 1.00 0.41 H new ATOM 1427 N ALA A 100 -9.014 -0.670 -9.852 1.00 0.27 N ATOM 1428 CA ALA A 100 -8.642 -1.690 -8.883 1.00 0.24 C ATOM 1429 C ALA A 100 -7.192 -2.105 -9.041 1.00 0.24 C ATOM 1430 O ALA A 100 -6.622 -2.041 -10.133 1.00 0.34 O ATOM 1431 CB ALA A 100 -9.519 -2.914 -9.022 1.00 0.25 C ATOM 0 H ALA A 100 -9.811 -0.919 -10.438 1.00 0.27 H new ATOM 0 HA ALA A 100 -8.780 -1.252 -7.895 1.00 0.24 H new ATOM 0 HB1 ALA A 100 -9.220 -3.661 -8.287 1.00 0.25 H new ATOM 0 HB2 ALA A 100 -10.560 -2.637 -8.855 1.00 0.25 H new ATOM 0 HB3 ALA A 100 -9.410 -3.328 -10.024 1.00 0.25 H new ATOM 1437 N MET A 101 -6.613 -2.564 -7.952 1.00 0.17 N ATOM 1438 CA MET A 101 -5.228 -2.973 -7.944 1.00 0.17 C ATOM 1439 C MET A 101 -5.104 -4.369 -7.372 1.00 0.14 C ATOM 1440 O MET A 101 -5.968 -4.819 -6.642 1.00 0.15 O ATOM 1441 CB MET A 101 -4.400 -1.999 -7.122 1.00 0.21 C ATOM 1442 CG MET A 101 -2.909 -2.298 -7.143 1.00 0.26 C ATOM 1443 SD MET A 101 -2.133 -1.903 -8.723 1.00 1.07 S ATOM 1444 CE MET A 101 -2.358 -0.124 -8.772 1.00 0.90 C ATOM 0 H MET A 101 -7.087 -2.663 -7.054 1.00 0.17 H new ATOM 0 HA MET A 101 -4.855 -2.975 -8.968 1.00 0.17 H new ATOM 0 HB2 MET A 101 -4.565 -0.989 -7.497 1.00 0.21 H new ATOM 0 HB3 MET A 101 -4.751 -2.017 -6.090 1.00 0.21 H new ATOM 0 HG2 MET A 101 -2.419 -1.730 -6.352 1.00 0.26 H new ATOM 0 HG3 MET A 101 -2.753 -3.354 -6.922 1.00 0.26 H new ATOM 0 HE1 MET A 101 -1.626 0.317 -9.448 1.00 0.90 H new ATOM 0 HE2 MET A 101 -3.363 0.106 -9.125 1.00 0.90 H new ATOM 0 HE3 MET A 101 -2.222 0.288 -7.772 1.00 0.90 H new ATOM 1454 N VAL A 102 -4.045 -5.050 -7.723 1.00 0.15 N ATOM 1455 CA VAL A 102 -3.782 -6.385 -7.208 1.00 0.14 C ATOM 1456 C VAL A 102 -2.506 -6.374 -6.369 1.00 0.14 C ATOM 1457 O VAL A 102 -1.417 -6.154 -6.892 1.00 0.18 O ATOM 1458 CB VAL A 102 -3.647 -7.408 -8.350 1.00 0.15 C ATOM 1459 CG1 VAL A 102 -3.279 -8.785 -7.811 1.00 0.16 C ATOM 1460 CG2 VAL A 102 -4.931 -7.475 -9.162 1.00 0.16 C ATOM 0 H VAL A 102 -3.337 -4.704 -8.371 1.00 0.15 H new ATOM 0 HA VAL A 102 -4.627 -6.681 -6.586 1.00 0.14 H new ATOM 0 HB VAL A 102 -2.841 -7.078 -9.005 1.00 0.15 H new ATOM 0 HG11 VAL A 102 -3.190 -9.488 -8.639 1.00 0.16 H new ATOM 0 HG12 VAL A 102 -2.328 -8.726 -7.281 1.00 0.16 H new ATOM 0 HG13 VAL A 102 -4.055 -9.127 -7.126 1.00 0.16 H new ATOM 0 HG21 VAL A 102 -4.816 -8.203 -9.965 1.00 0.16 H new ATOM 0 HG22 VAL A 102 -5.755 -7.775 -8.515 1.00 0.16 H new ATOM 0 HG23 VAL A 102 -5.143 -6.495 -9.589 1.00 0.16 H new ATOM 1470 N THR A 103 -2.646 -6.605 -5.072 1.00 0.15 N ATOM 1471 CA THR A 103 -1.526 -6.481 -4.149 1.00 0.14 C ATOM 1472 C THR A 103 -1.638 -7.486 -3.004 1.00 0.15 C ATOM 1473 O THR A 103 -2.729 -7.951 -2.683 1.00 0.18 O ATOM 1474 CB THR A 103 -1.452 -5.048 -3.580 1.00 0.15 C ATOM 1475 OG1 THR A 103 -0.408 -4.942 -2.602 1.00 0.18 O ATOM 1476 CG2 THR A 103 -2.777 -4.641 -2.963 1.00 0.19 C ATOM 0 H THR A 103 -3.525 -6.880 -4.634 1.00 0.15 H new ATOM 0 HA THR A 103 -0.613 -6.694 -4.706 1.00 0.14 H new ATOM 0 HB THR A 103 -1.230 -4.374 -4.407 1.00 0.15 H new ATOM 0 HG1 THR A 103 0.179 -4.192 -2.831 1.00 0.18 H new ATOM 0 HG21 THR A 103 -2.699 -3.628 -2.569 1.00 0.19 H new ATOM 0 HG22 THR A 103 -3.558 -4.676 -3.722 1.00 0.19 H new ATOM 0 HG23 THR A 103 -3.027 -5.327 -2.153 1.00 0.19 H new ATOM 1484 N SER A 104 -0.508 -7.821 -2.380 1.00 0.16 N ATOM 1485 CA SER A 104 -0.499 -8.815 -1.322 1.00 0.19 C ATOM 1486 C SER A 104 -0.728 -8.165 0.045 1.00 0.18 C ATOM 1487 O SER A 104 -0.473 -8.775 1.080 1.00 0.26 O ATOM 1488 CB SER A 104 0.839 -9.556 -1.331 1.00 0.25 C ATOM 1489 OG SER A 104 1.353 -9.651 -2.651 1.00 1.03 O ATOM 0 H SER A 104 0.405 -7.418 -2.592 1.00 0.16 H new ATOM 0 HA SER A 104 -1.311 -9.520 -1.501 1.00 0.19 H new ATOM 0 HB2 SER A 104 1.553 -9.034 -0.694 1.00 0.25 H new ATOM 0 HB3 SER A 104 0.710 -10.554 -0.913 1.00 0.25 H new ATOM 0 HG SER A 104 2.210 -10.127 -2.635 1.00 1.03 H new ATOM 1495 N GLN A 105 -1.188 -6.916 0.045 1.00 0.15 N ATOM 1496 CA GLN A 105 -1.419 -6.183 1.289 1.00 0.14 C ATOM 1497 C GLN A 105 -2.477 -5.106 1.107 1.00 0.13 C ATOM 1498 O GLN A 105 -2.568 -4.483 0.056 1.00 0.15 O ATOM 1499 CB GLN A 105 -0.122 -5.530 1.775 1.00 0.15 C ATOM 1500 CG GLN A 105 0.634 -4.787 0.685 1.00 0.15 C ATOM 1501 CD GLN A 105 1.925 -5.477 0.314 1.00 0.24 C ATOM 1502 OE1 GLN A 105 2.867 -4.840 -0.126 1.00 0.67 O ATOM 1503 NE2 GLN A 105 1.987 -6.785 0.513 1.00 0.21 N ATOM 0 H GLN A 105 -1.408 -6.390 -0.801 1.00 0.15 H new ATOM 0 HA GLN A 105 -1.770 -6.902 2.030 1.00 0.14 H new ATOM 0 HB2 GLN A 105 -0.356 -4.835 2.581 1.00 0.15 H new ATOM 0 HB3 GLN A 105 0.526 -6.299 2.195 1.00 0.15 H new ATOM 0 HG2 GLN A 105 0.002 -4.702 -0.199 1.00 0.15 H new ATOM 0 HG3 GLN A 105 0.850 -3.773 1.021 1.00 0.15 H new ATOM 0 HE21 GLN A 105 1.178 -7.284 0.883 1.00 0.21 H new ATOM 0 HE22 GLN A 105 2.844 -7.294 0.296 1.00 0.21 H new ATOM 1512 N SER A 106 -3.261 -4.879 2.154 1.00 0.13 N ATOM 1513 CA SER A 106 -4.272 -3.831 2.147 1.00 0.13 C ATOM 1514 C SER A 106 -3.615 -2.462 2.261 1.00 0.14 C ATOM 1515 O SER A 106 -4.238 -1.431 2.001 1.00 0.15 O ATOM 1516 CB SER A 106 -5.245 -4.051 3.305 1.00 0.17 C ATOM 1517 OG SER A 106 -4.548 -4.408 4.487 1.00 1.31 O ATOM 0 H SER A 106 -3.215 -5.411 3.023 1.00 0.13 H new ATOM 0 HA SER A 106 -4.821 -3.871 1.206 1.00 0.13 H new ATOM 0 HB2 SER A 106 -5.823 -3.143 3.478 1.00 0.17 H new ATOM 0 HB3 SER A 106 -5.955 -4.836 3.045 1.00 0.17 H new ATOM 0 HG SER A 106 -5.188 -4.543 5.216 1.00 1.31 H new ATOM 1523 N ALA A 107 -2.347 -2.479 2.653 1.00 0.14 N ATOM 1524 CA ALA A 107 -1.558 -1.271 2.807 1.00 0.16 C ATOM 1525 C ALA A 107 -1.501 -0.466 1.513 1.00 0.14 C ATOM 1526 O ALA A 107 -1.671 0.751 1.519 1.00 0.15 O ATOM 1527 CB ALA A 107 -0.159 -1.643 3.247 1.00 0.20 C ATOM 0 H ALA A 107 -1.839 -3.336 2.873 1.00 0.14 H new ATOM 0 HA ALA A 107 -2.034 -0.645 3.562 1.00 0.16 H new ATOM 0 HB1 ALA A 107 0.438 -0.739 3.364 1.00 0.20 H new ATOM 0 HB2 ALA A 107 -0.206 -2.173 4.198 1.00 0.20 H new ATOM 0 HB3 ALA A 107 0.300 -2.286 2.496 1.00 0.20 H new ATOM 1533 N ASP A 108 -1.275 -1.158 0.405 1.00 0.14 N ATOM 1534 CA ASP A 108 -1.143 -0.524 -0.893 1.00 0.15 C ATOM 1535 C ASP A 108 -2.398 0.257 -1.253 1.00 0.13 C ATOM 1536 O ASP A 108 -2.320 1.391 -1.725 1.00 0.14 O ATOM 1537 CB ASP A 108 -0.878 -1.592 -1.941 1.00 0.17 C ATOM 1538 CG ASP A 108 0.552 -1.615 -2.430 1.00 0.51 C ATOM 1539 OD1 ASP A 108 1.242 -0.586 -2.262 1.00 0.83 O ATOM 1540 OD2 ASP A 108 0.985 -2.643 -2.986 1.00 0.98 O ATOM 0 H ASP A 108 -1.179 -2.173 0.384 1.00 0.14 H new ATOM 0 HA ASP A 108 -0.311 0.179 -0.858 1.00 0.15 H new ATOM 0 HB2 ASP A 108 -1.127 -2.568 -1.525 1.00 0.17 H new ATOM 0 HB3 ASP A 108 -1.542 -1.429 -2.790 1.00 0.17 H new ATOM 1545 N CYS A 109 -3.559 -0.342 -1.008 1.00 0.11 N ATOM 1546 CA CYS A 109 -4.824 0.309 -1.317 1.00 0.11 C ATOM 1547 C CYS A 109 -5.008 1.542 -0.434 1.00 0.10 C ATOM 1548 O CYS A 109 -5.671 2.506 -0.825 1.00 0.11 O ATOM 1549 CB CYS A 109 -6.005 -0.650 -1.111 1.00 0.13 C ATOM 1550 SG CYS A 109 -5.602 -2.423 -1.286 1.00 0.14 S ATOM 0 H CYS A 109 -3.649 -1.272 -0.599 1.00 0.11 H new ATOM 0 HA CYS A 109 -4.800 0.609 -2.365 1.00 0.11 H new ATOM 0 HB2 CYS A 109 -6.419 -0.484 -0.116 1.00 0.13 H new ATOM 0 HB3 CYS A 109 -6.787 -0.398 -1.828 1.00 0.13 H new ATOM 1555 N GLN A 110 -4.404 1.508 0.754 1.00 0.10 N ATOM 1556 CA GLN A 110 -4.452 2.636 1.677 1.00 0.10 C ATOM 1557 C GLN A 110 -3.720 3.826 1.076 1.00 0.10 C ATOM 1558 O GLN A 110 -4.302 4.891 0.880 1.00 0.13 O ATOM 1559 CB GLN A 110 -3.814 2.256 3.016 1.00 0.12 C ATOM 1560 CG GLN A 110 -3.604 3.430 3.959 1.00 0.13 C ATOM 1561 CD GLN A 110 -2.526 3.151 4.984 1.00 0.26 C ATOM 1562 OE1 GLN A 110 -1.352 3.423 4.740 1.00 1.33 O ATOM 1563 NE2 GLN A 110 -2.913 2.621 6.134 1.00 0.80 N ATOM 0 H GLN A 110 -3.874 0.707 1.098 1.00 0.10 H new ATOM 0 HA GLN A 110 -5.494 2.904 1.849 1.00 0.10 H new ATOM 0 HB2 GLN A 110 -4.444 1.516 3.509 1.00 0.12 H new ATOM 0 HB3 GLN A 110 -2.852 1.780 2.826 1.00 0.12 H new ATOM 0 HG2 GLN A 110 -3.335 4.314 3.382 1.00 0.13 H new ATOM 0 HG3 GLN A 110 -4.540 3.656 4.470 1.00 0.13 H new ATOM 0 HE21 GLN A 110 -3.899 2.412 6.293 1.00 0.80 H new ATOM 0 HE22 GLN A 110 -2.226 2.422 6.861 1.00 0.80 H new ATOM 1572 N ALA A 111 -2.447 3.621 0.761 1.00 0.10 N ATOM 1573 CA ALA A 111 -1.616 4.672 0.193 1.00 0.11 C ATOM 1574 C ALA A 111 -2.163 5.126 -1.155 1.00 0.11 C ATOM 1575 O ALA A 111 -1.994 6.281 -1.543 1.00 0.13 O ATOM 1576 CB ALA A 111 -0.180 4.196 0.055 1.00 0.15 C ATOM 0 H ALA A 111 -1.967 2.731 0.891 1.00 0.10 H new ATOM 0 HA ALA A 111 -1.634 5.526 0.870 1.00 0.11 H new ATOM 0 HB1 ALA A 111 0.428 4.994 -0.371 1.00 0.15 H new ATOM 0 HB2 ALA A 111 0.210 3.927 1.037 1.00 0.15 H new ATOM 0 HB3 ALA A 111 -0.147 3.325 -0.600 1.00 0.15 H new ATOM 1582 N ALA A 112 -2.806 4.209 -1.871 1.00 0.10 N ATOM 1583 CA ALA A 112 -3.449 4.539 -3.133 1.00 0.13 C ATOM 1584 C ALA A 112 -4.554 5.561 -2.927 1.00 0.13 C ATOM 1585 O ALA A 112 -4.512 6.665 -3.468 1.00 0.19 O ATOM 1586 CB ALA A 112 -4.024 3.285 -3.765 1.00 0.17 C ATOM 0 H ALA A 112 -2.894 3.231 -1.596 1.00 0.10 H new ATOM 0 HA ALA A 112 -2.698 4.969 -3.796 1.00 0.13 H new ATOM 0 HB1 ALA A 112 -4.504 3.541 -4.710 1.00 0.17 H new ATOM 0 HB2 ALA A 112 -3.223 2.569 -3.947 1.00 0.17 H new ATOM 0 HB3 ALA A 112 -4.759 2.843 -3.093 1.00 0.17 H new ATOM 1592 N CYS A 113 -5.530 5.195 -2.117 1.00 0.12 N ATOM 1593 CA CYS A 113 -6.713 6.012 -1.952 1.00 0.14 C ATOM 1594 C CYS A 113 -6.419 7.271 -1.147 1.00 0.13 C ATOM 1595 O CYS A 113 -6.941 8.346 -1.451 1.00 0.15 O ATOM 1596 CB CYS A 113 -7.817 5.210 -1.281 1.00 0.17 C ATOM 1597 SG CYS A 113 -9.430 6.044 -1.301 1.00 0.25 S ATOM 0 H CYS A 113 -5.525 4.338 -1.564 1.00 0.12 H new ATOM 0 HA CYS A 113 -7.043 6.320 -2.944 1.00 0.14 H new ATOM 0 HB2 CYS A 113 -7.909 4.245 -1.780 1.00 0.17 H new ATOM 0 HB3 CYS A 113 -7.533 5.009 -0.248 1.00 0.17 H new ATOM 1602 N ALA A 114 -5.568 7.148 -0.137 1.00 0.14 N ATOM 1603 CA ALA A 114 -5.273 8.265 0.750 1.00 0.16 C ATOM 1604 C ALA A 114 -4.520 9.372 0.026 1.00 0.17 C ATOM 1605 O ALA A 114 -4.570 10.535 0.422 1.00 0.25 O ATOM 1606 CB ALA A 114 -4.484 7.793 1.958 1.00 0.18 C ATOM 0 H ALA A 114 -5.070 6.287 0.088 1.00 0.14 H new ATOM 0 HA ALA A 114 -6.224 8.676 1.088 1.00 0.16 H new ATOM 0 HB1 ALA A 114 -4.273 8.641 2.609 1.00 0.18 H new ATOM 0 HB2 ALA A 114 -5.066 7.051 2.505 1.00 0.18 H new ATOM 0 HB3 ALA A 114 -3.546 7.347 1.628 1.00 0.18 H new ATOM 1612 N ALA A 115 -3.832 9.012 -1.045 1.00 0.16 N ATOM 1613 CA ALA A 115 -3.049 9.981 -1.789 1.00 0.19 C ATOM 1614 C ALA A 115 -3.897 10.710 -2.817 1.00 0.22 C ATOM 1615 O ALA A 115 -3.582 11.835 -3.206 1.00 0.31 O ATOM 1616 CB ALA A 115 -1.882 9.301 -2.474 1.00 0.18 C ATOM 0 H ALA A 115 -3.800 8.062 -1.416 1.00 0.16 H new ATOM 0 HA ALA A 115 -2.671 10.716 -1.078 1.00 0.19 H new ATOM 0 HB1 ALA A 115 -1.304 10.041 -3.028 1.00 0.18 H new ATOM 0 HB2 ALA A 115 -1.245 8.829 -1.725 1.00 0.18 H new ATOM 0 HB3 ALA A 115 -2.256 8.543 -3.162 1.00 0.18 H new ATOM 1622 N ASP A 116 -4.977 10.078 -3.250 1.00 0.22 N ATOM 1623 CA ASP A 116 -5.778 10.623 -4.328 1.00 0.26 C ATOM 1624 C ASP A 116 -6.840 11.575 -3.789 1.00 0.28 C ATOM 1625 O ASP A 116 -7.464 11.311 -2.759 1.00 0.31 O ATOM 1626 CB ASP A 116 -6.447 9.506 -5.118 1.00 0.30 C ATOM 1627 CG ASP A 116 -6.904 9.986 -6.474 1.00 0.40 C ATOM 1628 OD1 ASP A 116 -8.086 10.377 -6.608 1.00 0.44 O ATOM 1629 OD2 ASP A 116 -6.097 9.937 -7.418 1.00 0.51 O ATOM 0 H ASP A 116 -5.315 9.193 -2.872 1.00 0.22 H new ATOM 0 HA ASP A 116 -5.112 11.177 -4.989 1.00 0.26 H new ATOM 0 HB2 ASP A 116 -5.750 8.677 -5.240 1.00 0.30 H new ATOM 0 HB3 ASP A 116 -7.301 9.124 -4.559 1.00 0.30 H new ATOM 1634 N PRO A 117 -7.061 12.696 -4.493 1.00 0.30 N ATOM 1635 CA PRO A 117 -8.013 13.725 -4.079 1.00 0.34 C ATOM 1636 C PRO A 117 -9.457 13.343 -4.385 1.00 0.35 C ATOM 1637 O PRO A 117 -10.390 13.899 -3.804 1.00 0.40 O ATOM 1638 CB PRO A 117 -7.597 14.929 -4.920 1.00 0.38 C ATOM 1639 CG PRO A 117 -7.067 14.329 -6.173 1.00 0.36 C ATOM 1640 CD PRO A 117 -6.390 13.050 -5.758 1.00 0.31 C ATOM 0 HA PRO A 117 -7.989 13.897 -3.003 1.00 0.34 H new ATOM 0 HB2 PRO A 117 -8.443 15.587 -5.120 1.00 0.38 H new ATOM 0 HB3 PRO A 117 -6.840 15.527 -4.413 1.00 0.38 H new ATOM 0 HG2 PRO A 117 -7.870 14.134 -6.884 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -6.364 15.003 -6.663 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -6.513 12.270 -6.509 1.00 0.31 H new ATOM 0 HD3 PRO A 117 -5.318 13.191 -5.617 1.00 0.31 H new ATOM 1648 N SER A 118 -9.641 12.392 -5.292 1.00 0.36 N ATOM 1649 CA SER A 118 -10.980 11.989 -5.688 1.00 0.40 C ATOM 1650 C SER A 118 -11.359 10.683 -5.011 1.00 0.35 C ATOM 1651 O SER A 118 -12.465 10.173 -5.185 1.00 0.32 O ATOM 1652 CB SER A 118 -11.086 11.864 -7.213 1.00 0.46 C ATOM 1653 OG SER A 118 -10.243 10.850 -7.731 1.00 1.13 O ATOM 0 H SER A 118 -8.887 11.891 -5.762 1.00 0.36 H new ATOM 0 HA SER A 118 -11.680 12.760 -5.367 1.00 0.40 H new ATOM 0 HB2 SER A 118 -12.119 11.649 -7.486 1.00 0.46 H new ATOM 0 HB3 SER A 118 -10.827 12.818 -7.672 1.00 0.46 H new ATOM 0 HG SER A 118 -9.309 11.066 -7.528 1.00 1.13 H new ATOM 1659 N CYS A 119 -10.447 10.161 -4.206 1.00 0.35 N ATOM 1660 CA CYS A 119 -10.678 8.899 -3.538 1.00 0.31 C ATOM 1661 C CYS A 119 -11.034 9.129 -2.077 1.00 0.32 C ATOM 1662 O CYS A 119 -10.426 9.964 -1.404 1.00 0.37 O ATOM 1663 CB CYS A 119 -9.453 7.991 -3.647 1.00 0.31 C ATOM 1664 SG CYS A 119 -9.810 6.240 -3.285 1.00 0.31 S ATOM 0 H CYS A 119 -9.545 10.593 -4.003 1.00 0.35 H new ATOM 0 HA CYS A 119 -11.515 8.404 -4.030 1.00 0.31 H new ATOM 0 HB2 CYS A 119 -9.041 8.069 -4.653 1.00 0.31 H new ATOM 0 HB3 CYS A 119 -8.685 8.346 -2.960 1.00 0.31 H new ATOM 1669 N GLU A 120 -12.038 8.404 -1.603 1.00 0.28 N ATOM 1670 CA GLU A 120 -12.490 8.517 -0.223 1.00 0.29 C ATOM 1671 C GLU A 120 -12.198 7.238 0.529 1.00 0.27 C ATOM 1672 O GLU A 120 -11.547 7.249 1.575 1.00 0.32 O ATOM 1673 CB GLU A 120 -13.995 8.786 -0.175 1.00 0.29 C ATOM 1674 CG GLU A 120 -14.423 9.986 -0.989 1.00 0.31 C ATOM 1675 CD GLU A 120 -13.819 11.278 -0.477 1.00 0.36 C ATOM 1676 OE1 GLU A 120 -14.022 11.600 0.715 1.00 0.53 O ATOM 1677 OE2 GLU A 120 -13.143 11.979 -1.257 1.00 0.70 O ATOM 0 H GLU A 120 -12.559 7.726 -2.159 1.00 0.28 H new ATOM 0 HA GLU A 120 -11.957 9.346 0.242 1.00 0.29 H new ATOM 0 HB2 GLU A 120 -14.525 7.905 -0.537 1.00 0.29 H new ATOM 0 HB3 GLU A 120 -14.296 8.935 0.862 1.00 0.29 H new ATOM 0 HG2 GLU A 120 -14.131 9.839 -2.029 1.00 0.31 H new ATOM 0 HG3 GLU A 120 -15.510 10.064 -0.971 1.00 0.31 H new ATOM 1684 N ILE A 121 -12.692 6.134 -0.008 1.00 0.21 N ATOM 1685 CA ILE A 121 -12.565 4.852 0.660 1.00 0.19 C ATOM 1686 C ILE A 121 -11.979 3.793 -0.277 1.00 0.15 C ATOM 1687 O ILE A 121 -11.849 4.008 -1.485 1.00 0.15 O ATOM 1688 CB ILE A 121 -13.936 4.360 1.197 1.00 0.21 C ATOM 1689 CG1 ILE A 121 -14.824 3.833 0.069 1.00 0.21 C ATOM 1690 CG2 ILE A 121 -14.664 5.479 1.920 1.00 0.27 C ATOM 1691 CD1 ILE A 121 -14.772 2.336 -0.106 1.00 0.21 C ATOM 0 H ILE A 121 -13.183 6.101 -0.902 1.00 0.21 H new ATOM 0 HA ILE A 121 -11.886 4.997 1.500 1.00 0.19 H new ATOM 0 HB ILE A 121 -13.733 3.546 1.893 1.00 0.21 H new ATOM 0 HG12 ILE A 121 -15.855 4.130 0.263 1.00 0.21 H new ATOM 0 HG13 ILE A 121 -14.526 4.308 -0.866 1.00 0.21 H new ATOM 0 HG21 ILE A 121 -15.622 5.112 2.288 1.00 0.27 H new ATOM 0 HG22 ILE A 121 -14.060 5.823 2.760 1.00 0.27 H new ATOM 0 HG23 ILE A 121 -14.833 6.307 1.232 1.00 0.27 H new ATOM 0 HD11 ILE A 121 -15.429 2.042 -0.925 1.00 0.21 H new ATOM 0 HD12 ILE A 121 -13.750 2.031 -0.333 1.00 0.21 H new ATOM 0 HD13 ILE A 121 -15.099 1.851 0.813 1.00 0.21 H new ATOM 1703 N PHE A 122 -11.671 2.638 0.290 1.00 0.13 N ATOM 1704 CA PHE A 122 -11.124 1.520 -0.466 1.00 0.13 C ATOM 1705 C PHE A 122 -11.485 0.202 0.202 1.00 0.12 C ATOM 1706 O PHE A 122 -11.972 0.185 1.329 1.00 0.20 O ATOM 1707 CB PHE A 122 -9.598 1.633 -0.596 1.00 0.14 C ATOM 1708 CG PHE A 122 -8.871 1.696 0.720 1.00 0.15 C ATOM 1709 CD1 PHE A 122 -8.443 0.533 1.342 1.00 0.17 C ATOM 1710 CD2 PHE A 122 -8.612 2.912 1.332 1.00 0.15 C ATOM 1711 CE1 PHE A 122 -7.773 0.584 2.548 1.00 0.20 C ATOM 1712 CE2 PHE A 122 -7.943 2.968 2.538 1.00 0.18 C ATOM 1713 CZ PHE A 122 -7.523 1.802 3.147 1.00 0.20 C ATOM 0 H PHE A 122 -11.792 2.448 1.285 1.00 0.13 H new ATOM 0 HA PHE A 122 -11.559 1.549 -1.465 1.00 0.13 H new ATOM 0 HB2 PHE A 122 -9.228 0.778 -1.162 1.00 0.14 H new ATOM 0 HB3 PHE A 122 -9.359 2.526 -1.174 1.00 0.14 H new ATOM 0 HD1 PHE A 122 -8.636 -0.423 0.878 1.00 0.17 H new ATOM 0 HD2 PHE A 122 -8.938 3.827 0.860 1.00 0.15 H new ATOM 0 HE1 PHE A 122 -7.445 -0.329 3.023 1.00 0.20 H new ATOM 0 HE2 PHE A 122 -7.748 3.922 3.005 1.00 0.18 H new ATOM 0 HZ PHE A 122 -7.000 1.843 4.091 1.00 0.20 H new ATOM 1723 N THR A 123 -11.260 -0.889 -0.509 1.00 0.13 N ATOM 1724 CA THR A 123 -11.434 -2.232 0.041 1.00 0.13 C ATOM 1725 C THR A 123 -10.417 -3.181 -0.575 1.00 0.13 C ATOM 1726 O THR A 123 -10.158 -3.142 -1.773 1.00 0.22 O ATOM 1727 CB THR A 123 -12.859 -2.786 -0.198 1.00 0.15 C ATOM 1728 OG1 THR A 123 -13.836 -1.818 0.213 1.00 0.17 O ATOM 1729 CG2 THR A 123 -13.075 -4.087 0.578 1.00 0.16 C ATOM 0 H THR A 123 -10.952 -0.875 -1.481 1.00 0.13 H new ATOM 0 HA THR A 123 -11.281 -2.160 1.118 1.00 0.13 H new ATOM 0 HB THR A 123 -12.970 -2.991 -1.263 1.00 0.15 H new ATOM 0 HG1 THR A 123 -14.174 -1.340 -0.573 1.00 0.17 H new ATOM 0 HG21 THR A 123 -14.084 -4.457 0.394 1.00 0.16 H new ATOM 0 HG22 THR A 123 -12.350 -4.831 0.249 1.00 0.16 H new ATOM 0 HG23 THR A 123 -12.946 -3.901 1.644 1.00 0.16 H new ATOM 1737 N TYR A 124 -9.825 -4.005 0.263 1.00 0.12 N ATOM 1738 CA TYR A 124 -8.831 -4.958 -0.165 1.00 0.12 C ATOM 1739 C TYR A 124 -9.335 -6.384 0.002 1.00 0.10 C ATOM 1740 O TYR A 124 -9.575 -6.846 1.111 1.00 0.09 O ATOM 1741 CB TYR A 124 -7.540 -4.760 0.627 1.00 0.13 C ATOM 1742 CG TYR A 124 -6.539 -5.869 0.421 1.00 0.13 C ATOM 1743 CD1 TYR A 124 -6.227 -6.747 1.450 1.00 0.15 C ATOM 1744 CD2 TYR A 124 -5.921 -6.047 -0.807 1.00 0.17 C ATOM 1745 CE1 TYR A 124 -5.325 -7.771 1.258 1.00 0.17 C ATOM 1746 CE2 TYR A 124 -5.018 -7.067 -1.005 1.00 0.20 C ATOM 1747 CZ TYR A 124 -4.722 -7.926 0.028 1.00 0.20 C ATOM 1748 OH TYR A 124 -3.826 -8.949 -0.176 1.00 0.23 O ATOM 0 H TYR A 124 -10.022 -4.031 1.263 1.00 0.12 H new ATOM 0 HA TYR A 124 -8.630 -4.790 -1.223 1.00 0.12 H new ATOM 0 HB2 TYR A 124 -7.086 -3.812 0.338 1.00 0.13 H new ATOM 0 HB3 TYR A 124 -7.780 -4.689 1.688 1.00 0.13 H new ATOM 0 HD1 TYR A 124 -6.698 -6.626 2.414 1.00 0.15 H new ATOM 0 HD2 TYR A 124 -6.151 -5.375 -1.621 1.00 0.17 H new ATOM 0 HE1 TYR A 124 -5.092 -8.448 2.066 1.00 0.17 H new ATOM 0 HE2 TYR A 124 -4.544 -7.192 -1.967 1.00 0.20 H new ATOM 0 HH TYR A 124 -3.332 -8.790 -1.007 1.00 0.23 H new ATOM 1758 N ASN A 125 -9.504 -7.058 -1.113 1.00 0.13 N ATOM 1759 CA ASN A 125 -9.822 -8.467 -1.143 1.00 0.14 C ATOM 1760 C ASN A 125 -8.589 -9.269 -0.784 1.00 0.16 C ATOM 1761 O ASN A 125 -7.632 -9.326 -1.544 1.00 0.20 O ATOM 1762 CB ASN A 125 -10.310 -8.833 -2.543 1.00 0.20 C ATOM 1763 CG ASN A 125 -11.779 -8.534 -2.755 1.00 0.34 C ATOM 1764 OD1 ASN A 125 -12.463 -9.230 -3.500 1.00 0.66 O ATOM 1765 ND2 ASN A 125 -12.268 -7.483 -2.118 1.00 0.24 N ATOM 0 H ASN A 125 -9.423 -6.636 -2.038 1.00 0.13 H new ATOM 0 HA ASN A 125 -10.606 -8.693 -0.420 1.00 0.14 H new ATOM 0 HB2 ASN A 125 -9.723 -8.286 -3.281 1.00 0.20 H new ATOM 0 HB3 ASN A 125 -10.132 -9.894 -2.718 1.00 0.20 H new ATOM 0 HD21 ASN A 125 -13.248 -7.225 -2.237 1.00 0.24 H new ATOM 0 HD22 ASN A 125 -11.666 -6.931 -1.508 1.00 0.24 H new ATOM 1772 N GLU A 126 -8.622 -9.875 0.383 1.00 0.17 N ATOM 1773 CA GLU A 126 -7.491 -10.627 0.895 1.00 0.20 C ATOM 1774 C GLU A 126 -7.403 -11.985 0.209 1.00 0.23 C ATOM 1775 O GLU A 126 -6.356 -12.628 0.213 1.00 0.30 O ATOM 1776 CB GLU A 126 -7.621 -10.797 2.410 1.00 0.22 C ATOM 1777 CG GLU A 126 -8.099 -9.534 3.111 1.00 0.23 C ATOM 1778 CD GLU A 126 -7.801 -9.531 4.597 1.00 0.31 C ATOM 1779 OE1 GLU A 126 -8.723 -9.804 5.394 1.00 0.50 O ATOM 1780 OE2 GLU A 126 -6.644 -9.252 4.975 1.00 0.57 O ATOM 0 H GLU A 126 -9.431 -9.862 1.005 1.00 0.17 H new ATOM 0 HA GLU A 126 -6.574 -10.077 0.682 1.00 0.20 H new ATOM 0 HB2 GLU A 126 -8.318 -11.609 2.621 1.00 0.22 H new ATOM 0 HB3 GLU A 126 -6.655 -11.091 2.821 1.00 0.22 H new ATOM 0 HG2 GLU A 126 -7.625 -8.668 2.650 1.00 0.23 H new ATOM 0 HG3 GLU A 126 -9.173 -9.427 2.962 1.00 0.23 H new ATOM 1787 N HIS A 127 -8.510 -12.408 -0.391 1.00 0.21 N ATOM 1788 CA HIS A 127 -8.569 -13.663 -1.101 1.00 0.23 C ATOM 1789 C HIS A 127 -8.053 -13.503 -2.518 1.00 0.26 C ATOM 1790 O HIS A 127 -7.327 -14.348 -3.031 1.00 0.35 O ATOM 1791 CB HIS A 127 -10.012 -14.137 -1.156 1.00 0.25 C ATOM 1792 CG HIS A 127 -10.531 -14.712 0.127 1.00 0.71 C ATOM 1793 ND1 HIS A 127 -11.824 -14.532 0.561 1.00 1.26 N ATOM 1794 CD2 HIS A 127 -9.931 -15.491 1.057 1.00 0.95 C ATOM 1795 CE1 HIS A 127 -11.998 -15.172 1.701 1.00 1.74 C ATOM 1796 NE2 HIS A 127 -10.865 -15.763 2.024 1.00 1.56 N ATOM 0 H HIS A 127 -9.386 -11.886 -0.394 1.00 0.21 H new ATOM 0 HA HIS A 127 -7.947 -14.389 -0.577 1.00 0.23 H new ATOM 0 HB2 HIS A 127 -10.645 -13.298 -1.445 1.00 0.25 H new ATOM 0 HB3 HIS A 127 -10.103 -14.890 -1.939 1.00 0.25 H new ATOM 0 HD2 HIS A 127 -8.907 -15.835 1.041 1.00 0.95 H new ATOM 0 HE1 HIS A 127 -12.914 -15.206 2.273 1.00 1.74 H new ATOM 0 HE2 HIS A 127 -10.708 -16.330 2.857 1.00 1.56 H new ATOM 1804 N ASP A 128 -8.446 -12.407 -3.141 1.00 0.25 N ATOM 1805 CA ASP A 128 -8.125 -12.161 -4.536 1.00 0.29 C ATOM 1806 C ASP A 128 -6.881 -11.289 -4.647 1.00 0.27 C ATOM 1807 O ASP A 128 -6.337 -11.080 -5.731 1.00 0.32 O ATOM 1808 CB ASP A 128 -9.315 -11.486 -5.217 1.00 0.32 C ATOM 1809 CG ASP A 128 -9.148 -11.360 -6.717 1.00 0.72 C ATOM 1810 OD1 ASP A 128 -9.165 -12.399 -7.411 1.00 0.72 O ATOM 1811 OD2 ASP A 128 -9.021 -10.226 -7.217 1.00 1.33 O ATOM 0 H ASP A 128 -8.992 -11.668 -2.699 1.00 0.25 H new ATOM 0 HA ASP A 128 -7.920 -13.109 -5.032 1.00 0.29 H new ATOM 0 HB2 ASP A 128 -10.219 -12.057 -5.005 1.00 0.32 H new ATOM 0 HB3 ASP A 128 -9.456 -10.494 -4.789 1.00 0.32 H new ATOM 1816 N GLN A 129 -6.431 -10.813 -3.485 1.00 0.21 N ATOM 1817 CA GLN A 129 -5.309 -9.887 -3.388 1.00 0.21 C ATOM 1818 C GLN A 129 -5.581 -8.658 -4.237 1.00 0.18 C ATOM 1819 O GLN A 129 -4.797 -8.307 -5.106 1.00 0.18 O ATOM 1820 CB GLN A 129 -3.988 -10.553 -3.799 1.00 0.30 C ATOM 1821 CG GLN A 129 -3.553 -11.680 -2.872 1.00 0.53 C ATOM 1822 CD GLN A 129 -4.243 -12.997 -3.172 1.00 0.72 C ATOM 1823 OE1 GLN A 129 -4.571 -13.292 -4.320 1.00 1.75 O ATOM 1824 NE2 GLN A 129 -4.480 -13.791 -2.142 1.00 0.69 N ATOM 0 H GLN A 129 -6.838 -11.062 -2.583 1.00 0.21 H new ATOM 0 HA GLN A 129 -5.206 -9.584 -2.346 1.00 0.21 H new ATOM 0 HB2 GLN A 129 -4.089 -10.946 -4.811 1.00 0.30 H new ATOM 0 HB3 GLN A 129 -3.204 -9.796 -3.828 1.00 0.30 H new ATOM 0 HG2 GLN A 129 -2.475 -11.815 -2.955 1.00 0.53 H new ATOM 0 HG3 GLN A 129 -3.760 -11.395 -1.841 1.00 0.53 H new ATOM 0 HE21 GLN A 129 -4.192 -13.510 -1.205 1.00 0.69 H new ATOM 0 HE22 GLN A 129 -4.951 -14.685 -2.285 1.00 0.69 H new ATOM 1833 N LYS A 130 -6.698 -7.998 -3.969 1.00 0.17 N ATOM 1834 CA LYS A 130 -7.159 -6.935 -4.842 1.00 0.16 C ATOM 1835 C LYS A 130 -7.674 -5.733 -4.059 1.00 0.18 C ATOM 1836 O LYS A 130 -8.223 -5.874 -2.979 1.00 0.26 O ATOM 1837 CB LYS A 130 -8.272 -7.464 -5.730 1.00 0.18 C ATOM 1838 CG LYS A 130 -8.333 -6.789 -7.087 1.00 0.18 C ATOM 1839 CD LYS A 130 -9.621 -7.117 -7.828 1.00 0.22 C ATOM 1840 CE LYS A 130 -10.834 -6.504 -7.145 1.00 0.26 C ATOM 1841 NZ LYS A 130 -12.098 -6.803 -7.875 1.00 1.15 N ATOM 0 H LYS A 130 -7.295 -8.179 -3.162 1.00 0.17 H new ATOM 0 HA LYS A 130 -6.310 -6.605 -5.441 1.00 0.16 H new ATOM 0 HB2 LYS A 130 -8.135 -8.536 -5.872 1.00 0.18 H new ATOM 0 HB3 LYS A 130 -9.227 -7.329 -5.222 1.00 0.18 H new ATOM 0 HG2 LYS A 130 -8.253 -5.709 -6.959 1.00 0.18 H new ATOM 0 HG3 LYS A 130 -7.479 -7.103 -7.687 1.00 0.18 H new ATOM 0 HD2 LYS A 130 -9.555 -6.750 -8.852 1.00 0.22 H new ATOM 0 HD3 LYS A 130 -9.743 -8.199 -7.885 1.00 0.22 H new ATOM 0 HE2 LYS A 130 -10.906 -6.883 -6.126 1.00 0.26 H new ATOM 0 HE3 LYS A 130 -10.703 -5.424 -7.075 1.00 0.26 H new ATOM 0 HZ1 LYS A 130 -12.899 -6.367 -7.375 1.00 1.15 H new ATOM 0 HZ2 LYS A 130 -12.041 -6.419 -8.840 1.00 1.15 H new ATOM 0 HZ3 LYS A 130 -12.238 -7.833 -7.920 1.00 1.15 H new ATOM 1855 N CYS A 131 -7.513 -4.561 -4.636 1.00 0.16 N ATOM 1856 CA CYS A 131 -8.020 -3.330 -4.060 1.00 0.16 C ATOM 1857 C CYS A 131 -9.167 -2.811 -4.908 1.00 0.14 C ATOM 1858 O CYS A 131 -9.170 -2.994 -6.118 1.00 0.20 O ATOM 1859 CB CYS A 131 -6.940 -2.255 -4.043 1.00 0.20 C ATOM 1860 SG CYS A 131 -5.357 -2.735 -3.280 1.00 0.26 S ATOM 0 H CYS A 131 -7.025 -4.433 -5.522 1.00 0.16 H new ATOM 0 HA CYS A 131 -8.346 -3.544 -3.042 1.00 0.16 H new ATOM 0 HB2 CYS A 131 -6.747 -1.944 -5.070 1.00 0.20 H new ATOM 0 HB3 CYS A 131 -7.328 -1.385 -3.513 1.00 0.20 H new ATOM 1865 N THR A 132 -10.125 -2.173 -4.274 1.00 0.17 N ATOM 1866 CA THR A 132 -11.175 -1.457 -4.979 1.00 0.18 C ATOM 1867 C THR A 132 -11.317 -0.064 -4.380 1.00 0.19 C ATOM 1868 O THR A 132 -11.337 0.086 -3.158 1.00 0.25 O ATOM 1869 CB THR A 132 -12.526 -2.201 -4.912 1.00 0.20 C ATOM 1870 OG1 THR A 132 -12.830 -2.561 -3.556 1.00 0.22 O ATOM 1871 CG2 THR A 132 -12.508 -3.449 -5.781 1.00 0.25 C ATOM 0 H THR A 132 -10.202 -2.133 -3.258 1.00 0.17 H new ATOM 0 HA THR A 132 -10.895 -1.389 -6.030 1.00 0.18 H new ATOM 0 HB THR A 132 -13.297 -1.528 -5.288 1.00 0.20 H new ATOM 0 HG1 THR A 132 -13.690 -3.031 -3.527 1.00 0.22 H new ATOM 0 HG21 THR A 132 -13.472 -3.953 -5.714 1.00 0.25 H new ATOM 0 HG22 THR A 132 -12.316 -3.168 -6.817 1.00 0.25 H new ATOM 0 HG23 THR A 132 -11.723 -4.121 -5.436 1.00 0.25 H new ATOM 1879 N PHE A 133 -11.381 0.952 -5.226 1.00 0.17 N ATOM 1880 CA PHE A 133 -11.417 2.326 -4.744 1.00 0.18 C ATOM 1881 C PHE A 133 -12.741 2.978 -5.102 1.00 0.18 C ATOM 1882 O PHE A 133 -13.109 3.065 -6.277 1.00 0.20 O ATOM 1883 CB PHE A 133 -10.259 3.111 -5.350 1.00 0.19 C ATOM 1884 CG PHE A 133 -8.936 2.426 -5.163 1.00 0.18 C ATOM 1885 CD1 PHE A 133 -8.340 1.739 -6.208 1.00 0.18 C ATOM 1886 CD2 PHE A 133 -8.302 2.453 -3.936 1.00 0.19 C ATOM 1887 CE1 PHE A 133 -7.132 1.093 -6.030 1.00 0.18 C ATOM 1888 CE2 PHE A 133 -7.095 1.812 -3.752 1.00 0.19 C ATOM 1889 CZ PHE A 133 -6.509 1.131 -4.801 1.00 0.18 C ATOM 0 H PHE A 133 -11.409 0.854 -6.241 1.00 0.17 H new ATOM 0 HA PHE A 133 -11.318 2.325 -3.658 1.00 0.18 H new ATOM 0 HB2 PHE A 133 -10.441 3.256 -6.415 1.00 0.19 H new ATOM 0 HB3 PHE A 133 -10.219 4.101 -4.895 1.00 0.19 H new ATOM 0 HD1 PHE A 133 -8.825 1.708 -7.172 1.00 0.18 H new ATOM 0 HD2 PHE A 133 -8.757 2.982 -3.112 1.00 0.19 H new ATOM 0 HE1 PHE A 133 -6.677 0.560 -6.852 1.00 0.18 H new ATOM 0 HE2 PHE A 133 -6.608 1.842 -2.788 1.00 0.19 H new ATOM 0 HZ PHE A 133 -5.564 0.629 -4.658 1.00 0.18 H new ATOM 1899 N LYS A 134 -13.431 3.468 -4.087 1.00 0.18 N ATOM 1900 CA LYS A 134 -14.792 3.958 -4.239 1.00 0.20 C ATOM 1901 C LYS A 134 -14.943 5.320 -3.574 1.00 0.21 C ATOM 1902 O LYS A 134 -14.268 5.622 -2.587 1.00 0.20 O ATOM 1903 CB LYS A 134 -15.786 2.951 -3.648 1.00 0.21 C ATOM 1904 CG LYS A 134 -16.222 1.848 -4.621 1.00 0.26 C ATOM 1905 CD LYS A 134 -15.079 0.963 -5.089 1.00 0.55 C ATOM 1906 CE LYS A 134 -15.557 -0.096 -6.073 1.00 0.56 C ATOM 1907 NZ LYS A 134 -16.365 0.479 -7.186 1.00 0.72 N ATOM 0 H LYS A 134 -13.066 3.538 -3.137 1.00 0.18 H new ATOM 0 HA LYS A 134 -15.008 4.072 -5.301 1.00 0.20 H new ATOM 0 HB2 LYS A 134 -15.337 2.488 -2.770 1.00 0.21 H new ATOM 0 HB3 LYS A 134 -16.671 3.489 -3.307 1.00 0.21 H new ATOM 0 HG2 LYS A 134 -16.977 1.227 -4.139 1.00 0.26 H new ATOM 0 HG3 LYS A 134 -16.694 2.307 -5.490 1.00 0.26 H new ATOM 0 HD2 LYS A 134 -14.311 1.577 -5.559 1.00 0.55 H new ATOM 0 HD3 LYS A 134 -14.617 0.479 -4.229 1.00 0.55 H new ATOM 0 HE2 LYS A 134 -14.694 -0.618 -6.487 1.00 0.56 H new ATOM 0 HE3 LYS A 134 -16.153 -0.838 -5.542 1.00 0.56 H new ATOM 0 HZ1 LYS A 134 -16.102 0.017 -8.080 1.00 0.72 H new ATOM 0 HZ2 LYS A 134 -17.376 0.321 -6.999 1.00 0.72 H new ATOM 0 HZ3 LYS A 134 -16.181 1.500 -7.257 1.00 0.72 H new ATOM 1921 N GLY A 135 -15.810 6.147 -4.140 1.00 0.25 N ATOM 1922 CA GLY A 135 -15.999 7.487 -3.632 1.00 0.29 C ATOM 1923 C GLY A 135 -17.191 7.608 -2.710 1.00 0.31 C ATOM 1924 O GLY A 135 -17.666 6.614 -2.159 1.00 0.35 O ATOM 0 H GLY A 135 -16.388 5.910 -4.946 1.00 0.25 H new ATOM 0 HA2 GLY A 135 -15.101 7.797 -3.098 1.00 0.29 H new ATOM 0 HA3 GLY A 135 -16.124 8.173 -4.470 1.00 0.29 H new ATOM 1928 N ARG A 136 -17.677 8.833 -2.557 1.00 0.33 N ATOM 1929 CA ARG A 136 -18.773 9.132 -1.642 1.00 0.40 C ATOM 1930 C ARG A 136 -20.049 8.392 -2.023 1.00 0.39 C ATOM 1931 O ARG A 136 -20.288 8.098 -3.198 1.00 0.43 O ATOM 1932 CB ARG A 136 -19.025 10.628 -1.597 1.00 0.51 C ATOM 1933 CG ARG A 136 -17.826 11.401 -1.091 1.00 0.55 C ATOM 1934 CD ARG A 136 -18.219 12.783 -0.633 1.00 1.03 C ATOM 1935 NE ARG A 136 -18.687 13.623 -1.734 1.00 1.91 N ATOM 1936 CZ ARG A 136 -18.682 14.955 -1.705 1.00 2.55 C ATOM 1937 NH1 ARG A 136 -18.240 15.596 -0.630 1.00 2.53 N ATOM 1938 NH2 ARG A 136 -19.124 15.646 -2.752 1.00 3.44 N ATOM 0 H ARG A 136 -17.324 9.646 -3.062 1.00 0.33 H new ATOM 0 HA ARG A 136 -18.478 8.787 -0.651 1.00 0.40 H new ATOM 0 HB2 ARG A 136 -19.286 10.980 -2.595 1.00 0.51 H new ATOM 0 HB3 ARG A 136 -19.882 10.830 -0.954 1.00 0.51 H new ATOM 0 HG2 ARG A 136 -17.364 10.860 -0.266 1.00 0.55 H new ATOM 0 HG3 ARG A 136 -17.079 11.476 -1.881 1.00 0.55 H new ATOM 0 HD2 ARG A 136 -19.004 12.704 0.119 1.00 1.03 H new ATOM 0 HD3 ARG A 136 -17.365 13.260 -0.153 1.00 1.03 H new ATOM 0 HE ARG A 136 -19.038 13.162 -2.574 1.00 1.91 H new ATOM 0 HH11 ARG A 136 -17.903 15.069 0.176 1.00 2.53 H new ATOM 0 HH12 ARG A 136 -18.237 16.616 -0.610 1.00 2.53 H new ATOM 0 HH21 ARG A 136 -19.467 15.156 -3.578 1.00 3.44 H new ATOM 0 HH22 ARG A 136 -19.120 16.666 -2.729 1.00 3.44 H new ATOM 1952 N GLY A 137 -20.866 8.098 -1.021 1.00 0.37 N ATOM 1953 CA GLY A 137 -22.049 7.295 -1.240 1.00 0.37 C ATOM 1954 C GLY A 137 -21.765 5.831 -0.984 1.00 0.33 C ATOM 1955 O GLY A 137 -22.631 4.974 -1.148 1.00 0.35 O ATOM 0 H GLY A 137 -20.729 8.403 -0.058 1.00 0.37 H new ATOM 0 HA2 GLY A 137 -22.850 7.634 -0.583 1.00 0.37 H new ATOM 0 HA3 GLY A 137 -22.399 7.428 -2.264 1.00 0.37 H new ATOM 1959 N PHE A 138 -20.537 5.565 -0.559 1.00 0.31 N ATOM 1960 CA PHE A 138 -20.054 4.216 -0.323 1.00 0.30 C ATOM 1961 C PHE A 138 -20.863 3.504 0.759 1.00 0.35 C ATOM 1962 O PHE A 138 -21.006 2.285 0.728 1.00 0.38 O ATOM 1963 CB PHE A 138 -18.567 4.267 0.058 1.00 0.29 C ATOM 1964 CG PHE A 138 -18.274 5.128 1.263 1.00 0.33 C ATOM 1965 CD1 PHE A 138 -18.033 6.486 1.117 1.00 0.36 C ATOM 1966 CD2 PHE A 138 -18.243 4.582 2.536 1.00 0.38 C ATOM 1967 CE1 PHE A 138 -17.767 7.280 2.216 1.00 0.42 C ATOM 1968 CE2 PHE A 138 -17.977 5.371 3.639 1.00 0.43 C ATOM 1969 CZ PHE A 138 -17.740 6.722 3.479 1.00 0.44 C ATOM 0 H PHE A 138 -19.844 6.288 -0.367 1.00 0.31 H new ATOM 0 HA PHE A 138 -20.176 3.642 -1.242 1.00 0.30 H new ATOM 0 HB2 PHE A 138 -18.217 3.253 0.254 1.00 0.29 H new ATOM 0 HB3 PHE A 138 -17.997 4.642 -0.792 1.00 0.29 H new ATOM 0 HD1 PHE A 138 -18.054 6.928 0.132 1.00 0.36 H new ATOM 0 HD2 PHE A 138 -18.429 3.526 2.668 1.00 0.38 H new ATOM 0 HE1 PHE A 138 -17.580 8.336 2.087 1.00 0.42 H new ATOM 0 HE2 PHE A 138 -17.954 4.931 4.625 1.00 0.43 H new ATOM 0 HZ PHE A 138 -17.534 7.341 4.340 1.00 0.44 H new ATOM 1979 N SER A 139 -21.412 4.266 1.698 1.00 0.41 N ATOM 1980 CA SER A 139 -22.166 3.693 2.807 1.00 0.50 C ATOM 1981 C SER A 139 -23.458 3.032 2.324 1.00 0.44 C ATOM 1982 O SER A 139 -23.923 2.055 2.913 1.00 0.49 O ATOM 1983 CB SER A 139 -22.464 4.775 3.841 1.00 0.60 C ATOM 1984 OG SER A 139 -22.886 5.974 3.212 1.00 1.47 O ATOM 0 H SER A 139 -21.349 5.284 1.713 1.00 0.41 H new ATOM 0 HA SER A 139 -21.559 2.915 3.270 1.00 0.50 H new ATOM 0 HB2 SER A 139 -23.238 4.427 4.525 1.00 0.60 H new ATOM 0 HB3 SER A 139 -21.573 4.967 4.439 1.00 0.60 H new ATOM 0 HG SER A 139 -23.073 6.653 3.894 1.00 1.47 H new ATOM 1990 N ALA A 140 -24.020 3.554 1.239 1.00 0.37 N ATOM 1991 CA ALA A 140 -25.230 2.992 0.656 1.00 0.38 C ATOM 1992 C ALA A 140 -24.928 1.675 -0.042 1.00 0.39 C ATOM 1993 O ALA A 140 -25.821 0.869 -0.306 1.00 0.53 O ATOM 1994 CB ALA A 140 -25.828 3.972 -0.332 1.00 0.39 C ATOM 0 H ALA A 140 -23.654 4.368 0.745 1.00 0.37 H new ATOM 0 HA ALA A 140 -25.945 2.804 1.457 1.00 0.38 H new ATOM 0 HB1 ALA A 140 -26.733 3.546 -0.765 1.00 0.39 H new ATOM 0 HB2 ALA A 140 -26.074 4.902 0.181 1.00 0.39 H new ATOM 0 HB3 ALA A 140 -25.108 4.175 -1.124 1.00 0.39 H new ATOM 2000 N PHE A 141 -23.657 1.472 -0.342 1.00 0.31 N ATOM 2001 CA PHE A 141 -23.213 0.285 -1.042 1.00 0.30 C ATOM 2002 C PHE A 141 -22.291 -0.523 -0.145 1.00 0.30 C ATOM 2003 O PHE A 141 -21.473 -1.313 -0.616 1.00 0.31 O ATOM 2004 CB PHE A 141 -22.490 0.686 -2.327 1.00 0.28 C ATOM 2005 CG PHE A 141 -23.347 1.480 -3.271 1.00 0.28 C ATOM 2006 CD1 PHE A 141 -24.264 0.849 -4.094 1.00 0.30 C ATOM 2007 CD2 PHE A 141 -23.233 2.859 -3.336 1.00 0.29 C ATOM 2008 CE1 PHE A 141 -25.051 1.577 -4.963 1.00 0.33 C ATOM 2009 CE2 PHE A 141 -24.016 3.594 -4.204 1.00 0.31 C ATOM 2010 CZ PHE A 141 -24.927 2.952 -5.018 1.00 0.32 C ATOM 0 H PHE A 141 -22.908 2.124 -0.107 1.00 0.31 H new ATOM 0 HA PHE A 141 -24.075 -0.329 -1.302 1.00 0.30 H new ATOM 0 HB2 PHE A 141 -21.607 1.271 -2.071 1.00 0.28 H new ATOM 0 HB3 PHE A 141 -22.141 -0.213 -2.834 1.00 0.28 H new ATOM 0 HD1 PHE A 141 -24.365 -0.226 -4.056 1.00 0.30 H new ATOM 0 HD2 PHE A 141 -22.523 3.366 -2.700 1.00 0.29 H new ATOM 0 HE1 PHE A 141 -25.763 1.073 -5.599 1.00 0.33 H new ATOM 0 HE2 PHE A 141 -23.916 4.669 -4.246 1.00 0.31 H new ATOM 0 HZ PHE A 141 -25.542 3.524 -5.697 1.00 0.32 H new ATOM 2020 N LYS A 142 -22.427 -0.308 1.152 1.00 0.31 N ATOM 2021 CA LYS A 142 -21.578 -0.974 2.124 1.00 0.30 C ATOM 2022 C LYS A 142 -22.082 -2.377 2.423 1.00 0.28 C ATOM 2023 O LYS A 142 -23.268 -2.582 2.679 1.00 0.35 O ATOM 2024 CB LYS A 142 -21.506 -0.164 3.417 1.00 0.32 C ATOM 2025 CG LYS A 142 -20.608 -0.802 4.462 1.00 0.37 C ATOM 2026 CD LYS A 142 -20.437 0.078 5.683 1.00 0.38 C ATOM 2027 CE LYS A 142 -19.428 -0.527 6.639 1.00 0.46 C ATOM 2028 NZ LYS A 142 -19.076 0.393 7.752 1.00 0.50 N ATOM 0 H LYS A 142 -23.118 0.323 1.557 1.00 0.31 H new ATOM 0 HA LYS A 142 -20.579 -1.050 1.694 1.00 0.30 H new ATOM 0 HB2 LYS A 142 -21.140 0.838 3.193 1.00 0.32 H new ATOM 0 HB3 LYS A 142 -22.510 -0.052 3.827 1.00 0.32 H new ATOM 0 HG2 LYS A 142 -21.029 -1.761 4.764 1.00 0.37 H new ATOM 0 HG3 LYS A 142 -19.631 -1.006 4.024 1.00 0.37 H new ATOM 0 HD2 LYS A 142 -20.108 1.072 5.379 1.00 0.38 H new ATOM 0 HD3 LYS A 142 -21.396 0.200 6.187 1.00 0.38 H new ATOM 0 HE2 LYS A 142 -19.832 -1.452 7.050 1.00 0.46 H new ATOM 0 HE3 LYS A 142 -18.524 -0.790 6.090 1.00 0.46 H new ATOM 0 HZ1 LYS A 142 -18.056 0.329 7.946 1.00 0.50 H new ATOM 0 HZ2 LYS A 142 -19.317 1.369 7.485 1.00 0.50 H new ATOM 0 HZ3 LYS A 142 -19.608 0.126 8.605 1.00 0.50 H new ATOM 2042 N GLU A 143 -21.172 -3.337 2.397 1.00 0.25 N ATOM 2043 CA GLU A 143 -21.504 -4.719 2.701 1.00 0.25 C ATOM 2044 C GLU A 143 -20.786 -5.154 3.970 1.00 0.23 C ATOM 2045 O GLU A 143 -19.560 -5.160 4.020 1.00 0.23 O ATOM 2046 CB GLU A 143 -21.109 -5.634 1.541 1.00 0.29 C ATOM 2047 CG GLU A 143 -21.897 -6.931 1.500 1.00 0.33 C ATOM 2048 CD GLU A 143 -21.487 -7.824 0.352 1.00 0.43 C ATOM 2049 OE1 GLU A 143 -21.385 -9.052 0.554 1.00 0.73 O ATOM 2050 OE2 GLU A 143 -21.242 -7.301 -0.752 1.00 0.52 O ATOM 0 H GLU A 143 -20.190 -3.182 2.167 1.00 0.25 H new ATOM 0 HA GLU A 143 -22.581 -4.794 2.851 1.00 0.25 H new ATOM 0 HB2 GLU A 143 -21.253 -5.100 0.602 1.00 0.29 H new ATOM 0 HB3 GLU A 143 -20.047 -5.865 1.616 1.00 0.29 H new ATOM 0 HG2 GLU A 143 -21.758 -7.466 2.439 1.00 0.33 H new ATOM 0 HG3 GLU A 143 -22.960 -6.704 1.417 1.00 0.33 H new ATOM 2057 N ARG A 144 -21.547 -5.498 4.997 1.00 0.23 N ATOM 2058 CA ARG A 144 -20.970 -5.900 6.275 1.00 0.23 C ATOM 2059 C ARG A 144 -20.885 -7.417 6.378 1.00 0.23 C ATOM 2060 O ARG A 144 -21.816 -8.127 5.992 1.00 0.29 O ATOM 2061 CB ARG A 144 -21.796 -5.363 7.450 1.00 0.30 C ATOM 2062 CG ARG A 144 -21.713 -3.857 7.655 1.00 0.35 C ATOM 2063 CD ARG A 144 -22.417 -3.081 6.553 1.00 0.34 C ATOM 2064 NE ARG A 144 -23.825 -3.447 6.425 1.00 0.49 N ATOM 2065 CZ ARG A 144 -24.771 -2.643 5.943 1.00 0.57 C ATOM 2066 NH1 ARG A 144 -24.491 -1.381 5.638 1.00 0.71 N ATOM 2067 NH2 ARG A 144 -26.005 -3.099 5.791 1.00 0.77 N ATOM 0 H ARG A 144 -22.567 -5.508 4.973 1.00 0.23 H new ATOM 0 HA ARG A 144 -19.967 -5.477 6.323 1.00 0.23 H new ATOM 0 HB2 ARG A 144 -22.840 -5.637 7.297 1.00 0.30 H new ATOM 0 HB3 ARG A 144 -21.467 -5.858 8.363 1.00 0.30 H new ATOM 0 HG2 ARG A 144 -22.156 -3.599 8.617 1.00 0.35 H new ATOM 0 HG3 ARG A 144 -20.666 -3.556 7.696 1.00 0.35 H new ATOM 0 HD2 ARG A 144 -22.339 -2.013 6.758 1.00 0.34 H new ATOM 0 HD3 ARG A 144 -21.910 -3.261 5.605 1.00 0.34 H new ATOM 0 HE ARG A 144 -24.103 -4.382 6.725 1.00 0.49 H new ATOM 0 HH11 ARG A 144 -23.546 -1.021 5.772 1.00 0.71 H new ATOM 0 HH12 ARG A 144 -25.221 -0.771 5.269 1.00 0.71 H new ATOM 0 HH21 ARG A 144 -26.227 -4.062 6.043 1.00 0.77 H new ATOM 0 HH22 ARG A 144 -26.733 -2.487 5.422 1.00 0.77 H new ATOM 2081 N GLY A 145 -19.760 -7.908 6.886 1.00 0.21 N ATOM 2082 CA GLY A 145 -19.607 -9.332 7.123 1.00 0.25 C ATOM 2083 C GLY A 145 -19.037 -10.058 5.926 1.00 0.22 C ATOM 2084 O GLY A 145 -19.327 -11.233 5.698 1.00 0.25 O ATOM 0 H GLY A 145 -18.949 -7.344 7.139 1.00 0.21 H new ATOM 0 HA2 GLY A 145 -18.955 -9.486 7.982 1.00 0.25 H new ATOM 0 HA3 GLY A 145 -20.576 -9.761 7.377 1.00 0.25 H new ATOM 2088 N VAL A 146 -18.211 -9.360 5.171 1.00 0.19 N ATOM 2089 CA VAL A 146 -17.630 -9.910 3.957 1.00 0.18 C ATOM 2090 C VAL A 146 -16.288 -10.561 4.258 1.00 0.17 C ATOM 2091 O VAL A 146 -15.328 -9.884 4.620 1.00 0.17 O ATOM 2092 CB VAL A 146 -17.442 -8.812 2.896 1.00 0.16 C ATOM 2093 CG1 VAL A 146 -16.981 -9.403 1.572 1.00 0.17 C ATOM 2094 CG2 VAL A 146 -18.726 -8.028 2.710 1.00 0.20 C ATOM 0 H VAL A 146 -17.924 -8.403 5.377 1.00 0.19 H new ATOM 0 HA VAL A 146 -18.315 -10.663 3.568 1.00 0.18 H new ATOM 0 HB VAL A 146 -16.667 -8.132 3.249 1.00 0.16 H new ATOM 0 HG11 VAL A 146 -16.856 -8.604 0.841 1.00 0.17 H new ATOM 0 HG12 VAL A 146 -16.030 -9.917 1.714 1.00 0.17 H new ATOM 0 HG13 VAL A 146 -17.726 -10.112 1.211 1.00 0.17 H new ATOM 0 HG21 VAL A 146 -18.575 -7.256 1.956 1.00 0.20 H new ATOM 0 HG22 VAL A 146 -19.520 -8.701 2.386 1.00 0.20 H new ATOM 0 HG23 VAL A 146 -19.008 -7.563 3.654 1.00 0.20 H new ATOM 2104 N LEU A 147 -16.223 -11.873 4.130 1.00 0.21 N ATOM 2105 CA LEU A 147 -14.997 -12.591 4.428 1.00 0.22 C ATOM 2106 C LEU A 147 -13.948 -12.364 3.356 1.00 0.21 C ATOM 2107 O LEU A 147 -14.227 -12.461 2.158 1.00 0.23 O ATOM 2108 CB LEU A 147 -15.261 -14.080 4.570 1.00 0.29 C ATOM 2109 CG LEU A 147 -16.269 -14.455 5.652 1.00 0.35 C ATOM 2110 CD1 LEU A 147 -16.445 -15.961 5.716 1.00 0.41 C ATOM 2111 CD2 LEU A 147 -15.827 -13.912 7.000 1.00 0.37 C ATOM 0 H LEU A 147 -16.999 -12.460 3.824 1.00 0.21 H new ATOM 0 HA LEU A 147 -14.619 -12.203 5.374 1.00 0.22 H new ATOM 0 HB2 LEU A 147 -15.617 -14.463 3.614 1.00 0.29 H new ATOM 0 HB3 LEU A 147 -14.318 -14.582 4.783 1.00 0.29 H new ATOM 0 HG LEU A 147 -17.230 -14.008 5.399 1.00 0.35 H new ATOM 0 HD11 LEU A 147 -17.167 -16.210 6.493 1.00 0.41 H new ATOM 0 HD12 LEU A 147 -16.806 -16.326 4.755 1.00 0.41 H new ATOM 0 HD13 LEU A 147 -15.488 -16.430 5.946 1.00 0.41 H new ATOM 0 HD21 LEU A 147 -16.557 -14.188 7.761 1.00 0.37 H new ATOM 0 HD22 LEU A 147 -14.855 -14.331 7.260 1.00 0.37 H new ATOM 0 HD23 LEU A 147 -15.751 -12.826 6.948 1.00 0.37 H new ATOM 2123 N GLY A 148 -12.745 -12.058 3.799 1.00 0.22 N ATOM 2124 CA GLY A 148 -11.640 -11.912 2.890 1.00 0.24 C ATOM 2125 C GLY A 148 -11.524 -10.532 2.305 1.00 0.19 C ATOM 2126 O GLY A 148 -10.993 -10.377 1.213 1.00 0.19 O ATOM 0 H GLY A 148 -12.514 -11.907 4.781 1.00 0.22 H new ATOM 0 HA2 GLY A 148 -10.715 -12.156 3.413 1.00 0.24 H new ATOM 0 HA3 GLY A 148 -11.748 -12.634 2.080 1.00 0.24 H new ATOM 2130 N VAL A 149 -12.031 -9.529 2.998 1.00 0.17 N ATOM 2131 CA VAL A 149 -11.869 -8.161 2.539 1.00 0.13 C ATOM 2132 C VAL A 149 -11.562 -7.221 3.689 1.00 0.13 C ATOM 2133 O VAL A 149 -11.936 -7.463 4.839 1.00 0.17 O ATOM 2134 CB VAL A 149 -13.106 -7.644 1.791 1.00 0.13 C ATOM 2135 CG1 VAL A 149 -13.376 -8.460 0.538 1.00 0.15 C ATOM 2136 CG2 VAL A 149 -14.300 -7.652 2.708 1.00 0.15 C ATOM 0 H VAL A 149 -12.552 -9.632 3.869 1.00 0.17 H new ATOM 0 HA VAL A 149 -11.027 -8.178 1.847 1.00 0.13 H new ATOM 0 HB VAL A 149 -12.914 -6.619 1.474 1.00 0.13 H new ATOM 0 HG11 VAL A 149 -14.258 -8.068 0.032 1.00 0.15 H new ATOM 0 HG12 VAL A 149 -12.517 -8.397 -0.129 1.00 0.15 H new ATOM 0 HG13 VAL A 149 -13.547 -9.501 0.812 1.00 0.15 H new ATOM 0 HG21 VAL A 149 -15.174 -7.284 2.171 1.00 0.15 H new ATOM 0 HG22 VAL A 149 -14.487 -8.669 3.052 1.00 0.15 H new ATOM 0 HG23 VAL A 149 -14.104 -7.009 3.566 1.00 0.15 H new ATOM 2146 N THR A 150 -10.874 -6.156 3.356 1.00 0.13 N ATOM 2147 CA THR A 150 -10.499 -5.133 4.304 1.00 0.15 C ATOM 2148 C THR A 150 -10.685 -3.757 3.685 1.00 0.14 C ATOM 2149 O THR A 150 -10.017 -3.412 2.721 1.00 0.15 O ATOM 2150 CB THR A 150 -9.030 -5.306 4.732 1.00 0.17 C ATOM 2151 OG1 THR A 150 -8.903 -6.409 5.640 1.00 0.20 O ATOM 2152 CG2 THR A 150 -8.493 -4.036 5.368 1.00 0.19 C ATOM 0 H THR A 150 -10.554 -5.972 2.405 1.00 0.13 H new ATOM 0 HA THR A 150 -11.138 -5.227 5.182 1.00 0.15 H new ATOM 0 HB THR A 150 -8.440 -5.513 3.839 1.00 0.17 H new ATOM 0 HG1 THR A 150 -8.156 -6.244 6.252 1.00 0.20 H new ATOM 0 HG21 THR A 150 -7.454 -4.187 5.661 1.00 0.19 H new ATOM 0 HG22 THR A 150 -8.553 -3.217 4.651 1.00 0.19 H new ATOM 0 HG23 THR A 150 -9.086 -3.791 6.249 1.00 0.19 H new ATOM 2160 N SER A 151 -11.576 -2.968 4.240 1.00 0.15 N ATOM 2161 CA SER A 151 -11.844 -1.658 3.694 1.00 0.16 C ATOM 2162 C SER A 151 -11.236 -0.580 4.567 1.00 0.20 C ATOM 2163 O SER A 151 -10.759 -0.854 5.657 1.00 0.45 O ATOM 2164 CB SER A 151 -13.351 -1.447 3.557 1.00 0.20 C ATOM 2165 OG SER A 151 -14.006 -1.606 4.799 1.00 1.06 O ATOM 0 H SER A 151 -12.125 -3.209 5.065 1.00 0.15 H new ATOM 0 HA SER A 151 -11.388 -1.593 2.706 1.00 0.16 H new ATOM 0 HB2 SER A 151 -13.547 -0.449 3.165 1.00 0.20 H new ATOM 0 HB3 SER A 151 -13.756 -2.157 2.836 1.00 0.20 H new ATOM 0 HG SER A 151 -14.217 -0.725 5.173 1.00 1.06 H new ATOM 2171 N GLY A 152 -11.190 0.627 4.051 1.00 0.14 N ATOM 2172 CA GLY A 152 -10.742 1.745 4.838 1.00 0.15 C ATOM 2173 C GLY A 152 -11.338 3.034 4.338 1.00 0.13 C ATOM 2174 O GLY A 152 -11.226 3.348 3.155 1.00 0.15 O ATOM 0 H GLY A 152 -11.457 0.856 3.093 1.00 0.14 H new ATOM 0 HA2 GLY A 152 -11.019 1.593 5.881 1.00 0.15 H new ATOM 0 HA3 GLY A 152 -9.654 1.806 4.803 1.00 0.15 H new ATOM 2178 N PRO A 153 -12.018 3.783 5.204 1.00 0.16 N ATOM 2179 CA PRO A 153 -12.662 5.026 4.829 1.00 0.19 C ATOM 2180 C PRO A 153 -11.809 6.255 5.118 1.00 0.19 C ATOM 2181 O PRO A 153 -12.328 7.370 5.194 1.00 0.24 O ATOM 2182 CB PRO A 153 -13.885 5.013 5.735 1.00 0.23 C ATOM 2183 CG PRO A 153 -13.388 4.395 7.004 1.00 0.25 C ATOM 2184 CD PRO A 153 -12.259 3.464 6.620 1.00 0.22 C ATOM 0 HA PRO A 153 -12.868 5.087 3.760 1.00 0.19 H new ATOM 0 HB2 PRO A 153 -14.267 6.020 5.904 1.00 0.23 H new ATOM 0 HB3 PRO A 153 -14.698 4.432 5.300 1.00 0.23 H new ATOM 0 HG2 PRO A 153 -13.040 5.161 7.697 1.00 0.25 H new ATOM 0 HG3 PRO A 153 -14.186 3.849 7.507 1.00 0.25 H new ATOM 0 HD2 PRO A 153 -11.371 3.638 7.228 1.00 0.22 H new ATOM 0 HD3 PRO A 153 -12.537 2.419 6.754 1.00 0.22 H new ATOM 2192 N LYS A 154 -10.507 6.063 5.281 1.00 0.17 N ATOM 2193 CA LYS A 154 -9.646 7.156 5.707 1.00 0.17 C ATOM 2194 C LYS A 154 -8.271 7.110 5.052 1.00 0.18 C ATOM 2195 O LYS A 154 -8.042 6.366 4.099 1.00 0.21 O ATOM 2196 CB LYS A 154 -9.493 7.142 7.235 1.00 0.19 C ATOM 2197 CG LYS A 154 -10.696 7.687 7.984 1.00 0.21 C ATOM 2198 CD LYS A 154 -10.472 7.644 9.484 1.00 0.29 C ATOM 2199 CE LYS A 154 -11.706 8.101 10.240 1.00 0.40 C ATOM 2200 NZ LYS A 154 -11.509 8.036 11.712 1.00 0.70 N ATOM 0 H LYS A 154 -10.030 5.175 5.127 1.00 0.17 H new ATOM 0 HA LYS A 154 -10.126 8.081 5.388 1.00 0.17 H new ATOM 0 HB2 LYS A 154 -9.308 6.119 7.561 1.00 0.19 H new ATOM 0 HB3 LYS A 154 -8.614 7.727 7.507 1.00 0.19 H new ATOM 0 HG2 LYS A 154 -10.888 8.713 7.671 1.00 0.21 H new ATOM 0 HG3 LYS A 154 -11.581 7.105 7.729 1.00 0.21 H new ATOM 0 HD2 LYS A 154 -10.213 6.629 9.786 1.00 0.29 H new ATOM 0 HD3 LYS A 154 -9.626 8.280 9.746 1.00 0.29 H new ATOM 0 HE2 LYS A 154 -11.951 9.123 9.951 1.00 0.40 H new ATOM 0 HE3 LYS A 154 -12.555 7.478 9.959 1.00 0.40 H new ATOM 0 HZ1 LYS A 154 -12.374 8.356 12.192 1.00 0.70 H new ATOM 0 HZ2 LYS A 154 -11.300 7.056 11.991 1.00 0.70 H new ATOM 0 HZ3 LYS A 154 -10.715 8.650 11.983 1.00 0.70 H new ATOM 2214 N GLN A 155 -7.369 7.932 5.580 1.00 0.18 N ATOM 2215 CA GLN A 155 -6.011 8.047 5.070 1.00 0.18 C ATOM 2216 C GLN A 155 -5.121 6.941 5.631 1.00 0.15 C ATOM 2217 O GLN A 155 -5.603 5.904 6.075 1.00 0.17 O ATOM 2218 CB GLN A 155 -5.424 9.402 5.482 1.00 0.20 C ATOM 2219 CG GLN A 155 -6.243 10.598 5.036 1.00 0.23 C ATOM 2220 CD GLN A 155 -6.141 10.860 3.548 1.00 0.75 C ATOM 2221 OE1 GLN A 155 -5.279 11.616 3.099 1.00 1.78 O ATOM 2222 NE2 GLN A 155 -7.007 10.229 2.775 1.00 0.92 N ATOM 0 H GLN A 155 -7.563 8.539 6.377 1.00 0.18 H new ATOM 0 HA GLN A 155 -6.047 7.959 3.984 1.00 0.18 H new ATOM 0 HB2 GLN A 155 -5.326 9.428 6.567 1.00 0.20 H new ATOM 0 HB3 GLN A 155 -4.419 9.490 5.069 1.00 0.20 H new ATOM 0 HG2 GLN A 155 -7.288 10.435 5.300 1.00 0.23 H new ATOM 0 HG3 GLN A 155 -5.911 11.483 5.579 1.00 0.23 H new ATOM 0 HE21 GLN A 155 -7.705 9.611 3.189 1.00 0.92 H new ATOM 0 HE22 GLN A 155 -6.977 10.359 1.764 1.00 0.92 H new ATOM 2231 N PHE A 156 -3.816 7.181 5.586 1.00 0.14 N ATOM 2232 CA PHE A 156 -2.847 6.340 6.276 1.00 0.11 C ATOM 2233 C PHE A 156 -3.233 6.265 7.751 1.00 0.14 C ATOM 2234 O PHE A 156 -3.470 7.301 8.370 1.00 0.20 O ATOM 2235 CB PHE A 156 -1.452 6.947 6.144 1.00 0.11 C ATOM 2236 CG PHE A 156 -1.076 7.351 4.741 1.00 0.14 C ATOM 2237 CD1 PHE A 156 -0.353 6.489 3.931 1.00 0.23 C ATOM 2238 CD2 PHE A 156 -1.446 8.585 4.231 1.00 0.24 C ATOM 2239 CE1 PHE A 156 -0.003 6.852 2.644 1.00 0.27 C ATOM 2240 CE2 PHE A 156 -1.100 8.951 2.946 1.00 0.30 C ATOM 2241 CZ PHE A 156 -0.388 8.107 2.157 1.00 0.26 C ATOM 0 H PHE A 156 -3.402 7.959 5.073 1.00 0.14 H new ATOM 0 HA PHE A 156 -2.842 5.342 5.838 1.00 0.11 H new ATOM 0 HB2 PHE A 156 -1.388 7.823 6.790 1.00 0.11 H new ATOM 0 HB3 PHE A 156 -0.720 6.227 6.510 1.00 0.11 H new ATOM 0 HD1 PHE A 156 -0.059 5.521 4.310 1.00 0.23 H new ATOM 0 HD2 PHE A 156 -2.012 9.269 4.846 1.00 0.24 H new ATOM 0 HE1 PHE A 156 0.562 6.175 2.021 1.00 0.27 H new ATOM 0 HE2 PHE A 156 -1.398 9.917 2.565 1.00 0.30 H new ATOM 0 HZ PHE A 156 -0.119 8.403 1.154 1.00 0.26 H new ATOM 2251 N CYS A 157 -3.278 5.063 8.319 1.00 0.17 N ATOM 2252 CA CYS A 157 -3.822 4.866 9.672 1.00 0.24 C ATOM 2253 C CYS A 157 -2.877 5.362 10.774 1.00 0.37 C ATOM 2254 O CYS A 157 -2.787 4.746 11.837 1.00 0.81 O ATOM 2255 CB CYS A 157 -4.120 3.389 9.922 1.00 0.28 C ATOM 2256 SG CYS A 157 -5.066 2.546 8.612 1.00 0.31 S ATOM 0 H CYS A 157 -2.947 4.209 7.870 1.00 0.17 H new ATOM 0 HA CYS A 157 -4.737 5.456 9.715 1.00 0.24 H new ATOM 0 HB2 CYS A 157 -3.175 2.864 10.058 1.00 0.28 H new ATOM 0 HB3 CYS A 157 -4.672 3.301 10.858 1.00 0.28 H new ATOM 2261 N ASP A 158 -2.196 6.472 10.522 1.00 0.42 N ATOM 2262 CA ASP A 158 -1.279 7.078 11.486 1.00 0.51 C ATOM 2263 C ASP A 158 -0.608 8.277 10.841 1.00 0.40 C ATOM 2264 O ASP A 158 -0.403 9.312 11.471 1.00 0.53 O ATOM 2265 CB ASP A 158 -0.205 6.079 11.947 1.00 0.71 C ATOM 2266 CG ASP A 158 0.519 6.534 13.203 1.00 1.00 C ATOM 2267 OD1 ASP A 158 0.026 6.265 14.320 1.00 1.24 O ATOM 2268 OD2 ASP A 158 1.584 7.175 13.075 1.00 1.43 O ATOM 0 H ASP A 158 -2.262 6.981 9.641 1.00 0.42 H new ATOM 0 HA ASP A 158 -1.852 7.384 12.361 1.00 0.51 H new ATOM 0 HB2 ASP A 158 -0.671 5.111 12.132 1.00 0.71 H new ATOM 0 HB3 ASP A 158 0.520 5.936 11.146 1.00 0.71 H new ATOM 2273 N GLU A 159 -0.303 8.123 9.558 1.00 0.31 N ATOM 2274 CA GLU A 159 0.399 9.143 8.791 1.00 0.41 C ATOM 2275 C GLU A 159 -0.559 10.240 8.322 1.00 0.55 C ATOM 2276 O GLU A 159 -0.127 11.273 7.815 1.00 0.98 O ATOM 2277 CB GLU A 159 1.065 8.495 7.574 1.00 0.49 C ATOM 2278 CG GLU A 159 1.693 7.137 7.860 1.00 0.49 C ATOM 2279 CD GLU A 159 3.003 7.234 8.613 1.00 0.57 C ATOM 2280 OE1 GLU A 159 4.042 6.825 8.067 1.00 0.83 O ATOM 2281 OE2 GLU A 159 2.999 7.728 9.761 1.00 0.95 O ATOM 0 H GLU A 159 -0.536 7.288 9.021 1.00 0.31 H new ATOM 0 HA GLU A 159 1.152 9.598 9.434 1.00 0.41 H new ATOM 0 HB2 GLU A 159 0.322 8.381 6.784 1.00 0.49 H new ATOM 0 HB3 GLU A 159 1.835 9.167 7.193 1.00 0.49 H new ATOM 0 HG2 GLU A 159 0.993 6.534 8.438 1.00 0.49 H new ATOM 0 HG3 GLU A 159 1.860 6.615 6.918 1.00 0.49 H new ATOM 2288 N GLY A 160 -1.858 10.008 8.484 1.00 0.40 N ATOM 2289 CA GLY A 160 -2.839 10.971 8.018 1.00 0.49 C ATOM 2290 C GLY A 160 -4.163 10.864 8.750 1.00 0.53 C ATOM 2291 O GLY A 160 -4.713 11.870 9.200 1.00 0.75 O ATOM 0 H GLY A 160 -2.247 9.176 8.927 1.00 0.40 H new ATOM 0 HA2 GLY A 160 -2.441 11.978 8.143 1.00 0.49 H new ATOM 0 HA3 GLY A 160 -3.006 10.825 6.951 1.00 0.49 H new ATOM 2295 N GLY A 161 -4.679 9.647 8.864 1.00 0.39 N ATOM 2296 CA GLY A 161 -5.946 9.432 9.531 1.00 0.53 C ATOM 2297 C GLY A 161 -5.778 9.226 11.023 1.00 0.67 C ATOM 2298 O GLY A 161 -5.789 10.223 11.775 1.00 1.29 O ATOM 2299 OXT GLY A 161 -5.625 8.066 11.452 1.00 1.35 O ATOM 0 H GLY A 161 -4.238 8.801 8.503 1.00 0.39 H new ATOM 0 HA2 GLY A 161 -6.598 10.288 9.355 1.00 0.53 H new ATOM 0 HA3 GLY A 161 -6.439 8.562 9.099 1.00 0.53 H new TER 2303 GLY A 161