USER MOD reduce.3.24.130724 H: found=0, std=0, add=1304, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1307 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 86 ASN : amide:sc= 1.17 K(o=-2,f=-4.8) USER MOD Set 1.2: A 138 ASN : amide:sc= -3.15! C(o=-2!,f=-4.1!) USER MOD Set 2.1: A 82 GLN : amide:sc= -1.24 K(o=-0.43,f=-1.9!) USER MOD Set 2.2: A 114 ASN : amide:sc= 0.814 K(o=-0.43,f=-1.9) USER MOD Set 3.1: A 76 SER OG : rot 60:sc= 0.118 USER MOD Set 3.2: A 78 GLN : amide:sc= -2.65 K(o=-2.5,f=-4!) USER MOD Set 4.1: A 77 ASN : amide:sc= -2.92! C(o=-0.79!,f=-5.4!) USER MOD Set 4.2: A 96 THR OG1 : rot 180:sc= 0.926 USER MOD Set 4.3: A 107 LYS NZ :NH3+ -121:sc= 1.21 (180deg=0.906) USER MOD Set 5.1: A 61 TYR OH : rot 180:sc= 0.095 USER MOD Set 5.2: A 65 LYS NZ :NH3+ -146:sc= 0.395 (180deg=-0.139) USER MOD Set 6.1: A 41 TYR OH : rot 180:sc= -0.947 USER MOD Set 6.2: A 141 SER OG : rot -108:sc= 0.207 USER MOD Set 7.1: A 28 TYR OH : rot -15:sc= 0.802 USER MOD Set 7.2: A 33 HIS : no HD1:sc= 0.638 K(o=0.55,f=-12!) USER MOD Set 7.3: A 70 THR OG1 : rot -140:sc= -0.891 USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc=0.000462 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.0628 X(o=-0.063,f=-0.1) USER MOD Single : A 26 LYS NZ :NH3+ -167:sc= 1.18 (180deg=1.02) USER MOD Single : A 29 ASN : amide:sc= -2.14! C(o=-2.1!,f=-5.6!) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -6.84! C(o=-6.8!,f=-5.5!) USER MOD Single : A 45 SER OG : rot 150:sc= -1.62! USER MOD Single : A 46 LYS NZ :NH3+ 166:sc=-0.000496 (180deg=-0.0727) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 117:sc= -1.34! USER MOD Single : A 56 THR OG1 : rot 86:sc= 0.506 USER MOD Single : A 58 THR OG1 : rot 84:sc= 1.05 USER MOD Single : A 59 THR OG1 : rot -85:sc= 1.23 USER MOD Single : A 62 ASN : amide:sc= -0.0721 K(o=-0.072,f=-1.4!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -131:sc= 1.02 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -3.66! K(o=-3.7!,f=-0.019) USER MOD Single : A 91 LYS NZ :NH3+ -171:sc= 1.27 (180deg=1.23) USER MOD Single : A 97 LYS NZ :NH3+ 146:sc= 0.109 (180deg=-0.812!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl 159:sc= -8.76! (180deg=-9.34!) USER MOD Single : A 109 ASN : amide:sc= -5.52! K(o=-5.5!,f=-2) USER MOD Single : A 111 ASN : amide:sc= -1.4! C(o=-1.4!,f=-16!) USER MOD Single : A 116 HIS : no HD1:sc= -1.03 K(o=-1,f=-7.3!) USER MOD Single : A 119 TYR OH : rot 50:sc= -1.25 USER MOD Single : A 121 TYR OH : rot 30:sc= -0.131 USER MOD Single : A 122 MET CE :methyl 159:sc= -4.8! (180deg=-6.52!) USER MOD Single : A 123 LYS NZ :NH3+ -167:sc= -0.0756 (180deg=-0.381) USER MOD Single : A 124 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0539) USER MOD Single : A 125 THR OG1 : rot 61:sc= 1.25 USER MOD Single : A 126 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0466) USER MOD Single : A 132 THR OG1 : rot 48:sc= 0.154 USER MOD Single : A 133 LYS NZ :NH3+ -158:sc= -0.186 (180deg=-0.699) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot -159:sc= -2.95! USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ 165:sc= 1.21 (180deg=1.15) USER MOD Single : A 166 LYS NZ :NH3+ 176:sc= -0.115 (180deg=-0.147) USER MOD Single : A 173 SER OG : rot 71:sc= 0.897 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 4.171 -18.086 -5.148 1.00 5.51 N ATOM 2 CA GLY A 10 3.653 -19.140 -4.239 1.00 4.76 C ATOM 3 C GLY A 10 4.703 -19.631 -3.260 1.00 3.67 C ATOM 4 O GLY A 10 4.551 -20.694 -2.657 1.00 3.91 O ATOM 0 HA2 GLY A 10 2.799 -18.750 -3.685 1.00 4.76 H new ATOM 0 HA3 GLY A 10 3.292 -19.981 -4.831 1.00 4.76 H new ATOM 10 N MET A 11 5.770 -18.864 -3.094 1.00 2.95 N ATOM 11 CA MET A 11 6.849 -19.248 -2.197 1.00 2.30 C ATOM 12 C MET A 11 6.880 -18.322 -0.986 1.00 1.53 C ATOM 13 O MET A 11 7.302 -18.711 0.102 1.00 2.02 O ATOM 14 CB MET A 11 8.193 -19.223 -2.930 1.00 2.82 C ATOM 15 CG MET A 11 9.361 -19.714 -2.091 1.00 3.53 C ATOM 16 SD MET A 11 10.908 -19.741 -3.017 1.00 4.49 S ATOM 17 CE MET A 11 12.037 -20.291 -1.743 1.00 5.05 C ATOM 0 H MET A 11 5.912 -17.972 -3.569 1.00 2.95 H new ATOM 0 HA MET A 11 6.670 -20.266 -1.852 1.00 2.30 H new ATOM 0 HB2 MET A 11 8.118 -19.838 -3.827 1.00 2.82 H new ATOM 0 HB3 MET A 11 8.398 -18.204 -3.259 1.00 2.82 H new ATOM 0 HG2 MET A 11 9.474 -19.071 -1.218 1.00 3.53 H new ATOM 0 HG3 MET A 11 9.144 -20.716 -1.722 1.00 3.53 H new ATOM 0 HE1 MET A 11 13.044 -20.361 -2.154 1.00 5.05 H new ATOM 0 HE2 MET A 11 12.030 -19.578 -0.918 1.00 5.05 H new ATOM 0 HE3 MET A 11 11.726 -21.270 -1.379 1.00 5.05 H new ATOM 27 N GLY A 12 6.409 -17.093 -1.188 1.00 1.18 N ATOM 28 CA GLY A 12 6.291 -16.144 -0.096 1.00 0.76 C ATOM 29 C GLY A 12 7.622 -15.554 0.329 1.00 0.71 C ATOM 30 O GLY A 12 7.775 -15.124 1.468 1.00 1.37 O ATOM 0 H GLY A 12 6.106 -16.737 -2.095 1.00 1.18 H new ATOM 0 HA2 GLY A 12 5.622 -15.337 -0.395 1.00 0.76 H new ATOM 0 HA3 GLY A 12 5.831 -16.639 0.759 1.00 0.76 H new ATOM 34 N SER A 13 8.581 -15.531 -0.586 1.00 0.71 N ATOM 35 CA SER A 13 9.902 -14.991 -0.297 1.00 0.72 C ATOM 36 C SER A 13 9.845 -13.476 -0.113 1.00 0.55 C ATOM 37 O SER A 13 10.428 -12.928 0.821 1.00 0.73 O ATOM 38 CB SER A 13 10.846 -15.330 -1.439 1.00 0.93 C ATOM 39 OG SER A 13 10.653 -16.665 -1.873 1.00 1.68 O ATOM 0 H SER A 13 8.468 -15.881 -1.537 1.00 0.71 H new ATOM 0 HA SER A 13 10.264 -15.436 0.630 1.00 0.72 H new ATOM 0 HB2 SER A 13 10.679 -14.645 -2.270 1.00 0.93 H new ATOM 0 HB3 SER A 13 11.878 -15.194 -1.116 1.00 0.93 H new ATOM 0 HG SER A 13 11.269 -16.862 -2.609 1.00 1.68 H new ATOM 45 N SER A 14 9.142 -12.811 -1.019 1.00 0.38 N ATOM 46 CA SER A 14 8.978 -11.370 -0.974 1.00 0.28 C ATOM 47 C SER A 14 7.674 -10.993 -1.662 1.00 0.26 C ATOM 48 O SER A 14 7.017 -11.861 -2.239 1.00 0.36 O ATOM 49 CB SER A 14 10.175 -10.679 -1.632 1.00 0.35 C ATOM 50 OG SER A 14 10.353 -11.112 -2.971 1.00 0.65 O ATOM 0 H SER A 14 8.670 -13.258 -1.805 1.00 0.38 H new ATOM 0 HA SER A 14 8.935 -11.036 0.063 1.00 0.28 H new ATOM 0 HB2 SER A 14 10.028 -9.599 -1.614 1.00 0.35 H new ATOM 0 HB3 SER A 14 11.078 -10.888 -1.058 1.00 0.35 H new ATOM 0 HG SER A 14 11.124 -10.652 -3.364 1.00 0.65 H new ATOM 56 N ILE A 15 7.288 -9.726 -1.601 1.00 0.22 N ATOM 57 CA ILE A 15 6.035 -9.281 -2.206 1.00 0.22 C ATOM 58 C ILE A 15 5.973 -9.631 -3.693 1.00 0.20 C ATOM 59 O ILE A 15 4.910 -9.937 -4.228 1.00 0.22 O ATOM 60 CB ILE A 15 5.819 -7.758 -2.045 1.00 0.22 C ATOM 61 CG1 ILE A 15 6.978 -6.968 -2.669 1.00 0.21 C ATOM 62 CG2 ILE A 15 5.645 -7.397 -0.576 1.00 0.25 C ATOM 63 CD1 ILE A 15 6.647 -5.514 -2.920 1.00 0.30 C ATOM 0 H ILE A 15 7.821 -8.988 -1.141 1.00 0.22 H new ATOM 0 HA ILE A 15 5.243 -9.809 -1.675 1.00 0.22 H new ATOM 0 HB ILE A 15 4.907 -7.486 -2.576 1.00 0.22 H new ATOM 0 HG12 ILE A 15 7.844 -7.027 -2.010 1.00 0.21 H new ATOM 0 HG13 ILE A 15 7.261 -7.436 -3.612 1.00 0.21 H new ATOM 0 HG21 ILE A 15 5.494 -6.322 -0.481 1.00 0.25 H new ATOM 0 HG22 ILE A 15 4.779 -7.922 -0.172 1.00 0.25 H new ATOM 0 HG23 ILE A 15 6.537 -7.689 -0.022 1.00 0.25 H new ATOM 0 HD11 ILE A 15 7.510 -5.015 -3.362 1.00 0.30 H new ATOM 0 HD12 ILE A 15 5.800 -5.446 -3.603 1.00 0.30 H new ATOM 0 HD13 ILE A 15 6.392 -5.031 -1.977 1.00 0.30 H new ATOM 75 N PHE A 16 7.130 -9.625 -4.338 1.00 0.20 N ATOM 76 CA PHE A 16 7.213 -9.790 -5.781 1.00 0.20 C ATOM 77 C PHE A 16 6.887 -11.209 -6.210 1.00 0.21 C ATOM 78 O PHE A 16 6.657 -11.475 -7.390 1.00 0.27 O ATOM 79 CB PHE A 16 8.595 -9.424 -6.262 1.00 0.20 C ATOM 80 CG PHE A 16 9.038 -8.089 -5.775 1.00 0.20 C ATOM 81 CD1 PHE A 16 8.441 -6.944 -6.257 1.00 0.22 C ATOM 82 CD2 PHE A 16 10.046 -7.977 -4.843 1.00 0.23 C ATOM 83 CE1 PHE A 16 8.841 -5.707 -5.823 1.00 0.24 C ATOM 84 CE2 PHE A 16 10.455 -6.740 -4.406 1.00 0.25 C ATOM 85 CZ PHE A 16 9.850 -5.603 -4.901 1.00 0.24 C ATOM 0 H PHE A 16 8.033 -9.506 -3.879 1.00 0.20 H new ATOM 0 HA PHE A 16 6.474 -9.126 -6.229 1.00 0.20 H new ATOM 0 HB2 PHE A 16 9.304 -10.182 -5.928 1.00 0.20 H new ATOM 0 HB3 PHE A 16 8.610 -9.432 -7.352 1.00 0.20 H new ATOM 0 HD1 PHE A 16 7.648 -7.023 -6.986 1.00 0.22 H new ATOM 0 HD2 PHE A 16 10.518 -8.867 -4.453 1.00 0.23 H new ATOM 0 HE1 PHE A 16 8.363 -4.818 -6.206 1.00 0.24 H new ATOM 0 HE2 PHE A 16 11.248 -6.658 -3.677 1.00 0.25 H new ATOM 0 HZ PHE A 16 10.172 -4.630 -4.561 1.00 0.24 H new ATOM 95 N ASP A 17 6.875 -12.118 -5.250 1.00 0.23 N ATOM 96 CA ASP A 17 6.522 -13.503 -5.520 1.00 0.27 C ATOM 97 C ASP A 17 5.034 -13.599 -5.849 1.00 0.24 C ATOM 98 O ASP A 17 4.561 -14.600 -6.393 1.00 0.33 O ATOM 99 CB ASP A 17 6.865 -14.378 -4.310 1.00 0.34 C ATOM 100 CG ASP A 17 6.481 -15.830 -4.503 1.00 0.99 C ATOM 101 OD1 ASP A 17 7.029 -16.479 -5.418 1.00 1.24 O ATOM 102 OD2 ASP A 17 5.629 -16.334 -3.748 1.00 1.96 O ATOM 0 H ASP A 17 7.106 -11.923 -4.276 1.00 0.23 H new ATOM 0 HA ASP A 17 7.094 -13.861 -6.376 1.00 0.27 H new ATOM 0 HB2 ASP A 17 7.935 -14.314 -4.114 1.00 0.34 H new ATOM 0 HB3 ASP A 17 6.355 -13.987 -3.429 1.00 0.34 H new ATOM 107 N PHE A 18 4.312 -12.532 -5.531 1.00 0.18 N ATOM 108 CA PHE A 18 2.879 -12.472 -5.767 1.00 0.19 C ATOM 109 C PHE A 18 2.546 -11.608 -6.987 1.00 0.24 C ATOM 110 O PHE A 18 3.419 -10.973 -7.581 1.00 0.40 O ATOM 111 CB PHE A 18 2.187 -11.923 -4.526 1.00 0.20 C ATOM 112 CG PHE A 18 2.368 -12.786 -3.308 1.00 0.18 C ATOM 113 CD1 PHE A 18 3.516 -12.691 -2.541 1.00 0.20 C ATOM 114 CD2 PHE A 18 1.394 -13.700 -2.939 1.00 0.19 C ATOM 115 CE1 PHE A 18 3.696 -13.494 -1.430 1.00 0.22 C ATOM 116 CE2 PHE A 18 1.563 -14.501 -1.827 1.00 0.20 C ATOM 117 CZ PHE A 18 2.689 -14.363 -1.040 1.00 0.20 C ATOM 0 H PHE A 18 4.701 -11.691 -5.105 1.00 0.18 H new ATOM 0 HA PHE A 18 2.520 -13.480 -5.973 1.00 0.19 H new ATOM 0 HB2 PHE A 18 2.573 -10.926 -4.316 1.00 0.20 H new ATOM 0 HB3 PHE A 18 1.122 -11.816 -4.731 1.00 0.20 H new ATOM 0 HD1 PHE A 18 4.282 -11.980 -2.814 1.00 0.20 H new ATOM 0 HD2 PHE A 18 0.493 -13.787 -3.528 1.00 0.19 H new ATOM 0 HE1 PHE A 18 4.617 -13.444 -0.868 1.00 0.22 H new ATOM 0 HE2 PHE A 18 0.814 -15.236 -1.573 1.00 0.20 H new ATOM 0 HZ PHE A 18 2.785 -14.929 -0.125 1.00 0.20 H new ATOM 127 N GLU A 19 1.270 -11.601 -7.342 1.00 0.28 N ATOM 128 CA GLU A 19 0.768 -10.888 -8.513 1.00 0.34 C ATOM 129 C GLU A 19 0.324 -9.473 -8.141 1.00 0.29 C ATOM 130 O GLU A 19 -0.058 -9.219 -7.000 1.00 0.48 O ATOM 131 CB GLU A 19 -0.421 -11.672 -9.086 1.00 0.59 C ATOM 132 CG GLU A 19 -1.255 -10.914 -10.107 1.00 1.16 C ATOM 133 CD GLU A 19 -2.661 -11.467 -10.216 1.00 1.99 C ATOM 134 OE1 GLU A 19 -3.467 -11.252 -9.286 1.00 2.77 O ATOM 135 OE2 GLU A 19 -2.973 -12.104 -11.249 1.00 2.28 O ATOM 0 H GLU A 19 0.544 -12.094 -6.822 1.00 0.28 H new ATOM 0 HA GLU A 19 1.563 -10.807 -9.254 1.00 0.34 H new ATOM 0 HB2 GLU A 19 -0.046 -12.584 -9.550 1.00 0.59 H new ATOM 0 HB3 GLU A 19 -1.068 -11.975 -8.263 1.00 0.59 H new ATOM 0 HG2 GLU A 19 -1.300 -9.861 -9.828 1.00 1.16 H new ATOM 0 HG3 GLU A 19 -0.769 -10.965 -11.081 1.00 1.16 H new ATOM 142 N VAL A 20 0.391 -8.549 -9.096 1.00 0.24 N ATOM 143 CA VAL A 20 -0.204 -7.231 -8.934 1.00 0.27 C ATOM 144 C VAL A 20 -0.890 -6.796 -10.222 1.00 0.25 C ATOM 145 O VAL A 20 -0.445 -7.124 -11.322 1.00 0.27 O ATOM 146 CB VAL A 20 0.831 -6.159 -8.514 1.00 0.35 C ATOM 147 CG1 VAL A 20 0.193 -4.781 -8.428 1.00 0.74 C ATOM 148 CG2 VAL A 20 1.432 -6.520 -7.181 1.00 0.49 C ATOM 0 H VAL A 20 0.854 -8.693 -9.993 1.00 0.24 H new ATOM 0 HA VAL A 20 -0.937 -7.316 -8.132 1.00 0.27 H new ATOM 0 HB VAL A 20 1.612 -6.129 -9.274 1.00 0.35 H new ATOM 0 HG11 VAL A 20 0.945 -4.050 -8.131 1.00 0.74 H new ATOM 0 HG12 VAL A 20 -0.215 -4.507 -9.401 1.00 0.74 H new ATOM 0 HG13 VAL A 20 -0.609 -4.797 -7.690 1.00 0.74 H new ATOM 0 HG21 VAL A 20 2.159 -5.761 -6.892 1.00 0.49 H new ATOM 0 HG22 VAL A 20 0.645 -6.573 -6.429 1.00 0.49 H new ATOM 0 HG23 VAL A 20 1.928 -7.488 -7.256 1.00 0.49 H new ATOM 158 N LEU A 21 -1.985 -6.075 -10.072 1.00 0.29 N ATOM 159 CA LEU A 21 -2.704 -5.521 -11.199 1.00 0.31 C ATOM 160 C LEU A 21 -2.744 -4.015 -11.080 1.00 0.27 C ATOM 161 O LEU A 21 -2.749 -3.479 -9.975 1.00 0.28 O ATOM 162 CB LEU A 21 -4.111 -6.098 -11.262 1.00 0.38 C ATOM 163 CG LEU A 21 -4.179 -7.619 -11.394 1.00 0.47 C ATOM 164 CD1 LEU A 21 -5.605 -8.104 -11.228 1.00 0.72 C ATOM 165 CD2 LEU A 21 -3.626 -8.061 -12.737 1.00 0.64 C ATOM 0 H LEU A 21 -2.399 -5.858 -9.165 1.00 0.29 H new ATOM 0 HA LEU A 21 -2.190 -5.787 -12.123 1.00 0.31 H new ATOM 0 HB2 LEU A 21 -4.650 -5.802 -10.362 1.00 0.38 H new ATOM 0 HB3 LEU A 21 -4.633 -5.651 -12.108 1.00 0.38 H new ATOM 0 HG LEU A 21 -3.569 -8.059 -10.605 1.00 0.47 H new ATOM 0 HD11 LEU A 21 -5.634 -9.189 -11.325 1.00 0.72 H new ATOM 0 HD12 LEU A 21 -5.974 -7.818 -10.243 1.00 0.72 H new ATOM 0 HD13 LEU A 21 -6.234 -7.654 -11.996 1.00 0.72 H new ATOM 0 HD21 LEU A 21 -3.682 -9.147 -12.814 1.00 0.64 H new ATOM 0 HD22 LEU A 21 -4.212 -7.610 -13.538 1.00 0.64 H new ATOM 0 HD23 LEU A 21 -2.587 -7.744 -12.825 1.00 0.64 H new ATOM 177 N ASP A 22 -2.745 -3.343 -12.219 1.00 0.28 N ATOM 178 CA ASP A 22 -2.752 -1.890 -12.255 1.00 0.29 C ATOM 179 C ASP A 22 -4.164 -1.398 -11.993 1.00 0.27 C ATOM 180 O ASP A 22 -5.048 -2.213 -11.727 1.00 0.27 O ATOM 181 CB ASP A 22 -2.242 -1.386 -13.613 1.00 0.41 C ATOM 182 CG ASP A 22 -1.909 0.095 -13.628 1.00 0.95 C ATOM 183 OD1 ASP A 22 -0.776 0.459 -13.267 1.00 1.32 O ATOM 184 OD2 ASP A 22 -2.782 0.900 -14.016 1.00 1.59 O ATOM 0 H ASP A 22 -2.741 -3.785 -13.138 1.00 0.28 H new ATOM 0 HA ASP A 22 -2.087 -1.500 -11.485 1.00 0.29 H new ATOM 0 HB2 ASP A 22 -1.353 -1.952 -13.890 1.00 0.41 H new ATOM 0 HB3 ASP A 22 -2.998 -1.587 -14.372 1.00 0.41 H new ATOM 189 N ALA A 23 -4.392 -0.105 -12.107 1.00 0.32 N ATOM 190 CA ALA A 23 -5.670 0.495 -11.729 1.00 0.38 C ATOM 191 C ALA A 23 -6.857 -0.197 -12.398 1.00 0.44 C ATOM 192 O ALA A 23 -7.969 -0.203 -11.864 1.00 0.52 O ATOM 193 CB ALA A 23 -5.665 1.973 -12.064 1.00 0.48 C ATOM 0 H ALA A 23 -3.706 0.562 -12.461 1.00 0.32 H new ATOM 0 HA ALA A 23 -5.788 0.364 -10.653 1.00 0.38 H new ATOM 0 HB1 ALA A 23 -6.620 2.414 -11.780 1.00 0.48 H new ATOM 0 HB2 ALA A 23 -4.861 2.467 -11.519 1.00 0.48 H new ATOM 0 HB3 ALA A 23 -5.510 2.103 -13.135 1.00 0.48 H new ATOM 199 N ASP A 24 -6.622 -0.792 -13.559 1.00 0.46 N ATOM 200 CA ASP A 24 -7.683 -1.478 -14.280 1.00 0.57 C ATOM 201 C ASP A 24 -7.401 -2.966 -14.445 1.00 0.49 C ATOM 202 O ASP A 24 -7.881 -3.579 -15.393 1.00 0.55 O ATOM 203 CB ASP A 24 -7.914 -0.831 -15.646 1.00 0.76 C ATOM 204 CG ASP A 24 -8.586 0.520 -15.526 1.00 1.49 C ATOM 205 OD1 ASP A 24 -9.799 0.564 -15.252 1.00 1.88 O ATOM 206 OD2 ASP A 24 -7.906 1.548 -15.722 1.00 2.22 O ATOM 0 H ASP A 24 -5.712 -0.813 -14.019 1.00 0.46 H new ATOM 0 HA ASP A 24 -8.588 -1.381 -13.680 1.00 0.57 H new ATOM 0 HB2 ASP A 24 -6.959 -0.717 -16.159 1.00 0.76 H new ATOM 0 HB3 ASP A 24 -8.529 -1.489 -16.260 1.00 0.76 H new ATOM 211 N HIS A 25 -6.588 -3.540 -13.543 1.00 0.43 N ATOM 212 CA HIS A 25 -6.379 -4.988 -13.493 1.00 0.42 C ATOM 213 C HIS A 25 -5.532 -5.445 -14.668 1.00 0.46 C ATOM 214 O HIS A 25 -5.387 -6.636 -14.934 1.00 0.53 O ATOM 215 CB HIS A 25 -7.699 -5.751 -13.427 1.00 0.45 C ATOM 216 CG HIS A 25 -8.467 -5.523 -12.154 1.00 0.51 C ATOM 217 ND1 HIS A 25 -8.613 -6.480 -11.174 1.00 0.57 N ATOM 218 CD2 HIS A 25 -9.122 -4.429 -11.701 1.00 0.66 C ATOM 219 CE1 HIS A 25 -9.319 -5.982 -10.174 1.00 0.67 C ATOM 220 NE2 HIS A 25 -9.646 -4.737 -10.467 1.00 0.73 N ATOM 0 H HIS A 25 -6.066 -3.018 -12.839 1.00 0.43 H new ATOM 0 HA HIS A 25 -5.838 -5.214 -12.574 1.00 0.42 H new ATOM 0 HB2 HIS A 25 -8.320 -5.458 -14.273 1.00 0.45 H new ATOM 0 HB3 HIS A 25 -7.498 -6.817 -13.533 1.00 0.45 H new ATOM 0 HD2 HIS A 25 -9.216 -3.484 -12.216 1.00 0.66 H new ATOM 0 HE1 HIS A 25 -9.584 -6.506 -9.268 1.00 0.67 H new ATOM 0 HE2 HIS A 25 -10.194 -4.110 -9.878 1.00 0.73 H new ATOM 229 N LYS A 26 -4.998 -4.468 -15.378 1.00 0.49 N ATOM 230 CA LYS A 26 -3.928 -4.699 -16.326 1.00 0.53 C ATOM 231 C LYS A 26 -2.731 -5.179 -15.528 1.00 0.45 C ATOM 232 O LYS A 26 -2.460 -4.624 -14.468 1.00 0.42 O ATOM 233 CB LYS A 26 -3.587 -3.386 -17.028 1.00 0.63 C ATOM 234 CG LYS A 26 -4.810 -2.615 -17.505 1.00 0.85 C ATOM 235 CD LYS A 26 -4.479 -1.152 -17.736 1.00 1.58 C ATOM 236 CE LYS A 26 -4.130 -0.473 -16.423 1.00 2.38 C ATOM 237 NZ LYS A 26 -3.618 0.910 -16.615 1.00 3.25 N ATOM 0 H LYS A 26 -5.295 -3.494 -15.313 1.00 0.49 H new ATOM 0 HA LYS A 26 -4.214 -5.433 -17.079 1.00 0.53 H new ATOM 0 HB2 LYS A 26 -3.014 -2.757 -16.346 1.00 0.63 H new ATOM 0 HB3 LYS A 26 -2.944 -3.597 -17.883 1.00 0.63 H new ATOM 0 HG2 LYS A 26 -5.184 -3.056 -18.429 1.00 0.85 H new ATOM 0 HG3 LYS A 26 -5.607 -2.698 -16.766 1.00 0.85 H new ATOM 0 HD2 LYS A 26 -3.643 -1.067 -18.430 1.00 1.58 H new ATOM 0 HD3 LYS A 26 -5.329 -0.649 -18.198 1.00 1.58 H new ATOM 0 HE2 LYS A 26 -5.014 -0.444 -15.786 1.00 2.38 H new ATOM 0 HE3 LYS A 26 -3.379 -1.065 -15.900 1.00 2.38 H new ATOM 0 HZ1 LYS A 26 -3.191 1.248 -15.729 1.00 3.25 H new ATOM 0 HZ2 LYS A 26 -2.901 0.913 -17.368 1.00 3.25 H new ATOM 0 HZ3 LYS A 26 -4.403 1.537 -16.883 1.00 3.25 H new ATOM 251 N PRO A 27 -2.019 -6.215 -15.978 1.00 0.51 N ATOM 252 CA PRO A 27 -0.937 -6.795 -15.181 1.00 0.46 C ATOM 253 C PRO A 27 0.121 -5.760 -14.803 1.00 0.36 C ATOM 254 O PRO A 27 0.821 -5.223 -15.664 1.00 0.41 O ATOM 255 CB PRO A 27 -0.336 -7.854 -16.109 1.00 0.58 C ATOM 256 CG PRO A 27 -1.416 -8.168 -17.089 1.00 0.86 C ATOM 257 CD PRO A 27 -2.200 -6.899 -17.267 1.00 0.68 C ATOM 0 HA PRO A 27 -1.300 -7.195 -14.234 1.00 0.46 H new ATOM 0 HB2 PRO A 27 0.555 -7.478 -16.611 1.00 0.58 H new ATOM 0 HB3 PRO A 27 -0.038 -8.743 -15.553 1.00 0.58 H new ATOM 0 HG2 PRO A 27 -0.996 -8.503 -18.038 1.00 0.86 H new ATOM 0 HG3 PRO A 27 -2.054 -8.972 -16.721 1.00 0.86 H new ATOM 0 HD2 PRO A 27 -1.820 -6.303 -18.097 1.00 0.68 H new ATOM 0 HD3 PRO A 27 -3.251 -7.100 -17.473 1.00 0.68 H new ATOM 265 N TYR A 28 0.218 -5.490 -13.510 1.00 0.28 N ATOM 266 CA TYR A 28 1.247 -4.607 -12.975 1.00 0.22 C ATOM 267 C TYR A 28 2.464 -5.398 -12.526 1.00 0.22 C ATOM 268 O TYR A 28 2.412 -6.140 -11.542 1.00 0.28 O ATOM 269 CB TYR A 28 0.677 -3.809 -11.805 1.00 0.20 C ATOM 270 CG TYR A 28 1.532 -2.655 -11.338 1.00 0.19 C ATOM 271 CD1 TYR A 28 1.626 -1.484 -12.083 1.00 0.21 C ATOM 272 CD2 TYR A 28 2.217 -2.720 -10.133 1.00 0.19 C ATOM 273 CE1 TYR A 28 2.380 -0.420 -11.643 1.00 0.23 C ATOM 274 CE2 TYR A 28 2.973 -1.659 -9.682 1.00 0.21 C ATOM 275 CZ TYR A 28 3.048 -0.508 -10.445 1.00 0.22 C ATOM 276 OH TYR A 28 3.797 0.559 -10.014 1.00 0.28 O ATOM 0 H TYR A 28 -0.410 -5.874 -12.804 1.00 0.28 H new ATOM 0 HA TYR A 28 1.562 -3.923 -13.763 1.00 0.22 H new ATOM 0 HB2 TYR A 28 -0.301 -3.423 -12.091 1.00 0.20 H new ATOM 0 HB3 TYR A 28 0.519 -4.487 -10.966 1.00 0.20 H new ATOM 0 HD1 TYR A 28 1.098 -1.409 -13.022 1.00 0.21 H new ATOM 0 HD2 TYR A 28 2.157 -3.619 -9.537 1.00 0.19 H new ATOM 0 HE1 TYR A 28 2.446 0.480 -12.236 1.00 0.23 H new ATOM 0 HE2 TYR A 28 3.501 -1.726 -8.742 1.00 0.21 H new ATOM 0 HH TYR A 28 3.943 1.179 -10.759 1.00 0.28 H new ATOM 286 N ASN A 29 3.558 -5.252 -13.262 1.00 0.27 N ATOM 287 CA ASN A 29 4.816 -5.870 -12.880 1.00 0.33 C ATOM 288 C ASN A 29 5.379 -5.146 -11.667 1.00 0.27 C ATOM 289 O ASN A 29 6.064 -4.131 -11.792 1.00 0.34 O ATOM 290 CB ASN A 29 5.824 -5.829 -14.030 1.00 0.49 C ATOM 291 CG ASN A 29 7.060 -6.656 -13.731 1.00 0.64 C ATOM 292 OD1 ASN A 29 6.977 -7.696 -13.078 1.00 1.65 O ATOM 293 ND2 ASN A 29 8.213 -6.193 -14.181 1.00 0.65 N ATOM 0 H ASN A 29 3.597 -4.711 -14.126 1.00 0.27 H new ATOM 0 HA ASN A 29 4.632 -6.916 -12.635 1.00 0.33 H new ATOM 0 HB2 ASN A 29 5.351 -6.199 -14.940 1.00 0.49 H new ATOM 0 HB3 ASN A 29 6.116 -4.796 -14.220 1.00 0.49 H new ATOM 0 HD21 ASN A 29 9.076 -6.702 -13.990 1.00 0.65 H new ATOM 0 HD22 ASN A 29 8.240 -5.327 -14.719 1.00 0.65 H new ATOM 300 N LEU A 30 5.064 -5.656 -10.490 1.00 0.20 N ATOM 301 CA LEU A 30 5.447 -5.005 -9.247 1.00 0.17 C ATOM 302 C LEU A 30 6.954 -5.073 -9.029 1.00 0.16 C ATOM 303 O LEU A 30 7.546 -4.199 -8.398 1.00 0.16 O ATOM 304 CB LEU A 30 4.728 -5.659 -8.057 1.00 0.19 C ATOM 305 CG LEU A 30 5.297 -6.991 -7.555 1.00 0.20 C ATOM 306 CD1 LEU A 30 4.645 -7.372 -6.238 1.00 0.25 C ATOM 307 CD2 LEU A 30 5.078 -8.091 -8.586 1.00 0.22 C ATOM 0 H LEU A 30 4.541 -6.523 -10.367 1.00 0.20 H new ATOM 0 HA LEU A 30 5.153 -3.958 -9.319 1.00 0.17 H new ATOM 0 HB2 LEU A 30 4.733 -4.953 -7.227 1.00 0.19 H new ATOM 0 HB3 LEU A 30 3.686 -5.817 -8.335 1.00 0.19 H new ATOM 0 HG LEU A 30 6.369 -6.873 -7.400 1.00 0.20 H new ATOM 0 HD11 LEU A 30 5.056 -8.320 -5.889 1.00 0.25 H new ATOM 0 HD12 LEU A 30 4.841 -6.597 -5.497 1.00 0.25 H new ATOM 0 HD13 LEU A 30 3.569 -7.473 -6.381 1.00 0.25 H new ATOM 0 HD21 LEU A 30 5.489 -9.028 -8.211 1.00 0.22 H new ATOM 0 HD22 LEU A 30 4.010 -8.210 -8.769 1.00 0.22 H new ATOM 0 HD23 LEU A 30 5.578 -7.822 -9.517 1.00 0.22 H new ATOM 319 N VAL A 31 7.567 -6.103 -9.584 1.00 0.16 N ATOM 320 CA VAL A 31 8.933 -6.463 -9.240 1.00 0.18 C ATOM 321 C VAL A 31 9.976 -5.552 -9.886 1.00 0.18 C ATOM 322 O VAL A 31 11.171 -5.688 -9.640 1.00 0.21 O ATOM 323 CB VAL A 31 9.180 -7.942 -9.569 1.00 0.22 C ATOM 324 CG1 VAL A 31 9.275 -8.179 -11.066 1.00 0.38 C ATOM 325 CG2 VAL A 31 10.396 -8.472 -8.852 1.00 0.41 C ATOM 0 H VAL A 31 7.137 -6.711 -10.281 1.00 0.16 H new ATOM 0 HA VAL A 31 9.051 -6.316 -8.166 1.00 0.18 H new ATOM 0 HB VAL A 31 8.315 -8.499 -9.208 1.00 0.22 H new ATOM 0 HG11 VAL A 31 9.450 -9.238 -11.256 1.00 0.38 H new ATOM 0 HG12 VAL A 31 8.343 -7.874 -11.543 1.00 0.38 H new ATOM 0 HG13 VAL A 31 10.100 -7.596 -11.475 1.00 0.38 H new ATOM 0 HG21 VAL A 31 10.541 -9.522 -9.108 1.00 0.41 H new ATOM 0 HG22 VAL A 31 11.274 -7.901 -9.153 1.00 0.41 H new ATOM 0 HG23 VAL A 31 10.254 -8.378 -7.775 1.00 0.41 H new ATOM 335 N GLN A 32 9.523 -4.595 -10.680 1.00 0.18 N ATOM 336 CA GLN A 32 10.417 -3.574 -11.209 1.00 0.22 C ATOM 337 C GLN A 32 10.700 -2.531 -10.131 1.00 0.21 C ATOM 338 O GLN A 32 11.505 -1.621 -10.318 1.00 0.25 O ATOM 339 CB GLN A 32 9.813 -2.905 -12.442 1.00 0.28 C ATOM 340 CG GLN A 32 8.464 -2.258 -12.176 1.00 0.29 C ATOM 341 CD GLN A 32 7.932 -1.478 -13.363 1.00 0.43 C ATOM 342 OE1 GLN A 32 8.695 -0.916 -14.147 1.00 1.24 O ATOM 343 NE2 GLN A 32 6.617 -1.458 -13.512 1.00 1.18 N ATOM 0 H GLN A 32 8.550 -4.503 -10.971 1.00 0.18 H new ATOM 0 HA GLN A 32 11.351 -4.051 -11.506 1.00 0.22 H new ATOM 0 HB2 GLN A 32 10.505 -2.148 -12.811 1.00 0.28 H new ATOM 0 HB3 GLN A 32 9.702 -3.648 -13.232 1.00 0.28 H new ATOM 0 HG2 GLN A 32 7.745 -3.031 -11.905 1.00 0.29 H new ATOM 0 HG3 GLN A 32 8.551 -1.589 -11.320 1.00 0.29 H new ATOM 0 HE21 GLN A 32 6.020 -1.938 -12.838 1.00 1.18 H new ATOM 0 HE22 GLN A 32 6.201 -0.963 -14.301 1.00 1.18 H new ATOM 352 N HIS A 33 10.019 -2.677 -9.001 1.00 0.19 N ATOM 353 CA HIS A 33 10.197 -1.784 -7.869 1.00 0.21 C ATOM 354 C HIS A 33 11.189 -2.403 -6.916 1.00 0.23 C ATOM 355 O HIS A 33 11.448 -1.879 -5.843 1.00 0.38 O ATOM 356 CB HIS A 33 8.861 -1.536 -7.170 1.00 0.22 C ATOM 357 CG HIS A 33 7.882 -0.822 -8.042 1.00 0.22 C ATOM 358 ND1 HIS A 33 8.169 0.384 -8.643 1.00 0.25 N ATOM 359 CD2 HIS A 33 6.626 -1.150 -8.437 1.00 0.21 C ATOM 360 CE1 HIS A 33 7.137 0.769 -9.364 1.00 0.26 C ATOM 361 NE2 HIS A 33 6.191 -0.142 -9.260 1.00 0.24 N ATOM 0 H HIS A 33 9.332 -3.415 -8.846 1.00 0.19 H new ATOM 0 HA HIS A 33 10.575 -0.822 -8.215 1.00 0.21 H new ATOM 0 HB2 HIS A 33 8.436 -2.490 -6.858 1.00 0.22 H new ATOM 0 HB3 HIS A 33 9.031 -0.951 -6.266 1.00 0.22 H new ATOM 0 HD2 HIS A 33 6.074 -2.035 -8.157 1.00 0.21 H new ATOM 0 HE1 HIS A 33 7.076 1.679 -9.943 1.00 0.26 H new ATOM 0 HE2 HIS A 33 5.280 -0.104 -9.718 1.00 0.24 H new ATOM 370 N LYS A 34 11.745 -3.534 -7.332 1.00 0.20 N ATOM 371 CA LYS A 34 12.717 -4.236 -6.527 1.00 0.21 C ATOM 372 C LYS A 34 14.077 -3.561 -6.644 1.00 0.21 C ATOM 373 O LYS A 34 14.429 -3.026 -7.699 1.00 0.28 O ATOM 374 CB LYS A 34 12.822 -5.703 -6.935 1.00 0.26 C ATOM 375 CG LYS A 34 13.624 -6.494 -5.924 1.00 0.35 C ATOM 376 CD LYS A 34 14.161 -7.801 -6.471 1.00 0.79 C ATOM 377 CE LYS A 34 13.063 -8.813 -6.725 1.00 1.03 C ATOM 378 NZ LYS A 34 13.622 -10.174 -6.900 1.00 1.73 N ATOM 0 H LYS A 34 11.534 -3.980 -8.225 1.00 0.20 H new ATOM 0 HA LYS A 34 12.385 -4.199 -5.490 1.00 0.21 H new ATOM 0 HB2 LYS A 34 11.824 -6.131 -7.026 1.00 0.26 H new ATOM 0 HB3 LYS A 34 13.292 -5.778 -7.916 1.00 0.26 H new ATOM 0 HG2 LYS A 34 14.458 -5.885 -5.576 1.00 0.35 H new ATOM 0 HG3 LYS A 34 12.997 -6.702 -5.057 1.00 0.35 H new ATOM 0 HD2 LYS A 34 14.698 -7.610 -7.400 1.00 0.79 H new ATOM 0 HD3 LYS A 34 14.881 -8.218 -5.767 1.00 0.79 H new ATOM 0 HE2 LYS A 34 12.361 -8.809 -5.891 1.00 1.03 H new ATOM 0 HE3 LYS A 34 12.502 -8.530 -7.616 1.00 1.03 H new ATOM 0 HZ1 LYS A 34 12.849 -10.847 -7.073 1.00 1.73 H new ATOM 0 HZ2 LYS A 34 14.274 -10.180 -7.711 1.00 1.73 H new ATOM 0 HZ3 LYS A 34 14.137 -10.451 -6.040 1.00 1.73 H new ATOM 392 N GLY A 35 14.838 -3.596 -5.560 1.00 0.21 N ATOM 393 CA GLY A 35 16.082 -2.863 -5.498 1.00 0.25 C ATOM 394 C GLY A 35 15.818 -1.428 -5.115 1.00 0.26 C ATOM 395 O GLY A 35 16.711 -0.580 -5.115 1.00 0.36 O ATOM 0 H GLY A 35 14.612 -4.124 -4.717 1.00 0.21 H new ATOM 0 HA2 GLY A 35 16.750 -3.325 -4.771 1.00 0.25 H new ATOM 0 HA3 GLY A 35 16.586 -2.903 -6.464 1.00 0.25 H new ATOM 399 N SER A 36 14.558 -1.166 -4.813 1.00 0.25 N ATOM 400 CA SER A 36 14.100 0.136 -4.383 1.00 0.29 C ATOM 401 C SER A 36 13.041 -0.046 -3.302 1.00 0.24 C ATOM 402 O SER A 36 12.231 -0.963 -3.386 1.00 0.31 O ATOM 403 CB SER A 36 13.518 0.888 -5.579 1.00 0.43 C ATOM 404 OG SER A 36 14.454 0.932 -6.642 1.00 1.14 O ATOM 0 H SER A 36 13.817 -1.865 -4.862 1.00 0.25 H new ATOM 0 HA SER A 36 14.930 0.714 -3.977 1.00 0.29 H new ATOM 0 HB2 SER A 36 12.603 0.399 -5.913 1.00 0.43 H new ATOM 0 HB3 SER A 36 13.248 1.902 -5.282 1.00 0.43 H new ATOM 0 HG SER A 36 14.065 1.416 -7.400 1.00 1.14 H new ATOM 410 N PRO A 37 13.061 0.775 -2.248 1.00 0.22 N ATOM 411 CA PRO A 37 12.018 0.737 -1.229 1.00 0.20 C ATOM 412 C PRO A 37 10.727 1.328 -1.758 1.00 0.19 C ATOM 413 O PRO A 37 10.739 2.204 -2.626 1.00 0.24 O ATOM 414 CB PRO A 37 12.581 1.594 -0.104 1.00 0.26 C ATOM 415 CG PRO A 37 13.501 2.542 -0.787 1.00 0.52 C ATOM 416 CD PRO A 37 14.075 1.803 -1.965 1.00 0.32 C ATOM 0 HA PRO A 37 11.777 -0.277 -0.909 1.00 0.20 H new ATOM 0 HB2 PRO A 37 11.789 2.122 0.428 1.00 0.26 H new ATOM 0 HB3 PRO A 37 13.109 0.987 0.631 1.00 0.26 H new ATOM 0 HG2 PRO A 37 12.967 3.435 -1.112 1.00 0.52 H new ATOM 0 HG3 PRO A 37 14.291 2.870 -0.112 1.00 0.52 H new ATOM 0 HD2 PRO A 37 14.227 2.463 -2.819 1.00 0.32 H new ATOM 0 HD3 PRO A 37 15.042 1.359 -1.729 1.00 0.32 H new ATOM 424 N LEU A 38 9.616 0.853 -1.247 1.00 0.18 N ATOM 425 CA LEU A 38 8.334 1.309 -1.720 1.00 0.19 C ATOM 426 C LEU A 38 7.277 1.172 -0.642 1.00 0.18 C ATOM 427 O LEU A 38 7.373 0.326 0.235 1.00 0.24 O ATOM 428 CB LEU A 38 7.908 0.541 -2.984 1.00 0.24 C ATOM 429 CG LEU A 38 7.709 -0.973 -2.840 1.00 0.40 C ATOM 430 CD1 LEU A 38 6.925 -1.514 -4.022 1.00 0.79 C ATOM 431 CD2 LEU A 38 9.042 -1.703 -2.735 1.00 1.03 C ATOM 0 H LEU A 38 9.575 0.153 -0.506 1.00 0.18 H new ATOM 0 HA LEU A 38 8.432 2.364 -1.974 1.00 0.19 H new ATOM 0 HB2 LEU A 38 6.975 0.973 -3.346 1.00 0.24 H new ATOM 0 HB3 LEU A 38 8.659 0.713 -3.755 1.00 0.24 H new ATOM 0 HG LEU A 38 7.150 -1.146 -1.920 1.00 0.40 H new ATOM 0 HD11 LEU A 38 6.791 -2.590 -3.908 1.00 0.79 H new ATOM 0 HD12 LEU A 38 5.950 -1.029 -4.065 1.00 0.79 H new ATOM 0 HD13 LEU A 38 7.471 -1.312 -4.944 1.00 0.79 H new ATOM 0 HD21 LEU A 38 8.864 -2.774 -2.634 1.00 1.03 H new ATOM 0 HD22 LEU A 38 9.631 -1.516 -3.633 1.00 1.03 H new ATOM 0 HD23 LEU A 38 9.587 -1.342 -1.863 1.00 1.03 H new ATOM 443 N LEU A 39 6.285 2.032 -0.703 1.00 0.17 N ATOM 444 CA LEU A 39 5.136 1.929 0.167 1.00 0.16 C ATOM 445 C LEU A 39 3.959 1.452 -0.641 1.00 0.19 C ATOM 446 O LEU A 39 3.903 1.666 -1.843 1.00 0.42 O ATOM 447 CB LEU A 39 4.795 3.261 0.825 1.00 0.21 C ATOM 448 CG LEU A 39 5.335 3.446 2.245 1.00 0.25 C ATOM 449 CD1 LEU A 39 6.842 3.284 2.295 1.00 0.97 C ATOM 450 CD2 LEU A 39 4.930 4.803 2.787 1.00 1.10 C ATOM 0 H LEU A 39 6.252 2.818 -1.353 1.00 0.17 H new ATOM 0 HA LEU A 39 5.373 1.222 0.962 1.00 0.16 H new ATOM 0 HB2 LEU A 39 5.181 4.066 0.199 1.00 0.21 H new ATOM 0 HB3 LEU A 39 3.711 3.368 0.849 1.00 0.21 H new ATOM 0 HG LEU A 39 4.899 2.668 2.872 1.00 0.25 H new ATOM 0 HD11 LEU A 39 7.189 3.422 3.319 1.00 0.97 H new ATOM 0 HD12 LEU A 39 7.112 2.285 1.952 1.00 0.97 H new ATOM 0 HD13 LEU A 39 7.310 4.028 1.650 1.00 0.97 H new ATOM 0 HD21 LEU A 39 5.320 4.922 3.798 1.00 1.10 H new ATOM 0 HD22 LEU A 39 5.335 5.586 2.147 1.00 1.10 H new ATOM 0 HD23 LEU A 39 3.843 4.877 2.807 1.00 1.10 H new ATOM 462 N ILE A 40 3.038 0.793 0.015 1.00 0.18 N ATOM 463 CA ILE A 40 1.887 0.221 -0.652 1.00 0.15 C ATOM 464 C ILE A 40 0.663 0.412 0.225 1.00 0.14 C ATOM 465 O ILE A 40 0.608 -0.127 1.332 1.00 0.15 O ATOM 466 CB ILE A 40 2.116 -1.279 -0.960 1.00 0.16 C ATOM 467 CG1 ILE A 40 3.334 -1.446 -1.880 1.00 0.18 C ATOM 468 CG2 ILE A 40 0.880 -1.891 -1.595 1.00 0.20 C ATOM 469 CD1 ILE A 40 3.718 -2.884 -2.154 1.00 0.18 C ATOM 0 H ILE A 40 3.061 0.636 1.023 1.00 0.18 H new ATOM 0 HA ILE A 40 1.732 0.729 -1.604 1.00 0.15 H new ATOM 0 HB ILE A 40 2.309 -1.802 -0.023 1.00 0.16 H new ATOM 0 HG12 ILE A 40 3.128 -0.951 -2.829 1.00 0.18 H new ATOM 0 HG13 ILE A 40 4.186 -0.934 -1.432 1.00 0.18 H new ATOM 0 HG21 ILE A 40 1.062 -2.945 -1.803 1.00 0.20 H new ATOM 0 HG22 ILE A 40 0.036 -1.797 -0.912 1.00 0.20 H new ATOM 0 HG23 ILE A 40 0.654 -1.371 -2.526 1.00 0.20 H new ATOM 0 HD11 ILE A 40 4.587 -2.910 -2.811 1.00 0.18 H new ATOM 0 HD12 ILE A 40 3.959 -3.382 -1.215 1.00 0.18 H new ATOM 0 HD13 ILE A 40 2.885 -3.398 -2.634 1.00 0.18 H new ATOM 481 N TYR A 41 -0.296 1.206 -0.242 1.00 0.13 N ATOM 482 CA TYR A 41 -1.437 1.555 0.579 1.00 0.13 C ATOM 483 C TYR A 41 -2.666 0.745 0.170 1.00 0.14 C ATOM 484 O TYR A 41 -3.079 0.794 -0.982 1.00 0.19 O ATOM 485 CB TYR A 41 -1.739 3.060 0.436 1.00 0.15 C ATOM 486 CG TYR A 41 -0.668 3.996 0.973 1.00 0.14 C ATOM 487 CD1 TYR A 41 0.561 4.108 0.334 1.00 0.17 C ATOM 488 CD2 TYR A 41 -0.868 4.741 2.124 1.00 0.18 C ATOM 489 CE1 TYR A 41 1.556 4.931 0.824 1.00 0.19 C ATOM 490 CE2 TYR A 41 0.121 5.573 2.618 1.00 0.20 C ATOM 491 CZ TYR A 41 1.258 5.757 1.946 1.00 0.18 C ATOM 492 OH TYR A 41 2.318 6.479 2.462 1.00 0.23 O ATOM 0 H TYR A 41 -0.301 1.614 -1.177 1.00 0.13 H new ATOM 0 HA TYR A 41 -1.199 1.325 1.618 1.00 0.13 H new ATOM 0 HB2 TYR A 41 -1.896 3.283 -0.619 1.00 0.15 H new ATOM 0 HB3 TYR A 41 -2.676 3.275 0.950 1.00 0.15 H new ATOM 0 HD1 TYR A 41 0.742 3.539 -0.566 1.00 0.17 H new ATOM 0 HD2 TYR A 41 -1.812 4.671 2.644 1.00 0.18 H new ATOM 0 HE1 TYR A 41 2.535 4.948 0.368 1.00 0.19 H new ATOM 0 HE2 TYR A 41 -0.030 6.080 3.560 1.00 0.20 H new ATOM 0 HH TYR A 41 2.010 7.012 3.225 1.00 0.23 H new ATOM 502 N ASN A 42 -3.245 0.014 1.115 1.00 0.16 N ATOM 503 CA ASN A 42 -4.552 -0.609 0.914 1.00 0.18 C ATOM 504 C ASN A 42 -5.631 0.447 1.153 1.00 0.18 C ATOM 505 O ASN A 42 -6.106 0.645 2.269 1.00 0.21 O ATOM 506 CB ASN A 42 -4.734 -1.821 1.846 1.00 0.26 C ATOM 507 CG ASN A 42 -4.185 -1.644 3.260 1.00 0.46 C ATOM 508 OD1 ASN A 42 -3.603 -2.570 3.826 1.00 1.25 O ATOM 509 ND2 ASN A 42 -4.401 -0.493 3.861 1.00 1.28 N ATOM 0 H ASN A 42 -2.831 -0.163 2.030 1.00 0.16 H new ATOM 0 HA ASN A 42 -4.631 -0.983 -0.107 1.00 0.18 H new ATOM 0 HB2 ASN A 42 -5.797 -2.051 1.913 1.00 0.26 H new ATOM 0 HB3 ASN A 42 -4.249 -2.685 1.391 1.00 0.26 H new ATOM 0 HD21 ASN A 42 -4.084 -0.351 4.820 1.00 1.28 H new ATOM 0 HD22 ASN A 42 -4.886 0.257 3.368 1.00 1.28 H new ATOM 516 N VAL A 43 -6.031 1.117 0.095 1.00 0.18 N ATOM 517 CA VAL A 43 -6.772 2.358 0.230 1.00 0.21 C ATOM 518 C VAL A 43 -8.223 2.238 -0.204 1.00 0.25 C ATOM 519 O VAL A 43 -8.526 1.718 -1.272 1.00 0.35 O ATOM 520 CB VAL A 43 -6.091 3.498 -0.567 1.00 0.27 C ATOM 521 CG1 VAL A 43 -5.762 3.065 -1.988 1.00 0.68 C ATOM 522 CG2 VAL A 43 -6.969 4.739 -0.586 1.00 0.88 C ATOM 0 H VAL A 43 -5.858 0.827 -0.867 1.00 0.18 H new ATOM 0 HA VAL A 43 -6.766 2.594 1.294 1.00 0.21 H new ATOM 0 HB VAL A 43 -5.155 3.737 -0.062 1.00 0.27 H new ATOM 0 HG11 VAL A 43 -5.285 3.889 -2.518 1.00 0.68 H new ATOM 0 HG12 VAL A 43 -5.085 2.211 -1.961 1.00 0.68 H new ATOM 0 HG13 VAL A 43 -6.680 2.784 -2.504 1.00 0.68 H new ATOM 0 HG21 VAL A 43 -6.472 5.528 -1.151 1.00 0.88 H new ATOM 0 HG22 VAL A 43 -7.923 4.502 -1.056 1.00 0.88 H new ATOM 0 HG23 VAL A 43 -7.142 5.078 0.435 1.00 0.88 H new ATOM 532 N ALA A 44 -9.121 2.736 0.637 1.00 0.32 N ATOM 533 CA ALA A 44 -10.499 2.928 0.232 1.00 0.39 C ATOM 534 C ALA A 44 -10.497 3.922 -0.914 1.00 0.36 C ATOM 535 O ALA A 44 -10.166 5.094 -0.732 1.00 0.42 O ATOM 536 CB ALA A 44 -11.352 3.419 1.387 1.00 0.52 C ATOM 0 H ALA A 44 -8.917 3.012 1.598 1.00 0.32 H new ATOM 0 HA ALA A 44 -10.935 1.981 -0.087 1.00 0.39 H new ATOM 0 HB1 ALA A 44 -12.380 3.553 1.049 1.00 0.52 H new ATOM 0 HB2 ALA A 44 -11.328 2.687 2.194 1.00 0.52 H new ATOM 0 HB3 ALA A 44 -10.962 4.371 1.748 1.00 0.52 H new ATOM 542 N SER A 45 -10.842 3.434 -2.085 1.00 0.39 N ATOM 543 CA SER A 45 -10.531 4.086 -3.336 1.00 0.45 C ATOM 544 C SER A 45 -11.419 5.310 -3.628 1.00 0.47 C ATOM 545 O SER A 45 -12.173 5.333 -4.600 1.00 0.60 O ATOM 546 CB SER A 45 -10.622 3.007 -4.409 1.00 0.62 C ATOM 547 OG SER A 45 -11.296 1.870 -3.898 1.00 1.84 O ATOM 0 H SER A 45 -11.355 2.559 -2.196 1.00 0.39 H new ATOM 0 HA SER A 45 -9.529 4.515 -3.304 1.00 0.45 H new ATOM 0 HB2 SER A 45 -11.152 3.393 -5.280 1.00 0.62 H new ATOM 0 HB3 SER A 45 -9.622 2.728 -4.742 1.00 0.62 H new ATOM 0 HG SER A 45 -11.768 1.415 -4.626 1.00 1.84 H new ATOM 553 N LYS A 46 -11.277 6.322 -2.765 1.00 0.56 N ATOM 554 CA LYS A 46 -11.903 7.641 -2.913 1.00 0.65 C ATOM 555 C LYS A 46 -13.387 7.628 -2.550 1.00 0.63 C ATOM 556 O LYS A 46 -14.237 8.069 -3.321 1.00 0.83 O ATOM 557 CB LYS A 46 -11.690 8.227 -4.319 1.00 0.77 C ATOM 558 CG LYS A 46 -12.068 9.700 -4.420 1.00 1.12 C ATOM 559 CD LYS A 46 -11.282 10.548 -3.429 1.00 1.59 C ATOM 560 CE LYS A 46 -9.920 10.952 -3.978 1.00 2.01 C ATOM 561 NZ LYS A 46 -10.035 12.001 -5.027 1.00 2.43 N ATOM 0 H LYS A 46 -10.708 6.244 -1.922 1.00 0.56 H new ATOM 0 HA LYS A 46 -11.399 8.293 -2.200 1.00 0.65 H new ATOM 0 HB2 LYS A 46 -10.644 8.107 -4.601 1.00 0.77 H new ATOM 0 HB3 LYS A 46 -12.281 7.657 -5.036 1.00 0.77 H new ATOM 0 HG2 LYS A 46 -11.881 10.056 -5.433 1.00 1.12 H new ATOM 0 HG3 LYS A 46 -13.136 9.816 -4.233 1.00 1.12 H new ATOM 0 HD2 LYS A 46 -11.854 11.443 -3.184 1.00 1.59 H new ATOM 0 HD3 LYS A 46 -11.148 9.991 -2.501 1.00 1.59 H new ATOM 0 HE2 LYS A 46 -9.295 11.319 -3.164 1.00 2.01 H new ATOM 0 HE3 LYS A 46 -9.421 10.076 -4.393 1.00 2.01 H new ATOM 0 HZ1 LYS A 46 -9.099 12.417 -5.206 1.00 2.43 H new ATOM 0 HZ2 LYS A 46 -10.399 11.577 -5.904 1.00 2.43 H new ATOM 0 HZ3 LYS A 46 -10.688 12.744 -4.705 1.00 2.43 H new ATOM 575 N CYS A 47 -13.690 7.129 -1.363 1.00 0.61 N ATOM 576 CA CYS A 47 -15.030 7.247 -0.814 1.00 0.63 C ATOM 577 C CYS A 47 -14.935 7.402 0.698 1.00 0.75 C ATOM 578 O CYS A 47 -14.194 6.668 1.355 1.00 0.96 O ATOM 579 CB CYS A 47 -15.897 6.025 -1.162 1.00 0.70 C ATOM 580 SG CYS A 47 -15.555 5.282 -2.780 1.00 0.99 S ATOM 0 H CYS A 47 -13.027 6.639 -0.762 1.00 0.61 H new ATOM 0 HA CYS A 47 -15.507 8.123 -1.254 1.00 0.63 H new ATOM 0 HB2 CYS A 47 -15.755 5.266 -0.393 1.00 0.70 H new ATOM 0 HB3 CYS A 47 -16.946 6.320 -1.128 1.00 0.70 H new ATOM 585 N GLY A 48 -15.637 8.387 1.240 1.00 0.82 N ATOM 586 CA GLY A 48 -15.730 8.522 2.680 1.00 1.09 C ATOM 587 C GLY A 48 -14.596 9.322 3.299 1.00 0.83 C ATOM 588 O GLY A 48 -14.742 10.518 3.551 1.00 0.95 O ATOM 0 H GLY A 48 -16.144 9.095 0.709 1.00 0.82 H new ATOM 0 HA2 GLY A 48 -16.677 9.000 2.930 1.00 1.09 H new ATOM 0 HA3 GLY A 48 -15.747 7.528 3.128 1.00 1.09 H new ATOM 592 N TYR A 49 -13.465 8.671 3.541 1.00 0.84 N ATOM 593 CA TYR A 49 -12.392 9.278 4.322 1.00 0.81 C ATOM 594 C TYR A 49 -11.025 9.006 3.693 1.00 0.74 C ATOM 595 O TYR A 49 -10.899 8.163 2.805 1.00 1.08 O ATOM 596 CB TYR A 49 -12.433 8.731 5.748 1.00 1.17 C ATOM 597 CG TYR A 49 -11.942 9.728 6.760 1.00 1.46 C ATOM 598 CD1 TYR A 49 -12.541 10.975 6.856 1.00 1.79 C ATOM 599 CD2 TYR A 49 -10.885 9.434 7.612 1.00 2.18 C ATOM 600 CE1 TYR A 49 -12.104 11.903 7.769 1.00 2.24 C ATOM 601 CE2 TYR A 49 -10.443 10.363 8.533 1.00 2.70 C ATOM 602 CZ TYR A 49 -11.056 11.594 8.603 1.00 2.55 C ATOM 603 OH TYR A 49 -10.630 12.525 9.511 1.00 3.16 O ATOM 0 H TYR A 49 -13.266 7.727 3.210 1.00 0.84 H new ATOM 0 HA TYR A 49 -12.542 10.358 4.337 1.00 0.81 H new ATOM 0 HB2 TYR A 49 -13.455 8.442 5.994 1.00 1.17 H new ATOM 0 HB3 TYR A 49 -11.824 7.829 5.806 1.00 1.17 H new ATOM 0 HD1 TYR A 49 -13.365 11.220 6.202 1.00 1.79 H new ATOM 0 HD2 TYR A 49 -10.404 8.469 7.553 1.00 2.18 H new ATOM 0 HE1 TYR A 49 -12.581 12.870 7.831 1.00 2.24 H new ATOM 0 HE2 TYR A 49 -9.622 10.126 9.194 1.00 2.70 H new ATOM 0 HH TYR A 49 -9.883 12.159 10.029 1.00 3.16 H new ATOM 613 N THR A 50 -10.009 9.735 4.155 1.00 0.66 N ATOM 614 CA THR A 50 -8.652 9.594 3.637 1.00 0.68 C ATOM 615 C THR A 50 -7.617 9.537 4.765 1.00 0.89 C ATOM 616 O THR A 50 -6.652 8.773 4.701 1.00 1.94 O ATOM 617 CB THR A 50 -8.303 10.763 2.694 1.00 0.71 C ATOM 618 OG1 THR A 50 -8.634 12.004 3.329 1.00 1.00 O ATOM 619 CG2 THR A 50 -9.046 10.650 1.371 1.00 0.83 C ATOM 0 H THR A 50 -10.104 10.433 4.892 1.00 0.66 H new ATOM 0 HA THR A 50 -8.620 8.654 3.086 1.00 0.68 H new ATOM 0 HB THR A 50 -7.234 10.725 2.485 1.00 0.71 H new ATOM 0 HG1 THR A 50 -8.411 12.747 2.731 1.00 1.00 H new ATOM 0 HG21 THR A 50 -8.777 11.490 0.730 1.00 0.83 H new ATOM 0 HG22 THR A 50 -8.773 9.716 0.879 1.00 0.83 H new ATOM 0 HG23 THR A 50 -10.120 10.663 1.555 1.00 0.83 H new ATOM 627 N LYS A 51 -7.817 10.389 5.775 1.00 0.51 N ATOM 628 CA LYS A 51 -6.989 10.428 6.992 1.00 0.44 C ATOM 629 C LYS A 51 -5.587 10.987 6.722 1.00 0.45 C ATOM 630 O LYS A 51 -4.780 11.108 7.642 1.00 0.59 O ATOM 631 CB LYS A 51 -6.907 9.053 7.669 1.00 0.55 C ATOM 632 CG LYS A 51 -6.638 9.154 9.167 1.00 1.23 C ATOM 633 CD LYS A 51 -6.566 7.796 9.850 1.00 1.45 C ATOM 634 CE LYS A 51 -7.864 7.013 9.725 1.00 1.44 C ATOM 635 NZ LYS A 51 -7.921 5.893 10.704 1.00 2.03 N ATOM 0 H LYS A 51 -8.567 11.081 5.774 1.00 0.51 H new ATOM 0 HA LYS A 51 -7.486 11.112 7.680 1.00 0.44 H new ATOM 0 HB2 LYS A 51 -7.841 8.515 7.506 1.00 0.55 H new ATOM 0 HB3 LYS A 51 -6.116 8.467 7.200 1.00 0.55 H new ATOM 0 HG2 LYS A 51 -5.700 9.686 9.327 1.00 1.23 H new ATOM 0 HG3 LYS A 51 -7.424 9.748 9.633 1.00 1.23 H new ATOM 0 HD2 LYS A 51 -5.752 7.216 9.414 1.00 1.45 H new ATOM 0 HD3 LYS A 51 -6.329 7.935 10.905 1.00 1.45 H new ATOM 0 HE2 LYS A 51 -8.710 7.681 9.885 1.00 1.44 H new ATOM 0 HE3 LYS A 51 -7.956 6.618 8.713 1.00 1.44 H new ATOM 0 HZ1 LYS A 51 -8.818 5.380 10.592 1.00 2.03 H new ATOM 0 HZ2 LYS A 51 -7.127 5.243 10.535 1.00 2.03 H new ATOM 0 HZ3 LYS A 51 -7.857 6.273 11.670 1.00 2.03 H new ATOM 649 N GLY A 52 -5.316 11.361 5.472 1.00 0.43 N ATOM 650 CA GLY A 52 -4.020 11.935 5.131 1.00 0.47 C ATOM 651 C GLY A 52 -3.135 10.974 4.364 1.00 0.39 C ATOM 652 O GLY A 52 -2.017 11.322 3.988 1.00 0.45 O ATOM 0 H GLY A 52 -5.967 11.278 4.691 1.00 0.43 H new ATOM 0 HA2 GLY A 52 -4.172 12.835 4.536 1.00 0.47 H new ATOM 0 HA3 GLY A 52 -3.511 12.239 6.045 1.00 0.47 H new ATOM 656 N GLY A 53 -3.656 9.783 4.090 1.00 0.34 N ATOM 657 CA GLY A 53 -2.881 8.759 3.413 1.00 0.30 C ATOM 658 C GLY A 53 -2.514 9.178 2.013 1.00 0.27 C ATOM 659 O GLY A 53 -1.486 8.775 1.484 1.00 0.26 O ATOM 0 H GLY A 53 -4.609 9.507 4.327 1.00 0.34 H new ATOM 0 HA2 GLY A 53 -1.974 8.553 3.981 1.00 0.30 H new ATOM 0 HA3 GLY A 53 -3.453 7.832 3.378 1.00 0.30 H new ATOM 663 N TYR A 54 -3.365 9.998 1.423 1.00 0.30 N ATOM 664 CA TYR A 54 -3.165 10.473 0.075 1.00 0.29 C ATOM 665 C TYR A 54 -2.013 11.470 0.028 1.00 0.26 C ATOM 666 O TYR A 54 -1.042 11.279 -0.706 1.00 0.25 O ATOM 667 CB TYR A 54 -4.461 11.115 -0.423 1.00 0.32 C ATOM 668 CG TYR A 54 -4.467 11.424 -1.895 1.00 0.32 C ATOM 669 CD1 TYR A 54 -3.381 11.105 -2.689 1.00 0.32 C ATOM 670 CD2 TYR A 54 -5.563 12.025 -2.488 1.00 0.49 C ATOM 671 CE1 TYR A 54 -3.388 11.375 -4.042 1.00 0.33 C ATOM 672 CE2 TYR A 54 -5.591 12.287 -3.838 1.00 0.57 C ATOM 673 CZ TYR A 54 -4.456 12.028 -4.602 1.00 0.43 C ATOM 674 OH TYR A 54 -4.527 12.189 -5.976 1.00 0.52 O ATOM 0 H TYR A 54 -4.212 10.350 1.868 1.00 0.30 H new ATOM 0 HA TYR A 54 -2.907 9.636 -0.574 1.00 0.29 H new ATOM 0 HB2 TYR A 54 -5.294 10.448 -0.199 1.00 0.32 H new ATOM 0 HB3 TYR A 54 -4.633 12.037 0.132 1.00 0.32 H new ATOM 0 HD1 TYR A 54 -2.515 10.638 -2.244 1.00 0.32 H new ATOM 0 HD2 TYR A 54 -6.413 12.294 -1.879 1.00 0.49 H new ATOM 0 HE1 TYR A 54 -2.554 11.073 -4.659 1.00 0.33 H new ATOM 0 HE2 TYR A 54 -6.481 12.688 -4.299 1.00 0.57 H new ATOM 0 HH TYR A 54 -5.309 11.710 -6.322 1.00 0.52 H new ATOM 684 N GLU A 55 -2.123 12.525 0.824 1.00 0.26 N ATOM 685 CA GLU A 55 -1.126 13.586 0.836 1.00 0.26 C ATOM 686 C GLU A 55 0.248 13.032 1.194 1.00 0.22 C ATOM 687 O GLU A 55 1.252 13.372 0.564 1.00 0.24 O ATOM 688 CB GLU A 55 -1.532 14.672 1.830 1.00 0.33 C ATOM 689 CG GLU A 55 -0.851 15.999 1.571 1.00 1.15 C ATOM 690 CD GLU A 55 -1.246 17.071 2.562 1.00 1.78 C ATOM 691 OE1 GLU A 55 -2.310 17.698 2.374 1.00 2.23 O ATOM 692 OE2 GLU A 55 -0.497 17.284 3.538 1.00 2.46 O ATOM 0 H GLU A 55 -2.897 12.669 1.473 1.00 0.26 H new ATOM 0 HA GLU A 55 -1.070 14.020 -0.162 1.00 0.26 H new ATOM 0 HB2 GLU A 55 -2.612 14.810 1.787 1.00 0.33 H new ATOM 0 HB3 GLU A 55 -1.294 14.339 2.840 1.00 0.33 H new ATOM 0 HG2 GLU A 55 0.229 15.859 1.607 1.00 1.15 H new ATOM 0 HG3 GLU A 55 -1.096 16.336 0.564 1.00 1.15 H new ATOM 699 N THR A 56 0.277 12.165 2.193 1.00 0.21 N ATOM 700 CA THR A 56 1.504 11.537 2.636 1.00 0.21 C ATOM 701 C THR A 56 2.103 10.656 1.533 1.00 0.19 C ATOM 702 O THR A 56 3.279 10.785 1.200 1.00 0.21 O ATOM 703 CB THR A 56 1.233 10.706 3.904 1.00 0.26 C ATOM 704 OG1 THR A 56 0.734 11.560 4.946 1.00 0.33 O ATOM 705 CG2 THR A 56 2.483 10.001 4.387 1.00 0.27 C ATOM 0 H THR A 56 -0.550 11.879 2.717 1.00 0.21 H new ATOM 0 HA THR A 56 2.229 12.317 2.867 1.00 0.21 H new ATOM 0 HB THR A 56 0.491 9.948 3.653 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.239 11.645 4.861 1.00 0.33 H new ATOM 0 HG21 THR A 56 2.253 9.425 5.283 1.00 0.27 H new ATOM 0 HG22 THR A 56 2.847 9.331 3.608 1.00 0.27 H new ATOM 0 HG23 THR A 56 3.251 10.739 4.618 1.00 0.27 H new ATOM 713 N ALA A 57 1.278 9.798 0.941 1.00 0.18 N ATOM 714 CA ALA A 57 1.735 8.888 -0.107 1.00 0.17 C ATOM 715 C ALA A 57 2.289 9.643 -1.306 1.00 0.17 C ATOM 716 O ALA A 57 3.355 9.311 -1.828 1.00 0.18 O ATOM 717 CB ALA A 57 0.597 7.991 -0.557 1.00 0.19 C ATOM 0 H ALA A 57 0.287 9.713 1.169 1.00 0.18 H new ATOM 0 HA ALA A 57 2.537 8.282 0.315 1.00 0.17 H new ATOM 0 HB1 ALA A 57 0.951 7.318 -1.338 1.00 0.19 H new ATOM 0 HB2 ALA A 57 0.238 7.407 0.290 1.00 0.19 H new ATOM 0 HB3 ALA A 57 -0.216 8.603 -0.947 1.00 0.19 H new ATOM 723 N THR A 58 1.557 10.660 -1.735 1.00 0.18 N ATOM 724 CA THR A 58 1.935 11.436 -2.902 1.00 0.20 C ATOM 725 C THR A 58 3.278 12.138 -2.691 1.00 0.19 C ATOM 726 O THR A 58 4.160 12.081 -3.548 1.00 0.21 O ATOM 727 CB THR A 58 0.874 12.495 -3.219 1.00 0.23 C ATOM 728 OG1 THR A 58 -0.420 11.889 -3.257 1.00 0.27 O ATOM 729 CG2 THR A 58 1.157 13.185 -4.544 1.00 0.30 C ATOM 0 H THR A 58 0.693 10.967 -1.288 1.00 0.18 H new ATOM 0 HA THR A 58 2.020 10.738 -3.735 1.00 0.20 H new ATOM 0 HB THR A 58 0.904 13.248 -2.432 1.00 0.23 H new ATOM 0 HG1 THR A 58 -0.783 11.835 -2.348 1.00 0.27 H new ATOM 0 HG21 THR A 58 0.385 13.930 -4.738 1.00 0.30 H new ATOM 0 HG22 THR A 58 2.130 13.674 -4.499 1.00 0.30 H new ATOM 0 HG23 THR A 58 1.158 12.447 -5.346 1.00 0.30 H new ATOM 737 N THR A 59 3.427 12.796 -1.541 1.00 0.18 N ATOM 738 CA THR A 59 4.645 13.534 -1.241 1.00 0.19 C ATOM 739 C THR A 59 5.842 12.598 -1.146 1.00 0.18 C ATOM 740 O THR A 59 6.918 12.903 -1.659 1.00 0.22 O ATOM 741 CB THR A 59 4.511 14.341 0.063 1.00 0.23 C ATOM 742 OG1 THR A 59 3.902 13.537 1.076 1.00 0.97 O ATOM 743 CG2 THR A 59 3.685 15.597 -0.157 1.00 1.08 C ATOM 0 H THR A 59 2.720 12.831 -0.807 1.00 0.18 H new ATOM 0 HA THR A 59 4.806 14.232 -2.063 1.00 0.19 H new ATOM 0 HB THR A 59 5.510 14.635 0.384 1.00 0.23 H new ATOM 0 HG1 THR A 59 2.927 13.586 0.990 1.00 0.97 H new ATOM 0 HG21 THR A 59 3.606 16.149 0.780 1.00 1.08 H new ATOM 0 HG22 THR A 59 4.168 16.223 -0.907 1.00 1.08 H new ATOM 0 HG23 THR A 59 2.688 15.321 -0.501 1.00 1.08 H new ATOM 751 N LEU A 60 5.644 11.451 -0.505 1.00 0.16 N ATOM 752 CA LEU A 60 6.678 10.432 -0.422 1.00 0.15 C ATOM 753 C LEU A 60 7.106 9.996 -1.802 1.00 0.14 C ATOM 754 O LEU A 60 8.295 10.005 -2.124 1.00 0.16 O ATOM 755 CB LEU A 60 6.174 9.221 0.335 1.00 0.15 C ATOM 756 CG LEU A 60 5.902 9.461 1.801 1.00 0.18 C ATOM 757 CD1 LEU A 60 5.127 8.294 2.349 1.00 0.81 C ATOM 758 CD2 LEU A 60 7.215 9.648 2.547 1.00 0.70 C ATOM 0 H LEU A 60 4.773 11.205 -0.035 1.00 0.16 H new ATOM 0 HA LEU A 60 7.528 10.865 0.105 1.00 0.15 H new ATOM 0 HB2 LEU A 60 5.257 8.870 -0.138 1.00 0.15 H new ATOM 0 HB3 LEU A 60 6.908 8.420 0.242 1.00 0.15 H new ATOM 0 HG LEU A 60 5.312 10.368 1.931 1.00 0.18 H new ATOM 0 HD11 LEU A 60 4.925 8.456 3.408 1.00 0.81 H new ATOM 0 HD12 LEU A 60 4.184 8.198 1.810 1.00 0.81 H new ATOM 0 HD13 LEU A 60 5.709 7.381 2.227 1.00 0.81 H new ATOM 0 HD21 LEU A 60 7.012 9.821 3.604 1.00 0.70 H new ATOM 0 HD22 LEU A 60 7.827 8.753 2.437 1.00 0.70 H new ATOM 0 HD23 LEU A 60 7.748 10.505 2.135 1.00 0.70 H new ATOM 770 N TYR A 61 6.120 9.612 -2.611 1.00 0.14 N ATOM 771 CA TYR A 61 6.370 9.219 -3.984 1.00 0.16 C ATOM 772 C TYR A 61 7.207 10.268 -4.693 1.00 0.18 C ATOM 773 O TYR A 61 8.296 9.991 -5.182 1.00 0.22 O ATOM 774 CB TYR A 61 5.069 9.053 -4.766 1.00 0.21 C ATOM 775 CG TYR A 61 5.323 8.437 -6.123 1.00 0.20 C ATOM 776 CD1 TYR A 61 5.648 7.093 -6.249 1.00 0.23 C ATOM 777 CD2 TYR A 61 5.183 9.190 -7.281 1.00 0.26 C ATOM 778 CE1 TYR A 61 5.829 6.518 -7.492 1.00 0.24 C ATOM 779 CE2 TYR A 61 5.372 8.627 -8.526 1.00 0.30 C ATOM 780 CZ TYR A 61 5.887 7.320 -8.605 1.00 0.27 C ATOM 781 OH TYR A 61 5.849 6.711 -9.867 1.00 0.33 O ATOM 0 H TYR A 61 5.140 9.567 -2.332 1.00 0.14 H new ATOM 0 HA TYR A 61 6.898 8.266 -3.948 1.00 0.16 H new ATOM 0 HB2 TYR A 61 4.380 8.425 -4.202 1.00 0.21 H new ATOM 0 HB3 TYR A 61 4.588 10.024 -4.888 1.00 0.21 H new ATOM 0 HD1 TYR A 61 5.761 6.488 -5.362 1.00 0.23 H new ATOM 0 HD2 TYR A 61 4.921 10.235 -7.206 1.00 0.26 H new ATOM 0 HE1 TYR A 61 5.924 5.446 -7.588 1.00 0.24 H new ATOM 0 HE2 TYR A 61 5.129 9.178 -9.422 1.00 0.30 H new ATOM 0 HH TYR A 61 5.897 7.399 -10.564 1.00 0.33 H new ATOM 791 N ASN A 62 6.700 11.486 -4.691 1.00 0.22 N ATOM 792 CA ASN A 62 7.252 12.542 -5.536 1.00 0.29 C ATOM 793 C ASN A 62 8.617 13.007 -5.054 1.00 0.28 C ATOM 794 O ASN A 62 9.463 13.401 -5.858 1.00 0.36 O ATOM 795 CB ASN A 62 6.301 13.740 -5.623 1.00 0.38 C ATOM 796 CG ASN A 62 5.125 13.497 -6.550 1.00 1.04 C ATOM 797 OD1 ASN A 62 5.204 12.690 -7.477 1.00 1.76 O ATOM 798 ND2 ASN A 62 4.033 14.210 -6.324 1.00 1.29 N ATOM 0 H ASN A 62 5.908 11.774 -4.117 1.00 0.22 H new ATOM 0 HA ASN A 62 7.371 12.110 -6.529 1.00 0.29 H new ATOM 0 HB2 ASN A 62 5.928 13.974 -4.626 1.00 0.38 H new ATOM 0 HB3 ASN A 62 6.855 14.612 -5.969 1.00 0.38 H new ATOM 0 HD21 ASN A 62 3.218 14.101 -6.928 1.00 1.29 H new ATOM 0 HD22 ASN A 62 4.006 14.869 -5.546 1.00 1.29 H new ATOM 805 N LYS A 63 8.835 12.967 -3.752 1.00 0.24 N ATOM 806 CA LYS A 63 10.087 13.441 -3.194 1.00 0.28 C ATOM 807 C LYS A 63 11.166 12.367 -3.249 1.00 0.27 C ATOM 808 O LYS A 63 12.287 12.624 -3.688 1.00 0.42 O ATOM 809 CB LYS A 63 9.888 13.915 -1.754 1.00 0.33 C ATOM 810 CG LYS A 63 11.150 14.485 -1.127 1.00 0.43 C ATOM 811 CD LYS A 63 10.879 15.054 0.252 1.00 0.98 C ATOM 812 CE LYS A 63 12.140 15.629 0.872 1.00 1.16 C ATOM 813 NZ LYS A 63 11.862 16.285 2.173 1.00 1.79 N ATOM 0 H LYS A 63 8.167 12.614 -3.067 1.00 0.24 H new ATOM 0 HA LYS A 63 10.419 14.283 -3.801 1.00 0.28 H new ATOM 0 HB2 LYS A 63 9.106 14.674 -1.734 1.00 0.33 H new ATOM 0 HB3 LYS A 63 9.536 13.079 -1.149 1.00 0.33 H new ATOM 0 HG2 LYS A 63 11.907 13.704 -1.057 1.00 0.43 H new ATOM 0 HG3 LYS A 63 11.556 15.266 -1.770 1.00 0.43 H new ATOM 0 HD2 LYS A 63 10.118 15.832 0.183 1.00 0.98 H new ATOM 0 HD3 LYS A 63 10.478 14.272 0.897 1.00 0.98 H new ATOM 0 HE2 LYS A 63 12.871 14.833 1.015 1.00 1.16 H new ATOM 0 HE3 LYS A 63 12.585 16.352 0.188 1.00 1.16 H new ATOM 0 HZ1 LYS A 63 12.747 16.665 2.566 1.00 1.79 H new ATOM 0 HZ2 LYS A 63 11.184 17.061 2.033 1.00 1.79 H new ATOM 0 HZ3 LYS A 63 11.461 15.589 2.834 1.00 1.79 H new ATOM 827 N TYR A 64 10.833 11.155 -2.835 1.00 0.18 N ATOM 828 CA TYR A 64 11.852 10.134 -2.668 1.00 0.19 C ATOM 829 C TYR A 64 11.978 9.208 -3.866 1.00 0.22 C ATOM 830 O TYR A 64 12.740 8.241 -3.823 1.00 0.28 O ATOM 831 CB TYR A 64 11.639 9.365 -1.369 1.00 0.21 C ATOM 832 CG TYR A 64 12.057 10.190 -0.178 1.00 0.24 C ATOM 833 CD1 TYR A 64 13.388 10.274 0.209 1.00 0.30 C ATOM 834 CD2 TYR A 64 11.105 10.850 0.588 1.00 0.27 C ATOM 835 CE1 TYR A 64 13.760 11.004 1.323 1.00 0.35 C ATOM 836 CE2 TYR A 64 11.467 11.572 1.704 1.00 0.33 C ATOM 837 CZ TYR A 64 12.859 11.769 1.963 1.00 0.34 C ATOM 838 OH TYR A 64 13.152 12.361 3.191 1.00 0.43 O ATOM 0 H TYR A 64 9.883 10.858 -2.612 1.00 0.18 H new ATOM 0 HA TYR A 64 12.809 10.652 -2.603 1.00 0.19 H new ATOM 0 HB2 TYR A 64 10.589 9.089 -1.274 1.00 0.21 H new ATOM 0 HB3 TYR A 64 12.212 8.438 -1.393 1.00 0.21 H new ATOM 0 HD1 TYR A 64 14.143 9.762 -0.368 1.00 0.30 H new ATOM 0 HD2 TYR A 64 10.064 10.796 0.304 1.00 0.27 H new ATOM 0 HE1 TYR A 64 14.778 10.959 1.680 1.00 0.35 H new ATOM 0 HE2 TYR A 64 10.718 11.979 2.367 1.00 0.33 H new ATOM 0 HH TYR A 64 12.422 12.186 3.821 1.00 0.43 H new ATOM 848 N LYS A 65 11.278 9.522 -4.952 1.00 0.22 N ATOM 849 CA LYS A 65 11.505 8.833 -6.224 1.00 0.29 C ATOM 850 C LYS A 65 12.959 9.006 -6.657 1.00 0.32 C ATOM 851 O LYS A 65 13.506 8.178 -7.387 1.00 0.39 O ATOM 852 CB LYS A 65 10.566 9.362 -7.313 1.00 0.36 C ATOM 853 CG LYS A 65 9.311 8.526 -7.505 1.00 0.38 C ATOM 854 CD LYS A 65 9.603 7.229 -8.243 1.00 0.92 C ATOM 855 CE LYS A 65 9.931 7.481 -9.703 1.00 1.37 C ATOM 856 NZ LYS A 65 8.741 7.929 -10.479 1.00 2.11 N ATOM 0 H LYS A 65 10.555 10.241 -4.981 1.00 0.22 H new ATOM 0 HA LYS A 65 11.295 7.773 -6.081 1.00 0.29 H new ATOM 0 HB2 LYS A 65 10.276 10.383 -7.064 1.00 0.36 H new ATOM 0 HB3 LYS A 65 11.109 9.406 -8.257 1.00 0.36 H new ATOM 0 HG2 LYS A 65 8.873 8.300 -6.533 1.00 0.38 H new ATOM 0 HG3 LYS A 65 8.572 9.102 -8.062 1.00 0.38 H new ATOM 0 HD2 LYS A 65 10.438 6.717 -7.765 1.00 0.92 H new ATOM 0 HD3 LYS A 65 8.740 6.567 -8.172 1.00 0.92 H new ATOM 0 HE2 LYS A 65 10.713 8.237 -9.772 1.00 1.37 H new ATOM 0 HE3 LYS A 65 10.329 6.568 -10.147 1.00 1.37 H new ATOM 0 HZ1 LYS A 65 8.799 7.557 -11.449 1.00 2.11 H new ATOM 0 HZ2 LYS A 65 7.876 7.575 -10.023 1.00 2.11 H new ATOM 0 HZ3 LYS A 65 8.716 8.968 -10.508 1.00 2.11 H new ATOM 870 N SER A 66 13.574 10.085 -6.178 1.00 0.33 N ATOM 871 CA SER A 66 14.980 10.370 -6.434 1.00 0.43 C ATOM 872 C SER A 66 15.882 9.251 -5.903 1.00 0.50 C ATOM 873 O SER A 66 16.904 8.931 -6.506 1.00 0.61 O ATOM 874 CB SER A 66 15.354 11.708 -5.784 1.00 0.52 C ATOM 875 OG SER A 66 16.732 12.007 -5.940 1.00 1.20 O ATOM 0 H SER A 66 13.109 10.786 -5.601 1.00 0.33 H new ATOM 0 HA SER A 66 15.131 10.431 -7.512 1.00 0.43 H new ATOM 0 HB2 SER A 66 14.757 12.506 -6.227 1.00 0.52 H new ATOM 0 HB3 SER A 66 15.107 11.677 -4.723 1.00 0.52 H new ATOM 0 HG SER A 66 16.930 12.867 -5.514 1.00 1.20 H new ATOM 881 N GLN A 67 15.494 8.646 -4.781 1.00 0.49 N ATOM 882 CA GLN A 67 16.284 7.570 -4.188 1.00 0.61 C ATOM 883 C GLN A 67 15.759 6.208 -4.622 1.00 0.63 C ATOM 884 O GLN A 67 16.232 5.169 -4.157 1.00 0.80 O ATOM 885 CB GLN A 67 16.292 7.657 -2.656 1.00 0.75 C ATOM 886 CG GLN A 67 17.299 8.650 -2.092 1.00 0.97 C ATOM 887 CD GLN A 67 16.702 10.002 -1.742 1.00 1.23 C ATOM 888 OE1 GLN A 67 17.167 10.673 -0.821 1.00 1.90 O ATOM 889 NE2 GLN A 67 15.680 10.417 -2.468 1.00 1.36 N ATOM 0 H GLN A 67 14.644 8.881 -4.268 1.00 0.49 H new ATOM 0 HA GLN A 67 17.307 7.687 -4.545 1.00 0.61 H new ATOM 0 HB2 GLN A 67 15.295 7.934 -2.314 1.00 0.75 H new ATOM 0 HB3 GLN A 67 16.506 6.669 -2.248 1.00 0.75 H new ATOM 0 HG2 GLN A 67 17.754 8.223 -1.198 1.00 0.97 H new ATOM 0 HG3 GLN A 67 18.098 8.794 -2.819 1.00 0.97 H new ATOM 0 HE21 GLN A 67 15.321 9.834 -3.224 1.00 1.36 H new ATOM 0 HE22 GLN A 67 15.250 11.321 -2.273 1.00 1.36 H new ATOM 898 N GLY A 68 14.796 6.224 -5.531 1.00 0.54 N ATOM 899 CA GLY A 68 14.172 4.995 -5.964 1.00 0.63 C ATOM 900 C GLY A 68 13.103 4.546 -4.993 1.00 0.72 C ATOM 901 O GLY A 68 13.257 3.542 -4.314 1.00 1.32 O ATOM 0 H GLY A 68 14.436 7.068 -5.976 1.00 0.54 H new ATOM 0 HA2 GLY A 68 13.732 5.137 -6.951 1.00 0.63 H new ATOM 0 HA3 GLY A 68 14.928 4.216 -6.061 1.00 0.63 H new ATOM 905 N PHE A 69 12.028 5.312 -4.908 1.00 0.26 N ATOM 906 CA PHE A 69 10.927 4.985 -4.021 1.00 0.24 C ATOM 907 C PHE A 69 9.605 5.078 -4.762 1.00 0.23 C ATOM 908 O PHE A 69 9.381 6.019 -5.517 1.00 0.26 O ATOM 909 CB PHE A 69 10.926 5.938 -2.829 1.00 0.22 C ATOM 910 CG PHE A 69 9.745 5.783 -1.927 1.00 0.19 C ATOM 911 CD1 PHE A 69 9.654 4.696 -1.078 1.00 0.18 C ATOM 912 CD2 PHE A 69 8.728 6.718 -1.926 1.00 0.24 C ATOM 913 CE1 PHE A 69 8.571 4.545 -0.243 1.00 0.19 C ATOM 914 CE2 PHE A 69 7.643 6.574 -1.091 1.00 0.24 C ATOM 915 CZ PHE A 69 7.548 5.503 -0.265 1.00 0.19 C ATOM 0 H PHE A 69 11.895 6.168 -5.446 1.00 0.26 H new ATOM 0 HA PHE A 69 11.053 3.963 -3.664 1.00 0.24 H new ATOM 0 HB2 PHE A 69 11.836 5.780 -2.250 1.00 0.22 H new ATOM 0 HB3 PHE A 69 10.957 6.964 -3.197 1.00 0.22 H new ATOM 0 HD1 PHE A 69 10.442 3.957 -1.070 1.00 0.18 H new ATOM 0 HD2 PHE A 69 8.785 7.570 -2.587 1.00 0.24 H new ATOM 0 HE1 PHE A 69 8.510 3.697 0.423 1.00 0.19 H new ATOM 0 HE2 PHE A 69 6.862 7.320 -1.094 1.00 0.24 H new ATOM 0 HZ PHE A 69 6.686 5.388 0.375 1.00 0.19 H new ATOM 925 N THR A 70 8.731 4.108 -4.553 1.00 0.22 N ATOM 926 CA THR A 70 7.441 4.122 -5.185 1.00 0.22 C ATOM 927 C THR A 70 6.345 3.914 -4.143 1.00 0.21 C ATOM 928 O THR A 70 6.565 3.252 -3.137 1.00 0.25 O ATOM 929 CB THR A 70 7.368 3.036 -6.285 1.00 0.27 C ATOM 930 OG1 THR A 70 6.744 3.558 -7.462 1.00 0.51 O ATOM 931 CG2 THR A 70 6.616 1.797 -5.828 1.00 0.33 C ATOM 0 H THR A 70 8.900 3.304 -3.948 1.00 0.22 H new ATOM 0 HA THR A 70 7.289 5.093 -5.656 1.00 0.22 H new ATOM 0 HB THR A 70 8.395 2.744 -6.505 1.00 0.27 H new ATOM 0 HG1 THR A 70 6.152 2.879 -7.847 1.00 0.51 H new ATOM 0 HG21 THR A 70 6.593 1.066 -6.636 1.00 0.33 H new ATOM 0 HG22 THR A 70 7.118 1.365 -4.962 1.00 0.33 H new ATOM 0 HG23 THR A 70 5.596 2.070 -5.557 1.00 0.33 H new ATOM 939 N VAL A 71 5.200 4.528 -4.351 1.00 0.20 N ATOM 940 CA VAL A 71 4.025 4.231 -3.549 1.00 0.19 C ATOM 941 C VAL A 71 2.958 3.588 -4.418 1.00 0.18 C ATOM 942 O VAL A 71 2.423 4.218 -5.327 1.00 0.24 O ATOM 943 CB VAL A 71 3.453 5.497 -2.892 1.00 0.22 C ATOM 944 CG1 VAL A 71 2.042 5.256 -2.342 1.00 0.23 C ATOM 945 CG2 VAL A 71 4.369 5.984 -1.782 1.00 0.24 C ATOM 0 H VAL A 71 5.054 5.238 -5.069 1.00 0.20 H new ATOM 0 HA VAL A 71 4.327 3.544 -2.758 1.00 0.19 H new ATOM 0 HB VAL A 71 3.389 6.266 -3.662 1.00 0.22 H new ATOM 0 HG11 VAL A 71 1.668 6.172 -1.884 1.00 0.23 H new ATOM 0 HG12 VAL A 71 1.380 4.961 -3.156 1.00 0.23 H new ATOM 0 HG13 VAL A 71 2.073 4.464 -1.594 1.00 0.23 H new ATOM 0 HG21 VAL A 71 3.947 6.881 -1.329 1.00 0.24 H new ATOM 0 HG22 VAL A 71 4.467 5.207 -1.024 1.00 0.24 H new ATOM 0 HG23 VAL A 71 5.351 6.214 -2.195 1.00 0.24 H new ATOM 955 N LEU A 72 2.679 2.333 -4.152 1.00 0.16 N ATOM 956 CA LEU A 72 1.640 1.614 -4.856 1.00 0.17 C ATOM 957 C LEU A 72 0.369 1.675 -4.034 1.00 0.18 C ATOM 958 O LEU A 72 0.353 1.251 -2.889 1.00 0.32 O ATOM 959 CB LEU A 72 2.053 0.154 -5.055 1.00 0.20 C ATOM 960 CG LEU A 72 3.468 -0.055 -5.594 1.00 0.20 C ATOM 961 CD1 LEU A 72 3.760 -1.539 -5.764 1.00 0.48 C ATOM 962 CD2 LEU A 72 3.638 0.673 -6.916 1.00 0.51 C ATOM 0 H LEU A 72 3.164 1.782 -3.444 1.00 0.16 H new ATOM 0 HA LEU A 72 1.478 2.067 -5.834 1.00 0.17 H new ATOM 0 HB2 LEU A 72 1.965 -0.365 -4.101 1.00 0.20 H new ATOM 0 HB3 LEU A 72 1.347 -0.316 -5.740 1.00 0.20 H new ATOM 0 HG LEU A 72 4.178 0.355 -4.875 1.00 0.20 H new ATOM 0 HD11 LEU A 72 4.772 -1.669 -6.149 1.00 0.48 H new ATOM 0 HD12 LEU A 72 3.671 -2.040 -4.800 1.00 0.48 H new ATOM 0 HD13 LEU A 72 3.047 -1.972 -6.465 1.00 0.48 H new ATOM 0 HD21 LEU A 72 4.650 0.517 -7.290 1.00 0.51 H new ATOM 0 HD22 LEU A 72 2.920 0.286 -7.639 1.00 0.51 H new ATOM 0 HD23 LEU A 72 3.466 1.739 -6.769 1.00 0.51 H new ATOM 974 N ALA A 73 -0.691 2.206 -4.595 1.00 0.15 N ATOM 975 CA ALA A 73 -1.936 2.291 -3.859 1.00 0.16 C ATOM 976 C ALA A 73 -2.949 1.322 -4.417 1.00 0.19 C ATOM 977 O ALA A 73 -3.423 1.479 -5.530 1.00 0.28 O ATOM 978 CB ALA A 73 -2.483 3.701 -3.879 1.00 0.17 C ATOM 0 H ALA A 73 -0.721 2.581 -5.543 1.00 0.15 H new ATOM 0 HA ALA A 73 -1.734 2.022 -2.822 1.00 0.16 H new ATOM 0 HB1 ALA A 73 -3.418 3.737 -3.319 1.00 0.17 H new ATOM 0 HB2 ALA A 73 -1.761 4.378 -3.423 1.00 0.17 H new ATOM 0 HB3 ALA A 73 -2.665 4.006 -4.909 1.00 0.17 H new ATOM 984 N PHE A 74 -3.274 0.326 -3.632 1.00 0.20 N ATOM 985 CA PHE A 74 -4.247 -0.669 -4.017 1.00 0.21 C ATOM 986 C PHE A 74 -5.597 -0.291 -3.438 1.00 0.25 C ATOM 987 O PHE A 74 -5.814 -0.359 -2.232 1.00 0.29 O ATOM 988 CB PHE A 74 -3.814 -2.059 -3.523 1.00 0.23 C ATOM 989 CG PHE A 74 -2.596 -2.660 -4.199 1.00 0.22 C ATOM 990 CD1 PHE A 74 -1.421 -1.930 -4.261 1.00 0.24 C ATOM 991 CD2 PHE A 74 -2.619 -3.920 -4.800 1.00 0.32 C ATOM 992 CE1 PHE A 74 -0.306 -2.428 -4.902 1.00 0.26 C ATOM 993 CE2 PHE A 74 -1.500 -4.420 -5.436 1.00 0.34 C ATOM 994 CZ PHE A 74 -0.376 -3.851 -5.385 1.00 0.26 C ATOM 0 H PHE A 74 -2.872 0.181 -2.706 1.00 0.20 H new ATOM 0 HA PHE A 74 -4.320 -0.707 -5.104 1.00 0.21 H new ATOM 0 HB2 PHE A 74 -3.616 -1.996 -2.453 1.00 0.23 H new ATOM 0 HB3 PHE A 74 -4.651 -2.745 -3.652 1.00 0.23 H new ATOM 0 HD1 PHE A 74 -1.377 -0.954 -3.800 1.00 0.24 H new ATOM 0 HD2 PHE A 74 -3.523 -4.511 -4.767 1.00 0.32 H new ATOM 0 HE1 PHE A 74 0.577 -1.824 -5.050 1.00 0.26 H new ATOM 0 HE2 PHE A 74 -1.591 -5.336 -6.000 1.00 0.34 H new ATOM 0 HZ PHE A 74 0.520 -4.376 -5.683 1.00 0.26 H new ATOM 1004 N PRO A 75 -6.503 0.146 -4.316 1.00 0.26 N ATOM 1005 CA PRO A 75 -7.843 0.600 -3.945 1.00 0.32 C ATOM 1006 C PRO A 75 -8.659 -0.503 -3.279 1.00 0.38 C ATOM 1007 O PRO A 75 -8.246 -1.664 -3.258 1.00 0.73 O ATOM 1008 CB PRO A 75 -8.459 1.002 -5.291 1.00 0.37 C ATOM 1009 CG PRO A 75 -7.305 1.221 -6.195 1.00 0.31 C ATOM 1010 CD PRO A 75 -6.283 0.223 -5.761 1.00 0.26 C ATOM 0 HA PRO A 75 -7.821 1.410 -3.216 1.00 0.32 H new ATOM 0 HB2 PRO A 75 -9.116 0.220 -5.673 1.00 0.37 H new ATOM 0 HB3 PRO A 75 -9.061 1.905 -5.195 1.00 0.37 H new ATOM 0 HG2 PRO A 75 -7.586 1.071 -7.238 1.00 0.31 H new ATOM 0 HG3 PRO A 75 -6.924 2.239 -6.110 1.00 0.31 H new ATOM 0 HD2 PRO A 75 -6.429 -0.743 -6.245 1.00 0.26 H new ATOM 0 HD3 PRO A 75 -5.271 0.550 -6.000 1.00 0.26 H new ATOM 1018 N SER A 76 -9.820 -0.164 -2.735 1.00 0.29 N ATOM 1019 CA SER A 76 -10.585 -1.164 -2.032 1.00 0.30 C ATOM 1020 C SER A 76 -12.044 -1.239 -2.462 1.00 0.44 C ATOM 1021 O SER A 76 -12.727 -0.227 -2.619 1.00 0.57 O ATOM 1022 CB SER A 76 -10.507 -0.959 -0.503 1.00 0.53 C ATOM 1023 OG SER A 76 -11.021 -2.083 0.191 1.00 1.54 O ATOM 0 H SER A 76 -10.236 0.767 -2.768 1.00 0.29 H new ATOM 0 HA SER A 76 -10.124 -2.114 -2.301 1.00 0.30 H new ATOM 0 HB2 SER A 76 -9.471 -0.789 -0.208 1.00 0.53 H new ATOM 0 HB3 SER A 76 -11.069 -0.068 -0.224 1.00 0.53 H new ATOM 0 HG SER A 76 -10.501 -2.879 -0.046 1.00 1.54 H new ATOM 1029 N ASN A 77 -12.499 -2.476 -2.638 1.00 0.60 N ATOM 1030 CA ASN A 77 -13.909 -2.783 -2.820 1.00 0.96 C ATOM 1031 C ASN A 77 -14.470 -3.362 -1.529 1.00 0.80 C ATOM 1032 O ASN A 77 -14.356 -4.560 -1.281 1.00 0.95 O ATOM 1033 CB ASN A 77 -14.115 -3.793 -3.953 1.00 1.50 C ATOM 1034 CG ASN A 77 -14.090 -3.167 -5.331 1.00 1.98 C ATOM 1035 OD1 ASN A 77 -14.492 -2.017 -5.519 1.00 2.40 O ATOM 1036 ND2 ASN A 77 -13.616 -3.923 -6.306 1.00 2.52 N ATOM 0 H ASN A 77 -11.894 -3.297 -2.658 1.00 0.60 H new ATOM 0 HA ASN A 77 -14.428 -1.861 -3.080 1.00 0.96 H new ATOM 0 HB2 ASN A 77 -13.339 -4.556 -3.895 1.00 1.50 H new ATOM 0 HB3 ASN A 77 -15.070 -4.299 -3.809 1.00 1.50 H new ATOM 0 HD21 ASN A 77 -13.573 -3.560 -7.258 1.00 2.52 H new ATOM 0 HD22 ASN A 77 -13.294 -4.870 -6.106 1.00 2.52 H new ATOM 1043 N GLN A 78 -15.074 -2.503 -0.714 1.00 0.89 N ATOM 1044 CA GLN A 78 -15.635 -2.894 0.582 1.00 1.16 C ATOM 1045 C GLN A 78 -16.716 -3.975 0.463 1.00 1.29 C ATOM 1046 O GLN A 78 -17.146 -4.535 1.470 1.00 1.56 O ATOM 1047 CB GLN A 78 -16.197 -1.683 1.330 1.00 1.60 C ATOM 1048 CG GLN A 78 -15.139 -0.805 1.989 1.00 2.42 C ATOM 1049 CD GLN A 78 -14.465 0.145 1.020 1.00 2.48 C ATOM 1050 OE1 GLN A 78 -14.927 1.261 0.820 1.00 3.18 O ATOM 1051 NE2 GLN A 78 -13.362 -0.276 0.429 1.00 2.31 N ATOM 0 H GLN A 78 -15.190 -1.513 -0.931 1.00 0.89 H new ATOM 0 HA GLN A 78 -14.807 -3.318 1.150 1.00 1.16 H new ATOM 0 HB2 GLN A 78 -16.773 -1.075 0.632 1.00 1.60 H new ATOM 0 HB3 GLN A 78 -16.890 -2.033 2.095 1.00 1.60 H new ATOM 0 HG2 GLN A 78 -15.602 -0.229 2.790 1.00 2.42 H new ATOM 0 HG3 GLN A 78 -14.383 -1.441 2.449 1.00 2.42 H new ATOM 0 HE21 GLN A 78 -13.007 -1.213 0.620 1.00 2.31 H new ATOM 0 HE22 GLN A 78 -12.865 0.336 -0.219 1.00 2.31 H new ATOM 1060 N PHE A 79 -17.155 -4.250 -0.760 1.00 1.28 N ATOM 1061 CA PHE A 79 -18.277 -5.156 -1.009 1.00 1.56 C ATOM 1062 C PHE A 79 -17.945 -6.593 -0.615 1.00 1.37 C ATOM 1063 O PHE A 79 -18.822 -7.456 -0.591 1.00 1.62 O ATOM 1064 CB PHE A 79 -18.682 -5.113 -2.485 1.00 1.92 C ATOM 1065 CG PHE A 79 -19.085 -3.751 -2.968 1.00 2.26 C ATOM 1066 CD1 PHE A 79 -20.260 -3.164 -2.529 1.00 2.55 C ATOM 1067 CD2 PHE A 79 -18.291 -3.061 -3.868 1.00 2.92 C ATOM 1068 CE1 PHE A 79 -20.636 -1.912 -2.977 1.00 3.26 C ATOM 1069 CE2 PHE A 79 -18.659 -1.809 -4.321 1.00 3.71 C ATOM 1070 CZ PHE A 79 -19.833 -1.233 -3.875 1.00 3.80 C ATOM 0 H PHE A 79 -16.746 -3.854 -1.607 1.00 1.28 H new ATOM 0 HA PHE A 79 -19.108 -4.816 -0.391 1.00 1.56 H new ATOM 0 HB2 PHE A 79 -17.849 -5.470 -3.090 1.00 1.92 H new ATOM 0 HB3 PHE A 79 -19.510 -5.803 -2.644 1.00 1.92 H new ATOM 0 HD1 PHE A 79 -20.890 -3.691 -1.828 1.00 2.55 H new ATOM 0 HD2 PHE A 79 -17.373 -3.507 -4.220 1.00 2.92 H new ATOM 0 HE1 PHE A 79 -21.555 -1.465 -2.627 1.00 3.26 H new ATOM 0 HE2 PHE A 79 -18.030 -1.281 -5.023 1.00 3.71 H new ATOM 0 HZ PHE A 79 -20.123 -0.254 -4.227 1.00 3.80 H new ATOM 1080 N GLY A 80 -16.678 -6.848 -0.328 1.00 1.10 N ATOM 1081 CA GLY A 80 -16.276 -8.157 0.145 1.00 1.07 C ATOM 1082 C GLY A 80 -16.820 -8.443 1.529 1.00 1.02 C ATOM 1083 O GLY A 80 -17.173 -9.581 1.848 1.00 1.45 O ATOM 0 H GLY A 80 -15.920 -6.171 -0.414 1.00 1.10 H new ATOM 0 HA2 GLY A 80 -16.629 -8.919 -0.550 1.00 1.07 H new ATOM 0 HA3 GLY A 80 -15.188 -8.220 0.161 1.00 1.07 H new ATOM 1087 N GLY A 81 -16.893 -7.403 2.347 1.00 1.00 N ATOM 1088 CA GLY A 81 -17.438 -7.542 3.677 1.00 1.13 C ATOM 1089 C GLY A 81 -16.584 -6.877 4.730 1.00 1.07 C ATOM 1090 O GLY A 81 -17.029 -5.930 5.383 1.00 1.43 O ATOM 0 H GLY A 81 -16.582 -6.461 2.109 1.00 1.00 H new ATOM 0 HA2 GLY A 81 -18.439 -7.111 3.702 1.00 1.13 H new ATOM 0 HA3 GLY A 81 -17.541 -8.601 3.914 1.00 1.13 H new ATOM 1094 N GLN A 82 -15.351 -7.341 4.891 1.00 0.83 N ATOM 1095 CA GLN A 82 -14.522 -6.864 5.989 1.00 0.86 C ATOM 1096 C GLN A 82 -13.473 -5.881 5.518 1.00 0.78 C ATOM 1097 O GLN A 82 -12.630 -5.453 6.299 1.00 0.95 O ATOM 1098 CB GLN A 82 -13.832 -8.015 6.722 1.00 0.97 C ATOM 1099 CG GLN A 82 -12.751 -8.705 5.905 1.00 0.93 C ATOM 1100 CD GLN A 82 -13.314 -9.692 4.899 1.00 0.98 C ATOM 1101 OE1 GLN A 82 -14.354 -10.309 5.133 1.00 1.43 O ATOM 1102 NE2 GLN A 82 -12.637 -9.846 3.774 1.00 1.16 N ATOM 0 H GLN A 82 -14.910 -8.034 4.287 1.00 0.83 H new ATOM 0 HA GLN A 82 -15.198 -6.358 6.678 1.00 0.86 H new ATOM 0 HB2 GLN A 82 -13.390 -7.634 7.643 1.00 0.97 H new ATOM 0 HB3 GLN A 82 -14.582 -8.752 7.010 1.00 0.97 H new ATOM 0 HG2 GLN A 82 -12.163 -7.952 5.379 1.00 0.93 H new ATOM 0 HG3 GLN A 82 -12.071 -9.227 6.578 1.00 0.93 H new ATOM 0 HE21 GLN A 82 -11.780 -9.316 3.618 1.00 1.16 H new ATOM 0 HE22 GLN A 82 -12.972 -10.495 3.062 1.00 1.16 H new ATOM 1111 N GLU A 83 -13.560 -5.498 4.268 1.00 0.65 N ATOM 1112 CA GLU A 83 -12.594 -4.593 3.668 1.00 0.57 C ATOM 1113 C GLU A 83 -12.624 -3.302 4.453 1.00 0.60 C ATOM 1114 O GLU A 83 -13.696 -2.905 4.900 1.00 0.75 O ATOM 1115 CB GLU A 83 -12.974 -4.369 2.210 1.00 0.69 C ATOM 1116 CG GLU A 83 -13.867 -5.473 1.667 1.00 1.05 C ATOM 1117 CD GLU A 83 -13.245 -6.848 1.785 1.00 2.31 C ATOM 1118 OE1 GLU A 83 -12.113 -7.023 1.299 1.00 3.06 O ATOM 1119 OE2 GLU A 83 -13.878 -7.747 2.366 1.00 2.86 O ATOM 0 H GLU A 83 -14.299 -5.801 3.633 1.00 0.65 H new ATOM 0 HA GLU A 83 -11.584 -5.002 3.695 1.00 0.57 H new ATOM 0 HB2 GLU A 83 -13.486 -3.411 2.114 1.00 0.69 H new ATOM 0 HB3 GLU A 83 -12.068 -4.308 1.607 1.00 0.69 H new ATOM 0 HG2 GLU A 83 -14.816 -5.462 2.203 1.00 1.05 H new ATOM 0 HG3 GLU A 83 -14.091 -5.270 0.620 1.00 1.05 H new ATOM 1126 N PRO A 84 -11.445 -2.655 4.598 1.00 0.61 N ATOM 1127 CA PRO A 84 -11.113 -1.666 5.616 1.00 0.82 C ATOM 1128 C PRO A 84 -12.280 -1.036 6.364 1.00 1.07 C ATOM 1129 O PRO A 84 -13.296 -0.707 5.779 1.00 1.61 O ATOM 1130 CB PRO A 84 -10.360 -0.643 4.793 1.00 0.97 C ATOM 1131 CG PRO A 84 -9.582 -1.469 3.822 1.00 0.73 C ATOM 1132 CD PRO A 84 -10.289 -2.803 3.712 1.00 0.52 C ATOM 0 HA PRO A 84 -10.566 -2.119 6.443 1.00 0.82 H new ATOM 0 HB2 PRO A 84 -11.040 0.039 4.283 1.00 0.97 H new ATOM 0 HB3 PRO A 84 -9.704 -0.033 5.415 1.00 0.97 H new ATOM 0 HG2 PRO A 84 -9.532 -0.977 2.850 1.00 0.73 H new ATOM 0 HG3 PRO A 84 -8.556 -1.603 4.165 1.00 0.73 H new ATOM 0 HD2 PRO A 84 -10.594 -3.012 2.687 1.00 0.52 H new ATOM 0 HD3 PRO A 84 -9.646 -3.625 4.026 1.00 0.52 H new ATOM 1140 N GLY A 85 -12.025 -0.761 7.646 1.00 1.07 N ATOM 1141 CA GLY A 85 -13.056 -0.455 8.645 1.00 1.39 C ATOM 1142 C GLY A 85 -14.105 0.547 8.209 1.00 1.07 C ATOM 1143 O GLY A 85 -15.169 0.639 8.823 1.00 1.36 O ATOM 0 H GLY A 85 -11.079 -0.744 8.027 1.00 1.07 H new ATOM 0 HA2 GLY A 85 -13.557 -1.383 8.922 1.00 1.39 H new ATOM 0 HA3 GLY A 85 -12.567 -0.077 9.543 1.00 1.39 H new ATOM 1147 N ASN A 86 -13.800 1.321 7.185 1.00 1.10 N ATOM 1148 CA ASN A 86 -14.805 2.141 6.521 1.00 1.75 C ATOM 1149 C ASN A 86 -16.025 1.296 6.095 1.00 1.70 C ATOM 1150 O ASN A 86 -17.132 1.818 6.018 1.00 2.55 O ATOM 1151 CB ASN A 86 -14.190 2.826 5.302 1.00 2.47 C ATOM 1152 CG ASN A 86 -13.131 3.842 5.684 1.00 3.15 C ATOM 1153 OD1 ASN A 86 -11.974 3.490 5.918 1.00 3.69 O ATOM 1154 ND2 ASN A 86 -13.510 5.111 5.725 1.00 3.63 N ATOM 0 H ASN A 86 -12.863 1.402 6.791 1.00 1.10 H new ATOM 0 HA ASN A 86 -15.150 2.896 7.227 1.00 1.75 H new ATOM 0 HB2 ASN A 86 -13.749 2.073 4.649 1.00 2.47 H new ATOM 0 HB3 ASN A 86 -14.976 3.321 4.732 1.00 2.47 H new ATOM 0 HD21 ASN A 86 -12.833 5.838 5.957 1.00 3.63 H new ATOM 0 HD22 ASN A 86 -14.478 5.361 5.525 1.00 3.63 H new ATOM 1161 N GLU A 87 -15.759 0.000 5.824 1.00 1.11 N ATOM 1162 CA GLU A 87 -16.727 -1.050 5.411 1.00 1.07 C ATOM 1163 C GLU A 87 -18.059 -0.537 4.852 1.00 1.00 C ATOM 1164 O GLU A 87 -18.866 0.088 5.545 1.00 1.56 O ATOM 1165 CB GLU A 87 -16.967 -2.073 6.532 1.00 1.29 C ATOM 1166 CG GLU A 87 -17.736 -1.544 7.731 1.00 1.44 C ATOM 1167 CD GLU A 87 -18.142 -2.648 8.682 1.00 1.98 C ATOM 1168 OE1 GLU A 87 -19.029 -3.449 8.327 1.00 2.29 O ATOM 1169 OE2 GLU A 87 -17.582 -2.716 9.799 1.00 2.47 O ATOM 0 H GLU A 87 -14.810 -0.367 5.890 1.00 1.11 H new ATOM 0 HA GLU A 87 -16.238 -1.541 4.570 1.00 1.07 H new ATOM 0 HB2 GLU A 87 -17.510 -2.923 6.118 1.00 1.29 H new ATOM 0 HB3 GLU A 87 -16.002 -2.447 6.875 1.00 1.29 H new ATOM 0 HG2 GLU A 87 -17.122 -0.817 8.262 1.00 1.44 H new ATOM 0 HG3 GLU A 87 -18.626 -1.018 7.386 1.00 1.44 H new ATOM 1176 N GLU A 88 -18.296 -0.885 3.590 1.00 1.34 N ATOM 1177 CA GLU A 88 -19.442 -0.397 2.834 1.00 1.67 C ATOM 1178 C GLU A 88 -19.354 1.120 2.704 1.00 1.50 C ATOM 1179 O GLU A 88 -20.353 1.828 2.710 1.00 1.58 O ATOM 1180 CB GLU A 88 -20.768 -0.827 3.476 1.00 2.11 C ATOM 1181 CG GLU A 88 -21.979 -0.571 2.590 1.00 2.70 C ATOM 1182 CD GLU A 88 -23.285 -0.918 3.265 1.00 3.20 C ATOM 1183 OE1 GLU A 88 -23.605 -0.292 4.296 1.00 3.54 O ATOM 1184 OE2 GLU A 88 -23.987 -1.829 2.780 1.00 3.64 O ATOM 0 H GLU A 88 -17.694 -1.517 3.062 1.00 1.34 H new ATOM 0 HA GLU A 88 -19.419 -0.841 1.839 1.00 1.67 H new ATOM 0 HB2 GLU A 88 -20.720 -1.889 3.715 1.00 2.11 H new ATOM 0 HB3 GLU A 88 -20.897 -0.294 4.418 1.00 2.11 H new ATOM 0 HG2 GLU A 88 -21.994 0.479 2.299 1.00 2.70 H new ATOM 0 HG3 GLU A 88 -21.883 -1.154 1.674 1.00 2.70 H new ATOM 1191 N GLU A 89 -18.131 1.609 2.587 1.00 1.41 N ATOM 1192 CA GLU A 89 -17.888 3.023 2.365 1.00 1.34 C ATOM 1193 C GLU A 89 -18.250 3.376 0.924 1.00 1.29 C ATOM 1194 O GLU A 89 -18.342 4.541 0.554 1.00 1.46 O ATOM 1195 CB GLU A 89 -16.423 3.358 2.655 1.00 1.37 C ATOM 1196 CG GLU A 89 -16.157 4.840 2.841 1.00 1.40 C ATOM 1197 CD GLU A 89 -16.787 5.398 4.101 1.00 1.75 C ATOM 1198 OE1 GLU A 89 -18.014 5.620 4.113 1.00 2.42 O ATOM 1199 OE2 GLU A 89 -16.059 5.624 5.089 1.00 1.90 O ATOM 0 H GLU A 89 -17.285 1.042 2.643 1.00 1.41 H new ATOM 0 HA GLU A 89 -18.509 3.612 3.040 1.00 1.34 H new ATOM 0 HB2 GLU A 89 -16.110 2.827 3.554 1.00 1.37 H new ATOM 0 HB3 GLU A 89 -15.807 2.988 1.836 1.00 1.37 H new ATOM 0 HG2 GLU A 89 -15.081 5.010 2.873 1.00 1.40 H new ATOM 0 HG3 GLU A 89 -16.540 5.384 1.978 1.00 1.40 H new ATOM 1206 N ILE A 90 -18.441 2.339 0.115 1.00 1.24 N ATOM 1207 CA ILE A 90 -18.814 2.495 -1.285 1.00 1.27 C ATOM 1208 C ILE A 90 -20.329 2.351 -1.447 1.00 1.40 C ATOM 1209 O ILE A 90 -20.813 1.984 -2.518 1.00 1.74 O ATOM 1210 CB ILE A 90 -18.138 1.437 -2.184 1.00 1.41 C ATOM 1211 CG1 ILE A 90 -16.795 1.002 -1.608 1.00 1.61 C ATOM 1212 CG2 ILE A 90 -17.958 1.973 -3.592 1.00 1.60 C ATOM 1213 CD1 ILE A 90 -16.099 -0.052 -2.439 1.00 2.05 C ATOM 0 H ILE A 90 -18.342 1.368 0.412 1.00 1.24 H new ATOM 0 HA ILE A 90 -18.482 3.487 -1.590 1.00 1.27 H new ATOM 0 HB ILE A 90 -18.789 0.564 -2.221 1.00 1.41 H new ATOM 0 HG12 ILE A 90 -16.146 1.873 -1.521 1.00 1.61 H new ATOM 0 HG13 ILE A 90 -16.948 0.617 -0.600 1.00 1.61 H new ATOM 0 HG21 ILE A 90 -17.480 1.214 -4.212 1.00 1.60 H new ATOM 0 HG22 ILE A 90 -18.932 2.225 -4.013 1.00 1.60 H new ATOM 0 HG23 ILE A 90 -17.333 2.865 -3.564 1.00 1.60 H new ATOM 0 HD11 ILE A 90 -15.150 -0.315 -1.972 1.00 2.05 H new ATOM 0 HD12 ILE A 90 -16.730 -0.939 -2.505 1.00 2.05 H new ATOM 0 HD13 ILE A 90 -15.915 0.337 -3.440 1.00 2.05 H new ATOM 1225 N LYS A 91 -21.077 2.605 -0.380 1.00 1.34 N ATOM 1226 CA LYS A 91 -22.529 2.515 -0.451 1.00 1.54 C ATOM 1227 C LYS A 91 -23.081 3.719 -1.202 1.00 1.63 C ATOM 1228 O LYS A 91 -23.058 4.837 -0.694 1.00 2.31 O ATOM 1229 CB LYS A 91 -23.148 2.390 0.944 1.00 1.70 C ATOM 1230 CG LYS A 91 -22.791 3.521 1.889 1.00 2.15 C ATOM 1231 CD LYS A 91 -23.081 3.151 3.334 1.00 2.83 C ATOM 1232 CE LYS A 91 -24.541 2.789 3.543 1.00 3.34 C ATOM 1233 NZ LYS A 91 -24.752 2.073 4.827 1.00 4.00 N ATOM 0 H LYS A 91 -20.708 2.871 0.533 1.00 1.34 H new ATOM 0 HA LYS A 91 -22.799 1.611 -0.998 1.00 1.54 H new ATOM 0 HB2 LYS A 91 -24.232 2.344 0.845 1.00 1.70 H new ATOM 0 HB3 LYS A 91 -22.828 1.447 1.387 1.00 1.70 H new ATOM 0 HG2 LYS A 91 -21.735 3.768 1.780 1.00 2.15 H new ATOM 0 HG3 LYS A 91 -23.356 4.413 1.620 1.00 2.15 H new ATOM 0 HD2 LYS A 91 -22.453 2.310 3.627 1.00 2.83 H new ATOM 0 HD3 LYS A 91 -22.817 3.986 3.983 1.00 2.83 H new ATOM 0 HE2 LYS A 91 -25.146 3.695 3.528 1.00 3.34 H new ATOM 0 HE3 LYS A 91 -24.883 2.164 2.718 1.00 3.34 H new ATOM 0 HZ1 LYS A 91 -25.726 1.709 4.866 1.00 4.00 H new ATOM 0 HZ2 LYS A 91 -24.083 1.280 4.896 1.00 4.00 H new ATOM 0 HZ3 LYS A 91 -24.595 2.728 5.620 1.00 4.00 H new ATOM 1247 N GLU A 92 -23.526 3.475 -2.438 1.00 1.63 N ATOM 1248 CA GLU A 92 -23.971 4.525 -3.363 1.00 1.81 C ATOM 1249 C GLU A 92 -22.765 5.302 -3.911 1.00 1.68 C ATOM 1250 O GLU A 92 -22.781 5.771 -5.051 1.00 1.97 O ATOM 1251 CB GLU A 92 -25.011 5.451 -2.701 1.00 2.06 C ATOM 1252 CG GLU A 92 -24.518 6.851 -2.366 1.00 2.20 C ATOM 1253 CD GLU A 92 -25.074 7.893 -3.308 1.00 2.74 C ATOM 1254 OE1 GLU A 92 -26.314 8.038 -3.366 1.00 3.10 O ATOM 1255 OE2 GLU A 92 -24.283 8.581 -3.987 1.00 3.05 O ATOM 0 H GLU A 92 -23.589 2.535 -2.830 1.00 1.63 H new ATOM 0 HA GLU A 92 -24.470 4.053 -4.210 1.00 1.81 H new ATOM 0 HB2 GLU A 92 -25.871 5.536 -3.365 1.00 2.06 H new ATOM 0 HB3 GLU A 92 -25.362 4.978 -1.784 1.00 2.06 H new ATOM 0 HG2 GLU A 92 -24.802 7.099 -1.344 1.00 2.20 H new ATOM 0 HG3 GLU A 92 -23.429 6.870 -2.408 1.00 2.20 H new ATOM 1262 N PHE A 93 -21.721 5.418 -3.094 1.00 1.41 N ATOM 1263 CA PHE A 93 -20.445 5.967 -3.532 1.00 1.30 C ATOM 1264 C PHE A 93 -19.792 5.007 -4.514 1.00 1.25 C ATOM 1265 O PHE A 93 -20.239 3.873 -4.667 1.00 1.39 O ATOM 1266 CB PHE A 93 -19.506 6.161 -2.340 1.00 1.23 C ATOM 1267 CG PHE A 93 -20.077 6.985 -1.224 1.00 1.39 C ATOM 1268 CD1 PHE A 93 -20.151 8.365 -1.317 1.00 1.52 C ATOM 1269 CD2 PHE A 93 -20.534 6.371 -0.072 1.00 1.56 C ATOM 1270 CE1 PHE A 93 -20.676 9.113 -0.279 1.00 1.77 C ATOM 1271 CE2 PHE A 93 -21.056 7.109 0.967 1.00 1.83 C ATOM 1272 CZ PHE A 93 -21.129 8.484 0.864 1.00 1.91 C ATOM 0 H PHE A 93 -21.737 5.135 -2.114 1.00 1.41 H new ATOM 0 HA PHE A 93 -20.628 6.931 -4.007 1.00 1.30 H new ATOM 0 HB2 PHE A 93 -19.231 5.182 -1.948 1.00 1.23 H new ATOM 0 HB3 PHE A 93 -18.588 6.633 -2.690 1.00 1.23 H new ATOM 0 HD1 PHE A 93 -19.796 8.861 -2.208 1.00 1.52 H new ATOM 0 HD2 PHE A 93 -20.481 5.296 0.014 1.00 1.56 H new ATOM 0 HE1 PHE A 93 -20.732 10.188 -0.362 1.00 1.77 H new ATOM 0 HE2 PHE A 93 -21.407 6.614 1.860 1.00 1.83 H new ATOM 0 HZ PHE A 93 -21.540 9.066 1.676 1.00 1.91 H new ATOM 1282 N VAL A 94 -18.748 5.450 -5.190 1.00 1.14 N ATOM 1283 CA VAL A 94 -18.005 4.561 -6.059 1.00 1.12 C ATOM 1284 C VAL A 94 -16.519 4.650 -5.779 1.00 0.89 C ATOM 1285 O VAL A 94 -15.902 5.704 -5.940 1.00 0.96 O ATOM 1286 CB VAL A 94 -18.289 4.820 -7.560 1.00 1.36 C ATOM 1287 CG1 VAL A 94 -17.916 6.242 -7.954 1.00 1.50 C ATOM 1288 CG2 VAL A 94 -17.549 3.808 -8.427 1.00 1.65 C ATOM 0 H VAL A 94 -18.400 6.408 -5.155 1.00 1.14 H new ATOM 0 HA VAL A 94 -18.348 3.550 -5.838 1.00 1.12 H new ATOM 0 HB VAL A 94 -19.360 4.699 -7.725 1.00 1.36 H new ATOM 0 HG11 VAL A 94 -18.127 6.393 -9.013 1.00 1.50 H new ATOM 0 HG12 VAL A 94 -18.500 6.948 -7.363 1.00 1.50 H new ATOM 0 HG13 VAL A 94 -16.854 6.404 -7.769 1.00 1.50 H new ATOM 0 HG21 VAL A 94 -17.761 4.006 -9.478 1.00 1.65 H new ATOM 0 HG22 VAL A 94 -16.477 3.893 -8.250 1.00 1.65 H new ATOM 0 HG23 VAL A 94 -17.880 2.801 -8.173 1.00 1.65 H new ATOM 1298 N CYS A 95 -15.943 3.551 -5.342 1.00 0.75 N ATOM 1299 CA CYS A 95 -14.529 3.529 -5.085 1.00 0.59 C ATOM 1300 C CYS A 95 -13.806 2.891 -6.248 1.00 0.59 C ATOM 1301 O CYS A 95 -13.956 1.696 -6.512 1.00 0.91 O ATOM 1302 CB CYS A 95 -14.231 2.732 -3.825 1.00 0.59 C ATOM 1303 SG CYS A 95 -14.877 3.441 -2.278 1.00 0.88 S ATOM 0 H CYS A 95 -16.430 2.673 -5.160 1.00 0.75 H new ATOM 0 HA CYS A 95 -14.188 4.556 -4.953 1.00 0.59 H new ATOM 0 HB2 CYS A 95 -14.642 1.730 -3.944 1.00 0.59 H new ATOM 0 HB3 CYS A 95 -13.150 2.624 -3.731 1.00 0.59 H new ATOM 1308 N THR A 96 -12.991 3.684 -6.908 1.00 0.66 N ATOM 1309 CA THR A 96 -12.181 3.210 -8.003 1.00 0.69 C ATOM 1310 C THR A 96 -10.963 4.106 -8.166 1.00 0.65 C ATOM 1311 O THR A 96 -11.109 5.304 -8.402 1.00 1.18 O ATOM 1312 CB THR A 96 -12.991 3.177 -9.316 1.00 1.20 C ATOM 1313 OG1 THR A 96 -14.047 2.215 -9.221 1.00 1.81 O ATOM 1314 CG2 THR A 96 -12.108 2.839 -10.507 1.00 1.92 C ATOM 0 H THR A 96 -12.873 4.675 -6.699 1.00 0.66 H new ATOM 0 HA THR A 96 -11.857 2.194 -7.778 1.00 0.69 H new ATOM 0 HB THR A 96 -13.410 4.171 -9.469 1.00 1.20 H new ATOM 0 HG1 THR A 96 -14.555 2.204 -10.059 1.00 1.81 H new ATOM 0 HG21 THR A 96 -12.711 2.824 -11.415 1.00 1.92 H new ATOM 0 HG22 THR A 96 -11.325 3.591 -10.604 1.00 1.92 H new ATOM 0 HG23 THR A 96 -11.654 1.859 -10.357 1.00 1.92 H new ATOM 1322 N LYS A 97 -9.776 3.520 -8.021 1.00 0.67 N ATOM 1323 CA LYS A 97 -8.501 4.218 -8.235 1.00 1.00 C ATOM 1324 C LYS A 97 -8.198 5.289 -7.176 1.00 0.96 C ATOM 1325 O LYS A 97 -7.077 5.374 -6.706 1.00 1.76 O ATOM 1326 CB LYS A 97 -8.448 4.863 -9.627 1.00 1.50 C ATOM 1327 CG LYS A 97 -8.485 3.875 -10.784 1.00 1.65 C ATOM 1328 CD LYS A 97 -8.538 4.600 -12.124 1.00 2.34 C ATOM 1329 CE LYS A 97 -8.421 3.646 -13.307 1.00 2.79 C ATOM 1330 NZ LYS A 97 -9.537 2.665 -13.361 1.00 3.18 N ATOM 0 H LYS A 97 -9.667 2.543 -7.750 1.00 0.67 H new ATOM 0 HA LYS A 97 -7.736 3.446 -8.149 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -9.288 5.551 -9.727 1.00 1.50 H new ATOM 0 HB3 LYS A 97 -7.538 5.458 -9.703 1.00 1.50 H new ATOM 0 HG2 LYS A 97 -7.603 3.235 -10.748 1.00 1.65 H new ATOM 0 HG3 LYS A 97 -9.355 3.226 -10.684 1.00 1.65 H new ATOM 0 HD2 LYS A 97 -9.475 5.153 -12.198 1.00 2.34 H new ATOM 0 HD3 LYS A 97 -7.732 5.332 -12.170 1.00 2.34 H new ATOM 0 HE2 LYS A 97 -8.402 4.221 -14.233 1.00 2.79 H new ATOM 0 HE3 LYS A 97 -7.474 3.110 -13.245 1.00 2.79 H new ATOM 0 HZ1 LYS A 97 -9.767 2.455 -14.353 1.00 3.18 H new ATOM 0 HZ2 LYS A 97 -9.252 1.789 -12.879 1.00 3.18 H new ATOM 0 HZ3 LYS A 97 -10.373 3.064 -12.889 1.00 3.18 H new ATOM 1344 N PHE A 98 -9.195 6.104 -6.824 1.00 0.70 N ATOM 1345 CA PHE A 98 -9.017 7.330 -6.019 1.00 0.66 C ATOM 1346 C PHE A 98 -8.190 8.377 -6.782 1.00 0.83 C ATOM 1347 O PHE A 98 -8.424 9.575 -6.627 1.00 1.74 O ATOM 1348 CB PHE A 98 -8.494 7.029 -4.580 1.00 0.82 C ATOM 1349 CG PHE A 98 -7.017 7.177 -4.342 1.00 0.52 C ATOM 1350 CD1 PHE A 98 -6.405 8.416 -4.445 1.00 0.62 C ATOM 1351 CD2 PHE A 98 -6.241 6.079 -4.027 1.00 0.44 C ATOM 1352 CE1 PHE A 98 -5.048 8.548 -4.226 1.00 0.55 C ATOM 1353 CE2 PHE A 98 -4.894 6.207 -3.804 1.00 0.36 C ATOM 1354 CZ PHE A 98 -4.296 7.462 -3.904 1.00 0.32 C ATOM 0 H PHE A 98 -10.165 5.935 -7.090 1.00 0.70 H new ATOM 0 HA PHE A 98 -9.999 7.776 -5.864 1.00 0.66 H new ATOM 0 HB2 PHE A 98 -9.016 7.688 -3.886 1.00 0.82 H new ATOM 0 HB3 PHE A 98 -8.777 6.008 -4.324 1.00 0.82 H new ATOM 0 HD1 PHE A 98 -6.994 9.285 -4.699 1.00 0.62 H new ATOM 0 HD2 PHE A 98 -6.702 5.105 -3.955 1.00 0.44 H new ATOM 0 HE1 PHE A 98 -4.582 9.518 -4.311 1.00 0.55 H new ATOM 0 HE2 PHE A 98 -4.300 5.341 -3.552 1.00 0.36 H new ATOM 0 HZ PHE A 98 -3.236 7.572 -3.726 1.00 0.32 H new ATOM 1364 N LYS A 99 -7.257 7.905 -7.611 1.00 0.73 N ATOM 1365 CA LYS A 99 -6.494 8.737 -8.552 1.00 0.68 C ATOM 1366 C LYS A 99 -5.465 9.595 -7.842 1.00 0.58 C ATOM 1367 O LYS A 99 -5.795 10.325 -6.914 1.00 0.77 O ATOM 1368 CB LYS A 99 -7.419 9.624 -9.399 1.00 0.87 C ATOM 1369 CG LYS A 99 -8.282 8.867 -10.403 1.00 1.19 C ATOM 1370 CD LYS A 99 -7.520 8.521 -11.680 1.00 1.64 C ATOM 1371 CE LYS A 99 -6.484 7.433 -11.453 1.00 2.13 C ATOM 1372 NZ LYS A 99 -5.757 7.083 -12.700 1.00 3.08 N ATOM 0 H LYS A 99 -7.004 6.918 -7.650 1.00 0.73 H new ATOM 0 HA LYS A 99 -5.967 8.050 -9.215 1.00 0.68 H new ATOM 0 HB2 LYS A 99 -8.071 10.187 -8.732 1.00 0.87 H new ATOM 0 HB3 LYS A 99 -6.810 10.350 -9.938 1.00 0.87 H new ATOM 0 HG2 LYS A 99 -8.650 7.950 -9.943 1.00 1.19 H new ATOM 0 HG3 LYS A 99 -9.154 9.470 -10.656 1.00 1.19 H new ATOM 0 HD2 LYS A 99 -8.225 8.195 -12.445 1.00 1.64 H new ATOM 0 HD3 LYS A 99 -7.027 9.416 -12.061 1.00 1.64 H new ATOM 0 HE2 LYS A 99 -5.770 7.765 -10.699 1.00 2.13 H new ATOM 0 HE3 LYS A 99 -6.974 6.543 -11.058 1.00 2.13 H new ATOM 0 HZ1 LYS A 99 -5.061 6.337 -12.498 1.00 3.08 H new ATOM 0 HZ2 LYS A 99 -6.434 6.741 -13.412 1.00 3.08 H new ATOM 0 HZ3 LYS A 99 -5.267 7.925 -13.064 1.00 3.08 H new ATOM 1386 N ALA A 100 -4.218 9.516 -8.299 1.00 0.43 N ATOM 1387 CA ALA A 100 -3.128 10.240 -7.665 1.00 0.36 C ATOM 1388 C ALA A 100 -1.916 10.389 -8.575 1.00 0.34 C ATOM 1389 O ALA A 100 -1.944 10.015 -9.748 1.00 0.41 O ATOM 1390 CB ALA A 100 -2.712 9.531 -6.400 1.00 0.31 C ATOM 0 H ALA A 100 -3.941 8.957 -9.106 1.00 0.43 H new ATOM 0 HA ALA A 100 -3.498 11.240 -7.441 1.00 0.36 H new ATOM 0 HB1 ALA A 100 -1.895 10.077 -5.929 1.00 0.31 H new ATOM 0 HB2 ALA A 100 -3.559 9.482 -5.715 1.00 0.31 H new ATOM 0 HB3 ALA A 100 -2.381 8.521 -6.641 1.00 0.31 H new ATOM 1396 N GLU A 101 -0.842 10.917 -7.998 1.00 0.32 N ATOM 1397 CA GLU A 101 0.389 11.191 -8.726 1.00 0.34 C ATOM 1398 C GLU A 101 1.372 10.027 -8.629 1.00 0.35 C ATOM 1399 O GLU A 101 2.525 10.138 -9.046 1.00 0.64 O ATOM 1400 CB GLU A 101 1.036 12.455 -8.169 1.00 0.45 C ATOM 1401 CG GLU A 101 0.226 13.715 -8.414 1.00 0.73 C ATOM 1402 CD GLU A 101 0.888 14.948 -7.842 1.00 1.37 C ATOM 1403 OE1 GLU A 101 1.946 15.355 -8.358 1.00 1.63 O ATOM 1404 OE2 GLU A 101 0.362 15.507 -6.862 1.00 2.19 O ATOM 0 H GLU A 101 -0.802 11.167 -7.010 1.00 0.32 H new ATOM 0 HA GLU A 101 0.137 11.329 -9.777 1.00 0.34 H new ATOM 0 HB2 GLU A 101 1.186 12.333 -7.096 1.00 0.45 H new ATOM 0 HB3 GLU A 101 2.022 12.575 -8.617 1.00 0.45 H new ATOM 0 HG2 GLU A 101 0.082 13.848 -9.486 1.00 0.73 H new ATOM 0 HG3 GLU A 101 -0.763 13.599 -7.971 1.00 0.73 H new ATOM 1411 N PHE A 102 0.906 8.916 -8.087 1.00 0.23 N ATOM 1412 CA PHE A 102 1.725 7.737 -7.910 1.00 0.19 C ATOM 1413 C PHE A 102 0.983 6.532 -8.506 1.00 0.18 C ATOM 1414 O PHE A 102 -0.146 6.679 -8.973 1.00 0.22 O ATOM 1415 CB PHE A 102 2.075 7.551 -6.422 1.00 0.20 C ATOM 1416 CG PHE A 102 0.929 7.588 -5.456 1.00 0.16 C ATOM 1417 CD1 PHE A 102 0.255 6.425 -5.122 1.00 0.18 C ATOM 1418 CD2 PHE A 102 0.496 8.784 -4.921 1.00 0.20 C ATOM 1419 CE1 PHE A 102 -0.829 6.458 -4.271 1.00 0.22 C ATOM 1420 CE2 PHE A 102 -0.584 8.823 -4.064 1.00 0.24 C ATOM 1421 CZ PHE A 102 -1.131 7.653 -3.600 1.00 0.22 C ATOM 0 H PHE A 102 -0.053 8.809 -7.758 1.00 0.23 H new ATOM 0 HA PHE A 102 2.674 7.841 -8.436 1.00 0.19 H new ATOM 0 HB2 PHE A 102 2.586 6.595 -6.309 1.00 0.20 H new ATOM 0 HB3 PHE A 102 2.785 8.328 -6.139 1.00 0.20 H new ATOM 0 HD1 PHE A 102 0.582 5.481 -5.533 1.00 0.18 H new ATOM 0 HD2 PHE A 102 1.009 9.700 -5.176 1.00 0.20 H new ATOM 0 HE1 PHE A 102 -1.437 5.578 -4.123 1.00 0.22 H new ATOM 0 HE2 PHE A 102 -0.998 9.772 -3.759 1.00 0.24 H new ATOM 0 HZ PHE A 102 -1.780 7.652 -2.737 1.00 0.22 H new ATOM 1431 N PRO A 103 1.613 5.352 -8.567 1.00 0.18 N ATOM 1432 CA PRO A 103 0.996 4.137 -9.128 1.00 0.21 C ATOM 1433 C PRO A 103 -0.121 3.569 -8.253 1.00 0.19 C ATOM 1434 O PRO A 103 0.134 2.886 -7.260 1.00 0.27 O ATOM 1435 CB PRO A 103 2.170 3.154 -9.207 1.00 0.27 C ATOM 1436 CG PRO A 103 3.380 4.012 -9.094 1.00 0.31 C ATOM 1437 CD PRO A 103 2.990 5.091 -8.148 1.00 0.21 C ATOM 0 HA PRO A 103 0.514 4.337 -10.085 1.00 0.21 H new ATOM 0 HB2 PRO A 103 2.128 2.419 -8.403 1.00 0.27 H new ATOM 0 HB3 PRO A 103 2.162 2.600 -10.146 1.00 0.27 H new ATOM 0 HG2 PRO A 103 4.233 3.446 -8.720 1.00 0.31 H new ATOM 0 HG3 PRO A 103 3.668 4.420 -10.063 1.00 0.31 H new ATOM 0 HD2 PRO A 103 3.050 4.768 -7.109 1.00 0.21 H new ATOM 0 HD3 PRO A 103 3.624 5.972 -8.245 1.00 0.21 H new ATOM 1445 N ILE A 104 -1.358 3.857 -8.630 1.00 0.24 N ATOM 1446 CA ILE A 104 -2.509 3.262 -7.973 1.00 0.24 C ATOM 1447 C ILE A 104 -2.938 2.038 -8.762 1.00 0.26 C ATOM 1448 O ILE A 104 -3.042 2.079 -9.990 1.00 0.36 O ATOM 1449 CB ILE A 104 -3.699 4.239 -7.813 1.00 0.27 C ATOM 1450 CG1 ILE A 104 -3.413 5.293 -6.732 1.00 0.25 C ATOM 1451 CG2 ILE A 104 -4.972 3.477 -7.485 1.00 0.37 C ATOM 1452 CD1 ILE A 104 -2.464 6.364 -7.183 1.00 0.31 C ATOM 0 H ILE A 104 -1.589 4.499 -9.388 1.00 0.24 H new ATOM 0 HA ILE A 104 -2.207 2.989 -6.962 1.00 0.24 H new ATOM 0 HB ILE A 104 -3.835 4.758 -8.762 1.00 0.27 H new ATOM 0 HG12 ILE A 104 -4.352 5.755 -6.427 1.00 0.25 H new ATOM 0 HG13 ILE A 104 -3.000 4.799 -5.853 1.00 0.25 H new ATOM 0 HG21 ILE A 104 -5.799 4.179 -7.376 1.00 0.37 H new ATOM 0 HG22 ILE A 104 -5.195 2.777 -8.290 1.00 0.37 H new ATOM 0 HG23 ILE A 104 -4.837 2.928 -6.553 1.00 0.37 H new ATOM 0 HD11 ILE A 104 -2.306 7.075 -6.372 1.00 0.31 H new ATOM 0 HD12 ILE A 104 -1.512 5.913 -7.461 1.00 0.31 H new ATOM 0 HD13 ILE A 104 -2.884 6.883 -8.044 1.00 0.31 H new ATOM 1464 N MET A 105 -3.171 0.959 -8.048 1.00 0.23 N ATOM 1465 CA MET A 105 -3.251 -0.362 -8.637 1.00 0.27 C ATOM 1466 C MET A 105 -4.679 -0.873 -8.694 1.00 0.26 C ATOM 1467 O MET A 105 -5.635 -0.097 -8.645 1.00 0.28 O ATOM 1468 CB MET A 105 -2.396 -1.310 -7.804 1.00 0.34 C ATOM 1469 CG MET A 105 -1.068 -0.707 -7.371 1.00 0.53 C ATOM 1470 SD MET A 105 0.208 -0.774 -8.638 1.00 0.74 S ATOM 1471 CE MET A 105 -0.435 0.314 -9.902 1.00 1.47 C ATOM 0 H MET A 105 -3.311 0.972 -7.038 1.00 0.23 H new ATOM 0 HA MET A 105 -2.887 -0.310 -9.663 1.00 0.27 H new ATOM 0 HB2 MET A 105 -2.956 -1.609 -6.918 1.00 0.34 H new ATOM 0 HB3 MET A 105 -2.204 -2.215 -8.380 1.00 0.34 H new ATOM 0 HG2 MET A 105 -1.228 0.332 -7.084 1.00 0.53 H new ATOM 0 HG3 MET A 105 -0.714 -1.232 -6.484 1.00 0.53 H new ATOM 0 HE1 MET A 105 0.381 0.652 -10.541 1.00 1.47 H new ATOM 0 HE2 MET A 105 -1.169 -0.222 -10.504 1.00 1.47 H new ATOM 0 HE3 MET A 105 -0.910 1.176 -9.433 1.00 1.47 H new ATOM 1481 N ALA A 106 -4.812 -2.182 -8.821 1.00 0.29 N ATOM 1482 CA ALA A 106 -6.108 -2.820 -8.832 1.00 0.32 C ATOM 1483 C ALA A 106 -6.702 -2.819 -7.432 1.00 0.32 C ATOM 1484 O ALA A 106 -6.010 -3.157 -6.469 1.00 0.39 O ATOM 1485 CB ALA A 106 -5.995 -4.247 -9.333 1.00 0.36 C ATOM 0 H ALA A 106 -4.027 -2.826 -8.919 1.00 0.29 H new ATOM 0 HA ALA A 106 -6.760 -2.261 -9.503 1.00 0.32 H new ATOM 0 HB1 ALA A 106 -6.981 -4.711 -9.334 1.00 0.36 H new ATOM 0 HB2 ALA A 106 -5.593 -4.246 -10.346 1.00 0.36 H new ATOM 0 HB3 ALA A 106 -5.329 -4.811 -8.679 1.00 0.36 H new ATOM 1491 N LYS A 107 -7.961 -2.428 -7.304 1.00 0.39 N ATOM 1492 CA LYS A 107 -8.642 -2.559 -6.031 1.00 0.42 C ATOM 1493 C LYS A 107 -8.886 -4.022 -5.742 1.00 0.35 C ATOM 1494 O LYS A 107 -9.527 -4.734 -6.519 1.00 0.43 O ATOM 1495 CB LYS A 107 -9.965 -1.787 -5.998 1.00 0.59 C ATOM 1496 CG LYS A 107 -10.674 -1.689 -7.330 1.00 0.59 C ATOM 1497 CD LYS A 107 -12.042 -1.055 -7.176 1.00 0.89 C ATOM 1498 CE LYS A 107 -12.763 -0.950 -8.505 1.00 1.15 C ATOM 1499 NZ LYS A 107 -14.150 -0.440 -8.342 1.00 1.66 N ATOM 0 H LYS A 107 -8.522 -2.024 -8.054 1.00 0.39 H new ATOM 0 HA LYS A 107 -8.001 -2.127 -5.263 1.00 0.42 H new ATOM 0 HB2 LYS A 107 -10.632 -2.267 -5.282 1.00 0.59 H new ATOM 0 HB3 LYS A 107 -9.773 -0.779 -5.629 1.00 0.59 H new ATOM 0 HG2 LYS A 107 -10.073 -1.100 -8.023 1.00 0.59 H new ATOM 0 HG3 LYS A 107 -10.778 -2.683 -7.764 1.00 0.59 H new ATOM 0 HD2 LYS A 107 -12.641 -1.645 -6.483 1.00 0.89 H new ATOM 0 HD3 LYS A 107 -11.936 -0.062 -6.740 1.00 0.89 H new ATOM 0 HE2 LYS A 107 -12.208 -0.287 -9.168 1.00 1.15 H new ATOM 0 HE3 LYS A 107 -12.790 -1.930 -8.982 1.00 1.15 H new ATOM 0 HZ1 LYS A 107 -14.823 -1.140 -8.714 1.00 1.66 H new ATOM 0 HZ2 LYS A 107 -14.343 -0.275 -7.333 1.00 1.66 H new ATOM 0 HZ3 LYS A 107 -14.255 0.453 -8.865 1.00 1.66 H new ATOM 1513 N ILE A 108 -8.354 -4.458 -4.627 1.00 0.33 N ATOM 1514 CA ILE A 108 -8.450 -5.823 -4.209 1.00 0.32 C ATOM 1515 C ILE A 108 -9.146 -5.867 -2.871 1.00 0.35 C ATOM 1516 O ILE A 108 -9.391 -4.830 -2.249 1.00 0.43 O ATOM 1517 CB ILE A 108 -7.047 -6.443 -4.086 1.00 0.35 C ATOM 1518 CG1 ILE A 108 -6.160 -5.557 -3.205 1.00 0.46 C ATOM 1519 CG2 ILE A 108 -6.428 -6.633 -5.466 1.00 0.47 C ATOM 1520 CD1 ILE A 108 -4.732 -6.034 -3.098 1.00 0.45 C ATOM 0 H ILE A 108 -7.837 -3.862 -3.980 1.00 0.33 H new ATOM 0 HA ILE A 108 -9.015 -6.393 -4.946 1.00 0.32 H new ATOM 0 HB ILE A 108 -7.131 -7.423 -3.616 1.00 0.35 H new ATOM 0 HG12 ILE A 108 -6.165 -4.543 -3.605 1.00 0.46 H new ATOM 0 HG13 ILE A 108 -6.592 -5.507 -2.205 1.00 0.46 H new ATOM 0 HG21 ILE A 108 -5.436 -7.072 -5.362 1.00 0.47 H new ATOM 0 HG22 ILE A 108 -7.058 -7.296 -6.059 1.00 0.47 H new ATOM 0 HG23 ILE A 108 -6.347 -5.667 -5.964 1.00 0.47 H new ATOM 0 HD11 ILE A 108 -4.169 -5.355 -2.458 1.00 0.45 H new ATOM 0 HD12 ILE A 108 -4.714 -7.036 -2.669 1.00 0.45 H new ATOM 0 HD13 ILE A 108 -4.281 -6.056 -4.090 1.00 0.45 H new ATOM 1532 N ASN A 109 -9.475 -7.057 -2.438 1.00 0.39 N ATOM 1533 CA ASN A 109 -10.155 -7.239 -1.176 1.00 0.48 C ATOM 1534 C ASN A 109 -9.174 -7.134 -0.029 1.00 0.48 C ATOM 1535 O ASN A 109 -8.880 -8.137 0.611 1.00 0.92 O ATOM 1536 CB ASN A 109 -10.818 -8.611 -1.140 1.00 0.68 C ATOM 1537 CG ASN A 109 -12.232 -8.609 -1.664 1.00 1.12 C ATOM 1538 OD1 ASN A 109 -12.472 -8.788 -2.861 1.00 2.16 O ATOM 1539 ND2 ASN A 109 -13.177 -8.420 -0.764 1.00 1.05 N ATOM 0 H ASN A 109 -9.282 -7.922 -2.943 1.00 0.39 H new ATOM 0 HA ASN A 109 -10.911 -6.460 -1.075 1.00 0.48 H new ATOM 0 HB2 ASN A 109 -10.222 -9.309 -1.728 1.00 0.68 H new ATOM 0 HB3 ASN A 109 -10.820 -8.978 -0.114 1.00 0.68 H new ATOM 0 HD21 ASN A 109 -14.157 -8.418 -1.046 1.00 1.05 H new ATOM 0 HD22 ASN A 109 -12.928 -8.276 0.215 1.00 1.05 H new ATOM 1546 N VAL A 110 -8.642 -5.945 0.240 1.00 0.28 N ATOM 1547 CA VAL A 110 -7.662 -5.845 1.305 1.00 0.26 C ATOM 1548 C VAL A 110 -8.328 -5.970 2.666 1.00 0.30 C ATOM 1549 O VAL A 110 -8.616 -4.980 3.312 1.00 0.38 O ATOM 1550 CB VAL A 110 -6.944 -4.483 1.265 1.00 0.28 C ATOM 1551 CG1 VAL A 110 -5.691 -4.573 0.429 1.00 0.29 C ATOM 1552 CG2 VAL A 110 -7.862 -3.389 0.736 1.00 0.36 C ATOM 0 H VAL A 110 -8.863 -5.075 -0.244 1.00 0.28 H new ATOM 0 HA VAL A 110 -6.947 -6.654 1.156 1.00 0.26 H new ATOM 0 HB VAL A 110 -6.666 -4.220 2.286 1.00 0.28 H new ATOM 0 HG11 VAL A 110 -5.195 -3.602 0.411 1.00 0.29 H new ATOM 0 HG12 VAL A 110 -5.019 -5.316 0.859 1.00 0.29 H new ATOM 0 HG13 VAL A 110 -5.952 -4.866 -0.588 1.00 0.29 H new ATOM 0 HG21 VAL A 110 -7.326 -2.440 0.720 1.00 0.36 H new ATOM 0 HG22 VAL A 110 -8.184 -3.641 -0.275 1.00 0.36 H new ATOM 0 HG23 VAL A 110 -8.735 -3.302 1.383 1.00 0.36 H new ATOM 1562 N ASN A 111 -8.512 -7.203 3.100 1.00 0.33 N ATOM 1563 CA ASN A 111 -8.731 -7.559 4.488 1.00 0.44 C ATOM 1564 C ASN A 111 -9.109 -9.027 4.533 1.00 0.48 C ATOM 1565 O ASN A 111 -9.210 -9.662 3.484 1.00 0.54 O ATOM 1566 CB ASN A 111 -9.796 -6.723 5.204 1.00 0.54 C ATOM 1567 CG ASN A 111 -9.545 -6.737 6.702 1.00 1.15 C ATOM 1568 OD1 ASN A 111 -8.432 -7.032 7.140 1.00 1.98 O ATOM 1569 ND2 ASN A 111 -10.545 -6.410 7.494 1.00 1.31 N ATOM 0 H ASN A 111 -8.513 -8.009 2.475 1.00 0.33 H new ATOM 0 HA ASN A 111 -7.805 -7.353 5.025 1.00 0.44 H new ATOM 0 HB2 ASN A 111 -9.776 -5.698 4.833 1.00 0.54 H new ATOM 0 HB3 ASN A 111 -10.788 -7.121 4.989 1.00 0.54 H new ATOM 0 HD21 ASN A 111 -10.411 -6.395 8.505 1.00 1.31 H new ATOM 0 HD22 ASN A 111 -11.453 -6.171 7.096 1.00 1.31 H new ATOM 1576 N GLY A 112 -9.321 -9.559 5.724 1.00 0.61 N ATOM 1577 CA GLY A 112 -10.009 -10.830 5.859 1.00 0.67 C ATOM 1578 C GLY A 112 -9.401 -11.965 5.065 1.00 0.71 C ATOM 1579 O GLY A 112 -8.187 -12.026 4.860 1.00 0.78 O ATOM 0 H GLY A 112 -9.029 -9.135 6.604 1.00 0.61 H new ATOM 0 HA2 GLY A 112 -10.025 -11.109 6.913 1.00 0.67 H new ATOM 0 HA3 GLY A 112 -11.046 -10.701 5.548 1.00 0.67 H new ATOM 1583 N GLU A 113 -10.270 -12.849 4.609 1.00 0.73 N ATOM 1584 CA GLU A 113 -9.867 -14.018 3.844 1.00 0.81 C ATOM 1585 C GLU A 113 -9.873 -13.712 2.350 1.00 0.73 C ATOM 1586 O GLU A 113 -9.314 -14.456 1.545 1.00 0.81 O ATOM 1587 CB GLU A 113 -10.829 -15.166 4.140 1.00 0.98 C ATOM 1588 CG GLU A 113 -12.268 -14.864 3.744 1.00 1.18 C ATOM 1589 CD GLU A 113 -13.231 -15.951 4.162 1.00 1.49 C ATOM 1590 OE1 GLU A 113 -13.343 -16.959 3.436 1.00 1.98 O ATOM 1591 OE2 GLU A 113 -13.879 -15.800 5.219 1.00 1.67 O ATOM 0 H GLU A 113 -11.277 -12.778 4.758 1.00 0.73 H new ATOM 0 HA GLU A 113 -8.854 -14.299 4.133 1.00 0.81 H new ATOM 0 HB2 GLU A 113 -10.493 -16.058 3.610 1.00 0.98 H new ATOM 0 HB3 GLU A 113 -10.793 -15.395 5.205 1.00 0.98 H new ATOM 0 HG2 GLU A 113 -12.574 -13.920 4.196 1.00 1.18 H new ATOM 0 HG3 GLU A 113 -12.323 -14.732 2.663 1.00 1.18 H new ATOM 1598 N ASN A 114 -10.515 -12.607 1.990 1.00 0.63 N ATOM 1599 CA ASN A 114 -10.705 -12.240 0.595 1.00 0.60 C ATOM 1600 C ASN A 114 -9.462 -11.568 0.023 1.00 0.48 C ATOM 1601 O ASN A 114 -9.347 -11.396 -1.192 1.00 0.53 O ATOM 1602 CB ASN A 114 -11.897 -11.293 0.479 1.00 0.67 C ATOM 1603 CG ASN A 114 -13.207 -11.937 0.880 1.00 1.15 C ATOM 1604 OD1 ASN A 114 -13.563 -11.954 2.058 1.00 2.04 O ATOM 1605 ND2 ASN A 114 -13.944 -12.451 -0.093 1.00 1.62 N ATOM 0 H ASN A 114 -10.916 -11.945 2.654 1.00 0.63 H new ATOM 0 HA ASN A 114 -10.891 -13.150 0.024 1.00 0.60 H new ATOM 0 HB2 ASN A 114 -11.722 -10.419 1.106 1.00 0.67 H new ATOM 0 HB3 ASN A 114 -11.973 -10.938 -0.549 1.00 0.67 H new ATOM 0 HD21 ASN A 114 -14.843 -12.882 0.122 1.00 1.62 H new ATOM 0 HD22 ASN A 114 -13.612 -12.416 -1.057 1.00 1.62 H new ATOM 1612 N ALA A 115 -8.549 -11.189 0.910 1.00 0.43 N ATOM 1613 CA ALA A 115 -7.334 -10.463 0.542 1.00 0.37 C ATOM 1614 C ALA A 115 -6.585 -11.106 -0.617 1.00 0.33 C ATOM 1615 O ALA A 115 -6.430 -12.328 -0.669 1.00 0.37 O ATOM 1616 CB ALA A 115 -6.415 -10.352 1.749 1.00 0.48 C ATOM 0 H ALA A 115 -8.629 -11.376 1.909 1.00 0.43 H new ATOM 0 HA ALA A 115 -7.645 -9.473 0.210 1.00 0.37 H new ATOM 0 HB1 ALA A 115 -5.511 -9.810 1.470 1.00 0.48 H new ATOM 0 HB2 ALA A 115 -6.927 -9.816 2.548 1.00 0.48 H new ATOM 0 HB3 ALA A 115 -6.147 -11.350 2.095 1.00 0.48 H new ATOM 1622 N HIS A 116 -6.146 -10.265 -1.559 1.00 0.29 N ATOM 1623 CA HIS A 116 -5.232 -10.693 -2.615 1.00 0.26 C ATOM 1624 C HIS A 116 -4.042 -11.405 -1.988 1.00 0.23 C ATOM 1625 O HIS A 116 -3.493 -10.884 -1.023 1.00 0.23 O ATOM 1626 CB HIS A 116 -4.721 -9.467 -3.382 1.00 0.27 C ATOM 1627 CG HIS A 116 -4.057 -9.768 -4.698 1.00 0.30 C ATOM 1628 ND1 HIS A 116 -2.732 -10.109 -4.811 1.00 0.41 N ATOM 1629 CD2 HIS A 116 -4.543 -9.760 -5.963 1.00 0.28 C ATOM 1630 CE1 HIS A 116 -2.436 -10.303 -6.083 1.00 0.42 C ATOM 1631 NE2 HIS A 116 -3.517 -10.101 -6.803 1.00 0.34 N ATOM 0 H HIS A 116 -6.412 -9.281 -1.609 1.00 0.29 H new ATOM 0 HA HIS A 116 -5.757 -11.363 -3.296 1.00 0.26 H new ATOM 0 HB2 HIS A 116 -5.560 -8.795 -3.562 1.00 0.27 H new ATOM 0 HB3 HIS A 116 -4.013 -8.931 -2.750 1.00 0.27 H new ATOM 0 HD2 HIS A 116 -5.556 -9.527 -6.256 1.00 0.28 H new ATOM 0 HE1 HIS A 116 -1.466 -10.582 -6.468 1.00 0.42 H new ATOM 0 HE2 HIS A 116 -3.581 -10.184 -7.818 1.00 0.34 H new ATOM 1640 N PRO A 117 -3.642 -12.588 -2.485 1.00 0.26 N ATOM 1641 CA PRO A 117 -2.522 -13.360 -1.930 1.00 0.26 C ATOM 1642 C PRO A 117 -1.350 -12.478 -1.489 1.00 0.21 C ATOM 1643 O PRO A 117 -0.786 -12.667 -0.410 1.00 0.23 O ATOM 1644 CB PRO A 117 -2.106 -14.279 -3.088 1.00 0.35 C ATOM 1645 CG PRO A 117 -3.095 -14.047 -4.193 1.00 0.36 C ATOM 1646 CD PRO A 117 -4.259 -13.308 -3.598 1.00 0.32 C ATOM 0 HA PRO A 117 -2.815 -13.898 -1.028 1.00 0.26 H new ATOM 0 HB2 PRO A 117 -1.093 -14.051 -3.420 1.00 0.35 H new ATOM 0 HB3 PRO A 117 -2.111 -15.323 -2.776 1.00 0.35 H new ATOM 0 HG2 PRO A 117 -2.643 -13.469 -4.999 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -3.420 -14.994 -4.624 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -4.718 -12.628 -4.316 1.00 0.32 H new ATOM 0 HD3 PRO A 117 -5.040 -13.988 -3.258 1.00 0.32 H new ATOM 1654 N LEU A 118 -1.015 -11.503 -2.329 1.00 0.21 N ATOM 1655 CA LEU A 118 0.029 -10.523 -2.030 1.00 0.19 C ATOM 1656 C LEU A 118 -0.212 -9.814 -0.693 1.00 0.18 C ATOM 1657 O LEU A 118 0.697 -9.686 0.122 1.00 0.18 O ATOM 1658 CB LEU A 118 0.095 -9.496 -3.160 1.00 0.23 C ATOM 1659 CG LEU A 118 0.945 -8.265 -2.867 1.00 0.28 C ATOM 1660 CD1 LEU A 118 2.412 -8.638 -2.783 1.00 1.10 C ATOM 1661 CD2 LEU A 118 0.718 -7.195 -3.921 1.00 1.05 C ATOM 0 H LEU A 118 -1.459 -11.368 -3.237 1.00 0.21 H new ATOM 0 HA LEU A 118 0.977 -11.055 -1.948 1.00 0.19 H new ATOM 0 HB2 LEU A 118 0.487 -9.985 -4.052 1.00 0.23 H new ATOM 0 HB3 LEU A 118 -0.919 -9.171 -3.394 1.00 0.23 H new ATOM 0 HG LEU A 118 0.642 -7.859 -1.902 1.00 0.28 H new ATOM 0 HD11 LEU A 118 3.003 -7.746 -2.573 1.00 1.10 H new ATOM 0 HD12 LEU A 118 2.557 -9.366 -1.985 1.00 1.10 H new ATOM 0 HD13 LEU A 118 2.732 -9.071 -3.731 1.00 1.10 H new ATOM 0 HD21 LEU A 118 1.334 -6.324 -3.694 1.00 1.05 H new ATOM 0 HD22 LEU A 118 0.990 -7.586 -4.901 1.00 1.05 H new ATOM 0 HD23 LEU A 118 -0.333 -6.905 -3.925 1.00 1.05 H new ATOM 1673 N TYR A 119 -1.437 -9.355 -0.470 1.00 0.19 N ATOM 1674 CA TYR A 119 -1.793 -8.712 0.787 1.00 0.20 C ATOM 1675 C TYR A 119 -1.920 -9.719 1.899 1.00 0.20 C ATOM 1676 O TYR A 119 -1.664 -9.386 3.039 1.00 0.21 O ATOM 1677 CB TYR A 119 -3.040 -7.852 0.655 1.00 0.24 C ATOM 1678 CG TYR A 119 -2.680 -6.389 0.538 1.00 0.35 C ATOM 1679 CD1 TYR A 119 -2.470 -5.809 -0.706 1.00 0.44 C ATOM 1680 CD2 TYR A 119 -2.584 -5.582 1.663 1.00 0.69 C ATOM 1681 CE1 TYR A 119 -2.170 -4.467 -0.826 1.00 0.79 C ATOM 1682 CE2 TYR A 119 -2.280 -4.238 1.551 1.00 1.06 C ATOM 1683 CZ TYR A 119 -1.965 -3.711 0.340 1.00 1.10 C ATOM 1684 OH TYR A 119 -1.772 -2.351 0.191 1.00 1.49 O ATOM 0 H TYR A 119 -2.200 -9.416 -1.144 1.00 0.19 H new ATOM 0 HA TYR A 119 -0.977 -8.038 1.048 1.00 0.20 H new ATOM 0 HB2 TYR A 119 -3.608 -8.161 -0.222 1.00 0.24 H new ATOM 0 HB3 TYR A 119 -3.684 -8.003 1.521 1.00 0.24 H new ATOM 0 HD1 TYR A 119 -2.543 -6.418 -1.595 1.00 0.44 H new ATOM 0 HD2 TYR A 119 -2.749 -6.010 2.641 1.00 0.69 H new ATOM 0 HE1 TYR A 119 -2.094 -4.006 -1.800 1.00 0.79 H new ATOM 0 HE2 TYR A 119 -2.293 -3.607 2.427 1.00 1.06 H new ATOM 0 HH TYR A 119 -2.478 -1.981 -0.379 1.00 1.49 H new ATOM 1694 N GLU A 120 -2.287 -10.950 1.590 1.00 0.21 N ATOM 1695 CA GLU A 120 -2.170 -11.999 2.587 1.00 0.22 C ATOM 1696 C GLU A 120 -0.730 -12.057 3.061 1.00 0.21 C ATOM 1697 O GLU A 120 -0.475 -12.200 4.247 1.00 0.26 O ATOM 1698 CB GLU A 120 -2.583 -13.366 2.044 1.00 0.28 C ATOM 1699 CG GLU A 120 -4.029 -13.455 1.598 1.00 0.40 C ATOM 1700 CD GLU A 120 -4.434 -14.881 1.295 1.00 1.38 C ATOM 1701 OE1 GLU A 120 -3.946 -15.438 0.287 1.00 2.37 O ATOM 1702 OE2 GLU A 120 -5.227 -15.455 2.068 1.00 1.57 O ATOM 0 H GLU A 120 -2.657 -11.243 0.686 1.00 0.21 H new ATOM 0 HA GLU A 120 -2.845 -11.762 3.410 1.00 0.22 H new ATOM 0 HB2 GLU A 120 -1.940 -13.617 1.201 1.00 0.28 H new ATOM 0 HB3 GLU A 120 -2.407 -14.117 2.814 1.00 0.28 H new ATOM 0 HG2 GLU A 120 -4.676 -13.051 2.377 1.00 0.40 H new ATOM 0 HG3 GLU A 120 -4.175 -12.839 0.711 1.00 0.40 H new ATOM 1709 N TYR A 121 0.204 -11.887 2.126 1.00 0.19 N ATOM 1710 CA TYR A 121 1.623 -11.892 2.467 1.00 0.18 C ATOM 1711 C TYR A 121 1.981 -10.663 3.293 1.00 0.17 C ATOM 1712 O TYR A 121 2.679 -10.763 4.296 1.00 0.21 O ATOM 1713 CB TYR A 121 2.510 -11.965 1.212 1.00 0.20 C ATOM 1714 CG TYR A 121 3.990 -11.794 1.502 1.00 0.26 C ATOM 1715 CD1 TYR A 121 4.754 -12.855 1.970 1.00 0.40 C ATOM 1716 CD2 TYR A 121 4.620 -10.568 1.312 1.00 0.32 C ATOM 1717 CE1 TYR A 121 6.101 -12.700 2.241 1.00 0.48 C ATOM 1718 CE2 TYR A 121 5.966 -10.407 1.583 1.00 0.41 C ATOM 1719 CZ TYR A 121 6.702 -11.476 2.045 1.00 0.47 C ATOM 1720 OH TYR A 121 8.041 -11.316 2.324 1.00 0.58 O ATOM 0 H TYR A 121 0.005 -11.745 1.136 1.00 0.19 H new ATOM 0 HA TYR A 121 1.811 -12.786 3.061 1.00 0.18 H new ATOM 0 HB2 TYR A 121 2.353 -12.926 0.722 1.00 0.20 H new ATOM 0 HB3 TYR A 121 2.195 -11.194 0.509 1.00 0.20 H new ATOM 0 HD1 TYR A 121 4.288 -13.817 2.125 1.00 0.40 H new ATOM 0 HD2 TYR A 121 4.048 -9.728 0.947 1.00 0.32 H new ATOM 0 HE1 TYR A 121 6.680 -13.536 2.605 1.00 0.48 H new ATOM 0 HE2 TYR A 121 6.438 -9.447 1.433 1.00 0.41 H new ATOM 0 HH TYR A 121 8.508 -12.166 2.182 1.00 0.58 H new ATOM 1730 N MET A 122 1.497 -9.508 2.874 1.00 0.16 N ATOM 1731 CA MET A 122 1.800 -8.267 3.572 1.00 0.18 C ATOM 1732 C MET A 122 1.206 -8.262 4.976 1.00 0.18 C ATOM 1733 O MET A 122 1.930 -8.102 5.962 1.00 0.21 O ATOM 1734 CB MET A 122 1.280 -7.075 2.772 1.00 0.20 C ATOM 1735 CG MET A 122 1.988 -6.894 1.442 1.00 0.22 C ATOM 1736 SD MET A 122 1.308 -5.548 0.461 1.00 0.34 S ATOM 1737 CE MET A 122 2.343 -5.652 -0.997 1.00 0.28 C ATOM 0 H MET A 122 0.895 -9.401 2.058 1.00 0.16 H new ATOM 0 HA MET A 122 2.883 -8.188 3.667 1.00 0.18 H new ATOM 0 HB2 MET A 122 0.212 -7.203 2.594 1.00 0.20 H new ATOM 0 HB3 MET A 122 1.397 -6.168 3.365 1.00 0.20 H new ATOM 0 HG2 MET A 122 3.046 -6.706 1.623 1.00 0.22 H new ATOM 0 HG3 MET A 122 1.922 -7.821 0.872 1.00 0.22 H new ATOM 0 HE1 MET A 122 1.842 -5.166 -1.834 1.00 0.28 H new ATOM 0 HE2 MET A 122 3.294 -5.154 -0.805 1.00 0.28 H new ATOM 0 HE3 MET A 122 2.524 -6.699 -1.241 1.00 0.28 H new ATOM 1747 N LYS A 123 -0.103 -8.473 5.057 1.00 0.18 N ATOM 1748 CA LYS A 123 -0.828 -8.415 6.320 1.00 0.22 C ATOM 1749 C LYS A 123 -0.239 -9.398 7.333 1.00 0.23 C ATOM 1750 O LYS A 123 -0.084 -9.066 8.511 1.00 0.31 O ATOM 1751 CB LYS A 123 -2.312 -8.747 6.122 1.00 0.32 C ATOM 1752 CG LYS A 123 -3.042 -7.930 5.074 1.00 0.60 C ATOM 1753 CD LYS A 123 -4.323 -8.647 4.652 1.00 0.78 C ATOM 1754 CE LYS A 123 -5.161 -9.059 5.859 1.00 0.74 C ATOM 1755 NZ LYS A 123 -6.103 -10.166 5.542 1.00 0.94 N ATOM 0 H LYS A 123 -0.690 -8.688 4.251 1.00 0.18 H new ATOM 0 HA LYS A 123 -0.732 -7.397 6.698 1.00 0.22 H new ATOM 0 HB2 LYS A 123 -2.396 -9.801 5.856 1.00 0.32 H new ATOM 0 HB3 LYS A 123 -2.823 -8.618 7.076 1.00 0.32 H new ATOM 0 HG2 LYS A 123 -3.282 -6.944 5.472 1.00 0.60 H new ATOM 0 HG3 LYS A 123 -2.399 -7.777 4.207 1.00 0.60 H new ATOM 0 HD2 LYS A 123 -4.910 -7.994 4.007 1.00 0.78 H new ATOM 0 HD3 LYS A 123 -4.070 -9.530 4.066 1.00 0.78 H new ATOM 0 HE2 LYS A 123 -4.500 -9.368 6.669 1.00 0.74 H new ATOM 0 HE3 LYS A 123 -5.724 -8.198 6.218 1.00 0.74 H new ATOM 0 HZ1 LYS A 123 -6.795 -10.264 6.312 1.00 0.94 H new ATOM 0 HZ2 LYS A 123 -6.600 -9.955 4.653 1.00 0.94 H new ATOM 0 HZ3 LYS A 123 -5.572 -11.055 5.439 1.00 0.94 H new ATOM 1769 N LYS A 124 0.081 -10.606 6.867 1.00 0.21 N ATOM 1770 CA LYS A 124 0.598 -11.656 7.743 1.00 0.24 C ATOM 1771 C LYS A 124 2.002 -11.323 8.219 1.00 0.25 C ATOM 1772 O LYS A 124 2.352 -11.592 9.367 1.00 0.30 O ATOM 1773 CB LYS A 124 0.603 -13.016 7.032 1.00 0.27 C ATOM 1774 CG LYS A 124 1.665 -13.148 5.943 1.00 0.26 C ATOM 1775 CD LYS A 124 1.500 -14.438 5.148 1.00 1.05 C ATOM 1776 CE LYS A 124 1.778 -15.672 5.994 1.00 1.37 C ATOM 1777 NZ LYS A 124 3.216 -15.796 6.347 1.00 2.13 N ATOM 0 H LYS A 124 -0.009 -10.881 5.889 1.00 0.21 H new ATOM 0 HA LYS A 124 -0.064 -11.715 8.607 1.00 0.24 H new ATOM 0 HB2 LYS A 124 0.759 -13.800 7.773 1.00 0.27 H new ATOM 0 HB3 LYS A 124 -0.379 -13.186 6.589 1.00 0.27 H new ATOM 0 HG2 LYS A 124 1.602 -12.294 5.268 1.00 0.26 H new ATOM 0 HG3 LYS A 124 2.656 -13.124 6.396 1.00 0.26 H new ATOM 0 HD2 LYS A 124 0.486 -14.492 4.752 1.00 1.05 H new ATOM 0 HD3 LYS A 124 2.176 -14.425 4.293 1.00 1.05 H new ATOM 0 HE2 LYS A 124 1.184 -15.626 6.907 1.00 1.37 H new ATOM 0 HE3 LYS A 124 1.460 -16.562 5.451 1.00 1.37 H new ATOM 0 HZ1 LYS A 124 3.383 -16.715 6.805 1.00 2.13 H new ATOM 0 HZ2 LYS A 124 3.792 -15.729 5.484 1.00 2.13 H new ATOM 0 HZ3 LYS A 124 3.480 -15.031 7.000 1.00 2.13 H new ATOM 1791 N THR A 125 2.796 -10.725 7.338 1.00 0.23 N ATOM 1792 CA THR A 125 4.186 -10.426 7.658 1.00 0.28 C ATOM 1793 C THR A 125 4.290 -9.409 8.791 1.00 0.34 C ATOM 1794 O THR A 125 5.150 -9.536 9.667 1.00 0.47 O ATOM 1795 CB THR A 125 4.966 -9.919 6.427 1.00 0.31 C ATOM 1796 OG1 THR A 125 4.994 -10.934 5.415 1.00 0.35 O ATOM 1797 CG2 THR A 125 6.396 -9.537 6.794 1.00 0.37 C ATOM 0 H THR A 125 2.504 -10.440 6.403 1.00 0.23 H new ATOM 0 HA THR A 125 4.637 -11.363 7.984 1.00 0.28 H new ATOM 0 HB THR A 125 4.456 -9.032 6.052 1.00 0.31 H new ATOM 0 HG1 THR A 125 4.078 -11.141 5.134 1.00 0.35 H new ATOM 0 HG21 THR A 125 6.918 -9.184 5.905 1.00 0.37 H new ATOM 0 HG22 THR A 125 6.380 -8.746 7.543 1.00 0.37 H new ATOM 0 HG23 THR A 125 6.913 -10.408 7.197 1.00 0.37 H new ATOM 1805 N LYS A 126 3.415 -8.410 8.788 1.00 0.34 N ATOM 1806 CA LYS A 126 3.450 -7.399 9.831 1.00 0.50 C ATOM 1807 C LYS A 126 2.090 -6.767 10.082 1.00 0.54 C ATOM 1808 O LYS A 126 1.583 -6.004 9.257 1.00 0.88 O ATOM 1809 CB LYS A 126 4.460 -6.308 9.489 1.00 0.70 C ATOM 1810 CG LYS A 126 4.603 -5.266 10.584 1.00 1.17 C ATOM 1811 CD LYS A 126 5.922 -4.535 10.482 1.00 0.75 C ATOM 1812 CE LYS A 126 7.090 -5.451 10.816 1.00 0.91 C ATOM 1813 NZ LYS A 126 7.170 -5.733 12.273 1.00 1.75 N ATOM 0 H LYS A 126 2.685 -8.281 8.087 1.00 0.34 H new ATOM 0 HA LYS A 126 3.752 -7.911 10.745 1.00 0.50 H new ATOM 0 HB2 LYS A 126 5.431 -6.766 9.302 1.00 0.70 H new ATOM 0 HB3 LYS A 126 4.156 -5.816 8.565 1.00 0.70 H new ATOM 0 HG2 LYS A 126 3.783 -4.551 10.517 1.00 1.17 H new ATOM 0 HG3 LYS A 126 4.527 -5.748 11.559 1.00 1.17 H new ATOM 0 HD2 LYS A 126 6.044 -4.140 9.473 1.00 0.75 H new ATOM 0 HD3 LYS A 126 5.921 -3.682 11.161 1.00 0.75 H new ATOM 0 HE2 LYS A 126 6.985 -6.388 10.269 1.00 0.91 H new ATOM 0 HE3 LYS A 126 8.020 -4.990 10.483 1.00 0.91 H new ATOM 0 HZ1 LYS A 126 8.051 -6.246 12.479 1.00 1.75 H new ATOM 0 HZ2 LYS A 126 7.159 -4.837 12.801 1.00 1.75 H new ATOM 0 HZ3 LYS A 126 6.356 -6.314 12.559 1.00 1.75 H new ATOM 1827 N PRO A 127 1.473 -7.101 11.222 1.00 0.60 N ATOM 1828 CA PRO A 127 0.323 -6.371 11.744 1.00 0.77 C ATOM 1829 C PRO A 127 0.773 -5.117 12.498 1.00 1.08 C ATOM 1830 O PRO A 127 1.966 -4.935 12.738 1.00 1.76 O ATOM 1831 CB PRO A 127 -0.318 -7.380 12.693 1.00 1.23 C ATOM 1832 CG PRO A 127 0.813 -8.216 13.187 1.00 1.43 C ATOM 1833 CD PRO A 127 1.839 -8.244 12.082 1.00 1.01 C ATOM 0 HA PRO A 127 -0.357 -6.020 10.968 1.00 0.77 H new ATOM 0 HB2 PRO A 127 -0.828 -6.879 13.516 1.00 1.23 H new ATOM 0 HB3 PRO A 127 -1.063 -7.987 12.179 1.00 1.23 H new ATOM 0 HG2 PRO A 127 1.237 -7.796 14.099 1.00 1.43 H new ATOM 0 HG3 PRO A 127 0.474 -9.224 13.428 1.00 1.43 H new ATOM 0 HD2 PRO A 127 2.851 -8.140 12.474 1.00 1.01 H new ATOM 0 HD3 PRO A 127 1.806 -9.184 11.531 1.00 1.01 H new ATOM 1841 N GLY A 128 -0.161 -4.243 12.856 1.00 1.46 N ATOM 1842 CA GLY A 128 0.216 -3.061 13.606 1.00 2.01 C ATOM 1843 C GLY A 128 -0.868 -2.005 13.649 1.00 2.05 C ATOM 1844 O GLY A 128 -1.700 -1.924 12.742 1.00 2.37 O ATOM 0 H GLY A 128 -1.155 -4.329 12.645 1.00 1.46 H new ATOM 0 HA2 GLY A 128 0.470 -3.352 14.625 1.00 2.01 H new ATOM 0 HA3 GLY A 128 1.115 -2.631 13.164 1.00 2.01 H new ATOM 1848 N ILE A 129 -0.851 -1.220 14.731 1.00 2.20 N ATOM 1849 CA ILE A 129 -1.707 -0.046 14.901 1.00 2.50 C ATOM 1850 C ILE A 129 -3.131 -0.421 15.307 1.00 2.45 C ATOM 1851 O ILE A 129 -3.794 -1.201 14.629 1.00 2.90 O ATOM 1852 CB ILE A 129 -1.721 0.851 13.642 1.00 2.89 C ATOM 1853 CG1 ILE A 129 -0.309 1.380 13.373 1.00 2.91 C ATOM 1854 CG2 ILE A 129 -2.701 2.009 13.810 1.00 3.56 C ATOM 1855 CD1 ILE A 129 -0.209 2.268 12.154 1.00 3.45 C ATOM 0 H ILE A 129 -0.232 -1.387 15.524 1.00 2.20 H new ATOM 0 HA ILE A 129 -1.270 0.529 15.718 1.00 2.50 H new ATOM 0 HB ILE A 129 -2.050 0.255 12.790 1.00 2.89 H new ATOM 0 HG12 ILE A 129 0.032 1.938 14.245 1.00 2.91 H new ATOM 0 HG13 ILE A 129 0.368 0.534 13.251 1.00 2.91 H new ATOM 0 HG21 ILE A 129 -2.693 2.626 12.911 1.00 3.56 H new ATOM 0 HG22 ILE A 129 -3.705 1.616 13.971 1.00 3.56 H new ATOM 0 HG23 ILE A 129 -2.406 2.614 14.668 1.00 3.56 H new ATOM 0 HD11 ILE A 129 0.821 2.602 12.031 1.00 3.45 H new ATOM 0 HD12 ILE A 129 -0.517 1.709 11.270 1.00 3.45 H new ATOM 0 HD13 ILE A 129 -0.859 3.134 12.280 1.00 3.45 H new ATOM 1867 N LEU A 130 -3.555 0.155 16.445 1.00 2.26 N ATOM 1868 CA LEU A 130 -4.902 0.004 17.034 1.00 2.32 C ATOM 1869 C LEU A 130 -5.277 -1.455 17.339 1.00 2.25 C ATOM 1870 O LEU A 130 -5.441 -1.819 18.505 1.00 2.76 O ATOM 1871 CB LEU A 130 -5.992 0.737 16.209 1.00 2.39 C ATOM 1872 CG LEU A 130 -6.128 0.379 14.723 1.00 2.23 C ATOM 1873 CD1 LEU A 130 -7.238 -0.633 14.505 1.00 2.55 C ATOM 1874 CD2 LEU A 130 -6.372 1.630 13.897 1.00 2.37 C ATOM 0 H LEU A 130 -2.951 0.760 17.001 1.00 2.26 H new ATOM 0 HA LEU A 130 -4.855 0.500 18.003 1.00 2.32 H new ATOM 0 HB2 LEU A 130 -6.954 0.553 16.687 1.00 2.39 H new ATOM 0 HB3 LEU A 130 -5.801 1.808 16.279 1.00 2.39 H new ATOM 0 HG LEU A 130 -5.193 -0.075 14.396 1.00 2.23 H new ATOM 0 HD11 LEU A 130 -7.312 -0.869 13.443 1.00 2.55 H new ATOM 0 HD12 LEU A 130 -7.016 -1.542 15.064 1.00 2.55 H new ATOM 0 HD13 LEU A 130 -8.184 -0.216 14.851 1.00 2.55 H new ATOM 0 HD21 LEU A 130 -6.466 1.359 12.845 1.00 2.37 H new ATOM 0 HD22 LEU A 130 -7.290 2.113 14.231 1.00 2.37 H new ATOM 0 HD23 LEU A 130 -5.535 2.317 14.021 1.00 2.37 H new ATOM 1886 N ALA A 131 -5.401 -2.280 16.319 1.00 2.21 N ATOM 1887 CA ALA A 131 -5.711 -3.689 16.489 1.00 2.28 C ATOM 1888 C ALA A 131 -4.857 -4.504 15.535 1.00 1.77 C ATOM 1889 O ALA A 131 -5.139 -4.586 14.334 1.00 2.30 O ATOM 1890 CB ALA A 131 -7.192 -3.949 16.262 1.00 2.84 C ATOM 0 H ALA A 131 -5.290 -1.994 15.346 1.00 2.21 H new ATOM 0 HA ALA A 131 -5.485 -3.989 17.512 1.00 2.28 H new ATOM 0 HB1 ALA A 131 -7.400 -5.011 16.395 1.00 2.84 H new ATOM 0 HB2 ALA A 131 -7.777 -3.373 16.979 1.00 2.84 H new ATOM 0 HB3 ALA A 131 -7.463 -3.650 15.249 1.00 2.84 H new ATOM 1896 N THR A 132 -3.806 -5.091 16.072 1.00 1.64 N ATOM 1897 CA THR A 132 -2.781 -5.713 15.262 1.00 1.94 C ATOM 1898 C THR A 132 -3.232 -7.014 14.613 1.00 1.54 C ATOM 1899 O THR A 132 -3.317 -8.051 15.272 1.00 2.28 O ATOM 1900 CB THR A 132 -1.520 -5.990 16.083 1.00 2.92 C ATOM 1901 OG1 THR A 132 -1.862 -6.601 17.335 1.00 3.52 O ATOM 1902 CG2 THR A 132 -0.738 -4.714 16.338 1.00 3.90 C ATOM 0 H THR A 132 -3.640 -5.150 17.077 1.00 1.64 H new ATOM 0 HA THR A 132 -2.567 -4.996 14.469 1.00 1.94 H new ATOM 0 HB THR A 132 -0.894 -6.671 15.507 1.00 2.92 H new ATOM 0 HG1 THR A 132 -2.489 -7.338 17.179 1.00 3.52 H new ATOM 0 HG21 THR A 132 0.152 -4.944 16.924 1.00 3.90 H new ATOM 0 HG22 THR A 132 -0.442 -4.272 15.386 1.00 3.90 H new ATOM 0 HG23 THR A 132 -1.362 -4.009 16.887 1.00 3.90 H new ATOM 1910 N LYS A 133 -3.520 -6.935 13.318 1.00 1.22 N ATOM 1911 CA LYS A 133 -3.750 -8.114 12.487 1.00 1.46 C ATOM 1912 C LYS A 133 -4.171 -7.709 11.090 1.00 1.08 C ATOM 1913 O LYS A 133 -3.546 -8.090 10.097 1.00 1.34 O ATOM 1914 CB LYS A 133 -4.829 -9.038 13.074 1.00 2.30 C ATOM 1915 CG LYS A 133 -5.293 -10.114 12.100 1.00 2.92 C ATOM 1916 CD LYS A 133 -6.236 -11.107 12.751 1.00 3.84 C ATOM 1917 CE LYS A 133 -5.490 -12.069 13.659 1.00 4.51 C ATOM 1918 NZ LYS A 133 -4.459 -12.837 12.913 1.00 5.13 N ATOM 0 H LYS A 133 -3.601 -6.052 12.814 1.00 1.22 H new ATOM 0 HA LYS A 133 -2.806 -8.658 12.455 1.00 1.46 H new ATOM 0 HB2 LYS A 133 -4.440 -9.515 13.973 1.00 2.30 H new ATOM 0 HB3 LYS A 133 -5.687 -8.437 13.377 1.00 2.30 H new ATOM 0 HG2 LYS A 133 -5.792 -9.644 11.252 1.00 2.92 H new ATOM 0 HG3 LYS A 133 -4.426 -10.644 11.706 1.00 2.92 H new ATOM 0 HD2 LYS A 133 -6.989 -10.571 13.328 1.00 3.84 H new ATOM 0 HD3 LYS A 133 -6.764 -11.668 11.980 1.00 3.84 H new ATOM 0 HE2 LYS A 133 -5.016 -11.513 14.468 1.00 4.51 H new ATOM 0 HE3 LYS A 133 -6.197 -12.759 14.118 1.00 4.51 H new ATOM 0 HZ1 LYS A 133 -4.235 -13.711 13.430 1.00 5.13 H new ATOM 0 HZ2 LYS A 133 -4.821 -13.077 11.968 1.00 5.13 H new ATOM 0 HZ3 LYS A 133 -3.598 -12.261 12.818 1.00 5.13 H new ATOM 1932 N ALA A 134 -5.199 -6.891 11.027 1.00 0.68 N ATOM 1933 CA ALA A 134 -5.966 -6.752 9.796 1.00 0.59 C ATOM 1934 C ALA A 134 -6.052 -5.323 9.288 1.00 0.46 C ATOM 1935 O ALA A 134 -5.503 -4.397 9.885 1.00 0.72 O ATOM 1936 CB ALA A 134 -7.357 -7.326 10.009 1.00 0.93 C ATOM 0 H ALA A 134 -5.525 -6.315 11.803 1.00 0.68 H new ATOM 0 HA ALA A 134 -5.436 -7.308 9.022 1.00 0.59 H new ATOM 0 HB1 ALA A 134 -7.937 -7.225 9.091 1.00 0.93 H new ATOM 0 HB2 ALA A 134 -7.279 -8.380 10.275 1.00 0.93 H new ATOM 0 HB3 ALA A 134 -7.855 -6.785 10.814 1.00 0.93 H new ATOM 1942 N ILE A 135 -6.747 -5.181 8.163 1.00 0.49 N ATOM 1943 CA ILE A 135 -6.863 -3.919 7.458 1.00 0.38 C ATOM 1944 C ILE A 135 -8.129 -3.172 7.911 1.00 0.51 C ATOM 1945 O ILE A 135 -9.242 -3.509 7.515 1.00 1.05 O ATOM 1946 CB ILE A 135 -6.854 -4.153 5.936 1.00 0.40 C ATOM 1947 CG1 ILE A 135 -5.594 -4.953 5.580 1.00 0.39 C ATOM 1948 CG2 ILE A 135 -6.887 -2.827 5.179 1.00 0.58 C ATOM 1949 CD1 ILE A 135 -5.412 -5.214 4.106 1.00 0.87 C ATOM 0 H ILE A 135 -7.248 -5.949 7.715 1.00 0.49 H new ATOM 0 HA ILE A 135 -6.004 -3.294 7.700 1.00 0.38 H new ATOM 0 HB ILE A 135 -7.743 -4.712 5.644 1.00 0.40 H new ATOM 0 HG12 ILE A 135 -4.721 -4.415 5.951 1.00 0.39 H new ATOM 0 HG13 ILE A 135 -5.626 -5.908 6.104 1.00 0.39 H new ATOM 0 HG21 ILE A 135 -6.880 -3.020 4.106 1.00 0.58 H new ATOM 0 HG22 ILE A 135 -7.792 -2.280 5.443 1.00 0.58 H new ATOM 0 HG23 ILE A 135 -6.013 -2.233 5.447 1.00 0.58 H new ATOM 0 HD11 ILE A 135 -4.497 -5.785 3.948 1.00 0.87 H new ATOM 0 HD12 ILE A 135 -6.263 -5.781 3.729 1.00 0.87 H new ATOM 0 HD13 ILE A 135 -5.344 -4.265 3.574 1.00 0.87 H new ATOM 1961 N LYS A 136 -7.935 -2.160 8.753 1.00 0.47 N ATOM 1962 CA LYS A 136 -9.025 -1.508 9.488 1.00 0.51 C ATOM 1963 C LYS A 136 -9.355 -0.119 8.944 1.00 0.52 C ATOM 1964 O LYS A 136 -10.230 0.567 9.473 1.00 0.84 O ATOM 1965 CB LYS A 136 -8.587 -1.323 10.937 1.00 0.60 C ATOM 1966 CG LYS A 136 -7.950 -2.549 11.553 1.00 0.67 C ATOM 1967 CD LYS A 136 -8.969 -3.381 12.291 1.00 0.90 C ATOM 1968 CE LYS A 136 -8.313 -4.558 12.982 1.00 1.05 C ATOM 1969 NZ LYS A 136 -9.280 -5.308 13.826 1.00 1.50 N ATOM 0 H LYS A 136 -7.015 -1.765 8.948 1.00 0.47 H new ATOM 0 HA LYS A 136 -9.906 -2.142 9.387 1.00 0.51 H new ATOM 0 HB2 LYS A 136 -7.880 -0.495 10.988 1.00 0.60 H new ATOM 0 HB3 LYS A 136 -9.454 -1.039 11.534 1.00 0.60 H new ATOM 0 HG2 LYS A 136 -7.482 -3.150 10.773 1.00 0.67 H new ATOM 0 HG3 LYS A 136 -7.159 -2.245 12.239 1.00 0.67 H new ATOM 0 HD2 LYS A 136 -9.483 -2.763 13.027 1.00 0.90 H new ATOM 0 HD3 LYS A 136 -9.725 -3.740 11.593 1.00 0.90 H new ATOM 0 HE2 LYS A 136 -7.886 -5.227 12.235 1.00 1.05 H new ATOM 0 HE3 LYS A 136 -7.488 -4.204 13.600 1.00 1.05 H new ATOM 0 HZ1 LYS A 136 -8.795 -6.107 14.283 1.00 1.50 H new ATOM 0 HZ2 LYS A 136 -9.668 -4.676 14.555 1.00 1.50 H new ATOM 0 HZ3 LYS A 136 -10.054 -5.667 13.231 1.00 1.50 H new ATOM 1983 N TRP A 137 -8.656 0.304 7.912 1.00 0.38 N ATOM 1984 CA TRP A 137 -8.630 1.712 7.544 1.00 0.37 C ATOM 1985 C TRP A 137 -8.299 1.941 6.076 1.00 0.32 C ATOM 1986 O TRP A 137 -7.983 1.017 5.336 1.00 0.33 O ATOM 1987 CB TRP A 137 -7.618 2.505 8.402 1.00 0.42 C ATOM 1988 CG TRP A 137 -6.612 1.688 9.144 1.00 0.30 C ATOM 1989 CD1 TRP A 137 -6.142 1.952 10.397 1.00 0.37 C ATOM 1990 CD2 TRP A 137 -5.943 0.503 8.707 1.00 0.35 C ATOM 1991 NE1 TRP A 137 -5.261 0.985 10.780 1.00 0.32 N ATOM 1992 CE2 TRP A 137 -5.108 0.102 9.757 1.00 0.41 C ATOM 1993 CE3 TRP A 137 -5.972 -0.262 7.532 1.00 0.54 C ATOM 1994 CZ2 TRP A 137 -4.310 -1.011 9.682 1.00 0.66 C ATOM 1995 CZ3 TRP A 137 -5.164 -1.376 7.465 1.00 0.81 C ATOM 1996 CH2 TRP A 137 -4.340 -1.741 8.533 1.00 0.87 C ATOM 0 H TRP A 137 -8.098 -0.302 7.311 1.00 0.38 H new ATOM 0 HA TRP A 137 -9.642 2.072 7.729 1.00 0.37 H new ATOM 0 HB2 TRP A 137 -7.086 3.200 7.752 1.00 0.42 H new ATOM 0 HB3 TRP A 137 -8.173 3.105 9.123 1.00 0.42 H new ATOM 0 HD1 TRP A 137 -6.426 2.803 10.998 1.00 0.37 H new ATOM 0 HE1 TRP A 137 -4.793 0.932 11.685 1.00 0.32 H new ATOM 0 HE3 TRP A 137 -6.609 0.014 6.704 1.00 0.54 H new ATOM 0 HZ2 TRP A 137 -3.678 -1.299 10.509 1.00 0.66 H new ATOM 0 HZ3 TRP A 137 -5.168 -1.979 6.569 1.00 0.81 H new ATOM 0 HH2 TRP A 137 -3.716 -2.618 8.445 1.00 0.87 H new ATOM 2007 N ASN A 138 -8.443 3.206 5.701 1.00 0.33 N ATOM 2008 CA ASN A 138 -7.971 3.799 4.439 1.00 0.33 C ATOM 2009 C ASN A 138 -6.533 3.425 4.072 1.00 0.27 C ATOM 2010 O ASN A 138 -5.998 2.435 4.549 1.00 0.26 O ATOM 2011 CB ASN A 138 -8.093 5.312 4.521 1.00 0.40 C ATOM 2012 CG ASN A 138 -9.533 5.752 4.651 1.00 1.09 C ATOM 2013 OD1 ASN A 138 -9.831 6.738 5.318 1.00 1.80 O ATOM 2014 ND2 ASN A 138 -10.435 5.011 4.020 1.00 1.17 N ATOM 0 H ASN A 138 -8.916 3.888 6.294 1.00 0.33 H new ATOM 0 HA ASN A 138 -8.603 3.390 3.651 1.00 0.33 H new ATOM 0 HB2 ASN A 138 -7.523 5.677 5.375 1.00 0.40 H new ATOM 0 HB3 ASN A 138 -7.655 5.761 3.630 1.00 0.40 H new ATOM 0 HD21 ASN A 138 -11.424 5.253 4.078 1.00 1.17 H new ATOM 0 HD22 ASN A 138 -10.139 4.200 3.477 1.00 1.17 H new ATOM 2021 N PHE A 139 -5.928 4.285 3.235 1.00 0.27 N ATOM 2022 CA PHE A 139 -4.661 4.032 2.530 1.00 0.26 C ATOM 2023 C PHE A 139 -3.754 3.058 3.268 1.00 0.22 C ATOM 2024 O PHE A 139 -3.477 2.017 2.731 1.00 0.30 O ATOM 2025 CB PHE A 139 -3.943 5.373 2.395 1.00 0.29 C ATOM 2026 CG PHE A 139 -4.664 6.365 1.526 1.00 0.59 C ATOM 2027 CD1 PHE A 139 -5.758 7.067 2.008 1.00 0.75 C ATOM 2028 CD2 PHE A 139 -4.248 6.594 0.226 1.00 0.89 C ATOM 2029 CE1 PHE A 139 -6.423 7.975 1.210 1.00 1.12 C ATOM 2030 CE2 PHE A 139 -4.911 7.502 -0.577 1.00 1.28 C ATOM 2031 CZ PHE A 139 -6.000 8.192 -0.084 1.00 1.37 C ATOM 0 H PHE A 139 -6.320 5.203 3.024 1.00 0.27 H new ATOM 0 HA PHE A 139 -4.887 3.580 1.564 1.00 0.26 H new ATOM 0 HB2 PHE A 139 -3.809 5.804 3.387 1.00 0.29 H new ATOM 0 HB3 PHE A 139 -2.948 5.201 1.985 1.00 0.29 H new ATOM 0 HD1 PHE A 139 -6.094 6.901 3.021 1.00 0.75 H new ATOM 0 HD2 PHE A 139 -3.396 6.057 -0.165 1.00 0.89 H new ATOM 0 HE1 PHE A 139 -7.274 8.515 1.599 1.00 1.12 H new ATOM 0 HE2 PHE A 139 -4.577 7.672 -1.590 1.00 1.28 H new ATOM 0 HZ PHE A 139 -6.520 8.901 -0.711 1.00 1.37 H new ATOM 2041 N THR A 140 -3.360 3.361 4.496 1.00 0.22 N ATOM 2042 CA THR A 140 -2.512 2.464 5.294 1.00 0.21 C ATOM 2043 C THR A 140 -1.435 1.758 4.473 1.00 0.19 C ATOM 2044 O THR A 140 -1.655 0.685 3.904 1.00 0.22 O ATOM 2045 CB THR A 140 -3.335 1.384 5.989 1.00 0.23 C ATOM 2046 OG1 THR A 140 -4.468 1.981 6.608 1.00 0.30 O ATOM 2047 CG2 THR A 140 -2.495 0.654 7.027 1.00 0.28 C ATOM 0 H THR A 140 -3.613 4.227 4.972 1.00 0.22 H new ATOM 0 HA THR A 140 -2.032 3.117 6.023 1.00 0.21 H new ATOM 0 HB THR A 140 -3.666 0.657 5.247 1.00 0.23 H new ATOM 0 HG1 THR A 140 -4.808 1.387 7.309 1.00 0.30 H new ATOM 0 HG21 THR A 140 -3.100 -0.112 7.511 1.00 0.28 H new ATOM 0 HG22 THR A 140 -1.640 0.186 6.539 1.00 0.28 H new ATOM 0 HG23 THR A 140 -2.143 1.364 7.775 1.00 0.28 H new ATOM 2055 N SER A 141 -0.270 2.329 4.450 1.00 0.18 N ATOM 2056 CA SER A 141 0.810 1.762 3.678 1.00 0.17 C ATOM 2057 C SER A 141 1.554 0.698 4.466 1.00 0.17 C ATOM 2058 O SER A 141 1.601 0.734 5.695 1.00 0.22 O ATOM 2059 CB SER A 141 1.787 2.858 3.296 1.00 0.21 C ATOM 2060 OG SER A 141 2.106 3.663 4.419 1.00 0.80 O ATOM 0 H SER A 141 -0.036 3.185 4.953 1.00 0.18 H new ATOM 0 HA SER A 141 0.382 1.302 2.788 1.00 0.17 H new ATOM 0 HB2 SER A 141 2.697 2.415 2.890 1.00 0.21 H new ATOM 0 HB3 SER A 141 1.356 3.478 2.510 1.00 0.21 H new ATOM 0 HG SER A 141 1.684 4.542 4.322 1.00 0.80 H new ATOM 2066 N PHE A 142 2.144 -0.234 3.752 1.00 0.17 N ATOM 2067 CA PHE A 142 3.162 -1.080 4.336 1.00 0.17 C ATOM 2068 C PHE A 142 4.501 -0.582 3.852 1.00 0.23 C ATOM 2069 O PHE A 142 4.674 -0.299 2.677 1.00 0.53 O ATOM 2070 CB PHE A 142 3.036 -2.541 3.919 1.00 0.17 C ATOM 2071 CG PHE A 142 1.922 -3.324 4.543 1.00 0.16 C ATOM 2072 CD1 PHE A 142 0.595 -2.999 4.327 1.00 0.23 C ATOM 2073 CD2 PHE A 142 2.224 -4.428 5.320 1.00 0.20 C ATOM 2074 CE1 PHE A 142 -0.410 -3.763 4.885 1.00 0.29 C ATOM 2075 CE2 PHE A 142 1.229 -5.198 5.871 1.00 0.26 C ATOM 2076 CZ PHE A 142 -0.089 -4.864 5.655 1.00 0.28 C ATOM 0 H PHE A 142 1.939 -0.425 2.771 1.00 0.17 H new ATOM 0 HA PHE A 142 3.052 -1.033 5.419 1.00 0.17 H new ATOM 0 HB2 PHE A 142 2.913 -2.577 2.837 1.00 0.17 H new ATOM 0 HB3 PHE A 142 3.976 -3.043 4.149 1.00 0.17 H new ATOM 0 HD1 PHE A 142 0.344 -2.143 3.718 1.00 0.23 H new ATOM 0 HD2 PHE A 142 3.257 -4.688 5.496 1.00 0.20 H new ATOM 0 HE1 PHE A 142 -1.445 -3.501 4.720 1.00 0.29 H new ATOM 0 HE2 PHE A 142 1.479 -6.061 6.470 1.00 0.26 H new ATOM 0 HZ PHE A 142 -0.875 -5.465 6.089 1.00 0.28 H new ATOM 2086 N LEU A 143 5.446 -0.478 4.737 1.00 0.14 N ATOM 2087 CA LEU A 143 6.761 -0.055 4.342 1.00 0.14 C ATOM 2088 C LEU A 143 7.499 -1.244 3.769 1.00 0.13 C ATOM 2089 O LEU A 143 7.914 -2.140 4.494 1.00 0.13 O ATOM 2090 CB LEU A 143 7.481 0.536 5.543 1.00 0.16 C ATOM 2091 CG LEU A 143 8.989 0.729 5.393 1.00 0.19 C ATOM 2092 CD1 LEU A 143 9.300 1.744 4.312 1.00 0.37 C ATOM 2093 CD2 LEU A 143 9.594 1.153 6.720 1.00 0.51 C ATOM 0 H LEU A 143 5.336 -0.678 5.731 1.00 0.14 H new ATOM 0 HA LEU A 143 6.709 0.718 3.575 1.00 0.14 H new ATOM 0 HB2 LEU A 143 7.032 1.503 5.771 1.00 0.16 H new ATOM 0 HB3 LEU A 143 7.301 -0.109 6.403 1.00 0.16 H new ATOM 0 HG LEU A 143 9.432 -0.221 5.095 1.00 0.19 H new ATOM 0 HD11 LEU A 143 10.380 1.863 4.225 1.00 0.37 H new ATOM 0 HD12 LEU A 143 8.895 1.398 3.361 1.00 0.37 H new ATOM 0 HD13 LEU A 143 8.849 2.702 4.572 1.00 0.37 H new ATOM 0 HD21 LEU A 143 10.669 1.288 6.603 1.00 0.51 H new ATOM 0 HD22 LEU A 143 9.143 2.092 7.042 1.00 0.51 H new ATOM 0 HD23 LEU A 143 9.404 0.384 7.469 1.00 0.51 H new ATOM 2105 N ILE A 144 7.633 -1.250 2.458 1.00 0.14 N ATOM 2106 CA ILE A 144 8.196 -2.382 1.759 1.00 0.14 C ATOM 2107 C ILE A 144 9.641 -2.076 1.407 1.00 0.15 C ATOM 2108 O ILE A 144 9.936 -1.059 0.776 1.00 0.19 O ATOM 2109 CB ILE A 144 7.394 -2.718 0.473 1.00 0.16 C ATOM 2110 CG1 ILE A 144 5.879 -2.697 0.743 1.00 0.16 C ATOM 2111 CG2 ILE A 144 7.820 -4.072 -0.059 1.00 0.20 C ATOM 2112 CD1 ILE A 144 5.417 -3.636 1.842 1.00 0.16 C ATOM 0 H ILE A 144 7.357 -0.476 1.854 1.00 0.14 H new ATOM 0 HA ILE A 144 8.145 -3.253 2.412 1.00 0.14 H new ATOM 0 HB ILE A 144 7.608 -1.956 -0.277 1.00 0.16 H new ATOM 0 HG12 ILE A 144 5.585 -1.681 1.005 1.00 0.16 H new ATOM 0 HG13 ILE A 144 5.356 -2.953 -0.178 1.00 0.16 H new ATOM 0 HG21 ILE A 144 7.254 -4.303 -0.961 1.00 0.20 H new ATOM 0 HG22 ILE A 144 8.884 -4.052 -0.293 1.00 0.20 H new ATOM 0 HG23 ILE A 144 7.628 -4.836 0.695 1.00 0.20 H new ATOM 0 HD11 ILE A 144 4.337 -3.553 1.961 1.00 0.16 H new ATOM 0 HD12 ILE A 144 5.675 -4.661 1.577 1.00 0.16 H new ATOM 0 HD13 ILE A 144 5.907 -3.369 2.778 1.00 0.16 H new ATOM 2124 N ASP A 145 10.545 -2.935 1.845 1.00 0.15 N ATOM 2125 CA ASP A 145 11.962 -2.694 1.648 1.00 0.17 C ATOM 2126 C ASP A 145 12.357 -2.977 0.201 1.00 0.18 C ATOM 2127 O ASP A 145 11.523 -3.382 -0.608 1.00 0.21 O ATOM 2128 CB ASP A 145 12.797 -3.548 2.609 1.00 0.22 C ATOM 2129 CG ASP A 145 13.096 -4.932 2.070 1.00 0.68 C ATOM 2130 OD1 ASP A 145 12.154 -5.645 1.689 1.00 1.02 O ATOM 2131 OD2 ASP A 145 14.286 -5.298 2.000 1.00 1.30 O ATOM 0 H ASP A 145 10.324 -3.801 2.337 1.00 0.15 H new ATOM 0 HA ASP A 145 12.162 -1.644 1.862 1.00 0.17 H new ATOM 0 HB2 ASP A 145 13.736 -3.036 2.818 1.00 0.22 H new ATOM 0 HB3 ASP A 145 12.267 -3.641 3.557 1.00 0.22 H new ATOM 2136 N ARG A 146 13.635 -2.797 -0.108 1.00 0.21 N ATOM 2137 CA ARG A 146 14.136 -2.950 -1.473 1.00 0.25 C ATOM 2138 C ARG A 146 13.962 -4.371 -2.006 1.00 0.27 C ATOM 2139 O ARG A 146 14.087 -4.607 -3.205 1.00 0.43 O ATOM 2140 CB ARG A 146 15.617 -2.573 -1.535 1.00 0.29 C ATOM 2141 CG ARG A 146 15.882 -1.083 -1.427 1.00 0.46 C ATOM 2142 CD ARG A 146 17.355 -0.777 -1.616 1.00 0.90 C ATOM 2143 NE ARG A 146 17.595 0.635 -1.903 1.00 1.87 N ATOM 2144 CZ ARG A 146 18.547 1.066 -2.734 1.00 2.72 C ATOM 2145 NH1 ARG A 146 19.414 0.209 -3.258 1.00 2.90 N ATOM 2146 NH2 ARG A 146 18.662 2.359 -3.006 1.00 3.78 N ATOM 0 H ARG A 146 14.351 -2.543 0.573 1.00 0.21 H new ATOM 0 HA ARG A 146 13.546 -2.282 -2.101 1.00 0.25 H new ATOM 0 HB2 ARG A 146 16.145 -3.084 -0.730 1.00 0.29 H new ATOM 0 HB3 ARG A 146 16.035 -2.938 -2.473 1.00 0.29 H new ATOM 0 HG2 ARG A 146 15.297 -0.551 -2.177 1.00 0.46 H new ATOM 0 HG3 ARG A 146 15.554 -0.722 -0.452 1.00 0.46 H new ATOM 0 HD2 ARG A 146 17.901 -1.061 -0.716 1.00 0.90 H new ATOM 0 HD3 ARG A 146 17.748 -1.383 -2.432 1.00 0.90 H new ATOM 0 HE ARG A 146 17.004 1.328 -1.444 1.00 1.87 H new ATOM 0 HH11 ARG A 146 19.354 -0.783 -3.026 1.00 2.90 H new ATOM 0 HH12 ARG A 146 20.140 0.542 -3.893 1.00 2.90 H new ATOM 0 HH21 ARG A 146 18.022 3.029 -2.580 1.00 3.78 H new ATOM 0 HH22 ARG A 146 19.391 2.684 -3.641 1.00 3.78 H new ATOM 2160 N ASP A 147 13.664 -5.309 -1.129 1.00 0.19 N ATOM 2161 CA ASP A 147 13.639 -6.708 -1.507 1.00 0.26 C ATOM 2162 C ASP A 147 12.208 -7.216 -1.551 1.00 0.20 C ATOM 2163 O ASP A 147 11.917 -8.251 -2.150 1.00 0.27 O ATOM 2164 CB ASP A 147 14.470 -7.521 -0.521 1.00 0.39 C ATOM 2165 CG ASP A 147 14.691 -8.952 -0.973 1.00 0.66 C ATOM 2166 OD1 ASP A 147 15.486 -9.169 -1.910 1.00 1.18 O ATOM 2167 OD2 ASP A 147 14.067 -9.868 -0.396 1.00 0.85 O ATOM 0 H ASP A 147 13.436 -5.128 -0.151 1.00 0.19 H new ATOM 0 HA ASP A 147 14.069 -6.818 -2.502 1.00 0.26 H new ATOM 0 HB2 ASP A 147 15.436 -7.036 -0.382 1.00 0.39 H new ATOM 0 HB3 ASP A 147 13.973 -7.525 0.449 1.00 0.39 H new ATOM 2172 N GLY A 148 11.315 -6.470 -0.915 1.00 0.18 N ATOM 2173 CA GLY A 148 9.907 -6.785 -0.961 1.00 0.16 C ATOM 2174 C GLY A 148 9.407 -7.439 0.307 1.00 0.16 C ATOM 2175 O GLY A 148 8.533 -8.301 0.265 1.00 0.23 O ATOM 0 H GLY A 148 11.548 -5.644 -0.363 1.00 0.18 H new ATOM 0 HA2 GLY A 148 9.341 -5.871 -1.139 1.00 0.16 H new ATOM 0 HA3 GLY A 148 9.716 -7.448 -1.805 1.00 0.16 H new ATOM 2179 N VAL A 149 9.961 -7.044 1.434 1.00 0.19 N ATOM 2180 CA VAL A 149 9.514 -7.551 2.718 1.00 0.20 C ATOM 2181 C VAL A 149 8.989 -6.410 3.583 1.00 0.18 C ATOM 2182 O VAL A 149 9.678 -5.412 3.795 1.00 0.22 O ATOM 2183 CB VAL A 149 10.648 -8.290 3.457 1.00 0.27 C ATOM 2184 CG1 VAL A 149 10.187 -8.772 4.826 1.00 0.61 C ATOM 2185 CG2 VAL A 149 11.145 -9.461 2.623 1.00 0.62 C ATOM 0 H VAL A 149 10.725 -6.370 1.489 1.00 0.19 H new ATOM 0 HA VAL A 149 8.709 -8.263 2.532 1.00 0.20 H new ATOM 0 HB VAL A 149 11.469 -7.589 3.605 1.00 0.27 H new ATOM 0 HG11 VAL A 149 11.007 -9.289 5.325 1.00 0.61 H new ATOM 0 HG12 VAL A 149 9.878 -7.917 5.428 1.00 0.61 H new ATOM 0 HG13 VAL A 149 9.346 -9.455 4.707 1.00 0.61 H new ATOM 0 HG21 VAL A 149 11.945 -9.974 3.156 1.00 0.62 H new ATOM 0 HG22 VAL A 149 10.324 -10.156 2.445 1.00 0.62 H new ATOM 0 HG23 VAL A 149 11.522 -9.094 1.669 1.00 0.62 H new ATOM 2195 N PRO A 150 7.733 -6.528 4.044 1.00 0.18 N ATOM 2196 CA PRO A 150 7.109 -5.551 4.946 1.00 0.19 C ATOM 2197 C PRO A 150 7.936 -5.288 6.205 1.00 0.19 C ATOM 2198 O PRO A 150 8.105 -6.169 7.050 1.00 0.30 O ATOM 2199 CB PRO A 150 5.783 -6.216 5.316 1.00 0.24 C ATOM 2200 CG PRO A 150 5.474 -7.097 4.161 1.00 0.26 C ATOM 2201 CD PRO A 150 6.802 -7.617 3.691 1.00 0.23 C ATOM 0 HA PRO A 150 7.006 -4.575 4.472 1.00 0.19 H new ATOM 0 HB2 PRO A 150 5.870 -6.788 6.240 1.00 0.24 H new ATOM 0 HB3 PRO A 150 4.998 -5.476 5.472 1.00 0.24 H new ATOM 0 HG2 PRO A 150 4.814 -7.913 4.455 1.00 0.26 H new ATOM 0 HG3 PRO A 150 4.966 -6.545 3.370 1.00 0.26 H new ATOM 0 HD2 PRO A 150 7.068 -8.551 4.187 1.00 0.23 H new ATOM 0 HD3 PRO A 150 6.801 -7.815 2.619 1.00 0.23 H new ATOM 2209 N VAL A 151 8.453 -4.073 6.311 1.00 0.15 N ATOM 2210 CA VAL A 151 9.227 -3.654 7.468 1.00 0.17 C ATOM 2211 C VAL A 151 8.324 -2.991 8.502 1.00 0.18 C ATOM 2212 O VAL A 151 8.581 -3.073 9.699 1.00 0.27 O ATOM 2213 CB VAL A 151 10.341 -2.659 7.070 1.00 0.21 C ATOM 2214 CG1 VAL A 151 11.262 -2.373 8.247 1.00 0.27 C ATOM 2215 CG2 VAL A 151 11.135 -3.184 5.885 1.00 0.23 C ATOM 0 H VAL A 151 8.348 -3.351 5.598 1.00 0.15 H new ATOM 0 HA VAL A 151 9.684 -4.548 7.892 1.00 0.17 H new ATOM 0 HB VAL A 151 9.866 -1.723 6.776 1.00 0.21 H new ATOM 0 HG11 VAL A 151 12.037 -1.670 7.940 1.00 0.27 H new ATOM 0 HG12 VAL A 151 10.684 -1.942 9.065 1.00 0.27 H new ATOM 0 HG13 VAL A 151 11.726 -3.302 8.580 1.00 0.27 H new ATOM 0 HG21 VAL A 151 11.913 -2.468 5.622 1.00 0.23 H new ATOM 0 HG22 VAL A 151 11.593 -4.138 6.148 1.00 0.23 H new ATOM 0 HG23 VAL A 151 10.469 -3.324 5.034 1.00 0.23 H new ATOM 2225 N GLU A 152 7.257 -2.348 8.030 1.00 0.17 N ATOM 2226 CA GLU A 152 6.332 -1.623 8.902 1.00 0.18 C ATOM 2227 C GLU A 152 4.951 -1.505 8.259 1.00 0.16 C ATOM 2228 O GLU A 152 4.793 -1.742 7.065 1.00 0.17 O ATOM 2229 CB GLU A 152 6.860 -0.217 9.217 1.00 0.26 C ATOM 2230 CG GLU A 152 7.912 -0.175 10.313 1.00 0.48 C ATOM 2231 CD GLU A 152 7.403 -0.738 11.624 1.00 0.66 C ATOM 2232 OE1 GLU A 152 6.323 -0.307 12.079 1.00 1.22 O ATOM 2233 OE2 GLU A 152 8.082 -1.608 12.208 1.00 1.05 O ATOM 0 H GLU A 152 7.010 -2.314 7.041 1.00 0.17 H new ATOM 0 HA GLU A 152 6.249 -2.192 9.828 1.00 0.18 H new ATOM 0 HB2 GLU A 152 7.282 0.212 8.308 1.00 0.26 H new ATOM 0 HB3 GLU A 152 6.022 0.416 9.509 1.00 0.26 H new ATOM 0 HG2 GLU A 152 8.788 -0.740 9.994 1.00 0.48 H new ATOM 0 HG3 GLU A 152 8.235 0.855 10.464 1.00 0.48 H new ATOM 2240 N ARG A 153 3.958 -1.168 9.070 1.00 0.20 N ATOM 2241 CA ARG A 153 2.615 -0.873 8.596 1.00 0.22 C ATOM 2242 C ARG A 153 2.169 0.490 9.138 1.00 0.22 C ATOM 2243 O ARG A 153 1.808 0.608 10.307 1.00 0.29 O ATOM 2244 CB ARG A 153 1.647 -1.969 9.064 1.00 0.28 C ATOM 2245 CG ARG A 153 0.218 -1.784 8.575 1.00 0.32 C ATOM 2246 CD ARG A 153 -0.754 -2.690 9.321 1.00 0.47 C ATOM 2247 NE ARG A 153 -0.504 -4.113 9.090 1.00 0.73 N ATOM 2248 CZ ARG A 153 -1.460 -5.040 9.107 1.00 1.34 C ATOM 2249 NH1 ARG A 153 -2.723 -4.688 9.325 1.00 1.72 N ATOM 2250 NH2 ARG A 153 -1.155 -6.317 8.915 1.00 1.75 N ATOM 0 H ARG A 153 4.063 -1.091 10.082 1.00 0.20 H new ATOM 0 HA ARG A 153 2.613 -0.842 7.506 1.00 0.22 H new ATOM 0 HB2 ARG A 153 2.015 -2.936 8.720 1.00 0.28 H new ATOM 0 HB3 ARG A 153 1.646 -1.997 10.154 1.00 0.28 H new ATOM 0 HG2 ARG A 153 -0.080 -0.744 8.706 1.00 0.32 H new ATOM 0 HG3 ARG A 153 0.168 -1.997 7.507 1.00 0.32 H new ATOM 0 HD2 ARG A 153 -0.687 -2.484 10.389 1.00 0.47 H new ATOM 0 HD3 ARG A 153 -1.772 -2.452 9.014 1.00 0.47 H new ATOM 0 HE ARG A 153 0.454 -4.411 8.906 1.00 0.73 H new ATOM 0 HH11 ARG A 153 -2.960 -3.708 9.479 1.00 1.72 H new ATOM 0 HH12 ARG A 153 -3.455 -5.398 9.338 1.00 1.72 H new ATOM 0 HH21 ARG A 153 -0.186 -6.591 8.754 1.00 1.75 H new ATOM 0 HH22 ARG A 153 -1.890 -7.024 8.929 1.00 1.75 H new ATOM 2264 N PHE A 154 2.222 1.512 8.293 1.00 0.21 N ATOM 2265 CA PHE A 154 1.789 2.861 8.670 1.00 0.22 C ATOM 2266 C PHE A 154 0.372 3.091 8.159 1.00 0.26 C ATOM 2267 O PHE A 154 0.165 3.089 6.956 1.00 0.38 O ATOM 2268 CB PHE A 154 2.682 3.939 8.033 1.00 0.24 C ATOM 2269 CG PHE A 154 4.160 3.827 8.288 1.00 0.20 C ATOM 2270 CD1 PHE A 154 4.931 2.910 7.591 1.00 0.24 C ATOM 2271 CD2 PHE A 154 4.767 4.599 9.264 1.00 0.20 C ATOM 2272 CE1 PHE A 154 6.280 2.769 7.861 1.00 0.25 C ATOM 2273 CE2 PHE A 154 6.115 4.468 9.532 1.00 0.22 C ATOM 2274 CZ PHE A 154 6.906 3.688 8.689 1.00 0.23 C ATOM 0 H PHE A 154 2.562 1.436 7.334 1.00 0.21 H new ATOM 0 HA PHE A 154 1.847 2.935 9.756 1.00 0.22 H new ATOM 0 HB2 PHE A 154 2.520 3.922 6.955 1.00 0.24 H new ATOM 0 HB3 PHE A 154 2.348 4.913 8.390 1.00 0.24 H new ATOM 0 HD1 PHE A 154 4.473 2.298 6.828 1.00 0.24 H new ATOM 0 HD2 PHE A 154 4.179 5.312 9.822 1.00 0.20 H new ATOM 0 HE1 PHE A 154 6.840 1.952 7.431 1.00 0.25 H new ATOM 0 HE2 PHE A 154 6.552 4.964 10.386 1.00 0.22 H new ATOM 0 HZ PHE A 154 7.980 3.797 8.681 1.00 0.23 H new ATOM 2284 N SER A 155 -0.597 3.306 9.039 1.00 0.26 N ATOM 2285 CA SER A 155 -1.963 3.537 8.591 1.00 0.28 C ATOM 2286 C SER A 155 -2.071 4.916 7.897 1.00 0.29 C ATOM 2287 O SER A 155 -1.078 5.641 7.833 1.00 0.34 O ATOM 2288 CB SER A 155 -2.922 3.400 9.779 1.00 0.37 C ATOM 2289 OG SER A 155 -2.847 4.517 10.649 1.00 0.99 O ATOM 0 H SER A 155 -0.466 3.325 10.050 1.00 0.26 H new ATOM 0 HA SER A 155 -2.246 2.788 7.852 1.00 0.28 H new ATOM 0 HB2 SER A 155 -3.943 3.294 9.412 1.00 0.37 H new ATOM 0 HB3 SER A 155 -2.686 2.491 10.333 1.00 0.37 H new ATOM 0 HG SER A 155 -3.473 4.395 11.393 1.00 0.99 H new ATOM 2295 N PRO A 156 -3.248 5.327 7.367 1.00 0.33 N ATOM 2296 CA PRO A 156 -3.360 6.586 6.610 1.00 0.42 C ATOM 2297 C PRO A 156 -3.166 7.788 7.516 1.00 0.47 C ATOM 2298 O PRO A 156 -2.933 8.906 7.067 1.00 0.66 O ATOM 2299 CB PRO A 156 -4.790 6.543 6.074 1.00 0.48 C ATOM 2300 CG PRO A 156 -5.521 5.730 7.074 1.00 0.48 C ATOM 2301 CD PRO A 156 -4.557 4.665 7.503 1.00 0.34 C ATOM 0 HA PRO A 156 -2.607 6.679 5.828 1.00 0.42 H new ATOM 0 HB2 PRO A 156 -5.214 7.543 5.986 1.00 0.48 H new ATOM 0 HB3 PRO A 156 -4.832 6.090 5.083 1.00 0.48 H new ATOM 0 HG2 PRO A 156 -5.836 6.339 7.921 1.00 0.48 H new ATOM 0 HG3 PRO A 156 -6.422 5.294 6.643 1.00 0.48 H new ATOM 0 HD2 PRO A 156 -4.742 4.343 8.528 1.00 0.34 H new ATOM 0 HD3 PRO A 156 -4.628 3.779 6.873 1.00 0.34 H new ATOM 2309 N GLY A 157 -3.249 7.510 8.802 1.00 0.40 N ATOM 2310 CA GLY A 157 -3.096 8.525 9.821 1.00 0.48 C ATOM 2311 C GLY A 157 -1.639 8.795 10.141 1.00 0.42 C ATOM 2312 O GLY A 157 -1.319 9.421 11.154 1.00 0.52 O ATOM 0 H GLY A 157 -3.424 6.574 9.168 1.00 0.40 H new ATOM 0 HA2 GLY A 157 -3.571 9.448 9.487 1.00 0.48 H new ATOM 0 HA3 GLY A 157 -3.614 8.210 10.727 1.00 0.48 H new ATOM 2316 N ALA A 158 -0.758 8.305 9.281 1.00 0.37 N ATOM 2317 CA ALA A 158 0.671 8.529 9.430 1.00 0.33 C ATOM 2318 C ALA A 158 1.117 9.718 8.592 1.00 0.30 C ATOM 2319 O ALA A 158 0.760 9.835 7.418 1.00 0.43 O ATOM 2320 CB ALA A 158 1.453 7.287 9.029 1.00 0.40 C ATOM 0 H ALA A 158 -1.011 7.745 8.467 1.00 0.37 H new ATOM 0 HA ALA A 158 0.872 8.745 10.479 1.00 0.33 H new ATOM 0 HB1 ALA A 158 2.520 7.475 9.148 1.00 0.40 H new ATOM 0 HB2 ALA A 158 1.159 6.451 9.664 1.00 0.40 H new ATOM 0 HB3 ALA A 158 1.241 7.044 7.988 1.00 0.40 H new ATOM 2326 N SER A 159 1.882 10.606 9.203 1.00 0.28 N ATOM 2327 CA SER A 159 2.412 11.760 8.503 1.00 0.36 C ATOM 2328 C SER A 159 3.679 11.393 7.736 1.00 0.28 C ATOM 2329 O SER A 159 4.286 10.350 7.996 1.00 0.25 O ATOM 2330 CB SER A 159 2.701 12.889 9.488 1.00 0.50 C ATOM 2331 OG SER A 159 1.542 13.227 10.235 1.00 1.25 O ATOM 0 H SER A 159 2.150 10.548 10.186 1.00 0.28 H new ATOM 0 HA SER A 159 1.663 12.099 7.787 1.00 0.36 H new ATOM 0 HB2 SER A 159 3.499 12.588 10.166 1.00 0.50 H new ATOM 0 HB3 SER A 159 3.057 13.766 8.947 1.00 0.50 H new ATOM 0 HG SER A 159 1.755 13.951 10.860 1.00 1.25 H new ATOM 2337 N VAL A 160 4.072 12.255 6.806 1.00 0.29 N ATOM 2338 CA VAL A 160 5.216 12.000 5.933 1.00 0.28 C ATOM 2339 C VAL A 160 6.468 11.629 6.731 1.00 0.26 C ATOM 2340 O VAL A 160 7.060 10.566 6.517 1.00 0.25 O ATOM 2341 CB VAL A 160 5.524 13.227 5.044 1.00 0.34 C ATOM 2342 CG1 VAL A 160 6.612 12.909 4.031 1.00 0.41 C ATOM 2343 CG2 VAL A 160 4.266 13.710 4.338 1.00 0.38 C ATOM 0 H VAL A 160 3.610 13.148 6.634 1.00 0.29 H new ATOM 0 HA VAL A 160 4.943 11.156 5.300 1.00 0.28 H new ATOM 0 HB VAL A 160 5.886 14.026 5.691 1.00 0.34 H new ATOM 0 HG11 VAL A 160 6.808 13.790 3.419 1.00 0.41 H new ATOM 0 HG12 VAL A 160 7.523 12.620 4.555 1.00 0.41 H new ATOM 0 HG13 VAL A 160 6.285 12.089 3.392 1.00 0.41 H new ATOM 0 HG21 VAL A 160 4.506 14.574 3.718 1.00 0.38 H new ATOM 0 HG22 VAL A 160 3.872 12.911 3.710 1.00 0.38 H new ATOM 0 HG23 VAL A 160 3.518 13.992 5.079 1.00 0.38 H new ATOM 2353 N LYS A 161 6.837 12.478 7.684 1.00 0.29 N ATOM 2354 CA LYS A 161 8.079 12.301 8.430 1.00 0.33 C ATOM 2355 C LYS A 161 7.986 11.093 9.353 1.00 0.29 C ATOM 2356 O LYS A 161 8.998 10.476 9.700 1.00 0.29 O ATOM 2357 CB LYS A 161 8.410 13.551 9.246 1.00 0.44 C ATOM 2358 CG LYS A 161 9.902 13.777 9.409 1.00 1.11 C ATOM 2359 CD LYS A 161 10.529 14.083 8.065 1.00 1.81 C ATOM 2360 CE LYS A 161 12.045 14.050 8.105 1.00 2.69 C ATOM 2361 NZ LYS A 161 12.618 14.337 6.765 1.00 3.44 N ATOM 0 H LYS A 161 6.294 13.296 7.959 1.00 0.29 H new ATOM 0 HA LYS A 161 8.878 12.134 7.708 1.00 0.33 H new ATOM 0 HB2 LYS A 161 7.967 14.422 8.762 1.00 0.44 H new ATOM 0 HB3 LYS A 161 7.951 13.467 10.231 1.00 0.44 H new ATOM 0 HG2 LYS A 161 10.080 14.602 10.099 1.00 1.11 H new ATOM 0 HG3 LYS A 161 10.367 12.892 9.843 1.00 1.11 H new ATOM 0 HD2 LYS A 161 10.173 13.361 7.330 1.00 1.81 H new ATOM 0 HD3 LYS A 161 10.200 15.067 7.731 1.00 1.81 H new ATOM 0 HE2 LYS A 161 12.410 14.783 8.825 1.00 2.69 H new ATOM 0 HE3 LYS A 161 12.382 13.072 8.447 1.00 2.69 H new ATOM 0 HZ1 LYS A 161 13.629 14.560 6.860 1.00 3.44 H new ATOM 0 HZ2 LYS A 161 12.503 13.504 6.153 1.00 3.44 H new ATOM 0 HZ3 LYS A 161 12.123 15.148 6.342 1.00 3.44 H new ATOM 2375 N ASP A 162 6.761 10.762 9.746 1.00 0.28 N ATOM 2376 CA ASP A 162 6.511 9.605 10.591 1.00 0.28 C ATOM 2377 C ASP A 162 6.824 8.328 9.833 1.00 0.22 C ATOM 2378 O ASP A 162 7.189 7.317 10.424 1.00 0.23 O ATOM 2379 CB ASP A 162 5.069 9.590 11.105 1.00 0.34 C ATOM 2380 CG ASP A 162 4.828 10.652 12.159 1.00 1.02 C ATOM 2381 OD1 ASP A 162 5.320 10.494 13.296 1.00 1.30 O ATOM 2382 OD2 ASP A 162 4.156 11.657 11.855 1.00 1.86 O ATOM 0 H ASP A 162 5.923 11.283 9.490 1.00 0.28 H new ATOM 0 HA ASP A 162 7.168 9.670 11.459 1.00 0.28 H new ATOM 0 HB2 ASP A 162 4.386 9.747 10.270 1.00 0.34 H new ATOM 0 HB3 ASP A 162 4.843 8.608 11.522 1.00 0.34 H new ATOM 2387 N ILE A 163 6.658 8.368 8.522 1.00 0.19 N ATOM 2388 CA ILE A 163 7.042 7.247 7.682 1.00 0.17 C ATOM 2389 C ILE A 163 8.536 7.297 7.372 1.00 0.17 C ATOM 2390 O ILE A 163 9.220 6.272 7.402 1.00 0.18 O ATOM 2391 CB ILE A 163 6.231 7.209 6.367 1.00 0.17 C ATOM 2392 CG1 ILE A 163 4.738 7.091 6.687 1.00 0.18 C ATOM 2393 CG2 ILE A 163 6.686 6.043 5.501 1.00 0.20 C ATOM 2394 CD1 ILE A 163 3.846 7.052 5.467 1.00 0.21 C ATOM 0 H ILE A 163 6.262 9.161 8.018 1.00 0.19 H new ATOM 0 HA ILE A 163 6.821 6.336 8.238 1.00 0.17 H new ATOM 0 HB ILE A 163 6.402 8.132 5.813 1.00 0.17 H new ATOM 0 HG12 ILE A 163 4.573 6.187 7.273 1.00 0.18 H new ATOM 0 HG13 ILE A 163 4.444 7.934 7.312 1.00 0.18 H new ATOM 0 HG21 ILE A 163 6.107 6.028 4.578 1.00 0.20 H new ATOM 0 HG22 ILE A 163 7.744 6.157 5.264 1.00 0.20 H new ATOM 0 HG23 ILE A 163 6.534 5.108 6.040 1.00 0.20 H new ATOM 0 HD11 ILE A 163 2.805 6.968 5.780 1.00 0.21 H new ATOM 0 HD12 ILE A 163 3.979 7.967 4.890 1.00 0.21 H new ATOM 0 HD13 ILE A 163 4.110 6.193 4.850 1.00 0.21 H new ATOM 2406 N GLU A 164 9.040 8.501 7.105 1.00 0.19 N ATOM 2407 CA GLU A 164 10.439 8.693 6.728 1.00 0.22 C ATOM 2408 C GLU A 164 11.410 8.128 7.757 1.00 0.23 C ATOM 2409 O GLU A 164 12.462 7.608 7.392 1.00 0.24 O ATOM 2410 CB GLU A 164 10.747 10.174 6.522 1.00 0.27 C ATOM 2411 CG GLU A 164 10.073 10.790 5.313 1.00 0.33 C ATOM 2412 CD GLU A 164 10.373 12.267 5.195 1.00 0.44 C ATOM 2413 OE1 GLU A 164 11.541 12.626 4.958 1.00 0.73 O ATOM 2414 OE2 GLU A 164 9.436 13.081 5.323 1.00 0.88 O ATOM 0 H GLU A 164 8.496 9.363 7.143 1.00 0.19 H new ATOM 0 HA GLU A 164 10.577 8.146 5.795 1.00 0.22 H new ATOM 0 HB2 GLU A 164 10.442 10.724 7.412 1.00 0.27 H new ATOM 0 HB3 GLU A 164 11.825 10.298 6.425 1.00 0.27 H new ATOM 0 HG2 GLU A 164 10.407 10.278 4.410 1.00 0.33 H new ATOM 0 HG3 GLU A 164 8.995 10.642 5.383 1.00 0.33 H new ATOM 2421 N GLU A 165 11.063 8.219 9.034 1.00 0.24 N ATOM 2422 CA GLU A 165 11.947 7.747 10.101 1.00 0.27 C ATOM 2423 C GLU A 165 12.280 6.266 9.928 1.00 0.27 C ATOM 2424 O GLU A 165 13.330 5.799 10.371 1.00 0.35 O ATOM 2425 CB GLU A 165 11.313 7.986 11.470 1.00 0.33 C ATOM 2426 CG GLU A 165 9.906 7.439 11.590 1.00 0.41 C ATOM 2427 CD GLU A 165 9.328 7.606 12.975 1.00 0.58 C ATOM 2428 OE1 GLU A 165 9.288 8.747 13.472 1.00 0.75 O ATOM 2429 OE2 GLU A 165 8.909 6.593 13.569 1.00 0.71 O ATOM 0 H GLU A 165 10.180 8.613 9.359 1.00 0.24 H new ATOM 0 HA GLU A 165 12.875 8.315 10.038 1.00 0.27 H new ATOM 0 HB2 GLU A 165 11.939 7.528 12.236 1.00 0.33 H new ATOM 0 HB3 GLU A 165 11.296 9.057 11.671 1.00 0.33 H new ATOM 0 HG2 GLU A 165 9.262 7.944 10.870 1.00 0.41 H new ATOM 0 HG3 GLU A 165 9.909 6.381 11.328 1.00 0.41 H new ATOM 2436 N LYS A 166 11.389 5.536 9.275 1.00 0.22 N ATOM 2437 CA LYS A 166 11.608 4.125 9.012 1.00 0.23 C ATOM 2438 C LYS A 166 11.975 3.909 7.544 1.00 0.20 C ATOM 2439 O LYS A 166 12.471 2.851 7.164 1.00 0.25 O ATOM 2440 CB LYS A 166 10.345 3.326 9.349 1.00 0.27 C ATOM 2441 CG LYS A 166 9.882 3.453 10.795 1.00 0.46 C ATOM 2442 CD LYS A 166 10.887 2.856 11.767 1.00 0.77 C ATOM 2443 CE LYS A 166 10.301 2.731 13.164 1.00 1.05 C ATOM 2444 NZ LYS A 166 9.935 4.047 13.748 1.00 1.58 N ATOM 0 H LYS A 166 10.506 5.900 8.917 1.00 0.22 H new ATOM 0 HA LYS A 166 12.431 3.779 9.638 1.00 0.23 H new ATOM 0 HB2 LYS A 166 9.538 3.653 8.693 1.00 0.27 H new ATOM 0 HB3 LYS A 166 10.527 2.274 9.131 1.00 0.27 H new ATOM 0 HG2 LYS A 166 9.726 4.505 11.035 1.00 0.46 H new ATOM 0 HG3 LYS A 166 8.921 2.953 10.914 1.00 0.46 H new ATOM 0 HD2 LYS A 166 11.199 1.874 11.412 1.00 0.77 H new ATOM 0 HD3 LYS A 166 11.779 3.481 11.800 1.00 0.77 H new ATOM 0 HE2 LYS A 166 9.417 2.095 13.128 1.00 1.05 H new ATOM 0 HE3 LYS A 166 11.023 2.237 13.814 1.00 1.05 H new ATOM 0 HZ1 LYS A 166 9.479 3.902 14.671 1.00 1.58 H new ATOM 0 HZ2 LYS A 166 10.792 4.622 13.872 1.00 1.58 H new ATOM 0 HZ3 LYS A 166 9.277 4.539 13.110 1.00 1.58 H new ATOM 2458 N LEU A 167 11.748 4.937 6.737 1.00 0.18 N ATOM 2459 CA LEU A 167 11.866 4.830 5.290 1.00 0.18 C ATOM 2460 C LEU A 167 13.239 5.276 4.790 1.00 0.18 C ATOM 2461 O LEU A 167 13.814 4.637 3.912 1.00 0.19 O ATOM 2462 CB LEU A 167 10.773 5.677 4.631 1.00 0.19 C ATOM 2463 CG LEU A 167 10.798 5.718 3.103 1.00 0.20 C ATOM 2464 CD1 LEU A 167 10.595 4.327 2.526 1.00 0.23 C ATOM 2465 CD2 LEU A 167 9.741 6.677 2.580 1.00 0.24 C ATOM 0 H LEU A 167 11.478 5.864 7.066 1.00 0.18 H new ATOM 0 HA LEU A 167 11.747 3.781 5.020 1.00 0.18 H new ATOM 0 HB2 LEU A 167 9.802 5.297 4.950 1.00 0.19 H new ATOM 0 HB3 LEU A 167 10.855 6.698 5.005 1.00 0.19 H new ATOM 0 HG LEU A 167 11.776 6.078 2.784 1.00 0.20 H new ATOM 0 HD11 LEU A 167 10.616 4.378 1.437 1.00 0.23 H new ATOM 0 HD12 LEU A 167 11.391 3.669 2.874 1.00 0.23 H new ATOM 0 HD13 LEU A 167 9.632 3.935 2.852 1.00 0.23 H new ATOM 0 HD21 LEU A 167 9.772 6.694 1.491 1.00 0.24 H new ATOM 0 HD22 LEU A 167 8.756 6.347 2.909 1.00 0.24 H new ATOM 0 HD23 LEU A 167 9.936 7.678 2.964 1.00 0.24 H new ATOM 2477 N ILE A 168 13.757 6.364 5.354 1.00 0.21 N ATOM 2478 CA ILE A 168 15.005 6.971 4.882 1.00 0.25 C ATOM 2479 C ILE A 168 16.153 5.961 4.772 1.00 0.26 C ATOM 2480 O ILE A 168 16.765 5.847 3.707 1.00 0.28 O ATOM 2481 CB ILE A 168 15.428 8.174 5.759 1.00 0.32 C ATOM 2482 CG1 ILE A 168 14.405 9.305 5.607 1.00 0.35 C ATOM 2483 CG2 ILE A 168 16.822 8.659 5.375 1.00 0.39 C ATOM 2484 CD1 ILE A 168 14.687 10.513 6.475 1.00 0.44 C ATOM 0 H ILE A 168 13.331 6.848 6.144 1.00 0.21 H new ATOM 0 HA ILE A 168 14.795 7.335 3.876 1.00 0.25 H new ATOM 0 HB ILE A 168 15.458 7.857 6.802 1.00 0.32 H new ATOM 0 HG12 ILE A 168 14.378 9.619 4.563 1.00 0.35 H new ATOM 0 HG13 ILE A 168 13.415 8.920 5.849 1.00 0.35 H new ATOM 0 HG21 ILE A 168 17.099 9.505 6.004 1.00 0.39 H new ATOM 0 HG22 ILE A 168 17.540 7.851 5.516 1.00 0.39 H new ATOM 0 HG23 ILE A 168 16.825 8.968 4.330 1.00 0.39 H new ATOM 0 HD11 ILE A 168 13.918 11.268 6.309 1.00 0.44 H new ATOM 0 HD12 ILE A 168 14.684 10.216 7.524 1.00 0.44 H new ATOM 0 HD13 ILE A 168 15.662 10.926 6.218 1.00 0.44 H new ATOM 2496 N PRO A 169 16.462 5.201 5.845 1.00 0.29 N ATOM 2497 CA PRO A 169 17.523 4.186 5.799 1.00 0.34 C ATOM 2498 C PRO A 169 17.296 3.150 4.698 1.00 0.35 C ATOM 2499 O PRO A 169 18.250 2.610 4.135 1.00 0.48 O ATOM 2500 CB PRO A 169 17.449 3.522 7.176 1.00 0.39 C ATOM 2501 CG PRO A 169 16.811 4.538 8.056 1.00 0.49 C ATOM 2502 CD PRO A 169 15.842 5.282 7.184 1.00 0.31 C ATOM 0 HA PRO A 169 18.493 4.630 5.576 1.00 0.34 H new ATOM 0 HB2 PRO A 169 16.862 2.604 7.141 1.00 0.39 H new ATOM 0 HB3 PRO A 169 18.441 3.252 7.538 1.00 0.39 H new ATOM 0 HG2 PRO A 169 16.299 4.064 8.894 1.00 0.49 H new ATOM 0 HG3 PRO A 169 17.556 5.213 8.478 1.00 0.49 H new ATOM 0 HD2 PRO A 169 14.853 4.823 7.198 1.00 0.31 H new ATOM 0 HD3 PRO A 169 15.719 6.315 7.509 1.00 0.31 H new ATOM 2510 N LEU A 170 16.032 2.889 4.377 1.00 0.27 N ATOM 2511 CA LEU A 170 15.687 1.883 3.381 1.00 0.29 C ATOM 2512 C LEU A 170 15.821 2.439 1.969 1.00 0.29 C ATOM 2513 O LEU A 170 16.147 1.698 1.037 1.00 0.37 O ATOM 2514 CB LEU A 170 14.265 1.364 3.602 1.00 0.29 C ATOM 2515 CG LEU A 170 13.995 0.749 4.976 1.00 0.38 C ATOM 2516 CD1 LEU A 170 12.598 0.158 5.017 1.00 0.60 C ATOM 2517 CD2 LEU A 170 15.032 -0.311 5.313 1.00 0.71 C ATOM 0 H LEU A 170 15.230 3.362 4.794 1.00 0.27 H new ATOM 0 HA LEU A 170 16.386 1.055 3.495 1.00 0.29 H new ATOM 0 HB2 LEU A 170 13.568 2.188 3.449 1.00 0.29 H new ATOM 0 HB3 LEU A 170 14.047 0.616 2.839 1.00 0.29 H new ATOM 0 HG LEU A 170 14.067 1.538 5.725 1.00 0.38 H new ATOM 0 HD11 LEU A 170 12.416 -0.277 6.000 1.00 0.60 H new ATOM 0 HD12 LEU A 170 11.865 0.942 4.826 1.00 0.60 H new ATOM 0 HD13 LEU A 170 12.508 -0.616 4.255 1.00 0.60 H new ATOM 0 HD21 LEU A 170 14.816 -0.732 6.295 1.00 0.71 H new ATOM 0 HD22 LEU A 170 15.000 -1.102 4.564 1.00 0.71 H new ATOM 0 HD23 LEU A 170 16.024 0.140 5.322 1.00 0.71 H new ATOM 2529 N LEU A 171 15.552 3.735 1.810 1.00 0.25 N ATOM 2530 CA LEU A 171 15.733 4.407 0.519 1.00 0.28 C ATOM 2531 C LEU A 171 17.175 4.269 0.087 1.00 0.34 C ATOM 2532 O LEU A 171 17.468 3.874 -1.043 1.00 0.46 O ATOM 2533 CB LEU A 171 15.368 5.886 0.620 1.00 0.29 C ATOM 2534 CG LEU A 171 14.028 6.156 1.276 1.00 0.30 C ATOM 2535 CD1 LEU A 171 13.925 7.607 1.698 1.00 0.45 C ATOM 2536 CD2 LEU A 171 12.894 5.801 0.329 1.00 0.40 C ATOM 0 H LEU A 171 15.209 4.341 2.556 1.00 0.25 H new ATOM 0 HA LEU A 171 15.076 3.941 -0.215 1.00 0.28 H new ATOM 0 HB2 LEU A 171 16.145 6.402 1.183 1.00 0.29 H new ATOM 0 HB3 LEU A 171 15.362 6.316 -0.382 1.00 0.29 H new ATOM 0 HG LEU A 171 13.949 5.531 2.165 1.00 0.30 H new ATOM 0 HD11 LEU A 171 12.957 7.782 2.167 1.00 0.45 H new ATOM 0 HD12 LEU A 171 14.719 7.836 2.409 1.00 0.45 H new ATOM 0 HD13 LEU A 171 14.025 8.249 0.823 1.00 0.45 H new ATOM 0 HD21 LEU A 171 11.939 6.000 0.814 1.00 0.40 H new ATOM 0 HD22 LEU A 171 12.974 6.403 -0.576 1.00 0.40 H new ATOM 0 HD23 LEU A 171 12.955 4.744 0.068 1.00 0.40 H new ATOM 2548 N GLY A 172 18.058 4.621 1.008 1.00 0.32 N ATOM 2549 CA GLY A 172 19.470 4.348 0.845 1.00 0.44 C ATOM 2550 C GLY A 172 19.740 2.895 0.473 1.00 0.71 C ATOM 2551 O GLY A 172 20.358 2.625 -0.557 1.00 1.52 O ATOM 0 H GLY A 172 17.817 5.097 1.877 1.00 0.32 H new ATOM 0 HA2 GLY A 172 19.877 5.000 0.072 1.00 0.44 H new ATOM 0 HA3 GLY A 172 19.993 4.587 1.771 1.00 0.44 H new ATOM 2555 N SER A 173 19.278 1.968 1.316 1.00 0.74 N ATOM 2556 CA SER A 173 19.356 0.531 1.036 1.00 0.92 C ATOM 2557 C SER A 173 18.787 -0.253 2.214 1.00 1.29 C ATOM 2558 O SER A 173 19.041 0.080 3.365 1.00 1.88 O ATOM 2559 CB SER A 173 20.805 0.092 0.774 1.00 1.67 C ATOM 2560 OG SER A 173 20.864 -1.264 0.349 1.00 2.52 O ATOM 0 H SER A 173 18.840 2.191 2.210 1.00 0.74 H new ATOM 0 HA SER A 173 18.771 0.327 0.139 1.00 0.92 H new ATOM 0 HB2 SER A 173 21.250 0.734 0.014 1.00 1.67 H new ATOM 0 HB3 SER A 173 21.395 0.217 1.682 1.00 1.67 H new ATOM 0 HG SER A 173 20.499 -1.339 -0.557 1.00 2.52 H new ATOM 2566 N ALA A 174 17.999 -1.285 1.930 1.00 1.48 N ATOM 2567 CA ALA A 174 17.430 -2.104 2.988 1.00 2.35 C ATOM 2568 C ALA A 174 18.326 -3.300 3.255 1.00 2.81 C ATOM 2569 O ALA A 174 18.473 -3.750 4.388 1.00 3.56 O ATOM 2570 CB ALA A 174 16.035 -2.555 2.603 1.00 2.70 C ATOM 0 H ALA A 174 17.743 -1.570 0.985 1.00 1.48 H new ATOM 0 HA ALA A 174 17.361 -1.513 3.901 1.00 2.35 H new ATOM 0 HB1 ALA A 174 15.617 -3.168 3.402 1.00 2.70 H new ATOM 0 HB2 ALA A 174 15.401 -1.682 2.446 1.00 2.70 H new ATOM 0 HB3 ALA A 174 16.082 -3.140 1.684 1.00 2.70 H new ATOM 2576 N ARG A 175 18.935 -3.783 2.186 1.00 2.66 N ATOM 2577 CA ARG A 175 19.823 -4.934 2.232 1.00 3.43 C ATOM 2578 C ARG A 175 20.556 -5.019 0.902 1.00 3.24 C ATOM 2579 O ARG A 175 21.729 -5.391 0.836 1.00 3.70 O ATOM 2580 CB ARG A 175 19.038 -6.226 2.518 1.00 4.20 C ATOM 2581 CG ARG A 175 18.035 -6.611 1.439 1.00 4.72 C ATOM 2582 CD ARG A 175 17.138 -7.757 1.885 1.00 5.65 C ATOM 2583 NE ARG A 175 17.891 -8.949 2.270 1.00 6.25 N ATOM 2584 CZ ARG A 175 17.455 -10.195 2.080 1.00 7.11 C ATOM 2585 NH1 ARG A 175 16.286 -10.411 1.488 1.00 7.46 N ATOM 2586 NH2 ARG A 175 18.187 -11.228 2.478 1.00 7.86 N ATOM 0 H ARG A 175 18.827 -3.385 1.253 1.00 2.66 H new ATOM 0 HA ARG A 175 20.542 -4.817 3.043 1.00 3.43 H new ATOM 0 HB2 ARG A 175 19.746 -7.045 2.646 1.00 4.20 H new ATOM 0 HB3 ARG A 175 18.508 -6.112 3.464 1.00 4.20 H new ATOM 0 HG2 ARG A 175 17.422 -5.746 1.187 1.00 4.72 H new ATOM 0 HG3 ARG A 175 18.568 -6.898 0.533 1.00 4.72 H new ATOM 0 HD2 ARG A 175 16.530 -7.429 2.728 1.00 5.65 H new ATOM 0 HD3 ARG A 175 16.452 -8.011 1.077 1.00 5.65 H new ATOM 0 HE ARG A 175 18.803 -8.821 2.709 1.00 6.25 H new ATOM 0 HH11 ARG A 175 15.718 -9.623 1.177 1.00 7.46 H new ATOM 0 HH12 ARG A 175 15.956 -11.365 1.344 1.00 7.46 H new ATOM 0 HH21 ARG A 175 19.087 -11.071 2.931 1.00 7.86 H new ATOM 0 HH22 ARG A 175 17.849 -12.179 2.331 1.00 7.86 H new ATOM 2600 N LEU A 176 19.839 -4.645 -0.150 1.00 2.91 N ATOM 2601 CA LEU A 176 20.403 -4.504 -1.480 1.00 3.12 C ATOM 2602 C LEU A 176 19.628 -3.427 -2.231 1.00 3.20 C ATOM 2603 O LEU A 176 18.608 -3.762 -2.867 1.00 3.57 O ATOM 2604 CB LEU A 176 20.348 -5.837 -2.234 1.00 3.58 C ATOM 2605 CG LEU A 176 20.996 -5.832 -3.623 1.00 4.24 C ATOM 2606 CD1 LEU A 176 22.480 -5.513 -3.524 1.00 4.78 C ATOM 2607 CD2 LEU A 176 20.781 -7.169 -4.313 1.00 4.81 C ATOM 2608 OXT LEU A 176 20.008 -2.243 -2.123 1.00 3.47 O ATOM 0 H LEU A 176 18.843 -4.430 -0.101 1.00 2.91 H new ATOM 0 HA LEU A 176 21.450 -4.211 -1.403 1.00 3.12 H new ATOM 0 HB2 LEU A 176 20.836 -6.599 -1.627 1.00 3.58 H new ATOM 0 HB3 LEU A 176 19.304 -6.133 -2.339 1.00 3.58 H new ATOM 0 HG LEU A 176 20.521 -5.054 -4.221 1.00 4.24 H new ATOM 0 HD11 LEU A 176 22.920 -5.515 -4.521 1.00 4.78 H new ATOM 0 HD12 LEU A 176 22.611 -4.530 -3.071 1.00 4.78 H new ATOM 0 HD13 LEU A 176 22.974 -6.265 -2.908 1.00 4.78 H new ATOM 0 HD21 LEU A 176 21.247 -7.149 -5.298 1.00 4.81 H new ATOM 0 HD22 LEU A 176 21.229 -7.963 -3.716 1.00 4.81 H new ATOM 0 HD23 LEU A 176 19.712 -7.355 -4.421 1.00 4.81 H new TER 2620 LEU A 176