USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1272 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 107 ASN : amide:sc= -11.6! C(o=-13!,f=-4.2!) USER MOD Set 1.2: A 112 THR OG1 : rot 179:sc= -1.32 USER MOD Set 2.1: A 10 ASN : amide:sc= -9.11! K(o=-23!,f=-10) USER MOD Set 2.2: A 48 GLN : amide:sc= -4.5! C(o=-23!,f=-13!) USER MOD Set 2.3: A 50 GLN : amide:sc= -8.81! C(o=-23!,f=-10!) USER MOD Set 2.4: A 53 TYR OH : rot -101:sc= -0.687 USER MOD Set 3.1: A 42 THR OG1 : rot 155:sc= 0.0681 USER MOD Set 3.2: A 55 ASN : amide:sc= -6.6! K(o=-6.5!,f=-1.7) USER MOD Set 4.1: A 40 TYR OH : rot 152:sc= -0.342 USER MOD Set 4.2: A 124 MET CE :methyl -130:sc= 0 (180deg=0) USER MOD Set 5.1: A 17 GLN : amide:sc= -6.48! C(o=-10!,f=-12!) USER MOD Set 5.2: A 80 GLN : amide:sc= -3.65! C(o=-10!,f=-16!) USER MOD Single : A 1 THR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 128:sc= 0.55 USER MOD Single : A 9 SER OG : rot -130:sc= -1.73! USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -4.95! K(o=-5!,f=-1.8) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 178:sc= -1.62 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -2.12! USER MOD Single : A 37 SER OG : rot 180:sc= 0.579 USER MOD Single : A 38 SER OG : rot -60:sc= -1.59! USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.086 USER MOD Single : A 63 SER OG : rot -125:sc= 0.951 USER MOD Single : A 71 ASN : amide:sc= -3.84! K(o=-3.8!,f=-0.75) USER MOD Single : A 72 HIS : no HD1:sc= -2.16 X(o=-2.2,f=-1.9!) USER MOD Single : A 73 THR OG1 : rot -150:sc= -1.01 USER MOD Single : A 74 GLN : amide:sc= -3.56! C(o=-3.6!,f=-4.6!) USER MOD Single : A 79 GLN : amide:sc=-0.000963 X(o=-0.00096,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -29:sc= 0.595 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= -9.18! C(o=-9.2!,f=-7!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0465 USER MOD Single : A 115 HIS : no HD1:sc= -5.15! C(o=-5.2!,f=-5.6!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -111:sc= -5.27! (180deg=-8.67!) USER MOD Single : A 119 LYS NZ :NH3+ 167:sc= -0.049 (180deg=-0.284) USER MOD Single : A 120 ASN : amide:sc= -0.507 K(o=-0.51,f=1) USER MOD Single : A 142 MET CE :methyl -167:sc= -2.38! (180deg=-3.2) USER MOD Single : A 145 GLN : amide:sc= -21.1! C(o=-21!,f=-19!) USER MOD Single : A 148 HIS : no HD1:sc= -1.38 K(o=-1.4,f=-0.18) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -166:sc= -0.0279 (180deg=-0.241) USER MOD Single : A 156 ASN : amide:sc= -0.162 K(o=-0.16,f=-1.2) USER MOD Single : A 157 LYS NZ :NH3+ 148:sc= -2.71! (180deg=-4.03!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 2.633 -9.846 -14.887 1.00 0.82 N ATOM 2 CA THR A 1 2.165 -10.093 -13.499 1.00 0.59 C ATOM 3 C THR A 1 1.880 -8.789 -12.766 1.00 0.52 C ATOM 4 O THR A 1 2.787 -8.173 -12.203 1.00 0.52 O ATOM 5 CB THR A 1 3.242 -10.887 -12.754 1.00 0.64 C ATOM 6 OG1 THR A 1 3.436 -12.154 -13.355 1.00 0.92 O ATOM 7 CG2 THR A 1 2.921 -11.114 -11.290 1.00 0.62 C ATOM 0 H1 THR A 1 2.818 -10.755 -15.358 1.00 0.82 H new ATOM 0 H2 THR A 1 1.902 -9.326 -15.413 1.00 0.82 H new ATOM 0 H3 THR A 1 3.508 -9.284 -14.864 1.00 0.82 H new ATOM 0 HA THR A 1 1.234 -10.658 -13.536 1.00 0.59 H new ATOM 0 HB THR A 1 4.143 -10.277 -12.817 1.00 0.64 H new ATOM 0 HG1 THR A 1 4.129 -12.645 -12.866 1.00 0.92 H new ATOM 0 HG21 THR A 1 3.726 -11.682 -10.825 1.00 0.62 H new ATOM 0 HG22 THR A 1 2.818 -10.153 -10.787 1.00 0.62 H new ATOM 0 HG23 THR A 1 1.988 -11.670 -11.204 1.00 0.62 H new ATOM 17 N VAL A 2 0.617 -8.373 -12.762 1.00 0.54 N ATOM 18 CA VAL A 2 0.234 -7.148 -12.077 1.00 0.54 C ATOM 19 C VAL A 2 0.101 -7.404 -10.581 1.00 0.44 C ATOM 20 O VAL A 2 -0.891 -7.967 -10.116 1.00 0.45 O ATOM 21 CB VAL A 2 -1.090 -6.580 -12.630 1.00 0.65 C ATOM 22 CG1 VAL A 2 -2.186 -7.637 -12.616 1.00 1.49 C ATOM 23 CG2 VAL A 2 -1.515 -5.348 -11.845 1.00 1.42 C ATOM 0 H VAL A 2 -0.151 -8.863 -13.222 1.00 0.54 H new ATOM 0 HA VAL A 2 1.017 -6.411 -12.252 1.00 0.54 H new ATOM 0 HB VAL A 2 -0.925 -6.284 -13.666 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -3.108 -7.210 -13.011 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.884 -8.483 -13.234 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -2.352 -7.976 -11.593 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -2.451 -4.963 -12.251 1.00 1.42 H new ATOM 0 HG22 VAL A 2 -1.656 -5.615 -10.798 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.743 -4.582 -11.923 1.00 1.42 H new ATOM 33 N ALA A 3 1.116 -6.998 -9.829 1.00 0.43 N ATOM 34 CA ALA A 3 1.120 -7.197 -8.387 1.00 0.40 C ATOM 35 C ALA A 3 0.447 -6.039 -7.669 1.00 0.33 C ATOM 36 O ALA A 3 0.558 -4.883 -8.091 1.00 0.37 O ATOM 37 CB ALA A 3 2.542 -7.373 -7.884 1.00 0.48 C ATOM 0 H ALA A 3 1.945 -6.530 -10.194 1.00 0.43 H new ATOM 0 HA ALA A 3 0.552 -8.102 -8.171 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.530 -7.521 -6.804 1.00 0.48 H new ATOM 0 HB2 ALA A 3 2.993 -8.241 -8.364 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.125 -6.483 -8.122 1.00 0.48 H new ATOM 43 N TYR A 4 -0.243 -6.351 -6.575 1.00 0.38 N ATOM 44 CA TYR A 4 -0.917 -5.315 -5.802 1.00 0.48 C ATOM 45 C TYR A 4 -0.129 -4.955 -4.559 1.00 0.46 C ATOM 46 O TYR A 4 0.134 -5.806 -3.702 1.00 0.72 O ATOM 47 CB TYR A 4 -2.328 -5.720 -5.395 1.00 0.79 C ATOM 48 CG TYR A 4 -2.984 -4.669 -4.527 1.00 2.03 C ATOM 49 CD1 TYR A 4 -3.076 -3.351 -4.942 1.00 3.01 C ATOM 50 CD2 TYR A 4 -3.534 -5.008 -3.296 1.00 2.70 C ATOM 51 CE1 TYR A 4 -3.696 -2.396 -4.157 1.00 4.21 C ATOM 52 CE2 TYR A 4 -4.153 -4.059 -2.505 1.00 3.83 C ATOM 53 CZ TYR A 4 -4.147 -2.719 -2.921 1.00 4.50 C ATOM 54 OH TYR A 4 -4.852 -1.812 -2.157 1.00 5.73 O ATOM 0 H TYR A 4 -0.349 -7.297 -6.209 1.00 0.38 H new ATOM 0 HA TYR A 4 -0.983 -4.446 -6.457 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -2.932 -5.883 -6.288 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -2.294 -6.667 -4.856 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -2.656 -3.064 -5.895 1.00 3.01 H new ATOM 0 HD2 TYR A 4 -3.477 -6.030 -2.952 1.00 2.70 H new ATOM 0 HE1 TYR A 4 -3.821 -1.390 -4.530 1.00 4.21 H new ATOM 0 HE2 TYR A 4 -4.634 -4.344 -1.581 1.00 3.83 H new ATOM 0 HH TYR A 4 -5.690 -2.221 -1.854 1.00 5.73 H new ATOM 64 N ILE A 5 0.229 -3.675 -4.479 1.00 0.40 N ATOM 65 CA ILE A 5 0.984 -3.137 -3.359 1.00 0.45 C ATOM 66 C ILE A 5 0.203 -2.022 -2.669 1.00 0.44 C ATOM 67 O ILE A 5 -0.389 -1.169 -3.330 1.00 0.57 O ATOM 68 CB ILE A 5 2.325 -2.554 -3.833 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.914 -3.410 -4.954 1.00 0.52 C ATOM 70 CG2 ILE A 5 3.297 -2.456 -2.668 1.00 0.93 C ATOM 71 CD1 ILE A 5 4.074 -2.747 -5.655 1.00 0.79 C ATOM 0 H ILE A 5 0.001 -2.983 -5.193 1.00 0.40 H new ATOM 0 HA ILE A 5 1.160 -3.958 -2.664 1.00 0.45 H new ATOM 0 HB ILE A 5 2.151 -1.552 -4.224 1.00 0.55 H new ATOM 0 HG12 ILE A 5 3.243 -4.363 -4.541 1.00 0.52 H new ATOM 0 HG13 ILE A 5 2.134 -3.631 -5.683 1.00 0.52 H new ATOM 0 HG21 ILE A 5 4.243 -2.042 -3.017 1.00 0.93 H new ATOM 0 HG22 ILE A 5 2.879 -1.807 -1.899 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.467 -3.449 -2.252 1.00 0.93 H new ATOM 0 HD11 ILE A 5 4.448 -3.404 -6.440 1.00 0.79 H new ATOM 0 HD12 ILE A 5 3.743 -1.807 -6.096 1.00 0.79 H new ATOM 0 HD13 ILE A 5 4.869 -2.551 -4.936 1.00 0.79 H new ATOM 83 N ALA A 6 0.221 -2.025 -1.345 1.00 0.48 N ATOM 84 CA ALA A 6 -0.470 -1.000 -0.569 1.00 0.51 C ATOM 85 C ALA A 6 0.519 0.054 -0.084 1.00 0.46 C ATOM 86 O ALA A 6 1.414 -0.245 0.704 1.00 0.58 O ATOM 87 CB ALA A 6 -1.198 -1.630 0.609 1.00 0.71 C ATOM 0 H ALA A 6 0.706 -2.725 -0.783 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.206 -0.514 -1.210 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -1.709 -0.854 1.179 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -1.929 -2.351 0.242 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -0.479 -2.138 1.252 1.00 0.71 H new ATOM 93 N ILE A 7 0.363 1.285 -0.568 1.00 0.44 N ATOM 94 CA ILE A 7 1.263 2.367 -0.181 1.00 0.43 C ATOM 95 C ILE A 7 0.616 3.293 0.844 1.00 0.49 C ATOM 96 O ILE A 7 -0.586 3.557 0.786 1.00 0.58 O ATOM 97 CB ILE A 7 1.705 3.194 -1.408 1.00 0.47 C ATOM 98 CG1 ILE A 7 2.710 4.269 -0.992 1.00 1.19 C ATOM 99 CG2 ILE A 7 0.496 3.820 -2.089 1.00 1.41 C ATOM 100 CD1 ILE A 7 3.273 5.057 -2.154 1.00 1.42 C ATOM 0 H ILE A 7 -0.371 1.555 -1.223 1.00 0.44 H new ATOM 0 HA ILE A 7 2.139 1.901 0.269 1.00 0.43 H new ATOM 0 HB ILE A 7 2.192 2.528 -2.120 1.00 0.47 H new ATOM 0 HG12 ILE A 7 2.227 4.957 -0.298 1.00 1.19 H new ATOM 0 HG13 ILE A 7 3.531 3.797 -0.453 1.00 1.19 H new ATOM 0 HG21 ILE A 7 0.824 4.400 -2.952 1.00 1.41 H new ATOM 0 HG22 ILE A 7 -0.184 3.034 -2.417 1.00 1.41 H new ATOM 0 HG23 ILE A 7 -0.019 4.475 -1.386 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.978 5.800 -1.782 1.00 1.42 H new ATOM 0 HD12 ILE A 7 3.786 4.381 -2.838 1.00 1.42 H new ATOM 0 HD13 ILE A 7 2.461 5.559 -2.681 1.00 1.42 H new ATOM 112 N GLY A 8 1.422 3.781 1.784 1.00 0.57 N ATOM 113 CA GLY A 8 0.909 4.669 2.810 1.00 0.69 C ATOM 114 C GLY A 8 1.964 5.609 3.361 1.00 0.68 C ATOM 115 O GLY A 8 3.042 5.176 3.768 1.00 0.77 O ATOM 0 H GLY A 8 2.419 3.577 1.852 1.00 0.57 H new ATOM 0 HA2 GLY A 8 0.087 5.255 2.398 1.00 0.69 H new ATOM 0 HA3 GLY A 8 0.498 4.074 3.626 1.00 0.69 H new ATOM 119 N SER A 9 1.645 6.901 3.381 1.00 0.70 N ATOM 120 CA SER A 9 2.562 7.915 3.892 1.00 0.75 C ATOM 121 C SER A 9 1.812 8.914 4.774 1.00 0.87 C ATOM 122 O SER A 9 0.589 9.032 4.687 1.00 0.92 O ATOM 123 CB SER A 9 3.243 8.644 2.734 1.00 0.76 C ATOM 124 OG SER A 9 4.035 7.755 1.967 1.00 1.67 O ATOM 0 H SER A 9 0.755 7.271 3.048 1.00 0.70 H new ATOM 0 HA SER A 9 3.325 7.421 4.494 1.00 0.75 H new ATOM 0 HB2 SER A 9 2.489 9.106 2.097 1.00 0.76 H new ATOM 0 HB3 SER A 9 3.867 9.448 3.123 1.00 0.76 H new ATOM 0 HG SER A 9 4.930 8.136 1.845 1.00 1.67 H new ATOM 130 N ASN A 10 2.545 9.627 5.624 1.00 1.03 N ATOM 131 CA ASN A 10 1.932 10.609 6.519 1.00 1.23 C ATOM 132 C ASN A 10 2.762 11.891 6.594 1.00 1.30 C ATOM 133 O ASN A 10 3.432 12.259 5.628 1.00 2.00 O ATOM 134 CB ASN A 10 1.750 10.004 7.916 1.00 1.55 C ATOM 135 CG ASN A 10 3.051 9.516 8.537 1.00 2.18 C ATOM 136 OD1 ASN A 10 3.054 8.988 9.649 1.00 2.66 O ATOM 137 ND2 ASN A 10 4.163 9.687 7.831 1.00 3.02 N ATOM 0 H ASN A 10 3.558 9.546 5.714 1.00 1.03 H new ATOM 0 HA ASN A 10 0.955 10.873 6.115 1.00 1.23 H new ATOM 0 HB2 ASN A 10 1.301 10.750 8.571 1.00 1.55 H new ATOM 0 HB3 ASN A 10 1.050 9.171 7.855 1.00 1.55 H new ATOM 0 HD21 ASN A 10 5.059 9.376 8.207 1.00 3.02 H new ATOM 0 HD22 ASN A 10 4.121 10.129 6.913 1.00 3.02 H new ATOM 144 N LEU A 11 2.707 12.566 7.747 1.00 1.21 N ATOM 145 CA LEU A 11 3.448 13.812 7.964 1.00 1.31 C ATOM 146 C LEU A 11 2.865 14.965 7.152 1.00 1.49 C ATOM 147 O LEU A 11 2.927 14.957 5.925 1.00 1.96 O ATOM 148 CB LEU A 11 4.929 13.632 7.617 1.00 1.36 C ATOM 149 CG LEU A 11 5.744 14.926 7.580 1.00 1.66 C ATOM 150 CD1 LEU A 11 5.705 15.629 8.930 1.00 2.11 C ATOM 151 CD2 LEU A 11 7.179 14.647 7.167 1.00 2.45 C ATOM 0 H LEU A 11 2.153 12.267 8.549 1.00 1.21 H new ATOM 0 HA LEU A 11 3.355 14.059 9.022 1.00 1.31 H new ATOM 0 HB2 LEU A 11 5.378 12.957 8.346 1.00 1.36 H new ATOM 0 HB3 LEU A 11 5.003 13.145 6.644 1.00 1.36 H new ATOM 0 HG LEU A 11 5.295 15.586 6.838 1.00 1.66 H new ATOM 0 HD11 LEU A 11 6.291 16.546 8.880 1.00 2.11 H new ATOM 0 HD12 LEU A 11 4.673 15.871 9.184 1.00 2.11 H new ATOM 0 HD13 LEU A 11 6.123 14.973 9.694 1.00 2.11 H new ATOM 0 HD21 LEU A 11 7.740 15.581 7.147 1.00 2.45 H new ATOM 0 HD22 LEU A 11 7.637 13.964 7.882 1.00 2.45 H new ATOM 0 HD23 LEU A 11 7.191 14.196 6.175 1.00 2.45 H new ATOM 163 N ALA A 12 2.316 15.959 7.864 1.00 1.57 N ATOM 164 CA ALA A 12 1.725 17.152 7.248 1.00 1.79 C ATOM 165 C ALA A 12 1.162 16.862 5.859 1.00 1.71 C ATOM 166 O ALA A 12 0.003 16.471 5.718 1.00 2.29 O ATOM 167 CB ALA A 12 2.753 18.272 7.180 1.00 2.08 C ATOM 0 H ALA A 12 2.270 15.957 8.883 1.00 1.57 H new ATOM 0 HA ALA A 12 0.891 17.466 7.876 1.00 1.79 H new ATOM 0 HB1 ALA A 12 2.303 19.152 6.721 1.00 2.08 H new ATOM 0 HB2 ALA A 12 3.088 18.520 8.187 1.00 2.08 H new ATOM 0 HB3 ALA A 12 3.605 17.948 6.583 1.00 2.08 H new ATOM 173 N SER A 13 1.996 17.048 4.839 1.00 1.54 N ATOM 174 CA SER A 13 1.595 16.798 3.462 1.00 1.42 C ATOM 175 C SER A 13 2.280 15.536 2.939 1.00 1.10 C ATOM 176 O SER A 13 3.371 15.603 2.373 1.00 1.17 O ATOM 177 CB SER A 13 1.950 17.994 2.575 1.00 1.72 C ATOM 178 OG SER A 13 1.317 19.176 3.035 1.00 2.45 O ATOM 0 H SER A 13 2.957 17.372 4.944 1.00 1.54 H new ATOM 0 HA SER A 13 0.515 16.654 3.435 1.00 1.42 H new ATOM 0 HB2 SER A 13 3.031 18.136 2.566 1.00 1.72 H new ATOM 0 HB3 SER A 13 1.647 17.792 1.548 1.00 1.72 H new ATOM 0 HG SER A 13 1.561 19.926 2.453 1.00 2.45 H new ATOM 184 N PRO A 14 1.653 14.364 3.138 1.00 0.96 N ATOM 185 CA PRO A 14 2.211 13.080 2.701 1.00 0.92 C ATOM 186 C PRO A 14 2.223 12.928 1.185 1.00 0.86 C ATOM 187 O PRO A 14 2.510 11.852 0.669 1.00 0.90 O ATOM 188 CB PRO A 14 1.275 12.035 3.330 1.00 1.18 C ATOM 189 CG PRO A 14 0.447 12.781 4.322 1.00 1.23 C ATOM 190 CD PRO A 14 0.362 14.188 3.817 1.00 1.14 C ATOM 0 HA PRO A 14 3.252 12.978 3.006 1.00 0.92 H new ATOM 0 HB2 PRO A 14 0.649 11.564 2.573 1.00 1.18 H new ATOM 0 HB3 PRO A 14 1.843 11.240 3.813 1.00 1.18 H new ATOM 0 HG2 PRO A 14 -0.545 12.339 4.413 1.00 1.23 H new ATOM 0 HG3 PRO A 14 0.902 12.749 5.312 1.00 1.23 H new ATOM 0 HD2 PRO A 14 -0.477 14.324 3.134 1.00 1.14 H new ATOM 0 HD3 PRO A 14 0.231 14.903 4.629 1.00 1.14 H new ATOM 198 N LEU A 15 1.911 14.007 0.475 1.00 0.89 N ATOM 199 CA LEU A 15 1.891 13.978 -0.983 1.00 0.90 C ATOM 200 C LEU A 15 3.294 13.779 -1.545 1.00 0.84 C ATOM 201 O LEU A 15 3.476 13.122 -2.569 1.00 0.84 O ATOM 202 CB LEU A 15 1.289 15.275 -1.534 1.00 1.07 C ATOM 203 CG LEU A 15 1.229 15.366 -3.061 1.00 1.33 C ATOM 204 CD1 LEU A 15 0.329 14.278 -3.628 1.00 1.67 C ATOM 205 CD2 LEU A 15 0.744 16.741 -3.493 1.00 1.72 C ATOM 0 H LEU A 15 1.669 14.910 0.884 1.00 0.89 H new ATOM 0 HA LEU A 15 1.272 13.136 -1.294 1.00 0.90 H new ATOM 0 HB2 LEU A 15 0.279 15.385 -1.139 1.00 1.07 H new ATOM 0 HB3 LEU A 15 1.872 16.116 -1.158 1.00 1.07 H new ATOM 0 HG LEU A 15 2.235 15.216 -3.454 1.00 1.33 H new ATOM 0 HD11 LEU A 15 0.300 14.360 -4.715 1.00 1.67 H new ATOM 0 HD12 LEU A 15 0.720 13.300 -3.348 1.00 1.67 H new ATOM 0 HD13 LEU A 15 -0.678 14.394 -3.228 1.00 1.67 H new ATOM 0 HD21 LEU A 15 0.707 16.789 -4.581 1.00 1.72 H new ATOM 0 HD22 LEU A 15 -0.252 16.919 -3.088 1.00 1.72 H new ATOM 0 HD23 LEU A 15 1.429 17.502 -3.120 1.00 1.72 H new ATOM 217 N GLU A 16 4.283 14.357 -0.872 1.00 0.86 N ATOM 218 CA GLU A 16 5.669 14.248 -1.312 1.00 0.88 C ATOM 219 C GLU A 16 6.238 12.863 -1.017 1.00 0.76 C ATOM 220 O GLU A 16 6.911 12.267 -1.860 1.00 0.75 O ATOM 221 CB GLU A 16 6.525 15.317 -0.635 1.00 1.05 C ATOM 222 CG GLU A 16 6.069 16.736 -0.931 1.00 1.40 C ATOM 223 CD GLU A 16 6.937 17.780 -0.256 1.00 1.82 C ATOM 224 OE1 GLU A 16 7.025 17.764 0.989 1.00 2.16 O ATOM 225 OE2 GLU A 16 7.529 18.614 -0.973 1.00 2.49 O ATOM 0 H GLU A 16 4.151 14.905 -0.022 1.00 0.86 H new ATOM 0 HA GLU A 16 5.689 14.401 -2.391 1.00 0.88 H new ATOM 0 HB2 GLU A 16 6.508 15.156 0.443 1.00 1.05 H new ATOM 0 HB3 GLU A 16 7.559 15.201 -0.958 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.081 16.900 -2.008 1.00 1.40 H new ATOM 0 HG3 GLU A 16 5.037 16.858 -0.601 1.00 1.40 H new ATOM 232 N GLN A 17 5.976 12.357 0.184 1.00 0.73 N ATOM 233 CA GLN A 17 6.479 11.046 0.584 1.00 0.71 C ATOM 234 C GLN A 17 5.759 9.927 -0.159 1.00 0.57 C ATOM 235 O GLN A 17 6.385 8.961 -0.589 1.00 0.51 O ATOM 236 CB GLN A 17 6.340 10.855 2.089 1.00 0.86 C ATOM 237 CG GLN A 17 6.971 11.977 2.893 1.00 1.20 C ATOM 238 CD GLN A 17 7.189 11.603 4.345 1.00 1.35 C ATOM 239 OE1 GLN A 17 7.366 12.471 5.197 1.00 2.20 O ATOM 240 NE2 GLN A 17 7.222 10.305 4.629 1.00 1.36 N ATOM 0 H GLN A 17 5.420 12.832 0.895 1.00 0.73 H new ATOM 0 HA GLN A 17 7.536 11.001 0.321 1.00 0.71 H new ATOM 0 HB2 GLN A 17 5.283 10.784 2.344 1.00 0.86 H new ATOM 0 HB3 GLN A 17 6.801 9.909 2.373 1.00 0.86 H new ATOM 0 HG2 GLN A 17 7.927 12.248 2.444 1.00 1.20 H new ATOM 0 HG3 GLN A 17 6.333 12.859 2.841 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.070 9.617 3.891 1.00 1.36 H new ATOM 0 HE22 GLN A 17 7.400 9.996 5.585 1.00 1.36 H new ATOM 249 N VAL A 18 4.447 10.059 -0.322 1.00 0.57 N ATOM 250 CA VAL A 18 3.685 9.046 -1.039 1.00 0.53 C ATOM 251 C VAL A 18 4.244 8.907 -2.449 1.00 0.49 C ATOM 252 O VAL A 18 4.305 7.813 -3.004 1.00 0.51 O ATOM 253 CB VAL A 18 2.179 9.378 -1.106 1.00 0.62 C ATOM 254 CG1 VAL A 18 1.933 10.631 -1.932 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.398 8.201 -1.669 1.00 1.25 C ATOM 0 H VAL A 18 3.897 10.844 0.027 1.00 0.57 H new ATOM 0 HA VAL A 18 3.783 8.108 -0.493 1.00 0.53 H new ATOM 0 HB VAL A 18 1.829 9.571 -0.092 1.00 0.62 H new ATOM 0 HG11 VAL A 18 0.864 10.842 -1.963 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.456 11.473 -1.480 1.00 1.10 H new ATOM 0 HG13 VAL A 18 2.302 10.477 -2.946 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.338 8.453 -1.709 1.00 1.25 H new ATOM 0 HG22 VAL A 18 1.755 7.974 -2.674 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.540 7.330 -1.029 1.00 1.25 H new ATOM 265 N ASN A 19 4.680 10.036 -3.006 1.00 0.52 N ATOM 266 CA ASN A 19 5.268 10.063 -4.336 1.00 0.57 C ATOM 267 C ASN A 19 6.688 9.511 -4.293 1.00 0.50 C ATOM 268 O ASN A 19 7.242 9.122 -5.318 1.00 0.52 O ATOM 269 CB ASN A 19 5.280 11.489 -4.890 1.00 0.72 C ATOM 270 CG ASN A 19 3.888 12.028 -5.182 1.00 1.26 C ATOM 271 OD1 ASN A 19 3.735 13.166 -5.621 1.00 1.96 O ATOM 272 ND2 ASN A 19 2.862 11.214 -4.941 1.00 1.71 N ATOM 0 H ASN A 19 4.635 10.947 -2.550 1.00 0.52 H new ATOM 0 HA ASN A 19 4.662 9.439 -4.993 1.00 0.57 H new ATOM 0 HB2 ASN A 19 5.775 12.146 -4.175 1.00 0.72 H new ATOM 0 HB3 ASN A 19 5.871 11.512 -5.805 1.00 0.72 H new ATOM 0 HD21 ASN A 19 1.908 11.528 -5.121 1.00 1.71 H new ATOM 0 HD22 ASN A 19 3.030 10.276 -4.577 1.00 1.71 H new ATOM 279 N ALA A 20 7.267 9.475 -3.093 1.00 0.49 N ATOM 280 CA ALA A 20 8.619 8.958 -2.910 1.00 0.49 C ATOM 281 C ALA A 20 8.669 7.481 -3.273 1.00 0.42 C ATOM 282 O ALA A 20 9.443 7.066 -4.135 1.00 0.48 O ATOM 283 CB ALA A 20 9.081 9.179 -1.479 1.00 0.57 C ATOM 0 H ALA A 20 6.820 9.798 -2.235 1.00 0.49 H new ATOM 0 HA ALA A 20 9.296 9.498 -3.572 1.00 0.49 H new ATOM 0 HB1 ALA A 20 10.091 8.788 -1.358 1.00 0.57 H new ATOM 0 HB2 ALA A 20 9.076 10.246 -1.256 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.408 8.662 -0.795 1.00 0.57 H new ATOM 289 N ALA A 21 7.814 6.694 -2.626 1.00 0.41 N ATOM 290 CA ALA A 21 7.736 5.264 -2.902 1.00 0.45 C ATOM 291 C ALA A 21 7.194 5.060 -4.310 1.00 0.36 C ATOM 292 O ALA A 21 7.581 4.125 -5.010 1.00 0.40 O ATOM 293 CB ALA A 21 6.844 4.568 -1.886 1.00 0.64 C ATOM 0 H ALA A 21 7.167 7.022 -1.909 1.00 0.41 H new ATOM 0 HA ALA A 21 8.732 4.828 -2.826 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.800 3.502 -2.110 1.00 0.64 H new ATOM 0 HB2 ALA A 21 7.252 4.712 -0.885 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.840 4.991 -1.933 1.00 0.64 H new ATOM 299 N LEU A 22 6.306 5.966 -4.718 1.00 0.40 N ATOM 300 CA LEU A 22 5.710 5.926 -6.047 1.00 0.47 C ATOM 301 C LEU A 22 6.750 6.300 -7.094 1.00 0.44 C ATOM 302 O LEU A 22 6.627 5.951 -8.267 1.00 0.53 O ATOM 303 CB LEU A 22 4.513 6.877 -6.122 1.00 0.64 C ATOM 304 CG LEU A 22 3.259 6.406 -5.384 1.00 1.16 C ATOM 305 CD1 LEU A 22 2.170 7.462 -5.453 1.00 1.74 C ATOM 306 CD2 LEU A 22 2.763 5.089 -5.963 1.00 1.73 C ATOM 0 H LEU A 22 5.983 6.742 -4.139 1.00 0.40 H new ATOM 0 HA LEU A 22 5.359 4.913 -6.246 1.00 0.47 H new ATOM 0 HB2 LEU A 22 4.812 7.844 -5.717 1.00 0.64 H new ATOM 0 HB3 LEU A 22 4.260 7.035 -7.170 1.00 0.64 H new ATOM 0 HG LEU A 22 3.516 6.247 -4.337 1.00 1.16 H new ATOM 0 HD11 LEU A 22 1.286 7.108 -4.922 1.00 1.74 H new ATOM 0 HD12 LEU A 22 2.526 8.383 -4.991 1.00 1.74 H new ATOM 0 HD13 LEU A 22 1.915 7.654 -6.495 1.00 1.74 H new ATOM 0 HD21 LEU A 22 1.870 4.769 -5.426 1.00 1.73 H new ATOM 0 HD22 LEU A 22 2.524 5.223 -7.018 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.540 4.331 -5.860 1.00 1.73 H new ATOM 318 N LYS A 23 7.785 7.002 -6.647 1.00 0.43 N ATOM 319 CA LYS A 23 8.873 7.416 -7.518 1.00 0.52 C ATOM 320 C LYS A 23 9.704 6.200 -7.893 1.00 0.47 C ATOM 321 O LYS A 23 10.126 6.041 -9.039 1.00 0.56 O ATOM 322 CB LYS A 23 9.742 8.455 -6.806 1.00 0.61 C ATOM 323 CG LYS A 23 11.014 8.817 -7.552 1.00 1.13 C ATOM 324 CD LYS A 23 11.867 9.771 -6.734 1.00 1.51 C ATOM 325 CE LYS A 23 13.190 10.068 -7.422 1.00 2.12 C ATOM 326 NZ LYS A 23 14.030 11.007 -6.629 1.00 2.74 N ATOM 0 H LYS A 23 7.891 7.298 -5.677 1.00 0.43 H new ATOM 0 HA LYS A 23 8.467 7.866 -8.424 1.00 0.52 H new ATOM 0 HB2 LYS A 23 9.154 9.360 -6.652 1.00 0.61 H new ATOM 0 HB3 LYS A 23 10.008 8.076 -5.819 1.00 0.61 H new ATOM 0 HG2 LYS A 23 11.581 7.913 -7.772 1.00 1.13 H new ATOM 0 HG3 LYS A 23 10.762 9.276 -8.508 1.00 1.13 H new ATOM 0 HD2 LYS A 23 11.322 10.701 -6.574 1.00 1.51 H new ATOM 0 HD3 LYS A 23 12.056 9.340 -5.751 1.00 1.51 H new ATOM 0 HE2 LYS A 23 13.735 9.137 -7.578 1.00 2.12 H new ATOM 0 HE3 LYS A 23 12.999 10.495 -8.407 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 14.923 11.184 -7.132 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 13.521 11.905 -6.501 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 14.234 10.589 -5.699 1.00 2.74 H new ATOM 340 N ALA A 24 9.910 5.333 -6.910 1.00 0.40 N ATOM 341 CA ALA A 24 10.663 4.107 -7.107 1.00 0.43 C ATOM 342 C ALA A 24 9.749 3.025 -7.669 1.00 0.38 C ATOM 343 O ALA A 24 10.197 2.109 -8.356 1.00 0.46 O ATOM 344 CB ALA A 24 11.289 3.662 -5.794 1.00 0.51 C ATOM 0 H ALA A 24 9.561 5.461 -5.960 1.00 0.40 H new ATOM 0 HA ALA A 24 11.466 4.287 -7.822 1.00 0.43 H new ATOM 0 HB1 ALA A 24 11.851 2.742 -5.952 1.00 0.51 H new ATOM 0 HB2 ALA A 24 11.960 4.439 -5.429 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.504 3.485 -5.058 1.00 0.51 H new ATOM 350 N LEU A 25 8.455 3.158 -7.378 1.00 0.43 N ATOM 351 CA LEU A 25 7.462 2.210 -7.862 1.00 0.40 C ATOM 352 C LEU A 25 7.001 2.608 -9.256 1.00 0.37 C ATOM 353 O LEU A 25 6.384 1.817 -9.970 1.00 0.45 O ATOM 354 CB LEU A 25 6.264 2.136 -6.915 1.00 0.47 C ATOM 355 CG LEU A 25 5.380 0.902 -7.091 1.00 0.56 C ATOM 356 CD1 LEU A 25 6.205 -0.367 -6.958 1.00 0.96 C ATOM 357 CD2 LEU A 25 4.257 0.911 -6.066 1.00 1.04 C ATOM 0 H LEU A 25 8.074 3.914 -6.809 1.00 0.43 H new ATOM 0 HA LEU A 25 7.924 1.223 -7.903 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.629 2.160 -5.888 1.00 0.47 H new ATOM 0 HB3 LEU A 25 5.652 3.027 -7.057 1.00 0.47 H new ATOM 0 HG LEU A 25 4.944 0.927 -8.090 1.00 0.56 H new ATOM 0 HD11 LEU A 25 5.559 -1.236 -7.086 1.00 0.96 H new ATOM 0 HD12 LEU A 25 6.983 -0.377 -7.722 1.00 0.96 H new ATOM 0 HD13 LEU A 25 6.666 -0.400 -5.971 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.634 0.027 -6.201 1.00 1.04 H new ATOM 0 HD22 LEU A 25 4.681 0.906 -5.062 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.650 1.807 -6.199 1.00 1.04 H new ATOM 369 N GLY A 26 7.320 3.840 -9.645 1.00 0.43 N ATOM 370 CA GLY A 26 6.958 4.318 -10.961 1.00 0.53 C ATOM 371 C GLY A 26 7.930 3.782 -11.977 1.00 0.56 C ATOM 372 O GLY A 26 7.556 3.400 -13.085 1.00 0.82 O ATOM 0 H GLY A 26 7.824 4.514 -9.068 1.00 0.43 H new ATOM 0 HA2 GLY A 26 5.945 4.000 -11.209 1.00 0.53 H new ATOM 0 HA3 GLY A 26 6.963 5.408 -10.977 1.00 0.53 H new ATOM 376 N ASP A 27 9.189 3.721 -11.560 1.00 0.59 N ATOM 377 CA ASP A 27 10.250 3.189 -12.391 1.00 0.76 C ATOM 378 C ASP A 27 11.054 2.168 -11.597 1.00 0.56 C ATOM 379 O ASP A 27 11.911 2.521 -10.788 1.00 0.81 O ATOM 380 CB ASP A 27 11.159 4.311 -12.875 1.00 1.35 C ATOM 381 CG ASP A 27 10.446 5.287 -13.792 1.00 2.02 C ATOM 382 OD1 ASP A 27 9.457 5.906 -13.345 1.00 2.61 O ATOM 383 OD2 ASP A 27 10.875 5.429 -14.955 1.00 2.42 O ATOM 0 H ASP A 27 9.497 4.038 -10.641 1.00 0.59 H new ATOM 0 HA ASP A 27 9.810 2.703 -13.262 1.00 0.76 H new ATOM 0 HB2 ASP A 27 11.554 4.850 -12.014 1.00 1.35 H new ATOM 0 HB3 ASP A 27 12.012 3.881 -13.401 1.00 1.35 H new ATOM 388 N ILE A 28 10.755 0.902 -11.836 1.00 0.51 N ATOM 389 CA ILE A 28 11.425 -0.196 -11.158 1.00 0.51 C ATOM 390 C ILE A 28 12.255 -0.992 -12.158 1.00 0.49 C ATOM 391 O ILE A 28 11.864 -1.108 -13.320 1.00 0.48 O ATOM 392 CB ILE A 28 10.406 -1.147 -10.486 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.173 -0.378 -10.003 1.00 0.82 C ATOM 394 CG2 ILE A 28 11.037 -1.887 -9.320 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.211 -0.014 -11.112 1.00 1.26 C ATOM 0 H ILE A 28 10.043 0.606 -12.504 1.00 0.51 H new ATOM 0 HA ILE A 28 12.068 0.231 -10.388 1.00 0.51 H new ATOM 0 HB ILE A 28 10.095 -1.874 -11.236 1.00 0.71 H new ATOM 0 HG12 ILE A 28 8.648 -0.980 -9.261 1.00 0.82 H new ATOM 0 HG13 ILE A 28 9.498 0.534 -9.502 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.299 -2.548 -8.866 1.00 0.83 H new ATOM 0 HG22 ILE A 28 11.881 -2.477 -9.677 1.00 0.83 H new ATOM 0 HG23 ILE A 28 11.385 -1.168 -8.578 1.00 0.83 H new ATOM 0 HD11 ILE A 28 7.363 0.529 -10.694 1.00 1.26 H new ATOM 0 HD12 ILE A 28 8.720 0.615 -11.843 1.00 1.26 H new ATOM 0 HD13 ILE A 28 7.856 -0.922 -11.599 1.00 1.26 H new ATOM 407 N PRO A 29 13.406 -1.551 -11.736 1.00 0.68 N ATOM 408 CA PRO A 29 14.269 -2.337 -12.614 1.00 0.83 C ATOM 409 C PRO A 29 13.502 -3.151 -13.661 1.00 0.70 C ATOM 410 O PRO A 29 13.976 -3.324 -14.784 1.00 0.88 O ATOM 411 CB PRO A 29 14.965 -3.259 -11.624 1.00 1.07 C ATOM 412 CG PRO A 29 15.150 -2.413 -10.411 1.00 1.14 C ATOM 413 CD PRO A 29 13.978 -1.461 -10.370 1.00 0.87 C ATOM 0 HA PRO A 29 14.933 -1.710 -13.209 1.00 0.83 H new ATOM 0 HB2 PRO A 29 14.361 -4.140 -11.407 1.00 1.07 H new ATOM 0 HB3 PRO A 29 15.920 -3.614 -12.012 1.00 1.07 H new ATOM 0 HG2 PRO A 29 15.183 -3.027 -9.511 1.00 1.14 H new ATOM 0 HG3 PRO A 29 16.092 -1.867 -10.459 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.252 -1.752 -9.611 1.00 0.87 H new ATOM 0 HD3 PRO A 29 14.295 -0.445 -10.134 1.00 0.87 H new ATOM 421 N GLU A 30 12.320 -3.653 -13.295 1.00 0.54 N ATOM 422 CA GLU A 30 11.517 -4.448 -14.224 1.00 0.58 C ATOM 423 C GLU A 30 10.027 -4.103 -14.140 1.00 0.60 C ATOM 424 O GLU A 30 9.333 -4.088 -15.156 1.00 1.01 O ATOM 425 CB GLU A 30 11.720 -5.940 -13.951 1.00 0.62 C ATOM 426 CG GLU A 30 13.168 -6.385 -14.072 1.00 0.63 C ATOM 427 CD GLU A 30 13.350 -7.871 -13.824 1.00 1.39 C ATOM 428 OE1 GLU A 30 12.340 -8.553 -13.548 1.00 2.35 O ATOM 429 OE2 GLU A 30 14.500 -8.351 -13.903 1.00 1.66 O ATOM 0 H GLU A 30 11.903 -3.525 -12.373 1.00 0.54 H new ATOM 0 HA GLU A 30 11.855 -4.208 -15.232 1.00 0.58 H new ATOM 0 HB2 GLU A 30 11.360 -6.171 -12.948 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.111 -6.515 -14.649 1.00 0.62 H new ATOM 0 HG2 GLU A 30 13.536 -6.140 -15.068 1.00 0.63 H new ATOM 0 HG3 GLU A 30 13.776 -5.826 -13.361 1.00 0.63 H new ATOM 436 N SER A 31 9.541 -3.842 -12.930 1.00 0.36 N ATOM 437 CA SER A 31 8.128 -3.516 -12.723 1.00 0.34 C ATOM 438 C SER A 31 7.722 -2.258 -13.490 1.00 0.36 C ATOM 439 O SER A 31 8.564 -1.573 -14.072 1.00 0.46 O ATOM 440 CB SER A 31 7.847 -3.327 -11.233 1.00 0.37 C ATOM 441 OG SER A 31 8.239 -4.467 -10.491 1.00 0.83 O ATOM 0 H SER A 31 10.101 -3.849 -12.078 1.00 0.36 H new ATOM 0 HA SER A 31 7.536 -4.348 -13.104 1.00 0.34 H new ATOM 0 HB2 SER A 31 8.381 -2.450 -10.868 1.00 0.37 H new ATOM 0 HB3 SER A 31 6.784 -3.139 -11.081 1.00 0.37 H new ATOM 0 HG SER A 31 8.080 -4.307 -9.537 1.00 0.83 H new ATOM 447 N HIS A 32 6.421 -1.957 -13.479 1.00 0.33 N ATOM 448 CA HIS A 32 5.898 -0.778 -14.168 1.00 0.39 C ATOM 449 C HIS A 32 4.477 -0.452 -13.715 1.00 0.34 C ATOM 450 O HIS A 32 3.581 -1.292 -13.784 1.00 0.36 O ATOM 451 CB HIS A 32 5.924 -0.978 -15.683 1.00 0.51 C ATOM 452 CG HIS A 32 5.265 0.127 -16.450 1.00 0.94 C ATOM 453 ND1 HIS A 32 5.700 1.435 -16.409 1.00 1.83 N ATOM 454 CD2 HIS A 32 4.192 0.115 -17.278 1.00 1.60 C ATOM 455 CE1 HIS A 32 4.925 2.179 -17.177 1.00 2.29 C ATOM 456 NE2 HIS A 32 4.002 1.403 -17.716 1.00 2.07 N ATOM 0 H HIS A 32 5.712 -2.514 -13.001 1.00 0.33 H new ATOM 0 HA HIS A 32 6.543 0.061 -13.909 1.00 0.39 H new ATOM 0 HB2 HIS A 32 6.960 -1.068 -16.011 1.00 0.51 H new ATOM 0 HB3 HIS A 32 5.431 -1.920 -15.924 1.00 0.51 H new ATOM 0 HD2 HIS A 32 3.597 -0.746 -17.544 1.00 1.60 H new ATOM 0 HE1 HIS A 32 5.028 3.242 -17.337 1.00 2.29 H new ATOM 0 HE2 HIS A 32 3.268 1.710 -18.354 1.00 2.07 H new ATOM 465 N ILE A 33 4.292 0.783 -13.259 1.00 0.36 N ATOM 466 CA ILE A 33 2.996 1.262 -12.789 1.00 0.36 C ATOM 467 C ILE A 33 1.882 1.029 -13.809 1.00 0.38 C ATOM 468 O ILE A 33 2.095 1.132 -15.018 1.00 0.50 O ATOM 469 CB ILE A 33 3.077 2.758 -12.430 1.00 0.53 C ATOM 470 CG1 ILE A 33 3.627 2.921 -11.012 1.00 0.58 C ATOM 471 CG2 ILE A 33 1.720 3.442 -12.566 1.00 0.93 C ATOM 472 CD1 ILE A 33 2.712 2.377 -9.940 1.00 1.05 C ATOM 0 H ILE A 33 5.035 1.479 -13.205 1.00 0.36 H new ATOM 0 HA ILE A 33 2.747 0.685 -11.899 1.00 0.36 H new ATOM 0 HB ILE A 33 3.754 3.242 -13.133 1.00 0.53 H new ATOM 0 HG12 ILE A 33 4.591 2.416 -10.945 1.00 0.58 H new ATOM 0 HG13 ILE A 33 3.807 3.979 -10.821 1.00 0.58 H new ATOM 0 HG21 ILE A 33 1.816 4.496 -12.305 1.00 0.93 H new ATOM 0 HG22 ILE A 33 1.369 3.354 -13.594 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.004 2.966 -11.896 1.00 0.93 H new ATOM 0 HD11 ILE A 33 3.168 2.528 -8.962 1.00 1.05 H new ATOM 0 HD12 ILE A 33 1.756 2.898 -9.979 1.00 1.05 H new ATOM 0 HD13 ILE A 33 2.551 1.312 -10.105 1.00 1.05 H new ATOM 484 N LEU A 34 0.690 0.726 -13.299 1.00 0.38 N ATOM 485 CA LEU A 34 -0.481 0.488 -14.139 1.00 0.50 C ATOM 486 C LEU A 34 -1.689 1.252 -13.599 1.00 0.46 C ATOM 487 O LEU A 34 -2.092 2.274 -14.156 1.00 0.60 O ATOM 488 CB LEU A 34 -0.802 -1.007 -14.203 1.00 0.65 C ATOM 489 CG LEU A 34 0.297 -1.898 -14.776 1.00 1.01 C ATOM 490 CD1 LEU A 34 -0.169 -3.345 -14.797 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.682 -1.441 -16.176 1.00 1.34 C ATOM 0 H LEU A 34 0.510 0.639 -12.299 1.00 0.38 H new ATOM 0 HA LEU A 34 -0.256 0.844 -15.144 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -1.036 -1.353 -13.196 1.00 0.65 H new ATOM 0 HB3 LEU A 34 -1.702 -1.141 -14.803 1.00 0.65 H new ATOM 0 HG LEU A 34 1.179 -1.821 -14.140 1.00 1.01 H new ATOM 0 HD11 LEU A 34 0.620 -3.975 -15.207 1.00 1.69 H new ATOM 0 HD12 LEU A 34 -0.400 -3.667 -13.782 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -1.061 -3.431 -15.417 1.00 1.69 H new ATOM 0 HD21 LEU A 34 1.467 -2.089 -16.567 1.00 1.34 H new ATOM 0 HD22 LEU A 34 -0.190 -1.493 -16.828 1.00 1.34 H new ATOM 0 HD23 LEU A 34 1.045 -0.414 -16.136 1.00 1.34 H new ATOM 503 N THR A 35 -2.255 0.747 -12.504 1.00 0.46 N ATOM 504 CA THR A 35 -3.413 1.375 -11.870 1.00 0.43 C ATOM 505 C THR A 35 -3.099 1.760 -10.430 1.00 0.43 C ATOM 506 O THR A 35 -2.914 0.896 -9.573 1.00 0.52 O ATOM 507 CB THR A 35 -4.618 0.432 -11.901 1.00 0.49 C ATOM 508 OG1 THR A 35 -4.283 -0.828 -11.345 1.00 0.68 O ATOM 509 CG2 THR A 35 -5.160 0.191 -13.292 1.00 0.72 C ATOM 0 H THR A 35 -1.929 -0.099 -12.036 1.00 0.46 H new ATOM 0 HA THR A 35 -3.653 2.279 -12.430 1.00 0.43 H new ATOM 0 HB THR A 35 -5.388 0.932 -11.314 1.00 0.49 H new ATOM 0 HG1 THR A 35 -5.066 -1.416 -11.372 1.00 0.68 H new ATOM 0 HG21 THR A 35 -6.012 -0.486 -13.238 1.00 0.72 H new ATOM 0 HG22 THR A 35 -5.476 1.138 -13.728 1.00 0.72 H new ATOM 0 HG23 THR A 35 -4.383 -0.253 -13.914 1.00 0.72 H new ATOM 517 N VAL A 36 -3.042 3.062 -10.170 1.00 0.40 N ATOM 518 CA VAL A 36 -2.751 3.563 -8.833 1.00 0.46 C ATOM 519 C VAL A 36 -3.460 4.888 -8.582 1.00 0.48 C ATOM 520 O VAL A 36 -3.260 5.860 -9.312 1.00 0.56 O ATOM 521 CB VAL A 36 -1.236 3.745 -8.614 1.00 0.58 C ATOM 522 CG1 VAL A 36 -0.642 4.641 -9.687 1.00 1.32 C ATOM 523 CG2 VAL A 36 -0.958 4.314 -7.231 1.00 1.45 C ATOM 0 H VAL A 36 -3.194 3.789 -10.869 1.00 0.40 H new ATOM 0 HA VAL A 36 -3.118 2.818 -8.127 1.00 0.46 H new ATOM 0 HB VAL A 36 -0.763 2.766 -8.684 1.00 0.58 H new ATOM 0 HG11 VAL A 36 0.428 4.756 -9.514 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -0.804 4.192 -10.667 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -1.123 5.619 -9.652 1.00 1.32 H new ATOM 0 HG21 VAL A 36 0.117 4.435 -7.097 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -1.447 5.283 -7.131 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -1.344 3.633 -6.473 1.00 1.45 H new ATOM 533 N SER A 37 -4.292 4.920 -7.546 1.00 0.45 N ATOM 534 CA SER A 37 -5.035 6.126 -7.198 1.00 0.54 C ATOM 535 C SER A 37 -5.865 5.895 -5.937 1.00 0.57 C ATOM 536 O SER A 37 -5.517 5.060 -5.102 1.00 1.08 O ATOM 537 CB SER A 37 -5.940 6.542 -8.364 1.00 0.65 C ATOM 538 OG SER A 37 -6.514 7.818 -8.143 1.00 1.28 O ATOM 0 H SER A 37 -4.469 4.124 -6.933 1.00 0.45 H new ATOM 0 HA SER A 37 -4.325 6.930 -7.001 1.00 0.54 H new ATOM 0 HB2 SER A 37 -5.362 6.557 -9.288 1.00 0.65 H new ATOM 0 HB3 SER A 37 -6.731 5.803 -8.494 1.00 0.65 H new ATOM 0 HG SER A 37 -7.084 8.056 -8.904 1.00 1.28 H new ATOM 544 N SER A 38 -6.962 6.635 -5.805 1.00 0.59 N ATOM 545 CA SER A 38 -7.844 6.513 -4.651 1.00 0.59 C ATOM 546 C SER A 38 -7.107 6.840 -3.356 1.00 0.52 C ATOM 547 O SER A 38 -6.956 5.987 -2.481 1.00 0.63 O ATOM 548 CB SER A 38 -8.439 5.105 -4.576 1.00 0.78 C ATOM 549 OG SER A 38 -9.329 4.988 -3.481 1.00 1.68 O ATOM 0 H SER A 38 -7.262 7.330 -6.489 1.00 0.59 H new ATOM 0 HA SER A 38 -8.653 7.233 -4.774 1.00 0.59 H new ATOM 0 HB2 SER A 38 -8.966 4.879 -5.503 1.00 0.78 H new ATOM 0 HB3 SER A 38 -7.638 4.372 -4.478 1.00 0.78 H new ATOM 0 HG SER A 38 -8.846 5.163 -2.647 1.00 1.68 H new ATOM 555 N PHE A 39 -6.659 8.086 -3.237 1.00 0.44 N ATOM 556 CA PHE A 39 -5.950 8.536 -2.044 1.00 0.50 C ATOM 557 C PHE A 39 -6.904 8.571 -0.855 1.00 0.57 C ATOM 558 O PHE A 39 -7.543 9.587 -0.584 1.00 0.75 O ATOM 559 CB PHE A 39 -5.332 9.920 -2.272 1.00 0.59 C ATOM 560 CG PHE A 39 -4.312 9.967 -3.383 1.00 0.59 C ATOM 561 CD1 PHE A 39 -4.628 9.532 -4.663 1.00 0.65 C ATOM 562 CD2 PHE A 39 -3.035 10.444 -3.143 1.00 0.83 C ATOM 563 CE1 PHE A 39 -3.690 9.574 -5.677 1.00 0.98 C ATOM 564 CE2 PHE A 39 -2.092 10.489 -4.151 1.00 1.19 C ATOM 565 CZ PHE A 39 -2.419 10.054 -5.421 1.00 1.26 C ATOM 0 H PHE A 39 -6.775 8.803 -3.953 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.144 7.834 -1.832 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -6.129 10.629 -2.496 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -4.861 10.252 -1.347 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -5.619 9.156 -4.869 1.00 0.65 H new ATOM 0 HD2 PHE A 39 -2.772 10.786 -2.153 1.00 0.83 H new ATOM 0 HE1 PHE A 39 -3.949 9.232 -6.668 1.00 0.98 H new ATOM 0 HE2 PHE A 39 -1.100 10.864 -3.947 1.00 1.19 H new ATOM 0 HZ PHE A 39 -1.684 10.089 -6.211 1.00 1.26 H new ATOM 575 N TYR A 40 -7.012 7.443 -0.164 1.00 0.65 N ATOM 576 CA TYR A 40 -7.908 7.327 0.982 1.00 0.81 C ATOM 577 C TYR A 40 -7.305 7.926 2.244 1.00 0.71 C ATOM 578 O TYR A 40 -6.085 8.014 2.389 1.00 0.71 O ATOM 579 CB TYR A 40 -8.263 5.859 1.220 1.00 1.01 C ATOM 580 CG TYR A 40 -7.065 4.970 1.445 1.00 1.49 C ATOM 581 CD1 TYR A 40 -6.383 4.401 0.377 1.00 1.73 C ATOM 582 CD2 TYR A 40 -6.619 4.698 2.730 1.00 2.39 C ATOM 583 CE1 TYR A 40 -5.287 3.586 0.584 1.00 2.61 C ATOM 584 CE2 TYR A 40 -5.522 3.882 2.947 1.00 3.35 C ATOM 585 CZ TYR A 40 -4.851 3.337 1.851 1.00 3.41 C ATOM 586 OH TYR A 40 -3.769 2.518 2.083 1.00 4.43 O ATOM 0 H TYR A 40 -6.489 6.593 -0.377 1.00 0.65 H new ATOM 0 HA TYR A 40 -8.811 7.892 0.750 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -8.922 5.790 2.085 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -8.823 5.487 0.362 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -6.715 4.599 -0.631 1.00 1.73 H new ATOM 0 HD2 TYR A 40 -7.136 5.130 3.574 1.00 2.39 H new ATOM 0 HE1 TYR A 40 -4.775 3.146 -0.259 1.00 2.61 H new ATOM 0 HE2 TYR A 40 -5.189 3.670 3.952 1.00 3.35 H new ATOM 0 HH TYR A 40 -3.327 2.788 2.915 1.00 4.43 H new ATOM 596 N ARG A 41 -8.183 8.327 3.156 1.00 0.70 N ATOM 597 CA ARG A 41 -7.767 8.914 4.423 1.00 0.67 C ATOM 598 C ARG A 41 -7.634 7.830 5.486 1.00 0.64 C ATOM 599 O ARG A 41 -8.561 7.050 5.706 1.00 0.70 O ATOM 600 CB ARG A 41 -8.779 9.968 4.878 1.00 0.79 C ATOM 601 CG ARG A 41 -8.386 10.680 6.163 1.00 0.95 C ATOM 602 CD ARG A 41 -9.466 11.649 6.617 1.00 1.52 C ATOM 603 NE ARG A 41 -10.732 10.968 6.882 1.00 2.11 N ATOM 604 CZ ARG A 41 -11.822 11.584 7.327 1.00 2.49 C ATOM 605 NH1 ARG A 41 -11.804 12.890 7.564 1.00 2.37 N ATOM 606 NH2 ARG A 41 -12.936 10.894 7.539 1.00 3.51 N ATOM 0 H ARG A 41 -9.194 8.255 3.040 1.00 0.70 H new ATOM 0 HA ARG A 41 -6.798 9.393 4.282 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -8.901 10.707 4.086 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -9.748 9.490 5.020 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -8.203 9.944 6.946 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -7.452 11.221 6.009 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -9.135 12.165 7.519 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -9.616 12.410 5.851 1.00 1.52 H new ATOM 0 HE ARG A 41 -10.781 9.963 6.716 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -10.951 13.426 7.405 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -12.644 13.358 7.906 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -12.956 9.890 7.360 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -13.772 11.368 7.881 1.00 3.51 H new ATOM 620 N THR A 42 -6.478 7.779 6.137 1.00 0.80 N ATOM 621 CA THR A 42 -6.235 6.780 7.167 1.00 0.97 C ATOM 622 C THR A 42 -6.067 7.427 8.540 1.00 1.03 C ATOM 623 O THR A 42 -5.030 8.024 8.829 1.00 1.12 O ATOM 624 CB THR A 42 -4.990 5.957 6.832 1.00 1.17 C ATOM 625 OG1 THR A 42 -5.149 5.292 5.592 1.00 1.44 O ATOM 626 CG2 THR A 42 -4.667 4.909 7.877 1.00 1.32 C ATOM 0 H THR A 42 -5.698 8.415 5.970 1.00 0.80 H new ATOM 0 HA THR A 42 -7.104 6.123 7.199 1.00 0.97 H new ATOM 0 HB THR A 42 -4.170 6.674 6.794 1.00 1.17 H new ATOM 0 HG1 THR A 42 -4.268 5.108 5.204 1.00 1.44 H new ATOM 0 HG21 THR A 42 -3.773 4.361 7.579 1.00 1.32 H new ATOM 0 HG22 THR A 42 -4.491 5.394 8.837 1.00 1.32 H new ATOM 0 HG23 THR A 42 -5.504 4.216 7.968 1.00 1.32 H new ATOM 634 N PRO A 43 -7.086 7.311 9.411 1.00 1.12 N ATOM 635 CA PRO A 43 -7.037 7.874 10.757 1.00 1.31 C ATOM 636 C PRO A 43 -6.180 7.012 11.682 1.00 1.50 C ATOM 637 O PRO A 43 -6.579 5.908 12.055 1.00 1.71 O ATOM 638 CB PRO A 43 -8.505 7.860 11.220 1.00 1.48 C ATOM 639 CG PRO A 43 -9.305 7.387 10.045 1.00 1.38 C ATOM 640 CD PRO A 43 -8.358 6.624 9.166 1.00 1.15 C ATOM 0 HA PRO A 43 -6.594 8.870 10.773 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -8.638 7.197 12.075 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -8.824 8.854 11.535 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -10.131 6.753 10.368 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -9.740 8.229 9.507 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -8.310 5.570 9.438 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -8.650 6.670 8.117 1.00 1.15 H new ATOM 648 N PRO A 44 -4.984 7.499 12.065 1.00 1.55 N ATOM 649 CA PRO A 44 -4.074 6.757 12.944 1.00 1.80 C ATOM 650 C PRO A 44 -4.750 6.321 14.237 1.00 2.15 C ATOM 651 O PRO A 44 -4.861 5.127 14.517 1.00 2.77 O ATOM 652 CB PRO A 44 -2.944 7.753 13.240 1.00 1.80 C ATOM 653 CG PRO A 44 -3.452 9.081 12.784 1.00 1.81 C ATOM 654 CD PRO A 44 -4.418 8.796 11.672 1.00 1.54 C ATOM 0 HA PRO A 44 -3.726 5.837 12.475 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -2.704 7.769 14.303 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -2.031 7.479 12.711 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -3.942 9.612 13.600 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -2.634 9.713 12.438 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -5.185 9.566 11.594 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -3.919 8.744 10.704 1.00 1.54 H new ATOM 662 N LEU A 45 -5.205 7.296 15.019 1.00 2.16 N ATOM 663 CA LEU A 45 -5.876 7.016 16.282 1.00 2.52 C ATOM 664 C LEU A 45 -4.997 6.172 17.201 1.00 2.69 C ATOM 665 O LEU A 45 -5.417 5.119 17.682 1.00 3.09 O ATOM 666 CB LEU A 45 -7.206 6.298 16.023 1.00 2.75 C ATOM 667 CG LEU A 45 -8.261 7.125 15.286 1.00 3.05 C ATOM 668 CD1 LEU A 45 -9.506 6.289 15.029 1.00 3.66 C ATOM 669 CD2 LEU A 45 -8.616 8.374 16.081 1.00 3.32 C ATOM 0 H LEU A 45 -5.120 8.288 14.799 1.00 2.16 H new ATOM 0 HA LEU A 45 -6.070 7.967 16.779 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -7.007 5.395 15.445 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -7.621 5.979 16.979 1.00 2.75 H new ATOM 0 HG LEU A 45 -7.846 7.435 14.327 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -10.247 6.892 14.504 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -9.244 5.424 14.420 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -9.920 5.951 15.979 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -9.368 8.948 15.540 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -9.012 8.085 17.055 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -7.723 8.984 16.218 1.00 3.32 H new ATOM 681 N GLY A 46 -3.776 6.641 17.445 1.00 2.52 N ATOM 682 CA GLY A 46 -2.865 5.910 18.311 1.00 2.73 C ATOM 683 C GLY A 46 -1.415 6.315 18.121 1.00 2.68 C ATOM 684 O GLY A 46 -0.814 6.904 19.020 1.00 2.81 O ATOM 0 H GLY A 46 -3.402 7.509 17.061 1.00 2.52 H new ATOM 0 HA2 GLY A 46 -3.149 6.074 19.350 1.00 2.73 H new ATOM 0 HA3 GLY A 46 -2.967 4.842 18.118 1.00 2.73 H new ATOM 688 N PRO A 47 -0.818 6.007 16.955 1.00 2.59 N ATOM 689 CA PRO A 47 0.582 6.344 16.669 1.00 2.65 C ATOM 690 C PRO A 47 0.878 7.826 16.869 1.00 2.60 C ATOM 691 O PRO A 47 1.702 8.198 17.705 1.00 2.86 O ATOM 692 CB PRO A 47 0.752 5.962 15.196 1.00 2.59 C ATOM 693 CG PRO A 47 -0.296 4.935 14.944 1.00 2.63 C ATOM 694 CD PRO A 47 -1.455 5.299 15.828 1.00 2.54 C ATOM 0 HA PRO A 47 1.266 5.824 17.340 1.00 2.65 H new ATOM 0 HB2 PRO A 47 0.622 6.827 14.546 1.00 2.59 H new ATOM 0 HB3 PRO A 47 1.749 5.565 15.003 1.00 2.59 H new ATOM 0 HG2 PRO A 47 -0.592 4.929 13.895 1.00 2.63 H new ATOM 0 HG3 PRO A 47 0.073 3.936 15.176 1.00 2.63 H new ATOM 0 HD2 PRO A 47 -2.172 5.934 15.308 1.00 2.54 H new ATOM 0 HD3 PRO A 47 -1.997 4.415 16.164 1.00 2.54 H new ATOM 702 N GLN A 48 0.205 8.667 16.092 1.00 2.39 N ATOM 703 CA GLN A 48 0.400 10.109 16.176 1.00 2.50 C ATOM 704 C GLN A 48 -0.735 10.779 16.942 1.00 2.40 C ATOM 705 O GLN A 48 -1.572 10.112 17.551 1.00 2.57 O ATOM 706 CB GLN A 48 0.487 10.710 14.773 1.00 2.56 C ATOM 707 CG GLN A 48 1.659 10.199 13.953 1.00 2.73 C ATOM 708 CD GLN A 48 1.700 10.790 12.554 1.00 2.73 C ATOM 709 OE1 GLN A 48 2.600 10.489 11.772 1.00 3.26 O ATOM 710 NE2 GLN A 48 0.725 11.634 12.228 1.00 2.45 N ATOM 0 H GLN A 48 -0.481 8.374 15.396 1.00 2.39 H new ATOM 0 HA GLN A 48 1.332 10.287 16.713 1.00 2.50 H new ATOM 0 HB2 GLN A 48 -0.438 10.494 14.239 1.00 2.56 H new ATOM 0 HB3 GLN A 48 0.561 11.794 14.857 1.00 2.56 H new ATOM 0 HG2 GLN A 48 2.589 10.436 14.470 1.00 2.73 H new ATOM 0 HG3 GLN A 48 1.601 9.113 13.882 1.00 2.73 H new ATOM 0 HE21 GLN A 48 -0.004 11.858 12.906 1.00 2.45 H new ATOM 0 HE22 GLN A 48 0.706 12.057 11.300 1.00 2.45 H new ATOM 719 N ASP A 49 -0.761 12.108 16.890 1.00 2.45 N ATOM 720 CA ASP A 49 -1.793 12.888 17.558 1.00 2.47 C ATOM 721 C ASP A 49 -2.591 13.686 16.533 1.00 2.38 C ATOM 722 O ASP A 49 -3.687 14.168 16.820 1.00 2.57 O ATOM 723 CB ASP A 49 -1.175 13.827 18.597 1.00 2.79 C ATOM 724 CG ASP A 49 -0.171 14.787 17.988 1.00 2.83 C ATOM 725 OD1 ASP A 49 0.844 14.311 17.436 1.00 3.28 O ATOM 726 OD2 ASP A 49 -0.401 16.012 18.064 1.00 3.02 O ATOM 0 H ASP A 49 -0.073 12.669 16.388 1.00 2.45 H new ATOM 0 HA ASP A 49 -2.465 12.202 18.074 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -1.967 14.396 19.085 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -0.685 13.236 19.370 1.00 2.79 H new ATOM 731 N GLN A 50 -2.033 13.806 15.331 1.00 2.26 N ATOM 732 CA GLN A 50 -2.687 14.527 14.245 1.00 2.39 C ATOM 733 C GLN A 50 -3.157 13.550 13.166 1.00 2.01 C ATOM 734 O GLN A 50 -2.410 13.221 12.245 1.00 2.19 O ATOM 735 CB GLN A 50 -1.752 15.583 13.640 1.00 3.08 C ATOM 736 CG GLN A 50 -0.358 15.075 13.301 1.00 3.45 C ATOM 737 CD GLN A 50 0.524 14.923 14.525 1.00 3.73 C ATOM 738 OE1 GLN A 50 0.733 15.877 15.275 1.00 4.34 O ATOM 739 NE2 GLN A 50 1.055 13.724 14.727 1.00 3.74 N ATOM 0 H GLN A 50 -1.125 13.411 15.085 1.00 2.26 H new ATOM 0 HA GLN A 50 -3.555 15.042 14.656 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -2.211 15.979 12.734 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -1.662 16.413 14.340 1.00 3.08 H new ATOM 0 HG2 GLN A 50 -0.440 14.113 12.795 1.00 3.45 H new ATOM 0 HG3 GLN A 50 0.115 15.764 12.601 1.00 3.45 H new ATOM 0 HE21 GLN A 50 0.855 12.962 14.080 1.00 3.74 H new ATOM 0 HE22 GLN A 50 1.664 13.564 15.530 1.00 3.74 H new ATOM 748 N PRO A 51 -4.407 13.062 13.276 1.00 1.98 N ATOM 749 CA PRO A 51 -4.969 12.110 12.311 1.00 2.00 C ATOM 750 C PRO A 51 -5.133 12.711 10.922 1.00 1.82 C ATOM 751 O PRO A 51 -6.009 13.547 10.699 1.00 2.47 O ATOM 752 CB PRO A 51 -6.338 11.756 12.903 1.00 2.71 C ATOM 753 CG PRO A 51 -6.673 12.891 13.806 1.00 2.89 C ATOM 754 CD PRO A 51 -5.363 13.390 14.349 1.00 2.51 C ATOM 0 HA PRO A 51 -4.315 11.249 12.172 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -7.088 11.640 12.121 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -6.300 10.814 13.450 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -7.196 13.679 13.264 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -7.331 12.567 14.612 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -5.392 14.461 14.549 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -5.102 12.898 15.286 1.00 2.51 H new ATOM 762 N ASP A 52 -4.290 12.273 9.989 1.00 1.32 N ATOM 763 CA ASP A 52 -4.348 12.767 8.618 1.00 1.52 C ATOM 764 C ASP A 52 -3.358 12.026 7.718 1.00 1.28 C ATOM 765 O ASP A 52 -2.559 12.648 7.017 1.00 2.07 O ATOM 766 CB ASP A 52 -4.061 14.270 8.585 1.00 2.12 C ATOM 767 CG ASP A 52 -4.240 14.866 7.202 1.00 2.77 C ATOM 768 OD1 ASP A 52 -5.362 14.787 6.660 1.00 3.33 O ATOM 769 OD2 ASP A 52 -3.255 15.414 6.662 1.00 3.26 O ATOM 0 H ASP A 52 -3.562 11.579 10.158 1.00 1.32 H new ATOM 0 HA ASP A 52 -5.353 12.584 8.239 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -4.724 14.779 9.285 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -3.041 14.449 8.925 1.00 2.12 H new ATOM 774 N TYR A 53 -3.417 10.694 7.729 1.00 0.84 N ATOM 775 CA TYR A 53 -2.523 9.895 6.896 1.00 1.19 C ATOM 776 C TYR A 53 -3.035 9.830 5.461 1.00 0.96 C ATOM 777 O TYR A 53 -4.167 9.412 5.214 1.00 1.43 O ATOM 778 CB TYR A 53 -2.379 8.476 7.452 1.00 2.08 C ATOM 779 CG TYR A 53 -1.443 8.359 8.636 1.00 3.12 C ATOM 780 CD1 TYR A 53 -1.502 9.256 9.698 1.00 3.74 C ATOM 781 CD2 TYR A 53 -0.499 7.341 8.689 1.00 3.88 C ATOM 782 CE1 TYR A 53 -0.643 9.139 10.776 1.00 4.86 C ATOM 783 CE2 TYR A 53 0.361 7.219 9.762 1.00 5.03 C ATOM 784 CZ TYR A 53 0.285 8.119 10.803 1.00 5.45 C ATOM 785 OH TYR A 53 1.139 7.998 11.873 1.00 6.66 O ATOM 0 H TYR A 53 -4.067 10.152 8.299 1.00 0.84 H new ATOM 0 HA TYR A 53 -1.546 10.378 6.904 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -3.364 8.113 7.746 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -2.022 7.822 6.656 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -2.229 10.055 9.680 1.00 3.74 H new ATOM 0 HD2 TYR A 53 -0.437 6.632 7.876 1.00 3.88 H new ATOM 0 HE1 TYR A 53 -0.699 9.843 11.593 1.00 4.86 H new ATOM 0 HE2 TYR A 53 1.090 6.422 9.786 1.00 5.03 H new ATOM 0 HH TYR A 53 2.018 8.358 11.632 1.00 6.66 H new ATOM 795 N LEU A 54 -2.190 10.232 4.518 1.00 0.84 N ATOM 796 CA LEU A 54 -2.553 10.205 3.106 1.00 0.76 C ATOM 797 C LEU A 54 -1.982 8.951 2.455 1.00 0.76 C ATOM 798 O LEU A 54 -0.778 8.862 2.204 1.00 0.98 O ATOM 799 CB LEU A 54 -2.045 11.473 2.402 1.00 0.97 C ATOM 800 CG LEU A 54 -2.499 11.669 0.948 1.00 1.15 C ATOM 801 CD1 LEU A 54 -1.758 10.729 0.011 1.00 1.60 C ATOM 802 CD2 LEU A 54 -4.002 11.468 0.824 1.00 1.60 C ATOM 0 H LEU A 54 -1.250 10.580 4.706 1.00 0.84 H new ATOM 0 HA LEU A 54 -3.639 10.181 3.012 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -2.367 12.339 2.981 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -0.955 11.463 2.422 1.00 0.97 H new ATOM 0 HG LEU A 54 -2.260 12.692 0.658 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -2.100 10.890 -1.011 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -0.687 10.925 0.071 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -1.955 9.697 0.301 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -4.304 11.611 -0.214 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -4.261 10.458 1.141 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -4.519 12.191 1.455 1.00 1.60 H new ATOM 814 N ASN A 55 -2.850 7.974 2.206 1.00 0.60 N ATOM 815 CA ASN A 55 -2.431 6.711 1.609 1.00 0.66 C ATOM 816 C ASN A 55 -3.176 6.446 0.299 1.00 0.50 C ATOM 817 O ASN A 55 -4.136 7.140 -0.033 1.00 0.56 O ATOM 818 CB ASN A 55 -2.679 5.563 2.588 1.00 0.87 C ATOM 819 CG ASN A 55 -1.963 5.728 3.920 1.00 1.51 C ATOM 820 OD1 ASN A 55 -2.205 4.971 4.859 1.00 2.21 O ATOM 821 ND2 ASN A 55 -1.063 6.700 4.007 1.00 2.21 N ATOM 0 H ASN A 55 -3.848 8.034 2.409 1.00 0.60 H new ATOM 0 HA ASN A 55 -1.366 6.777 1.389 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -3.750 5.478 2.770 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -2.359 4.629 2.127 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -0.545 6.839 4.874 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -0.890 7.308 3.206 1.00 2.21 H new ATOM 828 N ALA A 56 -2.725 5.433 -0.439 1.00 0.50 N ATOM 829 CA ALA A 56 -3.341 5.069 -1.709 1.00 0.45 C ATOM 830 C ALA A 56 -3.050 3.611 -2.058 1.00 0.45 C ATOM 831 O ALA A 56 -2.347 2.914 -1.322 1.00 0.61 O ATOM 832 CB ALA A 56 -2.852 5.988 -2.817 1.00 0.58 C ATOM 0 H ALA A 56 -1.931 4.849 -0.176 1.00 0.50 H new ATOM 0 HA ALA A 56 -4.420 5.185 -1.610 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -3.321 5.704 -3.759 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -3.115 7.018 -2.577 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -1.769 5.902 -2.910 1.00 0.58 H new ATOM 838 N ALA A 57 -3.590 3.158 -3.183 1.00 0.43 N ATOM 839 CA ALA A 57 -3.385 1.787 -3.631 1.00 0.47 C ATOM 840 C ALA A 57 -2.637 1.758 -4.952 1.00 0.40 C ATOM 841 O ALA A 57 -2.916 2.556 -5.848 1.00 0.44 O ATOM 842 CB ALA A 57 -4.716 1.063 -3.757 1.00 0.59 C ATOM 0 H ALA A 57 -4.174 3.721 -3.802 1.00 0.43 H new ATOM 0 HA ALA A 57 -2.780 1.272 -2.885 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -4.544 0.040 -4.093 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.215 1.048 -2.788 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.345 1.581 -4.481 1.00 0.59 H new ATOM 848 N VAL A 58 -1.689 0.835 -5.070 1.00 0.39 N ATOM 849 CA VAL A 58 -0.912 0.707 -6.276 1.00 0.39 C ATOM 850 C VAL A 58 -1.050 -0.691 -6.838 1.00 0.40 C ATOM 851 O VAL A 58 -0.899 -1.679 -6.123 1.00 0.60 O ATOM 852 CB VAL A 58 0.576 0.993 -6.028 1.00 0.49 C ATOM 853 CG1 VAL A 58 1.321 1.056 -7.346 1.00 1.11 C ATOM 854 CG2 VAL A 58 0.756 2.280 -5.237 1.00 1.22 C ATOM 0 H VAL A 58 -1.447 0.167 -4.338 1.00 0.39 H new ATOM 0 HA VAL A 58 -1.295 1.441 -6.985 1.00 0.39 H new ATOM 0 HB VAL A 58 0.993 0.179 -5.435 1.00 0.49 H new ATOM 0 HG11 VAL A 58 2.375 1.259 -7.159 1.00 1.11 H new ATOM 0 HG12 VAL A 58 1.222 0.103 -7.866 1.00 1.11 H new ATOM 0 HG13 VAL A 58 0.902 1.851 -7.963 1.00 1.11 H new ATOM 0 HG21 VAL A 58 1.818 2.461 -5.074 1.00 1.22 H new ATOM 0 HG22 VAL A 58 0.327 3.113 -5.795 1.00 1.22 H new ATOM 0 HG23 VAL A 58 0.251 2.189 -4.275 1.00 1.22 H new ATOM 864 N ALA A 59 -1.306 -0.766 -8.125 1.00 0.34 N ATOM 865 CA ALA A 59 -1.435 -2.037 -8.801 1.00 0.36 C ATOM 866 C ALA A 59 -0.666 -1.975 -10.095 1.00 0.37 C ATOM 867 O ALA A 59 -1.192 -1.570 -11.131 1.00 0.43 O ATOM 868 CB ALA A 59 -2.897 -2.370 -9.054 1.00 0.44 C ATOM 0 H ALA A 59 -1.430 0.047 -8.729 1.00 0.34 H new ATOM 0 HA ALA A 59 -1.027 -2.828 -8.172 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.968 -3.331 -9.564 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.428 -2.423 -8.103 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -3.344 -1.595 -9.676 1.00 0.44 H new ATOM 874 N LEU A 60 0.591 -2.360 -10.025 1.00 0.37 N ATOM 875 CA LEU A 60 1.449 -2.321 -11.200 1.00 0.45 C ATOM 876 C LEU A 60 1.948 -3.702 -11.576 1.00 0.39 C ATOM 877 O LEU A 60 2.054 -4.592 -10.733 1.00 0.38 O ATOM 878 CB LEU A 60 2.647 -1.401 -10.963 1.00 0.56 C ATOM 879 CG LEU A 60 3.652 -1.890 -9.923 1.00 0.48 C ATOM 880 CD1 LEU A 60 4.941 -1.088 -10.010 1.00 0.44 C ATOM 881 CD2 LEU A 60 3.063 -1.789 -8.528 1.00 0.98 C ATOM 0 H LEU A 60 1.042 -2.701 -9.176 1.00 0.37 H new ATOM 0 HA LEU A 60 0.847 -1.934 -12.022 1.00 0.45 H new ATOM 0 HB2 LEU A 60 3.169 -1.261 -11.910 1.00 0.56 H new ATOM 0 HB3 LEU A 60 2.277 -0.423 -10.655 1.00 0.56 H new ATOM 0 HG LEU A 60 3.879 -2.936 -10.130 1.00 0.48 H new ATOM 0 HD11 LEU A 60 5.646 -1.450 -9.262 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.375 -1.203 -11.003 1.00 0.44 H new ATOM 0 HD13 LEU A 60 4.727 -0.035 -9.828 1.00 0.44 H new ATOM 0 HD21 LEU A 60 3.792 -2.142 -7.799 1.00 0.98 H new ATOM 0 HD22 LEU A 60 2.809 -0.751 -8.315 1.00 0.98 H new ATOM 0 HD23 LEU A 60 2.164 -2.402 -8.467 1.00 0.98 H new ATOM 893 N GLU A 61 2.279 -3.860 -12.849 1.00 0.39 N ATOM 894 CA GLU A 61 2.799 -5.120 -13.345 1.00 0.38 C ATOM 895 C GLU A 61 4.265 -5.263 -12.968 1.00 0.36 C ATOM 896 O GLU A 61 5.155 -4.823 -13.698 1.00 0.38 O ATOM 897 CB GLU A 61 2.624 -5.216 -14.863 1.00 0.44 C ATOM 898 CG GLU A 61 2.971 -3.933 -15.601 1.00 1.08 C ATOM 899 CD GLU A 61 3.043 -4.122 -17.104 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.019 -4.514 -17.702 1.00 1.39 O ATOM 901 OE2 GLU A 61 4.123 -3.876 -17.681 1.00 1.24 O ATOM 0 H GLU A 61 2.196 -3.129 -13.556 1.00 0.39 H new ATOM 0 HA GLU A 61 2.237 -5.934 -12.886 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.251 -6.023 -15.242 1.00 0.44 H new ATOM 0 HB3 GLU A 61 1.591 -5.484 -15.084 1.00 0.44 H new ATOM 0 HG2 GLU A 61 2.225 -3.173 -15.370 1.00 1.08 H new ATOM 0 HG3 GLU A 61 3.929 -3.559 -15.240 1.00 1.08 H new ATOM 908 N THR A 62 4.507 -5.872 -11.815 1.00 0.39 N ATOM 909 CA THR A 62 5.850 -6.071 -11.329 1.00 0.43 C ATOM 910 C THR A 62 6.427 -7.363 -11.890 1.00 0.39 C ATOM 911 O THR A 62 5.772 -8.078 -12.649 1.00 0.43 O ATOM 912 CB THR A 62 5.848 -6.112 -9.800 1.00 0.54 C ATOM 913 OG1 THR A 62 5.195 -7.279 -9.330 1.00 1.47 O ATOM 914 CG2 THR A 62 5.156 -4.918 -9.170 1.00 1.02 C ATOM 0 H THR A 62 3.779 -6.236 -11.201 1.00 0.39 H new ATOM 0 HA THR A 62 6.473 -5.240 -11.660 1.00 0.43 H new ATOM 0 HB THR A 62 6.899 -6.101 -9.510 1.00 0.54 H new ATOM 0 HG1 THR A 62 5.206 -7.288 -8.350 1.00 1.47 H new ATOM 0 HG21 THR A 62 5.190 -5.009 -8.084 1.00 1.02 H new ATOM 0 HG22 THR A 62 5.663 -4.002 -9.473 1.00 1.02 H new ATOM 0 HG23 THR A 62 4.117 -4.884 -9.499 1.00 1.02 H new ATOM 922 N SER A 63 7.651 -7.655 -11.497 1.00 0.40 N ATOM 923 CA SER A 63 8.343 -8.864 -11.927 1.00 0.44 C ATOM 924 C SER A 63 9.220 -9.311 -10.784 1.00 0.44 C ATOM 925 O SER A 63 9.447 -10.500 -10.555 1.00 0.64 O ATOM 926 CB SER A 63 9.184 -8.598 -13.175 1.00 0.56 C ATOM 927 OG SER A 63 9.845 -9.777 -13.605 1.00 1.23 O ATOM 0 H SER A 63 8.198 -7.064 -10.871 1.00 0.40 H new ATOM 0 HA SER A 63 7.622 -9.640 -12.186 1.00 0.44 H new ATOM 0 HB2 SER A 63 8.545 -8.223 -13.975 1.00 0.56 H new ATOM 0 HB3 SER A 63 9.919 -7.822 -12.963 1.00 0.56 H new ATOM 0 HG SER A 63 10.808 -9.606 -13.674 1.00 1.23 H new ATOM 933 N LEU A 64 9.667 -8.310 -10.050 1.00 0.39 N ATOM 934 CA LEU A 64 10.482 -8.493 -8.879 1.00 0.38 C ATOM 935 C LEU A 64 9.577 -8.680 -7.676 1.00 0.35 C ATOM 936 O LEU A 64 9.090 -7.701 -7.108 1.00 0.39 O ATOM 937 CB LEU A 64 11.352 -7.256 -8.690 1.00 0.42 C ATOM 938 CG LEU A 64 10.644 -5.936 -9.018 1.00 0.50 C ATOM 939 CD1 LEU A 64 10.935 -4.901 -7.947 1.00 0.78 C ATOM 940 CD2 LEU A 64 11.087 -5.427 -10.382 1.00 0.84 C ATOM 0 H LEU A 64 9.467 -7.332 -10.260 1.00 0.39 H new ATOM 0 HA LEU A 64 11.119 -9.370 -8.990 1.00 0.38 H new ATOM 0 HB2 LEU A 64 11.698 -7.223 -7.657 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.237 -7.348 -9.320 1.00 0.42 H new ATOM 0 HG LEU A 64 9.569 -6.113 -9.045 1.00 0.50 H new ATOM 0 HD11 LEU A 64 10.426 -3.969 -8.193 1.00 0.78 H new ATOM 0 HD12 LEU A 64 10.579 -5.265 -6.983 1.00 0.78 H new ATOM 0 HD13 LEU A 64 12.009 -4.724 -7.894 1.00 0.78 H new ATOM 0 HD21 LEU A 64 10.577 -4.489 -10.604 1.00 0.84 H new ATOM 0 HD22 LEU A 64 12.164 -5.262 -10.376 1.00 0.84 H new ATOM 0 HD23 LEU A 64 10.837 -6.165 -11.144 1.00 0.84 H new ATOM 952 N ALA A 65 9.332 -9.935 -7.305 1.00 0.38 N ATOM 953 CA ALA A 65 8.466 -10.243 -6.175 1.00 0.42 C ATOM 954 C ALA A 65 8.650 -9.221 -5.061 1.00 0.39 C ATOM 955 O ALA A 65 9.757 -8.724 -4.860 1.00 0.38 O ATOM 956 CB ALA A 65 8.747 -11.645 -5.657 1.00 0.52 C ATOM 0 H ALA A 65 9.722 -10.753 -7.772 1.00 0.38 H new ATOM 0 HA ALA A 65 7.432 -10.198 -6.516 1.00 0.42 H new ATOM 0 HB1 ALA A 65 8.092 -11.859 -4.813 1.00 0.52 H new ATOM 0 HB2 ALA A 65 8.565 -12.369 -6.451 1.00 0.52 H new ATOM 0 HB3 ALA A 65 9.786 -11.713 -5.336 1.00 0.52 H new ATOM 962 N PRO A 66 7.565 -8.878 -4.334 1.00 0.44 N ATOM 963 CA PRO A 66 7.601 -7.904 -3.241 1.00 0.47 C ATOM 964 C PRO A 66 8.900 -7.928 -2.450 1.00 0.45 C ATOM 965 O PRO A 66 9.271 -6.946 -1.823 1.00 0.49 O ATOM 966 CB PRO A 66 6.431 -8.346 -2.384 1.00 0.55 C ATOM 967 CG PRO A 66 5.424 -8.800 -3.375 1.00 0.57 C ATOM 968 CD PRO A 66 6.199 -9.403 -4.525 1.00 0.50 C ATOM 0 HA PRO A 66 7.540 -6.876 -3.599 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.714 -9.149 -1.703 1.00 0.55 H new ATOM 0 HB3 PRO A 66 6.051 -7.528 -1.772 1.00 0.55 H new ATOM 0 HG2 PRO A 66 4.749 -9.534 -2.935 1.00 0.57 H new ATOM 0 HG3 PRO A 66 4.810 -7.966 -3.715 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.180 -10.492 -4.494 1.00 0.50 H new ATOM 0 HD3 PRO A 66 5.785 -9.104 -5.488 1.00 0.50 H new ATOM 976 N GLU A 67 9.611 -9.039 -2.498 1.00 0.45 N ATOM 977 CA GLU A 67 10.877 -9.129 -1.806 1.00 0.49 C ATOM 978 C GLU A 67 11.782 -8.005 -2.308 1.00 0.44 C ATOM 979 O GLU A 67 12.212 -7.139 -1.543 1.00 0.47 O ATOM 980 CB GLU A 67 11.512 -10.494 -2.067 1.00 0.52 C ATOM 981 CG GLU A 67 10.560 -11.650 -1.803 1.00 0.71 C ATOM 982 CD GLU A 67 11.142 -12.993 -2.207 1.00 0.77 C ATOM 983 OE1 GLU A 67 12.290 -13.023 -2.697 1.00 1.20 O ATOM 984 OE2 GLU A 67 10.447 -14.016 -2.032 1.00 1.06 O ATOM 0 H GLU A 67 9.335 -9.881 -3.003 1.00 0.45 H new ATOM 0 HA GLU A 67 10.732 -9.024 -0.731 1.00 0.49 H new ATOM 0 HB2 GLU A 67 11.852 -10.539 -3.102 1.00 0.52 H new ATOM 0 HB3 GLU A 67 12.394 -10.605 -1.436 1.00 0.52 H new ATOM 0 HG2 GLU A 67 10.307 -11.672 -0.743 1.00 0.71 H new ATOM 0 HG3 GLU A 67 9.631 -11.482 -2.348 1.00 0.71 H new ATOM 991 N GLU A 68 12.020 -8.010 -3.618 1.00 0.40 N ATOM 992 CA GLU A 68 12.832 -6.988 -4.272 1.00 0.39 C ATOM 993 C GLU A 68 12.075 -5.666 -4.324 1.00 0.35 C ATOM 994 O GLU A 68 12.633 -4.601 -4.063 1.00 0.40 O ATOM 995 CB GLU A 68 13.171 -7.434 -5.696 1.00 0.41 C ATOM 996 CG GLU A 68 13.894 -8.767 -5.761 1.00 0.97 C ATOM 997 CD GLU A 68 15.277 -8.723 -5.137 1.00 1.52 C ATOM 998 OE1 GLU A 68 15.697 -7.636 -4.689 1.00 1.90 O ATOM 999 OE2 GLU A 68 15.943 -9.780 -5.101 1.00 2.06 O ATOM 0 H GLU A 68 11.657 -8.720 -4.253 1.00 0.40 H new ATOM 0 HA GLU A 68 13.750 -6.851 -3.701 1.00 0.39 H new ATOM 0 HB2 GLU A 68 12.250 -7.501 -6.275 1.00 0.41 H new ATOM 0 HB3 GLU A 68 13.790 -6.671 -6.169 1.00 0.41 H new ATOM 0 HG2 GLU A 68 13.296 -9.523 -5.253 1.00 0.97 H new ATOM 0 HG3 GLU A 68 13.981 -9.076 -6.803 1.00 0.97 H new ATOM 1006 N LEU A 69 10.795 -5.757 -4.668 1.00 0.32 N ATOM 1007 CA LEU A 69 9.927 -4.590 -4.767 1.00 0.33 C ATOM 1008 C LEU A 69 9.933 -3.778 -3.477 1.00 0.34 C ATOM 1009 O LEU A 69 10.256 -2.589 -3.490 1.00 0.44 O ATOM 1010 CB LEU A 69 8.512 -5.052 -5.105 1.00 0.38 C ATOM 1011 CG LEU A 69 7.376 -4.218 -4.506 1.00 0.44 C ATOM 1012 CD1 LEU A 69 7.279 -2.879 -5.211 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.060 -4.982 -4.577 1.00 0.67 C ATOM 0 H LEU A 69 10.331 -6.639 -4.885 1.00 0.32 H new ATOM 0 HA LEU A 69 10.301 -3.939 -5.557 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.401 -5.056 -6.189 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.397 -6.082 -4.769 1.00 0.38 H new ATOM 0 HG LEU A 69 7.593 -4.028 -3.455 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.467 -2.296 -4.775 1.00 0.66 H new ATOM 0 HD12 LEU A 69 8.218 -2.338 -5.094 1.00 0.66 H new ATOM 0 HD13 LEU A 69 7.082 -3.039 -6.271 1.00 0.66 H new ATOM 0 HD21 LEU A 69 5.263 -4.375 -4.147 1.00 0.67 H new ATOM 0 HD22 LEU A 69 5.825 -5.205 -5.618 1.00 0.67 H new ATOM 0 HD23 LEU A 69 6.149 -5.913 -4.017 1.00 0.67 H new ATOM 1025 N LEU A 70 9.584 -4.422 -2.365 1.00 0.39 N ATOM 1026 CA LEU A 70 9.567 -3.744 -1.076 1.00 0.47 C ATOM 1027 C LEU A 70 10.881 -3.016 -0.866 1.00 0.44 C ATOM 1028 O LEU A 70 10.899 -1.897 -0.374 1.00 0.47 O ATOM 1029 CB LEU A 70 9.314 -4.716 0.082 1.00 0.62 C ATOM 1030 CG LEU A 70 7.844 -4.923 0.463 1.00 0.99 C ATOM 1031 CD1 LEU A 70 7.074 -5.587 -0.665 1.00 1.48 C ATOM 1032 CD2 LEU A 70 7.736 -5.745 1.738 1.00 1.65 C ATOM 0 H LEU A 70 9.312 -5.404 -2.333 1.00 0.39 H new ATOM 0 HA LEU A 70 8.744 -3.029 -1.086 1.00 0.47 H new ATOM 0 HB2 LEU A 70 9.743 -5.683 -0.179 1.00 0.62 H new ATOM 0 HB3 LEU A 70 9.851 -4.355 0.959 1.00 0.62 H new ATOM 0 HG LEU A 70 7.401 -3.943 0.641 1.00 0.99 H new ATOM 0 HD11 LEU A 70 6.034 -5.721 -0.366 1.00 1.48 H new ATOM 0 HD12 LEU A 70 7.118 -4.959 -1.555 1.00 1.48 H new ATOM 0 HD13 LEU A 70 7.517 -6.559 -0.885 1.00 1.48 H new ATOM 0 HD21 LEU A 70 6.686 -5.883 1.994 1.00 1.65 H new ATOM 0 HD22 LEU A 70 8.202 -6.718 1.584 1.00 1.65 H new ATOM 0 HD23 LEU A 70 8.243 -5.224 2.551 1.00 1.65 H new ATOM 1044 N ASN A 71 11.980 -3.648 -1.256 1.00 0.46 N ATOM 1045 CA ASN A 71 13.285 -3.020 -1.116 1.00 0.50 C ATOM 1046 C ASN A 71 13.309 -1.655 -1.804 1.00 0.41 C ATOM 1047 O ASN A 71 13.563 -0.647 -1.161 1.00 0.44 O ATOM 1048 CB ASN A 71 14.392 -3.916 -1.676 1.00 0.59 C ATOM 1049 CG ASN A 71 14.720 -5.074 -0.752 1.00 0.79 C ATOM 1050 OD1 ASN A 71 15.098 -4.872 0.401 1.00 1.59 O ATOM 1051 ND2 ASN A 71 14.582 -6.294 -1.256 1.00 0.72 N ATOM 0 H ASN A 71 11.994 -4.582 -1.666 1.00 0.46 H new ATOM 0 HA ASN A 71 13.469 -2.875 -0.052 1.00 0.50 H new ATOM 0 HB2 ASN A 71 14.085 -4.305 -2.647 1.00 0.59 H new ATOM 0 HB3 ASN A 71 15.290 -3.320 -1.841 1.00 0.59 H new ATOM 0 HD21 ASN A 71 14.792 -7.110 -0.681 1.00 0.72 H new ATOM 0 HD22 ASN A 71 14.265 -6.416 -2.218 1.00 0.72 H new ATOM 1058 N HIS A 72 13.041 -1.627 -3.111 1.00 0.37 N ATOM 1059 CA HIS A 72 13.047 -0.377 -3.866 1.00 0.35 C ATOM 1060 C HIS A 72 12.217 0.701 -3.182 1.00 0.32 C ATOM 1061 O HIS A 72 12.688 1.823 -2.992 1.00 0.35 O ATOM 1062 CB HIS A 72 12.541 -0.617 -5.288 1.00 0.39 C ATOM 1063 CG HIS A 72 13.436 -1.517 -6.077 1.00 0.57 C ATOM 1064 ND1 HIS A 72 14.748 -1.211 -6.361 1.00 1.07 N ATOM 1065 CD2 HIS A 72 13.206 -2.730 -6.631 1.00 0.61 C ATOM 1066 CE1 HIS A 72 15.289 -2.194 -7.056 1.00 1.40 C ATOM 1067 NE2 HIS A 72 14.373 -3.130 -7.232 1.00 1.11 N ATOM 0 H HIS A 72 12.818 -2.454 -3.665 1.00 0.37 H new ATOM 0 HA HIS A 72 14.076 -0.020 -3.908 1.00 0.35 H new ATOM 0 HB2 HIS A 72 11.542 -1.052 -5.245 1.00 0.39 H new ATOM 0 HB3 HIS A 72 12.450 0.340 -5.803 1.00 0.39 H new ATOM 0 HD2 HIS A 72 12.277 -3.281 -6.605 1.00 0.61 H new ATOM 0 HE1 HIS A 72 16.306 -2.228 -7.419 1.00 1.40 H new ATOM 0 HE2 HIS A 72 14.511 -4.008 -7.733 1.00 1.11 H new ATOM 1076 N THR A 73 10.988 0.367 -2.812 1.00 0.34 N ATOM 1077 CA THR A 73 10.119 1.334 -2.150 1.00 0.38 C ATOM 1078 C THR A 73 10.637 1.693 -0.750 1.00 0.36 C ATOM 1079 O THR A 73 10.891 2.861 -0.453 1.00 0.36 O ATOM 1080 CB THR A 73 8.703 0.776 -2.067 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.731 -0.586 -1.686 1.00 0.77 O ATOM 1082 CG2 THR A 73 7.939 0.879 -3.369 1.00 0.61 C ATOM 0 H THR A 73 10.573 -0.554 -2.956 1.00 0.34 H new ATOM 0 HA THR A 73 10.114 2.250 -2.741 1.00 0.38 H new ATOM 0 HB THR A 73 8.191 1.386 -1.322 1.00 0.47 H new ATOM 0 HG1 THR A 73 7.960 -1.050 -2.075 1.00 0.77 H new ATOM 0 HG21 THR A 73 6.940 0.464 -3.238 1.00 0.61 H new ATOM 0 HG22 THR A 73 7.861 1.926 -3.663 1.00 0.61 H new ATOM 0 HG23 THR A 73 8.465 0.322 -4.144 1.00 0.61 H new ATOM 1090 N GLN A 74 10.793 0.680 0.096 1.00 0.39 N ATOM 1091 CA GLN A 74 11.283 0.861 1.465 1.00 0.42 C ATOM 1092 C GLN A 74 12.656 1.524 1.487 1.00 0.41 C ATOM 1093 O GLN A 74 13.080 2.044 2.515 1.00 0.50 O ATOM 1094 CB GLN A 74 11.361 -0.486 2.190 1.00 0.49 C ATOM 1095 CG GLN A 74 10.019 -1.185 2.346 1.00 1.45 C ATOM 1096 CD GLN A 74 9.065 -0.458 3.282 1.00 1.87 C ATOM 1097 OE1 GLN A 74 7.928 -0.889 3.476 1.00 2.25 O ATOM 1098 NE2 GLN A 74 9.519 0.642 3.876 1.00 2.54 N ATOM 0 H GLN A 74 10.585 -0.289 -0.144 1.00 0.39 H new ATOM 0 HA GLN A 74 10.575 1.513 1.977 1.00 0.42 H new ATOM 0 HB2 GLN A 74 12.039 -1.142 1.644 1.00 0.49 H new ATOM 0 HB3 GLN A 74 11.795 -0.330 3.178 1.00 0.49 H new ATOM 0 HG2 GLN A 74 9.552 -1.282 1.366 1.00 1.45 H new ATOM 0 HG3 GLN A 74 10.185 -2.195 2.721 1.00 1.45 H new ATOM 0 HE21 GLN A 74 10.467 0.968 3.690 1.00 2.54 H new ATOM 0 HE22 GLN A 74 8.919 1.160 4.518 1.00 2.54 H new ATOM 1107 N ARG A 75 13.342 1.524 0.352 1.00 0.37 N ATOM 1108 CA ARG A 75 14.655 2.157 0.272 1.00 0.41 C ATOM 1109 C ARG A 75 14.458 3.650 0.236 1.00 0.39 C ATOM 1110 O ARG A 75 15.128 4.408 0.939 1.00 0.43 O ATOM 1111 CB ARG A 75 15.417 1.709 -0.974 1.00 0.48 C ATOM 1112 CG ARG A 75 16.078 0.352 -0.833 1.00 0.89 C ATOM 1113 CD ARG A 75 16.613 -0.133 -2.168 1.00 0.88 C ATOM 1114 NE ARG A 75 17.700 0.706 -2.666 1.00 1.59 N ATOM 1115 CZ ARG A 75 18.872 0.842 -2.051 1.00 2.26 C ATOM 1116 NH1 ARG A 75 19.118 0.184 -0.926 1.00 2.72 N ATOM 1117 NH2 ARG A 75 19.804 1.635 -2.566 1.00 3.06 N ATOM 0 H ARG A 75 13.018 1.099 -0.517 1.00 0.37 H new ATOM 0 HA ARG A 75 15.244 1.864 1.141 1.00 0.41 H new ATOM 0 HB2 ARG A 75 14.729 1.681 -1.819 1.00 0.48 H new ATOM 0 HB3 ARG A 75 16.180 2.452 -1.208 1.00 0.48 H new ATOM 0 HG2 ARG A 75 16.893 0.413 -0.111 1.00 0.89 H new ATOM 0 HG3 ARG A 75 15.359 -0.368 -0.442 1.00 0.89 H new ATOM 0 HD2 ARG A 75 16.967 -1.159 -2.064 1.00 0.88 H new ATOM 0 HD3 ARG A 75 15.804 -0.147 -2.898 1.00 0.88 H new ATOM 0 HE ARG A 75 17.552 1.217 -3.536 1.00 1.59 H new ATOM 0 HH11 ARG A 75 18.407 -0.430 -0.528 1.00 2.72 H new ATOM 0 HH12 ARG A 75 20.018 0.292 -0.459 1.00 2.72 H new ATOM 0 HH21 ARG A 75 19.622 2.140 -3.433 1.00 3.06 H new ATOM 0 HH22 ARG A 75 20.702 1.739 -2.094 1.00 3.06 H new ATOM 1131 N ILE A 76 13.506 4.052 -0.584 1.00 0.38 N ATOM 1132 CA ILE A 76 13.164 5.449 -0.728 1.00 0.41 C ATOM 1133 C ILE A 76 12.790 6.047 0.617 1.00 0.42 C ATOM 1134 O ILE A 76 13.443 6.973 1.083 1.00 0.44 O ATOM 1135 CB ILE A 76 11.991 5.641 -1.702 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.352 5.079 -3.078 1.00 0.55 C ATOM 1137 CG2 ILE A 76 11.613 7.113 -1.793 1.00 0.50 C ATOM 1138 CD1 ILE A 76 13.565 5.732 -3.711 1.00 0.83 C ATOM 0 H ILE A 76 12.953 3.422 -1.165 1.00 0.38 H new ATOM 0 HA ILE A 76 14.042 5.957 -1.127 1.00 0.41 H new ATOM 0 HB ILE A 76 11.126 5.094 -1.327 1.00 0.45 H new ATOM 0 HG12 ILE A 76 12.535 4.008 -2.985 1.00 0.55 H new ATOM 0 HG13 ILE A 76 11.498 5.200 -3.744 1.00 0.55 H new ATOM 0 HG21 ILE A 76 10.781 7.233 -2.487 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.319 7.475 -0.808 1.00 0.50 H new ATOM 0 HG23 ILE A 76 12.468 7.687 -2.150 1.00 0.50 H new ATOM 0 HD11 ILE A 76 13.756 5.279 -4.684 1.00 0.83 H new ATOM 0 HD12 ILE A 76 13.379 6.799 -3.838 1.00 0.83 H new ATOM 0 HD13 ILE A 76 14.433 5.589 -3.067 1.00 0.83 H new ATOM 1150 N GLU A 77 11.737 5.513 1.241 1.00 0.44 N ATOM 1151 CA GLU A 77 11.292 6.018 2.535 1.00 0.47 C ATOM 1152 C GLU A 77 12.404 5.921 3.575 1.00 0.48 C ATOM 1153 O GLU A 77 12.395 6.640 4.573 1.00 0.54 O ATOM 1154 CB GLU A 77 10.014 5.302 3.010 1.00 0.50 C ATOM 1155 CG GLU A 77 10.167 3.832 3.388 1.00 0.66 C ATOM 1156 CD GLU A 77 11.004 3.622 4.636 1.00 0.97 C ATOM 1157 OE1 GLU A 77 10.629 4.165 5.698 1.00 1.43 O ATOM 1158 OE2 GLU A 77 12.026 2.912 4.559 1.00 1.32 O ATOM 0 H GLU A 77 11.184 4.739 0.873 1.00 0.44 H new ATOM 0 HA GLU A 77 11.046 7.073 2.411 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.621 5.839 3.874 1.00 0.50 H new ATOM 0 HB3 GLU A 77 9.266 5.377 2.221 1.00 0.50 H new ATOM 0 HG2 GLU A 77 9.179 3.398 3.543 1.00 0.66 H new ATOM 0 HG3 GLU A 77 10.624 3.295 2.557 1.00 0.66 H new ATOM 1165 N LEU A 78 13.375 5.046 3.325 1.00 0.45 N ATOM 1166 CA LEU A 78 14.502 4.883 4.233 1.00 0.49 C ATOM 1167 C LEU A 78 15.432 6.087 4.130 1.00 0.49 C ATOM 1168 O LEU A 78 16.047 6.499 5.113 1.00 0.59 O ATOM 1169 CB LEU A 78 15.272 3.597 3.916 1.00 0.53 C ATOM 1170 CG LEU A 78 16.534 3.368 4.752 1.00 0.88 C ATOM 1171 CD1 LEU A 78 16.194 3.297 6.234 1.00 1.66 C ATOM 1172 CD2 LEU A 78 17.244 2.101 4.306 1.00 1.52 C ATOM 0 H LEU A 78 13.402 4.442 2.504 1.00 0.45 H new ATOM 0 HA LEU A 78 14.118 4.813 5.251 1.00 0.49 H new ATOM 0 HB2 LEU A 78 14.603 2.748 4.058 1.00 0.53 H new ATOM 0 HB3 LEU A 78 15.551 3.610 2.862 1.00 0.53 H new ATOM 0 HG LEU A 78 17.205 4.213 4.597 1.00 0.88 H new ATOM 0 HD11 LEU A 78 17.106 3.134 6.809 1.00 1.66 H new ATOM 0 HD12 LEU A 78 15.731 4.233 6.546 1.00 1.66 H new ATOM 0 HD13 LEU A 78 15.502 2.473 6.409 1.00 1.66 H new ATOM 0 HD21 LEU A 78 18.139 1.953 4.911 1.00 1.52 H new ATOM 0 HD22 LEU A 78 16.577 1.248 4.430 1.00 1.52 H new ATOM 0 HD23 LEU A 78 17.526 2.192 3.257 1.00 1.52 H new ATOM 1184 N GLN A 79 15.517 6.648 2.929 1.00 0.47 N ATOM 1185 CA GLN A 79 16.356 7.812 2.679 1.00 0.52 C ATOM 1186 C GLN A 79 15.491 9.040 2.410 1.00 0.53 C ATOM 1187 O GLN A 79 16.001 10.128 2.143 1.00 0.72 O ATOM 1188 CB GLN A 79 17.279 7.554 1.486 1.00 0.63 C ATOM 1189 CG GLN A 79 18.154 6.322 1.648 1.00 1.12 C ATOM 1190 CD GLN A 79 19.061 6.091 0.456 1.00 1.67 C ATOM 1191 OE1 GLN A 79 18.593 5.895 -0.665 1.00 2.24 O ATOM 1192 NE2 GLN A 79 20.368 6.116 0.692 1.00 2.32 N ATOM 0 H GLN A 79 15.011 6.312 2.109 1.00 0.47 H new ATOM 0 HA GLN A 79 16.965 7.996 3.564 1.00 0.52 H new ATOM 0 HB2 GLN A 79 16.674 7.443 0.586 1.00 0.63 H new ATOM 0 HB3 GLN A 79 17.917 8.425 1.336 1.00 0.63 H new ATOM 0 HG2 GLN A 79 18.761 6.428 2.547 1.00 1.12 H new ATOM 0 HG3 GLN A 79 17.520 5.447 1.793 1.00 1.12 H new ATOM 0 HE21 GLN A 79 20.712 6.282 1.638 1.00 2.32 H new ATOM 0 HE22 GLN A 79 21.027 5.969 -0.072 1.00 2.32 H new ATOM 1201 N GLN A 80 14.177 8.848 2.485 1.00 0.61 N ATOM 1202 CA GLN A 80 13.225 9.926 2.253 1.00 0.72 C ATOM 1203 C GLN A 80 12.803 10.542 3.583 1.00 0.88 C ATOM 1204 O GLN A 80 12.726 11.763 3.716 1.00 1.15 O ATOM 1205 CB GLN A 80 12.005 9.402 1.476 1.00 0.74 C ATOM 1206 CG GLN A 80 11.009 10.482 1.075 1.00 1.27 C ATOM 1207 CD GLN A 80 10.277 11.087 2.257 1.00 1.51 C ATOM 1208 OE1 GLN A 80 9.625 10.381 3.027 1.00 2.00 O ATOM 1209 NE2 GLN A 80 10.381 12.403 2.407 1.00 2.07 N ATOM 0 H GLN A 80 13.747 7.950 2.706 1.00 0.61 H new ATOM 0 HA GLN A 80 13.701 10.700 1.651 1.00 0.72 H new ATOM 0 HB2 GLN A 80 12.352 8.892 0.577 1.00 0.74 H new ATOM 0 HB3 GLN A 80 11.492 8.659 2.086 1.00 0.74 H new ATOM 0 HG2 GLN A 80 11.535 11.272 0.539 1.00 1.27 H new ATOM 0 HG3 GLN A 80 10.281 10.057 0.384 1.00 1.27 H new ATOM 0 HE21 GLN A 80 10.932 12.950 1.745 1.00 2.07 H new ATOM 0 HE22 GLN A 80 9.910 12.867 3.184 1.00 2.07 H new ATOM 1218 N GLY A 81 12.546 9.686 4.569 1.00 0.99 N ATOM 1219 CA GLY A 81 12.150 10.158 5.883 1.00 1.25 C ATOM 1220 C GLY A 81 13.333 10.276 6.823 1.00 1.79 C ATOM 1221 O GLY A 81 13.214 9.993 8.015 1.00 2.18 O ATOM 0 H GLY A 81 12.605 8.672 4.480 1.00 0.99 H new ATOM 0 HA2 GLY A 81 11.664 11.129 5.788 1.00 1.25 H new ATOM 0 HA3 GLY A 81 11.416 9.474 6.308 1.00 1.25 H new ATOM 1225 N ARG A 82 14.480 10.681 6.273 1.00 2.09 N ATOM 1226 CA ARG A 82 15.712 10.830 7.049 1.00 2.89 C ATOM 1227 C ARG A 82 16.285 9.465 7.417 1.00 2.71 C ATOM 1228 O ARG A 82 15.542 8.504 7.614 1.00 3.22 O ATOM 1229 CB ARG A 82 15.471 11.662 8.314 1.00 3.76 C ATOM 1230 CG ARG A 82 15.046 13.095 8.038 1.00 4.75 C ATOM 1231 CD ARG A 82 16.131 13.868 7.304 1.00 5.59 C ATOM 1232 NE ARG A 82 15.748 15.259 7.069 1.00 6.37 N ATOM 1233 CZ ARG A 82 16.524 16.144 6.449 1.00 7.14 C ATOM 1234 NH1 ARG A 82 17.720 15.784 6.002 1.00 7.29 N ATOM 1235 NH2 ARG A 82 16.105 17.390 6.277 1.00 8.02 N ATOM 0 H ARG A 82 14.580 10.913 5.285 1.00 2.09 H new ATOM 0 HA ARG A 82 16.435 11.357 6.427 1.00 2.89 H new ATOM 0 HB2 ARG A 82 14.704 11.176 8.916 1.00 3.76 H new ATOM 0 HB3 ARG A 82 16.384 11.673 8.909 1.00 3.76 H new ATOM 0 HG2 ARG A 82 14.132 13.096 7.444 1.00 4.75 H new ATOM 0 HG3 ARG A 82 14.815 13.595 8.979 1.00 4.75 H new ATOM 0 HD2 ARG A 82 17.053 13.839 7.885 1.00 5.59 H new ATOM 0 HD3 ARG A 82 16.340 13.383 6.350 1.00 5.59 H new ATOM 0 HE ARG A 82 14.834 15.569 7.399 1.00 6.37 H new ATOM 0 HH11 ARG A 82 18.047 14.827 6.133 1.00 7.29 H new ATOM 0 HH12 ARG A 82 18.313 16.465 5.527 1.00 7.29 H new ATOM 0 HH21 ARG A 82 15.187 17.671 6.620 1.00 8.02 H new ATOM 0 HH22 ARG A 82 16.701 18.067 5.801 1.00 8.02 H new ATOM 1249 N VAL A 83 17.610 9.388 7.502 1.00 2.65 N ATOM 1250 CA VAL A 83 18.284 8.138 7.840 1.00 2.95 C ATOM 1251 C VAL A 83 18.112 7.807 9.321 1.00 2.78 C ATOM 1252 O VAL A 83 19.039 7.956 10.116 1.00 3.48 O ATOM 1253 CB VAL A 83 19.787 8.200 7.504 1.00 3.70 C ATOM 1254 CG1 VAL A 83 20.452 6.854 7.752 1.00 4.50 C ATOM 1255 CG2 VAL A 83 19.992 8.646 6.063 1.00 4.33 C ATOM 0 H VAL A 83 18.238 10.176 7.342 1.00 2.65 H new ATOM 0 HA VAL A 83 17.822 7.354 7.240 1.00 2.95 H new ATOM 0 HB VAL A 83 20.255 8.933 8.161 1.00 3.70 H new ATOM 0 HG11 VAL A 83 21.512 6.922 7.508 1.00 4.50 H new ATOM 0 HG12 VAL A 83 20.338 6.579 8.801 1.00 4.50 H new ATOM 0 HG13 VAL A 83 19.983 6.096 7.125 1.00 4.50 H new ATOM 0 HG21 VAL A 83 21.059 8.684 5.842 1.00 4.33 H new ATOM 0 HG22 VAL A 83 19.508 7.938 5.391 1.00 4.33 H new ATOM 0 HG23 VAL A 83 19.557 9.635 5.923 1.00 4.33 H new ATOM 1265 N ARG A 84 16.916 7.353 9.679 1.00 2.54 N ATOM 1266 CA ARG A 84 16.608 6.992 11.057 1.00 3.37 C ATOM 1267 C ARG A 84 15.679 5.783 11.096 1.00 3.75 C ATOM 1268 O ARG A 84 15.035 5.517 12.111 1.00 4.35 O ATOM 1269 CB ARG A 84 15.953 8.168 11.787 1.00 3.92 C ATOM 1270 CG ARG A 84 16.831 9.407 11.884 1.00 4.19 C ATOM 1271 CD ARG A 84 18.081 9.149 12.712 1.00 5.23 C ATOM 1272 NE ARG A 84 18.938 10.329 12.794 1.00 5.75 N ATOM 1273 CZ ARG A 84 18.575 11.470 13.376 1.00 6.40 C ATOM 1274 NH1 ARG A 84 17.386 11.581 13.951 1.00 6.67 N ATOM 1275 NH2 ARG A 84 19.407 12.503 13.385 1.00 7.08 N ATOM 0 H ARG A 84 16.140 7.226 9.029 1.00 2.54 H new ATOM 0 HA ARG A 84 17.542 6.740 11.559 1.00 3.37 H new ATOM 0 HB2 ARG A 84 15.028 8.431 11.273 1.00 3.92 H new ATOM 0 HB3 ARG A 84 15.680 7.850 12.793 1.00 3.92 H new ATOM 0 HG2 ARG A 84 17.118 9.729 10.883 1.00 4.19 H new ATOM 0 HG3 ARG A 84 16.261 10.222 12.330 1.00 4.19 H new ATOM 0 HD2 ARG A 84 17.793 8.840 13.717 1.00 5.23 H new ATOM 0 HD3 ARG A 84 18.642 8.324 12.274 1.00 5.23 H new ATOM 0 HE ARG A 84 19.869 10.276 12.381 1.00 5.75 H new ATOM 0 HH11 ARG A 84 16.743 10.789 13.949 1.00 6.67 H new ATOM 0 HH12 ARG A 84 17.114 12.458 14.395 1.00 6.67 H new ATOM 0 HH21 ARG A 84 20.324 12.423 12.946 1.00 7.08 H new ATOM 0 HH22 ARG A 84 19.129 13.377 13.831 1.00 7.08 H new ATOM 1289 N LYS A 85 15.610 5.062 9.976 1.00 4.00 N ATOM 1290 CA LYS A 85 14.754 3.885 9.872 1.00 4.93 C ATOM 1291 C LYS A 85 13.295 4.261 10.108 1.00 5.06 C ATOM 1292 O LYS A 85 12.814 4.239 11.242 1.00 5.81 O ATOM 1293 CB LYS A 85 15.193 2.811 10.871 1.00 5.72 C ATOM 1294 CG LYS A 85 16.616 2.315 10.651 1.00 6.56 C ATOM 1295 CD LYS A 85 16.769 1.612 9.307 1.00 7.22 C ATOM 1296 CE LYS A 85 15.915 0.357 9.232 1.00 8.23 C ATOM 1297 NZ LYS A 85 16.060 -0.339 7.924 1.00 8.70 N ATOM 0 H LYS A 85 16.138 5.275 9.129 1.00 4.00 H new ATOM 0 HA LYS A 85 14.850 3.481 8.864 1.00 4.93 H new ATOM 0 HB2 LYS A 85 15.109 3.211 11.881 1.00 5.72 H new ATOM 0 HB3 LYS A 85 14.509 1.965 10.806 1.00 5.72 H new ATOM 0 HG2 LYS A 85 17.306 3.157 10.701 1.00 6.56 H new ATOM 0 HG3 LYS A 85 16.890 1.630 11.453 1.00 6.56 H new ATOM 0 HD2 LYS A 85 16.486 2.294 8.505 1.00 7.22 H new ATOM 0 HD3 LYS A 85 17.815 1.351 9.149 1.00 7.22 H new ATOM 0 HE2 LYS A 85 16.197 -0.322 10.037 1.00 8.23 H new ATOM 0 HE3 LYS A 85 14.869 0.620 9.388 1.00 8.23 H new ATOM 0 HZ1 LYS A 85 15.461 -1.189 7.915 1.00 8.70 H new ATOM 0 HZ2 LYS A 85 15.767 0.299 7.157 1.00 8.70 H new ATOM 0 HZ3 LYS A 85 17.053 -0.614 7.785 1.00 8.70 H new ATOM 1311 N ALA A 86 12.599 4.615 9.026 1.00 4.58 N ATOM 1312 CA ALA A 86 11.193 5.007 9.101 1.00 4.96 C ATOM 1313 C ALA A 86 11.015 6.294 9.887 1.00 4.23 C ATOM 1314 O ALA A 86 9.888 6.713 10.154 1.00 4.67 O ATOM 1315 CB ALA A 86 10.363 3.921 9.745 1.00 5.68 C ATOM 0 H ALA A 86 12.990 4.638 8.084 1.00 4.58 H new ATOM 0 HA ALA A 86 10.854 5.167 8.077 1.00 4.96 H new ATOM 0 HB1 ALA A 86 9.321 4.237 9.789 1.00 5.68 H new ATOM 0 HB2 ALA A 86 10.440 3.007 9.157 1.00 5.68 H new ATOM 0 HB3 ALA A 86 10.728 3.734 10.755 1.00 5.68 H new ATOM 1321 N GLU A 87 12.127 6.910 10.262 1.00 3.27 N ATOM 1322 CA GLU A 87 12.093 8.146 11.025 1.00 2.78 C ATOM 1323 C GLU A 87 11.494 7.910 12.411 1.00 2.78 C ATOM 1324 O GLU A 87 10.302 7.631 12.544 1.00 3.47 O ATOM 1325 CB GLU A 87 11.279 9.201 10.277 1.00 2.42 C ATOM 1326 CG GLU A 87 11.615 10.612 10.690 1.00 3.19 C ATOM 1327 CD GLU A 87 11.213 10.927 12.117 1.00 3.92 C ATOM 1328 OE1 GLU A 87 10.006 10.835 12.428 1.00 4.46 O ATOM 1329 OE2 GLU A 87 12.104 11.266 12.923 1.00 4.37 O ATOM 0 H GLU A 87 13.065 6.572 10.049 1.00 3.27 H new ATOM 0 HA GLU A 87 13.116 8.503 11.147 1.00 2.78 H new ATOM 0 HB2 GLU A 87 11.451 9.092 9.206 1.00 2.42 H new ATOM 0 HB3 GLU A 87 10.218 9.022 10.449 1.00 2.42 H new ATOM 0 HG2 GLU A 87 12.687 10.771 10.578 1.00 3.19 H new ATOM 0 HG3 GLU A 87 11.117 11.309 10.016 1.00 3.19 H new ATOM 1336 N ARG A 88 12.327 8.023 13.441 1.00 2.49 N ATOM 1337 CA ARG A 88 11.874 7.820 14.815 1.00 2.70 C ATOM 1338 C ARG A 88 11.843 9.135 15.586 1.00 2.60 C ATOM 1339 O ARG A 88 12.869 9.599 16.085 1.00 3.18 O ATOM 1340 CB ARG A 88 12.782 6.817 15.530 1.00 3.45 C ATOM 1341 CG ARG A 88 12.819 5.451 14.866 1.00 4.14 C ATOM 1342 CD ARG A 88 13.708 4.484 15.630 1.00 4.97 C ATOM 1343 NE ARG A 88 15.083 4.966 15.734 1.00 5.51 N ATOM 1344 CZ ARG A 88 16.049 4.308 16.367 1.00 6.30 C ATOM 1345 NH1 ARG A 88 15.790 3.148 16.956 1.00 6.63 N ATOM 1346 NH2 ARG A 88 17.276 4.810 16.413 1.00 7.05 N ATOM 0 H ARG A 88 13.317 8.253 13.352 1.00 2.49 H new ATOM 0 HA ARG A 88 10.860 7.423 14.778 1.00 2.70 H new ATOM 0 HB2 ARG A 88 13.794 7.220 15.570 1.00 3.45 H new ATOM 0 HB3 ARG A 88 12.443 6.702 16.560 1.00 3.45 H new ATOM 0 HG2 ARG A 88 11.808 5.047 14.805 1.00 4.14 H new ATOM 0 HG3 ARG A 88 13.184 5.552 13.844 1.00 4.14 H new ATOM 0 HD2 ARG A 88 13.301 4.331 16.630 1.00 4.97 H new ATOM 0 HD3 ARG A 88 13.701 3.515 15.131 1.00 4.97 H new ATOM 0 HE ARG A 88 15.315 5.858 15.296 1.00 5.51 H new ATOM 0 HH11 ARG A 88 14.848 2.759 16.924 1.00 6.63 H new ATOM 0 HH12 ARG A 88 16.533 2.645 17.441 1.00 6.63 H new ATOM 0 HH21 ARG A 88 17.479 5.702 15.962 1.00 7.05 H new ATOM 0 HH22 ARG A 88 18.016 4.304 16.899 1.00 7.05 H new ATOM 1360 N TRP A 89 10.656 9.727 15.681 1.00 2.49 N ATOM 1361 CA TRP A 89 10.471 10.989 16.391 1.00 2.93 C ATOM 1362 C TRP A 89 8.995 11.375 16.410 1.00 2.93 C ATOM 1363 O TRP A 89 8.551 12.148 17.260 1.00 3.71 O ATOM 1364 CB TRP A 89 11.295 12.098 15.729 1.00 3.69 C ATOM 1365 CG TRP A 89 11.174 13.431 16.408 1.00 4.09 C ATOM 1366 CD1 TRP A 89 10.875 14.624 15.816 1.00 4.50 C ATOM 1367 CD2 TRP A 89 11.355 13.708 17.803 1.00 4.70 C ATOM 1368 NE1 TRP A 89 10.857 15.626 16.756 1.00 5.25 N ATOM 1369 CE2 TRP A 89 11.147 15.089 17.983 1.00 5.32 C ATOM 1370 CE3 TRP A 89 11.669 12.925 18.917 1.00 5.16 C ATOM 1371 CZ2 TRP A 89 11.246 15.702 19.230 1.00 6.18 C ATOM 1372 CZ3 TRP A 89 11.767 13.533 20.154 1.00 6.02 C ATOM 1373 CH2 TRP A 89 11.555 14.910 20.302 1.00 6.44 C ATOM 0 H TRP A 89 9.801 9.349 15.272 1.00 2.49 H new ATOM 0 HA TRP A 89 10.814 10.862 17.418 1.00 2.93 H new ATOM 0 HB2 TRP A 89 12.344 11.801 15.717 1.00 3.69 H new ATOM 0 HB3 TRP A 89 10.981 12.200 14.690 1.00 3.69 H new ATOM 0 HD1 TRP A 89 10.681 14.760 14.762 1.00 4.50 H new ATOM 0 HE1 TRP A 89 10.660 16.609 16.571 1.00 5.25 H new ATOM 0 HE3 TRP A 89 11.832 11.863 18.813 1.00 5.16 H new ATOM 0 HZ2 TRP A 89 11.085 16.764 19.346 1.00 6.18 H new ATOM 0 HZ3 TRP A 89 12.011 12.937 21.021 1.00 6.02 H new ATOM 0 HH2 TRP A 89 11.637 15.355 21.282 1.00 6.44 H new ATOM 1384 N GLY A 90 8.245 10.824 15.463 1.00 2.39 N ATOM 1385 CA GLY A 90 6.825 11.108 15.367 1.00 2.51 C ATOM 1386 C GLY A 90 6.280 10.794 13.987 1.00 2.11 C ATOM 1387 O GLY A 90 6.157 9.624 13.621 1.00 2.15 O ATOM 0 H GLY A 90 8.598 10.181 14.755 1.00 2.39 H new ATOM 0 HA2 GLY A 90 6.286 10.523 16.112 1.00 2.51 H new ATOM 0 HA3 GLY A 90 6.648 12.159 15.597 1.00 2.51 H new ATOM 1391 N PRO A 91 5.952 11.821 13.185 1.00 1.87 N ATOM 1392 CA PRO A 91 5.430 11.627 11.832 1.00 1.71 C ATOM 1393 C PRO A 91 6.542 11.274 10.846 1.00 1.71 C ATOM 1394 O PRO A 91 7.561 10.702 11.233 1.00 2.14 O ATOM 1395 CB PRO A 91 4.819 12.989 11.503 1.00 1.86 C ATOM 1396 CG PRO A 91 5.653 13.961 12.265 1.00 2.00 C ATOM 1397 CD PRO A 91 6.073 13.254 13.528 1.00 1.98 C ATOM 0 HA PRO A 91 4.719 10.804 11.766 1.00 1.71 H new ATOM 0 HB2 PRO A 91 4.851 13.191 10.432 1.00 1.86 H new ATOM 0 HB3 PRO A 91 3.773 13.039 11.806 1.00 1.86 H new ATOM 0 HG2 PRO A 91 6.522 14.268 11.683 1.00 2.00 H new ATOM 0 HG3 PRO A 91 5.087 14.864 12.494 1.00 2.00 H new ATOM 0 HD2 PRO A 91 7.093 13.513 13.811 1.00 1.98 H new ATOM 0 HD3 PRO A 91 5.431 13.520 14.368 1.00 1.98 H new ATOM 1405 N ARG A 92 6.343 11.621 9.576 1.00 2.00 N ATOM 1406 CA ARG A 92 7.336 11.344 8.537 1.00 2.09 C ATOM 1407 C ARG A 92 7.611 9.847 8.448 1.00 1.39 C ATOM 1408 O ARG A 92 8.463 9.328 9.167 1.00 1.88 O ATOM 1409 CB ARG A 92 8.634 12.097 8.839 1.00 3.24 C ATOM 1410 CG ARG A 92 9.603 12.146 7.672 1.00 4.14 C ATOM 1411 CD ARG A 92 10.870 12.902 8.039 1.00 4.91 C ATOM 1412 NE ARG A 92 11.717 13.160 6.877 1.00 5.90 N ATOM 1413 CZ ARG A 92 11.360 13.939 5.858 1.00 6.64 C ATOM 1414 NH1 ARG A 92 10.178 14.542 5.863 1.00 6.67 N ATOM 1415 NH2 ARG A 92 12.187 14.121 4.838 1.00 7.60 N ATOM 0 H ARG A 92 5.504 12.094 9.241 1.00 2.00 H new ATOM 0 HA ARG A 92 6.941 11.683 7.579 1.00 2.09 H new ATOM 0 HB2 ARG A 92 8.390 13.116 9.139 1.00 3.24 H new ATOM 0 HB3 ARG A 92 9.127 11.625 9.688 1.00 3.24 H new ATOM 0 HG2 ARG A 92 9.858 11.132 7.365 1.00 4.14 H new ATOM 0 HG3 ARG A 92 9.124 12.626 6.819 1.00 4.14 H new ATOM 0 HD2 ARG A 92 10.603 13.849 8.508 1.00 4.91 H new ATOM 0 HD3 ARG A 92 11.432 12.328 8.776 1.00 4.91 H new ATOM 0 HE ARG A 92 12.635 12.718 6.844 1.00 5.90 H new ATOM 0 HH11 ARG A 92 9.541 14.409 6.648 1.00 6.67 H new ATOM 0 HH12 ARG A 92 9.906 15.138 5.081 1.00 6.67 H new ATOM 0 HH21 ARG A 92 13.099 13.664 4.833 1.00 7.60 H new ATOM 0 HH22 ARG A 92 11.911 14.718 4.058 1.00 7.60 H new ATOM 1429 N THR A 93 6.884 9.157 7.569 1.00 1.14 N ATOM 1430 CA THR A 93 7.052 7.716 7.408 1.00 1.33 C ATOM 1431 C THR A 93 6.360 7.220 6.141 1.00 1.11 C ATOM 1432 O THR A 93 5.549 7.926 5.540 1.00 1.61 O ATOM 1433 CB THR A 93 6.483 6.974 8.629 1.00 1.94 C ATOM 1434 OG1 THR A 93 7.042 7.466 9.833 1.00 2.57 O ATOM 1435 CG2 THR A 93 6.729 5.480 8.601 1.00 2.58 C ATOM 0 H THR A 93 6.177 9.571 6.961 1.00 1.14 H new ATOM 0 HA THR A 93 8.119 7.511 7.324 1.00 1.33 H new ATOM 0 HB THR A 93 5.409 7.155 8.585 1.00 1.94 H new ATOM 0 HG1 THR A 93 7.945 7.804 9.660 1.00 2.57 H new ATOM 0 HG21 THR A 93 6.300 5.024 9.493 1.00 2.58 H new ATOM 0 HG22 THR A 93 6.263 5.051 7.714 1.00 2.58 H new ATOM 0 HG23 THR A 93 7.802 5.288 8.576 1.00 2.58 H new ATOM 1443 N LEU A 94 6.688 5.995 5.754 1.00 0.80 N ATOM 1444 CA LEU A 94 6.115 5.366 4.574 1.00 0.54 C ATOM 1445 C LEU A 94 6.165 3.850 4.755 1.00 0.52 C ATOM 1446 O LEU A 94 7.096 3.329 5.371 1.00 0.65 O ATOM 1447 CB LEU A 94 6.891 5.808 3.332 1.00 0.48 C ATOM 1448 CG LEU A 94 6.196 5.597 1.986 1.00 0.52 C ATOM 1449 CD1 LEU A 94 6.917 6.377 0.901 1.00 1.39 C ATOM 1450 CD2 LEU A 94 6.141 4.122 1.623 1.00 1.37 C ATOM 0 H LEU A 94 7.360 5.409 6.250 1.00 0.80 H new ATOM 0 HA LEU A 94 5.076 5.668 4.443 1.00 0.54 H new ATOM 0 HB2 LEU A 94 7.124 6.868 3.434 1.00 0.48 H new ATOM 0 HB3 LEU A 94 7.841 5.273 3.314 1.00 0.48 H new ATOM 0 HG LEU A 94 5.172 5.962 2.070 1.00 0.52 H new ATOM 0 HD11 LEU A 94 6.415 6.221 -0.054 1.00 1.39 H new ATOM 0 HD12 LEU A 94 6.906 7.439 1.148 1.00 1.39 H new ATOM 0 HD13 LEU A 94 7.949 6.032 0.829 1.00 1.39 H new ATOM 0 HD21 LEU A 94 5.642 4.002 0.662 1.00 1.37 H new ATOM 0 HD22 LEU A 94 7.154 3.725 1.558 1.00 1.37 H new ATOM 0 HD23 LEU A 94 5.588 3.579 2.389 1.00 1.37 H new ATOM 1462 N ASP A 95 5.163 3.143 4.241 1.00 0.49 N ATOM 1463 CA ASP A 95 5.108 1.692 4.382 1.00 0.56 C ATOM 1464 C ASP A 95 4.350 1.065 3.225 1.00 0.48 C ATOM 1465 O ASP A 95 3.299 1.561 2.817 1.00 0.65 O ATOM 1466 CB ASP A 95 4.430 1.295 5.700 1.00 0.87 C ATOM 1467 CG ASP A 95 5.149 1.823 6.928 1.00 1.51 C ATOM 1468 OD1 ASP A 95 5.135 3.054 7.138 1.00 2.19 O ATOM 1469 OD2 ASP A 95 5.724 1.009 7.679 1.00 1.92 O ATOM 0 H ASP A 95 4.382 3.549 3.726 1.00 0.49 H new ATOM 0 HA ASP A 95 6.134 1.325 4.381 1.00 0.56 H new ATOM 0 HB2 ASP A 95 3.405 1.667 5.700 1.00 0.87 H new ATOM 0 HB3 ASP A 95 4.375 0.208 5.759 1.00 0.87 H new ATOM 1474 N LEU A 96 4.890 -0.023 2.697 1.00 0.48 N ATOM 1475 CA LEU A 96 4.258 -0.707 1.581 1.00 0.63 C ATOM 1476 C LEU A 96 4.247 -2.224 1.765 1.00 0.60 C ATOM 1477 O LEU A 96 5.261 -2.841 2.095 1.00 0.76 O ATOM 1478 CB LEU A 96 4.923 -0.319 0.248 1.00 0.97 C ATOM 1479 CG LEU A 96 6.451 -0.143 0.254 1.00 0.98 C ATOM 1480 CD1 LEU A 96 6.898 0.940 1.221 1.00 1.91 C ATOM 1481 CD2 LEU A 96 7.149 -1.458 0.554 1.00 2.04 C ATOM 0 H LEU A 96 5.759 -0.448 3.021 1.00 0.48 H new ATOM 0 HA LEU A 96 3.218 -0.380 1.554 1.00 0.63 H new ATOM 0 HB2 LEU A 96 4.673 -1.082 -0.490 1.00 0.97 H new ATOM 0 HB3 LEU A 96 4.476 0.614 -0.094 1.00 0.97 H new ATOM 0 HG LEU A 96 6.740 0.179 -0.746 1.00 0.98 H new ATOM 0 HD11 LEU A 96 7.984 1.029 1.191 1.00 1.91 H new ATOM 0 HD12 LEU A 96 6.448 1.891 0.935 1.00 1.91 H new ATOM 0 HD13 LEU A 96 6.583 0.678 2.231 1.00 1.91 H new ATOM 0 HD21 LEU A 96 8.228 -1.306 0.552 1.00 2.04 H new ATOM 0 HD22 LEU A 96 6.835 -1.821 1.533 1.00 2.04 H new ATOM 0 HD23 LEU A 96 6.885 -2.192 -0.207 1.00 2.04 H new ATOM 1493 N ASP A 97 3.077 -2.815 1.543 1.00 0.55 N ATOM 1494 CA ASP A 97 2.891 -4.257 1.664 1.00 0.62 C ATOM 1495 C ASP A 97 1.876 -4.732 0.640 1.00 0.56 C ATOM 1496 O ASP A 97 0.827 -4.115 0.453 1.00 0.70 O ATOM 1497 CB ASP A 97 2.428 -4.638 3.075 1.00 0.79 C ATOM 1498 CG ASP A 97 3.448 -4.296 4.144 1.00 1.45 C ATOM 1499 OD1 ASP A 97 3.720 -3.096 4.348 1.00 1.98 O ATOM 1500 OD2 ASP A 97 3.976 -5.234 4.782 1.00 2.17 O ATOM 0 H ASP A 97 2.233 -2.309 1.275 1.00 0.55 H new ATOM 0 HA ASP A 97 3.849 -4.742 1.479 1.00 0.62 H new ATOM 0 HB2 ASP A 97 1.492 -4.125 3.296 1.00 0.79 H new ATOM 0 HB3 ASP A 97 2.220 -5.708 3.107 1.00 0.79 H new ATOM 1505 N ILE A 98 2.209 -5.816 -0.038 1.00 0.69 N ATOM 1506 CA ILE A 98 1.353 -6.369 -1.071 1.00 0.63 C ATOM 1507 C ILE A 98 0.193 -7.183 -0.505 1.00 0.67 C ATOM 1508 O ILE A 98 0.341 -7.907 0.480 1.00 0.93 O ATOM 1509 CB ILE A 98 2.181 -7.252 -2.031 1.00 0.74 C ATOM 1510 CG1 ILE A 98 2.874 -8.383 -1.266 1.00 1.91 C ATOM 1511 CG2 ILE A 98 3.202 -6.400 -2.771 1.00 1.40 C ATOM 1512 CD1 ILE A 98 2.016 -9.616 -1.077 1.00 2.73 C ATOM 0 H ILE A 98 3.075 -6.334 0.111 1.00 0.69 H new ATOM 0 HA ILE A 98 0.926 -5.523 -1.610 1.00 0.63 H new ATOM 0 HB ILE A 98 1.507 -7.703 -2.759 1.00 0.74 H new ATOM 0 HG12 ILE A 98 3.783 -8.664 -1.798 1.00 1.91 H new ATOM 0 HG13 ILE A 98 3.179 -8.012 -0.288 1.00 1.91 H new ATOM 0 HG21 ILE A 98 3.781 -7.030 -3.446 1.00 1.40 H new ATOM 0 HG22 ILE A 98 2.686 -5.631 -3.346 1.00 1.40 H new ATOM 0 HG23 ILE A 98 3.871 -5.927 -2.052 1.00 1.40 H new ATOM 0 HD11 ILE A 98 2.579 -10.370 -0.527 1.00 2.73 H new ATOM 0 HD12 ILE A 98 1.119 -9.353 -0.517 1.00 2.73 H new ATOM 0 HD13 ILE A 98 1.732 -10.014 -2.051 1.00 2.73 H new ATOM 1524 N MET A 99 -0.953 -7.086 -1.172 1.00 0.53 N ATOM 1525 CA MET A 99 -2.132 -7.836 -0.797 1.00 0.63 C ATOM 1526 C MET A 99 -2.393 -8.840 -1.900 1.00 0.63 C ATOM 1527 O MET A 99 -3.350 -9.609 -1.854 1.00 0.87 O ATOM 1528 CB MET A 99 -3.350 -6.922 -0.637 1.00 0.70 C ATOM 1529 CG MET A 99 -3.106 -5.708 0.240 1.00 0.93 C ATOM 1530 SD MET A 99 -2.890 -6.128 1.978 1.00 1.77 S ATOM 1531 CE MET A 99 -2.608 -4.507 2.684 1.00 2.48 C ATOM 0 H MET A 99 -1.084 -6.484 -1.985 1.00 0.53 H new ATOM 0 HA MET A 99 -1.966 -8.327 0.162 1.00 0.63 H new ATOM 0 HB2 MET A 99 -3.670 -6.585 -1.623 1.00 0.70 H new ATOM 0 HB3 MET A 99 -4.172 -7.501 -0.216 1.00 0.70 H new ATOM 0 HG2 MET A 99 -2.219 -5.183 -0.114 1.00 0.93 H new ATOM 0 HG3 MET A 99 -3.945 -5.020 0.140 1.00 0.93 H new ATOM 0 HE1 MET A 99 -2.456 -4.600 3.759 1.00 2.48 H new ATOM 0 HE2 MET A 99 -1.723 -4.061 2.230 1.00 2.48 H new ATOM 0 HE3 MET A 99 -3.473 -3.872 2.493 1.00 2.48 H new ATOM 1541 N LEU A 100 -1.524 -8.800 -2.916 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.646 -9.691 -4.061 1.00 0.55 C ATOM 1543 C LEU A 100 -0.403 -9.621 -4.953 1.00 0.54 C ATOM 1544 O LEU A 100 0.294 -8.607 -4.973 1.00 0.76 O ATOM 1545 CB LEU A 100 -2.885 -9.317 -4.871 1.00 0.75 C ATOM 1546 CG LEU A 100 -3.092 -10.146 -6.128 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -3.448 -11.575 -5.767 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -4.166 -9.537 -7.005 1.00 1.69 C ATOM 0 H LEU A 100 -0.732 -8.159 -2.963 1.00 0.51 H new ATOM 0 HA LEU A 100 -1.741 -10.712 -3.692 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -3.764 -9.420 -4.235 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.816 -8.266 -5.152 1.00 0.75 H new ATOM 0 HG LEU A 100 -2.158 -10.152 -6.690 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -3.593 -12.155 -6.678 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -2.640 -12.014 -5.182 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -4.367 -11.584 -5.181 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -4.296 -10.148 -7.898 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -5.105 -9.495 -6.454 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -3.871 -8.529 -7.295 1.00 1.69 H new ATOM 1560 N PHE A 101 -0.131 -10.700 -5.696 1.00 0.46 N ATOM 1561 CA PHE A 101 1.027 -10.733 -6.591 1.00 0.46 C ATOM 1562 C PHE A 101 0.650 -11.307 -7.958 1.00 0.51 C ATOM 1563 O PHE A 101 0.790 -12.504 -8.201 1.00 0.58 O ATOM 1564 CB PHE A 101 2.161 -11.557 -5.972 1.00 0.45 C ATOM 1565 CG PHE A 101 3.413 -11.594 -6.804 1.00 0.51 C ATOM 1566 CD1 PHE A 101 3.993 -10.418 -7.260 1.00 0.56 C ATOM 1567 CD2 PHE A 101 4.013 -12.800 -7.129 1.00 0.58 C ATOM 1568 CE1 PHE A 101 5.144 -10.448 -8.024 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.163 -12.835 -7.893 1.00 0.68 C ATOM 1570 CZ PHE A 101 5.730 -11.664 -8.340 1.00 0.71 C ATOM 0 H PHE A 101 -0.691 -11.552 -5.695 1.00 0.46 H new ATOM 0 HA PHE A 101 1.369 -9.708 -6.731 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.401 -11.147 -4.991 1.00 0.45 H new ATOM 0 HB3 PHE A 101 1.811 -12.577 -5.814 1.00 0.45 H new ATOM 0 HD1 PHE A 101 3.539 -9.469 -7.015 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.576 -13.724 -6.781 1.00 0.58 H new ATOM 0 HE1 PHE A 101 5.586 -9.527 -8.374 1.00 0.65 H new ATOM 0 HE2 PHE A 101 5.618 -13.783 -8.140 1.00 0.68 H new ATOM 0 HZ PHE A 101 6.630 -11.692 -8.936 1.00 0.71 H new ATOM 1580 N GLY A 102 0.174 -10.437 -8.848 1.00 0.54 N ATOM 1581 CA GLY A 102 -0.215 -10.861 -10.184 1.00 0.65 C ATOM 1582 C GLY A 102 -1.438 -11.754 -10.178 1.00 0.67 C ATOM 1583 O GLY A 102 -1.880 -12.218 -11.229 1.00 0.99 O ATOM 0 H GLY A 102 0.051 -9.441 -8.666 1.00 0.54 H new ATOM 0 HA2 GLY A 102 -0.415 -9.982 -10.797 1.00 0.65 H new ATOM 0 HA3 GLY A 102 0.616 -11.392 -10.649 1.00 0.65 H new ATOM 1587 N ASN A 103 -1.950 -12.018 -8.979 1.00 0.58 N ATOM 1588 CA ASN A 103 -3.102 -12.890 -8.783 1.00 0.64 C ATOM 1589 C ASN A 103 -2.609 -14.315 -8.832 1.00 0.71 C ATOM 1590 O ASN A 103 -3.245 -15.214 -9.383 1.00 1.08 O ATOM 1591 CB ASN A 103 -4.207 -12.631 -9.816 1.00 0.78 C ATOM 1592 CG ASN A 103 -4.802 -11.249 -9.669 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -4.156 -10.242 -9.961 1.00 2.12 O ATOM 1594 ND2 ASN A 103 -6.041 -11.197 -9.193 1.00 1.38 N ATOM 0 H ASN A 103 -1.575 -11.631 -8.113 1.00 0.58 H new ATOM 0 HA ASN A 103 -3.559 -12.685 -7.815 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -3.799 -12.746 -10.820 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -4.992 -13.378 -9.703 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -6.497 -10.295 -9.055 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -6.536 -12.059 -8.965 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.429 -14.478 -8.255 1.00 0.53 N ATOM 1602 CA GLU A 104 -0.741 -15.744 -8.202 1.00 0.61 C ATOM 1603 C GLU A 104 -0.752 -16.281 -6.778 1.00 0.64 C ATOM 1604 O GLU A 104 -0.527 -15.534 -5.828 1.00 0.84 O ATOM 1605 CB GLU A 104 0.686 -15.506 -8.678 1.00 0.70 C ATOM 1606 CG GLU A 104 1.255 -16.620 -9.524 1.00 1.16 C ATOM 1607 CD GLU A 104 1.707 -17.819 -8.712 1.00 1.28 C ATOM 1608 OE1 GLU A 104 1.607 -17.764 -7.468 1.00 1.87 O ATOM 1609 OE2 GLU A 104 2.155 -18.815 -9.318 1.00 1.79 O ATOM 0 H GLU A 104 -0.920 -13.717 -7.805 1.00 0.53 H new ATOM 0 HA GLU A 104 -1.231 -16.482 -8.837 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.715 -14.579 -9.251 1.00 0.70 H new ATOM 0 HB3 GLU A 104 1.327 -15.363 -7.808 1.00 0.70 H new ATOM 0 HG2 GLU A 104 0.502 -16.941 -10.244 1.00 1.16 H new ATOM 0 HG3 GLU A 104 2.101 -16.237 -10.096 1.00 1.16 H new ATOM 1616 N VAL A 105 -1.001 -17.574 -6.627 1.00 0.62 N ATOM 1617 CA VAL A 105 -1.028 -18.176 -5.303 1.00 0.66 C ATOM 1618 C VAL A 105 0.389 -18.424 -4.827 1.00 0.70 C ATOM 1619 O VAL A 105 0.985 -19.463 -5.113 1.00 0.83 O ATOM 1620 CB VAL A 105 -1.811 -19.503 -5.283 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -1.943 -20.027 -3.861 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -3.179 -19.328 -5.925 1.00 0.95 C ATOM 0 H VAL A 105 -1.185 -18.219 -7.395 1.00 0.62 H new ATOM 0 HA VAL A 105 -1.537 -17.479 -4.637 1.00 0.66 H new ATOM 0 HB VAL A 105 -1.255 -20.238 -5.865 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -2.499 -20.965 -3.869 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -0.951 -20.197 -3.442 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -2.474 -19.296 -3.252 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -3.716 -20.276 -5.901 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -3.745 -18.576 -5.375 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -3.057 -19.006 -6.959 1.00 0.95 H new ATOM 1632 N ILE A 106 0.934 -17.444 -4.127 1.00 0.65 N ATOM 1633 CA ILE A 106 2.294 -17.526 -3.638 1.00 0.72 C ATOM 1634 C ILE A 106 2.446 -16.801 -2.303 1.00 0.77 C ATOM 1635 O ILE A 106 2.520 -15.574 -2.249 1.00 0.84 O ATOM 1636 CB ILE A 106 3.248 -16.933 -4.695 1.00 0.81 C ATOM 1637 CG1 ILE A 106 4.647 -16.699 -4.135 1.00 0.76 C ATOM 1638 CG2 ILE A 106 2.673 -15.643 -5.262 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.574 -16.073 -5.152 1.00 0.76 C ATOM 0 H ILE A 106 0.450 -16.579 -3.885 1.00 0.65 H new ATOM 0 HA ILE A 106 2.547 -18.573 -3.468 1.00 0.72 H new ATOM 0 HB ILE A 106 3.341 -17.663 -5.499 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.582 -16.053 -3.259 1.00 0.76 H new ATOM 0 HG13 ILE A 106 5.066 -17.648 -3.801 1.00 0.76 H new ATOM 0 HG21 ILE A 106 3.357 -15.236 -6.007 1.00 1.33 H new ATOM 0 HG22 ILE A 106 1.709 -15.848 -5.728 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.540 -14.919 -4.458 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.558 -15.926 -4.706 1.00 0.76 H new ATOM 0 HD12 ILE A 106 5.662 -16.730 -6.017 1.00 0.76 H new ATOM 0 HD13 ILE A 106 5.171 -15.110 -5.467 1.00 0.76 H new ATOM 1651 N ASN A 107 2.481 -17.582 -1.228 1.00 0.80 N ATOM 1652 CA ASN A 107 2.613 -17.033 0.117 1.00 0.91 C ATOM 1653 C ASN A 107 4.003 -17.277 0.690 1.00 0.92 C ATOM 1654 O ASN A 107 4.568 -18.362 0.551 1.00 1.03 O ATOM 1655 CB ASN A 107 1.556 -17.632 1.048 1.00 1.00 C ATOM 1656 CG ASN A 107 0.218 -16.925 0.948 1.00 1.11 C ATOM 1657 OD1 ASN A 107 -0.791 -17.412 1.456 1.00 1.79 O ATOM 1658 ND2 ASN A 107 0.206 -15.757 0.317 1.00 1.12 N ATOM 0 H ASN A 107 2.420 -18.600 -1.262 1.00 0.80 H new ATOM 0 HA ASN A 107 2.460 -15.956 0.045 1.00 0.91 H new ATOM 0 HB2 ASN A 107 1.423 -18.687 0.809 1.00 1.00 H new ATOM 0 HB3 ASN A 107 1.913 -17.581 2.077 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -0.663 -15.228 0.240 1.00 1.12 H new ATOM 0 HD22 ASN A 107 1.065 -15.389 -0.090 1.00 1.12 H new ATOM 1665 N THR A 108 4.536 -16.254 1.344 1.00 0.92 N ATOM 1666 CA THR A 108 5.852 -16.329 1.960 1.00 1.01 C ATOM 1667 C THR A 108 5.934 -15.355 3.132 1.00 1.15 C ATOM 1668 O THR A 108 4.943 -14.715 3.485 1.00 1.79 O ATOM 1669 CB THR A 108 6.940 -16.028 0.926 1.00 1.00 C ATOM 1670 OG1 THR A 108 8.227 -16.090 1.513 1.00 1.66 O ATOM 1671 CG2 THR A 108 6.794 -14.668 0.280 1.00 1.26 C ATOM 0 H THR A 108 4.071 -15.354 1.462 1.00 0.92 H new ATOM 0 HA THR A 108 6.012 -17.339 2.337 1.00 1.01 H new ATOM 0 HB THR A 108 6.822 -16.792 0.157 1.00 1.00 H new ATOM 0 HG1 THR A 108 8.906 -15.896 0.834 1.00 1.66 H new ATOM 0 HG21 THR A 108 7.597 -14.520 -0.442 1.00 1.26 H new ATOM 0 HG22 THR A 108 5.832 -14.609 -0.230 1.00 1.26 H new ATOM 0 HG23 THR A 108 6.847 -13.894 1.046 1.00 1.26 H new ATOM 1679 N GLU A 109 7.108 -15.252 3.743 1.00 0.95 N ATOM 1680 CA GLU A 109 7.295 -14.362 4.882 1.00 1.05 C ATOM 1681 C GLU A 109 7.622 -12.940 4.439 1.00 1.06 C ATOM 1682 O GLU A 109 7.848 -12.063 5.272 1.00 1.32 O ATOM 1683 CB GLU A 109 8.390 -14.909 5.806 1.00 1.20 C ATOM 1684 CG GLU A 109 9.686 -15.262 5.088 1.00 1.46 C ATOM 1685 CD GLU A 109 10.560 -14.056 4.792 1.00 2.13 C ATOM 1686 OE1 GLU A 109 10.247 -12.955 5.285 1.00 2.57 O ATOM 1687 OE2 GLU A 109 11.573 -14.222 4.078 1.00 2.74 O ATOM 0 H GLU A 109 7.942 -15.772 3.470 1.00 0.95 H new ATOM 0 HA GLU A 109 6.356 -14.321 5.433 1.00 1.05 H new ATOM 0 HB2 GLU A 109 8.604 -14.169 6.577 1.00 1.20 H new ATOM 0 HB3 GLU A 109 8.013 -15.798 6.313 1.00 1.20 H new ATOM 0 HG2 GLU A 109 10.249 -15.969 5.697 1.00 1.46 H new ATOM 0 HG3 GLU A 109 9.448 -15.767 4.152 1.00 1.46 H new ATOM 1694 N ARG A 110 7.633 -12.710 3.132 1.00 0.93 N ATOM 1695 CA ARG A 110 7.919 -11.381 2.606 1.00 0.97 C ATOM 1696 C ARG A 110 6.727 -10.837 1.834 1.00 0.79 C ATOM 1697 O ARG A 110 6.547 -9.623 1.737 1.00 0.87 O ATOM 1698 CB ARG A 110 9.159 -11.396 1.706 1.00 1.17 C ATOM 1699 CG ARG A 110 9.595 -10.010 1.252 1.00 1.05 C ATOM 1700 CD ARG A 110 9.991 -9.135 2.433 1.00 1.57 C ATOM 1701 NE ARG A 110 10.479 -7.826 2.004 1.00 2.14 N ATOM 1702 CZ ARG A 110 10.867 -6.870 2.846 1.00 2.68 C ATOM 1703 NH1 ARG A 110 10.809 -7.070 4.156 1.00 2.96 N ATOM 1704 NH2 ARG A 110 11.312 -5.713 2.377 1.00 3.52 N ATOM 0 H ARG A 110 7.449 -13.419 2.422 1.00 0.93 H new ATOM 0 HA ARG A 110 8.117 -10.728 3.456 1.00 0.97 H new ATOM 0 HB2 ARG A 110 9.982 -11.870 2.242 1.00 1.17 H new ATOM 0 HB3 ARG A 110 8.954 -12.010 0.829 1.00 1.17 H new ATOM 0 HG2 ARG A 110 10.437 -10.099 0.565 1.00 1.05 H new ATOM 0 HG3 ARG A 110 8.783 -9.534 0.701 1.00 1.05 H new ATOM 0 HD2 ARG A 110 9.132 -9.004 3.091 1.00 1.57 H new ATOM 0 HD3 ARG A 110 10.764 -9.638 3.014 1.00 1.57 H new ATOM 0 HE ARG A 110 10.525 -7.634 1.003 1.00 2.14 H new ATOM 0 HH11 ARG A 110 10.466 -7.958 4.522 1.00 2.96 H new ATOM 0 HH12 ARG A 110 11.107 -6.335 4.798 1.00 2.96 H new ATOM 0 HH21 ARG A 110 11.357 -5.554 1.370 1.00 3.52 H new ATOM 0 HH22 ARG A 110 11.609 -4.981 3.023 1.00 3.52 H new ATOM 1718 N LEU A 111 5.906 -11.731 1.286 1.00 0.72 N ATOM 1719 CA LEU A 111 4.739 -11.295 0.535 1.00 0.75 C ATOM 1720 C LEU A 111 3.611 -12.321 0.539 1.00 0.66 C ATOM 1721 O LEU A 111 3.651 -13.326 -0.169 1.00 0.70 O ATOM 1722 CB LEU A 111 5.115 -10.960 -0.911 1.00 0.95 C ATOM 1723 CG LEU A 111 5.485 -12.149 -1.801 1.00 0.69 C ATOM 1724 CD1 LEU A 111 4.759 -12.066 -3.133 1.00 0.95 C ATOM 1725 CD2 LEU A 111 6.985 -12.188 -2.021 1.00 1.36 C ATOM 0 H LEU A 111 6.026 -12.742 1.348 1.00 0.72 H new ATOM 0 HA LEU A 111 4.374 -10.401 1.040 1.00 0.75 H new ATOM 0 HB2 LEU A 111 4.278 -10.434 -1.371 1.00 0.95 H new ATOM 0 HB3 LEU A 111 5.957 -10.268 -0.895 1.00 0.95 H new ATOM 0 HG LEU A 111 5.178 -13.067 -1.299 1.00 0.69 H new ATOM 0 HD11 LEU A 111 5.035 -12.920 -3.752 1.00 0.95 H new ATOM 0 HD12 LEU A 111 3.683 -12.075 -2.962 1.00 0.95 H new ATOM 0 HD13 LEU A 111 5.038 -11.144 -3.642 1.00 0.95 H new ATOM 0 HD21 LEU A 111 7.238 -13.038 -2.655 1.00 1.36 H new ATOM 0 HD22 LEU A 111 7.306 -11.266 -2.505 1.00 1.36 H new ATOM 0 HD23 LEU A 111 7.491 -12.289 -1.061 1.00 1.36 H new ATOM 1737 N THR A 112 2.577 -12.033 1.306 1.00 0.71 N ATOM 1738 CA THR A 112 1.411 -12.894 1.349 1.00 0.67 C ATOM 1739 C THR A 112 0.428 -12.406 0.289 1.00 0.66 C ATOM 1740 O THR A 112 -0.118 -11.307 0.398 1.00 0.82 O ATOM 1741 CB THR A 112 0.779 -12.874 2.742 1.00 0.74 C ATOM 1742 OG1 THR A 112 -0.428 -13.616 2.757 1.00 0.75 O ATOM 1743 CG2 THR A 112 0.474 -11.481 3.248 1.00 0.83 C ATOM 0 H THR A 112 2.521 -11.211 1.907 1.00 0.71 H new ATOM 0 HA THR A 112 1.693 -13.926 1.142 1.00 0.67 H new ATOM 0 HB THR A 112 1.524 -13.321 3.400 1.00 0.74 H new ATOM 0 HG1 THR A 112 -0.807 -13.605 3.661 1.00 0.75 H new ATOM 0 HG21 THR A 112 0.028 -11.544 4.241 1.00 0.83 H new ATOM 0 HG22 THR A 112 1.397 -10.903 3.301 1.00 0.83 H new ATOM 0 HG23 THR A 112 -0.223 -10.991 2.568 1.00 0.83 H new ATOM 1751 N VAL A 113 0.218 -13.208 -0.751 1.00 0.60 N ATOM 1752 CA VAL A 113 -0.678 -12.821 -1.824 1.00 0.61 C ATOM 1753 C VAL A 113 -2.113 -12.793 -1.309 1.00 0.64 C ATOM 1754 O VAL A 113 -2.623 -11.711 -1.034 1.00 0.80 O ATOM 1755 CB VAL A 113 -0.501 -13.729 -3.055 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -1.646 -13.551 -4.035 1.00 1.27 C ATOM 1757 CG2 VAL A 113 0.826 -13.432 -3.725 1.00 1.38 C ATOM 0 H VAL A 113 0.655 -14.122 -0.869 1.00 0.60 H new ATOM 0 HA VAL A 113 -0.428 -11.814 -2.158 1.00 0.61 H new ATOM 0 HB VAL A 113 -0.508 -14.767 -2.723 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -1.494 -14.204 -4.894 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -2.586 -13.806 -3.546 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -1.681 -12.514 -4.369 1.00 1.27 H new ATOM 0 HG21 VAL A 113 0.947 -14.077 -4.595 1.00 1.38 H new ATOM 0 HG22 VAL A 113 0.849 -12.389 -4.040 1.00 1.38 H new ATOM 0 HG23 VAL A 113 1.638 -13.616 -3.022 1.00 1.38 H new ATOM 1767 N PRO A 114 -2.793 -13.949 -1.111 1.00 0.61 N ATOM 1768 CA PRO A 114 -4.146 -13.939 -0.564 1.00 0.70 C ATOM 1769 C PRO A 114 -4.231 -12.982 0.619 1.00 0.76 C ATOM 1770 O PRO A 114 -5.268 -12.372 0.872 1.00 0.88 O ATOM 1771 CB PRO A 114 -4.335 -15.381 -0.113 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.541 -16.160 -1.091 1.00 0.83 C ATOM 1773 CD PRO A 114 -2.318 -15.332 -1.349 1.00 0.63 C ATOM 0 HA PRO A 114 -4.905 -13.608 -1.273 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -3.977 -15.533 0.905 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -5.386 -15.671 -0.128 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -3.277 -17.140 -0.693 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -4.103 -16.330 -2.009 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -1.501 -15.599 -0.678 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -1.950 -15.462 -2.367 1.00 0.63 H new ATOM 1781 N HIS A 115 -3.097 -12.842 1.309 1.00 0.82 N ATOM 1782 CA HIS A 115 -2.967 -11.941 2.451 1.00 0.95 C ATOM 1783 C HIS A 115 -3.942 -12.277 3.567 1.00 0.86 C ATOM 1784 O HIS A 115 -5.131 -12.495 3.334 1.00 0.88 O ATOM 1785 CB HIS A 115 -3.188 -10.492 2.014 1.00 1.14 C ATOM 1786 CG HIS A 115 -2.819 -9.487 3.062 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -1.516 -9.181 3.389 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -3.594 -8.726 3.868 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -1.505 -8.276 4.352 1.00 4.09 C ATOM 1790 NE2 HIS A 115 -2.753 -7.984 4.661 1.00 3.97 N ATOM 0 H HIS A 115 -2.242 -13.353 1.089 1.00 0.82 H new ATOM 0 HA HIS A 115 -1.955 -12.067 2.836 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -2.602 -10.299 1.115 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -4.236 -10.358 1.747 1.00 1.14 H new ATOM 0 HD2 HIS A 115 -4.674 -8.706 3.885 1.00 2.95 H new ATOM 0 HE1 HIS A 115 -0.624 -7.849 4.808 1.00 4.09 H new ATOM 0 HE2 HIS A 115 -3.046 -7.316 5.373 1.00 3.97 H new ATOM 1799 N TYR A 116 -3.435 -12.275 4.788 1.00 1.04 N ATOM 1800 CA TYR A 116 -4.264 -12.536 5.949 1.00 1.14 C ATOM 1801 C TYR A 116 -4.401 -11.262 6.770 1.00 1.04 C ATOM 1802 O TYR A 116 -3.500 -10.925 7.537 1.00 1.47 O ATOM 1803 CB TYR A 116 -3.654 -13.651 6.805 1.00 1.62 C ATOM 1804 CG TYR A 116 -4.406 -13.915 8.093 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -5.775 -14.152 8.091 1.00 2.56 C ATOM 1806 CD2 TYR A 116 -3.742 -13.928 9.314 1.00 3.06 C ATOM 1807 CE1 TYR A 116 -6.461 -14.394 9.267 1.00 3.50 C ATOM 1808 CE2 TYR A 116 -4.420 -14.168 10.494 1.00 4.05 C ATOM 1809 CZ TYR A 116 -5.778 -14.400 10.465 1.00 4.18 C ATOM 1810 OH TYR A 116 -6.458 -14.640 11.639 1.00 5.29 O ATOM 0 H TYR A 116 -2.453 -12.095 5.000 1.00 1.04 H new ATOM 0 HA TYR A 116 -5.250 -12.860 5.616 1.00 1.14 H new ATOM 0 HB2 TYR A 116 -3.622 -14.570 6.219 1.00 1.62 H new ATOM 0 HB3 TYR A 116 -2.623 -13.390 7.044 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -6.313 -14.147 7.154 1.00 2.56 H new ATOM 0 HD2 TYR A 116 -2.678 -13.747 9.341 1.00 3.06 H new ATOM 0 HE1 TYR A 116 -7.525 -14.577 9.247 1.00 3.50 H new ATOM 0 HE2 TYR A 116 -3.888 -14.174 11.434 1.00 4.05 H new ATOM 0 HH TYR A 116 -5.831 -14.611 12.392 1.00 5.29 H new ATOM 1820 N ASP A 117 -5.543 -10.582 6.587 1.00 0.77 N ATOM 1821 CA ASP A 117 -5.892 -9.327 7.280 1.00 0.80 C ATOM 1822 C ASP A 117 -6.417 -8.271 6.308 1.00 0.72 C ATOM 1823 O ASP A 117 -6.901 -7.228 6.742 1.00 0.82 O ATOM 1824 CB ASP A 117 -4.733 -8.735 8.093 1.00 1.03 C ATOM 1825 CG ASP A 117 -4.558 -9.410 9.441 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -5.331 -10.344 9.744 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -3.649 -9.004 10.194 1.00 2.22 O ATOM 0 H ASP A 117 -6.267 -10.894 5.940 1.00 0.77 H new ATOM 0 HA ASP A 117 -6.681 -9.602 7.980 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -3.809 -8.828 7.522 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -4.908 -7.670 8.245 1.00 1.03 H new ATOM 1832 N MET A 118 -6.344 -8.533 4.998 1.00 0.69 N ATOM 1833 CA MET A 118 -6.857 -7.566 4.024 1.00 0.72 C ATOM 1834 C MET A 118 -8.291 -7.230 4.381 1.00 0.71 C ATOM 1835 O MET A 118 -8.654 -6.062 4.530 1.00 0.73 O ATOM 1836 CB MET A 118 -6.796 -8.101 2.576 1.00 0.83 C ATOM 1837 CG MET A 118 -6.979 -9.606 2.466 1.00 1.15 C ATOM 1838 SD MET A 118 -7.180 -10.160 0.760 1.00 2.40 S ATOM 1839 CE MET A 118 -5.719 -9.465 -0.007 1.00 3.10 C ATOM 0 H MET A 118 -5.946 -9.382 4.597 1.00 0.69 H new ATOM 0 HA MET A 118 -6.227 -6.678 4.066 1.00 0.72 H new ATOM 0 HB2 MET A 118 -7.567 -7.607 1.984 1.00 0.83 H new ATOM 0 HB3 MET A 118 -5.835 -7.829 2.139 1.00 0.83 H new ATOM 0 HG2 MET A 118 -6.117 -10.106 2.907 1.00 1.15 H new ATOM 0 HG3 MET A 118 -7.852 -9.905 3.046 1.00 1.15 H new ATOM 0 HE1 MET A 118 -6.011 -8.666 -0.689 1.00 3.10 H new ATOM 0 HE2 MET A 118 -5.061 -9.062 0.763 1.00 3.10 H new ATOM 0 HE3 MET A 118 -5.195 -10.243 -0.562 1.00 3.10 H new ATOM 1849 N LYS A 119 -9.095 -8.276 4.526 1.00 0.80 N ATOM 1850 CA LYS A 119 -10.503 -8.140 4.876 1.00 0.95 C ATOM 1851 C LYS A 119 -10.677 -7.283 6.125 1.00 0.99 C ATOM 1852 O LYS A 119 -11.744 -6.720 6.363 1.00 1.24 O ATOM 1853 CB LYS A 119 -11.101 -9.526 5.135 1.00 1.15 C ATOM 1854 CG LYS A 119 -10.606 -10.602 4.180 1.00 1.30 C ATOM 1855 CD LYS A 119 -11.233 -11.952 4.489 1.00 1.70 C ATOM 1856 CE LYS A 119 -10.733 -13.027 3.539 1.00 2.06 C ATOM 1857 NZ LYS A 119 -9.256 -13.201 3.625 1.00 2.67 N ATOM 0 H LYS A 119 -8.790 -9.242 4.404 1.00 0.80 H new ATOM 0 HA LYS A 119 -11.016 -7.655 4.045 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -10.867 -9.826 6.157 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -12.187 -9.461 5.062 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -10.841 -10.316 3.155 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -9.521 -10.679 4.248 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -11.002 -12.236 5.516 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -12.318 -11.876 4.416 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -11.224 -13.972 3.770 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -11.009 -12.766 2.517 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -8.981 -14.077 3.137 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -8.784 -12.391 3.175 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -8.971 -13.257 4.624 1.00 2.67 H new ATOM 1871 N ASN A 120 -9.624 -7.215 6.930 1.00 0.90 N ATOM 1872 CA ASN A 120 -9.646 -6.462 8.178 1.00 1.04 C ATOM 1873 C ASN A 120 -9.349 -4.986 7.960 1.00 1.08 C ATOM 1874 O ASN A 120 -9.099 -4.252 8.918 1.00 1.35 O ATOM 1875 CB ASN A 120 -8.610 -7.045 9.133 1.00 1.08 C ATOM 1876 CG ASN A 120 -8.964 -6.833 10.588 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -9.158 -5.706 11.044 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -9.044 -7.931 11.318 1.00 1.84 N ATOM 0 H ASN A 120 -8.735 -7.677 6.738 1.00 0.90 H new ATOM 0 HA ASN A 120 -10.648 -6.542 8.598 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -8.507 -8.113 8.941 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -7.640 -6.590 8.930 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -9.276 -7.869 12.309 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -8.874 -8.841 10.890 1.00 1.84 H new ATOM 1885 N ARG A 121 -9.359 -4.543 6.710 1.00 0.93 N ATOM 1886 CA ARG A 121 -9.067 -3.141 6.425 1.00 1.06 C ATOM 1887 C ARG A 121 -9.603 -2.663 5.074 1.00 0.84 C ATOM 1888 O ARG A 121 -9.093 -3.031 4.011 1.00 0.87 O ATOM 1889 CB ARG A 121 -7.559 -2.892 6.501 1.00 1.31 C ATOM 1890 CG ARG A 121 -6.731 -3.850 5.659 1.00 1.14 C ATOM 1891 CD ARG A 121 -5.264 -3.444 5.640 1.00 1.39 C ATOM 1892 NE ARG A 121 -4.709 -3.311 6.986 1.00 1.56 N ATOM 1893 CZ ARG A 121 -4.591 -4.321 7.843 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -4.964 -5.543 7.493 1.00 2.29 N ATOM 1895 NH2 ARG A 121 -4.092 -4.109 9.055 1.00 2.04 N ATOM 0 H ARG A 121 -9.561 -5.118 5.892 1.00 0.93 H new ATOM 0 HA ARG A 121 -9.587 -2.561 7.188 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -7.353 -1.871 6.180 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -7.240 -2.969 7.540 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -6.826 -4.861 6.056 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -7.118 -3.870 4.640 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -4.691 -4.186 5.084 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -5.158 -2.497 5.110 1.00 1.39 H new ATOM 0 HE ARG A 121 -4.393 -2.388 7.286 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -5.344 -5.713 6.562 1.00 2.29 H new ATOM 0 HH12 ARG A 121 -4.871 -6.314 8.155 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -3.799 -3.171 9.329 1.00 2.04 H new ATOM 0 HH22 ARG A 121 -4.002 -4.884 9.712 1.00 2.04 H new ATOM 1909 N GLY A 122 -10.602 -1.785 5.140 1.00 0.73 N ATOM 1910 CA GLY A 122 -11.176 -1.193 3.944 1.00 0.60 C ATOM 1911 C GLY A 122 -10.351 -0.013 3.498 1.00 0.57 C ATOM 1912 O GLY A 122 -10.727 0.715 2.584 1.00 0.59 O ATOM 0 H GLY A 122 -11.028 -1.471 6.012 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -11.221 -1.936 3.148 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -12.200 -0.876 4.142 1.00 0.60 H new ATOM 1916 N PHE A 123 -9.218 0.172 4.160 1.00 0.65 N ATOM 1917 CA PHE A 123 -8.323 1.268 3.852 1.00 0.72 C ATOM 1918 C PHE A 123 -7.536 0.973 2.586 1.00 0.80 C ATOM 1919 O PHE A 123 -7.304 1.864 1.780 1.00 1.14 O ATOM 1920 CB PHE A 123 -7.353 1.516 5.013 1.00 0.84 C ATOM 1921 CG PHE A 123 -8.016 1.872 6.319 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -9.001 1.055 6.850 1.00 1.10 C ATOM 1923 CD2 PHE A 123 -7.662 3.022 7.014 1.00 1.47 C ATOM 1924 CE1 PHE A 123 -9.617 1.374 8.045 1.00 1.49 C ATOM 1925 CE2 PHE A 123 -8.276 3.344 8.208 1.00 2.04 C ATOM 1926 CZ PHE A 123 -9.224 2.539 8.735 1.00 1.98 C ATOM 0 H PHE A 123 -8.899 -0.430 4.919 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.927 2.162 3.697 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -6.747 0.622 5.160 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.672 2.321 4.735 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -9.291 0.158 6.323 1.00 1.10 H new ATOM 0 HD2 PHE A 123 -6.897 3.672 6.615 1.00 1.47 H new ATOM 0 HE1 PHE A 123 -10.392 0.737 8.446 1.00 1.49 H new ATOM 0 HE2 PHE A 123 -7.995 4.249 8.726 1.00 2.04 H new ATOM 0 HZ PHE A 123 -9.680 2.787 9.682 1.00 1.98 H new ATOM 1936 N MET A 124 -7.119 -0.280 2.423 1.00 0.62 N ATOM 1937 CA MET A 124 -6.345 -0.680 1.252 1.00 0.68 C ATOM 1938 C MET A 124 -7.194 -1.460 0.249 1.00 0.64 C ATOM 1939 O MET A 124 -6.931 -1.429 -0.954 1.00 0.68 O ATOM 1940 CB MET A 124 -5.133 -1.518 1.667 1.00 0.80 C ATOM 1941 CG MET A 124 -4.099 -0.746 2.476 1.00 1.00 C ATOM 1942 SD MET A 124 -4.701 -0.255 4.103 1.00 1.91 S ATOM 1943 CE MET A 124 -3.286 0.640 4.738 1.00 2.23 C ATOM 0 H MET A 124 -7.304 -1.034 3.085 1.00 0.62 H new ATOM 0 HA MET A 124 -6.002 0.233 0.766 1.00 0.68 H new ATOM 0 HB2 MET A 124 -5.476 -2.371 2.253 1.00 0.80 H new ATOM 0 HB3 MET A 124 -4.656 -1.918 0.772 1.00 0.80 H new ATOM 0 HG2 MET A 124 -3.206 -1.360 2.595 1.00 1.00 H new ATOM 0 HG3 MET A 124 -3.802 0.144 1.921 1.00 1.00 H new ATOM 0 HE1 MET A 124 -3.041 0.273 5.735 1.00 2.23 H new ATOM 0 HE2 MET A 124 -2.433 0.489 4.076 1.00 2.23 H new ATOM 0 HE3 MET A 124 -3.521 1.703 4.790 1.00 2.23 H new ATOM 1953 N LEU A 125 -8.208 -2.167 0.736 1.00 0.61 N ATOM 1954 CA LEU A 125 -9.064 -2.949 -0.134 1.00 0.62 C ATOM 1955 C LEU A 125 -10.017 -2.060 -0.929 1.00 0.56 C ATOM 1956 O LEU A 125 -10.322 -2.337 -2.090 1.00 0.63 O ATOM 1957 CB LEU A 125 -9.830 -3.984 0.688 1.00 0.67 C ATOM 1958 CG LEU A 125 -8.961 -4.978 1.469 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -9.791 -6.156 1.934 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -7.779 -5.452 0.633 1.00 1.16 C ATOM 0 H LEU A 125 -8.453 -2.212 1.725 1.00 0.61 H new ATOM 0 HA LEU A 125 -8.437 -3.470 -0.858 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -10.474 -3.459 1.393 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -10.481 -4.545 0.018 1.00 0.67 H new ATOM 0 HG LEU A 125 -8.566 -4.463 2.345 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -9.159 -6.851 2.486 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -10.594 -5.803 2.581 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -10.219 -6.663 1.069 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -7.182 -6.155 1.213 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -8.145 -5.944 -0.268 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -7.164 -4.596 0.355 1.00 1.16 H new ATOM 1972 N TRP A 126 -10.473 -0.986 -0.303 1.00 0.48 N ATOM 1973 CA TRP A 126 -11.383 -0.041 -0.939 1.00 0.48 C ATOM 1974 C TRP A 126 -10.714 0.699 -2.101 1.00 0.47 C ATOM 1975 O TRP A 126 -11.253 0.744 -3.206 1.00 0.48 O ATOM 1976 CB TRP A 126 -11.874 0.967 0.096 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.661 2.085 -0.486 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -13.912 2.012 -0.990 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -12.240 3.438 -0.635 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -14.321 3.248 -1.427 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -13.307 4.143 -1.219 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -11.069 4.117 -0.322 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -13.233 5.504 -1.491 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -10.994 5.470 -0.595 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -12.071 6.151 -1.171 1.00 3.03 C ATOM 0 H TRP A 126 -10.225 -0.744 0.656 1.00 0.48 H new ATOM 0 HA TRP A 126 -12.224 -0.605 -1.344 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.487 0.448 0.833 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -11.015 1.377 0.627 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -14.505 1.111 -1.042 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -15.229 3.463 -1.838 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -10.234 3.598 0.126 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -14.062 6.031 -1.939 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -10.089 6.010 -0.360 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -11.984 7.209 -1.367 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.528 1.297 -1.867 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.798 2.035 -2.902 1.00 0.54 C ATOM 1998 C PRO A 127 -8.538 1.178 -4.126 1.00 0.53 C ATOM 1999 O PRO A 127 -8.675 1.638 -5.261 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.480 2.419 -2.214 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.388 1.510 -1.041 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.799 1.304 -0.594 1.00 0.55 C ATOM 0 HA PRO A 127 -9.358 2.896 -3.267 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.631 2.288 -2.884 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -7.484 3.464 -1.906 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.918 0.564 -1.312 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -6.784 1.950 -0.248 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -8.921 0.368 -0.049 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -9.138 2.103 0.065 1.00 0.55 H new ATOM 2010 N LEU A 128 -8.176 -0.079 -3.894 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.919 -0.998 -4.987 1.00 0.56 C ATOM 2012 C LEU A 128 -9.217 -1.338 -5.700 1.00 0.54 C ATOM 2013 O LEU A 128 -9.205 -1.769 -6.852 1.00 0.61 O ATOM 2014 CB LEU A 128 -7.265 -2.283 -4.481 1.00 0.63 C ATOM 2015 CG LEU A 128 -6.928 -3.300 -5.579 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -6.011 -2.683 -6.625 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -6.287 -4.540 -4.986 1.00 1.55 C ATOM 0 H LEU A 128 -8.056 -0.479 -2.964 1.00 0.53 H new ATOM 0 HA LEU A 128 -7.236 -0.510 -5.683 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -6.349 -2.025 -3.949 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -7.931 -2.755 -3.758 1.00 0.63 H new ATOM 0 HG LEU A 128 -7.860 -3.590 -6.064 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -5.786 -3.423 -7.393 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -6.505 -1.825 -7.081 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -5.085 -2.359 -6.151 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -6.057 -5.247 -5.783 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -5.368 -4.263 -4.470 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -6.975 -5.002 -4.278 1.00 1.55 H new ATOM 2029 N PHE A 129 -10.340 -1.139 -5.014 1.00 0.50 N ATOM 2030 CA PHE A 129 -11.635 -1.431 -5.612 1.00 0.51 C ATOM 2031 C PHE A 129 -11.983 -0.358 -6.636 1.00 0.53 C ATOM 2032 O PHE A 129 -12.745 -0.596 -7.570 1.00 0.70 O ATOM 2033 CB PHE A 129 -12.730 -1.519 -4.546 1.00 0.49 C ATOM 2034 CG PHE A 129 -13.940 -2.288 -5.003 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -14.938 -1.666 -5.734 1.00 0.62 C ATOM 2036 CD2 PHE A 129 -14.077 -3.636 -4.702 1.00 0.60 C ATOM 2037 CE1 PHE A 129 -16.047 -2.370 -6.160 1.00 0.73 C ATOM 2038 CE2 PHE A 129 -15.185 -4.344 -5.123 1.00 0.71 C ATOM 2039 CZ PHE A 129 -16.171 -3.711 -5.855 1.00 0.75 C ATOM 0 H PHE A 129 -10.378 -0.783 -4.059 1.00 0.50 H new ATOM 0 HA PHE A 129 -11.573 -2.399 -6.109 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -12.322 -1.993 -3.653 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -13.034 -0.511 -4.262 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -14.848 -0.617 -5.974 1.00 0.62 H new ATOM 0 HD2 PHE A 129 -13.308 -4.137 -4.132 1.00 0.60 H new ATOM 0 HE1 PHE A 129 -16.817 -1.872 -6.731 1.00 0.73 H new ATOM 0 HE2 PHE A 129 -15.281 -5.392 -4.880 1.00 0.71 H new ATOM 0 HZ PHE A 129 -17.037 -4.264 -6.188 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.406 0.826 -6.454 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.643 1.942 -7.363 1.00 0.49 C ATOM 2051 C GLU A 130 -10.748 1.833 -8.597 1.00 0.53 C ATOM 2052 O GLU A 130 -11.116 2.283 -9.681 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.386 3.269 -6.646 1.00 0.54 C ATOM 2054 CG GLU A 130 -11.643 4.495 -7.510 1.00 0.99 C ATOM 2055 CD GLU A 130 -13.101 4.645 -7.910 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -13.926 3.808 -7.486 1.00 2.04 O ATOM 2057 OE2 GLU A 130 -13.417 5.603 -8.647 1.00 2.40 O ATOM 0 H GLU A 130 -10.771 1.037 -5.685 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.683 1.907 -7.686 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -12.019 3.321 -5.760 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.352 3.290 -6.300 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -11.327 5.387 -6.969 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -11.030 4.434 -8.409 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.572 1.234 -8.421 1.00 0.48 N ATOM 2065 CA ILE A 131 -8.626 1.067 -9.519 1.00 0.56 C ATOM 2066 C ILE A 131 -8.691 -0.345 -10.100 1.00 0.52 C ATOM 2067 O ILE A 131 -8.070 -0.633 -11.124 1.00 0.64 O ATOM 2068 CB ILE A 131 -7.182 1.361 -9.063 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.786 0.437 -7.910 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -7.048 2.822 -8.655 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -5.354 0.617 -7.450 1.00 1.41 C ATOM 0 H ILE A 131 -9.253 0.857 -7.529 1.00 0.48 H new ATOM 0 HA ILE A 131 -8.909 1.782 -10.291 1.00 0.56 H new ATOM 0 HB ILE A 131 -6.506 1.172 -9.897 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -7.454 0.615 -7.067 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -6.932 -0.598 -8.219 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -6.025 3.018 -8.335 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -7.291 3.461 -9.504 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -7.732 3.035 -7.833 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -5.146 -0.071 -6.631 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -4.677 0.410 -8.279 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -5.207 1.642 -7.109 1.00 1.41 H new ATOM 2083 N ALA A 132 -9.448 -1.222 -9.441 1.00 0.53 N ATOM 2084 CA ALA A 132 -9.597 -2.603 -9.892 1.00 0.58 C ATOM 2085 C ALA A 132 -10.690 -3.331 -9.105 1.00 0.56 C ATOM 2086 O ALA A 132 -10.400 -4.084 -8.175 1.00 0.63 O ATOM 2087 CB ALA A 132 -8.274 -3.346 -9.769 1.00 0.73 C ATOM 0 H ALA A 132 -9.968 -0.999 -8.592 1.00 0.53 H new ATOM 0 HA ALA A 132 -9.895 -2.582 -10.940 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -8.401 -4.374 -10.109 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -7.521 -2.852 -10.382 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -7.952 -3.345 -8.728 1.00 0.73 H new ATOM 2093 N PRO A 133 -11.967 -3.106 -9.466 1.00 0.63 N ATOM 2094 CA PRO A 133 -13.109 -3.728 -8.798 1.00 0.66 C ATOM 2095 C PRO A 133 -13.516 -5.053 -9.435 1.00 0.88 C ATOM 2096 O PRO A 133 -14.706 -5.339 -9.580 1.00 1.24 O ATOM 2097 CB PRO A 133 -14.204 -2.688 -9.009 1.00 0.79 C ATOM 2098 CG PRO A 133 -13.895 -2.074 -10.338 1.00 0.82 C ATOM 2099 CD PRO A 133 -12.405 -2.215 -10.556 1.00 0.81 C ATOM 0 HA PRO A 133 -12.900 -3.974 -7.757 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -15.192 -3.148 -9.006 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -14.198 -1.940 -8.216 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -14.450 -2.574 -11.132 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -14.190 -1.025 -10.356 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -12.184 -2.642 -11.534 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -11.902 -1.249 -10.509 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.532 -5.859 -9.820 1.00 0.90 N ATOM 2108 CA GLU A 134 -12.808 -7.148 -10.446 1.00 1.12 C ATOM 2109 C GLU A 134 -11.696 -8.152 -10.157 1.00 1.08 C ATOM 2110 O GLU A 134 -11.630 -9.212 -10.779 1.00 1.25 O ATOM 2111 CB GLU A 134 -12.974 -6.979 -11.958 1.00 1.34 C ATOM 2112 CG GLU A 134 -11.743 -6.409 -12.645 1.00 1.87 C ATOM 2113 CD GLU A 134 -11.924 -6.267 -14.144 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -12.165 -7.294 -14.813 1.00 2.50 O ATOM 2115 OE2 GLU A 134 -11.826 -5.129 -14.650 1.00 2.61 O ATOM 0 H GLU A 134 -11.541 -5.644 -9.711 1.00 0.90 H new ATOM 0 HA GLU A 134 -13.736 -7.533 -10.022 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -13.211 -7.947 -12.400 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -13.824 -6.324 -12.151 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -11.512 -5.434 -12.217 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -10.888 -7.055 -12.446 1.00 1.87 H new ATOM 2122 N LEU A 135 -10.828 -7.810 -9.211 1.00 0.99 N ATOM 2123 CA LEU A 135 -9.717 -8.681 -8.838 1.00 1.03 C ATOM 2124 C LEU A 135 -10.224 -10.074 -8.480 1.00 1.50 C ATOM 2125 O LEU A 135 -10.195 -10.979 -9.312 1.00 2.32 O ATOM 2126 CB LEU A 135 -8.960 -8.092 -7.648 1.00 1.00 C ATOM 2127 CG LEU A 135 -7.547 -8.633 -7.463 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -6.613 -8.021 -8.496 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -7.052 -8.367 -6.052 1.00 2.26 C ATOM 0 H LEU A 135 -10.872 -6.936 -8.688 1.00 0.99 H new ATOM 0 HA LEU A 135 -9.043 -8.758 -9.692 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -8.908 -7.010 -7.767 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -9.531 -8.285 -6.740 1.00 1.00 H new ATOM 0 HG LEU A 135 -7.562 -9.713 -7.612 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -5.606 -8.414 -8.355 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -6.963 -8.272 -9.497 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -6.599 -6.938 -8.377 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -6.042 -8.761 -5.941 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -7.046 -7.293 -5.865 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -7.713 -8.856 -5.336 1.00 2.26 H new ATOM 2141 N VAL A 136 -10.687 -10.228 -7.233 1.00 1.65 N ATOM 2142 CA VAL A 136 -11.209 -11.502 -6.732 1.00 2.11 C ATOM 2143 C VAL A 136 -10.477 -12.695 -7.340 1.00 1.98 C ATOM 2144 O VAL A 136 -10.866 -13.213 -8.388 1.00 2.82 O ATOM 2145 CB VAL A 136 -12.728 -11.644 -6.983 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -13.071 -11.437 -8.453 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -13.228 -12.998 -6.501 1.00 3.66 C ATOM 0 H VAL A 136 -10.710 -9.474 -6.546 1.00 1.65 H new ATOM 0 HA VAL A 136 -11.034 -11.497 -5.656 1.00 2.11 H new ATOM 0 HB VAL A 136 -13.233 -10.865 -6.411 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -14.147 -11.544 -8.594 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -12.762 -10.438 -8.762 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -12.550 -12.181 -9.056 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -14.299 -13.078 -6.687 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -12.707 -13.791 -7.038 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -13.037 -13.097 -5.432 1.00 3.66 H new ATOM 2157 N PHE A 137 -9.417 -13.136 -6.675 1.00 1.34 N ATOM 2158 CA PHE A 137 -8.651 -14.276 -7.175 1.00 1.66 C ATOM 2159 C PHE A 137 -7.638 -14.810 -6.155 1.00 1.18 C ATOM 2160 O PHE A 137 -7.565 -16.023 -5.953 1.00 1.57 O ATOM 2161 CB PHE A 137 -7.937 -13.920 -8.478 1.00 2.23 C ATOM 2162 CG PHE A 137 -7.577 -15.123 -9.303 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -8.544 -16.039 -9.683 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -6.266 -15.337 -9.702 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -8.211 -17.144 -10.443 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -5.928 -16.439 -10.463 1.00 4.85 C ATOM 2167 CZ PHE A 137 -6.922 -17.356 -10.826 1.00 5.09 C ATOM 0 H PHE A 137 -9.071 -12.733 -5.804 1.00 1.34 H new ATOM 0 HA PHE A 137 -9.373 -15.071 -7.360 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -8.576 -13.262 -9.067 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -7.030 -13.361 -8.247 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -9.570 -15.888 -9.382 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -5.499 -14.633 -9.414 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -8.979 -17.845 -10.735 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -4.906 -16.592 -10.775 1.00 4.85 H new ATOM 0 HZ PHE A 137 -6.667 -18.229 -11.408 1.00 5.09 H new ATOM 2177 N PRO A 138 -6.832 -13.933 -5.503 1.00 0.88 N ATOM 2178 CA PRO A 138 -5.834 -14.349 -4.522 1.00 0.92 C ATOM 2179 C PRO A 138 -6.289 -15.567 -3.729 1.00 1.20 C ATOM 2180 O PRO A 138 -5.598 -16.584 -3.666 1.00 1.94 O ATOM 2181 CB PRO A 138 -5.706 -13.118 -3.604 1.00 1.24 C ATOM 2182 CG PRO A 138 -6.516 -12.029 -4.249 1.00 1.68 C ATOM 2183 CD PRO A 138 -6.810 -12.482 -5.653 1.00 1.44 C ATOM 0 HA PRO A 138 -4.894 -14.646 -4.987 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -6.077 -13.338 -2.603 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -4.664 -12.818 -3.499 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -7.440 -11.855 -3.697 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -5.966 -11.088 -4.253 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -7.762 -12.095 -6.016 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.044 -12.156 -6.356 1.00 1.44 H new ATOM 2191 N ASP A 139 -7.474 -15.451 -3.151 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.074 -16.528 -2.377 1.00 1.62 C ATOM 2193 C ASP A 139 -9.479 -16.810 -2.912 1.00 1.65 C ATOM 2194 O ASP A 139 -10.086 -17.836 -2.607 1.00 2.28 O ATOM 2195 CB ASP A 139 -8.126 -16.149 -0.893 1.00 2.26 C ATOM 2196 CG ASP A 139 -8.633 -17.276 -0.011 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -9.820 -17.643 -0.143 1.00 3.20 O ATOM 2198 OD2 ASP A 139 -7.847 -17.790 0.811 1.00 3.67 O ATOM 0 H ASP A 139 -8.047 -14.609 -3.205 1.00 1.07 H new ATOM 0 HA ASP A 139 -7.468 -17.429 -2.474 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -7.129 -15.857 -0.563 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -8.771 -15.279 -0.768 1.00 2.26 H new ATOM 2203 N GLY A 140 -9.979 -15.876 -3.721 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.303 -16.010 -4.306 1.00 1.72 C ATOM 2205 C GLY A 140 -12.233 -14.910 -3.854 1.00 1.31 C ATOM 2206 O GLY A 140 -13.454 -15.070 -3.859 1.00 1.85 O ATOM 0 H GLY A 140 -9.485 -15.023 -3.983 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -11.223 -15.994 -5.393 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -11.725 -16.977 -4.032 1.00 1.72 H new ATOM 2210 N GLU A 141 -11.644 -13.790 -3.459 1.00 0.75 N ATOM 2211 CA GLU A 141 -12.405 -12.642 -2.994 1.00 0.94 C ATOM 2212 C GLU A 141 -11.729 -11.345 -3.406 1.00 0.82 C ATOM 2213 O GLU A 141 -10.506 -11.226 -3.327 1.00 1.19 O ATOM 2214 CB GLU A 141 -12.537 -12.662 -1.468 1.00 1.56 C ATOM 2215 CG GLU A 141 -13.347 -13.824 -0.921 1.00 1.38 C ATOM 2216 CD GLU A 141 -12.573 -15.131 -0.889 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -11.357 -15.111 -1.170 1.00 2.97 O ATOM 2218 OE2 GLU A 141 -13.183 -16.172 -0.567 1.00 2.47 O ATOM 0 H GLU A 141 -10.633 -13.653 -3.452 1.00 0.75 H new ATOM 0 HA GLU A 141 -13.394 -12.699 -3.448 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -11.539 -12.693 -1.030 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -12.999 -11.729 -1.144 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -13.681 -13.582 0.088 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -14.241 -13.954 -1.530 1.00 1.38 H new ATOM 2225 N MET A 142 -12.525 -10.358 -3.803 1.00 0.57 N ATOM 2226 CA MET A 142 -11.973 -9.068 -4.170 1.00 0.54 C ATOM 2227 C MET A 142 -11.385 -8.435 -2.931 1.00 0.58 C ATOM 2228 O MET A 142 -11.300 -9.072 -1.884 1.00 0.92 O ATOM 2229 CB MET A 142 -13.038 -8.133 -4.742 1.00 0.57 C ATOM 2230 CG MET A 142 -13.738 -8.677 -5.966 1.00 0.67 C ATOM 2231 SD MET A 142 -14.911 -7.515 -6.691 1.00 1.32 S ATOM 2232 CE MET A 142 -16.215 -7.533 -5.463 1.00 1.58 C ATOM 0 H MET A 142 -13.540 -10.428 -3.877 1.00 0.57 H new ATOM 0 HA MET A 142 -11.216 -9.224 -4.939 1.00 0.54 H new ATOM 0 HB2 MET A 142 -13.781 -7.930 -3.971 1.00 0.57 H new ATOM 0 HB3 MET A 142 -12.573 -7.180 -4.995 1.00 0.57 H new ATOM 0 HG2 MET A 142 -12.992 -8.944 -6.714 1.00 0.67 H new ATOM 0 HG3 MET A 142 -14.263 -9.594 -5.698 1.00 0.67 H new ATOM 0 HE1 MET A 142 -17.104 -7.051 -5.870 1.00 1.58 H new ATOM 0 HE2 MET A 142 -16.450 -8.564 -5.197 1.00 1.58 H new ATOM 0 HE3 MET A 142 -15.885 -6.995 -4.574 1.00 1.58 H new ATOM 2242 N LEU A 143 -11.000 -7.186 -3.036 1.00 0.55 N ATOM 2243 CA LEU A 143 -10.449 -6.492 -1.895 1.00 0.62 C ATOM 2244 C LEU A 143 -11.557 -5.892 -1.034 1.00 0.56 C ATOM 2245 O LEU A 143 -11.718 -6.245 0.122 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.429 -5.418 -2.307 1.00 0.76 C ATOM 2247 CG LEU A 143 -9.403 -4.995 -3.780 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -9.038 -6.166 -4.681 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -10.731 -4.389 -4.203 1.00 1.70 C ATOM 0 H LEU A 143 -11.057 -6.633 -3.891 1.00 0.55 H new ATOM 0 HA LEU A 143 -9.913 -7.230 -1.299 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -9.615 -4.529 -1.705 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -8.435 -5.779 -2.043 1.00 0.76 H new ATOM 0 HG LEU A 143 -8.633 -4.231 -3.887 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -9.027 -5.836 -5.720 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -8.051 -6.541 -4.409 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -9.774 -6.961 -4.560 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -10.681 -4.099 -5.253 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -11.526 -5.123 -4.067 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -10.940 -3.510 -3.593 1.00 1.70 H new ATOM 2261 N ARG A 144 -12.314 -4.970 -1.586 1.00 0.53 N ATOM 2262 CA ARG A 144 -13.369 -4.326 -0.830 1.00 0.52 C ATOM 2263 C ARG A 144 -14.455 -5.285 -0.442 1.00 0.61 C ATOM 2264 O ARG A 144 -14.966 -5.220 0.666 1.00 0.69 O ATOM 2265 CB ARG A 144 -13.988 -3.158 -1.575 1.00 0.53 C ATOM 2266 CG ARG A 144 -15.068 -2.472 -0.753 1.00 0.58 C ATOM 2267 CD ARG A 144 -15.460 -1.119 -1.322 1.00 0.85 C ATOM 2268 NE ARG A 144 -16.230 -1.238 -2.558 1.00 1.18 N ATOM 2269 CZ ARG A 144 -16.741 -0.195 -3.209 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -16.542 1.037 -2.757 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -17.454 -0.381 -4.310 1.00 2.16 N ATOM 0 H ARG A 144 -12.221 -4.650 -2.550 1.00 0.53 H new ATOM 0 HA ARG A 144 -12.886 -3.950 0.072 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -13.212 -2.437 -1.829 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.415 -3.511 -2.514 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -15.949 -3.113 -0.709 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -14.715 -2.344 0.270 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -16.046 -0.573 -0.583 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -14.561 -0.533 -1.512 1.00 0.85 H new ATOM 0 HE ARG A 144 -16.384 -2.170 -2.943 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -15.996 1.187 -1.908 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -16.935 1.834 -3.258 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -17.613 -1.325 -4.661 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -17.844 0.420 -4.806 1.00 2.16 H new ATOM 2285 N GLN A 145 -14.818 -6.163 -1.343 1.00 0.76 N ATOM 2286 CA GLN A 145 -15.858 -7.115 -1.050 1.00 0.92 C ATOM 2287 C GLN A 145 -15.605 -7.782 0.311 1.00 0.89 C ATOM 2288 O GLN A 145 -16.554 -8.117 1.027 1.00 0.97 O ATOM 2289 CB GLN A 145 -15.960 -8.133 -2.188 1.00 1.21 C ATOM 2290 CG GLN A 145 -16.174 -9.551 -1.726 1.00 0.96 C ATOM 2291 CD GLN A 145 -14.930 -10.154 -1.123 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -14.950 -11.279 -0.627 1.00 2.27 O ATOM 2293 NE2 GLN A 145 -13.835 -9.403 -1.164 1.00 1.87 N ATOM 0 H GLN A 145 -14.413 -6.238 -2.276 1.00 0.76 H new ATOM 0 HA GLN A 145 -16.817 -6.602 -0.978 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -16.782 -7.848 -2.844 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -15.048 -8.090 -2.783 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -16.978 -9.573 -0.991 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -16.497 -10.160 -2.570 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -13.868 -8.475 -1.586 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -12.961 -9.754 -0.773 1.00 1.87 H new ATOM 2302 N ILE A 146 -14.327 -7.956 0.686 1.00 0.85 N ATOM 2303 CA ILE A 146 -14.006 -8.561 1.967 1.00 0.90 C ATOM 2304 C ILE A 146 -13.904 -7.515 3.057 1.00 0.85 C ATOM 2305 O ILE A 146 -14.320 -7.756 4.185 1.00 1.01 O ATOM 2306 CB ILE A 146 -12.704 -9.371 1.951 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -11.704 -8.804 0.953 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -12.990 -10.838 1.664 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -10.391 -9.555 0.913 1.00 1.06 C ATOM 0 H ILE A 146 -13.519 -7.688 0.124 1.00 0.85 H new ATOM 0 HA ILE A 146 -14.829 -9.246 2.171 1.00 0.90 H new ATOM 0 HB ILE A 146 -12.253 -9.296 2.940 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -12.150 -8.817 -0.042 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -11.508 -7.761 1.201 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -12.054 -11.397 1.657 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -13.646 -11.239 2.437 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -13.475 -10.931 0.692 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -9.730 -9.093 0.179 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -9.922 -9.521 1.896 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -10.574 -10.593 0.634 1.00 1.06 H new ATOM 2321 N LEU A 147 -13.366 -6.347 2.720 1.00 0.72 N ATOM 2322 CA LEU A 147 -13.254 -5.281 3.705 1.00 0.75 C ATOM 2323 C LEU A 147 -14.656 -4.867 4.097 1.00 0.71 C ATOM 2324 O LEU A 147 -14.918 -4.381 5.193 1.00 0.81 O ATOM 2325 CB LEU A 147 -12.503 -4.079 3.120 1.00 0.92 C ATOM 2326 CG LEU A 147 -13.343 -3.149 2.228 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -14.262 -2.288 3.059 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -12.461 -2.260 1.387 1.00 1.66 C ATOM 0 H LEU A 147 -13.008 -6.119 1.793 1.00 0.72 H new ATOM 0 HA LEU A 147 -12.697 -5.634 4.573 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -12.092 -3.493 3.942 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -11.658 -4.448 2.538 1.00 0.92 H new ATOM 0 HG LEU A 147 -13.939 -3.784 1.573 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -14.844 -1.640 2.404 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -14.936 -2.924 3.633 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -13.670 -1.677 3.741 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -13.082 -1.614 0.767 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -11.836 -1.648 2.037 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -11.827 -2.875 0.749 1.00 1.66 H new ATOM 2340 N HIS A 148 -15.545 -5.064 3.150 1.00 0.71 N ATOM 2341 CA HIS A 148 -16.938 -4.732 3.294 1.00 0.76 C ATOM 2342 C HIS A 148 -17.584 -5.626 4.334 1.00 0.83 C ATOM 2343 O HIS A 148 -18.294 -5.162 5.227 1.00 0.92 O ATOM 2344 CB HIS A 148 -17.621 -4.914 1.934 1.00 0.79 C ATOM 2345 CG HIS A 148 -19.111 -4.738 1.962 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -19.920 -4.981 0.871 1.00 1.04 N ATOM 2347 CD2 HIS A 148 -19.937 -4.321 2.952 1.00 1.02 C ATOM 2348 CE1 HIS A 148 -21.176 -4.721 1.188 1.00 1.20 C ATOM 2349 NE2 HIS A 148 -21.212 -4.320 2.445 1.00 1.19 N ATOM 0 H HIS A 148 -15.312 -5.467 2.242 1.00 0.71 H new ATOM 0 HA HIS A 148 -17.044 -3.699 3.625 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -17.196 -4.200 1.229 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -17.392 -5.910 1.556 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -19.646 -4.041 3.954 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -22.027 -4.820 0.531 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -22.053 -4.052 2.957 1.00 1.19 H new ATOM 2358 N THR A 149 -17.341 -6.912 4.192 1.00 0.86 N ATOM 2359 CA THR A 149 -17.915 -7.896 5.100 1.00 0.97 C ATOM 2360 C THR A 149 -17.062 -8.124 6.347 1.00 1.00 C ATOM 2361 O THR A 149 -17.546 -8.696 7.325 1.00 1.13 O ATOM 2362 CB THR A 149 -18.110 -9.225 4.373 1.00 1.02 C ATOM 2363 OG1 THR A 149 -16.886 -9.688 3.833 1.00 1.35 O ATOM 2364 CG2 THR A 149 -19.113 -9.147 3.243 1.00 1.48 C ATOM 0 H THR A 149 -16.751 -7.305 3.459 1.00 0.86 H new ATOM 0 HA THR A 149 -18.874 -7.496 5.429 1.00 0.97 H new ATOM 0 HB THR A 149 -18.491 -9.913 5.128 1.00 1.02 H new ATOM 0 HG1 THR A 149 -17.033 -10.541 3.373 1.00 1.35 H new ATOM 0 HG21 THR A 149 -19.204 -10.124 2.769 1.00 1.48 H new ATOM 0 HG22 THR A 149 -20.083 -8.843 3.638 1.00 1.48 H new ATOM 0 HG23 THR A 149 -18.776 -8.417 2.507 1.00 1.48 H new ATOM 2372 N ARG A 150 -15.796 -7.711 6.322 1.00 0.91 N ATOM 2373 CA ARG A 150 -14.928 -7.933 7.477 1.00 0.97 C ATOM 2374 C ARG A 150 -14.446 -6.639 8.125 1.00 0.97 C ATOM 2375 O ARG A 150 -14.283 -6.574 9.345 1.00 1.16 O ATOM 2376 CB ARG A 150 -13.732 -8.796 7.078 1.00 1.01 C ATOM 2377 CG ARG A 150 -14.119 -10.187 6.599 1.00 1.12 C ATOM 2378 CD ARG A 150 -14.828 -10.978 7.689 1.00 1.43 C ATOM 2379 NE ARG A 150 -15.209 -12.314 7.239 1.00 1.84 N ATOM 2380 CZ ARG A 150 -14.335 -13.249 6.869 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -13.033 -12.997 6.901 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -14.766 -14.437 6.472 1.00 2.86 N ATOM 0 H ARG A 150 -15.356 -7.232 5.536 1.00 0.91 H new ATOM 0 HA ARG A 150 -15.530 -8.452 8.223 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -13.177 -8.290 6.288 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -13.060 -8.888 7.931 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -14.768 -10.105 5.728 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -13.226 -10.725 6.281 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -14.176 -11.061 8.558 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -15.718 -10.436 8.009 1.00 1.43 H new ATOM 0 HE ARG A 150 -16.202 -12.545 7.206 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -12.698 -12.085 7.210 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -12.367 -13.716 6.617 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -15.766 -14.635 6.450 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -14.098 -15.153 6.189 1.00 2.86 H new ATOM 2396 N ALA A 151 -14.192 -5.623 7.314 1.00 0.88 N ATOM 2397 CA ALA A 151 -13.694 -4.350 7.832 1.00 0.91 C ATOM 2398 C ALA A 151 -14.806 -3.316 7.981 1.00 0.92 C ATOM 2399 O ALA A 151 -15.542 -3.323 8.968 1.00 1.18 O ATOM 2400 CB ALA A 151 -12.581 -3.816 6.940 1.00 0.89 C ATOM 0 H ALA A 151 -14.320 -5.650 6.302 1.00 0.88 H new ATOM 0 HA ALA A 151 -13.293 -4.536 8.828 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -12.220 -2.868 7.338 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -11.761 -4.534 6.912 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -12.965 -3.664 5.931 1.00 0.89 H new ATOM 2406 N PHE A 152 -14.915 -2.416 7.007 1.00 0.79 N ATOM 2407 CA PHE A 152 -15.924 -1.369 7.046 1.00 0.99 C ATOM 2408 C PHE A 152 -16.895 -1.512 5.875 1.00 0.88 C ATOM 2409 O PHE A 152 -17.825 -2.317 5.931 1.00 1.32 O ATOM 2410 CB PHE A 152 -15.238 -0.001 7.026 1.00 1.26 C ATOM 2411 CG PHE A 152 -16.181 1.164 7.105 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -17.128 1.225 8.112 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -16.124 2.191 6.176 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -18.004 2.291 8.194 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -16.997 3.260 6.252 1.00 3.27 C ATOM 2416 CZ PHE A 152 -17.915 3.331 7.242 1.00 3.92 C ATOM 0 H PHE A 152 -14.315 -2.393 6.182 1.00 0.79 H new ATOM 0 HA PHE A 152 -16.502 -1.461 7.966 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -14.540 0.055 7.861 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -14.650 0.084 6.112 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -17.183 0.431 8.842 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -15.390 2.156 5.385 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -18.748 2.328 8.976 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -16.945 4.046 5.513 1.00 3.27 H new ATOM 0 HZ PHE A 152 -18.579 4.181 7.305 1.00 3.92 H new ATOM 2426 N ASP A 153 -16.672 -0.735 4.814 1.00 0.92 N ATOM 2427 CA ASP A 153 -17.525 -0.788 3.632 1.00 1.10 C ATOM 2428 C ASP A 153 -17.039 0.175 2.554 1.00 1.14 C ATOM 2429 O ASP A 153 -17.072 -0.148 1.365 1.00 1.88 O ATOM 2430 CB ASP A 153 -18.981 -0.475 4.002 1.00 1.43 C ATOM 2431 CG ASP A 153 -19.143 0.869 4.685 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -18.863 1.900 4.038 1.00 2.58 O ATOM 2433 OD2 ASP A 153 -19.549 0.894 5.865 1.00 2.80 O ATOM 0 H ASP A 153 -15.907 -0.063 4.752 1.00 0.92 H new ATOM 0 HA ASP A 153 -17.472 -1.800 3.232 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -19.591 -0.493 3.099 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -19.360 -1.258 4.659 1.00 1.43 H new ATOM 2438 N LYS A 154 -16.592 1.360 2.973 1.00 0.75 N ATOM 2439 CA LYS A 154 -16.107 2.370 2.036 1.00 0.78 C ATOM 2440 C LYS A 154 -15.652 3.634 2.768 1.00 0.91 C ATOM 2441 O LYS A 154 -16.461 4.337 3.374 1.00 1.80 O ATOM 2442 CB LYS A 154 -17.213 2.705 1.025 1.00 0.89 C ATOM 2443 CG LYS A 154 -16.850 3.800 0.032 1.00 0.86 C ATOM 2444 CD LYS A 154 -17.232 5.181 0.545 1.00 1.03 C ATOM 2445 CE LYS A 154 -18.737 5.314 0.733 1.00 1.54 C ATOM 2446 NZ LYS A 154 -19.476 5.122 -0.545 1.00 2.17 N ATOM 0 H LYS A 154 -16.556 1.642 3.953 1.00 0.75 H new ATOM 0 HA LYS A 154 -15.243 1.966 1.508 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -17.468 1.801 0.472 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -18.107 3.008 1.570 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.779 3.770 -0.166 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -17.355 3.612 -0.916 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -16.729 5.369 1.493 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -16.884 5.939 -0.157 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -19.078 4.580 1.463 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -18.966 6.299 1.140 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -20.457 5.449 -0.431 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -19.014 5.669 -1.299 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -19.474 4.113 -0.799 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.351 3.924 2.693 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.795 5.114 3.337 1.00 0.61 C ATOM 2462 C LEU A 155 -13.976 6.334 2.445 1.00 0.68 C ATOM 2463 O LEU A 155 -14.768 6.312 1.505 1.00 0.89 O ATOM 2464 CB LEU A 155 -12.306 4.921 3.654 1.00 0.60 C ATOM 2465 CG LEU A 155 -11.982 3.825 4.676 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.492 3.802 4.972 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -12.779 4.029 5.958 1.00 1.23 C ATOM 0 H LEU A 155 -13.667 3.354 2.195 1.00 0.61 H new ATOM 0 HA LEU A 155 -14.333 5.271 4.272 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.782 4.693 2.726 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -11.906 5.866 4.022 1.00 0.60 H new ATOM 0 HG LEU A 155 -12.266 2.863 4.249 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -10.278 3.019 5.699 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -9.941 3.604 4.052 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -10.187 4.767 5.377 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -12.533 3.240 6.669 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -12.530 4.998 6.391 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -13.845 3.995 5.733 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.242 7.401 2.736 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.341 8.617 1.950 1.00 0.77 C ATOM 2481 C ASN A 156 -11.984 8.997 1.383 1.00 0.65 C ATOM 2482 O ASN A 156 -11.030 9.211 2.131 1.00 0.69 O ATOM 2483 CB ASN A 156 -13.898 9.753 2.805 1.00 1.04 C ATOM 2484 CG ASN A 156 -15.214 9.380 3.459 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -15.268 8.494 4.310 1.00 2.44 O ATOM 2486 ND2 ASN A 156 -16.286 10.047 3.051 1.00 2.12 N ATOM 0 H ASN A 156 -12.576 7.446 3.507 1.00 0.66 H new ATOM 0 HA ASN A 156 -14.023 8.439 1.118 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -13.173 10.016 3.575 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -14.040 10.638 2.184 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -17.201 9.832 3.446 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -16.195 10.775 2.342 1.00 2.12 H new ATOM 2493 N LYS A 157 -11.905 9.075 0.058 1.00 0.64 N ATOM 2494 CA LYS A 157 -10.663 9.431 -0.615 1.00 0.64 C ATOM 2495 C LYS A 157 -10.134 10.759 -0.096 1.00 0.68 C ATOM 2496 O LYS A 157 -10.454 11.823 -0.627 1.00 0.95 O ATOM 2497 CB LYS A 157 -10.877 9.492 -2.126 1.00 0.79 C ATOM 2498 CG LYS A 157 -10.172 8.378 -2.885 1.00 0.96 C ATOM 2499 CD LYS A 157 -10.784 8.144 -4.260 1.00 1.67 C ATOM 2500 CE LYS A 157 -12.072 7.337 -4.171 1.00 1.70 C ATOM 2501 NZ LYS A 157 -13.167 8.101 -3.508 1.00 2.51 N ATOM 0 H LYS A 157 -12.688 8.896 -0.570 1.00 0.64 H new ATOM 0 HA LYS A 157 -9.921 8.662 -0.401 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -11.946 9.444 -2.336 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -10.523 10.454 -2.496 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -9.117 8.627 -2.996 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -10.222 7.457 -2.305 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -10.987 9.103 -4.736 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -10.068 7.619 -4.893 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -12.388 7.047 -5.173 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -11.885 6.417 -3.617 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -14.082 7.817 -3.912 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -13.162 7.900 -2.488 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -13.022 9.119 -3.661 1.00 2.51 H new ATOM 2515 N TRP A 158 -9.323 10.678 0.952 1.00 0.73 N ATOM 2516 CA TRP A 158 -8.732 11.852 1.574 1.00 0.83 C ATOM 2517 C TRP A 158 -9.793 12.910 1.873 1.00 1.08 C ATOM 2518 O TRP A 158 -10.487 12.774 2.902 1.00 1.47 O ATOM 2519 CB TRP A 158 -7.644 12.432 0.670 1.00 0.85 C ATOM 2520 CG TRP A 158 -6.822 13.502 1.328 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -6.381 13.518 2.622 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -6.337 14.705 0.722 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -5.655 14.662 2.858 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -5.614 15.405 1.707 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -6.445 15.259 -0.556 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -5.000 16.630 1.449 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -5.837 16.474 -0.809 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -5.123 17.148 0.190 1.00 2.95 C ATOM 2529 OXT TRP A 158 -9.919 13.864 1.077 1.00 1.75 O ATOM 0 H TRP A 158 -9.058 9.797 1.393 1.00 0.73 H new ATOM 0 HA TRP A 158 -8.285 11.548 2.520 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -6.985 11.627 0.347 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -8.109 12.843 -0.226 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -6.574 12.746 3.352 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -5.219 14.916 3.744 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -6.994 14.747 -1.332 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -4.447 17.151 2.217 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -5.914 16.911 -1.794 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -4.660 18.096 -0.039 1.00 2.95 H new TER 2540 TRP A 158