USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=27 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 42 THR OG1 : rot 1:sc= -0.107! USER MOD Set 1.2: A 53 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 55 ASN : amide:sc= -1.96! K(o=-4.4!,f=-3.4) USER MOD Set 1.4: A 124 MET CE :methyl 150:sc= -2.38 (180deg=-3.15!) USER MOD Set 2.1: A 19 ASN : amide:sc= -1.95 K(o=-1.9,f=-10!) USER MOD Set 2.2: A 23 LYS NZ :NH3+ -139:sc= 0.0652 (180deg=-0.259) 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 180:sc= 0 USER MOD Single : A 9 SER OG : rot 70:sc= -2.91! USER MOD Single : A 10 ASN : amide:sc= -5.5! K(o=-5.5!,f=-1.4) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.323 K(o=-0.32,f=-4.6!) USER MOD Single : A 31 SER OG : rot -114:sc= -6.83! USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot -80:sc= -4.02! USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 62:sc= -1.68 USER MOD Single : A 40 TYR OH : rot 127:sc= 0.156 USER MOD Single : A 48 GLN : amide:sc= -9.1! K(o=-9.1!,f=-5.3) USER MOD Single : A 50 GLN : amide:sc= -3.64! K(o=-3.6!,f=-1.4) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.248 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -4.15! K(o=-4.1!,f=-1.2) USER MOD Single : A 72 HIS : no HD1:sc= -0.374 K(o=-0.37,f=-1.3) USER MOD Single : A 73 THR OG1 : rot -33:sc= 0.00716 USER MOD Single : A 74 GLN : amide:sc= -1.19! K(o=-1.2!,f=0) USER MOD Single : A 79 GLN : amide:sc= -2.94! K(o=-2.9!,f=-0.17) USER MOD Single : A 80 GLN : amide:sc= -0.215 X(o=-0.22,f=-0.22) USER MOD Single : A 85 LYS NZ :NH3+ -170:sc=-0.00812 (180deg=-0.117) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0587 USER MOD Single : A 99 MET CE :methyl -141:sc= 0 (180deg=-1.17) USER MOD Single : A 103 ASN : amide:sc= -4.02! C(o=-4!,f=-1.9!) USER MOD Single : A 107 ASN : amide:sc= -6.16! K(o=-6.2!,f=-2.6) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.182 USER MOD Single : A 112 THR OG1 : rot 165:sc= 0 USER MOD Single : A 115 HIS : no HE2:sc= -8.52! C(o=-8.5!,f=-14!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 161:sc= -7.23! (180deg=-7.87!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.703 K(o=-0.7,f=-0.0013) USER MOD Single : A 142 MET CE :methyl -178:sc= 0 (180deg=-0.00621) USER MOD Single : A 145 GLN : amide:sc= -3.12! K(o=-3.1!,f=-1.4) USER MOD Single : A 148 HIS : no HD1:sc= -2.05 K(o=-2.1,f=-0.57) USER MOD Single : A 149 THR OG1 : rot -67:sc= 1.34 USER MOD Single : A 154 LYS NZ :NH3+ 154:sc= -3.6! (180deg=-6.25!) USER MOD Single : A 156 ASN : amide:sc= -3.34! K(o=-3.3!,f=-0.1) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 2.980 -10.081 -14.686 1.00 0.82 N ATOM 2 CA THR A 1 2.573 -10.318 -13.276 1.00 0.59 C ATOM 3 C THR A 1 2.096 -9.030 -12.612 1.00 0.52 C ATOM 4 O THR A 1 2.877 -8.328 -11.969 1.00 0.52 O ATOM 5 CB THR A 1 3.768 -10.895 -12.513 1.00 0.64 C ATOM 6 OG1 THR A 1 4.158 -12.141 -13.061 1.00 0.92 O ATOM 7 CG2 THR A 1 3.498 -11.105 -11.036 1.00 0.62 C ATOM 0 H1 THR A 1 3.299 -10.975 -15.110 1.00 0.82 H new ATOM 0 H2 THR A 1 2.170 -9.712 -15.224 1.00 0.82 H new ATOM 0 H3 THR A 1 3.756 -9.389 -14.712 1.00 0.82 H new ATOM 0 HA THR A 1 1.741 -11.021 -13.259 1.00 0.59 H new ATOM 0 HB THR A 1 4.559 -10.152 -12.616 1.00 0.64 H new ATOM 0 HG1 THR A 1 4.924 -12.493 -12.561 1.00 0.92 H new ATOM 0 HG21 THR A 1 4.387 -11.516 -10.558 1.00 0.62 H new ATOM 0 HG22 THR A 1 3.245 -10.151 -10.573 1.00 0.62 H new ATOM 0 HG23 THR A 1 2.667 -11.799 -10.913 1.00 0.62 H new ATOM 17 N VAL A 2 0.810 -8.728 -12.758 1.00 0.54 N ATOM 18 CA VAL A 2 0.244 -7.528 -12.155 1.00 0.54 C ATOM 19 C VAL A 2 0.155 -7.698 -10.644 1.00 0.44 C ATOM 20 O VAL A 2 -0.724 -8.397 -10.139 1.00 0.45 O ATOM 21 CB VAL A 2 -1.155 -7.213 -12.717 1.00 0.65 C ATOM 22 CG1 VAL A 2 -1.720 -5.951 -12.081 1.00 1.49 C ATOM 23 CG2 VAL A 2 -1.103 -7.076 -14.231 1.00 1.42 C ATOM 0 H VAL A 2 0.145 -9.294 -13.285 1.00 0.54 H new ATOM 0 HA VAL A 2 0.904 -6.695 -12.398 1.00 0.54 H new ATOM 0 HB VAL A 2 -1.818 -8.042 -12.470 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -2.709 -5.747 -12.493 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.798 -6.090 -11.003 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -1.059 -5.110 -12.292 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -2.100 -6.854 -14.611 1.00 1.42 H new ATOM 0 HG22 VAL A 2 -0.424 -6.267 -14.500 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.748 -8.009 -14.669 1.00 1.42 H new ATOM 33 N ALA A 3 1.082 -7.071 -9.931 1.00 0.43 N ATOM 34 CA ALA A 3 1.121 -7.170 -8.478 1.00 0.40 C ATOM 35 C ALA A 3 0.339 -6.045 -7.811 1.00 0.33 C ATOM 36 O ALA A 3 0.514 -4.863 -8.133 1.00 0.37 O ATOM 37 CB ALA A 3 2.561 -7.172 -7.990 1.00 0.48 C ATOM 0 H ALA A 3 1.816 -6.489 -10.335 1.00 0.43 H new ATOM 0 HA ALA A 3 0.645 -8.110 -8.199 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.577 -7.246 -6.903 1.00 0.48 H new ATOM 0 HB2 ALA A 3 3.090 -8.023 -8.420 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.051 -6.248 -8.298 1.00 0.48 H new ATOM 43 N TYR A 4 -0.516 -6.431 -6.866 1.00 0.38 N ATOM 44 CA TYR A 4 -1.329 -5.475 -6.124 1.00 0.48 C ATOM 45 C TYR A 4 -0.589 -5.004 -4.891 1.00 0.46 C ATOM 46 O TYR A 4 -0.297 -5.786 -3.989 1.00 0.72 O ATOM 47 CB TYR A 4 -2.677 -6.089 -5.740 1.00 0.79 C ATOM 48 CG TYR A 4 -3.574 -6.390 -6.922 1.00 2.03 C ATOM 49 CD1 TYR A 4 -3.122 -7.148 -7.997 1.00 3.01 C ATOM 50 CD2 TYR A 4 -4.877 -5.912 -6.964 1.00 2.70 C ATOM 51 CE1 TYR A 4 -3.940 -7.419 -9.076 1.00 4.21 C ATOM 52 CE2 TYR A 4 -5.704 -6.182 -8.038 1.00 3.83 C ATOM 53 CZ TYR A 4 -5.230 -6.935 -9.091 1.00 4.50 C ATOM 54 OH TYR A 4 -6.050 -7.203 -10.165 1.00 5.73 O ATOM 0 H TYR A 4 -0.663 -7.404 -6.597 1.00 0.38 H new ATOM 0 HA TYR A 4 -1.520 -4.615 -6.766 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -2.500 -7.011 -5.187 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -3.197 -5.408 -5.066 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -2.113 -7.532 -7.988 1.00 3.01 H new ATOM 0 HD2 TYR A 4 -5.251 -5.319 -6.143 1.00 2.70 H new ATOM 0 HE1 TYR A 4 -3.571 -8.007 -9.903 1.00 4.21 H new ATOM 0 HE2 TYR A 4 -6.716 -5.805 -8.052 1.00 3.83 H new ATOM 0 HH TYR A 4 -6.927 -6.790 -10.018 1.00 5.73 H new ATOM 64 N ILE A 5 -0.267 -3.722 -4.878 1.00 0.40 N ATOM 65 CA ILE A 5 0.467 -3.125 -3.778 1.00 0.45 C ATOM 66 C ILE A 5 -0.377 -2.094 -3.040 1.00 0.44 C ATOM 67 O ILE A 5 -1.242 -1.441 -3.623 1.00 0.57 O ATOM 68 CB ILE A 5 1.747 -2.438 -4.287 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.243 -3.121 -5.559 1.00 0.52 C ATOM 70 CG2 ILE A 5 2.832 -2.440 -3.224 1.00 0.93 C ATOM 71 CD1 ILE A 5 1.948 -2.321 -6.804 1.00 0.79 C ATOM 0 H ILE A 5 -0.506 -3.070 -5.625 1.00 0.40 H new ATOM 0 HA ILE A 5 0.726 -3.932 -3.093 1.00 0.45 H new ATOM 0 HB ILE A 5 1.506 -1.400 -4.516 1.00 0.55 H new ATOM 0 HG12 ILE A 5 3.318 -3.284 -5.483 1.00 0.52 H new ATOM 0 HG13 ILE A 5 1.777 -4.103 -5.644 1.00 0.52 H new ATOM 0 HG21 ILE A 5 3.723 -1.948 -3.613 1.00 0.93 H new ATOM 0 HG22 ILE A 5 2.478 -1.906 -2.342 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.074 -3.468 -2.953 1.00 0.93 H new ATOM 0 HD11 ILE A 5 2.323 -2.855 -7.677 1.00 0.79 H new ATOM 0 HD12 ILE A 5 0.871 -2.180 -6.900 1.00 0.79 H new ATOM 0 HD13 ILE A 5 2.436 -1.349 -6.736 1.00 0.79 H new ATOM 83 N ALA A 6 -0.105 -1.951 -1.755 1.00 0.48 N ATOM 84 CA ALA A 6 -0.812 -0.995 -0.914 1.00 0.51 C ATOM 85 C ALA A 6 0.163 0.036 -0.349 1.00 0.46 C ATOM 86 O ALA A 6 1.127 -0.319 0.330 1.00 0.58 O ATOM 87 CB ALA A 6 -1.539 -1.716 0.210 1.00 0.71 C ATOM 0 H ALA A 6 0.608 -2.490 -1.265 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.551 -0.474 -1.523 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -2.063 -0.988 0.830 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -2.258 -2.417 -0.213 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -0.818 -2.260 0.820 1.00 0.71 H new ATOM 93 N ILE A 7 -0.080 1.308 -0.648 1.00 0.44 N ATOM 94 CA ILE A 7 0.795 2.378 -0.180 1.00 0.43 C ATOM 95 C ILE A 7 0.081 3.291 0.816 1.00 0.49 C ATOM 96 O ILE A 7 -1.065 3.684 0.599 1.00 0.58 O ATOM 97 CB ILE A 7 1.313 3.211 -1.370 1.00 0.47 C ATOM 98 CG1 ILE A 7 2.259 4.314 -0.892 1.00 1.19 C ATOM 99 CG2 ILE A 7 0.149 3.802 -2.152 1.00 1.41 C ATOM 100 CD1 ILE A 7 2.931 5.056 -2.026 1.00 1.42 C ATOM 0 H ILE A 7 -0.871 1.623 -1.209 1.00 0.44 H new ATOM 0 HA ILE A 7 1.639 1.911 0.329 1.00 0.43 H new ATOM 0 HB ILE A 7 1.873 2.550 -2.032 1.00 0.47 H new ATOM 0 HG12 ILE A 7 1.700 5.024 -0.283 1.00 1.19 H new ATOM 0 HG13 ILE A 7 3.023 3.875 -0.250 1.00 1.19 H new ATOM 0 HG21 ILE A 7 0.532 4.387 -2.988 1.00 1.41 H new ATOM 0 HG22 ILE A 7 -0.481 2.997 -2.531 1.00 1.41 H new ATOM 0 HG23 ILE A 7 -0.439 4.446 -1.498 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.588 5.824 -1.619 1.00 1.42 H new ATOM 0 HD12 ILE A 7 3.517 4.356 -2.622 1.00 1.42 H new ATOM 0 HD13 ILE A 7 2.173 5.523 -2.655 1.00 1.42 H new ATOM 112 N GLY A 8 0.764 3.619 1.917 1.00 0.57 N ATOM 113 CA GLY A 8 0.161 4.479 2.926 1.00 0.69 C ATOM 114 C GLY A 8 1.178 5.289 3.713 1.00 0.68 C ATOM 115 O GLY A 8 2.322 4.867 3.888 1.00 0.77 O ATOM 0 H GLY A 8 1.713 3.308 2.125 1.00 0.57 H new ATOM 0 HA2 GLY A 8 -0.539 5.160 2.441 1.00 0.69 H new ATOM 0 HA3 GLY A 8 -0.418 3.866 3.617 1.00 0.69 H new ATOM 119 N SER A 9 0.749 6.456 4.194 1.00 0.70 N ATOM 120 CA SER A 9 1.611 7.341 4.976 1.00 0.75 C ATOM 121 C SER A 9 0.793 8.176 5.960 1.00 0.87 C ATOM 122 O SER A 9 -0.435 8.204 5.891 1.00 0.92 O ATOM 123 CB SER A 9 2.402 8.270 4.058 1.00 0.76 C ATOM 124 OG SER A 9 3.099 9.245 4.808 1.00 1.67 O ATOM 0 H SER A 9 -0.197 6.812 4.054 1.00 0.70 H new ATOM 0 HA SER A 9 2.303 6.714 5.537 1.00 0.75 H new ATOM 0 HB2 SER A 9 3.108 7.688 3.465 1.00 0.76 H new ATOM 0 HB3 SER A 9 1.725 8.759 3.358 1.00 0.76 H new ATOM 0 HG SER A 9 3.828 8.817 5.303 1.00 1.67 H new ATOM 130 N ASN A 10 1.486 8.862 6.866 1.00 1.03 N ATOM 131 CA ASN A 10 0.826 9.704 7.861 1.00 1.23 C ATOM 132 C ASN A 10 1.796 10.716 8.472 1.00 1.30 C ATOM 133 O ASN A 10 2.581 10.383 9.359 1.00 2.00 O ATOM 134 CB ASN A 10 0.197 8.842 8.964 1.00 1.55 C ATOM 135 CG ASN A 10 1.173 7.863 9.608 1.00 2.18 C ATOM 136 OD1 ASN A 10 0.803 7.127 10.523 1.00 2.66 O ATOM 137 ND2 ASN A 10 2.417 7.841 9.139 1.00 3.02 N ATOM 0 H ASN A 10 2.504 8.851 6.932 1.00 1.03 H new ATOM 0 HA ASN A 10 0.038 10.259 7.352 1.00 1.23 H new ATOM 0 HB2 ASN A 10 -0.211 9.495 9.735 1.00 1.55 H new ATOM 0 HB3 ASN A 10 -0.640 8.284 8.544 1.00 1.55 H new ATOM 0 HD21 ASN A 10 3.101 7.199 9.539 1.00 3.02 H new ATOM 0 HD22 ASN A 10 2.687 8.466 8.379 1.00 3.02 H new ATOM 144 N LEU A 11 1.731 11.955 7.994 1.00 1.21 N ATOM 145 CA LEU A 11 2.599 13.015 8.496 1.00 1.31 C ATOM 146 C LEU A 11 2.020 14.389 8.170 1.00 1.49 C ATOM 147 O LEU A 11 0.877 14.500 7.726 1.00 1.96 O ATOM 148 CB LEU A 11 4.005 12.892 7.895 1.00 1.36 C ATOM 149 CG LEU A 11 4.109 13.212 6.402 1.00 1.66 C ATOM 150 CD1 LEU A 11 5.566 13.288 5.973 1.00 2.11 C ATOM 151 CD2 LEU A 11 3.372 12.167 5.581 1.00 2.45 C ATOM 0 H LEU A 11 1.087 12.250 7.260 1.00 1.21 H new ATOM 0 HA LEU A 11 2.665 12.908 9.579 1.00 1.31 H new ATOM 0 HB2 LEU A 11 4.674 13.558 8.440 1.00 1.36 H new ATOM 0 HB3 LEU A 11 4.364 11.876 8.058 1.00 1.36 H new ATOM 0 HG LEU A 11 3.645 14.182 6.226 1.00 1.66 H new ATOM 0 HD11 LEU A 11 5.620 13.516 4.909 1.00 2.11 H new ATOM 0 HD12 LEU A 11 6.071 14.071 6.538 1.00 2.11 H new ATOM 0 HD13 LEU A 11 6.052 12.331 6.164 1.00 2.11 H new ATOM 0 HD21 LEU A 11 3.456 12.410 4.522 1.00 2.45 H new ATOM 0 HD22 LEU A 11 3.810 11.186 5.764 1.00 2.45 H new ATOM 0 HD23 LEU A 11 2.320 12.154 5.868 1.00 2.45 H new ATOM 163 N ALA A 12 2.817 15.432 8.390 1.00 1.57 N ATOM 164 CA ALA A 12 2.384 16.798 8.112 1.00 1.79 C ATOM 165 C ALA A 12 2.002 16.955 6.646 1.00 1.71 C ATOM 166 O ALA A 12 1.038 17.644 6.312 1.00 2.29 O ATOM 167 CB ALA A 12 3.479 17.785 8.485 1.00 2.08 C ATOM 0 H ALA A 12 3.765 15.357 8.759 1.00 1.57 H new ATOM 0 HA ALA A 12 1.503 17.009 8.718 1.00 1.79 H new ATOM 0 HB1 ALA A 12 3.142 18.800 8.272 1.00 2.08 H new ATOM 0 HB2 ALA A 12 3.705 17.693 9.547 1.00 2.08 H new ATOM 0 HB3 ALA A 12 4.375 17.571 7.903 1.00 2.08 H new ATOM 173 N SER A 13 2.765 16.301 5.775 1.00 1.54 N ATOM 174 CA SER A 13 2.511 16.350 4.341 1.00 1.42 C ATOM 175 C SER A 13 2.437 14.937 3.769 1.00 1.10 C ATOM 176 O SER A 13 3.433 14.403 3.280 1.00 1.17 O ATOM 177 CB SER A 13 3.605 17.150 3.633 1.00 1.72 C ATOM 178 OG SER A 13 3.640 18.488 4.097 1.00 2.45 O ATOM 0 H SER A 13 3.567 15.729 6.040 1.00 1.54 H new ATOM 0 HA SER A 13 1.555 16.846 4.175 1.00 1.42 H new ATOM 0 HB2 SER A 13 4.573 16.678 3.803 1.00 1.72 H new ATOM 0 HB3 SER A 13 3.429 17.139 2.557 1.00 1.72 H new ATOM 0 HG SER A 13 4.349 18.978 3.630 1.00 2.45 H new ATOM 184 N PRO A 14 1.251 14.305 3.840 1.00 0.96 N ATOM 185 CA PRO A 14 1.048 12.938 3.342 1.00 0.92 C ATOM 186 C PRO A 14 1.430 12.773 1.876 1.00 0.86 C ATOM 187 O PRO A 14 1.618 11.654 1.403 1.00 0.90 O ATOM 188 CB PRO A 14 -0.456 12.710 3.524 1.00 1.18 C ATOM 189 CG PRO A 14 -0.860 13.662 4.594 1.00 1.23 C ATOM 190 CD PRO A 14 0.019 14.868 4.424 1.00 1.14 C ATOM 0 HA PRO A 14 1.676 12.225 3.876 1.00 0.92 H new ATOM 0 HB2 PRO A 14 -1.000 12.901 2.599 1.00 1.18 H new ATOM 0 HB3 PRO A 14 -0.668 11.680 3.811 1.00 1.18 H new ATOM 0 HG2 PRO A 14 -1.913 13.930 4.502 1.00 1.23 H new ATOM 0 HG3 PRO A 14 -0.729 13.219 5.581 1.00 1.23 H new ATOM 0 HD2 PRO A 14 -0.436 15.609 3.767 1.00 1.14 H new ATOM 0 HD3 PRO A 14 0.214 15.362 5.376 1.00 1.14 H new ATOM 198 N LEU A 15 1.532 13.886 1.160 1.00 0.89 N ATOM 199 CA LEU A 15 1.879 13.853 -0.257 1.00 0.90 C ATOM 200 C LEU A 15 3.364 13.563 -0.469 1.00 0.84 C ATOM 201 O LEU A 15 3.751 13.005 -1.495 1.00 0.84 O ATOM 202 CB LEU A 15 1.511 15.182 -0.923 1.00 1.07 C ATOM 203 CG LEU A 15 1.813 15.262 -2.423 1.00 1.33 C ATOM 204 CD1 LEU A 15 1.024 14.209 -3.188 1.00 1.67 C ATOM 205 CD2 LEU A 15 1.502 16.654 -2.952 1.00 1.72 C ATOM 0 H LEU A 15 1.380 14.822 1.536 1.00 0.89 H new ATOM 0 HA LEU A 15 1.309 13.045 -0.715 1.00 0.90 H new ATOM 0 HB2 LEU A 15 0.447 15.364 -0.772 1.00 1.07 H new ATOM 0 HB3 LEU A 15 2.047 15.985 -0.417 1.00 1.07 H new ATOM 0 HG LEU A 15 2.875 15.065 -2.571 1.00 1.33 H new ATOM 0 HD11 LEU A 15 1.253 14.284 -4.251 1.00 1.67 H new ATOM 0 HD12 LEU A 15 1.296 13.217 -2.827 1.00 1.67 H new ATOM 0 HD13 LEU A 15 -0.043 14.371 -3.035 1.00 1.67 H new ATOM 0 HD21 LEU A 15 1.722 16.695 -4.019 1.00 1.72 H new ATOM 0 HD22 LEU A 15 0.448 16.878 -2.790 1.00 1.72 H new ATOM 0 HD23 LEU A 15 2.114 17.388 -2.427 1.00 1.72 H new ATOM 217 N GLU A 16 4.193 13.954 0.494 1.00 0.86 N ATOM 218 CA GLU A 16 5.633 13.742 0.391 1.00 0.88 C ATOM 219 C GLU A 16 5.997 12.261 0.481 1.00 0.76 C ATOM 220 O GLU A 16 6.650 11.721 -0.410 1.00 0.75 O ATOM 221 CB GLU A 16 6.370 14.522 1.483 1.00 1.05 C ATOM 222 CG GLU A 16 6.252 16.031 1.341 1.00 1.40 C ATOM 223 CD GLU A 16 7.097 16.777 2.356 1.00 1.82 C ATOM 224 OE1 GLU A 16 8.330 16.576 2.364 1.00 2.49 O ATOM 225 OE2 GLU A 16 6.528 17.564 3.141 1.00 2.16 O ATOM 0 H GLU A 16 3.894 14.418 1.352 1.00 0.86 H new ATOM 0 HA GLU A 16 5.943 14.107 -0.588 1.00 0.88 H new ATOM 0 HB2 GLU A 16 5.978 14.226 2.456 1.00 1.05 H new ATOM 0 HB3 GLU A 16 7.424 14.246 1.466 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.555 16.323 0.336 1.00 1.40 H new ATOM 0 HG3 GLU A 16 5.208 16.323 1.457 1.00 1.40 H new ATOM 232 N GLN A 17 5.589 11.614 1.569 1.00 0.73 N ATOM 233 CA GLN A 17 5.892 10.200 1.776 1.00 0.71 C ATOM 234 C GLN A 17 5.300 9.328 0.677 1.00 0.57 C ATOM 235 O GLN A 17 6.028 8.615 -0.010 1.00 0.51 O ATOM 236 CB GLN A 17 5.385 9.743 3.137 1.00 0.86 C ATOM 237 CG GLN A 17 6.045 10.466 4.296 1.00 1.20 C ATOM 238 CD GLN A 17 7.553 10.336 4.273 1.00 1.35 C ATOM 239 OE1 GLN A 17 8.092 9.231 4.308 1.00 2.20 O ATOM 240 NE2 GLN A 17 8.243 11.469 4.212 1.00 1.36 N ATOM 0 H GLN A 17 5.049 12.044 2.320 1.00 0.73 H new ATOM 0 HA GLN A 17 6.976 10.089 1.740 1.00 0.71 H new ATOM 0 HB2 GLN A 17 4.307 9.899 3.187 1.00 0.86 H new ATOM 0 HB3 GLN A 17 5.557 8.672 3.240 1.00 0.86 H new ATOM 0 HG2 GLN A 17 5.773 11.521 4.265 1.00 1.20 H new ATOM 0 HG3 GLN A 17 5.663 10.066 5.235 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.753 12.363 4.185 1.00 1.36 H new ATOM 0 HE22 GLN A 17 9.263 11.445 4.192 1.00 1.36 H new ATOM 249 N VAL A 18 3.982 9.374 0.519 1.00 0.57 N ATOM 250 CA VAL A 18 3.314 8.573 -0.505 1.00 0.53 C ATOM 251 C VAL A 18 4.046 8.690 -1.840 1.00 0.49 C ATOM 252 O VAL A 18 4.150 7.724 -2.593 1.00 0.51 O ATOM 253 CB VAL A 18 1.842 8.993 -0.691 1.00 0.62 C ATOM 254 CG1 VAL A 18 1.743 10.415 -1.221 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.120 8.022 -1.614 1.00 1.25 C ATOM 0 H VAL A 18 3.357 9.952 1.081 1.00 0.57 H new ATOM 0 HA VAL A 18 3.335 7.538 -0.165 1.00 0.53 H new ATOM 0 HB VAL A 18 1.357 8.964 0.285 1.00 0.62 H new ATOM 0 HG11 VAL A 18 0.694 10.686 -1.343 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.215 11.100 -0.516 1.00 1.10 H new ATOM 0 HG13 VAL A 18 2.249 10.480 -2.184 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.083 8.336 -1.733 1.00 1.25 H new ATOM 0 HG22 VAL A 18 1.610 8.013 -2.588 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.149 7.021 -1.184 1.00 1.25 H new ATOM 265 N ASN A 19 4.561 9.882 -2.116 1.00 0.52 N ATOM 266 CA ASN A 19 5.295 10.144 -3.348 1.00 0.57 C ATOM 267 C ASN A 19 6.643 9.429 -3.346 1.00 0.50 C ATOM 268 O ASN A 19 7.137 9.013 -4.394 1.00 0.52 O ATOM 269 CB ASN A 19 5.504 11.648 -3.513 1.00 0.72 C ATOM 270 CG ASN A 19 6.323 11.988 -4.739 1.00 1.26 C ATOM 271 OD1 ASN A 19 7.486 11.607 -4.852 1.00 1.96 O ATOM 272 ND2 ASN A 19 5.718 12.712 -5.668 1.00 1.71 N ATOM 0 H ASN A 19 4.483 10.689 -1.497 1.00 0.52 H new ATOM 0 HA ASN A 19 4.709 9.763 -4.185 1.00 0.57 H new ATOM 0 HB2 ASN A 19 4.534 12.141 -3.580 1.00 0.72 H new ATOM 0 HB3 ASN A 19 6.002 12.042 -2.627 1.00 0.72 H new ATOM 0 HD21 ASN A 19 6.219 12.974 -6.517 1.00 1.71 H new ATOM 0 HD22 ASN A 19 4.751 13.008 -5.535 1.00 1.71 H new ATOM 279 N ALA A 20 7.229 9.292 -2.163 1.00 0.49 N ATOM 280 CA ALA A 20 8.518 8.630 -2.020 1.00 0.49 C ATOM 281 C ALA A 20 8.471 7.235 -2.627 1.00 0.42 C ATOM 282 O ALA A 20 9.356 6.848 -3.393 1.00 0.48 O ATOM 283 CB ALA A 20 8.923 8.561 -0.554 1.00 0.57 C ATOM 0 H ALA A 20 6.830 9.632 -1.288 1.00 0.49 H new ATOM 0 HA ALA A 20 9.266 9.214 -2.556 1.00 0.49 H new ATOM 0 HB1 ALA A 20 9.889 8.063 -0.466 1.00 0.57 H new ATOM 0 HB2 ALA A 20 8.997 9.570 -0.149 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.174 8.000 0.004 1.00 0.57 H new ATOM 289 N ALA A 21 7.423 6.488 -2.302 1.00 0.41 N ATOM 290 CA ALA A 21 7.267 5.149 -2.844 1.00 0.45 C ATOM 291 C ALA A 21 6.883 5.235 -4.311 1.00 0.36 C ATOM 292 O ALA A 21 7.140 4.321 -5.088 1.00 0.40 O ATOM 293 CB ALA A 21 6.222 4.361 -2.070 1.00 0.64 C ATOM 0 H ALA A 21 6.677 6.785 -1.673 1.00 0.41 H new ATOM 0 HA ALA A 21 8.217 4.624 -2.748 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.127 3.363 -2.499 1.00 0.64 H new ATOM 0 HB2 ALA A 21 6.526 4.280 -1.026 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.262 4.874 -2.129 1.00 0.64 H new ATOM 299 N LEU A 22 6.274 6.357 -4.683 1.00 0.40 N ATOM 300 CA LEU A 22 5.863 6.589 -6.061 1.00 0.47 C ATOM 301 C LEU A 22 7.084 6.741 -6.959 1.00 0.44 C ATOM 302 O LEU A 22 7.021 6.484 -8.161 1.00 0.53 O ATOM 303 CB LEU A 22 4.974 7.831 -6.148 1.00 0.64 C ATOM 304 CG LEU A 22 3.468 7.559 -6.211 1.00 1.16 C ATOM 305 CD1 LEU A 22 3.094 6.925 -7.541 1.00 1.74 C ATOM 306 CD2 LEU A 22 3.028 6.668 -5.059 1.00 1.73 C ATOM 0 H LEU A 22 6.054 7.122 -4.045 1.00 0.40 H new ATOM 0 HA LEU A 22 5.288 5.729 -6.404 1.00 0.47 H new ATOM 0 HB2 LEU A 22 5.176 8.463 -5.283 1.00 0.64 H new ATOM 0 HB3 LEU A 22 5.260 8.401 -7.032 1.00 0.64 H new ATOM 0 HG LEU A 22 2.950 8.514 -6.122 1.00 1.16 H new ATOM 0 HD11 LEU A 22 2.020 6.739 -7.566 1.00 1.74 H new ATOM 0 HD12 LEU A 22 3.365 7.598 -8.354 1.00 1.74 H new ATOM 0 HD13 LEU A 22 3.628 5.982 -7.657 1.00 1.74 H new ATOM 0 HD21 LEU A 22 1.955 6.490 -5.126 1.00 1.73 H new ATOM 0 HD22 LEU A 22 3.558 5.717 -5.112 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.256 7.158 -4.112 1.00 1.73 H new ATOM 318 N LYS A 23 8.203 7.146 -6.361 1.00 0.43 N ATOM 319 CA LYS A 23 9.444 7.312 -7.102 1.00 0.52 C ATOM 320 C LYS A 23 10.075 5.950 -7.368 1.00 0.47 C ATOM 321 O LYS A 23 10.517 5.662 -8.481 1.00 0.56 O ATOM 322 CB LYS A 23 10.424 8.199 -6.331 1.00 0.61 C ATOM 323 CG LYS A 23 9.902 9.598 -6.051 1.00 1.13 C ATOM 324 CD LYS A 23 10.957 10.454 -5.370 1.00 1.51 C ATOM 325 CE LYS A 23 10.430 11.842 -5.047 1.00 2.12 C ATOM 326 NZ LYS A 23 9.950 12.551 -6.264 1.00 2.74 N ATOM 0 H LYS A 23 8.272 7.364 -5.367 1.00 0.43 H new ATOM 0 HA LYS A 23 9.216 7.796 -8.051 1.00 0.52 H new ATOM 0 HB2 LYS A 23 10.667 7.717 -5.384 1.00 0.61 H new ATOM 0 HB3 LYS A 23 11.352 8.275 -6.897 1.00 0.61 H new ATOM 0 HG2 LYS A 23 9.596 10.068 -6.986 1.00 1.13 H new ATOM 0 HG3 LYS A 23 9.016 9.538 -5.419 1.00 1.13 H new ATOM 0 HD2 LYS A 23 11.285 9.966 -4.452 1.00 1.51 H new ATOM 0 HD3 LYS A 23 11.831 10.538 -6.016 1.00 1.51 H new ATOM 0 HE2 LYS A 23 9.615 11.762 -4.328 1.00 2.12 H new ATOM 0 HE3 LYS A 23 11.217 12.428 -4.572 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 10.246 13.547 -6.225 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 10.356 12.102 -7.110 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 8.912 12.499 -6.309 1.00 2.74 H new ATOM 340 N ALA A 24 10.105 5.111 -6.334 1.00 0.40 N ATOM 341 CA ALA A 24 10.669 3.771 -6.453 1.00 0.43 C ATOM 342 C ALA A 24 9.735 2.867 -7.246 1.00 0.38 C ATOM 343 O ALA A 24 10.121 2.311 -8.273 1.00 0.46 O ATOM 344 CB ALA A 24 10.935 3.184 -5.073 1.00 0.51 C ATOM 0 H ALA A 24 9.746 5.337 -5.406 1.00 0.40 H new ATOM 0 HA ALA A 24 11.616 3.840 -6.989 1.00 0.43 H new ATOM 0 HB1 ALA A 24 11.356 2.184 -5.178 1.00 0.51 H new ATOM 0 HB2 ALA A 24 11.640 3.820 -4.537 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.000 3.128 -4.515 1.00 0.51 H new ATOM 350 N LEU A 25 8.502 2.737 -6.767 1.00 0.43 N ATOM 351 CA LEU A 25 7.503 1.912 -7.433 1.00 0.40 C ATOM 352 C LEU A 25 7.309 2.385 -8.867 1.00 0.37 C ATOM 353 O LEU A 25 7.135 1.577 -9.780 1.00 0.45 O ATOM 354 CB LEU A 25 6.171 1.974 -6.682 1.00 0.47 C ATOM 355 CG LEU A 25 5.137 0.925 -7.099 1.00 0.56 C ATOM 356 CD1 LEU A 25 5.630 -0.473 -6.768 1.00 0.96 C ATOM 357 CD2 LEU A 25 3.807 1.197 -6.419 1.00 1.04 C ATOM 0 H LEU A 25 8.171 3.194 -5.917 1.00 0.43 H new ATOM 0 HA LEU A 25 7.854 0.880 -7.440 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.368 1.863 -5.616 1.00 0.47 H new ATOM 0 HB3 LEU A 25 5.738 2.964 -6.824 1.00 0.47 H new ATOM 0 HG LEU A 25 4.994 0.989 -8.178 1.00 0.56 H new ATOM 0 HD11 LEU A 25 4.881 -1.204 -7.072 1.00 0.96 H new ATOM 0 HD12 LEU A 25 6.562 -0.666 -7.300 1.00 0.96 H new ATOM 0 HD13 LEU A 25 5.801 -0.554 -5.695 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.081 0.443 -6.725 1.00 1.04 H new ATOM 0 HD22 LEU A 25 3.937 1.158 -5.337 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.447 2.185 -6.706 1.00 1.04 H new ATOM 369 N GLY A 26 7.358 3.703 -9.057 1.00 0.43 N ATOM 370 CA GLY A 26 7.204 4.268 -10.383 1.00 0.53 C ATOM 371 C GLY A 26 8.190 3.663 -11.354 1.00 0.56 C ATOM 372 O GLY A 26 7.817 3.233 -12.446 1.00 0.82 O ATOM 0 H GLY A 26 7.502 4.387 -8.314 1.00 0.43 H new ATOM 0 HA2 GLY A 26 6.188 4.096 -10.738 1.00 0.53 H new ATOM 0 HA3 GLY A 26 7.348 5.348 -10.340 1.00 0.53 H new ATOM 376 N ASP A 27 9.452 3.602 -10.941 1.00 0.59 N ATOM 377 CA ASP A 27 10.494 3.015 -11.766 1.00 0.76 C ATOM 378 C ASP A 27 11.276 1.981 -10.967 1.00 0.56 C ATOM 379 O ASP A 27 12.156 2.321 -10.175 1.00 0.81 O ATOM 380 CB ASP A 27 11.439 4.102 -12.281 1.00 1.35 C ATOM 381 CG ASP A 27 12.542 3.544 -13.158 1.00 2.02 C ATOM 382 OD1 ASP A 27 12.222 2.938 -14.203 1.00 2.42 O ATOM 383 OD2 ASP A 27 13.726 3.709 -12.799 1.00 2.61 O ATOM 0 H ASP A 27 9.775 3.953 -10.039 1.00 0.59 H new ATOM 0 HA ASP A 27 10.027 2.523 -12.619 1.00 0.76 H new ATOM 0 HB2 ASP A 27 10.867 4.838 -12.846 1.00 1.35 H new ATOM 0 HB3 ASP A 27 11.882 4.625 -11.434 1.00 1.35 H new ATOM 388 N ILE A 28 10.946 0.717 -11.189 1.00 0.51 N ATOM 389 CA ILE A 28 11.606 -0.390 -10.509 1.00 0.51 C ATOM 390 C ILE A 28 12.413 -1.206 -11.512 1.00 0.49 C ATOM 391 O ILE A 28 12.007 -1.333 -12.667 1.00 0.48 O ATOM 392 CB ILE A 28 10.573 -1.309 -9.819 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.520 -0.466 -9.094 1.00 0.82 C ATOM 394 CG2 ILE A 28 11.247 -2.266 -8.844 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.510 -1.279 -8.312 1.00 1.26 C ATOM 0 H ILE A 28 10.217 0.430 -11.842 1.00 0.51 H new ATOM 0 HA ILE A 28 12.269 0.025 -9.750 1.00 0.51 H new ATOM 0 HB ILE A 28 10.084 -1.906 -10.589 1.00 0.71 H new ATOM 0 HG12 ILE A 28 10.024 0.219 -8.413 1.00 0.82 H new ATOM 0 HG13 ILE A 28 8.991 0.144 -9.826 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.493 -2.899 -8.375 1.00 0.83 H new ATOM 0 HG22 ILE A 28 11.961 -2.890 -9.382 1.00 0.83 H new ATOM 0 HG23 ILE A 28 11.770 -1.695 -8.077 1.00 0.83 H new ATOM 0 HD11 ILE A 28 7.800 -0.609 -7.828 1.00 1.26 H new ATOM 0 HD12 ILE A 28 7.976 -1.946 -8.990 1.00 1.26 H new ATOM 0 HD13 ILE A 28 9.026 -1.869 -7.554 1.00 1.26 H new ATOM 407 N PRO A 29 13.564 -1.764 -11.089 1.00 0.68 N ATOM 408 CA PRO A 29 14.437 -2.571 -11.930 1.00 0.83 C ATOM 409 C PRO A 29 13.763 -3.220 -13.146 1.00 0.70 C ATOM 410 O PRO A 29 14.344 -3.242 -14.232 1.00 0.88 O ATOM 411 CB PRO A 29 14.883 -3.629 -10.934 1.00 1.07 C ATOM 412 CG PRO A 29 15.015 -2.894 -9.636 1.00 1.14 C ATOM 413 CD PRO A 29 14.143 -1.660 -9.736 1.00 0.87 C ATOM 0 HA PRO A 29 15.223 -1.975 -12.394 1.00 0.83 H new ATOM 0 HB2 PRO A 29 14.154 -4.436 -10.860 1.00 1.07 H new ATOM 0 HB3 PRO A 29 15.829 -4.080 -11.232 1.00 1.07 H new ATOM 0 HG2 PRO A 29 14.700 -3.523 -8.803 1.00 1.14 H new ATOM 0 HG3 PRO A 29 16.054 -2.619 -9.452 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.370 -1.650 -8.967 1.00 0.87 H new ATOM 0 HD3 PRO A 29 14.724 -0.746 -9.616 1.00 0.87 H new ATOM 421 N GLU A 30 12.557 -3.768 -12.975 1.00 0.54 N ATOM 422 CA GLU A 30 11.875 -4.426 -14.093 1.00 0.58 C ATOM 423 C GLU A 30 10.371 -4.135 -14.147 1.00 0.60 C ATOM 424 O GLU A 30 9.778 -4.150 -15.225 1.00 1.01 O ATOM 425 CB GLU A 30 12.092 -5.939 -14.017 1.00 0.62 C ATOM 426 CG GLU A 30 13.555 -6.350 -14.042 1.00 0.63 C ATOM 427 CD GLU A 30 13.740 -7.852 -13.940 1.00 1.39 C ATOM 428 OE1 GLU A 30 13.302 -8.437 -12.927 1.00 2.35 O ATOM 429 OE2 GLU A 30 14.324 -8.443 -14.873 1.00 1.66 O ATOM 0 H GLU A 30 12.042 -3.771 -12.095 1.00 0.54 H new ATOM 0 HA GLU A 30 12.313 -4.016 -15.003 1.00 0.58 H new ATOM 0 HB2 GLU A 30 11.633 -6.317 -13.103 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.577 -6.413 -14.852 1.00 0.62 H new ATOM 0 HG2 GLU A 30 14.013 -5.993 -14.964 1.00 0.63 H new ATOM 0 HG3 GLU A 30 14.079 -5.866 -13.218 1.00 0.63 H new ATOM 436 N SER A 31 9.749 -3.901 -12.996 1.00 0.36 N ATOM 437 CA SER A 31 8.306 -3.649 -12.953 1.00 0.34 C ATOM 438 C SER A 31 7.942 -2.265 -13.488 1.00 0.36 C ATOM 439 O SER A 31 8.801 -1.530 -13.977 1.00 0.46 O ATOM 440 CB SER A 31 7.776 -3.802 -11.533 1.00 0.37 C ATOM 441 OG SER A 31 8.380 -2.876 -10.661 1.00 0.83 O ATOM 0 H SER A 31 10.212 -3.880 -12.087 1.00 0.36 H new ATOM 0 HA SER A 31 7.839 -4.391 -13.600 1.00 0.34 H new ATOM 0 HB2 SER A 31 6.695 -3.659 -11.528 1.00 0.37 H new ATOM 0 HB3 SER A 31 7.965 -4.815 -11.179 1.00 0.37 H new ATOM 0 HG SER A 31 8.927 -3.354 -10.004 1.00 0.83 H new ATOM 447 N HIS A 32 6.655 -1.922 -13.387 1.00 0.33 N ATOM 448 CA HIS A 32 6.161 -0.626 -13.858 1.00 0.39 C ATOM 449 C HIS A 32 4.716 -0.385 -13.419 1.00 0.34 C ATOM 450 O HIS A 32 3.879 -1.288 -13.469 1.00 0.36 O ATOM 451 CB HIS A 32 6.260 -0.537 -15.383 1.00 0.51 C ATOM 452 CG HIS A 32 5.715 0.737 -15.947 1.00 0.94 C ATOM 453 ND1 HIS A 32 6.220 1.979 -15.626 1.00 1.83 N ATOM 454 CD2 HIS A 32 4.702 0.960 -16.819 1.00 1.60 C ATOM 455 CE1 HIS A 32 5.540 2.909 -16.271 1.00 2.29 C ATOM 456 NE2 HIS A 32 4.614 2.318 -17.002 1.00 2.07 N ATOM 0 H HIS A 32 5.937 -2.524 -12.983 1.00 0.33 H new ATOM 0 HA HIS A 32 6.787 0.146 -13.411 1.00 0.39 H new ATOM 0 HB2 HIS A 32 7.305 -0.637 -15.677 1.00 0.51 H new ATOM 0 HB3 HIS A 32 5.724 -1.378 -15.823 1.00 0.51 H new ATOM 0 HD2 HIS A 32 4.080 0.209 -17.284 1.00 1.60 H new ATOM 0 HE1 HIS A 32 5.713 3.973 -16.211 1.00 2.29 H new ATOM 0 HE2 HIS A 32 3.942 2.793 -17.605 1.00 2.07 H new ATOM 465 N ILE A 33 4.441 0.847 -12.993 1.00 0.36 N ATOM 466 CA ILE A 33 3.109 1.244 -12.534 1.00 0.36 C ATOM 467 C ILE A 33 2.030 1.005 -13.595 1.00 0.38 C ATOM 468 O ILE A 33 2.283 1.119 -14.795 1.00 0.50 O ATOM 469 CB ILE A 33 3.100 2.730 -12.114 1.00 0.53 C ATOM 470 CG1 ILE A 33 3.786 2.898 -10.757 1.00 0.58 C ATOM 471 CG2 ILE A 33 1.680 3.286 -12.069 1.00 0.93 C ATOM 472 CD1 ILE A 33 3.108 2.142 -9.633 1.00 1.05 C ATOM 0 H ILE A 33 5.132 1.596 -12.956 1.00 0.36 H new ATOM 0 HA ILE A 33 2.875 0.617 -11.674 1.00 0.36 H new ATOM 0 HB ILE A 33 3.653 3.297 -12.863 1.00 0.53 H new ATOM 0 HG12 ILE A 33 4.819 2.561 -10.838 1.00 0.58 H new ATOM 0 HG13 ILE A 33 3.816 3.958 -10.504 1.00 0.58 H new ATOM 0 HG21 ILE A 33 1.709 4.334 -11.770 1.00 0.93 H new ATOM 0 HG22 ILE A 33 1.225 3.203 -13.056 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.090 2.719 -11.349 1.00 0.93 H new ATOM 0 HD11 ILE A 33 3.651 2.309 -8.703 1.00 1.05 H new ATOM 0 HD12 ILE A 33 2.083 2.495 -9.523 1.00 1.05 H new ATOM 0 HD13 ILE A 33 3.102 1.077 -9.863 1.00 1.05 H new ATOM 484 N LEU A 34 0.824 0.684 -13.126 1.00 0.38 N ATOM 485 CA LEU A 34 -0.316 0.439 -14.007 1.00 0.50 C ATOM 486 C LEU A 34 -1.555 1.176 -13.500 1.00 0.46 C ATOM 487 O LEU A 34 -1.994 2.160 -14.099 1.00 0.60 O ATOM 488 CB LEU A 34 -0.604 -1.061 -14.106 1.00 0.65 C ATOM 489 CG LEU A 34 0.514 -1.905 -14.723 1.00 1.01 C ATOM 490 CD1 LEU A 34 0.134 -3.376 -14.712 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.815 -1.441 -16.141 1.00 1.34 C ATOM 0 H LEU A 34 0.612 0.587 -12.133 1.00 0.38 H new ATOM 0 HA LEU A 34 -0.066 0.815 -14.999 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -0.813 -1.440 -13.106 1.00 0.65 H new ATOM 0 HB3 LEU A 34 -1.510 -1.202 -14.696 1.00 0.65 H new ATOM 0 HG LEU A 34 1.415 -1.776 -14.123 1.00 1.01 H new ATOM 0 HD11 LEU A 34 0.939 -3.963 -15.154 1.00 1.69 H new ATOM 0 HD12 LEU A 34 -0.031 -3.702 -13.685 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -0.779 -3.520 -15.289 1.00 1.69 H new ATOM 0 HD21 LEU A 34 1.612 -2.053 -16.563 1.00 1.34 H new ATOM 0 HD22 LEU A 34 -0.081 -1.540 -16.754 1.00 1.34 H new ATOM 0 HD23 LEU A 34 1.129 -0.397 -16.123 1.00 1.34 H new ATOM 503 N THR A 35 -2.112 0.697 -12.388 1.00 0.46 N ATOM 504 CA THR A 35 -3.297 1.311 -11.792 1.00 0.43 C ATOM 505 C THR A 35 -2.951 1.971 -10.461 1.00 0.43 C ATOM 506 O THR A 35 -2.588 1.297 -9.498 1.00 0.52 O ATOM 507 CB THR A 35 -4.397 0.267 -11.589 1.00 0.49 C ATOM 508 OG1 THR A 35 -3.895 -0.863 -10.901 1.00 0.68 O ATOM 509 CG2 THR A 35 -5.011 -0.218 -12.884 1.00 0.72 C ATOM 0 H THR A 35 -1.761 -0.116 -11.881 1.00 0.46 H new ATOM 0 HA THR A 35 -3.662 2.077 -12.476 1.00 0.43 H new ATOM 0 HB THR A 35 -5.169 0.772 -11.008 1.00 0.49 H new ATOM 0 HG1 THR A 35 -3.416 -1.442 -11.530 1.00 0.68 H new ATOM 0 HG21 THR A 35 -5.783 -0.956 -12.667 1.00 0.72 H new ATOM 0 HG22 THR A 35 -5.454 0.625 -13.415 1.00 0.72 H new ATOM 0 HG23 THR A 35 -4.239 -0.673 -13.505 1.00 0.72 H new ATOM 517 N VAL A 36 -3.064 3.295 -10.417 1.00 0.40 N ATOM 518 CA VAL A 36 -2.760 4.059 -9.207 1.00 0.46 C ATOM 519 C VAL A 36 -3.640 5.298 -9.109 1.00 0.48 C ATOM 520 O VAL A 36 -3.513 6.214 -9.922 1.00 0.56 O ATOM 521 CB VAL A 36 -1.282 4.504 -9.177 1.00 0.58 C ATOM 522 CG1 VAL A 36 -1.003 5.352 -7.944 1.00 1.32 C ATOM 523 CG2 VAL A 36 -0.352 3.301 -9.227 1.00 1.45 C ATOM 0 H VAL A 36 -3.365 3.865 -11.208 1.00 0.40 H new ATOM 0 HA VAL A 36 -2.955 3.400 -8.361 1.00 0.46 H new ATOM 0 HB VAL A 36 -1.092 5.113 -10.061 1.00 0.58 H new ATOM 0 HG11 VAL A 36 0.044 5.656 -7.941 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -1.638 6.238 -7.960 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -1.215 4.770 -7.047 1.00 1.32 H new ATOM 0 HG21 VAL A 36 0.684 3.640 -9.205 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -0.542 2.658 -8.367 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -0.531 2.741 -10.145 1.00 1.45 H new ATOM 533 N SER A 37 -4.523 5.327 -8.106 1.00 0.45 N ATOM 534 CA SER A 37 -5.424 6.470 -7.905 1.00 0.54 C ATOM 535 C SER A 37 -6.502 6.150 -6.879 1.00 0.57 C ATOM 536 O SER A 37 -7.481 5.472 -7.194 1.00 1.08 O ATOM 537 CB SER A 37 -6.093 6.877 -9.223 1.00 0.65 C ATOM 538 OG SER A 37 -6.957 7.984 -9.035 1.00 1.28 O ATOM 0 H SER A 37 -4.634 4.577 -7.423 1.00 0.45 H new ATOM 0 HA SER A 37 -4.816 7.296 -7.536 1.00 0.54 H new ATOM 0 HB2 SER A 37 -5.330 7.128 -9.960 1.00 0.65 H new ATOM 0 HB3 SER A 37 -6.657 6.035 -9.623 1.00 0.65 H new ATOM 0 HG SER A 37 -7.370 8.225 -9.890 1.00 1.28 H new ATOM 544 N SER A 38 -6.322 6.649 -5.654 1.00 0.59 N ATOM 545 CA SER A 38 -7.287 6.421 -4.580 1.00 0.59 C ATOM 546 C SER A 38 -6.759 6.946 -3.243 1.00 0.52 C ATOM 547 O SER A 38 -6.453 6.170 -2.339 1.00 0.63 O ATOM 548 CB SER A 38 -7.595 4.932 -4.458 1.00 0.78 C ATOM 549 OG SER A 38 -6.415 4.195 -4.209 1.00 1.68 O ATOM 0 H SER A 38 -5.517 7.213 -5.383 1.00 0.59 H new ATOM 0 HA SER A 38 -8.199 6.963 -4.829 1.00 0.59 H new ATOM 0 HB2 SER A 38 -8.309 4.768 -3.651 1.00 0.78 H new ATOM 0 HB3 SER A 38 -8.065 4.577 -5.375 1.00 0.78 H new ATOM 0 HG SER A 38 -6.023 4.483 -3.358 1.00 1.68 H new ATOM 555 N PHE A 39 -6.658 8.265 -3.127 1.00 0.44 N ATOM 556 CA PHE A 39 -6.165 8.889 -1.900 1.00 0.50 C ATOM 557 C PHE A 39 -7.299 9.123 -0.900 1.00 0.57 C ATOM 558 O PHE A 39 -7.948 10.168 -0.916 1.00 0.75 O ATOM 559 CB PHE A 39 -5.470 10.218 -2.215 1.00 0.59 C ATOM 560 CG PHE A 39 -4.201 10.075 -3.013 1.00 0.59 C ATOM 561 CD1 PHE A 39 -4.185 9.381 -4.214 1.00 0.65 C ATOM 562 CD2 PHE A 39 -3.018 10.640 -2.558 1.00 0.83 C ATOM 563 CE1 PHE A 39 -3.018 9.252 -4.943 1.00 0.98 C ATOM 564 CE2 PHE A 39 -1.849 10.515 -3.283 1.00 1.19 C ATOM 565 CZ PHE A 39 -1.849 9.820 -4.477 1.00 1.26 C ATOM 0 H PHE A 39 -6.910 8.923 -3.864 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.445 8.206 -1.450 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -6.162 10.856 -2.765 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -5.242 10.727 -1.279 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -5.097 8.936 -4.584 1.00 0.65 H new ATOM 0 HD2 PHE A 39 -3.011 11.184 -1.625 1.00 0.83 H new ATOM 0 HE1 PHE A 39 -3.020 8.708 -5.876 1.00 0.98 H new ATOM 0 HE2 PHE A 39 -0.936 10.960 -2.917 1.00 1.19 H new ATOM 0 HZ PHE A 39 -0.936 9.721 -5.045 1.00 1.26 H new ATOM 575 N TYR A 40 -7.528 8.147 -0.025 1.00 0.65 N ATOM 576 CA TYR A 40 -8.579 8.257 0.983 1.00 0.81 C ATOM 577 C TYR A 40 -8.014 8.681 2.334 1.00 0.71 C ATOM 578 O TYR A 40 -6.828 8.496 2.611 1.00 0.71 O ATOM 579 CB TYR A 40 -9.325 6.929 1.142 1.00 1.01 C ATOM 580 CG TYR A 40 -10.084 6.499 -0.092 1.00 1.49 C ATOM 581 CD1 TYR A 40 -9.419 6.052 -1.225 1.00 1.73 C ATOM 582 CD2 TYR A 40 -11.471 6.541 -0.118 1.00 2.39 C ATOM 583 CE1 TYR A 40 -10.117 5.658 -2.351 1.00 2.61 C ATOM 584 CE2 TYR A 40 -12.174 6.149 -1.239 1.00 3.35 C ATOM 585 CZ TYR A 40 -11.494 5.709 -2.352 1.00 3.41 C ATOM 586 OH TYR A 40 -12.191 5.316 -3.471 1.00 4.43 O ATOM 0 H TYR A 40 -7.002 7.274 0.007 1.00 0.65 H new ATOM 0 HA TYR A 40 -9.274 9.022 0.638 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -8.609 6.151 1.405 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -10.023 7.014 1.975 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -8.340 6.011 -1.227 1.00 1.73 H new ATOM 0 HD2 TYR A 40 -12.009 6.886 0.753 1.00 2.39 H new ATOM 0 HE1 TYR A 40 -9.586 5.312 -3.225 1.00 2.61 H new ATOM 0 HE2 TYR A 40 -13.253 6.187 -1.243 1.00 3.35 H new ATOM 0 HH TYR A 40 -12.865 4.651 -3.220 1.00 4.43 H new ATOM 596 N ARG A 41 -8.879 9.239 3.176 1.00 0.70 N ATOM 597 CA ARG A 41 -8.480 9.683 4.508 1.00 0.67 C ATOM 598 C ARG A 41 -8.730 8.583 5.535 1.00 0.64 C ATOM 599 O ARG A 41 -9.576 7.710 5.330 1.00 0.70 O ATOM 600 CB ARG A 41 -9.250 10.944 4.911 1.00 0.79 C ATOM 601 CG ARG A 41 -8.838 11.490 6.271 1.00 0.95 C ATOM 602 CD ARG A 41 -9.748 12.615 6.752 1.00 1.52 C ATOM 603 NE ARG A 41 -9.723 13.781 5.870 1.00 2.11 N ATOM 604 CZ ARG A 41 -10.500 13.918 4.798 1.00 2.49 C ATOM 605 NH1 ARG A 41 -11.394 12.986 4.498 1.00 2.37 N ATOM 606 NH2 ARG A 41 -10.395 14.999 4.039 1.00 3.51 N ATOM 0 H ARG A 41 -9.863 9.395 2.959 1.00 0.70 H new ATOM 0 HA ARG A 41 -7.415 9.912 4.481 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -9.094 11.714 4.155 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -10.317 10.722 4.924 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -8.849 10.681 7.002 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -7.813 11.856 6.216 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -10.770 12.243 6.826 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -9.446 12.917 7.755 1.00 1.52 H new ATOM 0 HE ARG A 41 -9.071 14.534 6.089 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -11.488 12.160 5.090 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -11.988 13.095 3.676 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -9.719 15.725 4.276 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -10.990 15.105 3.217 1.00 3.51 H new ATOM 620 N THR A 42 -7.997 8.634 6.643 1.00 0.80 N ATOM 621 CA THR A 42 -8.147 7.646 7.704 1.00 0.97 C ATOM 622 C THR A 42 -7.656 8.199 9.040 1.00 1.03 C ATOM 623 O THR A 42 -6.601 8.828 9.109 1.00 1.12 O ATOM 624 CB THR A 42 -7.376 6.371 7.361 1.00 1.17 C ATOM 625 OG1 THR A 42 -7.888 5.776 6.184 1.00 1.44 O ATOM 626 CG2 THR A 42 -7.420 5.331 8.462 1.00 1.32 C ATOM 0 H THR A 42 -7.294 9.349 6.829 1.00 0.80 H new ATOM 0 HA THR A 42 -9.208 7.411 7.792 1.00 0.97 H new ATOM 0 HB THR A 42 -6.342 6.686 7.223 1.00 1.17 H new ATOM 0 HG1 THR A 42 -8.620 6.324 5.832 1.00 1.44 H new ATOM 0 HG21 THR A 42 -6.854 4.452 8.155 1.00 1.32 H new ATOM 0 HG22 THR A 42 -6.983 5.745 9.371 1.00 1.32 H new ATOM 0 HG23 THR A 42 -8.455 5.047 8.654 1.00 1.32 H new ATOM 634 N PRO A 43 -8.420 7.973 10.124 1.00 1.12 N ATOM 635 CA PRO A 43 -8.056 8.447 11.453 1.00 1.31 C ATOM 636 C PRO A 43 -7.149 7.462 12.193 1.00 1.50 C ATOM 637 O PRO A 43 -7.598 6.395 12.615 1.00 1.71 O ATOM 638 CB PRO A 43 -9.411 8.553 12.145 1.00 1.48 C ATOM 639 CG PRO A 43 -10.238 7.468 11.533 1.00 1.38 C ATOM 640 CD PRO A 43 -9.700 7.236 10.140 1.00 1.15 C ATOM 0 HA PRO A 43 -7.491 9.379 11.427 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -9.317 8.418 13.223 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -9.862 9.532 11.984 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -10.178 6.556 12.127 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -11.288 7.757 11.498 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -9.552 6.175 9.941 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -10.386 7.610 9.380 1.00 1.15 H new ATOM 648 N PRO A 44 -5.858 7.802 12.361 1.00 1.55 N ATOM 649 CA PRO A 44 -4.898 6.936 13.054 1.00 1.80 C ATOM 650 C PRO A 44 -5.206 6.808 14.541 1.00 2.15 C ATOM 651 O PRO A 44 -5.472 7.800 15.220 1.00 2.77 O ATOM 652 CB PRO A 44 -3.557 7.645 12.848 1.00 1.80 C ATOM 653 CG PRO A 44 -3.913 9.071 12.613 1.00 1.81 C ATOM 654 CD PRO A 44 -5.230 9.051 11.889 1.00 1.54 C ATOM 0 HA PRO A 44 -4.918 5.917 12.667 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -2.914 7.537 13.721 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -3.015 7.228 11.999 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -3.993 9.614 13.555 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -3.148 9.572 12.020 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -5.836 9.923 12.133 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -5.094 9.049 10.807 1.00 1.54 H new ATOM 662 N LEU A 45 -5.169 5.577 15.039 1.00 2.16 N ATOM 663 CA LEU A 45 -5.444 5.310 16.445 1.00 2.52 C ATOM 664 C LEU A 45 -4.246 4.648 17.120 1.00 2.69 C ATOM 665 O LEU A 45 -4.401 3.865 18.058 1.00 3.09 O ATOM 666 CB LEU A 45 -6.699 4.437 16.581 1.00 2.75 C ATOM 667 CG LEU A 45 -6.782 3.239 15.626 1.00 3.05 C ATOM 668 CD1 LEU A 45 -5.732 2.189 15.962 1.00 3.66 C ATOM 669 CD2 LEU A 45 -8.176 2.629 15.665 1.00 3.32 C ATOM 0 H LEU A 45 -4.951 4.747 14.488 1.00 2.16 H new ATOM 0 HA LEU A 45 -5.625 6.260 16.948 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -6.752 4.067 17.605 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -7.575 5.066 16.423 1.00 2.75 H new ATOM 0 HG LEU A 45 -6.582 3.599 14.617 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -5.818 1.354 15.267 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -4.738 2.629 15.880 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -5.888 1.832 16.980 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -8.221 1.780 14.983 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -8.398 2.293 16.678 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -8.909 3.377 15.362 1.00 3.32 H new ATOM 681 N GLY A 46 -3.048 4.971 16.637 1.00 2.52 N ATOM 682 CA GLY A 46 -1.840 4.399 17.203 1.00 2.73 C ATOM 683 C GLY A 46 -0.600 4.683 16.368 1.00 2.68 C ATOM 684 O GLY A 46 0.401 5.164 16.901 1.00 2.81 O ATOM 0 H GLY A 46 -2.894 5.618 15.864 1.00 2.52 H new ATOM 0 HA2 GLY A 46 -1.693 4.795 18.208 1.00 2.73 H new ATOM 0 HA3 GLY A 46 -1.966 3.321 17.301 1.00 2.73 H new ATOM 688 N PRO A 47 -0.631 4.387 15.051 1.00 2.59 N ATOM 689 CA PRO A 47 0.511 4.612 14.159 1.00 2.65 C ATOM 690 C PRO A 47 1.197 5.955 14.385 1.00 2.60 C ATOM 691 O PRO A 47 2.410 6.013 14.589 1.00 2.86 O ATOM 692 CB PRO A 47 -0.122 4.570 12.770 1.00 2.59 C ATOM 693 CG PRO A 47 -1.283 3.648 12.913 1.00 2.63 C ATOM 694 CD PRO A 47 -1.779 3.798 14.329 1.00 2.54 C ATOM 0 HA PRO A 47 1.296 3.873 14.321 1.00 2.65 H new ATOM 0 HB2 PRO A 47 -0.441 5.562 12.450 1.00 2.59 H new ATOM 0 HB3 PRO A 47 0.584 4.206 12.024 1.00 2.59 H new ATOM 0 HG2 PRO A 47 -2.067 3.899 12.199 1.00 2.63 H new ATOM 0 HG3 PRO A 47 -0.987 2.618 12.713 1.00 2.63 H new ATOM 0 HD2 PRO A 47 -2.655 4.444 14.378 1.00 2.54 H new ATOM 0 HD3 PRO A 47 -2.067 2.837 14.755 1.00 2.54 H new ATOM 702 N GLN A 48 0.421 7.035 14.341 1.00 2.39 N ATOM 703 CA GLN A 48 0.972 8.370 14.534 1.00 2.50 C ATOM 704 C GLN A 48 0.029 9.232 15.376 1.00 2.40 C ATOM 705 O GLN A 48 0.397 10.323 15.814 1.00 2.57 O ATOM 706 CB GLN A 48 1.257 9.010 13.171 1.00 2.56 C ATOM 707 CG GLN A 48 1.989 10.340 13.247 1.00 2.73 C ATOM 708 CD GLN A 48 1.055 11.533 13.247 1.00 2.73 C ATOM 709 OE1 GLN A 48 1.495 12.677 13.348 1.00 3.26 O ATOM 710 NE2 GLN A 48 -0.243 11.277 13.123 1.00 2.45 N ATOM 0 H GLN A 48 -0.585 7.011 14.174 1.00 2.39 H new ATOM 0 HA GLN A 48 1.911 8.295 15.082 1.00 2.50 H new ATOM 0 HB2 GLN A 48 1.848 8.316 12.573 1.00 2.56 H new ATOM 0 HB3 GLN A 48 0.313 9.157 12.647 1.00 2.56 H new ATOM 0 HG2 GLN A 48 2.597 10.362 14.151 1.00 2.73 H new ATOM 0 HG3 GLN A 48 2.672 10.421 12.401 1.00 2.73 H new ATOM 0 HE21 GLN A 48 -0.567 10.313 13.042 1.00 2.45 H new ATOM 0 HE22 GLN A 48 -0.915 12.044 13.109 1.00 2.45 H new ATOM 719 N ASP A 49 -1.175 8.709 15.618 1.00 2.45 N ATOM 720 CA ASP A 49 -2.189 9.384 16.434 1.00 2.47 C ATOM 721 C ASP A 49 -2.810 10.582 15.721 1.00 2.38 C ATOM 722 O ASP A 49 -4.002 10.567 15.405 1.00 2.57 O ATOM 723 CB ASP A 49 -1.600 9.826 17.776 1.00 2.79 C ATOM 724 CG ASP A 49 -2.644 10.450 18.685 1.00 2.83 C ATOM 725 OD1 ASP A 49 -3.635 9.761 19.009 1.00 3.28 O ATOM 726 OD2 ASP A 49 -2.469 11.625 19.072 1.00 3.02 O ATOM 0 H ASP A 49 -1.476 7.805 15.254 1.00 2.45 H new ATOM 0 HA ASP A 49 -2.982 8.657 16.608 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -1.154 8.966 18.275 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -0.799 10.544 17.600 1.00 2.79 H new ATOM 731 N GLN A 50 -2.015 11.625 15.491 1.00 2.26 N ATOM 732 CA GLN A 50 -2.512 12.833 14.836 1.00 2.39 C ATOM 733 C GLN A 50 -3.310 12.474 13.582 1.00 2.01 C ATOM 734 O GLN A 50 -2.761 11.938 12.621 1.00 2.19 O ATOM 735 CB GLN A 50 -1.356 13.773 14.478 1.00 3.08 C ATOM 736 CG GLN A 50 -0.232 13.782 15.504 1.00 3.45 C ATOM 737 CD GLN A 50 -0.736 13.850 16.931 1.00 3.73 C ATOM 738 OE1 GLN A 50 -1.350 14.835 17.342 1.00 4.34 O ATOM 739 NE2 GLN A 50 -0.482 12.792 17.692 1.00 3.74 N ATOM 0 H GLN A 50 -1.028 11.658 15.747 1.00 2.26 H new ATOM 0 HA GLN A 50 -3.172 13.349 15.534 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -0.949 13.481 13.510 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -1.744 14.786 14.369 1.00 3.08 H new ATOM 0 HG2 GLN A 50 0.373 12.884 15.380 1.00 3.45 H new ATOM 0 HG3 GLN A 50 0.420 14.634 15.313 1.00 3.45 H new ATOM 0 HE21 GLN A 50 0.031 11.998 17.307 1.00 3.74 H new ATOM 0 HE22 GLN A 50 -0.800 12.773 18.661 1.00 3.74 H new ATOM 748 N PRO A 51 -4.627 12.749 13.583 1.00 1.98 N ATOM 749 CA PRO A 51 -5.500 12.432 12.447 1.00 2.00 C ATOM 750 C PRO A 51 -5.010 13.033 11.132 1.00 1.82 C ATOM 751 O PRO A 51 -5.183 14.226 10.880 1.00 2.47 O ATOM 752 CB PRO A 51 -6.845 13.044 12.848 1.00 2.71 C ATOM 753 CG PRO A 51 -6.806 13.105 14.335 1.00 2.89 C ATOM 754 CD PRO A 51 -5.372 13.370 14.694 1.00 2.51 C ATOM 0 HA PRO A 51 -5.540 11.359 12.261 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -6.973 14.036 12.415 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -7.678 12.433 12.499 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -7.456 13.895 14.712 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -7.153 12.170 14.774 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -5.166 14.438 14.770 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -5.108 12.926 15.654 1.00 2.51 H new ATOM 762 N ASP A 52 -4.408 12.189 10.294 1.00 1.32 N ATOM 763 CA ASP A 52 -3.898 12.619 8.994 1.00 1.52 C ATOM 764 C ASP A 52 -3.299 11.439 8.232 1.00 1.28 C ATOM 765 O ASP A 52 -2.329 11.592 7.489 1.00 2.07 O ATOM 766 CB ASP A 52 -2.848 13.725 9.161 1.00 2.12 C ATOM 767 CG ASP A 52 -1.625 13.268 9.936 1.00 2.77 C ATOM 768 OD1 ASP A 52 -1.562 12.077 10.309 1.00 3.33 O ATOM 769 OD2 ASP A 52 -0.726 14.105 10.167 1.00 3.26 O ATOM 0 H ASP A 52 -4.262 11.200 10.494 1.00 1.32 H new ATOM 0 HA ASP A 52 -4.735 13.017 8.420 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -2.538 14.076 8.177 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -3.300 14.574 9.674 1.00 2.12 H new ATOM 774 N TYR A 53 -3.880 10.258 8.432 1.00 0.84 N ATOM 775 CA TYR A 53 -3.404 9.046 7.774 1.00 1.19 C ATOM 776 C TYR A 53 -3.950 8.950 6.349 1.00 0.96 C ATOM 777 O TYR A 53 -5.122 8.631 6.141 1.00 1.43 O ATOM 778 CB TYR A 53 -3.818 7.815 8.586 1.00 2.08 C ATOM 779 CG TYR A 53 -3.218 6.510 8.102 1.00 3.12 C ATOM 780 CD1 TYR A 53 -1.895 6.441 7.681 1.00 3.74 C ATOM 781 CD2 TYR A 53 -3.973 5.346 8.073 1.00 3.88 C ATOM 782 CE1 TYR A 53 -1.345 5.252 7.245 1.00 4.86 C ATOM 783 CE2 TYR A 53 -3.429 4.151 7.641 1.00 5.03 C ATOM 784 CZ TYR A 53 -2.115 4.110 7.228 1.00 5.45 C ATOM 785 OH TYR A 53 -1.569 2.922 6.796 1.00 6.66 O ATOM 0 H TYR A 53 -4.682 10.116 9.046 1.00 0.84 H new ATOM 0 HA TYR A 53 -2.316 9.087 7.718 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -3.530 7.968 9.626 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -4.905 7.730 8.565 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -1.287 7.333 7.695 1.00 3.74 H new ATOM 0 HD2 TYR A 53 -5.004 5.374 8.394 1.00 3.88 H new ATOM 0 HE1 TYR A 53 -0.316 5.218 6.919 1.00 4.86 H new ATOM 0 HE2 TYR A 53 -4.031 3.254 7.627 1.00 5.03 H new ATOM 0 HH TYR A 53 -2.244 2.214 6.847 1.00 6.66 H new ATOM 795 N LEU A 54 -3.088 9.228 5.375 1.00 0.84 N ATOM 796 CA LEU A 54 -3.468 9.176 3.967 1.00 0.76 C ATOM 797 C LEU A 54 -3.071 7.832 3.366 1.00 0.76 C ATOM 798 O LEU A 54 -2.038 7.267 3.724 1.00 0.98 O ATOM 799 CB LEU A 54 -2.800 10.335 3.207 1.00 0.97 C ATOM 800 CG LEU A 54 -3.200 10.519 1.734 1.00 1.15 C ATOM 801 CD1 LEU A 54 -2.576 9.448 0.852 1.00 1.60 C ATOM 802 CD2 LEU A 54 -4.716 10.520 1.582 1.00 1.60 C ATOM 0 H LEU A 54 -2.116 9.493 5.537 1.00 0.84 H new ATOM 0 HA LEU A 54 -4.549 9.281 3.880 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -3.021 11.261 3.737 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -1.720 10.192 3.251 1.00 0.97 H new ATOM 0 HG LEU A 54 -2.818 11.486 1.407 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -2.879 9.607 -0.183 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -1.490 9.504 0.925 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -2.912 8.465 1.181 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -4.976 10.652 0.532 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -5.118 9.572 1.940 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -5.140 11.337 2.166 1.00 1.60 H new ATOM 814 N ASN A 55 -3.897 7.321 2.458 1.00 0.60 N ATOM 815 CA ASN A 55 -3.621 6.039 1.822 1.00 0.66 C ATOM 816 C ASN A 55 -3.989 6.064 0.344 1.00 0.50 C ATOM 817 O ASN A 55 -4.931 6.746 -0.062 1.00 0.56 O ATOM 818 CB ASN A 55 -4.388 4.923 2.531 1.00 0.87 C ATOM 819 CG ASN A 55 -4.029 4.821 3.998 1.00 1.51 C ATOM 820 OD1 ASN A 55 -2.878 4.565 4.350 1.00 2.21 O ATOM 821 ND2 ASN A 55 -5.016 5.026 4.864 1.00 2.21 N ATOM 0 H ASN A 55 -4.758 7.772 2.148 1.00 0.60 H new ATOM 0 HA ASN A 55 -2.551 5.849 1.902 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -5.459 5.102 2.433 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -4.178 3.972 2.041 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -4.834 4.974 5.866 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -5.955 5.236 4.526 1.00 2.21 H new ATOM 828 N ALA A 56 -3.240 5.311 -0.454 1.00 0.50 N ATOM 829 CA ALA A 56 -3.479 5.235 -1.888 1.00 0.45 C ATOM 830 C ALA A 56 -3.323 3.803 -2.389 1.00 0.45 C ATOM 831 O ALA A 56 -2.755 2.953 -1.701 1.00 0.61 O ATOM 832 CB ALA A 56 -2.529 6.162 -2.633 1.00 0.58 C ATOM 0 H ALA A 56 -2.458 4.742 -0.128 1.00 0.50 H new ATOM 0 HA ALA A 56 -4.503 5.554 -2.080 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -2.720 6.094 -3.704 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -2.687 7.188 -2.301 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -1.499 5.869 -2.429 1.00 0.58 H new ATOM 838 N ALA A 57 -3.835 3.540 -3.587 1.00 0.43 N ATOM 839 CA ALA A 57 -3.754 2.210 -4.174 1.00 0.47 C ATOM 840 C ALA A 57 -2.842 2.197 -5.392 1.00 0.40 C ATOM 841 O ALA A 57 -2.948 3.053 -6.277 1.00 0.44 O ATOM 842 CB ALA A 57 -5.137 1.703 -4.546 1.00 0.59 C ATOM 0 H ALA A 57 -4.310 4.230 -4.169 1.00 0.43 H new ATOM 0 HA ALA A 57 -3.326 1.544 -3.425 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -5.054 0.708 -4.983 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.760 1.657 -3.653 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.590 2.380 -5.270 1.00 0.59 H new ATOM 848 N VAL A 58 -1.954 1.203 -5.427 1.00 0.39 N ATOM 849 CA VAL A 58 -1.019 1.038 -6.513 1.00 0.39 C ATOM 850 C VAL A 58 -0.959 -0.429 -6.909 1.00 0.40 C ATOM 851 O VAL A 58 -0.737 -1.300 -6.072 1.00 0.60 O ATOM 852 CB VAL A 58 0.391 1.527 -6.121 1.00 0.49 C ATOM 853 CG1 VAL A 58 0.401 3.034 -5.928 1.00 1.11 C ATOM 854 CG2 VAL A 58 0.867 0.831 -4.855 1.00 1.22 C ATOM 0 H VAL A 58 -1.872 0.495 -4.697 1.00 0.39 H new ATOM 0 HA VAL A 58 -1.363 1.639 -7.355 1.00 0.39 H new ATOM 0 HB VAL A 58 1.075 1.277 -6.932 1.00 0.49 H new ATOM 0 HG11 VAL A 58 1.404 3.359 -5.652 1.00 1.11 H new ATOM 0 HG12 VAL A 58 0.104 3.522 -6.857 1.00 1.11 H new ATOM 0 HG13 VAL A 58 -0.298 3.304 -5.137 1.00 1.11 H new ATOM 0 HG21 VAL A 58 1.863 1.189 -4.595 1.00 1.22 H new ATOM 0 HG22 VAL A 58 0.178 1.050 -4.039 1.00 1.22 H new ATOM 0 HG23 VAL A 58 0.901 -0.246 -5.022 1.00 1.22 H new ATOM 864 N ALA A 59 -1.159 -0.693 -8.182 1.00 0.34 N ATOM 865 CA ALA A 59 -1.123 -2.048 -8.692 1.00 0.36 C ATOM 866 C ALA A 59 -0.303 -2.072 -9.958 1.00 0.37 C ATOM 867 O ALA A 59 -0.804 -1.804 -11.049 1.00 0.43 O ATOM 868 CB ALA A 59 -2.531 -2.569 -8.940 1.00 0.44 C ATOM 0 H ALA A 59 -1.350 0.018 -8.888 1.00 0.34 H new ATOM 0 HA ALA A 59 -0.661 -2.704 -7.954 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.480 -3.588 -9.323 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.092 -2.560 -8.006 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -3.031 -1.932 -9.670 1.00 0.44 H new ATOM 874 N LEU A 60 0.971 -2.367 -9.797 1.00 0.37 N ATOM 875 CA LEU A 60 1.883 -2.394 -10.931 1.00 0.45 C ATOM 876 C LEU A 60 2.331 -3.807 -11.252 1.00 0.39 C ATOM 877 O LEU A 60 2.402 -4.667 -10.373 1.00 0.38 O ATOM 878 CB LEU A 60 3.099 -1.490 -10.671 1.00 0.56 C ATOM 879 CG LEU A 60 4.406 -2.197 -10.291 1.00 0.48 C ATOM 880 CD1 LEU A 60 5.566 -1.215 -10.326 1.00 0.44 C ATOM 881 CD2 LEU A 60 4.299 -2.827 -8.915 1.00 0.98 C ATOM 0 H LEU A 60 1.400 -2.591 -8.899 1.00 0.37 H new ATOM 0 HA LEU A 60 1.342 -2.012 -11.797 1.00 0.45 H new ATOM 0 HB2 LEU A 60 3.280 -0.895 -11.566 1.00 0.56 H new ATOM 0 HB3 LEU A 60 2.843 -0.794 -9.872 1.00 0.56 H new ATOM 0 HG LEU A 60 4.589 -2.988 -11.018 1.00 0.48 H new ATOM 0 HD11 LEU A 60 6.487 -1.730 -10.054 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.664 -0.803 -11.330 1.00 0.44 H new ATOM 0 HD13 LEU A 60 5.380 -0.407 -9.619 1.00 0.44 H new ATOM 0 HD21 LEU A 60 5.238 -3.322 -8.668 1.00 0.98 H new ATOM 0 HD22 LEU A 60 4.091 -2.053 -8.176 1.00 0.98 H new ATOM 0 HD23 LEU A 60 3.491 -3.559 -8.912 1.00 0.98 H new ATOM 893 N GLU A 61 2.646 -4.038 -12.518 1.00 0.39 N ATOM 894 CA GLU A 61 3.102 -5.341 -12.960 1.00 0.38 C ATOM 895 C GLU A 61 4.559 -5.542 -12.571 1.00 0.36 C ATOM 896 O GLU A 61 5.464 -4.965 -13.179 1.00 0.38 O ATOM 897 CB GLU A 61 2.924 -5.484 -14.475 1.00 0.44 C ATOM 898 CG GLU A 61 3.566 -4.362 -15.277 1.00 1.08 C ATOM 899 CD GLU A 61 3.350 -4.513 -16.771 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.694 -5.495 -17.181 1.00 1.39 O ATOM 901 OE2 GLU A 61 3.836 -3.651 -17.531 1.00 1.24 O ATOM 0 H GLU A 61 2.593 -3.336 -13.256 1.00 0.39 H new ATOM 0 HA GLU A 61 2.501 -6.109 -12.472 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.350 -6.435 -14.793 1.00 0.44 H new ATOM 0 HB3 GLU A 61 1.859 -5.519 -14.705 1.00 0.44 H new ATOM 0 HG2 GLU A 61 3.156 -3.406 -14.950 1.00 1.08 H new ATOM 0 HG3 GLU A 61 4.636 -4.338 -15.069 1.00 1.08 H new ATOM 908 N THR A 62 4.781 -6.348 -11.538 1.00 0.39 N ATOM 909 CA THR A 62 6.119 -6.608 -11.060 1.00 0.43 C ATOM 910 C THR A 62 6.766 -7.744 -11.830 1.00 0.39 C ATOM 911 O THR A 62 6.103 -8.515 -12.524 1.00 0.43 O ATOM 912 CB THR A 62 6.101 -6.948 -9.571 1.00 0.54 C ATOM 913 OG1 THR A 62 5.315 -8.102 -9.327 1.00 1.47 O ATOM 914 CG2 THR A 62 5.561 -5.835 -8.701 1.00 1.02 C ATOM 0 H THR A 62 4.046 -6.829 -11.020 1.00 0.39 H new ATOM 0 HA THR A 62 6.705 -5.702 -11.216 1.00 0.43 H new ATOM 0 HB THR A 62 7.145 -7.116 -9.307 1.00 0.54 H new ATOM 0 HG1 THR A 62 5.318 -8.303 -8.368 1.00 1.47 H new ATOM 0 HG21 THR A 62 5.579 -6.148 -7.657 1.00 1.02 H new ATOM 0 HG22 THR A 62 6.179 -4.945 -8.823 1.00 1.02 H new ATOM 0 HG23 THR A 62 4.536 -5.608 -8.995 1.00 1.02 H new ATOM 922 N SER A 63 8.068 -7.836 -11.669 1.00 0.40 N ATOM 923 CA SER A 63 8.874 -8.867 -12.298 1.00 0.44 C ATOM 924 C SER A 63 9.950 -9.246 -11.307 1.00 0.44 C ATOM 925 O SER A 63 10.883 -9.995 -11.597 1.00 0.64 O ATOM 926 CB SER A 63 9.486 -8.353 -13.601 1.00 0.56 C ATOM 927 OG SER A 63 8.479 -8.038 -14.549 1.00 1.23 O ATOM 0 H SER A 63 8.606 -7.190 -11.091 1.00 0.40 H new ATOM 0 HA SER A 63 8.266 -9.734 -12.556 1.00 0.44 H new ATOM 0 HB2 SER A 63 10.089 -7.468 -13.399 1.00 0.56 H new ATOM 0 HB3 SER A 63 10.156 -9.107 -14.014 1.00 0.56 H new ATOM 0 HG SER A 63 8.896 -7.710 -15.373 1.00 1.23 H new ATOM 933 N LEU A 64 9.775 -8.683 -10.121 1.00 0.39 N ATOM 934 CA LEU A 64 10.663 -8.873 -8.999 1.00 0.38 C ATOM 935 C LEU A 64 9.831 -9.019 -7.732 1.00 0.35 C ATOM 936 O LEU A 64 9.359 -8.032 -7.171 1.00 0.39 O ATOM 937 CB LEU A 64 11.607 -7.676 -8.913 1.00 0.42 C ATOM 938 CG LEU A 64 10.960 -6.324 -9.244 1.00 0.50 C ATOM 939 CD1 LEU A 64 10.641 -5.556 -7.976 1.00 0.78 C ATOM 940 CD2 LEU A 64 11.863 -5.505 -10.151 1.00 0.84 C ATOM 0 H LEU A 64 8.989 -8.067 -9.914 1.00 0.39 H new ATOM 0 HA LEU A 64 11.261 -9.776 -9.121 1.00 0.38 H new ATOM 0 HB2 LEU A 64 12.021 -7.629 -7.906 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.443 -7.840 -9.593 1.00 0.42 H new ATOM 0 HG LEU A 64 10.026 -6.515 -9.772 1.00 0.50 H new ATOM 0 HD11 LEU A 64 10.183 -4.601 -8.234 1.00 0.78 H new ATOM 0 HD12 LEU A 64 9.950 -6.136 -7.364 1.00 0.78 H new ATOM 0 HD13 LEU A 64 11.560 -5.378 -7.417 1.00 0.78 H new ATOM 0 HD21 LEU A 64 11.386 -4.551 -10.374 1.00 0.84 H new ATOM 0 HD22 LEU A 64 12.815 -5.327 -9.652 1.00 0.84 H new ATOM 0 HD23 LEU A 64 12.036 -6.049 -11.079 1.00 0.84 H new ATOM 952 N ALA A 65 9.632 -10.266 -7.316 1.00 0.38 N ATOM 953 CA ALA A 65 8.827 -10.578 -6.139 1.00 0.42 C ATOM 954 C ALA A 65 8.973 -9.517 -5.050 1.00 0.39 C ATOM 955 O ALA A 65 10.073 -9.039 -4.789 1.00 0.38 O ATOM 956 CB ALA A 65 9.202 -11.950 -5.601 1.00 0.52 C ATOM 0 H ALA A 65 10.022 -11.085 -7.782 1.00 0.38 H new ATOM 0 HA ALA A 65 7.781 -10.585 -6.444 1.00 0.42 H new ATOM 0 HB1 ALA A 65 8.596 -12.174 -4.723 1.00 0.52 H new ATOM 0 HB2 ALA A 65 9.022 -12.703 -6.368 1.00 0.52 H new ATOM 0 HB3 ALA A 65 10.257 -11.957 -5.326 1.00 0.52 H new ATOM 962 N PRO A 66 7.846 -9.131 -4.410 1.00 0.44 N ATOM 963 CA PRO A 66 7.812 -8.122 -3.345 1.00 0.47 C ATOM 964 C PRO A 66 9.028 -8.150 -2.439 1.00 0.45 C ATOM 965 O PRO A 66 9.400 -7.138 -1.865 1.00 0.49 O ATOM 966 CB PRO A 66 6.573 -8.521 -2.572 1.00 0.55 C ATOM 967 CG PRO A 66 5.641 -8.974 -3.633 1.00 0.57 C ATOM 968 CD PRO A 66 6.489 -9.643 -4.687 1.00 0.50 C ATOM 0 HA PRO A 66 7.805 -7.108 -3.745 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.784 -9.315 -1.856 1.00 0.55 H new ATOM 0 HB3 PRO A 66 6.164 -7.683 -2.008 1.00 0.55 H new ATOM 0 HG2 PRO A 66 4.902 -9.667 -3.231 1.00 0.57 H new ATOM 0 HG3 PRO A 66 5.092 -8.131 -4.053 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.445 -10.729 -4.608 1.00 0.50 H new ATOM 0 HD3 PRO A 66 6.159 -9.383 -5.693 1.00 0.50 H new ATOM 976 N GLU A 67 9.670 -9.295 -2.335 1.00 0.45 N ATOM 977 CA GLU A 67 10.864 -9.384 -1.521 1.00 0.49 C ATOM 978 C GLU A 67 11.809 -8.274 -1.953 1.00 0.44 C ATOM 979 O GLU A 67 12.215 -7.429 -1.156 1.00 0.47 O ATOM 980 CB GLU A 67 11.505 -10.760 -1.693 1.00 0.52 C ATOM 981 CG GLU A 67 11.263 -11.356 -3.068 1.00 0.71 C ATOM 982 CD GLU A 67 11.899 -12.722 -3.237 1.00 0.77 C ATOM 983 OE1 GLU A 67 11.537 -13.644 -2.475 1.00 1.06 O ATOM 984 OE2 GLU A 67 12.758 -12.870 -4.131 1.00 1.20 O ATOM 0 H GLU A 67 9.392 -10.162 -2.795 1.00 0.45 H new ATOM 0 HA GLU A 67 10.626 -9.264 -0.464 1.00 0.49 H new ATOM 0 HB2 GLU A 67 12.578 -10.679 -1.521 1.00 0.52 H new ATOM 0 HB3 GLU A 67 11.111 -11.436 -0.935 1.00 0.52 H new ATOM 0 HG2 GLU A 67 10.190 -11.436 -3.240 1.00 0.71 H new ATOM 0 HG3 GLU A 67 11.658 -10.680 -3.826 1.00 0.71 H new ATOM 991 N GLU A 68 12.095 -8.259 -3.246 1.00 0.40 N ATOM 992 CA GLU A 68 12.942 -7.245 -3.846 1.00 0.39 C ATOM 993 C GLU A 68 12.153 -5.950 -4.095 1.00 0.35 C ATOM 994 O GLU A 68 12.671 -4.854 -3.877 1.00 0.40 O ATOM 995 CB GLU A 68 13.533 -7.787 -5.149 1.00 0.41 C ATOM 996 CG GLU A 68 13.675 -6.746 -6.240 1.00 0.97 C ATOM 997 CD GLU A 68 14.563 -7.212 -7.379 1.00 1.52 C ATOM 998 OE1 GLU A 68 14.293 -8.295 -7.940 1.00 2.06 O ATOM 999 OE2 GLU A 68 15.528 -6.492 -7.710 1.00 1.90 O ATOM 0 H GLU A 68 11.745 -8.952 -3.908 1.00 0.40 H new ATOM 0 HA GLU A 68 13.754 -7.005 -3.160 1.00 0.39 H new ATOM 0 HB2 GLU A 68 14.513 -8.216 -4.941 1.00 0.41 H new ATOM 0 HB3 GLU A 68 12.901 -8.597 -5.514 1.00 0.41 H new ATOM 0 HG2 GLU A 68 12.688 -6.498 -6.631 1.00 0.97 H new ATOM 0 HG3 GLU A 68 14.087 -5.832 -5.813 1.00 0.97 H new ATOM 1006 N LEU A 69 10.899 -6.081 -4.542 1.00 0.32 N ATOM 1007 CA LEU A 69 10.053 -4.911 -4.802 1.00 0.33 C ATOM 1008 C LEU A 69 9.944 -4.040 -3.553 1.00 0.34 C ATOM 1009 O LEU A 69 10.277 -2.855 -3.580 1.00 0.44 O ATOM 1010 CB LEU A 69 8.656 -5.348 -5.290 1.00 0.38 C ATOM 1011 CG LEU A 69 7.479 -4.485 -4.805 1.00 0.44 C ATOM 1012 CD1 LEU A 69 7.458 -3.155 -5.539 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.152 -5.221 -4.978 1.00 0.67 C ATOM 0 H LEU A 69 10.450 -6.978 -4.730 1.00 0.32 H new ATOM 0 HA LEU A 69 10.518 -4.319 -5.590 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.656 -5.349 -6.380 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.485 -6.376 -4.970 1.00 0.38 H new ATOM 0 HG LEU A 69 7.616 -4.289 -3.741 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.619 -2.557 -5.184 1.00 0.66 H new ATOM 0 HD12 LEU A 69 8.390 -2.621 -5.351 1.00 0.66 H new ATOM 0 HD13 LEU A 69 7.350 -3.332 -6.609 1.00 0.66 H new ATOM 0 HD21 LEU A 69 5.337 -4.588 -4.627 1.00 0.67 H new ATOM 0 HD22 LEU A 69 6.001 -5.457 -6.032 1.00 0.67 H new ATOM 0 HD23 LEU A 69 6.170 -6.144 -4.399 1.00 0.67 H new ATOM 1025 N LEU A 70 9.488 -4.644 -2.463 1.00 0.39 N ATOM 1026 CA LEU A 70 9.345 -3.941 -1.195 1.00 0.47 C ATOM 1027 C LEU A 70 10.653 -3.263 -0.813 1.00 0.44 C ATOM 1028 O LEU A 70 10.653 -2.132 -0.329 1.00 0.47 O ATOM 1029 CB LEU A 70 8.918 -4.910 -0.089 1.00 0.62 C ATOM 1030 CG LEU A 70 7.566 -5.594 -0.309 1.00 0.99 C ATOM 1031 CD1 LEU A 70 7.340 -6.676 0.735 1.00 1.48 C ATOM 1032 CD2 LEU A 70 6.440 -4.574 -0.272 1.00 1.65 C ATOM 0 H LEU A 70 9.210 -5.625 -2.432 1.00 0.39 H new ATOM 0 HA LEU A 70 8.574 -3.180 -1.312 1.00 0.47 H new ATOM 0 HB2 LEU A 70 9.684 -5.679 0.014 1.00 0.62 H new ATOM 0 HB3 LEU A 70 8.883 -4.366 0.855 1.00 0.62 H new ATOM 0 HG LEU A 70 7.573 -6.062 -1.293 1.00 0.99 H new ATOM 0 HD11 LEU A 70 6.374 -7.151 0.563 1.00 1.48 H new ATOM 0 HD12 LEU A 70 8.130 -7.423 0.662 1.00 1.48 H new ATOM 0 HD13 LEU A 70 7.353 -6.230 1.730 1.00 1.48 H new ATOM 0 HD21 LEU A 70 5.487 -5.078 -0.430 1.00 1.65 H new ATOM 0 HD22 LEU A 70 6.431 -4.077 0.698 1.00 1.65 H new ATOM 0 HD23 LEU A 70 6.594 -3.834 -1.057 1.00 1.65 H new ATOM 1044 N ASN A 71 11.772 -3.956 -1.033 1.00 0.46 N ATOM 1045 CA ASN A 71 13.078 -3.394 -0.708 1.00 0.50 C ATOM 1046 C ASN A 71 13.268 -2.012 -1.330 1.00 0.41 C ATOM 1047 O ASN A 71 13.802 -1.119 -0.684 1.00 0.44 O ATOM 1048 CB ASN A 71 14.209 -4.323 -1.161 1.00 0.59 C ATOM 1049 CG ASN A 71 14.494 -5.426 -0.158 1.00 0.79 C ATOM 1050 OD1 ASN A 71 14.716 -5.161 1.024 1.00 1.59 O ATOM 1051 ND2 ASN A 71 14.508 -6.667 -0.626 1.00 0.72 N ATOM 0 H ASN A 71 11.798 -4.895 -1.430 1.00 0.46 H new ATOM 0 HA ASN A 71 13.117 -3.292 0.377 1.00 0.50 H new ATOM 0 HB2 ASN A 71 13.946 -4.768 -2.121 1.00 0.59 H new ATOM 0 HB3 ASN A 71 15.115 -3.737 -1.319 1.00 0.59 H new ATOM 0 HD21 ASN A 71 14.708 -7.446 0.001 1.00 0.72 H new ATOM 0 HD22 ASN A 71 14.318 -6.842 -1.613 1.00 0.72 H new ATOM 1058 N HIS A 72 12.833 -1.841 -2.581 1.00 0.37 N ATOM 1059 CA HIS A 72 12.970 -0.560 -3.276 1.00 0.35 C ATOM 1060 C HIS A 72 11.991 0.481 -2.747 1.00 0.32 C ATOM 1061 O HIS A 72 12.368 1.628 -2.501 1.00 0.35 O ATOM 1062 CB HIS A 72 12.768 -0.753 -4.777 1.00 0.39 C ATOM 1063 CG HIS A 72 13.891 -1.488 -5.434 1.00 0.57 C ATOM 1064 ND1 HIS A 72 15.138 -0.934 -5.636 1.00 1.07 N ATOM 1065 CD2 HIS A 72 13.957 -2.746 -5.926 1.00 0.61 C ATOM 1066 CE1 HIS A 72 15.920 -1.819 -6.225 1.00 1.40 C ATOM 1067 NE2 HIS A 72 15.227 -2.926 -6.413 1.00 1.11 N ATOM 0 H HIS A 72 12.384 -2.573 -3.132 1.00 0.37 H new ATOM 0 HA HIS A 72 13.978 -0.190 -3.089 1.00 0.35 H new ATOM 0 HB2 HIS A 72 11.839 -1.298 -4.945 1.00 0.39 H new ATOM 0 HB3 HIS A 72 12.655 0.223 -5.250 1.00 0.39 H new ATOM 0 HD2 HIS A 72 13.159 -3.473 -5.934 1.00 0.61 H new ATOM 0 HE1 HIS A 72 16.951 -1.664 -6.505 1.00 1.40 H new ATOM 0 HE2 HIS A 72 15.579 -3.778 -6.850 1.00 1.11 H new ATOM 1076 N THR A 73 10.736 0.088 -2.570 1.00 0.34 N ATOM 1077 CA THR A 73 9.728 1.008 -2.062 1.00 0.38 C ATOM 1078 C THR A 73 10.151 1.543 -0.698 1.00 0.36 C ATOM 1079 O THR A 73 10.263 2.754 -0.495 1.00 0.36 O ATOM 1080 CB THR A 73 8.374 0.309 -1.965 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.443 -0.805 -1.092 1.00 0.77 O ATOM 1082 CG2 THR A 73 7.859 -0.185 -3.300 1.00 0.61 C ATOM 0 H THR A 73 10.394 -0.852 -2.769 1.00 0.34 H new ATOM 0 HA THR A 73 9.634 1.846 -2.753 1.00 0.38 H new ATOM 0 HB THR A 73 7.687 1.065 -1.585 1.00 0.47 H new ATOM 0 HG1 THR A 73 9.332 -1.213 -1.152 1.00 0.77 H new ATOM 0 HG21 THR A 73 6.894 -0.672 -3.160 1.00 0.61 H new ATOM 0 HG22 THR A 73 7.745 0.659 -3.981 1.00 0.61 H new ATOM 0 HG23 THR A 73 8.567 -0.898 -3.722 1.00 0.61 H new ATOM 1090 N GLN A 74 10.403 0.624 0.226 1.00 0.39 N ATOM 1091 CA GLN A 74 10.839 0.972 1.570 1.00 0.42 C ATOM 1092 C GLN A 74 12.261 1.519 1.544 1.00 0.41 C ATOM 1093 O GLN A 74 12.750 2.055 2.536 1.00 0.50 O ATOM 1094 CB GLN A 74 10.770 -0.254 2.484 1.00 0.49 C ATOM 1095 CG GLN A 74 9.371 -0.836 2.621 1.00 1.45 C ATOM 1096 CD GLN A 74 9.327 -2.089 3.481 1.00 1.87 C ATOM 1097 OE1 GLN A 74 8.263 -2.668 3.695 1.00 2.25 O ATOM 1098 NE2 GLN A 74 10.485 -2.519 3.977 1.00 2.54 N ATOM 0 H GLN A 74 10.311 -0.379 0.065 1.00 0.39 H new ATOM 0 HA GLN A 74 10.173 1.743 1.959 1.00 0.42 H new ATOM 0 HB2 GLN A 74 11.438 -1.023 2.096 1.00 0.49 H new ATOM 0 HB3 GLN A 74 11.139 0.019 3.473 1.00 0.49 H new ATOM 0 HG2 GLN A 74 8.712 -0.083 3.053 1.00 1.45 H new ATOM 0 HG3 GLN A 74 8.982 -1.069 1.630 1.00 1.45 H new ATOM 0 HE21 GLN A 74 11.346 -2.010 3.776 1.00 2.54 H new ATOM 0 HE22 GLN A 74 10.511 -3.357 4.558 1.00 2.54 H new ATOM 1107 N ARG A 75 12.917 1.400 0.395 1.00 0.37 N ATOM 1108 CA ARG A 75 14.276 1.904 0.242 1.00 0.41 C ATOM 1109 C ARG A 75 14.248 3.419 0.253 1.00 0.39 C ATOM 1110 O ARG A 75 15.029 4.074 0.951 1.00 0.43 O ATOM 1111 CB ARG A 75 14.892 1.388 -1.063 1.00 0.48 C ATOM 1112 CG ARG A 75 16.229 2.006 -1.423 1.00 0.89 C ATOM 1113 CD ARG A 75 16.838 1.310 -2.632 1.00 0.88 C ATOM 1114 NE ARG A 75 18.000 2.024 -3.153 1.00 1.59 N ATOM 1115 CZ ARG A 75 17.949 3.251 -3.667 1.00 2.26 C ATOM 1116 NH1 ARG A 75 16.792 3.895 -3.748 1.00 2.72 N ATOM 1117 NH2 ARG A 75 19.057 3.832 -4.105 1.00 3.06 N ATOM 0 H ARG A 75 12.531 0.961 -0.441 1.00 0.37 H new ATOM 0 HA ARG A 75 14.890 1.549 1.069 1.00 0.41 H new ATOM 0 HB2 ARG A 75 15.015 0.308 -0.988 1.00 0.48 H new ATOM 0 HB3 ARG A 75 14.191 1.573 -1.877 1.00 0.48 H new ATOM 0 HG2 ARG A 75 16.099 3.067 -1.636 1.00 0.89 H new ATOM 0 HG3 ARG A 75 16.909 1.932 -0.574 1.00 0.89 H new ATOM 0 HD2 ARG A 75 17.130 0.297 -2.357 1.00 0.88 H new ATOM 0 HD3 ARG A 75 16.086 1.223 -3.416 1.00 0.88 H new ATOM 0 HE ARG A 75 18.905 1.555 -3.121 1.00 1.59 H new ATOM 0 HH11 ARG A 75 15.936 3.450 -3.416 1.00 2.72 H new ATOM 0 HH12 ARG A 75 16.758 4.835 -4.143 1.00 2.72 H new ATOM 0 HH21 ARG A 75 19.948 3.339 -4.048 1.00 3.06 H new ATOM 0 HH22 ARG A 75 19.018 4.772 -4.499 1.00 3.06 H new ATOM 1131 N ILE A 76 13.318 3.971 -0.509 1.00 0.38 N ATOM 1132 CA ILE A 76 13.162 5.404 -0.578 1.00 0.41 C ATOM 1133 C ILE A 76 12.701 5.957 0.762 1.00 0.42 C ATOM 1134 O ILE A 76 13.312 6.882 1.279 1.00 0.44 O ATOM 1135 CB ILE A 76 12.195 5.825 -1.699 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.798 5.450 -3.060 1.00 0.55 C ATOM 1137 CG2 ILE A 76 11.901 7.316 -1.621 1.00 0.50 C ATOM 1138 CD1 ILE A 76 12.106 6.093 -4.242 1.00 0.83 C ATOM 0 H ILE A 76 12.663 3.444 -1.086 1.00 0.38 H new ATOM 0 HA ILE A 76 14.138 5.826 -0.816 1.00 0.41 H new ATOM 0 HB ILE A 76 11.249 5.297 -1.577 1.00 0.45 H new ATOM 0 HG12 ILE A 76 13.850 5.735 -3.070 1.00 0.55 H new ATOM 0 HG13 ILE A 76 12.760 4.367 -3.176 1.00 0.55 H new ATOM 0 HG21 ILE A 76 11.216 7.594 -2.422 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.446 7.547 -0.658 1.00 0.50 H new ATOM 0 HG23 ILE A 76 12.830 7.876 -1.728 1.00 0.50 H new ATOM 0 HD11 ILE A 76 12.593 5.777 -5.165 1.00 0.83 H new ATOM 0 HD12 ILE A 76 11.060 5.788 -4.261 1.00 0.83 H new ATOM 0 HD13 ILE A 76 12.167 7.178 -4.153 1.00 0.83 H new ATOM 1150 N GLU A 77 11.639 5.385 1.340 1.00 0.44 N ATOM 1151 CA GLU A 77 11.156 5.863 2.636 1.00 0.47 C ATOM 1152 C GLU A 77 12.227 5.680 3.703 1.00 0.48 C ATOM 1153 O GLU A 77 12.211 6.354 4.730 1.00 0.54 O ATOM 1154 CB GLU A 77 9.844 5.187 3.059 1.00 0.50 C ATOM 1155 CG GLU A 77 9.929 3.695 3.339 1.00 0.66 C ATOM 1156 CD GLU A 77 10.618 3.379 4.655 1.00 0.97 C ATOM 1157 OE1 GLU A 77 10.132 3.850 5.705 1.00 1.43 O ATOM 1158 OE2 GLU A 77 11.637 2.661 4.639 1.00 1.32 O ATOM 0 H GLU A 77 11.110 4.609 0.941 1.00 0.44 H new ATOM 0 HA GLU A 77 10.942 6.926 2.527 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.473 5.685 3.955 1.00 0.50 H new ATOM 0 HB3 GLU A 77 9.105 5.349 2.275 1.00 0.50 H new ATOM 0 HG2 GLU A 77 8.923 3.275 3.351 1.00 0.66 H new ATOM 0 HG3 GLU A 77 10.468 3.208 2.526 1.00 0.66 H new ATOM 1165 N LEU A 78 13.173 4.783 3.445 1.00 0.45 N ATOM 1166 CA LEU A 78 14.262 4.557 4.384 1.00 0.49 C ATOM 1167 C LEU A 78 15.115 5.815 4.463 1.00 0.49 C ATOM 1168 O LEU A 78 15.640 6.164 5.520 1.00 0.59 O ATOM 1169 CB LEU A 78 15.119 3.366 3.946 1.00 0.53 C ATOM 1170 CG LEU A 78 16.291 3.035 4.872 1.00 0.88 C ATOM 1171 CD1 LEU A 78 15.789 2.620 6.246 1.00 1.66 C ATOM 1172 CD2 LEU A 78 17.155 1.940 4.266 1.00 1.52 C ATOM 0 H LEU A 78 13.207 4.208 2.603 1.00 0.45 H new ATOM 0 HA LEU A 78 13.847 4.329 5.366 1.00 0.49 H new ATOM 0 HB2 LEU A 78 14.479 2.487 3.867 1.00 0.53 H new ATOM 0 HB3 LEU A 78 15.510 3.567 2.948 1.00 0.53 H new ATOM 0 HG LEU A 78 16.900 3.931 4.988 1.00 0.88 H new ATOM 0 HD11 LEU A 78 16.638 2.389 6.889 1.00 1.66 H new ATOM 0 HD12 LEU A 78 15.213 3.435 6.684 1.00 1.66 H new ATOM 0 HD13 LEU A 78 15.155 1.738 6.151 1.00 1.66 H new ATOM 0 HD21 LEU A 78 17.984 1.717 4.938 1.00 1.52 H new ATOM 0 HD22 LEU A 78 16.555 1.042 4.120 1.00 1.52 H new ATOM 0 HD23 LEU A 78 17.546 2.275 3.305 1.00 1.52 H new ATOM 1184 N GLN A 79 15.235 6.492 3.324 1.00 0.47 N ATOM 1185 CA GLN A 79 16.013 7.724 3.235 1.00 0.52 C ATOM 1186 C GLN A 79 15.104 8.921 2.930 1.00 0.53 C ATOM 1187 O GLN A 79 15.582 10.042 2.756 1.00 0.72 O ATOM 1188 CB GLN A 79 17.070 7.594 2.134 1.00 0.63 C ATOM 1189 CG GLN A 79 17.919 6.335 2.240 1.00 1.12 C ATOM 1190 CD GLN A 79 18.877 6.348 3.420 1.00 1.67 C ATOM 1191 OE1 GLN A 79 19.541 5.352 3.700 1.00 2.24 O ATOM 1192 NE2 GLN A 79 18.966 7.481 4.109 1.00 2.32 N ATOM 0 H GLN A 79 14.801 6.206 2.446 1.00 0.47 H new ATOM 0 HA GLN A 79 16.501 7.890 4.195 1.00 0.52 H new ATOM 0 HB2 GLN A 79 16.573 7.605 1.164 1.00 0.63 H new ATOM 0 HB3 GLN A 79 17.724 8.465 2.167 1.00 0.63 H new ATOM 0 HG2 GLN A 79 17.262 5.469 2.325 1.00 1.12 H new ATOM 0 HG3 GLN A 79 18.490 6.213 1.320 1.00 1.12 H new ATOM 0 HE21 GLN A 79 18.397 8.285 3.844 1.00 2.32 H new ATOM 0 HE22 GLN A 79 19.603 7.546 4.903 1.00 2.32 H new ATOM 1201 N GLN A 80 13.797 8.670 2.849 1.00 0.61 N ATOM 1202 CA GLN A 80 12.823 9.718 2.544 1.00 0.72 C ATOM 1203 C GLN A 80 11.717 9.798 3.592 1.00 0.88 C ATOM 1204 O GLN A 80 10.857 10.675 3.524 1.00 1.15 O ATOM 1205 CB GLN A 80 12.210 9.488 1.157 1.00 0.74 C ATOM 1206 CG GLN A 80 13.138 9.880 0.018 1.00 1.27 C ATOM 1207 CD GLN A 80 13.469 11.360 0.020 1.00 1.51 C ATOM 1208 OE1 GLN A 80 12.580 12.206 -0.085 1.00 2.00 O ATOM 1209 NE2 GLN A 80 14.752 11.681 0.140 1.00 2.07 N ATOM 0 H GLN A 80 13.388 7.747 2.991 1.00 0.61 H new ATOM 0 HA GLN A 80 13.358 10.668 2.554 1.00 0.72 H new ATOM 0 HB2 GLN A 80 11.944 8.436 1.055 1.00 0.74 H new ATOM 0 HB3 GLN A 80 11.285 10.060 1.076 1.00 0.74 H new ATOM 0 HG2 GLN A 80 14.061 9.305 0.092 1.00 1.27 H new ATOM 0 HG3 GLN A 80 12.673 9.617 -0.932 1.00 1.27 H new ATOM 0 HE21 GLN A 80 15.456 10.947 0.224 1.00 2.07 H new ATOM 0 HE22 GLN A 80 15.034 12.661 0.148 1.00 2.07 H new ATOM 1218 N GLY A 81 11.735 8.884 4.554 1.00 0.99 N ATOM 1219 CA GLY A 81 10.719 8.883 5.592 1.00 1.25 C ATOM 1220 C GLY A 81 11.246 8.416 6.932 1.00 1.79 C ATOM 1221 O GLY A 81 10.534 8.461 7.937 1.00 2.18 O ATOM 0 H GLY A 81 12.433 8.144 4.635 1.00 0.99 H new ATOM 0 HA2 GLY A 81 10.314 9.889 5.697 1.00 1.25 H new ATOM 0 HA3 GLY A 81 9.895 8.238 5.286 1.00 1.25 H new ATOM 1225 N ARG A 82 12.495 7.971 6.953 1.00 2.09 N ATOM 1226 CA ARG A 82 13.119 7.501 8.182 1.00 2.89 C ATOM 1227 C ARG A 82 14.253 8.436 8.595 1.00 2.71 C ATOM 1228 O ARG A 82 14.002 9.520 9.120 1.00 3.22 O ATOM 1229 CB ARG A 82 13.639 6.071 8.000 1.00 3.76 C ATOM 1230 CG ARG A 82 12.544 5.050 7.737 1.00 4.75 C ATOM 1231 CD ARG A 82 11.630 4.882 8.943 1.00 5.59 C ATOM 1232 NE ARG A 82 12.364 4.439 10.125 1.00 6.37 N ATOM 1233 CZ ARG A 82 11.795 4.218 11.307 1.00 7.14 C ATOM 1234 NH1 ARG A 82 10.487 4.388 11.460 1.00 7.29 N ATOM 1235 NH2 ARG A 82 12.531 3.825 12.338 1.00 8.02 N ATOM 0 H ARG A 82 13.097 7.926 6.131 1.00 2.09 H new ATOM 0 HA ARG A 82 12.371 7.499 8.975 1.00 2.89 H new ATOM 0 HB2 ARG A 82 14.346 6.054 7.170 1.00 3.76 H new ATOM 0 HB3 ARG A 82 14.189 5.778 8.894 1.00 3.76 H new ATOM 0 HG2 ARG A 82 11.955 5.362 6.875 1.00 4.75 H new ATOM 0 HG3 ARG A 82 12.994 4.090 7.485 1.00 4.75 H new ATOM 0 HD2 ARG A 82 11.134 5.829 9.157 1.00 5.59 H new ATOM 0 HD3 ARG A 82 10.849 4.159 8.709 1.00 5.59 H new ATOM 0 HE ARG A 82 13.370 4.291 10.040 1.00 6.37 H new ATOM 0 HH11 ARG A 82 9.916 4.689 10.670 1.00 7.29 H new ATOM 0 HH12 ARG A 82 10.053 4.218 12.367 1.00 7.29 H new ATOM 0 HH21 ARG A 82 13.536 3.691 12.226 1.00 8.02 H new ATOM 0 HH22 ARG A 82 12.092 3.656 13.243 1.00 8.02 H new ATOM 1249 N VAL A 83 15.494 8.011 8.339 1.00 2.65 N ATOM 1250 CA VAL A 83 16.679 8.803 8.667 1.00 2.95 C ATOM 1251 C VAL A 83 16.485 9.633 9.940 1.00 2.78 C ATOM 1252 O VAL A 83 15.924 9.149 10.924 1.00 3.48 O ATOM 1253 CB VAL A 83 17.076 9.726 7.493 1.00 3.70 C ATOM 1254 CG1 VAL A 83 17.485 8.900 6.286 1.00 4.50 C ATOM 1255 CG2 VAL A 83 15.938 10.672 7.131 1.00 4.33 C ATOM 0 H VAL A 83 15.703 7.114 7.901 1.00 2.65 H new ATOM 0 HA VAL A 83 17.486 8.094 8.849 1.00 2.95 H new ATOM 0 HB VAL A 83 17.927 10.329 7.809 1.00 3.70 H new ATOM 0 HG11 VAL A 83 17.762 9.564 5.467 1.00 4.50 H new ATOM 0 HG12 VAL A 83 18.336 8.271 6.547 1.00 4.50 H new ATOM 0 HG13 VAL A 83 16.651 8.271 5.976 1.00 4.50 H new ATOM 0 HG21 VAL A 83 16.245 11.310 6.302 1.00 4.33 H new ATOM 0 HG22 VAL A 83 15.062 10.093 6.838 1.00 4.33 H new ATOM 0 HG23 VAL A 83 15.691 11.291 7.993 1.00 4.33 H new ATOM 1265 N ARG A 84 16.955 10.878 9.914 1.00 2.54 N ATOM 1266 CA ARG A 84 16.836 11.769 11.060 1.00 3.37 C ATOM 1267 C ARG A 84 17.199 13.197 10.666 1.00 3.75 C ATOM 1268 O ARG A 84 16.763 14.159 11.300 1.00 4.35 O ATOM 1269 CB ARG A 84 17.742 11.296 12.198 1.00 3.92 C ATOM 1270 CG ARG A 84 19.210 11.217 11.810 1.00 4.19 C ATOM 1271 CD ARG A 84 20.069 10.721 12.964 1.00 5.23 C ATOM 1272 NE ARG A 84 21.484 10.648 12.605 1.00 5.75 N ATOM 1273 CZ ARG A 84 21.968 9.857 11.650 1.00 6.40 C ATOM 1274 NH1 ARG A 84 21.158 9.060 10.964 1.00 6.67 N ATOM 1275 NH2 ARG A 84 23.267 9.859 11.382 1.00 7.08 N ATOM 0 H ARG A 84 17.423 11.292 9.108 1.00 2.54 H new ATOM 0 HA ARG A 84 15.801 11.752 11.402 1.00 3.37 H new ATOM 0 HB2 ARG A 84 17.634 11.975 13.044 1.00 3.92 H new ATOM 0 HB3 ARG A 84 17.409 10.313 12.533 1.00 3.92 H new ATOM 0 HG2 ARG A 84 19.326 10.549 10.956 1.00 4.19 H new ATOM 0 HG3 ARG A 84 19.557 12.201 11.494 1.00 4.19 H new ATOM 0 HD2 ARG A 84 19.946 11.386 13.819 1.00 5.23 H new ATOM 0 HD3 ARG A 84 19.723 9.735 13.275 1.00 5.23 H new ATOM 0 HE ARG A 84 22.140 11.238 13.117 1.00 5.75 H new ATOM 0 HH11 ARG A 84 20.159 9.051 11.167 1.00 6.67 H new ATOM 0 HH12 ARG A 84 21.535 8.456 10.233 1.00 6.67 H new ATOM 0 HH21 ARG A 84 23.895 10.467 11.908 1.00 7.08 H new ATOM 0 HH22 ARG A 84 23.638 9.253 10.650 1.00 7.08 H new ATOM 1289 N LYS A 85 17.994 13.321 9.608 1.00 4.00 N ATOM 1290 CA LYS A 85 18.418 14.626 9.117 1.00 4.93 C ATOM 1291 C LYS A 85 17.442 15.143 8.067 1.00 5.06 C ATOM 1292 O LYS A 85 17.315 16.350 7.859 1.00 5.81 O ATOM 1293 CB LYS A 85 19.827 14.540 8.521 1.00 5.72 C ATOM 1294 CG LYS A 85 19.918 13.639 7.298 1.00 6.56 C ATOM 1295 CD LYS A 85 21.328 13.609 6.729 1.00 7.22 C ATOM 1296 CE LYS A 85 21.400 12.784 5.454 1.00 8.23 C ATOM 1297 NZ LYS A 85 21.013 11.364 5.684 1.00 8.70 N ATOM 0 H LYS A 85 18.358 12.532 9.074 1.00 4.00 H new ATOM 0 HA LYS A 85 18.431 15.320 9.957 1.00 4.93 H new ATOM 0 HB2 LYS A 85 20.159 15.542 8.249 1.00 5.72 H new ATOM 0 HB3 LYS A 85 20.513 14.173 9.284 1.00 5.72 H new ATOM 0 HG2 LYS A 85 19.612 12.628 7.567 1.00 6.56 H new ATOM 0 HG3 LYS A 85 19.224 13.990 6.534 1.00 6.56 H new ATOM 0 HD2 LYS A 85 21.660 14.627 6.524 1.00 7.22 H new ATOM 0 HD3 LYS A 85 22.011 13.195 7.470 1.00 7.22 H new ATOM 0 HE2 LYS A 85 20.743 13.221 4.702 1.00 8.23 H new ATOM 0 HE3 LYS A 85 22.413 12.823 5.054 1.00 8.23 H new ATOM 0 HZ1 LYS A 85 21.236 10.802 4.838 1.00 8.70 H new ATOM 0 HZ2 LYS A 85 21.540 10.988 6.498 1.00 8.70 H new ATOM 0 HZ3 LYS A 85 19.993 11.309 5.877 1.00 8.70 H new ATOM 1311 N ALA A 86 16.755 14.215 7.407 1.00 4.58 N ATOM 1312 CA ALA A 86 15.787 14.566 6.375 1.00 4.96 C ATOM 1313 C ALA A 86 14.362 14.478 6.908 1.00 4.23 C ATOM 1314 O ALA A 86 13.543 15.364 6.662 1.00 4.67 O ATOM 1315 CB ALA A 86 15.957 13.660 5.165 1.00 5.68 C ATOM 0 H ALA A 86 16.852 13.213 7.570 1.00 4.58 H new ATOM 0 HA ALA A 86 15.971 15.597 6.073 1.00 4.96 H new ATOM 0 HB1 ALA A 86 15.228 13.932 4.401 1.00 5.68 H new ATOM 0 HB2 ALA A 86 16.964 13.775 4.763 1.00 5.68 H new ATOM 0 HB3 ALA A 86 15.801 12.623 5.462 1.00 5.68 H new ATOM 1321 N GLU A 87 14.069 13.405 7.638 1.00 3.27 N ATOM 1322 CA GLU A 87 12.740 13.208 8.203 1.00 2.78 C ATOM 1323 C GLU A 87 12.813 13.013 9.720 1.00 2.78 C ATOM 1324 O GLU A 87 13.581 13.692 10.402 1.00 3.47 O ATOM 1325 CB GLU A 87 12.060 12.006 7.539 1.00 2.42 C ATOM 1326 CG GLU A 87 11.947 12.131 6.028 1.00 3.19 C ATOM 1327 CD GLU A 87 11.145 13.343 5.597 1.00 3.92 C ATOM 1328 OE1 GLU A 87 9.954 13.429 5.966 1.00 4.46 O ATOM 1329 OE2 GLU A 87 11.706 14.206 4.891 1.00 4.37 O ATOM 0 H GLU A 87 14.733 12.661 7.851 1.00 3.27 H new ATOM 0 HA GLU A 87 12.147 14.101 8.008 1.00 2.78 H new ATOM 0 HB2 GLU A 87 12.621 11.103 7.780 1.00 2.42 H new ATOM 0 HB3 GLU A 87 11.062 11.884 7.961 1.00 2.42 H new ATOM 0 HG2 GLU A 87 12.946 12.191 5.597 1.00 3.19 H new ATOM 0 HG3 GLU A 87 11.480 11.231 5.627 1.00 3.19 H new ATOM 1336 N ARG A 88 12.009 12.089 10.241 1.00 2.49 N ATOM 1337 CA ARG A 88 11.983 11.817 11.676 1.00 2.70 C ATOM 1338 C ARG A 88 11.393 10.435 11.952 1.00 2.60 C ATOM 1339 O ARG A 88 10.726 9.852 11.097 1.00 3.18 O ATOM 1340 CB ARG A 88 11.167 12.893 12.401 1.00 3.45 C ATOM 1341 CG ARG A 88 11.155 12.745 13.914 1.00 4.14 C ATOM 1342 CD ARG A 88 10.273 13.794 14.571 1.00 4.97 C ATOM 1343 NE ARG A 88 10.250 13.659 16.025 1.00 5.51 N ATOM 1344 CZ ARG A 88 9.522 14.430 16.828 1.00 6.30 C ATOM 1345 NH1 ARG A 88 8.749 15.381 16.321 1.00 6.63 N ATOM 1346 NH2 ARG A 88 9.564 14.249 18.140 1.00 7.05 N ATOM 0 H ARG A 88 11.368 11.517 9.692 1.00 2.49 H new ATOM 0 HA ARG A 88 13.007 11.836 12.050 1.00 2.70 H new ATOM 0 HB2 ARG A 88 11.569 13.873 12.145 1.00 3.45 H new ATOM 0 HB3 ARG A 88 10.141 12.864 12.035 1.00 3.45 H new ATOM 0 HG2 ARG A 88 10.798 11.750 14.180 1.00 4.14 H new ATOM 0 HG3 ARG A 88 12.172 12.832 14.297 1.00 4.14 H new ATOM 0 HD2 ARG A 88 10.633 14.788 14.305 1.00 4.97 H new ATOM 0 HD3 ARG A 88 9.258 13.708 14.183 1.00 4.97 H new ATOM 0 HE ARG A 88 10.825 12.931 16.449 1.00 5.51 H new ATOM 0 HH11 ARG A 88 8.711 15.523 15.312 1.00 6.63 H new ATOM 0 HH12 ARG A 88 8.192 15.970 16.940 1.00 6.63 H new ATOM 0 HH21 ARG A 88 10.155 13.518 18.535 1.00 7.05 H new ATOM 0 HH22 ARG A 88 9.005 14.841 18.755 1.00 7.05 H new ATOM 1360 N TRP A 89 11.643 9.919 13.152 1.00 2.49 N ATOM 1361 CA TRP A 89 11.136 8.607 13.544 1.00 2.93 C ATOM 1362 C TRP A 89 9.666 8.685 13.952 1.00 2.93 C ATOM 1363 O TRP A 89 9.111 7.726 14.487 1.00 3.71 O ATOM 1364 CB TRP A 89 11.966 8.039 14.699 1.00 3.69 C ATOM 1365 CG TRP A 89 13.385 7.722 14.326 1.00 4.09 C ATOM 1366 CD1 TRP A 89 14.246 8.507 13.612 1.00 4.50 C ATOM 1367 CD2 TRP A 89 14.108 6.528 14.651 1.00 4.70 C ATOM 1368 NE1 TRP A 89 15.458 7.874 13.474 1.00 5.25 N ATOM 1369 CE2 TRP A 89 15.398 6.658 14.103 1.00 5.32 C ATOM 1370 CE3 TRP A 89 13.791 5.363 15.355 1.00 5.16 C ATOM 1371 CZ2 TRP A 89 16.368 5.668 14.235 1.00 6.18 C ATOM 1372 CZ3 TRP A 89 14.753 4.380 15.486 1.00 6.02 C ATOM 1373 CH2 TRP A 89 16.028 4.537 14.929 1.00 6.44 C ATOM 0 H TRP A 89 12.194 10.389 13.870 1.00 2.49 H new ATOM 0 HA TRP A 89 11.220 7.945 12.682 1.00 2.93 H new ATOM 0 HB2 TRP A 89 11.967 8.756 15.520 1.00 3.69 H new ATOM 0 HB3 TRP A 89 11.486 7.133 15.068 1.00 3.69 H new ATOM 0 HD1 TRP A 89 14.009 9.483 13.214 1.00 4.50 H new ATOM 0 HE1 TRP A 89 16.270 8.248 12.983 1.00 5.25 H new ATOM 0 HE3 TRP A 89 12.811 5.233 15.789 1.00 5.16 H new ATOM 0 HZ2 TRP A 89 17.352 5.787 13.806 1.00 6.18 H new ATOM 0 HZ3 TRP A 89 14.518 3.475 16.027 1.00 6.02 H new ATOM 0 HH2 TRP A 89 16.758 3.750 15.049 1.00 6.44 H new ATOM 1384 N GLY A 90 9.043 9.832 13.696 1.00 2.39 N ATOM 1385 CA GLY A 90 7.645 10.012 14.044 1.00 2.51 C ATOM 1386 C GLY A 90 6.718 9.823 12.857 1.00 2.11 C ATOM 1387 O GLY A 90 6.763 8.786 12.194 1.00 2.15 O ATOM 0 H GLY A 90 9.482 10.640 13.254 1.00 2.39 H new ATOM 0 HA2 GLY A 90 7.375 9.303 14.827 1.00 2.51 H new ATOM 0 HA3 GLY A 90 7.503 11.011 14.456 1.00 2.51 H new ATOM 1391 N PRO A 91 5.856 10.816 12.560 1.00 1.87 N ATOM 1392 CA PRO A 91 4.916 10.744 11.438 1.00 1.71 C ATOM 1393 C PRO A 91 5.601 10.379 10.125 1.00 1.71 C ATOM 1394 O PRO A 91 5.074 9.593 9.338 1.00 2.14 O ATOM 1395 CB PRO A 91 4.320 12.159 11.358 1.00 1.86 C ATOM 1396 CG PRO A 91 5.166 13.007 12.250 1.00 2.00 C ATOM 1397 CD PRO A 91 5.728 12.085 13.290 1.00 1.98 C ATOM 0 HA PRO A 91 4.168 9.967 11.595 1.00 1.71 H new ATOM 0 HB2 PRO A 91 4.335 12.532 10.334 1.00 1.86 H new ATOM 0 HB3 PRO A 91 3.280 12.164 11.684 1.00 1.86 H new ATOM 0 HG2 PRO A 91 5.964 13.491 11.686 1.00 2.00 H new ATOM 0 HG3 PRO A 91 4.575 13.799 12.710 1.00 2.00 H new ATOM 0 HD2 PRO A 91 6.690 12.435 13.665 1.00 1.98 H new ATOM 0 HD3 PRO A 91 5.065 11.992 14.150 1.00 1.98 H new ATOM 1405 N ARG A 92 6.782 10.947 9.897 1.00 2.00 N ATOM 1406 CA ARG A 92 7.542 10.671 8.680 1.00 2.09 C ATOM 1407 C ARG A 92 7.735 9.164 8.521 1.00 1.39 C ATOM 1408 O ARG A 92 8.218 8.507 9.443 1.00 1.88 O ATOM 1409 CB ARG A 92 8.908 11.359 8.742 1.00 3.24 C ATOM 1410 CG ARG A 92 8.872 12.770 9.315 1.00 4.14 C ATOM 1411 CD ARG A 92 8.054 13.723 8.457 1.00 4.91 C ATOM 1412 NE ARG A 92 8.057 15.078 9.009 1.00 5.90 N ATOM 1413 CZ ARG A 92 7.457 16.117 8.433 1.00 6.64 C ATOM 1414 NH1 ARG A 92 6.812 15.965 7.287 1.00 6.67 N ATOM 1415 NH2 ARG A 92 7.506 17.313 9.005 1.00 7.60 N ATOM 0 H ARG A 92 7.233 11.600 10.537 1.00 2.00 H new ATOM 0 HA ARG A 92 6.988 11.058 7.825 1.00 2.09 H new ATOM 0 HB2 ARG A 92 9.581 10.751 9.346 1.00 3.24 H new ATOM 0 HB3 ARG A 92 9.329 11.398 7.737 1.00 3.24 H new ATOM 0 HG2 ARG A 92 8.453 12.740 10.321 1.00 4.14 H new ATOM 0 HG3 ARG A 92 9.890 13.149 9.405 1.00 4.14 H new ATOM 0 HD2 ARG A 92 8.458 13.740 7.445 1.00 4.91 H new ATOM 0 HD3 ARG A 92 7.029 13.361 8.385 1.00 4.91 H new ATOM 0 HE ARG A 92 8.549 15.236 9.889 1.00 5.90 H new ATOM 0 HH11 ARG A 92 6.773 15.048 6.841 1.00 6.67 H new ATOM 0 HH12 ARG A 92 6.354 16.765 6.850 1.00 6.67 H new ATOM 0 HH21 ARG A 92 8.004 17.437 9.887 1.00 7.60 H new ATOM 0 HH22 ARG A 92 7.046 18.109 8.563 1.00 7.60 H new ATOM 1429 N THR A 93 7.360 8.625 7.355 1.00 1.14 N ATOM 1430 CA THR A 93 7.490 7.193 7.083 1.00 1.33 C ATOM 1431 C THR A 93 6.692 6.810 5.846 1.00 1.11 C ATOM 1432 O THR A 93 6.093 7.663 5.191 1.00 1.61 O ATOM 1433 CB THR A 93 7.012 6.360 8.279 1.00 1.94 C ATOM 1434 OG1 THR A 93 7.218 4.978 8.048 1.00 2.57 O ATOM 1435 CG2 THR A 93 5.544 6.555 8.598 1.00 2.58 C ATOM 0 H THR A 93 6.963 9.163 6.584 1.00 1.14 H new ATOM 0 HA THR A 93 8.545 6.983 6.909 1.00 1.33 H new ATOM 0 HB THR A 93 7.603 6.711 9.125 1.00 1.94 H new ATOM 0 HG1 THR A 93 6.908 4.467 8.824 1.00 2.57 H new ATOM 0 HG21 THR A 93 5.272 5.937 9.454 1.00 2.58 H new ATOM 0 HG22 THR A 93 5.359 7.603 8.834 1.00 2.58 H new ATOM 0 HG23 THR A 93 4.943 6.266 7.736 1.00 2.58 H new ATOM 1443 N LEU A 94 6.691 5.525 5.531 1.00 0.80 N ATOM 1444 CA LEU A 94 5.976 5.020 4.371 1.00 0.54 C ATOM 1445 C LEU A 94 5.946 3.493 4.428 1.00 0.52 C ATOM 1446 O LEU A 94 6.954 2.863 4.750 1.00 0.65 O ATOM 1447 CB LEU A 94 6.674 5.520 3.105 1.00 0.48 C ATOM 1448 CG LEU A 94 5.883 5.426 1.803 1.00 0.52 C ATOM 1449 CD1 LEU A 94 4.589 6.223 1.896 1.00 1.39 C ATOM 1450 CD2 LEU A 94 6.738 5.925 0.652 1.00 1.37 C ATOM 0 H LEU A 94 7.181 4.809 6.067 1.00 0.80 H new ATOM 0 HA LEU A 94 4.947 5.380 4.362 1.00 0.54 H new ATOM 0 HB2 LEU A 94 6.953 6.562 3.259 1.00 0.48 H new ATOM 0 HB3 LEU A 94 7.600 4.958 2.982 1.00 0.48 H new ATOM 0 HG LEU A 94 5.619 4.384 1.625 1.00 0.52 H new ATOM 0 HD11 LEU A 94 4.043 6.141 0.956 1.00 1.39 H new ATOM 0 HD12 LEU A 94 3.977 5.829 2.707 1.00 1.39 H new ATOM 0 HD13 LEU A 94 4.820 7.270 2.091 1.00 1.39 H new ATOM 0 HD21 LEU A 94 6.172 5.857 -0.277 1.00 1.37 H new ATOM 0 HD22 LEU A 94 7.019 6.963 0.831 1.00 1.37 H new ATOM 0 HD23 LEU A 94 7.637 5.313 0.575 1.00 1.37 H new ATOM 1462 N ASP A 95 4.787 2.901 4.152 1.00 0.49 N ATOM 1463 CA ASP A 95 4.650 1.448 4.217 1.00 0.56 C ATOM 1464 C ASP A 95 4.102 0.870 2.921 1.00 0.48 C ATOM 1465 O ASP A 95 3.087 1.332 2.398 1.00 0.65 O ATOM 1466 CB ASP A 95 3.737 1.060 5.382 1.00 0.87 C ATOM 1467 CG ASP A 95 3.551 -0.440 5.494 1.00 1.51 C ATOM 1468 OD1 ASP A 95 4.561 -1.150 5.682 1.00 1.92 O ATOM 1469 OD2 ASP A 95 2.396 -0.903 5.393 1.00 2.19 O ATOM 0 H ASP A 95 3.938 3.398 3.884 1.00 0.49 H new ATOM 0 HA ASP A 95 5.645 1.032 4.373 1.00 0.56 H new ATOM 0 HB2 ASP A 95 4.157 1.442 6.312 1.00 0.87 H new ATOM 0 HB3 ASP A 95 2.765 1.535 5.252 1.00 0.87 H new ATOM 1474 N LEU A 96 4.790 -0.151 2.413 1.00 0.48 N ATOM 1475 CA LEU A 96 4.385 -0.805 1.176 1.00 0.63 C ATOM 1476 C LEU A 96 4.227 -2.316 1.370 1.00 0.60 C ATOM 1477 O LEU A 96 5.082 -2.970 1.969 1.00 0.76 O ATOM 1478 CB LEU A 96 5.406 -0.524 0.068 1.00 0.97 C ATOM 1479 CG LEU A 96 5.644 0.957 -0.251 1.00 0.98 C ATOM 1480 CD1 LEU A 96 4.329 1.675 -0.507 1.00 1.91 C ATOM 1481 CD2 LEU A 96 6.424 1.638 0.867 1.00 2.04 C ATOM 0 H LEU A 96 5.630 -0.541 2.841 1.00 0.48 H new ATOM 0 HA LEU A 96 3.417 -0.397 0.885 1.00 0.63 H new ATOM 0 HB2 LEU A 96 6.357 -0.974 0.352 1.00 0.97 H new ATOM 0 HB3 LEU A 96 5.076 -1.025 -0.842 1.00 0.97 H new ATOM 0 HG LEU A 96 6.242 1.012 -1.161 1.00 0.98 H new ATOM 0 HD11 LEU A 96 4.525 2.724 -0.731 1.00 1.91 H new ATOM 0 HD12 LEU A 96 3.820 1.212 -1.353 1.00 1.91 H new ATOM 0 HD13 LEU A 96 3.698 1.605 0.379 1.00 1.91 H new ATOM 0 HD21 LEU A 96 6.579 2.687 0.616 1.00 2.04 H new ATOM 0 HD22 LEU A 96 5.862 1.567 1.798 1.00 2.04 H new ATOM 0 HD23 LEU A 96 7.390 1.147 0.988 1.00 2.04 H new ATOM 1493 N ASP A 97 3.127 -2.860 0.849 1.00 0.55 N ATOM 1494 CA ASP A 97 2.840 -4.293 0.943 1.00 0.62 C ATOM 1495 C ASP A 97 2.138 -4.765 -0.319 1.00 0.56 C ATOM 1496 O ASP A 97 1.769 -3.957 -1.162 1.00 0.70 O ATOM 1497 CB ASP A 97 1.984 -4.595 2.177 1.00 0.79 C ATOM 1498 CG ASP A 97 0.660 -3.860 2.157 1.00 1.45 C ATOM 1499 OD1 ASP A 97 0.675 -2.609 2.137 1.00 1.98 O ATOM 1500 OD2 ASP A 97 -0.393 -4.531 2.161 1.00 2.17 O ATOM 0 H ASP A 97 2.414 -2.325 0.353 1.00 0.55 H new ATOM 0 HA ASP A 97 3.783 -4.831 1.045 1.00 0.62 H new ATOM 0 HB2 ASP A 97 1.800 -5.668 2.234 1.00 0.79 H new ATOM 0 HB3 ASP A 97 2.536 -4.318 3.075 1.00 0.79 H new ATOM 1505 N ILE A 98 1.987 -6.074 -0.470 1.00 0.69 N ATOM 1506 CA ILE A 98 1.372 -6.616 -1.673 1.00 0.63 C ATOM 1507 C ILE A 98 0.149 -7.494 -1.410 1.00 0.67 C ATOM 1508 O ILE A 98 0.253 -8.608 -0.901 1.00 0.93 O ATOM 1509 CB ILE A 98 2.411 -7.408 -2.486 1.00 0.74 C ATOM 1510 CG1 ILE A 98 3.374 -8.140 -1.544 1.00 1.91 C ATOM 1511 CG2 ILE A 98 3.175 -6.473 -3.413 1.00 1.40 C ATOM 1512 CD1 ILE A 98 2.819 -9.406 -0.931 1.00 2.73 C ATOM 0 H ILE A 98 2.277 -6.771 0.215 1.00 0.69 H new ATOM 0 HA ILE A 98 1.015 -5.755 -2.238 1.00 0.63 H new ATOM 0 HB ILE A 98 1.893 -8.150 -3.094 1.00 0.74 H new ATOM 0 HG12 ILE A 98 4.282 -8.387 -2.095 1.00 1.91 H new ATOM 0 HG13 ILE A 98 3.663 -7.461 -0.742 1.00 1.91 H new ATOM 0 HG21 ILE A 98 3.907 -7.044 -3.983 1.00 1.40 H new ATOM 0 HG22 ILE A 98 2.478 -5.990 -4.098 1.00 1.40 H new ATOM 0 HG23 ILE A 98 3.687 -5.714 -2.822 1.00 1.40 H new ATOM 0 HD11 ILE A 98 3.570 -9.855 -0.280 1.00 2.73 H new ATOM 0 HD12 ILE A 98 1.929 -9.168 -0.348 1.00 2.73 H new ATOM 0 HD13 ILE A 98 2.558 -10.109 -1.722 1.00 2.73 H new ATOM 1524 N MET A 99 -1.014 -6.985 -1.789 1.00 0.53 N ATOM 1525 CA MET A 99 -2.257 -7.719 -1.634 1.00 0.63 C ATOM 1526 C MET A 99 -2.360 -8.835 -2.680 1.00 0.63 C ATOM 1527 O MET A 99 -3.239 -9.684 -2.590 1.00 0.87 O ATOM 1528 CB MET A 99 -3.449 -6.769 -1.752 1.00 0.70 C ATOM 1529 CG MET A 99 -3.461 -5.686 -0.686 1.00 0.93 C ATOM 1530 SD MET A 99 -3.608 -6.354 0.982 1.00 1.77 S ATOM 1531 CE MET A 99 -3.561 -4.851 1.956 1.00 2.48 C ATOM 0 H MET A 99 -1.121 -6.061 -2.208 1.00 0.53 H new ATOM 0 HA MET A 99 -2.268 -8.175 -0.644 1.00 0.63 H new ATOM 0 HB2 MET A 99 -3.436 -6.301 -2.736 1.00 0.70 H new ATOM 0 HB3 MET A 99 -4.372 -7.345 -1.686 1.00 0.70 H new ATOM 0 HG2 MET A 99 -2.545 -5.100 -0.759 1.00 0.93 H new ATOM 0 HG3 MET A 99 -4.291 -5.005 -0.875 1.00 0.93 H new ATOM 0 HE1 MET A 99 -2.978 -5.022 2.861 1.00 2.48 H new ATOM 0 HE2 MET A 99 -3.100 -4.054 1.373 1.00 2.48 H new ATOM 0 HE3 MET A 99 -4.576 -4.562 2.228 1.00 2.48 H new ATOM 1541 N LEU A 100 -1.449 -8.829 -3.664 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.427 -9.851 -4.723 1.00 0.55 C ATOM 1543 C LEU A 100 -0.095 -9.869 -5.471 1.00 0.54 C ATOM 1544 O LEU A 100 0.580 -8.845 -5.575 1.00 0.76 O ATOM 1545 CB LEU A 100 -2.542 -9.621 -5.756 1.00 0.75 C ATOM 1546 CG LEU A 100 -3.935 -10.123 -5.377 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -4.828 -10.183 -6.607 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -3.856 -11.486 -4.721 1.00 1.69 C ATOM 0 H LEU A 100 -0.715 -8.126 -3.749 1.00 0.51 H new ATOM 0 HA LEU A 100 -1.578 -10.804 -4.217 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -2.607 -8.551 -5.956 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.248 -10.102 -6.689 1.00 0.75 H new ATOM 0 HG LEU A 100 -4.367 -9.423 -4.662 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -5.817 -10.542 -6.322 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -4.915 -9.187 -7.042 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -4.393 -10.862 -7.340 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -4.859 -11.823 -4.460 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -3.403 -12.197 -5.412 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -3.249 -11.421 -3.818 1.00 1.69 H new ATOM 1560 N PHE A 101 0.262 -11.034 -6.022 1.00 0.46 N ATOM 1561 CA PHE A 101 1.498 -11.163 -6.794 1.00 0.46 C ATOM 1562 C PHE A 101 1.199 -11.720 -8.188 1.00 0.51 C ATOM 1563 O PHE A 101 1.519 -12.868 -8.495 1.00 0.58 O ATOM 1564 CB PHE A 101 2.507 -12.061 -6.073 1.00 0.45 C ATOM 1565 CG PHE A 101 3.821 -12.199 -6.794 1.00 0.51 C ATOM 1566 CD1 PHE A 101 4.490 -11.081 -7.271 1.00 0.56 C ATOM 1567 CD2 PHE A 101 4.386 -13.448 -6.993 1.00 0.58 C ATOM 1568 CE1 PHE A 101 5.697 -11.209 -7.932 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.593 -13.581 -7.656 1.00 0.68 C ATOM 1570 CZ PHE A 101 6.248 -12.461 -8.124 1.00 0.71 C ATOM 0 H PHE A 101 -0.283 -11.893 -5.948 1.00 0.46 H new ATOM 0 HA PHE A 101 1.937 -10.170 -6.895 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.690 -11.659 -5.077 1.00 0.45 H new ATOM 0 HB3 PHE A 101 2.070 -13.051 -5.942 1.00 0.45 H new ATOM 0 HD1 PHE A 101 4.063 -10.100 -7.124 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.878 -14.328 -6.626 1.00 0.58 H new ATOM 0 HE1 PHE A 101 6.209 -10.331 -8.298 1.00 0.65 H new ATOM 0 HE2 PHE A 101 6.022 -14.561 -7.807 1.00 0.68 H new ATOM 0 HZ PHE A 101 7.191 -12.563 -8.640 1.00 0.71 H new ATOM 1580 N GLY A 102 0.572 -10.893 -9.020 1.00 0.54 N ATOM 1581 CA GLY A 102 0.226 -11.307 -10.370 1.00 0.65 C ATOM 1582 C GLY A 102 -1.062 -12.105 -10.414 1.00 0.67 C ATOM 1583 O GLY A 102 -1.669 -12.248 -11.476 1.00 0.99 O ATOM 0 H GLY A 102 0.296 -9.940 -8.783 1.00 0.54 H new ATOM 0 HA2 GLY A 102 0.127 -10.426 -11.004 1.00 0.65 H new ATOM 0 HA3 GLY A 102 1.037 -11.907 -10.783 1.00 0.65 H new ATOM 1587 N ASN A 103 -1.437 -12.644 -9.250 1.00 0.58 N ATOM 1588 CA ASN A 103 -2.625 -13.471 -9.071 1.00 0.64 C ATOM 1589 C ASN A 103 -2.184 -14.918 -9.102 1.00 0.71 C ATOM 1590 O ASN A 103 -2.785 -15.778 -9.744 1.00 1.08 O ATOM 1591 CB ASN A 103 -3.710 -13.193 -10.115 1.00 0.78 C ATOM 1592 CG ASN A 103 -5.018 -13.860 -9.760 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -5.128 -15.084 -9.761 1.00 2.12 O ATOM 1594 ND2 ASN A 103 -6.015 -13.050 -9.439 1.00 1.38 N ATOM 0 H ASN A 103 -0.908 -12.512 -8.388 1.00 0.58 H new ATOM 0 HA ASN A 103 -3.086 -13.230 -8.113 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -3.863 -12.117 -10.202 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -3.375 -13.547 -11.090 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -6.922 -13.436 -9.178 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -5.876 -12.040 -9.453 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.088 -15.146 -8.402 1.00 0.53 N ATOM 1602 CA GLU A 104 -0.470 -16.445 -8.304 1.00 0.61 C ATOM 1603 C GLU A 104 -0.465 -16.877 -6.848 1.00 0.64 C ATOM 1604 O GLU A 104 -0.310 -16.045 -5.969 1.00 0.84 O ATOM 1605 CB GLU A 104 0.955 -16.323 -8.836 1.00 0.70 C ATOM 1606 CG GLU A 104 1.563 -17.623 -9.304 1.00 1.16 C ATOM 1607 CD GLU A 104 1.716 -18.647 -8.197 1.00 1.28 C ATOM 1608 OE1 GLU A 104 2.446 -18.366 -7.225 1.00 1.87 O ATOM 1609 OE2 GLU A 104 1.103 -19.729 -8.301 1.00 1.79 O ATOM 0 H GLU A 104 -0.599 -14.419 -7.880 1.00 0.53 H new ATOM 0 HA GLU A 104 -1.014 -17.190 -8.884 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.960 -15.615 -9.665 1.00 0.70 H new ATOM 0 HB3 GLU A 104 1.586 -15.902 -8.053 1.00 0.70 H new ATOM 0 HG2 GLU A 104 0.941 -18.043 -10.094 1.00 1.16 H new ATOM 0 HG3 GLU A 104 2.541 -17.422 -9.741 1.00 1.16 H new ATOM 1616 N VAL A 105 -0.633 -18.158 -6.578 1.00 0.62 N ATOM 1617 CA VAL A 105 -0.638 -18.616 -5.196 1.00 0.66 C ATOM 1618 C VAL A 105 0.781 -18.868 -4.729 1.00 0.70 C ATOM 1619 O VAL A 105 1.384 -19.893 -5.044 1.00 0.83 O ATOM 1620 CB VAL A 105 -1.480 -19.891 -4.999 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -1.550 -20.263 -3.527 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -2.874 -19.705 -5.579 1.00 0.95 C ATOM 0 H VAL A 105 -0.765 -18.888 -7.278 1.00 0.62 H new ATOM 0 HA VAL A 105 -1.095 -17.826 -4.600 1.00 0.66 H new ATOM 0 HB VAL A 105 -0.997 -20.710 -5.532 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -2.149 -21.166 -3.408 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -0.544 -20.443 -3.149 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -2.008 -19.448 -2.967 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -3.454 -20.616 -5.431 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -3.369 -18.874 -5.077 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -2.799 -19.492 -6.645 1.00 0.95 H new ATOM 1632 N ILE A 106 1.318 -17.900 -4.005 1.00 0.65 N ATOM 1633 CA ILE A 106 2.682 -17.979 -3.520 1.00 0.72 C ATOM 1634 C ILE A 106 2.850 -17.195 -2.229 1.00 0.77 C ATOM 1635 O ILE A 106 2.906 -15.966 -2.233 1.00 0.84 O ATOM 1636 CB ILE A 106 3.636 -17.454 -4.607 1.00 0.81 C ATOM 1637 CG1 ILE A 106 5.041 -17.210 -4.066 1.00 0.76 C ATOM 1638 CG2 ILE A 106 3.075 -16.185 -5.229 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.940 -16.555 -5.087 1.00 0.76 C ATOM 0 H ILE A 106 0.826 -17.047 -3.740 1.00 0.65 H new ATOM 0 HA ILE A 106 2.922 -19.020 -3.301 1.00 0.72 H new ATOM 0 HB ILE A 106 3.716 -18.223 -5.375 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.982 -16.580 -3.179 1.00 0.76 H new ATOM 0 HG13 ILE A 106 5.478 -18.159 -3.755 1.00 0.76 H new ATOM 0 HG21 ILE A 106 3.759 -15.823 -5.997 1.00 1.33 H new ATOM 0 HG22 ILE A 106 2.105 -16.398 -5.678 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.958 -15.423 -4.458 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.929 -16.402 -4.656 1.00 0.76 H new ATOM 0 HD12 ILE A 106 6.022 -17.197 -5.964 1.00 0.76 H new ATOM 0 HD13 ILE A 106 5.518 -15.593 -5.379 1.00 0.76 H new ATOM 1651 N ASN A 107 2.910 -17.925 -1.121 1.00 0.80 N ATOM 1652 CA ASN A 107 3.051 -17.309 0.188 1.00 0.91 C ATOM 1653 C ASN A 107 4.396 -17.647 0.820 1.00 0.92 C ATOM 1654 O ASN A 107 4.896 -18.764 0.692 1.00 1.03 O ATOM 1655 CB ASN A 107 1.924 -17.771 1.108 1.00 1.00 C ATOM 1656 CG ASN A 107 0.635 -18.008 0.355 1.00 1.11 C ATOM 1657 OD1 ASN A 107 0.513 -18.963 -0.413 1.00 1.79 O ATOM 1658 ND2 ASN A 107 -0.327 -17.125 0.554 1.00 1.12 N ATOM 0 H ASN A 107 2.863 -18.944 -1.106 1.00 0.80 H new ATOM 0 HA ASN A 107 2.997 -16.229 0.055 1.00 0.91 H new ATOM 0 HB2 ASN A 107 2.223 -18.690 1.613 1.00 1.00 H new ATOM 0 HB3 ASN A 107 1.758 -17.022 1.882 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -1.215 -17.219 0.062 1.00 1.12 H new ATOM 0 HD22 ASN A 107 -0.182 -16.349 1.200 1.00 1.12 H new ATOM 1665 N THR A 108 4.965 -16.668 1.510 1.00 0.92 N ATOM 1666 CA THR A 108 6.250 -16.842 2.182 1.00 1.01 C ATOM 1667 C THR A 108 6.293 -16.049 3.487 1.00 1.15 C ATOM 1668 O THR A 108 6.181 -16.615 4.573 1.00 1.79 O ATOM 1669 CB THR A 108 7.400 -16.410 1.267 1.00 1.00 C ATOM 1670 OG1 THR A 108 7.194 -15.095 0.785 1.00 1.66 O ATOM 1671 CG2 THR A 108 7.587 -17.315 0.068 1.00 1.26 C ATOM 0 H THR A 108 4.556 -15.740 1.621 1.00 0.92 H new ATOM 0 HA THR A 108 6.366 -17.900 2.416 1.00 1.01 H new ATOM 0 HB THR A 108 8.295 -16.467 1.887 1.00 1.00 H new ATOM 0 HG1 THR A 108 7.941 -14.839 0.204 1.00 1.66 H new ATOM 0 HG21 THR A 108 8.418 -16.951 -0.537 1.00 1.26 H new ATOM 0 HG22 THR A 108 7.802 -18.328 0.407 1.00 1.26 H new ATOM 0 HG23 THR A 108 6.676 -17.318 -0.531 1.00 1.26 H new ATOM 1679 N GLU A 109 6.451 -14.733 3.367 1.00 0.95 N ATOM 1680 CA GLU A 109 6.504 -13.852 4.528 1.00 1.05 C ATOM 1681 C GLU A 109 6.356 -12.400 4.094 1.00 1.06 C ATOM 1682 O GLU A 109 5.607 -11.631 4.698 1.00 1.32 O ATOM 1683 CB GLU A 109 7.818 -14.046 5.288 1.00 1.20 C ATOM 1684 CG GLU A 109 7.937 -13.181 6.533 1.00 1.46 C ATOM 1685 CD GLU A 109 6.844 -13.460 7.545 1.00 2.13 C ATOM 1686 OE1 GLU A 109 6.736 -14.620 7.999 1.00 2.74 O ATOM 1687 OE2 GLU A 109 6.095 -12.521 7.885 1.00 2.57 O ATOM 0 H GLU A 109 6.545 -14.253 2.472 1.00 0.95 H new ATOM 0 HA GLU A 109 5.679 -14.106 5.193 1.00 1.05 H new ATOM 0 HB2 GLU A 109 7.911 -15.094 5.574 1.00 1.20 H new ATOM 0 HB3 GLU A 109 8.650 -13.823 4.620 1.00 1.20 H new ATOM 0 HG2 GLU A 109 8.908 -13.351 6.997 1.00 1.46 H new ATOM 0 HG3 GLU A 109 7.901 -12.130 6.245 1.00 1.46 H new ATOM 1694 N ARG A 110 7.062 -12.043 3.028 1.00 0.93 N ATOM 1695 CA ARG A 110 7.000 -10.693 2.484 1.00 0.97 C ATOM 1696 C ARG A 110 6.317 -10.721 1.127 1.00 0.79 C ATOM 1697 O ARG A 110 6.219 -9.702 0.442 1.00 0.87 O ATOM 1698 CB ARG A 110 8.400 -10.076 2.356 1.00 1.17 C ATOM 1699 CG ARG A 110 9.328 -10.812 1.398 1.00 1.05 C ATOM 1700 CD ARG A 110 9.879 -12.091 2.013 1.00 1.57 C ATOM 1701 NE ARG A 110 10.813 -12.773 1.119 1.00 2.14 N ATOM 1702 CZ ARG A 110 11.426 -13.911 1.425 1.00 2.68 C ATOM 1703 NH1 ARG A 110 11.204 -14.495 2.596 1.00 2.96 N ATOM 1704 NH2 ARG A 110 12.262 -14.470 0.561 1.00 3.52 N ATOM 0 H ARG A 110 7.686 -12.672 2.522 1.00 0.93 H new ATOM 0 HA ARG A 110 6.424 -10.074 3.172 1.00 0.97 H new ATOM 0 HB2 ARG A 110 8.299 -9.043 2.023 1.00 1.17 H new ATOM 0 HB3 ARG A 110 8.863 -10.049 3.342 1.00 1.17 H new ATOM 0 HG2 ARG A 110 8.788 -11.053 0.482 1.00 1.05 H new ATOM 0 HG3 ARG A 110 10.154 -10.158 1.118 1.00 1.05 H new ATOM 0 HD2 ARG A 110 10.382 -11.854 2.950 1.00 1.57 H new ATOM 0 HD3 ARG A 110 9.054 -12.761 2.255 1.00 1.57 H new ATOM 0 HE ARG A 110 11.005 -12.352 0.210 1.00 2.14 H new ATOM 0 HH11 ARG A 110 10.561 -14.070 3.264 1.00 2.96 H new ATOM 0 HH12 ARG A 110 11.676 -15.369 2.828 1.00 2.96 H new ATOM 0 HH21 ARG A 110 12.436 -14.026 -0.341 1.00 3.52 H new ATOM 0 HH22 ARG A 110 12.732 -15.344 0.798 1.00 3.52 H new ATOM 1718 N LEU A 111 5.845 -11.905 0.748 1.00 0.72 N ATOM 1719 CA LEU A 111 5.166 -12.089 -0.524 1.00 0.75 C ATOM 1720 C LEU A 111 3.901 -12.928 -0.353 1.00 0.66 C ATOM 1721 O LEU A 111 3.856 -14.099 -0.731 1.00 0.70 O ATOM 1722 CB LEU A 111 6.114 -12.732 -1.544 1.00 0.95 C ATOM 1723 CG LEU A 111 5.480 -13.136 -2.881 1.00 0.69 C ATOM 1724 CD1 LEU A 111 4.567 -12.041 -3.400 1.00 0.95 C ATOM 1725 CD2 LEU A 111 6.560 -13.437 -3.904 1.00 1.36 C ATOM 0 H LEU A 111 5.923 -12.753 1.309 1.00 0.72 H new ATOM 0 HA LEU A 111 4.867 -11.110 -0.898 1.00 0.75 H new ATOM 0 HB2 LEU A 111 6.928 -12.035 -1.745 1.00 0.95 H new ATOM 0 HB3 LEU A 111 6.558 -13.619 -1.091 1.00 0.95 H new ATOM 0 HG LEU A 111 4.883 -14.033 -2.716 1.00 0.69 H new ATOM 0 HD11 LEU A 111 4.130 -12.351 -4.349 1.00 0.95 H new ATOM 0 HD12 LEU A 111 3.772 -11.857 -2.677 1.00 0.95 H new ATOM 0 HD13 LEU A 111 5.142 -11.127 -3.547 1.00 0.95 H new ATOM 0 HD21 LEU A 111 6.097 -13.723 -4.849 1.00 1.36 H new ATOM 0 HD22 LEU A 111 7.175 -12.550 -4.055 1.00 1.36 H new ATOM 0 HD23 LEU A 111 7.184 -14.255 -3.544 1.00 1.36 H new ATOM 1737 N THR A 112 2.873 -12.309 0.217 1.00 0.71 N ATOM 1738 CA THR A 112 1.599 -12.978 0.434 1.00 0.67 C ATOM 1739 C THR A 112 0.584 -12.547 -0.623 1.00 0.66 C ATOM 1740 O THR A 112 0.174 -11.387 -0.667 1.00 0.82 O ATOM 1741 CB THR A 112 1.067 -12.667 1.837 1.00 0.74 C ATOM 1742 OG1 THR A 112 -0.213 -13.243 2.027 1.00 0.75 O ATOM 1743 CG2 THR A 112 0.953 -11.184 2.125 1.00 0.83 C ATOM 0 H THR A 112 2.899 -11.341 0.538 1.00 0.71 H new ATOM 0 HA THR A 112 1.754 -14.054 0.349 1.00 0.67 H new ATOM 0 HB THR A 112 1.799 -13.095 2.522 1.00 0.74 H new ATOM 0 HG1 THR A 112 -0.434 -13.242 2.982 1.00 0.75 H new ATOM 0 HG21 THR A 112 0.570 -11.038 3.135 1.00 0.83 H new ATOM 0 HG22 THR A 112 1.936 -10.720 2.039 1.00 0.83 H new ATOM 0 HG23 THR A 112 0.271 -10.726 1.409 1.00 0.83 H new ATOM 1751 N VAL A 113 0.184 -13.484 -1.478 1.00 0.60 N ATOM 1752 CA VAL A 113 -0.781 -13.188 -2.528 1.00 0.61 C ATOM 1753 C VAL A 113 -2.192 -13.111 -1.946 1.00 0.64 C ATOM 1754 O VAL A 113 -2.796 -12.044 -1.971 1.00 0.80 O ATOM 1755 CB VAL A 113 -0.692 -14.207 -3.673 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -1.775 -13.957 -4.709 1.00 1.27 C ATOM 1757 CG2 VAL A 113 0.688 -14.134 -4.300 1.00 1.38 C ATOM 0 H VAL A 113 0.512 -14.450 -1.463 1.00 0.60 H new ATOM 0 HA VAL A 113 -0.539 -12.214 -2.953 1.00 0.61 H new ATOM 0 HB VAL A 113 -0.850 -15.209 -3.274 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -1.690 -14.692 -5.509 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -2.755 -14.044 -4.239 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -1.658 -12.955 -5.123 1.00 1.27 H new ATOM 0 HG21 VAL A 113 0.757 -14.856 -5.114 1.00 1.38 H new ATOM 0 HG22 VAL A 113 0.858 -13.130 -4.690 1.00 1.38 H new ATOM 0 HG23 VAL A 113 1.442 -14.363 -3.547 1.00 1.38 H new ATOM 1767 N PRO A 114 -2.736 -14.216 -1.373 1.00 0.61 N ATOM 1768 CA PRO A 114 -4.064 -14.189 -0.749 1.00 0.70 C ATOM 1769 C PRO A 114 -4.178 -13.014 0.213 1.00 0.76 C ATOM 1770 O PRO A 114 -5.268 -12.657 0.655 1.00 0.88 O ATOM 1771 CB PRO A 114 -4.128 -15.511 0.012 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.219 -16.414 -0.740 1.00 0.83 C ATOM 1773 CD PRO A 114 -2.109 -15.544 -1.256 1.00 0.63 C ATOM 0 HA PRO A 114 -4.872 -14.073 -1.472 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -3.803 -15.391 1.045 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -5.144 -15.904 0.041 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -2.830 -17.202 -0.095 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -3.745 -16.903 -1.560 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -1.261 -15.528 -0.572 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -1.736 -15.898 -2.217 1.00 0.63 H new ATOM 1781 N HIS A 115 -3.015 -12.416 0.494 1.00 0.82 N ATOM 1782 CA HIS A 115 -2.875 -11.251 1.364 1.00 0.95 C ATOM 1783 C HIS A 115 -3.647 -11.368 2.665 1.00 0.86 C ATOM 1784 O HIS A 115 -4.868 -11.491 2.684 1.00 0.88 O ATOM 1785 CB HIS A 115 -3.239 -9.952 0.622 1.00 1.14 C ATOM 1786 CG HIS A 115 -4.622 -9.899 0.037 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -5.052 -10.728 -0.980 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -5.666 -9.085 0.313 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -6.297 -10.426 -1.300 1.00 4.09 C ATOM 1790 NE2 HIS A 115 -6.693 -9.433 -0.528 1.00 3.97 N ATOM 0 H HIS A 115 -2.126 -12.739 0.112 1.00 0.82 H new ATOM 0 HA HIS A 115 -1.821 -11.212 1.640 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -3.125 -9.117 1.313 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -2.519 -9.801 -0.182 1.00 1.14 H new ATOM 0 HD1 HIS A 115 -4.494 -11.461 -1.417 1.00 3.14 H new ATOM 0 HD2 HIS A 115 -5.688 -8.304 1.059 1.00 2.95 H new ATOM 0 HE1 HIS A 115 -6.889 -10.909 -2.063 1.00 4.09 H new ATOM 1799 N TYR A 116 -2.900 -11.304 3.762 1.00 1.04 N ATOM 1800 CA TYR A 116 -3.471 -11.374 5.096 1.00 1.14 C ATOM 1801 C TYR A 116 -3.339 -10.021 5.789 1.00 1.04 C ATOM 1802 O TYR A 116 -2.440 -9.243 5.465 1.00 1.47 O ATOM 1803 CB TYR A 116 -2.774 -12.463 5.925 1.00 1.62 C ATOM 1804 CG TYR A 116 -3.006 -13.873 5.421 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -2.772 -14.209 4.092 1.00 3.06 C ATOM 1806 CD2 TYR A 116 -3.459 -14.869 6.277 1.00 2.56 C ATOM 1807 CE1 TYR A 116 -2.983 -15.495 3.632 1.00 4.05 C ATOM 1808 CE2 TYR A 116 -3.672 -16.157 5.824 1.00 3.50 C ATOM 1809 CZ TYR A 116 -3.433 -16.465 4.501 1.00 4.18 C ATOM 1810 OH TYR A 116 -3.644 -17.746 4.047 1.00 5.29 O ATOM 0 H TYR A 116 -1.885 -11.202 3.749 1.00 1.04 H new ATOM 0 HA TYR A 116 -4.527 -11.630 5.010 1.00 1.14 H new ATOM 0 HB2 TYR A 116 -1.702 -12.265 5.936 1.00 1.62 H new ATOM 0 HB3 TYR A 116 -3.121 -12.396 6.956 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -2.419 -13.452 3.407 1.00 3.06 H new ATOM 0 HD2 TYR A 116 -3.648 -14.633 7.314 1.00 2.56 H new ATOM 0 HE1 TYR A 116 -2.796 -15.738 2.597 1.00 4.05 H new ATOM 0 HE2 TYR A 116 -4.024 -16.919 6.503 1.00 3.50 H new ATOM 0 HH TYR A 116 -3.960 -18.307 4.786 1.00 5.29 H new ATOM 1820 N ASP A 117 -4.249 -9.753 6.725 1.00 0.77 N ATOM 1821 CA ASP A 117 -4.274 -8.495 7.481 1.00 0.80 C ATOM 1822 C ASP A 117 -5.030 -7.415 6.716 1.00 0.72 C ATOM 1823 O ASP A 117 -5.372 -6.373 7.271 1.00 0.82 O ATOM 1824 CB ASP A 117 -2.859 -8.010 7.826 1.00 1.03 C ATOM 1825 CG ASP A 117 -2.085 -9.021 8.651 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -2.644 -10.094 8.958 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -0.917 -8.738 8.990 1.00 2.22 O ATOM 0 H ASP A 117 -4.993 -10.402 6.983 1.00 0.77 H new ATOM 0 HA ASP A 117 -4.797 -8.693 8.417 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -2.314 -7.804 6.905 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -2.924 -7.071 8.375 1.00 1.03 H new ATOM 1832 N MET A 118 -5.304 -7.683 5.443 1.00 0.69 N ATOM 1833 CA MET A 118 -6.044 -6.746 4.600 1.00 0.72 C ATOM 1834 C MET A 118 -7.398 -6.437 5.230 1.00 0.71 C ATOM 1835 O MET A 118 -7.866 -5.300 5.193 1.00 0.73 O ATOM 1836 CB MET A 118 -6.250 -7.327 3.191 1.00 0.83 C ATOM 1837 CG MET A 118 -7.090 -8.602 3.173 1.00 1.15 C ATOM 1838 SD MET A 118 -6.478 -9.897 4.270 1.00 2.40 S ATOM 1839 CE MET A 118 -7.644 -11.215 3.933 1.00 3.10 C ATOM 0 H MET A 118 -5.025 -8.543 4.971 1.00 0.69 H new ATOM 0 HA MET A 118 -5.464 -5.827 4.517 1.00 0.72 H new ATOM 0 HB2 MET A 118 -6.731 -6.576 2.564 1.00 0.83 H new ATOM 0 HB3 MET A 118 -5.277 -7.537 2.748 1.00 0.83 H new ATOM 0 HG2 MET A 118 -8.114 -8.355 3.455 1.00 1.15 H new ATOM 0 HG3 MET A 118 -7.124 -8.989 2.154 1.00 1.15 H new ATOM 0 HE1 MET A 118 -7.222 -12.166 4.258 1.00 3.10 H new ATOM 0 HE2 MET A 118 -8.572 -11.026 4.472 1.00 3.10 H new ATOM 0 HE3 MET A 118 -7.848 -11.256 2.863 1.00 3.10 H new ATOM 1849 N LYS A 119 -8.014 -7.460 5.821 1.00 0.80 N ATOM 1850 CA LYS A 119 -9.311 -7.310 6.476 1.00 0.95 C ATOM 1851 C LYS A 119 -9.247 -6.242 7.556 1.00 0.99 C ATOM 1852 O LYS A 119 -10.273 -5.766 8.044 1.00 1.24 O ATOM 1853 CB LYS A 119 -9.746 -8.639 7.092 1.00 1.15 C ATOM 1854 CG LYS A 119 -8.670 -9.290 7.939 1.00 1.30 C ATOM 1855 CD LYS A 119 -9.195 -10.526 8.649 1.00 1.70 C ATOM 1856 CE LYS A 119 -8.139 -11.126 9.556 1.00 2.06 C ATOM 1857 NZ LYS A 119 -8.658 -12.292 10.323 1.00 2.67 N ATOM 0 H LYS A 119 -7.633 -8.405 5.859 1.00 0.80 H new ATOM 0 HA LYS A 119 -10.040 -7.005 5.725 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -10.631 -8.474 7.706 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -10.034 -9.324 6.294 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -7.824 -9.563 7.308 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -8.302 -8.575 8.675 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -10.076 -10.265 9.235 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -9.509 -11.266 7.913 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -7.283 -11.438 8.958 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -7.783 -10.365 10.250 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -7.904 -12.672 10.930 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -9.459 -11.990 10.914 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -8.974 -13.030 9.662 1.00 2.67 H new ATOM 1871 N ASN A 120 -8.028 -5.880 7.926 1.00 0.90 N ATOM 1872 CA ASN A 120 -7.797 -4.878 8.952 1.00 1.04 C ATOM 1873 C ASN A 120 -7.577 -3.496 8.349 1.00 1.08 C ATOM 1874 O ASN A 120 -7.050 -2.605 9.018 1.00 1.35 O ATOM 1875 CB ASN A 120 -6.581 -5.271 9.788 1.00 1.08 C ATOM 1876 CG ASN A 120 -6.838 -6.488 10.656 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -7.736 -6.486 11.499 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -6.047 -7.536 10.453 1.00 1.84 N ATOM 0 H ASN A 120 -7.176 -6.271 7.525 1.00 0.90 H new ATOM 0 HA ASN A 120 -8.685 -4.832 9.582 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -5.739 -5.473 9.126 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -6.294 -4.432 10.421 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -6.171 -8.384 11.007 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -5.316 -7.493 9.743 1.00 1.84 H new ATOM 1885 N ARG A 121 -7.966 -3.307 7.089 1.00 0.93 N ATOM 1886 CA ARG A 121 -7.777 -2.012 6.446 1.00 1.06 C ATOM 1887 C ARG A 121 -8.632 -1.822 5.191 1.00 0.84 C ATOM 1888 O ARG A 121 -8.381 -2.427 4.149 1.00 0.87 O ATOM 1889 CB ARG A 121 -6.297 -1.816 6.104 1.00 1.31 C ATOM 1890 CG ARG A 121 -5.688 -2.969 5.324 1.00 1.14 C ATOM 1891 CD ARG A 121 -4.206 -2.748 5.072 1.00 1.39 C ATOM 1892 NE ARG A 121 -3.460 -2.579 6.316 1.00 1.56 N ATOM 1893 CZ ARG A 121 -2.149 -2.357 6.369 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -1.438 -2.281 5.251 1.00 2.29 N ATOM 1895 NH2 ARG A 121 -1.547 -2.210 7.542 1.00 2.04 N ATOM 0 H ARG A 121 -8.405 -4.019 6.505 1.00 0.93 H new ATOM 0 HA ARG A 121 -8.107 -1.258 7.160 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -6.186 -0.899 5.525 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -5.736 -1.679 7.028 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -5.830 -3.898 5.876 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -6.208 -3.081 4.372 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -3.802 -3.596 4.519 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -4.072 -1.866 4.446 1.00 1.39 H new ATOM 0 HE ARG A 121 -3.974 -2.634 7.195 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -1.896 -2.393 4.347 1.00 2.29 H new ATOM 0 HH12 ARG A 121 -0.433 -2.111 5.296 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -2.089 -2.267 8.404 1.00 2.04 H new ATOM 0 HH22 ARG A 121 -0.542 -2.040 7.582 1.00 2.04 H new ATOM 1909 N GLY A 122 -9.617 -0.931 5.302 1.00 0.73 N ATOM 1910 CA GLY A 122 -10.478 -0.602 4.175 1.00 0.60 C ATOM 1911 C GLY A 122 -9.888 0.541 3.388 1.00 0.57 C ATOM 1912 O GLY A 122 -10.252 0.780 2.240 1.00 0.59 O ATOM 0 H GLY A 122 -9.835 -0.427 6.161 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -10.597 -1.474 3.531 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -11.472 -0.332 4.533 1.00 0.60 H new ATOM 1916 N PHE A 123 -8.950 1.235 4.021 1.00 0.65 N ATOM 1917 CA PHE A 123 -8.261 2.356 3.402 1.00 0.72 C ATOM 1918 C PHE A 123 -7.132 1.848 2.513 1.00 0.80 C ATOM 1919 O PHE A 123 -6.316 2.622 2.015 1.00 1.14 O ATOM 1920 CB PHE A 123 -7.718 3.292 4.482 1.00 0.84 C ATOM 1921 CG PHE A 123 -6.982 2.580 5.585 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -5.729 2.033 5.366 1.00 1.47 C ATOM 1923 CD2 PHE A 123 -7.552 2.455 6.842 1.00 1.10 C ATOM 1924 CE1 PHE A 123 -5.058 1.374 6.378 1.00 2.04 C ATOM 1925 CE2 PHE A 123 -6.885 1.798 7.859 1.00 1.49 C ATOM 1926 CZ PHE A 123 -5.637 1.257 7.627 1.00 1.98 C ATOM 0 H PHE A 123 -8.648 1.036 4.975 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.964 2.912 2.782 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -7.048 4.017 4.019 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -8.546 3.854 4.914 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -5.271 2.123 4.392 1.00 1.47 H new ATOM 0 HD2 PHE A 123 -8.529 2.876 7.029 1.00 1.10 H new ATOM 0 HE1 PHE A 123 -4.082 0.951 6.193 1.00 2.04 H new ATOM 0 HE2 PHE A 123 -7.340 1.708 8.834 1.00 1.49 H new ATOM 0 HZ PHE A 123 -5.114 0.743 8.420 1.00 1.98 H new ATOM 1936 N MET A 124 -7.106 0.533 2.322 1.00 0.62 N ATOM 1937 CA MET A 124 -6.098 -0.112 1.494 1.00 0.68 C ATOM 1938 C MET A 124 -6.759 -1.034 0.476 1.00 0.64 C ATOM 1939 O MET A 124 -6.301 -1.156 -0.662 1.00 0.68 O ATOM 1940 CB MET A 124 -5.128 -0.912 2.364 1.00 0.80 C ATOM 1941 CG MET A 124 -3.711 -0.361 2.375 1.00 1.00 C ATOM 1942 SD MET A 124 -3.628 1.351 2.928 1.00 1.91 S ATOM 1943 CE MET A 124 -1.859 1.622 2.915 1.00 2.23 C ATOM 0 H MET A 124 -7.780 -0.111 2.735 1.00 0.62 H new ATOM 0 HA MET A 124 -5.543 0.661 0.963 1.00 0.68 H new ATOM 0 HB2 MET A 124 -5.506 -0.935 3.386 1.00 0.80 H new ATOM 0 HB3 MET A 124 -5.104 -1.943 2.010 1.00 0.80 H new ATOM 0 HG2 MET A 124 -3.092 -0.978 3.026 1.00 1.00 H new ATOM 0 HG3 MET A 124 -3.290 -0.434 1.372 1.00 1.00 H new ATOM 0 HE1 MET A 124 -1.653 2.671 2.704 1.00 2.23 H new ATOM 0 HE2 MET A 124 -1.443 1.359 3.888 1.00 2.23 H new ATOM 0 HE3 MET A 124 -1.401 1.001 2.145 1.00 2.23 H new ATOM 1953 N LEU A 125 -7.847 -1.678 0.893 1.00 0.61 N ATOM 1954 CA LEU A 125 -8.574 -2.582 0.031 1.00 0.62 C ATOM 1955 C LEU A 125 -9.553 -1.819 -0.854 1.00 0.56 C ATOM 1956 O LEU A 125 -9.571 -1.997 -2.068 1.00 0.63 O ATOM 1957 CB LEU A 125 -9.280 -3.642 0.874 1.00 0.67 C ATOM 1958 CG LEU A 125 -8.350 -4.584 1.636 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -9.152 -5.561 2.481 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -7.441 -5.332 0.673 1.00 1.16 C ATOM 0 H LEU A 125 -8.239 -1.584 1.830 1.00 0.61 H new ATOM 0 HA LEU A 125 -7.871 -3.087 -0.632 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -9.931 -3.141 1.590 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -9.920 -4.236 0.222 1.00 0.67 H new ATOM 0 HG LEU A 125 -7.728 -3.986 2.302 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -8.471 -6.223 3.016 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -9.759 -5.009 3.198 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -9.801 -6.153 1.836 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -6.786 -5.998 1.234 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -8.047 -5.917 -0.019 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -6.838 -4.618 0.113 1.00 1.16 H new ATOM 1972 N TRP A 126 -10.348 -0.950 -0.245 1.00 0.48 N ATOM 1973 CA TRP A 126 -11.311 -0.145 -0.986 1.00 0.48 C ATOM 1974 C TRP A 126 -10.592 0.646 -2.081 1.00 0.47 C ATOM 1975 O TRP A 126 -10.959 0.555 -3.249 1.00 0.48 O ATOM 1976 CB TRP A 126 -12.080 0.768 -0.026 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.921 1.813 -0.688 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -13.094 3.086 -0.249 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -13.707 1.687 -1.883 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -13.933 3.770 -1.094 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -14.322 2.934 -2.106 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -13.948 0.649 -2.788 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -15.161 3.168 -3.192 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -14.781 0.883 -3.866 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -15.378 2.133 -4.060 1.00 3.03 C ATOM 0 H TRP A 126 -10.345 -0.784 0.761 1.00 0.48 H new ATOM 0 HA TRP A 126 -12.039 -0.794 -1.472 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.722 0.151 0.603 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -11.366 1.261 0.633 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -12.637 3.501 0.637 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -14.220 4.743 -0.985 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -13.491 -0.319 -2.647 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -15.624 4.132 -3.344 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -14.974 0.087 -4.570 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -16.024 2.284 -4.913 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.535 1.412 -1.739 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.772 2.162 -2.738 1.00 0.54 C ATOM 1998 C PRO A 127 -8.329 1.249 -3.879 1.00 0.53 C ATOM 1999 O PRO A 127 -8.533 1.557 -5.053 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.547 2.671 -1.966 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.549 1.931 -0.673 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.981 1.596 -0.389 1.00 0.55 C ATOM 0 HA PRO A 127 -9.356 2.964 -3.189 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.628 2.485 -2.522 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -7.607 3.747 -1.801 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.943 1.027 -0.740 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -7.125 2.540 0.125 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -9.075 0.694 0.215 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -9.486 2.396 0.152 1.00 0.55 H new ATOM 2010 N LEU A 128 -7.737 0.113 -3.512 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.276 -0.872 -4.487 1.00 0.56 C ATOM 2012 C LEU A 128 -8.468 -1.473 -5.216 1.00 0.54 C ATOM 2013 O LEU A 128 -8.343 -1.991 -6.325 1.00 0.61 O ATOM 2014 CB LEU A 128 -6.481 -1.973 -3.779 1.00 0.63 C ATOM 2015 CG LEU A 128 -5.865 -3.040 -4.695 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -5.053 -2.398 -5.806 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -4.987 -3.983 -3.888 1.00 1.55 C ATOM 0 H LEU A 128 -7.565 -0.148 -2.541 1.00 0.53 H new ATOM 0 HA LEU A 128 -6.628 -0.381 -5.213 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -5.680 -1.506 -3.205 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -7.138 -2.469 -3.065 1.00 0.63 H new ATOM 0 HG LEU A 128 -6.678 -3.609 -5.147 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -4.627 -3.175 -6.441 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -5.699 -1.755 -6.403 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -4.249 -1.803 -5.372 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -4.556 -4.735 -4.549 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -4.186 -3.417 -3.412 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -5.588 -4.474 -3.123 1.00 1.55 H new ATOM 2029 N PHE A 129 -9.626 -1.384 -4.577 1.00 0.50 N ATOM 2030 CA PHE A 129 -10.863 -1.898 -5.140 1.00 0.51 C ATOM 2031 C PHE A 129 -11.327 -0.984 -6.267 1.00 0.53 C ATOM 2032 O PHE A 129 -11.940 -1.427 -7.235 1.00 0.70 O ATOM 2033 CB PHE A 129 -11.932 -1.983 -4.049 1.00 0.49 C ATOM 2034 CG PHE A 129 -13.152 -2.758 -4.443 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -14.137 -2.179 -5.226 1.00 0.62 C ATOM 2036 CD2 PHE A 129 -13.320 -4.063 -4.016 1.00 0.60 C ATOM 2037 CE1 PHE A 129 -15.265 -2.890 -5.582 1.00 0.73 C ATOM 2038 CE2 PHE A 129 -14.446 -4.778 -4.369 1.00 0.71 C ATOM 2039 CZ PHE A 129 -15.420 -4.191 -5.155 1.00 0.75 C ATOM 0 H PHE A 129 -9.733 -0.955 -3.658 1.00 0.50 H new ATOM 0 HA PHE A 129 -10.694 -2.897 -5.541 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -11.494 -2.442 -3.162 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -12.232 -0.973 -3.770 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -14.021 -1.159 -5.562 1.00 0.62 H new ATOM 0 HD2 PHE A 129 -12.563 -4.526 -3.401 1.00 0.60 H new ATOM 0 HE1 PHE A 129 -16.025 -2.428 -6.194 1.00 0.73 H new ATOM 0 HE2 PHE A 129 -14.566 -5.797 -4.031 1.00 0.71 H new ATOM 0 HZ PHE A 129 -16.300 -4.751 -5.434 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.018 0.302 -6.130 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.388 1.292 -7.134 1.00 0.49 C ATOM 2051 C GLU A 130 -10.595 1.063 -8.417 1.00 0.53 C ATOM 2052 O GLU A 130 -11.151 1.100 -9.515 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.145 2.706 -6.591 1.00 0.54 C ATOM 2054 CG GLU A 130 -11.649 3.821 -7.500 1.00 0.99 C ATOM 2055 CD GLU A 130 -10.845 3.959 -8.777 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -9.622 4.203 -8.689 1.00 2.40 O ATOM 2057 OE2 GLU A 130 -11.437 3.824 -9.869 1.00 2.04 O ATOM 0 H GLU A 130 -10.511 0.683 -5.331 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.448 1.187 -7.363 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -11.630 2.798 -5.619 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.076 2.841 -6.428 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -12.692 3.631 -7.754 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -11.620 4.765 -6.956 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.296 0.821 -8.268 1.00 0.48 N ATOM 2065 CA ILE A 131 -8.432 0.579 -9.416 1.00 0.56 C ATOM 2066 C ILE A 131 -8.532 -0.872 -9.878 1.00 0.52 C ATOM 2067 O ILE A 131 -8.117 -1.211 -10.986 1.00 0.64 O ATOM 2068 CB ILE A 131 -6.960 0.913 -9.103 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.434 0.050 -7.950 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -6.820 2.392 -8.773 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -4.964 0.274 -7.663 1.00 1.41 C ATOM 0 H ILE A 131 -8.821 0.788 -7.366 1.00 0.48 H new ATOM 0 HA ILE A 131 -8.776 1.237 -10.214 1.00 0.56 H new ATOM 0 HB ILE A 131 -6.361 0.691 -9.986 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -7.011 0.265 -7.050 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -6.596 -1.001 -8.188 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -5.777 2.619 -8.553 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -7.149 2.988 -9.625 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -7.434 2.631 -7.904 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -4.653 -0.366 -6.837 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -4.379 0.031 -8.550 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -4.801 1.318 -7.395 1.00 1.41 H new ATOM 2083 N ALA A 132 -9.091 -1.723 -9.020 1.00 0.53 N ATOM 2084 CA ALA A 132 -9.252 -3.138 -9.340 1.00 0.58 C ATOM 2085 C ALA A 132 -10.365 -3.770 -8.504 1.00 0.56 C ATOM 2086 O ALA A 132 -10.102 -4.436 -7.502 1.00 0.63 O ATOM 2087 CB ALA A 132 -7.940 -3.879 -9.125 1.00 0.73 C ATOM 0 H ALA A 132 -9.439 -1.457 -8.099 1.00 0.53 H new ATOM 0 HA ALA A 132 -9.535 -3.218 -10.390 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -8.074 -4.933 -9.367 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -7.172 -3.453 -9.770 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -7.634 -3.782 -8.083 1.00 0.73 H new ATOM 2093 N PRO A 133 -11.633 -3.565 -8.907 1.00 0.63 N ATOM 2094 CA PRO A 133 -12.794 -4.105 -8.199 1.00 0.66 C ATOM 2095 C PRO A 133 -13.137 -5.528 -8.635 1.00 0.88 C ATOM 2096 O PRO A 133 -14.266 -5.984 -8.455 1.00 1.24 O ATOM 2097 CB PRO A 133 -13.905 -3.147 -8.617 1.00 0.79 C ATOM 2098 CG PRO A 133 -13.546 -2.752 -10.009 1.00 0.82 C ATOM 2099 CD PRO A 133 -12.039 -2.775 -10.089 1.00 0.81 C ATOM 0 HA PRO A 133 -12.630 -4.172 -7.124 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -14.882 -3.630 -8.580 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -13.952 -2.281 -7.957 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -13.983 -3.441 -10.732 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -13.931 -1.759 -10.242 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -11.695 -3.236 -11.015 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -11.622 -1.768 -10.060 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.163 -6.222 -9.218 1.00 0.90 N ATOM 2108 CA GLU A 134 -12.382 -7.588 -9.687 1.00 1.12 C ATOM 2109 C GLU A 134 -11.277 -8.526 -9.212 1.00 1.08 C ATOM 2110 O GLU A 134 -11.075 -9.597 -9.788 1.00 1.25 O ATOM 2111 CB GLU A 134 -12.466 -7.615 -11.214 1.00 1.34 C ATOM 2112 CG GLU A 134 -13.602 -6.776 -11.777 1.00 1.87 C ATOM 2113 CD GLU A 134 -13.677 -6.834 -13.290 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -12.833 -7.522 -13.901 1.00 2.50 O ATOM 2115 OE2 GLU A 134 -14.578 -6.187 -13.864 1.00 2.61 O ATOM 0 H GLU A 134 -11.221 -5.865 -9.376 1.00 0.90 H new ATOM 0 HA GLU A 134 -13.325 -7.936 -9.266 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -11.523 -7.258 -11.628 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -12.589 -8.646 -11.544 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -14.546 -7.122 -11.357 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -13.474 -5.740 -11.463 1.00 1.87 H new ATOM 2122 N LEU A 135 -10.567 -8.126 -8.162 1.00 0.99 N ATOM 2123 CA LEU A 135 -9.486 -8.940 -7.616 1.00 1.03 C ATOM 2124 C LEU A 135 -9.981 -10.349 -7.284 1.00 1.50 C ATOM 2125 O LEU A 135 -9.661 -11.299 -7.998 1.00 2.32 O ATOM 2126 CB LEU A 135 -8.906 -8.260 -6.374 1.00 1.00 C ATOM 2127 CG LEU A 135 -7.668 -8.923 -5.775 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -6.824 -7.897 -5.037 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -8.060 -10.053 -4.834 1.00 2.26 C ATOM 0 H LEU A 135 -10.720 -7.244 -7.672 1.00 0.99 H new ATOM 0 HA LEU A 135 -8.701 -9.033 -8.366 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -8.657 -7.230 -6.629 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -9.681 -8.220 -5.608 1.00 1.00 H new ATOM 0 HG LEU A 135 -7.080 -9.344 -6.591 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -5.945 -8.384 -4.615 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -6.509 -7.118 -5.731 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -7.412 -7.452 -4.234 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -7.161 -10.510 -4.420 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -8.672 -9.656 -4.024 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -8.628 -10.803 -5.384 1.00 2.26 H new ATOM 2141 N VAL A 136 -10.762 -10.456 -6.200 1.00 1.65 N ATOM 2142 CA VAL A 136 -11.335 -11.726 -5.727 1.00 2.11 C ATOM 2143 C VAL A 136 -10.869 -12.939 -6.531 1.00 1.98 C ATOM 2144 O VAL A 136 -11.325 -13.165 -7.654 1.00 2.82 O ATOM 2145 CB VAL A 136 -12.878 -11.678 -5.750 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -13.388 -11.303 -7.135 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -13.467 -13.007 -5.301 1.00 3.66 C ATOM 0 H VAL A 136 -11.017 -9.656 -5.621 1.00 1.65 H new ATOM 0 HA VAL A 136 -10.974 -11.845 -4.705 1.00 2.11 H new ATOM 0 HB VAL A 136 -13.202 -10.909 -5.049 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -14.478 -11.276 -7.126 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -13.003 -10.322 -7.411 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -13.049 -12.043 -7.860 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -14.555 -12.949 -5.325 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -13.130 -13.799 -5.970 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -13.138 -13.226 -4.285 1.00 3.66 H new ATOM 2157 N PHE A 137 -9.967 -13.727 -5.948 1.00 1.34 N ATOM 2158 CA PHE A 137 -9.455 -14.921 -6.622 1.00 1.66 C ATOM 2159 C PHE A 137 -8.395 -15.652 -5.793 1.00 1.18 C ATOM 2160 O PHE A 137 -8.483 -16.867 -5.611 1.00 1.57 O ATOM 2161 CB PHE A 137 -8.872 -14.551 -7.983 1.00 2.23 C ATOM 2162 CG PHE A 137 -8.973 -15.652 -9.007 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -10.112 -16.439 -9.091 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -7.933 -15.895 -9.888 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -10.209 -17.448 -10.031 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -8.024 -16.901 -10.831 1.00 4.85 C ATOM 2167 CZ PHE A 137 -9.162 -17.678 -10.903 1.00 5.09 C ATOM 0 H PHE A 137 -9.578 -13.563 -5.019 1.00 1.34 H new ATOM 0 HA PHE A 137 -10.299 -15.598 -6.750 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -9.387 -13.668 -8.361 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -7.824 -14.279 -7.857 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -10.934 -16.261 -8.413 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -7.039 -15.291 -9.838 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -11.101 -18.055 -10.084 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -7.205 -17.079 -11.512 1.00 4.85 H new ATOM 0 HZ PHE A 137 -9.234 -18.465 -11.640 1.00 5.09 H new ATOM 2177 N PRO A 138 -7.380 -14.932 -5.270 1.00 0.88 N ATOM 2178 CA PRO A 138 -6.317 -15.533 -4.453 1.00 0.92 C ATOM 2179 C PRO A 138 -6.898 -16.372 -3.330 1.00 1.20 C ATOM 2180 O PRO A 138 -6.676 -17.580 -3.248 1.00 1.94 O ATOM 2181 CB PRO A 138 -5.571 -14.315 -3.881 1.00 1.24 C ATOM 2182 CG PRO A 138 -6.485 -13.163 -4.122 1.00 1.68 C ATOM 2183 CD PRO A 138 -7.182 -13.485 -5.403 1.00 1.44 C ATOM 0 HA PRO A 138 -5.675 -16.202 -5.027 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -5.364 -14.441 -2.818 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -4.611 -14.170 -4.377 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -7.196 -13.045 -3.304 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -5.930 -12.228 -4.199 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -8.126 -12.949 -5.503 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.578 -13.232 -6.274 1.00 1.44 H new ATOM 2191 N ASP A 139 -7.662 -15.709 -2.478 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.316 -16.359 -1.353 1.00 1.62 C ATOM 2193 C ASP A 139 -9.803 -16.539 -1.641 1.00 1.65 C ATOM 2194 O ASP A 139 -10.475 -17.359 -1.015 1.00 2.28 O ATOM 2195 CB ASP A 139 -8.123 -15.539 -0.077 1.00 2.26 C ATOM 2196 CG ASP A 139 -8.741 -16.202 1.138 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -8.326 -17.332 1.471 1.00 3.67 O ATOM 2198 OD2 ASP A 139 -9.637 -15.593 1.756 1.00 3.20 O ATOM 0 H ASP A 139 -7.846 -14.708 -2.546 1.00 1.07 H new ATOM 0 HA ASP A 139 -7.864 -17.340 -1.208 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -7.057 -15.389 0.097 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -8.565 -14.552 -0.213 1.00 2.26 H new ATOM 2203 N GLY A 140 -10.306 -15.766 -2.602 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.707 -15.847 -2.973 1.00 1.72 C ATOM 2205 C GLY A 140 -12.501 -14.634 -2.543 1.00 1.31 C ATOM 2206 O GLY A 140 -13.708 -14.725 -2.317 1.00 1.85 O ATOM 0 H GLY A 140 -9.764 -15.083 -3.131 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -11.785 -15.962 -4.054 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -12.145 -16.739 -2.525 1.00 1.72 H new ATOM 2210 N GLU A 141 -11.827 -13.492 -2.442 1.00 0.75 N ATOM 2211 CA GLU A 141 -12.484 -12.247 -2.050 1.00 0.94 C ATOM 2212 C GLU A 141 -11.733 -11.042 -2.577 1.00 0.82 C ATOM 2213 O GLU A 141 -10.506 -10.980 -2.496 1.00 1.19 O ATOM 2214 CB GLU A 141 -12.581 -12.114 -0.525 1.00 1.56 C ATOM 2215 CG GLU A 141 -13.449 -13.158 0.143 1.00 1.38 C ATOM 2216 CD GLU A 141 -13.779 -12.809 1.582 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -13.324 -11.747 2.056 1.00 2.97 O ATOM 2218 OE2 GLU A 141 -14.493 -13.598 2.234 1.00 2.47 O ATOM 0 H GLU A 141 -10.828 -13.402 -2.626 1.00 0.75 H new ATOM 0 HA GLU A 141 -13.485 -12.281 -2.479 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -11.577 -12.171 -0.104 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -12.973 -11.126 -0.284 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -14.375 -13.270 -0.421 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -12.939 -14.121 0.114 1.00 1.38 H new ATOM 2225 N MET A 142 -12.477 -10.065 -3.079 1.00 0.57 N ATOM 2226 CA MET A 142 -11.873 -8.837 -3.569 1.00 0.54 C ATOM 2227 C MET A 142 -11.183 -8.136 -2.417 1.00 0.58 C ATOM 2228 O MET A 142 -10.950 -8.722 -1.360 1.00 0.92 O ATOM 2229 CB MET A 142 -12.921 -7.898 -4.171 1.00 0.57 C ATOM 2230 CG MET A 142 -13.714 -8.529 -5.286 1.00 0.67 C ATOM 2231 SD MET A 142 -15.084 -7.510 -5.863 1.00 1.32 S ATOM 2232 CE MET A 142 -15.772 -8.556 -7.144 1.00 1.58 C ATOM 0 H MET A 142 -13.493 -10.100 -3.157 1.00 0.57 H new ATOM 0 HA MET A 142 -11.158 -9.094 -4.350 1.00 0.54 H new ATOM 0 HB2 MET A 142 -13.604 -7.576 -3.385 1.00 0.57 H new ATOM 0 HB3 MET A 142 -12.424 -7.004 -4.548 1.00 0.57 H new ATOM 0 HG2 MET A 142 -13.047 -8.735 -6.123 1.00 0.67 H new ATOM 0 HG3 MET A 142 -14.104 -9.488 -4.946 1.00 0.67 H new ATOM 0 HE1 MET A 142 -16.609 -8.045 -7.621 1.00 1.58 H new ATOM 0 HE2 MET A 142 -15.006 -8.771 -7.889 1.00 1.58 H new ATOM 0 HE3 MET A 142 -16.121 -9.490 -6.703 1.00 1.58 H new ATOM 2242 N LEU A 143 -10.890 -6.873 -2.608 1.00 0.55 N ATOM 2243 CA LEU A 143 -10.265 -6.088 -1.570 1.00 0.62 C ATOM 2244 C LEU A 143 -11.301 -5.724 -0.527 1.00 0.56 C ATOM 2245 O LEU A 143 -11.302 -6.210 0.604 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.723 -4.790 -2.155 1.00 0.76 C ATOM 2247 CG LEU A 143 -8.654 -4.905 -3.228 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -7.471 -5.713 -2.721 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -9.217 -5.502 -4.509 1.00 1.70 C ATOM 0 H LEU A 143 -11.074 -6.365 -3.473 1.00 0.55 H new ATOM 0 HA LEU A 143 -9.456 -6.671 -1.130 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -10.561 -4.231 -2.572 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -9.318 -4.194 -1.337 1.00 0.76 H new ATOM 0 HG LEU A 143 -8.304 -3.900 -3.463 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -6.716 -5.784 -3.504 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -7.042 -5.222 -1.848 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -7.805 -6.714 -2.447 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -8.427 -5.571 -5.256 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -9.610 -6.498 -4.304 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -10.018 -4.866 -4.885 1.00 1.70 H new ATOM 2261 N ARG A 144 -12.165 -4.833 -0.956 1.00 0.53 N ATOM 2262 CA ARG A 144 -13.235 -4.295 -0.155 1.00 0.52 C ATOM 2263 C ARG A 144 -14.138 -5.361 0.463 1.00 0.61 C ATOM 2264 O ARG A 144 -14.807 -5.085 1.446 1.00 0.69 O ATOM 2265 CB ARG A 144 -14.023 -3.299 -0.994 1.00 0.53 C ATOM 2266 CG ARG A 144 -15.216 -2.701 -0.272 1.00 0.58 C ATOM 2267 CD ARG A 144 -16.004 -1.756 -1.166 1.00 0.85 C ATOM 2268 NE ARG A 144 -16.646 -2.452 -2.276 1.00 1.18 N ATOM 2269 CZ ARG A 144 -17.405 -1.846 -3.185 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -17.598 -0.536 -3.122 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -17.970 -2.548 -4.157 1.00 2.16 N ATOM 0 H ARG A 144 -12.140 -4.452 -1.902 1.00 0.53 H new ATOM 0 HA ARG A 144 -12.789 -3.787 0.700 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -13.358 -2.494 -1.306 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.370 -3.795 -1.900 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -15.869 -3.502 0.075 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -14.873 -2.163 0.612 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -16.762 -1.245 -0.573 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -15.336 -0.989 -1.558 1.00 0.85 H new ATOM 0 HE ARG A 144 -16.505 -3.459 -2.360 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -17.164 0.008 -2.376 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -18.180 -0.072 -3.819 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -17.823 -3.556 -4.210 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -18.551 -2.080 -4.852 1.00 2.16 H new ATOM 2285 N GLN A 145 -14.166 -6.574 -0.077 1.00 0.76 N ATOM 2286 CA GLN A 145 -15.005 -7.614 0.521 1.00 0.92 C ATOM 2287 C GLN A 145 -14.538 -7.865 1.936 1.00 0.89 C ATOM 2288 O GLN A 145 -15.324 -7.896 2.881 1.00 0.97 O ATOM 2289 CB GLN A 145 -14.912 -8.932 -0.242 1.00 1.21 C ATOM 2290 CG GLN A 145 -14.776 -8.750 -1.725 1.00 0.96 C ATOM 2291 CD GLN A 145 -15.963 -8.049 -2.332 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -17.046 -8.622 -2.463 1.00 2.27 O ATOM 2293 NE2 GLN A 145 -15.773 -6.790 -2.677 1.00 1.87 N ATOM 0 H GLN A 145 -13.637 -6.860 -0.901 1.00 0.76 H new ATOM 0 HA GLN A 145 -16.037 -7.264 0.491 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -14.057 -9.498 0.128 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -15.802 -9.527 -0.036 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -13.873 -8.177 -1.936 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -14.653 -9.725 -2.198 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -14.857 -6.359 -2.549 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -16.542 -6.248 -3.071 1.00 1.87 H new ATOM 2302 N ILE A 146 -13.234 -8.061 2.055 1.00 0.85 N ATOM 2303 CA ILE A 146 -12.606 -8.337 3.323 1.00 0.90 C ATOM 2304 C ILE A 146 -12.666 -7.134 4.267 1.00 0.85 C ATOM 2305 O ILE A 146 -12.694 -7.304 5.481 1.00 1.01 O ATOM 2306 CB ILE A 146 -11.136 -8.731 3.102 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -10.966 -9.399 1.736 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -10.677 -9.672 4.201 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -9.524 -9.632 1.362 1.00 1.06 C ATOM 0 H ILE A 146 -12.586 -8.032 1.268 1.00 0.85 H new ATOM 0 HA ILE A 146 -13.154 -9.158 3.786 1.00 0.90 H new ATOM 0 HB ILE A 146 -10.525 -7.829 3.130 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -11.493 -10.353 1.738 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -11.436 -8.777 0.974 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -9.635 -9.945 4.035 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -10.773 -9.177 5.167 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -11.293 -10.571 4.191 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -9.474 -10.108 0.383 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -8.998 -8.678 1.328 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -9.056 -10.279 2.104 1.00 1.06 H new ATOM 2321 N LEU A 147 -12.668 -5.917 3.715 1.00 0.72 N ATOM 2322 CA LEU A 147 -12.704 -4.715 4.558 1.00 0.75 C ATOM 2323 C LEU A 147 -14.131 -4.295 4.900 1.00 0.71 C ATOM 2324 O LEU A 147 -14.405 -3.833 6.005 1.00 0.81 O ATOM 2325 CB LEU A 147 -11.982 -3.554 3.866 1.00 0.92 C ATOM 2326 CG LEU A 147 -12.772 -2.850 2.758 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -13.742 -1.832 3.326 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -11.843 -2.158 1.800 1.00 1.66 C ATOM 0 H LEU A 147 -12.646 -5.738 2.711 1.00 0.72 H new ATOM 0 HA LEU A 147 -12.194 -4.964 5.489 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -11.713 -2.815 4.621 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -11.051 -3.930 3.441 1.00 0.92 H new ATOM 0 HG LEU A 147 -13.337 -3.619 2.231 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -14.285 -1.353 2.511 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -14.449 -2.333 3.988 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -13.191 -1.078 3.888 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -12.425 -1.665 1.021 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -11.253 -1.416 2.337 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -11.177 -2.891 1.346 1.00 1.66 H new ATOM 2340 N HIS A 148 -15.028 -4.425 3.935 1.00 0.71 N ATOM 2341 CA HIS A 148 -16.420 -4.033 4.118 1.00 0.76 C ATOM 2342 C HIS A 148 -17.098 -4.952 5.117 1.00 0.83 C ATOM 2343 O HIS A 148 -18.132 -4.617 5.694 1.00 0.92 O ATOM 2344 CB HIS A 148 -17.155 -4.081 2.775 1.00 0.79 C ATOM 2345 CG HIS A 148 -18.538 -3.495 2.790 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -19.382 -3.543 1.700 1.00 1.04 N ATOM 2347 CD2 HIS A 148 -19.221 -2.836 3.759 1.00 1.02 C ATOM 2348 CE1 HIS A 148 -20.520 -2.942 1.997 1.00 1.20 C ATOM 2349 NE2 HIS A 148 -20.449 -2.506 3.241 1.00 1.19 N ATOM 0 H HIS A 148 -14.817 -4.801 3.011 1.00 0.71 H new ATOM 0 HA HIS A 148 -16.452 -3.014 4.505 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -16.559 -3.550 2.032 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -17.220 -5.119 2.449 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -18.865 -2.612 4.754 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -21.365 -2.827 1.335 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -21.187 -2.005 3.737 1.00 1.19 H new ATOM 2358 N THR A 149 -16.513 -6.123 5.306 1.00 0.86 N ATOM 2359 CA THR A 149 -17.069 -7.102 6.216 1.00 0.97 C ATOM 2360 C THR A 149 -16.227 -7.251 7.486 1.00 1.00 C ATOM 2361 O THR A 149 -16.731 -7.723 8.505 1.00 1.13 O ATOM 2362 CB THR A 149 -17.194 -8.444 5.496 1.00 1.02 C ATOM 2363 OG1 THR A 149 -15.914 -8.967 5.197 1.00 1.35 O ATOM 2364 CG2 THR A 149 -17.962 -8.351 4.189 1.00 1.48 C ATOM 0 H THR A 149 -15.654 -6.416 4.840 1.00 0.86 H new ATOM 0 HA THR A 149 -18.054 -6.756 6.528 1.00 0.97 H new ATOM 0 HB THR A 149 -17.741 -9.093 6.180 1.00 1.02 H new ATOM 0 HG1 THR A 149 -15.476 -8.399 4.529 1.00 1.35 H new ATOM 0 HG21 THR A 149 -18.015 -9.337 3.727 1.00 1.48 H new ATOM 0 HG22 THR A 149 -18.971 -7.987 4.385 1.00 1.48 H new ATOM 0 HG23 THR A 149 -17.452 -7.662 3.516 1.00 1.48 H new ATOM 2372 N ARG A 150 -14.947 -6.867 7.433 1.00 0.91 N ATOM 2373 CA ARG A 150 -14.086 -7.000 8.614 1.00 0.97 C ATOM 2374 C ARG A 150 -13.594 -5.665 9.187 1.00 0.97 C ATOM 2375 O ARG A 150 -13.028 -5.648 10.282 1.00 1.16 O ATOM 2376 CB ARG A 150 -12.883 -7.900 8.326 1.00 1.01 C ATOM 2377 CG ARG A 150 -13.169 -9.389 8.473 1.00 1.12 C ATOM 2378 CD ARG A 150 -14.021 -9.931 7.335 1.00 1.43 C ATOM 2379 NE ARG A 150 -14.328 -11.349 7.525 1.00 1.84 N ATOM 2380 CZ ARG A 150 -14.944 -12.106 6.620 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -15.272 -11.604 5.438 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -15.217 -13.373 6.892 1.00 2.86 N ATOM 0 H ARG A 150 -14.493 -6.472 6.609 1.00 0.91 H new ATOM 0 HA ARG A 150 -14.723 -7.456 9.372 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -12.533 -7.707 7.312 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -12.071 -7.629 9.000 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -12.227 -9.935 8.510 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -13.678 -9.567 9.421 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -14.948 -9.362 7.270 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -13.497 -9.794 6.389 1.00 1.43 H new ATOM 0 HE ARG A 150 -14.053 -11.784 8.405 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -15.052 -10.633 5.218 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -15.744 -12.189 4.749 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -14.955 -13.769 7.795 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -15.689 -13.953 6.199 1.00 2.86 H new ATOM 2396 N ALA A 151 -13.780 -4.552 8.476 1.00 0.88 N ATOM 2397 CA ALA A 151 -13.309 -3.273 8.984 1.00 0.91 C ATOM 2398 C ALA A 151 -14.375 -2.198 8.862 1.00 0.92 C ATOM 2399 O ALA A 151 -15.166 -1.987 9.780 1.00 1.18 O ATOM 2400 CB ALA A 151 -12.041 -2.850 8.257 1.00 0.89 C ATOM 0 H ALA A 151 -14.243 -4.513 7.568 1.00 0.88 H new ATOM 0 HA ALA A 151 -13.084 -3.397 10.043 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -11.700 -1.891 8.648 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -11.266 -3.601 8.411 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -12.247 -2.755 7.191 1.00 0.89 H new ATOM 2406 N PHE A 152 -14.379 -1.507 7.730 1.00 0.79 N ATOM 2407 CA PHE A 152 -15.332 -0.441 7.500 1.00 0.99 C ATOM 2408 C PHE A 152 -16.281 -0.773 6.351 1.00 0.88 C ATOM 2409 O PHE A 152 -16.670 -1.925 6.171 1.00 1.32 O ATOM 2410 CB PHE A 152 -14.587 0.852 7.203 1.00 1.26 C ATOM 2411 CG PHE A 152 -13.929 1.477 8.405 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -13.048 0.750 9.193 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -14.190 2.796 8.743 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -12.443 1.327 10.294 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -13.587 3.378 9.843 1.00 3.27 C ATOM 2416 CZ PHE A 152 -12.714 2.641 10.619 1.00 3.92 C ATOM 0 H PHE A 152 -13.731 -1.669 6.959 1.00 0.79 H new ATOM 0 HA PHE A 152 -15.933 -0.322 8.401 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -13.826 0.654 6.448 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -15.285 1.569 6.771 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -12.832 -0.278 8.943 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -14.873 3.376 8.140 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -11.759 0.750 10.899 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -13.798 4.407 10.095 1.00 3.27 H new ATOM 0 HZ PHE A 152 -12.243 3.093 11.480 1.00 3.92 H new ATOM 2426 N ASP A 153 -16.653 0.249 5.582 1.00 0.92 N ATOM 2427 CA ASP A 153 -17.554 0.071 4.451 1.00 1.10 C ATOM 2428 C ASP A 153 -17.033 0.809 3.221 1.00 1.14 C ATOM 2429 O ASP A 153 -16.909 0.226 2.144 1.00 1.88 O ATOM 2430 CB ASP A 153 -18.956 0.578 4.802 1.00 1.43 C ATOM 2431 CG ASP A 153 -19.560 -0.152 5.986 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -18.980 -0.079 7.089 1.00 2.80 O ATOM 2433 OD2 ASP A 153 -20.617 -0.795 5.810 1.00 2.58 O ATOM 0 H ASP A 153 -16.342 1.210 5.724 1.00 0.92 H new ATOM 0 HA ASP A 153 -17.605 -0.994 4.224 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -18.908 1.644 5.023 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -19.608 0.461 3.936 1.00 1.43 H new ATOM 2438 N LYS A 154 -16.732 2.094 3.393 1.00 0.75 N ATOM 2439 CA LYS A 154 -16.227 2.918 2.298 1.00 0.78 C ATOM 2440 C LYS A 154 -15.774 4.284 2.811 1.00 0.91 C ATOM 2441 O LYS A 154 -16.592 5.105 3.225 1.00 1.80 O ATOM 2442 CB LYS A 154 -17.316 3.073 1.224 1.00 0.89 C ATOM 2443 CG LYS A 154 -16.874 3.833 -0.020 1.00 0.86 C ATOM 2444 CD LYS A 154 -16.955 5.344 0.158 1.00 1.03 C ATOM 2445 CE LYS A 154 -18.393 5.838 0.236 1.00 1.54 C ATOM 2446 NZ LYS A 154 -19.090 5.368 1.466 1.00 2.17 N ATOM 0 H LYS A 154 -16.829 2.587 4.281 1.00 0.75 H new ATOM 0 HA LYS A 154 -15.361 2.426 1.856 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -17.658 2.082 0.926 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -18.171 3.587 1.663 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.850 3.554 -0.267 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -17.497 3.536 -0.863 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -16.425 5.630 1.066 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -16.449 5.834 -0.674 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -18.402 6.928 0.211 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -18.940 5.495 -0.642 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -19.851 6.034 1.710 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -19.496 4.426 1.296 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -18.410 5.316 2.252 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.462 4.519 2.781 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.898 5.784 3.243 1.00 0.61 C ATOM 2462 C LEU A 155 -14.011 6.853 2.156 1.00 0.68 C ATOM 2463 O LEU A 155 -14.457 6.572 1.047 1.00 0.89 O ATOM 2464 CB LEU A 155 -12.436 5.596 3.659 1.00 0.60 C ATOM 2465 CG LEU A 155 -12.200 4.575 4.780 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.749 4.607 5.228 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -13.125 4.844 5.958 1.00 1.23 C ATOM 0 H LEU A 155 -13.772 3.849 2.442 1.00 0.61 H new ATOM 0 HA LEU A 155 -14.466 6.117 4.112 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.863 5.289 2.784 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -12.039 6.560 3.978 1.00 0.60 H new ATOM 0 HG LEU A 155 -12.423 3.582 4.390 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -10.598 3.877 6.023 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -10.102 4.364 4.385 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -10.504 5.603 5.598 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -12.940 4.108 6.741 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -12.936 5.844 6.348 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -14.162 4.772 5.630 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.615 8.083 2.481 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.693 9.182 1.524 1.00 0.77 C ATOM 2481 C ASN A 156 -12.323 9.516 0.949 1.00 0.65 C ATOM 2482 O ASN A 156 -11.323 9.521 1.667 1.00 0.69 O ATOM 2483 CB ASN A 156 -14.291 10.424 2.191 1.00 1.04 C ATOM 2484 CG ASN A 156 -15.707 10.208 2.700 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -16.301 11.103 3.300 1.00 2.44 O ATOM 2486 ND2 ASN A 156 -16.263 9.023 2.459 1.00 2.12 N ATOM 0 H ASN A 156 -13.240 8.341 3.394 1.00 0.66 H new ATOM 0 HA ASN A 156 -14.338 8.864 0.705 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -13.654 10.723 3.024 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -14.290 11.248 1.477 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -17.214 8.832 2.775 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -15.738 8.306 1.958 1.00 2.12 H new ATOM 2493 N LYS A 157 -12.287 9.807 -0.350 1.00 0.64 N ATOM 2494 CA LYS A 157 -11.042 10.155 -1.022 1.00 0.64 C ATOM 2495 C LYS A 157 -10.504 11.476 -0.489 1.00 0.68 C ATOM 2496 O LYS A 157 -10.796 12.541 -1.036 1.00 0.95 O ATOM 2497 CB LYS A 157 -11.259 10.249 -2.531 1.00 0.79 C ATOM 2498 CG LYS A 157 -11.720 8.947 -3.157 1.00 0.96 C ATOM 2499 CD LYS A 157 -12.079 9.124 -4.622 1.00 1.67 C ATOM 2500 CE LYS A 157 -12.546 7.814 -5.239 1.00 1.70 C ATOM 2501 NZ LYS A 157 -12.961 7.988 -6.659 1.00 2.51 N ATOM 0 H LYS A 157 -13.107 9.808 -0.956 1.00 0.64 H new ATOM 0 HA LYS A 157 -10.312 9.371 -0.821 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -11.998 11.024 -2.736 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -10.329 10.562 -3.005 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -10.932 8.199 -3.063 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -12.586 8.568 -2.613 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -12.864 9.874 -4.718 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -11.213 9.497 -5.168 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -11.743 7.079 -5.182 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -13.382 7.418 -4.662 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -13.273 7.074 -7.044 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -13.744 8.670 -6.711 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -12.156 8.342 -7.215 1.00 2.51 H new ATOM 2515 N TRP A 158 -9.720 11.392 0.582 1.00 0.73 N ATOM 2516 CA TRP A 158 -9.133 12.570 1.215 1.00 0.83 C ATOM 2517 C TRP A 158 -10.136 13.725 1.252 1.00 1.08 C ATOM 2518 O TRP A 158 -9.852 14.782 0.651 1.00 1.47 O ATOM 2519 CB TRP A 158 -7.858 12.989 0.475 1.00 0.85 C ATOM 2520 CG TRP A 158 -7.099 14.093 1.154 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -6.712 14.139 2.463 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -6.642 15.311 0.556 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -6.037 15.310 2.714 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -5.982 16.047 1.558 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -6.724 15.850 -0.731 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -5.410 17.292 1.314 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -6.155 17.087 -0.972 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -5.506 17.795 0.045 1.00 2.95 C ATOM 2529 OXT TRP A 158 -11.203 13.556 1.878 1.00 1.75 O ATOM 0 H TRP A 158 -9.474 10.511 1.034 1.00 0.73 H new ATOM 0 HA TRP A 158 -8.873 12.315 2.242 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -7.206 12.121 0.373 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -8.122 13.309 -0.533 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -6.908 13.368 3.194 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -5.642 15.586 3.613 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -7.223 15.310 -1.523 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -4.909 17.841 2.097 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -6.213 17.514 -1.962 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -5.072 18.759 -0.176 1.00 2.95 H new TER 2540 TRP A 158