USER MOD reduce.3.24.130724 H: found=0, std=0, add=614, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 612 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 66 TYR OH : rot 87:sc= -4.56! USER MOD Set 1.2: A 68 SER OG : rot 86:sc= 1.36 USER MOD Single : A 1 MET CE :methyl -158:sc= -0.151 (180deg=-0.78) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.0397 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HE2:sc= 0.497 K(o=0.5,f=-1.7!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 147:sc= -0.24 (180deg=-1.15!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.022 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -3.48! C(o=-3.5!,f=-6.4!) USER MOD Single : A 31 ASN : amide:sc= -0.364 X(o=-0.36,f=-0.52) USER MOD Single : A 33 ASN : amide:sc= -0.0849 K(o=-0.085,f=-0.89) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot -88:sc= 1.2 USER MOD Single : A 38 SER OG : rot 180:sc=-0.00966 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0.0257 X(o=0.026,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 TYR OH : rot 180:sc= -1.03 USER MOD Single : A 67 SER OG : rot 68:sc= 0.75 USER MOD Single : A 71 SER OG : rot -44:sc= 1.2 USER MOD Single : A 77 ASN : amide:sc= -2.44 K(o=-2.4,f=-5!) USER MOD Single : A 78 SER OG : rot 180:sc= -0.723 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -6.84! C(o=-6.8!,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.653 10.759 -4.839 1.00 42.31 N ATOM 2 CA MET A 1 -2.628 10.008 -5.620 1.00 71.43 C ATOM 3 C MET A 1 -2.247 8.532 -5.692 1.00 1.43 C ATOM 4 O MET A 1 -1.067 8.185 -5.674 1.00 42.43 O ATOM 5 CB MET A 1 -2.738 10.587 -7.032 1.00 71.10 C ATOM 6 CG MET A 1 -3.861 9.975 -7.854 1.00 43.02 C ATOM 7 SD MET A 1 -4.090 10.801 -9.440 1.00 41.34 S ATOM 8 CE MET A 1 -4.602 12.431 -8.902 1.00 44.22 C ATOM 0 H1 MET A 1 -2.072 11.027 -3.926 1.00 42.31 H new ATOM 0 H2 MET A 1 -0.812 10.170 -4.675 1.00 42.31 H new ATOM 0 H3 MET A 1 -1.378 11.617 -5.359 1.00 42.31 H new ATOM 0 HA MET A 1 -3.595 10.092 -5.124 1.00 71.43 H new ATOM 0 HB2 MET A 1 -2.894 11.664 -6.963 1.00 71.10 H new ATOM 0 HB3 MET A 1 -1.793 10.435 -7.553 1.00 71.10 H new ATOM 0 HG2 MET A 1 -3.647 8.920 -8.026 1.00 43.02 H new ATOM 0 HG3 MET A 1 -4.790 10.024 -7.286 1.00 43.02 H new ATOM 0 HE1 MET A 1 -5.145 12.926 -9.707 1.00 44.22 H new ATOM 0 HE2 MET A 1 -5.250 12.340 -8.030 1.00 44.22 H new ATOM 0 HE3 MET A 1 -3.723 13.021 -8.641 1.00 44.22 H new ATOM 18 N ASN A 2 -3.254 7.669 -5.772 1.00 21.32 N ATOM 19 CA ASN A 2 -3.023 6.230 -5.845 1.00 13.51 C ATOM 20 C ASN A 2 -3.145 5.732 -7.282 1.00 14.33 C ATOM 21 O ASN A 2 -4.184 5.897 -7.920 1.00 74.23 O ATOM 22 CB ASN A 2 -4.017 5.487 -4.949 1.00 41.55 C ATOM 23 CG ASN A 2 -3.402 5.065 -3.629 1.00 44.03 C ATOM 24 OD1 ASN A 2 -2.617 5.803 -3.033 1.00 64.23 O ATOM 25 ND2 ASN A 2 -3.756 3.872 -3.166 1.00 72.04 N ATOM 0 H ASN A 2 -4.237 7.940 -5.788 1.00 21.32 H new ATOM 0 HA ASN A 2 -2.010 6.031 -5.495 1.00 13.51 H new ATOM 0 HB2 ASN A 2 -4.878 6.127 -4.757 1.00 41.55 H new ATOM 0 HB3 ASN A 2 -4.386 4.605 -5.473 1.00 41.55 H new ATOM 0 HD21 ASN A 2 -3.374 3.534 -2.283 1.00 72.04 H new ATOM 0 HD22 ASN A 2 -4.410 3.294 -3.694 1.00 72.04 H new ATOM 32 N ALA A 3 -2.077 5.122 -7.784 1.00 3.25 N ATOM 33 CA ALA A 3 -2.065 4.598 -9.143 1.00 63.54 C ATOM 34 C ALA A 3 -2.122 3.074 -9.144 1.00 65.34 C ATOM 35 O ALA A 3 -1.354 2.415 -9.846 1.00 12.04 O ATOM 36 CB ALA A 3 -0.828 5.082 -9.885 1.00 63.01 C ATOM 0 H ALA A 3 -1.208 4.979 -7.269 1.00 3.25 H new ATOM 0 HA ALA A 3 -2.952 4.969 -9.657 1.00 63.54 H new ATOM 0 HB1 ALA A 3 -0.832 4.683 -10.899 1.00 63.01 H new ATOM 0 HB2 ALA A 3 -0.830 6.171 -9.924 1.00 63.01 H new ATOM 0 HB3 ALA A 3 0.066 4.739 -9.364 1.00 63.01 H new ATOM 42 N ALA A 4 -3.035 2.520 -8.354 1.00 21.32 N ATOM 43 CA ALA A 4 -3.192 1.073 -8.265 1.00 13.31 C ATOM 44 C ALA A 4 -4.636 0.696 -7.950 1.00 1.50 C ATOM 45 O ALA A 4 -4.891 -0.192 -7.138 1.00 15.11 O ATOM 46 CB ALA A 4 -2.254 0.504 -7.211 1.00 12.22 C ATOM 0 H ALA A 4 -3.678 3.051 -7.766 1.00 21.32 H new ATOM 0 HA ALA A 4 -2.935 0.644 -9.234 1.00 13.31 H new ATOM 0 HB1 ALA A 4 -2.382 -0.577 -7.155 1.00 12.22 H new ATOM 0 HB2 ALA A 4 -1.223 0.734 -7.479 1.00 12.22 H new ATOM 0 HB3 ALA A 4 -2.484 0.947 -6.242 1.00 12.22 H new ATOM 52 N GLU A 5 -5.576 1.378 -8.598 1.00 5.44 N ATOM 53 CA GLU A 5 -6.994 1.115 -8.384 1.00 63.11 C ATOM 54 C GLU A 5 -7.788 1.337 -9.668 1.00 63.12 C ATOM 55 O GLU A 5 -7.597 2.334 -10.365 1.00 14.25 O ATOM 56 CB GLU A 5 -7.540 2.012 -7.272 1.00 12.51 C ATOM 57 CG GLU A 5 -6.716 1.972 -5.996 1.00 65.24 C ATOM 58 CD GLU A 5 -7.244 2.911 -4.930 1.00 2.41 C ATOM 59 OE1 GLU A 5 -7.115 4.141 -5.105 1.00 22.00 O ATOM 60 OE2 GLU A 5 -7.787 2.416 -3.920 1.00 4.30 O ATOM 0 H GLU A 5 -5.381 2.116 -9.275 1.00 5.44 H new ATOM 0 HA GLU A 5 -7.103 0.072 -8.085 1.00 63.11 H new ATOM 0 HB2 GLU A 5 -7.583 3.039 -7.634 1.00 12.51 H new ATOM 0 HB3 GLU A 5 -8.562 1.711 -7.044 1.00 12.51 H new ATOM 0 HG2 GLU A 5 -6.707 0.954 -5.606 1.00 65.24 H new ATOM 0 HG3 GLU A 5 -5.683 2.234 -6.227 1.00 65.24 H new ATOM 67 N VAL A 6 -8.679 0.399 -9.976 1.00 5.52 N ATOM 68 CA VAL A 6 -9.502 0.492 -11.175 1.00 73.23 C ATOM 69 C VAL A 6 -10.943 0.086 -10.885 1.00 61.12 C ATOM 70 O VAL A 6 -11.265 -1.101 -10.830 1.00 24.41 O ATOM 71 CB VAL A 6 -8.948 -0.395 -12.306 1.00 74.22 C ATOM 72 CG1 VAL A 6 -9.946 -0.486 -13.451 1.00 20.22 C ATOM 73 CG2 VAL A 6 -7.611 0.139 -12.795 1.00 43.21 C ATOM 0 H VAL A 6 -8.849 -0.433 -9.411 1.00 5.52 H new ATOM 0 HA VAL A 6 -9.478 1.534 -11.495 1.00 73.23 H new ATOM 0 HB VAL A 6 -8.790 -1.399 -11.912 1.00 74.22 H new ATOM 0 HG11 VAL A 6 -9.537 -1.117 -14.241 1.00 20.22 H new ATOM 0 HG12 VAL A 6 -10.878 -0.918 -13.088 1.00 20.22 H new ATOM 0 HG13 VAL A 6 -10.138 0.511 -13.846 1.00 20.22 H new ATOM 0 HG21 VAL A 6 -7.234 -0.500 -13.594 1.00 43.21 H new ATOM 0 HG22 VAL A 6 -7.740 1.154 -13.172 1.00 43.21 H new ATOM 0 HG23 VAL A 6 -6.899 0.147 -11.970 1.00 43.21 H new ATOM 83 N ILE A 7 -11.806 1.079 -10.701 1.00 41.21 N ATOM 84 CA ILE A 7 -13.213 0.825 -10.418 1.00 51.33 C ATOM 85 C ILE A 7 -14.091 1.217 -11.602 1.00 11.00 C ATOM 86 O ILE A 7 -14.272 2.400 -11.890 1.00 43.22 O ATOM 87 CB ILE A 7 -13.684 1.593 -9.169 1.00 25.44 C ATOM 88 CG1 ILE A 7 -15.197 1.450 -8.995 1.00 60.32 C ATOM 89 CG2 ILE A 7 -13.293 3.059 -9.269 1.00 44.53 C ATOM 90 CD1 ILE A 7 -15.650 1.527 -7.554 1.00 71.01 C ATOM 0 H ILE A 7 -11.556 2.067 -10.743 1.00 41.21 H new ATOM 0 HA ILE A 7 -13.310 -0.245 -10.235 1.00 51.33 H new ATOM 0 HB ILE A 7 -13.195 1.166 -8.293 1.00 25.44 H new ATOM 0 HG12 ILE A 7 -15.696 2.233 -9.566 1.00 60.32 H new ATOM 0 HG13 ILE A 7 -15.514 0.496 -9.417 1.00 60.32 H new ATOM 0 HG21 ILE A 7 -13.633 3.588 -8.379 1.00 44.53 H new ATOM 0 HG22 ILE A 7 -12.209 3.142 -9.348 1.00 44.53 H new ATOM 0 HG23 ILE A 7 -13.756 3.500 -10.152 1.00 44.53 H new ATOM 0 HD11 ILE A 7 -16.734 1.418 -7.507 1.00 71.01 H new ATOM 0 HD12 ILE A 7 -15.180 0.728 -6.982 1.00 71.01 H new ATOM 0 HD13 ILE A 7 -15.364 2.491 -7.134 1.00 71.01 H new ATOM 102 N VAL A 8 -14.637 0.215 -12.284 1.00 42.12 N ATOM 103 CA VAL A 8 -15.499 0.454 -13.435 1.00 51.23 C ATOM 104 C VAL A 8 -16.777 -0.373 -13.346 1.00 1.51 C ATOM 105 O VAL A 8 -16.831 -1.376 -12.635 1.00 20.04 O ATOM 106 CB VAL A 8 -14.778 0.123 -14.755 1.00 42.13 C ATOM 107 CG1 VAL A 8 -13.468 0.890 -14.855 1.00 23.51 C ATOM 108 CG2 VAL A 8 -14.539 -1.375 -14.870 1.00 43.21 C ATOM 0 H VAL A 8 -14.497 -0.770 -12.059 1.00 42.12 H new ATOM 0 HA VAL A 8 -15.754 1.514 -13.424 1.00 51.23 H new ATOM 0 HB VAL A 8 -15.415 0.431 -15.584 1.00 42.13 H new ATOM 0 HG11 VAL A 8 -12.973 0.643 -15.794 1.00 23.51 H new ATOM 0 HG12 VAL A 8 -13.670 1.961 -14.821 1.00 23.51 H new ATOM 0 HG13 VAL A 8 -12.822 0.616 -14.021 1.00 23.51 H new ATOM 0 HG21 VAL A 8 -14.029 -1.591 -15.809 1.00 43.21 H new ATOM 0 HG22 VAL A 8 -13.922 -1.710 -14.036 1.00 43.21 H new ATOM 0 HG23 VAL A 8 -15.495 -1.899 -14.848 1.00 43.21 H new ATOM 118 N TYR A 9 -17.803 0.055 -14.072 1.00 54.23 N ATOM 119 CA TYR A 9 -19.083 -0.644 -14.074 1.00 23.41 C ATOM 120 C TYR A 9 -19.421 -1.158 -15.470 1.00 62.40 C ATOM 121 O TYR A 9 -19.128 -0.505 -16.471 1.00 32.21 O ATOM 122 CB TYR A 9 -20.194 0.281 -13.576 1.00 34.31 C ATOM 123 CG TYR A 9 -20.236 0.421 -12.071 1.00 54.30 C ATOM 124 CD1 TYR A 9 -19.124 0.861 -11.364 1.00 13.43 C ATOM 125 CD2 TYR A 9 -21.387 0.113 -11.356 1.00 53.14 C ATOM 126 CE1 TYR A 9 -19.158 0.991 -9.989 1.00 24.24 C ATOM 127 CE2 TYR A 9 -21.430 0.241 -9.982 1.00 32.14 C ATOM 128 CZ TYR A 9 -20.313 0.680 -9.302 1.00 61.23 C ATOM 129 OH TYR A 9 -20.351 0.807 -7.933 1.00 11.14 O ATOM 0 H TYR A 9 -17.774 0.883 -14.667 1.00 54.23 H new ATOM 0 HA TYR A 9 -19.002 -1.498 -13.402 1.00 23.41 H new ATOM 0 HB2 TYR A 9 -20.061 1.267 -14.021 1.00 34.31 H new ATOM 0 HB3 TYR A 9 -21.155 -0.099 -13.924 1.00 34.31 H new ATOM 0 HD1 TYR A 9 -18.218 1.106 -11.898 1.00 13.43 H new ATOM 0 HD2 TYR A 9 -22.263 -0.233 -11.884 1.00 53.14 H new ATOM 0 HE1 TYR A 9 -18.285 1.334 -9.455 1.00 24.24 H new ATOM 0 HE2 TYR A 9 -22.334 -0.001 -9.442 1.00 32.14 H new ATOM 0 HH TYR A 9 -21.238 0.549 -7.605 1.00 11.14 H new ATOM 139 N GLU A 10 -20.040 -2.334 -15.527 1.00 44.31 N ATOM 140 CA GLU A 10 -20.418 -2.936 -16.800 1.00 63.11 C ATOM 141 C GLU A 10 -21.867 -2.609 -17.148 1.00 10.52 C ATOM 142 O GLU A 10 -22.542 -3.378 -17.832 1.00 51.04 O ATOM 143 CB GLU A 10 -20.224 -4.453 -16.749 1.00 72.02 C ATOM 144 CG GLU A 10 -19.409 -5.002 -17.908 1.00 2.20 C ATOM 145 CD GLU A 10 -19.860 -4.456 -19.249 1.00 30.21 C ATOM 146 OE1 GLU A 10 -21.043 -4.649 -19.599 1.00 72.14 O ATOM 147 OE2 GLU A 10 -19.031 -3.837 -19.948 1.00 2.04 O ATOM 0 H GLU A 10 -20.290 -2.887 -14.707 1.00 44.31 H new ATOM 0 HA GLU A 10 -19.774 -2.520 -17.575 1.00 63.11 H new ATOM 0 HB2 GLU A 10 -19.732 -4.717 -15.813 1.00 72.02 H new ATOM 0 HB3 GLU A 10 -21.201 -4.936 -16.742 1.00 72.02 H new ATOM 0 HG2 GLU A 10 -18.358 -4.758 -17.756 1.00 2.20 H new ATOM 0 HG3 GLU A 10 -19.486 -6.089 -17.918 1.00 2.20 H new ATOM 154 N HIS A 11 -22.339 -1.461 -16.670 1.00 72.34 N ATOM 155 CA HIS A 11 -23.708 -1.031 -16.930 1.00 55.02 C ATOM 156 C HIS A 11 -23.947 0.377 -16.393 1.00 45.22 C ATOM 157 O HIS A 11 -23.034 1.015 -15.867 1.00 70.35 O ATOM 158 CB HIS A 11 -24.701 -2.006 -16.296 1.00 1.21 C ATOM 159 CG HIS A 11 -25.693 -2.567 -17.267 1.00 61.43 C ATOM 160 ND1 HIS A 11 -25.352 -3.465 -18.257 1.00 42.32 N ATOM 161 CD2 HIS A 11 -27.024 -2.356 -17.396 1.00 4.32 C ATOM 162 CE1 HIS A 11 -26.429 -3.779 -18.954 1.00 34.33 C ATOM 163 NE2 HIS A 11 -27.458 -3.120 -18.451 1.00 24.01 N ATOM 0 H HIS A 11 -21.794 -0.813 -16.101 1.00 72.34 H new ATOM 0 HA HIS A 11 -23.860 -1.020 -18.009 1.00 55.02 H new ATOM 0 HB2 HIS A 11 -24.149 -2.827 -15.838 1.00 1.21 H new ATOM 0 HB3 HIS A 11 -25.237 -1.496 -15.495 1.00 1.21 H new ATOM 0 HD1 HIS A 11 -24.414 -3.830 -18.425 1.00 42.32 H new ATOM 0 HD2 HIS A 11 -27.632 -1.707 -16.783 1.00 4.32 H new ATOM 0 HE1 HIS A 11 -26.463 -4.459 -19.793 1.00 34.33 H new ATOM 171 N VAL A 12 -25.179 0.857 -16.530 1.00 4.11 N ATOM 172 CA VAL A 12 -25.537 2.189 -16.058 1.00 42.44 C ATOM 173 C VAL A 12 -25.378 2.298 -14.546 1.00 40.31 C ATOM 174 O VAL A 12 -25.483 1.305 -13.828 1.00 10.12 O ATOM 175 CB VAL A 12 -26.985 2.549 -16.439 1.00 35.34 C ATOM 176 CG1 VAL A 12 -27.971 1.705 -15.645 1.00 70.40 C ATOM 177 CG2 VAL A 12 -27.242 4.032 -16.217 1.00 62.22 C ATOM 0 H VAL A 12 -25.946 0.343 -16.964 1.00 4.11 H new ATOM 0 HA VAL A 12 -24.857 2.890 -16.543 1.00 42.44 H new ATOM 0 HB VAL A 12 -27.128 2.333 -17.498 1.00 35.34 H new ATOM 0 HG11 VAL A 12 -28.989 1.973 -15.927 1.00 70.40 H new ATOM 0 HG12 VAL A 12 -27.801 0.650 -15.859 1.00 70.40 H new ATOM 0 HG13 VAL A 12 -27.830 1.887 -14.580 1.00 70.40 H new ATOM 0 HG21 VAL A 12 -28.270 4.268 -16.492 1.00 62.22 H new ATOM 0 HG22 VAL A 12 -27.082 4.276 -15.167 1.00 62.22 H new ATOM 0 HG23 VAL A 12 -26.559 4.616 -16.833 1.00 62.22 H new ATOM 187 N ASN A 13 -25.125 3.513 -14.069 1.00 64.31 N ATOM 188 CA ASN A 13 -24.951 3.752 -12.641 1.00 10.00 C ATOM 189 C ASN A 13 -26.141 3.216 -11.851 1.00 21.40 C ATOM 190 O ASN A 13 -25.980 2.402 -10.941 1.00 3.10 O ATOM 191 CB ASN A 13 -24.778 5.248 -12.371 1.00 1.02 C ATOM 192 CG ASN A 13 -24.131 5.522 -11.027 1.00 22.32 C ATOM 193 OD1 ASN A 13 -24.817 5.723 -10.025 1.00 21.35 O ATOM 194 ND2 ASN A 13 -22.803 5.531 -11.000 1.00 72.24 N ATOM 0 H ASN A 13 -25.036 4.346 -14.650 1.00 64.31 H new ATOM 0 HA ASN A 13 -24.054 3.224 -12.316 1.00 10.00 H new ATOM 0 HB2 ASN A 13 -24.170 5.689 -13.161 1.00 1.02 H new ATOM 0 HB3 ASN A 13 -25.752 5.736 -12.409 1.00 1.02 H new ATOM 0 HD21 ASN A 13 -22.312 5.710 -10.124 1.00 72.24 H new ATOM 0 HD22 ASN A 13 -22.274 5.359 -11.855 1.00 72.24 H new ATOM 201 N PHE A 14 -27.336 3.676 -12.206 1.00 2.43 N ATOM 202 CA PHE A 14 -28.553 3.243 -11.530 1.00 55.51 C ATOM 203 C PHE A 14 -28.997 1.873 -12.033 1.00 63.23 C ATOM 204 O PHE A 14 -30.052 1.738 -12.651 1.00 61.42 O ATOM 205 CB PHE A 14 -29.672 4.265 -11.746 1.00 33.22 C ATOM 206 CG PHE A 14 -29.755 4.774 -13.156 1.00 74.14 C ATOM 207 CD1 PHE A 14 -29.030 5.887 -13.549 1.00 65.33 C ATOM 208 CD2 PHE A 14 -30.560 4.140 -14.089 1.00 61.25 C ATOM 209 CE1 PHE A 14 -29.103 6.358 -14.847 1.00 34.33 C ATOM 210 CE2 PHE A 14 -30.637 4.606 -15.388 1.00 75.13 C ATOM 211 CZ PHE A 14 -29.909 5.717 -15.767 1.00 74.21 C ATOM 0 H PHE A 14 -27.488 4.348 -12.958 1.00 2.43 H new ATOM 0 HA PHE A 14 -28.339 3.167 -10.464 1.00 55.51 H new ATOM 0 HB2 PHE A 14 -30.625 3.811 -11.476 1.00 33.22 H new ATOM 0 HB3 PHE A 14 -29.518 5.108 -11.072 1.00 33.22 H new ATOM 0 HD1 PHE A 14 -28.400 6.393 -12.833 1.00 65.33 H new ATOM 0 HD2 PHE A 14 -31.133 3.272 -13.798 1.00 61.25 H new ATOM 0 HE1 PHE A 14 -28.531 7.226 -15.141 1.00 34.33 H new ATOM 0 HE2 PHE A 14 -31.266 4.102 -16.106 1.00 75.13 H new ATOM 0 HZ PHE A 14 -29.970 6.084 -16.781 1.00 74.21 H new ATOM 221 N GLY A 15 -28.181 0.858 -11.764 1.00 71.20 N ATOM 222 CA GLY A 15 -28.505 -0.489 -12.197 1.00 21.03 C ATOM 223 C GLY A 15 -27.384 -1.128 -12.992 1.00 42.21 C ATOM 224 O GLY A 15 -27.507 -1.332 -14.199 1.00 15.11 O ATOM 0 H GLY A 15 -27.302 0.945 -11.254 1.00 71.20 H new ATOM 0 HA2 GLY A 15 -28.724 -1.105 -11.325 1.00 21.03 H new ATOM 0 HA3 GLY A 15 -29.409 -0.464 -12.805 1.00 21.03 H new ATOM 228 N GLY A 16 -26.284 -1.443 -12.314 1.00 72.21 N ATOM 229 CA GLY A 16 -25.152 -2.057 -12.982 1.00 24.51 C ATOM 230 C GLY A 16 -24.225 -2.768 -12.016 1.00 22.41 C ATOM 231 O GLY A 16 -24.321 -2.585 -10.802 1.00 44.23 O ATOM 0 H GLY A 16 -26.157 -1.284 -11.315 1.00 72.21 H new ATOM 0 HA2 GLY A 16 -25.514 -2.769 -13.724 1.00 24.51 H new ATOM 0 HA3 GLY A 16 -24.593 -1.292 -13.521 1.00 24.51 H new ATOM 235 N LYS A 17 -23.325 -3.585 -12.554 1.00 41.51 N ATOM 236 CA LYS A 17 -22.376 -4.327 -11.732 1.00 53.15 C ATOM 237 C LYS A 17 -21.103 -3.518 -11.506 1.00 12.12 C ATOM 238 O LYS A 17 -20.613 -2.847 -12.414 1.00 1.11 O ATOM 239 CB LYS A 17 -22.033 -5.663 -12.395 1.00 20.13 C ATOM 240 CG LYS A 17 -21.165 -5.523 -13.634 1.00 15.24 C ATOM 241 CD LYS A 17 -19.747 -6.005 -13.379 1.00 33.22 C ATOM 242 CE LYS A 17 -19.708 -7.501 -13.104 1.00 51.25 C ATOM 243 NZ LYS A 17 -19.516 -7.794 -11.657 1.00 72.32 N ATOM 0 H LYS A 17 -23.233 -3.750 -13.556 1.00 41.51 H new ATOM 0 HA LYS A 17 -22.841 -4.517 -10.765 1.00 53.15 H new ATOM 0 HB2 LYS A 17 -21.520 -6.297 -11.672 1.00 20.13 H new ATOM 0 HB3 LYS A 17 -22.958 -6.173 -12.665 1.00 20.13 H new ATOM 0 HG2 LYS A 17 -21.603 -6.094 -14.452 1.00 15.24 H new ATOM 0 HG3 LYS A 17 -21.144 -4.480 -13.949 1.00 15.24 H new ATOM 0 HD2 LYS A 17 -19.123 -5.776 -14.243 1.00 33.22 H new ATOM 0 HD3 LYS A 17 -19.326 -5.467 -12.530 1.00 33.22 H new ATOM 0 HE2 LYS A 17 -20.636 -7.958 -13.447 1.00 51.25 H new ATOM 0 HE3 LYS A 17 -18.899 -7.955 -13.677 1.00 51.25 H new ATOM 0 HZ1 LYS A 17 -20.020 -8.669 -11.410 1.00 72.32 H new ATOM 0 HZ2 LYS A 17 -18.502 -7.911 -11.458 1.00 72.32 H new ATOM 0 HZ3 LYS A 17 -19.891 -7.007 -11.091 1.00 72.32 H new ATOM 257 N SER A 18 -20.572 -3.587 -10.289 1.00 71.23 N ATOM 258 CA SER A 18 -19.357 -2.859 -9.943 1.00 61.21 C ATOM 259 C SER A 18 -18.130 -3.756 -10.076 1.00 21.15 C ATOM 260 O SER A 18 -18.170 -4.937 -9.730 1.00 62.22 O ATOM 261 CB SER A 18 -19.453 -2.314 -8.517 1.00 24.02 C ATOM 262 OG SER A 18 -19.439 -3.365 -7.567 1.00 20.51 O ATOM 0 H SER A 18 -20.964 -4.140 -9.527 1.00 71.23 H new ATOM 0 HA SER A 18 -19.252 -2.025 -10.637 1.00 61.21 H new ATOM 0 HB2 SER A 18 -18.621 -1.636 -8.327 1.00 24.02 H new ATOM 0 HB3 SER A 18 -20.369 -1.733 -8.407 1.00 24.02 H new ATOM 0 HG SER A 18 -19.500 -2.990 -6.664 1.00 20.51 H new ATOM 268 N PHE A 19 -17.040 -3.186 -10.578 1.00 62.24 N ATOM 269 CA PHE A 19 -15.800 -3.933 -10.758 1.00 73.13 C ATOM 270 C PHE A 19 -14.600 -3.116 -10.288 1.00 71.42 C ATOM 271 O PHE A 19 -14.110 -2.244 -11.006 1.00 23.42 O ATOM 272 CB PHE A 19 -15.623 -4.322 -12.227 1.00 60.14 C ATOM 273 CG PHE A 19 -15.480 -5.802 -12.443 1.00 3.33 C ATOM 274 CD1 PHE A 19 -16.397 -6.686 -11.899 1.00 74.22 C ATOM 275 CD2 PHE A 19 -14.428 -6.308 -13.189 1.00 2.01 C ATOM 276 CE1 PHE A 19 -16.267 -8.048 -12.095 1.00 74.12 C ATOM 277 CE2 PHE A 19 -14.293 -7.669 -13.389 1.00 22.04 C ATOM 278 CZ PHE A 19 -15.215 -8.540 -12.842 1.00 24.12 C ATOM 0 H PHE A 19 -16.990 -2.209 -10.868 1.00 62.24 H new ATOM 0 HA PHE A 19 -15.859 -4.839 -10.154 1.00 73.13 H new ATOM 0 HB2 PHE A 19 -16.480 -3.961 -12.796 1.00 60.14 H new ATOM 0 HB3 PHE A 19 -14.742 -3.818 -12.624 1.00 60.14 H new ATOM 0 HD1 PHE A 19 -17.223 -6.307 -11.315 1.00 74.22 H new ATOM 0 HD2 PHE A 19 -13.705 -5.631 -13.619 1.00 2.01 H new ATOM 0 HE1 PHE A 19 -16.988 -8.727 -11.664 1.00 74.12 H new ATOM 0 HE2 PHE A 19 -13.468 -8.051 -13.972 1.00 22.04 H new ATOM 0 HZ PHE A 19 -15.113 -9.604 -12.998 1.00 24.12 H new ATOM 288 N ASP A 20 -14.133 -3.405 -9.079 1.00 30.23 N ATOM 289 CA ASP A 20 -12.990 -2.699 -8.512 1.00 11.33 C ATOM 290 C ASP A 20 -11.833 -3.658 -8.252 1.00 2.12 C ATOM 291 O ASP A 20 -11.767 -4.297 -7.202 1.00 51.02 O ATOM 292 CB ASP A 20 -13.390 -1.998 -7.212 1.00 61.22 C ATOM 293 CG ASP A 20 -14.339 -2.831 -6.374 1.00 32.43 C ATOM 294 OD1 ASP A 20 -15.526 -2.934 -6.747 1.00 53.51 O ATOM 295 OD2 ASP A 20 -13.895 -3.381 -5.344 1.00 13.25 O ATOM 0 H ASP A 20 -14.528 -4.123 -8.472 1.00 30.23 H new ATOM 0 HA ASP A 20 -12.662 -1.951 -9.233 1.00 11.33 H new ATOM 0 HB2 ASP A 20 -12.494 -1.778 -6.631 1.00 61.22 H new ATOM 0 HB3 ASP A 20 -13.860 -1.043 -7.447 1.00 61.22 H new ATOM 300 N ALA A 21 -10.923 -3.754 -9.215 1.00 44.15 N ATOM 301 CA ALA A 21 -9.768 -4.634 -9.090 1.00 64.15 C ATOM 302 C ALA A 21 -8.491 -3.932 -9.540 1.00 2.31 C ATOM 303 O ALA A 21 -8.540 -2.886 -10.189 1.00 61.53 O ATOM 304 CB ALA A 21 -9.984 -5.906 -9.896 1.00 60.43 C ATOM 0 H ALA A 21 -10.963 -3.233 -10.091 1.00 44.15 H new ATOM 0 HA ALA A 21 -9.656 -4.897 -8.038 1.00 64.15 H new ATOM 0 HB1 ALA A 21 -9.113 -6.554 -9.793 1.00 60.43 H new ATOM 0 HB2 ALA A 21 -10.868 -6.425 -9.526 1.00 60.43 H new ATOM 0 HB3 ALA A 21 -10.125 -5.652 -10.946 1.00 60.43 H new ATOM 310 N THR A 22 -7.347 -4.512 -9.190 1.00 0.23 N ATOM 311 CA THR A 22 -6.057 -3.941 -9.555 1.00 50.53 C ATOM 312 C THR A 22 -5.606 -4.433 -10.926 1.00 12.12 C ATOM 313 O THR A 22 -6.358 -5.102 -11.634 1.00 34.33 O ATOM 314 CB THR A 22 -4.974 -4.287 -8.516 1.00 72.31 C ATOM 315 OG1 THR A 22 -5.585 -4.773 -7.315 1.00 51.25 O ATOM 316 CG2 THR A 22 -4.119 -3.070 -8.199 1.00 44.04 C ATOM 0 H THR A 22 -7.288 -5.378 -8.654 1.00 0.23 H new ATOM 0 HA THR A 22 -6.188 -2.859 -9.585 1.00 50.53 H new ATOM 0 HB THR A 22 -4.333 -5.062 -8.937 1.00 72.31 H new ATOM 0 HG1 THR A 22 -4.890 -4.992 -6.660 1.00 51.25 H new ATOM 0 HG21 THR A 22 -3.361 -3.339 -7.463 1.00 44.04 H new ATOM 0 HG22 THR A 22 -3.632 -2.720 -9.109 1.00 44.04 H new ATOM 0 HG23 THR A 22 -4.750 -2.277 -7.797 1.00 44.04 H new ATOM 324 N SER A 23 -4.374 -4.098 -11.294 1.00 2.31 N ATOM 325 CA SER A 23 -3.824 -4.504 -12.582 1.00 3.40 C ATOM 326 C SER A 23 -3.519 -5.998 -12.596 1.00 22.53 C ATOM 327 O SER A 23 -2.374 -6.411 -12.408 1.00 73.53 O ATOM 328 CB SER A 23 -2.553 -3.710 -12.891 1.00 11.52 C ATOM 329 OG SER A 23 -2.078 -3.994 -14.195 1.00 71.32 O ATOM 0 H SER A 23 -3.738 -3.546 -10.719 1.00 2.31 H new ATOM 0 HA SER A 23 -4.570 -4.296 -13.349 1.00 3.40 H new ATOM 0 HB2 SER A 23 -2.756 -2.643 -12.799 1.00 11.52 H new ATOM 0 HB3 SER A 23 -1.782 -3.952 -12.159 1.00 11.52 H new ATOM 0 HG SER A 23 -1.266 -3.473 -14.368 1.00 71.32 H new ATOM 335 N ASP A 24 -4.551 -6.804 -12.819 1.00 32.22 N ATOM 336 CA ASP A 24 -4.395 -8.254 -12.858 1.00 53.43 C ATOM 337 C ASP A 24 -5.725 -8.935 -13.164 1.00 35.13 C ATOM 338 O ASP A 24 -6.066 -9.950 -12.558 1.00 33.44 O ATOM 339 CB ASP A 24 -3.840 -8.765 -11.528 1.00 43.41 C ATOM 340 CG ASP A 24 -2.826 -9.877 -11.713 1.00 35.11 C ATOM 341 OD1 ASP A 24 -2.836 -10.516 -12.786 1.00 14.32 O ATOM 342 OD2 ASP A 24 -2.024 -10.110 -10.784 1.00 52.33 O ATOM 0 H ASP A 24 -5.505 -6.478 -12.976 1.00 32.22 H new ATOM 0 HA ASP A 24 -3.691 -8.498 -13.654 1.00 53.43 H new ATOM 0 HB2 ASP A 24 -3.375 -7.939 -10.990 1.00 43.41 H new ATOM 0 HB3 ASP A 24 -4.662 -9.126 -10.909 1.00 43.41 H new ATOM 347 N GLN A 25 -6.472 -8.369 -14.106 1.00 52.41 N ATOM 348 CA GLN A 25 -7.766 -8.921 -14.490 1.00 22.21 C ATOM 349 C GLN A 25 -8.031 -8.704 -15.976 1.00 31.20 C ATOM 350 O GLN A 25 -7.391 -7.882 -16.632 1.00 73.12 O ATOM 351 CB GLN A 25 -8.883 -8.283 -13.662 1.00 25.22 C ATOM 352 CG GLN A 25 -9.155 -9.003 -12.351 1.00 31.01 C ATOM 353 CD GLN A 25 -8.445 -8.362 -11.175 1.00 34.24 C ATOM 354 OE1 GLN A 25 -7.614 -7.471 -11.347 1.00 44.12 O ATOM 355 NE2 GLN A 25 -8.771 -8.814 -9.969 1.00 0.40 N ATOM 0 H GLN A 25 -6.204 -7.528 -14.618 1.00 52.41 H new ATOM 0 HA GLN A 25 -7.747 -9.993 -14.296 1.00 22.21 H new ATOM 0 HB2 GLN A 25 -8.620 -7.247 -13.450 1.00 25.22 H new ATOM 0 HB3 GLN A 25 -9.798 -8.265 -14.254 1.00 25.22 H new ATOM 0 HG2 GLN A 25 -10.228 -9.012 -12.162 1.00 31.01 H new ATOM 0 HG3 GLN A 25 -8.838 -10.042 -12.439 1.00 31.01 H new ATOM 0 HE21 GLN A 25 -9.466 -9.555 -9.873 1.00 0.40 H new ATOM 0 HE22 GLN A 25 -8.327 -8.420 -9.140 1.00 0.40 H new ATOM 364 N PRO A 26 -8.997 -9.458 -16.521 1.00 60.44 N ATOM 365 CA PRO A 26 -9.369 -9.366 -17.936 1.00 71.33 C ATOM 366 C PRO A 26 -10.286 -8.181 -18.219 1.00 4.23 C ATOM 367 O PRO A 26 -10.725 -7.979 -19.350 1.00 33.21 O ATOM 368 CB PRO A 26 -10.104 -10.684 -18.196 1.00 43.13 C ATOM 369 CG PRO A 26 -10.653 -11.079 -16.869 1.00 71.52 C ATOM 370 CD PRO A 26 -9.800 -10.459 -15.799 1.00 14.43 C ATOM 0 HA PRO A 26 -8.500 -9.212 -18.576 1.00 71.33 H new ATOM 0 HB2 PRO A 26 -10.899 -10.556 -18.931 1.00 43.13 H new ATOM 0 HB3 PRO A 26 -9.428 -11.444 -18.587 1.00 43.13 H new ATOM 0 HG2 PRO A 26 -11.686 -10.745 -16.771 1.00 71.52 H new ATOM 0 HG3 PRO A 26 -10.658 -12.164 -16.769 1.00 71.52 H new ATOM 0 HD2 PRO A 26 -10.408 -9.998 -15.021 1.00 14.43 H new ATOM 0 HD3 PRO A 26 -9.168 -11.202 -15.311 1.00 14.43 H new ATOM 378 N GLY A 27 -10.570 -7.398 -17.182 1.00 44.12 N ATOM 379 CA GLY A 27 -11.432 -6.242 -17.340 1.00 52.43 C ATOM 380 C GLY A 27 -12.877 -6.544 -16.995 1.00 23.24 C ATOM 381 O GLY A 27 -13.307 -6.336 -15.861 1.00 14.41 O ATOM 0 H GLY A 27 -10.218 -7.544 -16.236 1.00 44.12 H new ATOM 0 HA2 GLY A 27 -11.071 -5.434 -16.704 1.00 52.43 H new ATOM 0 HA3 GLY A 27 -11.374 -5.887 -18.369 1.00 52.43 H new ATOM 385 N ALA A 28 -13.628 -7.036 -17.975 1.00 25.02 N ATOM 386 CA ALA A 28 -15.032 -7.368 -17.768 1.00 43.04 C ATOM 387 C ALA A 28 -15.438 -8.577 -18.604 1.00 35.35 C ATOM 388 O ALA A 28 -14.678 -9.042 -19.452 1.00 34.12 O ATOM 389 CB ALA A 28 -15.911 -6.173 -18.104 1.00 14.44 C ATOM 0 H ALA A 28 -13.287 -7.213 -18.920 1.00 25.02 H new ATOM 0 HA ALA A 28 -15.169 -7.622 -16.717 1.00 43.04 H new ATOM 0 HB1 ALA A 28 -16.957 -6.435 -17.945 1.00 14.44 H new ATOM 0 HB2 ALA A 28 -15.645 -5.334 -17.461 1.00 14.44 H new ATOM 0 HB3 ALA A 28 -15.761 -5.893 -19.147 1.00 14.44 H new ATOM 395 N GLY A 29 -16.643 -9.083 -18.357 1.00 31.33 N ATOM 396 CA GLY A 29 -17.129 -10.235 -19.094 1.00 12.02 C ATOM 397 C GLY A 29 -18.643 -10.288 -19.154 1.00 41.03 C ATOM 398 O GLY A 29 -19.300 -10.604 -18.162 1.00 62.43 O ATOM 0 H GLY A 29 -17.291 -8.716 -17.660 1.00 31.33 H new ATOM 0 HA2 GLY A 29 -16.729 -10.209 -20.108 1.00 12.02 H new ATOM 0 HA3 GLY A 29 -16.755 -11.146 -18.627 1.00 12.02 H new ATOM 402 N ASP A 30 -19.198 -9.976 -20.320 1.00 70.11 N ATOM 403 CA ASP A 30 -20.644 -9.989 -20.506 1.00 54.11 C ATOM 404 C ASP A 30 -21.001 -10.039 -21.988 1.00 72.24 C ATOM 405 O ASP A 30 -20.168 -9.753 -22.847 1.00 54.43 O ATOM 406 CB ASP A 30 -21.274 -8.755 -19.859 1.00 12.43 C ATOM 407 CG ASP A 30 -20.975 -7.482 -20.626 1.00 51.05 C ATOM 408 OD1 ASP A 30 -19.782 -7.191 -20.850 1.00 3.00 O ATOM 409 OD2 ASP A 30 -21.935 -6.776 -21.003 1.00 64.41 O ATOM 0 H ASP A 30 -18.668 -9.711 -21.150 1.00 70.11 H new ATOM 0 HA ASP A 30 -21.039 -10.884 -20.025 1.00 54.11 H new ATOM 0 HB2 ASP A 30 -22.353 -8.893 -19.796 1.00 12.43 H new ATOM 0 HB3 ASP A 30 -20.905 -8.656 -18.838 1.00 12.43 H new ATOM 414 N ASN A 31 -22.245 -10.407 -22.280 1.00 43.54 N ATOM 415 CA ASN A 31 -22.711 -10.496 -23.659 1.00 74.12 C ATOM 416 C ASN A 31 -24.230 -10.362 -23.729 1.00 64.54 C ATOM 417 O ASN A 31 -24.961 -11.322 -23.480 1.00 4.14 O ATOM 418 CB ASN A 31 -22.276 -11.824 -24.282 1.00 21.24 C ATOM 419 CG ASN A 31 -22.519 -13.003 -23.359 1.00 10.34 C ATOM 420 OD1 ASN A 31 -23.608 -13.577 -23.341 1.00 23.12 O ATOM 421 ND2 ASN A 31 -21.503 -13.368 -22.586 1.00 21.12 N ATOM 0 H ASN A 31 -22.947 -10.648 -21.581 1.00 43.54 H new ATOM 0 HA ASN A 31 -22.265 -9.676 -24.221 1.00 74.12 H new ATOM 0 HB2 ASN A 31 -22.818 -11.979 -25.215 1.00 21.24 H new ATOM 0 HB3 ASN A 31 -21.216 -11.775 -24.533 1.00 21.24 H new ATOM 0 HD21 ASN A 31 -21.607 -14.153 -21.944 1.00 21.12 H new ATOM 0 HD22 ASN A 31 -20.618 -12.863 -22.635 1.00 21.12 H new ATOM 428 N LEU A 32 -24.697 -9.167 -24.071 1.00 74.13 N ATOM 429 CA LEU A 32 -26.129 -8.907 -24.175 1.00 51.15 C ATOM 430 C LEU A 32 -26.390 -7.481 -24.651 1.00 73.54 C ATOM 431 O LEU A 32 -27.061 -6.704 -23.974 1.00 54.15 O ATOM 432 CB LEU A 32 -26.809 -9.139 -22.825 1.00 51.50 C ATOM 433 CG LEU A 32 -26.198 -8.404 -21.631 1.00 70.21 C ATOM 434 CD1 LEU A 32 -27.275 -7.666 -20.850 1.00 65.42 C ATOM 435 CD2 LEU A 32 -25.455 -9.379 -20.729 1.00 14.13 C ATOM 0 H LEU A 32 -24.106 -8.363 -24.281 1.00 74.13 H new ATOM 0 HA LEU A 32 -26.546 -9.597 -24.908 1.00 51.15 H new ATOM 0 HB2 LEU A 32 -27.855 -8.844 -22.912 1.00 51.50 H new ATOM 0 HB3 LEU A 32 -26.796 -10.208 -22.613 1.00 51.50 H new ATOM 0 HG LEU A 32 -25.484 -7.671 -22.006 1.00 70.21 H new ATOM 0 HD11 LEU A 32 -26.821 -7.149 -20.004 1.00 65.42 H new ATOM 0 HD12 LEU A 32 -27.763 -6.940 -21.500 1.00 65.42 H new ATOM 0 HD13 LEU A 32 -28.014 -8.380 -20.485 1.00 65.42 H new ATOM 0 HD21 LEU A 32 -25.027 -8.839 -19.885 1.00 14.13 H new ATOM 0 HD22 LEU A 32 -26.148 -10.136 -20.362 1.00 14.13 H new ATOM 0 HD23 LEU A 32 -24.657 -9.861 -21.294 1.00 14.13 H new ATOM 447 N ASN A 33 -25.857 -7.147 -25.822 1.00 4.33 N ATOM 448 CA ASN A 33 -26.033 -5.815 -26.389 1.00 74.04 C ATOM 449 C ASN A 33 -25.323 -4.764 -25.542 1.00 52.31 C ATOM 450 O ASN A 33 -25.481 -4.725 -24.322 1.00 23.33 O ATOM 451 CB ASN A 33 -27.522 -5.478 -26.498 1.00 41.14 C ATOM 452 CG ASN A 33 -27.823 -4.560 -27.667 1.00 43.05 C ATOM 453 OD1 ASN A 33 -27.258 -4.711 -28.751 1.00 2.11 O ATOM 454 ND2 ASN A 33 -28.716 -3.602 -27.452 1.00 54.43 N ATOM 0 H ASN A 33 -25.300 -7.780 -26.396 1.00 4.33 H new ATOM 0 HA ASN A 33 -25.592 -5.810 -27.386 1.00 74.04 H new ATOM 0 HB2 ASN A 33 -28.093 -6.400 -26.607 1.00 41.14 H new ATOM 0 HB3 ASN A 33 -27.853 -5.005 -25.574 1.00 41.14 H new ATOM 0 HD21 ASN A 33 -28.959 -2.954 -28.201 1.00 54.43 H new ATOM 0 HD22 ASN A 33 -29.159 -3.514 -26.538 1.00 54.43 H new ATOM 461 N ASP A 34 -24.542 -3.913 -26.198 1.00 10.42 N ATOM 462 CA ASP A 34 -23.809 -2.859 -25.506 1.00 24.24 C ATOM 463 C ASP A 34 -24.767 -1.886 -24.826 1.00 41.14 C ATOM 464 O ASP A 34 -25.873 -1.646 -25.312 1.00 3.32 O ATOM 465 CB ASP A 34 -22.908 -2.107 -26.486 1.00 43.32 C ATOM 466 CG ASP A 34 -21.502 -2.672 -26.531 1.00 43.13 C ATOM 467 OD1 ASP A 34 -21.023 -3.155 -25.484 1.00 41.50 O ATOM 468 OD2 ASP A 34 -20.880 -2.631 -27.614 1.00 3.23 O ATOM 0 H ASP A 34 -24.400 -3.932 -27.208 1.00 10.42 H new ATOM 0 HA ASP A 34 -23.189 -3.325 -24.740 1.00 24.24 H new ATOM 0 HB2 ASP A 34 -23.346 -2.150 -27.483 1.00 43.32 H new ATOM 0 HB3 ASP A 34 -22.865 -1.056 -26.202 1.00 43.32 H new ATOM 473 N LYS A 35 -24.336 -1.329 -23.700 1.00 12.42 N ATOM 474 CA LYS A 35 -25.155 -0.381 -22.953 1.00 24.14 C ATOM 475 C LYS A 35 -24.281 0.604 -22.183 1.00 43.43 C ATOM 476 O LYS A 35 -23.087 0.370 -21.990 1.00 35.24 O ATOM 477 CB LYS A 35 -26.077 -1.125 -21.984 1.00 61.01 C ATOM 478 CG LYS A 35 -27.548 -0.794 -22.169 1.00 44.13 C ATOM 479 CD LYS A 35 -28.132 -1.508 -23.376 1.00 54.24 C ATOM 480 CE LYS A 35 -28.428 -0.537 -24.509 1.00 44.23 C ATOM 481 NZ LYS A 35 -29.875 -0.197 -24.586 1.00 35.43 N ATOM 0 H LYS A 35 -23.424 -1.517 -23.284 1.00 12.42 H new ATOM 0 HA LYS A 35 -25.761 0.178 -23.666 1.00 24.14 H new ATOM 0 HB2 LYS A 35 -25.936 -2.198 -22.113 1.00 61.01 H new ATOM 0 HB3 LYS A 35 -25.785 -0.885 -20.962 1.00 61.01 H new ATOM 0 HG2 LYS A 35 -28.101 -1.078 -21.274 1.00 44.13 H new ATOM 0 HG3 LYS A 35 -27.667 0.283 -22.289 1.00 44.13 H new ATOM 0 HD2 LYS A 35 -27.434 -2.270 -23.722 1.00 54.24 H new ATOM 0 HD3 LYS A 35 -29.049 -2.022 -23.087 1.00 54.24 H new ATOM 0 HE2 LYS A 35 -27.848 0.375 -24.366 1.00 44.23 H new ATOM 0 HE3 LYS A 35 -28.107 -0.974 -25.455 1.00 44.23 H new ATOM 0 HZ1 LYS A 35 -30.034 0.467 -25.371 1.00 35.43 H new ATOM 0 HZ2 LYS A 35 -30.427 -1.063 -24.748 1.00 35.43 H new ATOM 0 HZ3 LYS A 35 -30.176 0.244 -23.693 1.00 35.43 H new ATOM 495 N ILE A 36 -24.882 1.706 -21.746 1.00 73.54 N ATOM 496 CA ILE A 36 -24.159 2.724 -20.996 1.00 44.30 C ATOM 497 C ILE A 36 -23.398 2.109 -19.826 1.00 54.11 C ATOM 498 O ILE A 36 -23.920 1.249 -19.117 1.00 70.41 O ATOM 499 CB ILE A 36 -25.110 3.811 -20.461 1.00 44.20 C ATOM 500 CG1 ILE A 36 -24.373 4.726 -19.480 1.00 53.01 C ATOM 501 CG2 ILE A 36 -26.320 3.175 -19.794 1.00 24.42 C ATOM 502 CD1 ILE A 36 -25.013 6.088 -19.327 1.00 75.02 C ATOM 0 H ILE A 36 -25.868 1.916 -21.899 1.00 73.54 H new ATOM 0 HA ILE A 36 -23.450 3.181 -21.687 1.00 44.30 H new ATOM 0 HB ILE A 36 -25.458 4.414 -21.300 1.00 44.20 H new ATOM 0 HG12 ILE A 36 -24.332 4.241 -18.505 1.00 53.01 H new ATOM 0 HG13 ILE A 36 -23.344 4.853 -19.817 1.00 53.01 H new ATOM 0 HG21 ILE A 36 -26.982 3.956 -19.421 1.00 24.42 H new ATOM 0 HG22 ILE A 36 -26.855 2.561 -20.519 1.00 24.42 H new ATOM 0 HG23 ILE A 36 -25.991 2.551 -18.963 1.00 24.42 H new ATOM 0 HD11 ILE A 36 -24.438 6.683 -18.617 1.00 75.02 H new ATOM 0 HD12 ILE A 36 -25.030 6.593 -20.293 1.00 75.02 H new ATOM 0 HD13 ILE A 36 -26.033 5.972 -18.960 1.00 75.02 H new ATOM 514 N SER A 37 -22.163 2.558 -19.629 1.00 22.31 N ATOM 515 CA SER A 37 -21.329 2.050 -18.546 1.00 0.03 C ATOM 516 C SER A 37 -20.620 3.192 -17.825 1.00 1.53 C ATOM 517 O SER A 37 -20.440 4.276 -18.381 1.00 73.21 O ATOM 518 CB SER A 37 -20.299 1.057 -19.089 1.00 12.44 C ATOM 519 OG SER A 37 -20.611 -0.268 -18.695 1.00 54.30 O ATOM 0 H SER A 37 -21.718 3.272 -20.205 1.00 22.31 H new ATOM 0 HA SER A 37 -21.975 1.538 -17.833 1.00 0.03 H new ATOM 0 HB2 SER A 37 -20.268 1.119 -20.177 1.00 12.44 H new ATOM 0 HB3 SER A 37 -19.306 1.323 -18.726 1.00 12.44 H new ATOM 0 HG SER A 37 -20.199 -0.456 -17.826 1.00 54.30 H new ATOM 525 N SER A 38 -20.219 2.942 -16.582 1.00 72.35 N ATOM 526 CA SER A 38 -19.533 3.950 -15.783 1.00 30.55 C ATOM 527 C SER A 38 -18.057 3.601 -15.619 1.00 22.41 C ATOM 528 O SER A 38 -17.704 2.678 -14.884 1.00 3.25 O ATOM 529 CB SER A 38 -20.194 4.077 -14.409 1.00 2.34 C ATOM 530 OG SER A 38 -19.225 4.268 -13.392 1.00 42.14 O ATOM 0 H SER A 38 -20.358 2.050 -16.107 1.00 72.35 H new ATOM 0 HA SER A 38 -19.607 4.904 -16.304 1.00 30.55 H new ATOM 0 HB2 SER A 38 -20.891 4.915 -14.413 1.00 2.34 H new ATOM 0 HB3 SER A 38 -20.776 3.180 -14.198 1.00 2.34 H new ATOM 0 HG SER A 38 -19.673 4.347 -12.524 1.00 42.14 H new ATOM 536 N ILE A 39 -17.200 4.345 -16.310 1.00 24.43 N ATOM 537 CA ILE A 39 -15.762 4.115 -16.241 1.00 2.32 C ATOM 538 C ILE A 39 -15.053 5.275 -15.550 1.00 44.44 C ATOM 539 O ILE A 39 -14.794 6.312 -16.162 1.00 10.21 O ATOM 540 CB ILE A 39 -15.155 3.919 -17.643 1.00 32.33 C ATOM 541 CG1 ILE A 39 -15.508 2.532 -18.185 1.00 40.20 C ATOM 542 CG2 ILE A 39 -13.646 4.108 -17.598 1.00 73.12 C ATOM 543 CD1 ILE A 39 -16.964 2.386 -18.569 1.00 43.14 C ATOM 0 H ILE A 39 -17.476 5.112 -16.924 1.00 24.43 H new ATOM 0 HA ILE A 39 -15.615 3.204 -15.660 1.00 2.32 H new ATOM 0 HB ILE A 39 -15.575 4.669 -18.313 1.00 32.33 H new ATOM 0 HG12 ILE A 39 -14.888 2.323 -19.057 1.00 40.20 H new ATOM 0 HG13 ILE A 39 -15.262 1.783 -17.432 1.00 40.20 H new ATOM 0 HG21 ILE A 39 -13.232 3.966 -18.596 1.00 73.12 H new ATOM 0 HG22 ILE A 39 -13.416 5.115 -17.249 1.00 73.12 H new ATOM 0 HG23 ILE A 39 -13.208 3.379 -16.917 1.00 73.12 H new ATOM 0 HD11 ILE A 39 -17.142 1.378 -18.945 1.00 43.14 H new ATOM 0 HD12 ILE A 39 -17.590 2.563 -17.695 1.00 43.14 H new ATOM 0 HD13 ILE A 39 -17.210 3.111 -19.345 1.00 43.14 H new ATOM 555 N LYS A 40 -14.738 5.093 -14.272 1.00 55.23 N ATOM 556 CA LYS A 40 -14.056 6.122 -13.497 1.00 42.54 C ATOM 557 C LYS A 40 -12.772 5.577 -12.880 1.00 42.15 C ATOM 558 O LYS A 40 -12.804 4.902 -11.851 1.00 45.24 O ATOM 559 CB LYS A 40 -14.976 6.656 -12.397 1.00 51.23 C ATOM 560 CG LYS A 40 -14.347 7.755 -11.558 1.00 71.11 C ATOM 561 CD LYS A 40 -14.265 7.360 -10.093 1.00 64.42 C ATOM 562 CE LYS A 40 -14.135 8.579 -9.193 1.00 71.03 C ATOM 563 NZ LYS A 40 -14.959 8.448 -7.960 1.00 22.13 N ATOM 0 H LYS A 40 -14.945 4.241 -13.751 1.00 55.23 H new ATOM 0 HA LYS A 40 -13.797 6.937 -14.172 1.00 42.54 H new ATOM 0 HB2 LYS A 40 -15.890 7.036 -12.853 1.00 51.23 H new ATOM 0 HB3 LYS A 40 -15.264 5.832 -11.744 1.00 51.23 H new ATOM 0 HG2 LYS A 40 -13.347 7.974 -11.933 1.00 71.11 H new ATOM 0 HG3 LYS A 40 -14.932 8.670 -11.657 1.00 71.11 H new ATOM 0 HD2 LYS A 40 -15.156 6.796 -9.817 1.00 64.42 H new ATOM 0 HD3 LYS A 40 -13.410 6.701 -9.940 1.00 64.42 H new ATOM 0 HE2 LYS A 40 -13.089 8.718 -8.918 1.00 71.03 H new ATOM 0 HE3 LYS A 40 -14.441 9.470 -9.742 1.00 71.03 H new ATOM 0 HZ1 LYS A 40 -14.843 9.299 -7.373 1.00 22.13 H new ATOM 0 HZ2 LYS A 40 -15.960 8.341 -8.221 1.00 22.13 H new ATOM 0 HZ3 LYS A 40 -14.650 7.612 -7.423 1.00 22.13 H new ATOM 577 N VAL A 41 -11.642 5.875 -13.515 1.00 54.31 N ATOM 578 CA VAL A 41 -10.347 5.417 -13.027 1.00 13.10 C ATOM 579 C VAL A 41 -9.252 6.429 -13.342 1.00 2.51 C ATOM 580 O VAL A 41 -9.345 7.181 -14.313 1.00 34.13 O ATOM 581 CB VAL A 41 -9.966 4.057 -13.640 1.00 64.33 C ATOM 582 CG1 VAL A 41 -8.711 3.506 -12.980 1.00 44.41 C ATOM 583 CG2 VAL A 41 -11.119 3.073 -13.514 1.00 53.41 C ATOM 0 H VAL A 41 -11.598 6.432 -14.369 1.00 54.31 H new ATOM 0 HA VAL A 41 -10.436 5.308 -11.946 1.00 13.10 H new ATOM 0 HB VAL A 41 -9.757 4.203 -14.700 1.00 64.33 H new ATOM 0 HG11 VAL A 41 -8.457 2.544 -13.426 1.00 44.41 H new ATOM 0 HG12 VAL A 41 -7.886 4.203 -13.127 1.00 44.41 H new ATOM 0 HG13 VAL A 41 -8.889 3.375 -11.913 1.00 44.41 H new ATOM 0 HG21 VAL A 41 -10.831 2.117 -13.953 1.00 53.41 H new ATOM 0 HG22 VAL A 41 -11.362 2.930 -12.461 1.00 53.41 H new ATOM 0 HG23 VAL A 41 -11.991 3.465 -14.038 1.00 53.41 H new ATOM 593 N LYS A 42 -8.212 6.444 -12.515 1.00 0.12 N ATOM 594 CA LYS A 42 -7.096 7.363 -12.705 1.00 23.24 C ATOM 595 C LYS A 42 -5.762 6.636 -12.562 1.00 74.34 C ATOM 596 O LYS A 42 -5.191 6.574 -11.474 1.00 10.42 O ATOM 597 CB LYS A 42 -7.174 8.509 -11.693 1.00 71.14 C ATOM 598 CG LYS A 42 -8.535 9.182 -11.641 1.00 22.42 C ATOM 599 CD LYS A 42 -9.186 9.017 -10.278 1.00 30.22 C ATOM 600 CE LYS A 42 -9.491 7.557 -9.979 1.00 2.04 C ATOM 601 NZ LYS A 42 -9.929 7.360 -8.569 1.00 75.42 N ATOM 0 H LYS A 42 -8.119 5.830 -11.706 1.00 0.12 H new ATOM 0 HA LYS A 42 -7.162 7.771 -13.714 1.00 23.24 H new ATOM 0 HB2 LYS A 42 -6.929 8.125 -10.702 1.00 71.14 H new ATOM 0 HB3 LYS A 42 -6.419 9.254 -11.942 1.00 71.14 H new ATOM 0 HG2 LYS A 42 -8.426 10.243 -11.868 1.00 22.42 H new ATOM 0 HG3 LYS A 42 -9.182 8.757 -12.408 1.00 22.42 H new ATOM 0 HD2 LYS A 42 -8.527 9.417 -9.508 1.00 30.22 H new ATOM 0 HD3 LYS A 42 -10.108 9.597 -10.241 1.00 30.22 H new ATOM 0 HE2 LYS A 42 -10.270 7.203 -10.654 1.00 2.04 H new ATOM 0 HE3 LYS A 42 -8.604 6.954 -10.172 1.00 2.04 H new ATOM 0 HZ1 LYS A 42 -10.127 6.352 -8.405 1.00 75.42 H new ATOM 0 HZ2 LYS A 42 -9.176 7.674 -7.924 1.00 75.42 H new ATOM 0 HZ3 LYS A 42 -10.790 7.916 -8.392 1.00 75.42 H new ATOM 615 N SER A 43 -5.272 6.087 -13.669 1.00 44.22 N ATOM 616 CA SER A 43 -4.006 5.362 -13.667 1.00 13.31 C ATOM 617 C SER A 43 -3.510 5.132 -15.091 1.00 22.51 C ATOM 618 O SER A 43 -3.962 4.216 -15.777 1.00 63.02 O ATOM 619 CB SER A 43 -4.163 4.022 -12.946 1.00 14.10 C ATOM 620 OG SER A 43 -2.945 3.622 -12.342 1.00 75.12 O ATOM 0 H SER A 43 -5.732 6.130 -14.578 1.00 44.22 H new ATOM 0 HA SER A 43 -3.270 5.967 -13.138 1.00 13.31 H new ATOM 0 HB2 SER A 43 -4.940 4.103 -12.186 1.00 14.10 H new ATOM 0 HB3 SER A 43 -4.489 3.260 -13.654 1.00 14.10 H new ATOM 0 HG SER A 43 -3.072 2.764 -11.886 1.00 75.12 H new ATOM 626 N GLY A 44 -2.576 5.970 -15.529 1.00 4.44 N ATOM 627 CA GLY A 44 -2.032 5.842 -16.868 1.00 54.32 C ATOM 628 C GLY A 44 -3.111 5.835 -17.933 1.00 52.21 C ATOM 629 O GLY A 44 -4.107 6.551 -17.824 1.00 52.33 O ATOM 0 H GLY A 44 -2.186 6.736 -14.980 1.00 4.44 H new ATOM 0 HA2 GLY A 44 -1.344 6.666 -17.058 1.00 54.32 H new ATOM 0 HA3 GLY A 44 -1.453 4.921 -16.935 1.00 54.32 H new ATOM 633 N THR A 45 -2.914 5.025 -18.968 1.00 63.42 N ATOM 634 CA THR A 45 -3.876 4.929 -20.059 1.00 3.23 C ATOM 635 C THR A 45 -4.417 3.510 -20.192 1.00 45.33 C ATOM 636 O THR A 45 -3.745 2.544 -19.832 1.00 30.35 O ATOM 637 CB THR A 45 -3.249 5.356 -21.400 1.00 11.04 C ATOM 638 OG1 THR A 45 -2.243 4.415 -21.792 1.00 15.21 O ATOM 639 CG2 THR A 45 -2.638 6.745 -21.293 1.00 63.14 C ATOM 0 H THR A 45 -2.096 4.425 -19.074 1.00 63.42 H new ATOM 0 HA THR A 45 -4.696 5.606 -19.818 1.00 3.23 H new ATOM 0 HB THR A 45 -4.036 5.380 -22.153 1.00 11.04 H new ATOM 0 HG1 THR A 45 -1.851 4.692 -22.646 1.00 15.21 H new ATOM 0 HG21 THR A 45 -2.201 7.025 -22.252 1.00 63.14 H new ATOM 0 HG22 THR A 45 -3.412 7.463 -21.023 1.00 63.14 H new ATOM 0 HG23 THR A 45 -1.862 6.743 -20.528 1.00 63.14 H new ATOM 647 N TRP A 46 -5.632 3.392 -20.713 1.00 55.50 N ATOM 648 CA TRP A 46 -6.263 2.090 -20.895 1.00 20.22 C ATOM 649 C TRP A 46 -6.836 1.954 -22.301 1.00 14.10 C ATOM 650 O TRP A 46 -7.070 2.951 -22.985 1.00 32.14 O ATOM 651 CB TRP A 46 -7.369 1.886 -19.858 1.00 2.42 C ATOM 652 CG TRP A 46 -7.242 2.790 -18.669 1.00 40.41 C ATOM 653 CD1 TRP A 46 -6.206 2.835 -17.781 1.00 1.55 C ATOM 654 CD2 TRP A 46 -8.185 3.778 -18.239 1.00 34.32 C ATOM 655 NE1 TRP A 46 -6.448 3.791 -16.824 1.00 15.34 N ATOM 656 CE2 TRP A 46 -7.656 4.384 -17.083 1.00 2.11 C ATOM 657 CE3 TRP A 46 -9.425 4.210 -18.718 1.00 63.14 C ATOM 658 CZ2 TRP A 46 -8.324 5.398 -16.402 1.00 35.45 C ATOM 659 CZ3 TRP A 46 -10.087 5.216 -18.041 1.00 32.42 C ATOM 660 CH2 TRP A 46 -9.536 5.801 -16.893 1.00 51.02 C ATOM 0 H TRP A 46 -6.201 4.182 -21.017 1.00 55.50 H new ATOM 0 HA TRP A 46 -5.501 1.323 -20.758 1.00 20.22 H new ATOM 0 HB2 TRP A 46 -8.336 2.054 -20.331 1.00 2.42 H new ATOM 0 HB3 TRP A 46 -7.354 0.850 -19.521 1.00 2.42 H new ATOM 0 HD1 TRP A 46 -5.326 2.211 -17.824 1.00 1.55 H new ATOM 0 HE1 TRP A 46 -5.829 4.022 -16.047 1.00 15.34 H new ATOM 0 HE3 TRP A 46 -9.858 3.765 -19.602 1.00 63.14 H new ATOM 0 HZ2 TRP A 46 -7.901 5.851 -15.517 1.00 35.45 H new ATOM 0 HZ3 TRP A 46 -11.046 5.557 -18.403 1.00 32.42 H new ATOM 0 HH2 TRP A 46 -10.078 6.585 -16.386 1.00 51.02 H new ATOM 671 N ARG A 47 -7.061 0.715 -22.727 1.00 11.42 N ATOM 672 CA ARG A 47 -7.607 0.450 -24.053 1.00 4.44 C ATOM 673 C ARG A 47 -8.963 -0.241 -23.954 1.00 55.30 C ATOM 674 O ARG A 47 -9.060 -1.380 -23.497 1.00 40.12 O ATOM 675 CB ARG A 47 -6.639 -0.415 -24.862 1.00 30.22 C ATOM 676 CG ARG A 47 -5.360 0.305 -25.254 1.00 44.41 C ATOM 677 CD ARG A 47 -4.162 -0.227 -24.483 1.00 44.23 C ATOM 678 NE ARG A 47 -2.915 -0.062 -25.227 1.00 34.43 N ATOM 679 CZ ARG A 47 -2.575 -0.816 -26.266 1.00 42.02 C ATOM 680 NH1 ARG A 47 -3.383 -1.781 -26.683 1.00 53.42 N ATOM 681 NH2 ARG A 47 -1.424 -0.605 -26.891 1.00 65.03 N ATOM 0 H ARG A 47 -6.874 -0.121 -22.173 1.00 11.42 H new ATOM 0 HA ARG A 47 -7.742 1.405 -24.561 1.00 4.44 H new ATOM 0 HB2 ARG A 47 -6.383 -1.301 -24.280 1.00 30.22 H new ATOM 0 HB3 ARG A 47 -7.142 -0.761 -25.765 1.00 30.22 H new ATOM 0 HG2 ARG A 47 -5.188 0.186 -26.324 1.00 44.41 H new ATOM 0 HG3 ARG A 47 -5.470 1.373 -25.066 1.00 44.41 H new ATOM 0 HD2 ARG A 47 -4.086 0.293 -23.528 1.00 44.23 H new ATOM 0 HD3 ARG A 47 -4.314 -1.283 -24.260 1.00 44.23 H new ATOM 0 HE ARG A 47 -2.271 0.672 -24.932 1.00 34.43 H new ATOM 0 HH11 ARG A 47 -4.269 -1.946 -26.205 1.00 53.42 H new ATOM 0 HH12 ARG A 47 -3.119 -2.358 -27.481 1.00 53.42 H new ATOM 0 HH21 ARG A 47 -0.800 0.137 -26.574 1.00 65.03 H new ATOM 0 HH22 ARG A 47 -1.163 -1.184 -27.689 1.00 65.03 H new ATOM 695 N PHE A 48 -10.009 0.457 -24.385 1.00 35.40 N ATOM 696 CA PHE A 48 -11.361 -0.089 -24.344 1.00 12.00 C ATOM 697 C PHE A 48 -11.805 -0.547 -25.730 1.00 60.31 C ATOM 698 O PHE A 48 -11.622 0.163 -26.719 1.00 13.21 O ATOM 699 CB PHE A 48 -12.339 0.956 -23.803 1.00 33.35 C ATOM 700 CG PHE A 48 -12.609 0.818 -22.331 1.00 53.34 C ATOM 701 CD1 PHE A 48 -13.608 -0.026 -21.873 1.00 3.13 C ATOM 702 CD2 PHE A 48 -11.865 1.533 -21.407 1.00 65.02 C ATOM 703 CE1 PHE A 48 -13.859 -0.153 -20.520 1.00 24.44 C ATOM 704 CE2 PHE A 48 -12.111 1.409 -20.053 1.00 4.23 C ATOM 705 CZ PHE A 48 -13.108 0.564 -19.608 1.00 54.04 C ATOM 0 H PHE A 48 -9.946 1.401 -24.766 1.00 35.40 H new ATOM 0 HA PHE A 48 -11.357 -0.953 -23.679 1.00 12.00 H new ATOM 0 HB2 PHE A 48 -11.941 1.951 -24.000 1.00 33.35 H new ATOM 0 HB3 PHE A 48 -13.281 0.877 -24.346 1.00 33.35 H new ATOM 0 HD1 PHE A 48 -14.197 -0.591 -22.581 1.00 3.13 H new ATOM 0 HD2 PHE A 48 -11.083 2.195 -21.749 1.00 65.02 H new ATOM 0 HE1 PHE A 48 -14.642 -0.812 -20.175 1.00 24.44 H new ATOM 0 HE2 PHE A 48 -11.524 1.973 -19.343 1.00 4.23 H new ATOM 0 HZ PHE A 48 -13.300 0.464 -18.550 1.00 54.04 H new ATOM 715 N TYR A 49 -12.388 -1.739 -25.794 1.00 20.22 N ATOM 716 CA TYR A 49 -12.855 -2.295 -27.058 1.00 54.22 C ATOM 717 C TYR A 49 -13.887 -3.393 -26.822 1.00 73.52 C ATOM 718 O TYR A 49 -13.669 -4.302 -26.022 1.00 35.23 O ATOM 719 CB TYR A 49 -11.678 -2.850 -27.862 1.00 10.42 C ATOM 720 CG TYR A 49 -10.644 -3.554 -27.013 1.00 2.31 C ATOM 721 CD1 TYR A 49 -10.837 -4.864 -26.592 1.00 14.34 C ATOM 722 CD2 TYR A 49 -9.474 -2.909 -26.631 1.00 64.23 C ATOM 723 CE1 TYR A 49 -9.896 -5.511 -25.815 1.00 44.14 C ATOM 724 CE2 TYR A 49 -8.526 -3.549 -25.856 1.00 62.15 C ATOM 725 CZ TYR A 49 -8.741 -4.850 -25.451 1.00 13.31 C ATOM 726 OH TYR A 49 -7.800 -5.490 -24.678 1.00 32.13 O ATOM 0 H TYR A 49 -12.548 -2.339 -24.985 1.00 20.22 H new ATOM 0 HA TYR A 49 -13.327 -1.493 -27.625 1.00 54.22 H new ATOM 0 HB2 TYR A 49 -12.056 -3.546 -28.611 1.00 10.42 H new ATOM 0 HB3 TYR A 49 -11.199 -2.032 -28.400 1.00 10.42 H new ATOM 0 HD1 TYR A 49 -11.739 -5.386 -26.877 1.00 14.34 H new ATOM 0 HD2 TYR A 49 -9.303 -1.890 -26.945 1.00 64.23 H new ATOM 0 HE1 TYR A 49 -10.063 -6.529 -25.494 1.00 44.14 H new ATOM 0 HE2 TYR A 49 -7.621 -3.033 -25.569 1.00 62.15 H new ATOM 0 HH TYR A 49 -7.047 -4.885 -24.512 1.00 32.13 H new ATOM 736 N GLU A 50 -15.011 -3.302 -27.526 1.00 52.13 N ATOM 737 CA GLU A 50 -16.077 -4.288 -27.394 1.00 14.24 C ATOM 738 C GLU A 50 -15.973 -5.352 -28.483 1.00 13.43 C ATOM 739 O GLU A 50 -16.835 -5.446 -29.358 1.00 25.14 O ATOM 740 CB GLU A 50 -17.445 -3.605 -27.461 1.00 40.13 C ATOM 741 CG GLU A 50 -17.986 -3.190 -26.103 1.00 41.25 C ATOM 742 CD GLU A 50 -18.390 -1.729 -26.058 1.00 75.14 C ATOM 743 OE1 GLU A 50 -18.777 -1.187 -27.115 1.00 1.02 O ATOM 744 OE2 GLU A 50 -18.321 -1.128 -24.966 1.00 23.33 O ATOM 0 H GLU A 50 -15.207 -2.556 -28.193 1.00 52.13 H new ATOM 0 HA GLU A 50 -15.969 -4.774 -26.424 1.00 14.24 H new ATOM 0 HB2 GLU A 50 -17.371 -2.723 -28.098 1.00 40.13 H new ATOM 0 HB3 GLU A 50 -18.156 -4.281 -27.935 1.00 40.13 H new ATOM 0 HG2 GLU A 50 -18.848 -3.809 -25.855 1.00 41.25 H new ATOM 0 HG3 GLU A 50 -17.229 -3.377 -25.342 1.00 41.25 H new ATOM 751 N TYR A 51 -14.913 -6.149 -28.423 1.00 30.45 N ATOM 752 CA TYR A 51 -14.694 -7.205 -29.405 1.00 2.44 C ATOM 753 C TYR A 51 -13.412 -7.974 -29.101 1.00 1.04 C ATOM 754 O TYR A 51 -12.766 -7.746 -28.077 1.00 71.13 O ATOM 755 CB TYR A 51 -14.625 -6.613 -30.813 1.00 44.34 C ATOM 756 CG TYR A 51 -15.745 -7.072 -31.719 1.00 20.11 C ATOM 757 CD1 TYR A 51 -16.060 -8.420 -31.839 1.00 3.12 C ATOM 758 CD2 TYR A 51 -16.490 -6.158 -32.454 1.00 4.42 C ATOM 759 CE1 TYR A 51 -17.082 -8.844 -32.666 1.00 1.15 C ATOM 760 CE2 TYR A 51 -17.515 -6.572 -33.282 1.00 23.51 C ATOM 761 CZ TYR A 51 -17.807 -7.917 -33.385 1.00 4.42 C ATOM 762 OH TYR A 51 -18.827 -8.335 -34.208 1.00 44.23 O ATOM 0 H TYR A 51 -14.191 -6.085 -27.705 1.00 30.45 H new ATOM 0 HA TYR A 51 -15.533 -7.898 -29.350 1.00 2.44 H new ATOM 0 HB2 TYR A 51 -14.649 -5.526 -30.742 1.00 44.34 H new ATOM 0 HB3 TYR A 51 -13.670 -6.882 -31.265 1.00 44.34 H new ATOM 0 HD1 TYR A 51 -15.496 -9.149 -31.276 1.00 3.12 H new ATOM 0 HD2 TYR A 51 -16.263 -5.105 -32.376 1.00 4.42 H new ATOM 0 HE1 TYR A 51 -17.312 -9.896 -32.749 1.00 1.15 H new ATOM 0 HE2 TYR A 51 -18.085 -5.848 -33.845 1.00 23.51 H new ATOM 0 HH TYR A 51 -19.237 -7.558 -34.641 1.00 44.23 H new ATOM 772 N ILE A 52 -13.050 -8.885 -29.997 1.00 60.33 N ATOM 773 CA ILE A 52 -11.845 -9.687 -29.827 1.00 21.41 C ATOM 774 C ILE A 52 -10.604 -8.805 -29.745 1.00 11.23 C ATOM 775 O ILE A 52 -10.620 -7.653 -30.176 1.00 42.11 O ATOM 776 CB ILE A 52 -11.670 -10.693 -30.980 1.00 73.12 C ATOM 777 CG1 ILE A 52 -10.674 -11.786 -30.587 1.00 14.14 C ATOM 778 CG2 ILE A 52 -11.209 -9.978 -32.241 1.00 52.13 C ATOM 779 CD1 ILE A 52 -11.035 -13.153 -31.123 1.00 64.51 C ATOM 0 H ILE A 52 -13.574 -9.086 -30.849 1.00 60.33 H new ATOM 0 HA ILE A 52 -11.961 -10.235 -28.892 1.00 21.41 H new ATOM 0 HB ILE A 52 -12.633 -11.162 -31.182 1.00 73.12 H new ATOM 0 HG12 ILE A 52 -9.684 -11.512 -30.951 1.00 14.14 H new ATOM 0 HG13 ILE A 52 -10.612 -11.836 -29.500 1.00 14.14 H new ATOM 0 HG21 ILE A 52 -11.090 -10.702 -33.047 1.00 52.13 H new ATOM 0 HG22 ILE A 52 -11.951 -9.233 -32.529 1.00 52.13 H new ATOM 0 HG23 ILE A 52 -10.255 -9.485 -32.052 1.00 52.13 H new ATOM 0 HD11 ILE A 52 -10.285 -13.878 -30.805 1.00 64.51 H new ATOM 0 HD12 ILE A 52 -12.011 -13.448 -30.739 1.00 64.51 H new ATOM 0 HD13 ILE A 52 -11.069 -13.120 -32.212 1.00 64.51 H new ATOM 791 N ASN A 53 -9.529 -9.355 -29.189 1.00 52.31 N ATOM 792 CA ASN A 53 -8.278 -8.618 -29.051 1.00 53.34 C ATOM 793 C ASN A 53 -7.775 -8.141 -30.411 1.00 33.14 C ATOM 794 O ASN A 53 -7.127 -7.100 -30.514 1.00 2.41 O ATOM 795 CB ASN A 53 -7.218 -9.493 -28.381 1.00 24.11 C ATOM 796 CG ASN A 53 -6.502 -8.774 -27.254 1.00 13.42 C ATOM 797 OD1 ASN A 53 -6.471 -9.250 -26.119 1.00 71.42 O ATOM 798 ND2 ASN A 53 -5.923 -7.619 -27.562 1.00 73.15 N ATOM 0 H ASN A 53 -9.499 -10.308 -28.827 1.00 52.31 H new ATOM 0 HA ASN A 53 -8.466 -7.745 -28.426 1.00 53.34 H new ATOM 0 HB2 ASN A 53 -7.689 -10.395 -27.991 1.00 24.11 H new ATOM 0 HB3 ASN A 53 -6.489 -9.811 -29.126 1.00 24.11 H new ATOM 0 HD21 ASN A 53 -5.428 -7.089 -26.845 1.00 73.15 H new ATOM 0 HD22 ASN A 53 -5.973 -7.262 -28.516 1.00 73.15 H new ATOM 805 N TYR A 54 -8.079 -8.910 -31.450 1.00 52.24 N ATOM 806 CA TYR A 54 -7.657 -8.568 -32.803 1.00 42.43 C ATOM 807 C TYR A 54 -8.855 -8.488 -33.745 1.00 21.55 C ATOM 808 O TYR A 54 -9.242 -9.481 -34.359 1.00 74.04 O ATOM 809 CB TYR A 54 -6.653 -9.598 -33.323 1.00 31.32 C ATOM 810 CG TYR A 54 -6.720 -10.925 -32.601 1.00 62.43 C ATOM 811 CD1 TYR A 54 -7.813 -11.769 -32.757 1.00 41.03 C ATOM 812 CD2 TYR A 54 -5.691 -11.335 -31.763 1.00 25.41 C ATOM 813 CE1 TYR A 54 -7.879 -12.982 -32.100 1.00 24.14 C ATOM 814 CE2 TYR A 54 -5.747 -12.547 -31.103 1.00 30.35 C ATOM 815 CZ TYR A 54 -6.843 -13.367 -31.274 1.00 31.02 C ATOM 816 OH TYR A 54 -6.904 -14.574 -30.617 1.00 22.44 O ATOM 0 H TYR A 54 -8.616 -9.774 -31.381 1.00 52.24 H new ATOM 0 HA TYR A 54 -7.179 -7.589 -32.770 1.00 42.43 H new ATOM 0 HB2 TYR A 54 -6.831 -9.762 -34.386 1.00 31.32 H new ATOM 0 HB3 TYR A 54 -5.646 -9.192 -33.228 1.00 31.32 H new ATOM 0 HD1 TYR A 54 -8.625 -11.471 -33.403 1.00 41.03 H new ATOM 0 HD2 TYR A 54 -4.832 -10.695 -31.625 1.00 25.41 H new ATOM 0 HE1 TYR A 54 -8.736 -13.625 -32.232 1.00 24.14 H new ATOM 0 HE2 TYR A 54 -4.937 -12.851 -30.457 1.00 30.35 H new ATOM 0 HH TYR A 54 -6.095 -14.694 -30.077 1.00 22.44 H new ATOM 826 N GLY A 55 -9.438 -7.298 -33.852 1.00 25.12 N ATOM 827 CA GLY A 55 -10.585 -7.109 -34.720 1.00 32.43 C ATOM 828 C GLY A 55 -11.785 -6.551 -33.981 1.00 51.40 C ATOM 829 O GLY A 55 -12.811 -7.217 -33.856 1.00 35.22 O ATOM 0 H GLY A 55 -9.136 -6.461 -33.353 1.00 25.12 H new ATOM 0 HA2 GLY A 55 -10.315 -6.433 -35.531 1.00 32.43 H new ATOM 0 HA3 GLY A 55 -10.853 -8.062 -35.175 1.00 32.43 H new ATOM 833 N GLY A 56 -11.656 -5.322 -33.488 1.00 62.34 N ATOM 834 CA GLY A 56 -12.745 -4.696 -32.763 1.00 11.34 C ATOM 835 C GLY A 56 -12.609 -3.187 -32.701 1.00 23.32 C ATOM 836 O GLY A 56 -11.685 -2.617 -33.281 1.00 41.31 O ATOM 0 H GLY A 56 -10.816 -4.750 -33.578 1.00 62.34 H new ATOM 0 HA2 GLY A 56 -13.690 -4.953 -33.241 1.00 11.34 H new ATOM 0 HA3 GLY A 56 -12.780 -5.096 -31.750 1.00 11.34 H new ATOM 840 N ARG A 57 -13.531 -2.540 -31.997 1.00 54.42 N ATOM 841 CA ARG A 57 -13.512 -1.088 -31.864 1.00 44.15 C ATOM 842 C ARG A 57 -12.492 -0.652 -30.816 1.00 52.42 C ATOM 843 O ARG A 57 -12.733 -0.769 -29.615 1.00 13.15 O ATOM 844 CB ARG A 57 -14.901 -0.570 -31.487 1.00 43.11 C ATOM 845 CG ARG A 57 -14.935 0.920 -31.189 1.00 42.20 C ATOM 846 CD ARG A 57 -14.957 1.188 -29.692 1.00 45.54 C ATOM 847 NE ARG A 57 -15.860 2.282 -29.345 1.00 51.25 N ATOM 848 CZ ARG A 57 -15.640 3.550 -29.676 1.00 31.14 C ATOM 849 NH1 ARG A 57 -14.553 3.882 -30.358 1.00 23.34 N ATOM 850 NH2 ARG A 57 -16.509 4.489 -29.324 1.00 33.22 N ATOM 0 H ARG A 57 -14.301 -2.998 -31.510 1.00 54.42 H new ATOM 0 HA ARG A 57 -13.223 -0.664 -32.826 1.00 44.15 H new ATOM 0 HB2 ARG A 57 -15.593 -0.785 -32.301 1.00 43.11 H new ATOM 0 HB3 ARG A 57 -15.258 -1.115 -30.613 1.00 43.11 H new ATOM 0 HG2 ARG A 57 -14.064 1.401 -31.633 1.00 42.20 H new ATOM 0 HG3 ARG A 57 -15.816 1.365 -31.652 1.00 42.20 H new ATOM 0 HD2 ARG A 57 -15.264 0.284 -29.166 1.00 45.54 H new ATOM 0 HD3 ARG A 57 -13.950 1.428 -29.352 1.00 45.54 H new ATOM 0 HE ARG A 57 -16.706 2.061 -28.820 1.00 51.25 H new ATOM 0 HH11 ARG A 57 -13.882 3.163 -30.630 1.00 23.34 H new ATOM 0 HH12 ARG A 57 -14.387 4.856 -30.611 1.00 23.34 H new ATOM 0 HH21 ARG A 57 -17.347 4.238 -28.799 1.00 33.22 H new ATOM 0 HH22 ARG A 57 -16.339 5.462 -29.578 1.00 33.22 H new ATOM 864 N TYR A 58 -11.353 -0.149 -31.280 1.00 13.15 N ATOM 865 CA TYR A 58 -10.296 0.302 -30.382 1.00 50.05 C ATOM 866 C TYR A 58 -10.562 1.724 -29.899 1.00 45.51 C ATOM 867 O TYR A 58 -10.807 2.628 -30.699 1.00 21.25 O ATOM 868 CB TYR A 58 -8.939 0.235 -31.085 1.00 51.33 C ATOM 869 CG TYR A 58 -7.842 0.976 -30.355 1.00 23.42 C ATOM 870 CD1 TYR A 58 -7.693 0.857 -28.978 1.00 54.15 C ATOM 871 CD2 TYR A 58 -6.952 1.793 -31.041 1.00 53.24 C ATOM 872 CE1 TYR A 58 -6.693 1.532 -28.307 1.00 43.30 C ATOM 873 CE2 TYR A 58 -5.948 2.471 -30.378 1.00 44.14 C ATOM 874 CZ TYR A 58 -5.822 2.338 -29.011 1.00 72.23 C ATOM 875 OH TYR A 58 -4.823 3.011 -28.346 1.00 51.03 O ATOM 0 H TYR A 58 -11.138 -0.043 -32.272 1.00 13.15 H new ATOM 0 HA TYR A 58 -10.282 -0.360 -29.516 1.00 50.05 H new ATOM 0 HB2 TYR A 58 -8.648 -0.810 -31.197 1.00 51.33 H new ATOM 0 HB3 TYR A 58 -9.039 0.647 -32.089 1.00 51.33 H new ATOM 0 HD1 TYR A 58 -8.371 0.226 -28.423 1.00 54.15 H new ATOM 0 HD2 TYR A 58 -7.047 1.900 -32.112 1.00 53.24 H new ATOM 0 HE1 TYR A 58 -6.593 1.430 -27.237 1.00 43.30 H new ATOM 0 HE2 TYR A 58 -5.265 3.102 -30.927 1.00 44.14 H new ATOM 0 HH TYR A 58 -4.298 3.533 -28.987 1.00 51.03 H new ATOM 885 N TRP A 59 -10.510 1.915 -28.586 1.00 22.12 N ATOM 886 CA TRP A 59 -10.744 3.227 -27.994 1.00 40.42 C ATOM 887 C TRP A 59 -10.047 3.348 -26.644 1.00 20.04 C ATOM 888 O TRP A 59 -10.521 2.815 -25.640 1.00 71.43 O ATOM 889 CB TRP A 59 -12.244 3.476 -27.832 1.00 14.02 C ATOM 890 CG TRP A 59 -12.571 4.438 -26.730 1.00 33.22 C ATOM 891 CD1 TRP A 59 -12.097 5.710 -26.585 1.00 2.21 C ATOM 892 CD2 TRP A 59 -13.442 4.203 -25.618 1.00 54.40 C ATOM 893 NE1 TRP A 59 -12.621 6.281 -25.450 1.00 25.10 N ATOM 894 CE2 TRP A 59 -13.450 5.377 -24.840 1.00 4.44 C ATOM 895 CE3 TRP A 59 -14.219 3.117 -25.205 1.00 44.14 C ATOM 896 CZ2 TRP A 59 -14.202 5.492 -23.674 1.00 3.45 C ATOM 897 CZ3 TRP A 59 -14.964 3.233 -24.048 1.00 32.33 C ATOM 898 CH2 TRP A 59 -14.952 4.413 -23.293 1.00 52.30 C ATOM 0 H TRP A 59 -10.308 1.178 -27.911 1.00 22.12 H new ATOM 0 HA TRP A 59 -10.328 3.979 -28.664 1.00 40.42 H new ATOM 0 HB2 TRP A 59 -12.645 3.860 -28.770 1.00 14.02 H new ATOM 0 HB3 TRP A 59 -12.743 2.527 -27.636 1.00 14.02 H new ATOM 0 HD1 TRP A 59 -11.411 6.196 -27.263 1.00 2.21 H new ATOM 0 HE1 TRP A 59 -12.425 7.225 -25.116 1.00 25.10 H new ATOM 0 HE3 TRP A 59 -14.236 2.203 -25.781 1.00 44.14 H new ATOM 0 HZ2 TRP A 59 -14.194 6.401 -23.091 1.00 3.45 H new ATOM 0 HZ3 TRP A 59 -15.567 2.399 -23.719 1.00 32.33 H new ATOM 0 HH2 TRP A 59 -15.546 4.472 -22.393 1.00 52.30 H new ATOM 909 N ASP A 60 -8.920 4.051 -26.625 1.00 13.41 N ATOM 910 CA ASP A 60 -8.159 4.243 -25.396 1.00 63.21 C ATOM 911 C ASP A 60 -8.365 5.649 -24.842 1.00 54.00 C ATOM 912 O ASP A 60 -8.776 6.558 -25.564 1.00 51.34 O ATOM 913 CB ASP A 60 -6.671 3.995 -25.649 1.00 61.50 C ATOM 914 CG ASP A 60 -6.103 4.914 -26.712 1.00 50.12 C ATOM 915 OD1 ASP A 60 -6.607 4.883 -27.855 1.00 1.13 O ATOM 916 OD2 ASP A 60 -5.155 5.665 -26.402 1.00 13.33 O ATOM 0 H ASP A 60 -8.513 4.497 -27.447 1.00 13.41 H new ATOM 0 HA ASP A 60 -8.520 3.525 -24.659 1.00 63.21 H new ATOM 0 HB2 ASP A 60 -6.119 4.135 -24.719 1.00 61.50 H new ATOM 0 HB3 ASP A 60 -6.525 2.959 -25.953 1.00 61.50 H new ATOM 921 N LEU A 61 -8.080 5.821 -23.556 1.00 64.42 N ATOM 922 CA LEU A 61 -8.235 7.116 -22.904 1.00 40.31 C ATOM 923 C LEU A 61 -7.412 7.183 -21.622 1.00 25.22 C ATOM 924 O LEU A 61 -7.032 6.155 -21.062 1.00 3.41 O ATOM 925 CB LEU A 61 -9.709 7.378 -22.591 1.00 52.31 C ATOM 926 CG LEU A 61 -10.260 6.699 -21.337 1.00 72.41 C ATOM 927 CD1 LEU A 61 -10.730 7.737 -20.330 1.00 22.21 C ATOM 928 CD2 LEU A 61 -11.396 5.752 -21.699 1.00 4.02 C ATOM 0 H LEU A 61 -7.740 5.079 -22.944 1.00 64.42 H new ATOM 0 HA LEU A 61 -7.872 7.884 -23.587 1.00 40.31 H new ATOM 0 HB2 LEU A 61 -9.853 8.454 -22.490 1.00 52.31 H new ATOM 0 HB3 LEU A 61 -10.304 7.056 -23.446 1.00 52.31 H new ATOM 0 HG LEU A 61 -9.459 6.117 -20.881 1.00 72.41 H new ATOM 0 HD11 LEU A 61 -11.119 7.235 -19.444 1.00 22.21 H new ATOM 0 HD12 LEU A 61 -9.893 8.375 -20.047 1.00 22.21 H new ATOM 0 HD13 LEU A 61 -11.516 8.347 -20.776 1.00 22.21 H new ATOM 0 HD21 LEU A 61 -11.776 5.277 -20.794 1.00 4.02 H new ATOM 0 HD22 LEU A 61 -12.198 6.313 -22.179 1.00 4.02 H new ATOM 0 HD23 LEU A 61 -11.028 4.987 -22.383 1.00 4.02 H new ATOM 940 N GLY A 62 -7.141 8.400 -21.161 1.00 2.33 N ATOM 941 CA GLY A 62 -6.366 8.578 -19.947 1.00 11.34 C ATOM 942 C GLY A 62 -7.228 8.554 -18.700 1.00 31.30 C ATOM 943 O GLY A 62 -8.371 8.095 -18.718 1.00 45.23 O ATOM 0 H GLY A 62 -7.444 9.266 -21.607 1.00 2.33 H new ATOM 0 HA2 GLY A 62 -5.615 7.791 -19.881 1.00 11.34 H new ATOM 0 HA3 GLY A 62 -5.831 9.526 -19.997 1.00 11.34 H new ATOM 947 N PRO A 63 -6.677 9.055 -17.585 1.00 1.13 N ATOM 948 CA PRO A 63 -7.385 9.099 -16.302 1.00 55.12 C ATOM 949 C PRO A 63 -8.580 10.046 -16.332 1.00 41.50 C ATOM 950 O PRO A 63 -8.422 11.263 -16.239 1.00 51.05 O ATOM 951 CB PRO A 63 -6.322 9.610 -15.327 1.00 31.23 C ATOM 952 CG PRO A 63 -5.350 10.350 -16.179 1.00 60.43 C ATOM 953 CD PRO A 63 -5.320 9.618 -17.490 1.00 4.41 C ATOM 0 HA PRO A 63 -7.799 8.128 -16.031 1.00 55.12 H new ATOM 0 HB2 PRO A 63 -6.760 10.260 -14.570 1.00 31.23 H new ATOM 0 HB3 PRO A 63 -5.840 8.787 -14.800 1.00 31.23 H new ATOM 0 HG2 PRO A 63 -5.659 11.386 -16.316 1.00 60.43 H new ATOM 0 HG3 PRO A 63 -4.362 10.370 -15.719 1.00 60.43 H new ATOM 0 HD2 PRO A 63 -5.102 10.288 -18.322 1.00 4.41 H new ATOM 0 HD3 PRO A 63 -4.558 8.839 -17.500 1.00 4.41 H new ATOM 961 N GLY A 64 -9.776 9.480 -16.461 1.00 61.05 N ATOM 962 CA GLY A 64 -10.980 10.289 -16.501 1.00 2.52 C ATOM 963 C GLY A 64 -12.239 9.465 -16.324 1.00 71.52 C ATOM 964 O GLY A 64 -12.223 8.249 -16.512 1.00 71.44 O ATOM 0 H GLY A 64 -9.933 8.475 -16.539 1.00 61.05 H new ATOM 0 HA2 GLY A 64 -10.932 11.045 -15.718 1.00 2.52 H new ATOM 0 HA3 GLY A 64 -11.027 10.818 -17.453 1.00 2.52 H new ATOM 968 N GLU A 65 -13.333 10.127 -15.960 1.00 43.10 N ATOM 969 CA GLU A 65 -14.605 9.445 -15.756 1.00 14.44 C ATOM 970 C GLU A 65 -15.398 9.371 -17.057 1.00 51.34 C ATOM 971 O GLU A 65 -15.202 10.182 -17.963 1.00 60.34 O ATOM 972 CB GLU A 65 -15.428 10.165 -14.685 1.00 33.22 C ATOM 973 CG GLU A 65 -16.507 9.296 -14.060 1.00 24.42 C ATOM 974 CD GLU A 65 -17.894 9.887 -14.214 1.00 35.31 C ATOM 975 OE1 GLU A 65 -18.039 11.115 -14.036 1.00 63.53 O ATOM 976 OE2 GLU A 65 -18.836 9.122 -14.512 1.00 2.33 O ATOM 0 H GLU A 65 -13.364 11.134 -15.801 1.00 43.10 H new ATOM 0 HA GLU A 65 -14.394 8.429 -15.421 1.00 14.44 H new ATOM 0 HB2 GLU A 65 -14.758 10.518 -13.901 1.00 33.22 H new ATOM 0 HB3 GLU A 65 -15.894 11.046 -15.127 1.00 33.22 H new ATOM 0 HG2 GLU A 65 -16.484 8.308 -14.520 1.00 24.42 H new ATOM 0 HG3 GLU A 65 -16.290 9.160 -13.001 1.00 24.42 H new ATOM 983 N TYR A 66 -16.293 8.394 -17.143 1.00 33.30 N ATOM 984 CA TYR A 66 -17.114 8.211 -18.334 1.00 61.22 C ATOM 985 C TYR A 66 -18.528 7.778 -17.960 1.00 72.33 C ATOM 986 O TYR A 66 -18.721 6.947 -17.073 1.00 22.40 O ATOM 987 CB TYR A 66 -16.479 7.173 -19.262 1.00 13.40 C ATOM 988 CG TYR A 66 -17.009 7.222 -20.677 1.00 73.12 C ATOM 989 CD1 TYR A 66 -17.084 8.424 -21.371 1.00 33.42 C ATOM 990 CD2 TYR A 66 -17.436 6.067 -21.320 1.00 70.34 C ATOM 991 CE1 TYR A 66 -17.568 8.473 -22.664 1.00 15.13 C ATOM 992 CE2 TYR A 66 -17.920 6.107 -22.614 1.00 32.44 C ATOM 993 CZ TYR A 66 -17.985 7.312 -23.281 1.00 23.01 C ATOM 994 OH TYR A 66 -18.468 7.356 -24.569 1.00 3.03 O ATOM 0 H TYR A 66 -16.469 7.716 -16.402 1.00 33.30 H new ATOM 0 HA TYR A 66 -17.172 9.167 -18.855 1.00 61.22 H new ATOM 0 HB2 TYR A 66 -15.400 7.327 -19.281 1.00 13.40 H new ATOM 0 HB3 TYR A 66 -16.652 6.178 -18.852 1.00 13.40 H new ATOM 0 HD1 TYR A 66 -16.758 9.335 -20.891 1.00 33.42 H new ATOM 0 HD2 TYR A 66 -17.389 5.122 -20.800 1.00 70.34 H new ATOM 0 HE1 TYR A 66 -17.620 9.415 -23.189 1.00 15.13 H new ATOM 0 HE2 TYR A 66 -18.246 5.199 -23.100 1.00 32.44 H new ATOM 0 HH TYR A 66 -17.722 7.281 -25.201 1.00 3.03 H new ATOM 1004 N SER A 67 -19.515 8.347 -18.645 1.00 1.31 N ATOM 1005 CA SER A 67 -20.913 8.024 -18.384 1.00 24.31 C ATOM 1006 C SER A 67 -21.791 8.415 -19.568 1.00 52.31 C ATOM 1007 O SER A 67 -22.857 9.007 -19.396 1.00 3.13 O ATOM 1008 CB SER A 67 -21.395 8.736 -17.119 1.00 32.43 C ATOM 1009 OG SER A 67 -21.654 10.106 -17.372 1.00 34.42 O ATOM 0 H SER A 67 -19.372 9.034 -19.385 1.00 1.31 H new ATOM 0 HA SER A 67 -20.990 6.947 -18.237 1.00 24.31 H new ATOM 0 HB2 SER A 67 -22.300 8.254 -16.749 1.00 32.43 H new ATOM 0 HB3 SER A 67 -20.642 8.644 -16.337 1.00 32.43 H new ATOM 0 HG SER A 67 -22.428 10.188 -17.968 1.00 34.42 H new ATOM 1015 N SER A 68 -21.336 8.080 -20.771 1.00 43.51 N ATOM 1016 CA SER A 68 -22.077 8.400 -21.985 1.00 73.14 C ATOM 1017 C SER A 68 -23.120 7.327 -22.283 1.00 62.44 C ATOM 1018 O SER A 68 -23.185 6.302 -21.603 1.00 54.53 O ATOM 1019 CB SER A 68 -21.120 8.540 -23.171 1.00 12.44 C ATOM 1020 OG SER A 68 -20.214 9.611 -22.970 1.00 63.10 O ATOM 0 H SER A 68 -20.458 7.587 -20.931 1.00 43.51 H new ATOM 0 HA SER A 68 -22.591 9.349 -21.828 1.00 73.14 H new ATOM 0 HB2 SER A 68 -20.566 7.611 -23.307 1.00 12.44 H new ATOM 0 HB3 SER A 68 -21.690 8.708 -24.085 1.00 12.44 H new ATOM 0 HG SER A 68 -19.439 9.293 -22.461 1.00 63.10 H new ATOM 1026 N VAL A 69 -23.934 7.569 -23.306 1.00 12.24 N ATOM 1027 CA VAL A 69 -24.974 6.624 -23.696 1.00 3.31 C ATOM 1028 C VAL A 69 -25.388 6.832 -25.148 1.00 53.22 C ATOM 1029 O VAL A 69 -26.483 6.442 -25.553 1.00 23.20 O ATOM 1030 CB VAL A 69 -26.216 6.753 -22.795 1.00 55.42 C ATOM 1031 CG1 VAL A 69 -26.987 8.023 -23.126 1.00 63.55 C ATOM 1032 CG2 VAL A 69 -27.106 5.528 -22.937 1.00 32.42 C ATOM 0 H VAL A 69 -23.893 8.411 -23.880 1.00 12.24 H new ATOM 0 HA VAL A 69 -24.554 5.625 -23.581 1.00 3.31 H new ATOM 0 HB VAL A 69 -25.886 6.817 -21.758 1.00 55.42 H new ATOM 0 HG11 VAL A 69 -27.861 8.097 -22.479 1.00 63.55 H new ATOM 0 HG12 VAL A 69 -26.345 8.890 -22.969 1.00 63.55 H new ATOM 0 HG13 VAL A 69 -27.308 7.993 -24.167 1.00 63.55 H new ATOM 0 HG21 VAL A 69 -27.979 5.636 -22.293 1.00 32.42 H new ATOM 0 HG22 VAL A 69 -27.429 5.431 -23.973 1.00 32.42 H new ATOM 0 HG23 VAL A 69 -26.549 4.638 -22.646 1.00 32.42 H new ATOM 1042 N GLU A 70 -24.506 7.450 -25.927 1.00 64.54 N ATOM 1043 CA GLU A 70 -24.781 7.709 -27.336 1.00 1.45 C ATOM 1044 C GLU A 70 -23.561 8.313 -28.026 1.00 32.00 C ATOM 1045 O GLU A 70 -23.691 9.103 -28.961 1.00 15.23 O ATOM 1046 CB GLU A 70 -25.979 8.650 -27.479 1.00 11.24 C ATOM 1047 CG GLU A 70 -25.760 10.016 -26.849 1.00 64.41 C ATOM 1048 CD GLU A 70 -26.774 11.042 -27.314 1.00 12.23 C ATOM 1049 OE1 GLU A 70 -27.595 10.710 -28.194 1.00 34.44 O ATOM 1050 OE2 GLU A 70 -26.747 12.179 -26.796 1.00 62.35 O ATOM 0 H GLU A 70 -23.596 7.780 -25.607 1.00 64.54 H new ATOM 0 HA GLU A 70 -25.015 6.758 -27.816 1.00 1.45 H new ATOM 0 HB2 GLU A 70 -26.204 8.780 -28.538 1.00 11.24 H new ATOM 0 HB3 GLU A 70 -26.852 8.184 -27.022 1.00 11.24 H new ATOM 0 HG2 GLU A 70 -25.813 9.924 -25.764 1.00 64.41 H new ATOM 0 HG3 GLU A 70 -24.757 10.367 -27.091 1.00 64.41 H new ATOM 1057 N SER A 71 -22.376 7.935 -27.558 1.00 30.21 N ATOM 1058 CA SER A 71 -21.132 8.441 -28.127 1.00 15.35 C ATOM 1059 C SER A 71 -19.985 7.466 -27.879 1.00 53.51 C ATOM 1060 O SER A 71 -18.815 7.846 -27.914 1.00 12.24 O ATOM 1061 CB SER A 71 -20.793 9.808 -27.529 1.00 12.12 C ATOM 1062 OG SER A 71 -19.598 10.326 -28.087 1.00 0.24 O ATOM 0 H SER A 71 -22.251 7.280 -26.786 1.00 30.21 H new ATOM 0 HA SER A 71 -21.269 8.547 -29.203 1.00 15.35 H new ATOM 0 HB2 SER A 71 -21.614 10.502 -27.711 1.00 12.12 H new ATOM 0 HB3 SER A 71 -20.685 9.719 -26.448 1.00 12.12 H new ATOM 0 HG SER A 71 -18.926 9.615 -28.138 1.00 0.24 H new ATOM 1068 N ALA A 72 -20.330 6.208 -27.630 1.00 33.45 N ATOM 1069 CA ALA A 72 -19.331 5.177 -27.378 1.00 63.02 C ATOM 1070 C ALA A 72 -19.662 3.895 -28.134 1.00 32.31 C ATOM 1071 O ALA A 72 -19.195 2.814 -27.777 1.00 62.05 O ATOM 1072 CB ALA A 72 -19.222 4.900 -25.886 1.00 72.51 C ATOM 0 H ALA A 72 -21.294 5.878 -27.597 1.00 33.45 H new ATOM 0 HA ALA A 72 -18.370 5.542 -27.739 1.00 63.02 H new ATOM 0 HB1 ALA A 72 -18.472 4.128 -25.713 1.00 72.51 H new ATOM 0 HB2 ALA A 72 -18.929 5.813 -25.367 1.00 72.51 H new ATOM 0 HB3 ALA A 72 -20.186 4.561 -25.508 1.00 72.51 H new ATOM 1078 N GLY A 73 -20.473 4.022 -29.180 1.00 13.21 N ATOM 1079 CA GLY A 73 -20.854 2.865 -29.969 1.00 11.23 C ATOM 1080 C GLY A 73 -21.644 1.851 -29.166 1.00 32.20 C ATOM 1081 O GLY A 73 -21.104 1.204 -28.268 1.00 72.43 O ATOM 0 H GLY A 73 -20.873 4.906 -29.495 1.00 13.21 H new ATOM 0 HA2 GLY A 73 -21.448 3.191 -30.823 1.00 11.23 H new ATOM 0 HA3 GLY A 73 -19.958 2.390 -30.368 1.00 11.23 H new ATOM 1085 N ILE A 74 -22.926 1.713 -29.488 1.00 21.32 N ATOM 1086 CA ILE A 74 -23.791 0.770 -28.789 1.00 51.33 C ATOM 1087 C ILE A 74 -24.330 -0.292 -29.742 1.00 41.50 C ATOM 1088 O ILE A 74 -25.531 -0.382 -29.995 1.00 53.34 O ATOM 1089 CB ILE A 74 -24.976 1.487 -28.115 1.00 4.14 C ATOM 1090 CG1 ILE A 74 -24.481 2.694 -27.315 1.00 0.02 C ATOM 1091 CG2 ILE A 74 -25.735 0.524 -27.215 1.00 22.53 C ATOM 1092 CD1 ILE A 74 -25.591 3.464 -26.634 1.00 51.14 C ATOM 0 H ILE A 74 -23.388 2.242 -30.228 1.00 21.32 H new ATOM 0 HA ILE A 74 -23.182 0.291 -28.022 1.00 51.33 H new ATOM 0 HB ILE A 74 -25.656 1.842 -28.890 1.00 4.14 H new ATOM 0 HG12 ILE A 74 -23.771 2.354 -26.562 1.00 0.02 H new ATOM 0 HG13 ILE A 74 -23.941 3.365 -27.982 1.00 0.02 H new ATOM 0 HG21 ILE A 74 -26.569 1.045 -26.746 1.00 22.53 H new ATOM 0 HG22 ILE A 74 -26.115 -0.307 -27.809 1.00 22.53 H new ATOM 0 HG23 ILE A 74 -25.066 0.143 -26.444 1.00 22.53 H new ATOM 0 HD11 ILE A 74 -25.167 4.305 -26.086 1.00 51.14 H new ATOM 0 HD12 ILE A 74 -26.290 3.835 -27.384 1.00 51.14 H new ATOM 0 HD13 ILE A 74 -26.117 2.808 -25.941 1.00 51.14 H new ATOM 1104 N PRO A 75 -23.421 -1.117 -30.282 1.00 74.25 N ATOM 1105 CA PRO A 75 -23.782 -2.190 -31.214 1.00 50.02 C ATOM 1106 C PRO A 75 -24.063 -3.508 -30.500 1.00 45.22 C ATOM 1107 O PRO A 75 -25.173 -4.035 -30.563 1.00 54.33 O ATOM 1108 CB PRO A 75 -22.544 -2.317 -32.105 1.00 23.31 C ATOM 1109 CG PRO A 75 -21.742 -1.095 -31.816 1.00 72.23 C ATOM 1110 CD PRO A 75 -21.972 -1.067 -30.025 1.00 74.42 C ATOM 0 HA PRO A 75 -24.697 -1.964 -31.762 1.00 50.02 H new ATOM 0 HB2 PRO A 75 -21.982 -3.223 -31.876 1.00 23.31 H new ATOM 0 HB3 PRO A 75 -22.818 -2.370 -33.159 1.00 23.31 H new ATOM 0 HG2 PRO A 75 -20.697 -1.192 -32.110 1.00 72.23 H new ATOM 0 HG3 PRO A 75 -22.130 -0.204 -32.309 1.00 72.23 H new ATOM 0 HD2 PRO A 75 -21.561 -1.921 -29.486 1.00 74.42 H new ATOM 0 HD3 PRO A 75 -21.616 -0.169 -29.520 1.00 74.42 H new ATOM 1118 N ASP A 76 -23.049 -4.035 -29.822 1.00 14.14 N ATOM 1119 CA ASP A 76 -23.188 -5.291 -29.094 1.00 22.10 C ATOM 1120 C ASP A 76 -22.089 -5.436 -28.045 1.00 53.44 C ATOM 1121 O ASP A 76 -20.928 -5.122 -28.302 1.00 62.00 O ATOM 1122 CB ASP A 76 -23.144 -6.474 -30.063 1.00 1.22 C ATOM 1123 CG ASP A 76 -22.143 -6.268 -31.183 1.00 54.30 C ATOM 1124 OD1 ASP A 76 -21.093 -5.642 -30.932 1.00 3.32 O ATOM 1125 OD2 ASP A 76 -22.411 -6.732 -32.311 1.00 54.22 O ATOM 0 H ASP A 76 -22.123 -3.612 -29.761 1.00 14.14 H new ATOM 0 HA ASP A 76 -24.152 -5.283 -28.585 1.00 22.10 H new ATOM 0 HB2 ASP A 76 -22.889 -7.380 -29.514 1.00 1.22 H new ATOM 0 HB3 ASP A 76 -24.135 -6.628 -30.489 1.00 1.22 H new ATOM 1130 N ASN A 77 -22.466 -5.911 -26.863 1.00 21.41 N ATOM 1131 CA ASN A 77 -21.513 -6.096 -25.774 1.00 42.35 C ATOM 1132 C ASN A 77 -20.916 -7.499 -25.806 1.00 61.40 C ATOM 1133 O ASN A 77 -20.711 -8.122 -24.764 1.00 14.32 O ATOM 1134 CB ASN A 77 -22.193 -5.849 -24.426 1.00 44.32 C ATOM 1135 CG ASN A 77 -21.318 -5.056 -23.474 1.00 62.12 C ATOM 1136 OD1 ASN A 77 -21.659 -3.940 -23.083 1.00 54.12 O ATOM 1137 ND2 ASN A 77 -20.182 -5.631 -23.097 1.00 21.41 N ATOM 0 H ASN A 77 -23.424 -6.175 -26.634 1.00 21.41 H new ATOM 0 HA ASN A 77 -20.706 -5.375 -25.904 1.00 42.35 H new ATOM 0 HB2 ASN A 77 -23.129 -5.313 -24.587 1.00 44.32 H new ATOM 0 HB3 ASN A 77 -22.448 -6.806 -23.970 1.00 44.32 H new ATOM 0 HD21 ASN A 77 -19.552 -5.146 -22.458 1.00 21.41 H new ATOM 0 HD22 ASN A 77 -19.939 -6.558 -23.446 1.00 21.41 H new ATOM 1144 N SER A 78 -20.638 -7.992 -27.009 1.00 50.51 N ATOM 1145 CA SER A 78 -20.067 -9.323 -27.177 1.00 54.13 C ATOM 1146 C SER A 78 -18.544 -9.257 -27.241 1.00 35.11 C ATOM 1147 O SER A 78 -17.976 -8.346 -27.843 1.00 55.35 O ATOM 1148 CB SER A 78 -20.614 -9.979 -28.447 1.00 13.43 C ATOM 1149 OG SER A 78 -20.020 -11.247 -28.663 1.00 3.35 O ATOM 0 H SER A 78 -20.799 -7.489 -27.882 1.00 50.51 H new ATOM 0 HA SER A 78 -20.351 -9.925 -26.314 1.00 54.13 H new ATOM 0 HB2 SER A 78 -21.695 -10.090 -28.366 1.00 13.43 H new ATOM 0 HB3 SER A 78 -20.423 -9.334 -29.304 1.00 13.43 H new ATOM 0 HG SER A 78 -20.388 -11.646 -29.479 1.00 3.35 H new ATOM 1155 N ILE A 79 -17.890 -10.229 -26.615 1.00 70.41 N ATOM 1156 CA ILE A 79 -16.433 -10.283 -26.601 1.00 75.20 C ATOM 1157 C ILE A 79 -15.838 -8.947 -26.169 1.00 32.41 C ATOM 1158 O ILE A 79 -14.875 -8.464 -26.764 1.00 13.30 O ATOM 1159 CB ILE A 79 -15.871 -10.660 -27.984 1.00 43.22 C ATOM 1160 CG1 ILE A 79 -16.709 -11.774 -28.614 1.00 55.43 C ATOM 1161 CG2 ILE A 79 -14.416 -11.088 -27.865 1.00 44.13 C ATOM 1162 CD1 ILE A 79 -16.220 -12.200 -29.981 1.00 3.34 C ATOM 0 H ILE A 79 -18.345 -10.990 -26.111 1.00 70.41 H new ATOM 0 HA ILE A 79 -16.152 -11.052 -25.882 1.00 75.20 H new ATOM 0 HB ILE A 79 -15.921 -9.784 -28.631 1.00 43.22 H new ATOM 0 HG12 ILE A 79 -16.706 -12.639 -27.951 1.00 55.43 H new ATOM 0 HG13 ILE A 79 -17.743 -11.438 -28.695 1.00 55.43 H new ATOM 0 HG21 ILE A 79 -14.032 -11.352 -28.851 1.00 44.13 H new ATOM 0 HG22 ILE A 79 -13.828 -10.267 -27.454 1.00 44.13 H new ATOM 0 HG23 ILE A 79 -14.344 -11.952 -27.205 1.00 44.13 H new ATOM 0 HD11 ILE A 79 -16.861 -12.993 -30.366 1.00 3.34 H new ATOM 0 HD12 ILE A 79 -16.249 -11.348 -30.660 1.00 3.34 H new ATOM 0 HD13 ILE A 79 -15.197 -12.567 -29.903 1.00 3.34 H new ATOM 1174 N SER A 80 -16.417 -8.357 -25.128 1.00 40.33 N ATOM 1175 CA SER A 80 -15.945 -7.075 -24.617 1.00 31.31 C ATOM 1176 C SER A 80 -14.751 -7.268 -23.688 1.00 5.14 C ATOM 1177 O SER A 80 -14.731 -8.184 -22.865 1.00 41.24 O ATOM 1178 CB SER A 80 -17.071 -6.352 -23.875 1.00 72.34 C ATOM 1179 OG SER A 80 -18.016 -5.814 -24.784 1.00 12.44 O ATOM 0 H SER A 80 -17.213 -8.746 -24.622 1.00 40.33 H new ATOM 0 HA SER A 80 -15.630 -6.467 -25.465 1.00 31.31 H new ATOM 0 HB2 SER A 80 -17.568 -7.045 -23.197 1.00 72.34 H new ATOM 0 HB3 SER A 80 -16.653 -5.552 -23.264 1.00 72.34 H new ATOM 1185 N SER A 81 -13.756 -6.397 -23.825 1.00 65.31 N ATOM 1186 CA SER A 81 -12.555 -6.473 -23.001 1.00 43.33 C ATOM 1187 C SER A 81 -11.817 -5.137 -22.993 1.00 64.55 C ATOM 1188 O SER A 81 -11.901 -4.363 -23.947 1.00 12.45 O ATOM 1189 CB SER A 81 -11.628 -7.578 -23.513 1.00 12.52 C ATOM 1190 OG SER A 81 -11.504 -8.620 -22.561 1.00 74.43 O ATOM 0 H SER A 81 -13.758 -5.631 -24.498 1.00 65.31 H new ATOM 0 HA SER A 81 -12.858 -6.707 -21.981 1.00 43.33 H new ATOM 0 HB2 SER A 81 -12.018 -7.980 -24.448 1.00 12.52 H new ATOM 0 HB3 SER A 81 -10.645 -7.161 -23.731 1.00 12.52 H new ATOM 0 HG SER A 81 -10.908 -9.314 -22.912 1.00 74.43 H new ATOM 1196 N PHE A 82 -11.092 -4.875 -21.911 1.00 34.35 N ATOM 1197 CA PHE A 82 -10.339 -3.634 -21.777 1.00 15.45 C ATOM 1198 C PHE A 82 -9.187 -3.800 -20.790 1.00 71.12 C ATOM 1199 O PHE A 82 -9.377 -4.279 -19.672 1.00 72.43 O ATOM 1200 CB PHE A 82 -11.260 -2.501 -21.316 1.00 61.33 C ATOM 1201 CG PHE A 82 -11.760 -2.669 -19.910 1.00 23.11 C ATOM 1202 CD1 PHE A 82 -12.736 -3.607 -19.615 1.00 11.11 C ATOM 1203 CD2 PHE A 82 -11.253 -1.890 -18.883 1.00 3.42 C ATOM 1204 CE1 PHE A 82 -13.198 -3.763 -18.322 1.00 12.43 C ATOM 1205 CE2 PHE A 82 -11.711 -2.041 -17.587 1.00 64.25 C ATOM 1206 CZ PHE A 82 -12.684 -2.980 -17.307 1.00 0.25 C ATOM 0 H PHE A 82 -11.010 -5.506 -21.114 1.00 34.35 H new ATOM 0 HA PHE A 82 -9.925 -3.383 -22.753 1.00 15.45 H new ATOM 0 HB2 PHE A 82 -10.724 -1.555 -21.392 1.00 61.33 H new ATOM 0 HB3 PHE A 82 -12.113 -2.440 -21.992 1.00 61.33 H new ATOM 0 HD1 PHE A 82 -13.140 -4.223 -20.404 1.00 11.11 H new ATOM 0 HD2 PHE A 82 -10.491 -1.156 -19.097 1.00 3.42 H new ATOM 0 HE1 PHE A 82 -13.960 -4.497 -18.105 1.00 12.43 H new ATOM 0 HE2 PHE A 82 -11.309 -1.426 -16.796 1.00 64.25 H new ATOM 0 HZ PHE A 82 -13.043 -3.102 -16.296 1.00 0.25 H new ATOM 1216 N ARG A 83 -7.992 -3.401 -21.213 1.00 60.42 N ATOM 1217 CA ARG A 83 -6.808 -3.508 -20.369 1.00 12.31 C ATOM 1218 C ARG A 83 -6.352 -2.130 -19.896 1.00 35.54 C ATOM 1219 O ARG A 83 -6.401 -1.158 -20.649 1.00 23.35 O ATOM 1220 CB ARG A 83 -5.674 -4.199 -21.128 1.00 52.35 C ATOM 1221 CG ARG A 83 -6.030 -5.593 -21.619 1.00 15.42 C ATOM 1222 CD ARG A 83 -5.841 -6.633 -20.526 1.00 14.11 C ATOM 1223 NE ARG A 83 -5.320 -7.891 -21.052 1.00 60.34 N ATOM 1224 CZ ARG A 83 -5.102 -8.967 -20.304 1.00 40.01 C ATOM 1225 NH1 ARG A 83 -5.359 -8.937 -19.004 1.00 34.22 N ATOM 1226 NH2 ARG A 83 -4.626 -10.076 -20.856 1.00 41.44 N ATOM 0 H ARG A 83 -7.818 -3.001 -22.135 1.00 60.42 H new ATOM 0 HA ARG A 83 -7.068 -4.106 -19.496 1.00 12.31 H new ATOM 0 HB2 ARG A 83 -5.392 -3.583 -21.982 1.00 52.35 H new ATOM 0 HB3 ARG A 83 -4.801 -4.264 -20.479 1.00 52.35 H new ATOM 0 HG2 ARG A 83 -7.065 -5.606 -21.961 1.00 15.42 H new ATOM 0 HG3 ARG A 83 -5.408 -5.848 -22.477 1.00 15.42 H new ATOM 0 HD2 ARG A 83 -5.157 -6.245 -19.771 1.00 14.11 H new ATOM 0 HD3 ARG A 83 -6.794 -6.815 -20.030 1.00 14.11 H new ATOM 0 HE ARG A 83 -5.112 -7.947 -22.049 1.00 60.34 H new ATOM 0 HH11 ARG A 83 -5.725 -8.087 -18.576 1.00 34.22 H new ATOM 0 HH12 ARG A 83 -5.191 -9.764 -18.432 1.00 34.22 H new ATOM 0 HH21 ARG A 83 -4.427 -10.103 -21.856 1.00 41.44 H new ATOM 0 HH22 ARG A 83 -4.459 -10.901 -20.280 1.00 41.44 H new ATOM 1240 N GLN A 84 -5.911 -2.057 -18.644 1.00 53.40 N ATOM 1241 CA GLN A 84 -5.449 -0.798 -18.071 1.00 25.33 C ATOM 1242 C GLN A 84 -3.930 -0.789 -17.933 1.00 44.24 C ATOM 1243 O GLN A 84 -3.324 -1.794 -17.561 1.00 33.24 O ATOM 1244 CB GLN A 84 -6.097 -0.567 -16.705 1.00 54.51 C ATOM 1245 CG GLN A 84 -7.617 -0.557 -16.747 1.00 60.52 C ATOM 1246 CD GLN A 84 -8.220 -1.889 -16.346 1.00 62.43 C ATOM 1247 OE1 GLN A 84 -8.893 -2.544 -17.143 1.00 22.21 O ATOM 1248 NE2 GLN A 84 -7.981 -2.298 -15.106 1.00 31.24 N ATOM 0 H GLN A 84 -5.864 -2.853 -18.008 1.00 53.40 H new ATOM 0 HA GLN A 84 -5.740 0.008 -18.745 1.00 25.33 H new ATOM 0 HB2 GLN A 84 -5.766 -1.346 -16.018 1.00 54.51 H new ATOM 0 HB3 GLN A 84 -5.747 0.383 -16.302 1.00 54.51 H new ATOM 0 HG2 GLN A 84 -7.990 0.222 -16.082 1.00 60.52 H new ATOM 0 HG3 GLN A 84 -7.947 -0.301 -17.754 1.00 60.52 H new ATOM 0 HE21 GLN A 84 -7.418 -1.723 -14.479 1.00 31.24 H new ATOM 0 HE22 GLN A 84 -8.360 -3.187 -14.780 1.00 31.24 H new ATOM 1257 N ILE A 85 -3.320 0.352 -18.237 1.00 53.21 N ATOM 1258 CA ILE A 85 -1.872 0.492 -18.147 1.00 32.04 C ATOM 1259 C ILE A 85 -1.480 1.414 -16.997 1.00 63.20 C ATOM 1260 O ILE A 85 -1.543 2.632 -17.153 1.00 50.23 O ATOM 1261 CB ILE A 85 -1.277 1.041 -19.456 1.00 43.24 C ATOM 1262 CG1 ILE A 85 -1.885 0.320 -20.661 1.00 32.22 C ATOM 1263 CG2 ILE A 85 0.237 0.893 -19.453 1.00 25.11 C ATOM 1264 CD1 ILE A 85 -1.703 -1.181 -20.621 1.00 71.33 C ATOM 0 H ILE A 85 -3.806 1.193 -18.548 1.00 53.21 H new ATOM 0 HA ILE A 85 -1.469 -0.504 -17.965 1.00 32.04 H new ATOM 0 HB ILE A 85 -1.519 2.101 -19.530 1.00 43.24 H new ATOM 0 HG12 ILE A 85 -2.950 0.548 -20.711 1.00 32.22 H new ATOM 0 HG13 ILE A 85 -1.432 0.709 -21.573 1.00 32.22 H new ATOM 0 HG21 ILE A 85 0.643 1.286 -20.385 1.00 25.11 H new ATOM 0 HG22 ILE A 85 0.655 1.448 -18.613 1.00 25.11 H new ATOM 0 HG23 ILE A 85 0.499 -0.161 -19.358 1.00 25.11 H new ATOM 0 HD11 ILE A 85 -2.158 -1.626 -21.506 1.00 71.33 H new ATOM 0 HD12 ILE A 85 -0.639 -1.418 -20.602 1.00 71.33 H new ATOM 0 HD13 ILE A 85 -2.180 -1.582 -19.727 1.00 71.33 H new TER 1276 ILE A 85 HETATM 1277 CA CA A 126 -21.693 -2.303 -20.870 1.00 11.30 CA HETATM 1278 CA CA A 136 -19.307 -5.399 -26.987 1.00 24.05 CA