USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1216 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 56 LYS NZ :NH3+ 164:sc= 0.627 (180deg=-0.00522) USER MOD Set 1.2: A 121 ASN : amide:sc= 1.38 K(o=2,f=-0.77) USER MOD Set 2.1: A 102 LYS NZ :NH3+ 180:sc=-0.00425 (180deg=-0.00425) USER MOD Set 2.2: A 103 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 68 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 88 HIS : no HE2:sc= -0.177 K(o=-0.18,f=-3.4!) USER MOD Set 4.1: A 66 ASN : amide:sc= 0.0526 X(o=0.36,f=-0.099) USER MOD Set 4.2: A 70 LYS NZ :NH3+ -174:sc= 0.31 (180deg=0) USER MOD Set 5.1: A 17 LYS NZ :NH3+ -118:sc= -0.457 (180deg=-2.36!) USER MOD Set 5.2: A 38 GLN :FLIP amide:sc= 0 F(o=-1.5,f=-0.46) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc=-0.000191 (180deg=-0.169) USER MOD Single : A 2 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0809) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 176:sc= 0.409 (180deg=0.388) USER MOD Single : A 13 LYS NZ :NH3+ 155:sc= -1.68! (180deg=-2.8!) USER MOD Single : A 18 THR OG1 : rot 110:sc= 0.362 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot -70:sc= 1.42 USER MOD Single : A 26 GLN : amide:sc= -2.03! K(o=-2!,f=-3) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.0382 K(o=-0.038,f=-0.71) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 81:sc= 0.767 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.216 K(o=-0.22,f=-2.8!) USER MOD Single : A 54 THR OG1 : rot 90:sc= 0.533 USER MOD Single : A 64 TYR OH : rot 85:sc= 0.389 USER MOD Single : A 65 SER OG : rot -150:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -179:sc= -0.783 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.942 X(o=-0.94,f=-0.84) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 165:sc= 0.778 (180deg=0.634) USER MOD Single : A 86 THR OG1 : rot 79:sc= 0.0654 USER MOD Single : A 87 LYS NZ :NH3+ 143:sc= 0.421 (180deg=-0.954) USER MOD Single : A 97 GLN : amide:sc= -0.0121 X(o=-0.012,f=-0.43) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 105 GLN : amide:sc= -0.0358 X(o=-0.036,f=-0.31) USER MOD Single : A 109 THR OG1 : rot -85:sc= 0.825 USER MOD Single : A 110 GLN :FLIP amide:sc= -0.423 F(o=-1.2,f=-0.42) USER MOD Single : A 117 ASN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 122 SER OG : rot 27:sc= 0.209 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 TYR OH : rot 30:sc= -0.0666 USER MOD Single : A 126 ASN : amide:sc= -3.81! C(o=-3.8!,f=-7.1!) USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.492 USER MOD Single : A 136 TYR OH : rot -112:sc= 0.0157 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 HIS : no HD1:sc=-0.00568 X(o=-0.0057,f=-0.099) USER MOD Single : A 145 HIS : no HE2:sc= 0.186 K(o=0.19,f=-0.88) USER MOD Single : A 146 HIS : no HE2:sc= 0.057 K(o=0.057,f=-1.2) USER MOD Single : A 147 HIS : no HE2:sc= -0.13 K(o=-0.13,f=-0.83) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.827 8.329 -6.576 1.00 1.34 N ATOM 2 CA MET A 1 18.358 8.298 -7.971 1.00 64.54 C ATOM 3 C MET A 1 17.888 7.021 -8.701 1.00 32.04 C ATOM 4 O MET A 1 17.352 7.093 -9.815 1.00 60.41 O ATOM 5 CB MET A 1 19.908 8.400 -7.959 1.00 3.20 C ATOM 6 CG MET A 1 20.452 9.679 -7.309 1.00 60.41 C ATOM 7 SD MET A 1 22.257 9.771 -7.334 1.00 13.40 S ATOM 8 CE MET A 1 22.548 11.374 -6.578 1.00 13.33 C ATOM 0 H1 MET A 1 17.992 9.269 -6.163 1.00 1.34 H new ATOM 0 H2 MET A 1 16.806 8.131 -6.589 1.00 1.34 H new ATOM 0 H3 MET A 1 18.312 7.609 -6.004 1.00 1.34 H new ATOM 0 HA MET A 1 17.966 9.157 -8.516 1.00 64.54 H new ATOM 0 HB2 MET A 1 20.313 7.537 -7.430 1.00 3.20 H new ATOM 0 HB3 MET A 1 20.272 8.345 -8.985 1.00 3.20 H new ATOM 0 HG2 MET A 1 20.042 10.546 -7.827 1.00 60.41 H new ATOM 0 HG3 MET A 1 20.105 9.731 -6.277 1.00 60.41 H new ATOM 0 HE1 MET A 1 23.620 11.564 -6.528 1.00 13.33 H new ATOM 0 HE2 MET A 1 22.070 12.150 -7.175 1.00 13.33 H new ATOM 0 HE3 MET A 1 22.131 11.382 -5.571 1.00 13.33 H new ATOM 20 N LYS A 2 18.108 5.850 -8.070 1.00 0.41 N ATOM 21 CA LYS A 2 17.559 4.563 -8.548 1.00 24.21 C ATOM 22 C LYS A 2 16.032 4.507 -8.298 1.00 63.33 C ATOM 23 O LYS A 2 15.570 4.164 -7.201 1.00 14.21 O ATOM 24 CB LYS A 2 18.295 3.374 -7.863 1.00 33.44 C ATOM 25 CG LYS A 2 17.816 1.965 -8.293 1.00 54.02 C ATOM 26 CD LYS A 2 18.581 0.829 -7.567 1.00 42.30 C ATOM 27 CE LYS A 2 20.061 0.738 -7.976 1.00 54.05 C ATOM 28 NZ LYS A 2 20.216 0.375 -9.411 1.00 23.34 N ATOM 0 H LYS A 2 18.667 5.769 -7.221 1.00 0.41 H new ATOM 0 HA LYS A 2 17.724 4.481 -9.622 1.00 24.21 H new ATOM 0 HB2 LYS A 2 19.361 3.458 -8.074 1.00 33.44 H new ATOM 0 HB3 LYS A 2 18.175 3.467 -6.784 1.00 33.44 H new ATOM 0 HG2 LYS A 2 16.750 1.869 -8.088 1.00 54.02 H new ATOM 0 HG3 LYS A 2 17.944 1.854 -9.370 1.00 54.02 H new ATOM 0 HD2 LYS A 2 18.517 0.987 -6.490 1.00 42.30 H new ATOM 0 HD3 LYS A 2 18.093 -0.122 -7.779 1.00 42.30 H new ATOM 0 HE2 LYS A 2 20.550 1.694 -7.788 1.00 54.05 H new ATOM 0 HE3 LYS A 2 20.564 -0.004 -7.357 1.00 54.05 H new ATOM 0 HZ1 LYS A 2 21.216 0.174 -9.612 1.00 23.34 H new ATOM 0 HZ2 LYS A 2 19.645 -0.469 -9.619 1.00 23.34 H new ATOM 0 HZ3 LYS A 2 19.895 1.166 -10.006 1.00 23.34 H new ATOM 42 N VAL A 3 15.262 4.907 -9.322 1.00 53.14 N ATOM 43 CA VAL A 3 13.791 4.953 -9.266 1.00 53.20 C ATOM 44 C VAL A 3 13.176 3.617 -9.764 1.00 73.51 C ATOM 45 O VAL A 3 13.331 3.229 -10.929 1.00 0.21 O ATOM 46 CB VAL A 3 13.221 6.189 -10.075 1.00 22.31 C ATOM 47 CG1 VAL A 3 13.584 7.520 -9.366 1.00 51.53 C ATOM 48 CG2 VAL A 3 13.713 6.202 -11.551 1.00 5.44 C ATOM 0 H VAL A 3 15.644 5.210 -10.218 1.00 53.14 H new ATOM 0 HA VAL A 3 13.500 5.086 -8.224 1.00 53.20 H new ATOM 0 HB VAL A 3 12.136 6.087 -10.098 1.00 22.31 H new ATOM 0 HG11 VAL A 3 13.184 8.358 -9.937 1.00 51.53 H new ATOM 0 HG12 VAL A 3 13.156 7.527 -8.364 1.00 51.53 H new ATOM 0 HG13 VAL A 3 14.668 7.612 -9.298 1.00 51.53 H new ATOM 0 HG21 VAL A 3 13.296 7.068 -12.066 1.00 5.44 H new ATOM 0 HG22 VAL A 3 14.801 6.257 -11.571 1.00 5.44 H new ATOM 0 HG23 VAL A 3 13.387 5.290 -12.051 1.00 5.44 H new ATOM 58 N PHE A 4 12.516 2.892 -8.846 1.00 72.35 N ATOM 59 CA PHE A 4 11.811 1.638 -9.174 1.00 42.12 C ATOM 60 C PHE A 4 10.434 1.950 -9.793 1.00 64.44 C ATOM 61 O PHE A 4 9.505 2.384 -9.107 1.00 23.33 O ATOM 62 CB PHE A 4 11.687 0.738 -7.921 1.00 20.44 C ATOM 63 CG PHE A 4 13.042 0.261 -7.402 1.00 2.00 C ATOM 64 CD1 PHE A 4 13.715 -0.791 -8.033 1.00 43.31 C ATOM 65 CD2 PHE A 4 13.655 0.868 -6.302 1.00 60.54 C ATOM 66 CE1 PHE A 4 14.947 -1.222 -7.579 1.00 73.14 C ATOM 67 CE2 PHE A 4 14.890 0.435 -5.851 1.00 1.45 C ATOM 68 CZ PHE A 4 15.533 -0.610 -6.488 1.00 71.15 C ATOM 0 H PHE A 4 12.455 3.154 -7.862 1.00 72.35 H new ATOM 0 HA PHE A 4 12.392 1.086 -9.913 1.00 42.12 H new ATOM 0 HB2 PHE A 4 11.174 1.288 -7.133 1.00 20.44 H new ATOM 0 HB3 PHE A 4 11.069 -0.127 -8.160 1.00 20.44 H new ATOM 0 HD1 PHE A 4 13.265 -1.274 -8.888 1.00 43.31 H new ATOM 0 HD2 PHE A 4 13.159 1.684 -5.798 1.00 60.54 H new ATOM 0 HE1 PHE A 4 15.451 -2.037 -8.077 1.00 73.14 H new ATOM 0 HE2 PHE A 4 15.352 0.914 -5.000 1.00 1.45 H new ATOM 0 HZ PHE A 4 16.495 -0.948 -6.132 1.00 71.15 H new ATOM 78 N LYS A 5 10.348 1.768 -11.114 1.00 10.54 N ATOM 79 CA LYS A 5 9.141 2.049 -11.906 1.00 11.31 C ATOM 80 C LYS A 5 9.062 1.092 -13.110 1.00 42.45 C ATOM 81 O LYS A 5 10.037 0.400 -13.437 1.00 2.43 O ATOM 82 CB LYS A 5 9.149 3.531 -12.372 1.00 62.21 C ATOM 83 CG LYS A 5 10.320 3.929 -13.307 1.00 23.22 C ATOM 84 CD LYS A 5 10.405 5.460 -13.543 1.00 71.05 C ATOM 85 CE LYS A 5 9.102 6.069 -14.100 1.00 21.24 C ATOM 86 NZ LYS A 5 9.203 7.542 -14.263 1.00 65.33 N ATOM 0 H LYS A 5 11.125 1.416 -11.674 1.00 10.54 H new ATOM 0 HA LYS A 5 8.258 1.888 -11.287 1.00 11.31 H new ATOM 0 HB2 LYS A 5 8.210 3.737 -12.886 1.00 62.21 H new ATOM 0 HB3 LYS A 5 9.177 4.171 -11.490 1.00 62.21 H new ATOM 0 HG2 LYS A 5 11.258 3.579 -12.876 1.00 23.22 H new ATOM 0 HG3 LYS A 5 10.202 3.424 -14.266 1.00 23.22 H new ATOM 0 HD2 LYS A 5 10.654 5.952 -12.602 1.00 71.05 H new ATOM 0 HD3 LYS A 5 11.220 5.668 -14.237 1.00 71.05 H new ATOM 0 HE2 LYS A 5 8.871 5.613 -15.062 1.00 21.24 H new ATOM 0 HE3 LYS A 5 8.276 5.834 -13.429 1.00 21.24 H new ATOM 0 HZ1 LYS A 5 8.307 7.912 -14.639 1.00 65.33 H new ATOM 0 HZ2 LYS A 5 9.398 7.981 -13.341 1.00 65.33 H new ATOM 0 HZ3 LYS A 5 9.975 7.766 -14.923 1.00 65.33 H new ATOM 100 N ARG A 6 7.903 1.077 -13.777 1.00 51.44 N ATOM 101 CA ARG A 6 7.653 0.183 -14.923 1.00 13.24 C ATOM 102 C ARG A 6 7.350 1.021 -16.180 1.00 14.44 C ATOM 103 O ARG A 6 6.292 1.647 -16.285 1.00 4.05 O ATOM 104 CB ARG A 6 6.513 -0.827 -14.611 1.00 70.43 C ATOM 105 CG ARG A 6 6.351 -1.934 -15.686 1.00 42.40 C ATOM 106 CD ARG A 6 5.406 -3.073 -15.256 1.00 53.11 C ATOM 107 NE ARG A 6 4.016 -2.623 -15.055 1.00 64.13 N ATOM 108 CZ ARG A 6 3.043 -2.737 -15.938 1.00 2.42 C ATOM 109 NH1 ARG A 6 3.268 -3.185 -17.135 1.00 0.52 N ATOM 110 NH2 ARG A 6 1.848 -2.369 -15.618 1.00 10.33 N ATOM 0 H ARG A 6 7.113 1.679 -13.543 1.00 51.44 H new ATOM 0 HA ARG A 6 8.549 -0.407 -15.114 1.00 13.24 H new ATOM 0 HB2 ARG A 6 6.708 -1.295 -13.646 1.00 70.43 H new ATOM 0 HB3 ARG A 6 5.573 -0.283 -14.517 1.00 70.43 H new ATOM 0 HG2 ARG A 6 5.972 -1.485 -16.604 1.00 42.40 H new ATOM 0 HG3 ARG A 6 7.331 -2.352 -15.916 1.00 42.40 H new ATOM 0 HD2 ARG A 6 5.422 -3.857 -16.013 1.00 53.11 H new ATOM 0 HD3 ARG A 6 5.776 -3.515 -14.331 1.00 53.11 H new ATOM 0 HE ARG A 6 3.789 -2.188 -14.161 1.00 64.13 H new ATOM 0 HH11 ARG A 6 4.212 -3.457 -17.409 1.00 0.52 H new ATOM 0 HH12 ARG A 6 2.501 -3.265 -17.802 1.00 0.52 H new ATOM 0 HH21 ARG A 6 1.662 -1.993 -14.688 1.00 10.33 H new ATOM 0 HH22 ARG A 6 1.090 -2.454 -16.295 1.00 10.33 H new ATOM 124 N VAL A 7 8.331 1.064 -17.102 1.00 23.00 N ATOM 125 CA VAL A 7 8.208 1.743 -18.417 1.00 13.33 C ATOM 126 C VAL A 7 7.397 0.818 -19.402 1.00 51.22 C ATOM 127 O VAL A 7 6.543 0.047 -18.942 1.00 0.24 O ATOM 128 CB VAL A 7 9.658 2.124 -18.961 1.00 22.52 C ATOM 129 CG1 VAL A 7 9.599 3.190 -20.090 1.00 25.03 C ATOM 130 CG2 VAL A 7 10.581 2.618 -17.813 1.00 61.21 C ATOM 0 H VAL A 7 9.241 0.626 -16.959 1.00 23.00 H new ATOM 0 HA VAL A 7 7.654 2.677 -18.323 1.00 13.33 H new ATOM 0 HB VAL A 7 10.079 1.211 -19.383 1.00 22.52 H new ATOM 0 HG11 VAL A 7 10.610 3.418 -20.429 1.00 25.03 H new ATOM 0 HG12 VAL A 7 9.015 2.804 -20.925 1.00 25.03 H new ATOM 0 HG13 VAL A 7 9.131 4.098 -19.709 1.00 25.03 H new ATOM 0 HG21 VAL A 7 11.562 2.870 -18.217 1.00 61.21 H new ATOM 0 HG22 VAL A 7 10.143 3.501 -17.348 1.00 61.21 H new ATOM 0 HG23 VAL A 7 10.687 1.830 -17.067 1.00 61.21 H new ATOM 140 N ALA A 8 7.645 0.866 -20.734 1.00 22.22 N ATOM 141 CA ALA A 8 6.865 0.083 -21.712 1.00 24.42 C ATOM 142 C ALA A 8 7.461 -1.340 -21.838 1.00 55.40 C ATOM 143 O ALA A 8 6.929 -2.285 -21.246 1.00 25.24 O ATOM 144 CB ALA A 8 6.809 0.816 -23.065 1.00 34.20 C ATOM 0 H ALA A 8 8.379 1.439 -21.151 1.00 22.22 H new ATOM 0 HA ALA A 8 5.837 -0.019 -21.364 1.00 24.42 H new ATOM 0 HB1 ALA A 8 6.230 0.225 -23.775 1.00 34.20 H new ATOM 0 HB2 ALA A 8 6.336 1.789 -22.932 1.00 34.20 H new ATOM 0 HB3 ALA A 8 7.821 0.953 -23.447 1.00 34.20 H new ATOM 150 N GLY A 9 8.550 -1.495 -22.642 1.00 23.14 N ATOM 151 CA GLY A 9 9.412 -2.700 -22.657 1.00 21.34 C ATOM 152 C GLY A 9 9.630 -3.509 -21.361 1.00 4.15 C ATOM 153 O GLY A 9 9.870 -4.713 -21.455 1.00 62.51 O ATOM 0 H GLY A 9 8.852 -0.778 -23.301 1.00 23.14 H new ATOM 0 HA2 GLY A 9 9.001 -3.383 -23.400 1.00 21.34 H new ATOM 0 HA3 GLY A 9 10.394 -2.392 -23.016 1.00 21.34 H new ATOM 157 N ILE A 10 9.596 -2.883 -20.163 1.00 54.13 N ATOM 158 CA ILE A 10 9.751 -3.644 -18.888 1.00 1.21 C ATOM 159 C ILE A 10 8.561 -4.618 -18.687 1.00 13.14 C ATOM 160 O ILE A 10 7.450 -4.180 -18.354 1.00 32.21 O ATOM 161 CB ILE A 10 9.883 -2.722 -17.615 1.00 75.05 C ATOM 162 CG1 ILE A 10 11.083 -1.732 -17.759 1.00 51.53 C ATOM 163 CG2 ILE A 10 10.015 -3.586 -16.320 1.00 64.51 C ATOM 164 CD1 ILE A 10 11.316 -0.833 -16.551 1.00 53.32 C ATOM 0 H ILE A 10 9.466 -1.878 -20.045 1.00 54.13 H new ATOM 0 HA ILE A 10 10.685 -4.197 -18.986 1.00 1.21 H new ATOM 0 HB ILE A 10 8.974 -2.126 -17.532 1.00 75.05 H new ATOM 0 HG12 ILE A 10 11.990 -2.307 -17.947 1.00 51.53 H new ATOM 0 HG13 ILE A 10 10.916 -1.105 -18.635 1.00 51.53 H new ATOM 0 HG21 ILE A 10 10.105 -2.931 -15.453 1.00 64.51 H new ATOM 0 HG22 ILE A 10 9.131 -4.214 -16.210 1.00 64.51 H new ATOM 0 HG23 ILE A 10 10.901 -4.216 -16.392 1.00 64.51 H new ATOM 0 HD11 ILE A 10 12.168 -0.181 -16.742 1.00 53.32 H new ATOM 0 HD12 ILE A 10 10.428 -0.227 -16.372 1.00 53.32 H new ATOM 0 HD13 ILE A 10 11.519 -1.447 -15.674 1.00 53.32 H new ATOM 176 N LYS A 11 8.795 -5.940 -18.884 1.00 3.32 N ATOM 177 CA LYS A 11 7.759 -7.004 -18.785 1.00 53.21 C ATOM 178 C LYS A 11 8.463 -8.363 -18.452 1.00 73.43 C ATOM 179 O LYS A 11 7.943 -9.446 -18.739 1.00 33.01 O ATOM 180 CB LYS A 11 6.935 -7.129 -20.117 1.00 24.40 C ATOM 181 CG LYS A 11 5.790 -6.096 -20.292 1.00 2.11 C ATOM 182 CD LYS A 11 5.035 -6.256 -21.632 1.00 24.20 C ATOM 183 CE LYS A 11 5.879 -5.847 -22.854 1.00 53.35 C ATOM 184 NZ LYS A 11 6.150 -4.384 -22.884 1.00 55.23 N ATOM 0 H LYS A 11 9.719 -6.303 -19.119 1.00 3.32 H new ATOM 0 HA LYS A 11 7.058 -6.742 -17.993 1.00 53.21 H new ATOM 0 HB2 LYS A 11 7.621 -7.032 -20.959 1.00 24.40 H new ATOM 0 HB3 LYS A 11 6.508 -8.131 -20.167 1.00 24.40 H new ATOM 0 HG2 LYS A 11 5.084 -6.201 -19.468 1.00 2.11 H new ATOM 0 HG3 LYS A 11 6.203 -5.089 -20.232 1.00 2.11 H new ATOM 0 HD2 LYS A 11 4.723 -7.294 -21.745 1.00 24.20 H new ATOM 0 HD3 LYS A 11 4.128 -5.652 -21.606 1.00 24.20 H new ATOM 0 HE2 LYS A 11 6.824 -6.390 -22.839 1.00 53.35 H new ATOM 0 HE3 LYS A 11 5.359 -6.138 -23.767 1.00 53.35 H new ATOM 0 HZ1 LYS A 11 6.776 -4.163 -23.684 1.00 55.23 H new ATOM 0 HZ2 LYS A 11 5.254 -3.867 -22.993 1.00 55.23 H new ATOM 0 HZ3 LYS A 11 6.609 -4.098 -21.996 1.00 55.23 H new ATOM 198 N ASP A 12 9.654 -8.266 -17.832 1.00 24.31 N ATOM 199 CA ASP A 12 10.512 -9.419 -17.437 1.00 45.40 C ATOM 200 C ASP A 12 10.312 -9.698 -15.937 1.00 71.44 C ATOM 201 O ASP A 12 10.186 -8.743 -15.183 1.00 55.11 O ATOM 202 CB ASP A 12 12.001 -9.054 -17.674 1.00 31.12 C ATOM 203 CG ASP A 12 12.269 -8.433 -19.047 1.00 54.12 C ATOM 204 OD1 ASP A 12 12.053 -7.206 -19.203 1.00 0.11 O ATOM 205 OD2 ASP A 12 12.688 -9.152 -19.976 1.00 3.11 O ATOM 0 H ASP A 12 10.064 -7.366 -17.582 1.00 24.31 H new ATOM 0 HA ASP A 12 10.243 -10.295 -18.027 1.00 45.40 H new ATOM 0 HB2 ASP A 12 12.323 -8.357 -16.900 1.00 31.12 H new ATOM 0 HB3 ASP A 12 12.608 -9.953 -17.566 1.00 31.12 H new ATOM 210 N LYS A 13 10.300 -10.960 -15.462 1.00 55.22 N ATOM 211 CA LYS A 13 10.065 -11.253 -14.026 1.00 74.40 C ATOM 212 C LYS A 13 11.225 -10.747 -13.112 1.00 23.25 C ATOM 213 O LYS A 13 10.975 -10.236 -12.034 1.00 64.35 O ATOM 214 CB LYS A 13 9.834 -12.787 -13.859 1.00 35.42 C ATOM 215 CG LYS A 13 9.187 -13.249 -12.521 1.00 12.22 C ATOM 216 CD LYS A 13 7.626 -13.192 -12.491 1.00 33.01 C ATOM 217 CE LYS A 13 7.028 -11.772 -12.433 1.00 0.33 C ATOM 218 NZ LYS A 13 5.546 -11.806 -12.348 1.00 21.31 N ATOM 0 H LYS A 13 10.448 -11.787 -16.041 1.00 55.22 H new ATOM 0 HA LYS A 13 9.178 -10.709 -13.702 1.00 74.40 H new ATOM 0 HB2 LYS A 13 9.203 -13.128 -14.679 1.00 35.42 H new ATOM 0 HB3 LYS A 13 10.795 -13.291 -13.965 1.00 35.42 H new ATOM 0 HG2 LYS A 13 9.503 -14.272 -12.316 1.00 12.22 H new ATOM 0 HG3 LYS A 13 9.574 -12.628 -11.713 1.00 12.22 H new ATOM 0 HD2 LYS A 13 7.242 -13.696 -13.378 1.00 33.01 H new ATOM 0 HD3 LYS A 13 7.273 -13.754 -11.627 1.00 33.01 H new ATOM 0 HE2 LYS A 13 7.430 -11.242 -11.570 1.00 0.33 H new ATOM 0 HE3 LYS A 13 7.329 -11.213 -13.319 1.00 0.33 H new ATOM 0 HZ1 LYS A 13 5.204 -10.933 -11.899 1.00 21.31 H new ATOM 0 HZ2 LYS A 13 5.145 -11.883 -13.305 1.00 21.31 H new ATOM 0 HZ3 LYS A 13 5.250 -12.626 -11.781 1.00 21.31 H new ATOM 232 N ALA A 14 12.487 -10.886 -13.569 1.00 24.42 N ATOM 233 CA ALA A 14 13.694 -10.283 -12.895 1.00 10.11 C ATOM 234 C ALA A 14 13.594 -8.721 -12.785 1.00 72.23 C ATOM 235 O ALA A 14 14.157 -8.086 -11.894 1.00 74.24 O ATOM 236 CB ALA A 14 14.965 -10.694 -13.656 1.00 73.31 C ATOM 0 H ALA A 14 12.715 -11.414 -14.411 1.00 24.42 H new ATOM 0 HA ALA A 14 13.738 -10.667 -11.876 1.00 10.11 H new ATOM 0 HB1 ALA A 14 15.837 -10.258 -13.169 1.00 73.31 H new ATOM 0 HB2 ALA A 14 15.054 -11.780 -13.656 1.00 73.31 H new ATOM 0 HB3 ALA A 14 14.906 -10.335 -14.684 1.00 73.31 H new ATOM 242 N ALA A 15 12.867 -8.178 -13.756 1.00 70.54 N ATOM 243 CA ALA A 15 12.535 -6.734 -13.829 1.00 33.54 C ATOM 244 C ALA A 15 11.403 -6.367 -12.820 1.00 41.04 C ATOM 245 O ALA A 15 11.437 -5.308 -12.189 1.00 40.42 O ATOM 246 CB ALA A 15 12.179 -6.314 -15.261 1.00 15.52 C ATOM 0 H ALA A 15 12.482 -8.722 -14.528 1.00 70.54 H new ATOM 0 HA ALA A 15 13.423 -6.172 -13.541 1.00 33.54 H new ATOM 0 HB1 ALA A 15 11.941 -5.250 -15.280 1.00 15.52 H new ATOM 0 HB2 ALA A 15 13.027 -6.508 -15.918 1.00 15.52 H new ATOM 0 HB3 ALA A 15 11.316 -6.885 -15.604 1.00 15.52 H new ATOM 252 N ILE A 16 10.410 -7.272 -12.683 1.00 44.32 N ATOM 253 CA ILE A 16 9.200 -7.063 -11.840 1.00 0.43 C ATOM 254 C ILE A 16 9.428 -7.346 -10.314 1.00 40.35 C ATOM 255 O ILE A 16 8.928 -6.611 -9.487 1.00 62.22 O ATOM 256 CB ILE A 16 7.985 -7.904 -12.415 1.00 52.14 C ATOM 257 CG1 ILE A 16 7.692 -7.499 -13.901 1.00 13.51 C ATOM 258 CG2 ILE A 16 6.702 -7.774 -11.554 1.00 24.52 C ATOM 259 CD1 ILE A 16 7.332 -6.038 -14.126 1.00 1.35 C ATOM 0 H ILE A 16 10.420 -8.176 -13.155 1.00 44.32 H new ATOM 0 HA ILE A 16 8.961 -6.001 -11.895 1.00 0.43 H new ATOM 0 HB ILE A 16 8.283 -8.952 -12.379 1.00 52.14 H new ATOM 0 HG12 ILE A 16 8.570 -7.735 -14.503 1.00 13.51 H new ATOM 0 HG13 ILE A 16 6.875 -8.117 -14.273 1.00 13.51 H new ATOM 0 HG21 ILE A 16 5.905 -8.371 -11.997 1.00 24.52 H new ATOM 0 HG22 ILE A 16 6.904 -8.130 -10.544 1.00 24.52 H new ATOM 0 HG23 ILE A 16 6.394 -6.729 -11.515 1.00 24.52 H new ATOM 0 HD11 ILE A 16 7.150 -5.867 -15.187 1.00 1.35 H new ATOM 0 HD12 ILE A 16 6.434 -5.793 -13.559 1.00 1.35 H new ATOM 0 HD13 ILE A 16 8.155 -5.405 -13.793 1.00 1.35 H new ATOM 271 N LYS A 17 10.192 -8.393 -9.944 1.00 41.25 N ATOM 272 CA LYS A 17 10.395 -8.796 -8.502 1.00 2.45 C ATOM 273 C LYS A 17 11.356 -7.819 -7.772 1.00 44.11 C ATOM 274 O LYS A 17 11.090 -7.362 -6.659 1.00 31.31 O ATOM 275 CB LYS A 17 10.951 -10.245 -8.437 1.00 54.33 C ATOM 276 CG LYS A 17 10.089 -11.266 -9.195 1.00 34.03 C ATOM 277 CD LYS A 17 10.719 -12.680 -9.251 1.00 52.30 C ATOM 278 CE LYS A 17 10.638 -13.427 -7.915 1.00 72.22 C ATOM 279 NZ LYS A 17 9.239 -13.736 -7.533 1.00 23.10 N ATOM 0 H LYS A 17 10.687 -8.987 -10.610 1.00 41.25 H new ATOM 0 HA LYS A 17 9.431 -8.754 -7.996 1.00 2.45 H new ATOM 0 HB2 LYS A 17 11.960 -10.257 -8.848 1.00 54.33 H new ATOM 0 HB3 LYS A 17 11.028 -10.550 -7.393 1.00 54.33 H new ATOM 0 HG2 LYS A 17 9.111 -11.330 -8.718 1.00 34.03 H new ATOM 0 HG3 LYS A 17 9.925 -10.909 -10.212 1.00 34.03 H new ATOM 0 HD2 LYS A 17 10.215 -13.266 -10.019 1.00 52.30 H new ATOM 0 HD3 LYS A 17 11.764 -12.594 -9.550 1.00 52.30 H new ATOM 0 HE2 LYS A 17 11.208 -14.354 -7.983 1.00 72.22 H new ATOM 0 HE3 LYS A 17 11.102 -12.824 -7.134 1.00 72.22 H new ATOM 0 HZ1 LYS A 17 9.009 -13.256 -6.640 1.00 23.10 H new ATOM 0 HZ2 LYS A 17 8.594 -13.406 -8.279 1.00 23.10 H new ATOM 0 HZ3 LYS A 17 9.131 -14.763 -7.412 1.00 23.10 H new ATOM 293 N THR A 18 12.508 -7.601 -8.417 1.00 62.32 N ATOM 294 CA THR A 18 13.440 -6.469 -8.108 1.00 20.55 C ATOM 295 C THR A 18 12.710 -5.067 -8.022 1.00 2.25 C ATOM 296 O THR A 18 13.226 -4.125 -7.438 1.00 42.11 O ATOM 297 CB THR A 18 14.623 -6.432 -9.140 1.00 31.11 C ATOM 298 OG1 THR A 18 15.257 -7.727 -9.180 1.00 25.14 O ATOM 299 CG2 THR A 18 15.696 -5.373 -8.809 1.00 4.54 C ATOM 0 H THR A 18 12.837 -8.199 -9.175 1.00 62.32 H new ATOM 0 HA THR A 18 13.845 -6.658 -7.114 1.00 20.55 H new ATOM 0 HB THR A 18 14.188 -6.164 -10.103 1.00 31.11 H new ATOM 0 HG1 THR A 18 15.067 -8.158 -10.039 1.00 25.14 H new ATOM 0 HG21 THR A 18 16.482 -5.404 -9.563 1.00 4.54 H new ATOM 0 HG22 THR A 18 15.240 -4.383 -8.800 1.00 4.54 H new ATOM 0 HG23 THR A 18 16.125 -5.583 -7.829 1.00 4.54 H new ATOM 307 N LEU A 19 11.526 -4.978 -8.649 1.00 23.42 N ATOM 308 CA LEU A 19 10.587 -3.820 -8.488 1.00 54.43 C ATOM 309 C LEU A 19 9.731 -3.974 -7.162 1.00 33.04 C ATOM 310 O LEU A 19 9.526 -3.007 -6.422 1.00 22.11 O ATOM 311 CB LEU A 19 9.716 -3.665 -9.779 1.00 74.31 C ATOM 312 CG LEU A 19 8.875 -2.343 -9.971 1.00 43.22 C ATOM 313 CD1 LEU A 19 8.550 -2.113 -11.465 1.00 32.02 C ATOM 314 CD2 LEU A 19 7.559 -2.338 -9.150 1.00 32.14 C ATOM 0 H LEU A 19 11.179 -5.697 -9.284 1.00 23.42 H new ATOM 0 HA LEU A 19 11.152 -2.895 -8.373 1.00 54.43 H new ATOM 0 HB2 LEU A 19 10.379 -3.763 -10.639 1.00 74.31 H new ATOM 0 HB3 LEU A 19 9.023 -4.506 -9.813 1.00 74.31 H new ATOM 0 HG LEU A 19 9.498 -1.531 -9.597 1.00 43.22 H new ATOM 0 HD11 LEU A 19 7.970 -1.197 -11.574 1.00 32.02 H new ATOM 0 HD12 LEU A 19 9.478 -2.025 -12.030 1.00 32.02 H new ATOM 0 HD13 LEU A 19 7.973 -2.955 -11.846 1.00 32.02 H new ATOM 0 HD21 LEU A 19 7.025 -1.404 -9.324 1.00 32.14 H new ATOM 0 HD22 LEU A 19 6.934 -3.176 -9.459 1.00 32.14 H new ATOM 0 HD23 LEU A 19 7.792 -2.431 -8.089 1.00 32.14 H new ATOM 326 N ILE A 20 9.240 -5.209 -6.904 1.00 3.05 N ATOM 327 CA ILE A 20 8.263 -5.550 -5.807 1.00 21.32 C ATOM 328 C ILE A 20 8.840 -5.598 -4.342 1.00 33.52 C ATOM 329 O ILE A 20 8.211 -5.065 -3.420 1.00 22.45 O ATOM 330 CB ILE A 20 7.533 -6.896 -6.180 1.00 32.33 C ATOM 331 CG1 ILE A 20 6.651 -6.680 -7.446 1.00 53.01 C ATOM 332 CG2 ILE A 20 6.691 -7.470 -5.018 1.00 2.23 C ATOM 333 CD1 ILE A 20 5.987 -7.928 -7.986 1.00 50.03 C ATOM 0 H ILE A 20 9.509 -6.023 -7.456 1.00 3.05 H new ATOM 0 HA ILE A 20 7.564 -4.715 -5.764 1.00 21.32 H new ATOM 0 HB ILE A 20 8.305 -7.636 -6.390 1.00 32.33 H new ATOM 0 HG12 ILE A 20 5.878 -5.949 -7.211 1.00 53.01 H new ATOM 0 HG13 ILE A 20 7.270 -6.248 -8.232 1.00 53.01 H new ATOM 0 HG21 ILE A 20 6.214 -8.396 -5.338 1.00 2.23 H new ATOM 0 HG22 ILE A 20 7.338 -7.671 -4.164 1.00 2.23 H new ATOM 0 HG23 ILE A 20 5.926 -6.748 -4.732 1.00 2.23 H new ATOM 0 HD11 ILE A 20 5.396 -7.674 -8.866 1.00 50.03 H new ATOM 0 HD12 ILE A 20 6.750 -8.657 -8.259 1.00 50.03 H new ATOM 0 HD13 ILE A 20 5.336 -8.353 -7.222 1.00 50.03 H new ATOM 345 N SER A 21 9.978 -6.284 -4.099 1.00 10.52 N ATOM 346 CA SER A 21 10.657 -6.271 -2.750 1.00 61.14 C ATOM 347 C SER A 21 11.205 -4.849 -2.448 1.00 22.10 C ATOM 348 O SER A 21 11.166 -4.347 -1.328 1.00 10.31 O ATOM 349 CB SER A 21 11.797 -7.319 -2.706 1.00 20.42 C ATOM 350 OG SER A 21 11.324 -8.633 -2.993 1.00 61.01 O ATOM 0 H SER A 21 10.454 -6.852 -4.799 1.00 10.52 H new ATOM 0 HA SER A 21 9.927 -6.534 -1.984 1.00 61.14 H new ATOM 0 HB2 SER A 21 12.569 -7.046 -3.426 1.00 20.42 H new ATOM 0 HB3 SER A 21 12.262 -7.308 -1.720 1.00 20.42 H new ATOM 0 HG SER A 21 12.072 -9.265 -2.957 1.00 61.01 H new ATOM 356 N ALA A 22 11.719 -4.284 -3.532 1.00 23.22 N ATOM 357 CA ALA A 22 12.073 -2.843 -3.635 1.00 71.11 C ATOM 358 C ALA A 22 10.870 -1.920 -3.234 1.00 64.41 C ATOM 359 O ALA A 22 11.069 -0.801 -2.750 1.00 10.43 O ATOM 360 CB ALA A 22 12.566 -2.507 -5.026 1.00 24.25 C ATOM 0 H ALA A 22 11.911 -4.807 -4.386 1.00 23.22 H new ATOM 0 HA ALA A 22 12.881 -2.655 -2.928 1.00 71.11 H new ATOM 0 HB1 ALA A 22 12.819 -1.448 -5.077 1.00 24.25 H new ATOM 0 HB2 ALA A 22 13.451 -3.102 -5.252 1.00 24.25 H new ATOM 0 HB3 ALA A 22 11.784 -2.729 -5.753 1.00 24.25 H new ATOM 366 N ALA A 23 9.630 -2.420 -3.435 1.00 21.04 N ATOM 367 CA ALA A 23 8.383 -1.727 -3.017 1.00 30.54 C ATOM 368 C ALA A 23 8.044 -2.000 -1.520 1.00 2.42 C ATOM 369 O ALA A 23 7.479 -1.140 -0.848 1.00 54.13 O ATOM 370 CB ALA A 23 7.207 -2.127 -3.920 1.00 21.54 C ATOM 0 H ALA A 23 9.462 -3.316 -3.892 1.00 21.04 H new ATOM 0 HA ALA A 23 8.554 -0.656 -3.125 1.00 30.54 H new ATOM 0 HB1 ALA A 23 6.306 -1.607 -3.595 1.00 21.54 H new ATOM 0 HB2 ALA A 23 7.431 -1.854 -4.951 1.00 21.54 H new ATOM 0 HB3 ALA A 23 7.049 -3.203 -3.856 1.00 21.54 H new ATOM 376 N TYR A 24 8.357 -3.229 -1.019 1.00 32.02 N ATOM 377 CA TYR A 24 8.101 -3.612 0.407 1.00 74.20 C ATOM 378 C TYR A 24 9.032 -2.833 1.363 1.00 44.42 C ATOM 379 O TYR A 24 8.585 -2.247 2.337 1.00 74.12 O ATOM 380 CB TYR A 24 8.336 -5.136 0.648 1.00 44.23 C ATOM 381 CG TYR A 24 7.498 -6.114 -0.187 1.00 13.54 C ATOM 382 CD1 TYR A 24 6.160 -5.872 -0.484 1.00 54.31 C ATOM 383 CD2 TYR A 24 8.051 -7.315 -0.644 1.00 55.33 C ATOM 384 CE1 TYR A 24 5.414 -6.779 -1.210 1.00 24.02 C ATOM 385 CE2 TYR A 24 7.310 -8.217 -1.369 1.00 50.01 C ATOM 386 CZ TYR A 24 5.992 -7.947 -1.648 1.00 10.10 C ATOM 387 OH TYR A 24 5.250 -8.840 -2.392 1.00 70.33 O ATOM 0 H TYR A 24 8.784 -3.970 -1.575 1.00 32.02 H new ATOM 0 HA TYR A 24 7.058 -3.367 0.608 1.00 74.20 H new ATOM 0 HB2 TYR A 24 9.389 -5.349 0.463 1.00 44.23 H new ATOM 0 HB3 TYR A 24 8.149 -5.345 1.701 1.00 44.23 H new ATOM 0 HD1 TYR A 24 5.697 -4.959 -0.141 1.00 54.31 H new ATOM 0 HD2 TYR A 24 9.084 -7.538 -0.422 1.00 55.33 H new ATOM 0 HE1 TYR A 24 4.378 -6.571 -1.433 1.00 24.02 H new ATOM 0 HE2 TYR A 24 7.762 -9.134 -1.718 1.00 50.01 H new ATOM 0 HH TYR A 24 4.569 -9.255 -1.822 1.00 70.33 H new ATOM 397 N ARG A 25 10.341 -2.898 1.071 1.00 5.11 N ATOM 398 CA ARG A 25 11.380 -2.025 1.708 1.00 0.21 C ATOM 399 C ARG A 25 11.009 -0.507 1.761 1.00 50.34 C ATOM 400 O ARG A 25 11.615 0.258 2.528 1.00 75.05 O ATOM 401 CB ARG A 25 12.722 -2.221 0.959 1.00 5.03 C ATOM 402 CG ARG A 25 13.257 -3.671 1.011 1.00 53.12 C ATOM 403 CD ARG A 25 13.729 -4.089 2.409 1.00 61.14 C ATOM 404 NE ARG A 25 14.983 -3.425 2.804 1.00 72.32 N ATOM 405 CZ ARG A 25 15.408 -3.269 4.043 1.00 54.11 C ATOM 406 NH1 ARG A 25 14.636 -3.504 5.062 1.00 15.20 N ATOM 407 NH2 ARG A 25 16.601 -2.827 4.246 1.00 51.42 N ATOM 0 H ARG A 25 10.724 -3.552 0.389 1.00 5.11 H new ATOM 0 HA ARG A 25 11.456 -2.337 2.750 1.00 0.21 H new ATOM 0 HB2 ARG A 25 12.593 -1.928 -0.083 1.00 5.03 H new ATOM 0 HB3 ARG A 25 13.468 -1.552 1.388 1.00 5.03 H new ATOM 0 HG2 ARG A 25 12.474 -4.353 0.680 1.00 53.12 H new ATOM 0 HG3 ARG A 25 14.085 -3.772 0.309 1.00 53.12 H new ATOM 0 HD2 ARG A 25 12.952 -3.853 3.137 1.00 61.14 H new ATOM 0 HD3 ARG A 25 13.871 -5.169 2.433 1.00 61.14 H new ATOM 0 HE ARG A 25 15.572 -3.055 2.058 1.00 72.32 H new ATOM 0 HH11 ARG A 25 13.677 -3.817 4.914 1.00 15.20 H new ATOM 0 HH12 ARG A 25 14.990 -3.375 6.010 1.00 15.20 H new ATOM 0 HH21 ARG A 25 17.203 -2.603 3.454 1.00 51.42 H new ATOM 0 HH22 ARG A 25 16.943 -2.701 5.199 1.00 51.42 H new ATOM 421 N GLN A 26 10.019 -0.082 0.958 1.00 5.13 N ATOM 422 CA GLN A 26 9.364 1.234 1.110 1.00 72.11 C ATOM 423 C GLN A 26 8.174 1.116 2.124 1.00 52.05 C ATOM 424 O GLN A 26 8.190 1.746 3.191 1.00 10.41 O ATOM 425 CB GLN A 26 8.898 1.743 -0.297 1.00 71.14 C ATOM 426 CG GLN A 26 8.701 3.275 -0.440 1.00 53.24 C ATOM 427 CD GLN A 26 7.522 3.860 0.348 1.00 63.13 C ATOM 428 OE1 GLN A 26 6.512 3.205 0.563 1.00 13.12 O ATOM 429 NE2 GLN A 26 7.638 5.109 0.769 1.00 62.12 N ATOM 0 H GLN A 26 9.649 -0.637 0.186 1.00 5.13 H new ATOM 0 HA GLN A 26 10.064 1.966 1.514 1.00 72.11 H new ATOM 0 HB2 GLN A 26 9.630 1.421 -1.038 1.00 71.14 H new ATOM 0 HB3 GLN A 26 7.957 1.252 -0.545 1.00 71.14 H new ATOM 0 HG2 GLN A 26 9.615 3.774 -0.118 1.00 53.24 H new ATOM 0 HG3 GLN A 26 8.564 3.510 -1.495 1.00 53.24 H new ATOM 0 HE21 GLN A 26 8.491 5.635 0.577 1.00 62.12 H new ATOM 0 HE22 GLN A 26 6.875 5.546 1.285 1.00 62.12 H new ATOM 438 N ILE A 27 7.175 0.266 1.784 1.00 12.21 N ATOM 439 CA ILE A 27 5.867 0.161 2.507 1.00 44.41 C ATOM 440 C ILE A 27 5.965 -0.653 3.838 1.00 42.24 C ATOM 441 O ILE A 27 5.764 -0.110 4.928 1.00 10.21 O ATOM 442 CB ILE A 27 4.771 -0.490 1.574 1.00 73.20 C ATOM 443 CG1 ILE A 27 4.636 0.298 0.238 1.00 51.24 C ATOM 444 CG2 ILE A 27 3.392 -0.595 2.283 1.00 70.41 C ATOM 445 CD1 ILE A 27 3.671 -0.320 -0.756 1.00 33.01 C ATOM 0 H ILE A 27 7.247 -0.375 0.994 1.00 12.21 H new ATOM 0 HA ILE A 27 5.581 1.180 2.769 1.00 44.41 H new ATOM 0 HB ILE A 27 5.105 -1.503 1.349 1.00 73.20 H new ATOM 0 HG12 ILE A 27 4.309 1.314 0.460 1.00 51.24 H new ATOM 0 HG13 ILE A 27 5.619 0.374 -0.227 1.00 51.24 H new ATOM 0 HG21 ILE A 27 2.668 -1.048 1.606 1.00 70.41 H new ATOM 0 HG22 ILE A 27 3.488 -1.212 3.177 1.00 70.41 H new ATOM 0 HG23 ILE A 27 3.051 0.401 2.565 1.00 70.41 H new ATOM 0 HD11 ILE A 27 3.637 0.291 -1.658 1.00 33.01 H new ATOM 0 HD12 ILE A 27 4.006 -1.325 -1.011 1.00 33.01 H new ATOM 0 HD13 ILE A 27 2.676 -0.370 -0.314 1.00 33.01 H new ATOM 457 N PHE A 28 6.263 -1.963 3.724 1.00 31.11 N ATOM 458 CA PHE A 28 6.361 -2.903 4.883 1.00 14.44 C ATOM 459 C PHE A 28 7.667 -2.700 5.705 1.00 11.42 C ATOM 460 O PHE A 28 7.819 -3.308 6.785 1.00 15.21 O ATOM 461 CB PHE A 28 6.298 -4.373 4.376 1.00 53.21 C ATOM 462 CG PHE A 28 4.990 -4.753 3.674 1.00 62.22 C ATOM 463 CD1 PHE A 28 4.755 -4.381 2.355 1.00 3.04 C ATOM 464 CD2 PHE A 28 4.004 -5.491 4.331 1.00 4.13 C ATOM 465 CE1 PHE A 28 3.585 -4.730 1.717 1.00 30.31 C ATOM 466 CE2 PHE A 28 2.830 -5.838 3.686 1.00 51.52 C ATOM 467 CZ PHE A 28 2.623 -5.457 2.382 1.00 44.30 C ATOM 0 H PHE A 28 6.445 -2.411 2.826 1.00 31.11 H new ATOM 0 HA PHE A 28 5.519 -2.690 5.541 1.00 14.44 H new ATOM 0 HB2 PHE A 28 7.126 -4.541 3.687 1.00 53.21 H new ATOM 0 HB3 PHE A 28 6.447 -5.042 5.224 1.00 53.21 H new ATOM 0 HD1 PHE A 28 5.501 -3.810 1.823 1.00 3.04 H new ATOM 0 HD2 PHE A 28 4.159 -5.795 5.356 1.00 4.13 H new ATOM 0 HE1 PHE A 28 3.422 -4.432 0.692 1.00 30.31 H new ATOM 0 HE2 PHE A 28 2.076 -6.409 4.208 1.00 51.52 H new ATOM 0 HZ PHE A 28 1.706 -5.728 1.879 1.00 44.30 H new ATOM 477 N GLU A 29 8.600 -1.873 5.156 1.00 70.44 N ATOM 478 CA GLU A 29 9.936 -1.558 5.731 1.00 61.10 C ATOM 479 C GLU A 29 10.961 -2.706 5.541 1.00 45.11 C ATOM 480 O GLU A 29 12.032 -2.505 4.961 1.00 33.53 O ATOM 481 CB GLU A 29 9.824 -1.068 7.227 1.00 42.31 C ATOM 482 CG GLU A 29 11.153 -0.836 8.009 1.00 52.42 C ATOM 483 CD GLU A 29 11.799 -2.130 8.561 1.00 40.31 C ATOM 484 OE1 GLU A 29 11.143 -2.820 9.360 1.00 62.53 O ATOM 485 OE2 GLU A 29 12.945 -2.463 8.186 1.00 62.34 O ATOM 0 H GLU A 29 8.436 -1.392 4.272 1.00 70.44 H new ATOM 0 HA GLU A 29 10.337 -0.722 5.159 1.00 61.10 H new ATOM 0 HB2 GLU A 29 9.262 -0.134 7.234 1.00 42.31 H new ATOM 0 HB3 GLU A 29 9.233 -1.800 7.778 1.00 42.31 H new ATOM 0 HG2 GLU A 29 11.866 -0.339 7.351 1.00 52.42 H new ATOM 0 HG3 GLU A 29 10.959 -0.157 8.840 1.00 52.42 H new ATOM 492 N ARG A 30 10.609 -3.897 6.018 1.00 23.23 N ATOM 493 CA ARG A 30 11.549 -5.023 6.203 1.00 64.33 C ATOM 494 C ARG A 30 11.767 -5.845 4.910 1.00 4.30 C ATOM 495 O ARG A 30 10.939 -5.838 3.988 1.00 5.15 O ATOM 496 CB ARG A 30 11.029 -5.953 7.330 1.00 52.10 C ATOM 497 CG ARG A 30 9.556 -6.394 7.138 1.00 64.01 C ATOM 498 CD ARG A 30 9.241 -7.741 7.820 1.00 20.31 C ATOM 499 NE ARG A 30 10.054 -8.842 7.260 1.00 62.32 N ATOM 500 CZ ARG A 30 9.946 -10.119 7.570 1.00 40.42 C ATOM 501 NH1 ARG A 30 9.091 -10.544 8.455 1.00 14.10 N ATOM 502 NH2 ARG A 30 10.735 -10.967 7.000 1.00 34.24 N ATOM 0 H ARG A 30 9.653 -4.120 6.294 1.00 23.23 H new ATOM 0 HA ARG A 30 12.514 -4.594 6.475 1.00 64.33 H new ATOM 0 HB2 ARG A 30 11.662 -6.839 7.379 1.00 52.10 H new ATOM 0 HB3 ARG A 30 11.124 -5.439 8.287 1.00 52.10 H new ATOM 0 HG2 ARG A 30 8.896 -5.625 7.540 1.00 64.01 H new ATOM 0 HG3 ARG A 30 9.341 -6.473 6.072 1.00 64.01 H new ATOM 0 HD2 ARG A 30 9.428 -7.659 8.891 1.00 20.31 H new ATOM 0 HD3 ARG A 30 8.183 -7.972 7.698 1.00 20.31 H new ATOM 0 HE ARG A 30 10.763 -8.591 6.571 1.00 62.32 H new ATOM 0 HH11 ARG A 30 8.479 -9.882 8.932 1.00 14.10 H new ATOM 0 HH12 ARG A 30 9.033 -11.539 8.671 1.00 14.10 H new ATOM 0 HH21 ARG A 30 11.427 -10.645 6.323 1.00 34.24 H new ATOM 0 HH22 ARG A 30 10.667 -11.959 7.227 1.00 34.24 H new ATOM 516 N ASP A 31 12.927 -6.524 4.868 1.00 62.52 N ATOM 517 CA ASP A 31 13.255 -7.514 3.824 1.00 3.54 C ATOM 518 C ASP A 31 12.260 -8.693 3.893 1.00 52.40 C ATOM 519 O ASP A 31 12.170 -9.366 4.931 1.00 71.53 O ATOM 520 CB ASP A 31 14.704 -8.045 4.006 1.00 75.25 C ATOM 521 CG ASP A 31 15.752 -6.923 4.079 1.00 23.10 C ATOM 522 OD1 ASP A 31 16.270 -6.500 3.027 1.00 4.43 O ATOM 523 OD2 ASP A 31 16.058 -6.458 5.201 1.00 12.35 O ATOM 0 H ASP A 31 13.667 -6.402 5.559 1.00 62.52 H new ATOM 0 HA ASP A 31 13.181 -7.028 2.851 1.00 3.54 H new ATOM 0 HB2 ASP A 31 14.754 -8.641 4.917 1.00 75.25 H new ATOM 0 HB3 ASP A 31 14.948 -8.709 3.177 1.00 75.25 H new ATOM 528 N ILE A 32 11.509 -8.947 2.807 1.00 60.33 N ATOM 529 CA ILE A 32 10.627 -10.121 2.688 1.00 63.33 C ATOM 530 C ILE A 32 11.278 -11.053 1.643 1.00 41.25 C ATOM 531 O ILE A 32 11.492 -10.629 0.498 1.00 44.41 O ATOM 532 CB ILE A 32 9.170 -9.708 2.221 1.00 53.00 C ATOM 533 CG1 ILE A 32 8.512 -8.735 3.259 1.00 32.40 C ATOM 534 CG2 ILE A 32 8.274 -10.954 1.967 1.00 70.35 C ATOM 535 CD1 ILE A 32 7.112 -8.249 2.893 1.00 42.35 C ATOM 0 H ILE A 32 11.497 -8.343 1.985 1.00 60.33 H new ATOM 0 HA ILE A 32 10.518 -10.613 3.654 1.00 63.33 H new ATOM 0 HB ILE A 32 9.261 -9.181 1.272 1.00 53.00 H new ATOM 0 HG12 ILE A 32 8.464 -9.237 4.225 1.00 32.40 H new ATOM 0 HG13 ILE A 32 9.160 -7.868 3.382 1.00 32.40 H new ATOM 0 HG21 ILE A 32 7.283 -10.631 1.648 1.00 70.35 H new ATOM 0 HG22 ILE A 32 8.722 -11.572 1.188 1.00 70.35 H new ATOM 0 HG23 ILE A 32 8.188 -11.534 2.886 1.00 70.35 H new ATOM 0 HD11 ILE A 32 6.743 -7.582 3.672 1.00 42.35 H new ATOM 0 HD12 ILE A 32 7.149 -7.713 1.945 1.00 42.35 H new ATOM 0 HD13 ILE A 32 6.443 -9.104 2.801 1.00 42.35 H new ATOM 547 N ALA A 33 11.611 -12.292 2.062 1.00 12.15 N ATOM 548 CA ALA A 33 12.392 -13.248 1.244 1.00 53.40 C ATOM 549 C ALA A 33 11.732 -13.507 -0.142 1.00 33.23 C ATOM 550 O ALA A 33 10.524 -13.717 -0.199 1.00 54.23 O ATOM 551 CB ALA A 33 12.583 -14.560 2.017 1.00 61.32 C ATOM 0 H ALA A 33 11.347 -12.659 2.976 1.00 12.15 H new ATOM 0 HA ALA A 33 13.368 -12.804 1.048 1.00 53.40 H new ATOM 0 HB1 ALA A 33 13.158 -15.259 1.410 1.00 61.32 H new ATOM 0 HB2 ALA A 33 13.118 -14.361 2.946 1.00 61.32 H new ATOM 0 HB3 ALA A 33 11.609 -14.993 2.245 1.00 61.32 H new ATOM 557 N PRO A 34 12.522 -13.488 -1.276 1.00 50.51 N ATOM 558 CA PRO A 34 11.981 -13.590 -2.673 1.00 1.13 C ATOM 559 C PRO A 34 11.016 -14.784 -2.923 1.00 22.50 C ATOM 560 O PRO A 34 10.099 -14.686 -3.753 1.00 71.11 O ATOM 561 CB PRO A 34 13.263 -13.718 -3.537 1.00 60.35 C ATOM 562 CG PRO A 34 14.315 -13.015 -2.739 1.00 60.32 C ATOM 563 CD PRO A 34 14.009 -13.341 -1.292 1.00 64.42 C ATOM 0 HA PRO A 34 11.357 -12.728 -2.907 1.00 1.13 H new ATOM 0 HB2 PRO A 34 13.525 -14.762 -3.709 1.00 60.35 H new ATOM 0 HB3 PRO A 34 13.131 -13.257 -4.516 1.00 60.35 H new ATOM 0 HG2 PRO A 34 15.312 -13.357 -3.016 1.00 60.32 H new ATOM 0 HG3 PRO A 34 14.287 -11.939 -2.914 1.00 60.32 H new ATOM 0 HD2 PRO A 34 14.507 -14.257 -0.973 1.00 64.42 H new ATOM 0 HD3 PRO A 34 14.341 -12.548 -0.623 1.00 64.42 H new ATOM 571 N TYR A 35 11.232 -15.903 -2.197 1.00 73.21 N ATOM 572 CA TYR A 35 10.338 -17.083 -2.259 1.00 41.12 C ATOM 573 C TYR A 35 9.016 -16.853 -1.476 1.00 34.32 C ATOM 574 O TYR A 35 7.952 -17.259 -1.932 1.00 4.42 O ATOM 575 CB TYR A 35 11.065 -18.374 -1.790 1.00 40.41 C ATOM 576 CG TYR A 35 11.578 -18.385 -0.334 1.00 33.32 C ATOM 577 CD1 TYR A 35 12.837 -17.871 -0.002 1.00 62.21 C ATOM 578 CD2 TYR A 35 10.818 -18.937 0.707 1.00 73.43 C ATOM 579 CE1 TYR A 35 13.310 -17.905 1.298 1.00 2.44 C ATOM 580 CE2 TYR A 35 11.290 -18.968 2.009 1.00 24.52 C ATOM 581 CZ TYR A 35 12.534 -18.453 2.299 1.00 13.43 C ATOM 582 OH TYR A 35 13.006 -18.479 3.599 1.00 64.11 O ATOM 0 H TYR A 35 12.020 -16.015 -1.559 1.00 73.21 H new ATOM 0 HA TYR A 35 10.066 -17.223 -3.305 1.00 41.12 H new ATOM 0 HB2 TYR A 35 10.384 -19.215 -1.918 1.00 40.41 H new ATOM 0 HB3 TYR A 35 11.913 -18.548 -2.452 1.00 40.41 H new ATOM 0 HD1 TYR A 35 13.452 -17.439 -0.777 1.00 62.21 H new ATOM 0 HD2 TYR A 35 9.843 -19.347 0.489 1.00 73.43 H new ATOM 0 HE1 TYR A 35 14.285 -17.503 1.529 1.00 2.44 H new ATOM 0 HE2 TYR A 35 10.684 -19.395 2.795 1.00 24.52 H new ATOM 0 HH TYR A 35 12.338 -18.897 4.181 1.00 64.11 H new ATOM 592 N ILE A 36 9.089 -16.182 -0.304 1.00 34.22 N ATOM 593 CA ILE A 36 7.882 -15.820 0.495 1.00 61.54 C ATOM 594 C ILE A 36 6.985 -14.843 -0.304 1.00 2.14 C ATOM 595 O ILE A 36 5.782 -15.057 -0.428 1.00 14.14 O ATOM 596 CB ILE A 36 8.271 -15.176 1.887 1.00 63.53 C ATOM 597 CG1 ILE A 36 9.159 -16.160 2.711 1.00 33.35 C ATOM 598 CG2 ILE A 36 7.013 -14.758 2.699 1.00 52.34 C ATOM 599 CD1 ILE A 36 9.654 -15.630 4.051 1.00 71.20 C ATOM 0 H ILE A 36 9.968 -15.878 0.115 1.00 34.22 H new ATOM 0 HA ILE A 36 7.332 -16.740 0.694 1.00 61.54 H new ATOM 0 HB ILE A 36 8.844 -14.271 1.686 1.00 63.53 H new ATOM 0 HG12 ILE A 36 8.591 -17.073 2.888 1.00 33.35 H new ATOM 0 HG13 ILE A 36 10.024 -16.435 2.107 1.00 33.35 H new ATOM 0 HG21 ILE A 36 7.322 -14.320 3.648 1.00 52.34 H new ATOM 0 HG22 ILE A 36 6.440 -14.025 2.131 1.00 52.34 H new ATOM 0 HG23 ILE A 36 6.394 -15.635 2.888 1.00 52.34 H new ATOM 0 HD11 ILE A 36 10.261 -16.391 4.542 1.00 71.20 H new ATOM 0 HD12 ILE A 36 10.255 -14.735 3.889 1.00 71.20 H new ATOM 0 HD13 ILE A 36 8.800 -15.384 4.683 1.00 71.20 H new ATOM 611 N ALA A 37 7.617 -13.799 -0.872 1.00 51.13 N ATOM 612 CA ALA A 37 6.943 -12.768 -1.698 1.00 31.12 C ATOM 613 C ALA A 37 6.174 -13.378 -2.902 1.00 3.15 C ATOM 614 O ALA A 37 5.031 -12.999 -3.174 1.00 14.43 O ATOM 615 CB ALA A 37 7.985 -11.749 -2.191 1.00 34.10 C ATOM 0 H ALA A 37 8.620 -13.642 -0.772 1.00 51.13 H new ATOM 0 HA ALA A 37 6.202 -12.273 -1.071 1.00 31.12 H new ATOM 0 HB1 ALA A 37 7.492 -10.990 -2.799 1.00 34.10 H new ATOM 0 HB2 ALA A 37 8.463 -11.274 -1.334 1.00 34.10 H new ATOM 0 HB3 ALA A 37 8.739 -12.260 -2.790 1.00 34.10 H new ATOM 621 N GLN A 38 6.819 -14.341 -3.598 1.00 13.22 N ATOM 622 CA GLN A 38 6.228 -14.989 -4.797 1.00 43.11 C ATOM 623 C GLN A 38 5.119 -16.014 -4.426 1.00 52.03 C ATOM 624 O GLN A 38 4.263 -16.311 -5.250 1.00 43.10 O ATOM 625 CB GLN A 38 7.333 -15.666 -5.669 1.00 32.41 C ATOM 626 CG GLN A 38 7.823 -17.047 -5.177 1.00 32.42 C ATOM 627 CD GLN A 38 9.004 -17.623 -5.973 1.00 21.33 C ATOM 628 OE1 GLN A 38 9.972 -16.792 -6.321 1.00 14.24 O flip ATOM 629 NE2 GLN A 38 9.086 -18.823 -6.198 1.00 10.05 N flip ATOM 0 H GLN A 38 7.746 -14.688 -3.353 1.00 13.22 H new ATOM 0 HA GLN A 38 5.757 -14.200 -5.383 1.00 43.11 H new ATOM 0 HB2 GLN A 38 6.952 -15.777 -6.684 1.00 32.41 H new ATOM 0 HB3 GLN A 38 8.190 -14.995 -5.722 1.00 32.41 H new ATOM 0 HG2 GLN A 38 8.113 -16.964 -4.130 1.00 32.42 H new ATOM 0 HG3 GLN A 38 6.992 -17.751 -5.223 1.00 32.42 H new ATOM 0 HE21 GLN A 38 8.328 -19.447 -5.921 1.00 10.05 H new ATOM 0 HE22 GLN A 38 9.912 -19.200 -6.662 1.00 10.05 H new ATOM 638 N ASN A 39 5.163 -16.580 -3.199 1.00 75.54 N ATOM 639 CA ASN A 39 4.120 -17.525 -2.715 1.00 52.22 C ATOM 640 C ASN A 39 2.852 -16.778 -2.235 1.00 55.42 C ATOM 641 O ASN A 39 1.733 -17.139 -2.610 1.00 13.42 O ATOM 642 CB ASN A 39 4.676 -18.426 -1.582 1.00 42.12 C ATOM 643 CG ASN A 39 5.757 -19.400 -2.056 1.00 25.44 C ATOM 644 OD1 ASN A 39 5.760 -19.839 -3.203 1.00 3.35 O ATOM 645 ND2 ASN A 39 6.678 -19.756 -1.177 1.00 64.00 N ATOM 0 H ASN A 39 5.906 -16.402 -2.524 1.00 75.54 H new ATOM 0 HA ASN A 39 3.837 -18.156 -3.557 1.00 52.22 H new ATOM 0 HB2 ASN A 39 5.086 -17.795 -0.794 1.00 42.12 H new ATOM 0 HB3 ASN A 39 3.855 -18.992 -1.142 1.00 42.12 H new ATOM 0 HD21 ASN A 39 7.413 -20.410 -1.445 1.00 64.00 H new ATOM 0 HD22 ASN A 39 6.653 -19.377 -0.230 1.00 64.00 H new ATOM 652 N GLU A 40 3.050 -15.729 -1.411 1.00 45.34 N ATOM 653 CA GLU A 40 1.946 -14.907 -0.851 1.00 50.11 C ATOM 654 C GLU A 40 1.211 -14.124 -1.966 1.00 32.20 C ATOM 655 O GLU A 40 -0.017 -14.171 -2.085 1.00 21.00 O ATOM 656 CB GLU A 40 2.501 -13.906 0.202 1.00 23.32 C ATOM 657 CG GLU A 40 3.204 -14.546 1.419 1.00 10.45 C ATOM 658 CD GLU A 40 2.269 -15.399 2.293 1.00 42.41 C ATOM 659 OE1 GLU A 40 1.447 -14.817 3.032 1.00 13.43 O ATOM 660 OE2 GLU A 40 2.347 -16.646 2.245 1.00 74.12 O ATOM 0 H GLU A 40 3.977 -15.424 -1.112 1.00 45.34 H new ATOM 0 HA GLU A 40 1.237 -15.584 -0.374 1.00 50.11 H new ATOM 0 HB2 GLU A 40 3.206 -13.238 -0.293 1.00 23.32 H new ATOM 0 HB3 GLU A 40 1.677 -13.290 0.562 1.00 23.32 H new ATOM 0 HG2 GLU A 40 4.026 -15.169 1.067 1.00 10.45 H new ATOM 0 HG3 GLU A 40 3.641 -13.757 2.032 1.00 10.45 H new ATOM 667 N PHE A 41 2.006 -13.414 -2.780 1.00 61.12 N ATOM 668 CA PHE A 41 1.512 -12.555 -3.877 1.00 15.20 C ATOM 669 C PHE A 41 1.736 -13.246 -5.246 1.00 65.22 C ATOM 670 O PHE A 41 2.212 -12.624 -6.192 1.00 11.33 O ATOM 671 CB PHE A 41 2.235 -11.174 -3.808 1.00 12.33 C ATOM 672 CG PHE A 41 2.029 -10.421 -2.486 1.00 31.21 C ATOM 673 CD1 PHE A 41 0.935 -9.573 -2.303 1.00 53.33 C ATOM 674 CD2 PHE A 41 2.928 -10.567 -1.421 1.00 62.40 C ATOM 675 CE1 PHE A 41 0.749 -8.897 -1.109 1.00 43.21 C ATOM 676 CE2 PHE A 41 2.740 -9.889 -0.229 1.00 12.22 C ATOM 677 CZ PHE A 41 1.652 -9.056 -0.074 1.00 54.42 C ATOM 0 H PHE A 41 3.023 -13.417 -2.698 1.00 61.12 H new ATOM 0 HA PHE A 41 0.440 -12.394 -3.767 1.00 15.20 H new ATOM 0 HB2 PHE A 41 3.303 -11.328 -3.963 1.00 12.33 H new ATOM 0 HB3 PHE A 41 1.880 -10.549 -4.628 1.00 12.33 H new ATOM 0 HD1 PHE A 41 0.223 -9.442 -3.105 1.00 53.33 H new ATOM 0 HD2 PHE A 41 3.782 -11.219 -1.532 1.00 62.40 H new ATOM 0 HE1 PHE A 41 -0.103 -8.244 -0.986 1.00 43.21 H new ATOM 0 HE2 PHE A 41 3.445 -10.012 0.580 1.00 12.22 H new ATOM 0 HZ PHE A 41 1.505 -8.528 0.856 1.00 54.42 H new ATOM 687 N SER A 42 1.344 -14.532 -5.348 1.00 41.31 N ATOM 688 CA SER A 42 1.578 -15.353 -6.570 1.00 12.42 C ATOM 689 C SER A 42 0.797 -14.816 -7.796 1.00 23.15 C ATOM 690 O SER A 42 1.379 -14.570 -8.858 1.00 24.31 O ATOM 691 CB SER A 42 1.193 -16.829 -6.297 1.00 34.31 C ATOM 692 OG SER A 42 1.507 -17.671 -7.400 1.00 33.13 O ATOM 0 H SER A 42 0.862 -15.032 -4.601 1.00 41.31 H new ATOM 0 HA SER A 42 2.640 -15.289 -6.809 1.00 12.42 H new ATOM 0 HB2 SER A 42 1.717 -17.183 -5.409 1.00 34.31 H new ATOM 0 HB3 SER A 42 0.126 -16.893 -6.084 1.00 34.31 H new ATOM 0 HG SER A 42 1.252 -18.594 -7.190 1.00 33.13 H new ATOM 698 N GLY A 43 -0.518 -14.614 -7.615 1.00 11.41 N ATOM 699 CA GLY A 43 -1.377 -14.025 -8.653 1.00 51.44 C ATOM 700 C GLY A 43 -1.181 -12.514 -8.816 1.00 21.15 C ATOM 701 O GLY A 43 -1.328 -11.981 -9.917 1.00 52.01 O ATOM 0 H GLY A 43 -1.011 -14.852 -6.754 1.00 11.41 H new ATOM 0 HA2 GLY A 43 -1.173 -14.516 -9.605 1.00 51.44 H new ATOM 0 HA3 GLY A 43 -2.420 -14.225 -8.408 1.00 51.44 H new ATOM 705 N TRP A 44 -0.838 -11.835 -7.705 1.00 23.03 N ATOM 706 CA TRP A 44 -0.713 -10.363 -7.661 1.00 14.24 C ATOM 707 C TRP A 44 0.554 -9.876 -8.419 1.00 32.23 C ATOM 708 O TRP A 44 0.474 -8.961 -9.251 1.00 1.12 O ATOM 709 CB TRP A 44 -0.755 -9.876 -6.181 1.00 23.25 C ATOM 710 CG TRP A 44 -1.116 -8.412 -5.992 1.00 44.30 C ATOM 711 CD1 TRP A 44 -0.483 -7.501 -5.184 1.00 51.44 C ATOM 712 CD2 TRP A 44 -2.217 -7.697 -6.605 1.00 42.22 C ATOM 713 NE1 TRP A 44 -1.090 -6.277 -5.282 1.00 4.52 N ATOM 714 CE2 TRP A 44 -2.157 -6.375 -6.141 1.00 14.41 C ATOM 715 CE3 TRP A 44 -3.237 -8.045 -7.512 1.00 50.10 C ATOM 716 CZ2 TRP A 44 -3.078 -5.407 -6.537 1.00 11.23 C ATOM 717 CZ3 TRP A 44 -4.149 -7.080 -7.901 1.00 73.33 C ATOM 718 CH2 TRP A 44 -4.057 -5.771 -7.417 1.00 11.52 C ATOM 0 H TRP A 44 -0.640 -12.289 -6.813 1.00 23.03 H new ATOM 0 HA TRP A 44 -1.560 -9.917 -8.182 1.00 14.24 H new ATOM 0 HB2 TRP A 44 -1.476 -10.485 -5.635 1.00 23.25 H new ATOM 0 HB3 TRP A 44 0.220 -10.055 -5.729 1.00 23.25 H new ATOM 0 HD1 TRP A 44 0.371 -7.718 -4.560 1.00 51.44 H new ATOM 0 HE1 TRP A 44 -0.797 -5.430 -4.796 1.00 4.52 H new ATOM 0 HE3 TRP A 44 -3.306 -9.051 -7.898 1.00 50.10 H new ATOM 0 HZ2 TRP A 44 -3.019 -4.397 -6.159 1.00 11.23 H new ATOM 0 HZ3 TRP A 44 -4.942 -7.341 -8.587 1.00 73.33 H new ATOM 0 HH2 TRP A 44 -4.774 -5.033 -7.746 1.00 11.52 H new ATOM 729 N GLU A 45 1.728 -10.466 -8.101 1.00 1.33 N ATOM 730 CA GLU A 45 2.964 -10.353 -8.930 1.00 21.01 C ATOM 731 C GLU A 45 2.734 -10.677 -10.434 1.00 43.15 C ATOM 732 O GLU A 45 3.339 -10.036 -11.311 1.00 31.50 O ATOM 733 CB GLU A 45 4.061 -11.290 -8.342 1.00 4.00 C ATOM 734 CG GLU A 45 5.424 -11.253 -9.070 1.00 2.41 C ATOM 735 CD GLU A 45 6.492 -12.170 -8.446 1.00 30.25 C ATOM 736 OE1 GLU A 45 6.998 -11.854 -7.345 1.00 74.30 O ATOM 737 OE2 GLU A 45 6.854 -13.200 -9.061 1.00 3.44 O ATOM 0 H GLU A 45 1.852 -11.035 -7.264 1.00 1.33 H new ATOM 0 HA GLU A 45 3.284 -9.312 -8.890 1.00 21.01 H new ATOM 0 HB2 GLU A 45 4.219 -11.025 -7.297 1.00 4.00 H new ATOM 0 HB3 GLU A 45 3.687 -12.314 -8.358 1.00 4.00 H new ATOM 0 HG2 GLU A 45 5.276 -11.540 -10.111 1.00 2.41 H new ATOM 0 HG3 GLU A 45 5.796 -10.228 -9.072 1.00 2.41 H new ATOM 744 N SER A 46 1.878 -11.680 -10.723 1.00 73.12 N ATOM 745 CA SER A 46 1.505 -12.034 -12.117 1.00 14.01 C ATOM 746 C SER A 46 0.706 -10.897 -12.796 1.00 74.13 C ATOM 747 O SER A 46 0.866 -10.658 -13.987 1.00 21.42 O ATOM 748 CB SER A 46 0.692 -13.354 -12.173 1.00 2.22 C ATOM 749 OG SER A 46 1.463 -14.467 -11.746 1.00 64.12 O ATOM 0 H SER A 46 1.431 -12.261 -10.014 1.00 73.12 H new ATOM 0 HA SER A 46 2.437 -12.179 -12.664 1.00 14.01 H new ATOM 0 HB2 SER A 46 -0.193 -13.262 -11.544 1.00 2.22 H new ATOM 0 HB3 SER A 46 0.343 -13.523 -13.192 1.00 2.22 H new ATOM 0 HG SER A 46 1.475 -14.500 -10.767 1.00 64.12 H new ATOM 755 N LYS A 47 -0.143 -10.194 -12.020 1.00 44.55 N ATOM 756 CA LYS A 47 -0.932 -9.049 -12.530 1.00 74.30 C ATOM 757 C LYS A 47 -0.032 -7.860 -12.956 1.00 71.00 C ATOM 758 O LYS A 47 -0.274 -7.235 -13.989 1.00 52.35 O ATOM 759 CB LYS A 47 -1.975 -8.588 -11.474 1.00 32.52 C ATOM 760 CG LYS A 47 -3.131 -9.581 -11.231 1.00 74.22 C ATOM 761 CD LYS A 47 -3.951 -9.854 -12.515 1.00 62.41 C ATOM 762 CE LYS A 47 -5.137 -10.796 -12.290 1.00 11.42 C ATOM 763 NZ LYS A 47 -5.906 -11.020 -13.541 1.00 52.13 N ATOM 0 H LYS A 47 -0.302 -10.398 -11.033 1.00 44.55 H new ATOM 0 HA LYS A 47 -1.457 -9.394 -13.421 1.00 74.30 H new ATOM 0 HB2 LYS A 47 -1.461 -8.412 -10.529 1.00 32.52 H new ATOM 0 HB3 LYS A 47 -2.395 -7.633 -11.791 1.00 32.52 H new ATOM 0 HG2 LYS A 47 -2.727 -10.521 -10.854 1.00 74.22 H new ATOM 0 HG3 LYS A 47 -3.791 -9.185 -10.459 1.00 74.22 H new ATOM 0 HD2 LYS A 47 -4.318 -8.907 -12.911 1.00 62.41 H new ATOM 0 HD3 LYS A 47 -3.295 -10.283 -13.272 1.00 62.41 H new ATOM 0 HE2 LYS A 47 -4.776 -11.751 -11.909 1.00 11.42 H new ATOM 0 HE3 LYS A 47 -5.795 -10.377 -11.528 1.00 11.42 H new ATOM 0 HZ1 LYS A 47 -6.701 -11.663 -13.349 1.00 52.13 H new ATOM 0 HZ2 LYS A 47 -6.272 -10.112 -13.891 1.00 52.13 H new ATOM 0 HZ3 LYS A 47 -5.284 -11.443 -14.260 1.00 52.13 H new ATOM 777 N LEU A 48 0.998 -7.548 -12.149 1.00 42.25 N ATOM 778 CA LEU A 48 1.953 -6.457 -12.474 1.00 53.31 C ATOM 779 C LEU A 48 2.867 -6.852 -13.668 1.00 70.12 C ATOM 780 O LEU A 48 3.042 -6.075 -14.615 1.00 53.03 O ATOM 781 CB LEU A 48 2.804 -6.081 -11.224 1.00 73.34 C ATOM 782 CG LEU A 48 3.725 -4.822 -11.371 1.00 43.00 C ATOM 783 CD1 LEU A 48 2.907 -3.561 -11.736 1.00 54.44 C ATOM 784 CD2 LEU A 48 4.571 -4.592 -10.098 1.00 45.23 C ATOM 0 H LEU A 48 1.195 -8.029 -11.271 1.00 42.25 H new ATOM 0 HA LEU A 48 1.377 -5.581 -12.771 1.00 53.31 H new ATOM 0 HB2 LEU A 48 2.128 -5.915 -10.386 1.00 73.34 H new ATOM 0 HB3 LEU A 48 3.429 -6.935 -10.965 1.00 73.34 H new ATOM 0 HG LEU A 48 4.413 -5.016 -12.194 1.00 43.00 H new ATOM 0 HD11 LEU A 48 3.578 -2.707 -11.830 1.00 54.44 H new ATOM 0 HD12 LEU A 48 2.391 -3.723 -12.682 1.00 54.44 H new ATOM 0 HD13 LEU A 48 2.175 -3.363 -10.953 1.00 54.44 H new ATOM 0 HD21 LEU A 48 5.199 -3.711 -10.233 1.00 45.23 H new ATOM 0 HD22 LEU A 48 3.910 -4.440 -9.245 1.00 45.23 H new ATOM 0 HD23 LEU A 48 5.201 -5.463 -9.918 1.00 45.23 H new ATOM 796 N GLY A 49 3.478 -8.048 -13.564 1.00 54.15 N ATOM 797 CA GLY A 49 4.293 -8.636 -14.650 1.00 34.33 C ATOM 798 C GLY A 49 3.638 -8.683 -16.048 1.00 53.40 C ATOM 799 O GLY A 49 4.249 -8.252 -17.036 1.00 54.31 O ATOM 0 H GLY A 49 3.422 -8.633 -12.730 1.00 54.15 H new ATOM 0 HA2 GLY A 49 5.221 -8.070 -14.726 1.00 34.33 H new ATOM 0 HA3 GLY A 49 4.562 -9.653 -14.364 1.00 34.33 H new ATOM 803 N ASN A 50 2.411 -9.225 -16.137 1.00 70.53 N ATOM 804 CA ASN A 50 1.607 -9.243 -17.403 1.00 73.31 C ATOM 805 C ASN A 50 1.020 -7.854 -17.799 1.00 63.03 C ATOM 806 O ASN A 50 0.356 -7.733 -18.832 1.00 61.31 O ATOM 807 CB ASN A 50 0.453 -10.272 -17.254 1.00 44.44 C ATOM 808 CG ASN A 50 0.915 -11.712 -16.980 1.00 32.42 C ATOM 809 OD1 ASN A 50 1.980 -11.957 -16.420 1.00 71.42 O ATOM 810 ND2 ASN A 50 0.105 -12.682 -17.356 1.00 43.40 N ATOM 0 H ASN A 50 1.938 -9.664 -15.347 1.00 70.53 H new ATOM 0 HA ASN A 50 2.289 -9.524 -18.205 1.00 73.31 H new ATOM 0 HB2 ASN A 50 -0.199 -9.952 -16.441 1.00 44.44 H new ATOM 0 HB3 ASN A 50 -0.145 -10.263 -18.165 1.00 44.44 H new ATOM 0 HD21 ASN A 50 0.359 -13.655 -17.183 1.00 43.40 H new ATOM 0 HD22 ASN A 50 -0.776 -12.460 -17.820 1.00 43.40 H new ATOM 817 N GLY A 51 1.300 -6.824 -16.980 1.00 2.21 N ATOM 818 CA GLY A 51 0.763 -5.464 -17.186 1.00 53.43 C ATOM 819 C GLY A 51 -0.769 -5.359 -17.112 1.00 4.32 C ATOM 820 O GLY A 51 -1.366 -4.466 -17.719 1.00 54.23 O ATOM 0 H GLY A 51 1.901 -6.909 -16.161 1.00 2.21 H new ATOM 0 HA2 GLY A 51 1.195 -4.800 -16.437 1.00 53.43 H new ATOM 0 HA3 GLY A 51 1.092 -5.102 -18.160 1.00 53.43 H new ATOM 824 N GLU A 52 -1.395 -6.286 -16.370 1.00 2.23 N ATOM 825 CA GLU A 52 -2.858 -6.286 -16.102 1.00 24.30 C ATOM 826 C GLU A 52 -3.263 -5.087 -15.207 1.00 70.35 C ATOM 827 O GLU A 52 -4.382 -4.573 -15.295 1.00 33.30 O ATOM 828 CB GLU A 52 -3.258 -7.610 -15.395 1.00 43.24 C ATOM 829 CG GLU A 52 -2.794 -8.906 -16.093 1.00 40.13 C ATOM 830 CD GLU A 52 -3.495 -9.175 -17.433 1.00 75.42 C ATOM 831 OE1 GLU A 52 -4.590 -9.777 -17.421 1.00 41.14 O ATOM 832 OE2 GLU A 52 -2.963 -8.789 -18.497 1.00 24.31 O ATOM 0 H GLU A 52 -0.905 -7.066 -15.932 1.00 2.23 H new ATOM 0 HA GLU A 52 -3.378 -6.198 -17.056 1.00 24.30 H new ATOM 0 HB2 GLU A 52 -2.852 -7.598 -14.384 1.00 43.24 H new ATOM 0 HB3 GLU A 52 -4.344 -7.638 -15.302 1.00 43.24 H new ATOM 0 HG2 GLU A 52 -1.718 -8.852 -16.261 1.00 40.13 H new ATOM 0 HG3 GLU A 52 -2.970 -9.750 -15.426 1.00 40.13 H new ATOM 839 N ILE A 53 -2.324 -4.660 -14.346 1.00 12.24 N ATOM 840 CA ILE A 53 -2.522 -3.573 -13.359 1.00 21.52 C ATOM 841 C ILE A 53 -1.319 -2.605 -13.431 1.00 60.41 C ATOM 842 O ILE A 53 -0.229 -3.002 -13.880 1.00 22.20 O ATOM 843 CB ILE A 53 -2.663 -4.129 -11.880 1.00 41.01 C ATOM 844 CG1 ILE A 53 -1.312 -4.712 -11.351 1.00 64.35 C ATOM 845 CG2 ILE A 53 -3.792 -5.184 -11.782 1.00 21.51 C ATOM 846 CD1 ILE A 53 -1.357 -5.254 -9.934 1.00 32.22 C ATOM 0 H ILE A 53 -1.388 -5.064 -14.312 1.00 12.24 H new ATOM 0 HA ILE A 53 -3.450 -3.057 -13.606 1.00 21.52 H new ATOM 0 HB ILE A 53 -2.931 -3.285 -11.244 1.00 41.01 H new ATOM 0 HG12 ILE A 53 -0.992 -5.511 -12.019 1.00 64.35 H new ATOM 0 HG13 ILE A 53 -0.553 -3.932 -11.401 1.00 64.35 H new ATOM 0 HG21 ILE A 53 -3.864 -5.546 -10.756 1.00 21.51 H new ATOM 0 HG22 ILE A 53 -4.739 -4.731 -12.074 1.00 21.51 H new ATOM 0 HG23 ILE A 53 -3.569 -6.019 -12.446 1.00 21.51 H new ATOM 0 HD11 ILE A 53 -0.374 -5.635 -9.659 1.00 32.22 H new ATOM 0 HD12 ILE A 53 -1.642 -4.456 -9.248 1.00 32.22 H new ATOM 0 HD13 ILE A 53 -2.088 -6.060 -9.876 1.00 32.22 H new ATOM 858 N THR A 54 -1.496 -1.344 -13.001 1.00 73.43 N ATOM 859 CA THR A 54 -0.364 -0.397 -12.823 1.00 32.53 C ATOM 860 C THR A 54 0.337 -0.630 -11.462 1.00 44.24 C ATOM 861 O THR A 54 -0.203 -1.327 -10.589 1.00 1.24 O ATOM 862 CB THR A 54 -0.841 1.096 -12.934 1.00 52.54 C ATOM 863 OG1 THR A 54 0.272 1.992 -12.790 1.00 44.12 O ATOM 864 CG2 THR A 54 -1.913 1.454 -11.891 1.00 23.32 C ATOM 0 H THR A 54 -2.408 -0.950 -12.769 1.00 73.43 H new ATOM 0 HA THR A 54 0.349 -0.587 -13.625 1.00 32.53 H new ATOM 0 HB THR A 54 -1.286 1.205 -13.923 1.00 52.54 H new ATOM 0 HG1 THR A 54 0.666 2.169 -13.670 1.00 44.12 H new ATOM 0 HG21 THR A 54 -2.206 2.497 -12.013 1.00 23.32 H new ATOM 0 HG22 THR A 54 -2.784 0.814 -12.030 1.00 23.32 H new ATOM 0 HG23 THR A 54 -1.510 1.306 -10.889 1.00 23.32 H new ATOM 872 N VAL A 55 1.539 -0.034 -11.285 1.00 12.13 N ATOM 873 CA VAL A 55 2.321 -0.165 -10.034 1.00 23.21 C ATOM 874 C VAL A 55 1.544 0.422 -8.822 1.00 40.12 C ATOM 875 O VAL A 55 1.561 -0.158 -7.755 1.00 43.04 O ATOM 876 CB VAL A 55 3.750 0.496 -10.139 1.00 32.54 C ATOM 877 CG1 VAL A 55 4.563 0.312 -8.830 1.00 43.40 C ATOM 878 CG2 VAL A 55 4.539 -0.054 -11.358 1.00 14.04 C ATOM 0 H VAL A 55 1.989 0.544 -11.995 1.00 12.13 H new ATOM 0 HA VAL A 55 2.468 -1.233 -9.875 1.00 23.21 H new ATOM 0 HB VAL A 55 3.598 1.565 -10.289 1.00 32.54 H new ATOM 0 HG11 VAL A 55 5.541 0.780 -8.940 1.00 43.40 H new ATOM 0 HG12 VAL A 55 4.029 0.778 -8.002 1.00 43.40 H new ATOM 0 HG13 VAL A 55 4.691 -0.751 -8.627 1.00 43.40 H new ATOM 0 HG21 VAL A 55 5.519 0.421 -11.402 1.00 14.04 H new ATOM 0 HG22 VAL A 55 4.663 -1.132 -11.255 1.00 14.04 H new ATOM 0 HG23 VAL A 55 3.990 0.162 -12.274 1.00 14.04 H new ATOM 888 N LYS A 56 0.833 1.540 -9.028 1.00 33.13 N ATOM 889 CA LYS A 56 -0.050 2.183 -8.010 1.00 35.14 C ATOM 890 C LYS A 56 -1.143 1.205 -7.478 1.00 70.12 C ATOM 891 O LYS A 56 -1.275 0.991 -6.275 1.00 72.23 O ATOM 892 CB LYS A 56 -0.655 3.472 -8.706 1.00 12.40 C ATOM 893 CG LYS A 56 -1.938 4.136 -8.126 1.00 33.22 C ATOM 894 CD LYS A 56 -3.268 3.565 -8.698 1.00 64.24 C ATOM 895 CE LYS A 56 -4.519 4.252 -8.120 1.00 53.04 C ATOM 896 NZ LYS A 56 -4.642 5.668 -8.560 1.00 41.24 N ATOM 0 H LYS A 56 0.847 2.041 -9.917 1.00 33.13 H new ATOM 0 HA LYS A 56 0.511 2.462 -7.118 1.00 35.14 H new ATOM 0 HB2 LYS A 56 0.127 4.232 -8.718 1.00 12.40 H new ATOM 0 HB3 LYS A 56 -0.864 3.213 -9.744 1.00 12.40 H new ATOM 0 HG2 LYS A 56 -1.939 4.013 -7.043 1.00 33.22 H new ATOM 0 HG3 LYS A 56 -1.901 5.207 -8.325 1.00 33.22 H new ATOM 0 HD2 LYS A 56 -3.268 3.677 -9.782 1.00 64.24 H new ATOM 0 HD3 LYS A 56 -3.318 2.497 -8.488 1.00 64.24 H new ATOM 0 HE2 LYS A 56 -5.408 3.700 -8.427 1.00 53.04 H new ATOM 0 HE3 LYS A 56 -4.481 4.215 -7.031 1.00 53.04 H new ATOM 0 HZ1 LYS A 56 -5.610 6.004 -8.381 1.00 41.24 H new ATOM 0 HZ2 LYS A 56 -3.967 6.256 -8.030 1.00 41.24 H new ATOM 0 HZ3 LYS A 56 -4.435 5.735 -9.577 1.00 41.24 H new ATOM 910 N GLU A 57 -1.954 0.714 -8.425 1.00 44.23 N ATOM 911 CA GLU A 57 -2.954 -0.362 -8.164 1.00 53.41 C ATOM 912 C GLU A 57 -2.317 -1.588 -7.422 1.00 1.12 C ATOM 913 O GLU A 57 -2.962 -2.203 -6.570 1.00 34.22 O ATOM 914 CB GLU A 57 -3.682 -0.790 -9.468 1.00 12.04 C ATOM 915 CG GLU A 57 -4.878 -1.750 -9.245 1.00 54.33 C ATOM 916 CD GLU A 57 -5.887 -1.754 -10.413 1.00 15.00 C ATOM 917 OE1 GLU A 57 -5.701 -2.515 -11.381 1.00 41.22 O ATOM 918 OE2 GLU A 57 -6.872 -0.985 -10.363 1.00 11.54 O ATOM 0 H GLU A 57 -1.946 1.040 -9.391 1.00 44.23 H new ATOM 0 HA GLU A 57 -3.706 0.054 -7.494 1.00 53.41 H new ATOM 0 HB2 GLU A 57 -4.039 0.103 -9.981 1.00 12.04 H new ATOM 0 HB3 GLU A 57 -2.963 -1.272 -10.130 1.00 12.04 H new ATOM 0 HG2 GLU A 57 -4.500 -2.762 -9.098 1.00 54.33 H new ATOM 0 HG3 GLU A 57 -5.396 -1.467 -8.328 1.00 54.33 H new ATOM 925 N PHE A 58 -1.040 -1.890 -7.735 1.00 64.01 N ATOM 926 CA PHE A 58 -0.244 -2.924 -7.020 1.00 22.13 C ATOM 927 C PHE A 58 0.156 -2.469 -5.574 1.00 72.12 C ATOM 928 O PHE A 58 0.160 -3.279 -4.654 1.00 74.31 O ATOM 929 CB PHE A 58 1.023 -3.287 -7.852 1.00 23.43 C ATOM 930 CG PHE A 58 1.834 -4.460 -7.298 1.00 51.34 C ATOM 931 CD1 PHE A 58 1.529 -5.772 -7.653 1.00 22.34 C ATOM 932 CD2 PHE A 58 2.885 -4.253 -6.401 1.00 33.13 C ATOM 933 CE1 PHE A 58 2.241 -6.832 -7.133 1.00 3.50 C ATOM 934 CE2 PHE A 58 3.589 -5.317 -5.879 1.00 52.33 C ATOM 935 CZ PHE A 58 3.263 -6.605 -6.244 1.00 75.42 C ATOM 0 H PHE A 58 -0.528 -1.429 -8.487 1.00 64.01 H new ATOM 0 HA PHE A 58 -0.871 -3.809 -6.912 1.00 22.13 H new ATOM 0 HB2 PHE A 58 0.717 -3.523 -8.871 1.00 23.43 H new ATOM 0 HB3 PHE A 58 1.668 -2.410 -7.908 1.00 23.43 H new ATOM 0 HD1 PHE A 58 0.723 -5.962 -8.346 1.00 22.34 H new ATOM 0 HD2 PHE A 58 3.149 -3.246 -6.113 1.00 33.13 H new ATOM 0 HE1 PHE A 58 1.995 -7.842 -7.425 1.00 3.50 H new ATOM 0 HE2 PHE A 58 4.396 -5.141 -5.184 1.00 52.33 H new ATOM 0 HZ PHE A 58 3.812 -7.438 -5.830 1.00 75.42 H new ATOM 945 N ILE A 59 0.489 -1.173 -5.404 1.00 23.23 N ATOM 946 CA ILE A 59 0.996 -0.583 -4.124 1.00 22.13 C ATOM 947 C ILE A 59 -0.135 -0.444 -3.068 1.00 33.33 C ATOM 948 O ILE A 59 0.022 -0.839 -1.908 1.00 70.33 O ATOM 949 CB ILE A 59 1.663 0.824 -4.428 1.00 52.41 C ATOM 950 CG1 ILE A 59 3.027 0.649 -5.179 1.00 70.33 C ATOM 951 CG2 ILE A 59 1.821 1.711 -3.170 1.00 13.15 C ATOM 952 CD1 ILE A 59 4.098 -0.109 -4.419 1.00 25.42 C ATOM 0 H ILE A 59 0.416 -0.488 -6.156 1.00 23.23 H new ATOM 0 HA ILE A 59 1.742 -1.256 -3.701 1.00 22.13 H new ATOM 0 HB ILE A 59 0.973 1.355 -5.084 1.00 52.41 H new ATOM 0 HG12 ILE A 59 2.840 0.133 -6.120 1.00 70.33 H new ATOM 0 HG13 ILE A 59 3.414 1.637 -5.429 1.00 70.33 H new ATOM 0 HG21 ILE A 59 2.283 2.658 -3.448 1.00 13.15 H new ATOM 0 HG22 ILE A 59 0.841 1.900 -2.733 1.00 13.15 H new ATOM 0 HG23 ILE A 59 2.451 1.200 -2.441 1.00 13.15 H new ATOM 0 HD11 ILE A 59 5.000 -0.173 -5.028 1.00 25.42 H new ATOM 0 HD12 ILE A 59 4.324 0.414 -3.490 1.00 25.42 H new ATOM 0 HD13 ILE A 59 3.741 -1.114 -4.192 1.00 25.42 H new ATOM 964 N GLU A 60 -1.251 0.157 -3.488 1.00 72.50 N ATOM 965 CA GLU A 60 -2.561 0.082 -2.790 1.00 61.12 C ATOM 966 C GLU A 60 -2.946 -1.402 -2.486 1.00 40.14 C ATOM 967 O GLU A 60 -3.398 -1.752 -1.397 1.00 22.51 O ATOM 968 CB GLU A 60 -3.604 0.742 -3.727 1.00 40.22 C ATOM 969 CG GLU A 60 -4.997 0.963 -3.130 1.00 71.41 C ATOM 970 CD GLU A 60 -5.992 1.498 -4.169 1.00 44.53 C ATOM 971 OE1 GLU A 60 -5.916 2.693 -4.528 1.00 42.52 O ATOM 972 OE2 GLU A 60 -6.845 0.725 -4.649 1.00 2.11 O ATOM 0 H GLU A 60 -1.282 0.722 -4.336 1.00 72.50 H new ATOM 0 HA GLU A 60 -2.520 0.598 -1.831 1.00 61.12 H new ATOM 0 HB2 GLU A 60 -3.213 1.706 -4.052 1.00 40.22 H new ATOM 0 HB3 GLU A 60 -3.706 0.123 -4.618 1.00 40.22 H new ATOM 0 HG2 GLU A 60 -5.369 0.023 -2.722 1.00 71.41 H new ATOM 0 HG3 GLU A 60 -4.928 1.666 -2.300 1.00 71.41 H new ATOM 979 N GLY A 61 -2.667 -2.219 -3.503 1.00 22.24 N ATOM 980 CA GLY A 61 -2.795 -3.685 -3.442 1.00 70.01 C ATOM 981 C GLY A 61 -2.012 -4.312 -2.261 1.00 74.12 C ATOM 982 O GLY A 61 -2.484 -5.250 -1.608 1.00 22.02 O ATOM 0 H GLY A 61 -2.340 -1.881 -4.408 1.00 22.24 H new ATOM 0 HA2 GLY A 61 -3.849 -3.949 -3.353 1.00 70.01 H new ATOM 0 HA3 GLY A 61 -2.437 -4.115 -4.377 1.00 70.01 H new ATOM 986 N LEU A 62 -0.807 -3.760 -1.997 1.00 33.12 N ATOM 987 CA LEU A 62 0.061 -4.159 -0.855 1.00 53.15 C ATOM 988 C LEU A 62 -0.431 -3.569 0.494 1.00 21.14 C ATOM 989 O LEU A 62 -0.299 -4.210 1.538 1.00 25.43 O ATOM 990 CB LEU A 62 1.528 -3.711 -1.108 1.00 54.33 C ATOM 991 CG LEU A 62 2.215 -4.256 -2.397 1.00 12.22 C ATOM 992 CD1 LEU A 62 3.669 -3.751 -2.508 1.00 45.22 C ATOM 993 CD2 LEU A 62 2.130 -5.799 -2.482 1.00 40.32 C ATOM 0 H LEU A 62 -0.402 -3.020 -2.571 1.00 33.12 H new ATOM 0 HA LEU A 62 0.010 -5.246 -0.784 1.00 53.15 H new ATOM 0 HB2 LEU A 62 1.549 -2.622 -1.146 1.00 54.33 H new ATOM 0 HB3 LEU A 62 2.128 -4.012 -0.249 1.00 54.33 H new ATOM 0 HG LEU A 62 1.668 -3.864 -3.254 1.00 12.22 H new ATOM 0 HD11 LEU A 62 4.123 -4.147 -3.416 1.00 45.22 H new ATOM 0 HD12 LEU A 62 3.674 -2.662 -2.545 1.00 45.22 H new ATOM 0 HD13 LEU A 62 4.238 -4.087 -1.641 1.00 45.22 H new ATOM 0 HD21 LEU A 62 2.620 -6.141 -3.394 1.00 40.32 H new ATOM 0 HD22 LEU A 62 2.626 -6.239 -1.617 1.00 40.32 H new ATOM 0 HD23 LEU A 62 1.084 -6.106 -2.495 1.00 40.32 H new ATOM 1005 N GLY A 63 -0.964 -2.329 0.462 1.00 14.31 N ATOM 1006 CA GLY A 63 -1.506 -1.662 1.666 1.00 64.52 C ATOM 1007 C GLY A 63 -2.696 -2.395 2.316 1.00 42.13 C ATOM 1008 O GLY A 63 -2.999 -2.184 3.495 1.00 11.25 O ATOM 0 H GLY A 63 -1.031 -1.768 -0.387 1.00 14.31 H new ATOM 0 HA2 GLY A 63 -0.709 -1.564 2.403 1.00 64.52 H new ATOM 0 HA3 GLY A 63 -1.818 -0.653 1.398 1.00 64.52 H new ATOM 1012 N TYR A 64 -3.376 -3.237 1.519 1.00 63.31 N ATOM 1013 CA TYR A 64 -4.467 -4.122 2.002 1.00 45.23 C ATOM 1014 C TYR A 64 -3.912 -5.370 2.750 1.00 11.21 C ATOM 1015 O TYR A 64 -4.561 -5.876 3.672 1.00 1.22 O ATOM 1016 CB TYR A 64 -5.353 -4.594 0.812 1.00 71.24 C ATOM 1017 CG TYR A 64 -6.083 -3.502 0.000 1.00 23.02 C ATOM 1018 CD1 TYR A 64 -5.931 -2.130 0.247 1.00 14.35 C ATOM 1019 CD2 TYR A 64 -6.937 -3.870 -1.047 1.00 4.24 C ATOM 1020 CE1 TYR A 64 -6.594 -1.183 -0.514 1.00 43.32 C ATOM 1021 CE2 TYR A 64 -7.599 -2.927 -1.804 1.00 42.54 C ATOM 1022 CZ TYR A 64 -7.427 -1.587 -1.539 1.00 10.34 C ATOM 1023 OH TYR A 64 -8.095 -0.648 -2.297 1.00 21.10 O ATOM 0 H TYR A 64 -3.190 -3.328 0.520 1.00 63.31 H new ATOM 0 HA TYR A 64 -5.066 -3.538 2.701 1.00 45.23 H new ATOM 0 HB2 TYR A 64 -4.724 -5.161 0.126 1.00 71.24 H new ATOM 0 HB3 TYR A 64 -6.102 -5.283 1.201 1.00 71.24 H new ATOM 0 HD1 TYR A 64 -5.283 -1.806 1.048 1.00 14.35 H new ATOM 0 HD2 TYR A 64 -7.080 -4.918 -1.267 1.00 4.24 H new ATOM 0 HE1 TYR A 64 -6.460 -0.131 -0.307 1.00 43.32 H new ATOM 0 HE2 TYR A 64 -8.253 -3.239 -2.605 1.00 42.54 H new ATOM 0 HH TYR A 64 -7.512 -0.338 -3.021 1.00 21.10 H new ATOM 1033 N SER A 65 -2.740 -5.878 2.295 1.00 35.44 N ATOM 1034 CA SER A 65 -2.076 -7.103 2.850 1.00 71.25 C ATOM 1035 C SER A 65 -1.969 -7.131 4.401 1.00 72.00 C ATOM 1036 O SER A 65 -1.641 -6.129 5.034 1.00 30.54 O ATOM 1037 CB SER A 65 -0.670 -7.269 2.242 1.00 73.34 C ATOM 1038 OG SER A 65 0.014 -8.401 2.773 1.00 51.45 O ATOM 0 H SER A 65 -2.219 -5.453 1.528 1.00 35.44 H new ATOM 0 HA SER A 65 -2.724 -7.934 2.570 1.00 71.25 H new ATOM 0 HB2 SER A 65 -0.753 -7.371 1.160 1.00 73.34 H new ATOM 0 HB3 SER A 65 -0.084 -6.370 2.433 1.00 73.34 H new ATOM 0 HG SER A 65 0.979 -8.232 2.767 1.00 51.45 H new ATOM 1044 N ASN A 66 -2.189 -8.335 4.974 1.00 63.22 N ATOM 1045 CA ASN A 66 -2.293 -8.569 6.439 1.00 4.51 C ATOM 1046 C ASN A 66 -0.989 -8.213 7.218 1.00 43.14 C ATOM 1047 O ASN A 66 -1.052 -7.805 8.383 1.00 32.22 O ATOM 1048 CB ASN A 66 -2.701 -10.054 6.685 1.00 2.24 C ATOM 1049 CG ASN A 66 -2.904 -10.441 8.160 1.00 10.43 C ATOM 1050 OD1 ASN A 66 -2.642 -11.573 8.560 1.00 1.01 O ATOM 1051 ND2 ASN A 66 -3.387 -9.526 8.982 1.00 14.12 N ATOM 0 H ASN A 66 -2.302 -9.188 4.426 1.00 63.22 H new ATOM 0 HA ASN A 66 -3.057 -7.897 6.828 1.00 4.51 H new ATOM 0 HB2 ASN A 66 -3.625 -10.255 6.143 1.00 2.24 H new ATOM 0 HB3 ASN A 66 -1.934 -10.700 6.258 1.00 2.24 H new ATOM 0 HD21 ASN A 66 -3.547 -9.755 9.963 1.00 14.12 H new ATOM 0 HD22 ASN A 66 -3.600 -8.591 8.636 1.00 14.12 H new ATOM 1058 N LEU A 67 0.181 -8.352 6.567 1.00 73.24 N ATOM 1059 CA LEU A 67 1.495 -7.984 7.173 1.00 11.42 C ATOM 1060 C LEU A 67 1.638 -6.438 7.340 1.00 52.41 C ATOM 1061 O LEU A 67 2.367 -5.953 8.198 1.00 73.32 O ATOM 1062 CB LEU A 67 2.659 -8.569 6.328 1.00 52.30 C ATOM 1063 CG LEU A 67 4.073 -8.508 6.987 1.00 32.23 C ATOM 1064 CD1 LEU A 67 4.082 -9.242 8.345 1.00 70.43 C ATOM 1065 CD2 LEU A 67 5.166 -9.056 6.037 1.00 65.03 C ATOM 0 H LEU A 67 0.253 -8.717 5.617 1.00 73.24 H new ATOM 0 HA LEU A 67 1.541 -8.418 8.172 1.00 11.42 H new ATOM 0 HB2 LEU A 67 2.430 -9.610 6.099 1.00 52.30 H new ATOM 0 HB3 LEU A 67 2.698 -8.035 5.378 1.00 52.30 H new ATOM 0 HG LEU A 67 4.307 -7.460 7.175 1.00 32.23 H new ATOM 0 HD11 LEU A 67 5.078 -9.185 8.783 1.00 70.43 H new ATOM 0 HD12 LEU A 67 3.363 -8.773 9.017 1.00 70.43 H new ATOM 0 HD13 LEU A 67 3.811 -10.287 8.195 1.00 70.43 H new ATOM 0 HD21 LEU A 67 6.137 -8.998 6.528 1.00 65.03 H new ATOM 0 HD22 LEU A 67 4.946 -10.094 5.789 1.00 65.03 H new ATOM 0 HD23 LEU A 67 5.186 -8.462 5.124 1.00 65.03 H new ATOM 1077 N TYR A 68 0.886 -5.705 6.511 1.00 30.35 N ATOM 1078 CA TYR A 68 0.799 -4.227 6.637 1.00 55.12 C ATOM 1079 C TYR A 68 -0.137 -3.882 7.825 1.00 64.40 C ATOM 1080 O TYR A 68 0.079 -2.915 8.563 1.00 10.22 O ATOM 1081 CB TYR A 68 0.338 -3.523 5.332 1.00 51.31 C ATOM 1082 CG TYR A 68 0.530 -1.991 5.370 1.00 41.42 C ATOM 1083 CD1 TYR A 68 1.813 -1.436 5.446 1.00 4.50 C ATOM 1084 CD2 TYR A 68 -0.554 -1.102 5.344 1.00 71.00 C ATOM 1085 CE1 TYR A 68 2.007 -0.067 5.497 1.00 13.12 C ATOM 1086 CE2 TYR A 68 -0.360 0.271 5.390 1.00 71.12 C ATOM 1087 CZ TYR A 68 0.922 0.782 5.468 1.00 72.53 C ATOM 1088 OH TYR A 68 1.121 2.150 5.523 1.00 62.41 O ATOM 0 H TYR A 68 0.331 -6.096 5.750 1.00 30.35 H new ATOM 0 HA TYR A 68 1.803 -3.847 6.827 1.00 55.12 H new ATOM 0 HB2 TYR A 68 0.895 -3.932 4.489 1.00 51.31 H new ATOM 0 HB3 TYR A 68 -0.714 -3.747 5.158 1.00 51.31 H new ATOM 0 HD1 TYR A 68 2.671 -2.092 5.465 1.00 4.50 H new ATOM 0 HD2 TYR A 68 -1.559 -1.493 5.287 1.00 71.00 H new ATOM 0 HE1 TYR A 68 3.007 0.336 5.559 1.00 13.12 H new ATOM 0 HE2 TYR A 68 -1.208 0.939 5.365 1.00 71.12 H new ATOM 0 HH TYR A 68 0.255 2.608 5.492 1.00 62.41 H new ATOM 1098 N LEU A 69 -1.172 -4.730 7.997 1.00 10.21 N ATOM 1099 CA LEU A 69 -2.223 -4.554 9.013 1.00 63.55 C ATOM 1100 C LEU A 69 -1.744 -4.842 10.464 1.00 62.42 C ATOM 1101 O LEU A 69 -2.008 -4.030 11.342 1.00 20.12 O ATOM 1102 CB LEU A 69 -3.495 -5.380 8.634 1.00 34.43 C ATOM 1103 CG LEU A 69 -4.508 -4.692 7.649 1.00 3.34 C ATOM 1104 CD1 LEU A 69 -5.256 -3.528 8.330 1.00 71.14 C ATOM 1105 CD2 LEU A 69 -3.820 -4.203 6.359 1.00 62.54 C ATOM 0 H LEU A 69 -1.300 -5.565 7.426 1.00 10.21 H new ATOM 0 HA LEU A 69 -2.487 -3.497 9.012 1.00 63.55 H new ATOM 0 HB2 LEU A 69 -3.171 -6.321 8.189 1.00 34.43 H new ATOM 0 HB3 LEU A 69 -4.027 -5.629 9.552 1.00 34.43 H new ATOM 0 HG LEU A 69 -5.236 -5.454 7.371 1.00 3.34 H new ATOM 0 HD11 LEU A 69 -5.948 -3.075 7.620 1.00 71.14 H new ATOM 0 HD12 LEU A 69 -5.812 -3.905 9.188 1.00 71.14 H new ATOM 0 HD13 LEU A 69 -4.537 -2.779 8.664 1.00 71.14 H new ATOM 0 HD21 LEU A 69 -4.558 -3.734 5.708 1.00 62.54 H new ATOM 0 HD22 LEU A 69 -3.046 -3.478 6.612 1.00 62.54 H new ATOM 0 HD23 LEU A 69 -3.368 -5.051 5.844 1.00 62.54 H new ATOM 1117 N LYS A 70 -1.099 -5.990 10.794 1.00 64.32 N ATOM 1118 CA LYS A 70 -0.508 -6.157 12.155 1.00 51.20 C ATOM 1119 C LYS A 70 0.658 -5.169 12.503 1.00 42.34 C ATOM 1120 O LYS A 70 0.625 -4.538 13.546 1.00 45.31 O ATOM 1121 CB LYS A 70 -0.094 -7.661 12.330 1.00 33.33 C ATOM 1122 CG LYS A 70 0.972 -8.185 11.322 1.00 53.10 C ATOM 1123 CD LYS A 70 1.027 -9.730 11.194 1.00 30.41 C ATOM 1124 CE LYS A 70 -0.195 -10.301 10.451 1.00 11.34 C ATOM 1125 NZ LYS A 70 -0.087 -11.760 10.183 1.00 53.22 N ATOM 0 H LYS A 70 -0.975 -6.786 10.168 1.00 64.32 H new ATOM 0 HA LYS A 70 -1.275 -5.886 12.880 1.00 51.20 H new ATOM 0 HB2 LYS A 70 0.289 -7.799 13.341 1.00 33.33 H new ATOM 0 HB3 LYS A 70 -0.988 -8.278 12.240 1.00 33.33 H new ATOM 0 HG2 LYS A 70 0.767 -7.758 10.340 1.00 53.10 H new ATOM 0 HG3 LYS A 70 1.953 -7.823 11.628 1.00 53.10 H new ATOM 0 HD2 LYS A 70 1.936 -10.016 10.666 1.00 30.41 H new ATOM 0 HD3 LYS A 70 1.084 -10.173 12.189 1.00 30.41 H new ATOM 0 HE2 LYS A 70 -1.092 -10.112 11.041 1.00 11.34 H new ATOM 0 HE3 LYS A 70 -0.317 -9.772 9.506 1.00 11.34 H new ATOM 0 HZ1 LYS A 70 -0.888 -12.065 9.594 1.00 53.22 H new ATOM 0 HZ2 LYS A 70 0.804 -11.956 9.684 1.00 53.22 H new ATOM 0 HZ3 LYS A 70 -0.101 -12.280 11.083 1.00 53.22 H new ATOM 1139 N GLU A 71 1.710 -5.136 11.676 1.00 23.41 N ATOM 1140 CA GLU A 71 2.858 -4.185 11.866 1.00 53.40 C ATOM 1141 C GLU A 71 2.466 -2.671 12.040 1.00 10.53 C ATOM 1142 O GLU A 71 3.249 -1.911 12.622 1.00 3.15 O ATOM 1143 CB GLU A 71 3.904 -4.344 10.727 1.00 45.12 C ATOM 1144 CG GLU A 71 4.432 -5.789 10.516 1.00 24.44 C ATOM 1145 CD GLU A 71 4.938 -6.486 11.798 1.00 5.44 C ATOM 1146 OE1 GLU A 71 5.828 -5.935 12.480 1.00 11.30 O ATOM 1147 OE2 GLU A 71 4.459 -7.602 12.112 1.00 54.40 O ATOM 0 H GLU A 71 1.808 -5.747 10.865 1.00 23.41 H new ATOM 0 HA GLU A 71 3.293 -4.475 12.823 1.00 53.40 H new ATOM 0 HB2 GLU A 71 3.459 -3.996 9.795 1.00 45.12 H new ATOM 0 HB3 GLU A 71 4.751 -3.691 10.939 1.00 45.12 H new ATOM 0 HG2 GLU A 71 3.635 -6.392 10.081 1.00 24.44 H new ATOM 0 HG3 GLU A 71 5.244 -5.762 9.789 1.00 24.44 H new ATOM 1154 N PHE A 72 1.263 -2.245 11.560 1.00 72.33 N ATOM 1155 CA PHE A 72 0.889 -0.778 11.524 1.00 20.11 C ATOM 1156 C PHE A 72 -0.562 -0.408 11.959 1.00 72.23 C ATOM 1157 O PHE A 72 -0.809 0.752 12.299 1.00 41.22 O ATOM 1158 CB PHE A 72 1.205 -0.181 10.120 1.00 50.01 C ATOM 1159 CG PHE A 72 2.705 -0.118 9.823 1.00 54.22 C ATOM 1160 CD1 PHE A 72 3.533 0.703 10.588 1.00 64.45 C ATOM 1161 CD2 PHE A 72 3.292 -0.893 8.819 1.00 73.03 C ATOM 1162 CE1 PHE A 72 4.893 0.750 10.365 1.00 13.35 C ATOM 1163 CE2 PHE A 72 4.657 -0.841 8.589 1.00 13.35 C ATOM 1164 CZ PHE A 72 5.457 -0.019 9.363 1.00 44.12 C ATOM 0 H PHE A 72 0.543 -2.870 11.198 1.00 72.33 H new ATOM 0 HA PHE A 72 1.511 -0.328 12.298 1.00 20.11 H new ATOM 0 HB2 PHE A 72 0.714 -0.783 9.356 1.00 50.01 H new ATOM 0 HB3 PHE A 72 0.784 0.822 10.054 1.00 50.01 H new ATOM 0 HD1 PHE A 72 3.102 1.312 11.368 1.00 64.45 H new ATOM 0 HD2 PHE A 72 2.674 -1.540 8.215 1.00 73.03 H new ATOM 0 HE1 PHE A 72 5.518 1.387 10.973 1.00 13.35 H new ATOM 0 HE2 PHE A 72 5.096 -1.441 7.806 1.00 13.35 H new ATOM 0 HZ PHE A 72 6.521 0.022 9.185 1.00 44.12 H new ATOM 1174 N TYR A 73 -1.510 -1.350 11.958 1.00 32.45 N ATOM 1175 CA TYR A 73 -2.948 -1.062 12.286 1.00 4.42 C ATOM 1176 C TYR A 73 -3.394 -1.687 13.640 1.00 11.32 C ATOM 1177 O TYR A 73 -4.183 -1.083 14.374 1.00 1.33 O ATOM 1178 CB TYR A 73 -3.850 -1.548 11.111 1.00 23.22 C ATOM 1179 CG TYR A 73 -5.375 -1.437 11.323 1.00 54.01 C ATOM 1180 CD1 TYR A 73 -6.049 -0.234 11.123 1.00 35.30 C ATOM 1181 CD2 TYR A 73 -6.142 -2.550 11.697 1.00 71.42 C ATOM 1182 CE1 TYR A 73 -7.419 -0.137 11.294 1.00 33.11 C ATOM 1183 CE2 TYR A 73 -7.512 -2.456 11.867 1.00 44.25 C ATOM 1184 CZ TYR A 73 -8.147 -1.247 11.666 1.00 73.33 C ATOM 1185 OH TYR A 73 -9.516 -1.149 11.834 1.00 60.25 O ATOM 0 H TYR A 73 -1.327 -2.328 11.735 1.00 32.45 H new ATOM 0 HA TYR A 73 -3.057 0.016 12.408 1.00 4.42 H new ATOM 0 HB2 TYR A 73 -3.587 -0.978 10.220 1.00 23.22 H new ATOM 0 HB3 TYR A 73 -3.609 -2.591 10.905 1.00 23.22 H new ATOM 0 HD1 TYR A 73 -5.490 0.642 10.828 1.00 35.30 H new ATOM 0 HD2 TYR A 73 -5.653 -3.500 11.856 1.00 71.42 H new ATOM 0 HE1 TYR A 73 -7.918 0.808 11.136 1.00 33.11 H new ATOM 0 HE2 TYR A 73 -8.083 -3.326 12.156 1.00 44.25 H new ATOM 0 HH TYR A 73 -9.877 -2.022 12.096 1.00 60.25 H new ATOM 1195 N THR A 74 -2.903 -2.896 13.952 1.00 10.43 N ATOM 1196 CA THR A 74 -3.352 -3.668 15.154 1.00 3.14 C ATOM 1197 C THR A 74 -2.856 -3.078 16.526 1.00 21.53 C ATOM 1198 O THR A 74 -3.668 -2.965 17.453 1.00 33.32 O ATOM 1199 CB THR A 74 -2.951 -5.179 15.037 1.00 73.34 C ATOM 1200 OG1 THR A 74 -3.361 -5.670 13.754 1.00 72.45 O ATOM 1201 CG2 THR A 74 -3.588 -6.058 16.136 1.00 34.32 C ATOM 0 H THR A 74 -2.193 -3.373 13.397 1.00 10.43 H new ATOM 0 HA THR A 74 -4.438 -3.576 15.161 1.00 3.14 H new ATOM 0 HB THR A 74 -1.870 -5.238 15.160 1.00 73.34 H new ATOM 0 HG1 THR A 74 -3.127 -6.619 13.677 1.00 72.45 H new ATOM 0 HG21 THR A 74 -3.273 -7.093 16.002 1.00 34.32 H new ATOM 0 HG22 THR A 74 -3.267 -5.705 17.116 1.00 34.32 H new ATOM 0 HG23 THR A 74 -4.674 -5.997 16.067 1.00 34.32 H new ATOM 1209 N PRO A 75 -1.532 -2.697 16.712 1.00 34.12 N ATOM 1210 CA PRO A 75 -1.034 -2.109 17.985 1.00 52.33 C ATOM 1211 C PRO A 75 -1.280 -0.579 18.066 1.00 3.30 C ATOM 1212 O PRO A 75 -1.190 0.021 19.145 1.00 12.54 O ATOM 1213 CB PRO A 75 0.500 -2.433 17.960 1.00 33.14 C ATOM 1214 CG PRO A 75 0.755 -3.118 16.640 1.00 41.00 C ATOM 1215 CD PRO A 75 -0.415 -2.779 15.749 1.00 2.44 C ATOM 0 HA PRO A 75 -1.549 -2.517 18.855 1.00 52.33 H new ATOM 0 HB2 PRO A 75 1.093 -1.523 18.049 1.00 33.14 H new ATOM 0 HB3 PRO A 75 0.777 -3.077 18.795 1.00 33.14 H new ATOM 0 HG2 PRO A 75 1.691 -2.775 16.199 1.00 41.00 H new ATOM 0 HG3 PRO A 75 0.842 -4.196 16.773 1.00 41.00 H new ATOM 0 HD2 PRO A 75 -0.264 -1.838 15.220 1.00 2.44 H new ATOM 0 HD3 PRO A 75 -0.586 -3.545 14.993 1.00 2.44 H new ATOM 1223 N TYR A 76 -1.593 0.032 16.914 1.00 42.31 N ATOM 1224 CA TYR A 76 -1.708 1.493 16.770 1.00 34.44 C ATOM 1225 C TYR A 76 -3.183 1.915 16.593 1.00 2.33 C ATOM 1226 O TYR A 76 -3.935 1.224 15.909 1.00 23.33 O ATOM 1227 CB TYR A 76 -0.876 1.955 15.547 1.00 13.12 C ATOM 1228 CG TYR A 76 0.628 1.676 15.683 1.00 71.54 C ATOM 1229 CD1 TYR A 76 1.406 2.397 16.587 1.00 34.23 C ATOM 1230 CD2 TYR A 76 1.269 0.706 14.909 1.00 63.52 C ATOM 1231 CE1 TYR A 76 2.755 2.164 16.714 1.00 64.01 C ATOM 1232 CE2 TYR A 76 2.624 0.470 15.030 1.00 13.41 C ATOM 1233 CZ TYR A 76 3.365 1.199 15.932 1.00 14.51 C ATOM 1234 OH TYR A 76 4.720 0.974 16.049 1.00 42.12 O ATOM 0 H TYR A 76 -1.775 -0.477 16.049 1.00 42.31 H new ATOM 0 HA TYR A 76 -1.326 1.965 17.675 1.00 34.44 H new ATOM 0 HB2 TYR A 76 -1.250 1.454 14.654 1.00 13.12 H new ATOM 0 HB3 TYR A 76 -1.026 3.024 15.399 1.00 13.12 H new ATOM 0 HD1 TYR A 76 0.940 3.154 17.200 1.00 34.23 H new ATOM 0 HD2 TYR A 76 0.693 0.129 14.201 1.00 63.52 H new ATOM 0 HE1 TYR A 76 3.338 2.733 17.423 1.00 64.01 H new ATOM 0 HE2 TYR A 76 3.100 -0.283 14.420 1.00 13.41 H new ATOM 0 HH TYR A 76 4.988 0.263 15.430 1.00 42.12 H new ATOM 1244 N PRO A 77 -3.631 3.048 17.221 1.00 62.20 N ATOM 1245 CA PRO A 77 -4.987 3.620 16.958 1.00 5.35 C ATOM 1246 C PRO A 77 -5.110 4.143 15.500 1.00 73.03 C ATOM 1247 O PRO A 77 -4.105 4.526 14.910 1.00 62.51 O ATOM 1248 CB PRO A 77 -5.078 4.786 17.981 1.00 52.03 C ATOM 1249 CG PRO A 77 -3.646 5.159 18.260 1.00 13.42 C ATOM 1250 CD PRO A 77 -2.875 3.855 18.229 1.00 72.42 C ATOM 0 HA PRO A 77 -5.787 2.888 17.066 1.00 5.35 H new ATOM 0 HB2 PRO A 77 -5.635 5.629 17.572 1.00 52.03 H new ATOM 0 HB3 PRO A 77 -5.591 4.476 18.891 1.00 52.03 H new ATOM 0 HG2 PRO A 77 -3.269 5.856 17.511 1.00 13.42 H new ATOM 0 HG3 PRO A 77 -3.550 5.649 19.229 1.00 13.42 H new ATOM 0 HD2 PRO A 77 -1.837 4.005 17.931 1.00 72.42 H new ATOM 0 HD3 PRO A 77 -2.859 3.371 19.205 1.00 72.42 H new ATOM 1258 N ASN A 78 -6.343 4.141 14.935 1.00 3.12 N ATOM 1259 CA ASN A 78 -6.676 4.733 13.580 1.00 61.43 C ATOM 1260 C ASN A 78 -6.051 6.156 13.374 1.00 35.13 C ATOM 1261 O ASN A 78 -5.721 6.557 12.269 1.00 70.54 O ATOM 1262 CB ASN A 78 -8.215 4.816 13.428 1.00 3.21 C ATOM 1263 CG ASN A 78 -8.939 3.508 13.768 1.00 34.42 C ATOM 1264 OD1 ASN A 78 -9.255 3.243 14.924 1.00 31.30 O ATOM 1265 ND2 ASN A 78 -9.212 2.687 12.776 1.00 24.22 N ATOM 0 H ASN A 78 -7.153 3.729 15.397 1.00 3.12 H new ATOM 0 HA ASN A 78 -6.247 4.080 12.820 1.00 61.43 H new ATOM 0 HB2 ASN A 78 -8.593 5.609 14.074 1.00 3.21 H new ATOM 0 HB3 ASN A 78 -8.455 5.098 12.403 1.00 3.21 H new ATOM 0 HD21 ASN A 78 -9.696 1.808 12.960 1.00 24.22 H new ATOM 0 HD22 ASN A 78 -8.939 2.929 11.824 1.00 24.22 H new ATOM 1272 N THR A 79 -5.884 6.832 14.509 1.00 51.02 N ATOM 1273 CA THR A 79 -5.219 8.155 14.598 1.00 33.32 C ATOM 1274 C THR A 79 -3.733 8.037 14.119 1.00 0.55 C ATOM 1275 O THR A 79 -3.288 8.779 13.234 1.00 63.23 O ATOM 1276 CB THR A 79 -5.273 8.756 16.038 1.00 71.12 C ATOM 1277 OG1 THR A 79 -6.614 8.669 16.556 1.00 64.51 O ATOM 1278 CG2 THR A 79 -4.813 10.235 16.062 1.00 15.32 C ATOM 0 H THR A 79 -6.207 6.482 15.411 1.00 51.02 H new ATOM 0 HA THR A 79 -5.765 8.837 13.946 1.00 33.32 H new ATOM 0 HB THR A 79 -4.591 8.177 16.660 1.00 71.12 H new ATOM 0 HG1 THR A 79 -6.641 9.046 17.460 1.00 64.51 H new ATOM 0 HG21 THR A 79 -4.865 10.616 17.082 1.00 15.32 H new ATOM 0 HG22 THR A 79 -3.787 10.303 15.702 1.00 15.32 H new ATOM 0 HG23 THR A 79 -5.463 10.829 15.419 1.00 15.32 H new ATOM 1286 N LYS A 80 -2.989 7.076 14.710 1.00 23.01 N ATOM 1287 CA LYS A 80 -1.584 6.747 14.325 1.00 61.21 C ATOM 1288 C LYS A 80 -1.481 5.973 12.972 1.00 13.31 C ATOM 1289 O LYS A 80 -0.456 6.056 12.286 1.00 64.11 O ATOM 1290 CB LYS A 80 -0.905 5.930 15.464 1.00 20.05 C ATOM 1291 CG LYS A 80 0.622 5.700 15.307 1.00 31.52 C ATOM 1292 CD LYS A 80 1.437 7.016 15.369 1.00 2.11 C ATOM 1293 CE LYS A 80 2.957 6.783 15.412 1.00 10.13 C ATOM 1294 NZ LYS A 80 3.710 8.061 15.468 1.00 42.12 N ATOM 0 H LYS A 80 -3.342 6.499 15.473 1.00 23.01 H new ATOM 0 HA LYS A 80 -1.064 7.694 14.179 1.00 61.21 H new ATOM 0 HB2 LYS A 80 -1.082 6.443 16.409 1.00 20.05 H new ATOM 0 HB3 LYS A 80 -1.395 4.959 15.532 1.00 20.05 H new ATOM 0 HG2 LYS A 80 0.966 5.028 16.093 1.00 31.52 H new ATOM 0 HG3 LYS A 80 0.814 5.204 14.356 1.00 31.52 H new ATOM 0 HD2 LYS A 80 1.194 7.628 14.501 1.00 2.11 H new ATOM 0 HD3 LYS A 80 1.137 7.581 16.252 1.00 2.11 H new ATOM 0 HE2 LYS A 80 3.207 6.176 16.282 1.00 10.13 H new ATOM 0 HE3 LYS A 80 3.263 6.219 14.531 1.00 10.13 H new ATOM 0 HZ1 LYS A 80 4.693 7.872 15.749 1.00 42.12 H new ATOM 0 HZ2 LYS A 80 3.698 8.512 14.531 1.00 42.12 H new ATOM 0 HZ3 LYS A 80 3.267 8.695 16.163 1.00 42.12 H new ATOM 1308 N VAL A 81 -2.536 5.220 12.592 1.00 54.04 N ATOM 1309 CA VAL A 81 -2.578 4.473 11.297 1.00 31.14 C ATOM 1310 C VAL A 81 -2.599 5.447 10.084 1.00 64.32 C ATOM 1311 O VAL A 81 -2.239 5.068 8.987 1.00 31.01 O ATOM 1312 CB VAL A 81 -3.809 3.474 11.235 1.00 41.02 C ATOM 1313 CG1 VAL A 81 -3.880 2.681 9.897 1.00 23.21 C ATOM 1314 CG2 VAL A 81 -3.777 2.497 12.427 1.00 22.53 C ATOM 0 H VAL A 81 -3.376 5.108 13.159 1.00 54.04 H new ATOM 0 HA VAL A 81 -1.666 3.879 11.241 1.00 31.14 H new ATOM 0 HB VAL A 81 -4.708 4.088 11.291 1.00 41.02 H new ATOM 0 HG11 VAL A 81 -4.742 2.015 9.914 1.00 23.21 H new ATOM 0 HG12 VAL A 81 -3.977 3.379 9.065 1.00 23.21 H new ATOM 0 HG13 VAL A 81 -2.970 2.094 9.773 1.00 23.21 H new ATOM 0 HG21 VAL A 81 -4.629 1.820 12.366 1.00 22.53 H new ATOM 0 HG22 VAL A 81 -2.853 1.920 12.400 1.00 22.53 H new ATOM 0 HG23 VAL A 81 -3.826 3.059 13.360 1.00 22.53 H new ATOM 1324 N ILE A 82 -3.087 6.678 10.294 1.00 0.30 N ATOM 1325 CA ILE A 82 -2.975 7.804 9.316 1.00 54.32 C ATOM 1326 C ILE A 82 -1.578 8.498 9.363 1.00 61.44 C ATOM 1327 O ILE A 82 -1.074 8.998 8.344 1.00 41.00 O ATOM 1328 CB ILE A 82 -4.128 8.835 9.576 1.00 55.32 C ATOM 1329 CG1 ILE A 82 -5.496 8.086 9.543 1.00 55.03 C ATOM 1330 CG2 ILE A 82 -4.112 10.005 8.549 1.00 11.24 C ATOM 1331 CD1 ILE A 82 -6.641 8.852 10.132 1.00 2.51 C ATOM 0 H ILE A 82 -3.577 6.937 11.150 1.00 0.30 H new ATOM 0 HA ILE A 82 -3.076 7.391 8.312 1.00 54.32 H new ATOM 0 HB ILE A 82 -3.975 9.283 10.558 1.00 55.32 H new ATOM 0 HG12 ILE A 82 -5.735 7.839 8.509 1.00 55.03 H new ATOM 0 HG13 ILE A 82 -5.392 7.143 10.080 1.00 55.03 H new ATOM 0 HG21 ILE A 82 -4.928 10.693 8.769 1.00 11.24 H new ATOM 0 HG22 ILE A 82 -3.162 10.535 8.616 1.00 11.24 H new ATOM 0 HG23 ILE A 82 -4.235 9.607 7.542 1.00 11.24 H new ATOM 0 HD11 ILE A 82 -7.550 8.255 10.066 1.00 2.51 H new ATOM 0 HD12 ILE A 82 -6.429 9.076 11.177 1.00 2.51 H new ATOM 0 HD13 ILE A 82 -6.778 9.783 9.582 1.00 2.51 H new ATOM 1343 N GLU A 83 -0.940 8.455 10.552 1.00 75.31 N ATOM 1344 CA GLU A 83 0.313 9.202 10.837 1.00 33.00 C ATOM 1345 C GLU A 83 1.499 8.479 10.182 1.00 10.01 C ATOM 1346 O GLU A 83 2.251 9.077 9.413 1.00 25.41 O ATOM 1347 CB GLU A 83 0.515 9.376 12.378 1.00 44.01 C ATOM 1348 CG GLU A 83 1.542 10.456 12.838 1.00 31.51 C ATOM 1349 CD GLU A 83 3.024 10.191 12.460 1.00 73.44 C ATOM 1350 OE1 GLU A 83 3.530 9.065 12.710 1.00 30.35 O ATOM 1351 OE2 GLU A 83 3.698 11.109 11.933 1.00 5.04 O ATOM 0 H GLU A 83 -1.275 7.904 11.343 1.00 75.31 H new ATOM 0 HA GLU A 83 0.245 10.203 10.411 1.00 33.00 H new ATOM 0 HB2 GLU A 83 -0.451 9.616 12.822 1.00 44.01 H new ATOM 0 HB3 GLU A 83 0.825 8.416 12.790 1.00 44.01 H new ATOM 0 HG2 GLU A 83 1.245 11.415 12.413 1.00 31.51 H new ATOM 0 HG3 GLU A 83 1.476 10.553 13.922 1.00 31.51 H new ATOM 1358 N LEU A 84 1.614 7.177 10.458 1.00 61.41 N ATOM 1359 CA LEU A 84 2.552 6.260 9.787 1.00 54.23 C ATOM 1360 C LEU A 84 2.027 5.915 8.370 1.00 22.51 C ATOM 1361 O LEU A 84 2.769 5.439 7.517 1.00 54.33 O ATOM 1362 CB LEU A 84 2.730 4.969 10.645 1.00 74.32 C ATOM 1363 CG LEU A 84 3.443 5.150 12.024 1.00 44.02 C ATOM 1364 CD1 LEU A 84 3.472 3.825 12.825 1.00 24.31 C ATOM 1365 CD2 LEU A 84 4.866 5.740 11.854 1.00 22.11 C ATOM 0 H LEU A 84 1.047 6.717 11.170 1.00 61.41 H new ATOM 0 HA LEU A 84 3.524 6.743 9.684 1.00 54.23 H new ATOM 0 HB2 LEU A 84 1.745 4.537 10.823 1.00 74.32 H new ATOM 0 HB3 LEU A 84 3.295 4.244 10.060 1.00 74.32 H new ATOM 0 HG LEU A 84 2.859 5.867 12.601 1.00 44.02 H new ATOM 0 HD11 LEU A 84 3.975 3.987 13.778 1.00 24.31 H new ATOM 0 HD12 LEU A 84 2.452 3.487 13.006 1.00 24.31 H new ATOM 0 HD13 LEU A 84 4.010 3.067 12.255 1.00 24.31 H new ATOM 0 HD21 LEU A 84 5.333 5.852 12.833 1.00 22.11 H new ATOM 0 HD22 LEU A 84 5.467 5.069 11.240 1.00 22.11 H new ATOM 0 HD23 LEU A 84 4.800 6.714 11.369 1.00 22.11 H new ATOM 1377 N GLY A 85 0.733 6.225 8.150 1.00 30.54 N ATOM 1378 CA GLY A 85 -0.078 5.616 7.105 1.00 44.35 C ATOM 1379 C GLY A 85 0.111 6.232 5.746 1.00 65.34 C ATOM 1380 O GLY A 85 0.354 5.502 4.780 1.00 4.51 O ATOM 0 H GLY A 85 0.227 6.915 8.706 1.00 30.54 H new ATOM 0 HA2 GLY A 85 0.160 4.554 7.047 1.00 44.35 H new ATOM 0 HA3 GLY A 85 -1.129 5.692 7.384 1.00 44.35 H new ATOM 1384 N THR A 86 0.037 7.578 5.620 1.00 42.41 N ATOM 1385 CA THR A 86 0.151 8.306 4.345 1.00 21.30 C ATOM 1386 C THR A 86 1.616 8.306 3.848 1.00 51.03 C ATOM 1387 O THR A 86 1.881 8.492 2.656 1.00 42.31 O ATOM 1388 CB THR A 86 -0.349 9.781 4.595 1.00 23.24 C ATOM 1389 OG1 THR A 86 -1.636 9.750 5.243 1.00 5.24 O ATOM 1390 CG2 THR A 86 -0.470 10.618 3.316 1.00 13.34 C ATOM 0 H THR A 86 -0.106 8.195 6.420 1.00 42.41 H new ATOM 0 HA THR A 86 -0.453 7.824 3.576 1.00 21.30 H new ATOM 0 HB THR A 86 0.407 10.255 5.222 1.00 23.24 H new ATOM 0 HG1 THR A 86 -1.517 9.571 6.199 1.00 5.24 H new ATOM 0 HG21 THR A 86 -0.819 11.619 3.568 1.00 13.34 H new ATOM 0 HG22 THR A 86 0.504 10.684 2.831 1.00 13.34 H new ATOM 0 HG23 THR A 86 -1.181 10.146 2.638 1.00 13.34 H new ATOM 1398 N LYS A 87 2.546 8.036 4.801 1.00 25.01 N ATOM 1399 CA LYS A 87 4.001 8.257 4.608 1.00 55.43 C ATOM 1400 C LYS A 87 4.556 7.383 3.461 1.00 70.11 C ATOM 1401 O LYS A 87 5.489 7.781 2.749 1.00 14.25 O ATOM 1402 CB LYS A 87 4.780 7.930 5.918 1.00 75.11 C ATOM 1403 CG LYS A 87 4.664 8.993 7.032 1.00 3.44 C ATOM 1404 CD LYS A 87 5.387 8.571 8.340 1.00 41.34 C ATOM 1405 CE LYS A 87 5.382 9.689 9.396 1.00 63.21 C ATOM 1406 NZ LYS A 87 5.818 9.214 10.737 1.00 1.31 N ATOM 0 H LYS A 87 2.309 7.661 5.719 1.00 25.01 H new ATOM 0 HA LYS A 87 4.139 9.307 4.349 1.00 55.43 H new ATOM 0 HB2 LYS A 87 4.421 6.977 6.308 1.00 75.11 H new ATOM 0 HB3 LYS A 87 5.834 7.797 5.672 1.00 75.11 H new ATOM 0 HG2 LYS A 87 5.085 9.934 6.676 1.00 3.44 H new ATOM 0 HG3 LYS A 87 3.611 9.176 7.246 1.00 3.44 H new ATOM 0 HD2 LYS A 87 4.903 7.685 8.750 1.00 41.34 H new ATOM 0 HD3 LYS A 87 6.416 8.295 8.111 1.00 41.34 H new ATOM 0 HE2 LYS A 87 6.039 10.495 9.069 1.00 63.21 H new ATOM 0 HE3 LYS A 87 4.378 10.107 9.472 1.00 63.21 H new ATOM 0 HZ1 LYS A 87 6.380 9.955 11.202 1.00 1.31 H new ATOM 0 HZ2 LYS A 87 4.982 8.998 11.317 1.00 1.31 H new ATOM 0 HZ3 LYS A 87 6.397 8.356 10.630 1.00 1.31 H new ATOM 1420 N HIS A 88 3.980 6.176 3.300 1.00 62.25 N ATOM 1421 CA HIS A 88 4.429 5.178 2.316 1.00 1.01 C ATOM 1422 C HIS A 88 3.763 5.353 0.928 1.00 31.22 C ATOM 1423 O HIS A 88 3.875 4.458 0.090 1.00 44.13 O ATOM 1424 CB HIS A 88 4.117 3.756 2.875 1.00 31.23 C ATOM 1425 CG HIS A 88 4.669 3.506 4.255 1.00 33.20 C ATOM 1426 ND1 HIS A 88 5.900 2.946 4.480 1.00 24.02 N ATOM 1427 CD2 HIS A 88 4.145 3.736 5.480 1.00 25.24 C ATOM 1428 CE1 HIS A 88 6.111 2.842 5.773 1.00 41.34 C ATOM 1429 NE2 HIS A 88 5.059 3.310 6.409 1.00 65.42 N ATOM 0 H HIS A 88 3.183 5.866 3.856 1.00 62.25 H new ATOM 0 HA HIS A 88 5.500 5.316 2.166 1.00 1.01 H new ATOM 0 HB2 HIS A 88 3.037 3.614 2.896 1.00 31.23 H new ATOM 0 HB3 HIS A 88 4.524 3.011 2.191 1.00 31.23 H new ATOM 0 HD1 HIS A 88 6.554 2.654 3.753 1.00 24.02 H new ATOM 0 HD2 HIS A 88 3.181 4.176 5.689 1.00 25.24 H new ATOM 0 HE1 HIS A 88 7.000 2.439 6.236 1.00 41.34 H new ATOM 1438 N PHE A 89 3.084 6.499 0.660 1.00 44.25 N ATOM 1439 CA PHE A 89 2.318 6.720 -0.598 1.00 32.12 C ATOM 1440 C PHE A 89 2.586 8.180 -1.059 1.00 44.30 C ATOM 1441 O PHE A 89 3.100 8.434 -2.153 1.00 75.02 O ATOM 1442 CB PHE A 89 0.790 6.462 -0.380 1.00 23.44 C ATOM 1443 CG PHE A 89 0.461 5.092 0.229 1.00 64.01 C ATOM 1444 CD1 PHE A 89 0.557 3.922 -0.528 1.00 3.44 C ATOM 1445 CD2 PHE A 89 0.070 4.975 1.562 1.00 54.11 C ATOM 1446 CE1 PHE A 89 0.273 2.684 0.032 1.00 60.24 C ATOM 1447 CE2 PHE A 89 -0.213 3.741 2.115 1.00 52.51 C ATOM 1448 CZ PHE A 89 -0.110 2.598 1.352 1.00 21.44 C ATOM 0 H PHE A 89 3.051 7.290 1.303 1.00 44.25 H new ATOM 0 HA PHE A 89 2.642 6.019 -1.367 1.00 32.12 H new ATOM 0 HB2 PHE A 89 0.391 7.241 0.270 1.00 23.44 H new ATOM 0 HB3 PHE A 89 0.278 6.553 -1.338 1.00 23.44 H new ATOM 0 HD1 PHE A 89 0.857 3.981 -1.564 1.00 3.44 H new ATOM 0 HD2 PHE A 89 -0.013 5.863 2.172 1.00 54.11 H new ATOM 0 HE1 PHE A 89 0.352 1.789 -0.567 1.00 60.24 H new ATOM 0 HE2 PHE A 89 -0.516 3.672 3.149 1.00 52.51 H new ATOM 0 HZ PHE A 89 -0.330 1.635 1.789 1.00 21.44 H new ATOM 1458 N LEU A 90 2.242 9.140 -0.178 1.00 22.13 N ATOM 1459 CA LEU A 90 2.708 10.547 -0.255 1.00 24.12 C ATOM 1460 C LEU A 90 3.333 10.945 1.103 1.00 73.20 C ATOM 1461 O LEU A 90 2.631 11.367 2.027 1.00 13.10 O ATOM 1462 CB LEU A 90 1.591 11.567 -0.695 1.00 13.13 C ATOM 1463 CG LEU A 90 0.128 11.325 -0.177 1.00 61.04 C ATOM 1464 CD1 LEU A 90 -0.725 12.610 -0.255 1.00 54.10 C ATOM 1465 CD2 LEU A 90 -0.575 10.176 -0.940 1.00 15.42 C ATOM 0 H LEU A 90 1.627 8.963 0.616 1.00 22.13 H new ATOM 0 HA LEU A 90 3.459 10.599 -1.044 1.00 24.12 H new ATOM 0 HB2 LEU A 90 1.900 12.561 -0.372 1.00 13.13 H new ATOM 0 HB3 LEU A 90 1.562 11.581 -1.785 1.00 13.13 H new ATOM 0 HG LEU A 90 0.218 11.033 0.869 1.00 61.04 H new ATOM 0 HD11 LEU A 90 -1.730 12.402 0.112 1.00 54.10 H new ATOM 0 HD12 LEU A 90 -0.269 13.387 0.358 1.00 54.10 H new ATOM 0 HD13 LEU A 90 -0.779 12.948 -1.290 1.00 54.10 H new ATOM 0 HD21 LEU A 90 -1.584 10.043 -0.549 1.00 15.42 H new ATOM 0 HD22 LEU A 90 -0.626 10.421 -2.001 1.00 15.42 H new ATOM 0 HD23 LEU A 90 -0.011 9.253 -0.808 1.00 15.42 H new ATOM 1477 N GLY A 91 4.663 10.735 1.219 1.00 32.11 N ATOM 1478 CA GLY A 91 5.419 11.064 2.432 1.00 75.43 C ATOM 1479 C GLY A 91 5.467 12.562 2.717 1.00 52.32 C ATOM 1480 O GLY A 91 6.384 13.255 2.266 1.00 21.23 O ATOM 0 H GLY A 91 5.234 10.334 0.474 1.00 32.11 H new ATOM 0 HA2 GLY A 91 4.970 10.552 3.283 1.00 75.43 H new ATOM 0 HA3 GLY A 91 6.437 10.686 2.333 1.00 75.43 H new ATOM 1484 N ARG A 92 4.444 13.062 3.435 1.00 33.31 N ATOM 1485 CA ARG A 92 4.351 14.486 3.816 1.00 3.03 C ATOM 1486 C ARG A 92 3.745 14.664 5.233 1.00 32.11 C ATOM 1487 O ARG A 92 3.284 15.763 5.571 1.00 42.32 O ATOM 1488 CB ARG A 92 3.497 15.255 2.761 1.00 52.30 C ATOM 1489 CG ARG A 92 1.989 14.880 2.729 1.00 22.02 C ATOM 1490 CD ARG A 92 1.150 15.792 1.795 1.00 10.35 C ATOM 1491 NE ARG A 92 1.266 15.428 0.373 1.00 4.52 N ATOM 1492 CZ ARG A 92 2.141 15.891 -0.494 1.00 64.31 C ATOM 1493 NH1 ARG A 92 3.064 16.745 -0.159 1.00 43.50 N ATOM 1494 NH2 ARG A 92 2.067 15.494 -1.718 1.00 5.12 N ATOM 0 H ARG A 92 3.663 12.496 3.766 1.00 33.31 H new ATOM 0 HA ARG A 92 5.360 14.897 3.840 1.00 3.03 H new ATOM 0 HB2 ARG A 92 3.585 16.324 2.955 1.00 52.30 H new ATOM 0 HB3 ARG A 92 3.921 15.075 1.773 1.00 52.30 H new ATOM 0 HG2 ARG A 92 1.886 13.845 2.403 1.00 22.02 H new ATOM 0 HG3 ARG A 92 1.586 14.938 3.740 1.00 22.02 H new ATOM 0 HD2 ARG A 92 0.103 15.741 2.092 1.00 10.35 H new ATOM 0 HD3 ARG A 92 1.468 16.826 1.926 1.00 10.35 H new ATOM 0 HE ARG A 92 0.596 14.743 0.022 1.00 4.52 H new ATOM 0 HH11 ARG A 92 3.126 17.077 0.803 1.00 43.50 H new ATOM 0 HH12 ARG A 92 3.725 17.082 -0.859 1.00 43.50 H new ATOM 0 HH21 ARG A 92 1.341 14.834 -1.997 1.00 5.12 H new ATOM 0 HH22 ARG A 92 2.735 15.840 -2.407 1.00 5.12 H new ATOM 1508 N ALA A 93 3.862 13.624 6.096 1.00 72.31 N ATOM 1509 CA ALA A 93 2.965 13.438 7.284 1.00 24.24 C ATOM 1510 C ALA A 93 1.429 13.513 6.925 1.00 14.11 C ATOM 1511 O ALA A 93 1.068 13.741 5.765 1.00 54.14 O ATOM 1512 CB ALA A 93 3.353 14.465 8.387 1.00 13.05 C ATOM 0 H ALA A 93 4.568 12.895 5.998 1.00 72.31 H new ATOM 0 HA ALA A 93 3.118 12.427 7.662 1.00 24.24 H new ATOM 0 HB1 ALA A 93 2.703 14.333 9.252 1.00 13.05 H new ATOM 0 HB2 ALA A 93 4.390 14.306 8.684 1.00 13.05 H new ATOM 0 HB3 ALA A 93 3.238 15.477 7.998 1.00 13.05 H new ATOM 1518 N PRO A 94 0.486 13.250 7.890 1.00 2.34 N ATOM 1519 CA PRO A 94 -0.933 13.684 7.738 1.00 22.05 C ATOM 1520 C PRO A 94 -1.053 15.223 7.910 1.00 62.22 C ATOM 1521 O PRO A 94 -0.414 15.806 8.800 1.00 23.34 O ATOM 1522 CB PRO A 94 -1.668 12.907 8.859 1.00 52.33 C ATOM 1523 CG PRO A 94 -0.615 12.692 9.905 1.00 41.34 C ATOM 1524 CD PRO A 94 0.679 12.459 9.137 1.00 61.03 C ATOM 0 HA PRO A 94 -1.353 13.475 6.754 1.00 22.05 H new ATOM 0 HB2 PRO A 94 -2.510 13.476 9.252 1.00 52.33 H new ATOM 0 HB3 PRO A 94 -2.066 11.960 8.493 1.00 52.33 H new ATOM 0 HG2 PRO A 94 -0.531 13.558 10.562 1.00 41.34 H new ATOM 0 HG3 PRO A 94 -0.857 11.836 10.535 1.00 41.34 H new ATOM 0 HD2 PRO A 94 1.548 12.801 9.700 1.00 61.03 H new ATOM 0 HD3 PRO A 94 0.834 11.402 8.922 1.00 61.03 H new ATOM 1532 N ILE A 95 -1.856 15.864 7.040 1.00 20.33 N ATOM 1533 CA ILE A 95 -1.952 17.344 6.917 1.00 2.10 C ATOM 1534 C ILE A 95 -2.413 18.016 8.248 1.00 14.52 C ATOM 1535 O ILE A 95 -1.685 18.834 8.826 1.00 25.35 O ATOM 1536 CB ILE A 95 -2.905 17.769 5.698 1.00 50.41 C ATOM 1537 CG1 ILE A 95 -2.295 17.383 4.285 1.00 70.44 C ATOM 1538 CG2 ILE A 95 -3.237 19.290 5.730 1.00 35.31 C ATOM 1539 CD1 ILE A 95 -2.160 15.897 3.977 1.00 4.02 C ATOM 0 H ILE A 95 -2.467 15.368 6.391 1.00 20.33 H new ATOM 0 HA ILE A 95 -0.947 17.708 6.703 1.00 2.10 H new ATOM 0 HB ILE A 95 -3.828 17.204 5.831 1.00 50.41 H new ATOM 0 HG12 ILE A 95 -2.917 17.835 3.512 1.00 70.44 H new ATOM 0 HG13 ILE A 95 -1.307 17.837 4.206 1.00 70.44 H new ATOM 0 HG21 ILE A 95 -3.884 19.539 4.889 1.00 35.31 H new ATOM 0 HG22 ILE A 95 -3.746 19.532 6.663 1.00 35.31 H new ATOM 0 HG23 ILE A 95 -2.314 19.865 5.660 1.00 35.31 H new ATOM 0 HD11 ILE A 95 -1.731 15.769 2.983 1.00 4.02 H new ATOM 0 HD12 ILE A 95 -1.509 15.430 4.716 1.00 4.02 H new ATOM 0 HD13 ILE A 95 -3.143 15.428 4.011 1.00 4.02 H new ATOM 1551 N ASP A 96 -3.622 17.674 8.715 1.00 54.42 N ATOM 1552 CA ASP A 96 -4.203 18.264 9.951 1.00 45.13 C ATOM 1553 C ASP A 96 -5.099 17.244 10.682 1.00 33.42 C ATOM 1554 O ASP A 96 -5.601 16.328 10.068 1.00 32.54 O ATOM 1555 CB ASP A 96 -5.004 19.543 9.567 1.00 44.21 C ATOM 1556 CG ASP A 96 -5.501 20.347 10.780 1.00 71.42 C ATOM 1557 OD1 ASP A 96 -4.705 21.128 11.354 1.00 44.34 O ATOM 1558 OD2 ASP A 96 -6.678 20.192 11.171 1.00 2.14 O ATOM 0 H ASP A 96 -4.226 16.990 8.260 1.00 54.42 H new ATOM 0 HA ASP A 96 -3.401 18.533 10.638 1.00 45.13 H new ATOM 0 HB2 ASP A 96 -4.374 20.184 8.950 1.00 44.21 H new ATOM 0 HB3 ASP A 96 -5.860 19.255 8.957 1.00 44.21 H new ATOM 1563 N GLN A 97 -5.319 17.445 12.004 1.00 61.12 N ATOM 1564 CA GLN A 97 -6.172 16.556 12.848 1.00 33.23 C ATOM 1565 C GLN A 97 -7.675 16.531 12.405 1.00 35.40 C ATOM 1566 O GLN A 97 -8.439 15.657 12.822 1.00 40.05 O ATOM 1567 CB GLN A 97 -6.024 16.971 14.346 1.00 35.20 C ATOM 1568 CG GLN A 97 -6.732 16.048 15.367 1.00 25.13 C ATOM 1569 CD GLN A 97 -6.243 14.593 15.379 1.00 64.42 C ATOM 1570 OE1 GLN A 97 -5.084 14.305 15.118 1.00 54.24 O ATOM 1571 NE2 GLN A 97 -7.133 13.664 15.682 1.00 60.22 N ATOM 0 H GLN A 97 -4.913 18.226 12.520 1.00 61.12 H new ATOM 0 HA GLN A 97 -5.818 15.534 12.713 1.00 33.23 H new ATOM 0 HB2 GLN A 97 -4.963 17.008 14.591 1.00 35.20 H new ATOM 0 HB3 GLN A 97 -6.414 17.982 14.465 1.00 35.20 H new ATOM 0 HG2 GLN A 97 -6.600 16.467 16.364 1.00 25.13 H new ATOM 0 HG3 GLN A 97 -7.802 16.054 15.157 1.00 25.13 H new ATOM 0 HE21 GLN A 97 -8.094 13.929 15.896 1.00 60.22 H new ATOM 0 HE22 GLN A 97 -6.858 12.682 15.702 1.00 60.22 H new ATOM 1580 N ALA A 98 -8.058 17.445 11.492 1.00 14.21 N ATOM 1581 CA ALA A 98 -9.429 17.496 10.925 1.00 64.34 C ATOM 1582 C ALA A 98 -9.481 16.564 9.685 1.00 41.51 C ATOM 1583 O ALA A 98 -10.438 15.814 9.463 1.00 71.02 O ATOM 1584 CB ALA A 98 -9.811 18.942 10.570 1.00 71.34 C ATOM 0 H ALA A 98 -7.435 18.165 11.126 1.00 14.21 H new ATOM 0 HA ALA A 98 -10.156 17.149 11.659 1.00 64.34 H new ATOM 0 HB1 ALA A 98 -10.819 18.961 10.156 1.00 71.34 H new ATOM 0 HB2 ALA A 98 -9.776 19.558 11.468 1.00 71.34 H new ATOM 0 HB3 ALA A 98 -9.109 19.334 9.834 1.00 71.34 H new ATOM 1590 N GLU A 99 -8.396 16.653 8.894 1.00 74.55 N ATOM 1591 CA GLU A 99 -8.077 15.750 7.761 1.00 52.42 C ATOM 1592 C GLU A 99 -7.825 14.286 8.245 1.00 22.31 C ATOM 1593 O GLU A 99 -8.099 13.322 7.520 1.00 62.21 O ATOM 1594 CB GLU A 99 -6.866 16.369 6.982 1.00 30.40 C ATOM 1595 CG GLU A 99 -6.151 15.469 5.935 1.00 41.52 C ATOM 1596 CD GLU A 99 -4.947 14.652 6.466 1.00 72.43 C ATOM 1597 OE1 GLU A 99 -4.571 14.794 7.649 1.00 62.30 O ATOM 1598 OE2 GLU A 99 -4.351 13.900 5.674 1.00 23.35 O ATOM 0 H GLU A 99 -7.691 17.378 9.026 1.00 74.55 H new ATOM 0 HA GLU A 99 -8.925 15.671 7.081 1.00 52.42 H new ATOM 0 HB2 GLU A 99 -7.217 17.265 6.471 1.00 30.40 H new ATOM 0 HB3 GLU A 99 -6.124 16.689 7.713 1.00 30.40 H new ATOM 0 HG2 GLU A 99 -6.882 14.776 5.518 1.00 41.52 H new ATOM 0 HG3 GLU A 99 -5.806 16.099 5.115 1.00 41.52 H new ATOM 1605 N ILE A 100 -7.269 14.136 9.463 1.00 31.12 N ATOM 1606 CA ILE A 100 -7.105 12.822 10.125 1.00 45.21 C ATOM 1607 C ILE A 100 -8.497 12.216 10.457 1.00 23.15 C ATOM 1608 O ILE A 100 -8.788 11.094 10.056 1.00 10.03 O ATOM 1609 CB ILE A 100 -6.197 12.958 11.419 1.00 61.24 C ATOM 1610 CG1 ILE A 100 -4.737 13.334 11.002 1.00 43.25 C ATOM 1611 CG2 ILE A 100 -6.213 11.686 12.312 1.00 31.20 C ATOM 1612 CD1 ILE A 100 -3.760 13.570 12.149 1.00 42.45 C ATOM 0 H ILE A 100 -6.921 14.919 10.017 1.00 31.12 H new ATOM 0 HA ILE A 100 -6.597 12.139 9.444 1.00 45.21 H new ATOM 0 HB ILE A 100 -6.619 13.756 12.030 1.00 61.24 H new ATOM 0 HG12 ILE A 100 -4.343 12.537 10.372 1.00 43.25 H new ATOM 0 HG13 ILE A 100 -4.775 14.235 10.390 1.00 43.25 H new ATOM 0 HG21 ILE A 100 -5.573 11.843 13.180 1.00 31.20 H new ATOM 0 HG22 ILE A 100 -7.232 11.487 12.644 1.00 31.20 H new ATOM 0 HG23 ILE A 100 -5.845 10.835 11.739 1.00 31.20 H new ATOM 0 HD11 ILE A 100 -2.780 13.824 11.746 1.00 42.45 H new ATOM 0 HD12 ILE A 100 -4.120 14.390 12.771 1.00 42.45 H new ATOM 0 HD13 ILE A 100 -3.681 12.665 12.752 1.00 42.45 H new ATOM 1624 N ARG A 101 -9.351 12.980 11.188 1.00 15.44 N ATOM 1625 CA ARG A 101 -10.809 12.639 11.339 1.00 30.34 C ATOM 1626 C ARG A 101 -11.521 12.262 10.001 1.00 35.53 C ATOM 1627 O ARG A 101 -12.400 11.400 10.002 1.00 11.42 O ATOM 1628 CB ARG A 101 -11.585 13.811 12.007 1.00 33.20 C ATOM 1629 CG ARG A 101 -11.171 14.139 13.461 1.00 21.25 C ATOM 1630 CD ARG A 101 -12.058 15.241 14.072 1.00 43.43 C ATOM 1631 NE ARG A 101 -11.734 15.535 15.483 1.00 42.54 N ATOM 1632 CZ ARG A 101 -12.610 15.921 16.397 1.00 2.24 C ATOM 1633 NH1 ARG A 101 -13.880 15.976 16.137 1.00 1.21 N ATOM 1634 NH2 ARG A 101 -12.209 16.222 17.582 1.00 54.41 N ATOM 0 H ARG A 101 -9.069 13.828 11.680 1.00 15.44 H new ATOM 0 HA ARG A 101 -10.826 11.752 11.973 1.00 30.34 H new ATOM 0 HB2 ARG A 101 -11.452 14.706 11.399 1.00 33.20 H new ATOM 0 HB3 ARG A 101 -12.649 13.573 11.995 1.00 33.20 H new ATOM 0 HG2 ARG A 101 -11.239 13.238 14.071 1.00 21.25 H new ATOM 0 HG3 ARG A 101 -10.129 14.459 13.479 1.00 21.25 H new ATOM 0 HD2 ARG A 101 -11.950 16.152 13.484 1.00 43.43 H new ATOM 0 HD3 ARG A 101 -13.103 14.938 14.002 1.00 43.43 H new ATOM 0 HE ARG A 101 -10.762 15.433 15.775 1.00 42.54 H new ATOM 0 HH11 ARG A 101 -14.223 15.719 15.211 1.00 1.21 H new ATOM 0 HH12 ARG A 101 -14.536 16.277 16.858 1.00 1.21 H new ATOM 0 HH21 ARG A 101 -11.218 16.163 17.815 1.00 54.41 H new ATOM 0 HH22 ARG A 101 -12.882 16.520 18.288 1.00 54.41 H new ATOM 1648 N LYS A 102 -11.127 12.903 8.880 1.00 43.11 N ATOM 1649 CA LYS A 102 -11.649 12.564 7.526 1.00 34.34 C ATOM 1650 C LYS A 102 -11.311 11.103 7.120 1.00 10.24 C ATOM 1651 O LYS A 102 -12.186 10.379 6.652 1.00 65.43 O ATOM 1652 CB LYS A 102 -11.082 13.553 6.470 1.00 62.31 C ATOM 1653 CG LYS A 102 -11.403 13.211 4.986 1.00 12.14 C ATOM 1654 CD LYS A 102 -10.541 14.022 3.985 1.00 31.15 C ATOM 1655 CE LYS A 102 -9.032 13.761 4.160 1.00 15.33 C ATOM 1656 NZ LYS A 102 -8.200 14.500 3.176 1.00 74.43 N ATOM 0 H LYS A 102 -10.446 13.663 8.880 1.00 43.11 H new ATOM 0 HA LYS A 102 -12.735 12.653 7.564 1.00 34.34 H new ATOM 0 HB2 LYS A 102 -11.469 14.549 6.686 1.00 62.31 H new ATOM 0 HB3 LYS A 102 -9.999 13.600 6.587 1.00 62.31 H new ATOM 0 HG2 LYS A 102 -11.240 12.146 4.820 1.00 12.14 H new ATOM 0 HG3 LYS A 102 -12.458 13.406 4.792 1.00 12.14 H new ATOM 0 HD2 LYS A 102 -10.835 13.767 2.967 1.00 31.15 H new ATOM 0 HD3 LYS A 102 -10.740 15.085 4.117 1.00 31.15 H new ATOM 0 HE2 LYS A 102 -8.733 14.047 5.168 1.00 15.33 H new ATOM 0 HE3 LYS A 102 -8.839 12.693 4.062 1.00 15.33 H new ATOM 0 HZ1 LYS A 102 -7.196 14.287 3.341 1.00 74.43 H new ATOM 0 HZ2 LYS A 102 -8.462 14.210 2.212 1.00 74.43 H new ATOM 0 HZ3 LYS A 102 -8.359 15.522 3.285 1.00 74.43 H new ATOM 1670 N TYR A 103 -10.050 10.668 7.347 1.00 74.44 N ATOM 1671 CA TYR A 103 -9.567 9.336 6.891 1.00 31.11 C ATOM 1672 C TYR A 103 -9.969 8.238 7.899 1.00 34.42 C ATOM 1673 O TYR A 103 -10.379 7.140 7.506 1.00 11.14 O ATOM 1674 CB TYR A 103 -8.026 9.337 6.682 1.00 44.12 C ATOM 1675 CG TYR A 103 -7.547 10.014 5.388 1.00 3.44 C ATOM 1676 CD1 TYR A 103 -8.128 9.693 4.159 1.00 71.25 C ATOM 1677 CD2 TYR A 103 -6.507 10.950 5.386 1.00 42.31 C ATOM 1678 CE1 TYR A 103 -7.698 10.280 2.984 1.00 54.33 C ATOM 1679 CE2 TYR A 103 -6.075 11.535 4.209 1.00 31.41 C ATOM 1680 CZ TYR A 103 -6.675 11.199 3.011 1.00 20.55 C ATOM 1681 OH TYR A 103 -6.245 11.782 1.835 1.00 43.43 O ATOM 0 H TYR A 103 -9.347 11.216 7.842 1.00 74.44 H new ATOM 0 HA TYR A 103 -10.039 9.122 5.932 1.00 31.11 H new ATOM 0 HB2 TYR A 103 -7.560 9.838 7.530 1.00 44.12 H new ATOM 0 HB3 TYR A 103 -7.673 8.306 6.687 1.00 44.12 H new ATOM 0 HD1 TYR A 103 -8.930 8.971 4.126 1.00 71.25 H new ATOM 0 HD2 TYR A 103 -6.034 11.220 6.318 1.00 42.31 H new ATOM 0 HE1 TYR A 103 -8.165 10.017 2.046 1.00 54.33 H new ATOM 0 HE2 TYR A 103 -5.269 12.254 4.227 1.00 31.41 H new ATOM 0 HH TYR A 103 -5.517 12.409 2.028 1.00 43.43 H new ATOM 1691 N ASN A 104 -9.735 8.527 9.196 1.00 1.12 N ATOM 1692 CA ASN A 104 -10.295 7.755 10.338 1.00 22.12 C ATOM 1693 C ASN A 104 -11.792 7.427 10.166 1.00 21.04 C ATOM 1694 O ASN A 104 -12.188 6.301 10.429 1.00 63.43 O ATOM 1695 CB ASN A 104 -10.059 8.542 11.666 1.00 50.32 C ATOM 1696 CG ASN A 104 -10.594 7.864 12.939 1.00 1.14 C ATOM 1697 OD1 ASN A 104 -10.740 6.651 13.012 1.00 72.22 O ATOM 1698 ND2 ASN A 104 -10.880 8.648 13.962 1.00 74.42 N ATOM 0 H ASN A 104 -9.148 9.308 9.488 1.00 1.12 H new ATOM 0 HA ASN A 104 -9.772 6.799 10.372 1.00 22.12 H new ATOM 0 HB2 ASN A 104 -8.988 8.707 11.785 1.00 50.32 H new ATOM 0 HB3 ASN A 104 -10.524 9.523 11.574 1.00 50.32 H new ATOM 0 HD21 ASN A 104 -11.229 8.245 14.832 1.00 74.42 H new ATOM 0 HD22 ASN A 104 -10.752 9.657 13.883 1.00 74.42 H new ATOM 1705 N GLN A 105 -12.604 8.393 9.695 1.00 72.14 N ATOM 1706 CA GLN A 105 -14.047 8.156 9.458 1.00 4.51 C ATOM 1707 C GLN A 105 -14.282 7.111 8.335 1.00 4.45 C ATOM 1708 O GLN A 105 -15.255 6.361 8.384 1.00 34.52 O ATOM 1709 CB GLN A 105 -14.795 9.473 9.110 1.00 53.50 C ATOM 1710 CG GLN A 105 -16.339 9.346 9.128 1.00 11.21 C ATOM 1711 CD GLN A 105 -16.922 9.054 10.521 1.00 61.43 C ATOM 1712 OE1 GLN A 105 -16.398 9.493 11.544 1.00 10.12 O ATOM 1713 NE2 GLN A 105 -17.997 8.289 10.574 1.00 23.00 N ATOM 0 H GLN A 105 -12.292 9.338 9.472 1.00 72.14 H new ATOM 0 HA GLN A 105 -14.451 7.761 10.390 1.00 4.51 H new ATOM 0 HB2 GLN A 105 -14.496 10.246 9.818 1.00 53.50 H new ATOM 0 HB3 GLN A 105 -14.480 9.807 8.121 1.00 53.50 H new ATOM 0 HG2 GLN A 105 -16.775 10.270 8.749 1.00 11.21 H new ATOM 0 HG3 GLN A 105 -16.637 8.550 8.446 1.00 11.21 H new ATOM 0 HE21 GLN A 105 -18.415 7.936 9.713 1.00 23.00 H new ATOM 0 HE22 GLN A 105 -18.410 8.051 11.476 1.00 23.00 H new ATOM 1722 N ILE A 106 -13.355 7.020 7.356 1.00 31.02 N ATOM 1723 CA ILE A 106 -13.535 6.139 6.178 1.00 51.12 C ATOM 1724 C ILE A 106 -13.181 4.687 6.603 1.00 11.44 C ATOM 1725 O ILE A 106 -13.976 3.756 6.465 1.00 42.42 O ATOM 1726 CB ILE A 106 -12.607 6.621 4.990 1.00 10.42 C ATOM 1727 CG1 ILE A 106 -12.950 8.088 4.569 1.00 70.14 C ATOM 1728 CG2 ILE A 106 -12.682 5.669 3.778 1.00 35.25 C ATOM 1729 CD1 ILE A 106 -11.997 8.700 3.540 1.00 30.04 C ATOM 0 H ILE A 106 -12.479 7.542 7.357 1.00 31.02 H new ATOM 0 HA ILE A 106 -14.566 6.178 5.828 1.00 51.12 H new ATOM 0 HB ILE A 106 -11.580 6.601 5.355 1.00 10.42 H new ATOM 0 HG12 ILE A 106 -13.961 8.107 4.163 1.00 70.14 H new ATOM 0 HG13 ILE A 106 -12.952 8.716 5.460 1.00 70.14 H new ATOM 0 HG21 ILE A 106 -12.030 6.037 2.986 1.00 35.25 H new ATOM 0 HG22 ILE A 106 -12.361 4.672 4.078 1.00 35.25 H new ATOM 0 HG23 ILE A 106 -13.708 5.625 3.413 1.00 35.25 H new ATOM 0 HD11 ILE A 106 -12.314 9.717 3.310 1.00 30.04 H new ATOM 0 HD12 ILE A 106 -10.986 8.719 3.946 1.00 30.04 H new ATOM 0 HD13 ILE A 106 -12.011 8.101 2.630 1.00 30.04 H new ATOM 1741 N LEU A 107 -11.942 4.535 7.101 1.00 10.51 N ATOM 1742 CA LEU A 107 -11.455 3.354 7.861 1.00 1.31 C ATOM 1743 C LEU A 107 -12.416 2.835 8.988 1.00 41.31 C ATOM 1744 O LEU A 107 -12.506 1.619 9.199 1.00 52.11 O ATOM 1745 CB LEU A 107 -10.070 3.784 8.443 1.00 40.43 C ATOM 1746 CG LEU A 107 -9.208 2.735 9.214 1.00 20.20 C ATOM 1747 CD1 LEU A 107 -8.940 1.474 8.379 1.00 61.42 C ATOM 1748 CD2 LEU A 107 -7.874 3.372 9.673 1.00 53.20 C ATOM 0 H LEU A 107 -11.223 5.249 6.986 1.00 10.51 H new ATOM 0 HA LEU A 107 -11.393 2.498 7.190 1.00 1.31 H new ATOM 0 HB2 LEU A 107 -9.468 4.158 7.615 1.00 40.43 H new ATOM 0 HB3 LEU A 107 -10.243 4.624 9.116 1.00 40.43 H new ATOM 0 HG LEU A 107 -9.780 2.425 10.089 1.00 20.20 H new ATOM 0 HD11 LEU A 107 -8.337 0.775 8.959 1.00 61.42 H new ATOM 0 HD12 LEU A 107 -9.887 1.004 8.116 1.00 61.42 H new ATOM 0 HD13 LEU A 107 -8.405 1.747 7.469 1.00 61.42 H new ATOM 0 HD21 LEU A 107 -7.282 2.630 10.209 1.00 53.20 H new ATOM 0 HD22 LEU A 107 -7.318 3.719 8.802 1.00 53.20 H new ATOM 0 HD23 LEU A 107 -8.081 4.216 10.331 1.00 53.20 H new ATOM 1760 N ALA A 108 -13.138 3.740 9.674 1.00 24.14 N ATOM 1761 CA ALA A 108 -14.096 3.366 10.758 1.00 44.11 C ATOM 1762 C ALA A 108 -15.438 2.808 10.216 1.00 50.43 C ATOM 1763 O ALA A 108 -16.153 2.097 10.931 1.00 31.12 O ATOM 1764 CB ALA A 108 -14.371 4.575 11.670 1.00 51.33 C ATOM 0 H ALA A 108 -13.083 4.744 9.503 1.00 24.14 H new ATOM 0 HA ALA A 108 -13.620 2.568 11.328 1.00 44.11 H new ATOM 0 HB1 ALA A 108 -15.071 4.287 12.455 1.00 51.33 H new ATOM 0 HB2 ALA A 108 -13.437 4.910 12.121 1.00 51.33 H new ATOM 0 HB3 ALA A 108 -14.800 5.385 11.081 1.00 51.33 H new ATOM 1770 N THR A 109 -15.768 3.129 8.949 1.00 33.23 N ATOM 1771 CA THR A 109 -17.096 2.810 8.347 1.00 71.41 C ATOM 1772 C THR A 109 -16.984 1.765 7.212 1.00 22.24 C ATOM 1773 O THR A 109 -17.995 1.185 6.802 1.00 54.40 O ATOM 1774 CB THR A 109 -17.793 4.094 7.778 1.00 0.10 C ATOM 1775 OG1 THR A 109 -16.957 4.712 6.777 1.00 23.05 O ATOM 1776 CG2 THR A 109 -18.118 5.109 8.895 1.00 44.13 C ATOM 0 H THR A 109 -15.134 3.612 8.312 1.00 33.23 H new ATOM 0 HA THR A 109 -17.699 2.394 9.154 1.00 71.41 H new ATOM 0 HB THR A 109 -18.734 3.785 7.323 1.00 0.10 H new ATOM 0 HG1 THR A 109 -16.307 5.303 7.212 1.00 23.05 H new ATOM 0 HG21 THR A 109 -18.600 5.985 8.461 1.00 44.13 H new ATOM 0 HG22 THR A 109 -18.788 4.649 9.621 1.00 44.13 H new ATOM 0 HG23 THR A 109 -17.196 5.411 9.392 1.00 44.13 H new ATOM 1784 N GLN A 110 -15.749 1.518 6.719 1.00 61.21 N ATOM 1785 CA GLN A 110 -15.494 0.705 5.493 1.00 12.24 C ATOM 1786 C GLN A 110 -14.267 -0.230 5.685 1.00 12.03 C ATOM 1787 O GLN A 110 -14.346 -1.439 5.424 1.00 14.44 O ATOM 1788 CB GLN A 110 -15.267 1.642 4.266 1.00 54.24 C ATOM 1789 CG GLN A 110 -16.502 2.467 3.838 1.00 74.12 C ATOM 1790 CD GLN A 110 -16.188 3.543 2.795 1.00 22.51 C ATOM 1791 OE1 GLN A 110 -15.881 4.746 3.248 1.00 22.21 O flip ATOM 1792 NE2 GLN A 110 -16.222 3.298 1.594 1.00 30.40 N flip ATOM 0 H GLN A 110 -14.898 1.873 7.154 1.00 61.21 H new ATOM 0 HA GLN A 110 -16.370 0.082 5.311 1.00 12.24 H new ATOM 0 HB2 GLN A 110 -14.453 2.328 4.498 1.00 54.24 H new ATOM 0 HB3 GLN A 110 -14.942 1.036 3.420 1.00 54.24 H new ATOM 0 HG2 GLN A 110 -17.258 1.792 3.436 1.00 74.12 H new ATOM 0 HG3 GLN A 110 -16.935 2.942 4.719 1.00 74.12 H new ATOM 0 HE21 GLN A 110 -16.462 2.361 1.271 1.00 30.40 H new ATOM 0 HE22 GLN A 110 -16.010 4.032 0.918 1.00 30.40 H new ATOM 1801 N GLY A 111 -13.127 0.348 6.120 1.00 44.22 N ATOM 1802 CA GLY A 111 -11.899 -0.432 6.387 1.00 31.23 C ATOM 1803 C GLY A 111 -10.682 0.015 5.576 1.00 24.24 C ATOM 1804 O GLY A 111 -10.790 0.875 4.696 1.00 52.13 O ATOM 0 H GLY A 111 -13.031 1.349 6.293 1.00 44.22 H new ATOM 0 HA2 GLY A 111 -11.660 -0.360 7.448 1.00 31.23 H new ATOM 0 HA3 GLY A 111 -12.097 -1.483 6.175 1.00 31.23 H new ATOM 1808 N ILE A 112 -9.505 -0.542 5.963 1.00 12.12 N ATOM 1809 CA ILE A 112 -8.182 -0.344 5.287 1.00 25.30 C ATOM 1810 C ILE A 112 -8.235 -0.270 3.730 1.00 1.24 C ATOM 1811 O ILE A 112 -7.449 0.463 3.131 1.00 72.53 O ATOM 1812 CB ILE A 112 -7.144 -1.450 5.755 1.00 5.01 C ATOM 1813 CG1 ILE A 112 -5.657 -0.988 5.547 1.00 61.33 C ATOM 1814 CG2 ILE A 112 -7.389 -2.829 5.076 1.00 53.21 C ATOM 1815 CD1 ILE A 112 -5.211 0.147 6.460 1.00 11.54 C ATOM 0 H ILE A 112 -9.441 -1.158 6.774 1.00 12.12 H new ATOM 0 HA ILE A 112 -7.850 0.644 5.606 1.00 25.30 H new ATOM 0 HB ILE A 112 -7.311 -1.580 6.824 1.00 5.01 H new ATOM 0 HG12 ILE A 112 -5.000 -1.843 5.705 1.00 61.33 H new ATOM 0 HG13 ILE A 112 -5.529 -0.675 4.511 1.00 61.33 H new ATOM 0 HG21 ILE A 112 -6.650 -3.547 5.433 1.00 53.21 H new ATOM 0 HG22 ILE A 112 -8.389 -3.184 5.324 1.00 53.21 H new ATOM 0 HG23 ILE A 112 -7.299 -2.723 3.995 1.00 53.21 H new ATOM 0 HD11 ILE A 112 -4.172 0.399 6.246 1.00 11.54 H new ATOM 0 HD12 ILE A 112 -5.840 1.021 6.288 1.00 11.54 H new ATOM 0 HD13 ILE A 112 -5.301 -0.166 7.500 1.00 11.54 H new ATOM 1827 N ARG A 113 -9.156 -1.031 3.099 1.00 25.22 N ATOM 1828 CA ARG A 113 -9.393 -0.981 1.631 1.00 74.41 C ATOM 1829 C ARG A 113 -9.663 0.461 1.150 1.00 63.01 C ATOM 1830 O ARG A 113 -8.996 0.973 0.256 1.00 60.14 O ATOM 1831 CB ARG A 113 -10.599 -1.880 1.243 1.00 4.04 C ATOM 1832 CG ARG A 113 -10.385 -3.391 1.465 1.00 21.33 C ATOM 1833 CD ARG A 113 -11.700 -4.184 1.318 1.00 30.14 C ATOM 1834 NE ARG A 113 -12.695 -3.751 2.327 1.00 51.42 N ATOM 1835 CZ ARG A 113 -13.980 -3.538 2.115 1.00 30.22 C ATOM 1836 NH1 ARG A 113 -14.510 -3.698 0.942 1.00 34.23 N ATOM 1837 NH2 ARG A 113 -14.730 -3.147 3.093 1.00 71.23 N ATOM 0 H ARG A 113 -9.756 -1.696 3.587 1.00 25.22 H new ATOM 0 HA ARG A 113 -8.489 -1.348 1.145 1.00 74.41 H new ATOM 0 HB2 ARG A 113 -11.469 -1.563 1.819 1.00 4.04 H new ATOM 0 HB3 ARG A 113 -10.834 -1.712 0.192 1.00 4.04 H new ATOM 0 HG2 ARG A 113 -9.654 -3.764 0.748 1.00 21.33 H new ATOM 0 HG3 ARG A 113 -9.970 -3.557 2.459 1.00 21.33 H new ATOM 0 HD2 ARG A 113 -12.106 -4.040 0.317 1.00 30.14 H new ATOM 0 HD3 ARG A 113 -11.501 -5.250 1.432 1.00 30.14 H new ATOM 0 HE ARG A 113 -12.354 -3.603 3.277 1.00 51.42 H new ATOM 0 HH11 ARG A 113 -13.931 -3.995 0.157 1.00 34.23 H new ATOM 0 HH12 ARG A 113 -15.506 -3.527 0.805 1.00 34.23 H new ATOM 0 HH21 ARG A 113 -14.327 -3.006 4.019 1.00 71.23 H new ATOM 0 HH22 ARG A 113 -15.724 -2.980 2.938 1.00 71.23 H new ATOM 1851 N ALA A 114 -10.645 1.085 1.797 1.00 21.42 N ATOM 1852 CA ALA A 114 -11.136 2.421 1.442 1.00 34.43 C ATOM 1853 C ALA A 114 -10.129 3.537 1.839 1.00 63.11 C ATOM 1854 O ALA A 114 -9.861 4.432 1.031 1.00 23.03 O ATOM 1855 CB ALA A 114 -12.514 2.637 2.073 1.00 31.23 C ATOM 0 H ALA A 114 -11.131 0.674 2.594 1.00 21.42 H new ATOM 0 HA ALA A 114 -11.234 2.483 0.358 1.00 34.43 H new ATOM 0 HB1 ALA A 114 -12.882 3.629 1.812 1.00 31.23 H new ATOM 0 HB2 ALA A 114 -13.207 1.883 1.701 1.00 31.23 H new ATOM 0 HB3 ALA A 114 -12.435 2.553 3.157 1.00 31.23 H new ATOM 1861 N PHE A 115 -9.611 3.514 3.093 1.00 35.45 N ATOM 1862 CA PHE A 115 -8.512 4.421 3.542 1.00 0.41 C ATOM 1863 C PHE A 115 -7.265 4.449 2.595 1.00 32.45 C ATOM 1864 O PHE A 115 -6.980 5.493 1.996 1.00 75.34 O ATOM 1865 CB PHE A 115 -8.118 3.988 4.996 1.00 73.01 C ATOM 1866 CG PHE A 115 -6.835 4.609 5.564 1.00 2.24 C ATOM 1867 CD1 PHE A 115 -6.703 5.987 5.719 1.00 50.44 C ATOM 1868 CD2 PHE A 115 -5.760 3.801 5.948 1.00 52.35 C ATOM 1869 CE1 PHE A 115 -5.541 6.534 6.231 1.00 62.44 C ATOM 1870 CE2 PHE A 115 -4.603 4.347 6.459 1.00 41.05 C ATOM 1871 CZ PHE A 115 -4.493 5.714 6.602 1.00 23.14 C ATOM 0 H PHE A 115 -9.936 2.875 3.818 1.00 35.45 H new ATOM 0 HA PHE A 115 -8.882 5.446 3.515 1.00 0.41 H new ATOM 0 HB2 PHE A 115 -8.943 4.237 5.663 1.00 73.01 H new ATOM 0 HB3 PHE A 115 -8.010 2.903 5.013 1.00 73.01 H new ATOM 0 HD1 PHE A 115 -7.518 6.636 5.436 1.00 50.44 H new ATOM 0 HD2 PHE A 115 -5.838 2.729 5.842 1.00 52.35 H new ATOM 0 HE1 PHE A 115 -5.452 7.605 6.341 1.00 62.44 H new ATOM 0 HE2 PHE A 115 -3.783 3.705 6.747 1.00 41.05 H new ATOM 0 HZ PHE A 115 -3.587 6.144 7.004 1.00 23.14 H new ATOM 1881 N ILE A 116 -6.486 3.342 2.557 1.00 25.33 N ATOM 1882 CA ILE A 116 -5.398 3.169 1.536 1.00 5.12 C ATOM 1883 C ILE A 116 -5.811 3.592 0.086 1.00 12.20 C ATOM 1884 O ILE A 116 -5.018 4.225 -0.602 1.00 11.43 O ATOM 1885 CB ILE A 116 -4.837 1.691 1.533 1.00 12.42 C ATOM 1886 CG1 ILE A 116 -4.343 1.271 2.955 1.00 63.02 C ATOM 1887 CG2 ILE A 116 -3.700 1.491 0.496 1.00 31.14 C ATOM 1888 CD1 ILE A 116 -3.214 2.109 3.533 1.00 62.23 C ATOM 0 H ILE A 116 -6.579 2.561 3.206 1.00 25.33 H new ATOM 0 HA ILE A 116 -4.609 3.854 1.845 1.00 5.12 H new ATOM 0 HB ILE A 116 -5.667 1.048 1.242 1.00 12.42 H new ATOM 0 HG12 ILE A 116 -5.189 1.312 3.641 1.00 63.02 H new ATOM 0 HG13 ILE A 116 -4.016 0.232 2.914 1.00 63.02 H new ATOM 0 HG21 ILE A 116 -3.350 0.459 0.534 1.00 31.14 H new ATOM 0 HG22 ILE A 116 -4.076 1.710 -0.503 1.00 31.14 H new ATOM 0 HG23 ILE A 116 -2.874 2.163 0.728 1.00 31.14 H new ATOM 0 HD11 ILE A 116 -2.950 1.732 4.521 1.00 62.23 H new ATOM 0 HD12 ILE A 116 -2.345 2.050 2.878 1.00 62.23 H new ATOM 0 HD13 ILE A 116 -3.537 3.147 3.616 1.00 62.23 H new ATOM 1900 N ASN A 117 -7.066 3.337 -0.331 1.00 74.31 N ATOM 1901 CA ASN A 117 -7.546 3.751 -1.683 1.00 63.41 C ATOM 1902 C ASN A 117 -7.626 5.299 -1.802 1.00 24.13 C ATOM 1903 O ASN A 117 -7.288 5.868 -2.840 1.00 32.52 O ATOM 1904 CB ASN A 117 -8.914 3.094 -2.006 1.00 30.42 C ATOM 1905 CG ASN A 117 -9.501 3.512 -3.357 1.00 14.03 C ATOM 1906 OD1 ASN A 117 -10.330 4.410 -3.438 1.00 4.33 O ATOM 1907 ND2 ASN A 117 -9.053 2.891 -4.430 1.00 50.35 N ATOM 0 H ASN A 117 -7.765 2.853 0.233 1.00 74.31 H new ATOM 0 HA ASN A 117 -6.821 3.401 -2.418 1.00 63.41 H new ATOM 0 HB2 ASN A 117 -8.798 2.010 -1.991 1.00 30.42 H new ATOM 0 HB3 ASN A 117 -9.623 3.349 -1.219 1.00 30.42 H new ATOM 0 HD21 ASN A 117 -9.397 3.155 -5.353 1.00 50.35 H new ATOM 0 HD22 ASN A 117 -8.362 2.146 -4.337 1.00 50.35 H new ATOM 1914 N ALA A 118 -8.050 5.966 -0.717 1.00 41.30 N ATOM 1915 CA ALA A 118 -8.185 7.439 -0.676 1.00 70.53 C ATOM 1916 C ALA A 118 -6.805 8.151 -0.813 1.00 75.44 C ATOM 1917 O ALA A 118 -6.644 9.044 -1.658 1.00 22.02 O ATOM 1918 CB ALA A 118 -8.909 7.860 0.611 1.00 35.41 C ATOM 0 H ALA A 118 -8.309 5.506 0.156 1.00 41.30 H new ATOM 0 HA ALA A 118 -8.783 7.752 -1.532 1.00 70.53 H new ATOM 0 HB1 ALA A 118 -9.006 8.945 0.636 1.00 35.41 H new ATOM 0 HB2 ALA A 118 -9.900 7.407 0.636 1.00 35.41 H new ATOM 0 HB3 ALA A 118 -8.336 7.527 1.476 1.00 35.41 H new ATOM 1924 N LEU A 119 -5.819 7.755 0.032 1.00 52.31 N ATOM 1925 CA LEU A 119 -4.394 8.203 -0.087 1.00 32.32 C ATOM 1926 C LEU A 119 -3.815 8.047 -1.519 1.00 61.41 C ATOM 1927 O LEU A 119 -3.331 9.012 -2.120 1.00 63.33 O ATOM 1928 CB LEU A 119 -3.510 7.365 0.892 1.00 2.11 C ATOM 1929 CG LEU A 119 -3.941 7.354 2.394 1.00 54.23 C ATOM 1930 CD1 LEU A 119 -3.064 6.387 3.219 1.00 12.30 C ATOM 1931 CD2 LEU A 119 -3.926 8.776 2.990 1.00 22.14 C ATOM 0 H LEU A 119 -5.981 7.120 0.813 1.00 52.31 H new ATOM 0 HA LEU A 119 -4.380 9.265 0.159 1.00 32.32 H new ATOM 0 HB2 LEU A 119 -3.491 6.335 0.536 1.00 2.11 H new ATOM 0 HB3 LEU A 119 -2.488 7.741 0.834 1.00 2.11 H new ATOM 0 HG LEU A 119 -4.967 6.990 2.443 1.00 54.23 H new ATOM 0 HD11 LEU A 119 -3.387 6.401 4.260 1.00 12.30 H new ATOM 0 HD12 LEU A 119 -3.163 5.377 2.821 1.00 12.30 H new ATOM 0 HD13 LEU A 119 -2.022 6.700 3.159 1.00 12.30 H new ATOM 0 HD21 LEU A 119 -4.230 8.735 4.036 1.00 22.14 H new ATOM 0 HD22 LEU A 119 -2.920 9.189 2.921 1.00 22.14 H new ATOM 0 HD23 LEU A 119 -4.617 9.410 2.435 1.00 22.14 H new ATOM 1943 N VAL A 120 -3.906 6.826 -2.051 1.00 45.24 N ATOM 1944 CA VAL A 120 -3.276 6.436 -3.334 1.00 42.02 C ATOM 1945 C VAL A 120 -3.947 7.125 -4.571 1.00 61.24 C ATOM 1946 O VAL A 120 -3.292 7.344 -5.601 1.00 15.05 O ATOM 1947 CB VAL A 120 -3.289 4.865 -3.453 1.00 51.01 C ATOM 1948 CG1 VAL A 120 -2.719 4.368 -4.785 1.00 42.43 C ATOM 1949 CG2 VAL A 120 -2.510 4.224 -2.281 1.00 72.32 C ATOM 0 H VAL A 120 -4.422 6.067 -1.606 1.00 45.24 H new ATOM 0 HA VAL A 120 -2.244 6.788 -3.335 1.00 42.02 H new ATOM 0 HB VAL A 120 -4.335 4.560 -3.410 1.00 51.01 H new ATOM 0 HG11 VAL A 120 -2.753 3.279 -4.811 1.00 42.43 H new ATOM 0 HG12 VAL A 120 -3.312 4.770 -5.607 1.00 42.43 H new ATOM 0 HG13 VAL A 120 -1.686 4.701 -4.886 1.00 42.43 H new ATOM 0 HG21 VAL A 120 -2.530 3.139 -2.381 1.00 72.32 H new ATOM 0 HG22 VAL A 120 -1.477 4.571 -2.298 1.00 72.32 H new ATOM 0 HG23 VAL A 120 -2.973 4.510 -1.337 1.00 72.32 H new ATOM 1959 N ASN A 121 -5.240 7.495 -4.451 1.00 22.42 N ATOM 1960 CA ASN A 121 -5.992 8.213 -5.528 1.00 13.21 C ATOM 1961 C ASN A 121 -6.111 9.749 -5.274 1.00 4.24 C ATOM 1962 O ASN A 121 -6.895 10.432 -5.950 1.00 12.24 O ATOM 1963 CB ASN A 121 -7.387 7.557 -5.721 1.00 2.11 C ATOM 1964 CG ASN A 121 -7.300 6.181 -6.388 1.00 61.14 C ATOM 1965 OD1 ASN A 121 -7.413 6.058 -7.604 1.00 50.45 O ATOM 1966 ND2 ASN A 121 -7.034 5.147 -5.617 1.00 71.41 N ATOM 0 H ASN A 121 -5.797 7.311 -3.616 1.00 22.42 H new ATOM 0 HA ASN A 121 -5.418 8.113 -6.449 1.00 13.21 H new ATOM 0 HB2 ASN A 121 -7.875 7.457 -4.752 1.00 2.11 H new ATOM 0 HB3 ASN A 121 -8.013 8.212 -6.327 1.00 2.11 H new ATOM 0 HD21 ASN A 121 -6.918 4.221 -6.028 1.00 71.41 H new ATOM 0 HD22 ASN A 121 -6.944 5.272 -4.609 1.00 71.41 H new ATOM 1973 N SER A 122 -5.321 10.293 -4.319 1.00 12.03 N ATOM 1974 CA SER A 122 -5.136 11.776 -4.161 1.00 32.45 C ATOM 1975 C SER A 122 -4.380 12.358 -5.381 1.00 44.44 C ATOM 1976 O SER A 122 -3.543 11.656 -5.974 1.00 42.14 O ATOM 1977 CB SER A 122 -4.342 12.101 -2.870 1.00 70.13 C ATOM 1978 OG SER A 122 -4.984 11.582 -1.718 1.00 12.34 O ATOM 0 H SER A 122 -4.798 9.738 -3.642 1.00 12.03 H new ATOM 0 HA SER A 122 -6.125 12.229 -4.093 1.00 32.45 H new ATOM 0 HB2 SER A 122 -3.337 11.685 -2.946 1.00 70.13 H new ATOM 0 HB3 SER A 122 -4.233 13.181 -2.771 1.00 70.13 H new ATOM 0 HG SER A 122 -5.523 10.803 -1.967 1.00 12.34 H new ATOM 1984 N GLN A 123 -4.613 13.650 -5.748 1.00 63.22 N ATOM 1985 CA GLN A 123 -4.024 14.242 -6.978 1.00 73.41 C ATOM 1986 C GLN A 123 -2.503 14.473 -6.795 1.00 15.34 C ATOM 1987 O GLN A 123 -1.736 14.502 -7.757 1.00 54.40 O ATOM 1988 CB GLN A 123 -4.746 15.585 -7.303 1.00 3.25 C ATOM 1989 CG GLN A 123 -4.254 16.312 -8.577 1.00 2.55 C ATOM 1990 CD GLN A 123 -4.994 17.622 -8.858 1.00 5.25 C ATOM 1991 OE1 GLN A 123 -6.009 17.647 -9.549 1.00 71.21 O ATOM 1992 NE2 GLN A 123 -4.499 18.719 -8.318 1.00 24.23 N ATOM 0 H GLN A 123 -5.198 14.293 -5.214 1.00 63.22 H new ATOM 0 HA GLN A 123 -4.162 13.551 -7.810 1.00 73.41 H new ATOM 0 HB2 GLN A 123 -5.813 15.388 -7.407 1.00 3.25 H new ATOM 0 HB3 GLN A 123 -4.627 16.257 -6.453 1.00 3.25 H new ATOM 0 HG2 GLN A 123 -3.189 16.520 -8.478 1.00 2.55 H new ATOM 0 HG3 GLN A 123 -4.371 15.647 -9.433 1.00 2.55 H new ATOM 0 HE21 GLN A 123 -3.654 18.671 -7.748 1.00 24.23 H new ATOM 0 HE22 GLN A 123 -4.961 19.616 -8.470 1.00 24.23 H new ATOM 2001 N GLU A 124 -2.094 14.628 -5.525 1.00 21.21 N ATOM 2002 CA GLU A 124 -0.681 14.797 -5.130 1.00 13.21 C ATOM 2003 C GLU A 124 0.161 13.557 -5.509 1.00 34.44 C ATOM 2004 O GLU A 124 1.327 13.686 -5.892 1.00 44.31 O ATOM 2005 CB GLU A 124 -0.600 15.064 -3.607 1.00 40.32 C ATOM 2006 CG GLU A 124 -1.438 16.268 -3.135 1.00 24.11 C ATOM 2007 CD GLU A 124 -1.246 16.596 -1.642 1.00 51.25 C ATOM 2008 OE1 GLU A 124 -1.718 15.816 -0.791 1.00 21.13 O ATOM 2009 OE2 GLU A 124 -0.586 17.613 -1.323 1.00 32.24 O ATOM 0 H GLU A 124 -2.739 14.640 -4.735 1.00 21.21 H new ATOM 0 HA GLU A 124 -0.269 15.650 -5.670 1.00 13.21 H new ATOM 0 HB2 GLU A 124 -0.932 14.173 -3.074 1.00 40.32 H new ATOM 0 HB3 GLU A 124 0.442 15.230 -3.333 1.00 40.32 H new ATOM 0 HG2 GLU A 124 -1.172 17.142 -3.729 1.00 24.11 H new ATOM 0 HG3 GLU A 124 -2.492 16.064 -3.322 1.00 24.11 H new ATOM 2016 N TYR A 125 -0.450 12.354 -5.396 1.00 34.21 N ATOM 2017 CA TYR A 125 0.169 11.103 -5.886 1.00 22.45 C ATOM 2018 C TYR A 125 0.251 11.123 -7.440 1.00 22.41 C ATOM 2019 O TYR A 125 1.276 10.720 -8.017 1.00 23.03 O ATOM 2020 CB TYR A 125 -0.629 9.858 -5.385 1.00 11.12 C ATOM 2021 CG TYR A 125 0.070 8.496 -5.626 1.00 40.05 C ATOM 2022 CD1 TYR A 125 0.009 7.847 -6.867 1.00 43.21 C ATOM 2023 CD2 TYR A 125 0.799 7.862 -4.610 1.00 65.04 C ATOM 2024 CE1 TYR A 125 0.640 6.637 -7.085 1.00 75.52 C ATOM 2025 CE2 TYR A 125 1.433 6.647 -4.826 1.00 12.30 C ATOM 2026 CZ TYR A 125 1.351 6.039 -6.064 1.00 2.12 C ATOM 2027 OH TYR A 125 1.983 4.828 -6.281 1.00 13.34 O ATOM 0 H TYR A 125 -1.368 12.225 -4.971 1.00 34.21 H new ATOM 0 HA TYR A 125 1.181 11.032 -5.486 1.00 22.45 H new ATOM 0 HB2 TYR A 125 -0.816 9.970 -4.317 1.00 11.12 H new ATOM 0 HB3 TYR A 125 -1.600 9.844 -5.879 1.00 11.12 H new ATOM 0 HD1 TYR A 125 -0.545 8.304 -7.673 1.00 43.21 H new ATOM 0 HD2 TYR A 125 0.868 8.329 -3.639 1.00 65.04 H new ATOM 0 HE1 TYR A 125 0.577 6.160 -8.052 1.00 75.52 H new ATOM 0 HE2 TYR A 125 1.989 6.177 -4.028 1.00 12.30 H new ATOM 0 HH TYR A 125 2.248 4.761 -7.222 1.00 13.34 H new ATOM 2037 N ASN A 126 -0.822 11.635 -8.113 1.00 44.32 N ATOM 2038 CA ASN A 126 -0.924 11.572 -9.591 1.00 11.41 C ATOM 2039 C ASN A 126 0.113 12.476 -10.280 1.00 51.22 C ATOM 2040 O ASN A 126 0.603 12.106 -11.347 1.00 24.54 O ATOM 2041 CB ASN A 126 -2.381 11.811 -10.142 1.00 73.43 C ATOM 2042 CG ASN A 126 -2.841 13.270 -10.402 1.00 73.52 C ATOM 2043 OD1 ASN A 126 -2.091 14.177 -10.713 1.00 73.15 O ATOM 2044 ND2 ASN A 126 -4.114 13.493 -10.321 1.00 10.23 N ATOM 0 H ASN A 126 -1.614 12.088 -7.657 1.00 44.32 H new ATOM 0 HA ASN A 126 -0.684 10.542 -9.854 1.00 11.41 H new ATOM 0 HB2 ASN A 126 -2.476 11.261 -11.078 1.00 73.43 H new ATOM 0 HB3 ASN A 126 -3.081 11.363 -9.436 1.00 73.43 H new ATOM 0 HD21 ASN A 126 -4.482 14.424 -10.517 1.00 10.23 H new ATOM 0 HD22 ASN A 126 -4.749 12.738 -10.061 1.00 10.23 H new ATOM 2051 N GLU A 127 0.425 13.700 -9.758 1.00 12.42 N ATOM 2052 CA GLU A 127 1.547 14.493 -10.292 1.00 25.10 C ATOM 2053 C GLU A 127 2.939 13.823 -10.186 1.00 14.31 C ATOM 2054 O GLU A 127 3.626 13.638 -11.192 1.00 30.10 O ATOM 2055 CB GLU A 127 1.610 15.850 -9.515 1.00 52.41 C ATOM 2056 CG GLU A 127 0.302 16.682 -9.464 1.00 75.21 C ATOM 2057 CD GLU A 127 -0.063 17.365 -10.788 1.00 40.20 C ATOM 2058 OE1 GLU A 127 0.543 18.413 -11.104 1.00 43.25 O ATOM 2059 OE2 GLU A 127 -0.941 16.864 -11.522 1.00 64.34 O ATOM 0 H GLU A 127 -0.078 14.140 -8.987 1.00 12.42 H new ATOM 0 HA GLU A 127 1.343 14.612 -11.356 1.00 25.10 H new ATOM 0 HB2 GLU A 127 1.922 15.642 -8.491 1.00 52.41 H new ATOM 0 HB3 GLU A 127 2.388 16.465 -9.967 1.00 52.41 H new ATOM 0 HG2 GLU A 127 -0.519 16.029 -9.167 1.00 75.21 H new ATOM 0 HG3 GLU A 127 0.399 17.444 -8.690 1.00 75.21 H new ATOM 2066 N VAL A 128 3.328 13.462 -8.944 1.00 72.02 N ATOM 2067 CA VAL A 128 4.742 13.153 -8.592 1.00 44.42 C ATOM 2068 C VAL A 128 5.207 11.827 -9.237 1.00 30.41 C ATOM 2069 O VAL A 128 6.363 11.686 -9.658 1.00 52.41 O ATOM 2070 CB VAL A 128 4.932 13.091 -7.024 1.00 45.50 C ATOM 2071 CG1 VAL A 128 6.401 12.790 -6.617 1.00 11.43 C ATOM 2072 CG2 VAL A 128 4.442 14.400 -6.354 1.00 22.33 C ATOM 0 H VAL A 128 2.682 13.375 -8.160 1.00 72.02 H new ATOM 0 HA VAL A 128 5.360 13.959 -8.988 1.00 44.42 H new ATOM 0 HB VAL A 128 4.321 12.262 -6.666 1.00 45.50 H new ATOM 0 HG11 VAL A 128 6.478 12.758 -5.530 1.00 11.43 H new ATOM 0 HG12 VAL A 128 6.703 11.828 -7.031 1.00 11.43 H new ATOM 0 HG13 VAL A 128 7.053 13.573 -7.004 1.00 11.43 H new ATOM 0 HG21 VAL A 128 4.584 14.332 -5.275 1.00 22.33 H new ATOM 0 HG22 VAL A 128 5.013 15.243 -6.742 1.00 22.33 H new ATOM 0 HG23 VAL A 128 3.384 14.547 -6.572 1.00 22.33 H new ATOM 2082 N PHE A 129 4.278 10.867 -9.315 1.00 21.43 N ATOM 2083 CA PHE A 129 4.538 9.520 -9.869 1.00 55.53 C ATOM 2084 C PHE A 129 3.781 9.321 -11.185 1.00 1.53 C ATOM 2085 O PHE A 129 4.342 8.861 -12.176 1.00 10.32 O ATOM 2086 CB PHE A 129 4.100 8.441 -8.838 1.00 1.11 C ATOM 2087 CG PHE A 129 4.678 8.701 -7.461 1.00 4.14 C ATOM 2088 CD1 PHE A 129 6.037 8.533 -7.228 1.00 24.52 C ATOM 2089 CD2 PHE A 129 3.882 9.177 -6.421 1.00 31.12 C ATOM 2090 CE1 PHE A 129 6.575 8.820 -6.001 1.00 53.53 C ATOM 2091 CE2 PHE A 129 4.428 9.469 -5.195 1.00 23.10 C ATOM 2092 CZ PHE A 129 5.777 9.290 -4.990 1.00 13.13 C ATOM 0 H PHE A 129 3.318 10.997 -8.996 1.00 21.43 H new ATOM 0 HA PHE A 129 5.605 9.423 -10.068 1.00 55.53 H new ATOM 0 HB2 PHE A 129 3.012 8.420 -8.776 1.00 1.11 H new ATOM 0 HB3 PHE A 129 4.419 7.458 -9.185 1.00 1.11 H new ATOM 0 HD1 PHE A 129 6.675 8.173 -8.021 1.00 24.52 H new ATOM 0 HD2 PHE A 129 2.823 9.318 -6.581 1.00 31.12 H new ATOM 0 HE1 PHE A 129 7.631 8.675 -5.830 1.00 53.53 H new ATOM 0 HE2 PHE A 129 3.802 9.837 -4.396 1.00 23.10 H new ATOM 0 HZ PHE A 129 6.209 9.521 -4.028 1.00 13.13 H new ATOM 2102 N GLY A 130 2.505 9.722 -11.180 1.00 32.10 N ATOM 2103 CA GLY A 130 1.544 9.289 -12.192 1.00 41.11 C ATOM 2104 C GLY A 130 0.746 8.111 -11.659 1.00 14.35 C ATOM 2105 O GLY A 130 -0.307 8.296 -11.031 1.00 41.44 O ATOM 0 H GLY A 130 2.115 10.351 -10.478 1.00 32.10 H new ATOM 0 HA2 GLY A 130 0.874 10.110 -12.448 1.00 41.11 H new ATOM 0 HA3 GLY A 130 2.065 9.005 -13.106 1.00 41.11 H new ATOM 2109 N GLU A 131 1.301 6.900 -11.867 1.00 63.31 N ATOM 2110 CA GLU A 131 0.767 5.637 -11.315 1.00 42.35 C ATOM 2111 C GLU A 131 1.737 4.458 -11.576 1.00 25.32 C ATOM 2112 O GLU A 131 1.840 3.542 -10.760 1.00 61.30 O ATOM 2113 CB GLU A 131 -0.655 5.329 -11.876 1.00 1.00 C ATOM 2114 CG GLU A 131 -0.760 5.254 -13.414 1.00 22.53 C ATOM 2115 CD GLU A 131 -2.203 5.025 -13.889 1.00 25.10 C ATOM 2116 OE1 GLU A 131 -2.977 6.007 -13.973 1.00 62.10 O ATOM 2117 OE2 GLU A 131 -2.578 3.864 -14.158 1.00 75.42 O ATOM 0 H GLU A 131 2.142 6.769 -12.429 1.00 63.31 H new ATOM 0 HA GLU A 131 0.677 5.762 -10.236 1.00 42.35 H new ATOM 0 HB2 GLU A 131 -0.993 4.380 -11.459 1.00 1.00 H new ATOM 0 HB3 GLU A 131 -1.342 6.097 -11.519 1.00 1.00 H new ATOM 0 HG2 GLU A 131 -0.380 6.179 -13.848 1.00 22.53 H new ATOM 0 HG3 GLU A 131 -0.127 4.446 -13.780 1.00 22.53 H new ATOM 2124 N ASP A 132 2.475 4.504 -12.700 1.00 5.12 N ATOM 2125 CA ASP A 132 3.396 3.412 -13.130 1.00 70.02 C ATOM 2126 C ASP A 132 4.780 3.482 -12.408 1.00 51.05 C ATOM 2127 O ASP A 132 5.815 3.132 -12.986 1.00 3.43 O ATOM 2128 CB ASP A 132 3.580 3.488 -14.671 1.00 21.43 C ATOM 2129 CG ASP A 132 2.245 3.550 -15.432 1.00 4.41 C ATOM 2130 OD1 ASP A 132 1.488 2.561 -15.398 1.00 0.11 O ATOM 2131 OD2 ASP A 132 1.951 4.582 -16.071 1.00 25.21 O ATOM 0 H ASP A 132 2.456 5.296 -13.343 1.00 5.12 H new ATOM 0 HA ASP A 132 2.949 2.458 -12.851 1.00 70.02 H new ATOM 0 HB2 ASP A 132 4.174 4.368 -14.918 1.00 21.43 H new ATOM 0 HB3 ASP A 132 4.144 2.618 -15.008 1.00 21.43 H new ATOM 2136 N THR A 133 4.771 3.870 -11.118 1.00 62.13 N ATOM 2137 CA THR A 133 5.993 4.090 -10.310 1.00 75.22 C ATOM 2138 C THR A 133 5.724 3.725 -8.832 1.00 33.01 C ATOM 2139 O THR A 133 4.609 3.936 -8.333 1.00 72.01 O ATOM 2140 CB THR A 133 6.464 5.593 -10.399 1.00 74.23 C ATOM 2141 OG1 THR A 133 6.635 5.975 -11.772 1.00 32.35 O ATOM 2142 CG2 THR A 133 7.788 5.861 -9.642 1.00 60.42 C ATOM 0 H THR A 133 3.909 4.042 -10.600 1.00 62.13 H new ATOM 0 HA THR A 133 6.781 3.451 -10.708 1.00 75.22 H new ATOM 0 HB THR A 133 5.683 6.187 -9.924 1.00 74.23 H new ATOM 0 HG1 THR A 133 6.926 6.910 -11.818 1.00 32.35 H new ATOM 0 HG21 THR A 133 8.058 6.912 -9.742 1.00 60.42 H new ATOM 0 HG22 THR A 133 7.660 5.618 -8.587 1.00 60.42 H new ATOM 0 HG23 THR A 133 8.580 5.242 -10.064 1.00 60.42 H new ATOM 2150 N VAL A 134 6.749 3.179 -8.140 1.00 33.03 N ATOM 2151 CA VAL A 134 6.695 2.936 -6.680 1.00 14.43 C ATOM 2152 C VAL A 134 6.806 4.298 -5.946 1.00 74.42 C ATOM 2153 O VAL A 134 7.661 5.114 -6.322 1.00 63.13 O ATOM 2154 CB VAL A 134 7.858 1.967 -6.205 1.00 13.01 C ATOM 2155 CG1 VAL A 134 7.897 1.792 -4.660 1.00 11.32 C ATOM 2156 CG2 VAL A 134 7.747 0.593 -6.911 1.00 42.22 C ATOM 0 H VAL A 134 7.629 2.897 -8.572 1.00 33.03 H new ATOM 0 HA VAL A 134 5.749 2.451 -6.440 1.00 14.43 H new ATOM 0 HB VAL A 134 8.799 2.436 -6.492 1.00 13.01 H new ATOM 0 HG11 VAL A 134 8.711 1.119 -4.390 1.00 11.32 H new ATOM 0 HG12 VAL A 134 8.056 2.762 -4.188 1.00 11.32 H new ATOM 0 HG13 VAL A 134 6.951 1.372 -4.317 1.00 11.32 H new ATOM 0 HG21 VAL A 134 8.554 -0.057 -6.572 1.00 42.22 H new ATOM 0 HG22 VAL A 134 6.787 0.136 -6.670 1.00 42.22 H new ATOM 0 HG23 VAL A 134 7.822 0.731 -7.990 1.00 42.22 H new ATOM 2166 N PRO A 135 5.928 4.589 -4.928 1.00 5.42 N ATOM 2167 CA PRO A 135 5.993 5.851 -4.154 1.00 41.50 C ATOM 2168 C PRO A 135 7.320 6.027 -3.371 1.00 2.13 C ATOM 2169 O PRO A 135 7.391 5.749 -2.171 1.00 2.23 O ATOM 2170 CB PRO A 135 4.764 5.767 -3.212 1.00 12.01 C ATOM 2171 CG PRO A 135 4.477 4.304 -3.108 1.00 10.41 C ATOM 2172 CD PRO A 135 4.794 3.743 -4.470 1.00 44.44 C ATOM 0 HA PRO A 135 5.972 6.725 -4.805 1.00 41.50 H new ATOM 0 HB2 PRO A 135 4.981 6.200 -2.236 1.00 12.01 H new ATOM 0 HB3 PRO A 135 3.912 6.311 -3.620 1.00 12.01 H new ATOM 0 HG2 PRO A 135 5.089 3.836 -2.337 1.00 10.41 H new ATOM 0 HG3 PRO A 135 3.436 4.125 -2.841 1.00 10.41 H new ATOM 0 HD2 PRO A 135 5.072 2.690 -4.418 1.00 44.44 H new ATOM 0 HD3 PRO A 135 3.940 3.814 -5.144 1.00 44.44 H new ATOM 2180 N TYR A 136 8.376 6.493 -4.077 1.00 51.23 N ATOM 2181 CA TYR A 136 9.702 6.738 -3.474 1.00 13.02 C ATOM 2182 C TYR A 136 9.614 7.780 -2.336 1.00 34.44 C ATOM 2183 O TYR A 136 8.795 8.703 -2.384 1.00 44.23 O ATOM 2184 CB TYR A 136 10.760 7.141 -4.556 1.00 62.55 C ATOM 2185 CG TYR A 136 10.345 8.252 -5.548 1.00 20.35 C ATOM 2186 CD1 TYR A 136 10.244 9.592 -5.151 1.00 34.31 C ATOM 2187 CD2 TYR A 136 10.069 7.958 -6.893 1.00 13.24 C ATOM 2188 CE1 TYR A 136 9.882 10.583 -6.044 1.00 3.31 C ATOM 2189 CE2 TYR A 136 9.708 8.951 -7.789 1.00 60.33 C ATOM 2190 CZ TYR A 136 9.615 10.261 -7.359 1.00 15.03 C ATOM 2191 OH TYR A 136 9.249 11.255 -8.245 1.00 41.13 O ATOM 0 H TYR A 136 8.332 6.708 -5.073 1.00 51.23 H new ATOM 0 HA TYR A 136 10.043 5.802 -3.031 1.00 13.02 H new ATOM 0 HB2 TYR A 136 11.666 7.463 -4.043 1.00 62.55 H new ATOM 0 HB3 TYR A 136 11.017 6.251 -5.130 1.00 62.55 H new ATOM 0 HD1 TYR A 136 10.454 9.856 -4.125 1.00 34.31 H new ATOM 0 HD2 TYR A 136 10.140 6.936 -7.236 1.00 13.24 H new ATOM 0 HE1 TYR A 136 9.808 11.608 -5.713 1.00 3.31 H new ATOM 0 HE2 TYR A 136 9.500 8.702 -8.819 1.00 60.33 H new ATOM 0 HH TYR A 136 8.313 11.132 -8.506 1.00 41.13 H new ATOM 2201 N ARG A 137 10.448 7.598 -1.309 1.00 34.32 N ATOM 2202 CA ARG A 137 10.412 8.410 -0.083 1.00 64.25 C ATOM 2203 C ARG A 137 10.910 9.855 -0.362 1.00 30.10 C ATOM 2204 O ARG A 137 12.058 10.060 -0.758 1.00 70.42 O ATOM 2205 CB ARG A 137 11.245 7.687 1.003 1.00 34.42 C ATOM 2206 CG ARG A 137 11.338 8.402 2.369 1.00 75.54 C ATOM 2207 CD ARG A 137 11.963 7.503 3.462 1.00 24.24 C ATOM 2208 NE ARG A 137 13.178 6.795 2.986 1.00 51.43 N ATOM 2209 CZ ARG A 137 14.377 6.870 3.523 1.00 64.34 C ATOM 2210 NH1 ARG A 137 14.622 7.665 4.511 1.00 75.25 N ATOM 2211 NH2 ARG A 137 15.335 6.153 3.039 1.00 44.24 N ATOM 0 H ARG A 137 11.172 6.880 -1.301 1.00 34.32 H new ATOM 0 HA ARG A 137 9.389 8.513 0.278 1.00 64.25 H new ATOM 0 HB2 ARG A 137 10.818 6.697 1.161 1.00 34.42 H new ATOM 0 HB3 ARG A 137 12.256 7.541 0.621 1.00 34.42 H new ATOM 0 HG2 ARG A 137 11.934 9.308 2.262 1.00 75.54 H new ATOM 0 HG3 ARG A 137 10.341 8.712 2.683 1.00 75.54 H new ATOM 0 HD2 ARG A 137 12.217 8.113 4.329 1.00 24.24 H new ATOM 0 HD3 ARG A 137 11.226 6.772 3.792 1.00 24.24 H new ATOM 0 HE ARG A 137 13.074 6.195 2.168 1.00 51.43 H new ATOM 0 HH11 ARG A 137 13.878 8.251 4.891 1.00 75.25 H new ATOM 0 HH12 ARG A 137 15.559 7.707 4.912 1.00 75.25 H new ATOM 0 HH21 ARG A 137 15.159 5.535 2.247 1.00 44.24 H new ATOM 0 HH22 ARG A 137 16.268 6.205 3.449 1.00 44.24 H new ATOM 2225 N ARG A 138 10.005 10.837 -0.146 1.00 45.13 N ATOM 2226 CA ARG A 138 10.222 12.281 -0.473 1.00 41.13 C ATOM 2227 C ARG A 138 11.347 12.939 0.369 1.00 71.23 C ATOM 2228 O ARG A 138 11.845 14.009 0.014 1.00 73.31 O ATOM 2229 CB ARG A 138 8.865 13.070 -0.294 1.00 74.25 C ATOM 2230 CG ARG A 138 8.116 13.443 -1.601 1.00 3.21 C ATOM 2231 CD ARG A 138 7.922 12.265 -2.577 1.00 13.40 C ATOM 2232 NE ARG A 138 7.397 11.046 -1.929 1.00 44.32 N ATOM 2233 CZ ARG A 138 6.144 10.645 -1.925 1.00 34.21 C ATOM 2234 NH1 ARG A 138 5.183 11.407 -2.349 1.00 50.31 N ATOM 2235 NH2 ARG A 138 5.861 9.462 -1.484 1.00 23.45 N ATOM 0 H ARG A 138 9.089 10.655 0.265 1.00 45.13 H new ATOM 0 HA ARG A 138 10.553 12.330 -1.510 1.00 41.13 H new ATOM 0 HB2 ARG A 138 8.198 12.470 0.325 1.00 74.25 H new ATOM 0 HB3 ARG A 138 9.071 13.987 0.257 1.00 74.25 H new ATOM 0 HG2 ARG A 138 7.139 13.851 -1.343 1.00 3.21 H new ATOM 0 HG3 ARG A 138 8.667 14.234 -2.109 1.00 3.21 H new ATOM 0 HD2 ARG A 138 7.239 12.569 -3.370 1.00 13.40 H new ATOM 0 HD3 ARG A 138 8.876 12.034 -3.050 1.00 13.40 H new ATOM 0 HE ARG A 138 8.071 10.459 -1.437 1.00 44.32 H new ATOM 0 HH11 ARG A 138 5.390 12.343 -2.697 1.00 50.31 H new ATOM 0 HH12 ARG A 138 4.220 11.070 -2.334 1.00 50.31 H new ATOM 0 HH21 ARG A 138 6.605 8.853 -1.145 1.00 23.45 H new ATOM 0 HH22 ARG A 138 4.894 9.139 -1.475 1.00 23.45 H new ATOM 2249 N PHE A 139 11.713 12.307 1.493 1.00 24.31 N ATOM 2250 CA PHE A 139 12.708 12.849 2.446 1.00 61.53 C ATOM 2251 C PHE A 139 13.886 11.858 2.656 1.00 22.53 C ATOM 2252 O PHE A 139 13.657 10.645 2.728 1.00 4.10 O ATOM 2253 CB PHE A 139 12.003 13.160 3.793 1.00 54.04 C ATOM 2254 CG PHE A 139 10.967 14.281 3.689 1.00 24.45 C ATOM 2255 CD1 PHE A 139 11.369 15.616 3.707 1.00 61.41 C ATOM 2256 CD2 PHE A 139 9.604 14.009 3.555 1.00 23.30 C ATOM 2257 CE1 PHE A 139 10.446 16.640 3.593 1.00 30.31 C ATOM 2258 CE2 PHE A 139 8.683 15.035 3.446 1.00 13.12 C ATOM 2259 CZ PHE A 139 9.105 16.349 3.464 1.00 23.05 C ATOM 0 H PHE A 139 11.330 11.404 1.773 1.00 24.31 H new ATOM 0 HA PHE A 139 13.129 13.767 2.035 1.00 61.53 H new ATOM 0 HB2 PHE A 139 11.515 12.256 4.157 1.00 54.04 H new ATOM 0 HB3 PHE A 139 12.754 13.436 4.533 1.00 54.04 H new ATOM 0 HD1 PHE A 139 12.417 15.854 3.812 1.00 61.41 H new ATOM 0 HD2 PHE A 139 9.264 12.984 3.536 1.00 23.30 H new ATOM 0 HE1 PHE A 139 10.776 17.668 3.605 1.00 30.31 H new ATOM 0 HE2 PHE A 139 7.632 14.808 3.347 1.00 13.12 H new ATOM 0 HZ PHE A 139 8.385 17.149 3.377 1.00 23.05 H new ATOM 2269 N PRO A 140 15.171 12.365 2.751 1.00 5.32 N ATOM 2270 CA PRO A 140 16.376 11.522 3.048 1.00 64.14 C ATOM 2271 C PRO A 140 16.210 10.598 4.283 1.00 52.35 C ATOM 2272 O PRO A 140 16.796 9.508 4.341 1.00 75.33 O ATOM 2273 CB PRO A 140 17.482 12.573 3.296 1.00 54.15 C ATOM 2274 CG PRO A 140 17.074 13.736 2.447 1.00 65.11 C ATOM 2275 CD PRO A 140 15.562 13.790 2.526 1.00 63.05 C ATOM 0 HA PRO A 140 16.585 10.828 2.234 1.00 64.14 H new ATOM 0 HB2 PRO A 140 17.541 12.849 4.349 1.00 54.15 H new ATOM 0 HB3 PRO A 140 18.463 12.195 3.010 1.00 54.15 H new ATOM 0 HG2 PRO A 140 17.519 14.662 2.812 1.00 65.11 H new ATOM 0 HG3 PRO A 140 17.408 13.606 1.418 1.00 65.11 H new ATOM 0 HD2 PRO A 140 15.226 14.431 3.341 1.00 63.05 H new ATOM 0 HD3 PRO A 140 15.126 14.185 1.608 1.00 63.05 H new ATOM 2283 N THR A 141 15.414 11.056 5.267 1.00 55.31 N ATOM 2284 CA THR A 141 15.024 10.235 6.436 1.00 73.42 C ATOM 2285 C THR A 141 13.587 10.553 6.913 1.00 4.03 C ATOM 2286 O THR A 141 13.144 11.706 6.889 1.00 23.51 O ATOM 2287 CB THR A 141 16.025 10.372 7.634 1.00 71.34 C ATOM 2288 OG1 THR A 141 15.623 9.509 8.714 1.00 21.03 O ATOM 2289 CG2 THR A 141 16.154 11.818 8.148 1.00 63.41 C ATOM 0 H THR A 141 15.024 11.998 5.278 1.00 55.31 H new ATOM 0 HA THR A 141 15.057 9.202 6.091 1.00 73.42 H new ATOM 0 HB THR A 141 17.005 10.076 7.259 1.00 71.34 H new ATOM 0 HG1 THR A 141 16.255 9.600 9.458 1.00 21.03 H new ATOM 0 HG21 THR A 141 16.861 11.848 8.977 1.00 63.41 H new ATOM 0 HG22 THR A 141 16.512 12.460 7.343 1.00 63.41 H new ATOM 0 HG23 THR A 141 15.181 12.171 8.488 1.00 63.41 H new ATOM 2297 N LEU A 142 12.861 9.492 7.314 1.00 41.35 N ATOM 2298 CA LEU A 142 11.537 9.587 7.976 1.00 3.32 C ATOM 2299 C LEU A 142 11.557 8.727 9.257 1.00 62.31 C ATOM 2300 O LEU A 142 12.104 7.617 9.250 1.00 55.35 O ATOM 2301 CB LEU A 142 10.387 9.116 7.029 1.00 12.22 C ATOM 2302 CG LEU A 142 9.994 10.081 5.857 1.00 53.22 C ATOM 2303 CD1 LEU A 142 8.822 9.509 5.023 1.00 23.21 C ATOM 2304 CD2 LEU A 142 9.663 11.497 6.380 1.00 63.22 C ATOM 0 H LEU A 142 13.178 8.531 7.188 1.00 41.35 H new ATOM 0 HA LEU A 142 11.345 10.630 8.227 1.00 3.32 H new ATOM 0 HB2 LEU A 142 10.674 8.157 6.597 1.00 12.22 H new ATOM 0 HB3 LEU A 142 9.499 8.939 7.636 1.00 12.22 H new ATOM 0 HG LEU A 142 10.860 10.163 5.200 1.00 53.22 H new ATOM 0 HD11 LEU A 142 8.575 10.203 4.219 1.00 23.21 H new ATOM 0 HD12 LEU A 142 9.113 8.549 4.597 1.00 23.21 H new ATOM 0 HD13 LEU A 142 7.952 9.372 5.665 1.00 23.21 H new ATOM 0 HD21 LEU A 142 9.395 12.141 5.542 1.00 63.22 H new ATOM 0 HD22 LEU A 142 8.827 11.441 7.077 1.00 63.22 H new ATOM 0 HD23 LEU A 142 10.534 11.909 6.890 1.00 63.22 H new ATOM 2316 N GLU A 143 10.927 9.231 10.336 1.00 14.34 N ATOM 2317 CA GLU A 143 10.967 8.591 11.665 1.00 62.34 C ATOM 2318 C GLU A 143 10.174 7.260 11.685 1.00 1.21 C ATOM 2319 O GLU A 143 8.939 7.249 11.815 1.00 61.33 O ATOM 2320 CB GLU A 143 10.433 9.567 12.748 1.00 72.53 C ATOM 2321 CG GLU A 143 11.225 10.886 12.872 1.00 42.44 C ATOM 2322 CD GLU A 143 10.678 11.819 13.972 1.00 64.02 C ATOM 2323 OE1 GLU A 143 9.673 12.524 13.723 1.00 63.32 O ATOM 2324 OE2 GLU A 143 11.237 11.841 15.092 1.00 3.41 O ATOM 0 H GLU A 143 10.378 10.090 10.311 1.00 14.34 H new ATOM 0 HA GLU A 143 12.007 8.352 11.889 1.00 62.34 H new ATOM 0 HB2 GLU A 143 9.393 9.803 12.524 1.00 72.53 H new ATOM 0 HB3 GLU A 143 10.444 9.060 13.713 1.00 72.53 H new ATOM 0 HG2 GLU A 143 12.269 10.657 13.084 1.00 42.44 H new ATOM 0 HG3 GLU A 143 11.201 11.409 11.916 1.00 42.44 H new ATOM 2331 N HIS A 144 10.907 6.149 11.480 1.00 12.44 N ATOM 2332 CA HIS A 144 10.379 4.785 11.644 1.00 31.32 C ATOM 2333 C HIS A 144 11.535 3.809 11.996 1.00 71.34 C ATOM 2334 O HIS A 144 12.567 3.775 11.310 1.00 62.12 O ATOM 2335 CB HIS A 144 9.604 4.306 10.374 1.00 13.42 C ATOM 2336 CG HIS A 144 10.444 4.066 9.137 1.00 12.43 C ATOM 2337 ND1 HIS A 144 11.031 2.846 8.858 1.00 61.24 N ATOM 2338 CD2 HIS A 144 10.772 4.875 8.093 1.00 14.33 C ATOM 2339 CE1 HIS A 144 11.671 2.913 7.711 1.00 12.33 C ATOM 2340 NE2 HIS A 144 11.531 4.127 7.220 1.00 51.45 N ATOM 0 H HIS A 144 11.886 6.175 11.195 1.00 12.44 H new ATOM 0 HA HIS A 144 9.663 4.794 12.466 1.00 31.32 H new ATOM 0 HB2 HIS A 144 9.080 3.382 10.619 1.00 13.42 H new ATOM 0 HB3 HIS A 144 8.844 5.049 10.134 1.00 13.42 H new ATOM 0 HD2 HIS A 144 10.490 5.910 7.972 1.00 14.33 H new ATOM 0 HE1 HIS A 144 12.220 2.106 7.248 1.00 12.33 H new ATOM 0 HE2 HIS A 144 11.921 4.459 6.338 1.00 51.45 H new ATOM 2349 N HIS A 145 11.362 3.040 13.083 1.00 14.23 N ATOM 2350 CA HIS A 145 12.303 1.962 13.477 1.00 24.44 C ATOM 2351 C HIS A 145 12.228 0.765 12.491 1.00 31.05 C ATOM 2352 O HIS A 145 11.358 0.711 11.605 1.00 32.12 O ATOM 2353 CB HIS A 145 11.984 1.478 14.921 1.00 71.13 C ATOM 2354 CG HIS A 145 10.627 0.823 15.057 1.00 50.05 C ATOM 2355 ND1 HIS A 145 10.437 -0.542 14.965 1.00 14.32 N ATOM 2356 CD2 HIS A 145 9.391 1.350 15.241 1.00 13.22 C ATOM 2357 CE1 HIS A 145 9.157 -0.820 15.082 1.00 63.42 C ATOM 2358 NE2 HIS A 145 8.499 0.305 15.255 1.00 1.44 N ATOM 0 H HIS A 145 10.569 3.142 13.717 1.00 14.23 H new ATOM 0 HA HIS A 145 13.314 2.367 13.446 1.00 24.44 H new ATOM 0 HB2 HIS A 145 12.752 0.771 15.236 1.00 71.13 H new ATOM 0 HB3 HIS A 145 12.036 2.329 15.600 1.00 71.13 H new ATOM 0 HD1 HIS A 145 11.177 -1.230 14.827 1.00 14.32 H new ATOM 0 HD2 HIS A 145 9.152 2.397 15.355 1.00 13.22 H new ATOM 0 HE1 HIS A 145 8.720 -1.807 15.043 1.00 63.42 H new ATOM 2367 N HIS A 146 13.142 -0.195 12.668 1.00 61.04 N ATOM 2368 CA HIS A 146 13.140 -1.465 11.913 1.00 5.32 C ATOM 2369 C HIS A 146 12.548 -2.608 12.766 1.00 32.21 C ATOM 2370 O HIS A 146 12.619 -2.581 14.001 1.00 30.33 O ATOM 2371 CB HIS A 146 14.571 -1.807 11.436 1.00 31.45 C ATOM 2372 CG HIS A 146 15.119 -0.825 10.428 1.00 43.21 C ATOM 2373 ND1 HIS A 146 15.238 -1.120 9.091 1.00 50.35 N ATOM 2374 CD2 HIS A 146 15.555 0.453 10.562 1.00 74.21 C ATOM 2375 CE1 HIS A 146 15.712 -0.083 8.445 1.00 12.53 C ATOM 2376 NE2 HIS A 146 15.917 0.890 9.310 1.00 71.52 N ATOM 0 H HIS A 146 13.907 -0.119 13.338 1.00 61.04 H new ATOM 0 HA HIS A 146 12.507 -1.346 11.033 1.00 5.32 H new ATOM 0 HB2 HIS A 146 15.236 -1.839 12.299 1.00 31.45 H new ATOM 0 HB3 HIS A 146 14.571 -2.805 10.997 1.00 31.45 H new ATOM 0 HD1 HIS A 146 14.994 -2.014 8.665 1.00 50.35 H new ATOM 0 HD2 HIS A 146 15.608 1.020 11.480 1.00 74.21 H new ATOM 0 HE1 HIS A 146 15.902 -0.034 7.383 1.00 12.53 H new ATOM 2385 N HIS A 147 11.951 -3.597 12.083 1.00 25.04 N ATOM 2386 CA HIS A 147 11.287 -4.755 12.723 1.00 35.04 C ATOM 2387 C HIS A 147 12.289 -5.892 13.027 1.00 64.24 C ATOM 2388 O HIS A 147 12.069 -6.671 13.963 1.00 60.30 O ATOM 2389 CB HIS A 147 10.138 -5.281 11.814 1.00 21.11 C ATOM 2390 CG HIS A 147 9.023 -4.290 11.590 1.00 15.43 C ATOM 2391 ND1 HIS A 147 8.672 -3.807 10.346 1.00 63.53 N ATOM 2392 CD2 HIS A 147 8.163 -3.719 12.460 1.00 44.12 C ATOM 2393 CE1 HIS A 147 7.647 -2.993 10.461 1.00 54.41 C ATOM 2394 NE2 HIS A 147 7.313 -2.922 11.733 1.00 32.53 N ATOM 0 H HIS A 147 11.912 -3.621 11.064 1.00 25.04 H new ATOM 0 HA HIS A 147 10.871 -4.418 13.673 1.00 35.04 H new ATOM 0 HB2 HIS A 147 10.555 -5.565 10.848 1.00 21.11 H new ATOM 0 HB3 HIS A 147 9.722 -6.184 12.260 1.00 21.11 H new ATOM 0 HD1 HIS A 147 9.137 -4.046 9.470 1.00 63.53 H new ATOM 0 HD2 HIS A 147 8.146 -3.862 13.530 1.00 44.12 H new ATOM 0 HE1 HIS A 147 7.161 -2.471 9.650 1.00 54.41 H new ATOM 2403 N HIS A 148 13.391 -5.949 12.233 1.00 64.11 N ATOM 2404 CA HIS A 148 14.401 -7.045 12.247 1.00 71.32 C ATOM 2405 C HIS A 148 13.791 -8.384 11.732 1.00 43.30 C ATOM 2406 O HIS A 148 14.155 -8.871 10.655 1.00 31.25 O ATOM 2407 CB HIS A 148 15.070 -7.234 13.644 1.00 43.10 C ATOM 2408 CG HIS A 148 15.784 -6.017 14.182 1.00 54.52 C ATOM 2409 ND1 HIS A 148 17.148 -5.849 14.107 1.00 64.52 N ATOM 2410 CD2 HIS A 148 15.316 -4.920 14.834 1.00 65.41 C ATOM 2411 CE1 HIS A 148 17.489 -4.719 14.686 1.00 35.04 C ATOM 2412 NE2 HIS A 148 16.399 -4.132 15.136 1.00 72.51 N ATOM 0 H HIS A 148 13.608 -5.221 11.552 1.00 64.11 H new ATOM 0 HA HIS A 148 15.192 -6.743 11.561 1.00 71.32 H new ATOM 0 HB2 HIS A 148 14.304 -7.532 14.359 1.00 43.10 H new ATOM 0 HB3 HIS A 148 15.783 -8.056 13.580 1.00 43.10 H new ATOM 0 HD2 HIS A 148 14.284 -4.708 15.071 1.00 65.41 H new ATOM 0 HE1 HIS A 148 18.495 -4.336 14.777 1.00 35.04 H new ATOM 0 HE2 HIS A 148 16.365 -3.239 15.628 1.00 72.51 H new ATOM 2421 N HIS A 149 12.859 -8.960 12.518 1.00 44.53 N ATOM 2422 CA HIS A 149 12.120 -10.193 12.165 1.00 71.40 C ATOM 2423 C HIS A 149 11.151 -9.951 10.986 1.00 52.23 C ATOM 2424 O HIS A 149 10.173 -9.201 11.095 1.00 63.13 O ATOM 2425 CB HIS A 149 11.353 -10.710 13.414 1.00 53.14 C ATOM 2426 CG HIS A 149 10.678 -12.045 13.227 1.00 2.32 C ATOM 2427 ND1 HIS A 149 9.317 -12.190 13.061 1.00 45.52 N ATOM 2428 CD2 HIS A 149 11.186 -13.300 13.192 1.00 63.13 C ATOM 2429 CE1 HIS A 149 9.020 -13.466 12.934 1.00 41.55 C ATOM 2430 NE2 HIS A 149 10.135 -14.162 13.006 1.00 52.12 N ATOM 0 H HIS A 149 12.594 -8.579 13.426 1.00 44.53 H new ATOM 0 HA HIS A 149 12.836 -10.950 11.844 1.00 71.40 H new ATOM 0 HB2 HIS A 149 12.051 -10.784 14.248 1.00 53.14 H new ATOM 0 HB3 HIS A 149 10.600 -9.973 13.693 1.00 53.14 H new ATOM 0 HD2 HIS A 149 12.226 -13.572 13.292 1.00 63.13 H new ATOM 0 HE1 HIS A 149 8.029 -13.873 12.794 1.00 41.55 H new ATOM 0 HE2 HIS A 149 10.206 -15.177 12.935 1.00 52.12 H new TER 2439 HIS A 149