USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1067 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 161 CYS SG : rot 180:sc= -0.181 USER MOD Set 1.2: A 163 ASN : amide:sc= -0.816 X(o=-1,f=-1.1) USER MOD Set 2.1: A 92 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.1: A 41 MET CE :methyl -159:sc= -0.323 (180deg=-1.01) USER MOD Set 3.2: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 74 ASN : amide:sc= -0.214 K(o=-0.54,f=-2.1) USER MOD Single : A 8 GLN :FLIP amide:sc= -0.579 F(o=-1.3,f=-0.58) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -175:sc= -0.916 (180deg=-0.954) USER MOD Single : A 18 LYS NZ :NH3+ 167:sc=-0.00234 (180deg=-0.0926) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 THR OG1 : rot -99:sc= -0.337 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : +bothHN:sc= -0.474 K(o=-0.47,f=-3.5) USER MOD Single : A 36 HIS :FLIP no HD1:sc= -0.0969 F(o=-2.2!,f=-0.097) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 40 TYR OH : rot -162:sc= -2.33! USER MOD Single : A 43 ASN : amide:sc= -0.013 K(o=-0.013,f=-1.1) USER MOD Single : A 45 ASN : amide:sc= -0.399 K(o=-0.4,f=-3.3!) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.0246 F(o=-1.9!,f=-0.025) USER MOD Single : A 55 TYR OH : rot 90:sc= -0.738 USER MOD Single : A 77 MET CE :methyl 144:sc= 0 (180deg=-1.04) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.244 K(o=-0.24,f=-1.3) USER MOD Single : A 82 SER OG : rot 180:sc= 0.258 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot 1:sc= 0.989 USER MOD Single : A 94 ASN : amide:sc= -0.334 X(o=-0.33,f=-0.19) USER MOD Single : A 123 THR OG1 : rot 94:sc= 0.696 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -2.64! C(o=-2.6!,f=-3!) USER MOD Single : A 129 HIS :FLIP no HE2:sc= -2.17! C(o=-2.8!,f=-2.2!) USER MOD Single : A 134 THR OG1 : rot -109:sc= 0.0699 USER MOD Single : A 135 SER OG : rot 0:sc= 1.05 USER MOD Single : A 138 ASN : amide:sc= 1.41 K(o=1.4,f=-5.3!) USER MOD Single : A 139 LYS NZ :NH3+ -129:sc= 0.426 (180deg=-0.613) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 38:sc= 0.0354 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N GLN A 8 4.064 10.437 -2.161 1.00 1.20 N ATOM 66 CA GLN A 8 5.205 11.304 -1.956 1.00 1.13 C ATOM 67 C GLN A 8 4.906 12.707 -2.444 1.00 0.98 C ATOM 68 O GLN A 8 4.365 12.901 -3.535 1.00 0.93 O ATOM 69 CB GLN A 8 6.448 10.757 -2.662 1.00 1.19 C ATOM 70 CG GLN A 8 7.196 9.719 -1.848 1.00 1.42 C ATOM 71 CD GLN A 8 7.752 10.305 -0.564 1.00 1.54 C ATOM 72 OE1 GLN A 8 6.956 10.277 0.494 1.00 2.00 O flip ATOM 73 NE2 GLN A 8 8.880 10.798 -0.527 1.00 1.75 N flip ATOM 0 HA GLN A 8 5.406 11.339 -0.885 1.00 1.13 H new ATOM 0 HB2 GLN A 8 6.152 10.317 -3.614 1.00 1.19 H new ATOM 0 HB3 GLN A 8 7.121 11.584 -2.889 1.00 1.19 H new ATOM 0 HG2 GLN A 8 6.527 8.892 -1.610 1.00 1.42 H new ATOM 0 HG3 GLN A 8 8.011 9.308 -2.443 1.00 1.42 H new ATOM 0 HE21 GLN A 8 9.463 10.800 -1.364 1.00 1.75 H new ATOM 0 HE22 GLN A 8 9.231 11.204 0.340 1.00 1.75 H new ATOM 82 N VAL A 9 5.223 13.679 -1.606 1.00 0.94 N ATOM 83 CA VAL A 9 5.145 15.069 -1.998 1.00 0.81 C ATOM 84 C VAL A 9 6.473 15.473 -2.607 1.00 0.79 C ATOM 85 O VAL A 9 7.506 15.482 -1.937 1.00 0.87 O ATOM 86 CB VAL A 9 4.807 15.988 -0.805 1.00 0.81 C ATOM 87 CG1 VAL A 9 4.620 17.425 -1.269 1.00 1.16 C ATOM 88 CG2 VAL A 9 3.566 15.479 -0.089 1.00 1.27 C ATOM 0 H VAL A 9 5.537 13.527 -0.648 1.00 0.94 H new ATOM 0 HA VAL A 9 4.340 15.181 -2.725 1.00 0.81 H new ATOM 0 HB VAL A 9 5.640 15.972 -0.103 1.00 0.81 H new ATOM 0 HG11 VAL A 9 4.382 18.056 -0.412 1.00 1.16 H new ATOM 0 HG12 VAL A 9 5.539 17.779 -1.737 1.00 1.16 H new ATOM 0 HG13 VAL A 9 3.805 17.471 -1.991 1.00 1.16 H new ATOM 0 HG21 VAL A 9 3.336 16.134 0.751 1.00 1.27 H new ATOM 0 HG22 VAL A 9 2.725 15.469 -0.782 1.00 1.27 H new ATOM 0 HG23 VAL A 9 3.746 14.469 0.278 1.00 1.27 H new ATOM 98 N TYR A 10 6.441 15.788 -3.883 1.00 0.71 N ATOM 99 CA TYR A 10 7.653 16.014 -4.632 1.00 0.71 C ATOM 100 C TYR A 10 8.085 17.459 -4.506 1.00 0.62 C ATOM 101 O TYR A 10 7.257 18.372 -4.487 1.00 0.57 O ATOM 102 CB TYR A 10 7.438 15.635 -6.095 1.00 0.74 C ATOM 103 CG TYR A 10 6.800 14.272 -6.258 1.00 0.83 C ATOM 104 CD1 TYR A 10 7.406 13.132 -5.744 1.00 0.95 C ATOM 105 CD2 TYR A 10 5.588 14.127 -6.914 1.00 0.84 C ATOM 106 CE1 TYR A 10 6.824 11.886 -5.884 1.00 1.04 C ATOM 107 CE2 TYR A 10 4.999 12.884 -7.061 1.00 0.94 C ATOM 108 CZ TYR A 10 5.621 11.767 -6.546 1.00 1.03 C ATOM 109 OH TYR A 10 5.038 10.528 -6.684 1.00 1.14 O ATOM 0 H TYR A 10 5.583 15.893 -4.424 1.00 0.71 H new ATOM 0 HA TYR A 10 8.447 15.387 -4.226 1.00 0.71 H new ATOM 0 HB2 TYR A 10 6.808 16.386 -6.572 1.00 0.74 H new ATOM 0 HB3 TYR A 10 8.397 15.647 -6.614 1.00 0.74 H new ATOM 0 HD1 TYR A 10 8.349 13.221 -5.226 1.00 0.95 H new ATOM 0 HD2 TYR A 10 5.095 14.999 -7.317 1.00 0.84 H new ATOM 0 HE1 TYR A 10 7.309 11.011 -5.477 1.00 1.04 H new ATOM 0 HE2 TYR A 10 4.055 12.789 -7.577 1.00 0.94 H new ATOM 0 HH TYR A 10 4.194 10.616 -7.174 1.00 1.14 H new ATOM 119 N ARG A 11 9.384 17.658 -4.409 1.00 0.66 N ATOM 120 CA ARG A 11 9.941 18.982 -4.220 1.00 0.64 C ATOM 121 C ARG A 11 10.466 19.524 -5.535 1.00 0.56 C ATOM 122 O ARG A 11 10.944 18.772 -6.384 1.00 0.66 O ATOM 123 CB ARG A 11 11.069 18.938 -3.191 1.00 0.85 C ATOM 124 CG ARG A 11 10.596 18.651 -1.777 1.00 0.85 C ATOM 125 CD ARG A 11 10.045 19.897 -1.105 1.00 1.11 C ATOM 126 NE ARG A 11 9.489 19.613 0.226 1.00 1.37 N ATOM 127 CZ ARG A 11 10.218 19.480 1.337 1.00 1.76 C ATOM 128 NH1 ARG A 11 11.545 19.559 1.285 1.00 2.15 N ATOM 129 NH2 ARG A 11 9.615 19.272 2.501 1.00 2.31 N ATOM 0 H ARG A 11 10.079 16.913 -4.458 1.00 0.66 H new ATOM 0 HA ARG A 11 9.153 19.641 -3.855 1.00 0.64 H new ATOM 0 HB2 ARG A 11 11.788 18.174 -3.486 1.00 0.85 H new ATOM 0 HB3 ARG A 11 11.596 19.892 -3.202 1.00 0.85 H new ATOM 0 HG2 ARG A 11 9.826 17.880 -1.800 1.00 0.85 H new ATOM 0 HG3 ARG A 11 11.425 18.257 -1.189 1.00 0.85 H new ATOM 0 HD2 ARG A 11 10.838 20.639 -1.014 1.00 1.11 H new ATOM 0 HD3 ARG A 11 9.270 20.334 -1.734 1.00 1.11 H new ATOM 0 HE ARG A 11 8.477 19.511 0.306 1.00 1.37 H new ATOM 0 HH11 ARG A 11 12.012 19.722 0.393 1.00 2.15 H new ATOM 0 HH12 ARG A 11 12.096 19.457 2.137 1.00 2.15 H new ATOM 0 HH21 ARG A 11 8.598 19.214 2.545 1.00 2.31 H new ATOM 0 HH22 ARG A 11 10.169 19.170 3.351 1.00 2.31 H new ATOM 143 N GLY A 12 10.345 20.823 -5.699 1.00 0.46 N ATOM 144 CA GLY A 12 10.891 21.489 -6.856 1.00 0.45 C ATOM 145 C GLY A 12 10.947 22.974 -6.623 1.00 0.44 C ATOM 146 O GLY A 12 10.685 23.434 -5.513 1.00 0.50 O ATOM 0 H GLY A 12 9.870 21.440 -5.040 1.00 0.46 H new ATOM 0 HA2 GLY A 12 11.891 21.109 -7.065 1.00 0.45 H new ATOM 0 HA3 GLY A 12 10.278 21.274 -7.731 1.00 0.45 H new ATOM 150 N PHE A 13 11.296 23.730 -7.642 1.00 0.44 N ATOM 151 CA PHE A 13 11.375 25.170 -7.497 1.00 0.46 C ATOM 152 C PHE A 13 10.840 25.877 -8.732 1.00 0.43 C ATOM 153 O PHE A 13 10.980 25.383 -9.855 1.00 0.45 O ATOM 154 CB PHE A 13 12.815 25.612 -7.203 1.00 0.57 C ATOM 155 CG PHE A 13 13.841 24.509 -7.306 1.00 0.57 C ATOM 156 CD1 PHE A 13 14.514 24.277 -8.497 1.00 0.63 C ATOM 157 CD2 PHE A 13 14.149 23.714 -6.203 1.00 0.58 C ATOM 158 CE1 PHE A 13 15.473 23.283 -8.585 1.00 0.68 C ATOM 159 CE2 PHE A 13 15.100 22.721 -6.291 1.00 0.63 C ATOM 160 CZ PHE A 13 15.765 22.505 -7.481 1.00 0.67 C ATOM 0 H PHE A 13 11.528 23.378 -8.571 1.00 0.44 H new ATOM 0 HA PHE A 13 10.750 25.453 -6.650 1.00 0.46 H new ATOM 0 HB2 PHE A 13 13.086 26.409 -7.896 1.00 0.57 H new ATOM 0 HB3 PHE A 13 12.854 26.035 -6.199 1.00 0.57 H new ATOM 0 HD1 PHE A 13 14.287 24.879 -9.365 1.00 0.63 H new ATOM 0 HD2 PHE A 13 13.635 23.879 -5.267 1.00 0.58 H new ATOM 0 HE1 PHE A 13 15.993 23.115 -9.517 1.00 0.68 H new ATOM 0 HE2 PHE A 13 15.325 22.111 -5.428 1.00 0.63 H new ATOM 0 HZ PHE A 13 16.513 21.729 -7.549 1.00 0.67 H new ATOM 170 N ILE A 14 10.206 27.024 -8.507 1.00 0.42 N ATOM 171 CA ILE A 14 9.634 27.824 -9.585 1.00 0.42 C ATOM 172 C ILE A 14 10.735 28.404 -10.465 1.00 0.48 C ATOM 173 O ILE A 14 11.375 29.384 -10.096 1.00 0.56 O ATOM 174 CB ILE A 14 8.779 28.992 -9.035 1.00 0.43 C ATOM 175 CG1 ILE A 14 7.707 28.485 -8.062 1.00 0.41 C ATOM 176 CG2 ILE A 14 8.137 29.767 -10.182 1.00 0.46 C ATOM 177 CD1 ILE A 14 6.640 27.632 -8.716 1.00 0.38 C ATOM 0 H ILE A 14 10.075 27.423 -7.578 1.00 0.42 H new ATOM 0 HA ILE A 14 8.998 27.160 -10.170 1.00 0.42 H new ATOM 0 HB ILE A 14 9.439 29.663 -8.485 1.00 0.43 H new ATOM 0 HG12 ILE A 14 8.189 27.906 -7.275 1.00 0.41 H new ATOM 0 HG13 ILE A 14 7.231 29.341 -7.583 1.00 0.41 H new ATOM 0 HG21 ILE A 14 7.539 30.585 -9.779 1.00 0.46 H new ATOM 0 HG22 ILE A 14 8.916 30.171 -10.829 1.00 0.46 H new ATOM 0 HG23 ILE A 14 7.497 29.099 -10.759 1.00 0.46 H new ATOM 0 HD11 ILE A 14 5.919 27.312 -7.964 1.00 0.38 H new ATOM 0 HD12 ILE A 14 6.130 28.213 -9.484 1.00 0.38 H new ATOM 0 HD13 ILE A 14 7.103 26.756 -9.171 1.00 0.38 H new ATOM 189 N ALA A 15 10.965 27.790 -11.612 1.00 0.49 N ATOM 190 CA ALA A 15 11.988 28.267 -12.531 1.00 0.58 C ATOM 191 C ALA A 15 11.393 29.230 -13.546 1.00 0.65 C ATOM 192 O ALA A 15 11.962 30.280 -13.831 1.00 0.76 O ATOM 193 CB ALA A 15 12.656 27.094 -13.232 1.00 0.59 C ATOM 0 H ALA A 15 10.460 26.963 -11.930 1.00 0.49 H new ATOM 0 HA ALA A 15 12.744 28.804 -11.958 1.00 0.58 H new ATOM 0 HB1 ALA A 15 13.419 27.466 -13.916 1.00 0.59 H new ATOM 0 HB2 ALA A 15 13.119 26.443 -12.491 1.00 0.59 H new ATOM 0 HB3 ALA A 15 11.909 26.532 -13.792 1.00 0.59 H new ATOM 199 N VAL A 16 10.235 28.876 -14.078 1.00 0.66 N ATOM 200 CA VAL A 16 9.574 29.712 -15.065 1.00 0.78 C ATOM 201 C VAL A 16 8.263 30.248 -14.521 1.00 0.69 C ATOM 202 O VAL A 16 7.386 29.482 -14.123 1.00 0.67 O ATOM 203 CB VAL A 16 9.285 28.946 -16.375 1.00 0.94 C ATOM 204 CG1 VAL A 16 8.524 29.824 -17.364 1.00 1.55 C ATOM 205 CG2 VAL A 16 10.570 28.435 -17.003 1.00 1.42 C ATOM 0 H VAL A 16 9.735 28.018 -13.844 1.00 0.66 H new ATOM 0 HA VAL A 16 10.256 30.534 -15.282 1.00 0.78 H new ATOM 0 HB VAL A 16 8.661 28.088 -16.126 1.00 0.94 H new ATOM 0 HG11 VAL A 16 8.333 29.261 -18.278 1.00 1.55 H new ATOM 0 HG12 VAL A 16 7.576 30.132 -16.923 1.00 1.55 H new ATOM 0 HG13 VAL A 16 9.119 30.707 -17.599 1.00 1.55 H new ATOM 0 HG21 VAL A 16 10.337 27.900 -17.924 1.00 1.42 H new ATOM 0 HG22 VAL A 16 11.225 29.277 -17.228 1.00 1.42 H new ATOM 0 HG23 VAL A 16 11.072 27.761 -16.308 1.00 1.42 H new ATOM 215 N MET A 17 8.138 31.564 -14.505 1.00 0.73 N ATOM 216 CA MET A 17 6.889 32.208 -14.143 1.00 0.71 C ATOM 217 C MET A 17 6.363 33.010 -15.322 1.00 0.81 C ATOM 218 O MET A 17 6.930 34.040 -15.688 1.00 0.89 O ATOM 219 CB MET A 17 7.077 33.122 -12.927 1.00 0.74 C ATOM 220 CG MET A 17 5.857 33.979 -12.609 1.00 1.23 C ATOM 221 SD MET A 17 6.095 35.028 -11.163 1.00 1.42 S ATOM 222 CE MET A 17 6.238 33.794 -9.871 1.00 0.90 C ATOM 0 H MET A 17 8.892 32.210 -14.740 1.00 0.73 H new ATOM 0 HA MET A 17 6.166 31.436 -13.880 1.00 0.71 H new ATOM 0 HB2 MET A 17 7.317 32.510 -12.057 1.00 0.74 H new ATOM 0 HB3 MET A 17 7.932 33.774 -13.103 1.00 0.74 H new ATOM 0 HG2 MET A 17 5.624 34.604 -13.471 1.00 1.23 H new ATOM 0 HG3 MET A 17 4.997 33.330 -12.444 1.00 1.23 H new ATOM 0 HE1 MET A 17 6.300 34.288 -8.901 1.00 0.90 H new ATOM 0 HE2 MET A 17 5.364 33.143 -9.891 1.00 0.90 H new ATOM 0 HE3 MET A 17 7.137 33.199 -10.034 1.00 0.90 H new ATOM 232 N LYS A 18 5.310 32.511 -15.944 1.00 0.83 N ATOM 233 CA LYS A 18 4.681 33.218 -17.039 1.00 0.97 C ATOM 234 C LYS A 18 3.310 33.702 -16.598 1.00 1.03 C ATOM 235 O LYS A 18 2.828 33.316 -15.539 1.00 1.01 O ATOM 236 CB LYS A 18 4.567 32.319 -18.275 1.00 1.02 C ATOM 237 CG LYS A 18 4.864 33.050 -19.576 1.00 1.31 C ATOM 238 CD LYS A 18 6.320 33.489 -19.639 1.00 1.39 C ATOM 239 CE LYS A 18 7.235 32.362 -20.081 1.00 1.29 C ATOM 240 NZ LYS A 18 7.092 32.057 -21.528 1.00 2.03 N ATOM 0 H LYS A 18 4.874 31.619 -15.708 1.00 0.83 H new ATOM 0 HA LYS A 18 5.296 34.076 -17.312 1.00 0.97 H new ATOM 0 HB2 LYS A 18 5.256 31.480 -18.171 1.00 1.02 H new ATOM 0 HB3 LYS A 18 3.561 31.902 -18.321 1.00 1.02 H new ATOM 0 HG2 LYS A 18 4.640 32.399 -20.421 1.00 1.31 H new ATOM 0 HG3 LYS A 18 4.214 33.921 -19.664 1.00 1.31 H new ATOM 0 HD2 LYS A 18 6.417 34.326 -20.330 1.00 1.39 H new ATOM 0 HD3 LYS A 18 6.633 33.847 -18.658 1.00 1.39 H new ATOM 0 HE2 LYS A 18 8.270 32.632 -19.869 1.00 1.29 H new ATOM 0 HE3 LYS A 18 7.013 31.467 -19.499 1.00 1.29 H new ATOM 0 HZ1 LYS A 18 7.876 31.446 -21.833 1.00 2.03 H new ATOM 0 HZ2 LYS A 18 6.189 31.569 -21.692 1.00 2.03 H new ATOM 0 HZ3 LYS A 18 7.111 32.943 -22.073 1.00 2.03 H new ATOM 254 N GLU A 19 2.686 34.533 -17.413 1.00 1.21 N ATOM 255 CA GLU A 19 1.392 35.119 -17.074 1.00 1.32 C ATOM 256 C GLU A 19 0.297 34.054 -16.969 1.00 1.18 C ATOM 257 O GLU A 19 -0.625 34.178 -16.165 1.00 1.24 O ATOM 258 CB GLU A 19 1.019 36.159 -18.129 1.00 1.62 C ATOM 259 CG GLU A 19 -0.328 36.823 -17.911 1.00 2.11 C ATOM 260 CD GLU A 19 -0.570 37.940 -18.897 1.00 2.65 C ATOM 261 OE1 GLU A 19 -0.421 37.709 -20.111 1.00 2.89 O ATOM 262 OE2 GLU A 19 -0.945 39.051 -18.465 1.00 3.24 O ATOM 0 H GLU A 19 3.053 34.821 -18.320 1.00 1.21 H new ATOM 0 HA GLU A 19 1.476 35.595 -16.097 1.00 1.32 H new ATOM 0 HB2 GLU A 19 1.790 36.929 -18.150 1.00 1.62 H new ATOM 0 HB3 GLU A 19 1.020 35.681 -19.108 1.00 1.62 H new ATOM 0 HG2 GLU A 19 -1.119 36.079 -18.004 1.00 2.11 H new ATOM 0 HG3 GLU A 19 -0.379 37.217 -16.896 1.00 2.11 H new ATOM 269 N ASN A 20 0.405 33.003 -17.770 1.00 1.10 N ATOM 270 CA ASN A 20 -0.646 31.988 -17.825 1.00 1.07 C ATOM 271 C ASN A 20 -0.273 30.731 -17.045 1.00 0.95 C ATOM 272 O ASN A 20 -1.133 30.090 -16.441 1.00 0.97 O ATOM 273 CB ASN A 20 -0.976 31.629 -19.277 1.00 1.19 C ATOM 274 CG ASN A 20 -1.623 32.779 -20.027 1.00 1.48 C ATOM 275 OD1 ASN A 20 -2.842 32.944 -20.004 1.00 2.03 O ATOM 276 ND2 ASN A 20 -0.814 33.571 -20.714 1.00 1.59 N ATOM 0 H ASN A 20 1.199 32.829 -18.386 1.00 1.10 H new ATOM 0 HA ASN A 20 -1.530 32.418 -17.353 1.00 1.07 H new ATOM 0 HB2 ASN A 20 -0.062 31.332 -19.791 1.00 1.19 H new ATOM 0 HB3 ASN A 20 -1.644 30.768 -19.292 1.00 1.19 H new ATOM 0 HD21 ASN A 20 -1.197 34.351 -21.249 1.00 1.59 H new ATOM 0 HD22 ASN A 20 0.192 33.401 -20.708 1.00 1.59 H new ATOM 283 N PHE A 21 1.003 30.375 -17.051 1.00 0.88 N ATOM 284 CA PHE A 21 1.455 29.169 -16.373 1.00 0.80 C ATOM 285 C PHE A 21 2.928 29.264 -16.006 1.00 0.75 C ATOM 286 O PHE A 21 3.550 30.311 -16.178 1.00 0.79 O ATOM 287 CB PHE A 21 1.208 27.924 -17.240 1.00 0.87 C ATOM 288 CG PHE A 21 1.736 28.012 -18.655 1.00 0.94 C ATOM 289 CD1 PHE A 21 3.053 28.371 -18.916 1.00 0.97 C ATOM 290 CD2 PHE A 21 0.909 27.711 -19.727 1.00 1.14 C ATOM 291 CE1 PHE A 21 3.528 28.432 -20.211 1.00 1.05 C ATOM 292 CE2 PHE A 21 1.381 27.772 -21.024 1.00 1.25 C ATOM 293 CZ PHE A 21 2.691 28.132 -21.266 1.00 1.15 C ATOM 0 H PHE A 21 1.742 30.902 -17.516 1.00 0.88 H new ATOM 0 HA PHE A 21 0.876 29.075 -15.454 1.00 0.80 H new ATOM 0 HB2 PHE A 21 1.665 27.064 -16.751 1.00 0.87 H new ATOM 0 HB3 PHE A 21 0.135 27.735 -17.280 1.00 0.87 H new ATOM 0 HD1 PHE A 21 3.714 28.605 -18.095 1.00 0.97 H new ATOM 0 HD2 PHE A 21 -0.117 27.425 -19.546 1.00 1.14 H new ATOM 0 HE1 PHE A 21 4.554 28.714 -20.398 1.00 1.05 H new ATOM 0 HE2 PHE A 21 0.724 27.538 -21.849 1.00 1.25 H new ATOM 0 HZ PHE A 21 3.061 28.179 -22.280 1.00 1.15 H new ATOM 303 N GLY A 22 3.479 28.167 -15.519 1.00 0.71 N ATOM 304 CA GLY A 22 4.875 28.140 -15.153 1.00 0.68 C ATOM 305 C GLY A 22 5.450 26.745 -15.227 1.00 0.66 C ATOM 306 O GLY A 22 4.722 25.777 -15.446 1.00 0.70 O ATOM 0 H GLY A 22 2.981 27.290 -15.370 1.00 0.71 H new ATOM 0 HA2 GLY A 22 5.437 28.800 -15.815 1.00 0.68 H new ATOM 0 HA3 GLY A 22 4.993 28.528 -14.141 1.00 0.68 H new ATOM 310 N PHE A 23 6.755 26.637 -15.040 1.00 0.66 N ATOM 311 CA PHE A 23 7.426 25.347 -15.084 1.00 0.65 C ATOM 312 C PHE A 23 8.262 25.146 -13.832 1.00 0.56 C ATOM 313 O PHE A 23 8.932 26.075 -13.360 1.00 0.59 O ATOM 314 CB PHE A 23 8.308 25.230 -16.328 1.00 0.76 C ATOM 315 CG PHE A 23 7.538 25.240 -17.623 1.00 0.85 C ATOM 316 CD1 PHE A 23 7.025 24.064 -18.149 1.00 0.88 C ATOM 317 CD2 PHE A 23 7.327 26.425 -18.312 1.00 0.98 C ATOM 318 CE1 PHE A 23 6.316 24.073 -19.335 1.00 0.98 C ATOM 319 CE2 PHE A 23 6.621 26.439 -19.499 1.00 1.08 C ATOM 320 CZ PHE A 23 6.114 25.260 -20.011 1.00 1.06 C ATOM 0 H PHE A 23 7.372 27.428 -14.856 1.00 0.66 H new ATOM 0 HA PHE A 23 6.663 24.570 -15.131 1.00 0.65 H new ATOM 0 HB2 PHE A 23 9.022 26.054 -16.334 1.00 0.76 H new ATOM 0 HB3 PHE A 23 8.886 24.308 -16.267 1.00 0.76 H new ATOM 0 HD1 PHE A 23 7.181 23.132 -17.627 1.00 0.88 H new ATOM 0 HD2 PHE A 23 7.720 27.349 -17.915 1.00 0.98 H new ATOM 0 HE1 PHE A 23 5.920 23.151 -19.734 1.00 0.98 H new ATOM 0 HE2 PHE A 23 6.466 27.369 -20.026 1.00 1.08 H new ATOM 0 HZ PHE A 23 5.561 25.267 -20.938 1.00 1.06 H new ATOM 330 N ILE A 24 8.219 23.935 -13.304 1.00 0.54 N ATOM 331 CA ILE A 24 8.937 23.600 -12.088 1.00 0.48 C ATOM 332 C ILE A 24 10.145 22.748 -12.423 1.00 0.54 C ATOM 333 O ILE A 24 10.026 21.762 -13.152 1.00 0.61 O ATOM 334 CB ILE A 24 8.044 22.820 -11.098 1.00 0.42 C ATOM 335 CG1 ILE A 24 6.764 23.595 -10.805 1.00 0.41 C ATOM 336 CG2 ILE A 24 8.799 22.545 -9.804 1.00 0.40 C ATOM 337 CD1 ILE A 24 5.755 22.806 -10.000 1.00 0.41 C ATOM 0 H ILE A 24 7.689 23.161 -13.704 1.00 0.54 H new ATOM 0 HA ILE A 24 9.245 24.535 -11.621 1.00 0.48 H new ATOM 0 HB ILE A 24 7.776 21.868 -11.556 1.00 0.42 H new ATOM 0 HG12 ILE A 24 7.016 24.507 -10.264 1.00 0.41 H new ATOM 0 HG13 ILE A 24 6.308 23.899 -11.747 1.00 0.41 H new ATOM 0 HG21 ILE A 24 8.156 21.995 -9.117 1.00 0.40 H new ATOM 0 HG22 ILE A 24 9.689 21.954 -10.020 1.00 0.40 H new ATOM 0 HG23 ILE A 24 9.094 23.490 -9.347 1.00 0.40 H new ATOM 0 HD11 ILE A 24 4.869 23.417 -9.828 1.00 0.41 H new ATOM 0 HD12 ILE A 24 5.475 21.907 -10.549 1.00 0.41 H new ATOM 0 HD13 ILE A 24 6.193 22.525 -9.043 1.00 0.41 H new ATOM 349 N GLU A 25 11.301 23.130 -11.910 1.00 0.58 N ATOM 350 CA GLU A 25 12.484 22.311 -12.064 1.00 0.67 C ATOM 351 C GLU A 25 12.478 21.264 -10.961 1.00 0.64 C ATOM 352 O GLU A 25 12.245 21.586 -9.792 1.00 0.63 O ATOM 353 CB GLU A 25 13.756 23.166 -12.005 1.00 0.78 C ATOM 354 CG GLU A 25 14.889 22.654 -12.892 1.00 0.95 C ATOM 355 CD GLU A 25 15.390 21.277 -12.496 1.00 1.60 C ATOM 356 OE1 GLU A 25 16.368 21.195 -11.715 1.00 2.07 O ATOM 357 OE2 GLU A 25 14.807 20.283 -12.965 1.00 2.30 O ATOM 0 H GLU A 25 11.443 23.995 -11.388 1.00 0.58 H new ATOM 0 HA GLU A 25 12.475 21.824 -13.039 1.00 0.67 H new ATOM 0 HB2 GLU A 25 13.510 24.186 -12.300 1.00 0.78 H new ATOM 0 HB3 GLU A 25 14.106 23.208 -10.974 1.00 0.78 H new ATOM 0 HG2 GLU A 25 14.546 22.624 -13.926 1.00 0.95 H new ATOM 0 HG3 GLU A 25 15.719 23.360 -12.852 1.00 0.95 H new ATOM 364 N THR A 26 12.690 20.021 -11.346 1.00 0.68 N ATOM 365 CA THR A 26 12.657 18.909 -10.418 1.00 0.69 C ATOM 366 C THR A 26 13.793 18.996 -9.406 1.00 0.71 C ATOM 367 O THR A 26 14.889 19.443 -9.730 1.00 0.82 O ATOM 368 CB THR A 26 12.746 17.579 -11.177 1.00 0.79 C ATOM 369 OG1 THR A 26 13.633 17.717 -12.293 1.00 0.84 O ATOM 370 CG2 THR A 26 11.376 17.135 -11.667 1.00 0.87 C ATOM 0 H THR A 26 12.890 19.754 -12.310 1.00 0.68 H new ATOM 0 HA THR A 26 11.711 18.958 -9.878 1.00 0.69 H new ATOM 0 HB THR A 26 13.129 16.822 -10.493 1.00 0.79 H new ATOM 0 HG1 THR A 26 13.111 17.870 -13.109 1.00 0.84 H new ATOM 0 HG21 THR A 26 11.470 16.190 -12.201 1.00 0.87 H new ATOM 0 HG22 THR A 26 10.709 17.006 -10.815 1.00 0.87 H new ATOM 0 HG23 THR A 26 10.966 17.891 -12.337 1.00 0.87 H new ATOM 378 N LEU A 27 13.517 18.560 -8.185 1.00 0.68 N ATOM 379 CA LEU A 27 14.483 18.629 -7.094 1.00 0.74 C ATOM 380 C LEU A 27 15.816 17.997 -7.495 1.00 0.89 C ATOM 381 O LEU A 27 16.882 18.555 -7.241 1.00 1.00 O ATOM 382 CB LEU A 27 13.903 17.921 -5.864 1.00 0.74 C ATOM 383 CG LEU A 27 14.568 18.241 -4.523 1.00 0.80 C ATOM 384 CD1 LEU A 27 15.853 17.450 -4.336 1.00 1.48 C ATOM 385 CD2 LEU A 27 14.846 19.728 -4.410 1.00 1.58 C ATOM 0 H LEU A 27 12.621 18.150 -7.922 1.00 0.68 H new ATOM 0 HA LEU A 27 14.674 19.676 -6.858 1.00 0.74 H new ATOM 0 HB2 LEU A 27 12.845 18.174 -5.791 1.00 0.74 H new ATOM 0 HB3 LEU A 27 13.963 16.845 -6.028 1.00 0.74 H new ATOM 0 HG LEU A 27 13.876 17.949 -3.733 1.00 0.80 H new ATOM 0 HD11 LEU A 27 16.299 17.702 -3.374 1.00 1.48 H new ATOM 0 HD12 LEU A 27 15.631 16.383 -4.365 1.00 1.48 H new ATOM 0 HD13 LEU A 27 16.552 17.697 -5.135 1.00 1.48 H new ATOM 0 HD21 LEU A 27 15.319 19.938 -3.451 1.00 1.58 H new ATOM 0 HD22 LEU A 27 15.510 20.036 -5.217 1.00 1.58 H new ATOM 0 HD23 LEU A 27 13.909 20.280 -4.481 1.00 1.58 H new ATOM 397 N SER A 28 15.746 16.834 -8.116 1.00 0.97 N ATOM 398 CA SER A 28 16.940 16.121 -8.534 1.00 1.16 C ATOM 399 C SER A 28 17.075 16.105 -10.056 1.00 1.12 C ATOM 400 O SER A 28 17.618 15.150 -10.618 1.00 1.25 O ATOM 401 CB SER A 28 16.895 14.695 -7.988 1.00 1.34 C ATOM 402 OG SER A 28 16.850 14.698 -6.567 1.00 2.04 O ATOM 0 H SER A 28 14.871 16.361 -8.343 1.00 0.97 H new ATOM 0 HA SER A 28 17.812 16.638 -8.133 1.00 1.16 H new ATOM 0 HB2 SER A 28 16.021 14.177 -8.383 1.00 1.34 H new ATOM 0 HB3 SER A 28 17.772 14.143 -8.327 1.00 1.34 H new ATOM 0 HG SER A 28 16.820 13.775 -6.239 1.00 2.04 H new ATOM 408 N HIS A 29 16.591 17.178 -10.703 1.00 1.00 N ATOM 409 CA HIS A 29 16.652 17.350 -12.170 1.00 1.01 C ATOM 410 C HIS A 29 16.274 16.063 -12.903 1.00 1.02 C ATOM 411 O HIS A 29 16.921 15.651 -13.871 1.00 1.13 O ATOM 412 CB HIS A 29 18.026 17.885 -12.640 1.00 1.17 C ATOM 413 CG HIS A 29 19.206 17.011 -12.328 1.00 1.75 C ATOM 414 ND1 HIS A 29 19.624 15.970 -13.127 1.00 2.53 N ATOM 415 CD2 HIS A 29 20.064 17.042 -11.280 1.00 2.06 C ATOM 416 CE1 HIS A 29 20.695 15.414 -12.555 1.00 3.29 C ATOM 417 NE2 HIS A 29 21.005 16.026 -11.431 1.00 3.03 N ATOM 0 H HIS A 29 16.143 17.958 -10.222 1.00 1.00 H new ATOM 0 HA HIS A 29 15.912 18.107 -12.428 1.00 1.01 H new ATOM 0 HB2 HIS A 29 17.986 18.039 -13.718 1.00 1.17 H new ATOM 0 HB3 HIS A 29 18.190 18.862 -12.185 1.00 1.17 H new ATOM 0 HD1 HIS A 29 19.191 15.675 -14.002 1.00 2.53 H new ATOM 0 HD2 HIS A 29 20.025 17.742 -10.459 1.00 2.06 H new ATOM 0 HE1 HIS A 29 21.236 14.572 -12.961 1.00 3.29 H new ATOM 0 HE2 HIS A 29 21.775 15.802 -10.801 1.00 3.03 H new ATOM 425 N ASP A 30 15.199 15.454 -12.435 1.00 1.05 N ATOM 426 CA ASP A 30 14.714 14.192 -12.966 1.00 1.17 C ATOM 427 C ASP A 30 14.158 14.380 -14.371 1.00 1.15 C ATOM 428 O ASP A 30 14.504 13.636 -15.292 1.00 1.31 O ATOM 429 CB ASP A 30 13.625 13.629 -12.047 1.00 1.31 C ATOM 430 CG ASP A 30 14.084 13.488 -10.610 1.00 2.12 C ATOM 431 OD1 ASP A 30 13.888 14.440 -9.821 1.00 2.89 O ATOM 432 OD2 ASP A 30 14.641 12.429 -10.260 1.00 2.47 O ATOM 0 H ASP A 30 14.634 15.824 -11.670 1.00 1.05 H new ATOM 0 HA ASP A 30 15.547 13.491 -13.014 1.00 1.17 H new ATOM 0 HB2 ASP A 30 12.753 14.282 -12.083 1.00 1.31 H new ATOM 0 HB3 ASP A 30 13.309 12.655 -12.420 1.00 1.31 H new ATOM 437 N GLU A 31 13.313 15.396 -14.531 1.00 1.06 N ATOM 438 CA GLU A 31 12.651 15.664 -15.804 1.00 1.19 C ATOM 439 C GLU A 31 11.889 16.988 -15.753 1.00 1.07 C ATOM 440 O GLU A 31 11.993 17.740 -14.788 1.00 0.94 O ATOM 441 CB GLU A 31 11.732 14.502 -16.225 1.00 1.37 C ATOM 442 CG GLU A 31 10.680 14.102 -15.206 1.00 1.33 C ATOM 443 CD GLU A 31 9.915 12.864 -15.643 1.00 1.49 C ATOM 444 OE1 GLU A 31 8.878 13.009 -16.331 1.00 1.80 O ATOM 445 OE2 GLU A 31 10.326 11.743 -15.282 1.00 1.65 O ATOM 0 H GLU A 31 13.070 16.051 -13.788 1.00 1.06 H new ATOM 0 HA GLU A 31 13.425 15.751 -16.567 1.00 1.19 H new ATOM 0 HB2 GLU A 31 11.229 14.776 -17.152 1.00 1.37 H new ATOM 0 HB3 GLU A 31 12.351 13.632 -16.443 1.00 1.37 H new ATOM 0 HG2 GLU A 31 11.158 13.914 -14.245 1.00 1.33 H new ATOM 0 HG3 GLU A 31 9.983 14.927 -15.059 1.00 1.33 H new ATOM 452 N GLU A 32 11.122 17.262 -16.793 1.00 1.20 N ATOM 453 CA GLU A 32 10.542 18.578 -17.006 1.00 1.14 C ATOM 454 C GLU A 32 9.071 18.598 -16.580 1.00 1.04 C ATOM 455 O GLU A 32 8.262 17.813 -17.071 1.00 1.17 O ATOM 456 CB GLU A 32 10.695 18.905 -18.492 1.00 1.41 C ATOM 457 CG GLU A 32 10.350 20.326 -18.890 1.00 1.85 C ATOM 458 CD GLU A 32 10.751 20.610 -20.324 1.00 2.71 C ATOM 459 OE1 GLU A 32 9.964 20.280 -21.237 1.00 3.37 O ATOM 460 OE2 GLU A 32 11.830 21.204 -20.535 1.00 3.06 O ATOM 0 H GLU A 32 10.883 16.580 -17.513 1.00 1.20 H new ATOM 0 HA GLU A 32 11.052 19.328 -16.401 1.00 1.14 H new ATOM 0 HB2 GLU A 32 11.726 18.705 -18.785 1.00 1.41 H new ATOM 0 HB3 GLU A 32 10.063 18.224 -19.062 1.00 1.41 H new ATOM 0 HG2 GLU A 32 9.279 20.489 -18.771 1.00 1.85 H new ATOM 0 HG3 GLU A 32 10.855 21.025 -18.224 1.00 1.85 H new ATOM 467 N VAL A 33 8.737 19.489 -15.644 1.00 0.87 N ATOM 468 CA VAL A 33 7.391 19.535 -15.074 1.00 0.80 C ATOM 469 C VAL A 33 6.677 20.842 -15.405 1.00 0.75 C ATOM 470 O VAL A 33 7.253 21.925 -15.303 1.00 0.71 O ATOM 471 CB VAL A 33 7.413 19.380 -13.537 1.00 0.71 C ATOM 472 CG1 VAL A 33 5.999 19.385 -12.971 1.00 0.78 C ATOM 473 CG2 VAL A 33 8.137 18.113 -13.129 1.00 0.76 C ATOM 0 H VAL A 33 9.379 20.186 -15.266 1.00 0.87 H new ATOM 0 HA VAL A 33 6.853 18.699 -15.521 1.00 0.80 H new ATOM 0 HB VAL A 33 7.954 20.232 -13.125 1.00 0.71 H new ATOM 0 HG11 VAL A 33 6.040 19.275 -11.887 1.00 0.78 H new ATOM 0 HG12 VAL A 33 5.510 20.327 -13.221 1.00 0.78 H new ATOM 0 HG13 VAL A 33 5.433 18.557 -13.399 1.00 0.78 H new ATOM 0 HG21 VAL A 33 8.138 18.028 -12.042 1.00 0.76 H new ATOM 0 HG22 VAL A 33 7.630 17.250 -13.560 1.00 0.76 H new ATOM 0 HG23 VAL A 33 9.165 18.148 -13.491 1.00 0.76 H new ATOM 483 N PHE A 34 5.413 20.721 -15.779 1.00 0.83 N ATOM 484 CA PHE A 34 4.556 21.868 -16.017 1.00 0.82 C ATOM 485 C PHE A 34 3.478 21.947 -14.937 1.00 0.75 C ATOM 486 O PHE A 34 2.819 20.954 -14.631 1.00 0.78 O ATOM 487 CB PHE A 34 3.926 21.768 -17.417 1.00 0.94 C ATOM 488 CG PHE A 34 2.598 22.467 -17.565 1.00 0.95 C ATOM 489 CD1 PHE A 34 1.420 21.737 -17.546 1.00 1.02 C ATOM 490 CD2 PHE A 34 2.526 23.842 -17.720 1.00 0.93 C ATOM 491 CE1 PHE A 34 0.196 22.362 -17.680 1.00 1.06 C ATOM 492 CE2 PHE A 34 1.303 24.471 -17.854 1.00 0.97 C ATOM 493 CZ PHE A 34 0.138 23.730 -17.834 1.00 1.04 C ATOM 0 H PHE A 34 4.953 19.822 -15.926 1.00 0.83 H new ATOM 0 HA PHE A 34 5.151 22.780 -15.973 1.00 0.82 H new ATOM 0 HB2 PHE A 34 4.623 22.185 -18.144 1.00 0.94 H new ATOM 0 HB3 PHE A 34 3.796 20.715 -17.667 1.00 0.94 H new ATOM 0 HD1 PHE A 34 1.460 20.665 -17.425 1.00 1.02 H new ATOM 0 HD2 PHE A 34 3.434 24.427 -17.736 1.00 0.93 H new ATOM 0 HE1 PHE A 34 -0.714 21.780 -17.664 1.00 1.06 H new ATOM 0 HE2 PHE A 34 1.258 25.543 -17.975 1.00 0.97 H new ATOM 0 HZ PHE A 34 -0.818 24.222 -17.939 1.00 1.04 H new ATOM 503 N PHE A 35 3.315 23.121 -14.347 1.00 0.68 N ATOM 504 CA PHE A 35 2.261 23.332 -13.372 1.00 0.65 C ATOM 505 C PHE A 35 1.415 24.523 -13.805 1.00 0.66 C ATOM 506 O PHE A 35 1.881 25.378 -14.562 1.00 0.67 O ATOM 507 CB PHE A 35 2.845 23.553 -11.967 1.00 0.62 C ATOM 508 CG PHE A 35 3.146 24.989 -11.625 1.00 0.80 C ATOM 509 CD1 PHE A 35 4.283 25.616 -12.112 1.00 1.17 C ATOM 510 CD2 PHE A 35 2.289 25.710 -10.807 1.00 1.23 C ATOM 511 CE1 PHE A 35 4.555 26.932 -11.790 1.00 1.72 C ATOM 512 CE2 PHE A 35 2.557 27.024 -10.483 1.00 1.76 C ATOM 513 CZ PHE A 35 3.692 27.635 -10.974 1.00 1.96 C ATOM 0 H PHE A 35 3.898 23.939 -14.527 1.00 0.68 H new ATOM 0 HA PHE A 35 1.633 22.443 -13.324 1.00 0.65 H new ATOM 0 HB2 PHE A 35 2.144 23.159 -11.232 1.00 0.62 H new ATOM 0 HB3 PHE A 35 3.763 22.973 -11.875 1.00 0.62 H new ATOM 0 HD1 PHE A 35 4.963 25.070 -12.749 1.00 1.17 H new ATOM 0 HD2 PHE A 35 1.400 25.236 -10.418 1.00 1.23 H new ATOM 0 HE1 PHE A 35 5.443 27.410 -12.177 1.00 1.72 H new ATOM 0 HE2 PHE A 35 1.879 27.573 -9.846 1.00 1.76 H new ATOM 0 HZ PHE A 35 3.905 28.663 -10.720 1.00 1.96 H new ATOM 523 N HIS A 36 0.181 24.589 -13.342 1.00 0.72 N ATOM 524 CA HIS A 36 -0.701 25.674 -13.732 1.00 0.74 C ATOM 525 C HIS A 36 -1.111 26.474 -12.499 1.00 0.70 C ATOM 526 O HIS A 36 -1.501 25.895 -11.486 1.00 0.74 O ATOM 527 CB HIS A 36 -1.933 25.123 -14.455 1.00 0.84 C ATOM 528 CG HIS A 36 -2.631 26.132 -15.318 1.00 0.94 C ATOM 529 ND1 HIS A 36 -3.563 27.062 -14.996 1.00 1.06 N flip ATOM 530 CD2 HIS A 36 -2.412 26.273 -16.671 1.00 1.15 C flip ATOM 531 CE1 HIS A 36 -3.911 27.776 -16.137 1.00 1.12 C flip ATOM 532 NE2 HIS A 36 -3.193 27.265 -17.115 1.00 1.18 N flip ATOM 0 H HIS A 36 -0.231 23.911 -12.701 1.00 0.72 H new ATOM 0 HA HIS A 36 -0.172 26.336 -14.418 1.00 0.74 H new ATOM 0 HB2 HIS A 36 -1.632 24.277 -15.073 1.00 0.84 H new ATOM 0 HB3 HIS A 36 -2.637 24.743 -13.715 1.00 0.84 H new ATOM 0 HD2 HIS A 36 -1.730 25.686 -17.268 1.00 1.15 H new ATOM 0 HE1 HIS A 36 -4.624 28.584 -16.207 1.00 1.12 H new ATOM 0 HE2 HIS A 36 -3.227 27.583 -18.083 1.00 1.18 H new ATOM 540 N PHE A 37 -1.029 27.801 -12.594 1.00 0.68 N ATOM 541 CA PHE A 37 -1.293 28.683 -11.450 1.00 0.67 C ATOM 542 C PHE A 37 -2.718 28.550 -10.914 1.00 0.73 C ATOM 543 O PHE A 37 -2.979 28.861 -9.756 1.00 0.75 O ATOM 544 CB PHE A 37 -1.011 30.142 -11.814 1.00 0.71 C ATOM 545 CG PHE A 37 0.454 30.488 -11.850 1.00 0.68 C ATOM 546 CD1 PHE A 37 1.091 30.758 -13.050 1.00 0.73 C ATOM 547 CD2 PHE A 37 1.194 30.539 -10.679 1.00 0.69 C ATOM 548 CE1 PHE A 37 2.440 31.074 -13.080 1.00 0.74 C ATOM 549 CE2 PHE A 37 2.540 30.856 -10.701 1.00 0.72 C ATOM 550 CZ PHE A 37 3.164 31.122 -11.903 1.00 0.73 C ATOM 0 H PHE A 37 -0.781 28.293 -13.453 1.00 0.68 H new ATOM 0 HA PHE A 37 -0.616 28.366 -10.657 1.00 0.67 H new ATOM 0 HB2 PHE A 37 -1.449 30.354 -12.789 1.00 0.71 H new ATOM 0 HB3 PHE A 37 -1.510 30.789 -11.093 1.00 0.71 H new ATOM 0 HD1 PHE A 37 0.530 30.722 -13.972 1.00 0.73 H new ATOM 0 HD2 PHE A 37 0.712 30.328 -9.736 1.00 0.69 H new ATOM 0 HE1 PHE A 37 2.925 31.283 -14.022 1.00 0.74 H new ATOM 0 HE2 PHE A 37 3.102 30.895 -9.779 1.00 0.72 H new ATOM 0 HZ PHE A 37 4.216 31.367 -11.924 1.00 0.73 H new ATOM 560 N SER A 38 -3.636 28.103 -11.752 1.00 0.80 N ATOM 561 CA SER A 38 -5.016 27.904 -11.325 1.00 0.90 C ATOM 562 C SER A 38 -5.108 26.776 -10.290 1.00 0.92 C ATOM 563 O SER A 38 -5.938 26.820 -9.384 1.00 1.07 O ATOM 564 CB SER A 38 -5.905 27.591 -12.533 1.00 0.98 C ATOM 565 OG SER A 38 -7.277 27.546 -12.176 1.00 1.63 O ATOM 0 H SER A 38 -3.456 27.871 -12.729 1.00 0.80 H new ATOM 0 HA SER A 38 -5.367 28.825 -10.859 1.00 0.90 H new ATOM 0 HB2 SER A 38 -5.754 28.348 -13.302 1.00 0.98 H new ATOM 0 HB3 SER A 38 -5.609 26.635 -12.964 1.00 0.98 H new ATOM 0 HG SER A 38 -7.815 27.346 -12.970 1.00 1.63 H new ATOM 571 N ASN A 39 -4.248 25.771 -10.425 1.00 0.82 N ATOM 572 CA ASN A 39 -4.245 24.625 -9.520 1.00 0.87 C ATOM 573 C ASN A 39 -3.232 24.830 -8.400 1.00 0.80 C ATOM 574 O ASN A 39 -2.810 23.879 -7.736 1.00 0.87 O ATOM 575 CB ASN A 39 -3.909 23.365 -10.312 1.00 0.92 C ATOM 576 CG ASN A 39 -4.818 23.194 -11.512 1.00 1.28 C ATOM 577 OD1 ASN A 39 -6.019 23.462 -11.446 1.00 2.07 O ATOM 578 ND2 ASN A 39 -4.241 22.808 -12.631 1.00 1.54 N ATOM 0 H ASN A 39 -3.539 25.727 -11.157 1.00 0.82 H new ATOM 0 HA ASN A 39 -5.232 24.521 -9.069 1.00 0.87 H new ATOM 0 HB2 ASN A 39 -2.872 23.411 -10.645 1.00 0.92 H new ATOM 0 HB3 ASN A 39 -3.997 22.494 -9.663 1.00 0.92 H new ATOM 0 HD21 ASN A 39 -4.792 22.722 -13.485 1.00 1.54 H new ATOM 0 HD22 ASN A 39 -3.243 22.595 -12.643 1.00 1.54 H new ATOM 585 N TYR A 40 -2.855 26.082 -8.190 1.00 0.72 N ATOM 586 CA TYR A 40 -1.858 26.439 -7.194 1.00 0.66 C ATOM 587 C TYR A 40 -2.533 26.787 -5.870 1.00 0.73 C ATOM 588 O TYR A 40 -3.577 27.440 -5.852 1.00 0.87 O ATOM 589 CB TYR A 40 -1.042 27.627 -7.711 1.00 0.65 C ATOM 590 CG TYR A 40 0.120 28.032 -6.836 1.00 0.59 C ATOM 591 CD1 TYR A 40 1.309 27.323 -6.865 1.00 0.55 C ATOM 592 CD2 TYR A 40 0.040 29.140 -6.000 1.00 0.75 C ATOM 593 CE1 TYR A 40 2.386 27.704 -6.095 1.00 0.64 C ATOM 594 CE2 TYR A 40 1.111 29.520 -5.222 1.00 0.81 C ATOM 595 CZ TYR A 40 2.279 28.801 -5.276 1.00 0.74 C ATOM 596 OH TYR A 40 3.353 29.199 -4.529 1.00 0.91 O ATOM 0 H TYR A 40 -3.231 26.878 -8.705 1.00 0.72 H new ATOM 0 HA TYR A 40 -1.194 25.592 -7.021 1.00 0.66 H new ATOM 0 HB2 TYR A 40 -0.663 27.383 -8.703 1.00 0.65 H new ATOM 0 HB3 TYR A 40 -1.707 28.483 -7.825 1.00 0.65 H new ATOM 0 HD1 TYR A 40 1.394 26.456 -7.503 1.00 0.55 H new ATOM 0 HD2 TYR A 40 -0.876 29.711 -5.960 1.00 0.75 H new ATOM 0 HE1 TYR A 40 3.308 27.144 -6.135 1.00 0.64 H new ATOM 0 HE2 TYR A 40 1.032 30.379 -4.573 1.00 0.81 H new ATOM 0 HH TYR A 40 3.049 29.789 -3.808 1.00 0.91 H new ATOM 606 N MET A 41 -1.944 26.351 -4.769 1.00 0.69 N ATOM 607 CA MET A 41 -2.518 26.607 -3.458 1.00 0.79 C ATOM 608 C MET A 41 -1.545 27.415 -2.609 1.00 0.77 C ATOM 609 O MET A 41 -0.579 26.877 -2.066 1.00 0.77 O ATOM 610 CB MET A 41 -2.874 25.293 -2.764 1.00 0.87 C ATOM 611 CG MET A 41 -3.739 25.472 -1.525 1.00 1.35 C ATOM 612 SD MET A 41 -4.141 23.908 -0.721 1.00 1.73 S ATOM 613 CE MET A 41 -4.844 22.985 -2.087 1.00 1.39 C ATOM 0 H MET A 41 -1.073 25.821 -4.756 1.00 0.69 H new ATOM 0 HA MET A 41 -3.433 27.185 -3.584 1.00 0.79 H new ATOM 0 HB2 MET A 41 -3.396 24.648 -3.471 1.00 0.87 H new ATOM 0 HB3 MET A 41 -1.954 24.779 -2.484 1.00 0.87 H new ATOM 0 HG2 MET A 41 -3.221 26.117 -0.816 1.00 1.35 H new ATOM 0 HG3 MET A 41 -4.662 25.980 -1.802 1.00 1.35 H new ATOM 0 HE1 MET A 41 -5.464 22.177 -1.699 1.00 1.39 H new ATOM 0 HE2 MET A 41 -5.454 23.649 -2.699 1.00 1.39 H new ATOM 0 HE3 MET A 41 -4.042 22.567 -2.695 1.00 1.39 H new ATOM 623 N GLY A 42 -1.792 28.709 -2.527 1.00 0.87 N ATOM 624 CA GLY A 42 -0.922 29.597 -1.787 1.00 0.91 C ATOM 625 C GLY A 42 -0.938 30.995 -2.363 1.00 0.92 C ATOM 626 O GLY A 42 -1.980 31.465 -2.817 1.00 1.05 O ATOM 0 H GLY A 42 -2.591 29.167 -2.966 1.00 0.87 H new ATOM 0 HA2 GLY A 42 -1.235 29.629 -0.743 1.00 0.91 H new ATOM 0 HA3 GLY A 42 0.096 29.207 -1.803 1.00 0.91 H new ATOM 630 N ASN A 43 0.211 31.656 -2.359 1.00 0.89 N ATOM 631 CA ASN A 43 0.310 33.000 -2.910 1.00 0.91 C ATOM 632 C ASN A 43 1.230 33.019 -4.121 1.00 0.83 C ATOM 633 O ASN A 43 2.451 33.050 -3.977 1.00 0.83 O ATOM 634 CB ASN A 43 0.820 33.985 -1.854 1.00 1.02 C ATOM 635 CG ASN A 43 -0.223 34.321 -0.808 1.00 1.48 C ATOM 636 OD1 ASN A 43 -1.422 34.343 -1.088 1.00 2.14 O ATOM 637 ND2 ASN A 43 0.225 34.591 0.407 1.00 2.03 N ATOM 0 H ASN A 43 1.084 31.286 -1.982 1.00 0.89 H new ATOM 0 HA ASN A 43 -0.688 33.307 -3.222 1.00 0.91 H new ATOM 0 HB2 ASN A 43 1.696 33.562 -1.363 1.00 1.02 H new ATOM 0 HB3 ASN A 43 1.142 34.903 -2.346 1.00 1.02 H new ATOM 0 HD21 ASN A 43 -0.431 34.828 1.151 1.00 2.03 H new ATOM 0 HD22 ASN A 43 1.226 34.562 0.599 1.00 2.03 H new ATOM 644 N PRO A 44 0.661 32.998 -5.335 1.00 0.84 N ATOM 645 CA PRO A 44 1.443 33.005 -6.563 1.00 0.82 C ATOM 646 C PRO A 44 1.887 34.410 -6.946 1.00 0.88 C ATOM 647 O PRO A 44 2.900 34.595 -7.619 1.00 0.91 O ATOM 648 CB PRO A 44 0.487 32.433 -7.615 1.00 0.92 C ATOM 649 CG PRO A 44 -0.894 32.495 -7.031 1.00 1.01 C ATOM 650 CD PRO A 44 -0.783 32.970 -5.601 1.00 0.93 C ATOM 0 HA PRO A 44 2.363 32.429 -6.463 1.00 0.82 H new ATOM 0 HB2 PRO A 44 0.541 33.008 -8.539 1.00 0.92 H new ATOM 0 HB3 PRO A 44 0.755 31.406 -7.863 1.00 0.92 H new ATOM 0 HG2 PRO A 44 -1.521 33.174 -7.609 1.00 1.01 H new ATOM 0 HG3 PRO A 44 -1.367 31.514 -7.070 1.00 1.01 H new ATOM 0 HD2 PRO A 44 -1.229 33.956 -5.474 1.00 0.93 H new ATOM 0 HD3 PRO A 44 -1.300 32.296 -4.918 1.00 0.93 H new ATOM 658 N ASN A 45 1.133 35.397 -6.491 1.00 0.94 N ATOM 659 CA ASN A 45 1.424 36.791 -6.793 1.00 1.05 C ATOM 660 C ASN A 45 2.622 37.269 -5.982 1.00 1.04 C ATOM 661 O ASN A 45 3.201 38.312 -6.270 1.00 1.15 O ATOM 662 CB ASN A 45 0.210 37.681 -6.487 1.00 1.15 C ATOM 663 CG ASN A 45 -1.048 37.288 -7.252 1.00 1.43 C ATOM 664 OD1 ASN A 45 -1.308 36.110 -7.505 1.00 2.08 O ATOM 665 ND2 ASN A 45 -1.838 38.280 -7.632 1.00 1.88 N ATOM 0 H ASN A 45 0.309 35.258 -5.907 1.00 0.94 H new ATOM 0 HA ASN A 45 1.655 36.864 -7.856 1.00 1.05 H new ATOM 0 HB2 ASN A 45 0.002 37.640 -5.418 1.00 1.15 H new ATOM 0 HB3 ASN A 45 0.460 38.715 -6.724 1.00 1.15 H new ATOM 0 HD21 ASN A 45 -2.693 38.081 -8.151 1.00 1.88 H new ATOM 0 HD22 ASN A 45 -1.592 39.244 -7.405 1.00 1.88 H new ATOM 672 N TRP A 46 2.988 36.490 -4.973 1.00 0.98 N ATOM 673 CA TRP A 46 4.093 36.836 -4.093 1.00 1.04 C ATOM 674 C TRP A 46 5.242 35.843 -4.239 1.00 0.96 C ATOM 675 O TRP A 46 6.107 35.745 -3.367 1.00 1.02 O ATOM 676 CB TRP A 46 3.611 36.868 -2.642 1.00 1.10 C ATOM 677 CG TRP A 46 2.751 38.054 -2.318 1.00 1.28 C ATOM 678 CD1 TRP A 46 1.440 38.245 -2.657 1.00 1.30 C ATOM 679 CD2 TRP A 46 3.146 39.214 -1.579 1.00 1.56 C ATOM 680 NE1 TRP A 46 1.002 39.458 -2.183 1.00 1.52 N ATOM 681 CE2 TRP A 46 2.032 40.073 -1.521 1.00 1.67 C ATOM 682 CE3 TRP A 46 4.339 39.617 -0.976 1.00 1.80 C ATOM 683 CZ2 TRP A 46 2.074 41.302 -0.864 1.00 1.97 C ATOM 684 CZ3 TRP A 46 4.382 40.837 -0.328 1.00 2.13 C ATOM 685 CH2 TRP A 46 3.256 41.670 -0.279 1.00 2.18 C ATOM 0 H TRP A 46 2.531 35.608 -4.744 1.00 0.98 H new ATOM 0 HA TRP A 46 4.459 37.823 -4.375 1.00 1.04 H new ATOM 0 HB2 TRP A 46 3.051 35.956 -2.434 1.00 1.10 H new ATOM 0 HB3 TRP A 46 4.477 36.867 -1.981 1.00 1.10 H new ATOM 0 HD1 TRP A 46 0.837 37.545 -3.216 1.00 1.30 H new ATOM 0 HE1 TRP A 46 0.063 39.838 -2.304 1.00 1.52 H new ATOM 0 HE3 TRP A 46 5.214 38.985 -1.015 1.00 1.80 H new ATOM 0 HZ2 TRP A 46 1.205 41.941 -0.818 1.00 1.97 H new ATOM 0 HZ3 TRP A 46 5.298 41.154 0.148 1.00 2.13 H new ATOM 0 HH2 TRP A 46 3.322 42.620 0.230 1.00 2.18 H new ATOM 696 N LEU A 47 5.254 35.118 -5.348 1.00 0.85 N ATOM 697 CA LEU A 47 6.286 34.115 -5.595 1.00 0.78 C ATOM 698 C LEU A 47 7.566 34.730 -6.151 1.00 0.82 C ATOM 699 O LEU A 47 7.599 35.897 -6.551 1.00 0.92 O ATOM 700 CB LEU A 47 5.781 33.040 -6.559 1.00 0.68 C ATOM 701 CG LEU A 47 4.996 31.893 -5.924 1.00 0.62 C ATOM 702 CD1 LEU A 47 4.446 30.974 -7.004 1.00 0.57 C ATOM 703 CD2 LEU A 47 5.887 31.108 -4.973 1.00 0.66 C ATOM 0 H LEU A 47 4.562 35.204 -6.092 1.00 0.85 H new ATOM 0 HA LEU A 47 6.517 33.662 -4.631 1.00 0.78 H new ATOM 0 HB2 LEU A 47 5.148 33.518 -7.307 1.00 0.68 H new ATOM 0 HB3 LEU A 47 6.638 32.621 -7.087 1.00 0.68 H new ATOM 0 HG LEU A 47 4.163 32.310 -5.359 1.00 0.62 H new ATOM 0 HD11 LEU A 47 3.888 30.160 -6.540 1.00 0.57 H new ATOM 0 HD12 LEU A 47 3.784 31.539 -7.660 1.00 0.57 H new ATOM 0 HD13 LEU A 47 5.270 30.563 -7.587 1.00 0.57 H new ATOM 0 HD21 LEU A 47 5.315 30.294 -4.527 1.00 0.66 H new ATOM 0 HD22 LEU A 47 6.734 30.698 -5.523 1.00 0.66 H new ATOM 0 HD23 LEU A 47 6.251 31.769 -4.186 1.00 0.66 H new ATOM 715 N GLU A 48 8.611 33.913 -6.188 1.00 0.81 N ATOM 716 CA GLU A 48 9.916 34.333 -6.671 1.00 0.89 C ATOM 717 C GLU A 48 10.452 33.334 -7.676 1.00 0.71 C ATOM 718 O GLU A 48 9.963 32.206 -7.770 1.00 0.62 O ATOM 719 CB GLU A 48 10.907 34.447 -5.514 1.00 1.15 C ATOM 720 CG GLU A 48 10.741 35.696 -4.673 1.00 1.48 C ATOM 721 CD GLU A 48 11.131 36.952 -5.420 1.00 1.86 C ATOM 722 OE1 GLU A 48 12.040 36.884 -6.274 1.00 2.35 O ATOM 723 OE2 GLU A 48 10.553 38.020 -5.135 1.00 2.13 O ATOM 0 H GLU A 48 8.575 32.940 -5.883 1.00 0.81 H new ATOM 0 HA GLU A 48 9.799 35.307 -7.146 1.00 0.89 H new ATOM 0 HB2 GLU A 48 10.800 33.573 -4.871 1.00 1.15 H new ATOM 0 HB3 GLU A 48 11.920 34.425 -5.915 1.00 1.15 H new ATOM 0 HG2 GLU A 48 9.703 35.777 -4.349 1.00 1.48 H new ATOM 0 HG3 GLU A 48 11.350 35.608 -3.773 1.00 1.48 H new ATOM 730 N LEU A 49 11.465 33.740 -8.416 1.00 0.75 N ATOM 731 CA LEU A 49 12.119 32.840 -9.350 1.00 0.67 C ATOM 732 C LEU A 49 13.185 32.032 -8.620 1.00 0.67 C ATOM 733 O LEU A 49 14.176 32.579 -8.131 1.00 0.73 O ATOM 734 CB LEU A 49 12.731 33.616 -10.519 1.00 0.76 C ATOM 735 CG LEU A 49 11.727 34.338 -11.420 1.00 0.85 C ATOM 736 CD1 LEU A 49 12.445 35.046 -12.558 1.00 1.40 C ATOM 737 CD2 LEU A 49 10.690 33.368 -11.970 1.00 1.11 C ATOM 0 H LEU A 49 11.853 34.683 -8.390 1.00 0.75 H new ATOM 0 HA LEU A 49 11.375 32.157 -9.761 1.00 0.67 H new ATOM 0 HB2 LEU A 49 13.430 34.351 -10.120 1.00 0.76 H new ATOM 0 HB3 LEU A 49 13.310 32.924 -11.130 1.00 0.76 H new ATOM 0 HG LEU A 49 11.209 35.083 -10.817 1.00 0.85 H new ATOM 0 HD11 LEU A 49 11.715 35.554 -13.188 1.00 1.40 H new ATOM 0 HD12 LEU A 49 13.143 35.777 -12.149 1.00 1.40 H new ATOM 0 HD13 LEU A 49 12.993 34.315 -13.153 1.00 1.40 H new ATOM 0 HD21 LEU A 49 9.989 33.907 -12.607 1.00 1.11 H new ATOM 0 HD22 LEU A 49 11.189 32.594 -12.553 1.00 1.11 H new ATOM 0 HD23 LEU A 49 10.149 32.907 -11.144 1.00 1.11 H new ATOM 749 N GLY A 50 12.970 30.730 -8.549 1.00 0.66 N ATOM 750 CA GLY A 50 13.833 29.872 -7.769 1.00 0.72 C ATOM 751 C GLY A 50 13.196 29.460 -6.456 1.00 0.69 C ATOM 752 O GLY A 50 13.822 28.776 -5.656 1.00 0.75 O ATOM 0 H GLY A 50 12.206 30.248 -9.022 1.00 0.66 H new ATOM 0 HA2 GLY A 50 14.076 28.981 -8.348 1.00 0.72 H new ATOM 0 HA3 GLY A 50 14.772 30.389 -7.569 1.00 0.72 H new ATOM 756 N GLN A 51 11.948 29.879 -6.242 1.00 0.62 N ATOM 757 CA GLN A 51 11.246 29.587 -4.993 1.00 0.60 C ATOM 758 C GLN A 51 10.934 28.103 -4.860 1.00 0.56 C ATOM 759 O GLN A 51 10.271 27.516 -5.722 1.00 0.53 O ATOM 760 CB GLN A 51 9.942 30.389 -4.895 1.00 0.59 C ATOM 761 CG GLN A 51 9.144 30.110 -3.625 1.00 0.60 C ATOM 762 CD GLN A 51 9.891 30.503 -2.365 1.00 0.70 C ATOM 763 OE1 GLN A 51 10.592 29.548 -1.775 1.00 1.06 O flip ATOM 764 NE2 GLN A 51 9.816 31.644 -1.911 1.00 0.87 N flip ATOM 0 H GLN A 51 11.405 30.420 -6.915 1.00 0.62 H new ATOM 0 HA GLN A 51 11.911 29.879 -4.180 1.00 0.60 H new ATOM 0 HB2 GLN A 51 10.176 31.453 -4.940 1.00 0.59 H new ATOM 0 HB3 GLN A 51 9.320 30.162 -5.761 1.00 0.59 H new ATOM 0 HG2 GLN A 51 8.200 30.654 -3.667 1.00 0.60 H new ATOM 0 HG3 GLN A 51 8.899 29.049 -3.581 1.00 0.60 H new ATOM 0 HE21 GLN A 51 9.265 32.351 -2.397 1.00 0.87 H new ATOM 0 HE22 GLN A 51 10.305 31.883 -1.048 1.00 0.87 H new ATOM 773 N GLU A 52 11.423 27.514 -3.779 1.00 0.57 N ATOM 774 CA GLU A 52 11.124 26.140 -3.431 1.00 0.55 C ATOM 775 C GLU A 52 9.631 25.945 -3.196 1.00 0.50 C ATOM 776 O GLU A 52 9.012 26.664 -2.409 1.00 0.55 O ATOM 777 CB GLU A 52 11.897 25.738 -2.168 1.00 0.63 C ATOM 778 CG GLU A 52 13.408 25.800 -2.332 1.00 1.15 C ATOM 779 CD GLU A 52 14.005 27.155 -1.998 1.00 1.94 C ATOM 780 OE1 GLU A 52 13.294 28.169 -2.162 1.00 2.44 O ATOM 781 OE2 GLU A 52 15.182 27.215 -1.583 1.00 2.51 O ATOM 0 H GLU A 52 12.042 27.982 -3.117 1.00 0.57 H new ATOM 0 HA GLU A 52 11.429 25.508 -4.265 1.00 0.55 H new ATOM 0 HB2 GLU A 52 11.602 26.393 -1.348 1.00 0.63 H new ATOM 0 HB3 GLU A 52 11.612 24.725 -1.885 1.00 0.63 H new ATOM 0 HG2 GLU A 52 13.865 25.044 -1.693 1.00 1.15 H new ATOM 0 HG3 GLU A 52 13.663 25.544 -3.360 1.00 1.15 H new ATOM 788 N VAL A 53 9.063 24.968 -3.885 1.00 0.43 N ATOM 789 CA VAL A 53 7.665 24.599 -3.710 1.00 0.40 C ATOM 790 C VAL A 53 7.528 23.078 -3.682 1.00 0.41 C ATOM 791 O VAL A 53 8.331 22.362 -4.288 1.00 0.44 O ATOM 792 CB VAL A 53 6.769 25.187 -4.826 1.00 0.37 C ATOM 793 CG1 VAL A 53 6.566 26.684 -4.630 1.00 0.41 C ATOM 794 CG2 VAL A 53 7.373 24.910 -6.190 1.00 0.37 C ATOM 0 H VAL A 53 9.556 24.408 -4.581 1.00 0.43 H new ATOM 0 HA VAL A 53 7.329 25.017 -2.761 1.00 0.40 H new ATOM 0 HB VAL A 53 5.795 24.702 -4.769 1.00 0.37 H new ATOM 0 HG11 VAL A 53 5.933 27.073 -5.428 1.00 0.41 H new ATOM 0 HG12 VAL A 53 6.088 26.863 -3.667 1.00 0.41 H new ATOM 0 HG13 VAL A 53 7.532 27.189 -4.655 1.00 0.41 H new ATOM 0 HG21 VAL A 53 6.731 25.330 -6.964 1.00 0.37 H new ATOM 0 HG22 VAL A 53 8.361 25.367 -6.250 1.00 0.37 H new ATOM 0 HG23 VAL A 53 7.462 23.834 -6.337 1.00 0.37 H new ATOM 804 N GLU A 54 6.539 22.581 -2.960 1.00 0.47 N ATOM 805 CA GLU A 54 6.323 21.146 -2.858 1.00 0.54 C ATOM 806 C GLU A 54 4.928 20.810 -3.359 1.00 0.52 C ATOM 807 O GLU A 54 3.969 21.521 -3.063 1.00 0.54 O ATOM 808 CB GLU A 54 6.528 20.652 -1.421 1.00 0.72 C ATOM 809 CG GLU A 54 5.628 21.299 -0.379 1.00 0.81 C ATOM 810 CD GLU A 54 5.808 20.664 0.988 1.00 1.05 C ATOM 811 OE1 GLU A 54 6.906 20.145 1.271 1.00 1.49 O ATOM 812 OE2 GLU A 54 4.853 20.705 1.796 1.00 1.30 O ATOM 0 H GLU A 54 5.873 23.148 -2.436 1.00 0.47 H new ATOM 0 HA GLU A 54 7.058 20.634 -3.479 1.00 0.54 H new ATOM 0 HB2 GLU A 54 6.367 19.574 -1.398 1.00 0.72 H new ATOM 0 HB3 GLU A 54 7.566 20.825 -1.139 1.00 0.72 H new ATOM 0 HG2 GLU A 54 5.849 22.365 -0.318 1.00 0.81 H new ATOM 0 HG3 GLU A 54 4.587 21.207 -0.689 1.00 0.81 H new ATOM 819 N TYR A 55 4.813 19.746 -4.128 1.00 0.54 N ATOM 820 CA TYR A 55 3.553 19.435 -4.779 1.00 0.58 C ATOM 821 C TYR A 55 3.441 17.952 -5.091 1.00 0.64 C ATOM 822 O TYR A 55 4.366 17.181 -4.837 1.00 0.66 O ATOM 823 CB TYR A 55 3.408 20.269 -6.061 1.00 0.55 C ATOM 824 CG TYR A 55 4.473 20.016 -7.112 1.00 0.52 C ATOM 825 CD1 TYR A 55 5.807 20.341 -6.884 1.00 0.54 C ATOM 826 CD2 TYR A 55 4.135 19.473 -8.342 1.00 0.63 C ATOM 827 CE1 TYR A 55 6.769 20.126 -7.852 1.00 0.56 C ATOM 828 CE2 TYR A 55 5.090 19.255 -9.315 1.00 0.65 C ATOM 829 CZ TYR A 55 6.406 19.584 -9.064 1.00 0.57 C ATOM 830 OH TYR A 55 7.362 19.365 -10.028 1.00 0.63 O ATOM 0 H TYR A 55 5.568 19.087 -4.317 1.00 0.54 H new ATOM 0 HA TYR A 55 2.743 19.688 -4.095 1.00 0.58 H new ATOM 0 HB2 TYR A 55 2.431 20.068 -6.499 1.00 0.55 H new ATOM 0 HB3 TYR A 55 3.426 21.326 -5.794 1.00 0.55 H new ATOM 0 HD1 TYR A 55 6.095 20.768 -5.935 1.00 0.54 H new ATOM 0 HD2 TYR A 55 3.105 19.216 -8.543 1.00 0.63 H new ATOM 0 HE1 TYR A 55 7.800 20.382 -7.659 1.00 0.56 H new ATOM 0 HE2 TYR A 55 4.808 18.829 -10.267 1.00 0.65 H new ATOM 0 HH TYR A 55 7.735 18.465 -9.921 1.00 0.63 H new ATOM 840 N THR A 56 2.310 17.553 -5.651 1.00 0.72 N ATOM 841 CA THR A 56 2.072 16.154 -5.958 1.00 0.82 C ATOM 842 C THR A 56 1.734 15.966 -7.430 1.00 0.85 C ATOM 843 O THR A 56 1.036 16.790 -8.024 1.00 0.85 O ATOM 844 CB THR A 56 0.932 15.583 -5.089 1.00 0.88 C ATOM 845 OG1 THR A 56 -0.137 16.537 -4.987 1.00 0.84 O ATOM 846 CG2 THR A 56 1.430 15.210 -3.696 1.00 0.94 C ATOM 0 H THR A 56 1.544 18.178 -5.901 1.00 0.72 H new ATOM 0 HA THR A 56 2.991 15.612 -5.736 1.00 0.82 H new ATOM 0 HB THR A 56 0.564 14.678 -5.572 1.00 0.88 H new ATOM 0 HG1 THR A 56 -0.856 16.165 -4.435 1.00 0.84 H new ATOM 0 HG21 THR A 56 0.603 14.811 -3.109 1.00 0.94 H new ATOM 0 HG22 THR A 56 2.213 14.456 -3.779 1.00 0.94 H new ATOM 0 HG23 THR A 56 1.830 16.096 -3.203 1.00 0.94 H new ATOM 854 N LEU A 57 2.236 14.888 -8.020 1.00 0.96 N ATOM 855 CA LEU A 57 1.931 14.574 -9.404 1.00 1.03 C ATOM 856 C LEU A 57 0.509 14.063 -9.507 1.00 1.12 C ATOM 857 O LEU A 57 0.141 13.063 -8.894 1.00 1.19 O ATOM 858 CB LEU A 57 2.909 13.546 -9.973 1.00 1.09 C ATOM 859 CG LEU A 57 4.323 14.070 -10.221 1.00 1.04 C ATOM 860 CD1 LEU A 57 5.219 12.938 -10.708 1.00 1.13 C ATOM 861 CD2 LEU A 57 4.292 15.236 -11.211 1.00 1.03 C ATOM 0 H LEU A 57 2.854 14.220 -7.560 1.00 0.96 H new ATOM 0 HA LEU A 57 2.033 15.485 -9.993 1.00 1.03 H new ATOM 0 HB2 LEU A 57 2.966 12.701 -9.286 1.00 1.09 H new ATOM 0 HB3 LEU A 57 2.508 13.166 -10.913 1.00 1.09 H new ATOM 0 HG LEU A 57 4.738 14.446 -9.286 1.00 1.04 H new ATOM 0 HD11 LEU A 57 6.225 13.320 -10.882 1.00 1.13 H new ATOM 0 HD12 LEU A 57 5.255 12.152 -9.954 1.00 1.13 H new ATOM 0 HD13 LEU A 57 4.819 12.531 -11.637 1.00 1.13 H new ATOM 0 HD21 LEU A 57 5.306 15.599 -11.378 1.00 1.03 H new ATOM 0 HD22 LEU A 57 3.867 14.899 -12.157 1.00 1.03 H new ATOM 0 HD23 LEU A 57 3.681 16.042 -10.805 1.00 1.03 H new ATOM 873 N ALA A 58 -0.282 14.779 -10.276 1.00 1.17 N ATOM 874 CA ALA A 58 -1.708 14.520 -10.371 1.00 1.30 C ATOM 875 C ALA A 58 -2.000 13.326 -11.253 1.00 1.40 C ATOM 876 O ALA A 58 -2.869 12.510 -10.963 1.00 2.04 O ATOM 877 CB ALA A 58 -2.403 15.753 -10.894 1.00 1.33 C ATOM 0 H ALA A 58 0.041 15.556 -10.853 1.00 1.17 H new ATOM 0 HA ALA A 58 -2.086 14.283 -9.376 1.00 1.30 H new ATOM 0 HB1 ALA A 58 -3.474 15.564 -10.967 1.00 1.33 H new ATOM 0 HB2 ALA A 58 -2.227 16.586 -10.213 1.00 1.33 H new ATOM 0 HB3 ALA A 58 -2.010 16.001 -11.880 1.00 1.33 H new ATOM 1026 N LEU A 70 1.898 17.064 -18.167 1.00 1.49 N ATOM 1027 CA LEU A 70 0.636 17.099 -17.459 1.00 1.50 C ATOM 1028 C LEU A 70 0.692 18.150 -16.357 1.00 1.25 C ATOM 1029 O LEU A 70 1.758 18.395 -15.795 1.00 1.15 O ATOM 1030 CB LEU A 70 0.336 15.718 -16.876 1.00 1.71 C ATOM 1031 CG LEU A 70 1.400 15.169 -15.921 1.00 1.88 C ATOM 1032 CD1 LEU A 70 1.033 15.428 -14.464 1.00 2.30 C ATOM 1033 CD2 LEU A 70 1.651 13.689 -16.180 1.00 2.29 C ATOM 0 HA LEU A 70 -0.164 17.366 -18.150 1.00 1.50 H new ATOM 0 HB2 LEU A 70 -0.616 15.763 -16.347 1.00 1.71 H new ATOM 0 HB3 LEU A 70 0.210 15.014 -17.698 1.00 1.71 H new ATOM 0 HG LEU A 70 2.330 15.704 -16.116 1.00 1.88 H new ATOM 0 HD11 LEU A 70 1.811 15.025 -13.816 1.00 2.30 H new ATOM 0 HD12 LEU A 70 0.942 16.501 -14.297 1.00 2.30 H new ATOM 0 HD13 LEU A 70 0.084 14.943 -14.236 1.00 2.30 H new ATOM 0 HD21 LEU A 70 2.410 13.322 -15.489 1.00 2.29 H new ATOM 0 HD22 LEU A 70 0.726 13.132 -16.032 1.00 2.29 H new ATOM 0 HD23 LEU A 70 1.996 13.552 -17.205 1.00 2.29 H new ATOM 1045 N PRO A 71 -0.443 18.787 -16.037 1.00 1.22 N ATOM 1046 CA PRO A 71 -0.492 19.793 -14.980 1.00 1.05 C ATOM 1047 C PRO A 71 -0.367 19.176 -13.589 1.00 0.97 C ATOM 1048 O PRO A 71 -0.791 18.040 -13.351 1.00 1.14 O ATOM 1049 CB PRO A 71 -1.862 20.447 -15.159 1.00 1.18 C ATOM 1050 CG PRO A 71 -2.697 19.434 -15.862 1.00 1.38 C ATOM 1051 CD PRO A 71 -1.754 18.583 -16.677 1.00 1.43 C ATOM 0 HA PRO A 71 0.336 20.498 -15.054 1.00 1.05 H new ATOM 0 HB2 PRO A 71 -2.298 20.715 -14.197 1.00 1.18 H new ATOM 0 HB3 PRO A 71 -1.786 21.365 -15.741 1.00 1.18 H new ATOM 0 HG2 PRO A 71 -3.249 18.824 -15.147 1.00 1.38 H new ATOM 0 HG3 PRO A 71 -3.434 19.918 -16.503 1.00 1.38 H new ATOM 0 HD2 PRO A 71 -2.047 17.533 -16.659 1.00 1.43 H new ATOM 0 HD3 PRO A 71 -1.740 18.892 -17.722 1.00 1.43 H new ATOM 1059 N ALA A 72 0.241 19.924 -12.687 1.00 0.80 N ATOM 1060 CA ALA A 72 0.388 19.499 -11.309 1.00 0.74 C ATOM 1061 C ALA A 72 -0.744 20.054 -10.459 1.00 0.72 C ATOM 1062 O ALA A 72 -1.169 21.195 -10.654 1.00 0.82 O ATOM 1063 CB ALA A 72 1.721 19.974 -10.764 1.00 0.70 C ATOM 0 H ALA A 72 0.645 20.839 -12.888 1.00 0.80 H new ATOM 0 HA ALA A 72 0.351 18.410 -11.273 1.00 0.74 H new ATOM 0 HB1 ALA A 72 1.826 19.652 -9.728 1.00 0.70 H new ATOM 0 HB2 ALA A 72 2.529 19.550 -11.360 1.00 0.70 H new ATOM 0 HB3 ALA A 72 1.767 21.062 -10.812 1.00 0.70 H new ATOM 1069 N GLU A 73 -1.223 19.255 -9.513 1.00 0.74 N ATOM 1070 CA GLU A 73 -2.287 19.686 -8.618 1.00 0.77 C ATOM 1071 C GLU A 73 -1.733 19.798 -7.205 1.00 0.69 C ATOM 1072 O GLU A 73 -0.727 19.158 -6.877 1.00 0.71 O ATOM 1073 CB GLU A 73 -3.469 18.703 -8.620 1.00 0.94 C ATOM 1074 CG GLU A 73 -4.056 18.397 -9.992 1.00 1.28 C ATOM 1075 CD GLU A 73 -4.575 19.610 -10.730 1.00 1.84 C ATOM 1076 OE1 GLU A 73 -5.477 20.283 -10.186 1.00 2.30 O ATOM 1077 OE2 GLU A 73 -4.062 19.915 -11.827 1.00 2.28 O ATOM 0 H GLU A 73 -0.891 18.305 -9.347 1.00 0.74 H new ATOM 0 HA GLU A 73 -2.652 20.652 -8.968 1.00 0.77 H new ATOM 0 HB2 GLU A 73 -3.144 17.768 -8.165 1.00 0.94 H new ATOM 0 HB3 GLU A 73 -4.259 19.108 -7.987 1.00 0.94 H new ATOM 0 HG2 GLU A 73 -3.292 17.914 -10.602 1.00 1.28 H new ATOM 0 HG3 GLU A 73 -4.870 17.681 -9.875 1.00 1.28 H new ATOM 1084 N ASN A 74 -2.390 20.609 -6.378 1.00 0.68 N ATOM 1085 CA ASN A 74 -1.996 20.790 -4.979 1.00 0.69 C ATOM 1086 C ASN A 74 -0.553 21.288 -4.895 1.00 0.59 C ATOM 1087 O ASN A 74 0.285 20.721 -4.193 1.00 0.66 O ATOM 1088 CB ASN A 74 -2.162 19.482 -4.197 1.00 0.81 C ATOM 1089 CG ASN A 74 -1.947 19.651 -2.700 1.00 1.39 C ATOM 1090 OD1 ASN A 74 -2.248 20.698 -2.125 1.00 1.81 O ATOM 1091 ND2 ASN A 74 -1.419 18.616 -2.061 1.00 2.01 N ATOM 0 H ASN A 74 -3.205 21.156 -6.654 1.00 0.68 H new ATOM 0 HA ASN A 74 -2.648 21.539 -4.530 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -3.162 19.085 -4.372 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -1.455 18.745 -4.579 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -1.248 18.670 -1.057 1.00 2.01 H new ATOM 0 HD22 ASN A 74 -1.184 17.766 -2.574 1.00 2.01 H new ATOM 1098 N VAL A 75 -0.261 22.337 -5.644 1.00 0.66 N ATOM 1099 CA VAL A 75 1.065 22.931 -5.616 1.00 0.58 C ATOM 1100 C VAL A 75 1.201 23.849 -4.408 1.00 0.59 C ATOM 1101 O VAL A 75 0.565 24.904 -4.338 1.00 0.64 O ATOM 1102 CB VAL A 75 1.376 23.717 -6.907 1.00 0.56 C ATOM 1103 CG1 VAL A 75 2.839 24.143 -6.941 1.00 0.72 C ATOM 1104 CG2 VAL A 75 1.024 22.892 -8.137 1.00 0.80 C ATOM 0 H VAL A 75 -0.919 22.793 -6.276 1.00 0.66 H new ATOM 0 HA VAL A 75 1.785 22.116 -5.543 1.00 0.58 H new ATOM 0 HB VAL A 75 0.761 24.617 -6.914 1.00 0.56 H new ATOM 0 HG11 VAL A 75 3.036 24.696 -7.860 1.00 0.72 H new ATOM 0 HG12 VAL A 75 3.053 24.779 -6.082 1.00 0.72 H new ATOM 0 HG13 VAL A 75 3.476 23.259 -6.905 1.00 0.72 H new ATOM 0 HG21 VAL A 75 1.251 23.465 -9.036 1.00 0.80 H new ATOM 0 HG22 VAL A 75 1.607 21.971 -8.136 1.00 0.80 H new ATOM 0 HG23 VAL A 75 -0.038 22.649 -8.120 1.00 0.80 H new ATOM 1114 N ARG A 76 2.019 23.429 -3.456 1.00 0.58 N ATOM 1115 CA ARG A 76 2.186 24.147 -2.206 1.00 0.62 C ATOM 1116 C ARG A 76 3.535 24.840 -2.129 1.00 0.55 C ATOM 1117 O ARG A 76 4.397 24.667 -2.987 1.00 0.52 O ATOM 1118 CB ARG A 76 2.044 23.182 -1.026 1.00 0.73 C ATOM 1119 CG ARG A 76 0.613 22.810 -0.695 1.00 1.28 C ATOM 1120 CD ARG A 76 -0.168 24.024 -0.231 1.00 1.58 C ATOM 1121 NE ARG A 76 -1.357 23.648 0.523 1.00 2.10 N ATOM 1122 CZ ARG A 76 -1.592 24.017 1.784 1.00 2.75 C ATOM 1123 NH1 ARG A 76 -0.715 24.772 2.444 1.00 3.11 N ATOM 1124 NH2 ARG A 76 -2.710 23.629 2.384 1.00 3.51 N ATOM 0 H ARG A 76 2.584 22.583 -3.529 1.00 0.58 H new ATOM 0 HA ARG A 76 1.409 24.910 -2.160 1.00 0.62 H new ATOM 0 HB2 ARG A 76 2.602 22.272 -1.246 1.00 0.73 H new ATOM 0 HB3 ARG A 76 2.503 23.632 -0.146 1.00 0.73 H new ATOM 0 HG2 ARG A 76 0.133 22.378 -1.573 1.00 1.28 H new ATOM 0 HG3 ARG A 76 0.602 22.046 0.083 1.00 1.28 H new ATOM 0 HD2 ARG A 76 0.472 24.652 0.389 1.00 1.58 H new ATOM 0 HD3 ARG A 76 -0.460 24.621 -1.095 1.00 1.58 H new ATOM 0 HE ARG A 76 -2.054 23.066 0.058 1.00 2.10 H new ATOM 0 HH11 ARG A 76 0.145 25.073 1.986 1.00 3.11 H new ATOM 0 HH12 ARG A 76 -0.904 25.049 3.407 1.00 3.11 H new ATOM 0 HH21 ARG A 76 -3.384 23.052 1.882 1.00 3.51 H new ATOM 0 HH22 ARG A 76 -2.895 23.908 3.348 1.00 3.51 H new ATOM 1138 N MET A 77 3.700 25.618 -1.075 1.00 0.63 N ATOM 1139 CA MET A 77 4.918 26.374 -0.841 1.00 0.60 C ATOM 1140 C MET A 77 5.566 25.896 0.447 1.00 0.70 C ATOM 1141 O MET A 77 4.867 25.536 1.399 1.00 0.91 O ATOM 1142 CB MET A 77 4.578 27.860 -0.730 1.00 0.72 C ATOM 1143 CG MET A 77 3.669 28.347 -1.841 1.00 0.80 C ATOM 1144 SD MET A 77 2.949 29.973 -1.521 1.00 1.12 S ATOM 1145 CE MET A 77 4.403 31.009 -1.604 1.00 0.86 C ATOM 0 H MET A 77 2.990 25.744 -0.354 1.00 0.63 H new ATOM 0 HA MET A 77 5.610 26.224 -1.670 1.00 0.60 H new ATOM 0 HB2 MET A 77 4.099 28.046 0.231 1.00 0.72 H new ATOM 0 HB3 MET A 77 5.501 28.440 -0.744 1.00 0.72 H new ATOM 0 HG2 MET A 77 4.235 28.385 -2.772 1.00 0.80 H new ATOM 0 HG3 MET A 77 2.866 27.625 -1.986 1.00 0.80 H new ATOM 0 HE1 MET A 77 4.142 31.966 -2.056 1.00 0.86 H new ATOM 0 HE2 MET A 77 4.789 31.176 -0.598 1.00 0.86 H new ATOM 0 HE3 MET A 77 5.166 30.518 -2.209 1.00 0.86 H new ATOM 1155 N LEU A 78 6.887 25.868 0.478 1.00 0.65 N ATOM 1156 CA LEU A 78 7.595 25.512 1.701 1.00 0.83 C ATOM 1157 C LEU A 78 8.694 26.529 1.984 1.00 0.83 C ATOM 1158 O LEU A 78 9.097 27.273 1.087 1.00 0.93 O ATOM 1159 CB LEU A 78 8.197 24.102 1.612 1.00 0.99 C ATOM 1160 CG LEU A 78 9.432 23.966 0.721 1.00 1.05 C ATOM 1161 CD1 LEU A 78 10.327 22.853 1.225 1.00 1.49 C ATOM 1162 CD2 LEU A 78 9.022 23.685 -0.707 1.00 1.67 C ATOM 0 H LEU A 78 7.487 26.084 -0.318 1.00 0.65 H new ATOM 0 HA LEU A 78 6.874 25.519 2.519 1.00 0.83 H new ATOM 0 HB2 LEU A 78 8.459 23.774 2.618 1.00 0.99 H new ATOM 0 HB3 LEU A 78 7.429 23.421 1.245 1.00 0.99 H new ATOM 0 HG LEU A 78 9.983 24.906 0.754 1.00 1.05 H new ATOM 0 HD11 LEU A 78 11.202 22.769 0.580 1.00 1.49 H new ATOM 0 HD12 LEU A 78 10.647 23.076 2.243 1.00 1.49 H new ATOM 0 HD13 LEU A 78 9.777 21.912 1.215 1.00 1.49 H new ATOM 0 HD21 LEU A 78 9.912 23.591 -1.329 1.00 1.67 H new ATOM 0 HD22 LEU A 78 8.452 22.757 -0.746 1.00 1.67 H new ATOM 0 HD23 LEU A 78 8.406 24.505 -1.077 1.00 1.67 H new ATOM 1174 N PRO A 79 9.175 26.608 3.236 1.00 1.15 N ATOM 1175 CA PRO A 79 10.291 27.484 3.578 1.00 1.27 C ATOM 1176 C PRO A 79 11.620 26.949 3.062 1.00 1.13 C ATOM 1177 O PRO A 79 11.751 25.762 2.748 1.00 1.59 O ATOM 1178 CB PRO A 79 10.269 27.509 5.109 1.00 1.97 C ATOM 1179 CG PRO A 79 9.656 26.207 5.494 1.00 2.15 C ATOM 1180 CD PRO A 79 8.658 25.882 4.414 1.00 1.65 C ATOM 0 HA PRO A 79 10.192 28.472 3.128 1.00 1.27 H new ATOM 0 HB2 PRO A 79 11.274 27.611 5.519 1.00 1.97 H new ATOM 0 HB3 PRO A 79 9.685 28.349 5.484 1.00 1.97 H new ATOM 0 HG2 PRO A 79 10.414 25.427 5.573 1.00 2.15 H new ATOM 0 HG3 PRO A 79 9.169 26.278 6.467 1.00 2.15 H new ATOM 0 HD2 PRO A 79 8.600 24.809 4.231 1.00 1.65 H new ATOM 0 HD3 PRO A 79 7.655 26.214 4.682 1.00 1.65 H new ATOM 1188 N LYS A 80 12.601 27.832 2.975 1.00 1.09 N ATOM 1189 CA LYS A 80 13.902 27.478 2.438 1.00 1.37 C ATOM 1190 C LYS A 80 14.711 26.635 3.408 1.00 1.18 C ATOM 1191 O LYS A 80 14.307 26.410 4.552 1.00 1.19 O ATOM 1192 CB LYS A 80 14.682 28.737 2.063 1.00 1.96 C ATOM 1193 CG LYS A 80 14.394 29.198 0.654 1.00 2.65 C ATOM 1194 CD LYS A 80 15.143 30.467 0.288 1.00 3.44 C ATOM 1195 CE LYS A 80 14.676 31.658 1.105 1.00 4.04 C ATOM 1196 NZ LYS A 80 15.301 32.916 0.632 1.00 4.61 N ATOM 0 H LYS A 80 12.519 28.804 3.272 1.00 1.09 H new ATOM 0 HA LYS A 80 13.730 26.878 1.545 1.00 1.37 H new ATOM 0 HB2 LYS A 80 14.433 29.536 2.761 1.00 1.96 H new ATOM 0 HB3 LYS A 80 15.750 28.544 2.167 1.00 1.96 H new ATOM 0 HG2 LYS A 80 14.665 28.407 -0.045 1.00 2.65 H new ATOM 0 HG3 LYS A 80 13.323 29.368 0.544 1.00 2.65 H new ATOM 0 HD2 LYS A 80 16.211 30.316 0.445 1.00 3.44 H new ATOM 0 HD3 LYS A 80 15.003 30.677 -0.772 1.00 3.44 H new ATOM 0 HE2 LYS A 80 13.591 31.742 1.041 1.00 4.04 H new ATOM 0 HE3 LYS A 80 14.922 31.500 2.155 1.00 4.04 H new ATOM 0 HZ1 LYS A 80 14.962 33.711 1.210 1.00 4.61 H new ATOM 0 HZ2 LYS A 80 16.335 32.843 0.716 1.00 4.61 H new ATOM 0 HZ3 LYS A 80 15.045 33.078 -0.363 1.00 4.61 H new ATOM 1210 N ASN A 81 15.858 26.178 2.915 1.00 1.26 N ATOM 1211 CA ASN A 81 16.789 25.350 3.673 1.00 1.35 C ATOM 1212 C ASN A 81 16.219 23.943 3.870 1.00 1.23 C ATOM 1213 O ASN A 81 16.493 23.263 4.860 1.00 1.43 O ATOM 1214 CB ASN A 81 17.145 26.003 5.021 1.00 1.57 C ATOM 1215 CG ASN A 81 18.353 25.362 5.689 1.00 2.26 C ATOM 1216 OD1 ASN A 81 19.243 24.836 5.020 1.00 2.84 O ATOM 1217 ND2 ASN A 81 18.399 25.414 7.013 1.00 2.81 N ATOM 0 H ASN A 81 16.171 26.375 1.964 1.00 1.26 H new ATOM 0 HA ASN A 81 17.712 25.264 3.099 1.00 1.35 H new ATOM 0 HB2 ASN A 81 17.343 27.063 4.864 1.00 1.57 H new ATOM 0 HB3 ASN A 81 16.287 25.934 5.690 1.00 1.57 H new ATOM 0 HD21 ASN A 81 19.191 25.010 7.512 1.00 2.81 H new ATOM 0 HD22 ASN A 81 17.642 25.858 7.533 1.00 2.81 H new ATOM 1224 N SER A 82 15.424 23.505 2.903 1.00 1.01 N ATOM 1225 CA SER A 82 14.890 22.150 2.906 1.00 1.03 C ATOM 1226 C SER A 82 15.266 21.454 1.594 1.00 0.96 C ATOM 1227 O SER A 82 14.776 20.370 1.270 1.00 1.12 O ATOM 1228 CB SER A 82 13.367 22.187 3.105 1.00 1.08 C ATOM 1229 OG SER A 82 12.838 20.895 3.358 1.00 1.70 O ATOM 0 H SER A 82 15.134 24.070 2.105 1.00 1.01 H new ATOM 0 HA SER A 82 15.320 21.583 3.732 1.00 1.03 H new ATOM 0 HB2 SER A 82 13.125 22.848 3.937 1.00 1.08 H new ATOM 0 HB3 SER A 82 12.894 22.606 2.217 1.00 1.08 H new ATOM 0 HG SER A 82 11.868 20.957 3.481 1.00 1.70 H new ATOM 1235 N ILE A 83 16.159 22.094 0.850 1.00 0.83 N ATOM 1236 CA ILE A 83 16.646 21.560 -0.411 1.00 0.77 C ATOM 1237 C ILE A 83 18.122 21.210 -0.269 1.00 0.76 C ATOM 1238 O ILE A 83 18.922 22.056 0.130 1.00 0.78 O ATOM 1239 CB ILE A 83 16.458 22.579 -1.559 1.00 0.76 C ATOM 1240 CG1 ILE A 83 14.983 22.978 -1.697 1.00 0.92 C ATOM 1241 CG2 ILE A 83 17.008 22.050 -2.874 1.00 0.79 C ATOM 1242 CD1 ILE A 83 14.008 21.824 -1.846 1.00 0.69 C ATOM 0 H ILE A 83 16.564 22.995 1.104 1.00 0.83 H new ATOM 0 HA ILE A 83 16.072 20.667 -0.656 1.00 0.77 H new ATOM 0 HB ILE A 83 17.029 23.472 -1.305 1.00 0.76 H new ATOM 0 HG12 ILE A 83 14.698 23.561 -0.821 1.00 0.92 H new ATOM 0 HG13 ILE A 83 14.881 23.632 -2.563 1.00 0.92 H new ATOM 0 HG21 ILE A 83 16.858 22.794 -3.657 1.00 0.79 H new ATOM 0 HG22 ILE A 83 18.073 21.846 -2.767 1.00 0.79 H new ATOM 0 HG23 ILE A 83 16.488 21.131 -3.142 1.00 0.79 H new ATOM 0 HD11 ILE A 83 12.994 22.214 -1.936 1.00 0.69 H new ATOM 0 HD12 ILE A 83 14.257 21.250 -2.739 1.00 0.69 H new ATOM 0 HD13 ILE A 83 14.072 21.178 -0.970 1.00 0.69 H new ATOM 1254 N PRO A 84 18.497 19.958 -0.577 1.00 0.82 N ATOM 1255 CA PRO A 84 19.862 19.459 -0.363 1.00 0.89 C ATOM 1256 C PRO A 84 20.895 20.119 -1.273 1.00 0.83 C ATOM 1257 O PRO A 84 20.562 20.660 -2.330 1.00 0.82 O ATOM 1258 CB PRO A 84 19.749 17.972 -0.696 1.00 1.03 C ATOM 1259 CG PRO A 84 18.611 17.895 -1.648 1.00 1.03 C ATOM 1260 CD PRO A 84 17.629 18.928 -1.177 1.00 0.91 C ATOM 0 HA PRO A 84 20.206 19.671 0.649 1.00 0.89 H new ATOM 0 HB2 PRO A 84 20.668 17.593 -1.143 1.00 1.03 H new ATOM 0 HB3 PRO A 84 19.561 17.377 0.198 1.00 1.03 H new ATOM 0 HG2 PRO A 84 18.937 18.099 -2.668 1.00 1.03 H new ATOM 0 HG3 PRO A 84 18.165 16.900 -1.649 1.00 1.03 H new ATOM 0 HD2 PRO A 84 17.037 19.328 -2.000 1.00 0.91 H new ATOM 0 HD3 PRO A 84 16.928 18.517 -0.451 1.00 0.91 H new ATOM 1268 N GLN A 85 22.152 20.063 -0.850 1.00 0.88 N ATOM 1269 CA GLN A 85 23.256 20.608 -1.621 1.00 0.88 C ATOM 1270 C GLN A 85 24.437 19.640 -1.588 1.00 0.77 C ATOM 1271 O GLN A 85 24.575 18.863 -0.640 1.00 0.74 O ATOM 1272 CB GLN A 85 23.676 21.980 -1.074 1.00 1.06 C ATOM 1273 CG GLN A 85 22.634 23.070 -1.274 1.00 1.73 C ATOM 1274 CD GLN A 85 23.067 24.402 -0.696 1.00 2.21 C ATOM 1275 OE1 GLN A 85 23.702 25.210 -1.373 1.00 2.76 O ATOM 1276 NE2 GLN A 85 22.720 24.644 0.557 1.00 2.65 N ATOM 0 H GLN A 85 22.431 19.639 0.035 1.00 0.88 H new ATOM 0 HA GLN A 85 22.930 20.739 -2.653 1.00 0.88 H new ATOM 0 HB2 GLN A 85 23.889 21.886 -0.009 1.00 1.06 H new ATOM 0 HB3 GLN A 85 24.604 22.285 -1.559 1.00 1.06 H new ATOM 0 HG2 GLN A 85 22.436 23.187 -2.339 1.00 1.73 H new ATOM 0 HG3 GLN A 85 21.698 22.763 -0.808 1.00 1.73 H new ATOM 0 HE21 GLN A 85 22.193 23.947 1.084 1.00 2.65 H new ATOM 0 HE22 GLN A 85 22.979 25.527 0.996 1.00 2.65 H new ATOM 1285 N PRO A 86 25.294 19.654 -2.623 1.00 0.81 N ATOM 1286 CA PRO A 86 26.445 18.750 -2.706 1.00 0.79 C ATOM 1287 C PRO A 86 27.528 19.086 -1.684 1.00 0.77 C ATOM 1288 O PRO A 86 27.698 20.246 -1.303 1.00 0.85 O ATOM 1289 CB PRO A 86 26.978 18.954 -4.132 1.00 0.88 C ATOM 1290 CG PRO A 86 25.947 19.763 -4.842 1.00 1.08 C ATOM 1291 CD PRO A 86 25.221 20.542 -3.786 1.00 0.95 C ATOM 0 HA PRO A 86 26.157 17.721 -2.491 1.00 0.79 H new ATOM 0 HB2 PRO A 86 27.938 19.469 -4.120 1.00 0.88 H new ATOM 0 HB3 PRO A 86 27.136 17.998 -4.631 1.00 0.88 H new ATOM 0 HG2 PRO A 86 26.410 20.431 -5.569 1.00 1.08 H new ATOM 0 HG3 PRO A 86 25.260 19.120 -5.392 1.00 1.08 H new ATOM 0 HD2 PRO A 86 25.698 21.503 -3.592 1.00 0.95 H new ATOM 0 HD3 PRO A 86 24.190 20.750 -4.073 1.00 0.95 H new ATOM 1299 N ALA A 87 28.265 18.071 -1.247 1.00 0.84 N ATOM 1300 CA ALA A 87 29.302 18.271 -0.252 1.00 0.93 C ATOM 1301 C ALA A 87 30.672 18.444 -0.903 1.00 0.90 C ATOM 1302 O ALA A 87 31.376 17.473 -1.184 1.00 0.98 O ATOM 1303 CB ALA A 87 29.317 17.105 0.721 1.00 1.10 C ATOM 0 H ALA A 87 28.162 17.108 -1.566 1.00 0.84 H new ATOM 0 HA ALA A 87 29.079 19.188 0.294 1.00 0.93 H new ATOM 0 HB1 ALA A 87 30.098 17.262 1.465 1.00 1.10 H new ATOM 0 HB2 ALA A 87 28.350 17.034 1.219 1.00 1.10 H new ATOM 0 HB3 ALA A 87 29.514 16.181 0.178 1.00 1.10 H new ATOM 1309 N VAL A 88 31.025 19.696 -1.151 1.00 0.87 N ATOM 1310 CA VAL A 88 32.345 20.070 -1.652 1.00 0.88 C ATOM 1311 C VAL A 88 32.745 21.380 -0.991 1.00 1.02 C ATOM 1312 O VAL A 88 32.056 22.385 -1.152 1.00 1.23 O ATOM 1313 CB VAL A 88 32.370 20.236 -3.193 1.00 0.81 C ATOM 1314 CG1 VAL A 88 33.735 20.696 -3.671 1.00 0.87 C ATOM 1315 CG2 VAL A 88 31.993 18.941 -3.889 1.00 0.94 C ATOM 0 H VAL A 88 30.400 20.490 -1.010 1.00 0.87 H new ATOM 0 HA VAL A 88 33.046 19.271 -1.409 1.00 0.88 H new ATOM 0 HB VAL A 88 31.634 20.998 -3.449 1.00 0.81 H new ATOM 0 HG11 VAL A 88 33.723 20.804 -4.756 1.00 0.87 H new ATOM 0 HG12 VAL A 88 33.976 21.655 -3.213 1.00 0.87 H new ATOM 0 HG13 VAL A 88 34.487 19.959 -3.388 1.00 0.87 H new ATOM 0 HG21 VAL A 88 32.019 19.087 -4.969 1.00 0.94 H new ATOM 0 HG22 VAL A 88 32.700 18.160 -3.612 1.00 0.94 H new ATOM 0 HG23 VAL A 88 30.988 18.645 -3.587 1.00 0.94 H new ATOM 1325 N LEU A 89 33.842 21.374 -0.249 1.00 1.09 N ATOM 1326 CA LEU A 89 34.166 22.507 0.614 1.00 1.27 C ATOM 1327 C LEU A 89 34.544 23.768 -0.164 1.00 1.15 C ATOM 1328 O LEU A 89 33.850 24.781 -0.070 1.00 1.29 O ATOM 1329 CB LEU A 89 35.296 22.131 1.571 1.00 1.54 C ATOM 1330 CG LEU A 89 35.001 20.947 2.492 1.00 2.14 C ATOM 1331 CD1 LEU A 89 36.173 20.698 3.424 1.00 2.87 C ATOM 1332 CD2 LEU A 89 33.727 21.186 3.288 1.00 2.45 C ATOM 0 H LEU A 89 34.517 20.610 -0.224 1.00 1.09 H new ATOM 0 HA LEU A 89 33.261 22.740 1.174 1.00 1.27 H new ATOM 0 HB2 LEU A 89 36.186 21.902 0.985 1.00 1.54 H new ATOM 0 HB3 LEU A 89 35.534 22.999 2.186 1.00 1.54 H new ATOM 0 HG LEU A 89 34.854 20.061 1.875 1.00 2.14 H new ATOM 0 HD11 LEU A 89 35.948 19.852 4.074 1.00 2.87 H new ATOM 0 HD12 LEU A 89 37.064 20.478 2.837 1.00 2.87 H new ATOM 0 HD13 LEU A 89 36.349 21.585 4.032 1.00 2.87 H new ATOM 0 HD21 LEU A 89 33.537 20.331 3.936 1.00 2.45 H new ATOM 0 HD22 LEU A 89 33.841 22.084 3.896 1.00 2.45 H new ATOM 0 HD23 LEU A 89 32.889 21.315 2.603 1.00 2.45 H new ATOM 1344 N GLU A 90 35.633 23.730 -0.922 1.00 1.05 N ATOM 1345 CA GLU A 90 36.093 24.945 -1.591 1.00 1.13 C ATOM 1346 C GLU A 90 35.585 25.050 -3.029 1.00 1.04 C ATOM 1347 O GLU A 90 34.805 25.945 -3.351 1.00 1.34 O ATOM 1348 CB GLU A 90 37.621 24.978 -1.586 1.00 1.30 C ATOM 1349 CG GLU A 90 38.203 26.251 -2.177 1.00 1.98 C ATOM 1350 CD GLU A 90 39.709 26.201 -2.310 1.00 2.31 C ATOM 1351 OE1 GLU A 90 40.405 26.236 -1.275 1.00 2.59 O ATOM 1352 OE2 GLU A 90 40.205 26.133 -3.455 1.00 2.84 O ATOM 0 H GLU A 90 36.201 22.899 -1.087 1.00 1.05 H new ATOM 0 HA GLU A 90 35.689 25.795 -1.041 1.00 1.13 H new ATOM 0 HB2 GLU A 90 37.975 24.868 -0.561 1.00 1.30 H new ATOM 0 HB3 GLU A 90 37.997 24.122 -2.147 1.00 1.30 H new ATOM 0 HG2 GLU A 90 37.762 26.425 -3.158 1.00 1.98 H new ATOM 0 HG3 GLU A 90 37.926 27.097 -1.548 1.00 1.98 H new ATOM 1359 N THR A 91 35.948 24.063 -3.847 1.00 0.84 N ATOM 1360 CA THR A 91 35.709 24.081 -5.298 1.00 0.77 C ATOM 1361 C THR A 91 36.241 22.791 -5.919 1.00 0.77 C ATOM 1362 O THR A 91 37.321 22.324 -5.549 1.00 0.95 O ATOM 1363 CB THR A 91 36.416 25.277 -6.004 1.00 0.81 C ATOM 1364 OG1 THR A 91 35.819 26.524 -5.637 1.00 1.42 O ATOM 1365 CG2 THR A 91 36.364 25.139 -7.521 1.00 1.41 C ATOM 0 H THR A 91 36.421 23.219 -3.523 1.00 0.84 H new ATOM 0 HA THR A 91 34.633 24.181 -5.440 1.00 0.77 H new ATOM 0 HB THR A 91 37.455 25.261 -5.676 1.00 0.81 H new ATOM 0 HG1 THR A 91 35.092 26.364 -4.999 1.00 1.42 H new ATOM 0 HG21 THR A 91 36.866 25.990 -7.981 1.00 1.41 H new ATOM 0 HG22 THR A 91 36.864 24.218 -7.820 1.00 1.41 H new ATOM 0 HG23 THR A 91 35.325 25.111 -7.848 1.00 1.41 H new ATOM 1373 N THR A 92 35.480 22.206 -6.835 1.00 0.69 N ATOM 1374 CA THR A 92 35.951 21.042 -7.571 1.00 0.73 C ATOM 1375 C THR A 92 36.309 21.415 -9.015 1.00 0.65 C ATOM 1376 O THR A 92 37.340 20.990 -9.533 1.00 0.69 O ATOM 1377 CB THR A 92 34.922 19.889 -7.543 1.00 0.81 C ATOM 1378 OG1 THR A 92 35.383 18.796 -8.342 1.00 1.30 O ATOM 1379 CG2 THR A 92 33.559 20.353 -8.036 1.00 0.82 C ATOM 0 H THR A 92 34.541 22.516 -7.084 1.00 0.69 H new ATOM 0 HA THR A 92 36.853 20.688 -7.072 1.00 0.73 H new ATOM 0 HB THR A 92 34.816 19.560 -6.509 1.00 0.81 H new ATOM 0 HG1 THR A 92 34.724 18.071 -8.316 1.00 1.30 H new ATOM 0 HG21 THR A 92 32.857 19.519 -8.004 1.00 0.82 H new ATOM 0 HG22 THR A 92 33.196 21.158 -7.397 1.00 0.82 H new ATOM 0 HG23 THR A 92 33.646 20.715 -9.060 1.00 0.82 H new ATOM 1387 N HIS A 93 35.473 22.233 -9.656 1.00 0.59 N ATOM 1388 CA HIS A 93 35.736 22.671 -11.022 1.00 0.54 C ATOM 1389 C HIS A 93 35.348 24.130 -11.195 1.00 0.49 C ATOM 1390 O HIS A 93 34.329 24.576 -10.667 1.00 0.63 O ATOM 1391 CB HIS A 93 34.969 21.824 -12.049 1.00 0.68 C ATOM 1392 CG HIS A 93 35.428 20.400 -12.165 1.00 0.62 C ATOM 1393 ND1 HIS A 93 36.633 20.017 -12.715 1.00 0.98 N ATOM 1394 CD2 HIS A 93 34.807 19.251 -11.794 1.00 0.72 C ATOM 1395 CE1 HIS A 93 36.703 18.681 -12.667 1.00 1.29 C ATOM 1396 NE2 HIS A 93 35.625 18.168 -12.117 1.00 1.10 N ATOM 0 H HIS A 93 34.613 22.603 -9.251 1.00 0.59 H new ATOM 0 HA HIS A 93 36.804 22.547 -11.198 1.00 0.54 H new ATOM 0 HB2 HIS A 93 33.912 21.829 -11.785 1.00 0.68 H new ATOM 0 HB3 HIS A 93 35.055 22.299 -13.026 1.00 0.68 H new ATOM 0 HD2 HIS A 93 33.837 19.186 -11.325 1.00 0.72 H new ATOM 0 HE1 HIS A 93 37.537 18.100 -13.033 1.00 1.29 H new ATOM 0 HE2 HIS A 93 35.427 17.180 -11.959 1.00 1.10 H new ATOM 1404 N ASN A 94 36.162 24.870 -11.930 1.00 0.45 N ATOM 1405 CA ASN A 94 35.840 26.245 -12.281 1.00 0.48 C ATOM 1406 C ASN A 94 35.702 26.358 -13.797 1.00 0.51 C ATOM 1407 O ASN A 94 36.677 26.256 -14.530 1.00 0.78 O ATOM 1408 CB ASN A 94 36.910 27.212 -11.734 1.00 0.57 C ATOM 1409 CG ASN A 94 38.326 26.893 -12.198 1.00 0.67 C ATOM 1410 OD1 ASN A 94 39.007 26.045 -11.619 1.00 1.36 O ATOM 1411 ND2 ASN A 94 38.787 27.585 -13.231 1.00 1.19 N ATOM 0 H ASN A 94 37.055 24.540 -12.297 1.00 0.45 H new ATOM 0 HA ASN A 94 34.891 26.526 -11.824 1.00 0.48 H new ATOM 0 HB2 ASN A 94 36.658 28.227 -12.040 1.00 0.57 H new ATOM 0 HB3 ASN A 94 36.882 27.191 -10.645 1.00 0.57 H new ATOM 0 HD21 ASN A 94 39.735 27.423 -13.571 1.00 1.19 H new ATOM 0 HD22 ASN A 94 38.194 28.279 -13.685 1.00 1.19 H new ATOM 1418 N GLY A 95 34.482 26.566 -14.263 1.00 0.45 N ATOM 1419 CA GLY A 95 34.226 26.521 -15.689 1.00 0.49 C ATOM 1420 C GLY A 95 33.808 27.857 -16.252 1.00 0.47 C ATOM 1421 O GLY A 95 33.857 28.875 -15.559 1.00 0.53 O ATOM 0 H GLY A 95 33.666 26.765 -13.684 1.00 0.45 H new ATOM 0 HA2 GLY A 95 35.124 26.180 -16.204 1.00 0.49 H new ATOM 0 HA3 GLY A 95 33.446 25.787 -15.890 1.00 0.49 H new ATOM 1425 N VAL A 96 33.390 27.851 -17.508 1.00 0.47 N ATOM 1426 CA VAL A 96 32.971 29.071 -18.176 1.00 0.48 C ATOM 1427 C VAL A 96 31.655 28.842 -18.926 1.00 0.45 C ATOM 1428 O VAL A 96 31.419 27.756 -19.461 1.00 0.43 O ATOM 1429 CB VAL A 96 34.071 29.579 -19.144 1.00 0.55 C ATOM 1430 CG1 VAL A 96 34.270 28.634 -20.319 1.00 1.21 C ATOM 1431 CG2 VAL A 96 33.756 30.977 -19.634 1.00 1.37 C ATOM 0 H VAL A 96 33.332 27.012 -18.086 1.00 0.47 H new ATOM 0 HA VAL A 96 32.810 29.838 -17.418 1.00 0.48 H new ATOM 0 HB VAL A 96 35.005 29.610 -18.583 1.00 0.55 H new ATOM 0 HG11 VAL A 96 35.049 29.026 -20.973 1.00 1.21 H new ATOM 0 HG12 VAL A 96 34.566 27.652 -19.950 1.00 1.21 H new ATOM 0 HG13 VAL A 96 33.338 28.546 -20.877 1.00 1.21 H new ATOM 0 HG21 VAL A 96 34.542 31.311 -20.311 1.00 1.37 H new ATOM 0 HG22 VAL A 96 32.802 30.972 -20.160 1.00 1.37 H new ATOM 0 HG23 VAL A 96 33.697 31.656 -18.783 1.00 1.37 H new ATOM 1441 N VAL A 97 30.791 29.853 -18.931 1.00 0.50 N ATOM 1442 CA VAL A 97 29.490 29.749 -19.590 1.00 0.53 C ATOM 1443 C VAL A 97 29.656 29.447 -21.080 1.00 0.60 C ATOM 1444 O VAL A 97 30.336 30.187 -21.799 1.00 0.67 O ATOM 1445 CB VAL A 97 28.672 31.044 -19.419 1.00 0.60 C ATOM 1446 CG1 VAL A 97 27.314 30.921 -20.090 1.00 0.69 C ATOM 1447 CG2 VAL A 97 28.517 31.384 -17.946 1.00 0.57 C ATOM 0 H VAL A 97 30.967 30.754 -18.487 1.00 0.50 H new ATOM 0 HA VAL A 97 28.952 28.928 -19.116 1.00 0.53 H new ATOM 0 HB VAL A 97 29.213 31.856 -19.904 1.00 0.60 H new ATOM 0 HG11 VAL A 97 26.756 31.848 -19.955 1.00 0.69 H new ATOM 0 HG12 VAL A 97 27.450 30.731 -21.155 1.00 0.69 H new ATOM 0 HG13 VAL A 97 26.760 30.096 -19.642 1.00 0.69 H new ATOM 0 HG21 VAL A 97 27.937 32.301 -17.843 1.00 0.57 H new ATOM 0 HG22 VAL A 97 28.001 30.570 -17.437 1.00 0.57 H new ATOM 0 HG23 VAL A 97 29.501 31.525 -17.500 1.00 0.57 H new ATOM 1457 N ALA A 98 29.031 28.361 -21.534 1.00 0.61 N ATOM 1458 CA ALA A 98 29.169 27.919 -22.916 1.00 0.70 C ATOM 1459 C ALA A 98 28.231 28.686 -23.834 1.00 0.83 C ATOM 1460 O ALA A 98 28.671 29.353 -24.769 1.00 0.89 O ATOM 1461 CB ALA A 98 28.913 26.425 -23.018 1.00 0.76 C ATOM 0 H ALA A 98 28.425 27.773 -20.962 1.00 0.61 H new ATOM 0 HA ALA A 98 30.190 28.123 -23.238 1.00 0.70 H new ATOM 0 HB1 ALA A 98 29.019 26.108 -24.055 1.00 0.76 H new ATOM 0 HB2 ALA A 98 29.633 25.889 -22.399 1.00 0.76 H new ATOM 0 HB3 ALA A 98 27.903 26.205 -22.673 1.00 0.76 H new ATOM 1467 N ARG A 99 26.935 28.604 -23.567 1.00 0.97 N ATOM 1468 CA ARG A 99 25.956 29.312 -24.378 1.00 1.17 C ATOM 1469 C ARG A 99 24.724 29.668 -23.552 1.00 1.38 C ATOM 1470 O ARG A 99 24.159 28.819 -22.863 1.00 1.41 O ATOM 1471 CB ARG A 99 25.549 28.483 -25.609 1.00 1.25 C ATOM 1472 CG ARG A 99 24.960 27.122 -25.275 1.00 1.85 C ATOM 1473 CD ARG A 99 24.536 26.370 -26.530 1.00 2.04 C ATOM 1474 NE ARG A 99 23.911 25.085 -26.211 1.00 2.61 N ATOM 1475 CZ ARG A 99 22.900 24.548 -26.897 1.00 2.99 C ATOM 1476 NH1 ARG A 99 22.429 25.148 -27.986 1.00 2.82 N ATOM 1477 NH2 ARG A 99 22.375 23.396 -26.501 1.00 3.92 N ATOM 0 H ARG A 99 26.540 28.059 -22.801 1.00 0.97 H new ATOM 0 HA ARG A 99 26.421 30.234 -24.726 1.00 1.17 H new ATOM 0 HB2 ARG A 99 24.821 29.049 -26.190 1.00 1.25 H new ATOM 0 HB3 ARG A 99 26.424 28.342 -26.244 1.00 1.25 H new ATOM 0 HG2 ARG A 99 25.695 26.532 -24.727 1.00 1.85 H new ATOM 0 HG3 ARG A 99 24.099 27.249 -24.618 1.00 1.85 H new ATOM 0 HD2 ARG A 99 23.838 26.982 -27.101 1.00 2.04 H new ATOM 0 HD3 ARG A 99 25.406 26.203 -27.165 1.00 2.04 H new ATOM 0 HE ARG A 99 24.272 24.566 -25.411 1.00 2.61 H new ATOM 0 HH11 ARG A 99 22.841 26.026 -28.303 1.00 2.82 H new ATOM 0 HH12 ARG A 99 21.656 24.731 -28.504 1.00 2.82 H new ATOM 0 HH21 ARG A 99 22.744 22.924 -25.675 1.00 3.92 H new ATOM 0 HH22 ARG A 99 21.602 22.982 -27.022 1.00 3.92 H new ATOM 1688 N ALA A 112 17.783 24.442 -19.210 1.00 1.24 N ATOM 1689 CA ALA A 112 18.615 24.626 -18.032 1.00 1.02 C ATOM 1690 C ALA A 112 19.893 25.396 -18.349 1.00 0.97 C ATOM 1691 O ALA A 112 20.421 26.101 -17.496 1.00 1.15 O ATOM 1692 CB ALA A 112 18.950 23.283 -17.414 1.00 1.06 C ATOM 0 HA ALA A 112 18.045 25.220 -17.318 1.00 1.02 H new ATOM 0 HB1 ALA A 112 19.573 23.433 -16.533 1.00 1.06 H new ATOM 0 HB2 ALA A 112 18.030 22.776 -17.125 1.00 1.06 H new ATOM 0 HB3 ALA A 112 19.488 22.673 -18.139 1.00 1.06 H new ATOM 1698 N GLY A 113 20.370 25.275 -19.578 1.00 0.94 N ATOM 1699 CA GLY A 113 21.615 25.922 -19.952 1.00 0.89 C ATOM 1700 C GLY A 113 22.810 25.068 -19.585 1.00 0.79 C ATOM 1701 O GLY A 113 22.686 24.147 -18.777 1.00 0.83 O ATOM 0 H GLY A 113 19.921 24.743 -20.323 1.00 0.94 H new ATOM 0 HA2 GLY A 113 21.619 26.115 -21.025 1.00 0.89 H new ATOM 0 HA3 GLY A 113 21.689 26.889 -19.454 1.00 0.89 H new ATOM 1705 N LEU A 114 23.976 25.375 -20.140 1.00 0.73 N ATOM 1706 CA LEU A 114 25.122 24.504 -19.963 1.00 0.66 C ATOM 1707 C LEU A 114 26.430 25.279 -19.905 1.00 0.58 C ATOM 1708 O LEU A 114 26.627 26.275 -20.605 1.00 0.63 O ATOM 1709 CB LEU A 114 25.158 23.453 -21.077 1.00 0.74 C ATOM 1710 CG LEU A 114 24.080 22.371 -20.962 1.00 0.83 C ATOM 1711 CD1 LEU A 114 23.817 21.712 -22.299 1.00 0.93 C ATOM 1712 CD2 LEU A 114 24.495 21.319 -19.951 1.00 0.80 C ATOM 0 H LEU A 114 24.148 26.206 -20.706 1.00 0.73 H new ATOM 0 HA LEU A 114 25.012 24.002 -19.002 1.00 0.66 H new ATOM 0 HB2 LEU A 114 25.049 23.956 -22.038 1.00 0.74 H new ATOM 0 HB3 LEU A 114 26.137 22.974 -21.077 1.00 0.74 H new ATOM 0 HG LEU A 114 23.162 22.854 -20.628 1.00 0.83 H new ATOM 0 HD11 LEU A 114 23.047 20.949 -22.183 1.00 0.93 H new ATOM 0 HD12 LEU A 114 23.480 22.462 -23.014 1.00 0.93 H new ATOM 0 HD13 LEU A 114 24.734 21.250 -22.663 1.00 0.93 H new ATOM 0 HD21 LEU A 114 23.719 20.557 -19.880 1.00 0.80 H new ATOM 0 HD22 LEU A 114 25.430 20.857 -20.269 1.00 0.80 H new ATOM 0 HD23 LEU A 114 24.635 21.786 -18.976 1.00 0.80 H new ATOM 1724 N ILE A 115 27.300 24.806 -19.034 1.00 0.49 N ATOM 1725 CA ILE A 115 28.624 25.363 -18.844 1.00 0.42 C ATOM 1726 C ILE A 115 29.655 24.388 -19.394 1.00 0.43 C ATOM 1727 O ILE A 115 29.579 23.189 -19.118 1.00 0.47 O ATOM 1728 CB ILE A 115 28.887 25.594 -17.339 1.00 0.34 C ATOM 1729 CG1 ILE A 115 27.853 26.564 -16.762 1.00 0.36 C ATOM 1730 CG2 ILE A 115 30.297 26.116 -17.095 1.00 0.31 C ATOM 1731 CD1 ILE A 115 27.751 26.509 -15.255 1.00 0.28 C ATOM 0 H ILE A 115 27.102 24.010 -18.428 1.00 0.49 H new ATOM 0 HA ILE A 115 28.696 26.316 -19.368 1.00 0.42 H new ATOM 0 HB ILE A 115 28.794 24.634 -16.832 1.00 0.34 H new ATOM 0 HG12 ILE A 115 28.110 27.579 -17.064 1.00 0.36 H new ATOM 0 HG13 ILE A 115 26.877 26.341 -17.193 1.00 0.36 H new ATOM 0 HG21 ILE A 115 30.449 26.268 -16.026 1.00 0.31 H new ATOM 0 HG22 ILE A 115 31.022 25.392 -17.465 1.00 0.31 H new ATOM 0 HG23 ILE A 115 30.430 27.063 -17.618 1.00 0.31 H new ATOM 0 HD11 ILE A 115 27.000 27.222 -14.915 1.00 0.28 H new ATOM 0 HD12 ILE A 115 27.464 25.504 -14.946 1.00 0.28 H new ATOM 0 HD13 ILE A 115 28.716 26.761 -14.816 1.00 0.28 H new ATOM 1743 N GLU A 116 30.604 24.878 -20.172 1.00 0.43 N ATOM 1744 CA GLU A 116 31.632 24.001 -20.706 1.00 0.47 C ATOM 1745 C GLU A 116 32.763 23.866 -19.696 1.00 0.45 C ATOM 1746 O GLU A 116 33.468 24.824 -19.377 1.00 0.49 O ATOM 1747 CB GLU A 116 32.120 24.458 -22.094 1.00 0.54 C ATOM 1748 CG GLU A 116 32.604 25.893 -22.186 1.00 0.84 C ATOM 1749 CD GLU A 116 32.866 26.315 -23.624 1.00 1.03 C ATOM 1750 OE1 GLU A 116 33.809 25.781 -24.245 1.00 1.14 O ATOM 1751 OE2 GLU A 116 32.147 27.203 -24.135 1.00 1.40 O ATOM 0 H GLU A 116 30.685 25.858 -20.444 1.00 0.43 H new ATOM 0 HA GLU A 116 31.203 23.012 -20.865 1.00 0.47 H new ATOM 0 HB2 GLU A 116 32.931 23.800 -22.407 1.00 0.54 H new ATOM 0 HB3 GLU A 116 31.306 24.323 -22.807 1.00 0.54 H new ATOM 0 HG2 GLU A 116 31.860 26.556 -21.744 1.00 0.84 H new ATOM 0 HG3 GLU A 116 33.518 26.005 -21.603 1.00 0.84 H new ATOM 1758 N ILE A 117 32.886 22.661 -19.161 1.00 0.47 N ATOM 1759 CA ILE A 117 33.777 22.390 -18.045 1.00 0.50 C ATOM 1760 C ILE A 117 35.163 22.054 -18.551 1.00 0.56 C ATOM 1761 O ILE A 117 35.309 21.265 -19.483 1.00 0.63 O ATOM 1762 CB ILE A 117 33.244 21.208 -17.209 1.00 0.53 C ATOM 1763 CG1 ILE A 117 31.734 21.337 -17.049 1.00 0.48 C ATOM 1764 CG2 ILE A 117 33.917 21.145 -15.841 1.00 0.60 C ATOM 1765 CD1 ILE A 117 31.305 22.575 -16.293 1.00 0.41 C ATOM 0 H ILE A 117 32.371 21.844 -19.489 1.00 0.47 H new ATOM 0 HA ILE A 117 33.824 23.283 -17.421 1.00 0.50 H new ATOM 0 HB ILE A 117 33.478 20.282 -17.735 1.00 0.53 H new ATOM 0 HG12 ILE A 117 31.273 21.347 -18.037 1.00 0.48 H new ATOM 0 HG13 ILE A 117 31.356 20.456 -16.530 1.00 0.48 H new ATOM 0 HG21 ILE A 117 33.518 20.301 -15.278 1.00 0.60 H new ATOM 0 HG22 ILE A 117 34.992 21.020 -15.970 1.00 0.60 H new ATOM 0 HG23 ILE A 117 33.722 22.069 -15.297 1.00 0.60 H new ATOM 0 HD11 ILE A 117 30.218 22.598 -16.219 1.00 0.41 H new ATOM 0 HD12 ILE A 117 31.736 22.558 -15.292 1.00 0.41 H new ATOM 0 HD13 ILE A 117 31.651 23.463 -16.822 1.00 0.41 H new ATOM 1777 N LEU A 118 36.173 22.632 -17.938 1.00 0.61 N ATOM 1778 CA LEU A 118 37.532 22.429 -18.396 1.00 0.70 C ATOM 1779 C LEU A 118 38.122 21.166 -17.788 1.00 0.79 C ATOM 1780 O LEU A 118 37.768 20.761 -16.679 1.00 0.88 O ATOM 1781 CB LEU A 118 38.414 23.644 -18.061 1.00 0.84 C ATOM 1782 CG LEU A 118 38.944 23.731 -16.617 1.00 0.96 C ATOM 1783 CD1 LEU A 118 39.781 24.988 -16.435 1.00 1.15 C ATOM 1784 CD2 LEU A 118 37.812 23.700 -15.599 1.00 1.21 C ATOM 0 H LEU A 118 36.081 23.243 -17.126 1.00 0.61 H new ATOM 0 HA LEU A 118 37.505 22.314 -19.480 1.00 0.70 H new ATOM 0 HB2 LEU A 118 39.268 23.643 -18.738 1.00 0.84 H new ATOM 0 HB3 LEU A 118 37.843 24.548 -18.270 1.00 0.84 H new ATOM 0 HG LEU A 118 39.571 22.856 -16.443 1.00 0.96 H new ATOM 0 HD11 LEU A 118 40.148 25.035 -15.410 1.00 1.15 H new ATOM 0 HD12 LEU A 118 40.626 24.965 -17.123 1.00 1.15 H new ATOM 0 HD13 LEU A 118 39.169 25.866 -16.642 1.00 1.15 H new ATOM 0 HD21 LEU A 118 38.226 23.763 -14.593 1.00 1.21 H new ATOM 0 HD22 LEU A 118 37.145 24.545 -15.771 1.00 1.21 H new ATOM 0 HD23 LEU A 118 37.254 22.770 -15.704 1.00 1.21 H new ATOM 1796 N ASP A 119 38.990 20.534 -18.551 1.00 0.83 N ATOM 1797 CA ASP A 119 39.795 19.431 -18.068 1.00 0.95 C ATOM 1798 C ASP A 119 40.593 19.890 -16.852 1.00 1.01 C ATOM 1799 O ASP A 119 40.919 21.073 -16.741 1.00 0.98 O ATOM 1800 CB ASP A 119 40.719 18.967 -19.199 1.00 1.05 C ATOM 1801 CG ASP A 119 41.762 17.973 -18.757 1.00 1.65 C ATOM 1802 OD1 ASP A 119 42.921 18.387 -18.567 1.00 2.29 O ATOM 1803 OD2 ASP A 119 41.433 16.781 -18.616 1.00 2.22 O ATOM 0 H ASP A 119 39.158 20.772 -19.529 1.00 0.83 H new ATOM 0 HA ASP A 119 39.166 18.594 -17.766 1.00 0.95 H new ATOM 0 HB2 ASP A 119 40.116 18.521 -19.990 1.00 1.05 H new ATOM 0 HB3 ASP A 119 41.217 19.836 -19.630 1.00 1.05 H new ATOM 1808 N GLU A 120 40.905 18.979 -15.940 1.00 1.17 N ATOM 1809 CA GLU A 120 41.530 19.369 -14.677 1.00 1.32 C ATOM 1810 C GLU A 120 42.936 19.916 -14.890 1.00 1.33 C ATOM 1811 O GLU A 120 43.497 20.564 -14.007 1.00 1.44 O ATOM 1812 CB GLU A 120 41.573 18.205 -13.691 1.00 1.55 C ATOM 1813 CG GLU A 120 42.433 17.041 -14.141 1.00 1.63 C ATOM 1814 CD GLU A 120 42.692 16.068 -13.016 1.00 1.96 C ATOM 1815 OE1 GLU A 120 41.892 15.130 -12.836 1.00 1.89 O ATOM 1816 OE2 GLU A 120 43.692 16.251 -12.292 1.00 2.78 O ATOM 0 H GLU A 120 40.740 17.978 -16.045 1.00 1.17 H new ATOM 0 HA GLU A 120 40.912 20.161 -14.255 1.00 1.32 H new ATOM 0 HB2 GLU A 120 41.945 18.568 -12.733 1.00 1.55 H new ATOM 0 HB3 GLU A 120 40.557 17.848 -13.523 1.00 1.55 H new ATOM 0 HG2 GLU A 120 41.941 16.523 -14.964 1.00 1.63 H new ATOM 0 HG3 GLU A 120 43.382 17.417 -14.523 1.00 1.63 H new ATOM 1823 N LEU A 121 43.510 19.649 -16.054 1.00 1.28 N ATOM 1824 CA LEU A 121 44.814 20.193 -16.397 1.00 1.34 C ATOM 1825 C LEU A 121 44.640 21.438 -17.262 1.00 1.21 C ATOM 1826 O LEU A 121 45.599 21.953 -17.833 1.00 1.27 O ATOM 1827 CB LEU A 121 45.677 19.149 -17.119 1.00 1.45 C ATOM 1828 CG LEU A 121 46.021 17.881 -16.321 1.00 1.65 C ATOM 1829 CD1 LEU A 121 46.104 18.169 -14.827 1.00 1.77 C ATOM 1830 CD2 LEU A 121 45.018 16.774 -16.607 1.00 1.65 C ATOM 0 H LEU A 121 43.094 19.060 -16.775 1.00 1.28 H new ATOM 0 HA LEU A 121 45.329 20.467 -15.476 1.00 1.34 H new ATOM 0 HB2 LEU A 121 45.161 18.850 -18.031 1.00 1.45 H new ATOM 0 HB3 LEU A 121 46.609 19.626 -17.422 1.00 1.45 H new ATOM 0 HG LEU A 121 47.005 17.541 -16.645 1.00 1.65 H new ATOM 0 HD11 LEU A 121 46.349 17.251 -14.293 1.00 1.77 H new ATOM 0 HD12 LEU A 121 46.878 18.914 -14.642 1.00 1.77 H new ATOM 0 HD13 LEU A 121 45.144 18.548 -14.476 1.00 1.77 H new ATOM 0 HD21 LEU A 121 45.282 15.887 -16.031 1.00 1.65 H new ATOM 0 HD22 LEU A 121 44.019 17.106 -16.325 1.00 1.65 H new ATOM 0 HD23 LEU A 121 45.034 16.535 -17.670 1.00 1.65 H new ATOM 1842 N ARG A 122 43.391 21.907 -17.342 1.00 1.11 N ATOM 1843 CA ARG A 122 43.027 23.126 -18.073 1.00 1.08 C ATOM 1844 C ARG A 122 43.309 22.977 -19.562 1.00 1.13 C ATOM 1845 O ARG A 122 43.575 23.961 -20.257 1.00 1.46 O ATOM 1846 CB ARG A 122 43.751 24.351 -17.495 1.00 1.24 C ATOM 1847 CG ARG A 122 43.438 24.587 -16.026 1.00 1.80 C ATOM 1848 CD ARG A 122 44.036 25.887 -15.515 1.00 2.04 C ATOM 1849 NE ARG A 122 43.435 27.063 -16.148 1.00 2.50 N ATOM 1850 CZ ARG A 122 43.244 28.232 -15.531 1.00 3.32 C ATOM 1851 NH1 ARG A 122 43.639 28.397 -14.271 1.00 3.73 N ATOM 1852 NH2 ARG A 122 42.682 29.245 -16.189 1.00 4.14 N ATOM 0 H ARG A 122 42.596 21.447 -16.897 1.00 1.11 H new ATOM 0 HA ARG A 122 41.955 23.281 -17.951 1.00 1.08 H new ATOM 0 HB2 ARG A 122 44.826 24.221 -17.615 1.00 1.24 H new ATOM 0 HB3 ARG A 122 43.471 25.235 -18.067 1.00 1.24 H new ATOM 0 HG2 ARG A 122 42.357 24.606 -15.885 1.00 1.80 H new ATOM 0 HG3 ARG A 122 43.822 23.755 -15.436 1.00 1.80 H new ATOM 0 HD2 ARG A 122 43.898 25.948 -14.436 1.00 2.04 H new ATOM 0 HD3 ARG A 122 45.110 25.887 -15.699 1.00 2.04 H new ATOM 0 HE ARG A 122 43.144 26.984 -17.122 1.00 2.50 H new ATOM 0 HH11 ARG A 122 44.089 27.629 -13.773 1.00 3.73 H new ATOM 0 HH12 ARG A 122 43.491 29.291 -13.803 1.00 3.73 H new ATOM 0 HH21 ARG A 122 42.399 29.127 -17.162 1.00 4.14 H new ATOM 0 HH22 ARG A 122 42.535 30.139 -15.720 1.00 4.14 H new ATOM 1866 N THR A 123 43.217 21.748 -20.055 1.00 1.08 N ATOM 1867 CA THR A 123 43.435 21.476 -21.466 1.00 1.20 C ATOM 1868 C THR A 123 42.258 21.975 -22.309 1.00 1.15 C ATOM 1869 O THR A 123 42.347 23.019 -22.950 1.00 1.38 O ATOM 1870 CB THR A 123 43.643 19.970 -21.716 1.00 1.40 C ATOM 1871 OG1 THR A 123 44.551 19.444 -20.740 1.00 1.86 O ATOM 1872 CG2 THR A 123 44.191 19.720 -23.117 1.00 1.87 C ATOM 0 H THR A 123 42.993 20.925 -19.496 1.00 1.08 H new ATOM 0 HA THR A 123 44.337 22.011 -21.763 1.00 1.20 H new ATOM 0 HB THR A 123 42.679 19.468 -21.631 1.00 1.40 H new ATOM 0 HG1 THR A 123 44.044 19.077 -19.986 1.00 1.86 H new ATOM 0 HG21 THR A 123 44.329 18.649 -23.268 1.00 1.87 H new ATOM 0 HG22 THR A 123 43.488 20.103 -23.856 1.00 1.87 H new ATOM 0 HG23 THR A 123 45.149 20.228 -23.229 1.00 1.87 H new ATOM 1880 N THR A 124 41.153 21.241 -22.292 1.00 1.01 N ATOM 1881 CA THR A 124 39.977 21.609 -23.069 1.00 1.03 C ATOM 1882 C THR A 124 38.699 21.264 -22.311 1.00 0.89 C ATOM 1883 O THR A 124 38.747 20.990 -21.116 1.00 0.85 O ATOM 1884 CB THR A 124 39.981 20.915 -24.443 1.00 1.26 C ATOM 1885 OG1 THR A 124 40.539 19.597 -24.328 1.00 1.54 O ATOM 1886 CG2 THR A 124 40.771 21.732 -25.457 1.00 1.53 C ATOM 0 H THR A 124 41.047 20.385 -21.747 1.00 1.01 H new ATOM 0 HA THR A 124 40.009 22.687 -23.229 1.00 1.03 H new ATOM 0 HB THR A 124 38.951 20.836 -24.792 1.00 1.26 H new ATOM 0 HG1 THR A 124 40.536 19.163 -25.206 1.00 1.54 H new ATOM 0 HG21 THR A 124 40.761 21.223 -26.421 1.00 1.53 H new ATOM 0 HG22 THR A 124 40.318 22.718 -25.562 1.00 1.53 H new ATOM 0 HG23 THR A 124 41.800 21.840 -25.115 1.00 1.53 H new ATOM 1894 N VAL A 125 37.566 21.279 -23.003 1.00 0.90 N ATOM 1895 CA VAL A 125 36.280 20.996 -22.382 1.00 0.82 C ATOM 1896 C VAL A 125 36.071 19.495 -22.238 1.00 0.86 C ATOM 1897 O VAL A 125 36.426 18.729 -23.134 1.00 0.96 O ATOM 1898 CB VAL A 125 35.126 21.581 -23.208 1.00 0.82 C ATOM 1899 CG1 VAL A 125 33.798 21.389 -22.496 1.00 1.17 C ATOM 1900 CG2 VAL A 125 35.371 23.047 -23.504 1.00 1.29 C ATOM 0 H VAL A 125 37.513 21.486 -24.000 1.00 0.90 H new ATOM 0 HA VAL A 125 36.287 21.461 -21.396 1.00 0.82 H new ATOM 0 HB VAL A 125 35.080 21.044 -24.156 1.00 0.82 H new ATOM 0 HG11 VAL A 125 32.996 21.812 -23.101 1.00 1.17 H new ATOM 0 HG12 VAL A 125 33.616 20.325 -22.345 1.00 1.17 H new ATOM 0 HG13 VAL A 125 33.827 21.892 -21.530 1.00 1.17 H new ATOM 0 HG21 VAL A 125 34.542 23.443 -24.090 1.00 1.29 H new ATOM 0 HG22 VAL A 125 35.450 23.599 -22.567 1.00 1.29 H new ATOM 0 HG23 VAL A 125 36.298 23.154 -24.067 1.00 1.29 H new ATOM 1910 N ILE A 126 35.526 19.074 -21.097 1.00 0.82 N ATOM 1911 CA ILE A 126 35.238 17.664 -20.884 1.00 0.90 C ATOM 1912 C ILE A 126 33.974 17.274 -21.636 1.00 0.93 C ATOM 1913 O ILE A 126 34.031 16.542 -22.620 1.00 1.03 O ATOM 1914 CB ILE A 126 35.023 17.359 -19.387 1.00 0.89 C ATOM 1915 CG1 ILE A 126 36.205 17.864 -18.560 1.00 0.87 C ATOM 1916 CG2 ILE A 126 34.819 15.860 -19.177 1.00 1.00 C ATOM 1917 CD1 ILE A 126 35.885 17.974 -17.090 1.00 0.87 C ATOM 0 H ILE A 126 35.279 19.684 -20.317 1.00 0.82 H new ATOM 0 HA ILE A 126 36.092 17.094 -21.249 1.00 0.90 H new ATOM 0 HB ILE A 126 34.127 17.881 -19.051 1.00 0.89 H new ATOM 0 HG12 ILE A 126 37.051 17.189 -18.694 1.00 0.87 H new ATOM 0 HG13 ILE A 126 36.514 18.840 -18.934 1.00 0.87 H new ATOM 0 HG21 ILE A 126 34.668 15.658 -18.116 1.00 1.00 H new ATOM 0 HG22 ILE A 126 33.944 15.530 -19.737 1.00 1.00 H new ATOM 0 HG23 ILE A 126 35.699 15.320 -19.528 1.00 1.00 H new ATOM 0 HD11 ILE A 126 36.761 18.337 -16.553 1.00 0.87 H new ATOM 0 HD12 ILE A 126 35.058 18.670 -16.949 1.00 0.87 H new ATOM 0 HD13 ILE A 126 35.604 16.994 -16.705 1.00 0.87 H new ATOM 1929 N SER A 127 32.828 17.752 -21.162 1.00 0.87 N ATOM 1930 CA SER A 127 31.596 17.675 -21.929 1.00 0.92 C ATOM 1931 C SER A 127 30.806 18.979 -21.804 1.00 0.84 C ATOM 1932 O SER A 127 30.945 19.892 -22.617 1.00 0.85 O ATOM 1933 CB SER A 127 30.766 16.475 -21.455 1.00 0.99 C ATOM 1934 OG SER A 127 31.528 15.283 -21.519 1.00 1.56 O ATOM 0 H SER A 127 32.730 18.197 -20.249 1.00 0.87 H new ATOM 0 HA SER A 127 31.837 17.534 -22.983 1.00 0.92 H new ATOM 0 HB2 SER A 127 30.428 16.642 -20.432 1.00 0.99 H new ATOM 0 HB3 SER A 127 29.874 16.376 -22.074 1.00 0.99 H new ATOM 0 HG SER A 127 30.983 14.529 -21.211 1.00 1.56 H new ATOM 1940 N GLN A 128 29.997 19.051 -20.744 1.00 0.79 N ATOM 1941 CA GLN A 128 29.228 20.237 -20.384 1.00 0.74 C ATOM 1942 C GLN A 128 28.459 19.948 -19.099 1.00 0.69 C ATOM 1943 O GLN A 128 28.028 18.814 -18.890 1.00 0.73 O ATOM 1944 CB GLN A 128 28.267 20.640 -21.513 1.00 0.86 C ATOM 1945 CG GLN A 128 27.424 19.491 -22.042 1.00 1.02 C ATOM 1946 CD GLN A 128 26.619 19.876 -23.267 1.00 1.43 C ATOM 1947 OE1 GLN A 128 27.026 20.735 -24.051 1.00 2.08 O ATOM 1948 NE2 GLN A 128 25.471 19.242 -23.441 1.00 1.88 N ATOM 0 H GLN A 128 29.858 18.270 -20.102 1.00 0.79 H new ATOM 0 HA GLN A 128 29.909 21.074 -20.227 1.00 0.74 H new ATOM 0 HB2 GLN A 128 27.605 21.427 -21.150 1.00 0.86 H new ATOM 0 HB3 GLN A 128 28.844 21.063 -22.335 1.00 0.86 H new ATOM 0 HG2 GLN A 128 28.074 18.651 -22.288 1.00 1.02 H new ATOM 0 HG3 GLN A 128 26.747 19.151 -21.259 1.00 1.02 H new ATOM 0 HE21 GLN A 128 25.171 18.537 -22.768 1.00 1.88 H new ATOM 0 HE22 GLN A 128 24.886 19.458 -24.248 1.00 1.88 H new ATOM 1957 N HIS A 129 28.298 20.935 -18.228 1.00 0.63 N ATOM 1958 CA HIS A 129 27.501 20.727 -17.024 1.00 0.60 C ATOM 1959 C HIS A 129 26.268 21.600 -17.025 1.00 0.58 C ATOM 1960 O HIS A 129 26.295 22.752 -17.459 1.00 0.54 O ATOM 1961 CB HIS A 129 28.287 20.965 -15.730 1.00 0.54 C ATOM 1962 CG HIS A 129 29.278 19.887 -15.393 1.00 0.58 C ATOM 1963 ND1 HIS A 129 29.631 18.774 -16.081 1.00 0.58 N flip ATOM 1964 CD2 HIS A 129 30.038 19.882 -14.246 1.00 0.65 C flip ATOM 1965 CE1 HIS A 129 30.608 18.085 -15.368 1.00 0.65 C flip ATOM 1966 NE2 HIS A 129 30.817 18.793 -14.273 1.00 0.68 N flip ATOM 0 H HIS A 129 28.698 21.868 -18.327 1.00 0.63 H new ATOM 0 HA HIS A 129 27.210 19.677 -17.046 1.00 0.60 H new ATOM 0 HB2 HIS A 129 28.816 21.914 -15.811 1.00 0.54 H new ATOM 0 HB3 HIS A 129 27.582 21.063 -14.905 1.00 0.54 H new ATOM 0 HD1 HIS A 129 29.242 18.487 -16.979 1.00 0.58 H new ATOM 0 HD2 HIS A 129 30.011 20.625 -13.463 1.00 0.65 H new ATOM 0 HE1 HIS A 129 31.094 17.163 -15.651 1.00 0.65 H new ATOM 1974 N GLU A 130 25.197 21.023 -16.526 1.00 0.64 N ATOM 1975 CA GLU A 130 23.900 21.661 -16.471 1.00 0.64 C ATOM 1976 C GLU A 130 23.770 22.418 -15.155 1.00 0.56 C ATOM 1977 O GLU A 130 24.243 21.945 -14.116 1.00 0.54 O ATOM 1978 CB GLU A 130 22.853 20.556 -16.571 1.00 0.77 C ATOM 1979 CG GLU A 130 21.501 20.963 -17.115 1.00 0.82 C ATOM 1980 CD GLU A 130 20.588 19.758 -17.246 1.00 0.98 C ATOM 1981 OE1 GLU A 130 19.913 19.628 -18.287 1.00 1.18 O ATOM 1982 OE2 GLU A 130 20.584 18.911 -16.321 1.00 1.19 O ATOM 0 H GLU A 130 25.203 20.079 -16.140 1.00 0.64 H new ATOM 0 HA GLU A 130 23.766 22.375 -17.283 1.00 0.64 H new ATOM 0 HB2 GLU A 130 23.252 19.763 -17.203 1.00 0.77 H new ATOM 0 HB3 GLU A 130 22.709 20.130 -15.578 1.00 0.77 H new ATOM 0 HG2 GLU A 130 21.045 21.700 -16.454 1.00 0.82 H new ATOM 0 HG3 GLU A 130 21.624 21.439 -18.088 1.00 0.82 H new ATOM 1989 N PHE A 131 23.165 23.594 -15.195 1.00 0.53 N ATOM 1990 CA PHE A 131 22.991 24.387 -13.984 1.00 0.46 C ATOM 1991 C PHE A 131 21.510 24.602 -13.673 1.00 0.51 C ATOM 1992 O PHE A 131 20.666 24.562 -14.567 1.00 0.74 O ATOM 1993 CB PHE A 131 23.745 25.721 -14.060 1.00 0.42 C ATOM 1994 CG PHE A 131 23.501 26.540 -15.296 1.00 0.48 C ATOM 1995 CD1 PHE A 131 22.432 27.415 -15.372 1.00 0.60 C ATOM 1996 CD2 PHE A 131 24.374 26.462 -16.366 1.00 0.46 C ATOM 1997 CE1 PHE A 131 22.236 28.196 -16.496 1.00 0.70 C ATOM 1998 CE2 PHE A 131 24.182 27.235 -17.493 1.00 0.56 C ATOM 1999 CZ PHE A 131 23.113 28.104 -17.559 1.00 0.68 C ATOM 0 H PHE A 131 22.789 24.019 -16.042 1.00 0.53 H new ATOM 0 HA PHE A 131 23.426 23.820 -13.161 1.00 0.46 H new ATOM 0 HB2 PHE A 131 23.474 26.320 -13.191 1.00 0.42 H new ATOM 0 HB3 PHE A 131 24.813 25.518 -13.987 1.00 0.42 H new ATOM 0 HD1 PHE A 131 21.743 27.489 -14.544 1.00 0.60 H new ATOM 0 HD2 PHE A 131 25.216 25.788 -16.319 1.00 0.46 H new ATOM 0 HE1 PHE A 131 21.399 28.877 -16.543 1.00 0.70 H new ATOM 0 HE2 PHE A 131 24.869 27.159 -18.323 1.00 0.56 H new ATOM 0 HZ PHE A 131 22.962 28.711 -18.440 1.00 0.68 H new ATOM 2009 N GLY A 132 21.211 24.833 -12.400 1.00 0.48 N ATOM 2010 CA GLY A 132 19.836 24.910 -11.946 1.00 0.51 C ATOM 2011 C GLY A 132 19.472 26.286 -11.430 1.00 0.50 C ATOM 2012 O GLY A 132 20.332 27.015 -10.948 1.00 0.47 O ATOM 0 H GLY A 132 21.906 24.970 -11.666 1.00 0.48 H new ATOM 0 HA2 GLY A 132 19.170 24.646 -12.768 1.00 0.51 H new ATOM 0 HA3 GLY A 132 19.676 24.175 -11.157 1.00 0.51 H new ATOM 2016 N ILE A 133 18.196 26.645 -11.543 1.00 0.54 N ATOM 2017 CA ILE A 133 17.698 27.954 -11.103 1.00 0.55 C ATOM 2018 C ILE A 133 18.095 28.264 -9.657 1.00 0.54 C ATOM 2019 O ILE A 133 18.331 29.419 -9.297 1.00 0.56 O ATOM 2020 CB ILE A 133 16.160 28.032 -11.244 1.00 0.60 C ATOM 2021 CG1 ILE A 133 15.625 29.403 -10.814 1.00 0.64 C ATOM 2022 CG2 ILE A 133 15.475 26.924 -10.455 1.00 0.61 C ATOM 2023 CD1 ILE A 133 16.027 30.537 -11.731 1.00 0.67 C ATOM 0 H ILE A 133 17.476 26.041 -11.941 1.00 0.54 H new ATOM 0 HA ILE A 133 18.161 28.700 -11.749 1.00 0.55 H new ATOM 0 HB ILE A 133 15.928 27.894 -12.300 1.00 0.60 H new ATOM 0 HG12 ILE A 133 14.537 29.358 -10.765 1.00 0.64 H new ATOM 0 HG13 ILE A 133 15.981 29.621 -9.807 1.00 0.64 H new ATOM 0 HG21 ILE A 133 14.395 27.007 -10.575 1.00 0.61 H new ATOM 0 HG22 ILE A 133 15.808 25.954 -10.825 1.00 0.61 H new ATOM 0 HG23 ILE A 133 15.731 27.017 -9.400 1.00 0.61 H new ATOM 0 HD11 ILE A 133 15.609 31.472 -11.358 1.00 0.67 H new ATOM 0 HD12 ILE A 133 17.114 30.612 -11.762 1.00 0.67 H new ATOM 0 HD13 ILE A 133 15.648 30.345 -12.735 1.00 0.67 H new ATOM 2035 N THR A 134 18.175 27.234 -8.836 1.00 0.57 N ATOM 2036 CA THR A 134 18.516 27.406 -7.441 1.00 0.61 C ATOM 2037 C THR A 134 20.012 27.633 -7.266 1.00 0.57 C ATOM 2038 O THR A 134 20.431 28.444 -6.441 1.00 0.61 O ATOM 2039 CB THR A 134 18.081 26.178 -6.628 1.00 0.71 C ATOM 2040 OG1 THR A 134 18.432 24.982 -7.340 1.00 1.35 O ATOM 2041 CG2 THR A 134 16.587 26.205 -6.376 1.00 0.86 C ATOM 0 H THR A 134 18.007 26.267 -9.115 1.00 0.57 H new ATOM 0 HA THR A 134 17.987 28.286 -7.075 1.00 0.61 H new ATOM 0 HB THR A 134 18.594 26.196 -5.666 1.00 0.71 H new ATOM 0 HG1 THR A 134 17.619 24.551 -7.677 1.00 1.35 H new ATOM 0 HG21 THR A 134 16.299 25.326 -5.799 1.00 0.86 H new ATOM 0 HG22 THR A 134 16.328 27.106 -5.819 1.00 0.86 H new ATOM 0 HG23 THR A 134 16.057 26.202 -7.329 1.00 0.86 H new ATOM 2049 N SER A 135 20.812 26.934 -8.060 1.00 0.54 N ATOM 2050 CA SER A 135 22.254 27.083 -7.989 1.00 0.57 C ATOM 2051 C SER A 135 22.704 28.322 -8.752 1.00 0.46 C ATOM 2052 O SER A 135 23.854 28.743 -8.646 1.00 0.44 O ATOM 2053 CB SER A 135 22.961 25.831 -8.513 1.00 0.72 C ATOM 2054 OG SER A 135 22.530 25.475 -9.813 1.00 1.10 O ATOM 0 H SER A 135 20.487 26.263 -8.756 1.00 0.54 H new ATOM 0 HA SER A 135 22.531 27.209 -6.942 1.00 0.57 H new ATOM 0 HB2 SER A 135 24.037 26.002 -8.524 1.00 0.72 H new ATOM 0 HB3 SER A 135 22.777 25.000 -7.831 1.00 0.72 H new ATOM 0 HG SER A 135 21.857 26.117 -10.122 1.00 1.10 H new ATOM 2060 N LEU A 136 21.784 28.900 -9.520 1.00 0.45 N ATOM 2061 CA LEU A 136 22.032 30.157 -10.211 1.00 0.43 C ATOM 2062 C LEU A 136 21.997 31.343 -9.255 1.00 0.47 C ATOM 2063 O LEU A 136 21.160 32.227 -9.388 1.00 0.53 O ATOM 2064 CB LEU A 136 21.046 30.367 -11.357 1.00 0.48 C ATOM 2065 CG LEU A 136 21.343 29.553 -12.617 1.00 0.81 C ATOM 2066 CD1 LEU A 136 20.311 29.852 -13.692 1.00 1.46 C ATOM 2067 CD2 LEU A 136 22.752 29.849 -13.128 1.00 1.24 C ATOM 0 H LEU A 136 20.854 28.512 -9.679 1.00 0.45 H new ATOM 0 HA LEU A 136 23.036 30.094 -10.631 1.00 0.43 H new ATOM 0 HB2 LEU A 136 20.045 30.115 -11.007 1.00 0.48 H new ATOM 0 HB3 LEU A 136 21.036 31.425 -11.619 1.00 0.48 H new ATOM 0 HG LEU A 136 21.287 28.494 -12.367 1.00 0.81 H new ATOM 0 HD11 LEU A 136 20.534 29.266 -14.584 1.00 1.46 H new ATOM 0 HD12 LEU A 136 19.318 29.591 -13.326 1.00 1.46 H new ATOM 0 HD13 LEU A 136 20.340 30.913 -13.939 1.00 1.46 H new ATOM 0 HD21 LEU A 136 22.945 29.260 -14.025 1.00 1.24 H new ATOM 0 HD22 LEU A 136 22.838 30.910 -13.364 1.00 1.24 H new ATOM 0 HD23 LEU A 136 23.480 29.588 -12.360 1.00 1.24 H new ATOM 2079 N VAL A 137 22.873 31.313 -8.257 1.00 0.49 N ATOM 2080 CA VAL A 137 23.014 32.405 -7.295 1.00 0.60 C ATOM 2081 C VAL A 137 23.035 33.763 -8.001 1.00 0.65 C ATOM 2082 O VAL A 137 22.403 34.723 -7.556 1.00 0.77 O ATOM 2083 CB VAL A 137 24.315 32.240 -6.471 1.00 0.63 C ATOM 2084 CG1 VAL A 137 24.563 33.447 -5.577 1.00 0.82 C ATOM 2085 CG2 VAL A 137 24.269 30.966 -5.641 1.00 0.59 C ATOM 0 H VAL A 137 23.507 30.531 -8.090 1.00 0.49 H new ATOM 0 HA VAL A 137 22.153 32.367 -6.628 1.00 0.60 H new ATOM 0 HB VAL A 137 25.144 32.167 -7.175 1.00 0.63 H new ATOM 0 HG11 VAL A 137 25.484 33.299 -5.013 1.00 0.82 H new ATOM 0 HG12 VAL A 137 24.654 34.342 -6.192 1.00 0.82 H new ATOM 0 HG13 VAL A 137 23.729 33.565 -4.886 1.00 0.82 H new ATOM 0 HG21 VAL A 137 25.193 30.870 -5.070 1.00 0.59 H new ATOM 0 HG22 VAL A 137 23.422 31.008 -4.956 1.00 0.59 H new ATOM 0 HG23 VAL A 137 24.159 30.106 -6.301 1.00 0.59 H new ATOM 2095 N ASN A 138 23.739 33.819 -9.120 1.00 0.59 N ATOM 2096 CA ASN A 138 23.883 35.054 -9.880 1.00 0.66 C ATOM 2097 C ASN A 138 22.804 35.188 -10.954 1.00 0.58 C ATOM 2098 O ASN A 138 23.050 35.746 -12.020 1.00 0.60 O ATOM 2099 CB ASN A 138 25.268 35.124 -10.517 1.00 0.76 C ATOM 2100 CG ASN A 138 26.368 35.282 -9.490 1.00 1.36 C ATOM 2101 OD1 ASN A 138 26.945 34.304 -9.022 1.00 2.08 O ATOM 2102 ND2 ASN A 138 26.654 36.518 -9.119 1.00 2.17 N ATOM 0 H ASN A 138 24.223 33.018 -9.526 1.00 0.59 H new ATOM 0 HA ASN A 138 23.764 35.884 -9.184 1.00 0.66 H new ATOM 0 HB2 ASN A 138 25.444 34.218 -11.098 1.00 0.76 H new ATOM 0 HB3 ASN A 138 25.302 35.961 -11.214 1.00 0.76 H new ATOM 0 HD21 ASN A 138 27.377 36.686 -8.420 1.00 2.17 H new ATOM 0 HD22 ASN A 138 26.151 37.304 -9.532 1.00 2.17 H new ATOM 2109 N LYS A 139 21.601 34.692 -10.660 1.00 0.55 N ATOM 2110 CA LYS A 139 20.465 34.795 -11.586 1.00 0.56 C ATOM 2111 C LYS A 139 20.068 36.260 -11.801 1.00 0.66 C ATOM 2112 O LYS A 139 19.281 36.588 -12.689 1.00 0.76 O ATOM 2113 CB LYS A 139 19.262 33.994 -11.049 1.00 0.62 C ATOM 2114 CG LYS A 139 18.627 34.595 -9.801 1.00 0.75 C ATOM 2115 CD LYS A 139 18.514 33.583 -8.665 1.00 0.96 C ATOM 2116 CE LYS A 139 17.476 32.504 -8.937 1.00 0.74 C ATOM 2117 NZ LYS A 139 17.257 31.635 -7.747 1.00 1.39 N ATOM 0 H LYS A 139 21.385 34.213 -9.786 1.00 0.55 H new ATOM 0 HA LYS A 139 20.769 34.376 -12.545 1.00 0.56 H new ATOM 0 HB2 LYS A 139 18.506 33.924 -11.831 1.00 0.62 H new ATOM 0 HB3 LYS A 139 19.585 32.977 -10.826 1.00 0.62 H new ATOM 0 HG2 LYS A 139 19.220 35.447 -9.468 1.00 0.75 H new ATOM 0 HG3 LYS A 139 17.635 34.974 -10.047 1.00 0.75 H new ATOM 0 HD2 LYS A 139 19.485 33.114 -8.504 1.00 0.96 H new ATOM 0 HD3 LYS A 139 18.256 34.105 -7.744 1.00 0.96 H new ATOM 0 HE2 LYS A 139 16.534 32.970 -9.225 1.00 0.74 H new ATOM 0 HE3 LYS A 139 17.799 31.892 -9.779 1.00 0.74 H new ATOM 0 HZ1 LYS A 139 17.339 30.637 -8.026 1.00 1.39 H new ATOM 0 HZ2 LYS A 139 17.971 31.852 -7.023 1.00 1.39 H new ATOM 0 HZ3 LYS A 139 16.307 31.809 -7.360 1.00 1.39 H new ATOM 2131 N ARG A 140 20.624 37.131 -10.969 1.00 0.73 N ATOM 2132 CA ARG A 140 20.382 38.568 -11.048 1.00 0.87 C ATOM 2133 C ARG A 140 21.365 39.233 -12.013 1.00 0.86 C ATOM 2134 O ARG A 140 21.111 40.318 -12.533 1.00 1.01 O ATOM 2135 CB ARG A 140 20.588 39.194 -9.672 1.00 1.03 C ATOM 2136 CG ARG A 140 22.027 39.089 -9.219 1.00 1.11 C ATOM 2137 CD ARG A 140 22.296 39.857 -7.953 1.00 1.39 C ATOM 2138 NE ARG A 140 23.711 39.793 -7.620 1.00 1.65 N ATOM 2139 CZ ARG A 140 24.254 40.338 -6.542 1.00 2.04 C ATOM 2140 NH1 ARG A 140 23.506 41.023 -5.682 1.00 2.31 N ATOM 2141 NH2 ARG A 140 25.555 40.217 -6.337 1.00 2.46 N ATOM 0 H ARG A 140 21.258 36.861 -10.217 1.00 0.73 H new ATOM 0 HA ARG A 140 19.361 38.719 -11.400 1.00 0.87 H new ATOM 0 HB2 ARG A 140 20.291 40.242 -9.701 1.00 1.03 H new ATOM 0 HB3 ARG A 140 19.941 38.700 -8.947 1.00 1.03 H new ATOM 0 HG2 ARG A 140 22.279 38.040 -9.063 1.00 1.11 H new ATOM 0 HG3 ARG A 140 22.680 39.459 -10.009 1.00 1.11 H new ATOM 0 HD2 ARG A 140 21.990 40.896 -8.077 1.00 1.39 H new ATOM 0 HD3 ARG A 140 21.703 39.446 -7.136 1.00 1.39 H new ATOM 0 HE ARG A 140 24.327 39.294 -8.261 1.00 1.65 H new ATOM 0 HH11 ARG A 140 22.506 41.132 -5.850 1.00 2.31 H new ATOM 0 HH12 ARG A 140 23.932 41.439 -4.854 1.00 2.31 H new ATOM 0 HH21 ARG A 140 26.132 39.707 -7.006 1.00 2.46 H new ATOM 0 HH22 ARG A 140 25.982 40.634 -5.510 1.00 2.46 H new ATOM 2155 N ASP A 141 22.487 38.565 -12.234 1.00 0.73 N ATOM 2156 CA ASP A 141 23.632 39.167 -12.898 1.00 0.75 C ATOM 2157 C ASP A 141 23.611 38.914 -14.392 1.00 0.72 C ATOM 2158 O ASP A 141 22.896 38.035 -14.880 1.00 0.75 O ATOM 2159 CB ASP A 141 24.924 38.605 -12.289 1.00 0.74 C ATOM 2160 CG ASP A 141 25.258 39.227 -10.944 1.00 1.24 C ATOM 2161 OD1 ASP A 141 25.059 38.558 -9.903 1.00 1.89 O ATOM 2162 OD2 ASP A 141 25.718 40.387 -10.921 1.00 1.57 O ATOM 0 H ASP A 141 22.629 37.593 -11.959 1.00 0.73 H new ATOM 0 HA ASP A 141 23.586 40.246 -12.747 1.00 0.75 H new ATOM 0 HB2 ASP A 141 24.826 37.526 -12.171 1.00 0.74 H new ATOM 0 HB3 ASP A 141 25.750 38.776 -12.979 1.00 0.74 H new ATOM 2167 N LEU A 142 24.389 39.704 -15.122 1.00 0.85 N ATOM 2168 CA LEU A 142 24.582 39.475 -16.543 1.00 0.92 C ATOM 2169 C LEU A 142 25.726 38.506 -16.742 1.00 0.80 C ATOM 2170 O LEU A 142 26.897 38.886 -16.734 1.00 1.03 O ATOM 2171 CB LEU A 142 24.856 40.777 -17.290 1.00 1.16 C ATOM 2172 CG LEU A 142 23.707 41.779 -17.298 1.00 2.05 C ATOM 2173 CD1 LEU A 142 24.107 43.013 -18.077 1.00 2.56 C ATOM 2174 CD2 LEU A 142 22.452 41.158 -17.895 1.00 2.88 C ATOM 0 H LEU A 142 24.895 40.508 -14.751 1.00 0.85 H new ATOM 0 HA LEU A 142 23.664 39.052 -16.951 1.00 0.92 H new ATOM 0 HB2 LEU A 142 25.729 41.254 -16.846 1.00 1.16 H new ATOM 0 HB3 LEU A 142 25.114 40.537 -18.321 1.00 1.16 H new ATOM 0 HG LEU A 142 23.486 42.064 -16.269 1.00 2.05 H new ATOM 0 HD11 LEU A 142 23.282 43.725 -18.079 1.00 2.56 H new ATOM 0 HD12 LEU A 142 24.980 43.470 -17.611 1.00 2.56 H new ATOM 0 HD13 LEU A 142 24.348 42.734 -19.103 1.00 2.56 H new ATOM 0 HD21 LEU A 142 21.646 41.891 -17.890 1.00 2.88 H new ATOM 0 HD22 LEU A 142 22.653 40.846 -18.920 1.00 2.88 H new ATOM 0 HD23 LEU A 142 22.158 40.291 -17.303 1.00 2.88 H new ATOM 2186 N LEU A 143 25.368 37.251 -16.893 1.00 0.90 N ATOM 2187 CA LEU A 143 26.337 36.179 -17.018 1.00 0.81 C ATOM 2188 C LEU A 143 26.224 35.567 -18.407 1.00 0.88 C ATOM 2189 O LEU A 143 25.245 34.886 -18.712 1.00 0.97 O ATOM 2190 CB LEU A 143 26.074 35.132 -15.929 1.00 0.70 C ATOM 2191 CG LEU A 143 27.251 34.216 -15.579 1.00 0.60 C ATOM 2192 CD1 LEU A 143 28.446 35.039 -15.127 1.00 0.65 C ATOM 2193 CD2 LEU A 143 26.848 33.233 -14.490 1.00 0.58 C ATOM 0 H LEU A 143 24.397 36.942 -16.933 1.00 0.90 H new ATOM 0 HA LEU A 143 27.349 36.562 -16.889 1.00 0.81 H new ATOM 0 HB2 LEU A 143 25.761 35.650 -15.023 1.00 0.70 H new ATOM 0 HB3 LEU A 143 25.237 34.510 -16.246 1.00 0.70 H new ATOM 0 HG LEU A 143 27.532 33.655 -16.471 1.00 0.60 H new ATOM 0 HD11 LEU A 143 29.274 34.374 -14.882 1.00 0.65 H new ATOM 0 HD12 LEU A 143 28.747 35.714 -15.928 1.00 0.65 H new ATOM 0 HD13 LEU A 143 28.175 35.621 -14.246 1.00 0.65 H new ATOM 0 HD21 LEU A 143 27.694 32.588 -14.251 1.00 0.58 H new ATOM 0 HD22 LEU A 143 26.547 33.782 -13.598 1.00 0.58 H new ATOM 0 HD23 LEU A 143 26.015 32.624 -14.840 1.00 0.58 H new ATOM 2205 N GLN A 144 27.203 35.834 -19.259 1.00 0.90 N ATOM 2206 CA GLN A 144 27.130 35.400 -20.647 1.00 1.00 C ATOM 2207 C GLN A 144 28.309 34.511 -21.015 1.00 0.92 C ATOM 2208 O GLN A 144 29.148 34.186 -20.174 1.00 0.84 O ATOM 2209 CB GLN A 144 27.060 36.606 -21.588 1.00 1.21 C ATOM 2210 CG GLN A 144 28.165 37.631 -21.382 1.00 1.27 C ATOM 2211 CD GLN A 144 28.072 38.778 -22.370 1.00 1.47 C ATOM 2212 OE1 GLN A 144 27.376 39.762 -22.132 1.00 1.71 O ATOM 2213 NE2 GLN A 144 28.784 38.669 -23.482 1.00 1.77 N ATOM 0 H GLN A 144 28.052 36.345 -19.017 1.00 0.90 H new ATOM 0 HA GLN A 144 26.218 34.813 -20.760 1.00 1.00 H new ATOM 0 HB2 GLN A 144 27.099 36.250 -22.618 1.00 1.21 H new ATOM 0 HB3 GLN A 144 26.096 37.098 -21.457 1.00 1.21 H new ATOM 0 HG2 GLN A 144 28.110 38.023 -20.366 1.00 1.27 H new ATOM 0 HG3 GLN A 144 29.135 37.143 -21.484 1.00 1.27 H new ATOM 0 HE21 GLN A 144 29.351 37.837 -23.645 1.00 1.77 H new ATOM 0 HE22 GLN A 144 28.766 39.417 -24.175 1.00 1.77 H new ATOM 2222 N LYS A 145 28.352 34.113 -22.281 1.00 0.97 N ATOM 2223 CA LYS A 145 29.401 33.238 -22.782 1.00 0.98 C ATOM 2224 C LYS A 145 30.768 33.877 -22.597 1.00 1.01 C ATOM 2225 O LYS A 145 31.040 34.955 -23.125 1.00 1.11 O ATOM 2226 CB LYS A 145 29.161 32.919 -24.261 1.00 1.06 C ATOM 2227 CG LYS A 145 30.258 32.080 -24.895 1.00 1.17 C ATOM 2228 CD LYS A 145 30.002 31.841 -26.376 1.00 1.25 C ATOM 2229 CE LYS A 145 31.101 30.994 -26.992 1.00 1.41 C ATOM 2230 NZ LYS A 145 30.905 30.781 -28.449 1.00 1.43 N ATOM 0 H LYS A 145 27.665 34.386 -22.984 1.00 0.97 H new ATOM 0 HA LYS A 145 29.376 32.309 -22.212 1.00 0.98 H new ATOM 0 HB2 LYS A 145 28.212 32.393 -24.360 1.00 1.06 H new ATOM 0 HB3 LYS A 145 29.066 33.854 -24.814 1.00 1.06 H new ATOM 0 HG2 LYS A 145 31.218 32.581 -24.768 1.00 1.17 H new ATOM 0 HG3 LYS A 145 30.327 31.122 -24.379 1.00 1.17 H new ATOM 0 HD2 LYS A 145 29.040 31.345 -26.506 1.00 1.25 H new ATOM 0 HD3 LYS A 145 29.941 32.797 -26.896 1.00 1.25 H new ATOM 0 HE2 LYS A 145 32.064 31.476 -26.825 1.00 1.41 H new ATOM 0 HE3 LYS A 145 31.137 30.028 -26.488 1.00 1.41 H new ATOM 0 HZ1 LYS A 145 31.681 30.197 -28.822 1.00 1.43 H new ATOM 0 HZ2 LYS A 145 29.999 30.297 -28.610 1.00 1.43 H new ATOM 0 HZ3 LYS A 145 30.898 31.700 -28.936 1.00 1.43 H new ATOM 2244 N GLY A 146 31.621 33.209 -21.836 1.00 0.97 N ATOM 2245 CA GLY A 146 32.953 33.721 -21.600 1.00 1.06 C ATOM 2246 C GLY A 146 33.151 34.218 -20.183 1.00 1.00 C ATOM 2247 O GLY A 146 34.254 34.623 -19.812 1.00 1.07 O ATOM 0 H GLY A 146 31.414 32.321 -21.378 1.00 0.97 H new ATOM 0 HA2 GLY A 146 33.681 32.937 -21.810 1.00 1.06 H new ATOM 0 HA3 GLY A 146 33.152 34.535 -22.296 1.00 1.06 H new ATOM 2251 N ASP A 147 32.088 34.190 -19.386 1.00 0.90 N ATOM 2252 CA ASP A 147 32.191 34.573 -17.983 1.00 0.87 C ATOM 2253 C ASP A 147 32.531 33.368 -17.122 1.00 0.72 C ATOM 2254 O ASP A 147 31.980 32.282 -17.312 1.00 0.63 O ATOM 2255 CB ASP A 147 30.902 35.227 -17.488 1.00 0.89 C ATOM 2256 CG ASP A 147 30.735 36.645 -17.997 1.00 1.35 C ATOM 2257 OD1 ASP A 147 29.650 36.959 -18.537 1.00 1.94 O ATOM 2258 OD2 ASP A 147 31.684 37.449 -17.884 1.00 1.60 O ATOM 0 H ASP A 147 31.154 33.909 -19.684 1.00 0.90 H new ATOM 0 HA ASP A 147 32.995 35.304 -17.900 1.00 0.87 H new ATOM 0 HB2 ASP A 147 30.049 34.628 -17.807 1.00 0.89 H new ATOM 0 HB3 ASP A 147 30.897 35.233 -16.398 1.00 0.89 H new ATOM 2263 N LEU A 148 33.445 33.573 -16.184 1.00 0.75 N ATOM 2264 CA LEU A 148 33.963 32.492 -15.353 1.00 0.66 C ATOM 2265 C LEU A 148 33.057 32.249 -14.153 1.00 0.60 C ATOM 2266 O LEU A 148 32.564 33.194 -13.530 1.00 0.63 O ATOM 2267 CB LEU A 148 35.391 32.813 -14.867 1.00 0.75 C ATOM 2268 CG LEU A 148 36.459 33.007 -15.956 1.00 0.93 C ATOM 2269 CD1 LEU A 148 36.419 31.883 -16.980 1.00 1.46 C ATOM 2270 CD2 LEU A 148 36.318 34.361 -16.635 1.00 1.79 C ATOM 0 H LEU A 148 33.847 34.487 -15.977 1.00 0.75 H new ATOM 0 HA LEU A 148 33.990 31.589 -15.963 1.00 0.66 H new ATOM 0 HB2 LEU A 148 35.350 33.720 -14.264 1.00 0.75 H new ATOM 0 HB3 LEU A 148 35.717 32.007 -14.209 1.00 0.75 H new ATOM 0 HG LEU A 148 37.431 32.977 -15.464 1.00 0.93 H new ATOM 0 HD11 LEU A 148 37.187 32.051 -17.735 1.00 1.46 H new ATOM 0 HD12 LEU A 148 36.602 30.931 -16.482 1.00 1.46 H new ATOM 0 HD13 LEU A 148 35.439 31.860 -17.457 1.00 1.46 H new ATOM 0 HD21 LEU A 148 37.088 34.467 -17.399 1.00 1.79 H new ATOM 0 HD22 LEU A 148 35.334 34.435 -17.098 1.00 1.79 H new ATOM 0 HD23 LEU A 148 36.431 35.153 -15.895 1.00 1.79 H new ATOM 2282 N VAL A 149 32.845 30.984 -13.821 1.00 0.53 N ATOM 2283 CA VAL A 149 31.997 30.624 -12.695 1.00 0.48 C ATOM 2284 C VAL A 149 32.656 29.569 -11.816 1.00 0.46 C ATOM 2285 O VAL A 149 33.324 28.656 -12.306 1.00 0.49 O ATOM 2286 CB VAL A 149 30.617 30.096 -13.148 1.00 0.50 C ATOM 2287 CG1 VAL A 149 29.765 31.220 -13.714 1.00 1.16 C ATOM 2288 CG2 VAL A 149 30.775 28.983 -14.170 1.00 1.10 C ATOM 0 H VAL A 149 33.249 30.189 -14.316 1.00 0.53 H new ATOM 0 HA VAL A 149 31.854 31.541 -12.124 1.00 0.48 H new ATOM 0 HB VAL A 149 30.109 29.690 -12.273 1.00 0.50 H new ATOM 0 HG11 VAL A 149 28.799 30.823 -14.026 1.00 1.16 H new ATOM 0 HG12 VAL A 149 29.614 31.983 -12.950 1.00 1.16 H new ATOM 0 HG13 VAL A 149 30.270 31.662 -14.573 1.00 1.16 H new ATOM 0 HG21 VAL A 149 29.791 28.626 -14.475 1.00 1.10 H new ATOM 0 HG22 VAL A 149 31.309 29.362 -15.041 1.00 1.10 H new ATOM 0 HG23 VAL A 149 31.338 28.161 -13.728 1.00 1.10 H new ATOM 2298 N SER A 150 32.470 29.710 -10.514 1.00 0.46 N ATOM 2299 CA SER A 150 32.904 28.700 -9.569 1.00 0.47 C ATOM 2300 C SER A 150 31.683 27.946 -9.063 1.00 0.41 C ATOM 2301 O SER A 150 30.743 28.554 -8.548 1.00 0.49 O ATOM 2302 CB SER A 150 33.661 29.336 -8.399 1.00 0.59 C ATOM 2303 OG SER A 150 32.845 30.267 -7.712 1.00 1.44 O ATOM 0 H SER A 150 32.019 30.519 -10.088 1.00 0.46 H new ATOM 0 HA SER A 150 33.585 28.009 -10.067 1.00 0.47 H new ATOM 0 HB2 SER A 150 33.992 28.559 -7.710 1.00 0.59 H new ATOM 0 HB3 SER A 150 34.556 29.836 -8.769 1.00 0.59 H new ATOM 0 HG SER A 150 31.927 29.927 -7.667 1.00 1.44 H new ATOM 2309 N PHE A 151 31.688 26.639 -9.230 1.00 0.34 N ATOM 2310 CA PHE A 151 30.558 25.814 -8.842 1.00 0.34 C ATOM 2311 C PHE A 151 31.060 24.527 -8.212 1.00 0.41 C ATOM 2312 O PHE A 151 32.239 24.179 -8.343 1.00 0.49 O ATOM 2313 CB PHE A 151 29.690 25.498 -10.068 1.00 0.30 C ATOM 2314 CG PHE A 151 30.466 24.905 -11.211 1.00 0.35 C ATOM 2315 CD1 PHE A 151 30.968 25.715 -12.218 1.00 0.39 C ATOM 2316 CD2 PHE A 151 30.713 23.542 -11.267 1.00 0.47 C ATOM 2317 CE1 PHE A 151 31.704 25.177 -13.254 1.00 0.53 C ATOM 2318 CE2 PHE A 151 31.443 23.000 -12.305 1.00 0.59 C ATOM 2319 CZ PHE A 151 31.941 23.821 -13.296 1.00 0.61 C ATOM 0 H PHE A 151 32.468 26.121 -9.635 1.00 0.34 H new ATOM 0 HA PHE A 151 29.952 26.355 -8.116 1.00 0.34 H new ATOM 0 HB2 PHE A 151 28.900 24.805 -9.776 1.00 0.30 H new ATOM 0 HB3 PHE A 151 29.203 26.413 -10.405 1.00 0.30 H new ATOM 0 HD1 PHE A 151 30.781 26.778 -12.191 1.00 0.39 H new ATOM 0 HD2 PHE A 151 30.330 22.897 -10.490 1.00 0.47 H new ATOM 0 HE1 PHE A 151 32.094 25.818 -14.031 1.00 0.53 H new ATOM 0 HE2 PHE A 151 31.624 21.936 -12.342 1.00 0.59 H new ATOM 0 HZ PHE A 151 32.518 23.399 -14.106 1.00 0.61 H new ATOM 2329 N ARG A 152 30.185 23.813 -7.522 1.00 0.44 N ATOM 2330 CA ARG A 152 30.574 22.541 -6.959 1.00 0.51 C ATOM 2331 C ARG A 152 29.647 21.444 -7.455 1.00 0.50 C ATOM 2332 O ARG A 152 28.438 21.487 -7.236 1.00 0.54 O ATOM 2333 CB ARG A 152 30.536 22.591 -5.423 1.00 0.69 C ATOM 2334 CG ARG A 152 31.528 23.564 -4.788 1.00 0.94 C ATOM 2335 CD ARG A 152 31.066 25.013 -4.892 1.00 1.05 C ATOM 2336 NE ARG A 152 32.053 25.948 -4.339 1.00 1.29 N ATOM 2337 CZ ARG A 152 31.879 27.271 -4.258 1.00 1.57 C ATOM 2338 NH1 ARG A 152 30.766 27.837 -4.717 1.00 2.03 N ATOM 2339 NH2 ARG A 152 32.825 28.029 -3.713 1.00 2.20 N ATOM 0 H ARG A 152 29.220 24.090 -7.343 1.00 0.44 H new ATOM 0 HA ARG A 152 31.594 22.325 -7.278 1.00 0.51 H new ATOM 0 HB2 ARG A 152 29.529 22.864 -5.107 1.00 0.69 H new ATOM 0 HB3 ARG A 152 30.732 21.591 -5.036 1.00 0.69 H new ATOM 0 HG2 ARG A 152 31.667 23.304 -3.739 1.00 0.94 H new ATOM 0 HG3 ARG A 152 32.498 23.459 -5.274 1.00 0.94 H new ATOM 0 HD2 ARG A 152 30.880 25.260 -5.937 1.00 1.05 H new ATOM 0 HD3 ARG A 152 30.120 25.130 -4.363 1.00 1.05 H new ATOM 0 HE ARG A 152 32.931 25.562 -3.993 1.00 1.29 H new ATOM 0 HH11 ARG A 152 30.036 27.261 -5.135 1.00 2.03 H new ATOM 0 HH12 ARG A 152 30.643 28.847 -4.651 1.00 2.03 H new ATOM 0 HH21 ARG A 152 33.680 27.601 -3.358 1.00 2.20 H new ATOM 0 HH22 ARG A 152 32.696 29.039 -3.649 1.00 2.20 H new ATOM 2353 N ILE A 153 30.227 20.476 -8.139 1.00 0.51 N ATOM 2354 CA ILE A 153 29.530 19.255 -8.502 1.00 0.56 C ATOM 2355 C ILE A 153 29.945 18.132 -7.560 1.00 0.65 C ATOM 2356 O ILE A 153 31.122 18.013 -7.229 1.00 0.75 O ATOM 2357 CB ILE A 153 29.799 18.857 -9.976 1.00 0.58 C ATOM 2358 CG1 ILE A 153 29.211 17.476 -10.290 1.00 1.23 C ATOM 2359 CG2 ILE A 153 31.287 18.888 -10.287 1.00 0.93 C ATOM 2360 CD1 ILE A 153 29.456 17.022 -11.717 1.00 1.24 C ATOM 0 H ILE A 153 31.195 20.513 -8.459 1.00 0.51 H new ATOM 0 HA ILE A 153 28.459 19.432 -8.407 1.00 0.56 H new ATOM 0 HB ILE A 153 29.303 19.590 -10.613 1.00 0.58 H new ATOM 0 HG12 ILE A 153 29.640 16.744 -9.606 1.00 1.23 H new ATOM 0 HG13 ILE A 153 28.137 17.496 -10.103 1.00 1.23 H new ATOM 0 HG21 ILE A 153 31.447 18.605 -11.327 1.00 0.93 H new ATOM 0 HG22 ILE A 153 31.672 19.894 -10.121 1.00 0.93 H new ATOM 0 HG23 ILE A 153 31.810 18.187 -9.636 1.00 0.93 H new ATOM 0 HD11 ILE A 153 29.012 16.038 -11.867 1.00 1.24 H new ATOM 0 HD12 ILE A 153 29.003 17.733 -12.408 1.00 1.24 H new ATOM 0 HD13 ILE A 153 30.529 16.969 -11.903 1.00 1.24 H new ATOM 2372 N ASP A 154 28.994 17.327 -7.109 1.00 0.71 N ATOM 2373 CA ASP A 154 29.321 16.167 -6.293 1.00 0.82 C ATOM 2374 C ASP A 154 28.157 15.177 -6.269 1.00 0.96 C ATOM 2375 O ASP A 154 27.949 14.445 -7.233 1.00 1.09 O ATOM 2376 CB ASP A 154 29.753 16.604 -4.878 1.00 0.84 C ATOM 2377 CG ASP A 154 29.935 15.450 -3.910 1.00 1.45 C ATOM 2378 OD1 ASP A 154 30.911 14.682 -4.062 1.00 1.92 O ATOM 2379 OD2 ASP A 154 29.108 15.318 -2.985 1.00 1.73 O ATOM 0 H ASP A 154 27.999 17.454 -7.292 1.00 0.71 H new ATOM 0 HA ASP A 154 30.169 15.648 -6.740 1.00 0.82 H new ATOM 0 HB2 ASP A 154 30.689 17.158 -4.949 1.00 0.84 H new ATOM 0 HB3 ASP A 154 29.007 17.289 -4.476 1.00 0.84 H new ATOM 2384 N GLU A 155 27.357 15.203 -5.218 1.00 1.00 N ATOM 2385 CA GLU A 155 26.276 14.236 -5.058 1.00 1.17 C ATOM 2386 C GLU A 155 25.039 14.664 -5.836 1.00 1.23 C ATOM 2387 O GLU A 155 24.060 13.927 -5.931 1.00 1.46 O ATOM 2388 CB GLU A 155 25.941 14.050 -3.577 1.00 1.25 C ATOM 2389 CG GLU A 155 25.683 15.354 -2.840 1.00 1.32 C ATOM 2390 CD GLU A 155 25.233 15.136 -1.412 1.00 2.00 C ATOM 2391 OE1 GLU A 155 24.043 14.813 -1.208 1.00 2.28 O ATOM 2392 OE2 GLU A 155 26.059 15.288 -0.491 1.00 2.76 O ATOM 0 H GLU A 155 27.432 15.882 -4.460 1.00 1.00 H new ATOM 0 HA GLU A 155 26.613 13.281 -5.462 1.00 1.17 H new ATOM 0 HB2 GLU A 155 25.060 13.414 -3.490 1.00 1.25 H new ATOM 0 HB3 GLU A 155 26.763 13.525 -3.091 1.00 1.25 H new ATOM 0 HG2 GLU A 155 26.593 15.955 -2.843 1.00 1.32 H new ATOM 0 HG3 GLU A 155 24.923 15.924 -3.374 1.00 1.32 H new ATOM 2399 N SER A 156 25.086 15.863 -6.385 1.00 1.10 N ATOM 2400 CA SER A 156 24.001 16.346 -7.213 1.00 1.19 C ATOM 2401 C SER A 156 24.291 16.033 -8.678 1.00 1.14 C ATOM 2402 O SER A 156 23.392 16.041 -9.514 1.00 1.27 O ATOM 2403 CB SER A 156 23.812 17.849 -7.003 1.00 1.17 C ATOM 2404 OG SER A 156 22.719 18.346 -7.750 1.00 1.98 O ATOM 0 H SER A 156 25.861 16.517 -6.273 1.00 1.10 H new ATOM 0 HA SER A 156 23.077 15.843 -6.929 1.00 1.19 H new ATOM 0 HB2 SER A 156 23.652 18.052 -5.944 1.00 1.17 H new ATOM 0 HB3 SER A 156 24.721 18.375 -7.294 1.00 1.17 H new ATOM 0 HG SER A 156 22.625 19.309 -7.592 1.00 1.98 H new ATOM 2410 N GLY A 157 25.558 15.734 -8.974 1.00 1.04 N ATOM 2411 CA GLY A 157 25.955 15.377 -10.335 1.00 1.09 C ATOM 2412 C GLY A 157 25.776 16.501 -11.346 1.00 1.02 C ATOM 2413 O GLY A 157 25.808 16.266 -12.556 1.00 1.27 O ATOM 0 H GLY A 157 26.319 15.732 -8.295 1.00 1.04 H new ATOM 0 HA2 GLY A 157 27.001 15.070 -10.329 1.00 1.09 H new ATOM 0 HA3 GLY A 157 25.372 14.515 -10.658 1.00 1.09 H new ATOM 2417 N ARG A 158 25.602 17.719 -10.853 1.00 0.79 N ATOM 2418 CA ARG A 158 25.410 18.885 -11.707 1.00 0.72 C ATOM 2419 C ARG A 158 26.180 20.071 -11.142 1.00 0.56 C ATOM 2420 O ARG A 158 26.866 19.945 -10.128 1.00 0.57 O ATOM 2421 CB ARG A 158 23.923 19.256 -11.824 1.00 0.85 C ATOM 2422 CG ARG A 158 23.098 18.314 -12.691 1.00 1.47 C ATOM 2423 CD ARG A 158 23.708 18.154 -14.074 1.00 1.52 C ATOM 2424 NE ARG A 158 22.730 17.726 -15.072 1.00 2.12 N ATOM 2425 CZ ARG A 158 22.896 16.701 -15.903 1.00 2.75 C ATOM 2426 NH1 ARG A 158 23.937 15.880 -15.773 1.00 3.00 N ATOM 2427 NH2 ARG A 158 22.005 16.489 -16.858 1.00 3.61 N ATOM 0 H ARG A 158 25.590 17.928 -9.855 1.00 0.79 H new ATOM 0 HA ARG A 158 25.782 18.636 -12.701 1.00 0.72 H new ATOM 0 HB2 ARG A 158 23.489 19.281 -10.824 1.00 0.85 H new ATOM 0 HB3 ARG A 158 23.845 20.264 -12.231 1.00 0.85 H new ATOM 0 HG2 ARG A 158 23.029 17.340 -12.208 1.00 1.47 H new ATOM 0 HG3 ARG A 158 22.082 18.698 -12.782 1.00 1.47 H new ATOM 0 HD2 ARG A 158 24.148 19.101 -14.385 1.00 1.52 H new ATOM 0 HD3 ARG A 158 24.518 17.426 -14.028 1.00 1.52 H new ATOM 0 HE ARG A 158 21.858 18.251 -15.136 1.00 2.12 H new ATOM 0 HH11 ARG A 158 24.618 16.034 -15.030 1.00 3.00 H new ATOM 0 HH12 ARG A 158 24.053 15.097 -16.417 1.00 3.00 H new ATOM 0 HH21 ARG A 158 21.200 17.109 -16.952 1.00 3.61 H new ATOM 0 HH22 ARG A 158 22.123 15.706 -17.501 1.00 3.61 H new ATOM 2441 N ALA A 159 26.053 21.222 -11.789 1.00 0.48 N ATOM 2442 CA ALA A 159 26.719 22.425 -11.320 1.00 0.39 C ATOM 2443 C ALA A 159 25.846 23.142 -10.295 1.00 0.39 C ATOM 2444 O ALA A 159 24.808 23.719 -10.630 1.00 0.48 O ATOM 2445 CB ALA A 159 27.048 23.340 -12.495 1.00 0.37 C ATOM 0 H ALA A 159 25.498 21.346 -12.635 1.00 0.48 H new ATOM 0 HA ALA A 159 27.655 22.147 -10.836 1.00 0.39 H new ATOM 0 HB1 ALA A 159 27.547 24.237 -12.129 1.00 0.37 H new ATOM 0 HB2 ALA A 159 27.705 22.818 -13.190 1.00 0.37 H new ATOM 0 HB3 ALA A 159 26.127 23.620 -13.007 1.00 0.37 H new ATOM 2451 N ALA A 160 26.263 23.084 -9.040 1.00 0.38 N ATOM 2452 CA ALA A 160 25.521 23.698 -7.959 1.00 0.41 C ATOM 2453 C ALA A 160 26.350 24.778 -7.290 1.00 0.41 C ATOM 2454 O ALA A 160 27.581 24.744 -7.344 1.00 0.42 O ATOM 2455 CB ALA A 160 25.091 22.655 -6.943 1.00 0.49 C ATOM 0 H ALA A 160 27.119 22.613 -8.747 1.00 0.38 H new ATOM 0 HA ALA A 160 24.626 24.158 -8.378 1.00 0.41 H new ATOM 0 HB1 ALA A 160 24.535 23.138 -6.139 1.00 0.49 H new ATOM 0 HB2 ALA A 160 24.457 21.914 -7.429 1.00 0.49 H new ATOM 0 HB3 ALA A 160 25.972 22.164 -6.530 1.00 0.49 H new ATOM 2461 N CYS A 161 25.663 25.725 -6.659 1.00 0.47 N ATOM 2462 CA CYS A 161 26.309 26.866 -6.020 1.00 0.51 C ATOM 2463 C CYS A 161 27.165 27.612 -7.042 1.00 0.42 C ATOM 2464 O CYS A 161 28.338 27.905 -6.810 1.00 0.49 O ATOM 2465 CB CYS A 161 27.145 26.406 -4.819 1.00 0.63 C ATOM 2466 SG CYS A 161 27.685 27.741 -3.726 1.00 1.55 S ATOM 0 H CYS A 161 24.646 25.723 -6.576 1.00 0.47 H new ATOM 0 HA CYS A 161 25.546 27.550 -5.647 1.00 0.51 H new ATOM 0 HB2 CYS A 161 26.561 25.692 -4.238 1.00 0.63 H new ATOM 0 HB3 CYS A 161 28.024 25.876 -5.186 1.00 0.63 H new ATOM 0 HG CYS A 161 28.380 27.245 -2.746 1.00 1.55 H new ATOM 2472 N VAL A 162 26.553 27.897 -8.188 1.00 0.37 N ATOM 2473 CA VAL A 162 27.215 28.604 -9.276 1.00 0.35 C ATOM 2474 C VAL A 162 27.407 30.075 -8.922 1.00 0.39 C ATOM 2475 O VAL A 162 26.439 30.831 -8.819 1.00 0.48 O ATOM 2476 CB VAL A 162 26.392 28.501 -10.582 1.00 0.45 C ATOM 2477 CG1 VAL A 162 27.100 29.192 -11.734 1.00 1.15 C ATOM 2478 CG2 VAL A 162 26.110 27.047 -10.928 1.00 1.26 C ATOM 0 H VAL A 162 25.585 27.644 -8.387 1.00 0.37 H new ATOM 0 HA VAL A 162 28.188 28.137 -9.429 1.00 0.35 H new ATOM 0 HB VAL A 162 25.442 29.009 -10.416 1.00 0.45 H new ATOM 0 HG11 VAL A 162 26.497 29.103 -12.638 1.00 1.15 H new ATOM 0 HG12 VAL A 162 27.241 30.246 -11.495 1.00 1.15 H new ATOM 0 HG13 VAL A 162 28.071 28.724 -11.898 1.00 1.15 H new ATOM 0 HG21 VAL A 162 25.530 26.998 -11.850 1.00 1.26 H new ATOM 0 HG22 VAL A 162 27.052 26.516 -11.063 1.00 1.26 H new ATOM 0 HG23 VAL A 162 25.545 26.583 -10.119 1.00 1.26 H new ATOM 2488 N ASN A 163 28.651 30.469 -8.711 1.00 0.43 N ATOM 2489 CA ASN A 163 28.965 31.856 -8.399 1.00 0.53 C ATOM 2490 C ASN A 163 29.842 32.453 -9.491 1.00 0.52 C ATOM 2491 O ASN A 163 30.892 31.896 -9.819 1.00 0.53 O ATOM 2492 CB ASN A 163 29.693 31.968 -7.049 1.00 0.67 C ATOM 2493 CG ASN A 163 28.965 31.292 -5.899 1.00 1.29 C ATOM 2494 OD1 ASN A 163 29.599 30.754 -4.989 1.00 1.96 O ATOM 2495 ND2 ASN A 163 27.642 31.318 -5.920 1.00 2.05 N ATOM 0 H ASN A 163 29.461 29.850 -8.750 1.00 0.43 H new ATOM 0 HA ASN A 163 28.026 32.406 -8.338 1.00 0.53 H new ATOM 0 HB2 ASN A 163 30.686 31.529 -7.145 1.00 0.67 H new ATOM 0 HB3 ASN A 163 29.832 33.022 -6.809 1.00 0.67 H new ATOM 0 HD21 ASN A 163 27.111 30.883 -5.165 1.00 2.05 H new ATOM 0 HD22 ASN A 163 27.153 31.773 -6.691 1.00 2.05 H new ATOM 2502 N ALA A 164 29.397 33.562 -10.074 1.00 0.53 N ATOM 2503 CA ALA A 164 30.194 34.286 -11.060 1.00 0.56 C ATOM 2504 C ALA A 164 31.453 34.849 -10.409 1.00 0.63 C ATOM 2505 O ALA A 164 31.367 35.627 -9.456 1.00 0.75 O ATOM 2506 CB ALA A 164 29.375 35.410 -11.686 1.00 0.60 C ATOM 0 H ALA A 164 28.487 33.980 -9.880 1.00 0.53 H new ATOM 0 HA ALA A 164 30.487 33.591 -11.847 1.00 0.56 H new ATOM 0 HB1 ALA A 164 29.984 35.939 -12.419 1.00 0.60 H new ATOM 0 HB2 ALA A 164 28.498 34.990 -12.179 1.00 0.60 H new ATOM 0 HB3 ALA A 164 29.057 36.105 -10.909 1.00 0.60 H new ATOM 2512 N VAL A 165 32.617 34.460 -10.913 1.00 0.62 N ATOM 2513 CA VAL A 165 33.881 34.870 -10.312 1.00 0.70 C ATOM 2514 C VAL A 165 34.814 35.473 -11.355 1.00 0.71 C ATOM 2515 O VAL A 165 34.878 35.008 -12.489 1.00 0.95 O ATOM 2516 CB VAL A 165 34.588 33.681 -9.612 1.00 1.07 C ATOM 2517 CG1 VAL A 165 35.929 34.098 -9.020 1.00 1.43 C ATOM 2518 CG2 VAL A 165 33.698 33.103 -8.529 1.00 1.56 C ATOM 0 H VAL A 165 32.713 33.863 -11.734 1.00 0.62 H new ATOM 0 HA VAL A 165 33.647 35.627 -9.563 1.00 0.70 H new ATOM 0 HB VAL A 165 34.777 32.917 -10.366 1.00 1.07 H new ATOM 0 HG11 VAL A 165 36.396 33.240 -8.537 1.00 1.43 H new ATOM 0 HG12 VAL A 165 36.579 34.466 -9.814 1.00 1.43 H new ATOM 0 HG13 VAL A 165 35.772 34.887 -8.284 1.00 1.43 H new ATOM 0 HG21 VAL A 165 34.207 32.269 -8.046 1.00 1.56 H new ATOM 0 HG22 VAL A 165 33.479 33.872 -7.789 1.00 1.56 H new ATOM 0 HG23 VAL A 165 32.767 32.751 -8.973 1.00 1.56 H new ATOM 2528 N ARG A 166 35.525 36.521 -10.967 1.00 0.84 N ATOM 2529 CA ARG A 166 36.504 37.146 -11.839 1.00 1.15 C ATOM 2530 C ARG A 166 37.906 36.871 -11.324 1.00 1.13 C ATOM 2531 O ARG A 166 38.226 37.200 -10.184 1.00 1.05 O ATOM 2532 CB ARG A 166 36.283 38.662 -11.923 1.00 1.51 C ATOM 2533 CG ARG A 166 35.133 39.077 -12.820 1.00 1.76 C ATOM 2534 CD ARG A 166 33.786 38.880 -12.146 1.00 1.58 C ATOM 2535 NE ARG A 166 33.570 39.818 -11.038 1.00 1.94 N ATOM 2536 CZ ARG A 166 32.991 41.016 -11.172 1.00 2.24 C ATOM 2537 NH1 ARG A 166 32.660 41.473 -12.374 1.00 2.45 N ATOM 2538 NH2 ARG A 166 32.754 41.765 -10.105 1.00 2.94 N ATOM 0 H ARG A 166 35.440 36.957 -10.049 1.00 0.84 H new ATOM 0 HA ARG A 166 36.386 36.722 -12.836 1.00 1.15 H new ATOM 0 HB2 ARG A 166 36.103 39.047 -10.919 1.00 1.51 H new ATOM 0 HB3 ARG A 166 37.198 39.131 -12.285 1.00 1.51 H new ATOM 0 HG2 ARG A 166 35.250 40.125 -13.098 1.00 1.76 H new ATOM 0 HG3 ARG A 166 35.165 38.497 -13.742 1.00 1.76 H new ATOM 0 HD2 ARG A 166 32.993 39.004 -12.883 1.00 1.58 H new ATOM 0 HD3 ARG A 166 33.716 37.859 -11.772 1.00 1.58 H new ATOM 0 HE ARG A 166 33.881 39.539 -10.108 1.00 1.94 H new ATOM 0 HH11 ARG A 166 32.847 40.909 -13.203 1.00 2.45 H new ATOM 0 HH12 ARG A 166 32.219 42.388 -12.468 1.00 2.45 H new ATOM 0 HH21 ARG A 166 33.013 41.428 -9.178 1.00 2.94 H new ATOM 0 HH22 ARG A 166 32.312 42.678 -10.211 1.00 2.94 H new