USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=29 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 40 TYR OH : rot -130:sc= -0.262 USER MOD Set 1.2: A 77 MET CE :methyl 170:sc= -0.58 (180deg=-0.128) USER MOD Set 2.1: A 36 HIS : no HE2:sc= -0.476 K(o=-0.44,f=-2!) USER MOD Set 2.2: A 38 SER OG : rot 180:sc= 0.0354 USER MOD Single : A 8 GLN :FLIP amide:sc= -0.328 F(o=-1.2,f=-0.33) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -176:sc= -0.993 (180deg=-1.02) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN :FLIP amide:sc= -0.0482 F(o=-1.3,f=-0.048) USER MOD Single : A 26 THR OG1 : rot 7:sc= 1.7 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HE2:sc= 0.767 K(o=0.77,f=-2.9!) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 MET CE :methyl -164:sc= -0.0629 (180deg=-0.42) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.411 K(o=-0.41,f=-3.4!) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.0534 F(o=-1.1,f=-0.053) USER MOD Single : A 55 TYR OH : rot 80:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.197 K(o=-0.2,f=-2.7!) USER MOD Single : A 80 LYS NZ :NH3+ -136:sc= -0.693 (180deg=-2.79!) USER MOD Single : A 81 ASN : amide:sc= -0.271 K(o=-0.27,f=-1.2) USER MOD Single : A 82 SER OG : rot -120:sc=-0.00785 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.0489 USER MOD Single : A 92 THR OG1 : rot -164:sc= 1.08 USER MOD Single : A 93 HIS : no HD1:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0487 USER MOD Single : A 124 THR OG1 : rot 22:sc= 1.24 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.454 K(o=-0.45,f=-2.4) USER MOD Single : A 129 HIS :FLIP no HD1:sc= -2 F(o=-3.4!,f=-2) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.0448 USER MOD Single : A 135 SER OG : rot 13:sc= 0.655 USER MOD Single : A 138 ASN : amide:sc= -2.5! C(o=-2.5!,f=-7.4!) USER MOD Single : A 139 LYS NZ :NH3+ 152:sc= 0.769 (180deg=0.172) USER MOD Single : A 144 GLN : amide:sc= 0.776 K(o=0.78,f=0) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot -47:sc= 0.342 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 180:sc= 0 USER MOD Single : A 163 ASN : amide:sc= -0.029 X(o=-0.029,f=0) USER MOD ----------------------------------------------------------------- ATOM 65 N GLN A 8 3.821 10.237 -2.462 1.00 1.20 N ATOM 66 CA GLN A 8 4.957 11.139 -2.421 1.00 1.13 C ATOM 67 C GLN A 8 4.583 12.548 -2.837 1.00 0.98 C ATOM 68 O GLN A 8 4.102 12.781 -3.948 1.00 0.93 O ATOM 69 CB GLN A 8 6.105 10.621 -3.289 1.00 1.19 C ATOM 70 CG GLN A 8 6.812 9.416 -2.689 1.00 1.42 C ATOM 71 CD GLN A 8 7.346 9.697 -1.296 1.00 1.54 C ATOM 72 OE1 GLN A 8 7.733 10.943 -1.039 1.00 2.00 O flip ATOM 73 NE2 GLN A 8 7.422 8.802 -0.457 1.00 1.75 N flip ATOM 0 HA GLN A 8 5.290 11.176 -1.384 1.00 1.13 H new ATOM 0 HB2 GLN A 8 5.717 10.354 -4.272 1.00 1.19 H new ATOM 0 HB3 GLN A 8 6.829 11.422 -3.439 1.00 1.19 H new ATOM 0 HG2 GLN A 8 6.120 8.575 -2.648 1.00 1.42 H new ATOM 0 HG3 GLN A 8 7.636 9.120 -3.339 1.00 1.42 H new ATOM 0 HE21 GLN A 8 7.115 7.857 -0.690 1.00 1.75 H new ATOM 0 HE22 GLN A 8 7.792 9.004 0.472 1.00 1.75 H new ATOM 82 N VAL A 9 4.786 13.476 -1.920 1.00 0.94 N ATOM 83 CA VAL A 9 4.694 14.885 -2.231 1.00 0.81 C ATOM 84 C VAL A 9 6.035 15.337 -2.783 1.00 0.79 C ATOM 85 O VAL A 9 7.058 15.259 -2.101 1.00 0.87 O ATOM 86 CB VAL A 9 4.327 15.726 -0.992 1.00 0.81 C ATOM 87 CG1 VAL A 9 3.993 17.157 -1.387 1.00 1.16 C ATOM 88 CG2 VAL A 9 3.172 15.081 -0.245 1.00 1.27 C ATOM 0 H VAL A 9 5.017 13.274 -0.947 1.00 0.94 H new ATOM 0 HA VAL A 9 3.901 15.032 -2.964 1.00 0.81 H new ATOM 0 HB VAL A 9 5.190 15.760 -0.327 1.00 0.81 H new ATOM 0 HG11 VAL A 9 3.737 17.730 -0.496 1.00 1.16 H new ATOM 0 HG12 VAL A 9 4.856 17.610 -1.875 1.00 1.16 H new ATOM 0 HG13 VAL A 9 3.146 17.157 -2.073 1.00 1.16 H new ATOM 0 HG21 VAL A 9 2.922 15.684 0.628 1.00 1.27 H new ATOM 0 HG22 VAL A 9 2.305 15.016 -0.902 1.00 1.27 H new ATOM 0 HG23 VAL A 9 3.460 14.080 0.076 1.00 1.27 H new ATOM 98 N TYR A 10 6.026 15.789 -4.016 1.00 0.71 N ATOM 99 CA TYR A 10 7.251 16.072 -4.730 1.00 0.71 C ATOM 100 C TYR A 10 7.704 17.489 -4.448 1.00 0.62 C ATOM 101 O TYR A 10 6.895 18.412 -4.389 1.00 0.57 O ATOM 102 CB TYR A 10 7.027 15.857 -6.225 1.00 0.74 C ATOM 103 CG TYR A 10 6.360 14.530 -6.529 1.00 0.83 C ATOM 104 CD1 TYR A 10 6.968 13.330 -6.177 1.00 0.95 C ATOM 105 CD2 TYR A 10 5.124 14.476 -7.163 1.00 0.84 C ATOM 106 CE1 TYR A 10 6.366 12.115 -6.452 1.00 1.04 C ATOM 107 CE2 TYR A 10 4.515 13.265 -7.440 1.00 0.94 C ATOM 108 CZ TYR A 10 5.141 12.089 -7.085 1.00 1.03 C ATOM 109 OH TYR A 10 4.544 10.880 -7.367 1.00 1.14 O ATOM 0 H TYR A 10 5.176 15.970 -4.550 1.00 0.71 H new ATOM 0 HA TYR A 10 8.036 15.395 -4.392 1.00 0.71 H new ATOM 0 HB2 TYR A 10 6.412 16.667 -6.617 1.00 0.74 H new ATOM 0 HB3 TYR A 10 7.985 15.905 -6.743 1.00 0.74 H new ATOM 0 HD1 TYR A 10 7.927 13.347 -5.680 1.00 0.95 H new ATOM 0 HD2 TYR A 10 4.631 15.395 -7.444 1.00 0.84 H new ATOM 0 HE1 TYR A 10 6.853 11.192 -6.173 1.00 1.04 H new ATOM 0 HE2 TYR A 10 3.554 13.241 -7.932 1.00 0.94 H new ATOM 0 HH TYR A 10 3.685 11.035 -7.813 1.00 1.14 H new ATOM 119 N ARG A 11 8.997 17.643 -4.251 1.00 0.66 N ATOM 120 CA ARG A 11 9.571 18.933 -3.955 1.00 0.64 C ATOM 121 C ARG A 11 10.319 19.441 -5.175 1.00 0.56 C ATOM 122 O ARG A 11 11.091 18.706 -5.791 1.00 0.66 O ATOM 123 CB ARG A 11 10.506 18.815 -2.749 1.00 0.85 C ATOM 124 CG ARG A 11 10.993 20.149 -2.209 1.00 0.85 C ATOM 125 CD ARG A 11 11.780 19.976 -0.916 1.00 1.11 C ATOM 126 NE ARG A 11 10.978 19.338 0.131 1.00 1.37 N ATOM 127 CZ ARG A 11 11.487 18.786 1.235 1.00 1.76 C ATOM 128 NH1 ARG A 11 12.793 18.843 1.469 1.00 2.15 N ATOM 129 NH2 ARG A 11 10.684 18.194 2.117 1.00 2.31 N ATOM 0 H ARG A 11 9.673 16.881 -4.292 1.00 0.66 H new ATOM 0 HA ARG A 11 8.783 19.644 -3.709 1.00 0.64 H new ATOM 0 HB2 ARG A 11 9.989 18.280 -1.953 1.00 0.85 H new ATOM 0 HB3 ARG A 11 11.369 18.212 -3.030 1.00 0.85 H new ATOM 0 HG2 ARG A 11 11.620 20.637 -2.955 1.00 0.85 H new ATOM 0 HG3 ARG A 11 10.140 20.804 -2.032 1.00 0.85 H new ATOM 0 HD2 ARG A 11 12.668 19.375 -1.110 1.00 1.11 H new ATOM 0 HD3 ARG A 11 12.124 20.950 -0.567 1.00 1.11 H new ATOM 0 HE ARG A 11 9.966 19.314 0.009 1.00 1.37 H new ATOM 0 HH11 ARG A 11 13.410 19.309 0.804 1.00 2.15 H new ATOM 0 HH12 ARG A 11 13.179 18.420 2.313 1.00 2.15 H new ATOM 0 HH21 ARG A 11 9.678 18.162 1.950 1.00 2.31 H new ATOM 0 HH22 ARG A 11 11.075 17.773 2.960 1.00 2.31 H new ATOM 143 N GLY A 12 10.062 20.682 -5.536 1.00 0.46 N ATOM 144 CA GLY A 12 10.700 21.273 -6.690 1.00 0.45 C ATOM 145 C GLY A 12 10.770 22.769 -6.556 1.00 0.44 C ATOM 146 O GLY A 12 10.465 23.308 -5.494 1.00 0.50 O ATOM 0 H GLY A 12 9.415 21.299 -5.045 1.00 0.46 H new ATOM 0 HA2 GLY A 12 11.705 20.866 -6.803 1.00 0.45 H new ATOM 0 HA3 GLY A 12 10.146 21.010 -7.591 1.00 0.45 H new ATOM 150 N PHE A 13 11.159 23.441 -7.622 1.00 0.44 N ATOM 151 CA PHE A 13 11.324 24.883 -7.580 1.00 0.46 C ATOM 152 C PHE A 13 10.956 25.531 -8.907 1.00 0.43 C ATOM 153 O PHE A 13 11.114 24.936 -9.975 1.00 0.45 O ATOM 154 CB PHE A 13 12.758 25.246 -7.182 1.00 0.57 C ATOM 155 CG PHE A 13 13.764 24.168 -7.474 1.00 0.57 C ATOM 156 CD1 PHE A 13 14.341 24.059 -8.730 1.00 0.63 C ATOM 157 CD2 PHE A 13 14.133 23.265 -6.485 1.00 0.58 C ATOM 158 CE1 PHE A 13 15.271 23.071 -8.990 1.00 0.68 C ATOM 159 CE2 PHE A 13 15.060 22.279 -6.741 1.00 0.63 C ATOM 160 CZ PHE A 13 15.630 22.182 -7.994 1.00 0.67 C ATOM 0 H PHE A 13 11.366 23.015 -8.525 1.00 0.44 H new ATOM 0 HA PHE A 13 10.640 25.272 -6.825 1.00 0.46 H new ATOM 0 HB2 PHE A 13 13.051 26.155 -7.708 1.00 0.57 H new ATOM 0 HB3 PHE A 13 12.782 25.473 -6.116 1.00 0.57 H new ATOM 0 HD1 PHE A 13 14.062 24.751 -9.510 1.00 0.63 H new ATOM 0 HD2 PHE A 13 13.688 23.337 -5.504 1.00 0.58 H new ATOM 0 HE1 PHE A 13 15.717 22.993 -9.970 1.00 0.68 H new ATOM 0 HE2 PHE A 13 15.340 21.584 -5.963 1.00 0.63 H new ATOM 0 HZ PHE A 13 16.358 21.410 -8.197 1.00 0.67 H new ATOM 170 N ILE A 14 10.451 26.753 -8.821 1.00 0.42 N ATOM 171 CA ILE A 14 10.038 27.513 -9.995 1.00 0.42 C ATOM 172 C ILE A 14 11.253 27.916 -10.831 1.00 0.48 C ATOM 173 O ILE A 14 12.107 28.669 -10.365 1.00 0.56 O ATOM 174 CB ILE A 14 9.270 28.789 -9.576 1.00 0.43 C ATOM 175 CG1 ILE A 14 8.113 28.438 -8.629 1.00 0.41 C ATOM 176 CG2 ILE A 14 8.754 29.541 -10.798 1.00 0.46 C ATOM 177 CD1 ILE A 14 7.074 27.517 -9.238 1.00 0.38 C ATOM 0 H ILE A 14 10.316 27.246 -7.938 1.00 0.42 H new ATOM 0 HA ILE A 14 9.384 26.875 -10.590 1.00 0.42 H new ATOM 0 HB ILE A 14 9.963 29.441 -9.045 1.00 0.43 H new ATOM 0 HG12 ILE A 14 8.520 27.968 -7.734 1.00 0.41 H new ATOM 0 HG13 ILE A 14 7.625 29.359 -8.311 1.00 0.41 H new ATOM 0 HG21 ILE A 14 8.218 30.434 -10.476 1.00 0.46 H new ATOM 0 HG22 ILE A 14 9.594 29.830 -11.429 1.00 0.46 H new ATOM 0 HG23 ILE A 14 8.080 28.897 -11.364 1.00 0.46 H new ATOM 0 HD11 ILE A 14 6.291 27.317 -8.506 1.00 0.38 H new ATOM 0 HD12 ILE A 14 6.637 27.992 -10.116 1.00 0.38 H new ATOM 0 HD13 ILE A 14 7.546 26.579 -9.530 1.00 0.38 H new ATOM 189 N ALA A 15 11.344 27.402 -12.046 1.00 0.49 N ATOM 190 CA ALA A 15 12.445 27.765 -12.932 1.00 0.58 C ATOM 191 C ALA A 15 11.985 28.761 -13.991 1.00 0.65 C ATOM 192 O ALA A 15 12.783 29.543 -14.508 1.00 0.76 O ATOM 193 CB ALA A 15 13.042 26.529 -13.587 1.00 0.59 C ATOM 0 H ALA A 15 10.678 26.739 -12.442 1.00 0.49 H new ATOM 0 HA ALA A 15 13.218 28.241 -12.329 1.00 0.58 H new ATOM 0 HB1 ALA A 15 13.861 26.824 -14.243 1.00 0.59 H new ATOM 0 HB2 ALA A 15 13.419 25.855 -12.817 1.00 0.59 H new ATOM 0 HB3 ALA A 15 12.275 26.020 -14.171 1.00 0.59 H new ATOM 199 N VAL A 16 10.697 28.719 -14.319 1.00 0.66 N ATOM 200 CA VAL A 16 10.114 29.660 -15.271 1.00 0.78 C ATOM 201 C VAL A 16 8.782 30.180 -14.731 1.00 0.69 C ATOM 202 O VAL A 16 8.010 29.425 -14.135 1.00 0.67 O ATOM 203 CB VAL A 16 9.929 29.033 -16.691 1.00 0.94 C ATOM 204 CG1 VAL A 16 10.473 27.614 -16.734 1.00 1.55 C ATOM 205 CG2 VAL A 16 8.471 29.061 -17.157 1.00 1.42 C ATOM 0 H VAL A 16 10.036 28.042 -13.939 1.00 0.66 H new ATOM 0 HA VAL A 16 10.810 30.491 -15.385 1.00 0.78 H new ATOM 0 HB VAL A 16 10.501 29.651 -17.383 1.00 0.94 H new ATOM 0 HG11 VAL A 16 10.332 27.200 -17.733 1.00 1.55 H new ATOM 0 HG12 VAL A 16 11.536 27.624 -16.492 1.00 1.55 H new ATOM 0 HG13 VAL A 16 9.942 26.998 -16.008 1.00 1.55 H new ATOM 0 HG21 VAL A 16 8.397 28.614 -18.148 1.00 1.42 H new ATOM 0 HG22 VAL A 16 7.855 28.496 -16.458 1.00 1.42 H new ATOM 0 HG23 VAL A 16 8.122 30.093 -17.197 1.00 1.42 H new ATOM 215 N MET A 17 8.532 31.468 -14.927 1.00 0.73 N ATOM 216 CA MET A 17 7.320 32.106 -14.430 1.00 0.71 C ATOM 217 C MET A 17 6.585 32.801 -15.566 1.00 0.81 C ATOM 218 O MET A 17 7.030 33.837 -16.063 1.00 0.89 O ATOM 219 CB MET A 17 7.672 33.116 -13.329 1.00 0.74 C ATOM 220 CG MET A 17 6.500 33.980 -12.882 1.00 1.23 C ATOM 221 SD MET A 17 5.169 33.034 -12.126 1.00 1.42 S ATOM 222 CE MET A 17 5.932 32.539 -10.580 1.00 0.90 C ATOM 0 H MET A 17 9.158 32.096 -15.431 1.00 0.73 H new ATOM 0 HA MET A 17 6.667 31.341 -14.011 1.00 0.71 H new ATOM 0 HB2 MET A 17 8.062 32.576 -12.466 1.00 0.74 H new ATOM 0 HB3 MET A 17 8.472 33.764 -13.687 1.00 0.74 H new ATOM 0 HG2 MET A 17 6.857 34.725 -12.171 1.00 1.23 H new ATOM 0 HG3 MET A 17 6.108 34.523 -13.742 1.00 1.23 H new ATOM 0 HE1 MET A 17 5.253 31.885 -10.032 1.00 0.90 H new ATOM 0 HE2 MET A 17 6.861 32.007 -10.787 1.00 0.90 H new ATOM 0 HE3 MET A 17 6.146 33.424 -9.980 1.00 0.90 H new ATOM 232 N LYS A 18 5.482 32.211 -15.998 1.00 0.83 N ATOM 233 CA LYS A 18 4.686 32.790 -17.066 1.00 0.97 C ATOM 234 C LYS A 18 3.336 33.269 -16.543 1.00 1.03 C ATOM 235 O LYS A 18 2.983 33.011 -15.397 1.00 1.01 O ATOM 236 CB LYS A 18 4.504 31.795 -18.213 1.00 1.02 C ATOM 237 CG LYS A 18 5.821 31.349 -18.825 1.00 1.31 C ATOM 238 CD LYS A 18 5.644 30.932 -20.271 1.00 1.39 C ATOM 239 CE LYS A 18 6.980 30.675 -20.951 1.00 1.29 C ATOM 240 NZ LYS A 18 6.840 30.547 -22.427 1.00 2.03 N ATOM 0 H LYS A 18 5.119 31.333 -15.626 1.00 0.83 H new ATOM 0 HA LYS A 18 5.223 33.656 -17.453 1.00 0.97 H new ATOM 0 HB2 LYS A 18 3.965 30.921 -17.847 1.00 1.02 H new ATOM 0 HB3 LYS A 18 3.885 32.250 -18.987 1.00 1.02 H new ATOM 0 HG2 LYS A 18 6.546 32.161 -18.765 1.00 1.31 H new ATOM 0 HG3 LYS A 18 6.227 30.516 -18.251 1.00 1.31 H new ATOM 0 HD2 LYS A 18 5.033 30.031 -20.317 1.00 1.39 H new ATOM 0 HD3 LYS A 18 5.105 31.711 -20.811 1.00 1.39 H new ATOM 0 HE2 LYS A 18 7.666 31.490 -20.721 1.00 1.29 H new ATOM 0 HE3 LYS A 18 7.422 29.764 -20.549 1.00 1.29 H new ATOM 0 HZ1 LYS A 18 7.774 30.373 -22.850 1.00 2.03 H new ATOM 0 HZ2 LYS A 18 6.206 29.753 -22.648 1.00 2.03 H new ATOM 0 HZ3 LYS A 18 6.442 31.426 -22.816 1.00 2.03 H new ATOM 254 N GLU A 19 2.596 33.954 -17.405 1.00 1.21 N ATOM 255 CA GLU A 19 1.315 34.572 -17.050 1.00 1.32 C ATOM 256 C GLU A 19 0.308 33.569 -16.472 1.00 1.18 C ATOM 257 O GLU A 19 -0.353 33.847 -15.477 1.00 1.24 O ATOM 258 CB GLU A 19 0.721 35.248 -18.291 1.00 1.62 C ATOM 259 CG GLU A 19 -0.607 35.950 -18.053 1.00 2.11 C ATOM 260 CD GLU A 19 -0.489 37.112 -17.089 1.00 2.65 C ATOM 261 OE1 GLU A 19 0.200 38.099 -17.419 1.00 2.89 O ATOM 262 OE2 GLU A 19 -1.082 37.039 -15.994 1.00 3.24 O ATOM 0 H GLU A 19 2.865 34.100 -18.378 1.00 1.21 H new ATOM 0 HA GLU A 19 1.512 35.306 -16.269 1.00 1.32 H new ATOM 0 HB2 GLU A 19 1.439 35.975 -18.671 1.00 1.62 H new ATOM 0 HB3 GLU A 19 0.586 34.496 -19.069 1.00 1.62 H new ATOM 0 HG2 GLU A 19 -0.998 36.311 -19.004 1.00 2.11 H new ATOM 0 HG3 GLU A 19 -1.328 35.232 -17.663 1.00 2.11 H new ATOM 269 N ASN A 20 0.177 32.413 -17.107 1.00 1.10 N ATOM 270 CA ASN A 20 -0.848 31.445 -16.708 1.00 1.07 C ATOM 271 C ASN A 20 -0.251 30.205 -16.058 1.00 0.95 C ATOM 272 O ASN A 20 -0.760 29.710 -15.052 1.00 0.97 O ATOM 273 CB ASN A 20 -1.697 31.034 -17.916 1.00 1.19 C ATOM 274 CG ASN A 20 -2.949 31.881 -18.092 1.00 1.48 C ATOM 275 OD1 ASN A 20 -2.928 33.104 -17.583 1.00 2.03 O flip ATOM 276 ND2 ASN A 20 -3.933 31.433 -18.679 1.00 1.59 N flip ATOM 0 H ASN A 20 0.758 32.120 -17.893 1.00 1.10 H new ATOM 0 HA ASN A 20 -1.477 31.939 -15.967 1.00 1.07 H new ATOM 0 HB2 ASN A 20 -1.090 31.105 -18.818 1.00 1.19 H new ATOM 0 HB3 ASN A 20 -1.987 29.989 -17.808 1.00 1.19 H new ATOM 0 HD21 ASN A 20 -3.913 30.486 -19.058 1.00 1.59 H new ATOM 0 HD22 ASN A 20 -4.768 32.008 -18.786 1.00 1.59 H new ATOM 283 N PHE A 21 0.825 29.699 -16.632 1.00 0.88 N ATOM 284 CA PHE A 21 1.416 28.459 -16.156 1.00 0.80 C ATOM 285 C PHE A 21 2.921 28.600 -15.993 1.00 0.75 C ATOM 286 O PHE A 21 3.517 29.570 -16.460 1.00 0.79 O ATOM 287 CB PHE A 21 1.092 27.308 -17.118 1.00 0.87 C ATOM 288 CG PHE A 21 1.596 27.518 -18.518 1.00 0.94 C ATOM 289 CD1 PHE A 21 2.904 27.204 -18.850 1.00 0.97 C ATOM 290 CD2 PHE A 21 0.760 28.020 -19.501 1.00 1.14 C ATOM 291 CE1 PHE A 21 3.370 27.389 -20.133 1.00 1.05 C ATOM 292 CE2 PHE A 21 1.220 28.208 -20.789 1.00 1.25 C ATOM 293 CZ PHE A 21 2.526 27.891 -21.106 1.00 1.15 C ATOM 0 H PHE A 21 1.307 30.124 -17.425 1.00 0.88 H new ATOM 0 HA PHE A 21 0.987 28.233 -15.180 1.00 0.80 H new ATOM 0 HB2 PHE A 21 1.521 26.387 -16.723 1.00 0.87 H new ATOM 0 HB3 PHE A 21 0.011 27.168 -17.149 1.00 0.87 H new ATOM 0 HD1 PHE A 21 3.566 26.809 -18.094 1.00 0.97 H new ATOM 0 HD2 PHE A 21 -0.263 28.267 -19.258 1.00 1.14 H new ATOM 0 HE1 PHE A 21 4.392 27.142 -20.378 1.00 1.05 H new ATOM 0 HE2 PHE A 21 0.560 28.602 -21.547 1.00 1.25 H new ATOM 0 HZ PHE A 21 2.888 28.035 -22.113 1.00 1.15 H new ATOM 303 N GLY A 22 3.524 27.623 -15.342 1.00 0.71 N ATOM 304 CA GLY A 22 4.954 27.624 -15.155 1.00 0.68 C ATOM 305 C GLY A 22 5.512 26.222 -15.173 1.00 0.66 C ATOM 306 O GLY A 22 4.775 25.254 -14.976 1.00 0.70 O ATOM 0 H GLY A 22 3.042 26.821 -14.936 1.00 0.71 H new ATOM 0 HA2 GLY A 22 5.425 28.215 -15.941 1.00 0.68 H new ATOM 0 HA3 GLY A 22 5.198 28.102 -14.207 1.00 0.68 H new ATOM 310 N PHE A 23 6.799 26.096 -15.420 1.00 0.66 N ATOM 311 CA PHE A 23 7.430 24.794 -15.408 1.00 0.65 C ATOM 312 C PHE A 23 8.248 24.637 -14.139 1.00 0.56 C ATOM 313 O PHE A 23 9.078 25.494 -13.807 1.00 0.59 O ATOM 314 CB PHE A 23 8.312 24.601 -16.642 1.00 0.76 C ATOM 315 CG PHE A 23 7.559 24.684 -17.939 1.00 0.85 C ATOM 316 CD1 PHE A 23 6.655 23.696 -18.297 1.00 0.88 C ATOM 317 CD2 PHE A 23 7.764 25.746 -18.806 1.00 0.98 C ATOM 318 CE1 PHE A 23 5.963 23.770 -19.491 1.00 0.98 C ATOM 319 CE2 PHE A 23 7.076 25.826 -20.002 1.00 1.08 C ATOM 320 CZ PHE A 23 6.175 24.836 -20.345 1.00 1.06 C ATOM 0 H PHE A 23 7.425 26.874 -15.630 1.00 0.66 H new ATOM 0 HA PHE A 23 6.654 24.029 -15.432 1.00 0.65 H new ATOM 0 HB2 PHE A 23 9.097 25.357 -16.639 1.00 0.76 H new ATOM 0 HB3 PHE A 23 8.804 23.630 -16.579 1.00 0.76 H new ATOM 0 HD1 PHE A 23 6.490 22.859 -17.635 1.00 0.88 H new ATOM 0 HD2 PHE A 23 8.470 26.520 -18.544 1.00 0.98 H new ATOM 0 HE1 PHE A 23 5.258 22.996 -19.756 1.00 0.98 H new ATOM 0 HE2 PHE A 23 7.242 26.661 -20.667 1.00 1.08 H new ATOM 0 HZ PHE A 23 5.637 24.895 -21.280 1.00 1.06 H new ATOM 330 N ILE A 24 7.993 23.558 -13.419 1.00 0.54 N ATOM 331 CA ILE A 24 8.703 23.286 -12.188 1.00 0.48 C ATOM 332 C ILE A 24 9.773 22.246 -12.446 1.00 0.54 C ATOM 333 O ILE A 24 9.482 21.166 -12.964 1.00 0.61 O ATOM 334 CB ILE A 24 7.773 22.758 -11.078 1.00 0.42 C ATOM 335 CG1 ILE A 24 6.513 23.616 -10.958 1.00 0.41 C ATOM 336 CG2 ILE A 24 8.524 22.718 -9.754 1.00 0.40 C ATOM 337 CD1 ILE A 24 5.542 23.092 -9.926 1.00 0.41 C ATOM 0 H ILE A 24 7.297 22.856 -13.669 1.00 0.54 H new ATOM 0 HA ILE A 24 9.137 24.228 -11.851 1.00 0.48 H new ATOM 0 HB ILE A 24 7.459 21.748 -11.340 1.00 0.42 H new ATOM 0 HG12 ILE A 24 6.797 24.636 -10.698 1.00 0.41 H new ATOM 0 HG13 ILE A 24 6.016 23.661 -11.927 1.00 0.41 H new ATOM 0 HG21 ILE A 24 7.863 22.344 -8.972 1.00 0.40 H new ATOM 0 HG22 ILE A 24 9.387 22.059 -9.845 1.00 0.40 H new ATOM 0 HG23 ILE A 24 8.860 23.722 -9.496 1.00 0.40 H new ATOM 0 HD11 ILE A 24 4.668 23.742 -9.886 1.00 0.41 H new ATOM 0 HD12 ILE A 24 5.232 22.083 -10.197 1.00 0.41 H new ATOM 0 HD13 ILE A 24 6.025 23.073 -8.949 1.00 0.41 H new ATOM 349 N GLU A 25 11.003 22.575 -12.117 1.00 0.58 N ATOM 350 CA GLU A 25 12.075 21.616 -12.245 1.00 0.67 C ATOM 351 C GLU A 25 12.079 20.714 -11.023 1.00 0.64 C ATOM 352 O GLU A 25 11.943 21.178 -9.885 1.00 0.63 O ATOM 353 CB GLU A 25 13.424 22.317 -12.419 1.00 0.78 C ATOM 354 CG GLU A 25 14.590 21.354 -12.588 1.00 0.95 C ATOM 355 CD GLU A 25 14.313 20.267 -13.616 1.00 1.60 C ATOM 356 OE1 GLU A 25 14.417 20.555 -14.836 1.00 2.07 O ATOM 357 OE2 GLU A 25 14.004 19.131 -13.215 1.00 2.30 O ATOM 0 H GLU A 25 11.283 23.490 -11.763 1.00 0.58 H new ATOM 0 HA GLU A 25 11.913 21.011 -13.137 1.00 0.67 H new ATOM 0 HB2 GLU A 25 13.375 22.972 -13.289 1.00 0.78 H new ATOM 0 HB3 GLU A 25 13.609 22.951 -11.552 1.00 0.78 H new ATOM 0 HG2 GLU A 25 15.477 21.913 -12.887 1.00 0.95 H new ATOM 0 HG3 GLU A 25 14.815 20.890 -11.627 1.00 0.95 H new ATOM 364 N THR A 26 12.183 19.423 -11.274 1.00 0.68 N ATOM 365 CA THR A 26 12.216 18.440 -10.216 1.00 0.69 C ATOM 366 C THR A 26 13.441 18.642 -9.333 1.00 0.71 C ATOM 367 O THR A 26 14.453 19.185 -9.777 1.00 0.82 O ATOM 368 CB THR A 26 12.218 17.021 -10.796 1.00 0.79 C ATOM 369 OG1 THR A 26 13.118 16.951 -11.904 1.00 0.84 O ATOM 370 CG2 THR A 26 10.824 16.611 -11.244 1.00 0.87 C ATOM 0 H THR A 26 12.247 19.031 -12.213 1.00 0.68 H new ATOM 0 HA THR A 26 11.320 18.569 -9.608 1.00 0.69 H new ATOM 0 HB THR A 26 12.544 16.335 -10.014 1.00 0.79 H new ATOM 0 HG1 THR A 26 13.612 17.794 -11.978 1.00 0.84 H new ATOM 0 HG21 THR A 26 10.855 15.600 -11.651 1.00 0.87 H new ATOM 0 HG22 THR A 26 10.145 16.638 -10.392 1.00 0.87 H new ATOM 0 HG23 THR A 26 10.471 17.300 -12.011 1.00 0.87 H new ATOM 378 N LEU A 27 13.334 18.193 -8.090 1.00 0.68 N ATOM 379 CA LEU A 27 14.372 18.392 -7.088 1.00 0.74 C ATOM 380 C LEU A 27 15.768 18.040 -7.610 1.00 0.89 C ATOM 381 O LEU A 27 16.733 18.765 -7.368 1.00 1.00 O ATOM 382 CB LEU A 27 14.067 17.532 -5.866 1.00 0.74 C ATOM 383 CG LEU A 27 14.821 17.939 -4.604 1.00 0.80 C ATOM 384 CD1 LEU A 27 14.230 19.208 -4.020 1.00 1.48 C ATOM 385 CD2 LEU A 27 14.805 16.822 -3.578 1.00 1.58 C ATOM 0 H LEU A 27 12.522 17.679 -7.747 1.00 0.68 H new ATOM 0 HA LEU A 27 14.373 19.451 -6.829 1.00 0.74 H new ATOM 0 HB2 LEU A 27 12.997 17.575 -5.665 1.00 0.74 H new ATOM 0 HB3 LEU A 27 14.306 16.494 -6.099 1.00 0.74 H new ATOM 0 HG LEU A 27 15.859 18.132 -4.876 1.00 0.80 H new ATOM 0 HD11 LEU A 27 14.779 19.485 -3.120 1.00 1.48 H new ATOM 0 HD12 LEU A 27 14.302 20.013 -4.751 1.00 1.48 H new ATOM 0 HD13 LEU A 27 13.183 19.039 -3.768 1.00 1.48 H new ATOM 0 HD21 LEU A 27 15.349 17.138 -2.688 1.00 1.58 H new ATOM 0 HD22 LEU A 27 13.775 16.589 -3.310 1.00 1.58 H new ATOM 0 HD23 LEU A 27 15.280 15.935 -3.998 1.00 1.58 H new ATOM 397 N SER A 28 15.862 16.935 -8.332 1.00 0.97 N ATOM 398 CA SER A 28 17.150 16.434 -8.779 1.00 1.16 C ATOM 399 C SER A 28 17.308 16.546 -10.298 1.00 1.12 C ATOM 400 O SER A 28 18.177 15.890 -10.877 1.00 1.25 O ATOM 401 CB SER A 28 17.307 14.973 -8.338 1.00 1.34 C ATOM 402 OG SER A 28 17.037 14.824 -6.952 1.00 2.04 O ATOM 0 H SER A 28 15.063 16.370 -8.620 1.00 0.97 H new ATOM 0 HA SER A 28 17.930 17.045 -8.325 1.00 1.16 H new ATOM 0 HB2 SER A 28 16.630 14.342 -8.913 1.00 1.34 H new ATOM 0 HB3 SER A 28 18.320 14.632 -8.553 1.00 1.34 H new ATOM 0 HG SER A 28 17.142 13.884 -6.697 1.00 2.04 H new ATOM 408 N HIS A 29 16.483 17.386 -10.934 1.00 1.00 N ATOM 409 CA HIS A 29 16.522 17.555 -12.393 1.00 1.01 C ATOM 410 C HIS A 29 16.300 16.216 -13.090 1.00 1.02 C ATOM 411 O HIS A 29 17.152 15.737 -13.841 1.00 1.13 O ATOM 412 CB HIS A 29 17.852 18.174 -12.851 1.00 1.17 C ATOM 413 CG HIS A 29 18.023 19.623 -12.507 1.00 1.75 C ATOM 414 ND1 HIS A 29 18.327 20.598 -13.434 1.00 2.53 N ATOM 415 CD2 HIS A 29 17.954 20.257 -11.308 1.00 2.06 C ATOM 416 CE1 HIS A 29 18.430 21.763 -12.789 1.00 3.29 C ATOM 417 NE2 HIS A 29 18.212 21.615 -11.493 1.00 3.03 N ATOM 0 H HIS A 29 15.782 17.958 -10.464 1.00 1.00 H new ATOM 0 HA HIS A 29 15.719 18.238 -12.669 1.00 1.01 H new ATOM 0 HB2 HIS A 29 18.671 17.610 -12.405 1.00 1.17 H new ATOM 0 HB3 HIS A 29 17.937 18.059 -13.932 1.00 1.17 H new ATOM 0 HD1 HIS A 29 18.451 20.455 -14.436 1.00 2.53 H new ATOM 0 HD2 HIS A 29 17.734 19.785 -10.362 1.00 2.06 H new ATOM 0 HE1 HIS A 29 18.661 22.705 -13.265 1.00 3.29 H new ATOM 425 N ASP A 30 15.159 15.613 -12.804 1.00 1.05 N ATOM 426 CA ASP A 30 14.834 14.279 -13.282 1.00 1.17 C ATOM 427 C ASP A 30 13.977 14.347 -14.540 1.00 1.15 C ATOM 428 O ASP A 30 14.260 13.667 -15.527 1.00 1.31 O ATOM 429 CB ASP A 30 14.092 13.508 -12.190 1.00 1.31 C ATOM 430 CG ASP A 30 13.858 12.057 -12.556 1.00 2.12 C ATOM 431 OD1 ASP A 30 12.726 11.705 -12.935 1.00 2.89 O ATOM 432 OD2 ASP A 30 14.812 11.257 -12.455 1.00 2.47 O ATOM 0 H ASP A 30 14.429 16.036 -12.231 1.00 1.05 H new ATOM 0 HA ASP A 30 15.762 13.763 -13.527 1.00 1.17 H new ATOM 0 HB2 ASP A 30 14.664 13.557 -11.263 1.00 1.31 H new ATOM 0 HB3 ASP A 30 13.133 13.989 -11.998 1.00 1.31 H new ATOM 437 N GLU A 31 12.941 15.180 -14.509 1.00 1.06 N ATOM 438 CA GLU A 31 12.028 15.303 -15.640 1.00 1.19 C ATOM 439 C GLU A 31 11.287 16.635 -15.602 1.00 1.07 C ATOM 440 O GLU A 31 11.550 17.479 -14.746 1.00 0.94 O ATOM 441 CB GLU A 31 11.035 14.133 -15.686 1.00 1.37 C ATOM 442 CG GLU A 31 10.046 14.083 -14.530 1.00 1.33 C ATOM 443 CD GLU A 31 8.991 13.015 -14.734 1.00 1.49 C ATOM 444 OE1 GLU A 31 8.357 12.986 -15.809 1.00 1.80 O ATOM 445 OE2 GLU A 31 8.773 12.209 -13.805 1.00 1.65 O ATOM 0 H GLU A 31 12.713 15.778 -13.715 1.00 1.06 H new ATOM 0 HA GLU A 31 12.627 15.271 -16.550 1.00 1.19 H new ATOM 0 HB2 GLU A 31 10.476 14.187 -16.620 1.00 1.37 H new ATOM 0 HB3 GLU A 31 11.597 13.199 -15.704 1.00 1.37 H new ATOM 0 HG2 GLU A 31 10.583 13.890 -13.601 1.00 1.33 H new ATOM 0 HG3 GLU A 31 9.563 15.054 -14.423 1.00 1.33 H new ATOM 452 N GLU A 32 10.345 16.804 -16.521 1.00 1.20 N ATOM 453 CA GLU A 32 9.663 18.076 -16.703 1.00 1.14 C ATOM 454 C GLU A 32 8.276 18.040 -16.073 1.00 1.04 C ATOM 455 O GLU A 32 7.461 17.176 -16.399 1.00 1.17 O ATOM 456 CB GLU A 32 9.542 18.374 -18.200 1.00 1.41 C ATOM 457 CG GLU A 32 8.683 19.583 -18.531 1.00 1.85 C ATOM 458 CD GLU A 32 8.328 19.644 -20.005 1.00 2.71 C ATOM 459 OE1 GLU A 32 7.239 19.156 -20.379 1.00 3.37 O ATOM 460 OE2 GLU A 32 9.140 20.164 -20.794 1.00 3.06 O ATOM 0 H GLU A 32 10.035 16.069 -17.156 1.00 1.20 H new ATOM 0 HA GLU A 32 10.242 18.859 -16.214 1.00 1.14 H new ATOM 0 HB2 GLU A 32 10.540 18.530 -18.609 1.00 1.41 H new ATOM 0 HB3 GLU A 32 9.125 17.500 -18.700 1.00 1.41 H new ATOM 0 HG2 GLU A 32 7.768 19.550 -17.939 1.00 1.85 H new ATOM 0 HG3 GLU A 32 9.213 20.492 -18.248 1.00 1.85 H new ATOM 467 N VAL A 33 8.014 18.973 -15.167 1.00 0.87 N ATOM 468 CA VAL A 33 6.701 19.074 -14.550 1.00 0.80 C ATOM 469 C VAL A 33 5.991 20.347 -14.993 1.00 0.75 C ATOM 470 O VAL A 33 6.370 21.455 -14.600 1.00 0.71 O ATOM 471 CB VAL A 33 6.774 19.065 -13.009 1.00 0.71 C ATOM 472 CG1 VAL A 33 5.383 18.938 -12.413 1.00 0.78 C ATOM 473 CG2 VAL A 33 7.674 17.950 -12.505 1.00 0.76 C ATOM 0 H VAL A 33 8.690 19.666 -14.846 1.00 0.87 H new ATOM 0 HA VAL A 33 6.143 18.197 -14.877 1.00 0.80 H new ATOM 0 HB VAL A 33 7.207 20.013 -12.688 1.00 0.71 H new ATOM 0 HG11 VAL A 33 5.452 18.933 -11.325 1.00 0.78 H new ATOM 0 HG12 VAL A 33 4.771 19.781 -12.734 1.00 0.78 H new ATOM 0 HG13 VAL A 33 4.926 18.008 -12.752 1.00 0.78 H new ATOM 0 HG21 VAL A 33 7.704 17.971 -11.416 1.00 0.76 H new ATOM 0 HG22 VAL A 33 7.284 16.989 -12.839 1.00 0.76 H new ATOM 0 HG23 VAL A 33 8.681 18.089 -12.898 1.00 0.76 H new ATOM 483 N PHE A 34 4.979 20.187 -15.830 1.00 0.83 N ATOM 484 CA PHE A 34 4.135 21.298 -16.226 1.00 0.82 C ATOM 485 C PHE A 34 3.089 21.562 -15.146 1.00 0.75 C ATOM 486 O PHE A 34 2.328 20.672 -14.764 1.00 0.78 O ATOM 487 CB PHE A 34 3.467 21.011 -17.579 1.00 0.94 C ATOM 488 CG PHE A 34 2.167 21.735 -17.784 1.00 0.95 C ATOM 489 CD1 PHE A 34 0.980 21.024 -17.841 1.00 1.02 C ATOM 490 CD2 PHE A 34 2.122 23.117 -17.892 1.00 0.93 C ATOM 491 CE1 PHE A 34 -0.224 21.671 -18.003 1.00 1.06 C ATOM 492 CE2 PHE A 34 0.917 23.771 -18.059 1.00 0.97 C ATOM 493 CZ PHE A 34 -0.257 23.045 -18.110 1.00 1.04 C ATOM 0 H PHE A 34 4.723 19.293 -16.249 1.00 0.83 H new ATOM 0 HA PHE A 34 4.751 22.190 -16.340 1.00 0.82 H new ATOM 0 HB2 PHE A 34 4.155 21.287 -18.378 1.00 0.94 H new ATOM 0 HB3 PHE A 34 3.292 19.939 -17.666 1.00 0.94 H new ATOM 0 HD1 PHE A 34 0.999 19.947 -17.757 1.00 1.02 H new ATOM 0 HD2 PHE A 34 3.038 23.687 -17.845 1.00 0.93 H new ATOM 0 HE1 PHE A 34 -1.142 21.103 -18.046 1.00 1.06 H new ATOM 0 HE2 PHE A 34 0.893 24.847 -18.149 1.00 0.97 H new ATOM 0 HZ PHE A 34 -1.201 23.554 -18.234 1.00 1.04 H new ATOM 503 N PHE A 35 3.068 22.782 -14.645 1.00 0.68 N ATOM 504 CA PHE A 35 2.125 23.158 -13.617 1.00 0.65 C ATOM 505 C PHE A 35 1.372 24.420 -14.007 1.00 0.66 C ATOM 506 O PHE A 35 1.960 25.391 -14.483 1.00 0.67 O ATOM 507 CB PHE A 35 2.850 23.345 -12.279 1.00 0.62 C ATOM 508 CG PHE A 35 2.032 24.055 -11.239 1.00 0.80 C ATOM 509 CD1 PHE A 35 2.422 25.296 -10.763 1.00 1.17 C ATOM 510 CD2 PHE A 35 0.869 23.488 -10.749 1.00 1.23 C ATOM 511 CE1 PHE A 35 1.665 25.955 -9.815 1.00 1.72 C ATOM 512 CE2 PHE A 35 0.111 24.141 -9.805 1.00 1.76 C ATOM 513 CZ PHE A 35 0.509 25.376 -9.337 1.00 1.96 C ATOM 0 H PHE A 35 3.697 23.530 -14.936 1.00 0.68 H new ATOM 0 HA PHE A 35 1.395 22.356 -13.506 1.00 0.65 H new ATOM 0 HB2 PHE A 35 3.140 22.367 -11.894 1.00 0.62 H new ATOM 0 HB3 PHE A 35 3.769 23.906 -12.450 1.00 0.62 H new ATOM 0 HD1 PHE A 35 3.327 25.752 -11.137 1.00 1.17 H new ATOM 0 HD2 PHE A 35 0.553 22.521 -11.112 1.00 1.23 H new ATOM 0 HE1 PHE A 35 1.978 26.922 -9.449 1.00 1.72 H new ATOM 0 HE2 PHE A 35 -0.795 23.687 -9.431 1.00 1.76 H new ATOM 0 HZ PHE A 35 -0.085 25.890 -8.596 1.00 1.96 H new ATOM 523 N HIS A 36 0.067 24.394 -13.816 1.00 0.72 N ATOM 524 CA HIS A 36 -0.759 25.546 -14.099 1.00 0.74 C ATOM 525 C HIS A 36 -1.079 26.257 -12.790 1.00 0.70 C ATOM 526 O HIS A 36 -1.612 25.638 -11.868 1.00 0.74 O ATOM 527 CB HIS A 36 -2.052 25.114 -14.797 1.00 0.84 C ATOM 528 CG HIS A 36 -2.451 26.018 -15.922 1.00 0.94 C ATOM 529 ND1 HIS A 36 -2.745 25.582 -17.195 1.00 1.06 N ATOM 530 CD2 HIS A 36 -2.584 27.365 -15.950 1.00 1.15 C ATOM 531 CE1 HIS A 36 -3.033 26.652 -17.941 1.00 1.12 C ATOM 532 NE2 HIS A 36 -2.948 27.760 -17.233 1.00 1.18 N ATOM 0 H HIS A 36 -0.443 23.583 -13.465 1.00 0.72 H new ATOM 0 HA HIS A 36 -0.224 26.225 -14.763 1.00 0.74 H new ATOM 0 HB2 HIS A 36 -1.928 24.101 -15.181 1.00 0.84 H new ATOM 0 HB3 HIS A 36 -2.858 25.081 -14.064 1.00 0.84 H new ATOM 0 HD1 HIS A 36 -2.743 24.613 -17.512 1.00 1.06 H new ATOM 0 HD2 HIS A 36 -2.432 28.027 -15.110 1.00 1.15 H new ATOM 0 HE1 HIS A 36 -3.300 26.614 -18.987 1.00 1.12 H new ATOM 540 N PHE A 37 -0.771 27.551 -12.714 1.00 0.68 N ATOM 541 CA PHE A 37 -0.902 28.309 -11.463 1.00 0.67 C ATOM 542 C PHE A 37 -2.334 28.323 -10.943 1.00 0.73 C ATOM 543 O PHE A 37 -2.578 28.635 -9.779 1.00 0.75 O ATOM 544 CB PHE A 37 -0.404 29.740 -11.643 1.00 0.71 C ATOM 545 CG PHE A 37 1.085 29.836 -11.805 1.00 0.68 C ATOM 546 CD1 PHE A 37 1.640 30.304 -12.981 1.00 0.73 C ATOM 547 CD2 PHE A 37 1.930 29.452 -10.775 1.00 0.69 C ATOM 548 CE1 PHE A 37 3.011 30.391 -13.130 1.00 0.74 C ATOM 549 CE2 PHE A 37 3.302 29.535 -10.918 1.00 0.72 C ATOM 550 CZ PHE A 37 3.842 30.004 -12.097 1.00 0.73 C ATOM 0 H PHE A 37 -0.428 28.100 -13.503 1.00 0.68 H new ATOM 0 HA PHE A 37 -0.284 27.801 -10.722 1.00 0.67 H new ATOM 0 HB2 PHE A 37 -0.886 30.178 -12.517 1.00 0.71 H new ATOM 0 HB3 PHE A 37 -0.707 30.334 -10.781 1.00 0.71 H new ATOM 0 HD1 PHE A 37 0.995 30.605 -13.793 1.00 0.73 H new ATOM 0 HD2 PHE A 37 1.511 29.084 -9.850 1.00 0.69 H new ATOM 0 HE1 PHE A 37 3.432 30.761 -14.053 1.00 0.74 H new ATOM 0 HE2 PHE A 37 3.950 29.233 -10.108 1.00 0.72 H new ATOM 0 HZ PHE A 37 4.914 30.069 -12.212 1.00 0.73 H new ATOM 560 N SER A 38 -3.273 27.984 -11.808 1.00 0.80 N ATOM 561 CA SER A 38 -4.671 27.850 -11.420 1.00 0.90 C ATOM 562 C SER A 38 -4.859 26.782 -10.326 1.00 0.92 C ATOM 563 O SER A 38 -5.904 26.725 -9.674 1.00 1.07 O ATOM 564 CB SER A 38 -5.495 27.488 -12.654 1.00 0.98 C ATOM 565 OG SER A 38 -5.006 28.176 -13.795 1.00 1.63 O ATOM 0 H SER A 38 -3.093 27.794 -12.794 1.00 0.80 H new ATOM 0 HA SER A 38 -5.009 28.801 -11.007 1.00 0.90 H new ATOM 0 HB2 SER A 38 -5.453 26.412 -12.824 1.00 0.98 H new ATOM 0 HB3 SER A 38 -6.542 27.744 -12.488 1.00 0.98 H new ATOM 0 HG SER A 38 -5.542 27.933 -14.578 1.00 1.63 H new ATOM 571 N ASN A 39 -3.846 25.938 -10.124 1.00 0.82 N ATOM 572 CA ASN A 39 -3.907 24.887 -9.109 1.00 0.87 C ATOM 573 C ASN A 39 -2.973 25.188 -7.938 1.00 0.80 C ATOM 574 O ASN A 39 -2.712 24.320 -7.103 1.00 0.87 O ATOM 575 CB ASN A 39 -3.539 23.534 -9.720 1.00 0.92 C ATOM 576 CG ASN A 39 -4.625 22.973 -10.616 1.00 1.28 C ATOM 577 OD1 ASN A 39 -5.508 22.249 -10.161 1.00 2.07 O ATOM 578 ND2 ASN A 39 -4.562 23.295 -11.899 1.00 1.54 N ATOM 0 H ASN A 39 -2.973 25.962 -10.651 1.00 0.82 H new ATOM 0 HA ASN A 39 -4.930 24.851 -8.735 1.00 0.87 H new ATOM 0 HB2 ASN A 39 -2.619 23.640 -10.296 1.00 0.92 H new ATOM 0 HB3 ASN A 39 -3.334 22.824 -8.919 1.00 0.92 H new ATOM 0 HD21 ASN A 39 -5.263 22.939 -12.549 1.00 1.54 H new ATOM 0 HD22 ASN A 39 -3.813 23.899 -12.237 1.00 1.54 H new ATOM 585 N TYR A 40 -2.472 26.415 -7.875 1.00 0.72 N ATOM 586 CA TYR A 40 -1.577 26.809 -6.794 1.00 0.66 C ATOM 587 C TYR A 40 -2.382 27.187 -5.554 1.00 0.73 C ATOM 588 O TYR A 40 -3.363 27.926 -5.642 1.00 0.87 O ATOM 589 CB TYR A 40 -0.688 27.987 -7.214 1.00 0.65 C ATOM 590 CG TYR A 40 0.277 28.414 -6.131 1.00 0.59 C ATOM 591 CD1 TYR A 40 1.425 27.678 -5.859 1.00 0.55 C ATOM 592 CD2 TYR A 40 0.028 29.544 -5.367 1.00 0.75 C ATOM 593 CE1 TYR A 40 2.295 28.061 -4.855 1.00 0.64 C ATOM 594 CE2 TYR A 40 0.893 29.934 -4.367 1.00 0.81 C ATOM 595 CZ TYR A 40 2.021 29.190 -4.111 1.00 0.74 C ATOM 596 OH TYR A 40 2.876 29.574 -3.108 1.00 0.91 O ATOM 0 H TYR A 40 -2.668 27.150 -8.554 1.00 0.72 H new ATOM 0 HA TYR A 40 -0.935 25.959 -6.563 1.00 0.66 H new ATOM 0 HB2 TYR A 40 -0.126 27.711 -8.106 1.00 0.65 H new ATOM 0 HB3 TYR A 40 -1.319 28.833 -7.485 1.00 0.65 H new ATOM 0 HD1 TYR A 40 1.640 26.794 -6.441 1.00 0.55 H new ATOM 0 HD2 TYR A 40 -0.859 30.129 -5.559 1.00 0.75 H new ATOM 0 HE1 TYR A 40 3.183 27.480 -4.655 1.00 0.64 H new ATOM 0 HE2 TYR A 40 0.686 30.821 -3.787 1.00 0.81 H new ATOM 0 HH TYR A 40 2.365 29.739 -2.288 1.00 0.91 H new ATOM 606 N MET A 41 -1.971 26.678 -4.402 1.00 0.69 N ATOM 607 CA MET A 41 -2.642 27.001 -3.154 1.00 0.79 C ATOM 608 C MET A 41 -1.986 28.205 -2.488 1.00 0.77 C ATOM 609 O MET A 41 -0.931 28.086 -1.860 1.00 0.77 O ATOM 610 CB MET A 41 -2.617 25.804 -2.204 1.00 0.87 C ATOM 611 CG MET A 41 -3.276 26.086 -0.859 1.00 1.35 C ATOM 612 SD MET A 41 -3.088 24.725 0.310 1.00 1.73 S ATOM 613 CE MET A 41 -3.967 23.421 -0.544 1.00 1.39 C ATOM 0 H MET A 41 -1.179 26.042 -4.307 1.00 0.69 H new ATOM 0 HA MET A 41 -3.679 27.247 -3.382 1.00 0.79 H new ATOM 0 HB2 MET A 41 -3.122 24.962 -2.678 1.00 0.87 H new ATOM 0 HB3 MET A 41 -1.583 25.503 -2.038 1.00 0.87 H new ATOM 0 HG2 MET A 41 -2.844 26.990 -0.430 1.00 1.35 H new ATOM 0 HG3 MET A 41 -4.337 26.283 -1.013 1.00 1.35 H new ATOM 0 HE1 MET A 41 -4.187 22.613 0.154 1.00 1.39 H new ATOM 0 HE2 MET A 41 -4.899 23.815 -0.949 1.00 1.39 H new ATOM 0 HE3 MET A 41 -3.351 23.039 -1.358 1.00 1.39 H new ATOM 623 N GLY A 42 -2.606 29.364 -2.644 1.00 0.87 N ATOM 624 CA GLY A 42 -2.085 30.576 -2.044 1.00 0.91 C ATOM 625 C GLY A 42 -1.974 31.707 -3.047 1.00 0.92 C ATOM 626 O GLY A 42 -2.788 31.807 -3.965 1.00 1.05 O ATOM 0 H GLY A 42 -3.466 29.488 -3.178 1.00 0.87 H new ATOM 0 HA2 GLY A 42 -2.734 30.882 -1.224 1.00 0.91 H new ATOM 0 HA3 GLY A 42 -1.103 30.375 -1.615 1.00 0.91 H new ATOM 630 N ASN A 43 -0.961 32.550 -2.886 1.00 0.89 N ATOM 631 CA ASN A 43 -0.762 33.683 -3.782 1.00 0.91 C ATOM 632 C ASN A 43 0.506 33.498 -4.607 1.00 0.83 C ATOM 633 O ASN A 43 1.614 33.654 -4.098 1.00 0.83 O ATOM 634 CB ASN A 43 -0.682 34.996 -2.990 1.00 1.02 C ATOM 635 CG ASN A 43 -1.980 35.324 -2.280 1.00 1.48 C ATOM 636 OD1 ASN A 43 -2.201 34.901 -1.148 1.00 2.14 O ATOM 637 ND2 ASN A 43 -2.841 36.093 -2.930 1.00 2.03 N ATOM 0 H ASN A 43 -0.265 32.471 -2.144 1.00 0.89 H new ATOM 0 HA ASN A 43 -1.617 33.733 -4.456 1.00 0.91 H new ATOM 0 HB2 ASN A 43 0.122 34.926 -2.257 1.00 1.02 H new ATOM 0 HB3 ASN A 43 -0.426 35.811 -3.668 1.00 1.02 H new ATOM 0 HD21 ASN A 43 -3.724 36.354 -2.491 1.00 2.03 H new ATOM 0 HD22 ASN A 43 -2.621 36.424 -3.869 1.00 2.03 H new ATOM 644 N PRO A 44 0.357 33.150 -5.895 1.00 0.84 N ATOM 645 CA PRO A 44 1.494 32.935 -6.798 1.00 0.82 C ATOM 646 C PRO A 44 2.130 34.246 -7.250 1.00 0.88 C ATOM 647 O PRO A 44 3.164 34.255 -7.910 1.00 0.91 O ATOM 648 CB PRO A 44 0.862 32.207 -7.985 1.00 0.92 C ATOM 649 CG PRO A 44 -0.553 32.675 -8.009 1.00 1.01 C ATOM 650 CD PRO A 44 -0.938 32.932 -6.576 1.00 0.93 C ATOM 0 HA PRO A 44 2.301 32.380 -6.319 1.00 0.82 H new ATOM 0 HB2 PRO A 44 1.375 32.449 -8.916 1.00 0.92 H new ATOM 0 HB3 PRO A 44 0.919 31.125 -7.862 1.00 0.92 H new ATOM 0 HG2 PRO A 44 -0.653 33.581 -8.607 1.00 1.01 H new ATOM 0 HG3 PRO A 44 -1.203 31.924 -8.458 1.00 1.01 H new ATOM 0 HD2 PRO A 44 -1.588 33.802 -6.487 1.00 0.93 H new ATOM 0 HD3 PRO A 44 -1.477 32.086 -6.149 1.00 0.93 H new ATOM 658 N ASN A 45 1.511 35.352 -6.859 1.00 0.94 N ATOM 659 CA ASN A 45 1.963 36.677 -7.262 1.00 1.05 C ATOM 660 C ASN A 45 3.229 37.079 -6.512 1.00 1.04 C ATOM 661 O ASN A 45 3.817 38.126 -6.781 1.00 1.15 O ATOM 662 CB ASN A 45 0.869 37.724 -7.019 1.00 1.15 C ATOM 663 CG ASN A 45 -0.437 37.423 -7.743 1.00 1.43 C ATOM 664 OD1 ASN A 45 -0.852 36.270 -7.866 1.00 2.08 O ATOM 665 ND2 ASN A 45 -1.100 38.461 -8.229 1.00 1.88 N ATOM 0 H ASN A 45 0.687 35.357 -6.258 1.00 0.94 H new ATOM 0 HA ASN A 45 2.186 36.635 -8.328 1.00 1.05 H new ATOM 0 HB2 ASN A 45 0.674 37.791 -5.949 1.00 1.15 H new ATOM 0 HB3 ASN A 45 1.235 38.700 -7.338 1.00 1.15 H new ATOM 0 HD21 ASN A 45 -1.981 38.318 -8.722 1.00 1.88 H new ATOM 0 HD22 ASN A 45 -0.729 39.404 -8.110 1.00 1.88 H new ATOM 672 N TRP A 46 3.630 36.256 -5.556 1.00 0.98 N ATOM 673 CA TRP A 46 4.834 36.511 -4.784 1.00 1.04 C ATOM 674 C TRP A 46 5.890 35.442 -5.052 1.00 0.96 C ATOM 675 O TRP A 46 6.873 35.325 -4.322 1.00 1.02 O ATOM 676 CB TRP A 46 4.501 36.560 -3.298 1.00 1.10 C ATOM 677 CG TRP A 46 3.599 37.700 -2.934 1.00 1.28 C ATOM 678 CD1 TRP A 46 2.241 37.725 -3.031 1.00 1.30 C ATOM 679 CD2 TRP A 46 3.990 38.980 -2.425 1.00 1.56 C ATOM 680 NE1 TRP A 46 1.759 38.944 -2.615 1.00 1.52 N ATOM 681 CE2 TRP A 46 2.815 39.731 -2.238 1.00 1.67 C ATOM 682 CE3 TRP A 46 5.220 39.564 -2.116 1.00 1.80 C ATOM 683 CZ2 TRP A 46 2.833 41.032 -1.742 1.00 1.97 C ATOM 684 CZ3 TRP A 46 5.237 40.859 -1.627 1.00 2.13 C ATOM 685 CH2 TRP A 46 4.052 41.581 -1.449 1.00 2.18 C ATOM 0 H TRP A 46 3.136 35.402 -5.296 1.00 0.98 H new ATOM 0 HA TRP A 46 5.240 37.475 -5.091 1.00 1.04 H new ATOM 0 HB2 TRP A 46 4.027 35.623 -3.007 1.00 1.10 H new ATOM 0 HB3 TRP A 46 5.426 36.640 -2.727 1.00 1.10 H new ATOM 0 HD1 TRP A 46 1.631 36.906 -3.383 1.00 1.30 H new ATOM 0 HE1 TRP A 46 0.777 39.217 -2.591 1.00 1.52 H new ATOM 0 HE3 TRP A 46 6.140 39.016 -2.256 1.00 1.80 H new ATOM 0 HZ2 TRP A 46 1.919 41.587 -1.594 1.00 1.97 H new ATOM 0 HZ3 TRP A 46 6.182 41.320 -1.379 1.00 2.13 H new ATOM 0 HH2 TRP A 46 4.100 42.592 -1.073 1.00 2.18 H new ATOM 696 N LEU A 47 5.678 34.668 -6.104 1.00 0.85 N ATOM 697 CA LEU A 47 6.610 33.614 -6.479 1.00 0.78 C ATOM 698 C LEU A 47 7.679 34.154 -7.412 1.00 0.82 C ATOM 699 O LEU A 47 7.430 35.071 -8.194 1.00 0.92 O ATOM 700 CB LEU A 47 5.877 32.460 -7.169 1.00 0.68 C ATOM 701 CG LEU A 47 5.007 31.588 -6.265 1.00 0.62 C ATOM 702 CD1 LEU A 47 4.227 30.583 -7.096 1.00 0.57 C ATOM 703 CD2 LEU A 47 5.867 30.870 -5.244 1.00 0.66 C ATOM 0 H LEU A 47 4.866 34.749 -6.716 1.00 0.85 H new ATOM 0 HA LEU A 47 7.079 33.246 -5.566 1.00 0.78 H new ATOM 0 HB2 LEU A 47 5.248 32.874 -7.957 1.00 0.68 H new ATOM 0 HB3 LEU A 47 6.617 31.823 -7.653 1.00 0.68 H new ATOM 0 HG LEU A 47 4.300 32.228 -5.738 1.00 0.62 H new ATOM 0 HD11 LEU A 47 3.611 29.968 -6.440 1.00 0.57 H new ATOM 0 HD12 LEU A 47 3.588 31.113 -7.802 1.00 0.57 H new ATOM 0 HD13 LEU A 47 4.922 29.946 -7.643 1.00 0.57 H new ATOM 0 HD21 LEU A 47 5.235 30.252 -4.606 1.00 0.66 H new ATOM 0 HD22 LEU A 47 6.591 30.238 -5.758 1.00 0.66 H new ATOM 0 HD23 LEU A 47 6.394 31.603 -4.632 1.00 0.66 H new ATOM 715 N GLU A 48 8.864 33.578 -7.327 1.00 0.81 N ATOM 716 CA GLU A 48 9.958 33.956 -8.203 1.00 0.89 C ATOM 717 C GLU A 48 10.806 32.737 -8.537 1.00 0.71 C ATOM 718 O GLU A 48 10.557 31.639 -8.035 1.00 0.62 O ATOM 719 CB GLU A 48 10.817 35.055 -7.574 1.00 1.15 C ATOM 720 CG GLU A 48 11.379 34.699 -6.207 1.00 1.48 C ATOM 721 CD GLU A 48 12.316 35.766 -5.678 1.00 1.86 C ATOM 722 OE1 GLU A 48 13.515 35.741 -6.030 1.00 2.35 O ATOM 723 OE2 GLU A 48 11.858 36.642 -4.915 1.00 2.13 O ATOM 0 H GLU A 48 9.094 32.844 -6.657 1.00 0.81 H new ATOM 0 HA GLU A 48 9.535 34.354 -9.125 1.00 0.89 H new ATOM 0 HB2 GLU A 48 11.644 35.284 -8.246 1.00 1.15 H new ATOM 0 HB3 GLU A 48 10.219 35.962 -7.484 1.00 1.15 H new ATOM 0 HG2 GLU A 48 10.558 34.558 -5.504 1.00 1.48 H new ATOM 0 HG3 GLU A 48 11.911 33.750 -6.271 1.00 1.48 H new ATOM 730 N LEU A 49 11.807 32.939 -9.378 1.00 0.75 N ATOM 731 CA LEU A 49 12.634 31.850 -9.861 1.00 0.67 C ATOM 732 C LEU A 49 13.558 31.335 -8.758 1.00 0.67 C ATOM 733 O LEU A 49 14.335 32.095 -8.175 1.00 0.73 O ATOM 734 CB LEU A 49 13.460 32.305 -11.071 1.00 0.76 C ATOM 735 CG LEU A 49 12.662 32.842 -12.268 1.00 0.85 C ATOM 736 CD1 LEU A 49 11.474 31.947 -12.586 1.00 1.40 C ATOM 737 CD2 LEU A 49 12.207 34.276 -12.037 1.00 1.11 C ATOM 0 H LEU A 49 12.066 33.856 -9.742 1.00 0.75 H new ATOM 0 HA LEU A 49 11.977 31.035 -10.166 1.00 0.67 H new ATOM 0 HB2 LEU A 49 14.151 33.081 -10.743 1.00 0.76 H new ATOM 0 HB3 LEU A 49 14.064 31.464 -11.411 1.00 0.76 H new ATOM 0 HG LEU A 49 13.330 32.837 -13.129 1.00 0.85 H new ATOM 0 HD11 LEU A 49 10.929 32.354 -13.438 1.00 1.40 H new ATOM 0 HD12 LEU A 49 11.828 30.945 -12.827 1.00 1.40 H new ATOM 0 HD13 LEU A 49 10.812 31.900 -11.721 1.00 1.40 H new ATOM 0 HD21 LEU A 49 11.645 34.624 -12.904 1.00 1.11 H new ATOM 0 HD22 LEU A 49 11.572 34.318 -11.152 1.00 1.11 H new ATOM 0 HD23 LEU A 49 13.078 34.915 -11.889 1.00 1.11 H new ATOM 749 N GLY A 50 13.459 30.044 -8.474 1.00 0.66 N ATOM 750 CA GLY A 50 14.294 29.432 -7.457 1.00 0.72 C ATOM 751 C GLY A 50 13.545 29.186 -6.159 1.00 0.69 C ATOM 752 O GLY A 50 14.124 28.700 -5.192 1.00 0.75 O ATOM 0 H GLY A 50 12.811 29.404 -8.933 1.00 0.66 H new ATOM 0 HA2 GLY A 50 14.684 28.486 -7.833 1.00 0.72 H new ATOM 0 HA3 GLY A 50 15.152 30.075 -7.261 1.00 0.72 H new ATOM 756 N GLN A 51 12.259 29.522 -6.140 1.00 0.62 N ATOM 757 CA GLN A 51 11.430 29.305 -4.954 1.00 0.60 C ATOM 758 C GLN A 51 10.997 27.846 -4.860 1.00 0.56 C ATOM 759 O GLN A 51 10.400 27.302 -5.794 1.00 0.53 O ATOM 760 CB GLN A 51 10.199 30.215 -4.994 1.00 0.59 C ATOM 761 CG GLN A 51 9.295 30.107 -3.768 1.00 0.60 C ATOM 762 CD GLN A 51 10.007 30.469 -2.478 1.00 0.70 C ATOM 763 OE1 GLN A 51 10.520 29.464 -1.789 1.00 1.06 O flip ATOM 764 NE2 GLN A 51 10.063 31.637 -2.084 1.00 0.87 N flip ATOM 0 H GLN A 51 11.768 29.944 -6.928 1.00 0.62 H new ATOM 0 HA GLN A 51 12.023 29.549 -4.072 1.00 0.60 H new ATOM 0 HB2 GLN A 51 10.529 31.249 -5.097 1.00 0.59 H new ATOM 0 HB3 GLN A 51 9.615 29.977 -5.883 1.00 0.59 H new ATOM 0 HG2 GLN A 51 8.434 30.762 -3.898 1.00 0.60 H new ATOM 0 HG3 GLN A 51 8.912 29.089 -3.693 1.00 0.60 H new ATOM 0 HE21 GLN A 51 9.655 32.385 -2.645 1.00 0.87 H new ATOM 0 HE22 GLN A 51 10.517 31.855 -1.197 1.00 0.87 H new ATOM 773 N GLU A 52 11.316 27.220 -3.734 1.00 0.57 N ATOM 774 CA GLU A 52 10.946 25.833 -3.493 1.00 0.55 C ATOM 775 C GLU A 52 9.455 25.705 -3.183 1.00 0.50 C ATOM 776 O GLU A 52 8.880 26.538 -2.478 1.00 0.55 O ATOM 777 CB GLU A 52 11.757 25.263 -2.328 1.00 0.63 C ATOM 778 CG GLU A 52 13.244 25.559 -2.412 1.00 1.15 C ATOM 779 CD GLU A 52 13.662 26.732 -1.544 1.00 1.94 C ATOM 780 OE1 GLU A 52 14.605 26.562 -0.741 1.00 2.44 O ATOM 781 OE2 GLU A 52 13.037 27.810 -1.645 1.00 2.51 O ATOM 0 H GLU A 52 11.833 27.655 -2.970 1.00 0.57 H new ATOM 0 HA GLU A 52 11.163 25.269 -4.400 1.00 0.55 H new ATOM 0 HB2 GLU A 52 11.368 25.669 -1.394 1.00 0.63 H new ATOM 0 HB3 GLU A 52 11.613 24.183 -2.291 1.00 0.63 H new ATOM 0 HG2 GLU A 52 13.803 24.673 -2.111 1.00 1.15 H new ATOM 0 HG3 GLU A 52 13.510 25.767 -3.448 1.00 1.15 H new ATOM 788 N VAL A 53 8.841 24.649 -3.709 1.00 0.43 N ATOM 789 CA VAL A 53 7.435 24.354 -3.448 1.00 0.40 C ATOM 790 C VAL A 53 7.225 22.849 -3.253 1.00 0.41 C ATOM 791 O VAL A 53 8.012 22.033 -3.742 1.00 0.44 O ATOM 792 CB VAL A 53 6.518 24.844 -4.595 1.00 0.37 C ATOM 793 CG1 VAL A 53 6.446 26.365 -4.637 1.00 0.41 C ATOM 794 CG2 VAL A 53 7.001 24.303 -5.931 1.00 0.37 C ATOM 0 H VAL A 53 9.300 23.977 -4.324 1.00 0.43 H new ATOM 0 HA VAL A 53 7.166 24.888 -2.536 1.00 0.40 H new ATOM 0 HB VAL A 53 5.514 24.465 -4.402 1.00 0.37 H new ATOM 0 HG11 VAL A 53 5.794 26.676 -5.453 1.00 0.41 H new ATOM 0 HG12 VAL A 53 6.048 26.737 -3.693 1.00 0.41 H new ATOM 0 HG13 VAL A 53 7.445 26.772 -4.795 1.00 0.41 H new ATOM 0 HG21 VAL A 53 6.345 24.657 -6.726 1.00 0.37 H new ATOM 0 HG22 VAL A 53 8.017 24.650 -6.118 1.00 0.37 H new ATOM 0 HG23 VAL A 53 6.988 23.213 -5.909 1.00 0.37 H new ATOM 804 N GLU A 54 6.179 22.500 -2.518 1.00 0.47 N ATOM 805 CA GLU A 54 5.798 21.110 -2.306 1.00 0.54 C ATOM 806 C GLU A 54 4.452 20.866 -2.977 1.00 0.52 C ATOM 807 O GLU A 54 3.541 21.689 -2.856 1.00 0.54 O ATOM 808 CB GLU A 54 5.713 20.804 -0.803 1.00 0.72 C ATOM 809 CG GLU A 54 4.655 21.621 -0.072 1.00 0.81 C ATOM 810 CD GLU A 54 4.625 21.359 1.420 1.00 1.05 C ATOM 811 OE1 GLU A 54 5.432 21.966 2.150 1.00 1.49 O ATOM 812 OE2 GLU A 54 3.774 20.561 1.875 1.00 1.30 O ATOM 0 H GLU A 54 5.570 23.172 -2.051 1.00 0.47 H new ATOM 0 HA GLU A 54 6.549 20.450 -2.741 1.00 0.54 H new ATOM 0 HB2 GLU A 54 5.498 19.744 -0.668 1.00 0.72 H new ATOM 0 HB3 GLU A 54 6.685 20.993 -0.347 1.00 0.72 H new ATOM 0 HG2 GLU A 54 4.840 22.681 -0.245 1.00 0.81 H new ATOM 0 HG3 GLU A 54 3.675 21.396 -0.494 1.00 0.81 H new ATOM 819 N TYR A 55 4.325 19.768 -3.710 1.00 0.54 N ATOM 820 CA TYR A 55 3.100 19.520 -4.461 1.00 0.58 C ATOM 821 C TYR A 55 2.987 18.076 -4.933 1.00 0.64 C ATOM 822 O TYR A 55 3.901 17.272 -4.751 1.00 0.66 O ATOM 823 CB TYR A 55 3.023 20.465 -5.659 1.00 0.55 C ATOM 824 CG TYR A 55 4.119 20.282 -6.686 1.00 0.52 C ATOM 825 CD1 TYR A 55 5.452 20.519 -6.379 1.00 0.54 C ATOM 826 CD2 TYR A 55 3.806 19.892 -7.975 1.00 0.63 C ATOM 827 CE1 TYR A 55 6.442 20.361 -7.328 1.00 0.56 C ATOM 828 CE2 TYR A 55 4.783 19.732 -8.930 1.00 0.65 C ATOM 829 CZ TYR A 55 6.100 19.971 -8.604 1.00 0.57 C ATOM 830 OH TYR A 55 7.077 19.810 -9.555 1.00 0.63 O ATOM 0 H TYR A 55 5.040 19.046 -3.801 1.00 0.54 H new ATOM 0 HA TYR A 55 2.265 19.706 -3.785 1.00 0.58 H new ATOM 0 HB2 TYR A 55 2.059 20.329 -6.149 1.00 0.55 H new ATOM 0 HB3 TYR A 55 3.053 21.492 -5.296 1.00 0.55 H new ATOM 0 HD1 TYR A 55 5.719 20.832 -5.381 1.00 0.54 H new ATOM 0 HD2 TYR A 55 2.774 19.709 -8.237 1.00 0.63 H new ATOM 0 HE1 TYR A 55 7.476 20.542 -7.072 1.00 0.56 H new ATOM 0 HE2 TYR A 55 4.519 19.421 -9.930 1.00 0.65 H new ATOM 0 HH TYR A 55 7.514 18.941 -9.431 1.00 0.63 H new ATOM 840 N THR A 56 1.854 17.763 -5.550 1.00 0.72 N ATOM 841 CA THR A 56 1.590 16.423 -6.050 1.00 0.82 C ATOM 842 C THR A 56 1.206 16.453 -7.530 1.00 0.85 C ATOM 843 O THR A 56 1.041 17.523 -8.120 1.00 0.85 O ATOM 844 CB THR A 56 0.468 15.740 -5.241 1.00 0.88 C ATOM 845 OG1 THR A 56 -0.599 16.669 -5.001 1.00 0.84 O ATOM 846 CG2 THR A 56 0.999 15.198 -3.916 1.00 0.94 C ATOM 0 H THR A 56 1.098 18.427 -5.716 1.00 0.72 H new ATOM 0 HA THR A 56 2.509 15.848 -5.935 1.00 0.82 H new ATOM 0 HB THR A 56 0.089 14.900 -5.824 1.00 0.88 H new ATOM 0 HG1 THR A 56 -1.308 16.227 -4.488 1.00 0.84 H new ATOM 0 HG21 THR A 56 0.187 14.722 -3.366 1.00 0.94 H new ATOM 0 HG22 THR A 56 1.784 14.467 -4.110 1.00 0.94 H new ATOM 0 HG23 THR A 56 1.406 16.018 -3.324 1.00 0.94 H new ATOM 854 N LEU A 57 1.071 15.275 -8.125 1.00 0.96 N ATOM 855 CA LEU A 57 0.712 15.168 -9.533 1.00 1.03 C ATOM 856 C LEU A 57 -0.713 14.656 -9.696 1.00 1.12 C ATOM 857 O LEU A 57 -1.166 13.806 -8.930 1.00 1.19 O ATOM 858 CB LEU A 57 1.679 14.239 -10.267 1.00 1.09 C ATOM 859 CG LEU A 57 3.116 14.749 -10.389 1.00 1.04 C ATOM 860 CD1 LEU A 57 3.983 13.738 -11.122 1.00 1.13 C ATOM 861 CD2 LEU A 57 3.153 16.085 -11.105 1.00 1.03 C ATOM 0 H LEU A 57 1.205 14.380 -7.654 1.00 0.96 H new ATOM 0 HA LEU A 57 0.777 16.166 -9.968 1.00 1.03 H new ATOM 0 HB2 LEU A 57 1.695 13.279 -9.751 1.00 1.09 H new ATOM 0 HB3 LEU A 57 1.290 14.056 -11.269 1.00 1.09 H new ATOM 0 HG LEU A 57 3.513 14.884 -9.383 1.00 1.04 H new ATOM 0 HD11 LEU A 57 5.001 14.119 -11.198 1.00 1.13 H new ATOM 0 HD12 LEU A 57 3.988 12.797 -10.572 1.00 1.13 H new ATOM 0 HD13 LEU A 57 3.582 13.572 -12.122 1.00 1.13 H new ATOM 0 HD21 LEU A 57 4.185 16.429 -11.181 1.00 1.03 H new ATOM 0 HD22 LEU A 57 2.733 15.974 -12.105 1.00 1.03 H new ATOM 0 HD23 LEU A 57 2.568 16.814 -10.545 1.00 1.03 H new ATOM 873 N ALA A 58 -1.397 15.159 -10.717 1.00 1.17 N ATOM 874 CA ALA A 58 -2.787 14.796 -10.979 1.00 1.30 C ATOM 875 C ALA A 58 -2.883 13.533 -11.840 1.00 1.40 C ATOM 876 O ALA A 58 -3.779 13.398 -12.677 1.00 2.04 O ATOM 877 CB ALA A 58 -3.506 15.956 -11.655 1.00 1.33 C ATOM 0 H ALA A 58 -1.008 15.826 -11.384 1.00 1.17 H new ATOM 0 HA ALA A 58 -3.268 14.582 -10.025 1.00 1.30 H new ATOM 0 HB1 ALA A 58 -4.542 15.679 -11.848 1.00 1.33 H new ATOM 0 HB2 ALA A 58 -3.479 16.830 -11.004 1.00 1.33 H new ATOM 0 HB3 ALA A 58 -3.012 16.191 -12.598 1.00 1.33 H new ATOM 1026 N LEU A 70 0.711 15.486 -17.587 1.00 1.49 N ATOM 1027 CA LEU A 70 -0.430 16.072 -16.902 1.00 1.50 C ATOM 1028 C LEU A 70 -0.005 17.269 -16.064 1.00 1.25 C ATOM 1029 O LEU A 70 1.129 17.328 -15.590 1.00 1.15 O ATOM 1030 CB LEU A 70 -1.089 15.027 -15.998 1.00 1.71 C ATOM 1031 CG LEU A 70 -1.560 13.752 -16.696 1.00 1.88 C ATOM 1032 CD1 LEU A 70 -2.118 12.775 -15.682 1.00 2.30 C ATOM 1033 CD2 LEU A 70 -2.604 14.067 -17.748 1.00 2.29 C ATOM 0 HA LEU A 70 -1.142 16.408 -17.655 1.00 1.50 H new ATOM 0 HB2 LEU A 70 -0.381 14.751 -15.216 1.00 1.71 H new ATOM 0 HB3 LEU A 70 -1.945 15.487 -15.505 1.00 1.71 H new ATOM 0 HG LEU A 70 -0.702 13.297 -17.191 1.00 1.88 H new ATOM 0 HD11 LEU A 70 -2.450 11.871 -16.192 1.00 2.30 H new ATOM 0 HD12 LEU A 70 -1.344 12.520 -14.958 1.00 2.30 H new ATOM 0 HD13 LEU A 70 -2.962 13.230 -15.164 1.00 2.30 H new ATOM 0 HD21 LEU A 70 -2.924 13.144 -18.231 1.00 2.29 H new ATOM 0 HD22 LEU A 70 -3.462 14.546 -17.277 1.00 2.29 H new ATOM 0 HD23 LEU A 70 -2.178 14.738 -18.494 1.00 2.29 H new ATOM 1045 N PRO A 71 -0.909 18.247 -15.883 1.00 1.22 N ATOM 1046 CA PRO A 71 -0.666 19.393 -15.002 1.00 1.05 C ATOM 1047 C PRO A 71 -0.571 18.971 -13.537 1.00 0.97 C ATOM 1048 O PRO A 71 -1.206 18.002 -13.114 1.00 1.14 O ATOM 1049 CB PRO A 71 -1.892 20.286 -15.212 1.00 1.18 C ATOM 1050 CG PRO A 71 -2.948 19.373 -15.731 1.00 1.38 C ATOM 1051 CD PRO A 71 -2.233 18.318 -16.526 1.00 1.43 C ATOM 0 HA PRO A 71 0.277 19.888 -15.232 1.00 1.05 H new ATOM 0 HB2 PRO A 71 -2.201 20.758 -14.279 1.00 1.18 H new ATOM 0 HB3 PRO A 71 -1.680 21.088 -15.920 1.00 1.18 H new ATOM 0 HG2 PRO A 71 -3.514 18.928 -14.913 1.00 1.38 H new ATOM 0 HG3 PRO A 71 -3.660 19.915 -16.354 1.00 1.38 H new ATOM 0 HD2 PRO A 71 -2.753 17.361 -16.483 1.00 1.43 H new ATOM 0 HD3 PRO A 71 -2.155 18.591 -17.578 1.00 1.43 H new ATOM 1059 N ALA A 72 0.226 19.695 -12.771 1.00 0.80 N ATOM 1060 CA ALA A 72 0.360 19.430 -11.347 1.00 0.74 C ATOM 1061 C ALA A 72 -0.727 20.155 -10.563 1.00 0.72 C ATOM 1062 O ALA A 72 -1.278 21.152 -11.035 1.00 0.82 O ATOM 1063 CB ALA A 72 1.733 19.860 -10.860 1.00 0.70 C ATOM 0 H ALA A 72 0.792 20.473 -13.111 1.00 0.80 H new ATOM 0 HA ALA A 72 0.248 18.358 -11.183 1.00 0.74 H new ATOM 0 HB1 ALA A 72 1.821 19.656 -9.793 1.00 0.70 H new ATOM 0 HB2 ALA A 72 2.501 19.305 -11.400 1.00 0.70 H new ATOM 0 HB3 ALA A 72 1.864 20.927 -11.038 1.00 0.70 H new ATOM 1069 N GLU A 73 -1.034 19.659 -9.372 1.00 0.74 N ATOM 1070 CA GLU A 73 -2.037 20.290 -8.526 1.00 0.77 C ATOM 1071 C GLU A 73 -1.635 20.209 -7.056 1.00 0.69 C ATOM 1072 O GLU A 73 -0.726 19.453 -6.694 1.00 0.71 O ATOM 1073 CB GLU A 73 -3.414 19.648 -8.724 1.00 0.94 C ATOM 1074 CG GLU A 73 -3.528 18.239 -8.167 1.00 1.28 C ATOM 1075 CD GLU A 73 -4.958 17.751 -8.136 1.00 1.84 C ATOM 1076 OE1 GLU A 73 -5.782 18.365 -7.419 1.00 2.30 O ATOM 1077 OE2 GLU A 73 -5.268 16.751 -8.809 1.00 2.28 O ATOM 0 H GLU A 73 -0.605 18.825 -8.971 1.00 0.74 H new ATOM 0 HA GLU A 73 -2.099 21.338 -8.819 1.00 0.77 H new ATOM 0 HB2 GLU A 73 -4.168 20.277 -8.250 1.00 0.94 H new ATOM 0 HB3 GLU A 73 -3.643 19.625 -9.790 1.00 0.94 H new ATOM 0 HG2 GLU A 73 -2.928 17.561 -8.773 1.00 1.28 H new ATOM 0 HG3 GLU A 73 -3.116 18.214 -7.158 1.00 1.28 H new ATOM 1084 N ASN A 74 -2.329 20.990 -6.225 1.00 0.68 N ATOM 1085 CA ASN A 74 -2.044 21.082 -4.790 1.00 0.69 C ATOM 1086 C ASN A 74 -0.590 21.469 -4.556 1.00 0.59 C ATOM 1087 O ASN A 74 0.248 20.629 -4.227 1.00 0.66 O ATOM 1088 CB ASN A 74 -2.367 19.765 -4.073 1.00 0.81 C ATOM 1089 CG ASN A 74 -2.412 19.907 -2.558 1.00 1.39 C ATOM 1090 OD1 ASN A 74 -1.769 20.777 -1.969 1.00 1.81 O ATOM 1091 ND2 ASN A 74 -3.182 19.045 -1.910 1.00 2.01 N ATOM 0 H ASN A 74 -3.106 21.578 -6.528 1.00 0.68 H new ATOM 0 HA ASN A 74 -2.685 21.859 -4.373 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -3.328 19.392 -4.426 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -1.618 19.019 -4.340 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -3.255 19.090 -0.894 1.00 2.01 H new ATOM 0 HD22 ASN A 74 -3.702 18.336 -2.428 1.00 2.01 H new ATOM 1098 N VAL A 75 -0.296 22.743 -4.755 1.00 0.66 N ATOM 1099 CA VAL A 75 1.060 23.243 -4.611 1.00 0.58 C ATOM 1100 C VAL A 75 1.145 24.243 -3.467 1.00 0.59 C ATOM 1101 O VAL A 75 0.461 25.269 -3.476 1.00 0.64 O ATOM 1102 CB VAL A 75 1.553 23.912 -5.914 1.00 0.56 C ATOM 1103 CG1 VAL A 75 3.004 24.351 -5.786 1.00 0.72 C ATOM 1104 CG2 VAL A 75 1.383 22.973 -7.098 1.00 0.80 C ATOM 0 H VAL A 75 -0.981 23.452 -5.018 1.00 0.66 H new ATOM 0 HA VAL A 75 1.700 22.388 -4.393 1.00 0.58 H new ATOM 0 HB VAL A 75 0.944 24.799 -6.087 1.00 0.56 H new ATOM 0 HG11 VAL A 75 3.326 24.819 -6.716 1.00 0.72 H new ATOM 0 HG12 VAL A 75 3.097 25.067 -4.969 1.00 0.72 H new ATOM 0 HG13 VAL A 75 3.630 23.483 -5.581 1.00 0.72 H new ATOM 0 HG21 VAL A 75 1.736 23.464 -8.005 1.00 0.80 H new ATOM 0 HG22 VAL A 75 1.961 22.065 -6.928 1.00 0.80 H new ATOM 0 HG23 VAL A 75 0.330 22.717 -7.211 1.00 0.80 H new ATOM 1114 N ARG A 76 1.975 23.935 -2.484 1.00 0.58 N ATOM 1115 CA ARG A 76 2.200 24.829 -1.361 1.00 0.62 C ATOM 1116 C ARG A 76 3.658 25.264 -1.345 1.00 0.55 C ATOM 1117 O ARG A 76 4.530 24.535 -1.812 1.00 0.52 O ATOM 1118 CB ARG A 76 1.856 24.147 -0.031 1.00 0.73 C ATOM 1119 CG ARG A 76 0.523 23.418 -0.027 1.00 1.28 C ATOM 1120 CD ARG A 76 0.135 22.986 1.378 1.00 1.58 C ATOM 1121 NE ARG A 76 1.213 22.271 2.063 1.00 2.10 N ATOM 1122 CZ ARG A 76 1.426 22.330 3.379 1.00 2.75 C ATOM 1123 NH1 ARG A 76 0.619 23.034 4.166 1.00 3.11 N ATOM 1124 NH2 ARG A 76 2.445 21.674 3.908 1.00 3.51 N ATOM 0 H ARG A 76 2.507 23.066 -2.442 1.00 0.58 H new ATOM 0 HA ARG A 76 1.551 25.697 -1.478 1.00 0.62 H new ATOM 0 HB2 ARG A 76 2.646 23.437 0.214 1.00 0.73 H new ATOM 0 HB3 ARG A 76 1.848 24.899 0.758 1.00 0.73 H new ATOM 0 HG2 ARG A 76 -0.251 24.067 -0.437 1.00 1.28 H new ATOM 0 HG3 ARG A 76 0.582 22.544 -0.675 1.00 1.28 H new ATOM 0 HD2 ARG A 76 -0.142 23.864 1.961 1.00 1.58 H new ATOM 0 HD3 ARG A 76 -0.746 22.346 1.328 1.00 1.58 H new ATOM 0 HE ARG A 76 1.838 21.693 1.501 1.00 2.10 H new ATOM 0 HH11 ARG A 76 -0.173 23.537 3.765 1.00 3.11 H new ATOM 0 HH12 ARG A 76 0.792 23.072 5.171 1.00 3.11 H new ATOM 0 HH21 ARG A 76 3.064 21.126 3.311 1.00 3.51 H new ATOM 0 HH22 ARG A 76 2.612 21.716 4.913 1.00 3.51 H new ATOM 1138 N MET A 77 3.923 26.447 -0.821 1.00 0.63 N ATOM 1139 CA MET A 77 5.291 26.929 -0.715 1.00 0.60 C ATOM 1140 C MET A 77 5.927 26.455 0.581 1.00 0.70 C ATOM 1141 O MET A 77 5.259 26.375 1.612 1.00 0.91 O ATOM 1142 CB MET A 77 5.339 28.457 -0.751 1.00 0.72 C ATOM 1143 CG MET A 77 5.932 29.032 -2.024 1.00 0.80 C ATOM 1144 SD MET A 77 6.423 30.758 -1.824 1.00 1.12 S ATOM 1145 CE MET A 77 4.850 31.523 -1.455 1.00 0.86 C ATOM 0 H MET A 77 3.215 27.089 -0.464 1.00 0.63 H new ATOM 0 HA MET A 77 5.843 26.529 -1.566 1.00 0.60 H new ATOM 0 HB2 MET A 77 4.327 28.844 -0.628 1.00 0.72 H new ATOM 0 HB3 MET A 77 5.921 28.811 0.100 1.00 0.72 H new ATOM 0 HG2 MET A 77 6.799 28.441 -2.319 1.00 0.80 H new ATOM 0 HG3 MET A 77 5.203 28.954 -2.831 1.00 0.80 H new ATOM 0 HE1 MET A 77 5.012 32.551 -1.133 1.00 0.86 H new ATOM 0 HE2 MET A 77 4.224 31.517 -2.347 1.00 0.86 H new ATOM 0 HE3 MET A 77 4.353 30.968 -0.660 1.00 0.86 H new ATOM 1155 N LEU A 78 7.210 26.137 0.527 1.00 0.65 N ATOM 1156 CA LEU A 78 7.966 25.849 1.734 1.00 0.83 C ATOM 1157 C LEU A 78 9.250 26.674 1.705 1.00 0.83 C ATOM 1158 O LEU A 78 10.050 26.563 0.777 1.00 0.93 O ATOM 1159 CB LEU A 78 8.227 24.338 1.916 1.00 0.99 C ATOM 1160 CG LEU A 78 9.287 23.684 1.026 1.00 1.05 C ATOM 1161 CD1 LEU A 78 9.552 22.265 1.502 1.00 1.49 C ATOM 1162 CD2 LEU A 78 8.842 23.664 -0.421 1.00 1.67 C ATOM 0 H LEU A 78 7.748 26.072 -0.337 1.00 0.65 H new ATOM 0 HA LEU A 78 7.381 26.135 2.608 1.00 0.83 H new ATOM 0 HB2 LEU A 78 8.512 24.170 2.955 1.00 0.99 H new ATOM 0 HB3 LEU A 78 7.285 23.814 1.755 1.00 0.99 H new ATOM 0 HG LEU A 78 10.203 24.270 1.095 1.00 1.05 H new ATOM 0 HD11 LEU A 78 10.307 21.803 0.866 1.00 1.49 H new ATOM 0 HD12 LEU A 78 9.909 22.287 2.532 1.00 1.49 H new ATOM 0 HD13 LEU A 78 8.630 21.686 1.450 1.00 1.49 H new ATOM 0 HD21 LEU A 78 9.613 23.194 -1.032 1.00 1.67 H new ATOM 0 HD22 LEU A 78 7.914 23.098 -0.509 1.00 1.67 H new ATOM 0 HD23 LEU A 78 8.678 24.685 -0.765 1.00 1.67 H new ATOM 1174 N PRO A 79 9.437 27.541 2.707 1.00 1.15 N ATOM 1175 CA PRO A 79 10.413 28.631 2.631 1.00 1.27 C ATOM 1176 C PRO A 79 11.876 28.237 2.841 1.00 1.13 C ATOM 1177 O PRO A 79 12.265 27.790 3.918 1.00 1.59 O ATOM 1178 CB PRO A 79 9.965 29.559 3.753 1.00 1.97 C ATOM 1179 CG PRO A 79 9.339 28.658 4.764 1.00 2.15 C ATOM 1180 CD PRO A 79 8.707 27.533 3.990 1.00 1.65 C ATOM 0 HA PRO A 79 10.417 29.056 1.627 1.00 1.27 H new ATOM 0 HB2 PRO A 79 10.809 30.104 4.177 1.00 1.97 H new ATOM 0 HB3 PRO A 79 9.255 30.303 3.392 1.00 1.97 H new ATOM 0 HG2 PRO A 79 10.085 28.279 5.462 1.00 2.15 H new ATOM 0 HG3 PRO A 79 8.593 29.192 5.353 1.00 2.15 H new ATOM 0 HD2 PRO A 79 8.816 26.580 4.507 1.00 1.65 H new ATOM 0 HD3 PRO A 79 7.639 27.697 3.845 1.00 1.65 H new ATOM 1188 N LYS A 80 12.649 28.447 1.773 1.00 1.09 N ATOM 1189 CA LYS A 80 14.113 28.521 1.779 1.00 1.37 C ATOM 1190 C LYS A 80 14.853 27.323 2.393 1.00 1.18 C ATOM 1191 O LYS A 80 14.602 26.911 3.525 1.00 1.19 O ATOM 1192 CB LYS A 80 14.558 29.807 2.465 1.00 1.96 C ATOM 1193 CG LYS A 80 15.952 30.232 2.045 1.00 2.65 C ATOM 1194 CD LYS A 80 16.357 31.576 2.634 1.00 3.44 C ATOM 1195 CE LYS A 80 16.755 31.471 4.099 1.00 4.04 C ATOM 1196 NZ LYS A 80 15.585 31.340 5.006 1.00 4.61 N ATOM 0 H LYS A 80 12.256 28.576 0.841 1.00 1.09 H new ATOM 0 HA LYS A 80 14.393 28.504 0.726 1.00 1.37 H new ATOM 0 HB2 LYS A 80 13.852 30.604 2.231 1.00 1.96 H new ATOM 0 HB3 LYS A 80 14.534 29.667 3.546 1.00 1.96 H new ATOM 0 HG2 LYS A 80 16.669 29.472 2.357 1.00 2.65 H new ATOM 0 HG3 LYS A 80 15.999 30.287 0.957 1.00 2.65 H new ATOM 0 HD2 LYS A 80 17.191 31.984 2.062 1.00 3.44 H new ATOM 0 HD3 LYS A 80 15.529 32.278 2.535 1.00 3.44 H new ATOM 0 HE2 LYS A 80 17.410 30.610 4.232 1.00 4.04 H new ATOM 0 HE3 LYS A 80 17.329 32.354 4.379 1.00 4.04 H new ATOM 0 HZ1 LYS A 80 15.714 31.961 5.830 1.00 4.61 H new ATOM 0 HZ2 LYS A 80 14.720 31.614 4.498 1.00 4.61 H new ATOM 0 HZ3 LYS A 80 15.502 30.354 5.325 1.00 4.61 H new ATOM 1210 N ASN A 81 15.797 26.797 1.615 1.00 1.26 N ATOM 1211 CA ASN A 81 16.799 25.836 2.093 1.00 1.35 C ATOM 1212 C ASN A 81 16.184 24.450 2.270 1.00 1.23 C ATOM 1213 O ASN A 81 16.616 23.652 3.106 1.00 1.43 O ATOM 1214 CB ASN A 81 17.435 26.336 3.402 1.00 1.57 C ATOM 1215 CG ASN A 81 18.683 25.565 3.800 1.00 2.26 C ATOM 1216 OD1 ASN A 81 19.410 25.049 2.949 1.00 2.84 O ATOM 1217 ND2 ASN A 81 18.948 25.498 5.096 1.00 2.81 N ATOM 0 H ASN A 81 15.892 27.026 0.625 1.00 1.26 H new ATOM 0 HA ASN A 81 17.585 25.752 1.343 1.00 1.35 H new ATOM 0 HB2 ASN A 81 17.687 27.391 3.295 1.00 1.57 H new ATOM 0 HB3 ASN A 81 16.701 26.264 4.205 1.00 1.57 H new ATOM 0 HD21 ASN A 81 19.780 25.006 5.422 1.00 2.81 H new ATOM 0 HD22 ASN A 81 18.320 25.939 5.768 1.00 2.81 H new ATOM 1224 N SER A 82 15.188 24.155 1.455 1.00 1.01 N ATOM 1225 CA SER A 82 14.531 22.860 1.498 1.00 1.03 C ATOM 1226 C SER A 82 15.142 21.903 0.469 1.00 0.96 C ATOM 1227 O SER A 82 14.674 20.777 0.295 1.00 1.12 O ATOM 1228 CB SER A 82 13.036 23.036 1.249 1.00 1.08 C ATOM 1229 OG SER A 82 12.473 23.932 2.193 1.00 1.70 O ATOM 0 H SER A 82 14.815 24.795 0.754 1.00 1.01 H new ATOM 0 HA SER A 82 14.678 22.423 2.486 1.00 1.03 H new ATOM 0 HB2 SER A 82 12.872 23.413 0.240 1.00 1.08 H new ATOM 0 HB3 SER A 82 12.535 22.070 1.313 1.00 1.08 H new ATOM 0 HG SER A 82 11.774 23.473 2.703 1.00 1.70 H new ATOM 1235 N ILE A 83 16.193 22.363 -0.200 1.00 0.83 N ATOM 1236 CA ILE A 83 16.888 21.562 -1.199 1.00 0.77 C ATOM 1237 C ILE A 83 18.249 21.135 -0.647 1.00 0.76 C ATOM 1238 O ILE A 83 18.940 21.943 -0.025 1.00 0.78 O ATOM 1239 CB ILE A 83 17.097 22.359 -2.515 1.00 0.76 C ATOM 1240 CG1 ILE A 83 15.852 23.184 -2.860 1.00 0.92 C ATOM 1241 CG2 ILE A 83 17.443 21.428 -3.665 1.00 0.79 C ATOM 1242 CD1 ILE A 83 14.591 22.368 -3.045 1.00 0.69 C ATOM 0 H ILE A 83 16.585 23.295 -0.066 1.00 0.83 H new ATOM 0 HA ILE A 83 16.277 20.687 -1.421 1.00 0.77 H new ATOM 0 HB ILE A 83 17.932 23.042 -2.359 1.00 0.76 H new ATOM 0 HG12 ILE A 83 15.684 23.914 -2.068 1.00 0.92 H new ATOM 0 HG13 ILE A 83 16.045 23.744 -3.775 1.00 0.92 H new ATOM 0 HG21 ILE A 83 17.584 22.011 -4.575 1.00 0.79 H new ATOM 0 HG22 ILE A 83 18.362 20.889 -3.433 1.00 0.79 H new ATOM 0 HG23 ILE A 83 16.632 20.715 -3.813 1.00 0.79 H new ATOM 0 HD11 ILE A 83 13.760 23.031 -3.286 1.00 0.69 H new ATOM 0 HD12 ILE A 83 14.734 21.656 -3.858 1.00 0.69 H new ATOM 0 HD13 ILE A 83 14.369 21.828 -2.124 1.00 0.69 H new ATOM 1254 N PRO A 84 18.643 19.860 -0.837 1.00 0.82 N ATOM 1255 CA PRO A 84 19.941 19.356 -0.368 1.00 0.89 C ATOM 1256 C PRO A 84 21.107 19.987 -1.125 1.00 0.83 C ATOM 1257 O PRO A 84 20.943 20.457 -2.254 1.00 0.82 O ATOM 1258 CB PRO A 84 19.866 17.856 -0.664 1.00 1.03 C ATOM 1259 CG PRO A 84 18.914 17.762 -1.800 1.00 1.03 C ATOM 1260 CD PRO A 84 17.871 18.808 -1.525 1.00 0.91 C ATOM 0 HA PRO A 84 20.117 19.589 0.682 1.00 0.89 H new ATOM 0 HB2 PRO A 84 20.843 17.452 -0.928 1.00 1.03 H new ATOM 0 HB3 PRO A 84 19.512 17.295 0.201 1.00 1.03 H new ATOM 0 HG2 PRO A 84 19.415 17.945 -2.750 1.00 1.03 H new ATOM 0 HG3 PRO A 84 18.470 16.769 -1.861 1.00 1.03 H new ATOM 0 HD2 PRO A 84 17.414 19.176 -2.444 1.00 0.91 H new ATOM 0 HD3 PRO A 84 17.065 18.422 -0.900 1.00 0.91 H new ATOM 1268 N GLN A 85 22.280 20.003 -0.507 1.00 0.88 N ATOM 1269 CA GLN A 85 23.451 20.596 -1.131 1.00 0.88 C ATOM 1270 C GLN A 85 24.573 19.571 -1.270 1.00 0.77 C ATOM 1271 O GLN A 85 24.726 18.693 -0.419 1.00 0.74 O ATOM 1272 CB GLN A 85 23.946 21.793 -0.314 1.00 1.06 C ATOM 1273 CG GLN A 85 22.896 22.876 -0.111 1.00 1.73 C ATOM 1274 CD GLN A 85 23.381 23.996 0.788 1.00 2.21 C ATOM 1275 OE1 GLN A 85 24.572 24.311 0.827 1.00 2.76 O ATOM 1276 NE2 GLN A 85 22.465 24.601 1.527 1.00 2.65 N ATOM 0 H GLN A 85 22.444 19.614 0.421 1.00 0.88 H new ATOM 0 HA GLN A 85 23.163 20.936 -2.126 1.00 0.88 H new ATOM 0 HB2 GLN A 85 24.284 21.441 0.661 1.00 1.06 H new ATOM 0 HB3 GLN A 85 24.812 22.228 -0.813 1.00 1.06 H new ATOM 0 HG2 GLN A 85 22.613 23.289 -1.079 1.00 1.73 H new ATOM 0 HG3 GLN A 85 21.999 22.431 0.320 1.00 1.73 H new ATOM 0 HE21 GLN A 85 21.489 24.312 1.467 1.00 2.65 H new ATOM 0 HE22 GLN A 85 22.735 25.357 2.157 1.00 2.65 H new ATOM 1285 N PRO A 86 25.367 19.671 -2.346 1.00 0.81 N ATOM 1286 CA PRO A 86 26.526 18.802 -2.566 1.00 0.79 C ATOM 1287 C PRO A 86 27.633 19.052 -1.548 1.00 0.77 C ATOM 1288 O PRO A 86 27.797 20.172 -1.061 1.00 0.85 O ATOM 1289 CB PRO A 86 27.006 19.181 -3.968 1.00 0.88 C ATOM 1290 CG PRO A 86 26.481 20.554 -4.198 1.00 1.08 C ATOM 1291 CD PRO A 86 25.188 20.641 -3.437 1.00 0.95 C ATOM 0 HA PRO A 86 26.265 17.749 -2.463 1.00 0.79 H new ATOM 0 HB2 PRO A 86 28.094 19.159 -4.032 1.00 0.88 H new ATOM 0 HB3 PRO A 86 26.629 18.484 -4.716 1.00 0.88 H new ATOM 0 HG2 PRO A 86 27.189 21.305 -3.849 1.00 1.08 H new ATOM 0 HG3 PRO A 86 26.320 20.737 -5.261 1.00 1.08 H new ATOM 0 HD2 PRO A 86 25.014 21.647 -3.055 1.00 0.95 H new ATOM 0 HD3 PRO A 86 24.334 20.386 -4.065 1.00 0.95 H new ATOM 1299 N ALA A 87 28.402 18.018 -1.245 1.00 0.84 N ATOM 1300 CA ALA A 87 29.450 18.126 -0.248 1.00 0.93 C ATOM 1301 C ALA A 87 30.796 18.378 -0.911 1.00 0.90 C ATOM 1302 O ALA A 87 31.482 17.446 -1.329 1.00 0.98 O ATOM 1303 CB ALA A 87 29.500 16.862 0.594 1.00 1.10 C ATOM 0 H ALA A 87 28.319 17.097 -1.675 1.00 0.84 H new ATOM 0 HA ALA A 87 29.227 18.972 0.402 1.00 0.93 H new ATOM 0 HB1 ALA A 87 30.290 16.953 1.340 1.00 1.10 H new ATOM 0 HB2 ALA A 87 28.542 16.720 1.095 1.00 1.10 H new ATOM 0 HB3 ALA A 87 29.704 16.005 -0.048 1.00 1.10 H new ATOM 1309 N VAL A 88 31.155 19.647 -1.015 1.00 0.87 N ATOM 1310 CA VAL A 88 32.437 20.049 -1.584 1.00 0.88 C ATOM 1311 C VAL A 88 33.020 21.174 -0.737 1.00 1.02 C ATOM 1312 O VAL A 88 32.305 22.106 -0.375 1.00 1.23 O ATOM 1313 CB VAL A 88 32.296 20.530 -3.048 1.00 0.81 C ATOM 1314 CG1 VAL A 88 33.660 20.780 -3.668 1.00 0.87 C ATOM 1315 CG2 VAL A 88 31.520 19.526 -3.883 1.00 0.94 C ATOM 0 H VAL A 88 30.572 20.426 -0.710 1.00 0.87 H new ATOM 0 HA VAL A 88 33.096 19.181 -1.584 1.00 0.88 H new ATOM 0 HB VAL A 88 31.740 21.468 -3.034 1.00 0.81 H new ATOM 0 HG11 VAL A 88 33.536 21.117 -4.697 1.00 0.87 H new ATOM 0 HG12 VAL A 88 34.185 21.545 -3.096 1.00 0.87 H new ATOM 0 HG13 VAL A 88 34.240 19.857 -3.656 1.00 0.87 H new ATOM 0 HG21 VAL A 88 31.437 19.891 -4.907 1.00 0.94 H new ATOM 0 HG22 VAL A 88 32.042 18.569 -3.880 1.00 0.94 H new ATOM 0 HG23 VAL A 88 30.523 19.396 -3.462 1.00 0.94 H new ATOM 1325 N LEU A 89 34.304 21.090 -0.415 1.00 1.09 N ATOM 1326 CA LEU A 89 34.895 22.030 0.532 1.00 1.27 C ATOM 1327 C LEU A 89 35.112 23.411 -0.093 1.00 1.15 C ATOM 1328 O LEU A 89 34.485 24.390 0.316 1.00 1.29 O ATOM 1329 CB LEU A 89 36.233 21.484 1.037 1.00 1.54 C ATOM 1330 CG LEU A 89 36.183 20.089 1.666 1.00 2.14 C ATOM 1331 CD1 LEU A 89 37.585 19.616 2.018 1.00 2.87 C ATOM 1332 CD2 LEU A 89 35.293 20.082 2.900 1.00 2.45 C ATOM 0 H LEU A 89 34.949 20.393 -0.788 1.00 1.09 H new ATOM 0 HA LEU A 89 34.198 22.143 1.362 1.00 1.27 H new ATOM 0 HB2 LEU A 89 36.934 21.462 0.203 1.00 1.54 H new ATOM 0 HB3 LEU A 89 36.635 22.181 1.773 1.00 1.54 H new ATOM 0 HG LEU A 89 35.756 19.401 0.936 1.00 2.14 H new ATOM 0 HD11 LEU A 89 37.533 18.623 2.464 1.00 2.87 H new ATOM 0 HD12 LEU A 89 38.193 19.576 1.114 1.00 2.87 H new ATOM 0 HD13 LEU A 89 38.035 20.309 2.728 1.00 2.87 H new ATOM 0 HD21 LEU A 89 35.274 19.080 3.329 1.00 2.45 H new ATOM 0 HD22 LEU A 89 35.685 20.784 3.636 1.00 2.45 H new ATOM 0 HD23 LEU A 89 34.281 20.377 2.621 1.00 2.45 H new ATOM 1344 N GLU A 90 35.990 23.492 -1.087 1.00 1.05 N ATOM 1345 CA GLU A 90 36.262 24.766 -1.748 1.00 1.13 C ATOM 1346 C GLU A 90 35.445 24.913 -3.021 1.00 1.04 C ATOM 1347 O GLU A 90 34.667 25.852 -3.173 1.00 1.34 O ATOM 1348 CB GLU A 90 37.743 24.875 -2.096 1.00 1.30 C ATOM 1349 CG GLU A 90 38.669 24.669 -0.912 1.00 1.98 C ATOM 1350 CD GLU A 90 40.125 24.757 -1.306 1.00 2.31 C ATOM 1351 OE1 GLU A 90 40.645 25.884 -1.435 1.00 2.59 O ATOM 1352 OE2 GLU A 90 40.761 23.696 -1.484 1.00 2.84 O ATOM 0 H GLU A 90 36.521 22.701 -1.451 1.00 1.05 H new ATOM 0 HA GLU A 90 35.983 25.560 -1.056 1.00 1.13 H new ATOM 0 HB2 GLU A 90 37.981 24.139 -2.863 1.00 1.30 H new ATOM 0 HB3 GLU A 90 37.934 25.858 -2.527 1.00 1.30 H new ATOM 0 HG2 GLU A 90 38.454 25.418 -0.150 1.00 1.98 H new ATOM 0 HG3 GLU A 90 38.473 23.694 -0.465 1.00 1.98 H new ATOM 1359 N THR A 91 35.616 23.930 -3.895 1.00 0.84 N ATOM 1360 CA THR A 91 35.037 23.900 -5.232 1.00 0.77 C ATOM 1361 C THR A 91 35.564 22.655 -5.930 1.00 0.77 C ATOM 1362 O THR A 91 36.577 22.095 -5.503 1.00 0.95 O ATOM 1363 CB THR A 91 35.409 25.136 -6.096 1.00 0.81 C ATOM 1364 OG1 THR A 91 36.666 25.684 -5.671 1.00 1.42 O ATOM 1365 CG2 THR A 91 34.329 26.214 -6.063 1.00 1.41 C ATOM 0 H THR A 91 36.179 23.106 -3.687 1.00 0.84 H new ATOM 0 HA THR A 91 33.952 23.902 -5.124 1.00 0.77 H new ATOM 0 HB THR A 91 35.493 24.791 -7.127 1.00 0.81 H new ATOM 0 HG1 THR A 91 36.888 26.461 -6.225 1.00 1.42 H new ATOM 0 HG21 THR A 91 34.637 27.057 -6.682 1.00 1.41 H new ATOM 0 HG22 THR A 91 33.394 25.804 -6.446 1.00 1.41 H new ATOM 0 HG23 THR A 91 34.184 26.552 -5.037 1.00 1.41 H new ATOM 1373 N THR A 92 34.894 22.212 -6.976 1.00 0.69 N ATOM 1374 CA THR A 92 35.363 21.052 -7.709 1.00 0.73 C ATOM 1375 C THR A 92 36.064 21.487 -8.987 1.00 0.65 C ATOM 1376 O THR A 92 37.216 21.135 -9.226 1.00 0.69 O ATOM 1377 CB THR A 92 34.213 20.095 -8.058 1.00 0.81 C ATOM 1378 OG1 THR A 92 33.229 20.108 -7.013 1.00 1.30 O ATOM 1379 CG2 THR A 92 34.743 18.679 -8.240 1.00 0.82 C ATOM 0 H THR A 92 34.035 22.630 -7.334 1.00 0.69 H new ATOM 0 HA THR A 92 36.064 20.521 -7.065 1.00 0.73 H new ATOM 0 HB THR A 92 33.755 20.427 -8.990 1.00 0.81 H new ATOM 0 HG1 THR A 92 32.645 19.326 -7.104 1.00 1.30 H new ATOM 0 HG21 THR A 92 33.918 18.011 -8.487 1.00 0.82 H new ATOM 0 HG22 THR A 92 35.475 18.666 -9.047 1.00 0.82 H new ATOM 0 HG23 THR A 92 35.216 18.346 -7.316 1.00 0.82 H new ATOM 1387 N HIS A 93 35.370 22.275 -9.799 1.00 0.59 N ATOM 1388 CA HIS A 93 35.928 22.766 -11.050 1.00 0.54 C ATOM 1389 C HIS A 93 35.544 24.220 -11.248 1.00 0.49 C ATOM 1390 O HIS A 93 34.571 24.702 -10.664 1.00 0.63 O ATOM 1391 CB HIS A 93 35.416 21.959 -12.253 1.00 0.68 C ATOM 1392 CG HIS A 93 35.813 20.511 -12.272 1.00 0.62 C ATOM 1393 ND1 HIS A 93 36.905 20.019 -12.959 1.00 0.98 N ATOM 1394 CD2 HIS A 93 35.224 19.437 -11.692 1.00 0.72 C ATOM 1395 CE1 HIS A 93 36.941 18.694 -12.777 1.00 1.29 C ATOM 1396 NE2 HIS A 93 35.943 18.290 -12.016 1.00 1.10 N ATOM 0 H HIS A 93 34.417 22.588 -9.612 1.00 0.59 H new ATOM 0 HA HIS A 93 37.011 22.659 -10.990 1.00 0.54 H new ATOM 0 HB2 HIS A 93 34.328 22.020 -12.274 1.00 0.68 H new ATOM 0 HB3 HIS A 93 35.779 22.430 -13.166 1.00 0.68 H new ATOM 0 HD2 HIS A 93 34.337 19.466 -11.076 1.00 0.72 H new ATOM 0 HE1 HIS A 93 37.690 18.040 -13.199 1.00 1.29 H new ATOM 0 HE2 HIS A 93 35.740 17.334 -11.725 1.00 1.10 H new ATOM 1404 N ASN A 94 36.311 24.912 -12.073 1.00 0.45 N ATOM 1405 CA ASN A 94 35.950 26.250 -12.514 1.00 0.48 C ATOM 1406 C ASN A 94 35.654 26.187 -14.004 1.00 0.51 C ATOM 1407 O ASN A 94 36.132 25.285 -14.687 1.00 0.78 O ATOM 1408 CB ASN A 94 37.072 27.264 -12.226 1.00 0.57 C ATOM 1409 CG ASN A 94 38.355 26.976 -12.988 1.00 0.67 C ATOM 1410 OD1 ASN A 94 38.540 27.431 -14.114 1.00 1.36 O ATOM 1411 ND2 ASN A 94 39.265 26.243 -12.363 1.00 1.19 N ATOM 0 H ASN A 94 37.193 24.568 -12.453 1.00 0.45 H new ATOM 0 HA ASN A 94 35.072 26.590 -11.965 1.00 0.48 H new ATOM 0 HB2 ASN A 94 36.722 28.264 -12.482 1.00 0.57 H new ATOM 0 HB3 ASN A 94 37.285 27.265 -11.157 1.00 0.57 H new ATOM 0 HD21 ASN A 94 40.155 26.039 -12.817 1.00 1.19 H new ATOM 0 HD22 ASN A 94 39.075 25.882 -11.428 1.00 1.19 H new ATOM 1418 N GLY A 95 34.859 27.107 -14.506 1.00 0.45 N ATOM 1419 CA GLY A 95 34.507 27.061 -15.904 1.00 0.49 C ATOM 1420 C GLY A 95 33.959 28.370 -16.389 1.00 0.47 C ATOM 1421 O GLY A 95 33.810 29.314 -15.609 1.00 0.53 O ATOM 0 H GLY A 95 34.453 27.880 -13.978 1.00 0.45 H new ATOM 0 HA2 GLY A 95 35.387 26.797 -16.491 1.00 0.49 H new ATOM 0 HA3 GLY A 95 33.768 26.276 -16.066 1.00 0.49 H new ATOM 1425 N VAL A 96 33.656 28.431 -17.669 1.00 0.47 N ATOM 1426 CA VAL A 96 33.123 29.638 -18.263 1.00 0.48 C ATOM 1427 C VAL A 96 31.761 29.343 -18.889 1.00 0.45 C ATOM 1428 O VAL A 96 31.501 28.218 -19.316 1.00 0.43 O ATOM 1429 CB VAL A 96 34.100 30.217 -19.321 1.00 0.55 C ATOM 1430 CG1 VAL A 96 34.152 29.358 -20.575 1.00 1.21 C ATOM 1431 CG2 VAL A 96 33.735 31.649 -19.668 1.00 1.37 C ATOM 0 H VAL A 96 33.771 27.654 -18.320 1.00 0.47 H new ATOM 0 HA VAL A 96 33.001 30.388 -17.482 1.00 0.48 H new ATOM 0 HB VAL A 96 35.096 30.210 -18.878 1.00 0.55 H new ATOM 0 HG11 VAL A 96 34.847 29.799 -21.289 1.00 1.21 H new ATOM 0 HG12 VAL A 96 34.487 28.354 -20.315 1.00 1.21 H new ATOM 0 HG13 VAL A 96 33.159 29.305 -21.021 1.00 1.21 H new ATOM 0 HG21 VAL A 96 34.434 32.033 -20.411 1.00 1.37 H new ATOM 0 HG22 VAL A 96 32.723 31.679 -20.072 1.00 1.37 H new ATOM 0 HG23 VAL A 96 33.785 32.265 -18.770 1.00 1.37 H new ATOM 1441 N VAL A 97 30.888 30.337 -18.901 1.00 0.50 N ATOM 1442 CA VAL A 97 29.557 30.185 -19.476 1.00 0.53 C ATOM 1443 C VAL A 97 29.628 29.952 -20.985 1.00 0.60 C ATOM 1444 O VAL A 97 30.203 30.755 -21.719 1.00 0.67 O ATOM 1445 CB VAL A 97 28.689 31.426 -19.180 1.00 0.60 C ATOM 1446 CG1 VAL A 97 27.343 31.324 -19.873 1.00 0.69 C ATOM 1447 CG2 VAL A 97 28.513 31.599 -17.676 1.00 0.57 C ATOM 0 H VAL A 97 31.076 31.263 -18.518 1.00 0.50 H new ATOM 0 HA VAL A 97 29.098 29.311 -19.013 1.00 0.53 H new ATOM 0 HB VAL A 97 29.200 32.305 -19.572 1.00 0.60 H new ATOM 0 HG11 VAL A 97 26.750 32.211 -19.649 1.00 0.69 H new ATOM 0 HG12 VAL A 97 27.493 31.251 -20.950 1.00 0.69 H new ATOM 0 HG13 VAL A 97 26.818 30.437 -19.519 1.00 0.69 H new ATOM 0 HG21 VAL A 97 27.899 32.478 -17.480 1.00 0.57 H new ATOM 0 HG22 VAL A 97 28.025 30.716 -17.263 1.00 0.57 H new ATOM 0 HG23 VAL A 97 29.489 31.727 -17.208 1.00 0.57 H new ATOM 1457 N ALA A 98 29.035 28.848 -21.435 1.00 0.61 N ATOM 1458 CA ALA A 98 29.090 28.462 -22.844 1.00 0.70 C ATOM 1459 C ALA A 98 28.096 29.259 -23.688 1.00 0.83 C ATOM 1460 O ALA A 98 28.473 29.914 -24.659 1.00 0.89 O ATOM 1461 CB ALA A 98 28.835 26.964 -22.991 1.00 0.76 C ATOM 0 H ALA A 98 28.510 28.204 -20.843 1.00 0.61 H new ATOM 0 HA ALA A 98 30.090 28.691 -23.213 1.00 0.70 H new ATOM 0 HB1 ALA A 98 28.879 26.689 -24.045 1.00 0.76 H new ATOM 0 HB2 ALA A 98 29.595 26.410 -22.440 1.00 0.76 H new ATOM 0 HB3 ALA A 98 27.849 26.722 -22.593 1.00 0.76 H new ATOM 1467 N ARG A 99 26.828 29.209 -23.312 1.00 0.97 N ATOM 1468 CA ARG A 99 25.783 29.871 -24.081 1.00 1.17 C ATOM 1469 C ARG A 99 24.616 30.279 -23.182 1.00 1.38 C ATOM 1470 O ARG A 99 24.012 29.437 -22.515 1.00 1.41 O ATOM 1471 CB ARG A 99 25.290 28.957 -25.217 1.00 1.25 C ATOM 1472 CG ARG A 99 23.955 29.385 -25.811 1.00 1.85 C ATOM 1473 CD ARG A 99 23.599 28.591 -27.058 1.00 2.04 C ATOM 1474 NE ARG A 99 24.232 29.142 -28.254 1.00 2.61 N ATOM 1475 CZ ARG A 99 24.069 28.651 -29.485 1.00 2.99 C ATOM 1476 NH1 ARG A 99 23.362 27.545 -29.685 1.00 2.82 N ATOM 1477 NH2 ARG A 99 24.637 29.258 -30.516 1.00 3.92 N ATOM 0 H ARG A 99 26.497 28.719 -22.481 1.00 0.97 H new ATOM 0 HA ARG A 99 26.207 30.775 -24.518 1.00 1.17 H new ATOM 0 HB2 ARG A 99 26.040 28.938 -26.008 1.00 1.25 H new ATOM 0 HB3 ARG A 99 25.200 27.939 -24.839 1.00 1.25 H new ATOM 0 HG2 ARG A 99 23.170 29.258 -25.065 1.00 1.85 H new ATOM 0 HG3 ARG A 99 23.992 30.446 -26.057 1.00 1.85 H new ATOM 0 HD2 ARG A 99 23.908 27.554 -26.929 1.00 2.04 H new ATOM 0 HD3 ARG A 99 22.517 28.587 -27.189 1.00 2.04 H new ATOM 0 HE ARG A 99 24.838 29.955 -28.141 1.00 2.61 H new ATOM 0 HH11 ARG A 99 22.937 27.061 -28.894 1.00 2.82 H new ATOM 0 HH12 ARG A 99 23.244 27.179 -30.630 1.00 2.82 H new ATOM 0 HH21 ARG A 99 25.197 30.098 -30.368 1.00 3.92 H new ATOM 0 HH22 ARG A 99 24.515 28.886 -31.458 1.00 3.92 H new ATOM 1688 N ALA A 112 18.116 25.085 -18.980 1.00 1.24 N ATOM 1689 CA ALA A 112 18.763 25.262 -17.687 1.00 1.02 C ATOM 1690 C ALA A 112 20.183 25.805 -17.837 1.00 0.97 C ATOM 1691 O ALA A 112 20.804 26.215 -16.858 1.00 1.15 O ATOM 1692 CB ALA A 112 18.750 23.954 -16.916 1.00 1.06 C ATOM 0 HA ALA A 112 18.199 26.004 -17.122 1.00 1.02 H new ATOM 0 HB1 ALA A 112 19.236 24.096 -15.951 1.00 1.06 H new ATOM 0 HB2 ALA A 112 17.720 23.634 -16.760 1.00 1.06 H new ATOM 0 HB3 ALA A 112 19.285 23.192 -17.483 1.00 1.06 H new ATOM 1698 N GLY A 113 20.687 25.821 -19.063 1.00 0.94 N ATOM 1699 CA GLY A 113 21.999 26.380 -19.310 1.00 0.89 C ATOM 1700 C GLY A 113 23.097 25.363 -19.117 1.00 0.79 C ATOM 1701 O GLY A 113 22.921 24.376 -18.401 1.00 0.83 O ATOM 0 H GLY A 113 20.211 25.458 -19.889 1.00 0.94 H new ATOM 0 HA2 GLY A 113 22.041 26.769 -20.327 1.00 0.89 H new ATOM 0 HA3 GLY A 113 22.165 27.223 -18.640 1.00 0.89 H new ATOM 1705 N LEU A 114 24.242 25.609 -19.737 1.00 0.73 N ATOM 1706 CA LEU A 114 25.345 24.674 -19.671 1.00 0.66 C ATOM 1707 C LEU A 114 26.682 25.396 -19.624 1.00 0.58 C ATOM 1708 O LEU A 114 26.913 26.370 -20.347 1.00 0.63 O ATOM 1709 CB LEU A 114 25.286 23.695 -20.848 1.00 0.74 C ATOM 1710 CG LEU A 114 24.200 22.617 -20.716 1.00 0.83 C ATOM 1711 CD1 LEU A 114 24.009 21.858 -22.010 1.00 0.93 C ATOM 1712 CD2 LEU A 114 24.547 21.644 -19.606 1.00 0.80 C ATOM 0 H LEU A 114 24.427 26.447 -20.289 1.00 0.73 H new ATOM 0 HA LEU A 114 25.252 24.105 -18.746 1.00 0.66 H new ATOM 0 HB2 LEU A 114 25.114 24.257 -21.766 1.00 0.74 H new ATOM 0 HB3 LEU A 114 26.256 23.208 -20.950 1.00 0.74 H new ATOM 0 HG LEU A 114 23.267 23.126 -20.474 1.00 0.83 H new ATOM 0 HD11 LEU A 114 23.233 21.104 -21.878 1.00 0.93 H new ATOM 0 HD12 LEU A 114 23.712 22.551 -22.798 1.00 0.93 H new ATOM 0 HD13 LEU A 114 24.944 21.372 -22.288 1.00 0.93 H new ATOM 0 HD21 LEU A 114 23.766 20.888 -19.528 1.00 0.80 H new ATOM 0 HD22 LEU A 114 25.498 21.161 -19.830 1.00 0.80 H new ATOM 0 HD23 LEU A 114 24.626 22.183 -18.662 1.00 0.80 H new ATOM 1724 N ILE A 115 27.535 24.924 -18.734 1.00 0.49 N ATOM 1725 CA ILE A 115 28.869 25.468 -18.554 1.00 0.42 C ATOM 1726 C ILE A 115 29.901 24.506 -19.138 1.00 0.43 C ATOM 1727 O ILE A 115 29.770 23.286 -18.992 1.00 0.47 O ATOM 1728 CB ILE A 115 29.156 25.685 -17.051 1.00 0.34 C ATOM 1729 CG1 ILE A 115 28.095 26.604 -16.426 1.00 0.36 C ATOM 1730 CG2 ILE A 115 30.549 26.265 -16.843 1.00 0.31 C ATOM 1731 CD1 ILE A 115 28.026 26.509 -14.911 1.00 0.28 C ATOM 0 H ILE A 115 27.320 24.146 -18.110 1.00 0.49 H new ATOM 0 HA ILE A 115 28.932 26.426 -19.070 1.00 0.42 H new ATOM 0 HB ILE A 115 29.112 24.716 -16.555 1.00 0.34 H new ATOM 0 HG12 ILE A 115 28.308 27.635 -16.708 1.00 0.36 H new ATOM 0 HG13 ILE A 115 27.119 26.354 -16.842 1.00 0.36 H new ATOM 0 HG21 ILE A 115 30.728 26.409 -15.777 1.00 0.31 H new ATOM 0 HG22 ILE A 115 31.293 25.578 -17.246 1.00 0.31 H new ATOM 0 HG23 ILE A 115 30.624 27.224 -17.356 1.00 0.31 H new ATOM 0 HD11 ILE A 115 27.256 27.185 -14.539 1.00 0.28 H new ATOM 0 HD12 ILE A 115 27.783 25.487 -14.621 1.00 0.28 H new ATOM 0 HD13 ILE A 115 28.990 26.787 -14.485 1.00 0.28 H new ATOM 1743 N GLU A 116 30.908 25.042 -19.815 1.00 0.43 N ATOM 1744 CA GLU A 116 31.958 24.210 -20.380 1.00 0.47 C ATOM 1745 C GLU A 116 33.087 24.020 -19.371 1.00 0.45 C ATOM 1746 O GLU A 116 33.733 24.977 -18.936 1.00 0.49 O ATOM 1747 CB GLU A 116 32.465 24.785 -21.711 1.00 0.54 C ATOM 1748 CG GLU A 116 32.771 26.274 -21.689 1.00 0.84 C ATOM 1749 CD GLU A 116 33.188 26.794 -23.052 1.00 1.03 C ATOM 1750 OE1 GLU A 116 34.407 26.945 -23.293 1.00 1.14 O ATOM 1751 OE2 GLU A 116 32.298 27.070 -23.887 1.00 1.40 O ATOM 0 H GLU A 116 31.018 26.042 -19.985 1.00 0.43 H new ATOM 0 HA GLU A 116 31.542 23.227 -20.599 1.00 0.47 H new ATOM 0 HB2 GLU A 116 33.367 24.248 -22.002 1.00 0.54 H new ATOM 0 HB3 GLU A 116 31.718 24.594 -22.481 1.00 0.54 H new ATOM 0 HG2 GLU A 116 31.891 26.819 -21.348 1.00 0.84 H new ATOM 0 HG3 GLU A 116 33.566 26.469 -20.969 1.00 0.84 H new ATOM 1758 N ILE A 117 33.286 22.771 -18.983 1.00 0.47 N ATOM 1759 CA ILE A 117 34.239 22.419 -17.947 1.00 0.50 C ATOM 1760 C ILE A 117 35.551 21.996 -18.587 1.00 0.56 C ATOM 1761 O ILE A 117 35.549 21.196 -19.522 1.00 0.63 O ATOM 1762 CB ILE A 117 33.699 21.250 -17.099 1.00 0.53 C ATOM 1763 CG1 ILE A 117 32.208 21.458 -16.827 1.00 0.48 C ATOM 1764 CG2 ILE A 117 34.474 21.112 -15.791 1.00 0.60 C ATOM 1765 CD1 ILE A 117 31.889 22.755 -16.118 1.00 0.41 C ATOM 0 H ILE A 117 32.790 21.973 -19.379 1.00 0.47 H new ATOM 0 HA ILE A 117 34.396 23.287 -17.307 1.00 0.50 H new ATOM 0 HB ILE A 117 33.834 20.324 -17.658 1.00 0.53 H new ATOM 0 HG12 ILE A 117 31.669 21.431 -17.774 1.00 0.48 H new ATOM 0 HG13 ILE A 117 31.839 20.627 -16.226 1.00 0.48 H new ATOM 0 HG21 ILE A 117 34.070 20.280 -15.215 1.00 0.60 H new ATOM 0 HG22 ILE A 117 35.526 20.926 -16.009 1.00 0.60 H new ATOM 0 HG23 ILE A 117 34.380 22.032 -15.214 1.00 0.60 H new ATOM 0 HD11 ILE A 117 30.813 22.829 -15.961 1.00 0.41 H new ATOM 0 HD12 ILE A 117 32.398 22.778 -15.155 1.00 0.41 H new ATOM 0 HD13 ILE A 117 32.226 23.595 -16.726 1.00 0.41 H new ATOM 1777 N LEU A 118 36.659 22.527 -18.098 1.00 0.61 N ATOM 1778 CA LEU A 118 37.961 22.193 -18.661 1.00 0.70 C ATOM 1779 C LEU A 118 38.517 20.931 -18.012 1.00 0.79 C ATOM 1780 O LEU A 118 38.180 20.610 -16.870 1.00 0.88 O ATOM 1781 CB LEU A 118 38.957 23.353 -18.495 1.00 0.84 C ATOM 1782 CG LEU A 118 39.573 23.534 -17.097 1.00 0.96 C ATOM 1783 CD1 LEU A 118 40.643 24.613 -17.131 1.00 1.15 C ATOM 1784 CD2 LEU A 118 38.516 23.885 -16.062 1.00 1.21 C ATOM 0 H LEU A 118 36.686 23.185 -17.320 1.00 0.61 H new ATOM 0 HA LEU A 118 37.823 22.013 -19.727 1.00 0.70 H new ATOM 0 HB2 LEU A 118 39.768 23.211 -19.209 1.00 0.84 H new ATOM 0 HB3 LEU A 118 38.451 24.279 -18.767 1.00 0.84 H new ATOM 0 HG LEU A 118 40.025 22.585 -16.808 1.00 0.96 H new ATOM 0 HD11 LEU A 118 41.072 24.732 -16.136 1.00 1.15 H new ATOM 0 HD12 LEU A 118 41.427 24.326 -17.832 1.00 1.15 H new ATOM 0 HD13 LEU A 118 40.199 25.556 -17.450 1.00 1.15 H new ATOM 0 HD21 LEU A 118 38.988 24.005 -15.087 1.00 1.21 H new ATOM 0 HD22 LEU A 118 38.025 24.816 -16.345 1.00 1.21 H new ATOM 0 HD23 LEU A 118 37.777 23.086 -16.011 1.00 1.21 H new ATOM 1796 N ASP A 119 39.355 20.212 -18.753 1.00 0.83 N ATOM 1797 CA ASP A 119 40.013 19.010 -18.240 1.00 0.95 C ATOM 1798 C ASP A 119 40.868 19.326 -17.025 1.00 1.01 C ATOM 1799 O ASP A 119 41.253 20.477 -16.800 1.00 0.98 O ATOM 1800 CB ASP A 119 40.904 18.373 -19.306 1.00 1.05 C ATOM 1801 CG ASP A 119 40.133 17.910 -20.518 1.00 1.65 C ATOM 1802 OD1 ASP A 119 40.069 18.663 -21.512 1.00 2.29 O ATOM 1803 OD2 ASP A 119 39.579 16.795 -20.471 1.00 2.22 O ATOM 0 H ASP A 119 39.597 20.441 -19.717 1.00 0.83 H new ATOM 0 HA ASP A 119 39.223 18.314 -17.958 1.00 0.95 H new ATOM 0 HB2 ASP A 119 41.661 19.093 -19.617 1.00 1.05 H new ATOM 0 HB3 ASP A 119 41.431 17.524 -18.871 1.00 1.05 H new ATOM 1808 N GLU A 120 41.188 18.289 -16.269 1.00 1.17 N ATOM 1809 CA GLU A 120 42.024 18.414 -15.080 1.00 1.32 C ATOM 1810 C GLU A 120 43.409 18.963 -15.430 1.00 1.33 C ATOM 1811 O GLU A 120 44.088 19.544 -14.585 1.00 1.44 O ATOM 1812 CB GLU A 120 42.154 17.048 -14.399 1.00 1.55 C ATOM 1813 CG GLU A 120 42.731 15.981 -15.312 1.00 1.63 C ATOM 1814 CD GLU A 120 42.434 14.572 -14.849 1.00 1.96 C ATOM 1815 OE1 GLU A 120 43.250 14.001 -14.101 1.00 1.89 O ATOM 1816 OE2 GLU A 120 41.387 14.027 -15.252 1.00 2.78 O ATOM 0 H GLU A 120 40.877 17.336 -16.459 1.00 1.17 H new ATOM 0 HA GLU A 120 41.549 19.119 -14.397 1.00 1.32 H new ATOM 0 HB2 GLU A 120 42.789 17.146 -13.518 1.00 1.55 H new ATOM 0 HB3 GLU A 120 41.172 16.727 -14.050 1.00 1.55 H new ATOM 0 HG2 GLU A 120 42.331 16.118 -16.317 1.00 1.63 H new ATOM 0 HG3 GLU A 120 43.811 16.114 -15.378 1.00 1.63 H new ATOM 1823 N LEU A 121 43.824 18.784 -16.683 1.00 1.28 N ATOM 1824 CA LEU A 121 45.125 19.271 -17.133 1.00 1.34 C ATOM 1825 C LEU A 121 44.991 20.640 -17.795 1.00 1.21 C ATOM 1826 O LEU A 121 45.979 21.187 -18.286 1.00 1.27 O ATOM 1827 CB LEU A 121 45.770 18.303 -18.140 1.00 1.45 C ATOM 1828 CG LEU A 121 46.034 16.866 -17.656 1.00 1.65 C ATOM 1829 CD1 LEU A 121 46.383 16.831 -16.175 1.00 1.77 C ATOM 1830 CD2 LEU A 121 44.841 15.968 -17.955 1.00 1.65 C ATOM 0 H LEU A 121 43.280 18.307 -17.402 1.00 1.28 H new ATOM 0 HA LEU A 121 45.759 19.346 -16.249 1.00 1.34 H new ATOM 0 HB2 LEU A 121 45.128 18.252 -19.020 1.00 1.45 H new ATOM 0 HB3 LEU A 121 46.719 18.732 -18.462 1.00 1.45 H new ATOM 0 HG LEU A 121 46.895 16.485 -18.205 1.00 1.65 H new ATOM 0 HD11 LEU A 121 46.563 15.801 -15.868 1.00 1.77 H new ATOM 0 HD12 LEU A 121 47.280 17.424 -15.998 1.00 1.77 H new ATOM 0 HD13 LEU A 121 45.556 17.243 -15.596 1.00 1.77 H new ATOM 0 HD21 LEU A 121 45.050 14.957 -17.604 1.00 1.65 H new ATOM 0 HD22 LEU A 121 43.958 16.354 -17.445 1.00 1.65 H new ATOM 0 HD23 LEU A 121 44.660 15.949 -19.030 1.00 1.65 H new ATOM 1842 N ARG A 122 43.772 21.181 -17.798 1.00 1.11 N ATOM 1843 CA ARG A 122 43.462 22.406 -18.532 1.00 1.08 C ATOM 1844 C ARG A 122 43.749 22.204 -20.018 1.00 1.13 C ATOM 1845 O ARG A 122 44.858 22.445 -20.498 1.00 1.46 O ATOM 1846 CB ARG A 122 44.255 23.602 -17.982 1.00 1.24 C ATOM 1847 CG ARG A 122 44.025 24.889 -18.754 1.00 1.80 C ATOM 1848 CD ARG A 122 44.989 25.988 -18.330 1.00 2.04 C ATOM 1849 NE ARG A 122 44.796 26.408 -16.941 1.00 2.50 N ATOM 1850 CZ ARG A 122 45.549 27.331 -16.345 1.00 3.32 C ATOM 1851 NH1 ARG A 122 46.582 27.867 -16.987 1.00 3.73 N ATOM 1852 NH2 ARG A 122 45.292 27.705 -15.100 1.00 4.14 N ATOM 0 H ARG A 122 42.978 20.785 -17.295 1.00 1.11 H new ATOM 0 HA ARG A 122 42.403 22.628 -18.401 1.00 1.08 H new ATOM 0 HB2 ARG A 122 43.982 23.760 -16.939 1.00 1.24 H new ATOM 0 HB3 ARG A 122 45.318 23.362 -18.000 1.00 1.24 H new ATOM 0 HG2 ARG A 122 44.140 24.697 -19.821 1.00 1.80 H new ATOM 0 HG3 ARG A 122 43.000 25.226 -18.600 1.00 1.80 H new ATOM 0 HD2 ARG A 122 46.013 25.637 -18.460 1.00 2.04 H new ATOM 0 HD3 ARG A 122 44.862 26.849 -18.986 1.00 2.04 H new ATOM 0 HE ARG A 122 44.047 25.972 -16.403 1.00 2.50 H new ATOM 0 HH11 ARG A 122 46.800 27.572 -17.939 1.00 3.73 H new ATOM 0 HH12 ARG A 122 47.157 28.574 -16.528 1.00 3.73 H new ATOM 0 HH21 ARG A 122 44.513 27.285 -14.592 1.00 4.14 H new ATOM 0 HH22 ARG A 122 45.873 28.412 -14.650 1.00 4.14 H new ATOM 1866 N THR A 123 42.755 21.723 -20.744 1.00 1.08 N ATOM 1867 CA THR A 123 42.955 21.359 -22.131 1.00 1.20 C ATOM 1868 C THR A 123 41.718 21.669 -22.972 1.00 1.15 C ATOM 1869 O THR A 123 41.676 22.684 -23.668 1.00 1.38 O ATOM 1870 CB THR A 123 43.324 19.867 -22.237 1.00 1.40 C ATOM 1871 OG1 THR A 123 44.443 19.594 -21.377 1.00 1.86 O ATOM 1872 CG2 THR A 123 43.678 19.486 -23.665 1.00 1.87 C ATOM 0 H THR A 123 41.807 21.577 -20.396 1.00 1.08 H new ATOM 0 HA THR A 123 43.778 21.956 -22.524 1.00 1.20 H new ATOM 0 HB THR A 123 42.460 19.276 -21.932 1.00 1.40 H new ATOM 0 HG1 THR A 123 44.680 18.645 -21.440 1.00 1.86 H new ATOM 0 HG21 THR A 123 43.934 18.427 -23.706 1.00 1.87 H new ATOM 0 HG22 THR A 123 42.825 19.679 -24.315 1.00 1.87 H new ATOM 0 HG23 THR A 123 44.530 20.078 -23.999 1.00 1.87 H new ATOM 1880 N THR A 124 40.707 20.823 -22.884 1.00 1.01 N ATOM 1881 CA THR A 124 39.497 20.997 -23.667 1.00 1.03 C ATOM 1882 C THR A 124 38.274 21.057 -22.760 1.00 0.89 C ATOM 1883 O THR A 124 38.399 21.236 -21.545 1.00 0.85 O ATOM 1884 CB THR A 124 39.325 19.849 -24.686 1.00 1.26 C ATOM 1885 OG1 THR A 124 39.546 18.579 -24.055 1.00 1.54 O ATOM 1886 CG2 THR A 124 40.284 20.005 -25.851 1.00 1.53 C ATOM 0 H THR A 124 40.701 20.005 -22.275 1.00 1.01 H new ATOM 0 HA THR A 124 39.589 21.938 -24.209 1.00 1.03 H new ATOM 0 HB THR A 124 38.303 19.893 -25.063 1.00 1.26 H new ATOM 0 HG1 THR A 124 39.419 18.668 -23.087 1.00 1.54 H new ATOM 0 HG21 THR A 124 40.141 19.183 -26.553 1.00 1.53 H new ATOM 0 HG22 THR A 124 40.092 20.951 -26.356 1.00 1.53 H new ATOM 0 HG23 THR A 124 41.310 19.993 -25.482 1.00 1.53 H new ATOM 1894 N VAL A 125 37.102 20.934 -23.361 1.00 0.90 N ATOM 1895 CA VAL A 125 35.863 20.831 -22.608 1.00 0.82 C ATOM 1896 C VAL A 125 35.492 19.364 -22.426 1.00 0.86 C ATOM 1897 O VAL A 125 35.430 18.609 -23.398 1.00 0.96 O ATOM 1898 CB VAL A 125 34.710 21.604 -23.295 1.00 0.82 C ATOM 1899 CG1 VAL A 125 34.559 21.204 -24.757 1.00 1.17 C ATOM 1900 CG2 VAL A 125 33.400 21.405 -22.549 1.00 1.29 C ATOM 0 H VAL A 125 36.983 20.903 -24.374 1.00 0.90 H new ATOM 0 HA VAL A 125 36.020 21.287 -21.630 1.00 0.82 H new ATOM 0 HB VAL A 125 34.967 22.663 -23.265 1.00 0.82 H new ATOM 0 HG11 VAL A 125 33.741 21.767 -25.206 1.00 1.17 H new ATOM 0 HG12 VAL A 125 35.484 21.421 -25.291 1.00 1.17 H new ATOM 0 HG13 VAL A 125 34.344 20.137 -24.822 1.00 1.17 H new ATOM 0 HG21 VAL A 125 32.607 21.958 -23.052 1.00 1.29 H new ATOM 0 HG22 VAL A 125 33.148 20.345 -22.532 1.00 1.29 H new ATOM 0 HG23 VAL A 125 33.504 21.769 -21.527 1.00 1.29 H new ATOM 1910 N ILE A 126 35.272 18.956 -21.178 1.00 0.82 N ATOM 1911 CA ILE A 126 35.019 17.555 -20.889 1.00 0.90 C ATOM 1912 C ILE A 126 33.710 17.099 -21.518 1.00 0.93 C ATOM 1913 O ILE A 126 33.711 16.299 -22.452 1.00 1.03 O ATOM 1914 CB ILE A 126 34.954 17.296 -19.370 1.00 0.89 C ATOM 1915 CG1 ILE A 126 36.202 17.848 -18.684 1.00 0.87 C ATOM 1916 CG2 ILE A 126 34.817 15.803 -19.095 1.00 1.00 C ATOM 1917 CD1 ILE A 126 36.084 17.870 -17.180 1.00 0.87 C ATOM 0 H ILE A 126 35.265 19.570 -20.363 1.00 0.82 H new ATOM 0 HA ILE A 126 35.848 16.989 -21.314 1.00 0.90 H new ATOM 0 HB ILE A 126 34.080 17.807 -18.966 1.00 0.89 H new ATOM 0 HG12 ILE A 126 37.064 17.243 -18.967 1.00 0.87 H new ATOM 0 HG13 ILE A 126 36.391 18.860 -19.043 1.00 0.87 H new ATOM 0 HG21 ILE A 126 34.772 15.634 -18.019 1.00 1.00 H new ATOM 0 HG22 ILE A 126 33.904 15.430 -19.559 1.00 1.00 H new ATOM 0 HG23 ILE A 126 35.677 15.276 -19.510 1.00 1.00 H new ATOM 0 HD11 ILE A 126 37.001 18.272 -16.749 1.00 0.87 H new ATOM 0 HD12 ILE A 126 35.241 18.498 -16.890 1.00 0.87 H new ATOM 0 HD13 ILE A 126 35.925 16.856 -16.813 1.00 0.87 H new ATOM 1929 N SER A 127 32.592 17.591 -21.008 1.00 0.87 N ATOM 1930 CA SER A 127 31.315 17.365 -21.655 1.00 0.92 C ATOM 1931 C SER A 127 30.478 18.642 -21.646 1.00 0.84 C ATOM 1932 O SER A 127 30.519 19.444 -22.583 1.00 0.85 O ATOM 1933 CB SER A 127 30.581 16.217 -20.957 1.00 0.99 C ATOM 1934 OG SER A 127 31.387 15.050 -20.928 1.00 1.56 O ATOM 0 H SER A 127 32.545 18.146 -20.153 1.00 0.87 H new ATOM 0 HA SER A 127 31.483 17.087 -22.696 1.00 0.92 H new ATOM 0 HB2 SER A 127 30.321 16.510 -19.940 1.00 0.99 H new ATOM 0 HB3 SER A 127 29.647 16.007 -21.477 1.00 0.99 H new ATOM 0 HG SER A 127 30.901 14.328 -20.477 1.00 1.56 H new ATOM 1940 N GLN A 128 29.755 18.826 -20.539 1.00 0.79 N ATOM 1941 CA GLN A 128 28.936 20.006 -20.288 1.00 0.74 C ATOM 1942 C GLN A 128 28.341 19.883 -18.886 1.00 0.69 C ATOM 1943 O GLN A 128 27.951 18.786 -18.484 1.00 0.73 O ATOM 1944 CB GLN A 128 27.806 20.154 -21.328 1.00 0.86 C ATOM 1945 CG GLN A 128 26.652 19.159 -21.174 1.00 1.02 C ATOM 1946 CD GLN A 128 27.029 17.735 -21.541 1.00 1.43 C ATOM 1947 OE1 GLN A 128 27.848 17.503 -22.428 1.00 2.08 O ATOM 1948 NE2 GLN A 128 26.447 16.767 -20.850 1.00 1.88 N ATOM 0 H GLN A 128 29.724 18.145 -19.781 1.00 0.79 H new ATOM 0 HA GLN A 128 29.563 20.894 -20.368 1.00 0.74 H new ATOM 0 HB2 GLN A 128 27.405 21.166 -21.265 1.00 0.86 H new ATOM 0 HB3 GLN A 128 28.233 20.042 -22.325 1.00 0.86 H new ATOM 0 HG2 GLN A 128 26.300 19.179 -20.143 1.00 1.02 H new ATOM 0 HG3 GLN A 128 25.820 19.479 -21.801 1.00 1.02 H new ATOM 0 HE21 GLN A 128 25.772 16.996 -20.121 1.00 1.88 H new ATOM 0 HE22 GLN A 128 26.674 15.792 -21.047 1.00 1.88 H new ATOM 1957 N HIS A 129 28.281 20.963 -18.125 1.00 0.63 N ATOM 1958 CA HIS A 129 27.645 20.889 -16.815 1.00 0.60 C ATOM 1959 C HIS A 129 26.440 21.802 -16.737 1.00 0.58 C ATOM 1960 O HIS A 129 26.503 22.979 -17.088 1.00 0.54 O ATOM 1961 CB HIS A 129 28.611 21.197 -15.666 1.00 0.54 C ATOM 1962 CG HIS A 129 29.567 20.081 -15.354 1.00 0.58 C ATOM 1963 ND1 HIS A 129 29.984 19.044 -16.123 1.00 0.58 N flip ATOM 1964 CD2 HIS A 129 30.216 19.939 -14.147 1.00 0.65 C flip ATOM 1965 CE1 HIS A 129 30.886 18.272 -15.401 1.00 0.65 C flip ATOM 1966 NE2 HIS A 129 30.992 18.849 -14.223 1.00 0.68 N flip ATOM 0 H HIS A 129 28.653 21.878 -18.379 1.00 0.63 H new ATOM 0 HA HIS A 129 27.318 19.856 -16.698 1.00 0.60 H new ATOM 0 HB2 HIS A 129 29.182 22.091 -15.915 1.00 0.54 H new ATOM 0 HB3 HIS A 129 28.033 21.427 -14.771 1.00 0.54 H new ATOM 0 HD2 HIS A 129 30.117 20.591 -13.291 1.00 0.65 H new ATOM 0 HE1 HIS A 129 31.396 17.381 -15.738 1.00 0.65 H new ATOM 0 HE2 HIS A 129 31.587 18.511 -13.467 1.00 0.68 H new ATOM 1974 N GLU A 130 25.349 21.227 -16.277 1.00 0.64 N ATOM 1975 CA GLU A 130 24.081 21.918 -16.148 1.00 0.64 C ATOM 1976 C GLU A 130 24.036 22.650 -14.812 1.00 0.56 C ATOM 1977 O GLU A 130 24.548 22.137 -13.811 1.00 0.54 O ATOM 1978 CB GLU A 130 22.983 20.864 -16.206 1.00 0.77 C ATOM 1979 CG GLU A 130 21.637 21.329 -16.715 1.00 0.82 C ATOM 1980 CD GLU A 130 20.590 20.253 -16.507 1.00 0.98 C ATOM 1981 OE1 GLU A 130 20.866 19.083 -16.870 1.00 1.18 O ATOM 1982 OE2 GLU A 130 19.514 20.552 -15.953 1.00 1.19 O ATOM 0 H GLU A 130 25.316 20.252 -15.978 1.00 0.64 H new ATOM 0 HA GLU A 130 23.949 22.650 -16.945 1.00 0.64 H new ATOM 0 HB2 GLU A 130 23.326 20.047 -16.841 1.00 0.77 H new ATOM 0 HB3 GLU A 130 22.848 20.455 -15.205 1.00 0.77 H new ATOM 0 HG2 GLU A 130 21.340 22.239 -16.195 1.00 0.82 H new ATOM 0 HG3 GLU A 130 21.708 21.576 -17.774 1.00 0.82 H new ATOM 1989 N PHE A 131 23.445 23.834 -14.784 1.00 0.53 N ATOM 1990 CA PHE A 131 23.305 24.567 -13.536 1.00 0.46 C ATOM 1991 C PHE A 131 21.835 24.769 -13.203 1.00 0.51 C ATOM 1992 O PHE A 131 21.023 25.093 -14.067 1.00 0.74 O ATOM 1993 CB PHE A 131 24.065 25.905 -13.556 1.00 0.42 C ATOM 1994 CG PHE A 131 23.724 26.835 -14.690 1.00 0.48 C ATOM 1995 CD1 PHE A 131 22.667 27.727 -14.585 1.00 0.60 C ATOM 1996 CD2 PHE A 131 24.481 26.837 -15.850 1.00 0.46 C ATOM 1997 CE1 PHE A 131 22.371 28.598 -15.615 1.00 0.70 C ATOM 1998 CE2 PHE A 131 24.187 27.704 -16.886 1.00 0.56 C ATOM 1999 CZ PHE A 131 23.130 28.586 -16.766 1.00 0.68 C ATOM 0 H PHE A 131 23.058 24.304 -15.602 1.00 0.53 H new ATOM 0 HA PHE A 131 23.759 23.966 -12.749 1.00 0.46 H new ATOM 0 HB2 PHE A 131 23.875 26.423 -12.616 1.00 0.42 H new ATOM 0 HB3 PHE A 131 25.134 25.694 -13.593 1.00 0.42 H new ATOM 0 HD1 PHE A 131 22.068 27.741 -13.686 1.00 0.60 H new ATOM 0 HD2 PHE A 131 25.311 26.153 -15.946 1.00 0.46 H new ATOM 0 HE1 PHE A 131 21.546 29.288 -15.519 1.00 0.70 H new ATOM 0 HE2 PHE A 131 24.782 27.692 -17.787 1.00 0.56 H new ATOM 0 HZ PHE A 131 22.899 29.265 -17.573 1.00 0.68 H new ATOM 2009 N GLY A 132 21.502 24.551 -11.944 1.00 0.48 N ATOM 2010 CA GLY A 132 20.129 24.638 -11.509 1.00 0.51 C ATOM 2011 C GLY A 132 19.742 26.041 -11.111 1.00 0.50 C ATOM 2012 O GLY A 132 20.584 26.821 -10.674 1.00 0.47 O ATOM 0 H GLY A 132 22.167 24.313 -11.208 1.00 0.48 H new ATOM 0 HA2 GLY A 132 19.474 24.296 -12.310 1.00 0.51 H new ATOM 0 HA3 GLY A 132 19.975 23.967 -10.664 1.00 0.51 H new ATOM 2016 N ILE A 133 18.467 26.367 -11.272 1.00 0.54 N ATOM 2017 CA ILE A 133 17.959 27.691 -10.922 1.00 0.55 C ATOM 2018 C ILE A 133 18.212 27.997 -9.443 1.00 0.54 C ATOM 2019 O ILE A 133 18.370 29.153 -9.048 1.00 0.56 O ATOM 2020 CB ILE A 133 16.447 27.800 -11.234 1.00 0.60 C ATOM 2021 CG1 ILE A 133 15.966 29.252 -11.131 1.00 0.64 C ATOM 2022 CG2 ILE A 133 15.626 26.902 -10.321 1.00 0.61 C ATOM 2023 CD1 ILE A 133 16.449 30.132 -12.262 1.00 0.67 C ATOM 0 H ILE A 133 17.761 25.732 -11.644 1.00 0.54 H new ATOM 0 HA ILE A 133 18.493 28.424 -11.526 1.00 0.55 H new ATOM 0 HB ILE A 133 16.301 27.462 -12.260 1.00 0.60 H new ATOM 0 HG12 ILE A 133 14.876 29.264 -11.112 1.00 0.64 H new ATOM 0 HG13 ILE A 133 16.306 29.672 -10.184 1.00 0.64 H new ATOM 0 HG21 ILE A 133 14.569 27.003 -10.567 1.00 0.61 H new ATOM 0 HG22 ILE A 133 15.933 25.865 -10.458 1.00 0.61 H new ATOM 0 HG23 ILE A 133 15.787 27.194 -9.283 1.00 0.61 H new ATOM 0 HD11 ILE A 133 16.070 31.144 -12.123 1.00 0.67 H new ATOM 0 HD12 ILE A 133 17.539 30.150 -12.269 1.00 0.67 H new ATOM 0 HD13 ILE A 133 16.087 29.736 -13.211 1.00 0.67 H new ATOM 2035 N THR A 134 18.270 26.944 -8.641 1.00 0.57 N ATOM 2036 CA THR A 134 18.515 27.067 -7.217 1.00 0.61 C ATOM 2037 C THR A 134 19.984 27.353 -6.938 1.00 0.57 C ATOM 2038 O THR A 134 20.322 28.166 -6.078 1.00 0.61 O ATOM 2039 CB THR A 134 18.102 25.773 -6.498 1.00 0.71 C ATOM 2040 OG1 THR A 134 18.599 24.636 -7.225 1.00 1.35 O ATOM 2041 CG2 THR A 134 16.593 25.680 -6.379 1.00 0.86 C ATOM 0 H THR A 134 18.148 25.983 -8.961 1.00 0.57 H new ATOM 0 HA THR A 134 17.920 27.901 -6.844 1.00 0.61 H new ATOM 0 HB THR A 134 18.529 25.784 -5.495 1.00 0.71 H new ATOM 0 HG1 THR A 134 18.336 23.812 -6.764 1.00 1.35 H new ATOM 0 HG21 THR A 134 16.325 24.756 -5.867 1.00 0.86 H new ATOM 0 HG22 THR A 134 16.220 26.532 -5.810 1.00 0.86 H new ATOM 0 HG23 THR A 134 16.149 25.685 -7.374 1.00 0.86 H new ATOM 2049 N SER A 135 20.852 26.695 -7.690 1.00 0.54 N ATOM 2050 CA SER A 135 22.278 26.867 -7.517 1.00 0.57 C ATOM 2051 C SER A 135 22.771 28.109 -8.254 1.00 0.46 C ATOM 2052 O SER A 135 23.879 28.577 -8.014 1.00 0.44 O ATOM 2053 CB SER A 135 23.028 25.618 -7.986 1.00 0.72 C ATOM 2054 OG SER A 135 22.603 25.193 -9.268 1.00 1.10 O ATOM 0 H SER A 135 20.590 26.038 -8.425 1.00 0.54 H new ATOM 0 HA SER A 135 22.480 27.008 -6.455 1.00 0.57 H new ATOM 0 HB2 SER A 135 24.098 25.825 -8.009 1.00 0.72 H new ATOM 0 HB3 SER A 135 22.875 24.812 -7.268 1.00 0.72 H new ATOM 0 HG SER A 135 22.060 25.896 -9.682 1.00 1.10 H new ATOM 2060 N LEU A 136 21.944 28.636 -9.152 1.00 0.45 N ATOM 2061 CA LEU A 136 22.263 29.871 -9.856 1.00 0.43 C ATOM 2062 C LEU A 136 21.976 31.081 -8.970 1.00 0.47 C ATOM 2063 O LEU A 136 21.138 31.921 -9.293 1.00 0.53 O ATOM 2064 CB LEU A 136 21.485 29.975 -11.166 1.00 0.48 C ATOM 2065 CG LEU A 136 21.982 31.048 -12.138 1.00 0.81 C ATOM 2066 CD1 LEU A 136 23.402 30.748 -12.588 1.00 1.46 C ATOM 2067 CD2 LEU A 136 21.057 31.136 -13.337 1.00 1.24 C ATOM 0 H LEU A 136 21.046 28.225 -9.409 1.00 0.45 H new ATOM 0 HA LEU A 136 23.326 29.856 -10.095 1.00 0.43 H new ATOM 0 HB2 LEU A 136 21.521 29.008 -11.668 1.00 0.48 H new ATOM 0 HB3 LEU A 136 20.439 30.175 -10.933 1.00 0.48 H new ATOM 0 HG LEU A 136 21.982 32.008 -11.622 1.00 0.81 H new ATOM 0 HD11 LEU A 136 23.736 31.523 -13.278 1.00 1.46 H new ATOM 0 HD12 LEU A 136 24.062 30.726 -11.720 1.00 1.46 H new ATOM 0 HD13 LEU A 136 23.428 29.780 -13.088 1.00 1.46 H new ATOM 0 HD21 LEU A 136 21.420 31.902 -14.021 1.00 1.24 H new ATOM 0 HD22 LEU A 136 21.033 30.174 -13.849 1.00 1.24 H new ATOM 0 HD23 LEU A 136 20.052 31.395 -13.003 1.00 1.24 H new ATOM 2079 N VAL A 137 22.625 31.119 -7.812 1.00 0.49 N ATOM 2080 CA VAL A 137 22.462 32.214 -6.852 1.00 0.60 C ATOM 2081 C VAL A 137 22.661 33.567 -7.533 1.00 0.65 C ATOM 2082 O VAL A 137 21.983 34.545 -7.222 1.00 0.77 O ATOM 2083 CB VAL A 137 23.485 32.095 -5.701 1.00 0.63 C ATOM 2084 CG1 VAL A 137 23.117 33.013 -4.549 1.00 0.82 C ATOM 2085 CG2 VAL A 137 23.608 30.657 -5.230 1.00 0.59 C ATOM 0 H VAL A 137 23.278 30.396 -7.509 1.00 0.49 H new ATOM 0 HA VAL A 137 21.450 32.145 -6.454 1.00 0.60 H new ATOM 0 HB VAL A 137 24.457 32.408 -6.083 1.00 0.63 H new ATOM 0 HG11 VAL A 137 23.853 32.910 -3.752 1.00 0.82 H new ATOM 0 HG12 VAL A 137 23.102 34.046 -4.897 1.00 0.82 H new ATOM 0 HG13 VAL A 137 22.131 32.743 -4.170 1.00 0.82 H new ATOM 0 HG21 VAL A 137 24.334 30.601 -4.419 1.00 0.59 H new ATOM 0 HG22 VAL A 137 22.639 30.307 -4.874 1.00 0.59 H new ATOM 0 HG23 VAL A 137 23.939 30.030 -6.058 1.00 0.59 H new ATOM 2095 N ASN A 138 23.574 33.593 -8.491 1.00 0.59 N ATOM 2096 CA ASN A 138 23.932 34.825 -9.192 1.00 0.66 C ATOM 2097 C ASN A 138 23.025 35.056 -10.408 1.00 0.58 C ATOM 2098 O ASN A 138 23.361 35.827 -11.302 1.00 0.60 O ATOM 2099 CB ASN A 138 25.404 34.771 -9.631 1.00 0.76 C ATOM 2100 CG ASN A 138 25.642 33.872 -10.836 1.00 1.36 C ATOM 2101 OD1 ASN A 138 25.665 34.335 -11.968 1.00 2.08 O ATOM 2102 ND2 ASN A 138 25.825 32.580 -10.606 1.00 2.17 N ATOM 0 H ASN A 138 24.087 32.769 -8.806 1.00 0.59 H new ATOM 0 HA ASN A 138 23.792 35.660 -8.505 1.00 0.66 H new ATOM 0 HB2 ASN A 138 25.742 35.780 -9.867 1.00 0.76 H new ATOM 0 HB3 ASN A 138 26.011 34.418 -8.798 1.00 0.76 H new ATOM 0 HD21 ASN A 138 25.991 31.942 -11.384 1.00 2.17 H new ATOM 0 HD22 ASN A 138 25.800 32.224 -9.651 1.00 2.17 H new ATOM 2109 N LYS A 139 21.850 34.424 -10.400 1.00 0.55 N ATOM 2110 CA LYS A 139 20.909 34.474 -11.527 1.00 0.56 C ATOM 2111 C LYS A 139 20.559 35.907 -11.947 1.00 0.66 C ATOM 2112 O LYS A 139 20.156 36.143 -13.084 1.00 0.76 O ATOM 2113 CB LYS A 139 19.614 33.733 -11.169 1.00 0.62 C ATOM 2114 CG LYS A 139 18.902 34.307 -9.953 1.00 0.75 C ATOM 2115 CD LYS A 139 17.579 33.605 -9.676 1.00 0.96 C ATOM 2116 CE LYS A 139 17.774 32.150 -9.272 1.00 0.74 C ATOM 2117 NZ LYS A 139 18.543 32.012 -8.007 1.00 1.39 N ATOM 0 H LYS A 139 21.522 33.863 -9.614 1.00 0.55 H new ATOM 0 HA LYS A 139 21.408 33.991 -12.367 1.00 0.56 H new ATOM 0 HB2 LYS A 139 18.939 33.765 -12.024 1.00 0.62 H new ATOM 0 HB3 LYS A 139 19.845 32.684 -10.983 1.00 0.62 H new ATOM 0 HG2 LYS A 139 19.548 34.218 -9.080 1.00 0.75 H new ATOM 0 HG3 LYS A 139 18.721 35.371 -10.108 1.00 0.75 H new ATOM 0 HD2 LYS A 139 17.049 34.133 -8.883 1.00 0.96 H new ATOM 0 HD3 LYS A 139 16.951 33.652 -10.566 1.00 0.96 H new ATOM 0 HE2 LYS A 139 16.800 31.674 -9.156 1.00 0.74 H new ATOM 0 HE3 LYS A 139 18.294 31.621 -10.070 1.00 0.74 H new ATOM 0 HZ1 LYS A 139 18.266 31.132 -7.526 1.00 1.39 H new ATOM 0 HZ2 LYS A 139 19.560 31.984 -8.221 1.00 1.39 H new ATOM 0 HZ3 LYS A 139 18.341 32.823 -7.388 1.00 1.39 H new ATOM 2131 N ARG A 140 20.708 36.854 -11.029 1.00 0.73 N ATOM 2132 CA ARG A 140 20.286 38.228 -11.279 1.00 0.87 C ATOM 2133 C ARG A 140 21.428 39.082 -11.825 1.00 0.86 C ATOM 2134 O ARG A 140 21.251 40.268 -12.113 1.00 1.01 O ATOM 2135 CB ARG A 140 19.740 38.841 -9.994 1.00 1.03 C ATOM 2136 CG ARG A 140 20.807 39.250 -8.989 1.00 1.11 C ATOM 2137 CD ARG A 140 20.177 39.754 -7.703 1.00 1.39 C ATOM 2138 NE ARG A 140 21.139 40.423 -6.831 1.00 1.65 N ATOM 2139 CZ ARG A 140 20.801 41.077 -5.719 1.00 2.04 C ATOM 2140 NH1 ARG A 140 19.534 41.101 -5.318 1.00 2.31 N ATOM 2141 NH2 ARG A 140 21.731 41.697 -5.002 1.00 2.46 N ATOM 0 H ARG A 140 21.116 36.697 -10.108 1.00 0.73 H new ATOM 0 HA ARG A 140 19.503 38.205 -12.036 1.00 0.87 H new ATOM 0 HB2 ARG A 140 19.143 39.717 -10.249 1.00 1.03 H new ATOM 0 HB3 ARG A 140 19.068 38.125 -9.521 1.00 1.03 H new ATOM 0 HG2 ARG A 140 21.453 38.399 -8.773 1.00 1.11 H new ATOM 0 HG3 ARG A 140 21.438 40.028 -9.419 1.00 1.11 H new ATOM 0 HD2 ARG A 140 19.370 40.445 -7.945 1.00 1.39 H new ATOM 0 HD3 ARG A 140 19.730 38.916 -7.169 1.00 1.39 H new ATOM 0 HE ARG A 140 22.126 40.388 -7.087 1.00 1.65 H new ATOM 0 HH11 ARG A 140 18.818 40.619 -5.861 1.00 2.31 H new ATOM 0 HH12 ARG A 140 19.278 41.602 -4.467 1.00 2.31 H new ATOM 0 HH21 ARG A 140 22.706 41.674 -5.302 1.00 2.46 H new ATOM 0 HH22 ARG A 140 21.471 42.197 -4.152 1.00 2.46 H new ATOM 2155 N ASP A 141 22.594 38.481 -11.954 1.00 0.73 N ATOM 2156 CA ASP A 141 23.758 39.188 -12.487 1.00 0.75 C ATOM 2157 C ASP A 141 23.665 39.285 -14.013 1.00 0.72 C ATOM 2158 O ASP A 141 22.751 38.730 -14.626 1.00 0.75 O ATOM 2159 CB ASP A 141 25.073 38.500 -12.081 1.00 0.74 C ATOM 2160 CG ASP A 141 26.264 39.442 -12.155 1.00 1.24 C ATOM 2161 OD1 ASP A 141 26.376 40.334 -11.282 1.00 1.89 O ATOM 2162 OD2 ASP A 141 27.083 39.309 -13.087 1.00 1.57 O ATOM 0 H ASP A 141 22.768 37.509 -11.700 1.00 0.73 H new ATOM 0 HA ASP A 141 23.760 40.191 -12.061 1.00 0.75 H new ATOM 0 HB2 ASP A 141 24.980 38.114 -11.066 1.00 0.74 H new ATOM 0 HB3 ASP A 141 25.249 37.644 -12.732 1.00 0.74 H new ATOM 2167 N LEU A 142 24.618 39.982 -14.619 1.00 0.85 N ATOM 2168 CA LEU A 142 24.632 40.203 -16.064 1.00 0.92 C ATOM 2169 C LEU A 142 25.431 39.102 -16.747 1.00 0.80 C ATOM 2170 O LEU A 142 26.024 39.307 -17.812 1.00 1.03 O ATOM 2171 CB LEU A 142 25.265 41.557 -16.361 1.00 1.16 C ATOM 2172 CG LEU A 142 24.692 42.727 -15.568 1.00 2.05 C ATOM 2173 CD1 LEU A 142 25.560 43.950 -15.762 1.00 2.56 C ATOM 2174 CD2 LEU A 142 23.259 43.016 -15.985 1.00 2.88 C ATOM 0 H LEU A 142 25.402 40.410 -14.126 1.00 0.85 H new ATOM 0 HA LEU A 142 23.610 40.188 -16.443 1.00 0.92 H new ATOM 0 HB2 LEU A 142 26.335 41.492 -16.162 1.00 1.16 H new ATOM 0 HB3 LEU A 142 25.151 41.768 -17.424 1.00 1.16 H new ATOM 0 HG LEU A 142 24.684 42.461 -14.511 1.00 2.05 H new ATOM 0 HD11 LEU A 142 25.147 44.783 -15.194 1.00 2.56 H new ATOM 0 HD12 LEU A 142 26.571 43.738 -15.413 1.00 2.56 H new ATOM 0 HD13 LEU A 142 25.589 44.211 -16.820 1.00 2.56 H new ATOM 0 HD21 LEU A 142 22.873 43.854 -15.405 1.00 2.88 H new ATOM 0 HD22 LEU A 142 23.232 43.266 -17.046 1.00 2.88 H new ATOM 0 HD23 LEU A 142 22.643 42.135 -15.804 1.00 2.88 H new ATOM 2186 N LEU A 143 25.419 37.942 -16.110 1.00 0.90 N ATOM 2187 CA LEU A 143 26.212 36.787 -16.519 1.00 0.81 C ATOM 2188 C LEU A 143 26.019 36.452 -18.001 1.00 0.88 C ATOM 2189 O LEU A 143 24.928 36.079 -18.438 1.00 0.97 O ATOM 2190 CB LEU A 143 25.843 35.581 -15.650 1.00 0.70 C ATOM 2191 CG LEU A 143 26.823 34.410 -15.712 1.00 0.60 C ATOM 2192 CD1 LEU A 143 28.210 34.865 -15.291 1.00 0.65 C ATOM 2193 CD2 LEU A 143 26.354 33.271 -14.824 1.00 0.58 C ATOM 0 H LEU A 143 24.850 37.771 -15.281 1.00 0.90 H new ATOM 0 HA LEU A 143 27.264 37.035 -16.380 1.00 0.81 H new ATOM 0 HB2 LEU A 143 25.761 35.911 -14.614 1.00 0.70 H new ATOM 0 HB3 LEU A 143 24.857 35.225 -15.950 1.00 0.70 H new ATOM 0 HG LEU A 143 26.865 34.050 -16.740 1.00 0.60 H new ATOM 0 HD11 LEU A 143 28.900 34.022 -15.339 1.00 0.65 H new ATOM 0 HD12 LEU A 143 28.553 35.653 -15.961 1.00 0.65 H new ATOM 0 HD13 LEU A 143 28.174 35.246 -14.270 1.00 0.65 H new ATOM 0 HD21 LEU A 143 27.066 32.447 -14.882 1.00 0.58 H new ATOM 0 HD22 LEU A 143 26.285 33.618 -13.793 1.00 0.58 H new ATOM 0 HD23 LEU A 143 25.375 32.929 -15.158 1.00 0.58 H new ATOM 2205 N GLN A 144 27.094 36.593 -18.766 1.00 0.90 N ATOM 2206 CA GLN A 144 27.074 36.306 -20.192 1.00 1.00 C ATOM 2207 C GLN A 144 28.114 35.250 -20.539 1.00 0.92 C ATOM 2208 O GLN A 144 28.790 34.715 -19.661 1.00 0.84 O ATOM 2209 CB GLN A 144 27.364 37.572 -21.002 1.00 1.21 C ATOM 2210 CG GLN A 144 28.673 38.242 -20.615 1.00 1.27 C ATOM 2211 CD GLN A 144 29.187 39.198 -21.671 1.00 1.47 C ATOM 2212 OE1 GLN A 144 28.837 40.376 -21.689 1.00 1.71 O ATOM 2213 NE2 GLN A 144 30.041 38.700 -22.553 1.00 1.77 N ATOM 0 H GLN A 144 27.999 36.908 -18.417 1.00 0.90 H new ATOM 0 HA GLN A 144 26.080 35.935 -20.442 1.00 1.00 H new ATOM 0 HB2 GLN A 144 27.392 37.319 -22.062 1.00 1.21 H new ATOM 0 HB3 GLN A 144 26.546 38.279 -20.864 1.00 1.21 H new ATOM 0 HG2 GLN A 144 28.534 38.784 -19.680 1.00 1.27 H new ATOM 0 HG3 GLN A 144 29.426 37.476 -20.430 1.00 1.27 H new ATOM 0 HE21 GLN A 144 30.308 37.717 -22.506 1.00 1.77 H new ATOM 0 HE22 GLN A 144 30.432 39.300 -23.279 1.00 1.77 H new ATOM 2222 N LYS A 145 28.241 34.961 -21.825 1.00 0.97 N ATOM 2223 CA LYS A 145 29.274 34.060 -22.303 1.00 0.98 C ATOM 2224 C LYS A 145 30.636 34.721 -22.156 1.00 1.01 C ATOM 2225 O LYS A 145 30.824 35.873 -22.554 1.00 1.11 O ATOM 2226 CB LYS A 145 29.032 33.687 -23.766 1.00 1.06 C ATOM 2227 CG LYS A 145 30.101 32.770 -24.335 1.00 1.17 C ATOM 2228 CD LYS A 145 29.886 32.499 -25.811 1.00 1.25 C ATOM 2229 CE LYS A 145 30.986 31.615 -26.366 1.00 1.41 C ATOM 2230 NZ LYS A 145 30.841 31.399 -27.824 1.00 1.43 N ATOM 0 H LYS A 145 27.639 35.339 -22.557 1.00 0.97 H new ATOM 0 HA LYS A 145 29.245 33.148 -21.706 1.00 0.98 H new ATOM 0 HB2 LYS A 145 28.061 33.200 -23.854 1.00 1.06 H new ATOM 0 HB3 LYS A 145 28.988 34.597 -24.364 1.00 1.06 H new ATOM 0 HG2 LYS A 145 31.082 33.221 -24.188 1.00 1.17 H new ATOM 0 HG3 LYS A 145 30.099 31.827 -23.789 1.00 1.17 H new ATOM 0 HD2 LYS A 145 28.919 32.019 -25.959 1.00 1.25 H new ATOM 0 HD3 LYS A 145 29.861 33.442 -26.358 1.00 1.25 H new ATOM 0 HE2 LYS A 145 31.955 32.070 -26.161 1.00 1.41 H new ATOM 0 HE3 LYS A 145 30.971 30.653 -25.854 1.00 1.41 H new ATOM 0 HZ1 LYS A 145 31.613 30.790 -28.163 1.00 1.43 H new ATOM 0 HZ2 LYS A 145 29.928 30.941 -28.018 1.00 1.43 H new ATOM 0 HZ3 LYS A 145 30.881 32.314 -28.316 1.00 1.43 H new ATOM 2244 N GLY A 146 31.578 33.998 -21.576 1.00 0.97 N ATOM 2245 CA GLY A 146 32.900 34.543 -21.364 1.00 1.06 C ATOM 2246 C GLY A 146 33.138 34.920 -19.917 1.00 1.00 C ATOM 2247 O GLY A 146 34.245 35.302 -19.541 1.00 1.07 O ATOM 0 H GLY A 146 31.451 33.041 -21.247 1.00 0.97 H new ATOM 0 HA2 GLY A 146 33.647 33.812 -21.675 1.00 1.06 H new ATOM 0 HA3 GLY A 146 33.034 35.423 -21.994 1.00 1.06 H new ATOM 2251 N ASP A 147 32.101 34.815 -19.098 1.00 0.90 N ATOM 2252 CA ASP A 147 32.256 35.048 -17.671 1.00 0.87 C ATOM 2253 C ASP A 147 32.556 33.745 -16.957 1.00 0.72 C ATOM 2254 O ASP A 147 31.925 32.717 -17.228 1.00 0.63 O ATOM 2255 CB ASP A 147 31.014 35.698 -17.068 1.00 0.89 C ATOM 2256 CG ASP A 147 31.095 37.210 -17.063 1.00 1.35 C ATOM 2257 OD1 ASP A 147 30.464 37.844 -17.939 1.00 1.94 O ATOM 2258 OD2 ASP A 147 31.788 37.769 -16.192 1.00 1.60 O ATOM 0 H ASP A 147 31.155 34.573 -19.393 1.00 0.90 H new ATOM 0 HA ASP A 147 33.092 35.735 -17.538 1.00 0.87 H new ATOM 0 HB2 ASP A 147 30.135 35.386 -17.632 1.00 0.89 H new ATOM 0 HB3 ASP A 147 30.881 35.341 -16.047 1.00 0.89 H new ATOM 2263 N LEU A 148 33.530 33.785 -16.063 1.00 0.75 N ATOM 2264 CA LEU A 148 33.896 32.614 -15.291 1.00 0.66 C ATOM 2265 C LEU A 148 32.931 32.425 -14.132 1.00 0.60 C ATOM 2266 O LEU A 148 32.495 33.392 -13.504 1.00 0.63 O ATOM 2267 CB LEU A 148 35.326 32.737 -14.764 1.00 0.75 C ATOM 2268 CG LEU A 148 36.423 32.769 -15.830 1.00 0.93 C ATOM 2269 CD1 LEU A 148 37.786 32.936 -15.185 1.00 1.46 C ATOM 2270 CD2 LEU A 148 36.388 31.503 -16.674 1.00 1.79 C ATOM 0 H LEU A 148 34.081 34.618 -15.855 1.00 0.75 H new ATOM 0 HA LEU A 148 33.841 31.744 -15.945 1.00 0.66 H new ATOM 0 HB2 LEU A 148 35.397 33.647 -14.168 1.00 0.75 H new ATOM 0 HB3 LEU A 148 35.520 31.900 -14.093 1.00 0.75 H new ATOM 0 HG LEU A 148 36.241 33.623 -16.482 1.00 0.93 H new ATOM 0 HD11 LEU A 148 38.554 32.957 -15.958 1.00 1.46 H new ATOM 0 HD12 LEU A 148 37.811 33.870 -14.624 1.00 1.46 H new ATOM 0 HD13 LEU A 148 37.974 32.101 -14.509 1.00 1.46 H new ATOM 0 HD21 LEU A 148 37.176 31.545 -17.426 1.00 1.79 H new ATOM 0 HD22 LEU A 148 36.544 30.635 -16.034 1.00 1.79 H new ATOM 0 HD23 LEU A 148 35.419 31.421 -17.167 1.00 1.79 H new ATOM 2282 N VAL A 149 32.594 31.183 -13.855 1.00 0.53 N ATOM 2283 CA VAL A 149 31.681 30.875 -12.774 1.00 0.48 C ATOM 2284 C VAL A 149 32.309 29.890 -11.804 1.00 0.46 C ATOM 2285 O VAL A 149 33.052 28.992 -12.202 1.00 0.49 O ATOM 2286 CB VAL A 149 30.343 30.310 -13.294 1.00 0.50 C ATOM 2287 CG1 VAL A 149 29.536 31.401 -13.977 1.00 1.16 C ATOM 2288 CG2 VAL A 149 30.579 29.150 -14.250 1.00 1.10 C ATOM 0 H VAL A 149 32.939 30.369 -14.364 1.00 0.53 H new ATOM 0 HA VAL A 149 31.475 31.811 -12.255 1.00 0.48 H new ATOM 0 HB VAL A 149 29.777 29.939 -12.440 1.00 0.50 H new ATOM 0 HG11 VAL A 149 28.595 30.986 -14.338 1.00 1.16 H new ATOM 0 HG12 VAL A 149 29.330 32.201 -13.266 1.00 1.16 H new ATOM 0 HG13 VAL A 149 30.103 31.800 -14.818 1.00 1.16 H new ATOM 0 HG21 VAL A 149 29.621 28.769 -14.603 1.00 1.10 H new ATOM 0 HG22 VAL A 149 31.168 29.493 -15.100 1.00 1.10 H new ATOM 0 HG23 VAL A 149 31.117 28.356 -13.733 1.00 1.10 H new ATOM 2298 N SER A 150 32.028 30.081 -10.531 1.00 0.46 N ATOM 2299 CA SER A 150 32.507 29.175 -9.511 1.00 0.47 C ATOM 2300 C SER A 150 31.387 28.231 -9.106 1.00 0.41 C ATOM 2301 O SER A 150 30.316 28.670 -8.690 1.00 0.49 O ATOM 2302 CB SER A 150 33.027 29.957 -8.303 1.00 0.59 C ATOM 2303 OG SER A 150 32.071 30.904 -7.841 1.00 1.44 O ATOM 0 H SER A 150 31.469 30.858 -10.179 1.00 0.46 H new ATOM 0 HA SER A 150 33.335 28.588 -9.909 1.00 0.47 H new ATOM 0 HB2 SER A 150 33.272 29.264 -7.498 1.00 0.59 H new ATOM 0 HB3 SER A 150 33.949 30.472 -8.572 1.00 0.59 H new ATOM 0 HG SER A 150 31.714 31.407 -8.603 1.00 1.44 H new ATOM 2309 N PHE A 151 31.631 26.940 -9.256 1.00 0.34 N ATOM 2310 CA PHE A 151 30.621 25.934 -8.987 1.00 0.34 C ATOM 2311 C PHE A 151 31.263 24.699 -8.382 1.00 0.41 C ATOM 2312 O PHE A 151 32.482 24.528 -8.447 1.00 0.49 O ATOM 2313 CB PHE A 151 29.885 25.566 -10.280 1.00 0.30 C ATOM 2314 CG PHE A 151 30.802 25.175 -11.411 1.00 0.35 C ATOM 2315 CD1 PHE A 151 31.274 26.134 -12.294 1.00 0.39 C ATOM 2316 CD2 PHE A 151 31.202 23.858 -11.587 1.00 0.47 C ATOM 2317 CE1 PHE A 151 32.125 25.789 -13.325 1.00 0.53 C ATOM 2318 CE2 PHE A 151 32.051 23.511 -12.622 1.00 0.59 C ATOM 2319 CZ PHE A 151 32.514 24.481 -13.486 1.00 0.61 C ATOM 0 H PHE A 151 32.527 26.563 -9.565 1.00 0.34 H new ATOM 0 HA PHE A 151 29.901 26.340 -8.277 1.00 0.34 H new ATOM 0 HB2 PHE A 151 29.202 24.741 -10.076 1.00 0.30 H new ATOM 0 HB3 PHE A 151 29.276 26.414 -10.595 1.00 0.30 H new ATOM 0 HD1 PHE A 151 30.972 27.164 -12.174 1.00 0.39 H new ATOM 0 HD2 PHE A 151 30.847 23.096 -10.909 1.00 0.47 H new ATOM 0 HE1 PHE A 151 32.485 26.547 -14.005 1.00 0.53 H new ATOM 0 HE2 PHE A 151 32.351 22.482 -12.753 1.00 0.59 H new ATOM 0 HZ PHE A 151 33.183 24.212 -14.290 1.00 0.61 H new ATOM 2329 N ARG A 152 30.456 23.841 -7.781 1.00 0.44 N ATOM 2330 CA ARG A 152 30.973 22.602 -7.245 1.00 0.51 C ATOM 2331 C ARG A 152 30.045 21.433 -7.561 1.00 0.50 C ATOM 2332 O ARG A 152 28.849 21.459 -7.268 1.00 0.54 O ATOM 2333 CB ARG A 152 31.209 22.737 -5.737 1.00 0.69 C ATOM 2334 CG ARG A 152 29.976 23.131 -4.935 1.00 0.94 C ATOM 2335 CD ARG A 152 30.225 24.392 -4.117 1.00 1.05 C ATOM 2336 NE ARG A 152 30.293 25.591 -4.956 1.00 1.29 N ATOM 2337 CZ ARG A 152 30.979 26.695 -4.643 1.00 1.57 C ATOM 2338 NH1 ARG A 152 31.710 26.742 -3.535 1.00 2.03 N ATOM 2339 NH2 ARG A 152 30.926 27.757 -5.440 1.00 2.20 N ATOM 0 H ARG A 152 29.453 23.980 -7.655 1.00 0.44 H new ATOM 0 HA ARG A 152 31.929 22.391 -7.724 1.00 0.51 H new ATOM 0 HB2 ARG A 152 31.587 21.788 -5.355 1.00 0.69 H new ATOM 0 HB3 ARG A 152 31.988 23.481 -5.570 1.00 0.69 H new ATOM 0 HG2 ARG A 152 29.137 23.294 -5.611 1.00 0.94 H new ATOM 0 HG3 ARG A 152 29.696 22.314 -4.270 1.00 0.94 H new ATOM 0 HD2 ARG A 152 29.429 24.510 -3.382 1.00 1.05 H new ATOM 0 HD3 ARG A 152 31.157 24.285 -3.562 1.00 1.05 H new ATOM 0 HE ARG A 152 29.782 25.583 -5.839 1.00 1.29 H new ATOM 0 HH11 ARG A 152 31.751 25.932 -2.916 1.00 2.03 H new ATOM 0 HH12 ARG A 152 32.231 27.588 -3.303 1.00 2.03 H new ATOM 0 HH21 ARG A 152 30.362 27.729 -6.290 1.00 2.20 H new ATOM 0 HH22 ARG A 152 31.449 28.600 -5.202 1.00 2.20 H new ATOM 2353 N ILE A 153 30.622 20.428 -8.201 1.00 0.51 N ATOM 2354 CA ILE A 153 29.933 19.191 -8.534 1.00 0.56 C ATOM 2355 C ILE A 153 30.277 18.101 -7.519 1.00 0.65 C ATOM 2356 O ILE A 153 31.444 17.942 -7.157 1.00 0.75 O ATOM 2357 CB ILE A 153 30.290 18.733 -9.974 1.00 0.58 C ATOM 2358 CG1 ILE A 153 29.936 17.256 -10.194 1.00 1.23 C ATOM 2359 CG2 ILE A 153 31.759 18.986 -10.278 1.00 0.93 C ATOM 2360 CD1 ILE A 153 30.283 16.750 -11.578 1.00 1.24 C ATOM 0 H ILE A 153 31.595 20.449 -8.508 1.00 0.51 H new ATOM 0 HA ILE A 153 28.859 19.373 -8.494 1.00 0.56 H new ATOM 0 HB ILE A 153 29.692 19.326 -10.666 1.00 0.58 H new ATOM 0 HG12 ILE A 153 30.459 16.651 -9.453 1.00 1.23 H new ATOM 0 HG13 ILE A 153 28.869 17.117 -10.022 1.00 1.23 H new ATOM 0 HG21 ILE A 153 31.983 18.656 -11.293 1.00 0.93 H new ATOM 0 HG22 ILE A 153 31.971 20.051 -10.188 1.00 0.93 H new ATOM 0 HG23 ILE A 153 32.377 18.432 -9.572 1.00 0.93 H new ATOM 0 HD11 ILE A 153 30.005 15.699 -11.662 1.00 1.24 H new ATOM 0 HD12 ILE A 153 29.739 17.330 -12.324 1.00 1.24 H new ATOM 0 HD13 ILE A 153 31.355 16.856 -11.746 1.00 1.24 H new ATOM 2372 N ASP A 154 29.271 17.371 -7.049 1.00 0.71 N ATOM 2373 CA ASP A 154 29.503 16.256 -6.129 1.00 0.82 C ATOM 2374 C ASP A 154 28.395 15.200 -6.234 1.00 0.96 C ATOM 2375 O ASP A 154 28.415 14.371 -7.142 1.00 1.09 O ATOM 2376 CB ASP A 154 29.663 16.763 -4.687 1.00 0.84 C ATOM 2377 CG ASP A 154 29.637 15.660 -3.644 1.00 1.45 C ATOM 2378 OD1 ASP A 154 30.459 14.727 -3.735 1.00 1.92 O ATOM 2379 OD2 ASP A 154 28.789 15.737 -2.729 1.00 1.73 O ATOM 0 H ASP A 154 28.291 17.528 -7.286 1.00 0.71 H new ATOM 0 HA ASP A 154 30.436 15.772 -6.419 1.00 0.82 H new ATOM 0 HB2 ASP A 154 30.605 17.306 -4.605 1.00 0.84 H new ATOM 0 HB3 ASP A 154 28.865 17.474 -4.471 1.00 0.84 H new ATOM 2384 N GLU A 155 27.414 15.254 -5.342 1.00 1.00 N ATOM 2385 CA GLU A 155 26.379 14.226 -5.283 1.00 1.17 C ATOM 2386 C GLU A 155 25.316 14.435 -6.355 1.00 1.23 C ATOM 2387 O GLU A 155 24.660 13.486 -6.789 1.00 1.46 O ATOM 2388 CB GLU A 155 25.759 14.183 -3.884 1.00 1.25 C ATOM 2389 CG GLU A 155 25.243 15.523 -3.385 1.00 1.32 C ATOM 2390 CD GLU A 155 23.733 15.618 -3.403 1.00 2.00 C ATOM 2391 OE1 GLU A 155 23.101 15.227 -2.406 1.00 2.28 O ATOM 2392 OE2 GLU A 155 23.177 16.086 -4.422 1.00 2.76 O ATOM 0 H GLU A 155 27.312 15.997 -4.650 1.00 1.00 H new ATOM 0 HA GLU A 155 26.846 13.262 -5.485 1.00 1.17 H new ATOM 0 HB2 GLU A 155 24.936 13.468 -3.886 1.00 1.25 H new ATOM 0 HB3 GLU A 155 26.504 13.809 -3.181 1.00 1.25 H new ATOM 0 HG2 GLU A 155 25.600 15.688 -2.368 1.00 1.32 H new ATOM 0 HG3 GLU A 155 25.659 16.319 -4.002 1.00 1.32 H new ATOM 2399 N SER A 156 25.166 15.676 -6.797 1.00 1.10 N ATOM 2400 CA SER A 156 24.220 16.005 -7.852 1.00 1.19 C ATOM 2401 C SER A 156 24.819 15.674 -9.220 1.00 1.14 C ATOM 2402 O SER A 156 24.104 15.556 -10.217 1.00 1.27 O ATOM 2403 CB SER A 156 23.841 17.492 -7.767 1.00 1.17 C ATOM 2404 OG SER A 156 22.891 17.851 -8.756 1.00 1.98 O ATOM 0 H SER A 156 25.690 16.474 -6.439 1.00 1.10 H new ATOM 0 HA SER A 156 23.317 15.409 -7.723 1.00 1.19 H new ATOM 0 HB2 SER A 156 23.436 17.708 -6.778 1.00 1.17 H new ATOM 0 HB3 SER A 156 24.736 18.102 -7.885 1.00 1.17 H new ATOM 0 HG SER A 156 22.673 18.803 -8.670 1.00 1.98 H new ATOM 2410 N GLY A 157 26.141 15.500 -9.253 1.00 1.04 N ATOM 2411 CA GLY A 157 26.830 15.192 -10.498 1.00 1.09 C ATOM 2412 C GLY A 157 26.745 16.310 -11.523 1.00 1.02 C ATOM 2413 O GLY A 157 26.984 16.089 -12.710 1.00 1.27 O ATOM 0 H GLY A 157 26.748 15.567 -8.436 1.00 1.04 H new ATOM 0 HA2 GLY A 157 27.878 14.984 -10.283 1.00 1.09 H new ATOM 0 HA3 GLY A 157 26.406 14.283 -10.925 1.00 1.09 H new ATOM 2417 N ARG A 158 26.405 17.506 -11.064 1.00 0.79 N ATOM 2418 CA ARG A 158 26.279 18.669 -11.935 1.00 0.72 C ATOM 2419 C ARG A 158 26.735 19.926 -11.197 1.00 0.56 C ATOM 2420 O ARG A 158 27.286 19.830 -10.099 1.00 0.57 O ATOM 2421 CB ARG A 158 24.833 18.811 -12.432 1.00 0.85 C ATOM 2422 CG ARG A 158 24.522 17.919 -13.628 1.00 1.47 C ATOM 2423 CD ARG A 158 23.067 18.013 -14.063 1.00 1.52 C ATOM 2424 NE ARG A 158 22.190 17.161 -13.262 1.00 2.12 N ATOM 2425 CZ ARG A 158 20.976 16.766 -13.658 1.00 2.75 C ATOM 2426 NH1 ARG A 158 20.475 17.189 -14.814 1.00 3.00 N ATOM 2427 NH2 ARG A 158 20.252 15.958 -12.889 1.00 3.61 N ATOM 0 H ARG A 158 26.209 17.699 -10.082 1.00 0.79 H new ATOM 0 HA ARG A 158 26.920 18.533 -12.806 1.00 0.72 H new ATOM 0 HB2 ARG A 158 24.150 18.569 -11.618 1.00 0.85 H new ATOM 0 HB3 ARG A 158 24.649 19.850 -12.704 1.00 0.85 H new ATOM 0 HG2 ARG A 158 25.166 18.198 -14.462 1.00 1.47 H new ATOM 0 HG3 ARG A 158 24.756 16.885 -13.376 1.00 1.47 H new ATOM 0 HD2 ARG A 158 22.734 19.048 -13.986 1.00 1.52 H new ATOM 0 HD3 ARG A 158 22.985 17.729 -15.112 1.00 1.52 H new ATOM 0 HE ARG A 158 22.523 16.850 -12.349 1.00 2.12 H new ATOM 0 HH11 ARG A 158 21.018 17.819 -15.405 1.00 3.00 H new ATOM 0 HH12 ARG A 158 19.548 16.884 -15.110 1.00 3.00 H new ATOM 0 HH21 ARG A 158 20.623 15.638 -11.994 1.00 3.61 H new ATOM 0 HH22 ARG A 158 19.326 15.658 -13.194 1.00 3.61 H new ATOM 2441 N ALA A 159 26.503 21.095 -11.787 1.00 0.48 N ATOM 2442 CA ALA A 159 27.010 22.339 -11.223 1.00 0.39 C ATOM 2443 C ALA A 159 26.051 22.911 -10.180 1.00 0.39 C ATOM 2444 O ALA A 159 24.870 23.142 -10.451 1.00 0.48 O ATOM 2445 CB ALA A 159 27.267 23.354 -12.327 1.00 0.37 C ATOM 0 H ALA A 159 25.971 21.206 -12.650 1.00 0.48 H new ATOM 0 HA ALA A 159 27.952 22.120 -10.721 1.00 0.39 H new ATOM 0 HB1 ALA A 159 27.645 24.278 -11.891 1.00 0.37 H new ATOM 0 HB2 ALA A 159 28.003 22.954 -13.025 1.00 0.37 H new ATOM 0 HB3 ALA A 159 26.337 23.558 -12.858 1.00 0.37 H new ATOM 2451 N ALA A 160 26.577 23.132 -8.983 1.00 0.38 N ATOM 2452 CA ALA A 160 25.794 23.650 -7.879 1.00 0.41 C ATOM 2453 C ALA A 160 26.568 24.739 -7.156 1.00 0.41 C ATOM 2454 O ALA A 160 27.803 24.775 -7.227 1.00 0.42 O ATOM 2455 CB ALA A 160 25.431 22.534 -6.921 1.00 0.49 C ATOM 0 H ALA A 160 27.555 22.957 -8.754 1.00 0.38 H new ATOM 0 HA ALA A 160 24.873 24.079 -8.273 1.00 0.41 H new ATOM 0 HB1 ALA A 160 24.843 22.939 -6.097 1.00 0.49 H new ATOM 0 HB2 ALA A 160 24.847 21.779 -7.447 1.00 0.49 H new ATOM 0 HB3 ALA A 160 26.341 22.081 -6.529 1.00 0.49 H new ATOM 2461 N CYS A 161 25.842 25.599 -6.444 1.00 0.47 N ATOM 2462 CA CYS A 161 26.419 26.795 -5.841 1.00 0.51 C ATOM 2463 C CYS A 161 27.243 27.555 -6.877 1.00 0.42 C ATOM 2464 O CYS A 161 28.462 27.685 -6.759 1.00 0.49 O ATOM 2465 CB CYS A 161 27.263 26.432 -4.620 1.00 0.63 C ATOM 2466 SG CYS A 161 26.372 25.474 -3.371 1.00 1.55 S ATOM 0 H CYS A 161 24.843 25.486 -6.271 1.00 0.47 H new ATOM 0 HA CYS A 161 25.612 27.444 -5.501 1.00 0.51 H new ATOM 0 HB2 CYS A 161 28.133 25.863 -4.948 1.00 0.63 H new ATOM 0 HB3 CYS A 161 27.636 27.349 -4.163 1.00 0.63 H new ATOM 0 HG CYS A 161 27.167 25.212 -2.377 1.00 1.55 H new ATOM 2472 N VAL A 162 26.560 27.995 -7.918 1.00 0.37 N ATOM 2473 CA VAL A 162 27.180 28.722 -9.010 1.00 0.35 C ATOM 2474 C VAL A 162 27.142 30.217 -8.738 1.00 0.39 C ATOM 2475 O VAL A 162 26.068 30.799 -8.553 1.00 0.48 O ATOM 2476 CB VAL A 162 26.452 28.444 -10.344 1.00 0.45 C ATOM 2477 CG1 VAL A 162 27.131 29.162 -11.497 1.00 1.15 C ATOM 2478 CG2 VAL A 162 26.367 26.949 -10.620 1.00 1.26 C ATOM 0 H VAL A 162 25.556 27.857 -8.030 1.00 0.37 H new ATOM 0 HA VAL A 162 28.213 28.383 -9.086 1.00 0.35 H new ATOM 0 HB VAL A 162 25.437 28.831 -10.253 1.00 0.45 H new ATOM 0 HG11 VAL A 162 26.598 28.948 -12.423 1.00 1.15 H new ATOM 0 HG12 VAL A 162 27.122 30.236 -11.312 1.00 1.15 H new ATOM 0 HG13 VAL A 162 28.161 28.817 -11.584 1.00 1.15 H new ATOM 0 HG21 VAL A 162 25.850 26.782 -11.565 1.00 1.26 H new ATOM 0 HG22 VAL A 162 27.372 26.532 -10.678 1.00 1.26 H new ATOM 0 HG23 VAL A 162 25.818 26.461 -9.815 1.00 1.26 H new ATOM 2488 N ASN A 163 28.309 30.840 -8.711 1.00 0.43 N ATOM 2489 CA ASN A 163 28.388 32.283 -8.580 1.00 0.53 C ATOM 2490 C ASN A 163 29.423 32.838 -9.552 1.00 0.52 C ATOM 2491 O ASN A 163 30.522 32.289 -9.673 1.00 0.53 O ATOM 2492 CB ASN A 163 28.735 32.684 -7.146 1.00 0.67 C ATOM 2493 CG ASN A 163 28.542 34.169 -6.915 1.00 1.29 C ATOM 2494 OD1 ASN A 163 29.453 34.967 -7.115 1.00 1.96 O ATOM 2495 ND2 ASN A 163 27.346 34.546 -6.491 1.00 2.05 N ATOM 0 H ASN A 163 29.211 30.369 -8.778 1.00 0.43 H new ATOM 0 HA ASN A 163 27.412 32.705 -8.821 1.00 0.53 H new ATOM 0 HB2 ASN A 163 28.110 32.124 -6.451 1.00 0.67 H new ATOM 0 HB3 ASN A 163 29.770 32.414 -6.933 1.00 0.67 H new ATOM 0 HD21 ASN A 163 27.154 35.533 -6.318 1.00 2.05 H new ATOM 0 HD22 ASN A 163 26.617 33.850 -6.337 1.00 2.05 H new ATOM 2502 N ALA A 164 29.048 33.892 -10.273 1.00 0.53 N ATOM 2503 CA ALA A 164 29.939 34.543 -11.224 1.00 0.56 C ATOM 2504 C ALA A 164 31.184 35.083 -10.540 1.00 0.63 C ATOM 2505 O ALA A 164 31.105 35.925 -9.648 1.00 0.75 O ATOM 2506 CB ALA A 164 29.207 35.665 -11.940 1.00 0.60 C ATOM 0 H ALA A 164 28.122 34.316 -10.214 1.00 0.53 H new ATOM 0 HA ALA A 164 30.255 33.797 -11.953 1.00 0.56 H new ATOM 0 HB1 ALA A 164 29.882 36.145 -12.649 1.00 0.60 H new ATOM 0 HB2 ALA A 164 28.349 35.257 -12.475 1.00 0.60 H new ATOM 0 HB3 ALA A 164 28.864 36.399 -11.211 1.00 0.60 H new ATOM 2512 N VAL A 165 32.335 34.600 -10.974 1.00 0.62 N ATOM 2513 CA VAL A 165 33.600 35.003 -10.388 1.00 0.70 C ATOM 2514 C VAL A 165 34.566 35.492 -11.468 1.00 0.71 C ATOM 2515 O VAL A 165 34.814 34.809 -12.459 1.00 0.95 O ATOM 2516 CB VAL A 165 34.238 33.847 -9.575 1.00 1.07 C ATOM 2517 CG1 VAL A 165 34.469 32.621 -10.443 1.00 1.43 C ATOM 2518 CG2 VAL A 165 35.538 34.294 -8.918 1.00 1.56 C ATOM 0 H VAL A 165 32.419 33.925 -11.734 1.00 0.62 H new ATOM 0 HA VAL A 165 33.399 35.826 -9.702 1.00 0.70 H new ATOM 0 HB VAL A 165 33.535 33.572 -8.789 1.00 1.07 H new ATOM 0 HG11 VAL A 165 34.917 31.829 -9.843 1.00 1.43 H new ATOM 0 HG12 VAL A 165 33.517 32.276 -10.846 1.00 1.43 H new ATOM 0 HG13 VAL A 165 35.139 32.877 -11.264 1.00 1.43 H new ATOM 0 HG21 VAL A 165 35.965 33.464 -8.354 1.00 1.56 H new ATOM 0 HG22 VAL A 165 36.243 34.612 -9.686 1.00 1.56 H new ATOM 0 HG23 VAL A 165 35.337 35.126 -8.243 1.00 1.56 H new ATOM 2528 N ARG A 166 35.094 36.691 -11.286 1.00 0.84 N ATOM 2529 CA ARG A 166 36.031 37.248 -12.243 1.00 1.15 C ATOM 2530 C ARG A 166 37.456 37.072 -11.738 1.00 1.13 C ATOM 2531 O ARG A 166 37.790 37.490 -10.629 1.00 1.05 O ATOM 2532 CB ARG A 166 35.725 38.725 -12.521 1.00 1.51 C ATOM 2533 CG ARG A 166 34.511 38.950 -13.422 1.00 1.76 C ATOM 2534 CD ARG A 166 33.192 38.708 -12.695 1.00 1.58 C ATOM 2535 NE ARG A 166 32.055 38.640 -13.618 1.00 1.94 N ATOM 2536 CZ ARG A 166 30.808 39.017 -13.319 1.00 2.24 C ATOM 2537 NH1 ARG A 166 30.534 39.584 -12.151 1.00 2.45 N ATOM 2538 NH2 ARG A 166 29.837 38.840 -14.207 1.00 2.94 N ATOM 0 H ARG A 166 34.890 37.293 -10.488 1.00 0.84 H new ATOM 0 HA ARG A 166 35.926 36.709 -13.185 1.00 1.15 H new ATOM 0 HB2 ARG A 166 35.560 39.236 -11.572 1.00 1.51 H new ATOM 0 HB3 ARG A 166 36.598 39.185 -12.983 1.00 1.51 H new ATOM 0 HG2 ARG A 166 34.530 39.971 -13.804 1.00 1.76 H new ATOM 0 HG3 ARG A 166 34.574 38.286 -14.284 1.00 1.76 H new ATOM 0 HD2 ARG A 166 33.256 37.778 -12.131 1.00 1.58 H new ATOM 0 HD3 ARG A 166 33.025 39.508 -11.974 1.00 1.58 H new ATOM 0 HE ARG A 166 32.228 38.279 -14.556 1.00 1.94 H new ATOM 0 HH11 ARG A 166 31.279 39.736 -11.471 1.00 2.45 H new ATOM 0 HH12 ARG A 166 29.579 39.868 -11.933 1.00 2.45 H new ATOM 0 HH21 ARG A 166 30.044 38.418 -15.112 1.00 2.94 H new ATOM 0 HH22 ARG A 166 28.884 39.126 -13.984 1.00 2.94 H new