USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1052 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 130 HIS : no HD1:sc= -0.155 X(o=-0.19,f=-0.13) USER MOD Set 1.2: A 131 HIS : no HD1:sc= -0.0327 X(o=-0.19,f=-0.13) USER MOD Set 2.1: A 85 MET CE :methyl -114:sc= -2.41 (180deg=-4.3!) USER MOD Set 2.2: A 91 CYS SG : rot 8:sc= -1.58! USER MOD Set 3.1: A 20 LYS NZ :NH3+ 154:sc= 1.71 (180deg=0.475) USER MOD Set 3.2: A 84 SER OG : rot 88:sc= 1.78 USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0347 (180deg=-0.289) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc= -0.0711 K(o=-0.071,f=-0.68) USER MOD Single : A 9 LYS NZ :NH3+ -122:sc= 0.351 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -149:sc= 1.16 USER MOD Single : A 21 THR OG1 : rot -100:sc= 0.858 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -0.628! X(o=-0.63!,f=-0.88) USER MOD Single : A 35 LYS NZ :NH3+ -158:sc= -0.0109 (180deg=-0.167) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= -0.846 K(o=-0.85,f=-2.4) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.366 X(o=-0.37,f=-0.23) USER MOD Single : A 44 TYR OH : rot -6:sc= 0.00601 USER MOD Single : A 47 LYS NZ :NH3+ -124:sc= 0.71 (180deg=-0.436) USER MOD Single : A 50 SER OG : rot -170:sc= 0 USER MOD Single : A 51 THR OG1 : rot -36:sc= 0.766 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 1.13 (180deg=1.13) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= -0.467 K(o=-0.47,f=-1.1) USER MOD Single : A 71 GLN : amide:sc= -3.22 K(o=-3.2,f=-3.9!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 CYS SG : rot 180:sc= -1.55 USER MOD Single : A 83 SER OG : rot -85:sc= 1.18 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 168:sc= 2.05 (180deg=1.52) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl -142:sc= -0.212 (180deg=-0.856) USER MOD Single : A 99 TYR OH : rot 150:sc= 0 USER MOD Single : A 101 TYR OH : rot -136:sc= 1.25 USER MOD Single : A 106 CYS SG : rot -135:sc= 0.291 USER MOD Single : A 109 SER OG : rot 177:sc= 0.0926 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0.035 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= -0.0581 K(o=-0.058,f=-2.8!) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.493 -6.152 -5.936 1.00 5.93 N ATOM 2 CA MET A 1 3.073 -7.476 -6.277 1.00 5.55 C ATOM 3 C MET A 1 3.941 -7.987 -5.138 1.00 5.18 C ATOM 4 O MET A 1 3.621 -8.990 -4.504 1.00 5.39 O ATOM 5 CB MET A 1 3.913 -7.397 -7.555 1.00 5.94 C ATOM 6 CG MET A 1 4.547 -8.725 -7.947 1.00 6.32 C ATOM 7 SD MET A 1 5.749 -8.559 -9.279 1.00 7.08 S ATOM 8 CE MET A 1 4.716 -7.933 -10.597 1.00 7.48 C ATOM 0 H1 MET A 1 1.903 -5.818 -6.725 1.00 5.93 H new ATOM 0 H2 MET A 1 1.909 -6.239 -5.080 1.00 5.93 H new ATOM 0 H3 MET A 1 3.260 -5.471 -5.765 1.00 5.93 H new ATOM 0 HA MET A 1 2.245 -8.166 -6.441 1.00 5.55 H new ATOM 0 HB2 MET A 1 3.283 -7.048 -8.373 1.00 5.94 H new ATOM 0 HB3 MET A 1 4.699 -6.654 -7.419 1.00 5.94 H new ATOM 0 HG2 MET A 1 5.035 -9.161 -7.075 1.00 6.32 H new ATOM 0 HG3 MET A 1 3.765 -9.419 -8.254 1.00 6.32 H new ATOM 0 HE1 MET A 1 5.254 -7.997 -11.543 1.00 7.48 H new ATOM 0 HE2 MET A 1 3.804 -8.527 -10.658 1.00 7.48 H new ATOM 0 HE3 MET A 1 4.459 -6.893 -10.395 1.00 7.48 H new ATOM 20 N THR A 2 5.046 -7.302 -4.886 1.00 4.95 N ATOM 21 CA THR A 2 5.948 -7.702 -3.825 1.00 4.71 C ATOM 22 C THR A 2 6.593 -6.484 -3.167 1.00 3.87 C ATOM 23 O THR A 2 6.887 -6.508 -1.973 1.00 3.96 O ATOM 24 CB THR A 2 7.036 -8.675 -4.348 1.00 5.39 C ATOM 25 OG1 THR A 2 7.865 -9.121 -3.270 1.00 5.76 O ATOM 26 CG2 THR A 2 7.896 -8.027 -5.428 1.00 5.90 C ATOM 0 H THR A 2 5.336 -6.471 -5.401 1.00 4.95 H new ATOM 0 HA THR A 2 5.358 -8.227 -3.074 1.00 4.71 H new ATOM 0 HB THR A 2 6.526 -9.531 -4.790 1.00 5.39 H new ATOM 0 HG1 THR A 2 8.546 -9.736 -3.614 1.00 5.76 H new ATOM 0 HG21 THR A 2 8.647 -8.739 -5.770 1.00 5.90 H new ATOM 0 HG22 THR A 2 7.266 -7.733 -6.267 1.00 5.90 H new ATOM 0 HG23 THR A 2 8.391 -7.146 -5.019 1.00 5.90 H new ATOM 34 N THR A 3 6.785 -5.416 -3.948 1.00 3.53 N ATOM 35 CA THR A 3 7.409 -4.189 -3.456 1.00 3.16 C ATOM 36 C THR A 3 8.859 -4.437 -3.047 1.00 2.69 C ATOM 37 O THR A 3 9.132 -4.920 -1.950 1.00 3.09 O ATOM 38 CB THR A 3 6.639 -3.596 -2.256 1.00 3.92 C ATOM 39 OG1 THR A 3 5.247 -3.467 -2.580 1.00 4.44 O ATOM 40 CG2 THR A 3 7.200 -2.235 -1.867 1.00 4.35 C ATOM 0 H THR A 3 6.514 -5.380 -4.931 1.00 3.53 H new ATOM 0 HA THR A 3 7.381 -3.473 -4.277 1.00 3.16 H new ATOM 0 HB THR A 3 6.755 -4.274 -1.411 1.00 3.92 H new ATOM 0 HG1 THR A 3 4.766 -3.092 -1.813 1.00 4.44 H new ATOM 0 HG21 THR A 3 6.640 -1.839 -1.020 1.00 4.35 H new ATOM 0 HG22 THR A 3 8.250 -2.339 -1.592 1.00 4.35 H new ATOM 0 HG23 THR A 3 7.113 -1.551 -2.711 1.00 4.35 H new ATOM 48 N GLU A 4 9.785 -4.122 -3.940 1.00 2.34 N ATOM 49 CA GLU A 4 11.199 -4.289 -3.646 1.00 2.09 C ATOM 50 C GLU A 4 11.631 -3.272 -2.595 1.00 1.62 C ATOM 51 O GLU A 4 11.782 -2.083 -2.888 1.00 1.79 O ATOM 52 CB GLU A 4 12.038 -4.142 -4.917 1.00 2.45 C ATOM 53 CG GLU A 4 11.635 -5.104 -6.027 1.00 3.05 C ATOM 54 CD GLU A 4 12.535 -5.005 -7.243 1.00 3.65 C ATOM 55 OE1 GLU A 4 12.598 -3.919 -7.857 1.00 3.66 O ATOM 56 OE2 GLU A 4 13.184 -6.013 -7.590 1.00 4.44 O ATOM 0 H GLU A 4 9.584 -3.751 -4.869 1.00 2.34 H new ATOM 0 HA GLU A 4 11.360 -5.293 -3.253 1.00 2.09 H new ATOM 0 HB2 GLU A 4 11.951 -3.119 -5.284 1.00 2.45 H new ATOM 0 HB3 GLU A 4 13.087 -4.304 -4.671 1.00 2.45 H new ATOM 0 HG2 GLU A 4 11.659 -6.124 -5.644 1.00 3.05 H new ATOM 0 HG3 GLU A 4 10.606 -4.899 -6.324 1.00 3.05 H new ATOM 63 N GLN A 5 11.790 -3.752 -1.366 1.00 1.60 N ATOM 64 CA GLN A 5 12.133 -2.902 -0.234 1.00 1.37 C ATOM 65 C GLN A 5 13.453 -2.184 -0.469 1.00 1.11 C ATOM 66 O GLN A 5 14.445 -2.800 -0.863 1.00 1.32 O ATOM 67 CB GLN A 5 12.232 -3.739 1.048 1.00 1.77 C ATOM 68 CG GLN A 5 10.938 -4.442 1.429 1.00 2.47 C ATOM 69 CD GLN A 5 9.803 -3.477 1.707 1.00 3.35 C ATOM 70 OE1 GLN A 5 10.024 -2.346 2.147 1.00 3.77 O ATOM 71 NE2 GLN A 5 8.580 -3.919 1.459 1.00 4.15 N ATOM 0 H GLN A 5 11.685 -4.738 -1.128 1.00 1.60 H new ATOM 0 HA GLN A 5 11.344 -2.158 -0.125 1.00 1.37 H new ATOM 0 HB2 GLN A 5 13.016 -4.486 0.922 1.00 1.77 H new ATOM 0 HB3 GLN A 5 12.537 -3.091 1.870 1.00 1.77 H new ATOM 0 HG2 GLN A 5 10.646 -5.116 0.624 1.00 2.47 H new ATOM 0 HG3 GLN A 5 11.111 -5.056 2.313 1.00 2.47 H new ATOM 0 HE21 GLN A 5 8.443 -4.862 1.095 1.00 4.15 H new ATOM 0 HE22 GLN A 5 7.775 -3.317 1.632 1.00 4.15 H new ATOM 80 N GLU A 6 13.463 -0.880 -0.238 1.00 1.06 N ATOM 81 CA GLU A 6 14.691 -0.115 -0.329 1.00 1.21 C ATOM 82 C GLU A 6 15.482 -0.272 0.962 1.00 1.08 C ATOM 83 O GLU A 6 15.171 0.353 1.980 1.00 1.33 O ATOM 84 CB GLU A 6 14.405 1.362 -0.599 1.00 1.65 C ATOM 85 CG GLU A 6 15.662 2.161 -0.914 1.00 2.45 C ATOM 86 CD GLU A 6 15.390 3.631 -1.123 1.00 3.07 C ATOM 87 OE1 GLU A 6 14.523 3.969 -1.953 1.00 3.61 O ATOM 88 OE2 GLU A 6 16.057 4.457 -0.470 1.00 3.52 O ATOM 0 H GLU A 6 12.638 -0.335 0.012 1.00 1.06 H new ATOM 0 HA GLU A 6 15.277 -0.497 -1.165 1.00 1.21 H new ATOM 0 HB2 GLU A 6 13.709 1.445 -1.434 1.00 1.65 H new ATOM 0 HB3 GLU A 6 13.913 1.797 0.271 1.00 1.65 H new ATOM 0 HG2 GLU A 6 16.376 2.042 -0.099 1.00 2.45 H new ATOM 0 HG3 GLU A 6 16.130 1.753 -1.810 1.00 2.45 H new ATOM 95 N PHE A 7 16.473 -1.144 0.923 1.00 0.87 N ATOM 96 CA PHE A 7 17.306 -1.417 2.081 1.00 0.77 C ATOM 97 C PHE A 7 18.571 -0.574 2.058 1.00 0.72 C ATOM 98 O PHE A 7 19.200 -0.402 1.014 1.00 0.87 O ATOM 99 CB PHE A 7 17.666 -2.909 2.150 1.00 0.77 C ATOM 100 CG PHE A 7 17.687 -3.602 0.808 1.00 1.61 C ATOM 101 CD1 PHE A 7 18.631 -3.274 -0.155 1.00 2.72 C ATOM 102 CD2 PHE A 7 16.761 -4.594 0.517 1.00 1.82 C ATOM 103 CE1 PHE A 7 18.642 -3.914 -1.383 1.00 3.60 C ATOM 104 CE2 PHE A 7 16.772 -5.235 -0.707 1.00 2.63 C ATOM 105 CZ PHE A 7 17.715 -4.898 -1.655 1.00 3.44 C ATOM 0 H PHE A 7 16.723 -1.681 0.092 1.00 0.87 H new ATOM 0 HA PHE A 7 16.735 -1.152 2.971 1.00 0.77 H new ATOM 0 HB2 PHE A 7 18.646 -3.014 2.616 1.00 0.77 H new ATOM 0 HB3 PHE A 7 16.949 -3.415 2.797 1.00 0.77 H new ATOM 0 HD1 PHE A 7 19.366 -2.511 0.056 1.00 2.72 H new ATOM 0 HD2 PHE A 7 16.023 -4.868 1.256 1.00 1.82 H new ATOM 0 HE1 PHE A 7 19.376 -3.643 -2.127 1.00 3.60 H new ATOM 0 HE2 PHE A 7 16.041 -6.001 -0.921 1.00 2.63 H new ATOM 0 HZ PHE A 7 17.728 -5.404 -2.609 1.00 3.44 H new ATOM 115 N GLU A 8 18.920 -0.034 3.212 1.00 0.72 N ATOM 116 CA GLU A 8 20.166 0.691 3.373 1.00 0.76 C ATOM 117 C GLU A 8 21.299 -0.305 3.595 1.00 0.62 C ATOM 118 O GLU A 8 21.076 -1.400 4.117 1.00 0.61 O ATOM 119 CB GLU A 8 20.056 1.660 4.555 1.00 1.01 C ATOM 120 CG GLU A 8 21.246 2.591 4.710 1.00 1.20 C ATOM 121 CD GLU A 8 21.513 3.394 3.459 1.00 1.97 C ATOM 122 OE1 GLU A 8 20.931 4.491 3.313 1.00 2.22 O ATOM 123 OE2 GLU A 8 22.299 2.935 2.611 1.00 2.71 O ATOM 0 H GLU A 8 18.352 -0.085 4.058 1.00 0.72 H new ATOM 0 HA GLU A 8 20.375 1.271 2.474 1.00 0.76 H new ATOM 0 HB2 GLU A 8 19.153 2.259 4.436 1.00 1.01 H new ATOM 0 HB3 GLU A 8 19.938 1.084 5.473 1.00 1.01 H new ATOM 0 HG2 GLU A 8 21.067 3.270 5.544 1.00 1.20 H new ATOM 0 HG3 GLU A 8 22.132 2.007 4.960 1.00 1.20 H new ATOM 130 N LYS A 9 22.505 0.068 3.196 1.00 0.60 N ATOM 131 CA LYS A 9 23.643 -0.830 3.306 1.00 0.53 C ATOM 132 C LYS A 9 24.437 -0.521 4.561 1.00 0.50 C ATOM 133 O LYS A 9 24.545 0.636 4.970 1.00 0.56 O ATOM 134 CB LYS A 9 24.593 -0.718 2.101 1.00 0.63 C ATOM 135 CG LYS A 9 23.927 -0.813 0.731 1.00 0.72 C ATOM 136 CD LYS A 9 23.274 0.506 0.321 1.00 0.95 C ATOM 137 CE LYS A 9 24.242 1.685 0.420 1.00 1.49 C ATOM 138 NZ LYS A 9 25.411 1.544 -0.485 1.00 1.88 N ATOM 0 H LYS A 9 22.720 0.981 2.795 1.00 0.60 H new ATOM 0 HA LYS A 9 23.238 -1.841 3.342 1.00 0.53 H new ATOM 0 HB2 LYS A 9 25.122 0.233 2.164 1.00 0.63 H new ATOM 0 HB3 LYS A 9 25.343 -1.505 2.177 1.00 0.63 H new ATOM 0 HG2 LYS A 9 24.670 -1.097 -0.014 1.00 0.72 H new ATOM 0 HG3 LYS A 9 23.174 -1.601 0.747 1.00 0.72 H new ATOM 0 HD2 LYS A 9 22.906 0.425 -0.702 1.00 0.95 H new ATOM 0 HD3 LYS A 9 22.409 0.694 0.957 1.00 0.95 H new ATOM 0 HE2 LYS A 9 23.711 2.607 0.181 1.00 1.49 H new ATOM 0 HE3 LYS A 9 24.592 1.777 1.448 1.00 1.49 H new ATOM 0 HZ1 LYS A 9 26.288 1.572 0.074 1.00 1.88 H new ATOM 0 HZ2 LYS A 9 25.351 0.637 -0.990 1.00 1.88 H new ATOM 0 HZ3 LYS A 9 25.414 2.324 -1.173 1.00 1.88 H new ATOM 152 N VAL A 10 24.996 -1.554 5.163 1.00 0.46 N ATOM 153 CA VAL A 10 25.935 -1.370 6.249 1.00 0.46 C ATOM 154 C VAL A 10 27.332 -1.571 5.698 1.00 0.48 C ATOM 155 O VAL A 10 27.759 -2.699 5.434 1.00 0.54 O ATOM 156 CB VAL A 10 25.681 -2.356 7.411 1.00 0.51 C ATOM 157 CG1 VAL A 10 26.557 -2.005 8.600 1.00 0.54 C ATOM 158 CG2 VAL A 10 24.212 -2.350 7.810 1.00 0.59 C ATOM 0 H VAL A 10 24.815 -2.527 4.917 1.00 0.46 H new ATOM 0 HA VAL A 10 25.813 -0.365 6.654 1.00 0.46 H new ATOM 0 HB VAL A 10 25.938 -3.360 7.074 1.00 0.51 H new ATOM 0 HG11 VAL A 10 26.368 -2.708 9.411 1.00 0.54 H new ATOM 0 HG12 VAL A 10 27.606 -2.061 8.308 1.00 0.54 H new ATOM 0 HG13 VAL A 10 26.327 -0.994 8.935 1.00 0.54 H new ATOM 0 HG21 VAL A 10 24.055 -3.051 8.630 1.00 0.59 H new ATOM 0 HG22 VAL A 10 23.926 -1.348 8.130 1.00 0.59 H new ATOM 0 HG23 VAL A 10 23.602 -2.647 6.957 1.00 0.59 H new ATOM 168 N GLU A 11 28.029 -0.470 5.495 1.00 0.53 N ATOM 169 CA GLU A 11 29.310 -0.496 4.827 1.00 0.63 C ATOM 170 C GLU A 11 30.441 -0.377 5.834 1.00 0.55 C ATOM 171 O GLU A 11 30.511 0.595 6.592 1.00 0.59 O ATOM 172 CB GLU A 11 29.367 0.618 3.778 1.00 0.88 C ATOM 173 CG GLU A 11 28.291 0.470 2.710 1.00 1.37 C ATOM 174 CD GLU A 11 28.380 1.513 1.619 1.00 1.72 C ATOM 175 OE1 GLU A 11 29.365 1.495 0.849 1.00 2.02 O ATOM 176 OE2 GLU A 11 27.480 2.370 1.537 1.00 2.16 O ATOM 0 H GLU A 11 27.724 0.459 5.787 1.00 0.53 H new ATOM 0 HA GLU A 11 29.431 -1.451 4.317 1.00 0.63 H new ATOM 0 HB2 GLU A 11 29.254 1.583 4.271 1.00 0.88 H new ATOM 0 HB3 GLU A 11 30.348 0.616 3.303 1.00 0.88 H new ATOM 0 HG2 GLU A 11 28.368 -0.521 2.262 1.00 1.37 H new ATOM 0 HG3 GLU A 11 27.310 0.531 3.182 1.00 1.37 H new ATOM 183 N LEU A 12 31.303 -1.393 5.843 1.00 0.52 N ATOM 184 CA LEU A 12 32.412 -1.482 6.786 1.00 0.51 C ATOM 185 C LEU A 12 31.863 -1.640 8.203 1.00 0.52 C ATOM 186 O LEU A 12 32.231 -0.905 9.118 1.00 0.61 O ATOM 187 CB LEU A 12 33.329 -0.251 6.685 1.00 0.57 C ATOM 188 CG LEU A 12 34.669 -0.368 7.418 1.00 0.88 C ATOM 189 CD1 LEU A 12 35.497 -1.498 6.826 1.00 1.35 C ATOM 190 CD2 LEU A 12 35.433 0.945 7.346 1.00 1.45 C ATOM 0 H LEU A 12 31.250 -2.178 5.194 1.00 0.52 H new ATOM 0 HA LEU A 12 33.015 -2.355 6.538 1.00 0.51 H new ATOM 0 HB2 LEU A 12 33.527 -0.052 5.632 1.00 0.57 H new ATOM 0 HB3 LEU A 12 32.793 0.613 7.078 1.00 0.57 H new ATOM 0 HG LEU A 12 34.472 -0.593 8.466 1.00 0.88 H new ATOM 0 HD11 LEU A 12 36.447 -1.570 7.356 1.00 1.35 H new ATOM 0 HD12 LEU A 12 34.954 -2.438 6.925 1.00 1.35 H new ATOM 0 HD13 LEU A 12 35.685 -1.297 5.771 1.00 1.35 H new ATOM 0 HD21 LEU A 12 36.382 0.843 7.872 1.00 1.45 H new ATOM 0 HD22 LEU A 12 35.622 1.199 6.303 1.00 1.45 H new ATOM 0 HD23 LEU A 12 34.843 1.735 7.811 1.00 1.45 H new ATOM 202 N THR A 13 30.962 -2.604 8.363 1.00 0.50 N ATOM 203 CA THR A 13 30.319 -2.856 9.644 1.00 0.56 C ATOM 204 C THR A 13 31.331 -3.283 10.708 1.00 0.53 C ATOM 205 O THR A 13 32.426 -3.757 10.395 1.00 0.50 O ATOM 206 CB THR A 13 29.213 -3.930 9.518 1.00 0.68 C ATOM 207 OG1 THR A 13 28.549 -4.104 10.775 1.00 0.78 O ATOM 208 CG2 THR A 13 29.783 -5.263 9.057 1.00 0.69 C ATOM 0 H THR A 13 30.660 -3.227 7.614 1.00 0.50 H new ATOM 0 HA THR A 13 29.863 -1.917 9.956 1.00 0.56 H new ATOM 0 HB THR A 13 28.499 -3.584 8.770 1.00 0.68 H new ATOM 0 HG1 THR A 13 28.239 -5.030 10.856 1.00 0.78 H new ATOM 0 HG21 THR A 13 28.979 -5.995 8.979 1.00 0.69 H new ATOM 0 HG22 THR A 13 30.257 -5.139 8.083 1.00 0.69 H new ATOM 0 HG23 THR A 13 30.522 -5.612 9.778 1.00 0.69 H new ATOM 216 N ALA A 14 30.943 -3.127 11.968 1.00 0.61 N ATOM 217 CA ALA A 14 31.804 -3.456 13.099 1.00 0.66 C ATOM 218 C ALA A 14 31.928 -4.966 13.285 1.00 0.69 C ATOM 219 O ALA A 14 32.587 -5.438 14.212 1.00 0.79 O ATOM 220 CB ALA A 14 31.264 -2.814 14.364 1.00 0.81 C ATOM 0 H ALA A 14 30.026 -2.770 12.235 1.00 0.61 H new ATOM 0 HA ALA A 14 32.800 -3.064 12.892 1.00 0.66 H new ATOM 0 HB1 ALA A 14 31.912 -3.064 15.204 1.00 0.81 H new ATOM 0 HB2 ALA A 14 31.234 -1.732 14.238 1.00 0.81 H new ATOM 0 HB3 ALA A 14 30.258 -3.185 14.559 1.00 0.81 H new ATOM 226 N ASP A 15 31.295 -5.718 12.397 1.00 0.71 N ATOM 227 CA ASP A 15 31.292 -7.172 12.486 1.00 0.85 C ATOM 228 C ASP A 15 32.551 -7.771 11.859 1.00 0.74 C ATOM 229 O ASP A 15 32.671 -8.988 11.749 1.00 0.86 O ATOM 230 CB ASP A 15 30.055 -7.754 11.793 1.00 1.08 C ATOM 231 CG ASP A 15 28.752 -7.157 12.294 1.00 1.69 C ATOM 232 OD1 ASP A 15 28.471 -7.251 13.506 1.00 1.87 O ATOM 233 OD2 ASP A 15 28.010 -6.573 11.469 1.00 2.40 O ATOM 0 H ASP A 15 30.775 -5.344 11.603 1.00 0.71 H new ATOM 0 HA ASP A 15 31.271 -7.432 13.544 1.00 0.85 H new ATOM 0 HB2 ASP A 15 30.135 -7.585 10.719 1.00 1.08 H new ATOM 0 HB3 ASP A 15 30.035 -8.833 11.946 1.00 1.08 H new ATOM 238 N GLY A 16 33.508 -6.921 11.486 1.00 0.64 N ATOM 239 CA GLY A 16 34.703 -7.407 10.814 1.00 0.68 C ATOM 240 C GLY A 16 34.947 -6.756 9.462 1.00 0.57 C ATOM 241 O GLY A 16 35.631 -7.328 8.616 1.00 0.63 O ATOM 0 H GLY A 16 33.478 -5.913 11.636 1.00 0.64 H new ATOM 0 HA2 GLY A 16 35.567 -7.231 11.454 1.00 0.68 H new ATOM 0 HA3 GLY A 16 34.621 -8.486 10.679 1.00 0.68 H new ATOM 245 N GLY A 17 34.381 -5.567 9.263 1.00 0.54 N ATOM 246 CA GLY A 17 34.691 -4.770 8.086 1.00 0.52 C ATOM 247 C GLY A 17 34.209 -5.378 6.782 1.00 0.46 C ATOM 248 O GLY A 17 35.017 -5.686 5.908 1.00 0.61 O ATOM 0 H GLY A 17 33.709 -5.139 9.900 1.00 0.54 H new ATOM 0 HA2 GLY A 17 34.244 -3.782 8.201 1.00 0.52 H new ATOM 0 HA3 GLY A 17 35.770 -4.627 8.031 1.00 0.52 H new ATOM 252 N VAL A 18 32.901 -5.536 6.637 1.00 0.36 N ATOM 253 CA VAL A 18 32.325 -6.060 5.401 1.00 0.34 C ATOM 254 C VAL A 18 31.075 -5.264 5.021 1.00 0.32 C ATOM 255 O VAL A 18 30.428 -4.675 5.889 1.00 0.36 O ATOM 256 CB VAL A 18 31.994 -7.573 5.535 1.00 0.40 C ATOM 257 CG1 VAL A 18 31.097 -8.068 4.406 1.00 0.47 C ATOM 258 CG2 VAL A 18 33.273 -8.390 5.558 1.00 0.49 C ATOM 0 H VAL A 18 32.216 -5.310 7.358 1.00 0.36 H new ATOM 0 HA VAL A 18 33.063 -5.951 4.607 1.00 0.34 H new ATOM 0 HB VAL A 18 31.454 -7.701 6.473 1.00 0.40 H new ATOM 0 HG11 VAL A 18 30.893 -9.130 4.542 1.00 0.47 H new ATOM 0 HG12 VAL A 18 30.158 -7.514 4.417 1.00 0.47 H new ATOM 0 HG13 VAL A 18 31.597 -7.914 3.450 1.00 0.47 H new ATOM 0 HG21 VAL A 18 33.027 -9.448 5.652 1.00 0.49 H new ATOM 0 HG22 VAL A 18 33.826 -8.227 4.633 1.00 0.49 H new ATOM 0 HG23 VAL A 18 33.886 -8.083 6.406 1.00 0.49 H new ATOM 268 N ILE A 19 30.765 -5.214 3.728 1.00 0.31 N ATOM 269 CA ILE A 19 29.561 -4.550 3.249 1.00 0.31 C ATOM 270 C ILE A 19 28.385 -5.518 3.318 1.00 0.30 C ATOM 271 O ILE A 19 28.313 -6.478 2.551 1.00 0.30 O ATOM 272 CB ILE A 19 29.721 -4.075 1.788 1.00 0.34 C ATOM 273 CG1 ILE A 19 31.073 -3.390 1.574 1.00 0.41 C ATOM 274 CG2 ILE A 19 28.586 -3.137 1.412 1.00 0.36 C ATOM 275 CD1 ILE A 19 31.267 -2.132 2.385 1.00 0.47 C ATOM 0 H ILE A 19 31.336 -5.629 2.991 1.00 0.31 H new ATOM 0 HA ILE A 19 29.384 -3.681 3.883 1.00 0.31 H new ATOM 0 HB ILE A 19 29.683 -4.952 1.141 1.00 0.34 H new ATOM 0 HG12 ILE A 19 31.867 -4.094 1.822 1.00 0.41 H new ATOM 0 HG13 ILE A 19 31.181 -3.147 0.517 1.00 0.41 H new ATOM 0 HG21 ILE A 19 28.711 -2.810 0.380 1.00 0.36 H new ATOM 0 HG22 ILE A 19 27.634 -3.658 1.515 1.00 0.36 H new ATOM 0 HG23 ILE A 19 28.597 -2.269 2.072 1.00 0.36 H new ATOM 0 HD11 ILE A 19 32.250 -1.711 2.174 1.00 0.47 H new ATOM 0 HD12 ILE A 19 30.497 -1.407 2.121 1.00 0.47 H new ATOM 0 HD13 ILE A 19 31.194 -2.369 3.447 1.00 0.47 H new ATOM 287 N LYS A 20 27.469 -5.264 4.235 1.00 0.33 N ATOM 288 CA LYS A 20 26.355 -6.171 4.471 1.00 0.37 C ATOM 289 C LYS A 20 25.025 -5.471 4.204 1.00 0.33 C ATOM 290 O LYS A 20 24.793 -4.358 4.675 1.00 0.37 O ATOM 291 CB LYS A 20 26.425 -6.714 5.909 1.00 0.53 C ATOM 292 CG LYS A 20 25.207 -7.512 6.355 1.00 0.59 C ATOM 293 CD LYS A 20 25.425 -8.143 7.727 1.00 0.76 C ATOM 294 CE LYS A 20 25.872 -7.116 8.762 1.00 0.83 C ATOM 295 NZ LYS A 20 25.931 -7.688 10.136 1.00 1.34 N ATOM 0 H LYS A 20 27.473 -4.436 4.831 1.00 0.33 H new ATOM 0 HA LYS A 20 26.425 -7.012 3.781 1.00 0.37 H new ATOM 0 HB2 LYS A 20 27.308 -7.346 6.000 1.00 0.53 H new ATOM 0 HB3 LYS A 20 26.561 -5.875 6.592 1.00 0.53 H new ATOM 0 HG2 LYS A 20 24.335 -6.859 6.388 1.00 0.59 H new ATOM 0 HG3 LYS A 20 24.994 -8.292 5.624 1.00 0.59 H new ATOM 0 HD2 LYS A 20 24.501 -8.615 8.060 1.00 0.76 H new ATOM 0 HD3 LYS A 20 26.175 -8.930 7.649 1.00 0.76 H new ATOM 0 HE2 LYS A 20 26.854 -6.731 8.488 1.00 0.83 H new ATOM 0 HE3 LYS A 20 25.184 -6.270 8.752 1.00 0.83 H new ATOM 0 HZ1 LYS A 20 26.619 -7.155 10.705 1.00 1.34 H new ATOM 0 HZ2 LYS A 20 24.992 -7.625 10.579 1.00 1.34 H new ATOM 0 HZ3 LYS A 20 26.223 -8.685 10.085 1.00 1.34 H new ATOM 309 N THR A 21 24.172 -6.118 3.421 1.00 0.34 N ATOM 310 CA THR A 21 22.868 -5.570 3.084 1.00 0.36 C ATOM 311 C THR A 21 21.754 -6.365 3.768 1.00 0.36 C ATOM 312 O THR A 21 21.585 -7.561 3.518 1.00 0.40 O ATOM 313 CB THR A 21 22.652 -5.579 1.561 1.00 0.44 C ATOM 314 OG1 THR A 21 23.763 -4.937 0.911 1.00 0.49 O ATOM 315 CG2 THR A 21 21.365 -4.865 1.187 1.00 0.50 C ATOM 0 H THR A 21 24.363 -7.030 3.005 1.00 0.34 H new ATOM 0 HA THR A 21 22.836 -4.540 3.439 1.00 0.36 H new ATOM 0 HB THR A 21 22.579 -6.616 1.233 1.00 0.44 H new ATOM 0 HG1 THR A 21 23.517 -4.018 0.675 1.00 0.49 H new ATOM 0 HG21 THR A 21 21.238 -4.887 0.105 1.00 0.50 H new ATOM 0 HG22 THR A 21 20.521 -5.365 1.662 1.00 0.50 H new ATOM 0 HG23 THR A 21 21.411 -3.830 1.526 1.00 0.50 H new ATOM 323 N ILE A 22 21.006 -5.692 4.633 1.00 0.40 N ATOM 324 CA ILE A 22 19.945 -6.326 5.409 1.00 0.43 C ATOM 325 C ILE A 22 18.715 -6.613 4.542 1.00 0.44 C ATOM 326 O ILE A 22 18.254 -5.752 3.794 1.00 0.55 O ATOM 327 CB ILE A 22 19.549 -5.432 6.613 1.00 0.56 C ATOM 328 CG1 ILE A 22 18.404 -6.055 7.415 1.00 0.63 C ATOM 329 CG2 ILE A 22 19.178 -4.026 6.157 1.00 0.67 C ATOM 330 CD1 ILE A 22 18.791 -7.315 8.158 1.00 0.66 C ATOM 0 H ILE A 22 21.116 -4.695 4.817 1.00 0.40 H new ATOM 0 HA ILE A 22 20.327 -7.277 5.780 1.00 0.43 H new ATOM 0 HB ILE A 22 20.420 -5.360 7.265 1.00 0.56 H new ATOM 0 HG12 ILE A 22 18.034 -5.322 8.131 1.00 0.63 H new ATOM 0 HG13 ILE A 22 17.581 -6.283 6.738 1.00 0.63 H new ATOM 0 HG21 ILE A 22 18.905 -3.423 7.023 1.00 0.67 H new ATOM 0 HG22 ILE A 22 20.030 -3.571 5.652 1.00 0.67 H new ATOM 0 HG23 ILE A 22 18.333 -4.077 5.470 1.00 0.67 H new ATOM 0 HD11 ILE A 22 17.927 -7.696 8.702 1.00 0.66 H new ATOM 0 HD12 ILE A 22 19.133 -8.067 7.446 1.00 0.66 H new ATOM 0 HD13 ILE A 22 19.593 -7.091 8.862 1.00 0.66 H new ATOM 342 N LEU A 23 18.203 -7.837 4.635 1.00 0.41 N ATOM 343 CA LEU A 23 17.012 -8.230 3.887 1.00 0.47 C ATOM 344 C LEU A 23 15.890 -8.681 4.823 1.00 0.50 C ATOM 345 O LEU A 23 14.992 -7.902 5.144 1.00 0.67 O ATOM 346 CB LEU A 23 17.337 -9.346 2.886 1.00 0.54 C ATOM 347 CG LEU A 23 17.515 -8.906 1.431 1.00 0.53 C ATOM 348 CD1 LEU A 23 16.215 -8.332 0.889 1.00 0.83 C ATOM 349 CD2 LEU A 23 18.649 -7.902 1.298 1.00 0.64 C ATOM 0 H LEU A 23 18.594 -8.574 5.221 1.00 0.41 H new ATOM 0 HA LEU A 23 16.670 -7.353 3.338 1.00 0.47 H new ATOM 0 HB2 LEU A 23 18.251 -9.843 3.210 1.00 0.54 H new ATOM 0 HB3 LEU A 23 16.539 -10.088 2.926 1.00 0.54 H new ATOM 0 HG LEU A 23 17.778 -9.782 0.839 1.00 0.53 H new ATOM 0 HD11 LEU A 23 16.357 -8.023 -0.147 1.00 0.83 H new ATOM 0 HD12 LEU A 23 15.434 -9.091 0.938 1.00 0.83 H new ATOM 0 HD13 LEU A 23 15.921 -7.470 1.487 1.00 0.83 H new ATOM 0 HD21 LEU A 23 18.753 -7.607 0.254 1.00 0.64 H new ATOM 0 HD22 LEU A 23 18.429 -7.023 1.904 1.00 0.64 H new ATOM 0 HD23 LEU A 23 19.579 -8.356 1.641 1.00 0.64 H new ATOM 361 N LYS A 24 15.952 -9.934 5.271 1.00 0.49 N ATOM 362 CA LYS A 24 14.915 -10.479 6.138 1.00 0.60 C ATOM 363 C LYS A 24 15.256 -10.219 7.596 1.00 0.60 C ATOM 364 O LYS A 24 16.391 -10.425 8.027 1.00 0.76 O ATOM 365 CB LYS A 24 14.735 -11.983 5.908 1.00 0.78 C ATOM 366 CG LYS A 24 13.539 -12.561 6.654 1.00 1.05 C ATOM 367 CD LYS A 24 13.515 -14.083 6.626 1.00 1.11 C ATOM 368 CE LYS A 24 13.385 -14.634 5.214 1.00 1.12 C ATOM 369 NZ LYS A 24 13.294 -16.122 5.211 1.00 1.56 N ATOM 0 H LYS A 24 16.705 -10.585 5.048 1.00 0.49 H new ATOM 0 HA LYS A 24 13.978 -9.979 5.893 1.00 0.60 H new ATOM 0 HB2 LYS A 24 14.615 -12.170 4.841 1.00 0.78 H new ATOM 0 HB3 LYS A 24 15.639 -12.504 6.223 1.00 0.78 H new ATOM 0 HG2 LYS A 24 13.561 -12.220 7.689 1.00 1.05 H new ATOM 0 HG3 LYS A 24 12.619 -12.178 6.212 1.00 1.05 H new ATOM 0 HD2 LYS A 24 14.428 -14.467 7.080 1.00 1.11 H new ATOM 0 HD3 LYS A 24 12.683 -14.442 7.231 1.00 1.11 H new ATOM 0 HE2 LYS A 24 12.498 -14.214 4.739 1.00 1.12 H new ATOM 0 HE3 LYS A 24 14.243 -14.320 4.620 1.00 1.12 H new ATOM 0 HZ1 LYS A 24 13.206 -16.462 4.232 1.00 1.56 H new ATOM 0 HZ2 LYS A 24 14.151 -16.523 5.642 1.00 1.56 H new ATOM 0 HZ3 LYS A 24 12.461 -16.420 5.757 1.00 1.56 H new ATOM 383 N LYS A 25 14.266 -9.763 8.346 1.00 0.61 N ATOM 384 CA LYS A 25 14.436 -9.477 9.758 1.00 0.64 C ATOM 385 C LYS A 25 13.649 -10.474 10.600 1.00 0.72 C ATOM 386 O LYS A 25 12.415 -10.501 10.552 1.00 0.90 O ATOM 387 CB LYS A 25 13.958 -8.057 10.062 1.00 0.76 C ATOM 388 CG LYS A 25 14.719 -6.983 9.305 1.00 1.52 C ATOM 389 CD LYS A 25 13.990 -5.649 9.346 1.00 1.72 C ATOM 390 CE LYS A 25 12.668 -5.725 8.597 1.00 2.60 C ATOM 391 NZ LYS A 25 11.906 -4.452 8.665 1.00 2.95 N ATOM 0 H LYS A 25 13.326 -9.582 7.993 1.00 0.61 H new ATOM 0 HA LYS A 25 15.494 -9.564 10.006 1.00 0.64 H new ATOM 0 HB2 LYS A 25 12.898 -7.980 9.818 1.00 0.76 H new ATOM 0 HB3 LYS A 25 14.053 -7.872 11.132 1.00 0.76 H new ATOM 0 HG2 LYS A 25 15.714 -6.869 9.736 1.00 1.52 H new ATOM 0 HG3 LYS A 25 14.854 -7.293 8.269 1.00 1.52 H new ATOM 0 HD2 LYS A 25 13.809 -5.362 10.382 1.00 1.72 H new ATOM 0 HD3 LYS A 25 14.617 -4.874 8.905 1.00 1.72 H new ATOM 0 HE2 LYS A 25 12.858 -5.976 7.554 1.00 2.60 H new ATOM 0 HE3 LYS A 25 12.063 -6.530 9.014 1.00 2.60 H new ATOM 0 HZ1 LYS A 25 11.014 -4.553 8.141 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 11.700 -4.223 9.658 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 12.470 -3.687 8.244 1.00 2.95 H new ATOM 405 N GLY A 26 14.362 -11.308 11.344 1.00 0.69 N ATOM 406 CA GLY A 26 13.725 -12.221 12.266 1.00 0.85 C ATOM 407 C GLY A 26 13.195 -11.505 13.497 1.00 0.88 C ATOM 408 O GLY A 26 12.856 -10.319 13.440 1.00 1.32 O ATOM 0 H GLY A 26 15.380 -11.367 11.323 1.00 0.69 H new ATOM 0 HA2 GLY A 26 12.905 -12.732 11.762 1.00 0.85 H new ATOM 0 HA3 GLY A 26 14.439 -12.986 12.570 1.00 0.85 H new ATOM 412 N ASP A 27 13.125 -12.204 14.620 1.00 0.84 N ATOM 413 CA ASP A 27 12.637 -11.581 15.843 1.00 1.01 C ATOM 414 C ASP A 27 13.497 -11.953 17.049 1.00 0.93 C ATOM 415 O ASP A 27 14.558 -11.363 17.263 1.00 1.24 O ATOM 416 CB ASP A 27 11.165 -11.933 16.089 1.00 1.33 C ATOM 417 CG ASP A 27 10.583 -11.170 17.259 1.00 2.08 C ATOM 418 OD1 ASP A 27 10.564 -9.925 17.208 1.00 2.38 O ATOM 419 OD2 ASP A 27 10.117 -11.818 18.222 1.00 2.77 O ATOM 0 H ASP A 27 13.394 -13.184 14.711 1.00 0.84 H new ATOM 0 HA ASP A 27 12.711 -10.502 15.711 1.00 1.01 H new ATOM 0 HB2 ASP A 27 10.586 -11.715 15.191 1.00 1.33 H new ATOM 0 HB3 ASP A 27 11.075 -13.003 16.275 1.00 1.33 H new ATOM 424 N GLU A 28 13.067 -12.944 17.817 1.00 0.91 N ATOM 425 CA GLU A 28 13.777 -13.313 19.034 1.00 0.91 C ATOM 426 C GLU A 28 14.825 -14.384 18.750 1.00 0.96 C ATOM 427 O GLU A 28 14.536 -15.427 18.154 1.00 1.22 O ATOM 428 CB GLU A 28 12.793 -13.770 20.121 1.00 1.11 C ATOM 429 CG GLU A 28 11.921 -14.955 19.734 1.00 1.59 C ATOM 430 CD GLU A 28 10.923 -15.312 20.817 1.00 2.09 C ATOM 431 OE1 GLU A 28 11.353 -15.739 21.916 1.00 2.56 O ATOM 432 OE2 GLU A 28 9.704 -15.185 20.573 1.00 2.64 O ATOM 0 H GLU A 28 12.237 -13.503 17.622 1.00 0.91 H new ATOM 0 HA GLU A 28 14.298 -12.431 19.405 1.00 0.91 H new ATOM 0 HB2 GLU A 28 13.357 -14.029 21.017 1.00 1.11 H new ATOM 0 HB3 GLU A 28 12.147 -12.932 20.383 1.00 1.11 H new ATOM 0 HG2 GLU A 28 11.387 -14.725 18.812 1.00 1.59 H new ATOM 0 HG3 GLU A 28 12.555 -15.818 19.528 1.00 1.59 H new ATOM 439 N GLY A 29 16.057 -14.113 19.152 1.00 0.88 N ATOM 440 CA GLY A 29 17.135 -15.039 18.893 1.00 1.04 C ATOM 441 C GLY A 29 18.095 -15.153 20.055 1.00 0.79 C ATOM 442 O GLY A 29 19.308 -15.084 19.869 1.00 0.90 O ATOM 0 H GLY A 29 16.328 -13.267 19.653 1.00 0.88 H new ATOM 0 HA2 GLY A 29 16.719 -16.022 18.672 1.00 1.04 H new ATOM 0 HA3 GLY A 29 17.681 -14.717 18.006 1.00 1.04 H new ATOM 446 N GLU A 30 17.550 -15.324 21.255 1.00 0.73 N ATOM 447 CA GLU A 30 18.363 -15.499 22.457 1.00 0.80 C ATOM 448 C GLU A 30 19.188 -16.779 22.346 1.00 0.78 C ATOM 449 O GLU A 30 20.370 -16.816 22.682 1.00 0.96 O ATOM 450 CB GLU A 30 17.456 -15.587 23.687 1.00 1.08 C ATOM 451 CG GLU A 30 18.170 -15.347 25.004 1.00 1.35 C ATOM 452 CD GLU A 30 18.362 -13.874 25.296 1.00 1.68 C ATOM 453 OE1 GLU A 30 19.396 -13.315 24.876 1.00 2.29 O ATOM 454 OE2 GLU A 30 17.487 -13.269 25.946 1.00 1.89 O ATOM 0 H GLU A 30 16.544 -15.345 21.423 1.00 0.73 H new ATOM 0 HA GLU A 30 19.033 -14.645 22.558 1.00 0.80 H new ATOM 0 HB2 GLU A 30 16.652 -14.858 23.584 1.00 1.08 H new ATOM 0 HB3 GLU A 30 16.992 -16.573 23.713 1.00 1.08 H new ATOM 0 HG2 GLU A 30 17.599 -15.803 25.812 1.00 1.35 H new ATOM 0 HG3 GLU A 30 19.142 -15.840 24.982 1.00 1.35 H new ATOM 461 N GLU A 31 18.539 -17.822 21.846 1.00 0.76 N ATOM 462 CA GLU A 31 19.163 -19.126 21.689 1.00 0.86 C ATOM 463 C GLU A 31 19.248 -19.473 20.201 1.00 0.78 C ATOM 464 O GLU A 31 19.200 -20.636 19.810 1.00 1.11 O ATOM 465 CB GLU A 31 18.348 -20.181 22.445 1.00 1.09 C ATOM 466 CG GLU A 31 19.092 -21.484 22.677 1.00 1.56 C ATOM 467 CD GLU A 31 18.235 -22.532 23.352 1.00 2.17 C ATOM 468 OE1 GLU A 31 17.458 -23.213 22.650 1.00 2.64 O ATOM 469 OE2 GLU A 31 18.337 -22.679 24.587 1.00 2.54 O ATOM 0 H GLU A 31 17.567 -17.787 21.539 1.00 0.76 H new ATOM 0 HA GLU A 31 20.171 -19.106 22.102 1.00 0.86 H new ATOM 0 HB2 GLU A 31 18.045 -19.770 23.408 1.00 1.09 H new ATOM 0 HB3 GLU A 31 17.435 -20.390 21.887 1.00 1.09 H new ATOM 0 HG2 GLU A 31 19.447 -21.871 21.722 1.00 1.56 H new ATOM 0 HG3 GLU A 31 19.973 -21.291 23.289 1.00 1.56 H new ATOM 476 N ASN A 32 19.329 -18.444 19.368 1.00 0.51 N ATOM 477 CA ASN A 32 19.398 -18.627 17.919 1.00 0.55 C ATOM 478 C ASN A 32 20.457 -17.720 17.307 1.00 0.49 C ATOM 479 O ASN A 32 20.120 -16.696 16.707 1.00 0.57 O ATOM 480 CB ASN A 32 18.047 -18.304 17.271 1.00 0.71 C ATOM 481 CG ASN A 32 17.142 -19.505 17.069 1.00 0.95 C ATOM 482 OD1 ASN A 32 16.308 -19.505 16.166 1.00 1.45 O ATOM 483 ND2 ASN A 32 17.295 -20.531 17.888 1.00 1.19 N ATOM 0 H ASN A 32 19.349 -17.470 19.669 1.00 0.51 H new ATOM 0 HA ASN A 32 19.659 -19.669 17.733 1.00 0.55 H new ATOM 0 HB2 ASN A 32 17.527 -17.573 17.890 1.00 0.71 H new ATOM 0 HB3 ASN A 32 18.225 -17.833 16.304 1.00 0.71 H new ATOM 0 HD21 ASN A 32 16.710 -21.360 17.782 1.00 1.19 H new ATOM 0 HD22 ASN A 32 17.998 -20.494 18.626 1.00 1.19 H new ATOM 490 N ILE A 33 21.725 -18.096 17.454 1.00 0.47 N ATOM 491 CA ILE A 33 22.834 -17.317 16.898 1.00 0.51 C ATOM 492 C ILE A 33 23.938 -18.232 16.351 1.00 0.44 C ATOM 493 O ILE A 33 24.548 -19.000 17.099 1.00 0.47 O ATOM 494 CB ILE A 33 23.450 -16.364 17.955 1.00 0.66 C ATOM 495 CG1 ILE A 33 22.457 -15.274 18.367 1.00 0.74 C ATOM 496 CG2 ILE A 33 24.731 -15.728 17.433 1.00 0.76 C ATOM 497 CD1 ILE A 33 22.116 -14.302 17.252 1.00 0.81 C ATOM 0 H ILE A 33 22.013 -18.937 17.954 1.00 0.47 H new ATOM 0 HA ILE A 33 22.418 -16.724 16.084 1.00 0.51 H new ATOM 0 HB ILE A 33 23.688 -16.963 18.834 1.00 0.66 H new ATOM 0 HG12 ILE A 33 21.539 -15.746 18.718 1.00 0.74 H new ATOM 0 HG13 ILE A 33 22.871 -14.717 19.208 1.00 0.74 H new ATOM 0 HG21 ILE A 33 25.143 -15.064 18.193 1.00 0.76 H new ATOM 0 HG22 ILE A 33 25.456 -16.508 17.200 1.00 0.76 H new ATOM 0 HG23 ILE A 33 24.512 -15.156 16.531 1.00 0.76 H new ATOM 0 HD11 ILE A 33 21.408 -13.560 17.620 1.00 0.81 H new ATOM 0 HD12 ILE A 33 23.024 -13.801 16.915 1.00 0.81 H new ATOM 0 HD13 ILE A 33 21.671 -14.846 16.419 1.00 0.81 H new ATOM 509 N PRO A 34 24.186 -18.180 15.033 1.00 0.46 N ATOM 510 CA PRO A 34 25.332 -18.855 14.405 1.00 0.44 C ATOM 511 C PRO A 34 26.654 -18.283 14.916 1.00 0.52 C ATOM 512 O PRO A 34 26.791 -17.070 15.073 1.00 0.75 O ATOM 513 CB PRO A 34 25.162 -18.550 12.915 1.00 0.51 C ATOM 514 CG PRO A 34 24.281 -17.350 12.866 1.00 0.54 C ATOM 515 CD PRO A 34 23.372 -17.458 14.054 1.00 0.62 C ATOM 0 HA PRO A 34 25.358 -19.922 14.624 1.00 0.44 H new ATOM 0 HB2 PRO A 34 26.123 -18.354 12.440 1.00 0.51 H new ATOM 0 HB3 PRO A 34 24.712 -19.392 12.388 1.00 0.51 H new ATOM 0 HG2 PRO A 34 24.868 -16.433 12.906 1.00 0.54 H new ATOM 0 HG3 PRO A 34 23.710 -17.323 11.938 1.00 0.54 H new ATOM 0 HD2 PRO A 34 23.074 -16.477 14.423 1.00 0.62 H new ATOM 0 HD3 PRO A 34 22.457 -17.999 13.813 1.00 0.62 H new ATOM 523 N LYS A 35 27.629 -19.144 15.174 1.00 0.49 N ATOM 524 CA LYS A 35 28.876 -18.702 15.781 1.00 0.60 C ATOM 525 C LYS A 35 30.082 -19.135 14.966 1.00 0.56 C ATOM 526 O LYS A 35 30.029 -20.118 14.222 1.00 0.58 O ATOM 527 CB LYS A 35 28.978 -19.232 17.210 1.00 0.83 C ATOM 528 CG LYS A 35 27.851 -18.741 18.099 1.00 1.17 C ATOM 529 CD LYS A 35 27.936 -17.239 18.327 1.00 1.46 C ATOM 530 CE LYS A 35 28.302 -16.906 19.763 1.00 1.98 C ATOM 531 NZ LYS A 35 27.230 -17.302 20.713 1.00 2.66 N ATOM 0 H LYS A 35 27.582 -20.143 14.975 1.00 0.49 H new ATOM 0 HA LYS A 35 28.871 -17.612 15.802 1.00 0.60 H new ATOM 0 HB2 LYS A 35 28.971 -20.322 17.190 1.00 0.83 H new ATOM 0 HB3 LYS A 35 29.933 -18.927 17.639 1.00 0.83 H new ATOM 0 HG2 LYS A 35 26.892 -18.987 17.643 1.00 1.17 H new ATOM 0 HG3 LYS A 35 27.890 -19.259 19.057 1.00 1.17 H new ATOM 0 HD2 LYS A 35 28.679 -16.811 17.654 1.00 1.46 H new ATOM 0 HD3 LYS A 35 26.979 -16.779 18.080 1.00 1.46 H new ATOM 0 HE2 LYS A 35 29.229 -17.414 20.029 1.00 1.98 H new ATOM 0 HE3 LYS A 35 28.489 -15.836 19.851 1.00 1.98 H new ATOM 0 HZ1 LYS A 35 27.323 -16.752 21.591 1.00 2.66 H new ATOM 0 HZ2 LYS A 35 26.301 -17.116 20.285 1.00 2.66 H new ATOM 0 HZ3 LYS A 35 27.315 -18.316 20.929 1.00 2.66 H new ATOM 545 N LYS A 36 31.165 -18.386 15.120 1.00 0.67 N ATOM 546 CA LYS A 36 32.390 -18.618 14.371 1.00 0.82 C ATOM 547 C LYS A 36 33.063 -19.901 14.843 1.00 0.84 C ATOM 548 O LYS A 36 33.462 -20.015 16.001 1.00 0.91 O ATOM 549 CB LYS A 36 33.323 -17.408 14.546 1.00 1.09 C ATOM 550 CG LYS A 36 34.568 -17.395 13.661 1.00 1.26 C ATOM 551 CD LYS A 36 35.678 -18.294 14.192 1.00 1.36 C ATOM 552 CE LYS A 36 35.999 -17.989 15.648 1.00 2.14 C ATOM 553 NZ LYS A 36 37.156 -18.780 16.136 1.00 2.51 N ATOM 0 H LYS A 36 31.218 -17.600 15.768 1.00 0.67 H new ATOM 0 HA LYS A 36 32.158 -18.736 13.313 1.00 0.82 H new ATOM 0 HB2 LYS A 36 32.751 -16.501 14.350 1.00 1.09 H new ATOM 0 HB3 LYS A 36 33.640 -17.366 15.588 1.00 1.09 H new ATOM 0 HG2 LYS A 36 34.297 -17.716 12.655 1.00 1.26 H new ATOM 0 HG3 LYS A 36 34.941 -16.374 13.581 1.00 1.26 H new ATOM 0 HD2 LYS A 36 35.379 -19.338 14.096 1.00 1.36 H new ATOM 0 HD3 LYS A 36 36.574 -18.162 13.586 1.00 1.36 H new ATOM 0 HE2 LYS A 36 36.214 -16.926 15.758 1.00 2.14 H new ATOM 0 HE3 LYS A 36 35.126 -18.203 16.265 1.00 2.14 H new ATOM 0 HZ1 LYS A 36 37.343 -18.544 17.131 1.00 2.51 H new ATOM 0 HZ2 LYS A 36 36.942 -19.794 16.055 1.00 2.51 H new ATOM 0 HZ3 LYS A 36 37.995 -18.557 15.564 1.00 2.51 H new ATOM 567 N GLY A 37 33.182 -20.862 13.944 1.00 0.92 N ATOM 568 CA GLY A 37 33.815 -22.119 14.277 1.00 1.04 C ATOM 569 C GLY A 37 32.801 -23.214 14.524 1.00 0.96 C ATOM 570 O GLY A 37 33.084 -24.394 14.313 1.00 1.12 O ATOM 0 H GLY A 37 32.849 -20.794 12.982 1.00 0.92 H new ATOM 0 HA2 GLY A 37 34.480 -22.416 13.466 1.00 1.04 H new ATOM 0 HA3 GLY A 37 34.433 -21.990 15.165 1.00 1.04 H new ATOM 574 N ASN A 38 31.607 -22.817 14.948 1.00 0.79 N ATOM 575 CA ASN A 38 30.534 -23.765 15.205 1.00 0.75 C ATOM 576 C ASN A 38 30.052 -24.377 13.901 1.00 0.72 C ATOM 577 O ASN A 38 30.187 -23.776 12.832 1.00 0.79 O ATOM 578 CB ASN A 38 29.356 -23.100 15.930 1.00 0.75 C ATOM 579 CG ASN A 38 29.657 -22.767 17.381 1.00 0.87 C ATOM 580 OD1 ASN A 38 30.788 -22.455 17.742 1.00 1.38 O ATOM 581 ND2 ASN A 38 28.641 -22.849 18.226 1.00 0.98 N ATOM 0 H ASN A 38 31.359 -21.843 15.121 1.00 0.79 H new ATOM 0 HA ASN A 38 30.932 -24.548 15.851 1.00 0.75 H new ATOM 0 HB2 ASN A 38 29.083 -22.186 15.403 1.00 0.75 H new ATOM 0 HB3 ASN A 38 28.491 -23.762 15.888 1.00 0.75 H new ATOM 0 HD21 ASN A 38 28.784 -22.649 19.216 1.00 0.98 H new ATOM 0 HD22 ASN A 38 27.716 -23.112 17.887 1.00 0.98 H new ATOM 588 N GLU A 39 29.498 -25.575 13.981 1.00 0.71 N ATOM 589 CA GLU A 39 29.041 -26.274 12.794 1.00 0.73 C ATOM 590 C GLU A 39 27.717 -25.702 12.305 1.00 0.63 C ATOM 591 O GLU A 39 26.656 -25.996 12.854 1.00 0.69 O ATOM 592 CB GLU A 39 28.886 -27.767 13.062 1.00 0.86 C ATOM 593 CG GLU A 39 30.148 -28.434 13.583 1.00 1.37 C ATOM 594 CD GLU A 39 30.019 -29.938 13.602 1.00 1.73 C ATOM 595 OE1 GLU A 39 29.135 -30.454 14.314 1.00 2.17 O ATOM 596 OE2 GLU A 39 30.827 -30.615 12.940 1.00 2.20 O ATOM 0 H GLU A 39 29.354 -26.082 14.854 1.00 0.71 H new ATOM 0 HA GLU A 39 29.796 -26.134 12.020 1.00 0.73 H new ATOM 0 HB2 GLU A 39 28.084 -27.915 13.785 1.00 0.86 H new ATOM 0 HB3 GLU A 39 28.580 -28.262 12.140 1.00 0.86 H new ATOM 0 HG2 GLU A 39 30.994 -28.149 12.958 1.00 1.37 H new ATOM 0 HG3 GLU A 39 30.360 -28.074 14.590 1.00 1.37 H new ATOM 603 N VAL A 40 27.790 -24.856 11.294 1.00 0.60 N ATOM 604 CA VAL A 40 26.599 -24.306 10.674 1.00 0.54 C ATOM 605 C VAL A 40 26.554 -24.723 9.212 1.00 0.54 C ATOM 606 O VAL A 40 27.598 -24.830 8.565 1.00 0.67 O ATOM 607 CB VAL A 40 26.552 -22.761 10.784 1.00 0.57 C ATOM 608 CG1 VAL A 40 26.585 -22.326 12.241 1.00 0.61 C ATOM 609 CG2 VAL A 40 27.698 -22.118 10.012 1.00 0.67 C ATOM 0 H VAL A 40 28.666 -24.534 10.883 1.00 0.60 H new ATOM 0 HA VAL A 40 25.730 -24.699 11.203 1.00 0.54 H new ATOM 0 HB VAL A 40 25.615 -22.424 10.341 1.00 0.57 H new ATOM 0 HG11 VAL A 40 26.551 -21.238 12.297 1.00 0.61 H new ATOM 0 HG12 VAL A 40 25.725 -22.743 12.765 1.00 0.61 H new ATOM 0 HG13 VAL A 40 27.503 -22.685 12.707 1.00 0.61 H new ATOM 0 HG21 VAL A 40 27.638 -21.034 10.108 1.00 0.67 H new ATOM 0 HG22 VAL A 40 28.649 -22.466 10.415 1.00 0.67 H new ATOM 0 HG23 VAL A 40 27.628 -22.394 8.960 1.00 0.67 H new ATOM 619 N THR A 41 25.366 -24.990 8.701 1.00 0.46 N ATOM 620 CA THR A 41 25.210 -25.333 7.303 1.00 0.48 C ATOM 621 C THR A 41 24.545 -24.175 6.573 1.00 0.42 C ATOM 622 O THR A 41 23.349 -23.926 6.741 1.00 0.44 O ATOM 623 CB THR A 41 24.370 -26.611 7.128 1.00 0.56 C ATOM 624 OG1 THR A 41 24.870 -27.642 7.994 1.00 0.65 O ATOM 625 CG2 THR A 41 24.410 -27.098 5.688 1.00 0.63 C ATOM 0 H THR A 41 24.497 -24.975 9.234 1.00 0.46 H new ATOM 0 HA THR A 41 26.198 -25.522 6.883 1.00 0.48 H new ATOM 0 HB THR A 41 23.337 -26.378 7.387 1.00 0.56 H new ATOM 0 HG1 THR A 41 24.332 -28.453 7.881 1.00 0.65 H new ATOM 0 HG21 THR A 41 23.808 -28.002 5.593 1.00 0.63 H new ATOM 0 HG22 THR A 41 24.010 -26.325 5.031 1.00 0.63 H new ATOM 0 HG23 THR A 41 25.440 -27.316 5.406 1.00 0.63 H new ATOM 633 N VAL A 42 25.329 -23.456 5.787 1.00 0.40 N ATOM 634 CA VAL A 42 24.838 -22.259 5.134 1.00 0.42 C ATOM 635 C VAL A 42 24.959 -22.350 3.620 1.00 0.43 C ATOM 636 O VAL A 42 25.944 -22.865 3.085 1.00 0.49 O ATOM 637 CB VAL A 42 25.558 -20.995 5.658 1.00 0.46 C ATOM 638 CG1 VAL A 42 25.017 -20.603 7.025 1.00 0.80 C ATOM 639 CG2 VAL A 42 27.061 -21.226 5.727 1.00 0.87 C ATOM 0 H VAL A 42 26.304 -23.681 5.588 1.00 0.40 H new ATOM 0 HA VAL A 42 23.779 -22.177 5.380 1.00 0.42 H new ATOM 0 HB VAL A 42 25.367 -20.177 4.963 1.00 0.46 H new ATOM 0 HG11 VAL A 42 25.535 -19.712 7.379 1.00 0.80 H new ATOM 0 HG12 VAL A 42 23.950 -20.396 6.948 1.00 0.80 H new ATOM 0 HG13 VAL A 42 25.179 -21.420 7.728 1.00 0.80 H new ATOM 0 HG21 VAL A 42 27.551 -20.326 6.098 1.00 0.87 H new ATOM 0 HG22 VAL A 42 27.271 -22.057 6.400 1.00 0.87 H new ATOM 0 HG23 VAL A 42 27.439 -21.461 4.732 1.00 0.87 H new ATOM 649 N HIS A 43 23.924 -21.864 2.949 1.00 0.44 N ATOM 650 CA HIS A 43 23.835 -21.897 1.497 1.00 0.49 C ATOM 651 C HIS A 43 24.109 -20.513 0.916 1.00 0.47 C ATOM 652 O HIS A 43 23.589 -19.510 1.409 1.00 0.53 O ATOM 653 CB HIS A 43 22.435 -22.400 1.092 1.00 0.64 C ATOM 654 CG HIS A 43 22.073 -22.192 -0.351 1.00 1.16 C ATOM 655 ND1 HIS A 43 20.836 -21.733 -0.747 1.00 2.00 N ATOM 656 CD2 HIS A 43 22.783 -22.379 -1.489 1.00 2.04 C ATOM 657 CE1 HIS A 43 20.798 -21.646 -2.063 1.00 2.74 C ATOM 658 NE2 HIS A 43 21.969 -22.027 -2.541 1.00 2.75 N ATOM 0 H HIS A 43 23.117 -21.433 3.401 1.00 0.44 H new ATOM 0 HA HIS A 43 24.587 -22.577 1.098 1.00 0.49 H new ATOM 0 HB2 HIS A 43 22.370 -23.465 1.316 1.00 0.64 H new ATOM 0 HB3 HIS A 43 21.693 -21.898 1.712 1.00 0.64 H new ATOM 0 HD2 HIS A 43 23.799 -22.738 -1.558 1.00 2.04 H new ATOM 0 HE1 HIS A 43 19.953 -21.319 -2.650 1.00 2.74 H new ATOM 0 HE2 HIS A 43 22.227 -22.056 -3.527 1.00 2.75 H new ATOM 667 N TYR A 44 24.926 -20.469 -0.129 1.00 0.44 N ATOM 668 CA TYR A 44 25.268 -19.212 -0.788 1.00 0.42 C ATOM 669 C TYR A 44 24.927 -19.279 -2.277 1.00 0.41 C ATOM 670 O TYR A 44 25.152 -20.300 -2.928 1.00 0.47 O ATOM 671 CB TYR A 44 26.759 -18.882 -0.598 1.00 0.46 C ATOM 672 CG TYR A 44 27.706 -19.884 -1.222 1.00 0.50 C ATOM 673 CD1 TYR A 44 27.874 -21.146 -0.671 1.00 0.52 C ATOM 674 CD2 TYR A 44 28.432 -19.562 -2.359 1.00 0.60 C ATOM 675 CE1 TYR A 44 28.736 -22.060 -1.235 1.00 0.60 C ATOM 676 CE2 TYR A 44 29.300 -20.473 -2.932 1.00 0.68 C ATOM 677 CZ TYR A 44 29.448 -21.722 -2.365 1.00 0.66 C ATOM 678 OH TYR A 44 30.299 -22.641 -2.929 1.00 0.76 O ATOM 0 H TYR A 44 25.366 -21.292 -0.541 1.00 0.44 H new ATOM 0 HA TYR A 44 24.679 -18.418 -0.329 1.00 0.42 H new ATOM 0 HB2 TYR A 44 26.958 -17.899 -1.024 1.00 0.46 H new ATOM 0 HB3 TYR A 44 26.971 -18.816 0.469 1.00 0.46 H new ATOM 0 HD1 TYR A 44 27.319 -21.416 0.215 1.00 0.52 H new ATOM 0 HD2 TYR A 44 28.318 -18.584 -2.804 1.00 0.60 H new ATOM 0 HE1 TYR A 44 28.853 -23.038 -0.793 1.00 0.60 H new ATOM 0 HE2 TYR A 44 29.859 -20.209 -3.818 1.00 0.68 H new ATOM 0 HH TYR A 44 30.351 -23.434 -2.355 1.00 0.76 H new ATOM 688 N VAL A 45 24.340 -18.208 -2.792 1.00 0.35 N ATOM 689 CA VAL A 45 24.038 -18.087 -4.217 1.00 0.36 C ATOM 690 C VAL A 45 23.640 -16.644 -4.506 1.00 0.30 C ATOM 691 O VAL A 45 23.171 -15.957 -3.608 1.00 0.30 O ATOM 692 CB VAL A 45 22.909 -19.059 -4.649 1.00 0.44 C ATOM 693 CG1 VAL A 45 21.582 -18.680 -4.003 1.00 0.47 C ATOM 694 CG2 VAL A 45 22.788 -19.121 -6.165 1.00 0.49 C ATOM 0 H VAL A 45 24.059 -17.399 -2.238 1.00 0.35 H new ATOM 0 HA VAL A 45 24.925 -18.356 -4.791 1.00 0.36 H new ATOM 0 HB VAL A 45 23.175 -20.056 -4.298 1.00 0.44 H new ATOM 0 HG11 VAL A 45 20.809 -19.378 -4.324 1.00 0.47 H new ATOM 0 HG12 VAL A 45 21.681 -18.721 -2.918 1.00 0.47 H new ATOM 0 HG13 VAL A 45 21.306 -17.670 -4.305 1.00 0.47 H new ATOM 0 HG21 VAL A 45 21.989 -19.810 -6.438 1.00 0.49 H new ATOM 0 HG22 VAL A 45 22.560 -18.128 -6.553 1.00 0.49 H new ATOM 0 HG23 VAL A 45 23.729 -19.469 -6.591 1.00 0.49 H new ATOM 704 N GLY A 46 23.842 -16.170 -5.723 1.00 0.31 N ATOM 705 CA GLY A 46 23.488 -14.799 -6.029 1.00 0.30 C ATOM 706 C GLY A 46 23.805 -14.405 -7.454 1.00 0.30 C ATOM 707 O GLY A 46 23.350 -15.048 -8.398 1.00 0.36 O ATOM 0 H GLY A 46 24.240 -16.701 -6.498 1.00 0.31 H new ATOM 0 HA2 GLY A 46 22.423 -14.657 -5.848 1.00 0.30 H new ATOM 0 HA3 GLY A 46 24.018 -14.133 -5.348 1.00 0.30 H new ATOM 711 N LYS A 47 24.583 -13.340 -7.611 1.00 0.27 N ATOM 712 CA LYS A 47 24.950 -12.856 -8.932 1.00 0.29 C ATOM 713 C LYS A 47 26.227 -12.024 -8.874 1.00 0.25 C ATOM 714 O LYS A 47 26.721 -11.693 -7.795 1.00 0.26 O ATOM 715 CB LYS A 47 23.801 -12.044 -9.559 1.00 0.36 C ATOM 716 CG LYS A 47 23.445 -10.763 -8.818 1.00 0.42 C ATOM 717 CD LYS A 47 22.223 -10.083 -9.426 1.00 0.66 C ATOM 718 CE LYS A 47 21.952 -8.719 -8.798 1.00 0.83 C ATOM 719 NZ LYS A 47 23.008 -7.724 -9.139 1.00 1.43 N ATOM 0 H LYS A 47 24.970 -12.797 -6.839 1.00 0.27 H new ATOM 0 HA LYS A 47 25.139 -13.723 -9.565 1.00 0.29 H new ATOM 0 HB2 LYS A 47 24.071 -11.791 -10.584 1.00 0.36 H new ATOM 0 HB3 LYS A 47 22.914 -12.676 -9.610 1.00 0.36 H new ATOM 0 HG2 LYS A 47 23.251 -10.990 -7.770 1.00 0.42 H new ATOM 0 HG3 LYS A 47 24.293 -10.079 -8.844 1.00 0.42 H new ATOM 0 HD2 LYS A 47 22.372 -9.964 -10.499 1.00 0.66 H new ATOM 0 HD3 LYS A 47 21.350 -10.722 -9.294 1.00 0.66 H new ATOM 0 HE2 LYS A 47 20.984 -8.350 -9.137 1.00 0.83 H new ATOM 0 HE3 LYS A 47 21.891 -8.825 -7.715 1.00 0.83 H new ATOM 0 HZ1 LYS A 47 23.411 -7.332 -8.264 1.00 1.43 H new ATOM 0 HZ2 LYS A 47 23.759 -8.189 -9.689 1.00 1.43 H new ATOM 0 HZ3 LYS A 47 22.592 -6.955 -9.703 1.00 1.43 H new ATOM 733 N LEU A 48 26.754 -11.710 -10.042 1.00 0.27 N ATOM 734 CA LEU A 48 27.952 -10.897 -10.176 1.00 0.26 C ATOM 735 C LEU A 48 27.573 -9.443 -10.451 1.00 0.25 C ATOM 736 O LEU A 48 27.189 -9.101 -11.569 1.00 0.27 O ATOM 737 CB LEU A 48 28.813 -11.450 -11.319 1.00 0.29 C ATOM 738 CG LEU A 48 30.092 -10.671 -11.634 1.00 0.32 C ATOM 739 CD1 LEU A 48 31.039 -10.685 -10.447 1.00 0.36 C ATOM 740 CD2 LEU A 48 30.773 -11.256 -12.858 1.00 0.38 C ATOM 0 H LEU A 48 26.361 -12.013 -10.933 1.00 0.27 H new ATOM 0 HA LEU A 48 28.522 -10.933 -9.247 1.00 0.26 H new ATOM 0 HB2 LEU A 48 29.087 -12.477 -11.077 1.00 0.29 H new ATOM 0 HB3 LEU A 48 28.203 -11.488 -12.221 1.00 0.29 H new ATOM 0 HG LEU A 48 29.821 -9.636 -11.842 1.00 0.32 H new ATOM 0 HD11 LEU A 48 31.941 -10.125 -10.694 1.00 0.36 H new ATOM 0 HD12 LEU A 48 30.551 -10.226 -9.587 1.00 0.36 H new ATOM 0 HD13 LEU A 48 31.305 -11.714 -10.206 1.00 0.36 H new ATOM 0 HD21 LEU A 48 31.682 -10.694 -13.072 1.00 0.38 H new ATOM 0 HD22 LEU A 48 31.028 -12.299 -12.669 1.00 0.38 H new ATOM 0 HD23 LEU A 48 30.099 -11.196 -13.713 1.00 0.38 H new ATOM 752 N GLU A 49 27.672 -8.596 -9.427 1.00 0.29 N ATOM 753 CA GLU A 49 27.299 -7.184 -9.561 1.00 0.36 C ATOM 754 C GLU A 49 28.289 -6.464 -10.463 1.00 0.34 C ATOM 755 O GLU A 49 27.961 -5.457 -11.079 1.00 0.41 O ATOM 756 CB GLU A 49 27.260 -6.485 -8.194 1.00 0.50 C ATOM 757 CG GLU A 49 26.423 -5.210 -8.181 1.00 0.63 C ATOM 758 CD GLU A 49 24.971 -5.459 -8.554 1.00 1.20 C ATOM 759 OE1 GLU A 49 24.172 -5.821 -7.664 1.00 1.96 O ATOM 760 OE2 GLU A 49 24.619 -5.310 -9.741 1.00 1.75 O ATOM 0 H GLU A 49 28.005 -8.859 -8.499 1.00 0.29 H new ATOM 0 HA GLU A 49 26.302 -7.145 -10.001 1.00 0.36 H new ATOM 0 HB2 GLU A 49 26.862 -7.178 -7.453 1.00 0.50 H new ATOM 0 HB3 GLU A 49 28.279 -6.244 -7.890 1.00 0.50 H new ATOM 0 HG2 GLU A 49 26.467 -4.761 -7.189 1.00 0.63 H new ATOM 0 HG3 GLU A 49 26.854 -4.490 -8.876 1.00 0.63 H new ATOM 767 N SER A 50 29.493 -7.016 -10.548 1.00 0.33 N ATOM 768 CA SER A 50 30.588 -6.393 -11.281 1.00 0.40 C ATOM 769 C SER A 50 30.212 -6.096 -12.735 1.00 0.45 C ATOM 770 O SER A 50 30.744 -5.168 -13.339 1.00 0.55 O ATOM 771 CB SER A 50 31.820 -7.291 -11.238 1.00 0.46 C ATOM 772 OG SER A 50 32.984 -6.592 -11.639 1.00 0.67 O ATOM 0 H SER A 50 29.737 -7.905 -10.112 1.00 0.33 H new ATOM 0 HA SER A 50 30.807 -5.441 -10.796 1.00 0.40 H new ATOM 0 HB2 SER A 50 31.956 -7.677 -10.228 1.00 0.46 H new ATOM 0 HB3 SER A 50 31.668 -8.151 -11.890 1.00 0.46 H new ATOM 0 HG SER A 50 33.723 -7.226 -11.754 1.00 0.67 H new ATOM 778 N THR A 51 29.313 -6.891 -13.298 1.00 0.44 N ATOM 779 CA THR A 51 28.863 -6.667 -14.664 1.00 0.53 C ATOM 780 C THR A 51 27.358 -6.918 -14.780 1.00 0.54 C ATOM 781 O THR A 51 26.808 -7.015 -15.879 1.00 0.73 O ATOM 782 CB THR A 51 29.641 -7.558 -15.663 1.00 0.59 C ATOM 783 OG1 THR A 51 29.272 -7.236 -17.010 1.00 0.72 O ATOM 784 CG2 THR A 51 29.386 -9.034 -15.402 1.00 0.53 C ATOM 0 H THR A 51 28.884 -7.691 -12.834 1.00 0.44 H new ATOM 0 HA THR A 51 29.063 -5.626 -14.917 1.00 0.53 H new ATOM 0 HB THR A 51 30.704 -7.362 -15.522 1.00 0.59 H new ATOM 0 HG1 THR A 51 28.318 -7.012 -17.043 1.00 0.72 H new ATOM 0 HG21 THR A 51 29.946 -9.633 -16.120 1.00 0.53 H new ATOM 0 HG22 THR A 51 29.707 -9.285 -14.391 1.00 0.53 H new ATOM 0 HG23 THR A 51 28.322 -9.244 -15.507 1.00 0.53 H new ATOM 792 N GLY A 52 26.700 -6.984 -13.623 1.00 0.48 N ATOM 793 CA GLY A 52 25.272 -7.251 -13.564 1.00 0.51 C ATOM 794 C GLY A 52 24.888 -8.573 -14.200 1.00 0.54 C ATOM 795 O GLY A 52 23.911 -8.657 -14.943 1.00 0.78 O ATOM 0 H GLY A 52 27.140 -6.855 -12.712 1.00 0.48 H new ATOM 0 HA2 GLY A 52 24.951 -7.249 -12.522 1.00 0.51 H new ATOM 0 HA3 GLY A 52 24.736 -6.444 -14.065 1.00 0.51 H new ATOM 799 N LYS A 53 25.657 -9.610 -13.904 1.00 0.44 N ATOM 800 CA LYS A 53 25.390 -10.939 -14.431 1.00 0.49 C ATOM 801 C LYS A 53 24.820 -11.831 -13.344 1.00 0.41 C ATOM 802 O LYS A 53 25.403 -11.962 -12.274 1.00 0.38 O ATOM 803 CB LYS A 53 26.667 -11.563 -15.001 1.00 0.60 C ATOM 804 CG LYS A 53 26.801 -11.416 -16.508 1.00 0.84 C ATOM 805 CD LYS A 53 25.694 -12.160 -17.238 1.00 1.47 C ATOM 806 CE LYS A 53 25.677 -13.634 -16.865 1.00 2.09 C ATOM 807 NZ LYS A 53 24.525 -14.348 -17.470 1.00 2.89 N ATOM 0 H LYS A 53 26.476 -9.555 -13.298 1.00 0.44 H new ATOM 0 HA LYS A 53 24.660 -10.846 -15.235 1.00 0.49 H new ATOM 0 HB2 LYS A 53 27.531 -11.102 -14.522 1.00 0.60 H new ATOM 0 HB3 LYS A 53 26.688 -12.622 -14.745 1.00 0.60 H new ATOM 0 HG2 LYS A 53 26.770 -10.360 -16.776 1.00 0.84 H new ATOM 0 HG3 LYS A 53 27.771 -11.798 -16.828 1.00 0.84 H new ATOM 0 HD2 LYS A 53 24.731 -11.711 -16.996 1.00 1.47 H new ATOM 0 HD3 LYS A 53 25.833 -12.057 -18.314 1.00 1.47 H new ATOM 0 HE2 LYS A 53 26.606 -14.101 -17.192 1.00 2.09 H new ATOM 0 HE3 LYS A 53 25.636 -13.733 -15.780 1.00 2.09 H new ATOM 0 HZ1 LYS A 53 24.552 -15.349 -17.190 1.00 2.89 H new ATOM 0 HZ2 LYS A 53 23.638 -13.919 -17.138 1.00 2.89 H new ATOM 0 HZ3 LYS A 53 24.578 -14.276 -18.506 1.00 2.89 H new ATOM 821 N VAL A 54 23.676 -12.430 -13.615 1.00 0.44 N ATOM 822 CA VAL A 54 23.053 -13.341 -12.665 1.00 0.44 C ATOM 823 C VAL A 54 23.661 -14.734 -12.820 1.00 0.46 C ATOM 824 O VAL A 54 24.264 -15.029 -13.852 1.00 0.51 O ATOM 825 CB VAL A 54 21.516 -13.399 -12.868 1.00 0.52 C ATOM 826 CG1 VAL A 54 21.162 -14.110 -14.165 1.00 0.59 C ATOM 827 CG2 VAL A 54 20.827 -14.063 -11.693 1.00 0.57 C ATOM 0 H VAL A 54 23.157 -12.304 -14.484 1.00 0.44 H new ATOM 0 HA VAL A 54 23.241 -12.972 -11.657 1.00 0.44 H new ATOM 0 HB VAL A 54 21.157 -12.372 -12.931 1.00 0.52 H new ATOM 0 HG11 VAL A 54 20.079 -14.136 -14.282 1.00 0.59 H new ATOM 0 HG12 VAL A 54 21.605 -13.575 -15.005 1.00 0.59 H new ATOM 0 HG13 VAL A 54 21.549 -15.129 -14.139 1.00 0.59 H new ATOM 0 HG21 VAL A 54 19.751 -14.087 -11.868 1.00 0.57 H new ATOM 0 HG22 VAL A 54 21.199 -15.081 -11.581 1.00 0.57 H new ATOM 0 HG23 VAL A 54 21.034 -13.499 -10.784 1.00 0.57 H new ATOM 837 N PHE A 55 23.535 -15.571 -11.797 1.00 0.48 N ATOM 838 CA PHE A 55 24.056 -16.930 -11.867 1.00 0.54 C ATOM 839 C PHE A 55 23.169 -17.810 -12.738 1.00 0.61 C ATOM 840 O PHE A 55 22.081 -18.210 -12.328 1.00 0.78 O ATOM 841 CB PHE A 55 24.173 -17.543 -10.470 1.00 0.59 C ATOM 842 CG PHE A 55 25.377 -17.093 -9.688 1.00 0.47 C ATOM 843 CD1 PHE A 55 26.171 -16.045 -10.127 1.00 0.52 C ATOM 844 CD2 PHE A 55 25.713 -17.731 -8.505 1.00 0.58 C ATOM 845 CE1 PHE A 55 27.273 -15.638 -9.397 1.00 0.46 C ATOM 846 CE2 PHE A 55 26.813 -17.331 -7.771 1.00 0.70 C ATOM 847 CZ PHE A 55 27.596 -16.284 -8.220 1.00 0.56 C ATOM 0 H PHE A 55 23.080 -15.335 -10.915 1.00 0.48 H new ATOM 0 HA PHE A 55 25.049 -16.877 -12.314 1.00 0.54 H new ATOM 0 HB2 PHE A 55 23.275 -17.297 -9.903 1.00 0.59 H new ATOM 0 HB3 PHE A 55 24.203 -18.628 -10.565 1.00 0.59 H new ATOM 0 HD1 PHE A 55 25.926 -15.540 -11.050 1.00 0.52 H new ATOM 0 HD2 PHE A 55 25.107 -18.552 -8.152 1.00 0.58 H new ATOM 0 HE1 PHE A 55 27.880 -14.816 -9.747 1.00 0.46 H new ATOM 0 HE2 PHE A 55 27.061 -17.835 -6.849 1.00 0.70 H new ATOM 0 HZ PHE A 55 28.459 -15.972 -7.651 1.00 0.56 H new ATOM 857 N ASP A 56 23.620 -18.064 -13.956 1.00 0.61 N ATOM 858 CA ASP A 56 22.939 -18.987 -14.849 1.00 0.71 C ATOM 859 C ASP A 56 23.917 -20.057 -15.333 1.00 0.70 C ATOM 860 O ASP A 56 24.562 -19.919 -16.374 1.00 0.87 O ATOM 861 CB ASP A 56 22.289 -18.242 -16.034 1.00 0.91 C ATOM 862 CG ASP A 56 23.274 -17.470 -16.900 1.00 1.59 C ATOM 863 OD1 ASP A 56 24.039 -16.644 -16.364 1.00 2.14 O ATOM 864 OD2 ASP A 56 23.275 -17.682 -18.130 1.00 2.18 O ATOM 0 H ASP A 56 24.460 -17.641 -14.350 1.00 0.61 H new ATOM 0 HA ASP A 56 22.135 -19.476 -14.299 1.00 0.71 H new ATOM 0 HB2 ASP A 56 21.762 -18.964 -16.658 1.00 0.91 H new ATOM 0 HB3 ASP A 56 21.542 -17.549 -15.647 1.00 0.91 H new ATOM 869 N SER A 57 24.062 -21.108 -14.544 1.00 0.61 N ATOM 870 CA SER A 57 25.002 -22.168 -14.852 1.00 0.67 C ATOM 871 C SER A 57 24.299 -23.523 -14.855 1.00 0.68 C ATOM 872 O SER A 57 23.147 -23.638 -14.435 1.00 0.75 O ATOM 873 CB SER A 57 26.128 -22.163 -13.818 1.00 0.75 C ATOM 874 OG SER A 57 26.736 -20.887 -13.739 1.00 1.24 O ATOM 0 H SER A 57 23.537 -21.249 -13.681 1.00 0.61 H new ATOM 0 HA SER A 57 25.419 -21.996 -15.845 1.00 0.67 H new ATOM 0 HB2 SER A 57 25.732 -22.442 -12.842 1.00 0.75 H new ATOM 0 HB3 SER A 57 26.875 -22.910 -14.085 1.00 0.75 H new ATOM 0 HG SER A 57 27.452 -20.907 -13.070 1.00 1.24 H new ATOM 880 N SER A 58 24.992 -24.544 -15.336 1.00 0.75 N ATOM 881 CA SER A 58 24.460 -25.899 -15.341 1.00 0.82 C ATOM 882 C SER A 58 24.413 -26.468 -13.927 1.00 0.70 C ATOM 883 O SER A 58 23.592 -27.328 -13.616 1.00 0.70 O ATOM 884 CB SER A 58 25.336 -26.784 -16.226 1.00 1.03 C ATOM 885 OG SER A 58 25.654 -26.128 -17.446 1.00 1.49 O ATOM 0 H SER A 58 25.929 -24.459 -15.730 1.00 0.75 H new ATOM 0 HA SER A 58 23.444 -25.875 -15.734 1.00 0.82 H new ATOM 0 HB2 SER A 58 26.254 -27.039 -15.696 1.00 1.03 H new ATOM 0 HB3 SER A 58 24.818 -27.720 -16.436 1.00 1.03 H new ATOM 0 HG SER A 58 26.217 -26.713 -17.995 1.00 1.49 H new ATOM 891 N PHE A 59 25.288 -25.964 -13.071 1.00 0.69 N ATOM 892 CA PHE A 59 25.494 -26.556 -11.762 1.00 0.70 C ATOM 893 C PHE A 59 24.646 -25.889 -10.683 1.00 0.64 C ATOM 894 O PHE A 59 24.019 -26.569 -9.877 1.00 0.67 O ATOM 895 CB PHE A 59 26.970 -26.471 -11.386 1.00 0.85 C ATOM 896 CG PHE A 59 27.467 -27.688 -10.671 1.00 1.08 C ATOM 897 CD1 PHE A 59 27.794 -28.829 -11.383 1.00 1.28 C ATOM 898 CD2 PHE A 59 27.610 -27.693 -9.294 1.00 1.39 C ATOM 899 CE1 PHE A 59 28.260 -29.957 -10.735 1.00 1.58 C ATOM 900 CE2 PHE A 59 28.073 -28.818 -8.639 1.00 1.77 C ATOM 901 CZ PHE A 59 28.399 -29.952 -9.360 1.00 1.80 C ATOM 0 H PHE A 59 25.867 -25.146 -13.261 1.00 0.69 H new ATOM 0 HA PHE A 59 25.182 -27.599 -11.822 1.00 0.70 H new ATOM 0 HB2 PHE A 59 27.561 -26.322 -12.290 1.00 0.85 H new ATOM 0 HB3 PHE A 59 27.128 -25.597 -10.754 1.00 0.85 H new ATOM 0 HD1 PHE A 59 27.684 -28.838 -12.457 1.00 1.28 H new ATOM 0 HD2 PHE A 59 27.357 -26.809 -8.727 1.00 1.39 H new ATOM 0 HE1 PHE A 59 28.515 -30.840 -11.302 1.00 1.58 H new ATOM 0 HE2 PHE A 59 28.180 -28.812 -7.564 1.00 1.77 H new ATOM 0 HZ PHE A 59 28.762 -30.832 -8.850 1.00 1.80 H new ATOM 911 N ASP A 60 24.611 -24.561 -10.691 1.00 0.66 N ATOM 912 CA ASP A 60 24.033 -23.796 -9.581 1.00 0.72 C ATOM 913 C ASP A 60 22.522 -24.010 -9.463 1.00 0.71 C ATOM 914 O ASP A 60 22.009 -24.226 -8.364 1.00 0.86 O ATOM 915 CB ASP A 60 24.347 -22.301 -9.739 1.00 0.83 C ATOM 916 CG ASP A 60 23.541 -21.639 -10.837 1.00 1.54 C ATOM 917 OD1 ASP A 60 23.679 -22.043 -12.004 1.00 1.89 O ATOM 918 OD2 ASP A 60 22.773 -20.705 -10.530 1.00 2.19 O ATOM 0 H ASP A 60 24.975 -23.988 -11.452 1.00 0.66 H new ATOM 0 HA ASP A 60 24.490 -24.163 -8.662 1.00 0.72 H new ATOM 0 HB2 ASP A 60 24.151 -21.793 -8.795 1.00 0.83 H new ATOM 0 HB3 ASP A 60 25.409 -22.179 -9.952 1.00 0.83 H new ATOM 923 N ARG A 61 21.817 -23.969 -10.590 1.00 0.68 N ATOM 924 CA ARG A 61 20.367 -24.150 -10.588 1.00 0.80 C ATOM 925 C ARG A 61 20.002 -25.621 -10.428 1.00 0.75 C ATOM 926 O ARG A 61 18.833 -25.969 -10.248 1.00 0.92 O ATOM 927 CB ARG A 61 19.749 -23.606 -11.879 1.00 0.97 C ATOM 928 CG ARG A 61 20.166 -24.371 -13.123 1.00 1.23 C ATOM 929 CD ARG A 61 19.412 -23.887 -14.349 1.00 1.65 C ATOM 930 NE ARG A 61 19.805 -24.610 -15.557 1.00 1.75 N ATOM 931 CZ ARG A 61 19.788 -24.079 -16.779 1.00 2.15 C ATOM 932 NH1 ARG A 61 19.346 -22.844 -16.962 1.00 2.58 N ATOM 933 NH2 ARG A 61 20.200 -24.794 -17.814 1.00 2.78 N ATOM 0 H ARG A 61 22.223 -23.813 -11.513 1.00 0.68 H new ATOM 0 HA ARG A 61 19.967 -23.593 -9.741 1.00 0.80 H new ATOM 0 HB2 ARG A 61 18.663 -23.635 -11.792 1.00 0.97 H new ATOM 0 HB3 ARG A 61 20.032 -22.560 -11.994 1.00 0.97 H new ATOM 0 HG2 ARG A 61 21.238 -24.253 -13.283 1.00 1.23 H new ATOM 0 HG3 ARG A 61 19.981 -25.435 -12.977 1.00 1.23 H new ATOM 0 HD2 ARG A 61 18.341 -24.008 -14.187 1.00 1.65 H new ATOM 0 HD3 ARG A 61 19.595 -22.822 -14.489 1.00 1.65 H new ATOM 0 HE ARG A 61 20.110 -25.578 -15.459 1.00 1.75 H new ATOM 0 HH11 ARG A 61 19.017 -22.297 -16.166 1.00 2.58 H new ATOM 0 HH12 ARG A 61 19.334 -22.440 -17.899 1.00 2.58 H new ATOM 0 HH21 ARG A 61 20.530 -25.749 -17.675 1.00 2.78 H new ATOM 0 HH22 ARG A 61 20.188 -24.390 -18.750 1.00 2.78 H new ATOM 947 N ASN A 62 21.006 -26.481 -10.510 1.00 0.64 N ATOM 948 CA ASN A 62 20.791 -27.909 -10.357 1.00 0.68 C ATOM 949 C ASN A 62 21.079 -28.328 -8.920 1.00 0.73 C ATOM 950 O ASN A 62 20.194 -28.807 -8.214 1.00 0.89 O ATOM 951 CB ASN A 62 21.678 -28.699 -11.327 1.00 0.71 C ATOM 952 CG ASN A 62 21.344 -30.180 -11.348 1.00 0.83 C ATOM 953 OD1 ASN A 62 21.997 -30.951 -10.494 1.00 0.93 O flip ATOM 954 ND2 ASN A 62 20.510 -30.629 -12.136 1.00 1.10 N flip ATOM 0 H ASN A 62 21.975 -26.214 -10.681 1.00 0.64 H new ATOM 0 HA ASN A 62 19.749 -28.129 -10.590 1.00 0.68 H new ATOM 0 HB2 ASN A 62 21.566 -28.291 -12.331 1.00 0.71 H new ATOM 0 HB3 ASN A 62 22.723 -28.570 -11.045 1.00 0.71 H new ATOM 0 HD21 ASN A 62 20.027 -30.002 -12.780 1.00 1.10 H new ATOM 0 HD22 ASN A 62 20.302 -31.628 -12.145 1.00 1.10 H new ATOM 961 N VAL A 63 22.317 -28.128 -8.488 1.00 0.68 N ATOM 962 CA VAL A 63 22.725 -28.491 -7.143 1.00 0.83 C ATOM 963 C VAL A 63 23.634 -27.414 -6.551 1.00 0.62 C ATOM 964 O VAL A 63 24.772 -27.224 -6.984 1.00 0.64 O ATOM 965 CB VAL A 63 23.420 -29.876 -7.105 1.00 1.16 C ATOM 966 CG1 VAL A 63 24.557 -29.957 -8.113 1.00 1.76 C ATOM 967 CG2 VAL A 63 23.917 -30.196 -5.700 1.00 2.03 C ATOM 0 H VAL A 63 23.057 -27.714 -9.055 1.00 0.68 H new ATOM 0 HA VAL A 63 21.824 -28.563 -6.534 1.00 0.83 H new ATOM 0 HB VAL A 63 22.678 -30.624 -7.384 1.00 1.16 H new ATOM 0 HG11 VAL A 63 25.022 -30.941 -8.059 1.00 1.76 H new ATOM 0 HG12 VAL A 63 24.165 -29.795 -9.117 1.00 1.76 H new ATOM 0 HG13 VAL A 63 25.300 -29.192 -7.886 1.00 1.76 H new ATOM 0 HG21 VAL A 63 24.401 -31.173 -5.699 1.00 2.03 H new ATOM 0 HG22 VAL A 63 24.632 -29.436 -5.385 1.00 2.03 H new ATOM 0 HG23 VAL A 63 23.074 -30.208 -5.010 1.00 2.03 H new ATOM 977 N PRO A 64 23.124 -26.675 -5.562 1.00 0.91 N ATOM 978 CA PRO A 64 23.875 -25.604 -4.913 1.00 1.03 C ATOM 979 C PRO A 64 24.925 -26.133 -3.937 1.00 0.81 C ATOM 980 O PRO A 64 24.826 -27.259 -3.444 1.00 0.86 O ATOM 981 CB PRO A 64 22.795 -24.824 -4.166 1.00 1.53 C ATOM 982 CG PRO A 64 21.738 -25.828 -3.869 1.00 1.76 C ATOM 983 CD PRO A 64 21.767 -26.820 -5.001 1.00 1.40 C ATOM 0 HA PRO A 64 24.436 -25.006 -5.631 1.00 1.03 H new ATOM 0 HB2 PRO A 64 23.188 -24.381 -3.251 1.00 1.53 H new ATOM 0 HB3 PRO A 64 22.405 -24.007 -4.773 1.00 1.53 H new ATOM 0 HG2 PRO A 64 21.927 -26.321 -2.915 1.00 1.76 H new ATOM 0 HG3 PRO A 64 20.760 -25.352 -3.794 1.00 1.76 H new ATOM 0 HD2 PRO A 64 21.587 -27.835 -4.648 1.00 1.40 H new ATOM 0 HD3 PRO A 64 21.001 -26.601 -5.745 1.00 1.40 H new ATOM 991 N PHE A 65 25.920 -25.310 -3.655 1.00 0.68 N ATOM 992 CA PHE A 65 26.994 -25.691 -2.753 1.00 0.53 C ATOM 993 C PHE A 65 26.780 -25.036 -1.388 1.00 0.47 C ATOM 994 O PHE A 65 26.113 -23.999 -1.288 1.00 0.54 O ATOM 995 CB PHE A 65 28.344 -25.274 -3.350 1.00 0.62 C ATOM 996 CG PHE A 65 29.503 -26.133 -2.917 1.00 0.72 C ATOM 997 CD1 PHE A 65 29.827 -27.281 -3.622 1.00 1.06 C ATOM 998 CD2 PHE A 65 30.274 -25.789 -1.818 1.00 0.71 C ATOM 999 CE1 PHE A 65 30.892 -28.071 -3.238 1.00 1.31 C ATOM 1000 CE2 PHE A 65 31.343 -26.576 -1.430 1.00 0.95 C ATOM 1001 CZ PHE A 65 31.652 -27.719 -2.141 1.00 1.24 C ATOM 0 H PHE A 65 26.007 -24.369 -4.039 1.00 0.68 H new ATOM 0 HA PHE A 65 26.993 -26.773 -2.621 1.00 0.53 H new ATOM 0 HB2 PHE A 65 28.272 -25.302 -4.437 1.00 0.62 H new ATOM 0 HB3 PHE A 65 28.548 -24.240 -3.071 1.00 0.62 H new ATOM 0 HD1 PHE A 65 29.239 -27.561 -4.483 1.00 1.06 H new ATOM 0 HD2 PHE A 65 30.037 -24.896 -1.258 1.00 0.71 H new ATOM 0 HE1 PHE A 65 31.130 -28.964 -3.796 1.00 1.31 H new ATOM 0 HE2 PHE A 65 31.936 -26.297 -0.571 1.00 0.95 H new ATOM 0 HZ PHE A 65 32.486 -28.336 -1.839 1.00 1.24 H new ATOM 1011 N LYS A 66 27.312 -25.653 -0.340 1.00 0.41 N ATOM 1012 CA LYS A 66 27.207 -25.111 1.012 1.00 0.39 C ATOM 1013 C LYS A 66 28.583 -25.080 1.670 1.00 0.38 C ATOM 1014 O LYS A 66 29.488 -25.806 1.253 1.00 0.48 O ATOM 1015 CB LYS A 66 26.206 -25.928 1.856 1.00 0.45 C ATOM 1016 CG LYS A 66 26.510 -27.425 1.955 1.00 0.60 C ATOM 1017 CD LYS A 66 27.606 -27.733 2.967 1.00 0.67 C ATOM 1018 CE LYS A 66 28.008 -29.200 2.914 1.00 0.93 C ATOM 1019 NZ LYS A 66 29.246 -29.474 3.693 1.00 1.36 N ATOM 0 H LYS A 66 27.823 -26.534 -0.400 1.00 0.41 H new ATOM 0 HA LYS A 66 26.830 -24.090 0.951 1.00 0.39 H new ATOM 0 HB2 LYS A 66 26.179 -25.511 2.863 1.00 0.45 H new ATOM 0 HB3 LYS A 66 25.210 -25.803 1.432 1.00 0.45 H new ATOM 0 HG2 LYS A 66 25.602 -27.959 2.234 1.00 0.60 H new ATOM 0 HG3 LYS A 66 26.810 -27.797 0.975 1.00 0.60 H new ATOM 0 HD2 LYS A 66 28.476 -27.107 2.767 1.00 0.67 H new ATOM 0 HD3 LYS A 66 27.259 -27.484 3.970 1.00 0.67 H new ATOM 0 HE2 LYS A 66 27.194 -29.812 3.302 1.00 0.93 H new ATOM 0 HE3 LYS A 66 28.161 -29.495 1.876 1.00 0.93 H new ATOM 0 HZ1 LYS A 66 29.481 -30.485 3.628 1.00 1.36 H new ATOM 0 HZ2 LYS A 66 30.031 -28.911 3.307 1.00 1.36 H new ATOM 0 HZ3 LYS A 66 29.093 -29.218 4.689 1.00 1.36 H new ATOM 1033 N PHE A 67 28.743 -24.259 2.699 1.00 0.39 N ATOM 1034 CA PHE A 67 30.027 -24.144 3.372 1.00 0.42 C ATOM 1035 C PHE A 67 29.848 -24.069 4.887 1.00 0.42 C ATOM 1036 O PHE A 67 28.726 -23.988 5.390 1.00 0.46 O ATOM 1037 CB PHE A 67 30.800 -22.919 2.862 1.00 0.46 C ATOM 1038 CG PHE A 67 30.152 -21.601 3.175 1.00 0.45 C ATOM 1039 CD1 PHE A 67 29.196 -21.068 2.331 1.00 0.55 C ATOM 1040 CD2 PHE A 67 30.510 -20.893 4.308 1.00 0.43 C ATOM 1041 CE1 PHE A 67 28.604 -19.853 2.612 1.00 0.57 C ATOM 1042 CE2 PHE A 67 29.923 -19.681 4.596 1.00 0.46 C ATOM 1043 CZ PHE A 67 28.969 -19.156 3.744 1.00 0.51 C ATOM 0 H PHE A 67 28.006 -23.668 3.083 1.00 0.39 H new ATOM 0 HA PHE A 67 30.606 -25.039 3.142 1.00 0.42 H new ATOM 0 HB2 PHE A 67 31.800 -22.930 3.295 1.00 0.46 H new ATOM 0 HB3 PHE A 67 30.919 -23.004 1.782 1.00 0.46 H new ATOM 0 HD1 PHE A 67 28.909 -21.608 1.441 1.00 0.55 H new ATOM 0 HD2 PHE A 67 31.259 -21.295 4.975 1.00 0.43 H new ATOM 0 HE1 PHE A 67 27.856 -19.449 1.946 1.00 0.57 H new ATOM 0 HE2 PHE A 67 30.208 -19.141 5.487 1.00 0.46 H new ATOM 0 HZ PHE A 67 28.511 -18.203 3.965 1.00 0.51 H new ATOM 1053 N HIS A 68 30.968 -24.101 5.594 1.00 0.42 N ATOM 1054 CA HIS A 68 30.994 -24.025 7.050 1.00 0.44 C ATOM 1055 C HIS A 68 31.713 -22.749 7.484 1.00 0.42 C ATOM 1056 O HIS A 68 32.700 -22.350 6.868 1.00 0.44 O ATOM 1057 CB HIS A 68 31.697 -25.282 7.602 1.00 0.53 C ATOM 1058 CG HIS A 68 32.083 -25.229 9.056 1.00 0.89 C ATOM 1059 ND1 HIS A 68 33.350 -25.528 9.507 1.00 1.68 N ATOM 1060 CD2 HIS A 68 31.359 -24.930 10.158 1.00 1.56 C ATOM 1061 CE1 HIS A 68 33.390 -25.411 10.819 1.00 1.98 C ATOM 1062 NE2 HIS A 68 32.194 -25.046 11.244 1.00 1.87 N ATOM 0 H HIS A 68 31.893 -24.181 5.171 1.00 0.42 H new ATOM 0 HA HIS A 68 29.980 -23.990 7.448 1.00 0.44 H new ATOM 0 HB2 HIS A 68 31.041 -26.139 7.450 1.00 0.53 H new ATOM 0 HB3 HIS A 68 32.596 -25.461 7.013 1.00 0.53 H new ATOM 0 HD2 HIS A 68 30.316 -24.651 10.181 1.00 1.56 H new ATOM 0 HE1 HIS A 68 34.255 -25.584 11.442 1.00 1.98 H new ATOM 0 HE2 HIS A 68 31.933 -24.878 12.216 1.00 1.87 H new ATOM 1071 N LEU A 69 31.199 -22.095 8.519 1.00 0.44 N ATOM 1072 CA LEU A 69 31.841 -20.900 9.055 1.00 0.47 C ATOM 1073 C LEU A 69 33.160 -21.268 9.734 1.00 0.49 C ATOM 1074 O LEU A 69 33.209 -22.193 10.544 1.00 0.58 O ATOM 1075 CB LEU A 69 30.897 -20.179 10.025 1.00 0.59 C ATOM 1076 CG LEU A 69 31.454 -18.911 10.684 1.00 0.71 C ATOM 1077 CD1 LEU A 69 32.017 -17.958 9.641 1.00 0.74 C ATOM 1078 CD2 LEU A 69 30.372 -18.219 11.499 1.00 0.95 C ATOM 0 H LEU A 69 30.344 -22.370 9.002 1.00 0.44 H new ATOM 0 HA LEU A 69 32.064 -20.218 8.235 1.00 0.47 H new ATOM 0 HB2 LEU A 69 29.986 -19.915 9.487 1.00 0.59 H new ATOM 0 HB3 LEU A 69 30.612 -20.878 10.811 1.00 0.59 H new ATOM 0 HG LEU A 69 32.265 -19.204 11.351 1.00 0.71 H new ATOM 0 HD11 LEU A 69 32.406 -17.067 10.134 1.00 0.74 H new ATOM 0 HD12 LEU A 69 32.822 -18.450 9.095 1.00 0.74 H new ATOM 0 HD13 LEU A 69 31.228 -17.673 8.945 1.00 0.74 H new ATOM 0 HD21 LEU A 69 30.783 -17.321 11.961 1.00 0.95 H new ATOM 0 HD22 LEU A 69 29.544 -17.945 10.846 1.00 0.95 H new ATOM 0 HD23 LEU A 69 30.013 -18.895 12.276 1.00 0.95 H new ATOM 1090 N GLU A 70 34.209 -20.520 9.399 1.00 0.59 N ATOM 1091 CA GLU A 70 35.583 -20.860 9.761 1.00 0.69 C ATOM 1092 C GLU A 70 35.929 -22.230 9.188 1.00 0.69 C ATOM 1093 O GLU A 70 35.862 -23.256 9.867 1.00 0.96 O ATOM 1094 CB GLU A 70 35.818 -20.827 11.275 1.00 0.95 C ATOM 1095 CG GLU A 70 37.192 -20.286 11.661 1.00 1.12 C ATOM 1096 CD GLU A 70 38.334 -21.042 11.009 1.00 1.47 C ATOM 1097 OE1 GLU A 70 38.627 -20.778 9.824 1.00 1.79 O ATOM 1098 OE2 GLU A 70 38.941 -21.905 11.679 1.00 2.08 O ATOM 0 H GLU A 70 34.129 -19.655 8.865 1.00 0.59 H new ATOM 0 HA GLU A 70 36.241 -20.103 9.333 1.00 0.69 H new ATOM 0 HB2 GLU A 70 35.049 -20.212 11.742 1.00 0.95 H new ATOM 0 HB3 GLU A 70 35.706 -21.835 11.675 1.00 0.95 H new ATOM 0 HG2 GLU A 70 37.254 -19.234 11.381 1.00 1.12 H new ATOM 0 HG3 GLU A 70 37.304 -20.334 12.744 1.00 1.12 H new ATOM 1105 N GLN A 71 36.250 -22.219 7.906 1.00 0.68 N ATOM 1106 CA GLN A 71 36.504 -23.435 7.155 1.00 0.86 C ATOM 1107 C GLN A 71 37.805 -23.303 6.359 1.00 0.83 C ATOM 1108 O GLN A 71 38.256 -24.246 5.706 1.00 0.96 O ATOM 1109 CB GLN A 71 35.303 -23.679 6.234 1.00 1.05 C ATOM 1110 CG GLN A 71 35.393 -24.897 5.329 1.00 0.96 C ATOM 1111 CD GLN A 71 34.137 -25.062 4.497 1.00 1.14 C ATOM 1112 OE1 GLN A 71 33.226 -25.798 4.865 1.00 1.98 O ATOM 1113 NE2 GLN A 71 34.052 -24.331 3.398 1.00 0.97 N ATOM 0 H GLN A 71 36.342 -21.365 7.356 1.00 0.68 H new ATOM 0 HA GLN A 71 36.625 -24.285 7.826 1.00 0.86 H new ATOM 0 HB2 GLN A 71 34.410 -23.776 6.852 1.00 1.05 H new ATOM 0 HB3 GLN A 71 35.164 -22.797 5.609 1.00 1.05 H new ATOM 0 HG2 GLN A 71 36.257 -24.800 4.671 1.00 0.96 H new ATOM 0 HG3 GLN A 71 35.551 -25.790 5.933 1.00 0.96 H new ATOM 0 HE21 GLN A 71 34.830 -23.731 3.123 1.00 0.97 H new ATOM 0 HE22 GLN A 71 33.209 -24.368 2.825 1.00 0.97 H new ATOM 1122 N GLY A 72 38.413 -22.122 6.427 1.00 0.72 N ATOM 1123 CA GLY A 72 39.599 -21.843 5.632 1.00 0.72 C ATOM 1124 C GLY A 72 39.257 -21.379 4.229 1.00 0.67 C ATOM 1125 O GLY A 72 40.078 -20.767 3.551 1.00 0.70 O ATOM 0 H GLY A 72 38.106 -21.351 7.020 1.00 0.72 H new ATOM 0 HA2 GLY A 72 40.195 -21.078 6.130 1.00 0.72 H new ATOM 0 HA3 GLY A 72 40.215 -22.741 5.575 1.00 0.72 H new ATOM 1129 N GLU A 73 38.030 -21.651 3.806 1.00 0.63 N ATOM 1130 CA GLU A 73 37.588 -21.300 2.462 1.00 0.62 C ATOM 1131 C GLU A 73 36.900 -19.936 2.479 1.00 0.57 C ATOM 1132 O GLU A 73 36.626 -19.349 1.435 1.00 0.66 O ATOM 1133 CB GLU A 73 36.617 -22.358 1.927 1.00 0.67 C ATOM 1134 CG GLU A 73 36.975 -23.790 2.314 1.00 0.73 C ATOM 1135 CD GLU A 73 38.251 -24.307 1.678 1.00 0.81 C ATOM 1136 OE1 GLU A 73 39.341 -23.909 2.122 1.00 0.92 O ATOM 1137 OE2 GLU A 73 38.160 -25.155 0.767 1.00 0.97 O ATOM 0 H GLU A 73 37.321 -22.114 4.375 1.00 0.63 H new ATOM 0 HA GLU A 73 38.460 -21.257 1.810 1.00 0.62 H new ATOM 0 HB2 GLU A 73 35.615 -22.134 2.294 1.00 0.67 H new ATOM 0 HB3 GLU A 73 36.582 -22.286 0.840 1.00 0.67 H new ATOM 0 HG2 GLU A 73 37.074 -23.847 3.398 1.00 0.73 H new ATOM 0 HG3 GLU A 73 36.151 -24.447 2.034 1.00 0.73 H new ATOM 1144 N VAL A 74 36.617 -19.442 3.678 1.00 0.50 N ATOM 1145 CA VAL A 74 35.930 -18.169 3.843 1.00 0.45 C ATOM 1146 C VAL A 74 36.734 -17.267 4.780 1.00 0.41 C ATOM 1147 O VAL A 74 37.080 -17.668 5.891 1.00 0.46 O ATOM 1148 CB VAL A 74 34.486 -18.371 4.383 1.00 0.50 C ATOM 1149 CG1 VAL A 74 33.646 -19.165 3.389 1.00 0.58 C ATOM 1150 CG2 VAL A 74 34.491 -19.062 5.746 1.00 0.55 C ATOM 0 H VAL A 74 36.855 -19.907 4.554 1.00 0.50 H new ATOM 0 HA VAL A 74 35.850 -17.691 2.867 1.00 0.45 H new ATOM 0 HB VAL A 74 34.040 -17.384 4.509 1.00 0.50 H new ATOM 0 HG11 VAL A 74 32.639 -19.295 3.786 1.00 0.58 H new ATOM 0 HG12 VAL A 74 33.596 -18.626 2.443 1.00 0.58 H new ATOM 0 HG13 VAL A 74 34.101 -20.142 3.227 1.00 0.58 H new ATOM 0 HG21 VAL A 74 33.466 -19.187 6.094 1.00 0.55 H new ATOM 0 HG22 VAL A 74 34.966 -20.039 5.657 1.00 0.55 H new ATOM 0 HG23 VAL A 74 35.045 -18.453 6.461 1.00 0.55 H new ATOM 1160 N ILE A 75 37.072 -16.070 4.312 1.00 0.38 N ATOM 1161 CA ILE A 75 37.904 -15.159 5.094 1.00 0.40 C ATOM 1162 C ILE A 75 37.086 -14.117 5.866 1.00 0.39 C ATOM 1163 O ILE A 75 37.132 -14.083 7.092 1.00 0.47 O ATOM 1164 CB ILE A 75 38.998 -14.447 4.247 1.00 0.45 C ATOM 1165 CG1 ILE A 75 38.461 -13.911 2.903 1.00 0.46 C ATOM 1166 CG2 ILE A 75 40.171 -15.387 4.016 1.00 0.53 C ATOM 1167 CD1 ILE A 75 38.437 -14.933 1.783 1.00 0.62 C ATOM 0 H ILE A 75 36.786 -15.709 3.402 1.00 0.38 H new ATOM 0 HA ILE A 75 38.406 -15.803 5.816 1.00 0.40 H new ATOM 0 HB ILE A 75 39.331 -13.580 4.817 1.00 0.45 H new ATOM 0 HG12 ILE A 75 37.450 -13.533 3.055 1.00 0.46 H new ATOM 0 HG13 ILE A 75 39.074 -13.065 2.593 1.00 0.46 H new ATOM 0 HG21 ILE A 75 40.932 -14.880 3.422 1.00 0.53 H new ATOM 0 HG22 ILE A 75 40.596 -15.681 4.976 1.00 0.53 H new ATOM 0 HG23 ILE A 75 39.827 -16.274 3.484 1.00 0.53 H new ATOM 0 HD11 ILE A 75 38.046 -14.471 0.877 1.00 0.62 H new ATOM 0 HD12 ILE A 75 39.449 -15.294 1.598 1.00 0.62 H new ATOM 0 HD13 ILE A 75 37.799 -15.770 2.068 1.00 0.62 H new ATOM 1179 N LYS A 76 36.336 -13.272 5.162 1.00 0.33 N ATOM 1180 CA LYS A 76 35.645 -12.162 5.816 1.00 0.35 C ATOM 1181 C LYS A 76 34.232 -11.981 5.283 1.00 0.29 C ATOM 1182 O LYS A 76 33.286 -11.884 6.058 1.00 0.31 O ATOM 1183 CB LYS A 76 36.425 -10.851 5.636 1.00 0.48 C ATOM 1184 CG LYS A 76 37.763 -10.794 6.368 1.00 0.62 C ATOM 1185 CD LYS A 76 37.623 -10.333 7.819 1.00 0.98 C ATOM 1186 CE LYS A 76 36.853 -11.328 8.678 1.00 1.18 C ATOM 1187 NZ LYS A 76 36.895 -10.976 10.121 1.00 2.04 N ATOM 0 H LYS A 76 36.192 -13.332 4.154 1.00 0.33 H new ATOM 0 HA LYS A 76 35.585 -12.409 6.876 1.00 0.35 H new ATOM 0 HB2 LYS A 76 36.602 -10.694 4.572 1.00 0.48 H new ATOM 0 HB3 LYS A 76 35.803 -10.025 5.981 1.00 0.48 H new ATOM 0 HG2 LYS A 76 38.226 -11.781 6.348 1.00 0.62 H new ATOM 0 HG3 LYS A 76 38.433 -10.117 5.839 1.00 0.62 H new ATOM 0 HD2 LYS A 76 38.615 -10.182 8.245 1.00 0.98 H new ATOM 0 HD3 LYS A 76 37.115 -9.369 7.843 1.00 0.98 H new ATOM 0 HE2 LYS A 76 35.816 -11.366 8.345 1.00 1.18 H new ATOM 0 HE3 LYS A 76 37.270 -12.325 8.537 1.00 1.18 H new ATOM 0 HZ1 LYS A 76 36.358 -11.681 10.666 1.00 2.04 H new ATOM 0 HZ2 LYS A 76 37.882 -10.965 10.447 1.00 2.04 H new ATOM 0 HZ3 LYS A 76 36.474 -10.036 10.261 1.00 2.04 H new ATOM 1201 N GLY A 77 34.091 -11.951 3.958 1.00 0.29 N ATOM 1202 CA GLY A 77 32.803 -11.650 3.346 1.00 0.30 C ATOM 1203 C GLY A 77 31.674 -12.515 3.877 1.00 0.27 C ATOM 1204 O GLY A 77 30.633 -12.007 4.290 1.00 0.32 O ATOM 0 H GLY A 77 34.846 -12.130 3.296 1.00 0.29 H new ATOM 0 HA2 GLY A 77 32.561 -10.601 3.519 1.00 0.30 H new ATOM 0 HA3 GLY A 77 32.880 -11.785 2.267 1.00 0.30 H new ATOM 1208 N TRP A 78 31.885 -13.818 3.882 1.00 0.24 N ATOM 1209 CA TRP A 78 30.888 -14.745 4.392 1.00 0.26 C ATOM 1210 C TRP A 78 30.857 -14.708 5.915 1.00 0.29 C ATOM 1211 O TRP A 78 29.788 -14.710 6.518 1.00 0.30 O ATOM 1212 CB TRP A 78 31.190 -16.164 3.909 1.00 0.28 C ATOM 1213 CG TRP A 78 31.227 -16.288 2.418 1.00 0.29 C ATOM 1214 CD1 TRP A 78 30.182 -16.588 1.594 1.00 0.32 C ATOM 1215 CD2 TRP A 78 32.372 -16.124 1.570 1.00 0.34 C ATOM 1216 NE1 TRP A 78 30.603 -16.616 0.287 1.00 0.36 N ATOM 1217 CE2 TRP A 78 31.946 -16.338 0.247 1.00 0.37 C ATOM 1218 CE3 TRP A 78 33.716 -15.818 1.803 1.00 0.40 C ATOM 1219 CZ2 TRP A 78 32.815 -16.250 -0.840 1.00 0.43 C ATOM 1220 CZ3 TRP A 78 34.579 -15.735 0.726 1.00 0.48 C ATOM 1221 CH2 TRP A 78 34.126 -15.952 -0.581 1.00 0.49 C ATOM 0 H TRP A 78 32.738 -14.260 3.539 1.00 0.24 H new ATOM 0 HA TRP A 78 29.911 -14.444 4.015 1.00 0.26 H new ATOM 0 HB2 TRP A 78 32.149 -16.482 4.317 1.00 0.28 H new ATOM 0 HB3 TRP A 78 30.435 -16.843 4.304 1.00 0.28 H new ATOM 0 HD1 TRP A 78 29.170 -16.776 1.922 1.00 0.32 H new ATOM 0 HE1 TRP A 78 30.013 -16.812 -0.522 1.00 0.36 H new ATOM 0 HE3 TRP A 78 34.074 -15.649 2.808 1.00 0.40 H new ATOM 0 HZ2 TRP A 78 32.467 -16.411 -1.849 1.00 0.43 H new ATOM 0 HZ3 TRP A 78 35.619 -15.499 0.896 1.00 0.48 H new ATOM 0 HH2 TRP A 78 34.825 -15.883 -1.401 1.00 0.49 H new ATOM 1232 N ASP A 79 32.042 -14.643 6.512 1.00 0.35 N ATOM 1233 CA ASP A 79 32.202 -14.668 7.968 1.00 0.42 C ATOM 1234 C ASP A 79 31.318 -13.631 8.660 1.00 0.43 C ATOM 1235 O ASP A 79 30.555 -13.961 9.569 1.00 0.47 O ATOM 1236 CB ASP A 79 33.676 -14.430 8.323 1.00 0.52 C ATOM 1237 CG ASP A 79 33.907 -14.190 9.804 1.00 0.76 C ATOM 1238 OD1 ASP A 79 33.680 -15.129 10.598 1.00 1.14 O ATOM 1239 OD2 ASP A 79 34.295 -13.066 10.177 1.00 0.90 O ATOM 0 H ASP A 79 32.923 -14.571 6.002 1.00 0.35 H new ATOM 0 HA ASP A 79 31.888 -15.649 8.325 1.00 0.42 H new ATOM 0 HB2 ASP A 79 34.262 -15.293 8.006 1.00 0.52 H new ATOM 0 HB3 ASP A 79 34.043 -13.571 7.761 1.00 0.52 H new ATOM 1244 N ILE A 80 31.406 -12.390 8.202 1.00 0.45 N ATOM 1245 CA ILE A 80 30.643 -11.292 8.791 1.00 0.52 C ATOM 1246 C ILE A 80 29.139 -11.509 8.637 1.00 0.47 C ATOM 1247 O ILE A 80 28.368 -11.283 9.572 1.00 0.56 O ATOM 1248 CB ILE A 80 31.037 -9.931 8.158 1.00 0.63 C ATOM 1249 CG1 ILE A 80 32.301 -9.366 8.813 1.00 0.75 C ATOM 1250 CG2 ILE A 80 29.905 -8.912 8.259 1.00 0.78 C ATOM 1251 CD1 ILE A 80 33.537 -10.219 8.638 1.00 0.70 C ATOM 0 H ILE A 80 32.001 -12.115 7.420 1.00 0.45 H new ATOM 0 HA ILE A 80 30.886 -11.273 9.853 1.00 0.52 H new ATOM 0 HB ILE A 80 31.236 -10.118 7.103 1.00 0.63 H new ATOM 0 HG12 ILE A 80 32.497 -8.377 8.400 1.00 0.75 H new ATOM 0 HG13 ILE A 80 32.114 -9.235 9.879 1.00 0.75 H new ATOM 0 HG21 ILE A 80 30.220 -7.972 7.805 1.00 0.78 H new ATOM 0 HG22 ILE A 80 29.027 -9.291 7.737 1.00 0.78 H new ATOM 0 HG23 ILE A 80 29.659 -8.744 9.308 1.00 0.78 H new ATOM 0 HD11 ILE A 80 34.382 -9.741 9.134 1.00 0.70 H new ATOM 0 HD12 ILE A 80 33.366 -11.202 9.078 1.00 0.70 H new ATOM 0 HD13 ILE A 80 33.755 -10.330 7.576 1.00 0.70 H new ATOM 1263 N CYS A 81 28.723 -11.951 7.462 1.00 0.38 N ATOM 1264 CA CYS A 81 27.305 -12.055 7.163 1.00 0.40 C ATOM 1265 C CYS A 81 26.663 -13.255 7.860 1.00 0.35 C ATOM 1266 O CYS A 81 25.569 -13.139 8.412 1.00 0.42 O ATOM 1267 CB CYS A 81 27.088 -12.133 5.654 1.00 0.44 C ATOM 1268 SG CYS A 81 25.350 -12.090 5.151 1.00 0.55 S ATOM 0 H CYS A 81 29.342 -12.242 6.705 1.00 0.38 H new ATOM 0 HA CYS A 81 26.819 -11.158 7.547 1.00 0.40 H new ATOM 0 HB2 CYS A 81 27.613 -11.304 5.180 1.00 0.44 H new ATOM 0 HB3 CYS A 81 27.540 -13.052 5.280 1.00 0.44 H new ATOM 0 HG CYS A 81 25.271 -12.159 3.855 1.00 0.55 H new ATOM 1274 N VAL A 82 27.346 -14.401 7.861 1.00 0.30 N ATOM 1275 CA VAL A 82 26.765 -15.625 8.416 1.00 0.34 C ATOM 1276 C VAL A 82 26.621 -15.546 9.933 1.00 0.39 C ATOM 1277 O VAL A 82 25.663 -16.070 10.490 1.00 0.48 O ATOM 1278 CB VAL A 82 27.573 -16.892 8.054 1.00 0.36 C ATOM 1279 CG1 VAL A 82 27.590 -17.113 6.553 1.00 0.84 C ATOM 1280 CG2 VAL A 82 28.985 -16.814 8.597 1.00 0.73 C ATOM 0 H VAL A 82 28.290 -14.508 7.489 1.00 0.30 H new ATOM 0 HA VAL A 82 25.778 -15.706 7.960 1.00 0.34 H new ATOM 0 HB VAL A 82 27.079 -17.744 8.520 1.00 0.36 H new ATOM 0 HG11 VAL A 82 28.165 -18.010 6.324 1.00 0.84 H new ATOM 0 HG12 VAL A 82 26.569 -17.234 6.191 1.00 0.84 H new ATOM 0 HG13 VAL A 82 28.049 -16.254 6.064 1.00 0.84 H new ATOM 0 HG21 VAL A 82 29.529 -17.719 8.327 1.00 0.73 H new ATOM 0 HG22 VAL A 82 29.490 -15.946 8.173 1.00 0.73 H new ATOM 0 HG23 VAL A 82 28.953 -16.721 9.683 1.00 0.73 H new ATOM 1290 N SER A 83 27.559 -14.873 10.591 1.00 0.39 N ATOM 1291 CA SER A 83 27.540 -14.748 12.047 1.00 0.49 C ATOM 1292 C SER A 83 26.423 -13.805 12.497 1.00 0.48 C ATOM 1293 O SER A 83 26.030 -13.797 13.660 1.00 0.60 O ATOM 1294 CB SER A 83 28.891 -14.233 12.544 1.00 0.63 C ATOM 1295 OG SER A 83 29.291 -13.084 11.819 1.00 1.43 O ATOM 0 H SER A 83 28.344 -14.404 10.139 1.00 0.39 H new ATOM 0 HA SER A 83 27.351 -15.733 12.475 1.00 0.49 H new ATOM 0 HB2 SER A 83 28.826 -13.994 13.605 1.00 0.63 H new ATOM 0 HB3 SER A 83 29.644 -15.014 12.439 1.00 0.63 H new ATOM 0 HG SER A 83 29.753 -13.359 10.999 1.00 1.43 H new ATOM 1301 N SER A 84 25.909 -13.021 11.556 1.00 0.50 N ATOM 1302 CA SER A 84 24.873 -12.040 11.852 1.00 0.53 C ATOM 1303 C SER A 84 23.488 -12.591 11.517 1.00 0.51 C ATOM 1304 O SER A 84 22.490 -11.862 11.551 1.00 0.64 O ATOM 1305 CB SER A 84 25.121 -10.765 11.045 1.00 0.69 C ATOM 1306 OG SER A 84 26.434 -10.257 11.245 1.00 1.23 O ATOM 0 H SER A 84 26.195 -13.047 10.577 1.00 0.50 H new ATOM 0 HA SER A 84 24.910 -11.815 12.918 1.00 0.53 H new ATOM 0 HB2 SER A 84 24.969 -10.971 9.985 1.00 0.69 H new ATOM 0 HB3 SER A 84 24.391 -10.007 11.330 1.00 0.69 H new ATOM 0 HG SER A 84 27.046 -10.668 10.599 1.00 1.23 H new ATOM 1312 N MET A 85 23.430 -13.876 11.192 1.00 0.46 N ATOM 1313 CA MET A 85 22.181 -14.503 10.779 1.00 0.49 C ATOM 1314 C MET A 85 21.466 -15.158 11.960 1.00 0.49 C ATOM 1315 O MET A 85 21.868 -15.012 13.111 1.00 0.74 O ATOM 1316 CB MET A 85 22.440 -15.552 9.690 1.00 0.54 C ATOM 1317 CG MET A 85 23.006 -15.000 8.385 1.00 0.63 C ATOM 1318 SD MET A 85 21.824 -14.024 7.434 1.00 1.05 S ATOM 1319 CE MET A 85 21.896 -12.439 8.269 1.00 2.27 C ATOM 0 H MET A 85 24.233 -14.505 11.206 1.00 0.46 H new ATOM 0 HA MET A 85 21.539 -13.718 10.380 1.00 0.49 H new ATOM 0 HB2 MET A 85 23.132 -16.298 10.082 1.00 0.54 H new ATOM 0 HB3 MET A 85 21.504 -16.068 9.473 1.00 0.54 H new ATOM 0 HG2 MET A 85 23.876 -14.382 8.609 1.00 0.63 H new ATOM 0 HG3 MET A 85 23.355 -15.830 7.771 1.00 0.63 H new ATOM 0 HE1 MET A 85 20.938 -12.237 8.749 1.00 2.27 H new ATOM 0 HE2 MET A 85 22.682 -12.461 9.023 1.00 2.27 H new ATOM 0 HE3 MET A 85 22.111 -11.655 7.543 1.00 2.27 H new ATOM 1329 N ARG A 86 20.388 -15.864 11.650 1.00 0.45 N ATOM 1330 CA ARG A 86 19.623 -16.621 12.632 1.00 0.46 C ATOM 1331 C ARG A 86 19.134 -17.909 11.992 1.00 0.49 C ATOM 1332 O ARG A 86 19.520 -18.228 10.876 1.00 0.57 O ATOM 1333 CB ARG A 86 18.421 -15.825 13.153 1.00 0.49 C ATOM 1334 CG ARG A 86 18.780 -14.660 14.061 1.00 0.96 C ATOM 1335 CD ARG A 86 17.543 -13.869 14.462 1.00 1.24 C ATOM 1336 NE ARG A 86 16.574 -14.677 15.216 1.00 2.20 N ATOM 1337 CZ ARG A 86 15.410 -15.110 14.713 1.00 3.10 C ATOM 1338 NH1 ARG A 86 15.103 -14.889 13.437 1.00 3.34 N ATOM 1339 NH2 ARG A 86 14.552 -15.766 15.489 1.00 4.19 N ATOM 0 H ARG A 86 20.016 -15.928 10.702 1.00 0.45 H new ATOM 0 HA ARG A 86 20.275 -16.835 13.479 1.00 0.46 H new ATOM 0 HB2 ARG A 86 17.857 -15.445 12.301 1.00 0.49 H new ATOM 0 HB3 ARG A 86 17.761 -16.502 13.696 1.00 0.49 H new ATOM 0 HG2 ARG A 86 19.281 -15.033 14.954 1.00 0.96 H new ATOM 0 HG3 ARG A 86 19.485 -14.003 13.552 1.00 0.96 H new ATOM 0 HD2 ARG A 86 17.844 -13.013 15.066 1.00 1.24 H new ATOM 0 HD3 ARG A 86 17.063 -13.475 13.567 1.00 1.24 H new ATOM 0 HE ARG A 86 16.801 -14.923 16.180 1.00 2.20 H new ATOM 0 HH11 ARG A 86 15.756 -14.387 12.835 1.00 3.34 H new ATOM 0 HH12 ARG A 86 14.215 -15.222 13.061 1.00 3.34 H new ATOM 0 HH21 ARG A 86 14.780 -15.940 16.468 1.00 4.19 H new ATOM 0 HH22 ARG A 86 13.666 -16.095 15.105 1.00 4.19 H new ATOM 1353 N LYS A 87 18.272 -18.628 12.697 1.00 0.51 N ATOM 1354 CA LYS A 87 17.756 -19.910 12.224 1.00 0.59 C ATOM 1355 C LYS A 87 16.894 -19.753 10.966 1.00 0.59 C ATOM 1356 O LYS A 87 16.741 -20.691 10.189 1.00 0.74 O ATOM 1357 CB LYS A 87 16.942 -20.554 13.345 1.00 0.68 C ATOM 1358 CG LYS A 87 16.523 -21.989 13.087 1.00 0.84 C ATOM 1359 CD LYS A 87 15.765 -22.540 14.284 1.00 1.03 C ATOM 1360 CE LYS A 87 15.463 -24.021 14.133 1.00 1.26 C ATOM 1361 NZ LYS A 87 14.858 -24.583 15.368 1.00 1.94 N ATOM 0 H LYS A 87 17.911 -18.344 13.608 1.00 0.51 H new ATOM 0 HA LYS A 87 18.600 -20.545 11.954 1.00 0.59 H new ATOM 0 HB2 LYS A 87 17.527 -20.521 14.264 1.00 0.68 H new ATOM 0 HB3 LYS A 87 16.048 -19.955 13.515 1.00 0.68 H new ATOM 0 HG2 LYS A 87 15.896 -22.038 12.197 1.00 0.84 H new ATOM 0 HG3 LYS A 87 17.403 -22.602 12.891 1.00 0.84 H new ATOM 0 HD2 LYS A 87 16.351 -22.380 15.189 1.00 1.03 H new ATOM 0 HD3 LYS A 87 14.832 -21.990 14.407 1.00 1.03 H new ATOM 0 HE2 LYS A 87 14.784 -24.171 13.293 1.00 1.26 H new ATOM 0 HE3 LYS A 87 16.382 -24.559 13.900 1.00 1.26 H new ATOM 0 HZ1 LYS A 87 14.665 -25.596 15.230 1.00 1.94 H new ATOM 0 HZ2 LYS A 87 15.517 -24.461 16.164 1.00 1.94 H new ATOM 0 HZ3 LYS A 87 13.968 -24.086 15.576 1.00 1.94 H new ATOM 1375 N ASN A 88 16.321 -18.568 10.776 1.00 0.55 N ATOM 1376 CA ASN A 88 15.476 -18.309 9.609 1.00 0.66 C ATOM 1377 C ASN A 88 15.802 -16.959 8.977 1.00 0.60 C ATOM 1378 O ASN A 88 15.034 -16.440 8.167 1.00 0.71 O ATOM 1379 CB ASN A 88 13.990 -18.358 9.986 1.00 0.79 C ATOM 1380 CG ASN A 88 13.450 -19.776 10.064 1.00 0.96 C ATOM 1381 OD1 ASN A 88 12.965 -20.324 9.072 1.00 1.23 O ATOM 1382 ND2 ASN A 88 13.521 -20.376 11.242 1.00 1.20 N ATOM 0 H ASN A 88 16.424 -17.775 11.409 1.00 0.55 H new ATOM 0 HA ASN A 88 15.682 -19.093 8.880 1.00 0.66 H new ATOM 0 HB2 ASN A 88 13.847 -17.866 10.948 1.00 0.79 H new ATOM 0 HB3 ASN A 88 13.415 -17.795 9.252 1.00 0.79 H new ATOM 0 HD21 ASN A 88 13.167 -21.326 11.353 1.00 1.20 H new ATOM 0 HD22 ASN A 88 13.930 -19.888 12.039 1.00 1.20 H new ATOM 1389 N GLU A 89 16.946 -16.397 9.344 1.00 0.50 N ATOM 1390 CA GLU A 89 17.359 -15.099 8.823 1.00 0.46 C ATOM 1391 C GLU A 89 17.956 -15.244 7.428 1.00 0.47 C ATOM 1392 O GLU A 89 18.385 -16.330 7.033 1.00 0.65 O ATOM 1393 CB GLU A 89 18.389 -14.458 9.750 1.00 0.50 C ATOM 1394 CG GLU A 89 18.127 -12.997 10.051 1.00 0.48 C ATOM 1395 CD GLU A 89 17.095 -12.813 11.138 1.00 1.01 C ATOM 1396 OE1 GLU A 89 16.405 -13.795 11.482 1.00 1.60 O ATOM 1397 OE2 GLU A 89 16.976 -11.691 11.663 1.00 1.38 O ATOM 0 H GLU A 89 17.604 -16.818 9.999 1.00 0.50 H new ATOM 0 HA GLU A 89 16.476 -14.462 8.768 1.00 0.46 H new ATOM 0 HB2 GLU A 89 18.412 -15.012 10.688 1.00 0.50 H new ATOM 0 HB3 GLU A 89 19.377 -14.553 9.299 1.00 0.50 H new ATOM 0 HG2 GLU A 89 19.058 -12.517 10.352 1.00 0.48 H new ATOM 0 HG3 GLU A 89 17.789 -12.496 9.144 1.00 0.48 H new ATOM 1404 N LYS A 90 17.987 -14.145 6.691 1.00 0.39 N ATOM 1405 CA LYS A 90 18.517 -14.149 5.342 1.00 0.40 C ATOM 1406 C LYS A 90 18.927 -12.742 4.930 1.00 0.39 C ATOM 1407 O LYS A 90 18.161 -11.795 5.115 1.00 0.47 O ATOM 1408 CB LYS A 90 17.465 -14.668 4.367 1.00 0.50 C ATOM 1409 CG LYS A 90 17.925 -14.647 2.921 1.00 0.56 C ATOM 1410 CD LYS A 90 16.747 -14.582 1.973 1.00 0.93 C ATOM 1411 CE LYS A 90 17.203 -14.563 0.527 1.00 0.85 C ATOM 1412 NZ LYS A 90 17.813 -15.858 0.124 1.00 1.17 N ATOM 0 H LYS A 90 17.649 -13.236 7.009 1.00 0.39 H new ATOM 0 HA LYS A 90 19.390 -14.801 5.319 1.00 0.40 H new ATOM 0 HB2 LYS A 90 17.197 -15.688 4.641 1.00 0.50 H new ATOM 0 HB3 LYS A 90 16.562 -14.065 4.463 1.00 0.50 H new ATOM 0 HG2 LYS A 90 18.576 -13.788 2.756 1.00 0.56 H new ATOM 0 HG3 LYS A 90 18.515 -15.539 2.711 1.00 0.56 H new ATOM 0 HD2 LYS A 90 16.096 -15.440 2.140 1.00 0.93 H new ATOM 0 HD3 LYS A 90 16.158 -13.689 2.182 1.00 0.93 H new ATOM 0 HE2 LYS A 90 16.353 -14.345 -0.119 1.00 0.85 H new ATOM 0 HE3 LYS A 90 17.926 -13.760 0.384 1.00 0.85 H new ATOM 0 HZ1 LYS A 90 17.926 -15.882 -0.910 1.00 1.17 H new ATOM 0 HZ2 LYS A 90 18.744 -15.959 0.576 1.00 1.17 H new ATOM 0 HZ3 LYS A 90 17.196 -16.640 0.423 1.00 1.17 H new ATOM 1426 N CYS A 91 20.122 -12.608 4.371 1.00 0.35 N ATOM 1427 CA CYS A 91 20.586 -11.321 3.863 1.00 0.38 C ATOM 1428 C CYS A 91 21.553 -11.514 2.703 1.00 0.32 C ATOM 1429 O CYS A 91 21.972 -12.636 2.410 1.00 0.37 O ATOM 1430 CB CYS A 91 21.260 -10.503 4.974 1.00 0.48 C ATOM 1431 SG CYS A 91 20.148 -9.997 6.306 1.00 1.20 S ATOM 0 H CYS A 91 20.788 -13.372 4.257 1.00 0.35 H new ATOM 0 HA CYS A 91 19.714 -10.772 3.506 1.00 0.38 H new ATOM 0 HB2 CYS A 91 22.073 -11.091 5.399 1.00 0.48 H new ATOM 0 HB3 CYS A 91 21.708 -9.613 4.533 1.00 0.48 H new ATOM 0 HG CYS A 91 18.994 -10.575 6.151 1.00 1.20 H new ATOM 1437 N LEU A 92 21.895 -10.415 2.041 1.00 0.31 N ATOM 1438 CA LEU A 92 22.819 -10.450 0.916 1.00 0.32 C ATOM 1439 C LEU A 92 24.086 -9.680 1.252 1.00 0.28 C ATOM 1440 O LEU A 92 24.033 -8.507 1.623 1.00 0.39 O ATOM 1441 CB LEU A 92 22.182 -9.863 -0.352 1.00 0.40 C ATOM 1442 CG LEU A 92 21.211 -10.782 -1.108 1.00 0.79 C ATOM 1443 CD1 LEU A 92 19.940 -11.027 -0.308 1.00 1.39 C ATOM 1444 CD2 LEU A 92 20.873 -10.193 -2.468 1.00 1.73 C ATOM 0 H LEU A 92 21.544 -9.484 2.266 1.00 0.31 H new ATOM 0 HA LEU A 92 23.066 -11.494 0.724 1.00 0.32 H new ATOM 0 HB2 LEU A 92 21.649 -8.952 -0.078 1.00 0.40 H new ATOM 0 HB3 LEU A 92 22.981 -9.572 -1.034 1.00 0.40 H new ATOM 0 HG LEU A 92 21.706 -11.742 -1.252 1.00 0.79 H new ATOM 0 HD11 LEU A 92 19.275 -11.681 -0.872 1.00 1.39 H new ATOM 0 HD12 LEU A 92 20.193 -11.499 0.642 1.00 1.39 H new ATOM 0 HD13 LEU A 92 19.440 -10.077 -0.119 1.00 1.39 H new ATOM 0 HD21 LEU A 92 20.184 -10.856 -2.991 1.00 1.73 H new ATOM 0 HD22 LEU A 92 20.407 -9.217 -2.336 1.00 1.73 H new ATOM 0 HD23 LEU A 92 21.786 -10.083 -3.054 1.00 1.73 H new ATOM 1456 N VAL A 93 25.219 -10.340 1.120 1.00 0.25 N ATOM 1457 CA VAL A 93 26.501 -9.715 1.399 1.00 0.25 C ATOM 1458 C VAL A 93 27.180 -9.297 0.097 1.00 0.23 C ATOM 1459 O VAL A 93 27.010 -9.948 -0.938 1.00 0.26 O ATOM 1460 CB VAL A 93 27.419 -10.663 2.212 1.00 0.34 C ATOM 1461 CG1 VAL A 93 27.591 -11.997 1.502 1.00 0.74 C ATOM 1462 CG2 VAL A 93 28.774 -10.026 2.484 1.00 0.60 C ATOM 0 H VAL A 93 25.280 -11.313 0.820 1.00 0.25 H new ATOM 0 HA VAL A 93 26.322 -8.825 2.002 1.00 0.25 H new ATOM 0 HB VAL A 93 26.934 -10.844 3.171 1.00 0.34 H new ATOM 0 HG11 VAL A 93 28.239 -12.643 2.094 1.00 0.74 H new ATOM 0 HG12 VAL A 93 26.618 -12.473 1.381 1.00 0.74 H new ATOM 0 HG13 VAL A 93 28.039 -11.833 0.522 1.00 0.74 H new ATOM 0 HG21 VAL A 93 29.393 -10.717 3.056 1.00 0.60 H new ATOM 0 HG22 VAL A 93 29.265 -9.797 1.538 1.00 0.60 H new ATOM 0 HG23 VAL A 93 28.636 -9.107 3.053 1.00 0.60 H new ATOM 1472 N ARG A 94 27.916 -8.191 0.138 1.00 0.25 N ATOM 1473 CA ARG A 94 28.626 -7.703 -1.036 1.00 0.30 C ATOM 1474 C ARG A 94 30.081 -8.139 -0.957 1.00 0.33 C ATOM 1475 O ARG A 94 30.826 -7.670 -0.096 1.00 0.38 O ATOM 1476 CB ARG A 94 28.563 -6.173 -1.112 1.00 0.40 C ATOM 1477 CG ARG A 94 27.182 -5.588 -0.848 1.00 0.92 C ATOM 1478 CD ARG A 94 26.184 -5.921 -1.946 1.00 0.65 C ATOM 1479 NE ARG A 94 24.865 -5.341 -1.662 1.00 0.89 N ATOM 1480 CZ ARG A 94 24.106 -4.726 -2.565 1.00 1.05 C ATOM 1481 NH1 ARG A 94 24.509 -4.636 -3.824 1.00 1.71 N ATOM 1482 NH2 ARG A 94 22.940 -4.200 -2.201 1.00 1.58 N ATOM 0 H ARG A 94 28.036 -7.617 0.972 1.00 0.25 H new ATOM 0 HA ARG A 94 28.154 -8.117 -1.927 1.00 0.30 H new ATOM 0 HB2 ARG A 94 29.265 -5.756 -0.390 1.00 0.40 H new ATOM 0 HB3 ARG A 94 28.896 -5.856 -2.100 1.00 0.40 H new ATOM 0 HG2 ARG A 94 26.808 -5.965 0.104 1.00 0.92 H new ATOM 0 HG3 ARG A 94 27.263 -4.505 -0.752 1.00 0.92 H new ATOM 0 HD2 ARG A 94 26.551 -5.544 -2.901 1.00 0.65 H new ATOM 0 HD3 ARG A 94 26.095 -7.003 -2.043 1.00 0.65 H new ATOM 0 HE ARG A 94 24.507 -5.415 -0.710 1.00 0.89 H new ATOM 0 HH11 ARG A 94 25.403 -5.039 -4.103 1.00 1.71 H new ATOM 0 HH12 ARG A 94 23.925 -4.164 -4.514 1.00 1.71 H new ATOM 0 HH21 ARG A 94 22.630 -4.269 -1.232 1.00 1.58 H new ATOM 0 HH22 ARG A 94 22.356 -3.728 -2.891 1.00 1.58 H new ATOM 1496 N ILE A 95 30.489 -9.031 -1.844 1.00 0.35 N ATOM 1497 CA ILE A 95 31.836 -9.579 -1.795 1.00 0.38 C ATOM 1498 C ILE A 95 32.741 -8.851 -2.774 1.00 0.41 C ATOM 1499 O ILE A 95 32.652 -9.043 -3.986 1.00 0.45 O ATOM 1500 CB ILE A 95 31.895 -11.101 -2.098 1.00 0.43 C ATOM 1501 CG1 ILE A 95 31.023 -11.900 -1.125 1.00 0.47 C ATOM 1502 CG2 ILE A 95 33.332 -11.601 -2.029 1.00 0.52 C ATOM 1503 CD1 ILE A 95 29.551 -11.862 -1.457 1.00 0.51 C ATOM 0 H ILE A 95 29.911 -9.390 -2.604 1.00 0.35 H new ATOM 0 HA ILE A 95 32.179 -9.433 -0.771 1.00 0.38 H new ATOM 0 HB ILE A 95 31.508 -11.251 -3.106 1.00 0.43 H new ATOM 0 HG12 ILE A 95 31.358 -12.937 -1.119 1.00 0.47 H new ATOM 0 HG13 ILE A 95 31.169 -11.511 -0.117 1.00 0.47 H new ATOM 0 HG21 ILE A 95 33.356 -12.669 -2.244 1.00 0.52 H new ATOM 0 HG22 ILE A 95 33.938 -11.070 -2.763 1.00 0.52 H new ATOM 0 HG23 ILE A 95 33.732 -11.422 -1.031 1.00 0.52 H new ATOM 0 HD11 ILE A 95 28.998 -12.450 -0.725 1.00 0.51 H new ATOM 0 HD12 ILE A 95 29.200 -10.830 -1.435 1.00 0.51 H new ATOM 0 HD13 ILE A 95 29.391 -12.278 -2.452 1.00 0.51 H new ATOM 1515 N GLU A 96 33.580 -7.981 -2.234 1.00 0.43 N ATOM 1516 CA GLU A 96 34.606 -7.316 -3.013 1.00 0.49 C ATOM 1517 C GLU A 96 35.841 -8.213 -3.046 1.00 0.45 C ATOM 1518 O GLU A 96 35.896 -9.211 -2.322 1.00 0.45 O ATOM 1519 CB GLU A 96 34.940 -5.956 -2.386 1.00 0.55 C ATOM 1520 CG GLU A 96 35.671 -5.004 -3.318 1.00 0.77 C ATOM 1521 CD GLU A 96 36.045 -3.699 -2.643 1.00 0.88 C ATOM 1522 OE1 GLU A 96 35.130 -2.974 -2.202 1.00 1.19 O ATOM 1523 OE2 GLU A 96 37.248 -3.398 -2.541 1.00 1.37 O ATOM 0 H GLU A 96 33.567 -7.719 -1.248 1.00 0.43 H new ATOM 0 HA GLU A 96 34.255 -7.140 -4.030 1.00 0.49 H new ATOM 0 HB2 GLU A 96 34.015 -5.484 -2.055 1.00 0.55 H new ATOM 0 HB3 GLU A 96 35.551 -6.118 -1.498 1.00 0.55 H new ATOM 0 HG2 GLU A 96 36.574 -5.488 -3.690 1.00 0.77 H new ATOM 0 HG3 GLU A 96 35.042 -4.794 -4.183 1.00 0.77 H new ATOM 1530 N SER A 97 36.820 -7.864 -3.866 1.00 0.49 N ATOM 1531 CA SER A 97 38.058 -8.632 -3.970 1.00 0.54 C ATOM 1532 C SER A 97 38.695 -8.875 -2.597 1.00 0.52 C ATOM 1533 O SER A 97 39.215 -9.957 -2.329 1.00 0.59 O ATOM 1534 CB SER A 97 39.036 -7.898 -4.888 1.00 0.64 C ATOM 1535 OG SER A 97 39.112 -6.524 -4.544 1.00 1.00 O ATOM 0 H SER A 97 36.783 -7.047 -4.476 1.00 0.49 H new ATOM 0 HA SER A 97 37.819 -9.608 -4.392 1.00 0.54 H new ATOM 0 HB2 SER A 97 40.024 -8.352 -4.812 1.00 0.64 H new ATOM 0 HB3 SER A 97 38.716 -8.001 -5.925 1.00 0.64 H new ATOM 0 HG SER A 97 39.744 -6.072 -5.141 1.00 1.00 H new ATOM 1541 N MET A 98 38.627 -7.871 -1.726 1.00 0.48 N ATOM 1542 CA MET A 98 39.243 -7.951 -0.403 1.00 0.53 C ATOM 1543 C MET A 98 38.408 -8.788 0.570 1.00 0.49 C ATOM 1544 O MET A 98 38.848 -9.079 1.679 1.00 0.58 O ATOM 1545 CB MET A 98 39.448 -6.544 0.165 1.00 0.59 C ATOM 1546 CG MET A 98 38.151 -5.777 0.376 1.00 0.57 C ATOM 1547 SD MET A 98 38.410 -4.139 1.084 1.00 0.79 S ATOM 1548 CE MET A 98 39.206 -4.556 2.631 1.00 1.79 C ATOM 0 H MET A 98 38.150 -6.989 -1.913 1.00 0.48 H new ATOM 0 HA MET A 98 40.207 -8.445 -0.520 1.00 0.53 H new ATOM 0 HB2 MET A 98 39.975 -6.619 1.116 1.00 0.59 H new ATOM 0 HB3 MET A 98 40.089 -5.978 -0.511 1.00 0.59 H new ATOM 0 HG2 MET A 98 37.635 -5.677 -0.579 1.00 0.57 H new ATOM 0 HG3 MET A 98 37.498 -6.352 1.033 1.00 0.57 H new ATOM 0 HE1 MET A 98 38.851 -3.887 3.415 1.00 1.79 H new ATOM 0 HE2 MET A 98 38.967 -5.586 2.897 1.00 1.79 H new ATOM 0 HE3 MET A 98 40.286 -4.449 2.525 1.00 1.79 H new ATOM 1558 N TYR A 99 37.200 -9.161 0.164 1.00 0.41 N ATOM 1559 CA TYR A 99 36.319 -9.940 1.029 1.00 0.43 C ATOM 1560 C TYR A 99 36.314 -11.404 0.610 1.00 0.49 C ATOM 1561 O TYR A 99 35.886 -12.278 1.372 1.00 0.48 O ATOM 1562 CB TYR A 99 34.890 -9.390 0.994 1.00 0.43 C ATOM 1563 CG TYR A 99 34.766 -7.941 1.423 1.00 0.46 C ATOM 1564 CD1 TYR A 99 35.587 -7.407 2.407 1.00 0.51 C ATOM 1565 CD2 TYR A 99 33.819 -7.107 0.842 1.00 0.53 C ATOM 1566 CE1 TYR A 99 35.469 -6.085 2.796 1.00 0.59 C ATOM 1567 CE2 TYR A 99 33.696 -5.785 1.226 1.00 0.62 C ATOM 1568 CZ TYR A 99 34.522 -5.279 2.204 1.00 0.63 C ATOM 1569 OH TYR A 99 34.400 -3.965 2.589 1.00 0.75 O ATOM 0 H TYR A 99 36.809 -8.939 -0.752 1.00 0.41 H new ATOM 0 HA TYR A 99 36.700 -9.861 2.047 1.00 0.43 H new ATOM 0 HB2 TYR A 99 34.499 -9.491 -0.019 1.00 0.43 H new ATOM 0 HB3 TYR A 99 34.262 -10.003 1.641 1.00 0.43 H new ATOM 0 HD1 TYR A 99 36.330 -8.034 2.877 1.00 0.51 H new ATOM 0 HD2 TYR A 99 33.167 -7.499 0.076 1.00 0.53 H new ATOM 0 HE1 TYR A 99 36.118 -5.686 3.562 1.00 0.59 H new ATOM 0 HE2 TYR A 99 32.955 -5.152 0.761 1.00 0.62 H new ATOM 0 HH TYR A 99 34.084 -3.430 1.831 1.00 0.75 H new ATOM 1579 N GLY A 100 36.792 -11.658 -0.600 1.00 0.60 N ATOM 1580 CA GLY A 100 36.841 -13.007 -1.121 1.00 0.71 C ATOM 1581 C GLY A 100 38.266 -13.433 -1.409 1.00 0.67 C ATOM 1582 O GLY A 100 39.210 -12.812 -0.919 1.00 0.67 O ATOM 0 H GLY A 100 37.150 -10.945 -1.235 1.00 0.60 H new ATOM 0 HA2 GLY A 100 36.392 -13.693 -0.403 1.00 0.71 H new ATOM 0 HA3 GLY A 100 36.249 -13.068 -2.034 1.00 0.71 H new ATOM 1586 N TYR A 101 38.432 -14.485 -2.197 1.00 0.76 N ATOM 1587 CA TYR A 101 39.759 -14.939 -2.582 1.00 0.86 C ATOM 1588 C TYR A 101 40.124 -14.439 -3.969 1.00 0.93 C ATOM 1589 O TYR A 101 39.818 -15.076 -4.977 1.00 1.52 O ATOM 1590 CB TYR A 101 39.859 -16.462 -2.526 1.00 1.01 C ATOM 1591 CG TYR A 101 40.172 -17.000 -1.150 1.00 0.86 C ATOM 1592 CD1 TYR A 101 41.416 -16.780 -0.573 1.00 1.09 C ATOM 1593 CD2 TYR A 101 39.230 -17.722 -0.425 1.00 0.75 C ATOM 1594 CE1 TYR A 101 41.716 -17.264 0.684 1.00 1.14 C ATOM 1595 CE2 TYR A 101 39.525 -18.207 0.837 1.00 0.74 C ATOM 1596 CZ TYR A 101 40.769 -17.973 1.386 1.00 0.92 C ATOM 1597 OH TYR A 101 41.068 -18.444 2.645 1.00 1.09 O ATOM 0 H TYR A 101 37.666 -15.039 -2.581 1.00 0.76 H new ATOM 0 HA TYR A 101 40.468 -14.523 -1.867 1.00 0.86 H new ATOM 0 HB2 TYR A 101 38.918 -16.892 -2.869 1.00 1.01 H new ATOM 0 HB3 TYR A 101 40.632 -16.792 -3.220 1.00 1.01 H new ATOM 0 HD1 TYR A 101 42.162 -16.220 -1.118 1.00 1.09 H new ATOM 0 HD2 TYR A 101 38.256 -17.907 -0.853 1.00 0.75 H new ATOM 0 HE1 TYR A 101 42.690 -17.087 1.115 1.00 1.14 H new ATOM 0 HE2 TYR A 101 38.785 -18.766 1.390 1.00 0.74 H new ATOM 0 HH TYR A 101 40.749 -19.367 2.733 1.00 1.09 H new ATOM 1607 N GLY A 102 40.753 -13.276 -4.015 1.00 1.06 N ATOM 1608 CA GLY A 102 41.201 -12.730 -5.276 1.00 1.21 C ATOM 1609 C GLY A 102 42.693 -12.883 -5.448 1.00 1.78 C ATOM 1610 O GLY A 102 43.205 -12.838 -6.562 1.00 2.30 O ATOM 0 H GLY A 102 40.961 -12.700 -3.200 1.00 1.06 H new ATOM 0 HA2 GLY A 102 40.686 -13.233 -6.095 1.00 1.21 H new ATOM 0 HA3 GLY A 102 40.934 -11.675 -5.332 1.00 1.21 H new ATOM 1614 N ASP A 103 43.387 -13.074 -4.336 1.00 2.37 N ATOM 1615 CA ASP A 103 44.839 -13.204 -4.342 1.00 3.29 C ATOM 1616 C ASP A 103 45.257 -14.591 -4.799 1.00 2.98 C ATOM 1617 O ASP A 103 46.143 -14.747 -5.635 1.00 3.44 O ATOM 1618 CB ASP A 103 45.401 -12.973 -2.938 1.00 4.29 C ATOM 1619 CG ASP A 103 44.727 -11.835 -2.213 1.00 5.21 C ATOM 1620 OD1 ASP A 103 43.584 -12.016 -1.743 1.00 5.86 O ATOM 1621 OD2 ASP A 103 45.331 -10.747 -2.137 1.00 5.54 O ATOM 0 H ASP A 103 42.965 -13.143 -3.410 1.00 2.37 H new ATOM 0 HA ASP A 103 45.232 -12.457 -5.032 1.00 3.29 H new ATOM 0 HB2 ASP A 103 45.289 -13.886 -2.353 1.00 4.29 H new ATOM 0 HB3 ASP A 103 46.469 -12.769 -3.009 1.00 4.29 H new ATOM 1626 N GLU A 104 44.615 -15.596 -4.225 1.00 2.45 N ATOM 1627 CA GLU A 104 45.010 -16.978 -4.440 1.00 2.35 C ATOM 1628 C GLU A 104 44.334 -17.564 -5.681 1.00 1.99 C ATOM 1629 O GLU A 104 44.768 -18.584 -6.213 1.00 2.35 O ATOM 1630 CB GLU A 104 44.678 -17.798 -3.192 1.00 2.63 C ATOM 1631 CG GLU A 104 45.251 -19.201 -3.203 1.00 2.96 C ATOM 1632 CD GLU A 104 45.110 -19.883 -1.861 1.00 3.62 C ATOM 1633 OE1 GLU A 104 44.046 -20.477 -1.606 1.00 4.27 O ATOM 1634 OE2 GLU A 104 46.062 -19.821 -1.052 1.00 3.81 O ATOM 0 H GLU A 104 43.814 -15.479 -3.604 1.00 2.45 H new ATOM 0 HA GLU A 104 46.085 -17.015 -4.616 1.00 2.35 H new ATOM 0 HB2 GLU A 104 45.052 -17.271 -2.314 1.00 2.63 H new ATOM 0 HB3 GLU A 104 43.595 -17.860 -3.089 1.00 2.63 H new ATOM 0 HG2 GLU A 104 44.744 -19.793 -3.965 1.00 2.96 H new ATOM 0 HG3 GLU A 104 46.305 -19.160 -3.479 1.00 2.96 H new ATOM 1641 N GLY A 105 43.269 -16.917 -6.135 1.00 1.73 N ATOM 1642 CA GLY A 105 42.618 -17.334 -7.364 1.00 2.16 C ATOM 1643 C GLY A 105 41.537 -18.372 -7.145 1.00 1.86 C ATOM 1644 O GLY A 105 40.757 -18.663 -8.053 1.00 1.83 O ATOM 0 H GLY A 105 42.844 -16.112 -5.676 1.00 1.73 H new ATOM 0 HA2 GLY A 105 42.182 -16.462 -7.850 1.00 2.16 H new ATOM 0 HA3 GLY A 105 43.367 -17.737 -8.045 1.00 2.16 H new ATOM 1648 N CYS A 106 41.488 -18.931 -5.944 1.00 2.02 N ATOM 1649 CA CYS A 106 40.507 -19.954 -5.614 1.00 1.91 C ATOM 1650 C CYS A 106 39.100 -19.358 -5.513 1.00 1.52 C ATOM 1651 O CYS A 106 38.718 -18.783 -4.494 1.00 1.85 O ATOM 1652 CB CYS A 106 40.905 -20.660 -4.315 1.00 2.62 C ATOM 1653 SG CYS A 106 41.558 -19.554 -3.041 1.00 3.34 S ATOM 0 H CYS A 106 42.119 -18.692 -5.179 1.00 2.02 H new ATOM 0 HA CYS A 106 40.489 -20.691 -6.417 1.00 1.91 H new ATOM 0 HB2 CYS A 106 40.035 -21.181 -3.917 1.00 2.62 H new ATOM 0 HB3 CYS A 106 41.655 -21.418 -4.541 1.00 2.62 H new ATOM 0 HG CYS A 106 42.622 -20.081 -2.513 1.00 3.34 H new ATOM 1659 N GLY A 107 38.342 -19.481 -6.594 1.00 1.20 N ATOM 1660 CA GLY A 107 36.983 -18.992 -6.607 1.00 1.16 C ATOM 1661 C GLY A 107 36.020 -20.035 -7.119 1.00 1.09 C ATOM 1662 O GLY A 107 36.385 -20.865 -7.950 1.00 1.19 O ATOM 0 H GLY A 107 38.649 -19.914 -7.465 1.00 1.20 H new ATOM 0 HA2 GLY A 107 36.694 -18.693 -5.599 1.00 1.16 H new ATOM 0 HA3 GLY A 107 36.922 -18.102 -7.233 1.00 1.16 H new ATOM 1666 N GLU A 108 34.793 -19.996 -6.622 1.00 1.15 N ATOM 1667 CA GLU A 108 33.794 -20.998 -6.967 1.00 1.27 C ATOM 1668 C GLU A 108 33.178 -20.738 -8.340 1.00 1.10 C ATOM 1669 O GLU A 108 33.417 -21.487 -9.288 1.00 1.19 O ATOM 1670 CB GLU A 108 32.702 -21.034 -5.899 1.00 1.53 C ATOM 1671 CG GLU A 108 33.223 -21.396 -4.519 1.00 1.74 C ATOM 1672 CD GLU A 108 33.832 -22.783 -4.482 1.00 2.49 C ATOM 1673 OE1 GLU A 108 35.034 -22.910 -4.779 1.00 3.08 O ATOM 1674 OE2 GLU A 108 33.110 -23.748 -4.146 1.00 3.02 O ATOM 0 H GLU A 108 34.464 -19.279 -5.976 1.00 1.15 H new ATOM 0 HA GLU A 108 34.295 -21.965 -7.010 1.00 1.27 H new ATOM 0 HB2 GLU A 108 32.217 -20.059 -5.852 1.00 1.53 H new ATOM 0 HB3 GLU A 108 31.940 -21.756 -6.193 1.00 1.53 H new ATOM 0 HG2 GLU A 108 33.970 -20.665 -4.212 1.00 1.74 H new ATOM 0 HG3 GLU A 108 32.407 -21.340 -3.798 1.00 1.74 H new ATOM 1681 N SER A 109 32.389 -19.672 -8.446 1.00 0.97 N ATOM 1682 CA SER A 109 31.672 -19.387 -9.680 1.00 0.88 C ATOM 1683 C SER A 109 32.507 -18.518 -10.624 1.00 0.77 C ATOM 1684 O SER A 109 33.057 -19.018 -11.603 1.00 0.85 O ATOM 1685 CB SER A 109 30.346 -18.701 -9.354 1.00 0.92 C ATOM 1686 OG SER A 109 29.680 -19.377 -8.300 1.00 1.52 O ATOM 0 H SER A 109 32.232 -18.997 -7.697 1.00 0.97 H new ATOM 0 HA SER A 109 31.476 -20.330 -10.191 1.00 0.88 H new ATOM 0 HB2 SER A 109 30.527 -17.664 -9.071 1.00 0.92 H new ATOM 0 HB3 SER A 109 29.712 -18.684 -10.240 1.00 0.92 H new ATOM 0 HG SER A 109 28.861 -18.892 -8.066 1.00 1.52 H new ATOM 1692 N ILE A 110 32.633 -17.226 -10.310 1.00 0.68 N ATOM 1693 CA ILE A 110 33.413 -16.304 -11.143 1.00 0.65 C ATOM 1694 C ILE A 110 34.078 -15.213 -10.299 1.00 0.63 C ATOM 1695 O ILE A 110 33.448 -14.222 -9.932 1.00 0.75 O ATOM 1696 CB ILE A 110 32.585 -15.629 -12.284 1.00 0.64 C ATOM 1697 CG1 ILE A 110 31.272 -15.007 -11.771 1.00 0.66 C ATOM 1698 CG2 ILE A 110 32.307 -16.616 -13.410 1.00 0.72 C ATOM 1699 CD1 ILE A 110 30.131 -15.988 -11.574 1.00 0.74 C ATOM 0 H ILE A 110 32.208 -16.795 -9.489 1.00 0.68 H new ATOM 0 HA ILE A 110 34.172 -16.929 -11.614 1.00 0.65 H new ATOM 0 HB ILE A 110 33.194 -14.814 -12.674 1.00 0.64 H new ATOM 0 HG12 ILE A 110 31.470 -14.508 -10.822 1.00 0.66 H new ATOM 0 HG13 ILE A 110 30.953 -14.238 -12.475 1.00 0.66 H new ATOM 0 HG21 ILE A 110 31.730 -16.123 -14.192 1.00 0.72 H new ATOM 0 HG22 ILE A 110 33.251 -16.970 -13.825 1.00 0.72 H new ATOM 0 HG23 ILE A 110 31.741 -17.462 -13.021 1.00 0.72 H new ATOM 0 HD11 ILE A 110 29.252 -15.455 -11.211 1.00 0.74 H new ATOM 0 HD12 ILE A 110 29.898 -16.470 -12.523 1.00 0.74 H new ATOM 0 HD13 ILE A 110 30.423 -16.744 -10.845 1.00 0.74 H new ATOM 1711 N PRO A 111 35.356 -15.409 -9.943 1.00 0.70 N ATOM 1712 CA PRO A 111 36.151 -14.395 -9.263 1.00 0.78 C ATOM 1713 C PRO A 111 36.920 -13.513 -10.253 1.00 0.79 C ATOM 1714 O PRO A 111 36.623 -13.503 -11.450 1.00 1.58 O ATOM 1715 CB PRO A 111 37.115 -15.251 -8.447 1.00 1.10 C ATOM 1716 CG PRO A 111 37.368 -16.447 -9.309 1.00 1.22 C ATOM 1717 CD PRO A 111 36.126 -16.651 -10.150 1.00 0.89 C ATOM 0 HA PRO A 111 35.552 -13.700 -8.674 1.00 0.78 H new ATOM 0 HB2 PRO A 111 38.039 -14.714 -8.231 1.00 1.10 H new ATOM 0 HB3 PRO A 111 36.680 -15.536 -7.489 1.00 1.10 H new ATOM 0 HG2 PRO A 111 38.242 -16.290 -9.942 1.00 1.22 H new ATOM 0 HG3 PRO A 111 37.571 -17.327 -8.699 1.00 1.22 H new ATOM 0 HD2 PRO A 111 36.374 -16.798 -11.201 1.00 0.89 H new ATOM 0 HD3 PRO A 111 35.565 -17.528 -9.829 1.00 0.89 H new ATOM 1725 N GLY A 112 37.912 -12.783 -9.756 1.00 0.95 N ATOM 1726 CA GLY A 112 38.748 -11.984 -10.635 1.00 1.02 C ATOM 1727 C GLY A 112 38.740 -10.508 -10.291 1.00 1.09 C ATOM 1728 O GLY A 112 38.525 -9.669 -11.163 1.00 2.05 O ATOM 0 H GLY A 112 38.152 -12.729 -8.766 1.00 0.95 H new ATOM 0 HA2 GLY A 112 39.772 -12.355 -10.588 1.00 1.02 H new ATOM 0 HA3 GLY A 112 38.409 -12.112 -11.663 1.00 1.02 H new ATOM 1732 N ASN A 113 38.971 -10.195 -9.014 1.00 0.74 N ATOM 1733 CA ASN A 113 39.022 -8.804 -8.534 1.00 0.84 C ATOM 1734 C ASN A 113 37.674 -8.099 -8.723 1.00 0.75 C ATOM 1735 O ASN A 113 37.583 -6.874 -8.654 1.00 1.00 O ATOM 1736 CB ASN A 113 40.135 -8.014 -9.243 1.00 1.00 C ATOM 1737 CG ASN A 113 41.517 -8.579 -8.973 1.00 1.49 C ATOM 1738 OD1 ASN A 113 41.996 -9.453 -9.695 1.00 2.03 O ATOM 1739 ND2 ASN A 113 42.177 -8.071 -7.944 1.00 1.79 N ATOM 0 H ASN A 113 39.128 -10.890 -8.284 1.00 0.74 H new ATOM 0 HA ASN A 113 39.245 -8.838 -7.468 1.00 0.84 H new ATOM 0 HB2 ASN A 113 39.949 -8.017 -10.317 1.00 1.00 H new ATOM 0 HB3 ASN A 113 40.102 -6.975 -8.916 1.00 1.00 H new ATOM 0 HD21 ASN A 113 43.117 -8.403 -7.727 1.00 1.79 H new ATOM 0 HD22 ASN A 113 41.746 -7.347 -7.369 1.00 1.79 H new ATOM 1746 N SER A 114 36.632 -8.891 -8.927 1.00 0.57 N ATOM 1747 CA SER A 114 35.299 -8.376 -9.180 1.00 0.58 C ATOM 1748 C SER A 114 34.479 -8.298 -7.892 1.00 0.50 C ATOM 1749 O SER A 114 34.939 -8.699 -6.822 1.00 0.59 O ATOM 1750 CB SER A 114 34.622 -9.284 -10.210 1.00 0.65 C ATOM 1751 OG SER A 114 34.848 -10.652 -9.895 1.00 1.14 O ATOM 0 H SER A 114 36.689 -9.909 -8.921 1.00 0.57 H new ATOM 0 HA SER A 114 35.367 -7.360 -9.570 1.00 0.58 H new ATOM 0 HB2 SER A 114 33.551 -9.082 -10.233 1.00 0.65 H new ATOM 0 HB3 SER A 114 35.009 -9.066 -11.205 1.00 0.65 H new ATOM 0 HG SER A 114 34.407 -11.218 -10.562 1.00 1.14 H new ATOM 1757 N VAL A 115 33.273 -7.756 -7.999 1.00 0.44 N ATOM 1758 CA VAL A 115 32.376 -7.670 -6.858 1.00 0.38 C ATOM 1759 C VAL A 115 31.141 -8.539 -7.091 1.00 0.31 C ATOM 1760 O VAL A 115 30.477 -8.441 -8.132 1.00 0.31 O ATOM 1761 CB VAL A 115 31.961 -6.207 -6.553 1.00 0.44 C ATOM 1762 CG1 VAL A 115 31.346 -5.536 -7.775 1.00 0.48 C ATOM 1763 CG2 VAL A 115 31.009 -6.151 -5.364 1.00 0.42 C ATOM 0 H VAL A 115 32.895 -7.370 -8.864 1.00 0.44 H new ATOM 0 HA VAL A 115 32.916 -8.041 -5.987 1.00 0.38 H new ATOM 0 HB VAL A 115 32.864 -5.654 -6.294 1.00 0.44 H new ATOM 0 HG11 VAL A 115 31.067 -4.512 -7.526 1.00 0.48 H new ATOM 0 HG12 VAL A 115 32.071 -5.527 -8.589 1.00 0.48 H new ATOM 0 HG13 VAL A 115 30.459 -6.089 -8.086 1.00 0.48 H new ATOM 0 HG21 VAL A 115 30.732 -5.115 -5.169 1.00 0.42 H new ATOM 0 HG22 VAL A 115 30.113 -6.731 -5.587 1.00 0.42 H new ATOM 0 HG23 VAL A 115 31.500 -6.567 -4.485 1.00 0.42 H new ATOM 1773 N LEU A 116 30.851 -9.405 -6.132 1.00 0.28 N ATOM 1774 CA LEU A 116 29.735 -10.330 -6.252 1.00 0.25 C ATOM 1775 C LEU A 116 28.735 -10.132 -5.118 1.00 0.28 C ATOM 1776 O LEU A 116 29.012 -9.420 -4.156 1.00 0.37 O ATOM 1777 CB LEU A 116 30.219 -11.790 -6.237 1.00 0.30 C ATOM 1778 CG LEU A 116 31.095 -12.234 -7.414 1.00 0.33 C ATOM 1779 CD1 LEU A 116 32.528 -11.745 -7.254 1.00 0.51 C ATOM 1780 CD2 LEU A 116 31.060 -13.748 -7.557 1.00 0.50 C ATOM 0 H LEU A 116 31.374 -9.486 -5.260 1.00 0.28 H new ATOM 0 HA LEU A 116 29.249 -10.121 -7.205 1.00 0.25 H new ATOM 0 HB2 LEU A 116 30.777 -11.955 -5.315 1.00 0.30 H new ATOM 0 HB3 LEU A 116 29.344 -12.439 -6.200 1.00 0.30 H new ATOM 0 HG LEU A 116 30.691 -11.786 -8.322 1.00 0.33 H new ATOM 0 HD11 LEU A 116 33.123 -12.077 -8.105 1.00 0.51 H new ATOM 0 HD12 LEU A 116 32.538 -10.656 -7.207 1.00 0.51 H new ATOM 0 HD13 LEU A 116 32.951 -12.152 -6.335 1.00 0.51 H new ATOM 0 HD21 LEU A 116 31.687 -14.049 -8.397 1.00 0.50 H new ATOM 0 HD22 LEU A 116 31.433 -14.209 -6.642 1.00 0.50 H new ATOM 0 HD23 LEU A 116 30.035 -14.073 -7.734 1.00 0.50 H new ATOM 1792 N LEU A 117 27.574 -10.771 -5.237 1.00 0.31 N ATOM 1793 CA LEU A 117 26.569 -10.746 -4.183 1.00 0.38 C ATOM 1794 C LEU A 117 26.143 -12.166 -3.871 1.00 0.31 C ATOM 1795 O LEU A 117 25.752 -12.911 -4.772 1.00 0.38 O ATOM 1796 CB LEU A 117 25.321 -9.953 -4.592 1.00 0.61 C ATOM 1797 CG LEU A 117 25.558 -8.689 -5.417 1.00 0.38 C ATOM 1798 CD1 LEU A 117 25.533 -9.014 -6.901 1.00 0.70 C ATOM 1799 CD2 LEU A 117 24.520 -7.635 -5.090 1.00 0.59 C ATOM 0 H LEU A 117 27.307 -11.314 -6.058 1.00 0.31 H new ATOM 0 HA LEU A 117 27.017 -10.262 -3.315 1.00 0.38 H new ATOM 0 HB2 LEU A 117 24.667 -10.614 -5.161 1.00 0.61 H new ATOM 0 HB3 LEU A 117 24.782 -9.674 -3.687 1.00 0.61 H new ATOM 0 HG LEU A 117 26.541 -8.293 -5.163 1.00 0.38 H new ATOM 0 HD11 LEU A 117 25.703 -8.104 -7.476 1.00 0.70 H new ATOM 0 HD12 LEU A 117 26.315 -9.738 -7.128 1.00 0.70 H new ATOM 0 HD13 LEU A 117 24.562 -9.434 -7.165 1.00 0.70 H new ATOM 0 HD21 LEU A 117 24.706 -6.743 -5.688 1.00 0.59 H new ATOM 0 HD22 LEU A 117 23.526 -8.021 -5.315 1.00 0.59 H new ATOM 0 HD23 LEU A 117 24.580 -7.381 -4.032 1.00 0.59 H new ATOM 1811 N PHE A 118 26.219 -12.548 -2.611 1.00 0.30 N ATOM 1812 CA PHE A 118 25.767 -13.867 -2.205 1.00 0.34 C ATOM 1813 C PHE A 118 24.630 -13.772 -1.199 1.00 0.34 C ATOM 1814 O PHE A 118 24.752 -13.117 -0.159 1.00 0.37 O ATOM 1815 CB PHE A 118 26.916 -14.696 -1.621 1.00 0.43 C ATOM 1816 CG PHE A 118 27.932 -15.129 -2.642 1.00 0.37 C ATOM 1817 CD1 PHE A 118 27.533 -15.572 -3.895 1.00 0.39 C ATOM 1818 CD2 PHE A 118 29.285 -15.111 -2.345 1.00 0.38 C ATOM 1819 CE1 PHE A 118 28.463 -15.976 -4.830 1.00 0.38 C ATOM 1820 CE2 PHE A 118 30.220 -15.513 -3.279 1.00 0.40 C ATOM 1821 CZ PHE A 118 29.808 -15.950 -4.522 1.00 0.38 C ATOM 0 H PHE A 118 26.586 -11.970 -1.855 1.00 0.30 H new ATOM 0 HA PHE A 118 25.400 -14.371 -3.099 1.00 0.34 H new ATOM 0 HB2 PHE A 118 27.417 -14.112 -0.849 1.00 0.43 H new ATOM 0 HB3 PHE A 118 26.503 -15.580 -1.135 1.00 0.43 H new ATOM 0 HD1 PHE A 118 26.482 -15.601 -4.141 1.00 0.39 H new ATOM 0 HD2 PHE A 118 29.613 -14.779 -1.371 1.00 0.38 H new ATOM 0 HE1 PHE A 118 28.139 -16.313 -5.803 1.00 0.38 H new ATOM 0 HE2 PHE A 118 31.272 -15.485 -3.037 1.00 0.40 H new ATOM 0 HZ PHE A 118 30.537 -16.271 -5.252 1.00 0.38 H new ATOM 1831 N GLU A 119 23.517 -14.406 -1.535 1.00 0.33 N ATOM 1832 CA GLU A 119 22.441 -14.601 -0.589 1.00 0.37 C ATOM 1833 C GLU A 119 22.884 -15.636 0.424 1.00 0.34 C ATOM 1834 O GLU A 119 23.199 -16.770 0.057 1.00 0.47 O ATOM 1835 CB GLU A 119 21.169 -15.097 -1.287 1.00 0.56 C ATOM 1836 CG GLU A 119 20.591 -14.131 -2.305 1.00 0.82 C ATOM 1837 CD GLU A 119 19.407 -14.723 -3.046 1.00 1.18 C ATOM 1838 OE1 GLU A 119 18.423 -15.120 -2.383 1.00 1.46 O ATOM 1839 OE2 GLU A 119 19.445 -14.791 -4.290 1.00 1.43 O ATOM 0 H GLU A 119 23.340 -14.794 -2.461 1.00 0.33 H new ATOM 0 HA GLU A 119 22.215 -13.649 -0.108 1.00 0.37 H new ATOM 0 HB2 GLU A 119 21.388 -16.041 -1.785 1.00 0.56 H new ATOM 0 HB3 GLU A 119 20.412 -15.304 -0.531 1.00 0.56 H new ATOM 0 HG2 GLU A 119 20.281 -13.216 -1.800 1.00 0.82 H new ATOM 0 HG3 GLU A 119 21.365 -13.854 -3.021 1.00 0.82 H new ATOM 1846 N ILE A 120 22.934 -15.252 1.680 1.00 0.29 N ATOM 1847 CA ILE A 120 23.316 -16.176 2.722 1.00 0.31 C ATOM 1848 C ILE A 120 22.094 -16.567 3.523 1.00 0.31 C ATOM 1849 O ILE A 120 21.436 -15.725 4.140 1.00 0.33 O ATOM 1850 CB ILE A 120 24.411 -15.596 3.639 1.00 0.34 C ATOM 1851 CG1 ILE A 120 25.727 -15.499 2.858 1.00 0.33 C ATOM 1852 CG2 ILE A 120 24.581 -16.452 4.890 1.00 0.48 C ATOM 1853 CD1 ILE A 120 26.896 -14.993 3.674 1.00 0.39 C ATOM 0 H ILE A 120 22.716 -14.309 2.003 1.00 0.29 H new ATOM 0 HA ILE A 120 23.740 -17.063 2.250 1.00 0.31 H new ATOM 0 HB ILE A 120 24.115 -14.598 3.963 1.00 0.34 H new ATOM 0 HG12 ILE A 120 25.974 -16.484 2.461 1.00 0.33 H new ATOM 0 HG13 ILE A 120 25.582 -14.838 2.003 1.00 0.33 H new ATOM 0 HG21 ILE A 120 25.359 -16.023 5.522 1.00 0.48 H new ATOM 0 HG22 ILE A 120 23.641 -16.481 5.441 1.00 0.48 H new ATOM 0 HG23 ILE A 120 24.865 -17.464 4.602 1.00 0.48 H new ATOM 0 HD11 ILE A 120 27.787 -14.954 3.048 1.00 0.39 H new ATOM 0 HD12 ILE A 120 26.673 -13.994 4.049 1.00 0.39 H new ATOM 0 HD13 ILE A 120 27.072 -15.665 4.514 1.00 0.39 H new ATOM 1865 N GLU A 121 21.772 -17.847 3.453 1.00 0.36 N ATOM 1866 CA GLU A 121 20.583 -18.380 4.084 1.00 0.40 C ATOM 1867 C GLU A 121 20.965 -19.561 4.974 1.00 0.35 C ATOM 1868 O GLU A 121 21.535 -20.554 4.504 1.00 0.40 O ATOM 1869 CB GLU A 121 19.589 -18.792 2.994 1.00 0.60 C ATOM 1870 CG GLU A 121 18.137 -18.859 3.448 1.00 1.06 C ATOM 1871 CD GLU A 121 17.175 -18.933 2.276 1.00 1.43 C ATOM 1872 OE1 GLU A 121 16.738 -17.870 1.784 1.00 1.88 O ATOM 1873 OE2 GLU A 121 16.838 -20.059 1.846 1.00 1.67 O ATOM 0 H GLU A 121 22.328 -18.543 2.957 1.00 0.36 H new ATOM 0 HA GLU A 121 20.111 -17.627 4.715 1.00 0.40 H new ATOM 0 HB2 GLU A 121 19.664 -18.086 2.167 1.00 0.60 H new ATOM 0 HB3 GLU A 121 19.880 -19.769 2.607 1.00 0.60 H new ATOM 0 HG2 GLU A 121 17.997 -19.731 4.087 1.00 1.06 H new ATOM 0 HG3 GLU A 121 17.905 -17.981 4.052 1.00 1.06 H new ATOM 1880 N LEU A 122 20.684 -19.427 6.263 1.00 0.33 N ATOM 1881 CA LEU A 122 21.053 -20.435 7.245 1.00 0.33 C ATOM 1882 C LEU A 122 19.917 -21.440 7.403 1.00 0.38 C ATOM 1883 O LEU A 122 18.815 -21.082 7.812 1.00 0.54 O ATOM 1884 CB LEU A 122 21.389 -19.744 8.579 1.00 0.38 C ATOM 1885 CG LEU A 122 22.023 -20.621 9.670 1.00 0.43 C ATOM 1886 CD1 LEU A 122 22.758 -19.750 10.671 1.00 0.80 C ATOM 1887 CD2 LEU A 122 20.970 -21.446 10.391 1.00 1.12 C ATOM 0 H LEU A 122 20.197 -18.621 6.655 1.00 0.33 H new ATOM 0 HA LEU A 122 21.935 -20.981 6.911 1.00 0.33 H new ATOM 0 HB2 LEU A 122 22.067 -18.916 8.372 1.00 0.38 H new ATOM 0 HB3 LEU A 122 20.471 -19.313 8.979 1.00 0.38 H new ATOM 0 HG LEU A 122 22.726 -21.302 9.190 1.00 0.43 H new ATOM 0 HD11 LEU A 122 23.205 -20.379 11.441 1.00 0.80 H new ATOM 0 HD12 LEU A 122 23.541 -19.190 10.160 1.00 0.80 H new ATOM 0 HD13 LEU A 122 22.057 -19.054 11.132 1.00 0.80 H new ATOM 0 HD21 LEU A 122 21.448 -22.057 11.157 1.00 1.12 H new ATOM 0 HD22 LEU A 122 20.243 -20.781 10.858 1.00 1.12 H new ATOM 0 HD23 LEU A 122 20.462 -22.093 9.676 1.00 1.12 H new ATOM 1899 N LEU A 123 20.183 -22.696 7.066 1.00 0.39 N ATOM 1900 CA LEU A 123 19.154 -23.724 7.130 1.00 0.47 C ATOM 1901 C LEU A 123 19.269 -24.559 8.405 1.00 0.47 C ATOM 1902 O LEU A 123 18.287 -25.152 8.852 1.00 0.59 O ATOM 1903 CB LEU A 123 19.205 -24.614 5.878 1.00 0.55 C ATOM 1904 CG LEU A 123 20.555 -25.274 5.571 1.00 0.58 C ATOM 1905 CD1 LEU A 123 20.716 -26.581 6.333 1.00 1.00 C ATOM 1906 CD2 LEU A 123 20.701 -25.507 4.078 1.00 0.77 C ATOM 0 H LEU A 123 21.095 -23.025 6.748 1.00 0.39 H new ATOM 0 HA LEU A 123 18.185 -23.226 7.159 1.00 0.47 H new ATOM 0 HB2 LEU A 123 18.456 -25.399 5.985 1.00 0.55 H new ATOM 0 HB3 LEU A 123 18.915 -24.012 5.017 1.00 0.55 H new ATOM 0 HG LEU A 123 21.344 -24.597 5.899 1.00 0.58 H new ATOM 0 HD11 LEU A 123 21.683 -27.025 6.094 1.00 1.00 H new ATOM 0 HD12 LEU A 123 20.660 -26.387 7.404 1.00 1.00 H new ATOM 0 HD13 LEU A 123 19.920 -27.269 6.047 1.00 1.00 H new ATOM 0 HD21 LEU A 123 21.664 -25.976 3.875 1.00 0.77 H new ATOM 0 HD22 LEU A 123 19.900 -26.159 3.731 1.00 0.77 H new ATOM 0 HD23 LEU A 123 20.645 -24.553 3.554 1.00 0.77 H new ATOM 1918 N SER A 124 20.464 -24.604 8.989 1.00 0.44 N ATOM 1919 CA SER A 124 20.681 -25.346 10.225 1.00 0.47 C ATOM 1920 C SER A 124 21.992 -24.924 10.880 1.00 0.43 C ATOM 1921 O SER A 124 22.923 -24.469 10.206 1.00 0.48 O ATOM 1922 CB SER A 124 20.685 -26.856 9.960 1.00 0.63 C ATOM 1923 OG SER A 124 20.729 -27.584 11.174 1.00 1.19 O ATOM 0 H SER A 124 21.294 -24.136 8.626 1.00 0.44 H new ATOM 0 HA SER A 124 19.860 -25.117 10.905 1.00 0.47 H new ATOM 0 HB2 SER A 124 19.793 -27.133 9.398 1.00 0.63 H new ATOM 0 HB3 SER A 124 21.544 -27.118 9.343 1.00 0.63 H new ATOM 0 HG SER A 124 20.729 -28.545 10.980 1.00 1.19 H new ATOM 1929 N PHE A 125 22.052 -25.078 12.196 1.00 0.39 N ATOM 1930 CA PHE A 125 23.220 -24.698 12.976 1.00 0.43 C ATOM 1931 C PHE A 125 23.176 -25.390 14.334 1.00 0.46 C ATOM 1932 O PHE A 125 22.229 -26.119 14.634 1.00 0.46 O ATOM 1933 CB PHE A 125 23.284 -23.171 13.166 1.00 0.46 C ATOM 1934 CG PHE A 125 22.235 -22.599 14.089 1.00 0.46 C ATOM 1935 CD1 PHE A 125 20.927 -23.052 14.055 1.00 0.44 C ATOM 1936 CD2 PHE A 125 22.566 -21.596 14.989 1.00 0.62 C ATOM 1937 CE1 PHE A 125 19.968 -22.520 14.893 1.00 0.54 C ATOM 1938 CE2 PHE A 125 21.612 -21.059 15.832 1.00 0.72 C ATOM 1939 CZ PHE A 125 20.312 -21.524 15.787 1.00 0.67 C ATOM 0 H PHE A 125 21.292 -25.470 12.752 1.00 0.39 H new ATOM 0 HA PHE A 125 24.113 -25.011 12.436 1.00 0.43 H new ATOM 0 HB2 PHE A 125 24.269 -22.909 13.553 1.00 0.46 H new ATOM 0 HB3 PHE A 125 23.187 -22.694 12.191 1.00 0.46 H new ATOM 0 HD1 PHE A 125 20.653 -23.834 13.362 1.00 0.44 H new ATOM 0 HD2 PHE A 125 23.581 -21.231 15.031 1.00 0.62 H new ATOM 0 HE1 PHE A 125 18.951 -22.881 14.850 1.00 0.54 H new ATOM 0 HE2 PHE A 125 21.882 -20.276 16.525 1.00 0.72 H new ATOM 0 HZ PHE A 125 19.566 -21.110 16.449 1.00 0.67 H new ATOM 1949 N ARG A 126 24.194 -25.158 15.147 1.00 0.60 N ATOM 1950 CA ARG A 126 24.237 -25.715 16.486 1.00 0.71 C ATOM 1951 C ARG A 126 25.033 -24.801 17.406 1.00 0.76 C ATOM 1952 O ARG A 126 26.070 -24.258 17.016 1.00 0.90 O ATOM 1953 CB ARG A 126 24.848 -27.116 16.463 1.00 0.83 C ATOM 1954 CG ARG A 126 26.261 -27.155 15.905 1.00 0.85 C ATOM 1955 CD ARG A 126 26.824 -28.567 15.888 1.00 1.12 C ATOM 1956 NE ARG A 126 26.760 -29.209 17.200 1.00 1.57 N ATOM 1957 CZ ARG A 126 27.309 -30.390 17.477 1.00 2.14 C ATOM 1958 NH1 ARG A 126 28.054 -31.016 16.577 1.00 2.47 N ATOM 1959 NH2 ARG A 126 27.134 -30.940 18.667 1.00 2.98 N ATOM 0 H ARG A 126 25.002 -24.586 14.901 1.00 0.60 H new ATOM 0 HA ARG A 126 23.218 -25.793 16.866 1.00 0.71 H new ATOM 0 HB2 ARG A 126 24.856 -27.517 17.477 1.00 0.83 H new ATOM 0 HB3 ARG A 126 24.213 -27.771 15.866 1.00 0.83 H new ATOM 0 HG2 ARG A 126 26.263 -26.751 14.893 1.00 0.85 H new ATOM 0 HG3 ARG A 126 26.906 -26.514 16.505 1.00 0.85 H new ATOM 0 HD2 ARG A 126 26.271 -29.167 15.166 1.00 1.12 H new ATOM 0 HD3 ARG A 126 27.860 -28.538 15.551 1.00 1.12 H new ATOM 0 HE ARG A 126 26.265 -28.723 17.948 1.00 1.57 H new ATOM 0 HH11 ARG A 126 28.211 -30.593 15.662 1.00 2.47 H new ATOM 0 HH12 ARG A 126 28.470 -31.920 16.799 1.00 2.47 H new ATOM 0 HH21 ARG A 126 26.578 -30.459 19.374 1.00 2.98 H new ATOM 0 HH22 ARG A 126 27.555 -31.845 18.878 1.00 2.98 H new ATOM 1973 N GLU A 127 24.531 -24.611 18.613 1.00 0.82 N ATOM 1974 CA GLU A 127 25.205 -23.774 19.591 1.00 0.88 C ATOM 1975 C GLU A 127 25.973 -24.628 20.585 1.00 1.01 C ATOM 1976 O GLU A 127 25.625 -25.786 20.823 1.00 1.11 O ATOM 1977 CB GLU A 127 24.211 -22.885 20.333 1.00 1.10 C ATOM 1978 CG GLU A 127 23.501 -21.884 19.437 1.00 1.68 C ATOM 1979 CD GLU A 127 22.567 -20.980 20.212 1.00 2.69 C ATOM 1980 OE1 GLU A 127 21.664 -21.506 20.884 1.00 3.18 O ATOM 1981 OE2 GLU A 127 22.747 -19.742 20.158 1.00 3.38 O ATOM 0 H GLU A 127 23.658 -25.025 18.940 1.00 0.82 H new ATOM 0 HA GLU A 127 25.906 -23.135 19.054 1.00 0.88 H new ATOM 0 HB2 GLU A 127 23.467 -23.515 20.820 1.00 1.10 H new ATOM 0 HB3 GLU A 127 24.737 -22.345 21.121 1.00 1.10 H new ATOM 0 HG2 GLU A 127 24.242 -21.277 18.916 1.00 1.68 H new ATOM 0 HG3 GLU A 127 22.935 -22.420 18.675 1.00 1.68 H new ATOM 1988 N LEU A 128 27.028 -24.056 21.144 1.00 1.18 N ATOM 1989 CA LEU A 128 27.861 -24.752 22.112 1.00 1.39 C ATOM 1990 C LEU A 128 28.628 -23.720 22.928 1.00 1.83 C ATOM 1991 O LEU A 128 29.419 -22.955 22.380 1.00 2.41 O ATOM 1992 CB LEU A 128 28.823 -25.714 21.389 1.00 1.95 C ATOM 1993 CG LEU A 128 29.501 -26.780 22.260 1.00 2.44 C ATOM 1994 CD1 LEU A 128 30.024 -27.911 21.389 1.00 2.79 C ATOM 1995 CD2 LEU A 128 30.645 -26.182 23.065 1.00 3.35 C ATOM 0 H LEU A 128 27.329 -23.103 20.941 1.00 1.18 H new ATOM 0 HA LEU A 128 27.240 -25.347 22.782 1.00 1.39 H new ATOM 0 HB2 LEU A 128 28.270 -26.220 20.598 1.00 1.95 H new ATOM 0 HB3 LEU A 128 29.600 -25.122 20.906 1.00 1.95 H new ATOM 0 HG LEU A 128 28.758 -27.171 22.955 1.00 2.44 H new ATOM 0 HD11 LEU A 128 30.503 -28.662 22.017 1.00 2.79 H new ATOM 0 HD12 LEU A 128 29.195 -28.366 20.847 1.00 2.79 H new ATOM 0 HD13 LEU A 128 30.749 -27.517 20.677 1.00 2.79 H new ATOM 0 HD21 LEU A 128 31.107 -26.960 23.673 1.00 3.35 H new ATOM 0 HD22 LEU A 128 31.387 -25.763 22.386 1.00 3.35 H new ATOM 0 HD23 LEU A 128 30.261 -25.395 23.714 1.00 3.35 H new ATOM 2007 N GLU A 129 28.370 -23.679 24.227 1.00 2.29 N ATOM 2008 CA GLU A 129 29.036 -22.722 25.099 1.00 3.05 C ATOM 2009 C GLU A 129 30.311 -23.339 25.668 1.00 3.49 C ATOM 2010 O GLU A 129 30.303 -24.465 26.171 1.00 3.72 O ATOM 2011 CB GLU A 129 28.091 -22.268 26.214 1.00 3.72 C ATOM 2012 CG GLU A 129 28.633 -21.118 27.046 1.00 4.36 C ATOM 2013 CD GLU A 129 27.559 -20.448 27.875 1.00 4.88 C ATOM 2014 OE1 GLU A 129 27.135 -21.030 28.893 1.00 5.04 O ATOM 2015 OE2 GLU A 129 27.133 -19.330 27.516 1.00 5.39 O ATOM 0 H GLU A 129 27.707 -24.294 24.699 1.00 2.29 H new ATOM 0 HA GLU A 129 29.312 -21.841 24.520 1.00 3.05 H new ATOM 0 HB2 GLU A 129 27.140 -21.969 25.773 1.00 3.72 H new ATOM 0 HB3 GLU A 129 27.885 -23.114 26.870 1.00 3.72 H new ATOM 0 HG2 GLU A 129 29.418 -21.489 27.705 1.00 4.36 H new ATOM 0 HG3 GLU A 129 29.092 -20.381 26.387 1.00 4.36 H new ATOM 2022 N HIS A 130 31.404 -22.598 25.571 1.00 4.02 N ATOM 2023 CA HIS A 130 32.721 -23.114 25.918 1.00 4.65 C ATOM 2024 C HIS A 130 33.272 -22.369 27.137 1.00 4.79 C ATOM 2025 O HIS A 130 32.726 -21.337 27.522 1.00 5.17 O ATOM 2026 CB HIS A 130 33.642 -22.952 24.700 1.00 5.23 C ATOM 2027 CG HIS A 130 34.941 -23.703 24.769 1.00 5.76 C ATOM 2028 ND1 HIS A 130 35.027 -25.074 24.659 1.00 6.35 N ATOM 2029 CD2 HIS A 130 36.213 -23.263 24.916 1.00 6.21 C ATOM 2030 CE1 HIS A 130 36.292 -25.441 24.731 1.00 7.04 C ATOM 2031 NE2 HIS A 130 37.032 -24.363 24.887 1.00 6.98 N ATOM 0 H HIS A 130 31.405 -21.629 25.252 1.00 4.02 H new ATOM 0 HA HIS A 130 32.659 -24.170 26.181 1.00 4.65 H new ATOM 0 HB2 HIS A 130 33.101 -23.277 23.811 1.00 5.23 H new ATOM 0 HB3 HIS A 130 33.861 -21.892 24.570 1.00 5.23 H new ATOM 0 HD2 HIS A 130 36.525 -22.236 25.034 1.00 6.21 H new ATOM 0 HE1 HIS A 130 36.659 -26.455 24.672 1.00 7.04 H new ATOM 0 HE2 HIS A 130 38.048 -24.348 24.972 1.00 6.98 H new ATOM 2040 N HIS A 131 34.336 -22.913 27.745 1.00 4.87 N ATOM 2041 CA HIS A 131 34.993 -22.303 28.911 1.00 5.24 C ATOM 2042 C HIS A 131 34.163 -22.495 30.176 1.00 5.58 C ATOM 2043 O HIS A 131 33.193 -23.257 30.189 1.00 5.71 O ATOM 2044 CB HIS A 131 35.272 -20.806 28.696 1.00 5.62 C ATOM 2045 CG HIS A 131 36.313 -20.514 27.663 1.00 6.06 C ATOM 2046 ND1 HIS A 131 36.025 -19.934 26.448 1.00 6.53 N ATOM 2047 CD2 HIS A 131 37.651 -20.696 27.681 1.00 6.53 C ATOM 2048 CE1 HIS A 131 37.141 -19.775 25.765 1.00 7.20 C ATOM 2049 NE2 HIS A 131 38.148 -20.227 26.491 1.00 7.21 N ATOM 0 H HIS A 131 34.765 -23.788 27.443 1.00 4.87 H new ATOM 0 HA HIS A 131 35.948 -22.814 29.033 1.00 5.24 H new ATOM 0 HB2 HIS A 131 34.343 -20.313 28.408 1.00 5.62 H new ATOM 0 HB3 HIS A 131 35.585 -20.367 29.644 1.00 5.62 H new ATOM 0 HD2 HIS A 131 38.225 -21.131 28.485 1.00 6.53 H new ATOM 0 HE1 HIS A 131 37.219 -19.347 24.777 1.00 7.20 H new ATOM 0 HE2 HIS A 131 39.130 -20.227 26.214 1.00 7.21 H new ATOM 2058 N HIS A 132 34.574 -21.823 31.246 1.00 6.07 N ATOM 2059 CA HIS A 132 33.840 -21.848 32.506 1.00 6.73 C ATOM 2060 C HIS A 132 32.917 -20.641 32.580 1.00 7.16 C ATOM 2061 O HIS A 132 33.171 -19.624 31.933 1.00 7.46 O ATOM 2062 CB HIS A 132 34.805 -21.835 33.698 1.00 7.36 C ATOM 2063 CG HIS A 132 35.653 -23.067 33.813 1.00 7.90 C ATOM 2064 ND1 HIS A 132 35.327 -24.132 34.623 1.00 8.29 N ATOM 2065 CD2 HIS A 132 36.823 -23.394 33.217 1.00 8.39 C ATOM 2066 CE1 HIS A 132 36.260 -25.060 34.523 1.00 8.95 C ATOM 2067 NE2 HIS A 132 37.175 -24.637 33.676 1.00 9.02 N ATOM 0 H HIS A 132 35.418 -21.250 31.265 1.00 6.07 H new ATOM 0 HA HIS A 132 33.252 -22.765 32.549 1.00 6.73 H new ATOM 0 HB2 HIS A 132 35.456 -20.965 33.615 1.00 7.36 H new ATOM 0 HB3 HIS A 132 34.230 -21.716 34.616 1.00 7.36 H new ATOM 0 HD2 HIS A 132 37.375 -22.790 32.513 1.00 8.39 H new ATOM 0 HE1 HIS A 132 36.271 -26.005 35.046 1.00 8.95 H new ATOM 0 HE2 HIS A 132 38.012 -25.152 33.405 1.00 9.02 H new ATOM 2076 N HIS A 133 31.857 -20.741 33.368 1.00 7.47 N ATOM 2077 CA HIS A 133 30.909 -19.639 33.487 1.00 8.09 C ATOM 2078 C HIS A 133 31.448 -18.555 34.417 1.00 8.82 C ATOM 2079 O HIS A 133 31.137 -18.539 35.608 1.00 9.23 O ATOM 2080 CB HIS A 133 29.538 -20.138 33.968 1.00 8.42 C ATOM 2081 CG HIS A 133 28.441 -19.896 32.970 1.00 8.83 C ATOM 2082 ND1 HIS A 133 27.145 -19.574 33.320 1.00 9.20 N ATOM 2083 CD2 HIS A 133 28.459 -19.945 31.617 1.00 9.20 C ATOM 2084 CE1 HIS A 133 26.420 -19.432 32.223 1.00 9.73 C ATOM 2085 NE2 HIS A 133 27.193 -19.655 31.176 1.00 9.75 N ATOM 0 H HIS A 133 31.631 -21.562 33.929 1.00 7.47 H new ATOM 0 HA HIS A 133 30.779 -19.203 32.497 1.00 8.09 H new ATOM 0 HB2 HIS A 133 29.600 -21.205 34.180 1.00 8.42 H new ATOM 0 HB3 HIS A 133 29.285 -19.642 34.905 1.00 8.42 H new ATOM 0 HD2 HIS A 133 29.314 -20.171 30.998 1.00 9.20 H new ATOM 0 HE1 HIS A 133 25.371 -19.176 32.189 1.00 9.73 H new ATOM 0 HE2 HIS A 133 26.898 -19.618 30.200 1.00 9.75 H new ATOM 2094 N HIS A 134 32.298 -17.690 33.853 1.00 9.17 N ATOM 2095 CA HIS A 134 32.858 -16.526 34.549 1.00 10.02 C ATOM 2096 C HIS A 134 33.911 -16.927 35.583 1.00 10.42 C ATOM 2097 O HIS A 134 33.624 -17.643 36.545 1.00 10.82 O ATOM 2098 CB HIS A 134 31.757 -15.696 35.214 1.00 10.46 C ATOM 2099 CG HIS A 134 32.253 -14.407 35.796 1.00 11.09 C ATOM 2100 ND1 HIS A 134 32.390 -14.192 37.150 1.00 11.60 N ATOM 2101 CD2 HIS A 134 32.664 -13.267 35.193 1.00 11.51 C ATOM 2102 CE1 HIS A 134 32.866 -12.978 37.354 1.00 12.26 C ATOM 2103 NE2 HIS A 134 33.041 -12.396 36.182 1.00 12.22 N ATOM 0 H HIS A 134 32.620 -17.779 32.889 1.00 9.17 H new ATOM 0 HA HIS A 134 33.349 -15.915 33.792 1.00 10.02 H new ATOM 0 HB2 HIS A 134 30.981 -15.480 34.479 1.00 10.46 H new ATOM 0 HB3 HIS A 134 31.293 -16.288 36.003 1.00 10.46 H new ATOM 0 HD2 HIS A 134 32.690 -13.079 34.130 1.00 11.51 H new ATOM 0 HE1 HIS A 134 33.077 -12.536 38.317 1.00 12.26 H new ATOM 0 HE2 HIS A 134 33.399 -11.452 36.036 1.00 12.22 H new ATOM 2112 N HIS A 135 35.131 -16.460 35.371 1.00 10.51 N ATOM 2113 CA HIS A 135 36.196 -16.653 36.339 1.00 11.06 C ATOM 2114 C HIS A 135 36.363 -15.394 37.181 1.00 11.14 C ATOM 2115 O HIS A 135 37.019 -14.451 36.704 1.00 11.30 O ATOM 2116 CB HIS A 135 37.521 -16.994 35.647 1.00 11.78 C ATOM 2117 CG HIS A 135 38.661 -17.182 36.612 1.00 12.27 C ATOM 2118 ND1 HIS A 135 39.495 -16.153 36.998 1.00 12.92 N ATOM 2119 CD2 HIS A 135 39.091 -18.278 37.284 1.00 12.37 C ATOM 2120 CE1 HIS A 135 40.382 -16.603 37.861 1.00 13.35 C ATOM 2121 NE2 HIS A 135 40.160 -17.888 38.053 1.00 13.03 N ATOM 2122 OXT HIS A 135 35.845 -15.360 38.314 1.00 11.24 O ATOM 0 H HIS A 135 35.407 -15.944 34.536 1.00 10.51 H new ATOM 0 HA HIS A 135 35.923 -17.490 36.981 1.00 11.06 H new ATOM 0 HB2 HIS A 135 37.394 -17.905 35.062 1.00 11.78 H new ATOM 0 HB3 HIS A 135 37.773 -16.198 34.947 1.00 11.78 H new ATOM 0 HD2 HIS A 135 38.672 -19.272 37.226 1.00 12.37 H new ATOM 0 HE1 HIS A 135 41.159 -16.019 38.331 1.00 13.35 H new ATOM 0 HE2 HIS A 135 40.696 -18.495 38.673 1.00 13.03 H new TER 2131 HIS A 135