USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 890 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 75 ASN : amide:sc= -1.33 K(o=-1.3,f=-4.8!) USER MOD Set 1.2: A 81 GLN : amide:sc= 0 X(o=-1.3,f=-1.8) USER MOD Set 2.1: A 18 THR OG1 : rot -100:sc= -0.598 USER MOD Set 2.2: A 19 ASN : amide:sc= -0.963 K(o=-0.43,f=-6.5!) USER MOD Set 2.3: A 22 THR OG1 : rot 97:sc= 1.13 USER MOD Set 3.1: A 16 LYS NZ :NH3+ 162:sc= 1.33 (180deg=1.07) USER MOD Set 3.2: A 40 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 1 GLY N :NH3+ -111:sc= 0.0317 (180deg=0) USER MOD Set 4.2: A 3 SER OG : rot 33:sc= 0.146 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 170:sc= 0 USER MOD Single : A 6 SER OG : rot -107:sc= 0.424 USER MOD Single : A 9 ASN : amide:sc= -0.0799 K(o=-0.08,f=-3!) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0.869 USER MOD Single : A 15 MET CE :methyl -124:sc= -0.706 (180deg=-2.38) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.27 USER MOD Single : A 25 GLN : amide:sc= -0.276 K(o=-0.28,f=-2!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.522 K(o=-0.52,f=-2.4!) USER MOD Single : A 33 ASN : amide:sc= -4.33! C(o=-4.3!,f=-6.7!) USER MOD Single : A 43 ASN : amide:sc= -1.27 K(o=-1.3,f=-4!) USER MOD Single : A 45 GLN : amide:sc= -0.0667 X(o=-0.067,f=-0.35) USER MOD Single : A 46 SER OG : rot -33:sc= 0.166 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 159:sc= -0.088 (180deg=-0.503) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.141 K(o=-0.14,f=-2!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0331 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0181 USER MOD Single : A 70 HIS : no HD1:sc= -8.49! C(o=-8.5!,f=-6.6!) USER MOD Single : A 71 THR OG1 : rot -4:sc= 1.06 USER MOD Single : A 73 THR OG1 : rot -60:sc= 0.813 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= -0.154 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.0437 K(o=-0.044,f=-0.6) USER MOD Single : A 94 HIS : no HD1:sc= -0.118 K(o=-0.12,f=-0.63) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.0104 K(o=-0.01,f=-1.5!) USER MOD Single : A 102 CYS SG : rot -160:sc= 0 USER MOD Single : A 103 THR OG1 : rot 33:sc= 0.699 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0.1) USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 106 HIS : no HD1:sc= -2.33 K(o=-2.3,f=-1.8) USER MOD Single : A 107 THR OG1 : rot -37:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -0.0615 K(o=-0.061,f=-1) USER MOD Single : A 114 ASN : amide:sc= -0.614 K(o=-0.61,f=-3!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.047 13.227 4.113 1.00 0.00 N ATOM 2 CA GLY A 1 -17.208 14.244 4.718 1.00 0.00 C ATOM 3 C GLY A 1 -16.168 13.657 5.653 1.00 0.00 C ATOM 4 O GLY A 1 -16.393 12.614 6.266 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.836 13.163 3.097 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.860 12.309 4.564 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.047 13.479 4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.708 14.812 3.934 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.834 14.946 5.270 1.00 0.00 H new ATOM 8 N SER A 2 -15.026 14.328 5.761 1.00 0.00 N ATOM 9 CA SER A 2 -13.945 13.864 6.623 1.00 0.00 C ATOM 10 C SER A 2 -13.798 12.348 6.540 1.00 0.00 C ATOM 11 O SER A 2 -13.718 11.665 7.561 1.00 0.00 O ATOM 12 CB SER A 2 -14.204 14.285 8.071 1.00 0.00 C ATOM 13 OG SER A 2 -13.645 15.559 8.339 1.00 0.00 O ATOM 0 H SER A 2 -14.825 15.195 5.262 1.00 0.00 H new ATOM 0 HA SER A 2 -13.017 14.321 6.280 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.277 14.308 8.260 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.777 13.547 8.750 1.00 0.00 H new ATOM 0 HG SER A 2 -13.826 15.806 9.270 1.00 0.00 H new ATOM 19 N SER A 3 -13.762 11.829 5.317 1.00 0.00 N ATOM 20 CA SER A 3 -13.628 10.393 5.100 1.00 0.00 C ATOM 21 C SER A 3 -12.198 10.034 4.711 1.00 0.00 C ATOM 22 O SER A 3 -11.512 10.805 4.040 1.00 0.00 O ATOM 23 CB SER A 3 -14.597 9.928 4.011 1.00 0.00 C ATOM 24 OG SER A 3 -15.942 10.173 4.386 1.00 0.00 O ATOM 0 H SER A 3 -13.824 12.381 4.462 1.00 0.00 H new ATOM 0 HA SER A 3 -13.871 9.885 6.033 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.376 10.446 3.078 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.456 8.863 3.825 1.00 0.00 H new ATOM 0 HG SER A 3 -15.986 10.983 4.936 1.00 0.00 H new ATOM 30 N GLY A 4 -11.753 8.856 5.138 1.00 0.00 N ATOM 31 CA GLY A 4 -10.406 8.413 4.825 1.00 0.00 C ATOM 32 C GLY A 4 -9.778 7.624 5.957 1.00 0.00 C ATOM 33 O GLY A 4 -9.576 8.150 7.051 1.00 0.00 O ATOM 0 H GLY A 4 -12.301 8.200 5.695 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.429 7.797 3.926 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.784 9.280 4.602 1.00 0.00 H new ATOM 37 N SER A 5 -9.470 6.358 5.693 1.00 0.00 N ATOM 38 CA SER A 5 -8.866 5.493 6.700 1.00 0.00 C ATOM 39 C SER A 5 -7.851 6.263 7.540 1.00 0.00 C ATOM 40 O SER A 5 -7.006 6.982 7.007 1.00 0.00 O ATOM 41 CB SER A 5 -8.188 4.295 6.033 1.00 0.00 C ATOM 42 OG SER A 5 -7.077 4.706 5.256 1.00 0.00 O ATOM 0 H SER A 5 -9.629 5.909 4.791 1.00 0.00 H new ATOM 0 HA SER A 5 -9.658 5.134 7.357 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.861 3.587 6.795 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.905 3.773 5.400 1.00 0.00 H new ATOM 0 HG SER A 5 -6.567 3.919 4.973 1.00 0.00 H new ATOM 48 N SER A 6 -7.943 6.107 8.857 1.00 0.00 N ATOM 49 CA SER A 6 -7.036 6.790 9.772 1.00 0.00 C ATOM 50 C SER A 6 -5.583 6.470 9.437 1.00 0.00 C ATOM 51 O SER A 6 -4.787 7.366 9.158 1.00 0.00 O ATOM 52 CB SER A 6 -7.338 6.389 11.217 1.00 0.00 C ATOM 53 OG SER A 6 -6.345 6.878 12.101 1.00 0.00 O ATOM 0 H SER A 6 -8.636 5.514 9.314 1.00 0.00 H new ATOM 0 HA SER A 6 -7.188 7.864 9.661 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.313 6.779 11.509 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.393 5.303 11.292 1.00 0.00 H new ATOM 0 HG SER A 6 -5.781 6.135 12.403 1.00 0.00 H new ATOM 59 N GLY A 7 -5.244 5.185 9.467 1.00 0.00 N ATOM 60 CA GLY A 7 -3.887 4.768 9.164 1.00 0.00 C ATOM 61 C GLY A 7 -3.249 4.000 10.305 1.00 0.00 C ATOM 62 O GLY A 7 -2.523 4.573 11.117 1.00 0.00 O ATOM 0 H GLY A 7 -5.885 4.425 9.696 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.893 4.146 8.269 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.282 5.646 8.938 1.00 0.00 H new ATOM 66 N GLU A 8 -3.521 2.701 10.367 1.00 0.00 N ATOM 67 CA GLU A 8 -2.969 1.855 11.419 1.00 0.00 C ATOM 68 C GLU A 8 -1.948 0.874 10.849 1.00 0.00 C ATOM 69 O GLU A 8 -2.028 0.485 9.685 1.00 0.00 O ATOM 70 CB GLU A 8 -4.088 1.089 12.127 1.00 0.00 C ATOM 71 CG GLU A 8 -4.905 1.946 13.079 1.00 0.00 C ATOM 72 CD GLU A 8 -5.797 2.934 12.354 1.00 0.00 C ATOM 73 OE1 GLU A 8 -6.864 2.516 11.857 1.00 0.00 O ATOM 74 OE2 GLU A 8 -5.429 4.125 12.282 1.00 0.00 O ATOM 0 H GLU A 8 -4.120 2.211 9.702 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.465 2.498 12.141 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -4.753 0.659 11.378 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -3.653 0.258 12.682 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -5.519 1.301 13.707 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -4.232 2.489 13.742 1.00 0.00 H new ATOM 81 N ASN A 9 -0.988 0.480 11.679 1.00 0.00 N ATOM 82 CA ASN A 9 0.051 -0.454 11.258 1.00 0.00 C ATOM 83 C ASN A 9 -0.480 -1.884 11.239 1.00 0.00 C ATOM 84 O ASN A 9 -0.846 -2.436 12.276 1.00 0.00 O ATOM 85 CB ASN A 9 1.260 -0.359 12.191 1.00 0.00 C ATOM 86 CG ASN A 9 0.861 -0.083 13.628 1.00 0.00 C ATOM 87 OD1 ASN A 9 -0.258 -0.385 14.042 1.00 0.00 O ATOM 88 ND2 ASN A 9 1.778 0.495 14.395 1.00 0.00 N ATOM 0 H ASN A 9 -0.907 0.792 12.647 1.00 0.00 H new ATOM 0 HA ASN A 9 0.359 -0.186 10.247 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.824 -1.290 12.146 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.923 0.433 11.842 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.567 0.706 15.370 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.693 0.728 14.009 1.00 0.00 H new ATOM 95 N VAL A 10 -0.518 -2.480 10.051 1.00 0.00 N ATOM 96 CA VAL A 10 -1.002 -3.846 9.896 1.00 0.00 C ATOM 97 C VAL A 10 0.156 -4.825 9.738 1.00 0.00 C ATOM 98 O VAL A 10 0.969 -4.699 8.821 1.00 0.00 O ATOM 99 CB VAL A 10 -1.938 -3.976 8.679 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.539 -5.371 8.613 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.030 -2.918 8.733 1.00 0.00 C ATOM 0 H VAL A 10 -0.219 -2.038 9.182 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.559 -4.088 10.801 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.353 -3.816 7.774 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.197 -5.443 7.747 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.740 -6.107 8.524 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.111 -5.564 9.520 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.682 -3.024 7.866 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.614 -3.044 9.644 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.577 -1.927 8.727 1.00 0.00 H new ATOM 111 N TYR A 11 0.226 -5.800 10.638 1.00 0.00 N ATOM 112 CA TYR A 11 1.287 -6.800 10.600 1.00 0.00 C ATOM 113 C TYR A 11 0.713 -8.207 10.729 1.00 0.00 C ATOM 114 O TYR A 11 -0.454 -8.385 11.075 1.00 0.00 O ATOM 115 CB TYR A 11 2.297 -6.544 11.720 1.00 0.00 C ATOM 116 CG TYR A 11 1.687 -5.922 12.956 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.524 -6.438 13.515 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.272 -4.818 13.563 1.00 0.00 C ATOM 119 CE1 TYR A 11 -0.037 -5.873 14.644 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.719 -4.248 14.693 1.00 0.00 C ATOM 121 CZ TYR A 11 0.564 -4.778 15.229 1.00 0.00 C ATOM 122 OH TYR A 11 0.009 -4.212 16.353 1.00 0.00 O ATOM 0 H TYR A 11 -0.439 -5.919 11.402 1.00 0.00 H new ATOM 0 HA TYR A 11 1.793 -6.721 9.638 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.770 -7.487 11.994 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.084 -5.890 11.345 1.00 0.00 H new ATOM 0 HD1 TYR A 11 0.051 -7.295 13.059 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.175 -4.398 13.144 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -0.941 -6.286 15.066 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.189 -3.392 15.154 1.00 0.00 H new ATOM 0 HH TYR A 11 0.555 -3.451 16.640 1.00 0.00 H new ATOM 132 N GLY A 12 1.544 -9.206 10.448 1.00 0.00 N ATOM 133 CA GLY A 12 1.104 -10.586 10.539 1.00 0.00 C ATOM 134 C GLY A 12 2.096 -11.553 9.924 1.00 0.00 C ATOM 135 O GLY A 12 2.909 -11.169 9.084 1.00 0.00 O ATOM 0 H GLY A 12 2.515 -9.084 10.159 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.949 -10.846 11.586 1.00 0.00 H new ATOM 0 HA3 GLY A 12 0.141 -10.691 10.039 1.00 0.00 H new ATOM 139 N TYR A 13 2.031 -12.812 10.345 1.00 0.00 N ATOM 140 CA TYR A 13 2.934 -13.836 9.834 1.00 0.00 C ATOM 141 C TYR A 13 2.371 -14.475 8.567 1.00 0.00 C ATOM 142 O TYR A 13 1.439 -15.279 8.624 1.00 0.00 O ATOM 143 CB TYR A 13 3.175 -14.910 10.896 1.00 0.00 C ATOM 144 CG TYR A 13 4.330 -14.597 11.821 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.370 -13.407 12.537 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.381 -15.492 11.978 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.423 -13.117 13.382 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.437 -15.211 12.823 1.00 0.00 C ATOM 149 CZ TYR A 13 6.454 -14.023 13.522 1.00 0.00 C ATOM 150 OH TYR A 13 7.505 -13.739 14.363 1.00 0.00 O ATOM 0 H TYR A 13 1.362 -13.147 11.039 1.00 0.00 H new ATOM 0 HA TYR A 13 3.883 -13.358 9.589 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.269 -15.033 11.489 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.364 -15.863 10.401 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.564 -12.696 12.431 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.372 -16.423 11.430 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.439 -12.187 13.930 1.00 0.00 H new ATOM 0 HE2 TYR A 13 7.245 -15.918 12.935 1.00 0.00 H new ATOM 0 HH TYR A 13 8.146 -14.481 14.348 1.00 0.00 H new ATOM 160 N LEU A 14 2.944 -14.112 7.425 1.00 0.00 N ATOM 161 CA LEU A 14 2.502 -14.650 6.143 1.00 0.00 C ATOM 162 C LEU A 14 3.579 -15.534 5.523 1.00 0.00 C ATOM 163 O LEU A 14 4.730 -15.525 5.958 1.00 0.00 O ATOM 164 CB LEU A 14 2.147 -13.511 5.186 1.00 0.00 C ATOM 165 CG LEU A 14 1.372 -12.341 5.793 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.682 -11.052 5.048 1.00 0.00 C ATOM 167 CD2 LEU A 14 -0.123 -12.624 5.774 1.00 0.00 C ATOM 0 H LEU A 14 3.715 -13.448 7.360 1.00 0.00 H new ATOM 0 HA LEU A 14 1.615 -15.259 6.318 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.070 -13.124 4.755 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.560 -13.923 4.365 1.00 0.00 H new ATOM 0 HG LEU A 14 1.685 -12.222 6.830 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.122 -10.230 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.749 -10.841 5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.398 -11.159 4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.659 -11.781 6.210 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.452 -12.771 4.745 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.330 -13.524 6.353 1.00 0.00 H new ATOM 179 N MET A 15 3.197 -16.294 4.502 1.00 0.00 N ATOM 180 CA MET A 15 4.132 -17.182 3.819 1.00 0.00 C ATOM 181 C MET A 15 4.619 -16.558 2.515 1.00 0.00 C ATOM 182 O MET A 15 3.846 -16.379 1.574 1.00 0.00 O ATOM 183 CB MET A 15 3.472 -18.533 3.537 1.00 0.00 C ATOM 184 CG MET A 15 3.071 -19.287 4.794 1.00 0.00 C ATOM 185 SD MET A 15 2.875 -21.057 4.510 1.00 0.00 S ATOM 186 CE MET A 15 4.574 -21.610 4.634 1.00 0.00 C ATOM 0 H MET A 15 2.248 -16.313 4.129 1.00 0.00 H new ATOM 0 HA MET A 15 4.992 -17.336 4.471 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.587 -18.374 2.920 1.00 0.00 H new ATOM 0 HB3 MET A 15 4.158 -19.150 2.957 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.825 -19.128 5.565 1.00 0.00 H new ATOM 0 HG3 MET A 15 2.135 -18.878 5.175 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.852 -22.139 3.723 1.00 0.00 H new ATOM 0 HE2 MET A 15 5.228 -20.748 4.767 1.00 0.00 H new ATOM 0 HE3 MET A 15 4.677 -22.279 5.488 1.00 0.00 H new ATOM 196 N LYS A 16 5.905 -16.230 2.465 1.00 0.00 N ATOM 197 CA LYS A 16 6.497 -15.627 1.276 1.00 0.00 C ATOM 198 C LYS A 16 7.154 -16.687 0.399 1.00 0.00 C ATOM 199 O LYS A 16 7.947 -17.499 0.877 1.00 0.00 O ATOM 200 CB LYS A 16 7.528 -14.569 1.675 1.00 0.00 C ATOM 201 CG LYS A 16 7.771 -13.522 0.602 1.00 0.00 C ATOM 202 CD LYS A 16 9.086 -12.793 0.821 1.00 0.00 C ATOM 203 CE LYS A 16 9.239 -11.619 -0.134 1.00 0.00 C ATOM 204 NZ LYS A 16 10.670 -11.293 -0.387 1.00 0.00 N ATOM 0 H LYS A 16 6.559 -16.372 3.235 1.00 0.00 H new ATOM 0 HA LYS A 16 5.700 -15.151 0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.193 -14.073 2.586 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.471 -15.063 1.909 1.00 0.00 H new ATOM 0 HG2 LYS A 16 7.777 -13.999 -0.378 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.951 -12.803 0.601 1.00 0.00 H new ATOM 0 HD2 LYS A 16 9.138 -12.436 1.849 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.915 -13.487 0.682 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.747 -11.852 -1.078 1.00 0.00 H new ATOM 0 HE3 LYS A 16 8.735 -10.746 0.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.747 -10.715 -1.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.054 -10.763 0.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 11.210 -12.173 -0.511 1.00 0.00 H new ATOM 218 N TYR A 17 6.820 -16.674 -0.887 1.00 0.00 N ATOM 219 CA TYR A 17 7.377 -17.635 -1.831 1.00 0.00 C ATOM 220 C TYR A 17 8.833 -17.307 -2.148 1.00 0.00 C ATOM 221 O TYR A 17 9.134 -16.267 -2.736 1.00 0.00 O ATOM 222 CB TYR A 17 6.554 -17.651 -3.120 1.00 0.00 C ATOM 223 CG TYR A 17 6.657 -18.949 -3.889 1.00 0.00 C ATOM 224 CD1 TYR A 17 7.789 -19.249 -4.636 1.00 0.00 C ATOM 225 CD2 TYR A 17 5.623 -19.877 -3.866 1.00 0.00 C ATOM 226 CE1 TYR A 17 7.887 -20.434 -5.340 1.00 0.00 C ATOM 227 CE2 TYR A 17 5.713 -21.065 -4.566 1.00 0.00 C ATOM 228 CZ TYR A 17 6.846 -21.338 -5.302 1.00 0.00 C ATOM 229 OH TYR A 17 6.941 -22.520 -6.000 1.00 0.00 O ATOM 0 H TYR A 17 6.166 -16.008 -1.299 1.00 0.00 H new ATOM 0 HA TYR A 17 7.338 -18.622 -1.370 1.00 0.00 H new ATOM 0 HB2 TYR A 17 5.508 -17.465 -2.876 1.00 0.00 H new ATOM 0 HB3 TYR A 17 6.882 -16.832 -3.760 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.607 -18.544 -4.667 1.00 0.00 H new ATOM 0 HD2 TYR A 17 4.733 -19.666 -3.291 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.774 -20.651 -5.917 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.900 -21.776 -4.537 1.00 0.00 H new ATOM 0 HH TYR A 17 6.124 -23.045 -5.867 1.00 0.00 H new ATOM 239 N THR A 18 9.734 -18.201 -1.754 1.00 0.00 N ATOM 240 CA THR A 18 11.158 -18.008 -1.995 1.00 0.00 C ATOM 241 C THR A 18 11.556 -18.515 -3.376 1.00 0.00 C ATOM 242 O THR A 18 12.105 -17.770 -4.187 1.00 0.00 O ATOM 243 CB THR A 18 12.010 -18.728 -0.932 1.00 0.00 C ATOM 244 OG1 THR A 18 11.597 -20.093 -0.814 1.00 0.00 O ATOM 245 CG2 THR A 18 11.886 -18.037 0.418 1.00 0.00 C ATOM 0 H THR A 18 9.502 -19.066 -1.266 1.00 0.00 H new ATOM 0 HA THR A 18 11.346 -16.936 -1.936 1.00 0.00 H new ATOM 0 HB THR A 18 13.053 -18.691 -1.248 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.015 -20.192 -0.032 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.496 -18.562 1.153 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.229 -17.006 0.332 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.844 -18.047 0.737 1.00 0.00 H new ATOM 253 N ASN A 19 11.276 -19.788 -3.638 1.00 0.00 N ATOM 254 CA ASN A 19 11.605 -20.394 -4.923 1.00 0.00 C ATOM 255 C ASN A 19 10.859 -21.712 -5.110 1.00 0.00 C ATOM 256 O ASN A 19 10.277 -22.248 -4.166 1.00 0.00 O ATOM 257 CB ASN A 19 13.113 -20.629 -5.028 1.00 0.00 C ATOM 258 CG ASN A 19 13.750 -20.905 -3.680 1.00 0.00 C ATOM 259 OD1 ASN A 19 13.404 -21.874 -3.004 1.00 0.00 O ATOM 260 ND2 ASN A 19 14.687 -20.052 -3.283 1.00 0.00 N ATOM 0 H ASN A 19 10.822 -20.419 -2.978 1.00 0.00 H new ATOM 0 HA ASN A 19 11.295 -19.707 -5.711 1.00 0.00 H new ATOM 0 HB2 ASN A 19 13.301 -21.470 -5.695 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.584 -19.755 -5.477 1.00 0.00 H new ATOM 0 HD21 ASN A 19 15.152 -20.186 -2.385 1.00 0.00 H new ATOM 0 HD22 ASN A 19 14.942 -19.262 -3.876 1.00 0.00 H new ATOM 267 N LEU A 20 10.881 -22.229 -6.333 1.00 0.00 N ATOM 268 CA LEU A 20 10.207 -23.485 -6.644 1.00 0.00 C ATOM 269 C LEU A 20 10.649 -24.591 -5.691 1.00 0.00 C ATOM 270 O LEU A 20 9.832 -25.174 -4.978 1.00 0.00 O ATOM 271 CB LEU A 20 10.496 -23.897 -8.089 1.00 0.00 C ATOM 272 CG LEU A 20 10.089 -22.892 -9.167 1.00 0.00 C ATOM 273 CD1 LEU A 20 9.681 -23.613 -10.443 1.00 0.00 C ATOM 274 CD2 LEU A 20 8.958 -22.004 -8.669 1.00 0.00 C ATOM 0 H LEU A 20 11.358 -21.799 -7.125 1.00 0.00 H new ATOM 0 HA LEU A 20 9.135 -23.333 -6.523 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.565 -24.089 -8.184 1.00 0.00 H new ATOM 0 HB3 LEU A 20 9.984 -24.839 -8.287 1.00 0.00 H new ATOM 0 HG LEU A 20 10.949 -22.260 -9.390 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.395 -22.881 -11.199 1.00 0.00 H new ATOM 0 HD12 LEU A 20 10.519 -24.205 -10.810 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.836 -24.270 -10.236 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.681 -21.295 -9.449 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.095 -22.621 -8.417 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.286 -21.459 -7.784 1.00 0.00 H new ATOM 286 N VAL A 21 11.948 -24.874 -5.682 1.00 0.00 N ATOM 287 CA VAL A 21 12.499 -25.907 -4.813 1.00 0.00 C ATOM 288 C VAL A 21 11.909 -25.819 -3.411 1.00 0.00 C ATOM 289 O VAL A 21 11.328 -26.780 -2.907 1.00 0.00 O ATOM 290 CB VAL A 21 14.033 -25.802 -4.720 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.457 -24.359 -4.498 1.00 0.00 C ATOM 292 CG2 VAL A 21 14.561 -26.699 -3.611 1.00 0.00 C ATOM 0 H VAL A 21 12.638 -24.402 -6.267 1.00 0.00 H new ATOM 0 HA VAL A 21 12.234 -26.867 -5.255 1.00 0.00 H new ATOM 0 HB VAL A 21 14.461 -26.139 -5.664 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.544 -24.305 -4.435 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.111 -23.746 -5.330 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.021 -23.990 -3.570 1.00 0.00 H new ATOM 0 HG21 VAL A 21 15.646 -26.613 -3.559 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.127 -26.394 -2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.289 -27.734 -3.819 1.00 0.00 H new ATOM 302 N THR A 22 12.060 -24.657 -2.783 1.00 0.00 N ATOM 303 CA THR A 22 11.543 -24.442 -1.437 1.00 0.00 C ATOM 304 C THR A 22 10.020 -24.390 -1.436 1.00 0.00 C ATOM 305 O THR A 22 9.359 -25.293 -0.924 1.00 0.00 O ATOM 306 CB THR A 22 12.090 -23.137 -0.827 1.00 0.00 C ATOM 307 OG1 THR A 22 13.518 -23.200 -0.737 1.00 0.00 O ATOM 308 CG2 THR A 22 11.500 -22.897 0.555 1.00 0.00 C ATOM 0 H THR A 22 12.536 -23.850 -3.185 1.00 0.00 H new ATOM 0 HA THR A 22 11.876 -25.285 -0.832 1.00 0.00 H new ATOM 0 HB THR A 22 11.803 -22.310 -1.476 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.915 -22.751 -1.513 1.00 0.00 H new ATOM 0 HG21 THR A 22 11.901 -21.970 0.966 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.415 -22.821 0.479 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.761 -23.727 1.211 1.00 0.00 H new ATOM 316 N GLY A 23 9.467 -23.327 -2.012 1.00 0.00 N ATOM 317 CA GLY A 23 8.025 -23.178 -2.067 1.00 0.00 C ATOM 318 C GLY A 23 7.526 -22.041 -1.197 1.00 0.00 C ATOM 319 O GLY A 23 7.783 -20.872 -1.484 1.00 0.00 O ATOM 0 H GLY A 23 9.993 -22.566 -2.442 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.720 -23.003 -3.099 1.00 0.00 H new ATOM 0 HA3 GLY A 23 7.554 -24.108 -1.749 1.00 0.00 H new ATOM 323 N TRP A 24 6.810 -22.384 -0.132 1.00 0.00 N ATOM 324 CA TRP A 24 6.272 -21.383 0.782 1.00 0.00 C ATOM 325 C TRP A 24 7.025 -21.395 2.107 1.00 0.00 C ATOM 326 O TRP A 24 7.170 -22.441 2.739 1.00 0.00 O ATOM 327 CB TRP A 24 4.782 -21.632 1.025 1.00 0.00 C ATOM 328 CG TRP A 24 3.944 -21.466 -0.206 1.00 0.00 C ATOM 329 CD1 TRP A 24 3.745 -22.388 -1.193 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.192 -20.306 -0.581 1.00 0.00 C ATOM 331 NE1 TRP A 24 2.916 -21.872 -2.160 1.00 0.00 N ATOM 332 CE2 TRP A 24 2.562 -20.596 -1.807 1.00 0.00 C ATOM 333 CE3 TRP A 24 2.989 -19.051 0.000 1.00 0.00 C ATOM 334 CZ2 TRP A 24 1.745 -19.677 -2.460 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.179 -18.140 -0.650 1.00 0.00 C ATOM 336 CH2 TRP A 24 1.564 -18.456 -1.868 1.00 0.00 C ATOM 0 H TRP A 24 6.589 -23.347 0.120 1.00 0.00 H new ATOM 0 HA TRP A 24 6.399 -20.403 0.323 1.00 0.00 H new ATOM 0 HB2 TRP A 24 4.648 -22.642 1.414 1.00 0.00 H new ATOM 0 HB3 TRP A 24 4.427 -20.945 1.793 1.00 0.00 H new ATOM 0 HD1 TRP A 24 4.176 -23.378 -1.211 1.00 0.00 H new ATOM 0 HE1 TRP A 24 2.613 -22.359 -3.003 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.457 -18.798 0.940 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 1.271 -19.919 -3.400 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 2.017 -17.167 -0.211 1.00 0.00 H new ATOM 0 HH2 TRP A 24 0.935 -17.722 -2.350 1.00 0.00 H new ATOM 347 N GLN A 25 7.502 -20.226 2.523 1.00 0.00 N ATOM 348 CA GLN A 25 8.240 -20.104 3.774 1.00 0.00 C ATOM 349 C GLN A 25 7.631 -19.026 4.664 1.00 0.00 C ATOM 350 O GLN A 25 7.438 -17.888 4.234 1.00 0.00 O ATOM 351 CB GLN A 25 9.709 -19.781 3.494 1.00 0.00 C ATOM 352 CG GLN A 25 10.448 -20.891 2.764 1.00 0.00 C ATOM 353 CD GLN A 25 11.012 -21.935 3.706 1.00 0.00 C ATOM 354 OE1 GLN A 25 10.304 -22.459 4.567 1.00 0.00 O ATOM 355 NE2 GLN A 25 12.294 -22.245 3.549 1.00 0.00 N ATOM 0 H GLN A 25 7.390 -19.350 2.012 1.00 0.00 H new ATOM 0 HA GLN A 25 8.178 -21.058 4.297 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.765 -18.868 2.901 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.214 -19.579 4.438 1.00 0.00 H new ATOM 0 HG2 GLN A 25 9.769 -21.372 2.060 1.00 0.00 H new ATOM 0 HG3 GLN A 25 11.260 -20.458 2.180 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.844 -21.787 2.823 1.00 0.00 H new ATOM 0 HE22 GLN A 25 12.728 -22.942 4.155 1.00 0.00 H new ATOM 364 N TYR A 26 7.329 -19.390 5.905 1.00 0.00 N ATOM 365 CA TYR A 26 6.738 -18.455 6.854 1.00 0.00 C ATOM 366 C TYR A 26 7.670 -17.274 7.107 1.00 0.00 C ATOM 367 O TYR A 26 8.884 -17.441 7.224 1.00 0.00 O ATOM 368 CB TYR A 26 6.425 -19.163 8.173 1.00 0.00 C ATOM 369 CG TYR A 26 5.174 -20.010 8.123 1.00 0.00 C ATOM 370 CD1 TYR A 26 3.918 -19.424 8.028 1.00 0.00 C ATOM 371 CD2 TYR A 26 5.248 -21.397 8.171 1.00 0.00 C ATOM 372 CE1 TYR A 26 2.772 -20.195 7.983 1.00 0.00 C ATOM 373 CE2 TYR A 26 4.107 -22.175 8.126 1.00 0.00 C ATOM 374 CZ TYR A 26 2.872 -21.570 8.032 1.00 0.00 C ATOM 375 OH TYR A 26 1.733 -22.340 7.986 1.00 0.00 O ATOM 0 H TYR A 26 7.484 -20.327 6.277 1.00 0.00 H new ATOM 0 HA TYR A 26 5.811 -18.078 6.423 1.00 0.00 H new ATOM 0 HB2 TYR A 26 7.270 -19.794 8.446 1.00 0.00 H new ATOM 0 HB3 TYR A 26 6.317 -18.416 8.960 1.00 0.00 H new ATOM 0 HD1 TYR A 26 3.836 -18.348 7.989 1.00 0.00 H new ATOM 0 HD2 TYR A 26 6.214 -21.875 8.245 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.803 -19.724 7.910 1.00 0.00 H new ATOM 0 HE2 TYR A 26 4.182 -23.252 8.164 1.00 0.00 H new ATOM 0 HH TYR A 26 1.977 -23.288 8.029 1.00 0.00 H new ATOM 385 N ARG A 27 7.093 -16.080 7.189 1.00 0.00 N ATOM 386 CA ARG A 27 7.870 -14.870 7.428 1.00 0.00 C ATOM 387 C ARG A 27 7.012 -13.791 8.082 1.00 0.00 C ATOM 388 O ARG A 27 5.789 -13.785 7.939 1.00 0.00 O ATOM 389 CB ARG A 27 8.453 -14.345 6.114 1.00 0.00 C ATOM 390 CG ARG A 27 9.758 -13.585 6.287 1.00 0.00 C ATOM 391 CD ARG A 27 10.957 -14.518 6.234 1.00 0.00 C ATOM 392 NE ARG A 27 11.124 -15.265 7.477 1.00 0.00 N ATOM 393 CZ ARG A 27 11.792 -16.410 7.562 1.00 0.00 C ATOM 394 NH1 ARG A 27 12.353 -16.936 6.482 1.00 0.00 N ATOM 395 NH2 ARG A 27 11.900 -17.032 8.730 1.00 0.00 N ATOM 0 H ARG A 27 6.089 -15.925 7.093 1.00 0.00 H new ATOM 0 HA ARG A 27 8.686 -15.121 8.106 1.00 0.00 H new ATOM 0 HB2 ARG A 27 8.618 -15.184 5.439 1.00 0.00 H new ATOM 0 HB3 ARG A 27 7.722 -13.691 5.638 1.00 0.00 H new ATOM 0 HG2 ARG A 27 9.848 -12.831 5.505 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.749 -13.056 7.240 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.837 -15.216 5.405 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.859 -13.939 6.035 1.00 0.00 H new ATOM 0 HE ARG A 27 10.705 -14.887 8.327 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.272 -16.461 5.583 1.00 0.00 H new ATOM 0 HH12 ARG A 27 12.865 -17.815 6.550 1.00 0.00 H new ATOM 0 HH21 ARG A 27 11.470 -16.631 9.563 1.00 0.00 H new ATOM 0 HH22 ARG A 27 12.413 -17.911 8.794 1.00 0.00 H new ATOM 409 N PHE A 28 7.660 -12.881 8.801 1.00 0.00 N ATOM 410 CA PHE A 28 6.956 -11.799 9.479 1.00 0.00 C ATOM 411 C PHE A 28 6.897 -10.553 8.599 1.00 0.00 C ATOM 412 O PHE A 28 7.883 -10.183 7.960 1.00 0.00 O ATOM 413 CB PHE A 28 7.642 -11.468 10.805 1.00 0.00 C ATOM 414 CG PHE A 28 7.035 -10.293 11.518 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.705 -10.313 11.906 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.794 -9.169 11.800 1.00 0.00 C ATOM 417 CE1 PHE A 28 5.144 -9.233 12.560 1.00 0.00 C ATOM 418 CE2 PHE A 28 7.238 -8.086 12.455 1.00 0.00 C ATOM 419 CZ PHE A 28 5.911 -8.119 12.836 1.00 0.00 C ATOM 0 H PHE A 28 8.672 -12.871 8.929 1.00 0.00 H new ATOM 0 HA PHE A 28 5.937 -12.131 9.678 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.596 -12.341 11.456 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.696 -11.264 10.618 1.00 0.00 H new ATOM 0 HD1 PHE A 28 5.100 -11.182 11.695 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.832 -9.138 11.505 1.00 0.00 H new ATOM 0 HE1 PHE A 28 4.106 -9.260 12.855 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.840 -7.215 12.668 1.00 0.00 H new ATOM 0 HZ PHE A 28 5.474 -7.275 13.349 1.00 0.00 H new ATOM 429 N PHE A 29 5.734 -9.911 8.570 1.00 0.00 N ATOM 430 CA PHE A 29 5.545 -8.708 7.768 1.00 0.00 C ATOM 431 C PHE A 29 4.937 -7.586 8.605 1.00 0.00 C ATOM 432 O PHE A 29 4.130 -7.832 9.501 1.00 0.00 O ATOM 433 CB PHE A 29 4.646 -9.007 6.566 1.00 0.00 C ATOM 434 CG PHE A 29 5.303 -9.869 5.526 1.00 0.00 C ATOM 435 CD1 PHE A 29 5.327 -11.248 5.665 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.895 -9.302 4.410 1.00 0.00 C ATOM 437 CE1 PHE A 29 5.931 -12.043 4.710 1.00 0.00 C ATOM 438 CE2 PHE A 29 6.501 -10.092 3.451 1.00 0.00 C ATOM 439 CZ PHE A 29 6.518 -11.465 3.601 1.00 0.00 C ATOM 0 H PHE A 29 4.908 -10.204 9.093 1.00 0.00 H new ATOM 0 HA PHE A 29 6.522 -8.383 7.411 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.739 -9.500 6.915 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.341 -8.066 6.107 1.00 0.00 H new ATOM 0 HD1 PHE A 29 4.869 -11.706 6.529 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.883 -8.229 4.287 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.944 -13.116 4.830 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.960 -9.637 2.586 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.989 -12.085 2.853 1.00 0.00 H new ATOM 449 N VAL A 30 5.332 -6.353 8.306 1.00 0.00 N ATOM 450 CA VAL A 30 4.826 -5.192 9.029 1.00 0.00 C ATOM 451 C VAL A 30 4.586 -4.018 8.086 1.00 0.00 C ATOM 452 O VAL A 30 5.529 -3.366 7.637 1.00 0.00 O ATOM 453 CB VAL A 30 5.801 -4.754 10.138 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.283 -3.511 10.845 1.00 0.00 C ATOM 455 CG2 VAL A 30 6.024 -5.887 11.129 1.00 0.00 C ATOM 0 H VAL A 30 6.001 -6.132 7.568 1.00 0.00 H new ATOM 0 HA VAL A 30 3.880 -5.489 9.482 1.00 0.00 H new ATOM 0 HB VAL A 30 6.759 -4.509 9.679 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.985 -3.217 11.625 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.180 -2.699 10.125 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.312 -3.725 11.292 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.715 -5.560 11.906 1.00 0.00 H new ATOM 0 HG22 VAL A 30 5.073 -6.165 11.583 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.443 -6.748 10.609 1.00 0.00 H new ATOM 465 N LEU A 31 3.319 -3.754 7.790 1.00 0.00 N ATOM 466 CA LEU A 31 2.953 -2.658 6.900 1.00 0.00 C ATOM 467 C LEU A 31 3.125 -1.311 7.596 1.00 0.00 C ATOM 468 O LEU A 31 2.825 -1.172 8.781 1.00 0.00 O ATOM 469 CB LEU A 31 1.508 -2.820 6.426 1.00 0.00 C ATOM 470 CG LEU A 31 0.947 -1.676 5.580 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.332 -1.855 4.119 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.566 -1.595 5.728 1.00 0.00 C ATOM 0 H LEU A 31 2.527 -4.284 8.153 1.00 0.00 H new ATOM 0 HA LEU A 31 3.617 -2.687 6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.437 -3.741 5.848 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.871 -2.944 7.302 1.00 0.00 H new ATOM 0 HG LEU A 31 1.378 -0.740 5.937 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.924 -1.032 3.532 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.418 -1.863 4.027 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.930 -2.798 3.750 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.948 -0.775 5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.015 -2.532 5.398 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.820 -1.420 6.773 1.00 0.00 H new ATOM 484 N ASN A 32 3.607 -0.323 6.850 1.00 0.00 N ATOM 485 CA ASN A 32 3.817 1.014 7.395 1.00 0.00 C ATOM 486 C ASN A 32 2.908 2.029 6.710 1.00 0.00 C ATOM 487 O ASN A 32 3.071 2.325 5.527 1.00 0.00 O ATOM 488 CB ASN A 32 5.280 1.430 7.231 1.00 0.00 C ATOM 489 CG ASN A 32 5.718 2.430 8.284 1.00 0.00 C ATOM 490 OD1 ASN A 32 5.009 2.669 9.262 1.00 0.00 O ATOM 491 ND2 ASN A 32 6.891 3.020 8.087 1.00 0.00 N ATOM 0 H ASN A 32 3.860 -0.422 5.867 1.00 0.00 H new ATOM 0 HA ASN A 32 3.570 0.990 8.456 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.915 0.546 7.287 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.423 1.863 6.241 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.238 3.702 8.761 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.445 2.791 7.262 1.00 0.00 H new ATOM 498 N ASN A 33 1.950 2.561 7.463 1.00 0.00 N ATOM 499 CA ASN A 33 1.015 3.544 6.928 1.00 0.00 C ATOM 500 C ASN A 33 1.675 4.915 6.811 1.00 0.00 C ATOM 501 O ASN A 33 1.806 5.460 5.716 1.00 0.00 O ATOM 502 CB ASN A 33 -0.225 3.637 7.820 1.00 0.00 C ATOM 503 CG ASN A 33 0.122 3.624 9.296 1.00 0.00 C ATOM 504 OD1 ASN A 33 0.464 4.657 9.873 1.00 0.00 O ATOM 505 ND2 ASN A 33 0.036 2.452 9.914 1.00 0.00 N ATOM 0 H ASN A 33 1.801 2.328 8.445 1.00 0.00 H new ATOM 0 HA ASN A 33 0.715 3.219 5.932 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.770 4.552 7.586 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -0.892 2.803 7.599 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.258 2.382 10.907 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.252 1.622 9.396 1.00 0.00 H new ATOM 512 N GLU A 34 2.088 5.466 7.948 1.00 0.00 N ATOM 513 CA GLU A 34 2.734 6.773 7.973 1.00 0.00 C ATOM 514 C GLU A 34 3.667 6.941 6.778 1.00 0.00 C ATOM 515 O GLU A 34 3.724 8.008 6.166 1.00 0.00 O ATOM 516 CB GLU A 34 3.516 6.956 9.275 1.00 0.00 C ATOM 517 CG GLU A 34 4.419 5.781 9.612 1.00 0.00 C ATOM 518 CD GLU A 34 5.303 6.050 10.814 1.00 0.00 C ATOM 519 OE1 GLU A 34 6.149 6.965 10.734 1.00 0.00 O ATOM 520 OE2 GLU A 34 5.149 5.347 11.835 1.00 0.00 O ATOM 0 H GLU A 34 1.987 5.028 8.864 1.00 0.00 H new ATOM 0 HA GLU A 34 1.957 7.535 7.915 1.00 0.00 H new ATOM 0 HB2 GLU A 34 4.121 7.859 9.202 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.812 7.109 10.093 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.806 4.901 9.806 1.00 0.00 H new ATOM 0 HG3 GLU A 34 5.045 5.550 8.750 1.00 0.00 H new ATOM 527 N ALA A 35 4.398 5.880 6.451 1.00 0.00 N ATOM 528 CA ALA A 35 5.328 5.909 5.329 1.00 0.00 C ATOM 529 C ALA A 35 4.683 5.345 4.067 1.00 0.00 C ATOM 530 O ALA A 35 4.605 6.021 3.043 1.00 0.00 O ATOM 531 CB ALA A 35 6.592 5.134 5.671 1.00 0.00 C ATOM 0 H ALA A 35 4.364 4.990 6.947 1.00 0.00 H new ATOM 0 HA ALA A 35 5.594 6.948 5.136 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.278 5.164 4.824 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.070 5.584 6.541 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.335 4.098 5.893 1.00 0.00 H new ATOM 537 N GLY A 36 4.223 4.100 4.150 1.00 0.00 N ATOM 538 CA GLY A 36 3.592 3.465 3.007 1.00 0.00 C ATOM 539 C GLY A 36 4.488 2.435 2.348 1.00 0.00 C ATOM 540 O GLY A 36 4.401 2.207 1.141 1.00 0.00 O ATOM 0 H GLY A 36 4.276 3.520 4.988 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.667 2.986 3.327 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.321 4.227 2.276 1.00 0.00 H new ATOM 544 N LEU A 37 5.354 1.813 3.140 1.00 0.00 N ATOM 545 CA LEU A 37 6.271 0.802 2.626 1.00 0.00 C ATOM 546 C LEU A 37 6.035 -0.544 3.305 1.00 0.00 C ATOM 547 O LEU A 37 5.838 -0.613 4.519 1.00 0.00 O ATOM 548 CB LEU A 37 7.720 1.245 2.839 1.00 0.00 C ATOM 549 CG LEU A 37 8.319 2.128 1.743 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.373 3.058 2.324 1.00 0.00 C ATOM 551 CD2 LEU A 37 8.913 1.272 0.634 1.00 0.00 C ATOM 0 H LEU A 37 5.440 1.991 4.141 1.00 0.00 H new ATOM 0 HA LEU A 37 6.084 0.687 1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.779 1.784 3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.340 0.354 2.940 1.00 0.00 H new ATOM 0 HG LEU A 37 7.522 2.737 1.317 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.788 3.679 1.530 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.918 3.695 3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.169 2.467 2.777 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.335 1.917 -0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.698 0.637 1.045 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.133 0.648 0.198 1.00 0.00 H new ATOM 563 N LEU A 38 6.057 -1.611 2.514 1.00 0.00 N ATOM 564 CA LEU A 38 5.847 -2.956 3.038 1.00 0.00 C ATOM 565 C LEU A 38 7.177 -3.673 3.247 1.00 0.00 C ATOM 566 O LEU A 38 7.902 -3.946 2.291 1.00 0.00 O ATOM 567 CB LEU A 38 4.964 -3.764 2.085 1.00 0.00 C ATOM 568 CG LEU A 38 4.772 -5.239 2.437 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.648 -5.405 3.449 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.487 -6.054 1.183 1.00 0.00 C ATOM 0 H LEU A 38 6.218 -1.571 1.508 1.00 0.00 H new ATOM 0 HA LEU A 38 5.346 -2.869 4.002 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.983 -3.291 2.041 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.392 -3.703 1.085 1.00 0.00 H new ATOM 0 HG LEU A 38 5.694 -5.608 2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.526 -6.462 3.687 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.892 -4.854 4.357 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.720 -5.019 3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.353 -7.102 1.453 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.580 -5.683 0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.324 -5.962 0.491 1.00 0.00 H new ATOM 582 N GLU A 39 7.489 -3.976 4.503 1.00 0.00 N ATOM 583 CA GLU A 39 8.732 -4.662 4.837 1.00 0.00 C ATOM 584 C GLU A 39 8.452 -6.058 5.385 1.00 0.00 C ATOM 585 O GLU A 39 7.308 -6.402 5.685 1.00 0.00 O ATOM 586 CB GLU A 39 9.530 -3.851 5.859 1.00 0.00 C ATOM 587 CG GLU A 39 9.354 -2.348 5.715 1.00 0.00 C ATOM 588 CD GLU A 39 10.099 -1.569 6.781 1.00 0.00 C ATOM 589 OE1 GLU A 39 10.047 -1.977 7.961 1.00 0.00 O ATOM 590 OE2 GLU A 39 10.735 -0.551 6.435 1.00 0.00 O ATOM 0 H GLU A 39 6.899 -3.758 5.306 1.00 0.00 H new ATOM 0 HA GLU A 39 9.320 -4.760 3.924 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.228 -4.149 6.863 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.587 -4.096 5.759 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.705 -2.037 4.731 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.293 -2.104 5.766 1.00 0.00 H new ATOM 597 N TYR A 40 9.504 -6.859 5.514 1.00 0.00 N ATOM 598 CA TYR A 40 9.372 -8.219 6.023 1.00 0.00 C ATOM 599 C TYR A 40 10.671 -8.685 6.673 1.00 0.00 C ATOM 600 O TYR A 40 11.724 -8.709 6.035 1.00 0.00 O ATOM 601 CB TYR A 40 8.982 -9.173 4.894 1.00 0.00 C ATOM 602 CG TYR A 40 10.139 -9.559 4.000 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.996 -10.595 4.348 1.00 0.00 C ATOM 604 CD2 TYR A 40 10.374 -8.887 2.806 1.00 0.00 C ATOM 605 CE1 TYR A 40 12.055 -10.950 3.535 1.00 0.00 C ATOM 606 CE2 TYR A 40 11.429 -9.236 1.986 1.00 0.00 C ATOM 607 CZ TYR A 40 12.267 -10.268 2.355 1.00 0.00 C ATOM 608 OH TYR A 40 13.320 -10.620 1.541 1.00 0.00 O ATOM 0 H TYR A 40 10.458 -6.590 5.273 1.00 0.00 H new ATOM 0 HA TYR A 40 8.587 -8.223 6.779 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.550 -10.076 5.326 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.205 -8.707 4.288 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.832 -11.132 5.270 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.720 -8.078 2.515 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.713 -11.757 3.822 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.597 -8.704 1.061 1.00 0.00 H new ATOM 0 HH TYR A 40 13.328 -10.043 0.749 1.00 0.00 H new ATOM 618 N PHE A 41 10.588 -9.057 7.946 1.00 0.00 N ATOM 619 CA PHE A 41 11.757 -9.524 8.684 1.00 0.00 C ATOM 620 C PHE A 41 11.605 -10.992 9.070 1.00 0.00 C ATOM 621 O PHE A 41 10.491 -11.502 9.193 1.00 0.00 O ATOM 622 CB PHE A 41 11.967 -8.674 9.938 1.00 0.00 C ATOM 623 CG PHE A 41 11.805 -7.200 9.698 1.00 0.00 C ATOM 624 CD1 PHE A 41 10.543 -6.636 9.594 1.00 0.00 C ATOM 625 CD2 PHE A 41 12.914 -6.378 9.576 1.00 0.00 C ATOM 626 CE1 PHE A 41 10.391 -5.281 9.372 1.00 0.00 C ATOM 627 CE2 PHE A 41 12.768 -5.022 9.355 1.00 0.00 C ATOM 628 CZ PHE A 41 11.505 -4.472 9.253 1.00 0.00 C ATOM 0 H PHE A 41 9.724 -9.044 8.488 1.00 0.00 H new ATOM 0 HA PHE A 41 12.628 -9.425 8.037 1.00 0.00 H new ATOM 0 HB2 PHE A 41 11.258 -8.989 10.704 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.966 -8.862 10.332 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.669 -7.263 9.688 1.00 0.00 H new ATOM 0 HD2 PHE A 41 13.904 -6.802 9.655 1.00 0.00 H new ATOM 0 HE1 PHE A 41 9.402 -4.854 9.291 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.641 -4.393 9.262 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.388 -3.412 9.081 1.00 0.00 H new ATOM 638 N VAL A 42 12.734 -11.668 9.260 1.00 0.00 N ATOM 639 CA VAL A 42 12.729 -13.077 9.632 1.00 0.00 C ATOM 640 C VAL A 42 11.611 -13.379 10.624 1.00 0.00 C ATOM 641 O VAL A 42 10.895 -14.370 10.485 1.00 0.00 O ATOM 642 CB VAL A 42 14.075 -13.500 10.250 1.00 0.00 C ATOM 643 CG1 VAL A 42 13.988 -14.913 10.805 1.00 0.00 C ATOM 644 CG2 VAL A 42 15.190 -13.391 9.221 1.00 0.00 C ATOM 0 H VAL A 42 13.664 -11.261 9.162 1.00 0.00 H new ATOM 0 HA VAL A 42 12.563 -13.645 8.717 1.00 0.00 H new ATOM 0 HB VAL A 42 14.304 -12.825 11.075 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.948 -15.194 11.237 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.217 -14.955 11.575 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.736 -15.605 10.001 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.134 -13.694 9.674 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.969 -14.041 8.375 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.267 -12.360 8.876 1.00 0.00 H new ATOM 654 N ASN A 43 11.465 -12.516 11.624 1.00 0.00 N ATOM 655 CA ASN A 43 10.434 -12.690 12.640 1.00 0.00 C ATOM 656 C ASN A 43 10.097 -11.360 13.308 1.00 0.00 C ATOM 657 O ASN A 43 10.741 -10.344 13.048 1.00 0.00 O ATOM 658 CB ASN A 43 10.891 -13.701 13.694 1.00 0.00 C ATOM 659 CG ASN A 43 10.626 -15.134 13.273 1.00 0.00 C ATOM 660 OD1 ASN A 43 9.738 -15.401 12.464 1.00 0.00 O ATOM 661 ND2 ASN A 43 11.398 -16.064 13.824 1.00 0.00 N ATOM 0 H ASN A 43 12.048 -11.689 11.752 1.00 0.00 H new ATOM 0 HA ASN A 43 9.537 -13.067 12.149 1.00 0.00 H new ATOM 0 HB2 ASN A 43 11.957 -13.571 13.880 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.376 -13.500 14.634 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.266 -17.046 13.581 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.122 -15.796 14.490 1.00 0.00 H new ATOM 668 N GLU A 44 9.085 -11.376 14.170 1.00 0.00 N ATOM 669 CA GLU A 44 8.664 -10.171 14.874 1.00 0.00 C ATOM 670 C GLU A 44 9.825 -9.565 15.658 1.00 0.00 C ATOM 671 O GLU A 44 10.096 -8.369 15.560 1.00 0.00 O ATOM 672 CB GLU A 44 7.504 -10.485 15.820 1.00 0.00 C ATOM 673 CG GLU A 44 6.999 -9.275 16.588 1.00 0.00 C ATOM 674 CD GLU A 44 6.319 -9.653 17.890 1.00 0.00 C ATOM 675 OE1 GLU A 44 5.408 -10.506 17.857 1.00 0.00 O ATOM 676 OE2 GLU A 44 6.697 -9.094 18.941 1.00 0.00 O ATOM 0 H GLU A 44 8.542 -12.209 14.397 1.00 0.00 H new ATOM 0 HA GLU A 44 8.331 -9.445 14.132 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.681 -10.908 15.244 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.822 -11.248 16.530 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.835 -8.608 16.799 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.298 -8.720 15.964 1.00 0.00 H new ATOM 683 N GLN A 45 10.505 -10.400 16.437 1.00 0.00 N ATOM 684 CA GLN A 45 11.635 -9.947 17.239 1.00 0.00 C ATOM 685 C GLN A 45 12.633 -9.173 16.384 1.00 0.00 C ATOM 686 O GLN A 45 13.390 -8.345 16.893 1.00 0.00 O ATOM 687 CB GLN A 45 12.329 -11.140 17.899 1.00 0.00 C ATOM 688 CG GLN A 45 11.552 -11.725 19.068 1.00 0.00 C ATOM 689 CD GLN A 45 11.553 -10.817 20.282 1.00 0.00 C ATOM 690 OE1 GLN A 45 10.717 -9.921 20.402 1.00 0.00 O ATOM 691 NE2 GLN A 45 12.493 -11.045 21.191 1.00 0.00 N ATOM 0 H GLN A 45 10.293 -11.393 16.530 1.00 0.00 H new ATOM 0 HA GLN A 45 11.255 -9.282 18.014 1.00 0.00 H new ATOM 0 HB2 GLN A 45 12.485 -11.918 17.152 1.00 0.00 H new ATOM 0 HB3 GLN A 45 13.314 -10.830 18.247 1.00 0.00 H new ATOM 0 HG2 GLN A 45 10.523 -11.911 18.759 1.00 0.00 H new ATOM 0 HG3 GLN A 45 11.982 -12.689 19.340 1.00 0.00 H new ATOM 0 HE21 GLN A 45 13.166 -11.799 21.051 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.542 -10.467 22.030 1.00 0.00 H new ATOM 700 N SER A 46 12.629 -9.447 15.084 1.00 0.00 N ATOM 701 CA SER A 46 13.537 -8.778 14.159 1.00 0.00 C ATOM 702 C SER A 46 12.807 -7.699 13.365 1.00 0.00 C ATOM 703 O SER A 46 13.073 -7.498 12.180 1.00 0.00 O ATOM 704 CB SER A 46 14.165 -9.794 13.203 1.00 0.00 C ATOM 705 OG SER A 46 13.278 -10.115 12.146 1.00 0.00 O ATOM 0 H SER A 46 12.007 -10.127 14.647 1.00 0.00 H new ATOM 0 HA SER A 46 14.326 -8.303 14.743 1.00 0.00 H new ATOM 0 HB2 SER A 46 15.091 -9.390 12.795 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.427 -10.700 13.750 1.00 0.00 H new ATOM 0 HG SER A 46 12.355 -10.084 12.473 1.00 0.00 H new ATOM 711 N ARG A 47 11.885 -7.009 14.027 1.00 0.00 N ATOM 712 CA ARG A 47 11.114 -5.951 13.384 1.00 0.00 C ATOM 713 C ARG A 47 11.865 -4.624 13.434 1.00 0.00 C ATOM 714 O ARG A 47 11.718 -3.783 12.548 1.00 0.00 O ATOM 715 CB ARG A 47 9.749 -5.803 14.058 1.00 0.00 C ATOM 716 CG ARG A 47 9.823 -5.219 15.460 1.00 0.00 C ATOM 717 CD ARG A 47 8.531 -4.509 15.836 1.00 0.00 C ATOM 718 NE ARG A 47 8.664 -3.753 17.078 1.00 0.00 N ATOM 719 CZ ARG A 47 7.631 -3.370 17.819 1.00 0.00 C ATOM 720 NH1 ARG A 47 6.395 -3.671 17.445 1.00 0.00 N ATOM 721 NH2 ARG A 47 7.832 -2.685 18.938 1.00 0.00 N ATOM 0 H ARG A 47 11.653 -7.163 15.008 1.00 0.00 H new ATOM 0 HA ARG A 47 10.967 -6.227 12.340 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.116 -5.166 13.441 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.268 -6.780 14.105 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.024 -6.015 16.177 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.656 -4.518 15.520 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.240 -3.835 15.030 1.00 0.00 H new ATOM 0 HD3 ARG A 47 7.732 -5.243 15.942 1.00 0.00 H new ATOM 0 HE ARG A 47 9.602 -3.506 17.394 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.236 -4.198 16.586 1.00 0.00 H new ATOM 0 HH12 ARG A 47 5.603 -3.376 18.016 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.781 -2.452 19.230 1.00 0.00 H new ATOM 0 HH22 ARG A 47 7.037 -2.392 19.506 1.00 0.00 H new ATOM 735 N ASN A 48 12.670 -4.444 14.476 1.00 0.00 N ATOM 736 CA ASN A 48 13.443 -3.219 14.643 1.00 0.00 C ATOM 737 C ASN A 48 14.678 -3.229 13.747 1.00 0.00 C ATOM 738 O ASN A 48 15.016 -2.221 13.128 1.00 0.00 O ATOM 739 CB ASN A 48 13.861 -3.049 16.105 1.00 0.00 C ATOM 740 CG ASN A 48 14.656 -1.779 16.335 1.00 0.00 C ATOM 741 OD1 ASN A 48 15.872 -1.820 16.519 1.00 0.00 O ATOM 742 ND2 ASN A 48 13.970 -0.642 16.326 1.00 0.00 N ATOM 0 H ASN A 48 12.804 -5.131 15.218 1.00 0.00 H new ATOM 0 HA ASN A 48 12.812 -2.379 14.353 1.00 0.00 H new ATOM 0 HB2 ASN A 48 12.972 -3.037 16.735 1.00 0.00 H new ATOM 0 HB3 ASN A 48 14.457 -3.908 16.412 1.00 0.00 H new ATOM 0 HD21 ASN A 48 14.451 0.245 16.476 1.00 0.00 H new ATOM 0 HD22 ASN A 48 12.962 -0.656 16.169 1.00 0.00 H new ATOM 749 N GLN A 49 15.347 -4.376 13.685 1.00 0.00 N ATOM 750 CA GLN A 49 16.545 -4.517 12.865 1.00 0.00 C ATOM 751 C GLN A 49 16.263 -4.128 11.418 1.00 0.00 C ATOM 752 O GLN A 49 15.130 -3.804 11.060 1.00 0.00 O ATOM 753 CB GLN A 49 17.064 -5.955 12.927 1.00 0.00 C ATOM 754 CG GLN A 49 18.510 -6.099 12.480 1.00 0.00 C ATOM 755 CD GLN A 49 19.218 -7.255 13.158 1.00 0.00 C ATOM 756 OE1 GLN A 49 18.799 -8.407 13.046 1.00 0.00 O ATOM 757 NE2 GLN A 49 20.300 -6.953 13.867 1.00 0.00 N ATOM 0 H GLN A 49 15.080 -5.220 14.192 1.00 0.00 H new ATOM 0 HA GLN A 49 17.307 -3.845 13.261 1.00 0.00 H new ATOM 0 HB2 GLN A 49 16.970 -6.323 13.949 1.00 0.00 H new ATOM 0 HB3 GLN A 49 16.434 -6.587 12.301 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.540 -6.243 11.400 1.00 0.00 H new ATOM 0 HG3 GLN A 49 19.046 -5.174 12.693 1.00 0.00 H new ATOM 0 HE21 GLN A 49 20.612 -5.984 13.933 1.00 0.00 H new ATOM 0 HE22 GLN A 49 20.818 -7.690 14.345 1.00 0.00 H new ATOM 766 N LYS A 50 17.301 -4.162 10.588 1.00 0.00 N ATOM 767 CA LYS A 50 17.166 -3.814 9.179 1.00 0.00 C ATOM 768 C LYS A 50 16.313 -4.843 8.443 1.00 0.00 C ATOM 769 O LYS A 50 16.467 -6.051 8.619 1.00 0.00 O ATOM 770 CB LYS A 50 18.545 -3.715 8.523 1.00 0.00 C ATOM 771 CG LYS A 50 18.536 -2.976 7.196 1.00 0.00 C ATOM 772 CD LYS A 50 18.308 -1.486 7.390 1.00 0.00 C ATOM 773 CE LYS A 50 19.587 -0.776 7.809 1.00 0.00 C ATOM 774 NZ LYS A 50 20.619 -0.815 6.736 1.00 0.00 N ATOM 0 H LYS A 50 18.245 -4.427 10.868 1.00 0.00 H new ATOM 0 HA LYS A 50 16.670 -2.846 9.116 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.228 -3.209 9.206 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.937 -4.720 8.367 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.484 -3.136 6.683 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.754 -3.385 6.556 1.00 0.00 H new ATOM 0 HD2 LYS A 50 17.936 -1.050 6.463 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.539 -1.330 8.147 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.362 0.261 8.059 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.983 -1.243 8.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.310 -0.053 6.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 21.106 -1.734 6.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.163 -0.686 5.810 1.00 0.00 H new ATOM 788 N PRO A 51 15.393 -4.355 7.598 1.00 0.00 N ATOM 789 CA PRO A 51 14.500 -5.215 6.818 1.00 0.00 C ATOM 790 C PRO A 51 15.239 -5.980 5.725 1.00 0.00 C ATOM 791 O PRO A 51 16.224 -5.492 5.171 1.00 0.00 O ATOM 792 CB PRO A 51 13.506 -4.228 6.201 1.00 0.00 C ATOM 793 CG PRO A 51 14.242 -2.935 6.144 1.00 0.00 C ATOM 794 CD PRO A 51 15.154 -2.925 7.340 1.00 0.00 C ATOM 0 HA PRO A 51 14.033 -5.982 7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.194 -4.550 5.208 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.604 -4.144 6.807 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.811 -2.850 5.218 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.552 -2.092 6.172 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.083 -2.393 7.133 1.00 0.00 H new ATOM 0 HD3 PRO A 51 14.690 -2.434 8.195 1.00 0.00 H new ATOM 802 N ARG A 52 14.758 -7.181 5.420 1.00 0.00 N ATOM 803 CA ARG A 52 15.375 -8.013 4.394 1.00 0.00 C ATOM 804 C ARG A 52 14.978 -7.538 2.999 1.00 0.00 C ATOM 805 O ARG A 52 15.738 -7.687 2.042 1.00 0.00 O ATOM 806 CB ARG A 52 14.969 -9.476 4.582 1.00 0.00 C ATOM 807 CG ARG A 52 15.228 -10.005 5.983 1.00 0.00 C ATOM 808 CD ARG A 52 16.651 -10.522 6.128 1.00 0.00 C ATOM 809 NE ARG A 52 16.929 -11.625 5.213 1.00 0.00 N ATOM 810 CZ ARG A 52 18.072 -12.303 5.204 1.00 0.00 C ATOM 811 NH1 ARG A 52 19.038 -11.991 6.058 1.00 0.00 N ATOM 812 NH2 ARG A 52 18.250 -13.294 4.341 1.00 0.00 N ATOM 0 H ARG A 52 13.943 -7.599 5.869 1.00 0.00 H new ATOM 0 HA ARG A 52 16.457 -7.928 4.494 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.909 -9.582 4.353 1.00 0.00 H new ATOM 0 HB3 ARG A 52 15.513 -10.090 3.865 1.00 0.00 H new ATOM 0 HG2 ARG A 52 15.051 -9.213 6.711 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.524 -10.806 6.207 1.00 0.00 H new ATOM 0 HD2 ARG A 52 17.353 -9.709 5.940 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.814 -10.852 7.154 1.00 0.00 H new ATOM 0 HE ARG A 52 16.206 -11.890 4.544 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.904 -11.229 6.723 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.914 -12.513 6.049 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.509 -13.537 3.683 1.00 0.00 H new ATOM 0 HH22 ARG A 52 19.128 -13.814 4.335 1.00 0.00 H new ATOM 826 N GLY A 53 13.782 -6.967 2.891 1.00 0.00 N ATOM 827 CA GLY A 53 13.305 -6.481 1.610 1.00 0.00 C ATOM 828 C GLY A 53 12.057 -5.631 1.740 1.00 0.00 C ATOM 829 O GLY A 53 11.111 -6.005 2.434 1.00 0.00 O ATOM 0 H GLY A 53 13.135 -6.832 3.668 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.091 -5.896 1.131 1.00 0.00 H new ATOM 0 HA3 GLY A 53 13.097 -7.329 0.958 1.00 0.00 H new ATOM 833 N THR A 54 12.054 -4.481 1.073 1.00 0.00 N ATOM 834 CA THR A 54 10.915 -3.573 1.120 1.00 0.00 C ATOM 835 C THR A 54 10.280 -3.416 -0.257 1.00 0.00 C ATOM 836 O THR A 54 10.874 -3.782 -1.271 1.00 0.00 O ATOM 837 CB THR A 54 11.324 -2.184 1.645 1.00 0.00 C ATOM 838 OG1 THR A 54 12.058 -1.477 0.639 1.00 0.00 O ATOM 839 CG2 THR A 54 12.170 -2.309 2.904 1.00 0.00 C ATOM 0 H THR A 54 12.828 -4.156 0.494 1.00 0.00 H new ATOM 0 HA THR A 54 10.189 -4.012 1.804 1.00 0.00 H new ATOM 0 HB THR A 54 10.417 -1.630 1.889 1.00 0.00 H new ATOM 0 HG1 THR A 54 12.313 -0.594 0.980 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.447 -1.315 3.256 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.598 -2.822 3.677 1.00 0.00 H new ATOM 0 HG23 THR A 54 13.072 -2.879 2.681 1.00 0.00 H new ATOM 847 N LEU A 55 9.069 -2.870 -0.286 1.00 0.00 N ATOM 848 CA LEU A 55 8.353 -2.664 -1.540 1.00 0.00 C ATOM 849 C LEU A 55 7.418 -1.462 -1.442 1.00 0.00 C ATOM 850 O LEU A 55 6.686 -1.312 -0.465 1.00 0.00 O ATOM 851 CB LEU A 55 7.555 -3.917 -1.906 1.00 0.00 C ATOM 852 CG LEU A 55 6.745 -3.842 -3.201 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.632 -4.129 -4.402 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.575 -4.814 -3.156 1.00 0.00 C ATOM 0 H LEU A 55 8.563 -2.562 0.544 1.00 0.00 H new ATOM 0 HA LEU A 55 9.087 -2.467 -2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 55 8.248 -4.755 -1.982 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.872 -4.141 -1.086 1.00 0.00 H new ATOM 0 HG LEU A 55 6.348 -2.832 -3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 55 7.039 -4.071 -5.315 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.436 -3.394 -4.445 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.058 -5.128 -4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 55 5.010 -4.747 -4.086 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.950 -5.830 -3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.925 -4.563 -2.318 1.00 0.00 H new ATOM 866 N GLN A 56 7.449 -0.611 -2.462 1.00 0.00 N ATOM 867 CA GLN A 56 6.603 0.577 -2.491 1.00 0.00 C ATOM 868 C GLN A 56 5.150 0.203 -2.764 1.00 0.00 C ATOM 869 O GLN A 56 4.868 -0.705 -3.546 1.00 0.00 O ATOM 870 CB GLN A 56 7.099 1.556 -3.556 1.00 0.00 C ATOM 871 CG GLN A 56 8.137 2.541 -3.041 1.00 0.00 C ATOM 872 CD GLN A 56 9.024 3.084 -4.144 1.00 0.00 C ATOM 873 OE1 GLN A 56 8.968 2.624 -5.285 1.00 0.00 O ATOM 874 NE2 GLN A 56 9.850 4.068 -3.809 1.00 0.00 N ATOM 0 H GLN A 56 8.050 -0.721 -3.279 1.00 0.00 H new ATOM 0 HA GLN A 56 6.658 1.056 -1.514 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.526 0.992 -4.386 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.248 2.111 -3.952 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.631 3.370 -2.545 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.756 2.051 -2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 56 9.863 4.419 -2.851 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.471 4.473 -4.509 1.00 0.00 H new ATOM 883 N LEU A 57 4.231 0.909 -2.114 1.00 0.00 N ATOM 884 CA LEU A 57 2.806 0.652 -2.286 1.00 0.00 C ATOM 885 C LEU A 57 2.139 1.782 -3.065 1.00 0.00 C ATOM 886 O LEU A 57 1.130 1.573 -3.739 1.00 0.00 O ATOM 887 CB LEU A 57 2.129 0.488 -0.924 1.00 0.00 C ATOM 888 CG LEU A 57 2.408 -0.824 -0.190 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.952 -0.733 1.258 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.724 -1.986 -0.895 1.00 0.00 C ATOM 0 H LEU A 57 4.448 1.664 -1.463 1.00 0.00 H new ATOM 0 HA LEU A 57 2.695 -0.272 -2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.441 1.313 -0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.052 0.582 -1.062 1.00 0.00 H new ATOM 0 HG LEU A 57 3.483 -1.002 -0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.159 -1.676 1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.489 0.073 1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.881 -0.531 1.290 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.934 -2.911 -0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.648 -1.815 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.100 -2.065 -1.915 1.00 0.00 H new ATOM 902 N ALA A 58 2.711 2.977 -2.969 1.00 0.00 N ATOM 903 CA ALA A 58 2.174 4.139 -3.668 1.00 0.00 C ATOM 904 C ALA A 58 2.087 3.884 -5.169 1.00 0.00 C ATOM 905 O ALA A 58 3.077 4.011 -5.889 1.00 0.00 O ATOM 906 CB ALA A 58 3.030 5.365 -3.387 1.00 0.00 C ATOM 0 H ALA A 58 3.546 3.167 -2.414 1.00 0.00 H new ATOM 0 HA ALA A 58 1.165 4.322 -3.298 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.618 6.225 -3.915 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.037 5.566 -2.316 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.049 5.183 -3.729 1.00 0.00 H new ATOM 912 N GLY A 59 0.895 3.524 -5.636 1.00 0.00 N ATOM 913 CA GLY A 59 0.702 3.256 -7.049 1.00 0.00 C ATOM 914 C GLY A 59 0.707 1.774 -7.365 1.00 0.00 C ATOM 915 O GLY A 59 0.922 1.377 -8.510 1.00 0.00 O ATOM 0 H GLY A 59 0.060 3.413 -5.061 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.244 3.690 -7.372 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.489 3.748 -7.620 1.00 0.00 H new ATOM 919 N ALA A 60 0.472 0.953 -6.347 1.00 0.00 N ATOM 920 CA ALA A 60 0.450 -0.494 -6.521 1.00 0.00 C ATOM 921 C ALA A 60 -0.976 -1.005 -6.698 1.00 0.00 C ATOM 922 O ALA A 60 -1.940 -0.270 -6.484 1.00 0.00 O ATOM 923 CB ALA A 60 1.115 -1.179 -5.336 1.00 0.00 C ATOM 0 H ALA A 60 0.294 1.266 -5.393 1.00 0.00 H new ATOM 0 HA ALA A 60 1.009 -0.734 -7.426 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.091 -2.259 -5.480 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.150 -0.846 -5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.581 -0.923 -4.421 1.00 0.00 H new ATOM 929 N VAL A 61 -1.103 -2.268 -7.090 1.00 0.00 N ATOM 930 CA VAL A 61 -2.411 -2.877 -7.295 1.00 0.00 C ATOM 931 C VAL A 61 -2.496 -4.240 -6.617 1.00 0.00 C ATOM 932 O VAL A 61 -1.592 -5.067 -6.748 1.00 0.00 O ATOM 933 CB VAL A 61 -2.726 -3.042 -8.794 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.865 -4.029 -8.996 1.00 0.00 C ATOM 935 CG2 VAL A 61 -3.058 -1.695 -9.418 1.00 0.00 C ATOM 0 H VAL A 61 -0.315 -2.890 -7.272 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.145 -2.206 -6.849 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.842 -3.440 -9.292 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.073 -4.132 -10.061 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.583 -4.999 -8.586 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.757 -3.665 -8.486 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.278 -1.829 -10.477 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.927 -1.267 -8.918 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.207 -1.023 -9.306 1.00 0.00 H new ATOM 945 N ILE A 62 -3.586 -4.468 -5.892 1.00 0.00 N ATOM 946 CA ILE A 62 -3.789 -5.732 -5.195 1.00 0.00 C ATOM 947 C ILE A 62 -4.706 -6.656 -5.988 1.00 0.00 C ATOM 948 O ILE A 62 -5.877 -6.347 -6.208 1.00 0.00 O ATOM 949 CB ILE A 62 -4.388 -5.512 -3.793 1.00 0.00 C ATOM 950 CG1 ILE A 62 -3.391 -4.771 -2.899 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.779 -6.843 -3.169 1.00 0.00 C ATOM 952 CD1 ILE A 62 -3.116 -3.353 -3.347 1.00 0.00 C ATOM 0 H ILE A 62 -4.342 -3.794 -5.772 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.808 -6.197 -5.093 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.285 -4.901 -3.889 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.774 -4.753 -1.879 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.453 -5.325 -2.878 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.201 -6.671 -2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.520 -7.336 -3.798 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.897 -7.477 -3.082 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.401 -2.889 -2.667 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.703 -3.364 -4.356 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.045 -2.783 -3.341 1.00 0.00 H new ATOM 964 N SER A 63 -4.166 -7.794 -6.413 1.00 0.00 N ATOM 965 CA SER A 63 -4.935 -8.764 -7.184 1.00 0.00 C ATOM 966 C SER A 63 -4.994 -10.107 -6.463 1.00 0.00 C ATOM 967 O SER A 63 -4.124 -10.964 -6.622 1.00 0.00 O ATOM 968 CB SER A 63 -4.322 -8.944 -8.574 1.00 0.00 C ATOM 969 OG SER A 63 -5.281 -9.436 -9.494 1.00 0.00 O ATOM 0 H SER A 63 -3.199 -8.067 -6.236 1.00 0.00 H new ATOM 0 HA SER A 63 -5.951 -8.384 -7.290 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.929 -7.991 -8.928 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.480 -9.634 -8.517 1.00 0.00 H new ATOM 0 HG SER A 63 -4.865 -9.541 -10.375 1.00 0.00 H new ATOM 975 N PRO A 64 -6.044 -10.297 -5.651 1.00 0.00 N ATOM 976 CA PRO A 64 -6.243 -11.533 -4.889 1.00 0.00 C ATOM 977 C PRO A 64 -6.598 -12.715 -5.784 1.00 0.00 C ATOM 978 O PRO A 64 -7.582 -12.674 -6.522 1.00 0.00 O ATOM 979 CB PRO A 64 -7.412 -11.195 -3.961 1.00 0.00 C ATOM 980 CG PRO A 64 -8.155 -10.113 -4.668 1.00 0.00 C ATOM 981 CD PRO A 64 -7.119 -9.319 -5.413 1.00 0.00 C ATOM 0 HA PRO A 64 -5.338 -11.837 -4.363 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.046 -12.065 -3.790 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.059 -10.861 -2.985 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -8.894 -10.530 -5.352 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -8.695 -9.484 -3.961 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.514 -8.921 -6.348 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.767 -8.469 -4.828 1.00 0.00 H new ATOM 989 N SER A 65 -5.790 -13.769 -5.715 1.00 0.00 N ATOM 990 CA SER A 65 -6.017 -14.961 -6.522 1.00 0.00 C ATOM 991 C SER A 65 -7.332 -15.634 -6.139 1.00 0.00 C ATOM 992 O SER A 65 -8.030 -15.185 -5.229 1.00 0.00 O ATOM 993 CB SER A 65 -4.859 -15.946 -6.353 1.00 0.00 C ATOM 994 OG SER A 65 -4.824 -16.880 -7.418 1.00 0.00 O ATOM 0 H SER A 65 -4.972 -13.821 -5.108 1.00 0.00 H new ATOM 0 HA SER A 65 -6.075 -14.656 -7.567 1.00 0.00 H new ATOM 0 HB2 SER A 65 -3.916 -15.400 -6.313 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.962 -16.474 -5.405 1.00 0.00 H new ATOM 0 HG SER A 65 -4.074 -17.497 -7.287 1.00 0.00 H new ATOM 1000 N ASP A 66 -7.663 -16.713 -6.839 1.00 0.00 N ATOM 1001 CA ASP A 66 -8.892 -17.450 -6.573 1.00 0.00 C ATOM 1002 C ASP A 66 -8.617 -18.947 -6.468 1.00 0.00 C ATOM 1003 O ASP A 66 -9.229 -19.645 -5.659 1.00 0.00 O ATOM 1004 CB ASP A 66 -9.920 -17.184 -7.673 1.00 0.00 C ATOM 1005 CG ASP A 66 -11.084 -18.154 -7.626 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -11.724 -18.261 -6.558 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -11.356 -18.807 -8.655 1.00 0.00 O ATOM 0 H ASP A 66 -7.097 -17.097 -7.596 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.294 -17.105 -5.620 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -10.296 -16.165 -7.576 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.433 -17.253 -8.646 1.00 0.00 H new ATOM 1012 N GLU A 67 -7.694 -19.433 -7.291 1.00 0.00 N ATOM 1013 CA GLU A 67 -7.340 -20.848 -7.292 1.00 0.00 C ATOM 1014 C GLU A 67 -7.324 -21.405 -5.871 1.00 0.00 C ATOM 1015 O GLU A 67 -8.121 -22.278 -5.527 1.00 0.00 O ATOM 1016 CB GLU A 67 -5.973 -21.054 -7.947 1.00 0.00 C ATOM 1017 CG GLU A 67 -6.045 -21.276 -9.449 1.00 0.00 C ATOM 1018 CD GLU A 67 -6.424 -22.699 -9.810 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -5.729 -23.632 -9.355 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -7.415 -22.880 -10.548 1.00 0.00 O ATOM 0 H GLU A 67 -7.178 -18.868 -7.966 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.095 -21.385 -7.867 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.348 -20.183 -7.746 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.483 -21.911 -7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.774 -20.589 -9.880 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.080 -21.037 -9.895 1.00 0.00 H new ATOM 1027 N ASP A 68 -6.412 -20.895 -5.052 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.291 -21.340 -3.669 1.00 0.00 C ATOM 1029 C ASP A 68 -7.244 -20.565 -2.764 1.00 0.00 C ATOM 1030 O ASP A 68 -7.633 -19.439 -3.074 1.00 0.00 O ATOM 1031 CB ASP A 68 -4.852 -21.171 -3.179 1.00 0.00 C ATOM 1032 CG ASP A 68 -3.979 -22.361 -3.527 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -4.471 -23.505 -3.434 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -2.804 -22.148 -3.892 1.00 0.00 O ATOM 0 H ASP A 68 -5.745 -20.172 -5.322 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.558 -22.396 -3.629 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.425 -20.270 -3.619 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -4.853 -21.029 -2.098 1.00 0.00 H new ATOM 1039 N SER A 69 -7.616 -21.176 -1.643 1.00 0.00 N ATOM 1040 CA SER A 69 -8.527 -20.546 -0.695 1.00 0.00 C ATOM 1041 C SER A 69 -7.951 -19.230 -0.180 1.00 0.00 C ATOM 1042 O SER A 69 -8.557 -18.170 -0.335 1.00 0.00 O ATOM 1043 CB SER A 69 -8.808 -21.487 0.478 1.00 0.00 C ATOM 1044 OG SER A 69 -8.963 -22.823 0.034 1.00 0.00 O ATOM 0 H SER A 69 -7.300 -22.107 -1.370 1.00 0.00 H new ATOM 0 HA SER A 69 -9.462 -20.335 -1.214 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.990 -21.432 1.196 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.711 -21.166 0.998 1.00 0.00 H new ATOM 0 HG SER A 69 -9.140 -23.405 0.803 1.00 0.00 H new ATOM 1050 N HIS A 70 -6.774 -19.307 0.433 1.00 0.00 N ATOM 1051 CA HIS A 70 -6.113 -18.124 0.972 1.00 0.00 C ATOM 1052 C HIS A 70 -4.874 -17.774 0.154 1.00 0.00 C ATOM 1053 O HIS A 70 -3.869 -18.485 0.193 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.727 -18.349 2.433 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.664 -19.259 3.167 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -6.286 -20.001 4.266 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -7.971 -19.541 2.955 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -7.320 -20.703 4.697 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -8.354 -20.441 3.919 1.00 0.00 N ATOM 0 H HIS A 70 -6.258 -20.177 0.569 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.813 -17.290 0.914 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.721 -18.767 2.474 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.694 -17.387 2.944 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.596 -19.134 2.174 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -7.319 -21.376 5.542 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -9.287 -20.842 4.018 1.00 0.00 H new ATOM 1068 N THR A 71 -4.951 -16.674 -0.589 1.00 0.00 N ATOM 1069 CA THR A 71 -3.837 -16.231 -1.417 1.00 0.00 C ATOM 1070 C THR A 71 -4.081 -14.828 -1.963 1.00 0.00 C ATOM 1071 O THR A 71 -5.222 -14.437 -2.210 1.00 0.00 O ATOM 1072 CB THR A 71 -3.597 -17.193 -2.596 1.00 0.00 C ATOM 1073 OG1 THR A 71 -3.034 -18.420 -2.120 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.666 -16.567 -3.624 1.00 0.00 C ATOM 0 H THR A 71 -5.774 -16.074 -0.634 1.00 0.00 H new ATOM 0 HA THR A 71 -2.953 -16.221 -0.779 1.00 0.00 H new ATOM 0 HB THR A 71 -4.556 -17.395 -3.073 1.00 0.00 H new ATOM 0 HG1 THR A 71 -2.870 -18.352 -1.156 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.511 -17.265 -4.447 1.00 0.00 H new ATOM 0 HG22 THR A 71 -3.111 -15.648 -4.006 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.708 -16.339 -3.156 1.00 0.00 H new ATOM 1082 N PHE A 72 -3.002 -14.075 -2.149 1.00 0.00 N ATOM 1083 CA PHE A 72 -3.099 -12.715 -2.665 1.00 0.00 C ATOM 1084 C PHE A 72 -1.745 -12.227 -3.171 1.00 0.00 C ATOM 1085 O PHE A 72 -0.704 -12.800 -2.847 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.621 -11.771 -1.580 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.674 -11.602 -0.427 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -2.624 -12.544 0.589 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -1.835 -10.502 -0.358 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -1.754 -12.390 1.652 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -0.962 -10.344 0.703 1.00 0.00 C ATOM 1092 CZ PHE A 72 -0.921 -11.290 1.708 1.00 0.00 C ATOM 0 H PHE A 72 -2.050 -14.384 -1.950 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.799 -12.720 -3.500 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.819 -10.795 -2.023 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.572 -12.150 -1.206 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.272 -13.407 0.549 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -1.863 -9.759 -1.142 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -1.726 -13.130 2.438 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -0.313 -9.482 0.745 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.239 -11.170 2.536 1.00 0.00 H new ATOM 1102 N THR A 73 -1.766 -11.164 -3.970 1.00 0.00 N ATOM 1103 CA THR A 73 -0.541 -10.599 -4.523 1.00 0.00 C ATOM 1104 C THR A 73 -0.562 -9.076 -4.461 1.00 0.00 C ATOM 1105 O THR A 73 -1.607 -8.452 -4.642 1.00 0.00 O ATOM 1106 CB THR A 73 -0.329 -11.040 -5.983 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.494 -10.739 -6.760 1.00 0.00 O ATOM 1108 CG2 THR A 73 -0.032 -12.530 -6.061 1.00 0.00 C ATOM 0 H THR A 73 -2.618 -10.677 -4.248 1.00 0.00 H new ATOM 0 HA THR A 73 0.283 -10.973 -3.915 1.00 0.00 H new ATOM 0 HB THR A 73 0.525 -10.494 -6.384 1.00 0.00 H new ATOM 0 HG1 THR A 73 -2.267 -11.213 -6.388 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.114 -12.818 -7.102 1.00 0.00 H new ATOM 0 HG22 THR A 73 0.872 -12.751 -5.493 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.869 -13.090 -5.644 1.00 0.00 H new ATOM 1116 N VAL A 74 0.600 -8.484 -4.204 1.00 0.00 N ATOM 1117 CA VAL A 74 0.716 -7.033 -4.121 1.00 0.00 C ATOM 1118 C VAL A 74 1.543 -6.480 -5.276 1.00 0.00 C ATOM 1119 O VAL A 74 2.770 -6.434 -5.208 1.00 0.00 O ATOM 1120 CB VAL A 74 1.358 -6.597 -2.790 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.579 -5.092 -2.771 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.495 -7.032 -1.615 1.00 0.00 C ATOM 0 H VAL A 74 1.474 -8.987 -4.050 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.296 -6.631 -4.178 1.00 0.00 H new ATOM 0 HB VAL A 74 2.329 -7.084 -2.698 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.033 -4.803 -1.823 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.240 -4.811 -3.591 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.622 -4.582 -2.885 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.963 -6.716 -0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.491 -6.575 -1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.393 -8.117 -1.620 1.00 0.00 H new ATOM 1132 N ASN A 75 0.861 -6.060 -6.337 1.00 0.00 N ATOM 1133 CA ASN A 75 1.532 -5.510 -7.509 1.00 0.00 C ATOM 1134 C ASN A 75 2.289 -4.234 -7.153 1.00 0.00 C ATOM 1135 O ASN A 75 2.259 -3.781 -6.009 1.00 0.00 O ATOM 1136 CB ASN A 75 0.516 -5.221 -8.616 1.00 0.00 C ATOM 1137 CG ASN A 75 -0.349 -6.425 -8.935 1.00 0.00 C ATOM 1138 OD1 ASN A 75 -1.577 -6.353 -8.882 1.00 0.00 O ATOM 1139 ND2 ASN A 75 0.290 -7.541 -9.268 1.00 0.00 N ATOM 0 H ASN A 75 -0.156 -6.090 -6.409 1.00 0.00 H new ATOM 0 HA ASN A 75 2.249 -6.249 -7.867 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.121 -4.390 -8.313 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.043 -4.907 -9.517 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.239 -8.384 -9.493 1.00 0.00 H new ATOM 0 HD22 ASN A 75 1.309 -7.555 -9.299 1.00 0.00 H new ATOM 1146 N ALA A 76 2.967 -3.660 -8.141 1.00 0.00 N ATOM 1147 CA ALA A 76 3.730 -2.435 -7.933 1.00 0.00 C ATOM 1148 C ALA A 76 3.955 -1.699 -9.249 1.00 0.00 C ATOM 1149 O ALA A 76 4.503 -2.258 -10.199 1.00 0.00 O ATOM 1150 CB ALA A 76 5.062 -2.750 -7.267 1.00 0.00 C ATOM 0 H ALA A 76 3.004 -4.023 -9.093 1.00 0.00 H new ATOM 0 HA ALA A 76 3.153 -1.783 -7.277 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.621 -1.827 -7.118 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.883 -3.226 -6.303 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.637 -3.423 -7.903 1.00 0.00 H new ATOM 1156 N ALA A 77 3.529 -0.441 -9.298 1.00 0.00 N ATOM 1157 CA ALA A 77 3.685 0.372 -10.498 1.00 0.00 C ATOM 1158 C ALA A 77 5.039 0.126 -11.155 1.00 0.00 C ATOM 1159 O ALA A 77 5.121 -0.104 -12.361 1.00 0.00 O ATOM 1160 CB ALA A 77 3.520 1.847 -10.161 1.00 0.00 C ATOM 0 H ALA A 77 3.073 0.037 -8.521 1.00 0.00 H new ATOM 0 HA ALA A 77 2.909 0.083 -11.207 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.639 2.443 -11.066 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.528 2.016 -9.743 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.275 2.140 -9.432 1.00 0.00 H new ATOM 1166 N SER A 78 6.099 0.178 -10.354 1.00 0.00 N ATOM 1167 CA SER A 78 7.450 -0.035 -10.860 1.00 0.00 C ATOM 1168 C SER A 78 7.515 -1.290 -11.725 1.00 0.00 C ATOM 1169 O SER A 78 8.183 -1.312 -12.758 1.00 0.00 O ATOM 1170 CB SER A 78 8.439 -0.151 -9.698 1.00 0.00 C ATOM 1171 OG SER A 78 9.748 -0.421 -10.169 1.00 0.00 O ATOM 0 H SER A 78 6.048 0.366 -9.353 1.00 0.00 H new ATOM 0 HA SER A 78 7.721 0.823 -11.475 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.440 0.775 -9.123 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.121 -0.945 -9.023 1.00 0.00 H new ATOM 0 HG SER A 78 10.362 -0.489 -9.408 1.00 0.00 H new ATOM 1177 N GLY A 79 6.814 -2.335 -11.294 1.00 0.00 N ATOM 1178 CA GLY A 79 6.805 -3.580 -12.040 1.00 0.00 C ATOM 1179 C GLY A 79 7.252 -4.761 -11.201 1.00 0.00 C ATOM 1180 O GLY A 79 8.037 -5.592 -11.657 1.00 0.00 O ATOM 0 H GLY A 79 6.253 -2.341 -10.442 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.800 -3.766 -12.418 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.459 -3.486 -12.907 1.00 0.00 H new ATOM 1184 N GLU A 80 6.751 -4.836 -9.972 1.00 0.00 N ATOM 1185 CA GLU A 80 7.105 -5.923 -9.068 1.00 0.00 C ATOM 1186 C GLU A 80 5.867 -6.473 -8.366 1.00 0.00 C ATOM 1187 O GLU A 80 4.959 -5.722 -8.009 1.00 0.00 O ATOM 1188 CB GLU A 80 8.122 -5.443 -8.031 1.00 0.00 C ATOM 1189 CG GLU A 80 8.631 -6.547 -7.120 1.00 0.00 C ATOM 1190 CD GLU A 80 9.860 -7.240 -7.675 1.00 0.00 C ATOM 1191 OE1 GLU A 80 9.760 -7.841 -8.765 1.00 0.00 O ATOM 1192 OE2 GLU A 80 10.922 -7.182 -7.019 1.00 0.00 O ATOM 0 H GLU A 80 6.099 -4.157 -9.580 1.00 0.00 H new ATOM 0 HA GLU A 80 7.550 -6.723 -9.660 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.969 -4.991 -8.547 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.666 -4.662 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.866 -6.127 -6.142 1.00 0.00 H new ATOM 0 HG3 GLU A 80 7.841 -7.282 -6.970 1.00 0.00 H new ATOM 1199 N GLN A 81 5.838 -7.788 -8.173 1.00 0.00 N ATOM 1200 CA GLN A 81 4.711 -8.438 -7.515 1.00 0.00 C ATOM 1201 C GLN A 81 5.181 -9.274 -6.330 1.00 0.00 C ATOM 1202 O GLN A 81 6.257 -9.871 -6.366 1.00 0.00 O ATOM 1203 CB GLN A 81 3.953 -9.320 -8.509 1.00 0.00 C ATOM 1204 CG GLN A 81 2.767 -10.047 -7.895 1.00 0.00 C ATOM 1205 CD GLN A 81 2.106 -11.008 -8.864 1.00 0.00 C ATOM 1206 OE1 GLN A 81 0.959 -10.812 -9.265 1.00 0.00 O ATOM 1207 NE2 GLN A 81 2.829 -12.054 -9.247 1.00 0.00 N ATOM 0 H GLN A 81 6.581 -8.423 -8.463 1.00 0.00 H new ATOM 0 HA GLN A 81 4.041 -7.662 -7.145 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.602 -8.703 -9.336 1.00 0.00 H new ATOM 0 HB3 GLN A 81 4.641 -10.054 -8.929 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.099 -10.596 -7.014 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.033 -9.316 -7.557 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.776 -12.178 -8.889 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.437 -12.734 -9.899 1.00 0.00 H new ATOM 1216 N TYR A 82 4.368 -9.313 -5.280 1.00 0.00 N ATOM 1217 CA TYR A 82 4.702 -10.074 -4.082 1.00 0.00 C ATOM 1218 C TYR A 82 3.716 -11.219 -3.871 1.00 0.00 C ATOM 1219 O TYR A 82 2.503 -11.011 -3.836 1.00 0.00 O ATOM 1220 CB TYR A 82 4.709 -9.159 -2.856 1.00 0.00 C ATOM 1221 CG TYR A 82 6.043 -8.495 -2.603 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.835 -8.059 -3.659 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.513 -8.306 -1.310 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.055 -7.452 -3.433 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.732 -7.699 -1.074 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.499 -7.274 -2.139 1.00 0.00 C ATOM 1227 OH TYR A 82 9.714 -6.670 -1.909 1.00 0.00 O ATOM 0 H TYR A 82 3.473 -8.826 -5.234 1.00 0.00 H new ATOM 0 HA TYR A 82 5.698 -10.497 -4.217 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.948 -8.389 -2.983 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.430 -9.741 -1.977 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.491 -8.197 -4.673 1.00 0.00 H new ATOM 0 HD2 TYR A 82 5.916 -8.639 -0.474 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.658 -7.119 -4.265 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.082 -7.558 -0.062 1.00 0.00 H new ATOM 0 HH TYR A 82 9.877 -6.621 -0.944 1.00 0.00 H new ATOM 1237 N LYS A 83 4.245 -12.429 -3.730 1.00 0.00 N ATOM 1238 CA LYS A 83 3.415 -13.609 -3.520 1.00 0.00 C ATOM 1239 C LYS A 83 3.339 -13.964 -2.039 1.00 0.00 C ATOM 1240 O LYS A 83 4.221 -14.638 -1.506 1.00 0.00 O ATOM 1241 CB LYS A 83 3.968 -14.795 -4.313 1.00 0.00 C ATOM 1242 CG LYS A 83 2.904 -15.795 -4.734 1.00 0.00 C ATOM 1243 CD LYS A 83 3.471 -16.851 -5.668 1.00 0.00 C ATOM 1244 CE LYS A 83 2.401 -17.407 -6.595 1.00 0.00 C ATOM 1245 NZ LYS A 83 2.704 -18.802 -7.019 1.00 0.00 N ATOM 0 H LYS A 83 5.247 -12.619 -3.757 1.00 0.00 H new ATOM 0 HA LYS A 83 2.409 -13.382 -3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.476 -14.422 -5.202 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.717 -15.307 -3.709 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.486 -16.276 -3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.086 -15.271 -5.229 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.278 -16.419 -6.260 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.904 -17.662 -5.082 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.435 -17.383 -6.090 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.317 -16.770 -7.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.951 -19.144 -7.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.614 -18.822 -7.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.759 -19.415 -6.181 1.00 0.00 H new ATOM 1259 N LEU A 84 2.279 -13.509 -1.380 1.00 0.00 N ATOM 1260 CA LEU A 84 2.087 -13.781 0.041 1.00 0.00 C ATOM 1261 C LEU A 84 0.825 -14.607 0.272 1.00 0.00 C ATOM 1262 O LEU A 84 0.013 -14.783 -0.636 1.00 0.00 O ATOM 1263 CB LEU A 84 2.003 -12.470 0.824 1.00 0.00 C ATOM 1264 CG LEU A 84 3.098 -11.443 0.534 1.00 0.00 C ATOM 1265 CD1 LEU A 84 2.827 -10.148 1.284 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.464 -12.001 0.906 1.00 0.00 C ATOM 0 H LEU A 84 1.540 -12.950 -1.806 1.00 0.00 H new ATOM 0 HA LEU A 84 2.944 -14.354 0.395 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.037 -12.009 0.619 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.025 -12.704 1.888 1.00 0.00 H new ATOM 0 HG LEU A 84 3.094 -11.228 -0.535 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.617 -9.429 1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.867 -9.739 0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.803 -10.346 2.356 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.231 -11.257 0.693 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.480 -12.245 1.968 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.660 -12.901 0.324 1.00 0.00 H new ATOM 1278 N ARG A 85 0.668 -15.108 1.492 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.495 -15.914 1.843 1.00 0.00 C ATOM 1280 C ARG A 85 -1.030 -15.528 3.219 1.00 0.00 C ATOM 1281 O ARG A 85 -0.263 -15.200 4.124 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.137 -17.401 1.822 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.290 -18.311 2.214 1.00 0.00 C ATOM 1284 CD ARG A 85 -0.960 -19.772 1.951 1.00 0.00 C ATOM 1285 NE ARG A 85 -2.162 -20.596 1.853 1.00 0.00 N ATOM 1286 CZ ARG A 85 -2.139 -21.916 1.711 1.00 0.00 C ATOM 1287 NH1 ARG A 85 -0.982 -22.560 1.651 1.00 0.00 N ATOM 1288 NH2 ARG A 85 -3.276 -22.596 1.629 1.00 0.00 N ATOM 0 H ARG A 85 1.331 -14.970 2.254 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.273 -15.724 1.104 1.00 0.00 H new ATOM 0 HB2 ARG A 85 0.203 -17.670 0.822 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.698 -17.574 2.500 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.521 -18.173 3.270 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.182 -18.032 1.654 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -0.388 -19.854 1.027 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -0.326 -20.150 2.753 1.00 0.00 H new ATOM 0 HE ARG A 85 -3.069 -20.132 1.896 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -0.106 -22.042 1.714 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -0.968 -23.574 1.542 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.169 -22.105 1.675 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -3.257 -23.610 1.520 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.350 -15.569 3.368 1.00 0.00 N ATOM 1303 CA ALA A 86 -2.987 -15.225 4.633 1.00 0.00 C ATOM 1304 C ALA A 86 -3.238 -16.469 5.477 1.00 0.00 C ATOM 1305 O ALA A 86 -3.345 -17.578 4.952 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.291 -14.482 4.382 1.00 0.00 C ATOM 0 H ALA A 86 -2.999 -15.837 2.628 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.311 -14.573 5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.756 -14.231 5.335 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.087 -13.567 3.826 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.965 -15.115 3.805 1.00 0.00 H new ATOM 1312 N THR A 87 -3.331 -16.279 6.790 1.00 0.00 N ATOM 1313 CA THR A 87 -3.568 -17.387 7.707 1.00 0.00 C ATOM 1314 C THR A 87 -4.851 -18.129 7.353 1.00 0.00 C ATOM 1315 O THR A 87 -4.897 -19.359 7.385 1.00 0.00 O ATOM 1316 CB THR A 87 -3.656 -16.899 9.166 1.00 0.00 C ATOM 1317 OG1 THR A 87 -3.771 -18.019 10.051 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.847 -15.972 9.355 1.00 0.00 C ATOM 0 H THR A 87 -3.246 -15.368 7.242 1.00 0.00 H new ATOM 0 HA THR A 87 -2.721 -18.066 7.609 1.00 0.00 H new ATOM 0 HB THR A 87 -2.745 -16.346 9.397 1.00 0.00 H new ATOM 0 HG1 THR A 87 -3.825 -17.701 10.976 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.889 -15.640 10.392 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.742 -15.106 8.701 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.765 -16.504 9.107 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.891 -17.375 7.016 1.00 0.00 N ATOM 1327 CA ASP A 88 -7.176 -17.962 6.653 1.00 0.00 C ATOM 1328 C ASP A 88 -7.921 -17.072 5.664 1.00 0.00 C ATOM 1329 O ASP A 88 -7.657 -15.873 5.572 1.00 0.00 O ATOM 1330 CB ASP A 88 -8.030 -18.184 7.903 1.00 0.00 C ATOM 1331 CG ASP A 88 -7.543 -19.352 8.737 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -7.341 -20.445 8.168 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -7.362 -19.173 9.960 1.00 0.00 O ATOM 0 H ASP A 88 -5.870 -16.356 6.986 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.987 -18.924 6.176 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -8.022 -17.279 8.511 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -9.064 -18.359 7.606 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.852 -17.666 4.926 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.636 -16.927 3.944 1.00 0.00 C ATOM 1340 C ALA A 89 -10.144 -15.612 4.525 1.00 0.00 C ATOM 1341 O ALA A 89 -10.196 -14.594 3.834 1.00 0.00 O ATOM 1342 CB ALA A 89 -10.801 -17.773 3.453 1.00 0.00 C ATOM 0 H ALA A 89 -9.082 -18.658 4.989 1.00 0.00 H new ATOM 0 HA ALA A 89 -8.988 -16.695 3.099 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.377 -17.208 2.720 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.420 -18.684 2.991 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.442 -18.034 4.295 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.519 -15.639 5.800 1.00 0.00 N ATOM 1349 CA LYS A 90 -11.023 -14.449 6.476 1.00 0.00 C ATOM 1350 C LYS A 90 -9.950 -13.367 6.544 1.00 0.00 C ATOM 1351 O LYS A 90 -10.156 -12.247 6.078 1.00 0.00 O ATOM 1352 CB LYS A 90 -11.497 -14.802 7.887 1.00 0.00 C ATOM 1353 CG LYS A 90 -12.765 -15.637 7.912 1.00 0.00 C ATOM 1354 CD LYS A 90 -12.454 -17.124 7.868 1.00 0.00 C ATOM 1355 CE LYS A 90 -13.602 -17.951 8.427 1.00 0.00 C ATOM 1356 NZ LYS A 90 -14.623 -18.257 7.387 1.00 0.00 N ATOM 0 H LYS A 90 -10.483 -16.473 6.386 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.866 -14.064 5.902 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.704 -15.345 8.402 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.667 -13.881 8.445 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.334 -15.410 8.814 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.394 -15.371 7.063 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -12.255 -17.425 6.839 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.548 -17.324 8.440 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -13.212 -18.882 8.838 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -14.072 -17.411 9.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -15.388 -18.822 7.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -15.014 -17.369 7.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -14.181 -18.794 6.614 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.805 -13.710 7.126 1.00 0.00 N ATOM 1371 CA GLU A 91 -7.701 -12.767 7.254 1.00 0.00 C ATOM 1372 C GLU A 91 -7.353 -12.151 5.902 1.00 0.00 C ATOM 1373 O GLU A 91 -7.176 -10.938 5.788 1.00 0.00 O ATOM 1374 CB GLU A 91 -6.471 -13.463 7.841 1.00 0.00 C ATOM 1375 CG GLU A 91 -5.211 -12.615 7.794 1.00 0.00 C ATOM 1376 CD GLU A 91 -4.214 -12.993 8.872 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -4.594 -12.990 10.061 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -3.052 -13.293 8.525 1.00 0.00 O ATOM 0 H GLU A 91 -8.618 -14.634 7.516 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.014 -11.970 7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.677 -13.735 8.876 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.295 -14.391 7.297 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.741 -12.722 6.816 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.480 -11.565 7.905 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.255 -12.996 4.881 1.00 0.00 N ATOM 1386 CA ARG A 92 -6.927 -12.535 3.537 1.00 0.00 C ATOM 1387 C ARG A 92 -7.712 -11.275 3.187 1.00 0.00 C ATOM 1388 O ARG A 92 -7.136 -10.267 2.777 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.221 -13.633 2.512 1.00 0.00 C ATOM 1390 CG ARG A 92 -6.860 -13.248 1.087 1.00 0.00 C ATOM 1391 CD ARG A 92 -7.690 -14.022 0.074 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.107 -13.675 0.149 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.073 -14.414 -0.385 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -9.776 -15.535 -1.028 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.339 -14.033 -0.275 1.00 0.00 N ATOM 0 H ARG A 92 -7.398 -14.003 4.959 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.863 -12.298 3.511 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.670 -14.532 2.787 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.281 -13.883 2.554 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.017 -12.179 0.947 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -5.801 -13.440 0.914 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -7.319 -13.818 -0.930 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.569 -15.091 0.247 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.369 -12.819 0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.804 -15.832 -1.113 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -10.520 -16.101 -1.437 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.571 -13.172 0.220 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.080 -14.601 -0.685 1.00 0.00 H new ATOM 1409 N GLN A 93 -9.029 -11.339 3.351 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.893 -10.203 3.051 1.00 0.00 C ATOM 1411 C GLN A 93 -9.373 -8.934 3.717 1.00 0.00 C ATOM 1412 O GLN A 93 -9.415 -7.851 3.131 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.323 -10.487 3.513 1.00 0.00 C ATOM 1414 CG GLN A 93 -12.082 -11.434 2.598 1.00 0.00 C ATOM 1415 CD GLN A 93 -13.584 -11.345 2.782 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -14.144 -10.255 2.900 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -14.246 -12.496 2.808 1.00 0.00 N ATOM 0 H GLN A 93 -9.521 -12.165 3.690 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.891 -10.052 1.972 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.294 -10.911 4.517 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.868 -9.545 3.580 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -11.833 -11.209 1.561 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -11.756 -12.457 2.789 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -13.742 -13.377 2.706 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -15.259 -12.499 2.930 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.884 -9.073 4.945 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.356 -7.936 5.691 1.00 0.00 C ATOM 1428 C HIS A 94 -7.133 -7.349 4.992 1.00 0.00 C ATOM 1429 O HIS A 94 -7.138 -6.187 4.585 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.990 -8.359 7.114 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.479 -7.234 7.961 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -8.301 -6.436 8.728 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -6.221 -6.776 8.159 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.571 -5.535 9.361 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -6.305 -5.720 9.033 1.00 0.00 N ATOM 0 H HIS A 94 -8.842 -9.961 5.445 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.130 -7.170 5.735 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.868 -8.793 7.592 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.232 -9.141 7.068 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.319 -7.168 7.713 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.946 -4.776 10.032 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -5.518 -5.168 9.374 1.00 0.00 H new ATOM 1444 N TRP A 95 -6.089 -8.158 4.858 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.859 -7.717 4.210 1.00 0.00 C ATOM 1446 C TRP A 95 -5.159 -7.044 2.875 1.00 0.00 C ATOM 1447 O TRP A 95 -4.744 -5.911 2.633 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.917 -8.904 3.996 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.995 -9.145 5.153 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.023 -10.203 6.017 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -1.910 -8.311 5.572 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -2.021 -10.076 6.948 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.323 -8.924 6.697 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.375 -7.107 5.107 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.231 -8.372 7.360 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.291 -6.560 5.767 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.272 -7.192 6.883 1.00 0.00 C ATOM 0 H TRP A 95 -6.069 -9.123 5.189 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.374 -6.990 4.862 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.509 -9.802 3.819 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.324 -8.731 3.098 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.729 -11.019 5.974 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.828 -10.733 7.704 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -1.801 -6.612 4.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.204 -8.858 8.221 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 0.129 -5.629 5.416 1.00 0.00 H new ATOM 0 HH2 TRP A 95 1.119 -6.739 7.377 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.883 -7.749 2.011 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.240 -7.218 0.700 1.00 0.00 C ATOM 1470 C VAL A 96 -6.795 -5.803 0.813 1.00 0.00 C ATOM 1471 O VAL A 96 -6.211 -4.853 0.292 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.279 -8.111 -0.003 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.705 -7.495 -1.327 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.723 -9.512 -0.212 1.00 0.00 C ATOM 0 H VAL A 96 -6.234 -8.689 2.195 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.326 -7.200 0.106 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.159 -8.185 0.635 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.439 -8.140 -1.809 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.146 -6.515 -1.147 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.835 -7.388 -1.975 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.470 -10.130 -0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.826 -9.459 -0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.473 -9.952 0.753 1.00 0.00 H new ATOM 1484 N SER A 97 -7.926 -5.670 1.498 1.00 0.00 N ATOM 1485 CA SER A 97 -8.563 -4.371 1.677 1.00 0.00 C ATOM 1486 C SER A 97 -7.559 -3.338 2.181 1.00 0.00 C ATOM 1487 O SER A 97 -7.269 -2.355 1.500 1.00 0.00 O ATOM 1488 CB SER A 97 -9.733 -4.483 2.657 1.00 0.00 C ATOM 1489 OG SER A 97 -10.619 -3.385 2.521 1.00 0.00 O ATOM 0 H SER A 97 -8.420 -6.446 1.938 1.00 0.00 H new ATOM 0 HA SER A 97 -8.940 -4.043 0.708 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.272 -5.414 2.480 1.00 0.00 H new ATOM 0 HB3 SER A 97 -9.354 -4.524 3.678 1.00 0.00 H new ATOM 0 HG SER A 97 -11.359 -3.481 3.157 1.00 0.00 H new ATOM 1495 N ARG A 98 -7.033 -3.570 3.380 1.00 0.00 N ATOM 1496 CA ARG A 98 -6.063 -2.661 3.977 1.00 0.00 C ATOM 1497 C ARG A 98 -5.107 -2.116 2.920 1.00 0.00 C ATOM 1498 O ARG A 98 -5.016 -0.904 2.716 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.273 -3.374 5.076 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.109 -3.727 6.295 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.688 -2.484 6.952 1.00 0.00 C ATOM 1502 NE ARG A 98 -5.652 -1.517 7.305 1.00 0.00 N ATOM 1503 CZ ARG A 98 -5.910 -0.300 7.768 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -7.163 0.098 7.934 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -4.912 0.523 8.067 1.00 0.00 N ATOM 0 H ARG A 98 -7.263 -4.380 3.956 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.608 -1.825 4.415 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -4.840 -4.286 4.667 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.444 -2.738 5.386 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -6.918 -4.395 6.001 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.495 -4.268 7.015 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -7.404 -2.017 6.276 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.237 -2.771 7.849 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.677 -1.792 7.189 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.933 -0.531 7.706 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.358 1.034 8.290 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -3.946 0.220 7.941 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -5.111 1.458 8.423 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.395 -3.017 2.253 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.445 -2.627 1.217 1.00 0.00 C ATOM 1521 C LEU A 99 -4.138 -1.835 0.112 1.00 0.00 C ATOM 1522 O LEU A 99 -3.603 -0.843 -0.382 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.768 -3.865 0.625 1.00 0.00 C ATOM 1524 CG LEU A 99 -1.980 -4.732 1.607 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -1.823 -6.144 1.065 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.619 -4.114 1.892 1.00 0.00 C ATOM 0 H LEU A 99 -4.457 -4.023 2.411 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.688 -1.990 1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.533 -4.484 0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.092 -3.542 -0.167 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.536 -4.784 2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.260 -6.747 1.777 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.807 -6.587 0.913 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.289 -6.112 0.115 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.072 -4.745 2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.055 -4.031 0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.753 -3.123 2.325 1.00 0.00 H new ATOM 1538 N GLN A 100 -5.331 -2.281 -0.269 1.00 0.00 N ATOM 1539 CA GLN A 100 -6.097 -1.613 -1.314 1.00 0.00 C ATOM 1540 C GLN A 100 -6.424 -0.177 -0.916 1.00 0.00 C ATOM 1541 O GLN A 100 -6.595 0.691 -1.772 1.00 0.00 O ATOM 1542 CB GLN A 100 -7.388 -2.382 -1.600 1.00 0.00 C ATOM 1543 CG GLN A 100 -7.224 -3.481 -2.638 1.00 0.00 C ATOM 1544 CD GLN A 100 -8.538 -3.879 -3.279 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -9.594 -3.341 -2.944 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -8.481 -4.826 -4.208 1.00 0.00 N ATOM 0 H GLN A 100 -5.787 -3.101 0.130 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.488 -1.590 -2.218 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.752 -2.822 -0.672 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -8.150 -1.682 -1.942 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.534 -3.145 -3.412 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.774 -4.355 -2.168 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.584 -5.245 -4.455 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.334 -5.135 -4.675 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.511 0.065 0.388 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.817 1.395 0.898 1.00 0.00 C ATOM 1557 C ILE A 101 -5.553 2.238 1.029 1.00 0.00 C ATOM 1558 O ILE A 101 -5.502 3.376 0.561 1.00 0.00 O ATOM 1559 CB ILE A 101 -7.518 1.325 2.268 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.791 0.482 2.172 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.839 2.724 2.771 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -9.388 0.134 3.517 1.00 0.00 C ATOM 0 H ILE A 101 -6.374 -0.643 1.110 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.489 1.862 0.178 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.844 0.850 2.980 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.532 1.023 1.584 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.567 -0.439 1.634 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.334 2.658 3.740 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.916 3.295 2.873 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -8.497 3.224 2.061 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -10.288 -0.464 3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.664 -0.435 4.100 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.643 1.050 4.050 1.00 0.00 H new ATOM 1574 N CYS A 102 -4.535 1.672 1.667 1.00 0.00 N ATOM 1575 CA CYS A 102 -3.269 2.371 1.858 1.00 0.00 C ATOM 1576 C CYS A 102 -2.604 2.670 0.518 1.00 0.00 C ATOM 1577 O CYS A 102 -2.212 3.805 0.246 1.00 0.00 O ATOM 1578 CB CYS A 102 -2.330 1.539 2.732 1.00 0.00 C ATOM 1579 SG CYS A 102 -2.513 1.838 4.506 1.00 0.00 S ATOM 0 H CYS A 102 -4.561 0.731 2.061 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.477 3.317 2.358 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.507 0.482 2.533 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.300 1.750 2.443 1.00 0.00 H new ATOM 0 HG CYS A 102 -1.442 1.439 5.126 1.00 0.00 H new ATOM 1585 N THR A 103 -2.479 1.643 -0.317 1.00 0.00 N ATOM 1586 CA THR A 103 -1.860 1.794 -1.627 1.00 0.00 C ATOM 1587 C THR A 103 -2.426 3.001 -2.367 1.00 0.00 C ATOM 1588 O THR A 103 -1.683 3.772 -2.973 1.00 0.00 O ATOM 1589 CB THR A 103 -2.061 0.535 -2.492 1.00 0.00 C ATOM 1590 OG1 THR A 103 -1.075 0.491 -3.530 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.453 0.518 -3.107 1.00 0.00 C ATOM 0 H THR A 103 -2.799 0.697 -0.108 1.00 0.00 H new ATOM 0 HA THR A 103 -0.794 1.943 -1.457 1.00 0.00 H new ATOM 0 HB THR A 103 -1.953 -0.340 -1.851 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.239 0.885 -3.204 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.572 -0.380 -3.713 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.201 0.522 -2.314 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.584 1.400 -3.735 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.744 3.158 -2.311 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.409 4.273 -2.977 1.00 0.00 C ATOM 1601 C GLN A 104 -4.281 5.552 -2.156 1.00 0.00 C ATOM 1602 O GLN A 104 -3.689 6.534 -2.606 1.00 0.00 O ATOM 1603 CB GLN A 104 -5.885 3.948 -3.210 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.137 3.127 -4.464 1.00 0.00 C ATOM 1605 CD GLN A 104 -7.613 2.909 -4.733 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -8.318 2.295 -3.932 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -8.089 3.412 -5.866 1.00 0.00 N ATOM 0 H GLN A 104 -4.373 2.528 -1.812 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.923 4.431 -3.940 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.269 3.405 -2.347 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.447 4.879 -3.277 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -5.686 3.630 -5.319 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -5.643 2.160 -4.366 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -7.469 3.914 -6.501 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -9.075 3.296 -6.101 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.839 5.533 -0.950 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.787 6.692 -0.066 1.00 0.00 C ATOM 1618 C HIS A 105 -3.422 7.369 -0.136 1.00 0.00 C ATOM 1619 O HIS A 105 -3.296 8.566 0.122 1.00 0.00 O ATOM 1620 CB HIS A 105 -5.089 6.275 1.374 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.713 7.362 2.194 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -6.942 7.914 1.900 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -5.273 7.998 3.305 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -7.230 8.844 2.794 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -6.233 8.914 3.658 1.00 0.00 N ATOM 0 H HIS A 105 -5.332 4.729 -0.563 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.543 7.404 -0.397 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.755 5.412 1.362 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -4.163 5.956 1.853 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.340 7.818 3.818 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -8.127 9.444 2.815 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -6.184 9.546 4.457 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.400 6.594 -0.488 1.00 0.00 N ATOM 1635 CA HIS A 106 -1.043 7.119 -0.592 1.00 0.00 C ATOM 1636 C HIS A 106 -0.790 7.698 -1.981 1.00 0.00 C ATOM 1637 O HIS A 106 -0.511 8.888 -2.128 1.00 0.00 O ATOM 1638 CB HIS A 106 -0.024 6.019 -0.292 1.00 0.00 C ATOM 1639 CG HIS A 106 0.343 5.922 1.157 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.587 6.266 1.643 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.380 5.519 2.228 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.614 6.076 2.950 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.433 5.624 3.330 1.00 0.00 N ATOM 0 H HIS A 106 -2.486 5.601 -0.706 1.00 0.00 H new ATOM 0 HA HIS A 106 -0.931 7.918 0.141 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.428 5.061 -0.621 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.878 6.202 -0.876 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.405 5.178 2.218 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.459 6.259 3.598 1.00 0.00 H new ATOM 0 HE2 HIS A 106 0.168 5.391 4.287 1.00 0.00 H new ATOM 1652 N THR A 107 -0.889 6.848 -2.999 1.00 0.00 N ATOM 1653 CA THR A 107 -0.669 7.274 -4.375 1.00 0.00 C ATOM 1654 C THR A 107 -1.469 8.531 -4.696 1.00 0.00 C ATOM 1655 O THR A 107 -1.051 9.352 -5.510 1.00 0.00 O ATOM 1656 CB THR A 107 -1.052 6.166 -5.374 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.332 6.342 -6.600 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.547 6.181 -5.652 1.00 0.00 C ATOM 0 H THR A 107 -1.120 5.860 -2.896 1.00 0.00 H new ATOM 0 HA THR A 107 0.395 7.489 -4.473 1.00 0.00 H new ATOM 0 HB THR A 107 -0.790 5.204 -4.934 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.244 7.299 -6.793 1.00 0.00 H new ATOM 0 HG21 THR A 107 -2.793 5.390 -6.360 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.092 6.018 -4.722 1.00 0.00 H new ATOM 0 HG23 THR A 107 -2.829 7.146 -6.073 1.00 0.00 H new ATOM 1666 N GLU A 108 -2.622 8.674 -4.049 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.481 9.832 -4.267 1.00 0.00 C ATOM 1668 C GLU A 108 -2.988 11.033 -3.465 1.00 0.00 C ATOM 1669 O GLU A 108 -3.106 12.177 -3.904 1.00 0.00 O ATOM 1670 CB GLU A 108 -4.925 9.504 -3.881 1.00 0.00 C ATOM 1671 CG GLU A 108 -5.824 10.726 -3.795 1.00 0.00 C ATOM 1672 CD GLU A 108 -6.330 11.175 -5.153 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -6.803 10.313 -5.923 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -6.252 12.386 -5.444 1.00 0.00 O ATOM 0 H GLU A 108 -2.982 8.003 -3.370 1.00 0.00 H new ATOM 0 HA GLU A 108 -3.445 10.085 -5.327 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.339 8.809 -4.612 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.928 8.993 -2.918 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.674 10.502 -3.150 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -5.276 11.544 -3.327 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.437 10.764 -2.286 1.00 0.00 N ATOM 1682 CA ALA A 109 -1.925 11.821 -1.423 1.00 0.00 C ATOM 1683 C ALA A 109 -0.719 12.509 -2.052 1.00 0.00 C ATOM 1684 O ALA A 109 -0.592 13.732 -1.998 1.00 0.00 O ATOM 1685 CB ALA A 109 -1.561 11.257 -0.057 1.00 0.00 C ATOM 0 H ALA A 109 -2.334 9.823 -1.907 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.710 12.566 -1.299 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.180 12.057 0.577 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.447 10.819 0.404 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.795 10.490 -0.172 1.00 0.00 H new ATOM 1691 N ILE A 110 0.164 11.715 -2.648 1.00 0.00 N ATOM 1692 CA ILE A 110 1.360 12.249 -3.289 1.00 0.00 C ATOM 1693 C ILE A 110 1.022 13.439 -4.180 1.00 0.00 C ATOM 1694 O ILE A 110 0.109 13.372 -5.003 1.00 0.00 O ATOM 1695 CB ILE A 110 2.073 11.176 -4.133 1.00 0.00 C ATOM 1696 CG1 ILE A 110 2.497 10.000 -3.250 1.00 0.00 C ATOM 1697 CG2 ILE A 110 3.279 11.774 -4.842 1.00 0.00 C ATOM 1698 CD1 ILE A 110 2.723 8.717 -4.020 1.00 0.00 C ATOM 0 H ILE A 110 0.074 10.700 -2.701 1.00 0.00 H new ATOM 0 HA ILE A 110 2.027 12.574 -2.491 1.00 0.00 H new ATOM 0 HB ILE A 110 1.378 10.808 -4.888 1.00 0.00 H new ATOM 0 HG12 ILE A 110 3.414 10.264 -2.723 1.00 0.00 H new ATOM 0 HG13 ILE A 110 1.731 9.830 -2.493 1.00 0.00 H new ATOM 0 HG21 ILE A 110 3.772 11.003 -5.434 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.952 12.582 -5.497 1.00 0.00 H new ATOM 0 HG23 ILE A 110 3.978 12.166 -4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.021 7.927 -3.331 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.801 8.429 -4.526 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.510 8.870 -4.759 1.00 0.00 H new ATOM 1710 N GLY A 111 1.765 14.528 -4.011 1.00 0.00 N ATOM 1711 CA GLY A 111 1.530 15.717 -4.809 1.00 0.00 C ATOM 1712 C GLY A 111 2.674 16.708 -4.723 1.00 0.00 C ATOM 1713 O GLY A 111 3.707 16.533 -5.370 1.00 0.00 O ATOM 0 H GLY A 111 2.525 14.608 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 111 1.380 15.429 -5.850 1.00 0.00 H new ATOM 0 HA3 GLY A 111 0.610 16.198 -4.476 1.00 0.00 H new ATOM 1717 N LYS A 112 2.490 17.754 -3.925 1.00 0.00 N ATOM 1718 CA LYS A 112 3.514 18.778 -3.756 1.00 0.00 C ATOM 1719 C LYS A 112 4.661 18.264 -2.891 1.00 0.00 C ATOM 1720 O LYS A 112 4.607 18.342 -1.664 1.00 0.00 O ATOM 1721 CB LYS A 112 2.909 20.035 -3.126 1.00 0.00 C ATOM 1722 CG LYS A 112 1.994 20.804 -4.063 1.00 0.00 C ATOM 1723 CD LYS A 112 2.769 21.800 -4.908 1.00 0.00 C ATOM 1724 CE LYS A 112 1.882 22.450 -5.958 1.00 0.00 C ATOM 1725 NZ LYS A 112 0.922 23.415 -5.353 1.00 0.00 N ATOM 0 H LYS A 112 1.640 17.915 -3.384 1.00 0.00 H new ATOM 0 HA LYS A 112 3.909 19.027 -4.741 1.00 0.00 H new ATOM 0 HB2 LYS A 112 2.348 19.751 -2.236 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.715 20.692 -2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.468 20.105 -4.714 1.00 0.00 H new ATOM 0 HG3 LYS A 112 1.237 21.330 -3.482 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.197 22.569 -4.265 1.00 0.00 H new ATOM 0 HD3 LYS A 112 3.602 21.294 -5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 112 2.504 22.966 -6.689 1.00 0.00 H new ATOM 0 HE3 LYS A 112 1.331 21.679 -6.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 0.336 23.837 -6.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 0.312 22.918 -4.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 1.448 24.165 -4.861 1.00 0.00 H new ATOM 1739 N ASN A 113 5.697 17.741 -3.539 1.00 0.00 N ATOM 1740 CA ASN A 113 6.856 17.216 -2.828 1.00 0.00 C ATOM 1741 C ASN A 113 8.085 17.194 -3.732 1.00 0.00 C ATOM 1742 O ASN A 113 7.976 16.989 -4.940 1.00 0.00 O ATOM 1743 CB ASN A 113 6.567 15.806 -2.309 1.00 0.00 C ATOM 1744 CG ASN A 113 7.436 15.436 -1.122 1.00 0.00 C ATOM 1745 OD1 ASN A 113 7.734 16.275 -0.272 1.00 0.00 O ATOM 1746 ND2 ASN A 113 7.847 14.175 -1.060 1.00 0.00 N ATOM 0 H ASN A 113 5.757 17.670 -4.555 1.00 0.00 H new ATOM 0 HA ASN A 113 7.060 17.873 -1.982 1.00 0.00 H new ATOM 0 HB2 ASN A 113 5.518 15.735 -2.023 1.00 0.00 H new ATOM 0 HB3 ASN A 113 6.728 15.086 -3.112 1.00 0.00 H new ATOM 0 HD21 ASN A 113 8.434 13.868 -0.285 1.00 0.00 H new ATOM 0 HD22 ASN A 113 7.575 13.514 -1.787 1.00 0.00 H new ATOM 1753 N ASN A 114 9.254 17.407 -3.137 1.00 0.00 N ATOM 1754 CA ASN A 114 10.504 17.412 -3.889 1.00 0.00 C ATOM 1755 C ASN A 114 10.504 16.318 -4.952 1.00 0.00 C ATOM 1756 O ASN A 114 10.374 15.135 -4.640 1.00 0.00 O ATOM 1757 CB ASN A 114 11.692 17.221 -2.944 1.00 0.00 C ATOM 1758 CG ASN A 114 11.721 15.837 -2.324 1.00 0.00 C ATOM 1759 OD1 ASN A 114 10.683 15.290 -1.951 1.00 0.00 O ATOM 1760 ND2 ASN A 114 12.913 15.264 -2.211 1.00 0.00 N ATOM 0 H ASN A 114 9.362 17.578 -2.137 1.00 0.00 H new ATOM 0 HA ASN A 114 10.596 18.377 -4.387 1.00 0.00 H new ATOM 0 HB2 ASN A 114 12.619 17.390 -3.492 1.00 0.00 H new ATOM 0 HB3 ASN A 114 11.648 17.970 -2.153 1.00 0.00 H new ATOM 0 HD21 ASN A 114 12.995 14.333 -1.802 1.00 0.00 H new ATOM 0 HD22 ASN A 114 13.747 15.754 -2.534 1.00 0.00 H new ATOM 1767 N SER A 115 10.652 16.723 -6.209 1.00 0.00 N ATOM 1768 CA SER A 115 10.666 15.778 -7.320 1.00 0.00 C ATOM 1769 C SER A 115 11.962 15.894 -8.116 1.00 0.00 C ATOM 1770 O SER A 115 12.460 16.993 -8.356 1.00 0.00 O ATOM 1771 CB SER A 115 9.467 16.020 -8.239 1.00 0.00 C ATOM 1772 OG SER A 115 9.593 15.290 -9.446 1.00 0.00 O ATOM 0 H SER A 115 10.764 17.699 -6.484 1.00 0.00 H new ATOM 0 HA SER A 115 10.602 14.771 -6.908 1.00 0.00 H new ATOM 0 HB2 SER A 115 8.549 15.729 -7.728 1.00 0.00 H new ATOM 0 HB3 SER A 115 9.384 17.084 -8.461 1.00 0.00 H new ATOM 0 HG SER A 115 8.813 15.461 -10.015 1.00 0.00 H new ATOM 1778 N GLY A 116 12.504 14.750 -8.523 1.00 0.00 N ATOM 1779 CA GLY A 116 13.738 14.744 -9.287 1.00 0.00 C ATOM 1780 C GLY A 116 13.764 13.650 -10.336 1.00 0.00 C ATOM 1781 O GLY A 116 14.341 12.581 -10.134 1.00 0.00 O ATOM 0 H GLY A 116 12.111 13.827 -8.337 1.00 0.00 H new ATOM 0 HA2 GLY A 116 13.866 15.712 -9.772 1.00 0.00 H new ATOM 0 HA3 GLY A 116 14.581 14.613 -8.609 1.00 0.00 H new ATOM 1785 N PRO A 117 13.127 13.912 -11.486 1.00 0.00 N ATOM 1786 CA PRO A 117 13.065 12.953 -12.593 1.00 0.00 C ATOM 1787 C PRO A 117 14.417 12.762 -13.272 1.00 0.00 C ATOM 1788 O PRO A 117 15.291 13.626 -13.190 1.00 0.00 O ATOM 1789 CB PRO A 117 12.067 13.593 -13.561 1.00 0.00 C ATOM 1790 CG PRO A 117 12.137 15.052 -13.269 1.00 0.00 C ATOM 1791 CD PRO A 117 12.419 15.165 -11.796 1.00 0.00 C ATOM 0 HA PRO A 117 12.774 11.959 -12.254 1.00 0.00 H new ATOM 0 HB2 PRO A 117 12.331 13.384 -14.598 1.00 0.00 H new ATOM 0 HB3 PRO A 117 11.060 13.206 -13.404 1.00 0.00 H new ATOM 0 HG2 PRO A 117 12.922 15.530 -13.855 1.00 0.00 H new ATOM 0 HG3 PRO A 117 11.201 15.547 -13.526 1.00 0.00 H new ATOM 0 HD2 PRO A 117 13.031 16.038 -11.570 1.00 0.00 H new ATOM 0 HD3 PRO A 117 11.500 15.261 -11.217 1.00 0.00 H new ATOM 1799 N SER A 118 14.583 11.626 -13.941 1.00 0.00 N ATOM 1800 CA SER A 118 15.831 11.321 -14.631 1.00 0.00 C ATOM 1801 C SER A 118 15.578 10.426 -15.841 1.00 0.00 C ATOM 1802 O SER A 118 15.082 9.307 -15.706 1.00 0.00 O ATOM 1803 CB SER A 118 16.814 10.640 -13.676 1.00 0.00 C ATOM 1804 OG SER A 118 18.154 10.880 -14.067 1.00 0.00 O ATOM 0 H SER A 118 13.869 10.902 -14.020 1.00 0.00 H new ATOM 0 HA SER A 118 16.264 12.259 -14.978 1.00 0.00 H new ATOM 0 HB2 SER A 118 16.656 11.009 -12.663 1.00 0.00 H new ATOM 0 HB3 SER A 118 16.624 9.567 -13.658 1.00 0.00 H new ATOM 0 HG SER A 118 18.762 10.436 -13.440 1.00 0.00 H new ATOM 1810 N SER A 119 15.923 10.927 -17.022 1.00 0.00 N ATOM 1811 CA SER A 119 15.730 10.176 -18.257 1.00 0.00 C ATOM 1812 C SER A 119 16.965 10.270 -19.149 1.00 0.00 C ATOM 1813 O SER A 119 17.618 11.310 -19.216 1.00 0.00 O ATOM 1814 CB SER A 119 14.504 10.695 -19.009 1.00 0.00 C ATOM 1815 OG SER A 119 13.305 10.263 -18.389 1.00 0.00 O ATOM 0 H SER A 119 16.338 11.850 -17.150 1.00 0.00 H new ATOM 0 HA SER A 119 15.571 9.130 -17.995 1.00 0.00 H new ATOM 0 HB2 SER A 119 14.528 11.784 -19.042 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.531 10.344 -20.041 1.00 0.00 H new ATOM 0 HG SER A 119 12.536 10.609 -18.888 1.00 0.00 H new ATOM 1821 N GLY A 120 17.279 9.173 -19.832 1.00 0.00 N ATOM 1822 CA GLY A 120 18.434 9.152 -20.711 1.00 0.00 C ATOM 1823 C GLY A 120 19.736 9.348 -19.961 1.00 0.00 C ATOM 1824 O GLY A 120 20.116 10.477 -19.648 1.00 0.00 O ATOM 0 H GLY A 120 16.755 8.299 -19.792 1.00 0.00 H new ATOM 0 HA2 GLY A 120 18.464 8.201 -21.243 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.329 9.935 -21.462 1.00 0.00 H new TER 1828 GLY A 120