USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1079 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 73 TYR OH : rot 119:sc= -0.205 USER MOD Set 1.2: A 168 CYS SG : rot 73:sc= 0.114 USER MOD Set 2.1: A 58 GLN : amide:sc= 1.15 K(o=2.2,f=-0.46) USER MOD Set 2.2: A 62 GLN : amide:sc= 1.05 K(o=2.2,f=-2.3) USER MOD Single : A 9 LYS NZ :NH3+ 175:sc= 1.26 (180deg=1.16) USER MOD Single : A 15 ASN : amide:sc= 0.357 K(o=0.36,f=-2) USER MOD Single : A 20 SER OG : rot 180:sc= -0.682 USER MOD Single : A 21 HIS : no HD1:sc= -5.15! C(o=-5.1!,f=-4.2!) USER MOD Single : A 25 HIS : no HD1:sc= -0.8 K(o=-0.8,f=-0.16) USER MOD Single : A 28 HIS : no HE2:sc= -0.212 X(o=-0.21,f=-0.15) USER MOD Single : A 29 TYR OH : rot 54:sc= 1.02 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -62:sc= 0.979 USER MOD Single : A 54 ASN : amide:sc= -1.23! C(o=-1.2!,f=-3.8!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 82:sc= 0.981 USER MOD Single : A 70 SER OG : rot -61:sc= 0.162 USER MOD Single : A 78 LYS NZ :NH3+ 132:sc= -0.0569 (180deg=-0.387) USER MOD Single : A 83 TYR OH : rot -64:sc= -1.92 USER MOD Single : A 88 LYS NZ :NH3+ -130:sc= -2.47! (180deg=-3.45!) USER MOD Single : A 107 ASN : amide:sc= -1.02 K(o=-1,f=-1.6) USER MOD Single : A 109 HIS : no HE2:sc= 0.645 K(o=0.64,f=-7.4!) USER MOD Single : A 110 THR OG1 : rot 52:sc= 0.00314 USER MOD Single : A 113 LYS NZ :NH3+ 178:sc= 1.28 (180deg=1.17) USER MOD Single : A 123 HIS : no HD1:sc=-0.00765 X(o=-0.0077,f=-0.0012) USER MOD Single : A 124 SER OG : rot 17:sc= 0.747 USER MOD Single : A 125 THR OG1 : rot -13:sc= 1.02 USER MOD Single : A 127 HIS : no HD1:sc= 0.0984 K(o=0.098,f=-5.8!) USER MOD Single : A 134 SER OG : rot 180:sc= -0.0145 USER MOD Single : A 136 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0315) USER MOD Single : A 137 LYS NZ :NH3+ -121:sc= -0.109 (180deg=-0.497) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= -0.152 USER MOD Single : A 143 GLN : amide:sc= -0.351 X(o=-0.35,f=-0.28) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 17:sc= 0.104 USER MOD Single : A 150 THR OG1 : rot 50:sc= 0.0785 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot -64:sc= 1.24 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 MET CE :methyl 179:sc= -8.71! (180deg=-8.82!) USER MOD Single : A 174 LYS NZ :NH3+ 154:sc= 0.999 (180deg=0.596) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N LEU A 6 -10.613 12.622 3.275 1.00 0.72 N ATOM 9 CA LEU A 6 -9.889 11.362 3.223 1.00 0.55 C ATOM 10 C LEU A 6 -9.965 10.634 4.562 1.00 0.42 C ATOM 11 O LEU A 6 -10.220 9.430 4.616 1.00 0.36 O ATOM 12 CB LEU A 6 -8.427 11.618 2.861 1.00 0.53 C ATOM 13 CG LEU A 6 -7.621 10.364 2.540 1.00 0.44 C ATOM 14 CD1 LEU A 6 -8.127 9.735 1.257 1.00 0.52 C ATOM 15 CD2 LEU A 6 -6.138 10.679 2.438 1.00 0.47 C ATOM 0 HA LEU A 6 -10.350 10.734 2.461 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -8.392 12.286 2.001 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.948 12.139 3.690 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.753 9.652 3.355 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -7.545 8.840 1.036 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -9.177 9.466 1.373 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -8.024 10.446 0.438 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -5.587 9.767 2.208 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -5.975 11.410 1.646 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.786 11.086 3.386 1.00 0.47 H new ATOM 27 N ALA A 7 -9.747 11.384 5.641 1.00 0.44 N ATOM 28 CA ALA A 7 -9.802 10.841 6.995 1.00 0.41 C ATOM 29 C ALA A 7 -11.192 10.312 7.330 1.00 0.39 C ATOM 30 O ALA A 7 -11.350 9.476 8.220 1.00 0.44 O ATOM 31 CB ALA A 7 -9.402 11.907 8.002 1.00 0.53 C ATOM 0 H ALA A 7 -9.529 12.380 5.601 1.00 0.44 H new ATOM 0 HA ALA A 7 -9.101 10.008 7.047 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.446 11.491 9.009 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.386 12.243 7.792 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -10.086 12.752 7.928 1.00 0.53 H new ATOM 37 N ASP A 8 -12.193 10.816 6.624 1.00 0.41 N ATOM 38 CA ASP A 8 -13.575 10.464 6.903 1.00 0.48 C ATOM 39 C ASP A 8 -13.957 9.166 6.207 1.00 0.44 C ATOM 40 O ASP A 8 -14.638 8.321 6.783 1.00 0.60 O ATOM 41 CB ASP A 8 -14.507 11.591 6.457 1.00 0.61 C ATOM 42 CG ASP A 8 -15.914 11.431 6.996 1.00 1.30 C ATOM 43 OD1 ASP A 8 -16.732 10.765 6.328 1.00 2.18 O ATOM 44 OD2 ASP A 8 -16.208 11.947 8.092 1.00 1.44 O ATOM 0 H ASP A 8 -12.072 11.472 5.852 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.678 10.320 7.978 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -14.101 12.546 6.790 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.540 11.620 5.368 1.00 0.61 H new ATOM 49 N LYS A 9 -13.507 9.002 4.967 1.00 0.33 N ATOM 50 CA LYS A 9 -13.929 7.863 4.165 1.00 0.34 C ATOM 51 C LYS A 9 -12.920 6.720 4.202 1.00 0.29 C ATOM 52 O LYS A 9 -13.163 5.670 3.609 1.00 0.36 O ATOM 53 CB LYS A 9 -14.190 8.268 2.711 1.00 0.44 C ATOM 54 CG LYS A 9 -15.065 9.500 2.567 1.00 0.65 C ATOM 55 CD LYS A 9 -16.369 9.349 3.332 1.00 0.86 C ATOM 56 CE LYS A 9 -17.238 10.585 3.210 1.00 1.24 C ATOM 57 NZ LYS A 9 -18.333 10.580 4.210 1.00 1.79 N ATOM 0 H LYS A 9 -12.858 9.636 4.501 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.859 7.509 4.610 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -13.236 8.452 2.218 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -14.663 7.435 2.191 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -14.527 10.375 2.932 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -15.279 9.675 1.513 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -16.913 8.483 2.955 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -16.154 9.158 4.383 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -16.625 11.477 3.344 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -17.660 10.637 2.207 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -18.857 11.477 4.156 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -18.979 9.789 4.013 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -17.932 10.470 5.163 1.00 1.79 H new ATOM 71 N VAL A 10 -11.775 6.918 4.852 1.00 0.26 N ATOM 72 CA VAL A 10 -10.864 5.808 5.081 1.00 0.24 C ATOM 73 C VAL A 10 -11.539 4.731 5.919 1.00 0.23 C ATOM 74 O VAL A 10 -12.209 5.025 6.911 1.00 0.30 O ATOM 75 CB VAL A 10 -9.572 6.258 5.784 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.860 6.842 7.162 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.580 5.106 5.881 1.00 0.28 C ATOM 0 H VAL A 10 -11.464 7.817 5.221 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.599 5.407 4.103 1.00 0.24 H new ATOM 0 HB VAL A 10 -9.125 7.047 5.179 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -8.925 7.149 7.630 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.516 7.706 7.061 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.345 6.089 7.782 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.674 5.447 6.382 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -9.024 4.290 6.451 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -8.331 4.755 4.880 1.00 0.28 H new ATOM 87 N ILE A 11 -11.378 3.488 5.510 1.00 0.24 N ATOM 88 CA ILE A 11 -11.932 2.380 6.263 1.00 0.29 C ATOM 89 C ILE A 11 -10.819 1.521 6.840 1.00 0.26 C ATOM 90 O ILE A 11 -11.016 0.819 7.831 1.00 0.28 O ATOM 91 CB ILE A 11 -12.859 1.499 5.398 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.111 0.973 4.172 1.00 0.53 C ATOM 93 CG2 ILE A 11 -14.091 2.285 4.979 1.00 0.92 C ATOM 94 CD1 ILE A 11 -12.880 -0.069 3.392 1.00 0.62 C ATOM 0 H ILE A 11 -10.871 3.221 4.666 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.525 2.809 7.071 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.180 0.644 5.993 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.879 1.809 3.513 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -11.161 0.546 4.493 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -14.736 1.652 4.370 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -14.634 2.610 5.866 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -13.787 3.157 4.400 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -12.287 -0.395 2.537 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -13.090 -0.924 4.035 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.819 0.359 3.040 1.00 0.62 H new ATOM 106 N TRP A 12 -9.641 1.595 6.227 1.00 0.23 N ATOM 107 CA TRP A 12 -8.552 0.705 6.588 1.00 0.21 C ATOM 108 C TRP A 12 -7.228 1.233 6.033 1.00 0.21 C ATOM 109 O TRP A 12 -7.200 1.866 4.982 1.00 0.25 O ATOM 110 CB TRP A 12 -8.886 -0.679 6.022 1.00 0.23 C ATOM 111 CG TRP A 12 -7.919 -1.770 6.343 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.012 -2.676 7.354 1.00 0.31 C ATOM 113 CD2 TRP A 12 -6.732 -2.093 5.620 1.00 0.26 C ATOM 114 NE1 TRP A 12 -6.954 -3.546 7.301 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.153 -3.205 6.244 1.00 0.29 C ATOM 116 CE3 TRP A 12 -6.106 -1.543 4.505 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -4.976 -3.785 5.782 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -4.941 -2.115 4.052 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.387 -3.226 4.688 1.00 0.36 C ATOM 0 H TRP A 12 -9.421 2.258 5.484 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.439 0.645 7.670 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -9.869 -0.972 6.390 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -8.963 -0.597 4.938 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -8.802 -2.705 8.089 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -6.790 -4.321 7.944 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.528 -0.683 4.005 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.545 -4.646 6.272 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.446 -1.697 3.188 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.472 -3.652 4.305 1.00 0.36 H new ATOM 130 N ALA A 13 -6.139 0.990 6.750 1.00 0.23 N ATOM 131 CA ALA A 13 -4.816 1.406 6.301 1.00 0.23 C ATOM 132 C ALA A 13 -3.740 0.594 7.010 1.00 0.25 C ATOM 133 O ALA A 13 -3.877 0.295 8.194 1.00 0.26 O ATOM 134 CB ALA A 13 -4.610 2.886 6.571 1.00 0.25 C ATOM 0 H ALA A 13 -6.145 0.506 7.648 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.742 1.230 5.228 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.618 3.183 6.231 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.365 3.462 6.036 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -4.699 3.077 7.641 1.00 0.25 H new ATOM 140 N VAL A 14 -2.681 0.227 6.291 1.00 0.27 N ATOM 141 CA VAL A 14 -1.557 -0.488 6.884 1.00 0.27 C ATOM 142 C VAL A 14 -0.215 -0.079 6.277 1.00 0.26 C ATOM 143 O VAL A 14 0.048 -0.280 5.082 1.00 0.33 O ATOM 144 CB VAL A 14 -1.709 -2.033 6.803 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.381 -2.734 7.061 1.00 0.70 C ATOM 146 CG2 VAL A 14 -2.715 -2.522 7.821 1.00 0.79 C ATOM 0 H VAL A 14 -2.580 0.415 5.294 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.568 -0.198 7.935 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.052 -2.270 5.796 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.521 -3.813 6.997 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.348 -2.418 6.315 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.019 -2.473 8.055 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -2.808 -3.606 7.749 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -2.380 -2.252 8.822 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -3.683 -2.061 7.626 1.00 0.79 H new ATOM 156 N ASN A 15 0.621 0.509 7.125 1.00 0.26 N ATOM 157 CA ASN A 15 2.035 0.670 6.832 1.00 0.28 C ATOM 158 C ASN A 15 2.742 -0.577 7.318 1.00 0.28 C ATOM 159 O ASN A 15 3.166 -0.647 8.471 1.00 0.34 O ATOM 160 CB ASN A 15 2.626 1.919 7.517 1.00 0.32 C ATOM 161 CG ASN A 15 4.155 1.963 7.509 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.766 2.482 8.444 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.782 1.440 6.464 1.00 0.83 N ATOM 0 H ASN A 15 0.337 0.885 8.030 1.00 0.26 H new ATOM 0 HA ASN A 15 2.171 0.808 5.759 1.00 0.28 H new ATOM 0 HB2 ASN A 15 2.244 2.810 7.019 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.276 1.956 8.549 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.801 1.460 6.418 1.00 0.83 H new ATOM 0 HD22 ASN A 15 4.245 1.018 5.706 1.00 0.83 H new ATOM 170 N ALA A 16 2.812 -1.573 6.451 1.00 0.33 N ATOM 171 CA ALA A 16 3.471 -2.814 6.790 1.00 0.39 C ATOM 172 C ALA A 16 4.922 -2.557 7.106 1.00 0.37 C ATOM 173 O ALA A 16 5.744 -2.336 6.191 1.00 0.38 O ATOM 174 CB ALA A 16 3.346 -3.834 5.676 1.00 0.48 C ATOM 0 H ALA A 16 2.420 -1.543 5.510 1.00 0.33 H new ATOM 0 HA ALA A 16 2.979 -3.227 7.671 1.00 0.39 H new ATOM 0 HB1 ALA A 16 3.853 -4.754 5.966 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.292 -4.043 5.491 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.802 -3.439 4.768 1.00 0.48 H new ATOM 180 N GLY A 17 5.207 -2.568 8.403 1.00 0.40 N ATOM 181 CA GLY A 17 6.544 -2.336 8.885 1.00 0.45 C ATOM 182 C GLY A 17 6.587 -1.926 10.342 1.00 0.49 C ATOM 183 O GLY A 17 7.359 -2.477 11.127 1.00 0.76 O ATOM 0 H GLY A 17 4.518 -2.737 9.136 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.135 -3.242 8.751 1.00 0.45 H new ATOM 0 HA3 GLY A 17 7.012 -1.559 8.281 1.00 0.45 H new ATOM 187 N GLY A 18 5.750 -0.967 10.707 1.00 0.57 N ATOM 188 CA GLY A 18 5.812 -0.395 12.042 1.00 0.66 C ATOM 189 C GLY A 18 4.655 -0.803 12.932 1.00 0.57 C ATOM 190 O GLY A 18 4.345 -1.986 13.052 1.00 0.74 O ATOM 0 H GLY A 18 5.028 -0.572 10.105 1.00 0.57 H new ATOM 0 HA2 GLY A 18 6.747 -0.697 12.514 1.00 0.66 H new ATOM 0 HA3 GLY A 18 5.832 0.692 11.962 1.00 0.66 H new ATOM 194 N GLU A 19 4.042 0.188 13.580 1.00 0.53 N ATOM 195 CA GLU A 19 2.892 -0.034 14.455 1.00 0.50 C ATOM 196 C GLU A 19 1.981 1.191 14.467 1.00 0.45 C ATOM 197 O GLU A 19 2.437 2.272 14.820 1.00 0.64 O ATOM 198 CB GLU A 19 3.343 -0.300 15.895 1.00 0.69 C ATOM 199 CG GLU A 19 4.089 -1.605 16.101 1.00 1.27 C ATOM 200 CD GLU A 19 4.598 -1.750 17.521 1.00 1.45 C ATOM 201 OE1 GLU A 19 5.688 -1.219 17.826 1.00 1.75 O ATOM 202 OE2 GLU A 19 3.924 -2.412 18.337 1.00 1.77 O ATOM 0 H GLU A 19 4.328 1.165 13.513 1.00 0.53 H new ATOM 0 HA GLU A 19 2.355 -0.900 14.068 1.00 0.50 H new ATOM 0 HB2 GLU A 19 3.982 0.522 16.217 1.00 0.69 H new ATOM 0 HB3 GLU A 19 2.466 -0.294 16.542 1.00 0.69 H new ATOM 0 HG2 GLU A 19 3.430 -2.440 15.865 1.00 1.27 H new ATOM 0 HG3 GLU A 19 4.929 -1.656 15.408 1.00 1.27 H new ATOM 209 N SER A 20 0.717 1.001 14.048 1.00 0.42 N ATOM 210 CA SER A 20 -0.368 2.008 14.169 1.00 0.42 C ATOM 211 C SER A 20 0.077 3.484 14.044 1.00 0.38 C ATOM 212 O SER A 20 0.660 4.049 14.968 1.00 0.44 O ATOM 213 CB SER A 20 -1.105 1.807 15.495 1.00 0.59 C ATOM 214 OG SER A 20 -1.802 0.571 15.510 1.00 1.29 O ATOM 0 H SER A 20 0.410 0.133 13.609 1.00 0.42 H new ATOM 0 HA SER A 20 -1.020 1.832 13.313 1.00 0.42 H new ATOM 0 HB2 SER A 20 -0.392 1.836 16.319 1.00 0.59 H new ATOM 0 HB3 SER A 20 -1.807 2.626 15.652 1.00 0.59 H new ATOM 0 HG SER A 20 -2.263 0.466 16.368 1.00 1.29 H new ATOM 220 N HIS A 21 -0.265 4.132 12.930 1.00 0.34 N ATOM 221 CA HIS A 21 0.095 5.540 12.737 1.00 0.33 C ATOM 222 C HIS A 21 -0.959 6.260 11.911 1.00 0.32 C ATOM 223 O HIS A 21 -1.349 5.775 10.855 1.00 0.32 O ATOM 224 CB HIS A 21 1.466 5.668 12.047 1.00 0.35 C ATOM 225 CG HIS A 21 1.786 7.066 11.576 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.269 8.056 12.401 1.00 0.41 N ATOM 227 CD2 HIS A 21 1.657 7.638 10.355 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.412 9.172 11.704 1.00 0.42 C ATOM 229 NE2 HIS A 21 2.048 8.946 10.464 1.00 0.41 N ATOM 0 H HIS A 21 -0.783 3.714 12.157 1.00 0.34 H new ATOM 0 HA HIS A 21 0.151 6.003 13.722 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.242 5.342 12.740 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.496 4.992 11.193 1.00 0.35 H new ATOM 0 HD2 HIS A 21 1.308 7.150 9.457 1.00 0.40 H new ATOM 0 HE1 HIS A 21 2.770 10.114 12.092 1.00 0.42 H new ATOM 0 HE2 HIS A 21 2.055 9.630 9.708 1.00 0.41 H new ATOM 238 N VAL A 22 -1.403 7.418 12.380 1.00 0.41 N ATOM 239 CA VAL A 22 -2.323 8.231 11.604 1.00 0.40 C ATOM 240 C VAL A 22 -1.535 9.302 10.849 1.00 0.40 C ATOM 241 O VAL A 22 -0.740 10.043 11.431 1.00 0.48 O ATOM 242 CB VAL A 22 -3.449 8.866 12.481 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.040 10.188 13.108 1.00 0.84 C ATOM 244 CG2 VAL A 22 -4.714 9.057 11.664 1.00 1.01 C ATOM 0 H VAL A 22 -1.143 7.811 13.285 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.830 7.582 10.890 1.00 0.40 H new ATOM 0 HB VAL A 22 -3.635 8.167 13.296 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -3.865 10.578 13.705 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -2.171 10.034 13.747 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -2.791 10.902 12.323 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -5.488 9.500 12.290 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -4.507 9.717 10.821 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -5.057 8.091 11.293 1.00 1.01 H new ATOM 254 N ASP A 23 -1.704 9.322 9.541 1.00 0.37 N ATOM 255 CA ASP A 23 -1.019 10.291 8.693 1.00 0.42 C ATOM 256 C ASP A 23 -1.715 11.640 8.792 1.00 0.36 C ATOM 257 O ASP A 23 -2.864 11.699 9.236 1.00 0.33 O ATOM 258 CB ASP A 23 -1.001 9.818 7.234 1.00 0.51 C ATOM 259 CG ASP A 23 -1.915 10.641 6.350 1.00 0.55 C ATOM 260 OD1 ASP A 23 -3.124 10.343 6.303 1.00 0.77 O ATOM 261 OD2 ASP A 23 -1.423 11.554 5.662 1.00 0.75 O ATOM 0 H ASP A 23 -2.312 8.677 9.036 1.00 0.37 H new ATOM 0 HA ASP A 23 0.011 10.388 9.036 1.00 0.42 H new ATOM 0 HB2 ASP A 23 0.018 9.872 6.850 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -1.303 8.772 7.190 1.00 0.51 H new ATOM 266 N VAL A 24 -1.030 12.699 8.350 1.00 0.38 N ATOM 267 CA VAL A 24 -1.540 14.071 8.437 1.00 0.37 C ATOM 268 C VAL A 24 -2.912 14.246 7.779 1.00 0.38 C ATOM 269 O VAL A 24 -3.699 15.091 8.209 1.00 0.49 O ATOM 270 CB VAL A 24 -0.553 15.087 7.817 1.00 0.42 C ATOM 271 CG1 VAL A 24 0.625 15.325 8.748 1.00 0.59 C ATOM 272 CG2 VAL A 24 -0.062 14.607 6.460 1.00 0.62 C ATOM 0 H VAL A 24 -0.107 12.630 7.922 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.648 14.268 9.504 1.00 0.37 H new ATOM 0 HB VAL A 24 -1.083 16.029 7.677 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.308 16.043 8.294 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.264 15.719 9.698 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.148 14.385 8.920 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.631 15.339 6.044 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.447 13.650 6.575 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -0.911 14.488 5.787 1.00 0.62 H new ATOM 282 N HIS A 25 -3.213 13.453 6.754 1.00 0.37 N ATOM 283 CA HIS A 25 -4.528 13.522 6.114 1.00 0.43 C ATOM 284 C HIS A 25 -5.581 12.968 7.064 1.00 0.40 C ATOM 285 O HIS A 25 -6.775 13.213 6.903 1.00 0.51 O ATOM 286 CB HIS A 25 -4.585 12.728 4.801 1.00 0.53 C ATOM 287 CG HIS A 25 -3.462 12.994 3.843 1.00 0.61 C ATOM 288 ND1 HIS A 25 -3.058 14.257 3.474 1.00 0.73 N ATOM 289 CD2 HIS A 25 -2.652 12.137 3.181 1.00 0.72 C ATOM 290 CE1 HIS A 25 -2.053 14.162 2.624 1.00 0.86 C ATOM 291 NE2 HIS A 25 -1.782 12.885 2.430 1.00 0.86 N ATOM 0 H HIS A 25 -2.577 12.764 6.352 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.719 14.570 5.882 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -4.594 11.664 5.039 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.528 12.951 4.301 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -2.684 11.059 3.234 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -1.538 14.992 2.163 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -1.049 12.517 1.824 1.00 0.86 H new ATOM 300 N GLY A 26 -5.110 12.216 8.049 1.00 0.32 N ATOM 301 CA GLY A 26 -5.974 11.600 9.026 1.00 0.33 C ATOM 302 C GLY A 26 -6.183 10.135 8.725 1.00 0.30 C ATOM 303 O GLY A 26 -7.240 9.572 9.022 1.00 0.33 O ATOM 0 H GLY A 26 -4.118 12.021 8.187 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.541 11.711 10.020 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.936 12.112 9.039 1.00 0.33 H new ATOM 307 N ILE A 27 -5.168 9.508 8.143 1.00 0.26 N ATOM 308 CA ILE A 27 -5.271 8.100 7.760 1.00 0.24 C ATOM 309 C ILE A 27 -4.533 7.210 8.757 1.00 0.26 C ATOM 310 O ILE A 27 -3.307 7.226 8.836 1.00 0.28 O ATOM 311 CB ILE A 27 -4.743 7.844 6.331 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.649 8.508 5.295 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.660 6.355 6.049 1.00 0.27 C ATOM 314 CD1 ILE A 27 -7.100 8.191 5.489 1.00 0.31 C ATOM 0 H ILE A 27 -4.272 9.944 7.926 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.331 7.847 7.772 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.745 8.276 6.261 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.511 9.588 5.340 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.344 8.189 4.298 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -4.286 6.197 5.038 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.983 5.887 6.764 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.651 5.911 6.143 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.688 8.693 4.721 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -7.250 7.114 5.415 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.419 8.535 6.473 1.00 0.31 H new ATOM 326 N HIS A 28 -5.288 6.430 9.515 1.00 0.31 N ATOM 327 CA HIS A 28 -4.726 5.659 10.617 1.00 0.33 C ATOM 328 C HIS A 28 -4.444 4.220 10.197 1.00 0.33 C ATOM 329 O HIS A 28 -5.363 3.447 9.936 1.00 0.39 O ATOM 330 CB HIS A 28 -5.700 5.684 11.795 1.00 0.40 C ATOM 331 CG HIS A 28 -5.106 5.322 13.123 1.00 0.49 C ATOM 332 ND1 HIS A 28 -5.244 6.122 14.236 1.00 0.60 N ATOM 333 CD2 HIS A 28 -4.391 4.245 13.526 1.00 0.80 C ATOM 334 CE1 HIS A 28 -4.643 5.557 15.262 1.00 0.66 C ATOM 335 NE2 HIS A 28 -4.117 4.417 14.861 1.00 0.78 N ATOM 0 H HIS A 28 -6.293 6.313 9.388 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.778 6.109 10.912 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -6.131 6.682 11.868 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.520 4.998 11.583 1.00 0.40 H new ATOM 0 HD1 HIS A 28 -5.736 7.015 14.261 1.00 0.60 H new ATOM 0 HD2 HIS A 28 -4.092 3.408 12.913 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -4.590 5.959 16.263 1.00 0.66 H new ATOM 344 N TYR A 29 -3.167 3.877 10.126 1.00 0.32 N ATOM 345 CA TYR A 29 -2.743 2.516 9.842 1.00 0.35 C ATOM 346 C TYR A 29 -2.898 1.637 11.079 1.00 0.40 C ATOM 347 O TYR A 29 -2.468 2.011 12.172 1.00 0.44 O ATOM 348 CB TYR A 29 -1.294 2.510 9.314 1.00 0.42 C ATOM 349 CG TYR A 29 -0.379 1.449 9.901 1.00 0.65 C ATOM 350 CD1 TYR A 29 -0.632 0.098 9.719 1.00 0.80 C ATOM 351 CD2 TYR A 29 0.758 1.807 10.612 1.00 0.98 C ATOM 352 CE1 TYR A 29 0.212 -0.865 10.223 1.00 1.17 C ATOM 353 CE2 TYR A 29 1.607 0.847 11.123 1.00 1.30 C ATOM 354 CZ TYR A 29 1.327 -0.488 10.925 1.00 1.39 C ATOM 355 OH TYR A 29 2.159 -1.446 11.438 1.00 1.75 O ATOM 0 H TYR A 29 -2.398 4.533 10.263 1.00 0.32 H new ATOM 0 HA TYR A 29 -3.383 2.099 9.064 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -1.322 2.380 8.232 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -0.854 3.489 9.506 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -1.511 -0.205 9.170 1.00 0.80 H new ATOM 0 HD2 TYR A 29 0.981 2.852 10.767 1.00 0.98 H new ATOM 0 HE1 TYR A 29 -0.003 -1.912 10.066 1.00 1.17 H new ATOM 0 HE2 TYR A 29 2.487 1.140 11.676 1.00 1.30 H new ATOM 0 HH TYR A 29 2.429 -2.061 10.724 1.00 1.75 H new ATOM 365 N ARG A 30 -3.520 0.479 10.891 1.00 0.50 N ATOM 366 CA ARG A 30 -3.698 -0.493 11.961 1.00 0.64 C ATOM 367 C ARG A 30 -2.503 -1.438 12.035 1.00 0.76 C ATOM 368 O ARG A 30 -2.314 -2.267 11.146 1.00 1.46 O ATOM 369 CB ARG A 30 -4.999 -1.293 11.762 1.00 0.83 C ATOM 370 CG ARG A 30 -5.213 -1.792 10.337 1.00 0.73 C ATOM 371 CD ARG A 30 -5.513 -3.287 10.283 1.00 0.93 C ATOM 372 NE ARG A 30 -6.838 -3.635 10.801 1.00 1.52 N ATOM 373 CZ ARG A 30 -7.497 -4.756 10.477 1.00 2.17 C ATOM 374 NH1 ARG A 30 -6.946 -5.644 9.648 1.00 2.48 N ATOM 375 NH2 ARG A 30 -8.697 -4.994 10.995 1.00 2.94 N ATOM 0 H ARG A 30 -3.914 0.189 9.996 1.00 0.50 H new ATOM 0 HA ARG A 30 -3.768 0.052 12.903 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -4.994 -2.148 12.438 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -5.845 -0.667 12.047 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -6.037 -1.242 9.882 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -4.323 -1.581 9.744 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -5.434 -3.629 9.251 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -4.756 -3.823 10.855 1.00 0.93 H new ATOM 0 HE ARG A 30 -7.286 -2.985 11.447 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -6.019 -5.471 9.258 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -7.451 -6.496 9.404 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -9.117 -4.324 11.639 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -9.199 -5.847 10.749 1.00 2.94 H new ATOM 389 N LYS A 31 -1.688 -1.232 13.084 1.00 0.59 N ATOM 390 CA LYS A 31 -0.530 -2.078 13.438 1.00 0.67 C ATOM 391 C LYS A 31 -0.579 -3.460 12.793 1.00 0.86 C ATOM 392 O LYS A 31 -1.560 -4.188 12.967 1.00 1.37 O ATOM 393 CB LYS A 31 -0.481 -2.240 14.955 1.00 0.99 C ATOM 394 CG LYS A 31 0.769 -2.941 15.450 1.00 1.25 C ATOM 395 CD LYS A 31 0.572 -3.522 16.841 1.00 1.61 C ATOM 396 CE LYS A 31 0.232 -2.447 17.858 1.00 2.18 C ATOM 397 NZ LYS A 31 0.071 -3.006 19.225 1.00 2.78 N ATOM 0 H LYS A 31 -1.818 -0.452 13.728 1.00 0.59 H new ATOM 0 HA LYS A 31 0.362 -1.578 13.061 1.00 0.67 H new ATOM 0 HB2 LYS A 31 -0.544 -1.256 15.419 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -1.356 -2.802 15.281 1.00 0.99 H new ATOM 0 HG2 LYS A 31 1.038 -3.738 14.757 1.00 1.25 H new ATOM 0 HG3 LYS A 31 1.601 -2.236 15.464 1.00 1.25 H new ATOM 0 HD2 LYS A 31 -0.226 -4.264 16.815 1.00 1.61 H new ATOM 0 HD3 LYS A 31 1.479 -4.041 17.150 1.00 1.61 H new ATOM 0 HE2 LYS A 31 1.019 -1.693 17.865 1.00 2.18 H new ATOM 0 HE3 LYS A 31 -0.689 -1.945 17.561 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 -0.160 -2.239 19.889 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 -0.697 -3.707 19.225 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 0.957 -3.463 19.520 1.00 2.78 H new ATOM 411 N ASP A 32 0.522 -3.804 12.104 1.00 0.75 N ATOM 412 CA ASP A 32 0.609 -4.974 11.219 1.00 1.00 C ATOM 413 C ASP A 32 -0.174 -6.179 11.708 1.00 0.93 C ATOM 414 O ASP A 32 0.247 -6.953 12.571 1.00 1.29 O ATOM 415 CB ASP A 32 2.055 -5.330 10.921 1.00 1.58 C ATOM 416 CG ASP A 32 2.559 -4.527 9.746 1.00 1.92 C ATOM 417 OD1 ASP A 32 2.281 -4.910 8.589 1.00 2.36 O ATOM 418 OD2 ASP A 32 3.263 -3.519 9.980 1.00 2.41 O ATOM 0 H ASP A 32 1.389 -3.268 12.148 1.00 0.75 H new ATOM 0 HA ASP A 32 0.127 -4.677 10.288 1.00 1.00 H new ATOM 0 HB2 ASP A 32 2.673 -5.133 11.797 1.00 1.58 H new ATOM 0 HB3 ASP A 32 2.138 -6.395 10.705 1.00 1.58 H new ATOM 423 N PRO A 33 -1.336 -6.336 11.086 1.00 0.72 N ATOM 424 CA PRO A 33 -2.403 -7.215 11.520 1.00 0.89 C ATOM 425 C PRO A 33 -2.525 -8.522 10.736 1.00 1.04 C ATOM 426 O PRO A 33 -3.634 -9.001 10.510 1.00 1.87 O ATOM 427 CB PRO A 33 -3.608 -6.327 11.229 1.00 0.99 C ATOM 428 CG PRO A 33 -3.236 -5.603 9.963 1.00 0.86 C ATOM 429 CD PRO A 33 -1.727 -5.580 9.897 1.00 0.69 C ATOM 0 HA PRO A 33 -2.266 -7.557 12.546 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -4.515 -6.917 11.098 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -3.796 -5.630 12.046 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -3.653 -6.109 9.092 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -3.638 -4.590 9.965 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -1.356 -6.044 8.983 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -1.337 -4.562 9.919 1.00 0.69 H new ATOM 682 N ILE A 50 11.869 7.844 2.770 1.00 0.66 N ATOM 683 CA ILE A 50 10.953 8.189 1.697 1.00 0.48 C ATOM 684 C ILE A 50 10.870 9.707 1.552 1.00 0.70 C ATOM 685 O ILE A 50 10.201 10.404 2.313 1.00 1.59 O ATOM 686 CB ILE A 50 9.551 7.534 1.878 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.573 6.123 1.295 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.464 8.334 1.178 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.463 5.153 2.028 1.00 0.51 C ATOM 0 HA ILE A 50 11.348 7.778 0.768 1.00 0.48 H new ATOM 0 HB ILE A 50 9.329 7.509 2.945 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.556 5.730 1.291 1.00 0.42 H new ATOM 0 HG13 ILE A 50 9.897 6.179 0.256 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.501 7.846 1.326 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.429 9.341 1.593 1.00 0.42 H new ATOM 0 HG23 ILE A 50 8.682 8.389 0.111 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.415 4.178 1.543 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.490 5.517 2.010 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.128 5.062 3.061 1.00 0.51 H new ATOM 701 N LEU A 51 11.592 10.197 0.556 1.00 0.60 N ATOM 702 CA LEU A 51 11.806 11.625 0.358 1.00 0.60 C ATOM 703 C LEU A 51 10.596 12.336 -0.237 1.00 0.62 C ATOM 704 O LEU A 51 10.628 13.548 -0.434 1.00 0.90 O ATOM 705 CB LEU A 51 13.005 11.826 -0.563 1.00 0.66 C ATOM 706 CG LEU A 51 14.361 11.426 0.027 1.00 0.92 C ATOM 707 CD1 LEU A 51 15.462 11.608 -1.005 1.00 1.51 C ATOM 708 CD2 LEU A 51 14.670 12.242 1.274 1.00 1.91 C ATOM 0 H LEU A 51 12.050 9.612 -0.143 1.00 0.60 H new ATOM 0 HA LEU A 51 11.983 12.062 1.341 1.00 0.60 H new ATOM 0 HB2 LEU A 51 12.841 11.252 -1.475 1.00 0.66 H new ATOM 0 HB3 LEU A 51 13.049 12.876 -0.851 1.00 0.66 H new ATOM 0 HG LEU A 51 14.313 10.374 0.308 1.00 0.92 H new ATOM 0 HD11 LEU A 51 16.419 11.320 -0.571 1.00 1.51 H new ATOM 0 HD12 LEU A 51 15.254 10.982 -1.873 1.00 1.51 H new ATOM 0 HD13 LEU A 51 15.503 12.653 -1.313 1.00 1.51 H new ATOM 0 HD21 LEU A 51 15.638 11.941 1.675 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.697 13.301 1.018 1.00 1.91 H new ATOM 0 HD23 LEU A 51 13.897 12.069 2.023 1.00 1.91 H new ATOM 720 N ARG A 52 9.540 11.603 -0.543 1.00 0.56 N ATOM 721 CA ARG A 52 8.372 12.224 -1.154 1.00 0.60 C ATOM 722 C ARG A 52 7.204 12.270 -0.177 1.00 0.59 C ATOM 723 O ARG A 52 6.056 12.434 -0.583 1.00 0.83 O ATOM 724 CB ARG A 52 7.960 11.494 -2.439 1.00 0.70 C ATOM 725 CG ARG A 52 9.087 11.323 -3.452 1.00 0.93 C ATOM 726 CD ARG A 52 9.891 12.603 -3.650 1.00 1.14 C ATOM 727 NE ARG A 52 9.092 13.704 -4.184 1.00 1.80 N ATOM 728 CZ ARG A 52 9.078 14.930 -3.660 1.00 2.47 C ATOM 729 NH1 ARG A 52 9.715 15.182 -2.525 1.00 2.72 N ATOM 730 NH2 ARG A 52 8.407 15.905 -4.260 1.00 3.17 N ATOM 0 H ARG A 52 9.464 10.598 -0.384 1.00 0.56 H new ATOM 0 HA ARG A 52 8.646 13.246 -1.416 1.00 0.60 H new ATOM 0 HB2 ARG A 52 7.572 10.510 -2.176 1.00 0.70 H new ATOM 0 HB3 ARG A 52 7.144 12.043 -2.909 1.00 0.70 H new ATOM 0 HG2 ARG A 52 9.753 10.527 -3.119 1.00 0.93 H new ATOM 0 HG3 ARG A 52 8.668 11.009 -4.408 1.00 0.93 H new ATOM 0 HD2 ARG A 52 10.323 12.905 -2.696 1.00 1.14 H new ATOM 0 HD3 ARG A 52 10.721 12.403 -4.327 1.00 1.14 H new ATOM 0 HE ARG A 52 8.512 13.524 -5.004 1.00 1.80 H new ATOM 0 HH11 ARG A 52 10.220 14.436 -2.047 1.00 2.72 H new ATOM 0 HH12 ARG A 52 9.700 16.122 -2.130 1.00 2.72 H new ATOM 0 HH21 ARG A 52 7.900 15.718 -5.125 1.00 3.17 H new ATOM 0 HH22 ARG A 52 8.398 16.842 -3.856 1.00 3.17 H new ATOM 744 N SER A 53 7.503 12.120 1.105 1.00 0.49 N ATOM 745 CA SER A 53 6.481 12.198 2.138 1.00 0.47 C ATOM 746 C SER A 53 6.906 13.183 3.226 1.00 0.46 C ATOM 747 O SER A 53 8.046 13.657 3.236 1.00 0.54 O ATOM 748 CB SER A 53 6.239 10.811 2.741 1.00 0.47 C ATOM 749 OG SER A 53 4.857 10.504 2.778 1.00 0.97 O ATOM 0 H SER A 53 8.445 11.944 1.455 1.00 0.49 H new ATOM 0 HA SER A 53 5.552 12.553 1.691 1.00 0.47 H new ATOM 0 HB2 SER A 53 6.766 10.059 2.154 1.00 0.47 H new ATOM 0 HB3 SER A 53 6.650 10.773 3.750 1.00 0.47 H new ATOM 0 HG SER A 53 4.393 11.154 3.346 1.00 0.97 H new ATOM 755 N ASN A 54 5.982 13.498 4.124 1.00 0.46 N ATOM 756 CA ASN A 54 6.251 14.395 5.243 1.00 0.48 C ATOM 757 C ASN A 54 6.671 13.565 6.457 1.00 0.44 C ATOM 758 O ASN A 54 6.078 12.536 6.716 1.00 0.42 O ATOM 759 CB ASN A 54 5.003 15.255 5.520 1.00 0.60 C ATOM 760 CG ASN A 54 4.873 15.711 6.961 1.00 0.92 C ATOM 761 OD1 ASN A 54 5.427 16.739 7.357 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.104 14.968 7.739 1.00 0.75 N ATOM 0 H ASN A 54 5.027 13.141 4.099 1.00 0.46 H new ATOM 0 HA ASN A 54 7.069 15.076 5.008 1.00 0.48 H new ATOM 0 HB2 ASN A 54 5.028 16.132 4.873 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.114 14.685 5.249 1.00 0.60 H new ATOM 0 HD21 ASN A 54 3.949 15.238 8.710 1.00 0.75 H new ATOM 0 HD22 ASN A 54 3.666 14.125 7.368 1.00 0.75 H new ATOM 769 N PRO A 55 7.676 14.026 7.231 1.00 0.47 N ATOM 770 CA PRO A 55 8.419 13.197 8.205 1.00 0.49 C ATOM 771 C PRO A 55 7.598 12.170 9.004 1.00 0.45 C ATOM 772 O PRO A 55 8.044 11.032 9.181 1.00 0.46 O ATOM 773 CB PRO A 55 8.998 14.250 9.143 1.00 0.57 C ATOM 774 CG PRO A 55 9.280 15.410 8.255 1.00 0.70 C ATOM 775 CD PRO A 55 8.200 15.406 7.202 1.00 0.53 C ATOM 0 HA PRO A 55 9.135 12.560 7.685 1.00 0.49 H new ATOM 0 HB2 PRO A 55 8.292 14.513 9.931 1.00 0.57 H new ATOM 0 HB3 PRO A 55 9.904 13.893 9.633 1.00 0.57 H new ATOM 0 HG2 PRO A 55 9.271 16.343 8.819 1.00 0.70 H new ATOM 0 HG3 PRO A 55 10.267 15.322 7.801 1.00 0.70 H new ATOM 0 HD2 PRO A 55 7.420 16.134 7.428 1.00 0.53 H new ATOM 0 HD3 PRO A 55 8.599 15.661 6.220 1.00 0.53 H new ATOM 783 N GLU A 56 6.413 12.533 9.481 1.00 0.47 N ATOM 784 CA GLU A 56 5.634 11.605 10.297 1.00 0.49 C ATOM 785 C GLU A 56 4.985 10.534 9.419 1.00 0.40 C ATOM 786 O GLU A 56 5.054 9.332 9.709 1.00 0.39 O ATOM 787 CB GLU A 56 4.574 12.347 11.127 1.00 0.62 C ATOM 788 CG GLU A 56 3.535 13.087 10.308 1.00 0.78 C ATOM 789 CD GLU A 56 2.126 12.646 10.644 1.00 1.73 C ATOM 790 OE1 GLU A 56 1.647 11.664 10.043 1.00 2.71 O ATOM 791 OE2 GLU A 56 1.502 13.275 11.524 1.00 2.02 O ATOM 0 H GLU A 56 5.977 13.441 9.323 1.00 0.47 H new ATOM 0 HA GLU A 56 6.315 11.115 10.993 1.00 0.49 H new ATOM 0 HB2 GLU A 56 4.066 11.628 11.770 1.00 0.62 H new ATOM 0 HB3 GLU A 56 5.077 13.059 11.781 1.00 0.62 H new ATOM 0 HG2 GLU A 56 3.631 14.158 10.484 1.00 0.78 H new ATOM 0 HG3 GLU A 56 3.724 12.920 9.247 1.00 0.78 H new ATOM 798 N ASP A 57 4.382 10.963 8.329 1.00 0.40 N ATOM 799 CA ASP A 57 3.743 10.045 7.414 1.00 0.38 C ATOM 800 C ASP A 57 4.784 9.392 6.515 1.00 0.35 C ATOM 801 O ASP A 57 4.536 8.354 5.912 1.00 0.38 O ATOM 802 CB ASP A 57 2.659 10.760 6.610 1.00 0.47 C ATOM 803 CG ASP A 57 3.173 11.946 5.825 1.00 0.92 C ATOM 804 OD1 ASP A 57 3.695 11.760 4.708 1.00 1.63 O ATOM 805 OD2 ASP A 57 3.053 13.075 6.336 1.00 1.36 O ATOM 0 H ASP A 57 4.322 11.944 8.057 1.00 0.40 H new ATOM 0 HA ASP A 57 3.254 9.253 7.982 1.00 0.38 H new ATOM 0 HB2 ASP A 57 2.201 10.050 5.922 1.00 0.47 H new ATOM 0 HB3 ASP A 57 1.876 11.096 7.290 1.00 0.47 H new ATOM 810 N GLN A 58 5.963 9.997 6.455 1.00 0.34 N ATOM 811 CA GLN A 58 7.126 9.360 5.874 1.00 0.36 C ATOM 812 C GLN A 58 7.397 8.062 6.612 1.00 0.34 C ATOM 813 O GLN A 58 7.661 7.046 5.996 1.00 0.35 O ATOM 814 CB GLN A 58 8.346 10.282 5.952 1.00 0.42 C ATOM 815 CG GLN A 58 9.649 9.612 5.549 1.00 0.51 C ATOM 816 CD GLN A 58 10.858 10.503 5.757 1.00 0.89 C ATOM 817 OE1 GLN A 58 10.781 11.727 5.648 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.985 9.892 6.078 1.00 1.58 N ATOM 0 H GLN A 58 6.135 10.939 6.807 1.00 0.34 H new ATOM 0 HA GLN A 58 6.933 9.151 4.822 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.178 11.146 5.309 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.441 10.657 6.971 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.775 8.696 6.127 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.594 9.322 4.500 1.00 0.51 H new ATOM 0 HE21 GLN A 58 12.009 8.875 6.159 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.831 10.437 6.245 1.00 1.58 H new ATOM 827 N VAL A 59 7.310 8.101 7.941 1.00 0.35 N ATOM 828 CA VAL A 59 7.386 6.879 8.741 1.00 0.37 C ATOM 829 C VAL A 59 6.330 5.889 8.271 1.00 0.32 C ATOM 830 O VAL A 59 6.616 4.709 8.068 1.00 0.37 O ATOM 831 CB VAL A 59 7.168 7.148 10.245 1.00 0.45 C ATOM 832 CG1 VAL A 59 7.264 5.859 11.043 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.161 8.170 10.758 1.00 1.27 C ATOM 0 H VAL A 59 7.188 8.957 8.483 1.00 0.35 H new ATOM 0 HA VAL A 59 8.389 6.473 8.607 1.00 0.37 H new ATOM 0 HB VAL A 59 6.165 7.554 10.374 1.00 0.45 H new ATOM 0 HG11 VAL A 59 7.107 6.073 12.100 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.503 5.160 10.697 1.00 1.08 H new ATOM 0 HG13 VAL A 59 8.251 5.418 10.905 1.00 1.08 H new ATOM 0 HG21 VAL A 59 7.988 8.344 11.820 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.175 7.798 10.611 1.00 1.27 H new ATOM 0 HG23 VAL A 59 8.035 9.105 10.212 1.00 1.27 H new ATOM 843 N LEU A 60 5.115 6.398 8.075 1.00 0.30 N ATOM 844 CA LEU A 60 3.998 5.592 7.575 1.00 0.31 C ATOM 845 C LEU A 60 4.274 5.065 6.162 1.00 0.33 C ATOM 846 O LEU A 60 3.590 4.174 5.668 1.00 0.41 O ATOM 847 CB LEU A 60 2.721 6.433 7.555 1.00 0.34 C ATOM 848 CG LEU A 60 1.454 5.685 7.156 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.999 4.775 8.280 1.00 1.12 C ATOM 850 CD2 LEU A 60 0.354 6.657 6.773 1.00 1.18 C ATOM 0 H LEU A 60 4.876 7.373 8.256 1.00 0.30 H new ATOM 0 HA LEU A 60 3.877 4.740 8.244 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.573 6.862 8.546 1.00 0.34 H new ATOM 0 HB3 LEU A 60 2.864 7.265 6.865 1.00 0.34 H new ATOM 0 HG LEU A 60 1.679 5.069 6.285 1.00 0.56 H new ATOM 0 HD11 LEU A 60 0.093 4.249 7.978 1.00 1.12 H new ATOM 0 HD12 LEU A 60 1.783 4.051 8.502 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.793 5.370 9.170 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.541 6.102 6.492 1.00 1.18 H new ATOM 0 HD22 LEU A 60 0.128 7.304 7.621 1.00 1.18 H new ATOM 0 HD23 LEU A 60 0.683 7.265 5.931 1.00 1.18 H new ATOM 862 N TYR A 61 5.261 5.638 5.511 1.00 0.35 N ATOM 863 CA TYR A 61 5.604 5.268 4.146 1.00 0.40 C ATOM 864 C TYR A 61 6.990 4.620 4.074 1.00 0.45 C ATOM 865 O TYR A 61 7.444 4.247 3.003 1.00 0.56 O ATOM 866 CB TYR A 61 5.577 6.509 3.238 1.00 0.42 C ATOM 867 CG TYR A 61 4.192 7.043 2.892 1.00 0.47 C ATOM 868 CD1 TYR A 61 3.081 6.772 3.682 1.00 0.59 C ATOM 869 CD2 TYR A 61 4.010 7.834 1.764 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.833 7.272 3.358 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.766 8.336 1.434 1.00 0.99 C ATOM 872 CZ TYR A 61 1.681 8.054 2.232 1.00 0.78 C ATOM 873 OH TYR A 61 0.440 8.559 1.905 1.00 0.96 O ATOM 0 H TYR A 61 5.850 6.371 5.906 1.00 0.35 H new ATOM 0 HA TYR A 61 4.864 4.544 3.805 1.00 0.40 H new ATOM 0 HB2 TYR A 61 6.142 7.304 3.724 1.00 0.42 H new ATOM 0 HB3 TYR A 61 6.096 6.269 2.310 1.00 0.42 H new ATOM 0 HD1 TYR A 61 3.194 6.160 4.565 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.857 8.061 1.133 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.981 7.051 3.984 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.645 8.948 0.552 1.00 0.99 H new ATOM 0 HH TYR A 61 0.509 9.089 1.084 1.00 0.96 H new ATOM 883 N GLN A 62 7.655 4.472 5.205 1.00 0.43 N ATOM 884 CA GLN A 62 9.070 4.078 5.198 1.00 0.58 C ATOM 885 C GLN A 62 9.329 2.797 5.977 1.00 0.73 C ATOM 886 O GLN A 62 10.082 1.937 5.529 1.00 1.49 O ATOM 887 CB GLN A 62 9.919 5.209 5.778 1.00 0.63 C ATOM 888 CG GLN A 62 11.397 4.887 5.886 1.00 0.99 C ATOM 889 CD GLN A 62 12.185 6.017 6.513 1.00 1.18 C ATOM 890 OE1 GLN A 62 11.836 7.188 6.375 1.00 1.97 O ATOM 891 NE2 GLN A 62 13.254 5.675 7.205 1.00 1.13 N ATOM 0 H GLN A 62 7.254 4.614 6.132 1.00 0.43 H new ATOM 0 HA GLN A 62 9.345 3.886 4.161 1.00 0.58 H new ATOM 0 HB2 GLN A 62 9.797 6.095 5.156 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.540 5.460 6.769 1.00 0.63 H new ATOM 0 HG2 GLN A 62 11.527 3.982 6.480 1.00 0.99 H new ATOM 0 HG3 GLN A 62 11.795 4.676 4.893 1.00 0.99 H new ATOM 0 HE21 GLN A 62 13.510 4.692 7.296 1.00 1.13 H new ATOM 0 HE22 GLN A 62 13.825 6.394 7.650 1.00 1.13 H new ATOM 900 N THR A 63 8.713 2.689 7.138 1.00 0.44 N ATOM 901 CA THR A 63 8.948 1.561 8.039 1.00 0.48 C ATOM 902 C THR A 63 8.586 0.224 7.371 1.00 0.61 C ATOM 903 O THR A 63 7.509 0.090 6.784 1.00 1.27 O ATOM 904 CB THR A 63 8.136 1.743 9.333 1.00 0.50 C ATOM 905 OG1 THR A 63 8.151 3.124 9.715 1.00 0.89 O ATOM 906 CG2 THR A 63 8.713 0.909 10.463 1.00 0.89 C ATOM 0 H THR A 63 8.040 3.371 7.488 1.00 0.44 H new ATOM 0 HA THR A 63 10.011 1.538 8.280 1.00 0.48 H new ATOM 0 HB THR A 63 7.114 1.413 9.144 1.00 0.50 H new ATOM 0 HG1 THR A 63 7.474 3.613 9.202 1.00 0.89 H new ATOM 0 HG21 THR A 63 8.119 1.058 11.365 1.00 0.89 H new ATOM 0 HG22 THR A 63 8.693 -0.145 10.185 1.00 0.89 H new ATOM 0 HG23 THR A 63 9.742 1.215 10.652 1.00 0.89 H new ATOM 914 N GLU A 64 9.496 -0.752 7.455 1.00 0.53 N ATOM 915 CA GLU A 64 9.343 -2.026 6.750 1.00 0.53 C ATOM 916 C GLU A 64 9.235 -3.218 7.706 1.00 0.58 C ATOM 917 O GLU A 64 9.620 -3.138 8.869 1.00 0.99 O ATOM 918 CB GLU A 64 10.535 -2.241 5.805 1.00 0.67 C ATOM 919 CG GLU A 64 11.804 -2.794 6.462 1.00 1.00 C ATOM 920 CD GLU A 64 12.390 -1.912 7.556 1.00 1.42 C ATOM 921 OE1 GLU A 64 12.163 -0.683 7.503 1.00 1.96 O ATOM 922 OE2 GLU A 64 13.061 -2.437 8.467 1.00 1.78 O ATOM 0 H GLU A 64 10.350 -0.682 8.008 1.00 0.53 H new ATOM 0 HA GLU A 64 8.412 -1.971 6.186 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.230 -2.924 5.012 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.777 -1.290 5.331 1.00 0.67 H new ATOM 0 HG2 GLU A 64 11.581 -3.774 6.885 1.00 1.00 H new ATOM 0 HG3 GLU A 64 12.560 -2.944 5.691 1.00 1.00 H new ATOM 929 N ARG A 65 8.671 -4.314 7.199 1.00 0.85 N ATOM 930 CA ARG A 65 8.628 -5.585 7.921 1.00 0.96 C ATOM 931 C ARG A 65 8.905 -6.745 6.964 1.00 1.17 C ATOM 932 O ARG A 65 8.685 -6.626 5.756 1.00 2.02 O ATOM 933 CB ARG A 65 7.263 -5.796 8.589 1.00 0.96 C ATOM 934 CG ARG A 65 6.103 -5.744 7.611 1.00 1.17 C ATOM 935 CD ARG A 65 4.796 -6.211 8.233 1.00 1.09 C ATOM 936 NE ARG A 65 4.791 -7.645 8.496 1.00 1.70 N ATOM 937 CZ ARG A 65 4.101 -8.516 7.773 1.00 2.50 C ATOM 938 NH1 ARG A 65 3.379 -8.099 6.740 1.00 2.93 N ATOM 939 NH2 ARG A 65 4.126 -9.798 8.092 1.00 3.35 N ATOM 0 H ARG A 65 8.232 -4.346 6.279 1.00 0.85 H new ATOM 0 HA ARG A 65 9.396 -5.554 8.694 1.00 0.96 H new ATOM 0 HB2 ARG A 65 7.259 -6.761 9.096 1.00 0.96 H new ATOM 0 HB3 ARG A 65 7.119 -5.033 9.354 1.00 0.96 H new ATOM 0 HG2 ARG A 65 5.984 -4.723 7.247 1.00 1.17 H new ATOM 0 HG3 ARG A 65 6.333 -6.366 6.746 1.00 1.17 H new ATOM 0 HD2 ARG A 65 4.627 -5.672 9.165 1.00 1.09 H new ATOM 0 HD3 ARG A 65 3.970 -5.963 7.567 1.00 1.09 H new ATOM 0 HE ARG A 65 5.347 -7.996 9.276 1.00 1.70 H new ATOM 0 HH11 ARG A 65 3.355 -7.107 6.502 1.00 2.93 H new ATOM 0 HH12 ARG A 65 2.849 -8.770 6.184 1.00 2.93 H new ATOM 0 HH21 ARG A 65 4.675 -10.114 8.892 1.00 3.35 H new ATOM 0 HH22 ARG A 65 3.597 -10.472 7.539 1.00 3.35 H new ATOM 1015 N SER A 70 4.251 -13.927 0.161 1.00 0.78 N ATOM 1016 CA SER A 70 2.807 -13.900 -0.011 1.00 0.76 C ATOM 1017 C SER A 70 2.119 -13.437 1.269 1.00 0.82 C ATOM 1018 O SER A 70 1.325 -14.172 1.866 1.00 1.01 O ATOM 1019 CB SER A 70 2.297 -15.284 -0.440 1.00 0.96 C ATOM 1020 OG SER A 70 0.905 -15.268 -0.714 1.00 1.41 O ATOM 0 HA SER A 70 2.564 -13.186 -0.798 1.00 0.76 H new ATOM 0 HB2 SER A 70 2.839 -15.613 -1.327 1.00 0.96 H new ATOM 0 HB3 SER A 70 2.505 -16.009 0.347 1.00 0.96 H new ATOM 0 HG SER A 70 0.416 -15.007 0.094 1.00 1.41 H new ATOM 1026 N PHE A 71 2.412 -12.217 1.691 1.00 0.78 N ATOM 1027 CA PHE A 71 1.816 -11.705 2.908 1.00 0.94 C ATOM 1028 C PHE A 71 0.708 -10.725 2.570 1.00 0.58 C ATOM 1029 O PHE A 71 0.917 -9.740 1.858 1.00 0.79 O ATOM 1030 CB PHE A 71 2.855 -11.119 3.891 1.00 1.57 C ATOM 1031 CG PHE A 71 3.899 -10.182 3.324 1.00 1.10 C ATOM 1032 CD1 PHE A 71 3.579 -8.857 3.097 1.00 1.10 C ATOM 1033 CD2 PHE A 71 5.168 -10.628 2.966 1.00 1.38 C ATOM 1034 CE1 PHE A 71 4.493 -7.989 2.538 1.00 1.29 C ATOM 1035 CE2 PHE A 71 6.091 -9.758 2.395 1.00 1.18 C ATOM 1036 CZ PHE A 71 5.899 -8.478 2.380 1.00 1.02 C ATOM 0 H PHE A 71 3.047 -11.575 1.217 1.00 0.78 H new ATOM 0 HA PHE A 71 1.374 -12.546 3.442 1.00 0.94 H new ATOM 0 HB2 PHE A 71 2.315 -10.587 4.674 1.00 1.57 H new ATOM 0 HB3 PHE A 71 3.373 -11.951 4.369 1.00 1.57 H new ATOM 0 HD1 PHE A 71 2.596 -8.495 3.362 1.00 1.10 H new ATOM 0 HD2 PHE A 71 5.439 -11.660 3.133 1.00 1.38 H new ATOM 0 HE1 PHE A 71 4.206 -6.996 2.226 1.00 1.29 H new ATOM 0 HE2 PHE A 71 6.990 -10.161 1.953 1.00 1.18 H new ATOM 0 HZ PHE A 71 6.722 -7.789 2.258 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.485 -11.040 3.057 1.00 0.46 N ATOM 1047 CA GLY A 72 -1.666 -10.318 2.655 1.00 0.78 C ATOM 1048 C GLY A 72 -2.225 -9.417 3.730 1.00 0.58 C ATOM 1049 O GLY A 72 -1.753 -9.412 4.865 1.00 0.74 O ATOM 0 H GLY A 72 -0.652 -11.790 3.728 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -1.432 -9.717 1.776 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.434 -11.032 2.357 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.239 -8.657 3.354 1.00 0.39 N ATOM 1054 CA TYR A 73 -3.884 -7.716 4.250 1.00 0.36 C ATOM 1055 C TYR A 73 -5.395 -7.884 4.165 1.00 0.34 C ATOM 1056 O TYR A 73 -5.935 -8.117 3.082 1.00 0.43 O ATOM 1057 CB TYR A 73 -3.505 -6.287 3.868 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.016 -6.060 3.753 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -1.263 -5.716 4.868 1.00 0.72 C ATOM 1060 CD2 TYR A 73 -1.364 -6.189 2.535 1.00 0.78 C ATOM 1061 CE1 TYR A 73 0.096 -5.503 4.773 1.00 0.89 C ATOM 1062 CE2 TYR A 73 -0.003 -5.980 2.431 1.00 0.97 C ATOM 1063 CZ TYR A 73 0.722 -5.650 3.525 1.00 0.99 C ATOM 1064 OH TYR A 73 2.081 -5.423 3.469 1.00 1.21 O ATOM 0 H TYR A 73 -3.639 -8.676 2.416 1.00 0.39 H new ATOM 0 HA TYR A 73 -3.553 -7.911 5.270 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -3.975 -6.039 2.917 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -3.911 -5.602 4.613 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -1.750 -5.614 5.826 1.00 0.72 H new ATOM 0 HD2 TYR A 73 -1.930 -6.457 1.655 1.00 0.78 H new ATOM 0 HE1 TYR A 73 0.670 -5.227 5.645 1.00 0.89 H new ATOM 0 HE2 TYR A 73 0.485 -6.080 1.473 1.00 0.97 H new ATOM 0 HH TYR A 73 2.538 -6.242 3.183 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.069 -7.766 5.299 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.514 -7.936 5.345 1.00 0.39 C ATOM 1076 C ASP A 74 -8.221 -6.598 5.511 1.00 0.34 C ATOM 1077 O ASP A 74 -8.072 -5.923 6.522 1.00 0.44 O ATOM 1078 CB ASP A 74 -7.929 -8.906 6.466 1.00 0.57 C ATOM 1079 CG ASP A 74 -7.453 -8.494 7.852 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -6.322 -8.868 8.225 1.00 1.92 O ATOM 1081 OD2 ASP A 74 -8.216 -7.822 8.582 1.00 2.47 O ATOM 0 H ASP A 74 -5.639 -7.553 6.199 1.00 0.35 H new ATOM 0 HA ASP A 74 -7.820 -8.368 4.392 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -9.016 -8.989 6.476 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -7.536 -9.897 6.238 1.00 0.57 H new ATOM 1086 N ILE A 75 -8.971 -6.215 4.489 1.00 0.28 N ATOM 1087 CA ILE A 75 -9.786 -5.010 4.526 1.00 0.27 C ATOM 1088 C ILE A 75 -11.253 -5.397 4.650 1.00 0.27 C ATOM 1089 O ILE A 75 -11.920 -5.622 3.645 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.652 -4.151 3.242 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.214 -3.744 2.937 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.499 -2.901 3.356 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.368 -4.826 2.320 1.00 0.38 C ATOM 0 H ILE A 75 -9.032 -6.730 3.611 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.436 -4.427 5.378 1.00 0.27 H new ATOM 0 HB ILE A 75 -9.999 -4.779 2.421 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.229 -2.886 2.264 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.740 -3.415 3.862 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.395 -2.307 2.448 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.544 -3.181 3.490 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.168 -2.314 4.213 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.363 -4.444 2.139 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.316 -5.678 2.998 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -7.812 -5.141 1.375 1.00 0.38 H new ATOM 1105 N PRO A 76 -11.777 -5.505 5.868 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.183 -5.850 6.079 1.00 0.35 C ATOM 1107 C PRO A 76 -14.123 -4.833 5.431 1.00 0.34 C ATOM 1108 O PRO A 76 -14.131 -3.658 5.803 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.341 -5.817 7.593 1.00 0.45 C ATOM 1110 CG PRO A 76 -11.962 -5.959 8.136 1.00 0.59 C ATOM 1111 CD PRO A 76 -11.056 -5.311 7.131 1.00 0.41 C ATOM 0 HA PRO A 76 -13.436 -6.812 5.634 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -13.798 -4.883 7.920 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -13.985 -6.626 7.939 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -11.874 -5.477 9.110 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -11.703 -7.009 8.276 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -10.900 -4.254 7.349 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.073 -5.781 7.111 1.00 0.41 H new ATOM 1119 N ILE A 77 -14.914 -5.286 4.470 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.794 -4.394 3.728 1.00 0.30 C ATOM 1121 C ILE A 77 -17.251 -4.812 3.881 1.00 0.36 C ATOM 1122 O ILE A 77 -17.572 -5.997 3.853 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.434 -4.372 2.224 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.010 -3.852 2.017 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.426 -3.519 1.436 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.593 -3.780 0.565 1.00 0.49 C ATOM 0 H ILE A 77 -14.965 -6.264 4.186 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.657 -3.395 4.143 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.490 -5.395 1.852 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -13.928 -2.859 2.459 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.315 -4.498 2.554 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.150 -3.520 0.382 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.429 -3.930 1.549 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.408 -2.497 1.814 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.573 -3.403 0.498 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.642 -4.775 0.123 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.264 -3.110 0.027 1.00 0.49 H new ATOM 1138 N LYS A 78 -18.123 -3.832 4.062 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.557 -4.075 4.083 1.00 0.54 C ATOM 1140 C LYS A 78 -20.294 -3.011 3.287 1.00 0.55 C ATOM 1141 O LYS A 78 -21.521 -2.975 3.278 1.00 0.71 O ATOM 1142 CB LYS A 78 -20.084 -4.099 5.518 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.738 -5.366 6.277 1.00 1.23 C ATOM 1144 CD LYS A 78 -20.370 -6.588 5.630 1.00 1.82 C ATOM 1145 CE LYS A 78 -20.139 -7.837 6.461 1.00 2.66 C ATOM 1146 NZ LYS A 78 -20.732 -7.720 7.821 1.00 3.32 N ATOM 0 H LYS A 78 -17.860 -2.856 4.197 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.735 -5.048 3.626 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -19.681 -3.242 6.057 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.168 -3.983 5.499 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -18.655 -5.488 6.310 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -20.081 -5.280 7.308 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -21.441 -6.424 5.507 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -19.953 -6.730 4.633 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -20.571 -8.697 5.950 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -19.068 -8.022 6.547 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -21.282 -8.577 8.035 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -19.972 -7.612 8.523 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -21.357 -6.890 7.857 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.546 -2.156 2.599 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.138 -1.020 1.913 1.00 0.47 C ATOM 1162 C GLU A 79 -19.811 -1.078 0.429 1.00 0.36 C ATOM 1163 O GLU A 79 -19.160 -2.017 -0.032 1.00 0.39 O ATOM 1164 CB GLU A 79 -19.605 0.280 2.517 1.00 0.60 C ATOM 1165 CG GLU A 79 -19.999 0.492 3.969 1.00 1.02 C ATOM 1166 CD GLU A 79 -21.421 0.985 4.124 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -22.365 0.187 3.951 1.00 2.16 O ATOM 1168 OE2 GLU A 79 -21.602 2.183 4.426 1.00 1.87 O ATOM 0 H GLU A 79 -18.533 -2.229 2.503 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.221 -1.054 2.034 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -18.518 0.285 2.442 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -19.969 1.120 1.926 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -19.883 -0.445 4.513 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -19.318 1.211 4.424 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.245 -0.070 -0.305 1.00 0.38 N ATOM 1176 CA GLU A 80 -19.964 0.019 -1.724 1.00 0.34 C ATOM 1177 C GLU A 80 -19.364 1.375 -2.065 1.00 0.35 C ATOM 1178 O GLU A 80 -19.162 2.216 -1.184 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.238 -0.221 -2.526 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.680 -1.669 -2.517 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.179 -1.814 -2.421 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -23.847 -1.852 -3.478 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -23.697 -1.892 -1.294 1.00 1.20 O ATOM 0 H GLU A 80 -20.798 0.704 0.063 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.237 -0.750 -1.986 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -22.038 0.399 -2.121 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -21.078 0.098 -3.556 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.328 -2.159 -3.425 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.214 -2.183 -1.676 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.082 1.574 -3.338 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.447 2.794 -3.782 1.00 0.28 C ATOM 1192 C GLY A 81 -17.146 2.492 -4.480 1.00 0.24 C ATOM 1193 O GLY A 81 -16.835 1.322 -4.723 1.00 0.28 O ATOM 0 H GLY A 81 -19.284 0.905 -4.081 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.112 3.331 -4.458 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.265 3.447 -2.928 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.378 3.518 -4.811 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.089 3.290 -5.436 1.00 0.23 C ATOM 1199 C GLU A 82 -14.014 3.220 -4.367 1.00 0.22 C ATOM 1200 O GLU A 82 -13.648 4.232 -3.788 1.00 0.26 O ATOM 1201 CB GLU A 82 -14.762 4.401 -6.436 1.00 0.29 C ATOM 1202 CG GLU A 82 -15.881 4.676 -7.426 1.00 0.42 C ATOM 1203 CD GLU A 82 -15.464 5.627 -8.526 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -15.117 6.785 -8.216 1.00 1.96 O ATOM 1205 OE2 GLU A 82 -15.485 5.226 -9.706 1.00 1.30 O ATOM 0 H GLU A 82 -16.620 4.497 -4.660 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.127 2.346 -5.979 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -14.539 5.317 -5.889 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -13.860 4.130 -6.985 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -16.209 3.735 -7.869 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -16.737 5.093 -6.895 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.474 2.045 -4.119 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.480 1.921 -3.070 1.00 0.22 C ATOM 1214 C TYR A 83 -11.124 2.091 -3.679 1.00 0.22 C ATOM 1215 O TYR A 83 -10.758 1.395 -4.621 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.533 0.564 -2.372 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.751 0.338 -1.526 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -14.958 0.002 -2.108 1.00 0.59 C ATOM 1219 CD2 TYR A 83 -13.700 0.478 -0.151 1.00 0.67 C ATOM 1220 CE1 TYR A 83 -16.078 -0.194 -1.345 1.00 0.60 C ATOM 1221 CE2 TYR A 83 -14.816 0.282 0.619 1.00 0.71 C ATOM 1222 CZ TYR A 83 -15.977 -0.101 0.046 1.00 0.39 C ATOM 1223 OH TYR A 83 -17.126 -0.247 0.776 1.00 0.44 O ATOM 0 H TYR A 83 -13.698 1.182 -4.614 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.687 2.687 -2.322 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.483 -0.220 -3.128 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.648 0.459 -1.745 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -15.019 -0.108 -3.181 1.00 0.59 H new ATOM 0 HD2 TYR A 83 -12.767 0.746 0.322 1.00 0.67 H new ATOM 0 HE1 TYR A 83 -17.026 -0.417 -1.811 1.00 0.60 H new ATOM 0 HE2 TYR A 83 -14.767 0.434 1.687 1.00 0.71 H new ATOM 0 HH TYR A 83 -17.743 0.484 0.564 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.380 3.011 -3.134 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.118 3.369 -3.715 1.00 0.22 C ATOM 1235 C VAL A 84 -7.991 3.003 -2.782 1.00 0.23 C ATOM 1236 O VAL A 84 -7.782 3.633 -1.740 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.084 4.863 -4.093 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -7.703 5.279 -4.567 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.115 5.125 -5.169 1.00 0.25 C ATOM 0 H VAL A 84 -10.625 3.526 -2.289 1.00 0.22 H new ATOM 0 HA VAL A 84 -8.987 2.804 -4.638 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.318 5.456 -3.209 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -7.711 6.338 -4.826 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -6.978 5.106 -3.772 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.427 4.693 -5.444 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.097 6.180 -5.441 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -9.887 4.520 -6.046 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.105 4.864 -4.795 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.298 1.944 -3.151 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.167 1.480 -2.391 1.00 0.30 C ATOM 1251 C LEU A 85 -4.923 2.173 -2.896 1.00 0.29 C ATOM 1252 O LEU A 85 -4.418 1.864 -3.973 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.001 -0.042 -2.512 1.00 0.40 C ATOM 1254 CG LEU A 85 -7.160 -0.886 -1.969 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -8.334 -0.905 -2.938 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -6.690 -2.300 -1.684 1.00 1.13 C ATOM 0 H LEU A 85 -7.505 1.388 -3.981 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.330 1.715 -1.339 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -5.858 -0.290 -3.564 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -5.090 -0.332 -1.989 1.00 0.40 H new ATOM 0 HG LEU A 85 -7.501 -0.430 -1.040 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -9.139 -1.512 -2.523 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -8.692 0.112 -3.096 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -8.014 -1.329 -3.890 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -7.522 -2.889 -1.299 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -6.320 -2.753 -2.604 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -5.890 -2.275 -0.944 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.454 3.131 -2.134 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.228 3.816 -2.461 1.00 0.34 C ATOM 1270 C VAL A 86 -2.137 3.286 -1.553 1.00 0.32 C ATOM 1271 O VAL A 86 -2.082 3.627 -0.369 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.361 5.342 -2.274 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -2.051 6.044 -2.603 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -4.493 5.887 -3.129 1.00 1.14 C ATOM 0 H VAL A 86 -4.906 3.455 -1.279 1.00 0.31 H new ATOM 0 HA VAL A 86 -2.989 3.635 -3.509 1.00 0.34 H new ATOM 0 HB VAL A 86 -3.596 5.539 -1.228 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -2.169 7.119 -2.464 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -1.266 5.677 -1.942 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -1.779 5.840 -3.639 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -4.572 6.964 -2.984 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -4.290 5.676 -4.179 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -5.430 5.412 -2.838 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.299 2.418 -2.078 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.236 1.861 -1.273 1.00 0.32 C ATOM 1286 C LEU A 87 1.087 2.508 -1.632 1.00 0.28 C ATOM 1287 O LEU A 87 1.422 2.667 -2.807 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.149 0.309 -1.367 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.533 -0.389 -2.690 1.00 0.57 C ATOM 1290 CD1 LEU A 87 -2.025 -0.288 -2.974 1.00 1.37 C ATOM 1291 CD2 LEU A 87 0.264 0.154 -3.853 1.00 1.44 C ATOM 0 H LEU A 87 -1.332 2.088 -3.042 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.471 2.086 -0.233 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.876 0.023 -1.131 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -0.784 -0.103 -0.583 1.00 0.42 H new ATOM 0 HG LEU A 87 -0.288 -1.444 -2.570 1.00 0.57 H new ATOM 0 HD11 LEU A 87 -2.251 -0.792 -3.914 1.00 1.37 H new ATOM 0 HD12 LEU A 87 -2.582 -0.761 -2.165 1.00 1.37 H new ATOM 0 HD13 LEU A 87 -2.311 0.761 -3.047 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -0.032 -0.359 -4.768 1.00 1.44 H new ATOM 0 HD22 LEU A 87 0.073 1.222 -3.958 1.00 1.44 H new ATOM 0 HD23 LEU A 87 1.327 -0.008 -3.673 1.00 1.44 H new ATOM 1303 N LYS A 88 1.836 2.909 -0.620 1.00 0.28 N ATOM 1304 CA LYS A 88 3.180 3.403 -0.868 1.00 0.28 C ATOM 1305 C LYS A 88 4.132 2.225 -0.855 1.00 0.28 C ATOM 1306 O LYS A 88 4.244 1.516 0.144 1.00 0.39 O ATOM 1307 CB LYS A 88 3.614 4.435 0.183 1.00 0.35 C ATOM 1308 CG LYS A 88 4.674 5.434 -0.286 1.00 0.67 C ATOM 1309 CD LYS A 88 5.904 4.778 -0.900 1.00 1.91 C ATOM 1310 CE LYS A 88 6.904 4.302 0.140 1.00 2.70 C ATOM 1311 NZ LYS A 88 6.409 3.141 0.926 1.00 3.73 N ATOM 0 H LYS A 88 1.547 2.904 0.358 1.00 0.28 H new ATOM 0 HA LYS A 88 3.195 3.903 -1.837 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.734 4.989 0.510 1.00 0.35 H new ATOM 0 HB3 LYS A 88 3.998 3.904 1.054 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.228 6.107 -1.019 1.00 0.67 H new ATOM 0 HG3 LYS A 88 4.984 6.046 0.561 1.00 0.67 H new ATOM 0 HD2 LYS A 88 5.591 3.930 -1.510 1.00 1.91 H new ATOM 0 HD3 LYS A 88 6.392 5.488 -1.568 1.00 1.91 H new ATOM 0 HE2 LYS A 88 7.835 4.029 -0.356 1.00 2.70 H new ATOM 0 HE3 LYS A 88 7.134 5.123 0.819 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 6.531 3.332 1.941 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 5.401 2.987 0.721 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 6.948 2.291 0.666 1.00 3.73 H new ATOM 1325 N PHE A 89 4.833 2.032 -1.948 1.00 0.27 N ATOM 1326 CA PHE A 89 5.799 0.960 -2.037 1.00 0.28 C ATOM 1327 C PHE A 89 7.219 1.488 -1.989 1.00 0.28 C ATOM 1328 O PHE A 89 7.522 2.548 -2.535 1.00 0.29 O ATOM 1329 CB PHE A 89 5.589 0.152 -3.306 1.00 0.32 C ATOM 1330 CG PHE A 89 4.624 -0.969 -3.127 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.810 -1.874 -2.101 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.541 -1.126 -3.971 1.00 0.37 C ATOM 1333 CE1 PHE A 89 3.940 -2.920 -1.913 1.00 0.44 C ATOM 1334 CE2 PHE A 89 2.665 -2.176 -3.792 1.00 0.42 C ATOM 1335 CZ PHE A 89 2.863 -3.075 -2.763 1.00 0.45 C ATOM 0 H PHE A 89 4.753 2.603 -2.789 1.00 0.27 H new ATOM 0 HA PHE A 89 5.647 0.311 -1.174 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.229 0.812 -4.095 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.547 -0.249 -3.638 1.00 0.32 H new ATOM 0 HD1 PHE A 89 5.653 -1.758 -1.436 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.380 -0.423 -4.775 1.00 0.37 H new ATOM 0 HE1 PHE A 89 4.098 -3.618 -1.104 1.00 0.44 H new ATOM 0 HE2 PHE A 89 1.823 -2.295 -4.458 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.177 -3.897 -2.623 1.00 0.45 H new ATOM 1345 N ALA A 90 8.067 0.752 -1.301 1.00 0.32 N ATOM 1346 CA ALA A 90 9.484 1.073 -1.215 1.00 0.36 C ATOM 1347 C ALA A 90 10.299 -0.198 -1.444 1.00 0.42 C ATOM 1348 O ALA A 90 10.232 -1.138 -0.641 1.00 0.51 O ATOM 1349 CB ALA A 90 9.816 1.695 0.131 1.00 0.44 C ATOM 0 H ALA A 90 7.798 -0.086 -0.785 1.00 0.32 H new ATOM 0 HA ALA A 90 9.735 1.804 -1.984 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.880 1.926 0.172 1.00 0.44 H new ATOM 0 HB2 ALA A 90 9.240 2.611 0.260 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.566 0.994 0.927 1.00 0.44 H new ATOM 1521 N VAL A 101 9.771 -7.812 -10.698 1.00 0.62 N ATOM 1522 CA VAL A 101 8.336 -7.683 -10.850 1.00 0.51 C ATOM 1523 C VAL A 101 7.611 -8.480 -9.779 1.00 0.49 C ATOM 1524 O VAL A 101 7.799 -9.687 -9.636 1.00 0.64 O ATOM 1525 CB VAL A 101 7.864 -8.119 -12.258 1.00 0.60 C ATOM 1526 CG1 VAL A 101 8.345 -7.128 -13.308 1.00 1.22 C ATOM 1527 CG2 VAL A 101 8.351 -9.523 -12.598 1.00 1.20 C ATOM 0 HA VAL A 101 8.090 -6.628 -10.732 1.00 0.51 H new ATOM 0 HB VAL A 101 6.774 -8.133 -12.254 1.00 0.60 H new ATOM 0 HG11 VAL A 101 8.005 -7.448 -14.293 1.00 1.22 H new ATOM 0 HG12 VAL A 101 7.941 -6.140 -13.088 1.00 1.22 H new ATOM 0 HG13 VAL A 101 9.434 -7.085 -13.296 1.00 1.22 H new ATOM 0 HG21 VAL A 101 8.002 -9.798 -13.593 1.00 1.20 H new ATOM 0 HG22 VAL A 101 9.441 -9.545 -12.576 1.00 1.20 H new ATOM 0 HG23 VAL A 101 7.959 -10.231 -11.868 1.00 1.20 H new ATOM 1537 N PHE A 102 6.820 -7.773 -8.997 1.00 0.43 N ATOM 1538 CA PHE A 102 6.085 -8.371 -7.897 1.00 0.43 C ATOM 1539 C PHE A 102 4.617 -8.528 -8.248 1.00 0.35 C ATOM 1540 O PHE A 102 4.104 -7.838 -9.125 1.00 0.34 O ATOM 1541 CB PHE A 102 6.219 -7.490 -6.665 1.00 0.47 C ATOM 1542 CG PHE A 102 7.631 -7.364 -6.161 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.278 -8.450 -5.598 1.00 0.80 C ATOM 1544 CD2 PHE A 102 8.309 -6.160 -6.255 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.575 -8.339 -5.136 1.00 0.97 C ATOM 1546 CE2 PHE A 102 9.606 -6.042 -5.795 1.00 0.91 C ATOM 1547 CZ PHE A 102 10.239 -7.133 -5.235 1.00 0.99 C ATOM 0 H PHE A 102 6.668 -6.770 -9.104 1.00 0.43 H new ATOM 0 HA PHE A 102 6.500 -9.359 -7.698 1.00 0.43 H new ATOM 0 HB2 PHE A 102 5.835 -6.496 -6.897 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.594 -7.896 -5.870 1.00 0.47 H new ATOM 0 HD1 PHE A 102 7.763 -9.396 -5.519 1.00 0.80 H new ATOM 0 HD2 PHE A 102 7.818 -5.304 -6.693 1.00 0.76 H new ATOM 0 HE1 PHE A 102 10.069 -9.194 -4.698 1.00 0.97 H new ATOM 0 HE2 PHE A 102 10.124 -5.098 -5.873 1.00 0.91 H new ATOM 0 HZ PHE A 102 11.253 -7.043 -4.875 1.00 0.99 H new ATOM 1557 N ASP A 103 3.941 -9.422 -7.551 1.00 0.35 N ATOM 1558 CA ASP A 103 2.525 -9.651 -7.791 1.00 0.34 C ATOM 1559 C ASP A 103 1.715 -9.108 -6.630 1.00 0.33 C ATOM 1560 O ASP A 103 2.091 -9.276 -5.473 1.00 0.40 O ATOM 1561 CB ASP A 103 2.253 -11.143 -7.967 1.00 0.45 C ATOM 1562 CG ASP A 103 2.943 -11.730 -9.182 1.00 0.86 C ATOM 1563 OD1 ASP A 103 2.388 -11.627 -10.294 1.00 1.53 O ATOM 1564 OD2 ASP A 103 4.054 -12.284 -9.036 1.00 1.46 O ATOM 0 H ASP A 103 4.346 -10.001 -6.816 1.00 0.35 H new ATOM 0 HA ASP A 103 2.232 -9.134 -8.705 1.00 0.34 H new ATOM 0 HB2 ASP A 103 2.584 -11.675 -7.075 1.00 0.45 H new ATOM 0 HB3 ASP A 103 1.178 -11.303 -8.053 1.00 0.45 H new ATOM 1569 N VAL A 104 0.608 -8.447 -6.932 1.00 0.30 N ATOM 1570 CA VAL A 104 -0.203 -7.842 -5.892 1.00 0.31 C ATOM 1571 C VAL A 104 -1.689 -8.026 -6.183 1.00 0.28 C ATOM 1572 O VAL A 104 -2.178 -7.692 -7.269 1.00 0.30 O ATOM 1573 CB VAL A 104 0.180 -6.351 -5.707 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -0.746 -5.394 -6.442 1.00 0.45 C ATOM 1575 CG2 VAL A 104 0.256 -6.000 -4.231 1.00 0.63 C ATOM 0 H VAL A 104 0.255 -8.318 -7.880 1.00 0.30 H new ATOM 0 HA VAL A 104 -0.002 -8.350 -4.949 1.00 0.31 H new ATOM 0 HB VAL A 104 1.165 -6.227 -6.158 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.420 -4.368 -6.269 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -0.718 -5.609 -7.510 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.764 -5.518 -6.074 1.00 0.45 H new ATOM 0 HG21 VAL A 104 0.526 -4.950 -4.120 1.00 0.63 H new ATOM 0 HG22 VAL A 104 -0.713 -6.177 -3.765 1.00 0.63 H new ATOM 0 HG23 VAL A 104 1.010 -6.621 -3.748 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.389 -8.602 -5.210 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.798 -8.944 -5.359 1.00 0.26 C ATOM 1587 C ARG A 105 -4.677 -8.020 -4.534 1.00 0.28 C ATOM 1588 O ARG A 105 -4.355 -7.712 -3.395 1.00 0.39 O ATOM 1589 CB ARG A 105 -4.076 -10.372 -4.883 1.00 0.37 C ATOM 1590 CG ARG A 105 -3.016 -11.392 -5.249 1.00 0.64 C ATOM 1591 CD ARG A 105 -3.438 -12.784 -4.816 1.00 0.57 C ATOM 1592 NE ARG A 105 -2.377 -13.776 -4.982 1.00 1.11 N ATOM 1593 CZ ARG A 105 -2.254 -14.866 -4.223 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -3.081 -15.072 -3.201 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -1.296 -15.747 -4.488 1.00 1.95 N ATOM 0 H ARG A 105 -1.997 -8.844 -4.300 1.00 0.28 H new ATOM 0 HA ARG A 105 -4.027 -8.844 -6.420 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -4.188 -10.361 -3.799 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -5.030 -10.697 -5.299 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.846 -11.377 -6.326 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -2.071 -11.129 -4.773 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -3.743 -12.757 -3.770 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -4.309 -13.091 -5.394 1.00 0.57 H new ATOM 0 HE ARG A 105 -1.691 -13.626 -5.721 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.815 -14.394 -2.994 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.981 -15.908 -2.625 1.00 1.37 H new ATOM 0 HH21 ARG A 105 -0.659 -15.588 -5.269 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -1.197 -16.582 -3.911 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.788 -7.606 -5.117 1.00 0.28 N ATOM 1610 CA VAL A 106 -6.832 -6.894 -4.405 1.00 0.31 C ATOM 1611 C VAL A 106 -8.079 -7.761 -4.344 1.00 0.28 C ATOM 1612 O VAL A 106 -8.785 -7.927 -5.339 1.00 0.34 O ATOM 1613 CB VAL A 106 -7.158 -5.536 -5.059 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -8.378 -4.893 -4.422 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -5.964 -4.602 -4.958 1.00 1.41 C ATOM 0 H VAL A 106 -5.992 -7.756 -6.105 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.473 -6.686 -3.397 1.00 0.31 H new ATOM 0 HB VAL A 106 -7.382 -5.718 -6.110 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -8.580 -3.938 -4.906 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -9.240 -5.550 -4.541 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -8.191 -4.729 -3.361 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -6.208 -3.647 -5.424 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -5.716 -4.441 -3.909 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -5.110 -5.047 -5.469 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.300 -8.352 -3.176 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.394 -9.289 -2.948 1.00 0.28 C ATOM 1627 C ASN A 107 -9.180 -10.521 -3.819 1.00 0.29 C ATOM 1628 O ASN A 107 -10.116 -11.070 -4.395 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.748 -8.630 -3.243 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.897 -9.217 -2.434 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.810 -8.497 -2.040 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -11.884 -10.521 -2.204 1.00 1.65 N ATOM 0 H ASN A 107 -7.720 -8.193 -2.353 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.403 -9.589 -1.900 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.676 -7.562 -3.036 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -10.971 -8.735 -4.305 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -12.648 -10.955 -1.686 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -11.110 -11.091 -2.545 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.919 -10.934 -3.920 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.564 -12.066 -4.757 1.00 0.35 C ATOM 1641 C GLY A 108 -7.161 -11.647 -6.157 1.00 0.32 C ATOM 1642 O GLY A 108 -6.442 -12.365 -6.846 1.00 0.42 O ATOM 0 H GLY A 108 -7.133 -10.502 -3.434 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.743 -12.613 -4.294 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.410 -12.751 -4.815 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.609 -10.467 -6.560 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.423 -9.981 -7.920 1.00 0.27 C ATOM 1648 C HIS A 109 -6.056 -9.332 -8.109 1.00 0.23 C ATOM 1649 O HIS A 109 -5.876 -8.189 -7.721 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.506 -8.944 -8.211 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.882 -9.521 -8.338 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.432 -9.895 -9.536 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.820 -9.787 -7.398 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.645 -10.363 -9.335 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.909 -10.315 -8.042 1.00 0.65 N ATOM 0 H HIS A 109 -8.112 -9.819 -5.954 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.489 -10.829 -8.602 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.507 -8.201 -7.414 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -8.256 -8.421 -9.134 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -9.972 -9.822 -10.443 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -10.727 -9.615 -6.336 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -12.314 -10.726 -10.101 1.00 0.68 H new ATOM 1664 N THR A 110 -5.098 -10.039 -8.708 1.00 0.27 N ATOM 1665 CA THR A 110 -3.781 -9.449 -8.949 1.00 0.30 C ATOM 1666 C THR A 110 -3.875 -8.254 -9.891 1.00 0.30 C ATOM 1667 O THR A 110 -3.838 -8.398 -11.115 1.00 0.48 O ATOM 1668 CB THR A 110 -2.749 -10.452 -9.509 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.346 -11.318 -10.482 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.125 -11.275 -8.402 1.00 0.61 C ATOM 0 H THR A 110 -5.204 -11.001 -9.030 1.00 0.27 H new ATOM 0 HA THR A 110 -3.429 -9.126 -7.969 1.00 0.30 H new ATOM 0 HB THR A 110 -1.964 -9.871 -9.993 1.00 0.40 H new ATOM 0 HG1 THR A 110 -3.814 -10.781 -11.155 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.403 -11.971 -8.829 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.619 -10.614 -7.698 1.00 0.61 H new ATOM 0 HG23 THR A 110 -2.903 -11.833 -7.881 1.00 0.61 H new ATOM 1678 N VAL A 111 -4.001 -7.073 -9.305 1.00 0.26 N ATOM 1679 CA VAL A 111 -4.084 -5.845 -10.065 1.00 0.29 C ATOM 1680 C VAL A 111 -2.728 -5.507 -10.638 1.00 0.29 C ATOM 1681 O VAL A 111 -2.600 -5.211 -11.827 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.565 -4.669 -9.198 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -4.919 -3.470 -10.066 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.744 -5.087 -8.340 1.00 0.94 C ATOM 0 H VAL A 111 -4.048 -6.944 -8.294 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.808 -6.002 -10.865 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.752 -4.375 -8.535 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -5.257 -2.650 -9.433 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -4.040 -3.156 -10.629 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -5.714 -3.745 -10.759 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -6.070 -4.242 -7.734 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -6.564 -5.412 -8.981 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.446 -5.908 -7.688 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.701 -5.574 -9.799 1.00 0.27 N ATOM 1695 CA VAL A 112 -0.367 -5.265 -10.259 1.00 0.28 C ATOM 1696 C VAL A 112 0.503 -6.491 -10.122 1.00 0.28 C ATOM 1697 O VAL A 112 1.122 -6.722 -9.089 1.00 0.27 O ATOM 1698 CB VAL A 112 0.271 -4.085 -9.492 1.00 0.29 C ATOM 1699 CG1 VAL A 112 1.534 -3.620 -10.198 1.00 0.35 C ATOM 1700 CG2 VAL A 112 -0.715 -2.939 -9.348 1.00 0.33 C ATOM 0 H VAL A 112 -1.770 -5.835 -8.815 1.00 0.27 H new ATOM 0 HA VAL A 112 -0.443 -4.962 -11.303 1.00 0.28 H new ATOM 0 HB VAL A 112 0.538 -4.428 -8.492 1.00 0.29 H new ATOM 0 HG11 VAL A 112 1.973 -2.788 -9.647 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.248 -4.442 -10.245 1.00 0.35 H new ATOM 0 HG13 VAL A 112 1.287 -3.296 -11.209 1.00 0.35 H new ATOM 0 HG21 VAL A 112 -0.244 -2.120 -8.805 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -1.017 -2.593 -10.336 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -1.593 -3.281 -8.799 1.00 0.33 H new ATOM 1710 N LYS A 113 0.530 -7.283 -11.171 1.00 0.33 N ATOM 1711 CA LYS A 113 1.346 -8.474 -11.194 1.00 0.37 C ATOM 1712 C LYS A 113 2.490 -8.270 -12.177 1.00 0.41 C ATOM 1713 O LYS A 113 2.564 -8.904 -13.230 1.00 0.68 O ATOM 1714 CB LYS A 113 0.477 -9.684 -11.572 1.00 0.44 C ATOM 1715 CG LYS A 113 -0.725 -9.341 -12.458 1.00 1.24 C ATOM 1716 CD LYS A 113 -0.303 -8.718 -13.781 1.00 2.09 C ATOM 1717 CE LYS A 113 -1.328 -7.723 -14.283 1.00 3.07 C ATOM 1718 NZ LYS A 113 -0.757 -6.825 -15.322 1.00 4.01 N ATOM 0 H LYS A 113 -0.007 -7.121 -12.023 1.00 0.33 H new ATOM 0 HA LYS A 113 1.772 -8.667 -10.209 1.00 0.37 H new ATOM 0 HB2 LYS A 113 1.098 -10.416 -12.089 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.118 -10.159 -10.659 1.00 0.44 H new ATOM 0 HG2 LYS A 113 -1.302 -10.245 -12.652 1.00 1.24 H new ATOM 0 HG3 LYS A 113 -1.381 -8.652 -11.927 1.00 1.24 H new ATOM 0 HD2 LYS A 113 0.659 -8.220 -13.658 1.00 2.09 H new ATOM 0 HD3 LYS A 113 -0.163 -9.503 -14.525 1.00 2.09 H new ATOM 0 HE2 LYS A 113 -2.184 -8.258 -14.694 1.00 3.07 H new ATOM 0 HE3 LYS A 113 -1.696 -7.127 -13.448 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 -1.496 -6.179 -15.667 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 0.023 -6.272 -14.912 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 -0.398 -7.395 -16.114 1.00 4.01 H new ATOM 1732 N ASP A 114 3.409 -7.421 -11.753 1.00 0.39 N ATOM 1733 CA ASP A 114 4.485 -6.896 -12.589 1.00 0.45 C ATOM 1734 C ASP A 114 5.087 -5.682 -11.899 1.00 0.38 C ATOM 1735 O ASP A 114 5.684 -4.819 -12.541 1.00 0.45 O ATOM 1736 CB ASP A 114 3.987 -6.490 -13.995 1.00 0.63 C ATOM 1737 CG ASP A 114 2.744 -5.603 -13.988 1.00 1.33 C ATOM 1738 OD1 ASP A 114 2.844 -4.444 -13.527 1.00 1.96 O ATOM 1739 OD2 ASP A 114 1.660 -6.053 -14.417 1.00 1.52 O ATOM 0 H ASP A 114 3.432 -7.067 -10.797 1.00 0.39 H new ATOM 0 HA ASP A 114 5.228 -7.682 -12.720 1.00 0.45 H new ATOM 0 HB2 ASP A 114 4.790 -5.967 -14.515 1.00 0.63 H new ATOM 0 HB3 ASP A 114 3.772 -7.393 -14.566 1.00 0.63 H new ATOM 1744 N LEU A 115 4.942 -5.646 -10.576 1.00 0.33 N ATOM 1745 CA LEU A 115 5.283 -4.475 -9.786 1.00 0.34 C ATOM 1746 C LEU A 115 6.792 -4.271 -9.709 1.00 0.37 C ATOM 1747 O LEU A 115 7.451 -4.819 -8.833 1.00 0.47 O ATOM 1748 CB LEU A 115 4.688 -4.596 -8.380 1.00 0.38 C ATOM 1749 CG LEU A 115 3.962 -3.348 -7.880 1.00 0.45 C ATOM 1750 CD1 LEU A 115 3.375 -3.607 -6.512 1.00 1.18 C ATOM 1751 CD2 LEU A 115 4.894 -2.143 -7.849 1.00 1.07 C ATOM 0 H LEU A 115 4.585 -6.428 -10.027 1.00 0.33 H new ATOM 0 HA LEU A 115 4.857 -3.602 -10.280 1.00 0.34 H new ATOM 0 HB2 LEU A 115 3.991 -5.434 -8.367 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.489 -4.837 -7.681 1.00 0.38 H new ATOM 0 HG LEU A 115 3.153 -3.119 -8.574 1.00 0.45 H new ATOM 0 HD11 LEU A 115 2.859 -2.713 -6.162 1.00 1.18 H new ATOM 0 HD12 LEU A 115 2.668 -4.435 -6.570 1.00 1.18 H new ATOM 0 HD13 LEU A 115 4.174 -3.861 -5.815 1.00 1.18 H new ATOM 0 HD21 LEU A 115 4.349 -1.270 -7.489 1.00 1.07 H new ATOM 0 HD22 LEU A 115 5.732 -2.348 -7.182 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.269 -1.947 -8.853 1.00 1.07 H new ATOM 1763 N ASP A 116 7.326 -3.505 -10.649 1.00 0.39 N ATOM 1764 CA ASP A 116 8.732 -3.128 -10.636 1.00 0.44 C ATOM 1765 C ASP A 116 8.880 -1.674 -10.199 1.00 0.43 C ATOM 1766 O ASP A 116 8.804 -0.743 -11.007 1.00 0.48 O ATOM 1767 CB ASP A 116 9.398 -3.379 -11.999 1.00 0.53 C ATOM 1768 CG ASP A 116 8.610 -2.876 -13.200 1.00 1.28 C ATOM 1769 OD1 ASP A 116 7.510 -2.307 -13.030 1.00 1.93 O ATOM 1770 OD2 ASP A 116 9.088 -3.073 -14.334 1.00 1.83 O ATOM 0 H ASP A 116 6.800 -3.129 -11.438 1.00 0.39 H new ATOM 0 HA ASP A 116 9.249 -3.759 -9.913 1.00 0.44 H new ATOM 0 HB2 ASP A 116 10.379 -2.903 -12.001 1.00 0.53 H new ATOM 0 HB3 ASP A 116 9.564 -4.450 -12.114 1.00 0.53 H new ATOM 1775 N ILE A 117 9.113 -1.496 -8.908 1.00 0.44 N ATOM 1776 CA ILE A 117 9.090 -0.182 -8.284 1.00 0.46 C ATOM 1777 C ILE A 117 10.153 0.741 -8.875 1.00 0.48 C ATOM 1778 O ILE A 117 9.910 1.940 -9.063 1.00 0.51 O ATOM 1779 CB ILE A 117 9.271 -0.313 -6.756 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.126 -1.155 -6.178 1.00 0.56 C ATOM 1781 CG2 ILE A 117 9.326 1.053 -6.090 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.264 -1.462 -4.702 1.00 0.82 C ATOM 0 H ILE A 117 9.323 -2.258 -8.263 1.00 0.44 H new ATOM 0 HA ILE A 117 8.118 0.268 -8.487 1.00 0.46 H new ATOM 0 HB ILE A 117 10.220 -0.811 -6.556 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.185 -0.629 -6.342 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.067 -2.094 -6.729 1.00 0.56 H new ATOM 0 HG21 ILE A 117 9.454 0.929 -5.015 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.165 1.620 -6.492 1.00 0.58 H new ATOM 0 HG23 ILE A 117 8.398 1.591 -6.285 1.00 0.58 H new ATOM 0 HD11 ILE A 117 7.414 -2.060 -4.374 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.186 -2.017 -4.530 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.291 -0.530 -4.137 1.00 0.82 H new ATOM 1794 N PHE A 118 11.313 0.176 -9.194 1.00 0.54 N ATOM 1795 CA PHE A 118 12.398 0.938 -9.810 1.00 0.62 C ATOM 1796 C PHE A 118 11.949 1.548 -11.142 1.00 0.65 C ATOM 1797 O PHE A 118 12.302 2.679 -11.468 1.00 0.74 O ATOM 1798 CB PHE A 118 13.623 0.042 -10.034 1.00 0.70 C ATOM 1799 CG PHE A 118 14.805 0.770 -10.612 1.00 0.81 C ATOM 1800 CD1 PHE A 118 15.691 1.447 -9.790 1.00 0.89 C ATOM 1801 CD2 PHE A 118 15.033 0.769 -11.976 1.00 0.92 C ATOM 1802 CE1 PHE A 118 16.782 2.105 -10.318 1.00 1.02 C ATOM 1803 CE2 PHE A 118 16.122 1.427 -12.511 1.00 1.06 C ATOM 1804 CZ PHE A 118 16.973 2.135 -11.678 1.00 1.08 C ATOM 0 H PHE A 118 11.528 -0.809 -9.036 1.00 0.54 H new ATOM 0 HA PHE A 118 12.669 1.747 -9.131 1.00 0.62 H new ATOM 0 HB2 PHE A 118 13.913 -0.407 -9.084 1.00 0.70 H new ATOM 0 HB3 PHE A 118 13.348 -0.775 -10.702 1.00 0.70 H new ATOM 0 HD1 PHE A 118 15.525 1.460 -8.723 1.00 0.89 H new ATOM 0 HD2 PHE A 118 14.351 0.247 -12.631 1.00 0.92 H new ATOM 0 HE1 PHE A 118 17.486 2.596 -9.663 1.00 1.02 H new ATOM 0 HE2 PHE A 118 16.310 1.390 -13.574 1.00 1.06 H new ATOM 0 HZ PHE A 118 17.786 2.710 -12.097 1.00 1.08 H new ATOM 1814 N ASP A 119 11.160 0.795 -11.899 1.00 0.61 N ATOM 1815 CA ASP A 119 10.690 1.247 -13.209 1.00 0.68 C ATOM 1816 C ASP A 119 9.651 2.353 -13.064 1.00 0.69 C ATOM 1817 O ASP A 119 9.570 3.257 -13.894 1.00 0.81 O ATOM 1818 CB ASP A 119 10.087 0.072 -13.988 1.00 0.68 C ATOM 1819 CG ASP A 119 9.604 0.452 -15.377 1.00 0.82 C ATOM 1820 OD1 ASP A 119 10.412 0.387 -16.330 1.00 0.96 O ATOM 1821 OD2 ASP A 119 8.413 0.791 -15.531 1.00 0.89 O ATOM 0 H ASP A 119 10.830 -0.132 -11.631 1.00 0.61 H new ATOM 0 HA ASP A 119 11.545 1.644 -13.756 1.00 0.68 H new ATOM 0 HB2 ASP A 119 10.833 -0.718 -14.075 1.00 0.68 H new ATOM 0 HB3 ASP A 119 9.252 -0.339 -13.421 1.00 0.68 H new ATOM 1826 N ARG A 120 8.879 2.285 -11.988 1.00 0.61 N ATOM 1827 CA ARG A 120 7.742 3.177 -11.804 1.00 0.66 C ATOM 1828 C ARG A 120 8.183 4.577 -11.383 1.00 0.75 C ATOM 1829 O ARG A 120 7.736 5.573 -11.950 1.00 0.97 O ATOM 1830 CB ARG A 120 6.793 2.603 -10.757 1.00 0.63 C ATOM 1831 CG ARG A 120 6.420 1.151 -11.003 1.00 0.59 C ATOM 1832 CD ARG A 120 5.754 0.953 -12.353 1.00 0.72 C ATOM 1833 NE ARG A 120 5.610 -0.461 -12.676 1.00 1.02 N ATOM 1834 CZ ARG A 120 4.447 -1.100 -12.743 1.00 1.31 C ATOM 1835 NH1 ARG A 120 3.311 -0.456 -12.496 1.00 1.69 N ATOM 1836 NH2 ARG A 120 4.430 -2.388 -13.047 1.00 1.65 N ATOM 0 H ARG A 120 9.020 1.620 -11.228 1.00 0.61 H new ATOM 0 HA ARG A 120 7.229 3.259 -12.762 1.00 0.66 H new ATOM 0 HB2 ARG A 120 7.256 2.689 -9.774 1.00 0.63 H new ATOM 0 HB3 ARG A 120 5.884 3.204 -10.735 1.00 0.63 H new ATOM 0 HG2 ARG A 120 7.316 0.533 -10.947 1.00 0.59 H new ATOM 0 HG3 ARG A 120 5.748 0.811 -10.215 1.00 0.59 H new ATOM 0 HD2 ARG A 120 4.773 1.428 -12.349 1.00 0.72 H new ATOM 0 HD3 ARG A 120 6.343 1.446 -13.126 1.00 0.72 H new ATOM 0 HE ARG A 120 6.458 -0.995 -12.863 1.00 1.02 H new ATOM 0 HH11 ARG A 120 3.329 0.535 -12.253 1.00 1.69 H new ATOM 0 HH12 ARG A 120 2.421 -0.952 -12.549 1.00 1.69 H new ATOM 0 HH21 ARG A 120 5.305 -2.881 -13.227 1.00 1.65 H new ATOM 0 HH22 ARG A 120 3.542 -2.888 -13.101 1.00 1.65 H new ATOM 1850 N VAL A 121 9.045 4.652 -10.374 1.00 0.65 N ATOM 1851 CA VAL A 121 9.466 5.948 -9.831 1.00 0.75 C ATOM 1852 C VAL A 121 10.906 6.292 -10.214 1.00 0.80 C ATOM 1853 O VAL A 121 11.233 7.455 -10.466 1.00 0.95 O ATOM 1854 CB VAL A 121 9.322 5.983 -8.293 1.00 0.79 C ATOM 1855 CG1 VAL A 121 9.752 7.328 -7.726 1.00 1.42 C ATOM 1856 CG2 VAL A 121 7.890 5.677 -7.899 1.00 1.49 C ATOM 0 H VAL A 121 9.465 3.843 -9.917 1.00 0.65 H new ATOM 0 HA VAL A 121 8.806 6.695 -10.271 1.00 0.75 H new ATOM 0 HB VAL A 121 9.979 5.221 -7.874 1.00 0.79 H new ATOM 0 HG11 VAL A 121 9.638 7.319 -6.642 1.00 1.42 H new ATOM 0 HG12 VAL A 121 10.796 7.513 -7.980 1.00 1.42 H new ATOM 0 HG13 VAL A 121 9.130 8.117 -8.149 1.00 1.42 H new ATOM 0 HG21 VAL A 121 7.798 5.704 -6.813 1.00 1.49 H new ATOM 0 HG22 VAL A 121 7.225 6.421 -8.338 1.00 1.49 H new ATOM 0 HG23 VAL A 121 7.617 4.686 -8.262 1.00 1.49 H new ATOM 1866 N GLY A 122 11.763 5.288 -10.265 1.00 0.76 N ATOM 1867 CA GLY A 122 13.161 5.533 -10.536 1.00 0.89 C ATOM 1868 C GLY A 122 14.043 5.080 -9.396 1.00 1.00 C ATOM 1869 O GLY A 122 14.147 3.888 -9.128 1.00 1.40 O ATOM 0 H GLY A 122 11.516 4.308 -10.124 1.00 0.76 H new ATOM 0 HA2 GLY A 122 13.451 5.012 -11.449 1.00 0.89 H new ATOM 0 HA3 GLY A 122 13.315 6.597 -10.714 1.00 0.89 H new ATOM 1873 N HIS A 123 14.658 6.026 -8.703 1.00 1.10 N ATOM 1874 CA HIS A 123 15.584 5.686 -7.632 1.00 1.36 C ATOM 1875 C HIS A 123 15.024 6.090 -6.268 1.00 1.08 C ATOM 1876 O HIS A 123 14.876 7.277 -5.969 1.00 1.41 O ATOM 1877 CB HIS A 123 16.947 6.345 -7.871 1.00 2.01 C ATOM 1878 CG HIS A 123 18.056 5.734 -7.065 1.00 2.61 C ATOM 1879 ND1 HIS A 123 18.890 6.460 -6.247 1.00 3.35 N ATOM 1880 CD2 HIS A 123 18.474 4.447 -6.975 1.00 3.26 C ATOM 1881 CE1 HIS A 123 19.771 5.650 -5.687 1.00 4.11 C ATOM 1882 NE2 HIS A 123 19.539 4.422 -6.112 1.00 4.08 N ATOM 0 H HIS A 123 14.535 7.026 -8.860 1.00 1.10 H new ATOM 0 HA HIS A 123 15.716 4.604 -7.633 1.00 1.36 H new ATOM 0 HB2 HIS A 123 17.196 6.273 -8.930 1.00 2.01 H new ATOM 0 HB3 HIS A 123 16.876 7.406 -7.631 1.00 2.01 H new ATOM 0 HD2 HIS A 123 18.047 3.598 -7.488 1.00 3.26 H new ATOM 0 HE1 HIS A 123 20.549 5.943 -4.998 1.00 4.11 H new ATOM 0 HE2 HIS A 123 20.066 3.591 -5.843 1.00 4.08 H new ATOM 1891 N SER A 124 14.717 5.072 -5.460 1.00 1.19 N ATOM 1892 CA SER A 124 14.199 5.224 -4.094 1.00 1.00 C ATOM 1893 C SER A 124 12.969 6.131 -4.038 1.00 1.02 C ATOM 1894 O SER A 124 12.180 6.166 -4.981 1.00 1.97 O ATOM 1895 CB SER A 124 15.297 5.715 -3.129 1.00 1.06 C ATOM 1896 OG SER A 124 15.944 6.883 -3.600 1.00 1.72 O ATOM 0 H SER A 124 14.823 4.097 -5.741 1.00 1.19 H new ATOM 0 HA SER A 124 13.880 4.235 -3.766 1.00 1.00 H new ATOM 0 HB2 SER A 124 14.856 5.915 -2.152 1.00 1.06 H new ATOM 0 HB3 SER A 124 16.035 4.925 -2.990 1.00 1.06 H new ATOM 0 HG SER A 124 15.400 7.297 -4.302 1.00 1.72 H new ATOM 1902 N THR A 125 12.808 6.820 -2.902 1.00 0.66 N ATOM 1903 CA THR A 125 11.680 7.712 -2.640 1.00 0.53 C ATOM 1904 C THR A 125 10.366 6.930 -2.585 1.00 0.48 C ATOM 1905 O THR A 125 10.367 5.717 -2.362 1.00 0.60 O ATOM 1906 CB THR A 125 11.579 8.900 -3.640 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.179 8.472 -4.943 1.00 0.81 O ATOM 1908 CG2 THR A 125 12.908 9.638 -3.736 1.00 0.85 C ATOM 0 H THR A 125 13.471 6.770 -2.128 1.00 0.66 H new ATOM 0 HA THR A 125 11.869 8.157 -1.663 1.00 0.53 H new ATOM 0 HB THR A 125 10.814 9.573 -3.253 1.00 0.60 H new ATOM 0 HG1 THR A 125 11.247 7.496 -5.002 1.00 0.81 H new ATOM 0 HG21 THR A 125 12.815 10.465 -4.440 1.00 0.85 H new ATOM 0 HG22 THR A 125 13.180 10.026 -2.755 1.00 0.85 H new ATOM 0 HG23 THR A 125 13.681 8.952 -4.082 1.00 0.85 H new ATOM 1916 N ALA A 126 9.253 7.620 -2.754 1.00 0.44 N ATOM 1917 CA ALA A 126 7.950 6.991 -2.593 1.00 0.45 C ATOM 1918 C ALA A 126 7.372 6.504 -3.914 1.00 0.40 C ATOM 1919 O ALA A 126 7.200 7.283 -4.849 1.00 0.50 O ATOM 1920 CB ALA A 126 6.977 7.958 -1.939 1.00 0.57 C ATOM 0 H ALA A 126 9.222 8.609 -3.001 1.00 0.44 H new ATOM 0 HA ALA A 126 8.096 6.120 -1.955 1.00 0.45 H new ATOM 0 HB1 ALA A 126 6.006 7.476 -1.824 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.356 8.248 -0.959 1.00 0.57 H new ATOM 0 HB3 ALA A 126 6.870 8.845 -2.564 1.00 0.57 H new ATOM 1926 N HIS A 127 7.078 5.208 -3.991 1.00 0.33 N ATOM 1927 CA HIS A 127 6.288 4.688 -5.095 1.00 0.32 C ATOM 1928 C HIS A 127 4.823 4.678 -4.707 1.00 0.34 C ATOM 1929 O HIS A 127 4.450 4.173 -3.651 1.00 0.55 O ATOM 1930 CB HIS A 127 6.721 3.279 -5.521 1.00 0.34 C ATOM 1931 CG HIS A 127 5.824 2.684 -6.580 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.347 3.410 -7.652 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.277 1.448 -6.698 1.00 0.48 C ATOM 1934 CE1 HIS A 127 4.544 2.653 -8.373 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.484 1.460 -7.821 1.00 0.51 N ATOM 0 H HIS A 127 7.373 4.509 -3.309 1.00 0.33 H new ATOM 0 HA HIS A 127 6.451 5.345 -5.949 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.743 3.317 -5.897 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.726 2.626 -4.648 1.00 0.34 H new ATOM 0 HD2 HIS A 127 5.435 0.611 -6.034 1.00 0.48 H new ATOM 0 HE1 HIS A 127 4.022 2.961 -9.267 1.00 0.50 H new ATOM 0 HE2 HIS A 127 3.938 0.672 -8.170 1.00 0.51 H new ATOM 1944 N ASP A 128 4.013 5.215 -5.581 1.00 0.38 N ATOM 1945 CA ASP A 128 2.587 5.319 -5.366 1.00 0.47 C ATOM 1946 C ASP A 128 1.855 4.501 -6.411 1.00 0.46 C ATOM 1947 O ASP A 128 2.057 4.689 -7.614 1.00 0.61 O ATOM 1948 CB ASP A 128 2.167 6.789 -5.430 1.00 0.66 C ATOM 1949 CG ASP A 128 0.730 6.981 -5.880 1.00 0.99 C ATOM 1950 OD1 ASP A 128 -0.184 6.786 -5.047 1.00 1.64 O ATOM 1951 OD2 ASP A 128 0.518 7.320 -7.058 1.00 1.36 O ATOM 0 H ASP A 128 4.325 5.598 -6.473 1.00 0.38 H new ATOM 0 HA ASP A 128 2.331 4.928 -4.381 1.00 0.47 H new ATOM 0 HB2 ASP A 128 2.296 7.240 -4.446 1.00 0.66 H new ATOM 0 HB3 ASP A 128 2.829 7.320 -6.114 1.00 0.66 H new ATOM 1956 N GLU A 129 1.065 3.552 -5.950 1.00 0.40 N ATOM 1957 CA GLU A 129 0.245 2.752 -6.836 1.00 0.41 C ATOM 1958 C GLU A 129 -1.205 2.873 -6.389 1.00 0.33 C ATOM 1959 O GLU A 129 -1.592 2.353 -5.338 1.00 0.39 O ATOM 1960 CB GLU A 129 0.700 1.291 -6.799 1.00 0.53 C ATOM 1961 CG GLU A 129 0.307 0.477 -8.020 1.00 0.97 C ATOM 1962 CD GLU A 129 1.283 0.652 -9.165 1.00 0.72 C ATOM 1963 OE1 GLU A 129 2.475 0.321 -8.999 1.00 0.75 O ATOM 1964 OE2 GLU A 129 0.861 1.138 -10.236 1.00 1.12 O ATOM 0 H GLU A 129 0.974 3.316 -4.962 1.00 0.40 H new ATOM 0 HA GLU A 129 0.343 3.108 -7.862 1.00 0.41 H new ATOM 0 HB2 GLU A 129 1.785 1.264 -6.694 1.00 0.53 H new ATOM 0 HB3 GLU A 129 0.282 0.816 -5.912 1.00 0.53 H new ATOM 0 HG2 GLU A 129 0.253 -0.577 -7.749 1.00 0.97 H new ATOM 0 HG3 GLU A 129 -0.690 0.774 -8.346 1.00 0.97 H new ATOM 1971 N ILE A 130 -1.993 3.582 -7.175 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.385 3.824 -6.846 1.00 0.24 C ATOM 1973 C ILE A 130 -4.271 2.779 -7.511 1.00 0.25 C ATOM 1974 O ILE A 130 -4.310 2.676 -8.740 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.814 5.235 -7.306 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.956 6.294 -6.611 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.290 5.470 -7.025 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -3.224 7.706 -7.086 1.00 0.74 C ATOM 0 H ILE A 130 -1.690 4.004 -8.053 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.498 3.756 -5.764 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.662 5.312 -8.383 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -3.132 6.243 -5.537 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.904 6.060 -6.773 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.569 6.470 -7.357 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.885 4.730 -7.561 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.476 5.378 -5.955 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -2.578 8.400 -6.548 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -3.020 7.775 -8.155 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -4.267 7.961 -6.898 1.00 0.74 H new ATOM 1990 N ILE A 131 -4.975 2.002 -6.705 1.00 0.24 N ATOM 1991 CA ILE A 131 -5.813 0.930 -7.220 1.00 0.28 C ATOM 1992 C ILE A 131 -7.277 1.169 -6.869 1.00 0.25 C ATOM 1993 O ILE A 131 -7.726 0.825 -5.774 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.373 -0.442 -6.664 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -3.902 -0.701 -6.997 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.252 -1.552 -7.229 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.352 -1.980 -6.400 1.00 1.25 C ATOM 0 H ILE A 131 -4.983 2.093 -5.689 1.00 0.24 H new ATOM 0 HA ILE A 131 -5.699 0.924 -8.304 1.00 0.28 H new ATOM 0 HB ILE A 131 -5.487 -0.432 -5.580 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -3.786 -0.738 -8.080 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.306 0.140 -6.642 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -5.929 -2.512 -6.827 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.290 -1.372 -6.949 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.167 -1.566 -8.316 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.305 -2.092 -6.681 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -3.434 -1.939 -5.314 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -3.921 -2.831 -6.775 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.036 1.802 -7.776 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.470 2.009 -7.603 1.00 0.23 C ATOM 2011 C PRO A 132 -10.301 0.800 -8.041 1.00 0.23 C ATOM 2012 O PRO A 132 -10.201 0.326 -9.178 1.00 0.25 O ATOM 2013 CB PRO A 132 -9.774 3.220 -8.504 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.460 3.636 -9.090 1.00 0.29 C ATOM 2015 CD PRO A 132 -7.570 2.425 -9.013 1.00 0.28 C ATOM 0 HA PRO A 132 -9.727 2.163 -6.555 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.485 2.956 -9.287 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.220 4.032 -7.930 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -8.580 3.967 -10.122 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.032 4.471 -8.535 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -7.694 1.769 -9.875 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.515 2.693 -8.965 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.116 0.314 -7.120 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.075 -0.747 -7.389 1.00 0.21 C ATOM 2025 C ILE A 133 -13.470 -0.128 -7.351 1.00 0.19 C ATOM 2026 O ILE A 133 -13.632 0.997 -6.880 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.008 -1.870 -6.322 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -12.808 -1.484 -5.080 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.569 -2.156 -5.929 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.725 -2.499 -3.961 1.00 0.27 C ATOM 0 H ILE A 133 -11.132 0.647 -6.156 1.00 0.21 H new ATOM 0 HA ILE A 133 -11.847 -1.190 -8.358 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.442 -2.769 -6.760 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.450 -0.522 -4.713 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -13.853 -1.350 -5.359 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.547 -2.947 -5.179 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -10.008 -2.473 -6.808 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.118 -1.253 -5.517 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.318 -2.155 -3.113 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -13.111 -3.457 -4.309 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.686 -2.617 -3.653 1.00 0.27 H new ATOM 2042 N SER A 134 -14.462 -0.838 -7.834 1.00 0.19 N ATOM 2043 CA SER A 134 -15.826 -0.360 -7.772 1.00 0.21 C ATOM 2044 C SER A 134 -16.735 -1.456 -7.237 1.00 0.22 C ATOM 2045 O SER A 134 -17.018 -2.434 -7.929 1.00 0.25 O ATOM 2046 CB SER A 134 -16.284 0.088 -9.162 1.00 0.26 C ATOM 2047 OG SER A 134 -17.545 0.733 -9.111 1.00 1.24 O ATOM 0 H SER A 134 -14.351 -1.751 -8.275 1.00 0.19 H new ATOM 0 HA SER A 134 -15.878 0.494 -7.097 1.00 0.21 H new ATOM 0 HB2 SER A 134 -15.545 0.766 -9.589 1.00 0.26 H new ATOM 0 HB3 SER A 134 -16.343 -0.777 -9.823 1.00 0.26 H new ATOM 0 HG SER A 134 -17.808 1.008 -10.014 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.176 -1.305 -6.001 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.089 -2.266 -5.412 1.00 0.25 C ATOM 2055 C ILE A 135 -19.504 -1.729 -5.496 1.00 0.29 C ATOM 2056 O ILE A 135 -19.777 -0.628 -5.024 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.758 -2.573 -3.935 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.331 -3.095 -3.809 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.743 -3.583 -3.365 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -15.944 -3.487 -2.398 1.00 0.32 C ATOM 0 H ILE A 135 -16.918 -0.531 -5.389 1.00 0.23 H new ATOM 0 HA ILE A 135 -17.987 -3.195 -5.974 1.00 0.25 H new ATOM 0 HB ILE A 135 -17.843 -1.649 -3.364 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.212 -3.960 -4.462 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.642 -2.329 -4.165 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.494 -3.787 -2.324 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.754 -3.179 -3.424 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.688 -4.508 -3.939 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -14.916 -3.848 -2.390 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.029 -2.620 -1.743 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.608 -4.275 -2.044 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.384 -2.491 -6.125 1.00 0.31 N ATOM 2073 CA LYS A 136 -21.787 -2.126 -6.244 1.00 0.37 C ATOM 2074 C LYS A 136 -22.619 -3.394 -6.325 1.00 0.40 C ATOM 2075 O LYS A 136 -22.227 -4.347 -7.000 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.030 -1.257 -7.489 1.00 0.46 C ATOM 2077 CG LYS A 136 -21.367 0.112 -7.425 1.00 0.66 C ATOM 2078 CD LYS A 136 -21.537 0.886 -8.719 1.00 1.28 C ATOM 2079 CE LYS A 136 -20.741 2.182 -8.702 1.00 1.51 C ATOM 2080 NZ LYS A 136 -21.209 3.125 -7.649 1.00 1.95 N ATOM 0 H LYS A 136 -20.147 -3.379 -6.567 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.077 -1.543 -5.370 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.662 -1.787 -8.367 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.103 -1.124 -7.623 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -21.795 0.684 -6.601 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -20.305 -0.009 -7.212 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -21.213 0.270 -9.558 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -22.593 1.108 -8.875 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -19.687 1.955 -8.540 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -20.817 2.664 -9.677 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -20.681 4.018 -7.723 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -22.224 3.312 -7.777 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -21.049 2.705 -6.711 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.735 -3.419 -5.601 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.630 -4.578 -5.579 1.00 0.54 C ATOM 2096 C LYS A 137 -23.948 -5.769 -4.910 1.00 0.48 C ATOM 2097 O LYS A 137 -24.378 -6.912 -5.053 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.084 -4.939 -6.997 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.062 -3.948 -7.592 1.00 0.81 C ATOM 2100 CD LYS A 137 -26.251 -4.177 -9.083 1.00 1.53 C ATOM 2101 CE LYS A 137 -25.100 -3.595 -9.888 1.00 2.40 C ATOM 2102 NZ LYS A 137 -25.053 -2.111 -9.784 1.00 3.13 N ATOM 0 H LYS A 137 -24.045 -2.643 -5.016 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.513 -4.318 -4.996 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.209 -5.006 -7.644 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -25.545 -5.927 -6.981 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -27.023 -4.035 -7.085 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -25.702 -2.933 -7.422 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -26.330 -5.246 -9.281 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -27.188 -3.723 -9.406 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -24.159 -4.015 -9.534 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -25.204 -3.884 -10.934 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -25.139 -1.694 -10.733 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -25.838 -1.780 -9.188 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -24.149 -1.821 -9.359 1.00 3.13 H new ATOM 2116 N GLY A 138 -22.891 -5.484 -4.163 1.00 0.41 N ATOM 2117 CA GLY A 138 -22.149 -6.528 -3.487 1.00 0.40 C ATOM 2118 C GLY A 138 -21.117 -7.178 -4.387 1.00 0.37 C ATOM 2119 O GLY A 138 -20.566 -8.224 -4.050 1.00 0.39 O ATOM 0 H GLY A 138 -22.532 -4.541 -4.013 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.652 -6.109 -2.612 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.842 -7.288 -3.126 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.856 -6.573 -5.537 1.00 0.37 N ATOM 2124 CA LYS A 139 -19.838 -7.080 -6.446 1.00 0.36 C ATOM 2125 C LYS A 139 -18.671 -6.114 -6.533 1.00 0.32 C ATOM 2126 O LYS A 139 -18.862 -4.901 -6.567 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.407 -7.317 -7.842 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.472 -8.395 -7.904 1.00 0.87 C ATOM 2129 CD LYS A 139 -21.810 -8.744 -9.342 1.00 1.14 C ATOM 2130 CE LYS A 139 -22.883 -9.814 -9.419 1.00 1.64 C ATOM 2131 NZ LYS A 139 -23.145 -10.226 -10.822 1.00 2.23 N ATOM 0 H LYS A 139 -21.334 -5.733 -5.862 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.490 -8.033 -6.047 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -20.829 -6.383 -8.214 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -19.592 -7.588 -8.513 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.123 -9.286 -7.382 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.370 -8.054 -7.388 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -22.149 -7.849 -9.864 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -20.912 -9.091 -9.854 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -22.575 -10.682 -8.836 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -23.804 -9.440 -8.971 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -23.883 -10.958 -10.837 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -23.463 -9.403 -11.372 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -22.272 -10.606 -11.241 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.471 -6.659 -6.575 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.263 -5.860 -6.640 1.00 0.30 C ATOM 2147 C LEU A 140 -15.716 -5.878 -8.064 1.00 0.31 C ATOM 2148 O LEU A 140 -15.334 -6.928 -8.582 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.226 -6.424 -5.652 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.018 -5.531 -5.337 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.352 -5.996 -4.054 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.005 -5.547 -6.473 1.00 0.37 C ATOM 0 H LEU A 140 -17.306 -7.666 -6.565 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.484 -4.828 -6.366 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -15.736 -6.650 -4.715 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -14.856 -7.369 -6.049 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.378 -4.509 -5.216 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -12.496 -5.358 -3.837 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.066 -5.938 -3.232 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.016 -7.026 -4.171 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.162 -4.905 -6.218 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.650 -6.566 -6.630 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.476 -5.182 -7.386 1.00 0.37 H new ATOM 2164 N SER A 141 -15.697 -4.727 -8.707 1.00 0.28 N ATOM 2165 CA SER A 141 -15.103 -4.615 -10.025 1.00 0.31 C ATOM 2166 C SER A 141 -13.828 -3.786 -9.942 1.00 0.28 C ATOM 2167 O SER A 141 -13.882 -2.574 -9.786 1.00 0.36 O ATOM 2168 CB SER A 141 -16.097 -3.962 -10.987 1.00 0.39 C ATOM 2169 OG SER A 141 -17.368 -4.580 -10.891 1.00 1.19 O ATOM 0 H SER A 141 -16.085 -3.858 -8.340 1.00 0.28 H new ATOM 0 HA SER A 141 -14.856 -5.609 -10.397 1.00 0.31 H new ATOM 0 HB2 SER A 141 -16.186 -2.900 -10.760 1.00 0.39 H new ATOM 0 HB3 SER A 141 -15.726 -4.040 -12.009 1.00 0.39 H new ATOM 0 HG SER A 141 -17.990 -4.147 -11.513 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.686 -4.434 -10.062 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.415 -3.736 -9.968 1.00 0.35 C ATOM 2177 C VAL A 142 -10.983 -3.280 -11.361 1.00 0.43 C ATOM 2178 O VAL A 142 -10.601 -4.093 -12.206 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.315 -4.608 -9.299 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -10.191 -5.952 -9.982 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -8.979 -3.881 -9.300 1.00 0.83 C ATOM 0 H VAL A 142 -12.610 -5.438 -10.224 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.550 -2.865 -9.327 1.00 0.35 H new ATOM 0 HB VAL A 142 -10.611 -4.784 -8.265 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -9.414 -6.539 -9.492 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -11.141 -6.482 -9.917 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -9.928 -5.805 -11.030 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -8.223 -4.508 -8.827 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -8.682 -3.666 -10.327 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -9.073 -2.947 -8.747 1.00 0.83 H new ATOM 2191 N GLN A 143 -11.087 -1.971 -11.596 1.00 0.56 N ATOM 2192 CA GLN A 143 -10.848 -1.380 -12.914 1.00 0.70 C ATOM 2193 C GLN A 143 -11.872 -1.886 -13.931 1.00 0.82 C ATOM 2194 O GLN A 143 -12.865 -1.214 -14.206 1.00 1.45 O ATOM 2195 CB GLN A 143 -9.421 -1.655 -13.404 1.00 0.74 C ATOM 2196 CG GLN A 143 -8.353 -0.875 -12.652 1.00 0.83 C ATOM 2197 CD GLN A 143 -8.493 0.623 -12.840 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -7.942 1.195 -13.780 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -9.220 1.273 -11.943 1.00 1.11 N ATOM 0 H GLN A 143 -11.339 -1.291 -10.879 1.00 0.56 H new ATOM 0 HA GLN A 143 -10.963 -0.301 -12.814 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -9.213 -2.721 -13.310 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -9.357 -1.411 -14.464 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -8.413 -1.113 -11.590 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -7.367 -1.191 -12.994 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -9.661 0.763 -11.178 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -9.338 2.283 -12.018 1.00 1.11 H new ATOM 2208 N GLY A 144 -11.638 -3.074 -14.464 1.00 0.86 N ATOM 2209 CA GLY A 144 -12.564 -3.658 -15.413 1.00 0.96 C ATOM 2210 C GLY A 144 -12.841 -5.118 -15.113 1.00 0.85 C ATOM 2211 O GLY A 144 -13.628 -5.765 -15.806 1.00 1.02 O ATOM 0 H GLY A 144 -10.820 -3.647 -14.256 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -13.500 -3.101 -15.395 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -12.157 -3.566 -16.420 1.00 0.96 H new ATOM 2215 N GLU A 145 -12.208 -5.635 -14.068 1.00 0.66 N ATOM 2216 CA GLU A 145 -12.346 -7.039 -13.716 1.00 0.65 C ATOM 2217 C GLU A 145 -13.423 -7.193 -12.649 1.00 0.52 C ATOM 2218 O GLU A 145 -13.261 -6.729 -11.520 1.00 0.55 O ATOM 2219 CB GLU A 145 -11.009 -7.591 -13.217 1.00 0.74 C ATOM 2220 CG GLU A 145 -10.904 -9.101 -13.288 1.00 1.06 C ATOM 2221 CD GLU A 145 -9.514 -9.600 -12.954 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -8.605 -9.461 -13.795 1.00 1.84 O ATOM 2223 OE2 GLU A 145 -9.325 -10.132 -11.844 1.00 1.95 O ATOM 0 H GLU A 145 -11.595 -5.102 -13.451 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.641 -7.606 -14.599 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.203 -7.152 -13.806 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -10.859 -7.274 -12.185 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -11.622 -9.545 -12.598 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -11.176 -9.435 -14.289 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.516 -7.849 -13.007 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.689 -7.904 -12.144 1.00 0.54 C ATOM 2232 C VAL A 146 -15.836 -9.268 -11.473 1.00 0.53 C ATOM 2233 O VAL A 146 -15.714 -10.311 -12.117 1.00 0.67 O ATOM 2234 CB VAL A 146 -16.978 -7.564 -12.937 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -17.150 -8.493 -14.134 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -18.208 -7.612 -12.034 1.00 0.92 C ATOM 0 H VAL A 146 -14.617 -8.351 -13.889 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.545 -7.157 -11.364 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.874 -6.546 -13.313 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -18.062 -8.230 -14.670 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -16.294 -8.389 -14.801 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -17.217 -9.524 -13.788 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -19.097 -7.370 -12.617 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.312 -8.612 -11.613 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -18.095 -6.889 -11.227 1.00 0.92 H new ATOM 2246 N SER A 147 -16.073 -9.244 -10.171 1.00 0.47 N ATOM 2247 CA SER A 147 -16.341 -10.448 -9.403 1.00 0.47 C ATOM 2248 C SER A 147 -17.035 -10.068 -8.104 1.00 0.48 C ATOM 2249 O SER A 147 -16.625 -9.127 -7.435 1.00 0.79 O ATOM 2250 CB SER A 147 -15.037 -11.194 -9.109 1.00 0.54 C ATOM 2251 OG SER A 147 -15.275 -12.383 -8.372 1.00 1.27 O ATOM 0 H SER A 147 -16.085 -8.388 -9.617 1.00 0.47 H new ATOM 0 HA SER A 147 -16.988 -11.108 -9.981 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.537 -11.439 -10.046 1.00 0.54 H new ATOM 0 HB3 SER A 147 -14.364 -10.546 -8.549 1.00 0.54 H new ATOM 0 HG SER A 147 -14.424 -12.838 -8.201 1.00 1.27 H new ATOM 2257 N THR A 148 -18.099 -10.785 -7.767 1.00 0.41 N ATOM 2258 CA THR A 148 -18.868 -10.500 -6.565 1.00 0.40 C ATOM 2259 C THR A 148 -17.972 -10.508 -5.323 1.00 0.39 C ATOM 2260 O THR A 148 -17.080 -11.344 -5.184 1.00 0.46 O ATOM 2261 CB THR A 148 -20.040 -11.499 -6.399 1.00 0.46 C ATOM 2262 OG1 THR A 148 -20.840 -11.161 -5.257 1.00 1.45 O ATOM 2263 CG2 THR A 148 -19.536 -12.926 -6.270 1.00 1.28 C ATOM 0 H THR A 148 -18.450 -11.572 -8.313 1.00 0.41 H new ATOM 0 HA THR A 148 -19.290 -9.501 -6.674 1.00 0.40 H new ATOM 0 HB THR A 148 -20.655 -11.431 -7.296 1.00 0.46 H new ATOM 0 HG1 THR A 148 -20.645 -10.241 -4.982 1.00 1.45 H new ATOM 0 HG21 THR A 148 -20.383 -13.602 -6.155 1.00 1.28 H new ATOM 0 HG22 THR A 148 -18.975 -13.196 -7.165 1.00 1.28 H new ATOM 0 HG23 THR A 148 -18.887 -13.005 -5.398 1.00 1.28 H new ATOM 2271 N PHE A 149 -18.224 -9.557 -4.436 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.408 -9.355 -3.249 1.00 0.32 C ATOM 2273 C PHE A 149 -17.786 -10.357 -2.163 1.00 0.35 C ATOM 2274 O PHE A 149 -18.968 -10.577 -1.890 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.590 -7.909 -2.763 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.153 -7.670 -1.352 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.825 -7.416 -1.050 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -18.080 -7.702 -0.324 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.433 -7.201 0.251 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.692 -7.488 0.979 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.369 -7.238 1.266 1.00 0.47 C ATOM 0 H PHE A 149 -19.002 -8.902 -4.520 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.358 -9.520 -3.489 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -17.030 -7.245 -3.421 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.642 -7.637 -2.855 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.092 -7.387 -1.842 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -19.119 -7.897 -0.547 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.396 -7.004 0.478 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.423 -7.516 1.774 1.00 0.46 H new ATOM 0 HZ PHE A 149 -16.062 -7.070 2.288 1.00 0.47 H new ATOM 2291 N THR A 150 -16.779 -10.967 -1.554 1.00 0.37 N ATOM 2292 CA THR A 150 -17.003 -12.006 -0.562 1.00 0.48 C ATOM 2293 C THR A 150 -16.257 -11.729 0.745 1.00 0.43 C ATOM 2294 O THR A 150 -15.066 -12.025 0.874 1.00 0.82 O ATOM 2295 CB THR A 150 -16.576 -13.380 -1.118 1.00 0.78 C ATOM 2296 OG1 THR A 150 -15.308 -13.264 -1.781 1.00 1.79 O ATOM 2297 CG2 THR A 150 -17.614 -13.923 -2.091 1.00 1.25 C ATOM 0 H THR A 150 -15.796 -10.759 -1.731 1.00 0.37 H new ATOM 0 HA THR A 150 -18.071 -12.012 -0.343 1.00 0.48 H new ATOM 0 HB THR A 150 -16.491 -14.074 -0.282 1.00 0.78 H new ATOM 0 HG1 THR A 150 -14.673 -12.802 -1.194 1.00 1.79 H new ATOM 0 HG21 THR A 150 -17.288 -14.892 -2.468 1.00 1.25 H new ATOM 0 HG22 THR A 150 -18.569 -14.036 -1.578 1.00 1.25 H new ATOM 0 HG23 THR A 150 -17.729 -13.230 -2.924 1.00 1.25 H new ATOM 2305 N GLY A 151 -16.962 -11.143 1.704 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.428 -10.992 3.045 1.00 0.37 C ATOM 2307 C GLY A 151 -15.587 -9.749 3.235 1.00 0.32 C ATOM 2308 O GLY A 151 -15.996 -8.826 3.939 1.00 0.34 O ATOM 0 H GLY A 151 -17.901 -10.767 1.576 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -17.255 -10.971 3.754 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.824 -11.867 3.286 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.414 -9.713 2.622 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.510 -8.589 2.812 1.00 0.28 C ATOM 2314 C LYS A 152 -12.511 -8.509 1.670 1.00 0.27 C ATOM 2315 O LYS A 152 -12.334 -9.468 0.918 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.786 -8.688 4.172 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.472 -9.459 4.174 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.626 -10.891 3.692 1.00 0.62 C ATOM 2319 CE LYS A 152 -10.276 -11.570 3.598 1.00 0.77 C ATOM 2320 NZ LYS A 152 -9.772 -11.998 4.927 1.00 1.23 N ATOM 0 H LYS A 152 -14.068 -10.440 1.996 1.00 0.29 H new ATOM 0 HA LYS A 152 -14.100 -7.673 2.814 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.592 -7.678 4.532 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.461 -9.158 4.887 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.753 -8.943 3.539 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -11.060 -9.463 5.183 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -12.270 -11.443 4.376 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -12.113 -10.902 2.717 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -10.352 -12.438 2.943 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.559 -10.888 3.141 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -8.846 -12.458 4.815 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -9.674 -11.167 5.545 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -10.443 -12.669 5.353 1.00 1.23 H new ATOM 2334 N LEU A 153 -11.864 -7.365 1.556 1.00 0.23 N ATOM 2335 CA LEU A 153 -10.857 -7.157 0.534 1.00 0.24 C ATOM 2336 C LEU A 153 -9.552 -7.761 1.026 1.00 0.26 C ATOM 2337 O LEU A 153 -9.255 -7.706 2.213 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.719 -5.662 0.235 1.00 0.26 C ATOM 2339 CG LEU A 153 -10.036 -5.293 -1.089 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.371 -3.862 -1.468 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -8.530 -5.456 -0.993 1.00 1.16 C ATOM 0 H LEU A 153 -12.020 -6.560 2.163 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.141 -7.645 -0.398 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.715 -5.219 0.241 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.159 -5.201 1.049 1.00 0.26 H new ATOM 0 HG LEU A 153 -10.407 -5.970 -1.858 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -9.881 -3.611 -2.409 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.450 -3.759 -1.582 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -10.022 -3.187 -0.686 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -8.074 -5.187 -1.946 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -8.143 -4.805 -0.209 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.291 -6.493 -0.755 1.00 1.16 H new ATOM 2353 N SER A 154 -8.786 -8.357 0.136 1.00 0.24 N ATOM 2354 CA SER A 154 -7.615 -9.097 0.558 1.00 0.27 C ATOM 2355 C SER A 154 -6.425 -8.778 -0.340 1.00 0.30 C ATOM 2356 O SER A 154 -6.380 -9.185 -1.499 1.00 0.50 O ATOM 2357 CB SER A 154 -7.930 -10.594 0.544 1.00 0.38 C ATOM 2358 OG SER A 154 -6.931 -11.340 1.206 1.00 1.35 O ATOM 0 H SER A 154 -8.949 -8.345 -0.871 1.00 0.24 H new ATOM 0 HA SER A 154 -7.348 -8.802 1.573 1.00 0.27 H new ATOM 0 HB2 SER A 154 -8.893 -10.768 1.023 1.00 0.38 H new ATOM 0 HB3 SER A 154 -8.020 -10.938 -0.486 1.00 0.38 H new ATOM 0 HG SER A 154 -6.083 -11.251 0.724 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.473 -8.030 0.190 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.321 -7.620 -0.596 1.00 0.28 C ATOM 2366 C VAL A 155 -3.136 -8.539 -0.352 1.00 0.29 C ATOM 2367 O VAL A 155 -2.440 -8.406 0.647 1.00 0.38 O ATOM 2368 CB VAL A 155 -3.908 -6.165 -0.295 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -2.714 -5.756 -1.149 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.073 -5.225 -0.536 1.00 0.39 C ATOM 0 H VAL A 155 -5.473 -7.696 1.154 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.619 -7.686 -1.642 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.618 -6.102 0.754 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.439 -4.726 -0.921 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -1.871 -6.413 -0.934 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -2.977 -5.836 -2.204 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -4.766 -4.202 -0.319 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.389 -5.296 -1.577 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -5.903 -5.500 0.115 1.00 0.39 H new ATOM 2380 N GLU A 156 -2.916 -9.476 -1.260 1.00 0.32 N ATOM 2381 CA GLU A 156 -1.767 -10.365 -1.149 1.00 0.40 C ATOM 2382 C GLU A 156 -0.633 -9.876 -2.025 1.00 0.36 C ATOM 2383 O GLU A 156 -0.804 -9.690 -3.231 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.100 -11.807 -1.543 1.00 0.61 C ATOM 2385 CG GLU A 156 -3.035 -12.523 -0.587 1.00 0.73 C ATOM 2386 CD GLU A 156 -4.459 -12.534 -1.083 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -4.784 -13.385 -1.938 1.00 1.92 O ATOM 2388 OE2 GLU A 156 -5.251 -11.707 -0.617 1.00 1.98 O ATOM 0 H GLU A 156 -3.509 -9.641 -2.073 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.471 -10.355 -0.100 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -2.550 -11.804 -2.536 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -1.172 -12.374 -1.615 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -2.693 -13.548 -0.447 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -2.996 -12.038 0.388 1.00 0.73 H new ATOM 2395 N PHE A 157 0.513 -9.658 -1.418 1.00 0.41 N ATOM 2396 CA PHE A 157 1.707 -9.325 -2.164 1.00 0.43 C ATOM 2397 C PHE A 157 2.587 -10.569 -2.248 1.00 0.43 C ATOM 2398 O PHE A 157 3.007 -11.114 -1.220 1.00 0.51 O ATOM 2399 CB PHE A 157 2.426 -8.155 -1.491 1.00 0.55 C ATOM 2400 CG PHE A 157 3.617 -7.628 -2.232 1.00 0.88 C ATOM 2401 CD1 PHE A 157 4.863 -8.205 -2.067 1.00 1.19 C ATOM 2402 CD2 PHE A 157 3.493 -6.536 -3.068 1.00 1.46 C ATOM 2403 CE1 PHE A 157 5.964 -7.702 -2.726 1.00 1.85 C ATOM 2404 CE2 PHE A 157 4.589 -6.030 -3.733 1.00 2.17 C ATOM 2405 CZ PHE A 157 5.826 -6.612 -3.559 1.00 2.32 C ATOM 0 H PHE A 157 0.644 -9.705 -0.407 1.00 0.41 H new ATOM 0 HA PHE A 157 1.458 -9.010 -3.177 1.00 0.43 H new ATOM 0 HB2 PHE A 157 1.714 -7.341 -1.355 1.00 0.55 H new ATOM 0 HB3 PHE A 157 2.746 -8.469 -0.497 1.00 0.55 H new ATOM 0 HD1 PHE A 157 4.974 -9.059 -1.415 1.00 1.19 H new ATOM 0 HD2 PHE A 157 2.526 -6.073 -3.202 1.00 1.46 H new ATOM 0 HE1 PHE A 157 6.932 -8.160 -2.590 1.00 1.85 H new ATOM 0 HE2 PHE A 157 4.479 -5.179 -4.389 1.00 2.17 H new ATOM 0 HZ PHE A 157 6.687 -6.214 -4.075 1.00 2.32 H new ATOM 2415 N VAL A 158 2.816 -11.027 -3.473 1.00 0.44 N ATOM 2416 CA VAL A 158 3.526 -12.274 -3.732 1.00 0.48 C ATOM 2417 C VAL A 158 4.956 -11.988 -4.194 1.00 0.48 C ATOM 2418 O VAL A 158 5.201 -11.009 -4.911 1.00 0.47 O ATOM 2419 CB VAL A 158 2.797 -13.115 -4.805 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.428 -14.492 -4.941 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.315 -13.235 -4.479 1.00 0.59 C ATOM 0 H VAL A 158 2.513 -10.542 -4.318 1.00 0.44 H new ATOM 0 HA VAL A 158 3.553 -12.841 -2.801 1.00 0.48 H new ATOM 0 HB VAL A 158 2.899 -12.601 -5.761 1.00 0.52 H new ATOM 0 HG11 VAL A 158 2.896 -15.062 -5.702 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.473 -14.386 -5.231 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.368 -15.016 -3.987 1.00 0.62 H new ATOM 0 HG21 VAL A 158 0.821 -13.831 -5.247 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.194 -13.719 -3.510 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.868 -12.241 -4.447 1.00 0.59 H new ATOM 2431 N LYS A 159 5.890 -12.848 -3.781 1.00 0.58 N ATOM 2432 CA LYS A 159 7.308 -12.634 -4.039 1.00 0.66 C ATOM 2433 C LYS A 159 7.641 -12.711 -5.523 1.00 0.63 C ATOM 2434 O LYS A 159 7.270 -13.662 -6.210 1.00 0.77 O ATOM 2435 CB LYS A 159 8.171 -13.631 -3.253 1.00 0.93 C ATOM 2436 CG LYS A 159 7.889 -15.099 -3.523 1.00 1.36 C ATOM 2437 CD LYS A 159 8.873 -15.969 -2.760 1.00 1.66 C ATOM 2438 CE LYS A 159 8.633 -17.453 -2.988 1.00 1.99 C ATOM 2439 NZ LYS A 159 9.634 -18.281 -2.267 1.00 2.26 N ATOM 0 H LYS A 159 5.684 -13.703 -3.264 1.00 0.58 H new ATOM 0 HA LYS A 159 7.537 -11.624 -3.699 1.00 0.66 H new ATOM 0 HB2 LYS A 159 9.219 -13.433 -3.478 1.00 0.93 H new ATOM 0 HB3 LYS A 159 8.033 -13.443 -2.188 1.00 0.93 H new ATOM 0 HG2 LYS A 159 6.869 -15.342 -3.224 1.00 1.36 H new ATOM 0 HG3 LYS A 159 7.965 -15.301 -4.591 1.00 1.36 H new ATOM 0 HD2 LYS A 159 9.889 -15.717 -3.065 1.00 1.66 H new ATOM 0 HD3 LYS A 159 8.797 -15.751 -1.695 1.00 1.66 H new ATOM 0 HE2 LYS A 159 7.630 -17.717 -2.652 1.00 1.99 H new ATOM 0 HE3 LYS A 159 8.679 -17.671 -4.055 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 9.443 -19.288 -2.443 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 10.588 -18.045 -2.606 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 9.572 -18.090 -1.247 1.00 2.26 H new ATOM 2564 N VAL A 167 8.687 -2.613 1.850 1.00 0.49 N ATOM 2565 CA VAL A 167 7.944 -1.612 2.605 1.00 0.44 C ATOM 2566 C VAL A 167 6.567 -1.395 2.013 1.00 0.38 C ATOM 2567 O VAL A 167 6.425 -1.250 0.789 1.00 0.39 O ATOM 2568 CB VAL A 167 8.682 -0.258 2.625 1.00 0.53 C ATOM 2569 CG1 VAL A 167 7.962 0.740 3.516 1.00 1.15 C ATOM 2570 CG2 VAL A 167 10.127 -0.431 3.061 1.00 1.19 C ATOM 0 HA VAL A 167 7.854 -1.992 3.623 1.00 0.44 H new ATOM 0 HB VAL A 167 8.684 0.137 1.609 1.00 0.53 H new ATOM 0 HG11 VAL A 167 8.503 1.687 3.513 1.00 1.15 H new ATOM 0 HG12 VAL A 167 6.951 0.898 3.142 1.00 1.15 H new ATOM 0 HG13 VAL A 167 7.916 0.352 4.534 1.00 1.15 H new ATOM 0 HG21 VAL A 167 10.624 0.539 3.066 1.00 1.19 H new ATOM 0 HG22 VAL A 167 10.156 -0.859 4.063 1.00 1.19 H new ATOM 0 HG23 VAL A 167 10.639 -1.097 2.367 1.00 1.19 H new ATOM 2580 N CYS A 168 5.555 -1.338 2.873 1.00 0.38 N ATOM 2581 CA CYS A 168 4.203 -1.121 2.396 1.00 0.40 C ATOM 2582 C CYS A 168 3.508 -0.034 3.204 1.00 0.47 C ATOM 2583 O CYS A 168 3.695 0.075 4.404 1.00 0.94 O ATOM 2584 CB CYS A 168 3.408 -2.418 2.467 1.00 0.48 C ATOM 2585 SG CYS A 168 1.987 -2.481 1.352 1.00 1.36 S ATOM 0 H CYS A 168 5.646 -1.437 3.884 1.00 0.38 H new ATOM 0 HA CYS A 168 4.256 -0.792 1.358 1.00 0.40 H new ATOM 0 HB2 CYS A 168 4.073 -3.251 2.237 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.059 -2.561 3.490 1.00 0.48 H new ATOM 0 HG CYS A 168 2.401 -2.630 0.129 1.00 1.36 H new ATOM 2591 N ALA A 169 2.738 0.780 2.512 1.00 0.29 N ATOM 2592 CA ALA A 169 1.950 1.846 3.120 1.00 0.28 C ATOM 2593 C ALA A 169 0.528 1.780 2.596 1.00 0.27 C ATOM 2594 O ALA A 169 -0.059 2.798 2.245 1.00 0.28 O ATOM 2595 CB ALA A 169 2.558 3.213 2.898 1.00 0.31 C ATOM 0 H ALA A 169 2.637 0.724 1.499 1.00 0.29 H new ATOM 0 HA ALA A 169 1.944 1.692 4.199 1.00 0.28 H new ATOM 0 HB1 ALA A 169 1.933 3.970 3.371 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.556 3.243 3.335 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.624 3.413 1.828 1.00 0.31 H new ATOM 2601 N LEU A 170 0.079 0.554 2.370 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.222 0.278 1.772 1.00 0.32 C ATOM 2603 C LEU A 170 -2.370 0.876 2.576 1.00 0.32 C ATOM 2604 O LEU A 170 -2.774 0.342 3.600 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.396 -1.240 1.635 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.831 -1.742 1.457 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.452 -1.215 0.177 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -2.856 -3.257 1.470 1.00 0.69 C ATOM 0 H LEU A 170 0.611 -0.286 2.598 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.251 0.750 0.790 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.807 -1.577 0.782 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -0.974 -1.715 2.521 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.424 -1.366 2.290 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.470 -1.592 0.085 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -3.470 -0.125 0.203 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -2.863 -1.548 -0.677 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -3.881 -3.605 1.343 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.240 -3.638 0.656 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -2.465 -3.619 2.421 1.00 0.69 H new ATOM 2620 N PHE A 171 -2.894 1.982 2.088 1.00 0.27 N ATOM 2621 CA PHE A 171 -4.042 2.628 2.692 1.00 0.27 C ATOM 2622 C PHE A 171 -5.254 2.498 1.764 1.00 0.27 C ATOM 2623 O PHE A 171 -5.144 2.730 0.558 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.689 4.095 2.981 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.665 5.092 2.439 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.864 5.325 3.083 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.381 5.790 1.277 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.763 6.234 2.583 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.278 6.703 0.769 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.471 6.924 1.424 1.00 0.47 C ATOM 0 H PHE A 171 -2.536 2.459 1.261 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.303 2.148 3.635 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -3.613 4.230 4.060 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -2.705 4.307 2.563 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -6.097 4.786 3.990 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -3.447 5.616 0.764 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.697 6.409 3.096 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.048 7.243 -0.138 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.178 7.638 1.029 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.404 2.101 2.309 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.615 2.022 1.507 1.00 0.23 C ATOM 2642 C ILE A 172 -8.698 2.977 2.025 1.00 0.23 C ATOM 2643 O ILE A 172 -9.103 2.936 3.202 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.202 0.596 1.402 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.436 0.626 0.491 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.551 0.036 2.769 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.191 -0.685 0.431 1.00 0.30 C ATOM 0 H ILE A 172 -6.518 1.834 3.287 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.306 2.322 0.506 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.449 -0.064 0.971 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -10.112 1.407 0.839 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -9.124 0.900 -0.517 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -8.961 -0.968 2.657 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.653 -0.005 3.385 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.290 0.679 3.248 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -11.049 -0.581 -0.233 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.532 -1.467 0.053 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.536 -0.952 1.430 1.00 0.30 H new ATOM 2659 N MET A 173 -9.152 3.841 1.137 1.00 0.24 N ATOM 2660 CA MET A 173 -10.242 4.751 1.432 1.00 0.25 C ATOM 2661 C MET A 173 -11.414 4.400 0.530 1.00 0.27 C ATOM 2662 O MET A 173 -11.234 3.690 -0.463 1.00 0.31 O ATOM 2663 CB MET A 173 -9.788 6.194 1.216 1.00 0.28 C ATOM 2664 CG MET A 173 -9.737 6.632 -0.237 1.00 0.33 C ATOM 2665 SD MET A 173 -11.291 7.358 -0.772 1.00 0.99 S ATOM 2666 CE MET A 173 -11.542 8.521 0.562 1.00 0.50 C ATOM 0 H MET A 173 -8.777 3.932 0.193 1.00 0.24 H new ATOM 0 HA MET A 173 -10.550 4.656 2.473 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.462 6.858 1.758 1.00 0.28 H new ATOM 0 HB3 MET A 173 -8.798 6.318 1.654 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.933 7.356 -0.370 1.00 0.33 H new ATOM 0 HG3 MET A 173 -9.501 5.774 -0.867 1.00 0.33 H new ATOM 0 HE1 MET A 173 -12.461 9.081 0.388 1.00 0.50 H new ATOM 0 HE2 MET A 173 -11.619 7.981 1.506 1.00 0.50 H new ATOM 0 HE3 MET A 173 -10.699 9.211 0.606 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.607 4.870 0.854 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.765 4.461 0.091 1.00 0.34 C ATOM 2678 C LYS A 174 -14.482 5.621 -0.587 1.00 0.30 C ATOM 2679 O LYS A 174 -14.514 6.754 -0.106 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.752 3.675 0.963 1.00 0.50 C ATOM 2681 CG LYS A 174 -15.617 4.528 1.880 1.00 0.69 C ATOM 2682 CD LYS A 174 -16.580 3.668 2.690 1.00 0.77 C ATOM 2683 CE LYS A 174 -17.527 2.873 1.797 1.00 0.74 C ATOM 2684 NZ LYS A 174 -18.554 3.730 1.153 1.00 1.22 N ATOM 0 H LYS A 174 -12.793 5.518 1.620 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.384 3.815 -0.700 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -15.403 3.091 0.313 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.191 2.966 1.572 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -14.981 5.100 2.555 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -16.180 5.248 1.286 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -16.012 2.981 3.318 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -17.160 4.305 3.358 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -16.951 2.361 1.027 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -18.021 2.103 2.390 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -18.871 3.286 0.268 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -19.365 3.842 1.795 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -18.146 4.664 0.945 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.038 5.281 -1.726 1.00 0.28 N ATOM 2699 CA GLY A 175 -15.978 6.109 -2.439 1.00 0.28 C ATOM 2700 C GLY A 175 -15.424 6.775 -3.684 1.00 0.28 C ATOM 2701 O GLY A 175 -16.166 6.893 -4.658 1.00 0.31 O ATOM 0 H GLY A 175 -14.843 4.396 -2.194 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -16.836 5.499 -2.722 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.345 6.882 -1.764 1.00 0.28 H new ATOM 2705 N THR A 176 -14.117 7.076 -3.722 1.00 0.27 N ATOM 2706 CA THR A 176 -13.517 7.770 -4.875 1.00 0.32 C ATOM 2707 C THR A 176 -12.005 7.907 -4.750 1.00 0.38 C ATOM 2708 O THR A 176 -11.463 7.924 -3.653 1.00 0.44 O ATOM 2709 CB THR A 176 -14.046 9.201 -5.028 1.00 0.43 C ATOM 2710 OG1 THR A 176 -14.458 9.714 -3.754 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.185 9.299 -6.035 1.00 0.68 C ATOM 0 H THR A 176 -13.459 6.853 -2.975 1.00 0.27 H new ATOM 0 HA THR A 176 -13.786 7.152 -5.731 1.00 0.32 H new ATOM 0 HB THR A 176 -13.228 9.807 -5.416 1.00 0.43 H new ATOM 0 HG1 THR A 176 -14.792 10.629 -3.862 1.00 0.57 H new ATOM 0 HG21 THR A 176 -15.522 10.333 -6.104 1.00 0.68 H new ATOM 0 HG22 THR A 176 -14.836 8.965 -7.012 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.013 8.669 -5.710 1.00 0.68 H new ATOM 2719 N ALA A 177 -11.336 8.027 -5.894 1.00 0.50 N ATOM 2720 CA ALA A 177 -9.923 8.388 -5.928 1.00 0.65 C ATOM 2721 C ALA A 177 -9.758 9.902 -5.863 1.00 0.68 C ATOM 2722 O ALA A 177 -8.682 10.410 -5.553 1.00 0.86 O ATOM 2723 CB ALA A 177 -9.261 7.839 -7.186 1.00 0.82 C ATOM 0 H ALA A 177 -11.753 7.879 -6.813 1.00 0.50 H new ATOM 0 HA ALA A 177 -9.435 7.947 -5.059 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -8.207 8.118 -7.194 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -9.349 6.753 -7.199 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -9.753 8.253 -8.066 1.00 0.82 H new ATOM 2729 N ASP A 178 -10.840 10.614 -6.158 1.00 0.61 N ATOM 2730 CA ASP A 178 -10.837 12.077 -6.185 1.00 0.68 C ATOM 2731 C ASP A 178 -10.684 12.657 -4.782 1.00 0.67 C ATOM 2732 O ASP A 178 -10.261 13.800 -4.613 1.00 0.79 O ATOM 2733 CB ASP A 178 -12.131 12.585 -6.825 1.00 0.82 C ATOM 2734 CG ASP A 178 -12.202 14.099 -6.920 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -11.600 14.672 -7.854 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -12.887 14.720 -6.078 1.00 2.16 O ATOM 0 H ASP A 178 -11.743 10.197 -6.385 1.00 0.61 H new ATOM 0 HA ASP A 178 -9.984 12.406 -6.778 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -12.224 12.161 -7.825 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -12.981 12.224 -6.245 1.00 0.82 H new