USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1080 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 39 LYS NZ :NH3+ -161:sc= 1.22 (180deg=-0.311) USER MOD Set 1.2: A 127 GLN : amide:sc= 1.27 K(o=2.5,f=-7.9!) USER MOD Set 2.1: A 111 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.15) USER MOD Set 2.2: A 112 GLN : amide:sc= -1.26 K(o=-0.098,f=-5.1!) USER MOD Set 3.1: A 65 THR OG1 : rot -135:sc= 0.159 USER MOD Set 3.2: A 66 THR OG1 : rot -120:sc= 1.36 USER MOD Set 3.3: A 67 THR OG1 : rot 180:sc= 0.486 USER MOD Single : A 1 GLY N :NH3+ -155:sc= 0.781 (180deg=-0.278!) USER MOD Single : A 2 SER OG : rot -34:sc= 0.26 USER MOD Single : A 8 LYS NZ :NH3+ -151:sc= 1.11 (180deg=0.436) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.0251 K(o=-0.025,f=-1) USER MOD Single : A 16 LYS NZ :NH3+ -172:sc=-0.00287 (180deg=-0.129) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ -162:sc= 1.33 (180deg=1.02) USER MOD Single : A 34 ASN : amide:sc= -5.33! C(o=-5.3!,f=-6!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= 1.83 K(o=1.8,f=-4.1!) USER MOD Single : A 43 ASN : amide:sc= -2.09! C(o=-2.1!,f=-11!) USER MOD Single : A 45 LYS NZ :NH3+ 167:sc= -0.0299 (180deg=-0.225) USER MOD Single : A 48 MET CE :methyl 180:sc= -3.02 (180deg=-3.02) USER MOD Single : A 50 MET CE :methyl 170:sc= -0.931 (180deg=-1.19) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 LYS NZ :NH3+ -179:sc= 0.544 (180deg=0.513) USER MOD Single : A 59 CYS SG : rot 50:sc= -0.203 USER MOD Single : A 61 ASN : amide:sc= -0.262 K(o=-0.26,f=-2.4!) USER MOD Single : A 62 HIS : no HD1:sc= -0.481 K(o=-0.48,f=-4.9!) USER MOD Single : A 68 MET CE :methyl 139:sc= -0.631 (180deg=-3.42) USER MOD Single : A 69 ASN : amide:sc= -0.283 X(o=-0.28,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 167:sc= -0.0164 (180deg=-0.223) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -130:sc= 0 USER MOD Single : A 81 MET CE :methyl -172:sc= 0 (180deg=-0.0402) USER MOD Single : A 85 SER OG : rot 180:sc= 0.0682 USER MOD Single : A 88 SER OG : rot 111:sc= -1.02 USER MOD Single : A 93 LYS NZ :NH3+ -170:sc= 0.691 (180deg=0.363) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ -157:sc= -0.137 (180deg=-0.67) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.331 USER MOD Single : A 113 LYS NZ :NH3+ 164:sc= 1.26 (180deg=0.638) USER MOD Single : A 117 CYS SG : rot 82:sc= 0.526 USER MOD Single : A 118 GLN : amide:sc= -2.37! C(o=-2.4!,f=-8.3!) USER MOD Single : A 128 THR OG1 : rot -140:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.159 -6.517 -6.997 1.00 0.00 N ATOM 2 CA GLY A 1 -18.025 -5.466 -7.508 1.00 0.00 C ATOM 3 C GLY A 1 -17.607 -4.127 -6.980 1.00 0.00 C ATOM 4 O GLY A 1 -17.987 -3.750 -5.865 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.167 -7.323 -7.654 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.189 -6.154 -6.906 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.501 -6.827 -6.065 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.991 -5.459 -8.597 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.057 -5.668 -7.222 1.00 0.00 H new ATOM 10 N SER A 2 -16.771 -3.433 -7.757 1.00 0.00 N ATOM 11 CA SER A 2 -16.259 -2.114 -7.434 1.00 0.00 C ATOM 12 C SER A 2 -15.348 -2.166 -6.179 1.00 0.00 C ATOM 13 O SER A 2 -15.124 -1.145 -5.518 1.00 0.00 O ATOM 14 CB SER A 2 -17.439 -1.116 -7.261 1.00 0.00 C ATOM 15 OG SER A 2 -16.996 0.227 -7.142 1.00 0.00 O ATOM 0 H SER A 2 -16.427 -3.789 -8.649 1.00 0.00 H new ATOM 0 HA SER A 2 -15.640 -1.759 -8.258 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.111 -1.200 -8.115 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.014 -1.386 -6.375 1.00 0.00 H new ATOM 0 HG SER A 2 -16.141 0.248 -6.664 1.00 0.00 H new ATOM 21 N GLY A 3 -14.760 -3.327 -5.910 1.00 0.00 N ATOM 22 CA GLY A 3 -13.973 -3.469 -4.705 1.00 0.00 C ATOM 23 C GLY A 3 -12.750 -4.334 -4.882 1.00 0.00 C ATOM 24 O GLY A 3 -11.638 -3.912 -4.576 1.00 0.00 O ATOM 0 H GLY A 3 -14.814 -4.159 -6.497 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -13.663 -2.481 -4.365 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -14.599 -3.895 -3.920 1.00 0.00 H new ATOM 28 N GLU A 4 -12.945 -5.531 -5.389 1.00 0.00 N ATOM 29 CA GLU A 4 -11.850 -6.493 -5.577 1.00 0.00 C ATOM 30 C GLU A 4 -11.267 -6.381 -6.973 1.00 0.00 C ATOM 31 O GLU A 4 -10.323 -7.090 -7.338 1.00 0.00 O ATOM 32 CB GLU A 4 -12.350 -7.898 -5.320 1.00 0.00 C ATOM 33 CG GLU A 4 -12.757 -8.134 -3.883 1.00 0.00 C ATOM 34 CD GLU A 4 -13.468 -9.431 -3.716 1.00 0.00 C ATOM 35 OE1 GLU A 4 -12.810 -10.479 -3.603 1.00 0.00 O ATOM 36 OE2 GLU A 4 -14.721 -9.438 -3.742 1.00 0.00 O ATOM 0 H GLU A 4 -13.858 -5.876 -5.685 1.00 0.00 H new ATOM 0 HA GLU A 4 -11.058 -6.264 -4.864 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -13.202 -8.097 -5.969 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -11.570 -8.609 -5.591 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -11.872 -8.120 -3.247 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -13.401 -7.321 -3.549 1.00 0.00 H new ATOM 43 N GLU A 5 -11.849 -5.495 -7.723 1.00 0.00 N ATOM 44 CA GLU A 5 -11.506 -5.127 -9.000 1.00 0.00 C ATOM 45 C GLU A 5 -11.723 -3.655 -8.978 1.00 0.00 C ATOM 46 O GLU A 5 -11.670 -3.082 -7.882 1.00 0.00 O ATOM 47 CB GLU A 5 -12.364 -5.865 -10.040 1.00 0.00 C ATOM 48 CG GLU A 5 -13.812 -5.522 -9.958 1.00 0.00 C ATOM 49 CD GLU A 5 -14.556 -6.106 -8.765 1.00 0.00 C ATOM 50 OE1 GLU A 5 -15.030 -7.246 -8.842 1.00 0.00 O ATOM 51 OE2 GLU A 5 -14.704 -5.416 -7.728 1.00 0.00 O ATOM 0 H GLU A 5 -12.660 -4.975 -7.387 1.00 0.00 H new ATOM 0 HA GLU A 5 -10.486 -5.384 -9.287 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -11.997 -5.627 -11.038 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.244 -6.940 -9.904 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.910 -4.437 -9.929 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.301 -5.862 -10.871 1.00 0.00 H new ATOM 58 N ASP A 6 -11.914 -3.056 -10.124 1.00 0.00 N ATOM 59 CA ASP A 6 -12.228 -1.597 -10.260 1.00 0.00 C ATOM 60 C ASP A 6 -11.006 -0.720 -10.014 1.00 0.00 C ATOM 61 O ASP A 6 -11.078 0.494 -9.898 1.00 0.00 O ATOM 62 CB ASP A 6 -13.376 -1.308 -9.305 1.00 0.00 C ATOM 63 CG ASP A 6 -13.779 0.149 -9.056 1.00 0.00 C ATOM 64 OD1 ASP A 6 -14.526 0.711 -9.875 1.00 0.00 O ATOM 65 OD2 ASP A 6 -13.412 0.715 -7.988 1.00 0.00 O ATOM 0 H ASP A 6 -11.863 -3.544 -11.018 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.525 -1.356 -11.280 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -14.255 -1.835 -9.676 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -13.123 -1.750 -8.341 1.00 0.00 H new ATOM 70 N GLU A 7 -9.894 -1.332 -10.023 1.00 0.00 N ATOM 71 CA GLU A 7 -8.701 -0.699 -9.775 1.00 0.00 C ATOM 72 C GLU A 7 -7.923 -0.546 -11.030 1.00 0.00 C ATOM 73 O GLU A 7 -7.935 -1.396 -11.935 1.00 0.00 O ATOM 74 CB GLU A 7 -7.950 -1.414 -8.663 1.00 0.00 C ATOM 75 CG GLU A 7 -7.355 -2.780 -9.063 1.00 0.00 C ATOM 76 CD GLU A 7 -8.339 -3.867 -9.406 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.827 -3.911 -10.551 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.608 -4.714 -8.556 1.00 0.00 O ATOM 0 H GLU A 7 -9.802 -2.330 -10.213 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.883 0.313 -9.415 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.143 -0.769 -8.315 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.627 -1.560 -7.821 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.701 -2.629 -9.922 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.729 -3.133 -8.243 1.00 0.00 H new ATOM 85 N LYS A 8 -7.305 0.551 -11.098 1.00 0.00 N ATOM 86 CA LYS A 8 -6.554 0.919 -12.228 1.00 0.00 C ATOM 87 C LYS A 8 -5.084 1.131 -11.837 1.00 0.00 C ATOM 88 O LYS A 8 -4.795 1.372 -10.680 1.00 0.00 O ATOM 89 CB LYS A 8 -7.167 2.153 -12.881 1.00 0.00 C ATOM 90 CG LYS A 8 -7.014 3.427 -12.065 1.00 0.00 C ATOM 91 CD LYS A 8 -8.063 4.465 -12.401 1.00 0.00 C ATOM 92 CE LYS A 8 -8.158 4.772 -13.881 1.00 0.00 C ATOM 93 NZ LYS A 8 -9.237 5.742 -14.148 1.00 0.00 N ATOM 0 H LYS A 8 -7.302 1.245 -10.351 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.578 0.117 -12.965 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.705 2.302 -13.857 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -8.227 1.970 -13.054 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.076 3.184 -11.004 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.024 3.848 -12.238 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.033 4.117 -12.047 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.838 5.385 -11.861 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.208 5.172 -14.236 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.344 3.853 -14.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.618 5.584 -15.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.996 5.619 -13.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.859 6.709 -14.082 1.00 0.00 H new ATOM 107 N VAL A 9 -4.188 1.072 -12.786 1.00 0.00 N ATOM 108 CA VAL A 9 -2.775 1.184 -12.524 1.00 0.00 C ATOM 109 C VAL A 9 -2.305 2.596 -12.787 1.00 0.00 C ATOM 110 O VAL A 9 -2.440 3.115 -13.893 1.00 0.00 O ATOM 111 CB VAL A 9 -1.939 0.217 -13.398 1.00 0.00 C ATOM 112 CG1 VAL A 9 -0.449 0.374 -13.090 1.00 0.00 C ATOM 113 CG2 VAL A 9 -2.380 -1.226 -13.177 1.00 0.00 C ATOM 0 H VAL A 9 -4.419 0.944 -13.771 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.628 0.920 -11.477 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.106 0.469 -14.445 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.125 -0.312 -13.712 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.140 1.398 -13.299 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.269 0.148 -12.039 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.780 -1.889 -13.800 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -2.244 -1.492 -12.129 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.432 -1.330 -13.444 1.00 0.00 H new ATOM 123 N LEU A 10 -1.787 3.204 -11.777 1.00 0.00 N ATOM 124 CA LEU A 10 -1.250 4.566 -11.905 1.00 0.00 C ATOM 125 C LEU A 10 0.268 4.634 -11.848 1.00 0.00 C ATOM 126 O LEU A 10 0.888 5.376 -12.606 1.00 0.00 O ATOM 127 CB LEU A 10 -1.853 5.569 -10.893 1.00 0.00 C ATOM 128 CG LEU A 10 -3.357 5.877 -10.994 1.00 0.00 C ATOM 129 CD1 LEU A 10 -3.771 6.211 -12.418 1.00 0.00 C ATOM 130 CD2 LEU A 10 -4.194 4.761 -10.420 1.00 0.00 C ATOM 0 H LEU A 10 -1.711 2.803 -10.842 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.562 4.866 -12.905 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.656 5.191 -9.890 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.312 6.510 -10.992 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.542 6.765 -10.389 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.840 6.422 -12.446 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.219 7.086 -12.762 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.551 5.365 -13.069 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.250 5.015 -10.509 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.995 3.839 -10.966 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.942 4.621 -9.369 1.00 0.00 H new ATOM 142 N TYR A 11 0.873 3.868 -10.986 1.00 0.00 N ATOM 143 CA TYR A 11 2.315 3.982 -10.791 1.00 0.00 C ATOM 144 C TYR A 11 2.940 2.628 -10.549 1.00 0.00 C ATOM 145 O TYR A 11 2.297 1.726 -10.000 1.00 0.00 O ATOM 146 CB TYR A 11 2.592 4.940 -9.625 1.00 0.00 C ATOM 147 CG TYR A 11 4.041 5.339 -9.409 1.00 0.00 C ATOM 148 CD1 TYR A 11 4.695 6.138 -10.333 1.00 0.00 C ATOM 149 CD2 TYR A 11 4.732 4.962 -8.263 1.00 0.00 C ATOM 150 CE1 TYR A 11 5.994 6.551 -10.132 1.00 0.00 C ATOM 151 CE2 TYR A 11 6.039 5.365 -8.055 1.00 0.00 C ATOM 152 CZ TYR A 11 6.665 6.164 -8.995 1.00 0.00 C ATOM 153 OH TYR A 11 7.964 6.592 -8.785 1.00 0.00 O ATOM 0 H TYR A 11 0.412 3.165 -10.409 1.00 0.00 H new ATOM 0 HA TYR A 11 2.768 4.385 -11.697 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.008 5.847 -9.782 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.225 4.478 -8.709 1.00 0.00 H new ATOM 0 HD1 TYR A 11 4.176 6.443 -11.229 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.241 4.346 -7.524 1.00 0.00 H new ATOM 0 HE1 TYR A 11 6.484 7.176 -10.864 1.00 0.00 H new ATOM 0 HE2 TYR A 11 6.567 5.058 -7.164 1.00 0.00 H new ATOM 0 HH TYR A 11 8.294 6.231 -7.936 1.00 0.00 H new ATOM 163 N SER A 12 4.143 2.463 -11.044 1.00 0.00 N ATOM 164 CA SER A 12 4.894 1.291 -10.890 1.00 0.00 C ATOM 165 C SER A 12 6.344 1.625 -10.396 1.00 0.00 C ATOM 166 O SER A 12 6.914 2.648 -10.823 1.00 0.00 O ATOM 167 CB SER A 12 4.892 0.619 -12.230 1.00 0.00 C ATOM 168 OG SER A 12 5.330 1.508 -13.256 1.00 0.00 O ATOM 0 H SER A 12 4.623 3.184 -11.582 1.00 0.00 H new ATOM 0 HA SER A 12 4.469 0.631 -10.134 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.542 -0.256 -12.202 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.888 0.262 -12.459 1.00 0.00 H new ATOM 0 HG SER A 12 5.320 1.042 -14.118 1.00 0.00 H new ATOM 174 N GLN A 13 6.919 0.806 -9.487 1.00 0.00 N ATOM 175 CA GLN A 13 8.310 1.048 -8.992 1.00 0.00 C ATOM 176 C GLN A 13 9.068 -0.203 -8.636 1.00 0.00 C ATOM 177 O GLN A 13 8.551 -1.083 -8.034 1.00 0.00 O ATOM 178 CB GLN A 13 8.351 2.077 -7.856 1.00 0.00 C ATOM 179 CG GLN A 13 9.140 3.364 -8.113 1.00 0.00 C ATOM 180 CD GLN A 13 10.645 3.177 -8.243 1.00 0.00 C ATOM 181 OE1 GLN A 13 11.229 2.263 -7.683 1.00 0.00 O ATOM 182 NE2 GLN A 13 11.282 4.072 -8.927 1.00 0.00 N ATOM 0 H GLN A 13 6.462 -0.012 -9.084 1.00 0.00 H new ATOM 0 HA GLN A 13 8.838 1.473 -9.846 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.325 2.352 -7.610 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.771 1.592 -6.975 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.766 3.826 -9.026 1.00 0.00 H new ATOM 0 HG3 GLN A 13 8.944 4.062 -7.299 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.768 4.825 -9.385 1.00 0.00 H new ATOM 0 HE22 GLN A 13 12.298 4.024 -9.008 1.00 0.00 H new ATOM 191 N ARG A 14 10.342 -0.203 -8.937 1.00 0.00 N ATOM 192 CA ARG A 14 11.161 -1.347 -8.705 1.00 0.00 C ATOM 193 C ARG A 14 11.513 -1.430 -7.237 1.00 0.00 C ATOM 194 O ARG A 14 12.165 -0.552 -6.666 1.00 0.00 O ATOM 195 CB ARG A 14 12.406 -1.315 -9.590 1.00 0.00 C ATOM 196 CG ARG A 14 13.367 -2.464 -9.341 1.00 0.00 C ATOM 197 CD ARG A 14 14.474 -2.489 -10.367 1.00 0.00 C ATOM 198 NE ARG A 14 13.981 -2.811 -11.713 1.00 0.00 N ATOM 199 CZ ARG A 14 14.477 -2.324 -12.848 1.00 0.00 C ATOM 200 NH1 ARG A 14 15.328 -1.287 -12.829 1.00 0.00 N ATOM 201 NH2 ARG A 14 14.091 -2.840 -13.999 1.00 0.00 N ATOM 0 H ARG A 14 10.832 0.592 -9.348 1.00 0.00 H new ATOM 0 HA ARG A 14 10.607 -2.247 -8.973 1.00 0.00 H new ATOM 0 HB2 ARG A 14 12.097 -1.332 -10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.931 -0.374 -9.428 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.796 -2.372 -8.343 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.823 -3.408 -9.368 1.00 0.00 H new ATOM 0 HD2 ARG A 14 14.970 -1.518 -10.387 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.223 -3.224 -10.072 1.00 0.00 H new ATOM 0 HE ARG A 14 13.196 -3.459 -11.783 1.00 0.00 H new ATOM 0 HH11 ARG A 14 15.599 -0.866 -11.940 1.00 0.00 H new ATOM 0 HH12 ARG A 14 15.704 -0.920 -13.703 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.418 -3.606 -14.014 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.466 -2.473 -14.874 1.00 0.00 H new ATOM 215 N VAL A 15 11.118 -2.511 -6.666 1.00 0.00 N ATOM 216 CA VAL A 15 11.192 -2.713 -5.262 1.00 0.00 C ATOM 217 C VAL A 15 11.599 -4.169 -4.992 1.00 0.00 C ATOM 218 O VAL A 15 11.654 -4.991 -5.924 1.00 0.00 O ATOM 219 CB VAL A 15 9.777 -2.423 -4.645 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.774 -3.541 -4.933 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.838 -2.079 -3.167 1.00 0.00 C ATOM 0 H VAL A 15 10.723 -3.302 -7.176 1.00 0.00 H new ATOM 0 HA VAL A 15 11.929 -2.048 -4.812 1.00 0.00 H new ATOM 0 HB VAL A 15 9.408 -1.531 -5.152 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.812 -3.291 -4.485 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.654 -3.653 -6.011 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.140 -4.476 -4.509 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.831 -1.889 -2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.276 -2.912 -2.617 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.451 -1.189 -3.026 1.00 0.00 H new ATOM 231 N LYS A 16 11.900 -4.472 -3.762 1.00 0.00 N ATOM 232 CA LYS A 16 12.189 -5.823 -3.338 1.00 0.00 C ATOM 233 C LYS A 16 11.045 -6.234 -2.452 1.00 0.00 C ATOM 234 O LYS A 16 10.675 -5.438 -1.569 1.00 0.00 O ATOM 235 CB LYS A 16 13.465 -5.862 -2.489 1.00 0.00 C ATOM 236 CG LYS A 16 14.726 -5.367 -3.165 1.00 0.00 C ATOM 237 CD LYS A 16 15.901 -5.397 -2.194 1.00 0.00 C ATOM 238 CE LYS A 16 17.212 -4.952 -2.835 1.00 0.00 C ATOM 239 NZ LYS A 16 17.647 -5.851 -3.924 1.00 0.00 N ATOM 0 H LYS A 16 11.954 -3.783 -3.012 1.00 0.00 H new ATOM 0 HA LYS A 16 12.320 -6.472 -4.204 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.299 -5.266 -1.592 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.630 -6.889 -2.163 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.948 -5.988 -4.033 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.575 -4.351 -3.530 1.00 0.00 H new ATOM 0 HD2 LYS A 16 15.680 -4.751 -1.344 1.00 0.00 H new ATOM 0 HD3 LYS A 16 16.018 -6.408 -1.804 1.00 0.00 H new ATOM 0 HE2 LYS A 16 17.095 -3.942 -3.228 1.00 0.00 H new ATOM 0 HE3 LYS A 16 17.989 -4.910 -2.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 18.603 -5.584 -4.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 17.655 -6.833 -3.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 16.989 -5.769 -4.725 1.00 0.00 H new ATOM 253 N LEU A 17 10.490 -7.439 -2.628 1.00 0.00 N ATOM 254 CA LEU A 17 9.416 -7.849 -1.781 1.00 0.00 C ATOM 255 C LEU A 17 9.988 -8.819 -0.816 1.00 0.00 C ATOM 256 O LEU A 17 10.922 -9.509 -1.145 1.00 0.00 O ATOM 257 CB LEU A 17 8.268 -8.474 -2.596 1.00 0.00 C ATOM 258 CG LEU A 17 7.132 -9.152 -1.811 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.421 -8.180 -0.879 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.143 -9.789 -2.768 1.00 0.00 C ATOM 0 H LEU A 17 10.773 -8.116 -3.336 1.00 0.00 H new ATOM 0 HA LEU A 17 8.982 -6.995 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.830 -7.692 -3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.698 -9.213 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 17 7.580 -9.927 -1.189 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.627 -8.702 -0.346 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.135 -7.776 -0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.991 -7.365 -1.462 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.343 -10.266 -2.201 1.00 0.00 H new ATOM 0 HD22 LEU A 17 5.720 -9.023 -3.418 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.654 -10.537 -3.374 1.00 0.00 H new ATOM 272 N PHE A 18 9.486 -8.822 0.359 1.00 0.00 N ATOM 273 CA PHE A 18 9.965 -9.658 1.439 1.00 0.00 C ATOM 274 C PHE A 18 8.818 -10.355 2.146 1.00 0.00 C ATOM 275 O PHE A 18 7.725 -9.840 2.200 1.00 0.00 O ATOM 276 CB PHE A 18 10.711 -8.800 2.474 1.00 0.00 C ATOM 277 CG PHE A 18 12.133 -8.394 2.148 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.423 -7.538 1.100 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.183 -8.878 2.910 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.725 -7.182 0.821 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.486 -8.523 2.635 1.00 0.00 C ATOM 282 CZ PHE A 18 14.757 -7.675 1.588 1.00 0.00 C ATOM 0 H PHE A 18 8.701 -8.228 0.626 1.00 0.00 H new ATOM 0 HA PHE A 18 10.630 -10.405 1.005 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.131 -7.892 2.640 1.00 0.00 H new ATOM 0 HB3 PHE A 18 10.724 -9.346 3.417 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.620 -7.145 0.494 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.977 -9.545 3.734 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.936 -6.515 -0.001 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.292 -8.910 3.241 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.777 -7.396 1.367 1.00 0.00 H new ATOM 292 N ARG A 19 9.089 -11.534 2.645 1.00 0.00 N ATOM 293 CA ARG A 19 8.254 -12.278 3.465 1.00 0.00 C ATOM 294 C ARG A 19 8.879 -12.446 4.778 1.00 0.00 C ATOM 295 O ARG A 19 10.088 -12.517 4.903 1.00 0.00 O ATOM 296 CB ARG A 19 7.990 -13.638 2.930 1.00 0.00 C ATOM 297 CG ARG A 19 9.167 -14.370 2.288 1.00 0.00 C ATOM 298 CD ARG A 19 8.836 -15.835 2.035 1.00 0.00 C ATOM 299 NE ARG A 19 8.978 -16.641 3.259 1.00 0.00 N ATOM 300 CZ ARG A 19 8.008 -17.326 3.889 1.00 0.00 C ATOM 301 NH1 ARG A 19 6.751 -17.289 3.456 1.00 0.00 N ATOM 302 NH2 ARG A 19 8.322 -18.065 4.949 1.00 0.00 N ATOM 0 H ARG A 19 9.973 -12.008 2.456 1.00 0.00 H new ATOM 0 HA ARG A 19 7.313 -11.732 3.525 1.00 0.00 H new ATOM 0 HB2 ARG A 19 7.611 -14.255 3.745 1.00 0.00 H new ATOM 0 HB3 ARG A 19 7.193 -13.562 2.190 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.429 -13.886 1.347 1.00 0.00 H new ATOM 0 HG3 ARG A 19 10.040 -14.299 2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.816 -15.919 1.660 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.494 -16.229 1.261 1.00 0.00 H new ATOM 0 HE ARG A 19 9.910 -16.684 3.672 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.511 -16.735 2.634 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.027 -17.815 3.946 1.00 0.00 H new ATOM 0 HH21 ARG A 19 9.288 -18.106 5.274 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.597 -18.590 5.437 1.00 0.00 H new ATOM 316 N PHE A 20 8.073 -12.501 5.712 1.00 0.00 N ATOM 317 CA PHE A 20 8.471 -12.691 7.055 1.00 0.00 C ATOM 318 C PHE A 20 8.512 -14.152 7.255 1.00 0.00 C ATOM 319 O PHE A 20 7.517 -14.853 7.093 1.00 0.00 O ATOM 320 CB PHE A 20 7.479 -12.113 8.024 1.00 0.00 C ATOM 321 CG PHE A 20 7.954 -12.034 9.452 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.750 -10.982 9.873 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.589 -13.007 10.375 1.00 0.00 C ATOM 324 CE1 PHE A 20 9.174 -10.899 11.186 1.00 0.00 C ATOM 325 CE2 PHE A 20 8.012 -12.930 11.686 1.00 0.00 C ATOM 326 CZ PHE A 20 8.804 -11.875 12.092 1.00 0.00 C ATOM 0 H PHE A 20 7.064 -12.414 5.589 1.00 0.00 H new ATOM 0 HA PHE A 20 9.427 -12.198 7.232 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.210 -11.111 7.691 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.570 -12.714 7.992 1.00 0.00 H new ATOM 0 HD1 PHE A 20 9.043 -10.218 9.168 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.967 -13.833 10.062 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.793 -10.073 11.503 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.724 -13.694 12.393 1.00 0.00 H new ATOM 0 HZ PHE A 20 9.135 -11.812 13.118 1.00 0.00 H new ATOM 336 N ASP A 21 9.613 -14.599 7.573 1.00 0.00 N ATOM 337 CA ASP A 21 9.801 -15.991 7.804 1.00 0.00 C ATOM 338 C ASP A 21 9.511 -16.275 9.184 1.00 0.00 C ATOM 339 O ASP A 21 10.039 -15.685 10.047 1.00 0.00 O ATOM 340 CB ASP A 21 11.174 -16.527 7.510 1.00 0.00 C ATOM 341 CG ASP A 21 11.021 -17.934 7.023 1.00 0.00 C ATOM 342 OD1 ASP A 21 10.851 -18.134 5.818 1.00 0.00 O ATOM 343 OD2 ASP A 21 11.027 -18.841 7.836 1.00 0.00 O ATOM 0 H ASP A 21 10.451 -14.030 7.693 1.00 0.00 H new ATOM 0 HA ASP A 21 9.126 -16.484 7.104 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.670 -15.914 6.758 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.795 -16.498 8.405 1.00 0.00 H new ATOM 348 N ALA A 22 8.617 -17.088 9.355 1.00 0.00 N ATOM 349 CA ALA A 22 8.194 -17.546 10.648 1.00 0.00 C ATOM 350 C ALA A 22 9.284 -18.390 11.264 1.00 0.00 C ATOM 351 O ALA A 22 9.582 -18.283 12.454 1.00 0.00 O ATOM 352 CB ALA A 22 6.911 -18.332 10.525 1.00 0.00 C ATOM 0 H ALA A 22 8.096 -17.509 8.585 1.00 0.00 H new ATOM 0 HA ALA A 22 8.006 -16.689 11.295 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.598 -18.675 11.511 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.135 -17.697 10.099 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.072 -19.193 9.876 1.00 0.00 H new ATOM 358 N GLU A 23 9.941 -19.157 10.422 1.00 0.00 N ATOM 359 CA GLU A 23 10.975 -20.044 10.851 1.00 0.00 C ATOM 360 C GLU A 23 12.255 -19.272 11.049 1.00 0.00 C ATOM 361 O GLU A 23 13.066 -19.617 11.903 1.00 0.00 O ATOM 362 CB GLU A 23 11.169 -21.157 9.839 1.00 0.00 C ATOM 363 CG GLU A 23 9.913 -21.965 9.591 1.00 0.00 C ATOM 364 CD GLU A 23 10.115 -23.036 8.572 1.00 0.00 C ATOM 365 OE1 GLU A 23 10.772 -24.053 8.885 1.00 0.00 O ATOM 366 OE2 GLU A 23 9.639 -22.888 7.425 1.00 0.00 O ATOM 0 H GLU A 23 9.765 -19.176 9.418 1.00 0.00 H new ATOM 0 HA GLU A 23 10.688 -20.497 11.800 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.508 -20.727 8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 23 11.958 -21.823 10.188 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.584 -22.416 10.527 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.116 -21.299 9.261 1.00 0.00 H new ATOM 373 N VAL A 24 12.433 -18.190 10.295 1.00 0.00 N ATOM 374 CA VAL A 24 13.649 -17.403 10.483 1.00 0.00 C ATOM 375 C VAL A 24 13.373 -16.303 11.441 1.00 0.00 C ATOM 376 O VAL A 24 14.284 -15.645 11.983 1.00 0.00 O ATOM 377 CB VAL A 24 14.214 -16.773 9.182 1.00 0.00 C ATOM 378 CG1 VAL A 24 15.653 -16.280 9.358 1.00 0.00 C ATOM 379 CG2 VAL A 24 14.136 -17.741 8.093 1.00 0.00 C ATOM 0 H VAL A 24 11.787 -17.850 9.582 1.00 0.00 H new ATOM 0 HA VAL A 24 14.400 -18.101 10.852 1.00 0.00 H new ATOM 0 HB VAL A 24 13.605 -15.902 8.941 1.00 0.00 H new ATOM 0 HG11 VAL A 24 16.006 -15.847 8.422 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.685 -15.524 10.143 1.00 0.00 H new ATOM 0 HG13 VAL A 24 16.293 -17.118 9.635 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.533 -17.296 7.181 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.720 -18.625 8.349 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.096 -18.027 7.934 1.00 0.00 H new ATOM 389 N SER A 25 12.091 -16.175 11.714 1.00 0.00 N ATOM 390 CA SER A 25 11.522 -15.046 12.374 1.00 0.00 C ATOM 391 C SER A 25 11.950 -13.824 11.667 1.00 0.00 C ATOM 392 O SER A 25 12.059 -12.754 12.276 1.00 0.00 O ATOM 393 CB SER A 25 11.962 -15.019 13.765 1.00 0.00 C ATOM 394 OG SER A 25 11.283 -15.961 14.593 1.00 0.00 O ATOM 0 H SER A 25 11.402 -16.886 11.469 1.00 0.00 H new ATOM 0 HA SER A 25 10.434 -15.107 12.362 1.00 0.00 H new ATOM 0 HB2 SER A 25 13.033 -15.219 13.803 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.810 -14.017 14.167 1.00 0.00 H new ATOM 0 HG SER A 25 11.623 -15.895 15.510 1.00 0.00 H new ATOM 400 N GLN A 26 12.132 -13.919 10.358 1.00 0.00 N ATOM 401 CA GLN A 26 12.741 -12.790 9.795 1.00 0.00 C ATOM 402 C GLN A 26 12.277 -12.519 8.386 1.00 0.00 C ATOM 403 O GLN A 26 11.973 -13.428 7.655 1.00 0.00 O ATOM 404 CB GLN A 26 14.251 -12.949 9.798 1.00 0.00 C ATOM 405 CG GLN A 26 15.036 -11.702 9.414 1.00 0.00 C ATOM 406 CD GLN A 26 16.513 -11.972 9.277 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.277 -11.869 10.236 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.927 -12.320 8.094 1.00 0.00 N ATOM 0 H GLN A 26 11.886 -14.694 9.742 1.00 0.00 H new ATOM 0 HA GLN A 26 12.448 -11.940 10.412 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.565 -13.264 10.793 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.517 -13.752 9.111 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.652 -11.310 8.472 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.879 -10.931 10.168 1.00 0.00 H new ATOM 0 HE21 GLN A 26 16.263 -12.395 7.323 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.915 -12.518 7.937 1.00 0.00 H new ATOM 417 N TRP A 27 12.276 -11.278 8.015 1.00 0.00 N ATOM 418 CA TRP A 27 11.978 -10.844 6.719 1.00 0.00 C ATOM 419 C TRP A 27 13.088 -11.270 5.733 1.00 0.00 C ATOM 420 O TRP A 27 14.276 -11.010 5.952 1.00 0.00 O ATOM 421 CB TRP A 27 11.778 -9.318 6.763 1.00 0.00 C ATOM 422 CG TRP A 27 12.570 -8.614 7.850 1.00 0.00 C ATOM 423 CD1 TRP A 27 12.160 -8.380 9.138 1.00 0.00 C ATOM 424 CD2 TRP A 27 13.888 -8.060 7.746 1.00 0.00 C ATOM 425 NE1 TRP A 27 13.150 -7.756 9.842 1.00 0.00 N ATOM 426 CE2 TRP A 27 14.217 -7.531 9.009 1.00 0.00 C ATOM 427 CE3 TRP A 27 14.824 -7.962 6.711 1.00 0.00 C ATOM 428 CZ2 TRP A 27 15.437 -6.923 9.264 1.00 0.00 C ATOM 429 CZ3 TRP A 27 16.035 -7.353 6.968 1.00 0.00 C ATOM 430 CH2 TRP A 27 16.331 -6.840 8.234 1.00 0.00 C ATOM 0 H TRP A 27 12.497 -10.514 8.653 1.00 0.00 H new ATOM 0 HA TRP A 27 11.060 -11.308 6.357 1.00 0.00 H new ATOM 0 HB2 TRP A 27 12.058 -8.899 5.797 1.00 0.00 H new ATOM 0 HB3 TRP A 27 10.718 -9.106 6.907 1.00 0.00 H new ATOM 0 HD1 TRP A 27 11.194 -8.650 9.538 1.00 0.00 H new ATOM 0 HE1 TRP A 27 13.104 -7.499 10.828 1.00 0.00 H new ATOM 0 HE3 TRP A 27 14.603 -8.355 5.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 15.672 -6.529 10.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 16.767 -7.271 6.178 1.00 0.00 H new ATOM 0 HH2 TRP A 27 17.288 -6.368 8.402 1.00 0.00 H new ATOM 441 N LYS A 28 12.690 -11.984 4.717 1.00 0.00 N ATOM 442 CA LYS A 28 13.555 -12.458 3.655 1.00 0.00 C ATOM 443 C LYS A 28 12.833 -12.205 2.376 1.00 0.00 C ATOM 444 O LYS A 28 11.617 -12.277 2.344 1.00 0.00 O ATOM 445 CB LYS A 28 13.889 -13.948 3.835 1.00 0.00 C ATOM 446 CG LYS A 28 14.874 -14.505 2.816 1.00 0.00 C ATOM 447 CD LYS A 28 15.102 -15.993 3.016 1.00 0.00 C ATOM 448 CE LYS A 28 16.124 -16.544 2.027 1.00 0.00 C ATOM 449 NZ LYS A 28 15.700 -16.387 0.613 1.00 0.00 N ATOM 0 H LYS A 28 11.718 -12.266 4.595 1.00 0.00 H new ATOM 0 HA LYS A 28 14.511 -11.935 3.664 1.00 0.00 H new ATOM 0 HB2 LYS A 28 14.297 -14.097 4.835 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.965 -14.523 3.779 1.00 0.00 H new ATOM 0 HG2 LYS A 28 14.497 -14.326 1.809 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.823 -13.976 2.900 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.446 -16.175 4.034 1.00 0.00 H new ATOM 0 HD3 LYS A 28 14.158 -16.525 2.898 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.076 -16.035 2.174 1.00 0.00 H new ATOM 0 HE3 LYS A 28 16.292 -17.601 2.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 16.255 -17.028 0.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 14.690 -16.618 0.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 15.858 -15.405 0.310 1.00 0.00 H new ATOM 463 N GLU A 29 13.560 -11.887 1.348 1.00 0.00 N ATOM 464 CA GLU A 29 13.019 -11.455 0.160 1.00 0.00 C ATOM 465 C GLU A 29 12.174 -12.512 -0.500 1.00 0.00 C ATOM 466 O GLU A 29 12.465 -13.704 -0.454 1.00 0.00 O ATOM 467 CB GLU A 29 14.089 -10.881 -0.803 1.00 0.00 C ATOM 468 CG GLU A 29 15.079 -11.886 -1.408 1.00 0.00 C ATOM 469 CD GLU A 29 15.875 -12.666 -0.390 1.00 0.00 C ATOM 470 OE1 GLU A 29 16.697 -12.072 0.323 1.00 0.00 O ATOM 471 OE2 GLU A 29 15.698 -13.885 -0.294 1.00 0.00 O ATOM 0 H GLU A 29 14.579 -11.934 1.345 1.00 0.00 H new ATOM 0 HA GLU A 29 12.352 -10.630 0.410 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.575 -10.375 -1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.659 -10.123 -0.266 1.00 0.00 H new ATOM 0 HG2 GLU A 29 14.529 -12.587 -2.036 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.770 -11.350 -2.059 1.00 0.00 H new ATOM 478 N ARG A 30 11.137 -12.063 -1.065 1.00 0.00 N ATOM 479 CA ARG A 30 10.256 -12.915 -1.833 1.00 0.00 C ATOM 480 C ARG A 30 10.752 -12.862 -3.249 1.00 0.00 C ATOM 481 O ARG A 30 10.570 -13.786 -4.030 1.00 0.00 O ATOM 482 CB ARG A 30 8.762 -12.492 -1.824 1.00 0.00 C ATOM 483 CG ARG A 30 7.973 -12.729 -0.531 1.00 0.00 C ATOM 484 CD ARG A 30 6.471 -12.501 -0.770 1.00 0.00 C ATOM 485 NE ARG A 30 5.618 -12.647 0.428 1.00 0.00 N ATOM 486 CZ ARG A 30 4.258 -12.773 0.406 1.00 0.00 C ATOM 487 NH1 ARG A 30 3.598 -12.895 -0.762 1.00 0.00 N ATOM 488 NH2 ARG A 30 3.582 -12.834 1.551 1.00 0.00 N ATOM 0 H ARG A 30 10.846 -11.086 -1.025 1.00 0.00 H new ATOM 0 HA ARG A 30 10.281 -13.908 -1.383 1.00 0.00 H new ATOM 0 HB2 ARG A 30 8.711 -11.429 -2.061 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.256 -13.023 -2.630 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.141 -13.746 -0.176 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.330 -12.056 0.249 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.331 -11.500 -1.177 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.129 -13.204 -1.529 1.00 0.00 H new ATOM 0 HE ARG A 30 6.079 -12.654 1.338 1.00 0.00 H new ATOM 0 HH11 ARG A 30 4.114 -12.894 -1.642 1.00 0.00 H new ATOM 0 HH12 ARG A 30 2.582 -12.988 -0.766 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.080 -12.787 2.440 1.00 0.00 H new ATOM 0 HH22 ARG A 30 2.566 -12.928 1.539 1.00 0.00 H new ATOM 502 N GLY A 31 11.368 -11.734 -3.565 1.00 0.00 N ATOM 503 CA GLY A 31 11.924 -11.506 -4.831 1.00 0.00 C ATOM 504 C GLY A 31 12.175 -10.037 -5.038 1.00 0.00 C ATOM 505 O GLY A 31 12.210 -9.255 -4.084 1.00 0.00 O ATOM 0 H GLY A 31 11.482 -10.955 -2.916 1.00 0.00 H new ATOM 0 HA2 GLY A 31 12.859 -12.058 -4.929 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.251 -11.879 -5.603 1.00 0.00 H new ATOM 509 N LEU A 32 12.257 -9.685 -6.260 1.00 0.00 N ATOM 510 CA LEU A 32 12.557 -8.361 -6.760 1.00 0.00 C ATOM 511 C LEU A 32 11.514 -8.074 -7.803 1.00 0.00 C ATOM 512 O LEU A 32 11.159 -8.982 -8.580 1.00 0.00 O ATOM 513 CB LEU A 32 13.941 -8.306 -7.489 1.00 0.00 C ATOM 514 CG LEU A 32 15.225 -8.708 -6.733 1.00 0.00 C ATOM 515 CD1 LEU A 32 15.337 -8.011 -5.413 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.380 -10.212 -6.591 1.00 0.00 C ATOM 0 H LEU A 32 12.108 -10.354 -7.016 1.00 0.00 H new ATOM 0 HA LEU A 32 12.575 -7.657 -5.928 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.870 -8.944 -8.370 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.080 -7.285 -7.845 1.00 0.00 H new ATOM 0 HG LEU A 32 16.058 -8.372 -7.350 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.255 -8.322 -4.914 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.358 -6.933 -5.572 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.480 -8.270 -4.791 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.301 -10.434 -6.051 1.00 0.00 H new ATOM 0 HD22 LEU A 32 14.530 -10.615 -6.040 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.420 -10.669 -7.580 1.00 0.00 H new ATOM 528 N GLY A 33 11.012 -6.880 -7.855 1.00 0.00 N ATOM 529 CA GLY A 33 10.030 -6.603 -8.847 1.00 0.00 C ATOM 530 C GLY A 33 9.715 -5.151 -9.006 1.00 0.00 C ATOM 531 O GLY A 33 10.560 -4.296 -8.798 1.00 0.00 O ATOM 0 H GLY A 33 11.258 -6.104 -7.241 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.375 -6.996 -9.804 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.114 -7.137 -8.595 1.00 0.00 H new ATOM 535 N ASN A 34 8.504 -4.916 -9.369 1.00 0.00 N ATOM 536 CA ASN A 34 7.910 -3.629 -9.625 1.00 0.00 C ATOM 537 C ASN A 34 6.658 -3.616 -8.898 1.00 0.00 C ATOM 538 O ASN A 34 5.849 -4.555 -8.979 1.00 0.00 O ATOM 539 CB ASN A 34 7.630 -3.493 -11.091 1.00 0.00 C ATOM 540 CG ASN A 34 6.864 -2.242 -11.439 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.441 -1.194 -11.683 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.557 -2.364 -11.507 1.00 0.00 N ATOM 0 H ASN A 34 7.838 -5.676 -9.509 1.00 0.00 H new ATOM 0 HA ASN A 34 8.566 -2.814 -9.319 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.574 -3.496 -11.636 1.00 0.00 H new ATOM 0 HB3 ASN A 34 7.065 -4.362 -11.428 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.983 -1.564 -11.772 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.117 -3.259 -11.295 1.00 0.00 H new ATOM 549 N LEU A 35 6.519 -2.616 -8.163 1.00 0.00 N ATOM 550 CA LEU A 35 5.410 -2.408 -7.407 1.00 0.00 C ATOM 551 C LEU A 35 4.433 -1.692 -8.259 1.00 0.00 C ATOM 552 O LEU A 35 4.689 -0.621 -8.752 1.00 0.00 O ATOM 553 CB LEU A 35 5.779 -1.683 -6.082 1.00 0.00 C ATOM 554 CG LEU A 35 4.680 -1.377 -5.035 1.00 0.00 C ATOM 555 CD1 LEU A 35 5.334 -0.969 -3.724 1.00 0.00 C ATOM 556 CD2 LEU A 35 3.785 -0.241 -5.486 1.00 0.00 C ATOM 0 H LEU A 35 7.223 -1.883 -8.074 1.00 0.00 H new ATOM 0 HA LEU A 35 4.949 -3.340 -7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.542 -2.283 -5.586 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.244 -0.735 -6.350 1.00 0.00 H new ATOM 0 HG LEU A 35 4.078 -2.277 -4.912 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.563 -0.753 -2.985 1.00 0.00 H new ATOM 0 HD12 LEU A 35 5.965 -1.782 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.944 -0.080 -3.883 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.025 -0.053 -4.727 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.384 0.658 -5.631 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.301 -0.510 -6.425 1.00 0.00 H new ATOM 568 N LYS A 36 3.364 -2.311 -8.438 1.00 0.00 N ATOM 569 CA LYS A 36 2.335 -1.859 -9.242 1.00 0.00 C ATOM 570 C LYS A 36 1.268 -1.320 -8.302 1.00 0.00 C ATOM 571 O LYS A 36 0.936 -1.971 -7.306 1.00 0.00 O ATOM 572 CB LYS A 36 1.781 -3.071 -9.983 1.00 0.00 C ATOM 573 CG LYS A 36 1.008 -2.832 -11.263 1.00 0.00 C ATOM 574 CD LYS A 36 1.941 -2.598 -12.432 1.00 0.00 C ATOM 575 CE LYS A 36 1.202 -2.748 -13.748 1.00 0.00 C ATOM 576 NZ LYS A 36 2.106 -2.662 -14.903 1.00 0.00 N ATOM 0 H LYS A 36 3.167 -3.210 -7.998 1.00 0.00 H new ATOM 0 HA LYS A 36 2.654 -1.096 -9.952 1.00 0.00 H new ATOM 0 HB2 LYS A 36 2.617 -3.730 -10.217 1.00 0.00 H new ATOM 0 HB3 LYS A 36 1.130 -3.613 -9.297 1.00 0.00 H new ATOM 0 HG2 LYS A 36 0.369 -3.691 -11.471 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.353 -1.970 -11.139 1.00 0.00 H new ATOM 0 HD2 LYS A 36 2.373 -1.600 -12.364 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.768 -3.307 -12.391 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.683 -3.707 -13.765 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.440 -1.972 -13.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 1.559 -2.770 -15.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 2.582 -1.737 -14.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 2.818 -3.418 -14.844 1.00 0.00 H new ATOM 590 N ILE A 37 0.734 -0.188 -8.591 1.00 0.00 N ATOM 591 CA ILE A 37 -0.312 0.337 -7.789 1.00 0.00 C ATOM 592 C ILE A 37 -1.561 0.273 -8.529 1.00 0.00 C ATOM 593 O ILE A 37 -1.678 0.814 -9.645 1.00 0.00 O ATOM 594 CB ILE A 37 -0.055 1.810 -7.412 1.00 0.00 C ATOM 595 CG1 ILE A 37 1.032 1.876 -6.373 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.344 2.529 -6.922 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.605 1.374 -4.998 1.00 0.00 C ATOM 0 H ILE A 37 1.006 0.396 -9.382 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.361 -0.258 -6.877 1.00 0.00 H new ATOM 0 HB ILE A 37 0.267 2.339 -8.309 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.884 1.288 -6.715 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.372 2.908 -6.283 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.110 3.563 -6.669 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.094 2.510 -7.713 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.733 2.019 -6.041 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.443 1.454 -4.305 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.227 1.977 -4.633 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.293 0.332 -5.072 1.00 0.00 H new ATOM 609 N LEU A 38 -2.485 -0.409 -7.944 1.00 0.00 N ATOM 610 CA LEU A 38 -3.780 -0.429 -8.484 1.00 0.00 C ATOM 611 C LEU A 38 -4.641 0.353 -7.531 1.00 0.00 C ATOM 612 O LEU A 38 -4.606 0.155 -6.324 1.00 0.00 O ATOM 613 CB LEU A 38 -4.316 -1.877 -8.662 1.00 0.00 C ATOM 614 CG LEU A 38 -3.614 -2.804 -9.712 1.00 0.00 C ATOM 615 CD1 LEU A 38 -2.148 -3.037 -9.405 1.00 0.00 C ATOM 616 CD2 LEU A 38 -4.315 -4.142 -9.789 1.00 0.00 C ATOM 0 H LEU A 38 -2.358 -0.956 -7.093 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.786 0.010 -9.482 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.263 -2.373 -7.693 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.371 -1.811 -8.929 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.679 -2.284 -10.668 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.716 -3.686 -10.166 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.621 -2.083 -9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.052 -3.510 -8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.814 -4.773 -10.523 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.284 -4.626 -8.813 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.353 -3.992 -10.087 1.00 0.00 H new ATOM 628 N LYS A 39 -5.382 1.225 -8.067 1.00 0.00 N ATOM 629 CA LYS A 39 -6.225 2.097 -7.325 1.00 0.00 C ATOM 630 C LYS A 39 -7.633 1.977 -7.796 1.00 0.00 C ATOM 631 O LYS A 39 -7.896 2.115 -8.983 1.00 0.00 O ATOM 632 CB LYS A 39 -5.753 3.528 -7.539 1.00 0.00 C ATOM 633 CG LYS A 39 -6.700 4.592 -7.027 1.00 0.00 C ATOM 634 CD LYS A 39 -6.230 5.966 -7.413 1.00 0.00 C ATOM 635 CE LYS A 39 -7.224 7.005 -6.979 1.00 0.00 C ATOM 636 NZ LYS A 39 -8.559 6.811 -7.606 1.00 0.00 N ATOM 0 H LYS A 39 -5.431 1.370 -9.075 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.179 1.831 -6.269 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.788 3.654 -7.049 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.592 3.687 -8.605 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.698 4.419 -7.430 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.778 4.522 -5.942 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.262 6.167 -6.955 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.089 6.018 -8.493 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.327 6.974 -5.894 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.846 7.995 -7.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.103 7.695 -7.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.438 6.546 -8.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.070 6.055 -7.107 1.00 0.00 H new ATOM 650 N ASN A 40 -8.528 1.741 -6.881 1.00 0.00 N ATOM 651 CA ASN A 40 -9.946 1.712 -7.204 1.00 0.00 C ATOM 652 C ASN A 40 -10.434 3.057 -7.681 1.00 0.00 C ATOM 653 O ASN A 40 -9.947 4.116 -7.232 1.00 0.00 O ATOM 654 CB ASN A 40 -10.798 1.284 -6.009 1.00 0.00 C ATOM 655 CG ASN A 40 -10.843 -0.206 -5.829 1.00 0.00 C ATOM 656 OD1 ASN A 40 -10.009 -0.813 -5.162 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.829 -0.796 -6.392 1.00 0.00 N ATOM 0 H ASN A 40 -8.312 1.564 -5.900 1.00 0.00 H new ATOM 0 HA ASN A 40 -10.055 0.978 -8.003 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.401 1.743 -5.103 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -11.813 1.660 -6.139 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.943 -1.805 -6.295 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -12.501 -0.257 -6.938 1.00 0.00 H new ATOM 664 N GLU A 41 -11.367 3.016 -8.602 1.00 0.00 N ATOM 665 CA GLU A 41 -12.020 4.115 -9.148 1.00 0.00 C ATOM 666 C GLU A 41 -12.812 4.842 -8.059 1.00 0.00 C ATOM 667 O GLU A 41 -13.036 6.049 -8.130 1.00 0.00 O ATOM 668 CB GLU A 41 -12.923 3.529 -10.184 1.00 0.00 C ATOM 669 CG GLU A 41 -12.229 3.103 -11.467 1.00 0.00 C ATOM 670 CD GLU A 41 -11.954 4.262 -12.391 1.00 0.00 C ATOM 671 OE1 GLU A 41 -11.088 5.109 -12.093 1.00 0.00 O ATOM 672 OE2 GLU A 41 -12.631 4.373 -13.428 1.00 0.00 O ATOM 0 H GLU A 41 -11.692 2.134 -8.999 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.341 4.852 -9.576 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.429 2.663 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.693 4.260 -10.430 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.289 2.609 -11.220 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.848 2.370 -11.984 1.00 0.00 H new ATOM 679 N VAL A 42 -13.176 4.089 -7.029 1.00 0.00 N ATOM 680 CA VAL A 42 -13.861 4.549 -5.894 1.00 0.00 C ATOM 681 C VAL A 42 -12.873 5.247 -4.965 1.00 0.00 C ATOM 682 O VAL A 42 -13.241 6.106 -4.163 1.00 0.00 O ATOM 683 CB VAL A 42 -14.463 3.298 -5.235 1.00 0.00 C ATOM 684 CG1 VAL A 42 -14.780 3.509 -3.802 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.688 2.853 -5.993 1.00 0.00 C ATOM 0 H VAL A 42 -12.976 3.090 -6.990 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.644 5.269 -6.135 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.709 2.512 -5.276 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.203 2.595 -3.384 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.869 3.767 -3.262 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -15.502 4.320 -3.705 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.107 1.966 -5.518 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.429 3.652 -5.988 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -15.414 2.619 -7.022 1.00 0.00 H new ATOM 695 N ASN A 43 -11.598 4.880 -5.138 1.00 0.00 N ATOM 696 CA ASN A 43 -10.488 5.374 -4.339 1.00 0.00 C ATOM 697 C ASN A 43 -10.698 4.921 -2.898 1.00 0.00 C ATOM 698 O ASN A 43 -10.260 5.526 -1.936 1.00 0.00 O ATOM 699 CB ASN A 43 -10.385 6.901 -4.538 1.00 0.00 C ATOM 700 CG ASN A 43 -9.317 7.619 -3.717 1.00 0.00 C ATOM 701 OD1 ASN A 43 -8.158 7.655 -4.116 1.00 0.00 O ATOM 702 ND2 ASN A 43 -9.710 8.259 -2.642 1.00 0.00 N ATOM 0 H ASN A 43 -11.310 4.215 -5.856 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.525 4.967 -4.647 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -10.194 7.097 -5.593 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.353 7.343 -4.302 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -9.042 8.812 -2.105 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -10.684 8.204 -2.343 1.00 0.00 H new ATOM 709 N GLY A 44 -11.323 3.768 -2.788 1.00 0.00 N ATOM 710 CA GLY A 44 -11.630 3.232 -1.479 1.00 0.00 C ATOM 711 C GLY A 44 -10.495 2.395 -0.981 1.00 0.00 C ATOM 712 O GLY A 44 -10.038 2.530 0.164 1.00 0.00 O ATOM 0 H GLY A 44 -11.624 3.192 -3.574 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.823 4.047 -0.781 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.539 2.632 -1.528 1.00 0.00 H new ATOM 716 N LYS A 45 -10.052 1.523 -1.831 1.00 0.00 N ATOM 717 CA LYS A 45 -8.923 0.706 -1.565 1.00 0.00 C ATOM 718 C LYS A 45 -7.943 0.843 -2.697 1.00 0.00 C ATOM 719 O LYS A 45 -8.324 0.935 -3.867 1.00 0.00 O ATOM 720 CB LYS A 45 -9.326 -0.768 -1.412 1.00 0.00 C ATOM 721 CG LYS A 45 -10.237 -1.053 -0.232 1.00 0.00 C ATOM 722 CD LYS A 45 -10.614 -2.521 -0.163 1.00 0.00 C ATOM 723 CE LYS A 45 -11.511 -2.810 1.031 1.00 0.00 C ATOM 724 NZ LYS A 45 -12.786 -2.052 0.976 1.00 0.00 N ATOM 0 H LYS A 45 -10.476 1.360 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.470 1.032 -0.629 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.824 -1.092 -2.326 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.423 -1.370 -1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.739 -0.760 0.692 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.140 -0.448 -0.313 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.125 -2.810 -1.082 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.711 -3.127 -0.096 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.727 -3.878 1.070 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -10.981 -2.559 1.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.450 -2.438 1.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.603 -1.050 1.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -13.199 -2.137 0.025 1.00 0.00 H new ATOM 738 N LEU A 46 -6.713 0.953 -2.370 1.00 0.00 N ATOM 739 CA LEU A 46 -5.706 0.914 -3.302 1.00 0.00 C ATOM 740 C LEU A 46 -4.829 -0.186 -2.901 1.00 0.00 C ATOM 741 O LEU A 46 -4.764 -0.542 -1.730 1.00 0.00 O ATOM 742 CB LEU A 46 -4.883 2.149 -3.348 1.00 0.00 C ATOM 743 CG LEU A 46 -5.530 3.481 -3.769 1.00 0.00 C ATOM 744 CD1 LEU A 46 -6.537 4.008 -2.752 1.00 0.00 C ATOM 745 CD2 LEU A 46 -4.454 4.511 -4.066 1.00 0.00 C ATOM 0 H LEU A 46 -6.391 1.076 -1.410 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.155 0.798 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.457 2.293 -2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.052 1.961 -4.028 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.101 3.288 -4.677 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.956 4.949 -3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.338 3.280 -2.622 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.038 4.172 -1.797 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.921 5.450 -4.363 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.849 4.673 -3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -3.818 4.150 -4.875 1.00 0.00 H new ATOM 757 N ARG A 47 -4.178 -0.701 -3.822 1.00 0.00 N ATOM 758 CA ARG A 47 -3.307 -1.827 -3.611 1.00 0.00 C ATOM 759 C ARG A 47 -1.972 -1.517 -4.178 1.00 0.00 C ATOM 760 O ARG A 47 -1.835 -0.740 -5.118 1.00 0.00 O ATOM 761 CB ARG A 47 -3.734 -3.072 -4.377 1.00 0.00 C ATOM 762 CG ARG A 47 -5.096 -3.007 -5.066 1.00 0.00 C ATOM 763 CD ARG A 47 -6.248 -3.163 -4.076 1.00 0.00 C ATOM 764 NE ARG A 47 -7.549 -2.884 -4.692 1.00 0.00 N ATOM 765 CZ ARG A 47 -8.138 -3.620 -5.645 1.00 0.00 C ATOM 766 NH1 ARG A 47 -7.612 -4.772 -6.054 1.00 0.00 N ATOM 767 NH2 ARG A 47 -9.279 -3.222 -6.152 1.00 0.00 N ATOM 0 H ARG A 47 -4.208 -0.372 -4.787 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.322 -2.008 -2.536 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.978 -3.285 -5.133 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.740 -3.914 -3.685 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -5.193 -2.055 -5.587 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.158 -3.791 -5.820 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.247 -4.177 -3.677 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -6.095 -2.489 -3.233 1.00 0.00 H new ATOM 0 HE ARG A 47 -8.050 -2.057 -4.367 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -6.743 -5.111 -5.641 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.078 -5.316 -6.781 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -9.711 -2.359 -5.821 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -9.735 -3.775 -6.878 1.00 0.00 H new ATOM 781 N MET A 48 -1.051 -2.153 -3.634 1.00 0.00 N ATOM 782 CA MET A 48 0.264 -2.219 -4.060 1.00 0.00 C ATOM 783 C MET A 48 0.484 -3.682 -4.272 1.00 0.00 C ATOM 784 O MET A 48 0.336 -4.483 -3.339 1.00 0.00 O ATOM 785 CB MET A 48 1.223 -1.768 -2.935 1.00 0.00 C ATOM 786 CG MET A 48 0.872 -0.441 -2.305 1.00 0.00 C ATOM 787 SD MET A 48 2.130 0.201 -1.207 1.00 0.00 S ATOM 788 CE MET A 48 1.538 1.885 -1.045 1.00 0.00 C ATOM 0 H MET A 48 -1.209 -2.701 -2.788 1.00 0.00 H new ATOM 0 HA MET A 48 0.443 -1.593 -4.935 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.236 -2.532 -2.158 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.233 -1.708 -3.339 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.688 0.287 -3.095 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.059 -0.550 -1.749 1.00 0.00 H new ATOM 0 HE1 MET A 48 2.205 2.444 -0.388 1.00 0.00 H new ATOM 0 HE2 MET A 48 1.515 2.359 -2.026 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.534 1.878 -0.622 1.00 0.00 H new ATOM 798 N LEU A 49 0.771 -4.044 -5.440 1.00 0.00 N ATOM 799 CA LEU A 49 1.168 -5.388 -5.708 1.00 0.00 C ATOM 800 C LEU A 49 2.436 -5.399 -6.418 1.00 0.00 C ATOM 801 O LEU A 49 2.757 -4.467 -7.103 1.00 0.00 O ATOM 802 CB LEU A 49 0.148 -6.243 -6.425 1.00 0.00 C ATOM 803 CG LEU A 49 -0.373 -5.832 -7.831 1.00 0.00 C ATOM 804 CD1 LEU A 49 0.605 -6.166 -8.954 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.726 -6.471 -8.096 1.00 0.00 C ATOM 0 H LEU A 49 0.745 -3.433 -6.256 1.00 0.00 H new ATOM 0 HA LEU A 49 1.270 -5.854 -4.728 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.573 -7.242 -6.518 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.720 -6.326 -5.771 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.476 -4.747 -7.824 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.182 -5.854 -9.909 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.546 -5.642 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 49 0.786 -7.241 -8.971 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.081 -6.176 -9.084 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.630 -7.556 -8.054 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.439 -6.140 -7.341 1.00 0.00 H new ATOM 817 N MET A 50 3.179 -6.408 -6.263 1.00 0.00 N ATOM 818 CA MET A 50 4.371 -6.473 -6.842 1.00 0.00 C ATOM 819 C MET A 50 4.570 -7.794 -7.419 1.00 0.00 C ATOM 820 O MET A 50 4.357 -8.843 -6.807 1.00 0.00 O ATOM 821 CB MET A 50 5.437 -6.085 -5.915 1.00 0.00 C ATOM 822 CG MET A 50 5.372 -6.797 -4.606 1.00 0.00 C ATOM 823 SD MET A 50 6.148 -5.870 -3.273 1.00 0.00 S ATOM 824 CE MET A 50 4.997 -4.515 -3.081 1.00 0.00 C ATOM 0 H MET A 50 2.932 -7.223 -5.702 1.00 0.00 H new ATOM 0 HA MET A 50 4.412 -5.752 -7.658 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.403 -6.283 -6.380 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.382 -5.011 -5.739 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.329 -6.987 -4.352 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.859 -7.767 -4.700 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.243 -3.954 -2.180 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.062 -3.857 -3.948 1.00 0.00 H new ATOM 0 HE3 MET A 50 3.983 -4.907 -2.999 1.00 0.00 H new ATOM 834 N ARG A 51 4.882 -7.689 -8.558 1.00 0.00 N ATOM 835 CA ARG A 51 5.191 -8.734 -9.483 1.00 0.00 C ATOM 836 C ARG A 51 6.647 -8.717 -9.622 1.00 0.00 C ATOM 837 O ARG A 51 7.287 -7.663 -9.577 1.00 0.00 O ATOM 838 CB ARG A 51 4.531 -8.401 -10.809 1.00 0.00 C ATOM 839 CG ARG A 51 4.660 -9.298 -12.039 1.00 0.00 C ATOM 840 CD ARG A 51 3.935 -8.586 -13.177 1.00 0.00 C ATOM 841 NE ARG A 51 3.868 -9.312 -14.447 1.00 0.00 N ATOM 842 CZ ARG A 51 3.944 -8.701 -15.654 1.00 0.00 C ATOM 843 NH1 ARG A 51 4.437 -7.470 -15.758 1.00 0.00 N ATOM 844 NH2 ARG A 51 3.558 -9.331 -16.743 1.00 0.00 N ATOM 0 H ARG A 51 4.958 -6.770 -8.995 1.00 0.00 H new ATOM 0 HA ARG A 51 4.840 -9.713 -9.156 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.464 -8.298 -10.609 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.897 -7.417 -11.101 1.00 0.00 H new ATOM 0 HG2 ARG A 51 5.708 -9.462 -12.290 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.220 -10.277 -11.852 1.00 0.00 H new ATOM 0 HD2 ARG A 51 2.918 -8.366 -12.853 1.00 0.00 H new ATOM 0 HD3 ARG A 51 4.427 -7.630 -13.353 1.00 0.00 H new ATOM 0 HE ARG A 51 3.759 -10.326 -14.422 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.762 -6.979 -14.925 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.491 -7.017 -16.671 1.00 0.00 H new ATOM 0 HH21 ARG A 51 3.199 -10.284 -16.681 1.00 0.00 H new ATOM 0 HH22 ARG A 51 3.617 -8.866 -17.649 1.00 0.00 H new ATOM 858 N ARG A 52 7.155 -9.850 -9.764 1.00 0.00 N ATOM 859 CA ARG A 52 8.493 -10.049 -9.918 1.00 0.00 C ATOM 860 C ARG A 52 8.699 -9.861 -11.360 1.00 0.00 C ATOM 861 O ARG A 52 8.027 -10.451 -12.174 1.00 0.00 O ATOM 862 CB ARG A 52 8.862 -11.413 -9.367 1.00 0.00 C ATOM 863 CG ARG A 52 8.615 -11.562 -7.867 1.00 0.00 C ATOM 864 CD ARG A 52 8.876 -12.988 -7.379 1.00 0.00 C ATOM 865 NE ARG A 52 10.272 -13.421 -7.553 1.00 0.00 N ATOM 866 CZ ARG A 52 10.723 -14.669 -7.317 1.00 0.00 C ATOM 867 NH1 ARG A 52 9.875 -15.657 -7.019 1.00 0.00 N ATOM 868 NH2 ARG A 52 12.017 -14.934 -7.400 1.00 0.00 N ATOM 0 H ARG A 52 6.608 -10.711 -9.775 1.00 0.00 H new ATOM 0 HA ARG A 52 9.144 -9.369 -9.369 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.290 -12.175 -9.897 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.915 -11.604 -9.573 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.259 -10.870 -7.324 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.586 -11.285 -7.640 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.611 -13.057 -6.324 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.221 -13.673 -7.917 1.00 0.00 H new ATOM 0 HE ARG A 52 10.946 -12.727 -7.875 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.873 -15.471 -6.968 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.229 -16.597 -6.843 1.00 0.00 H new ATOM 0 HH21 ARG A 52 12.675 -14.193 -7.643 1.00 0.00 H new ATOM 0 HH22 ARG A 52 12.357 -15.879 -7.221 1.00 0.00 H new ATOM 882 N GLU A 53 9.562 -8.976 -11.630 1.00 0.00 N ATOM 883 CA GLU A 53 9.804 -8.391 -12.953 1.00 0.00 C ATOM 884 C GLU A 53 10.131 -9.380 -13.941 1.00 0.00 C ATOM 885 O GLU A 53 9.345 -9.638 -14.869 1.00 0.00 O ATOM 886 CB GLU A 53 10.889 -7.360 -12.856 1.00 0.00 C ATOM 887 CG GLU A 53 10.838 -6.301 -13.933 1.00 0.00 C ATOM 888 CD GLU A 53 11.909 -5.275 -13.750 1.00 0.00 C ATOM 889 OE1 GLU A 53 11.768 -4.390 -12.879 1.00 0.00 O ATOM 890 OE2 GLU A 53 12.927 -5.330 -14.449 1.00 0.00 O ATOM 0 H GLU A 53 10.178 -8.590 -10.915 1.00 0.00 H new ATOM 0 HA GLU A 53 8.878 -7.919 -13.281 1.00 0.00 H new ATOM 0 HB2 GLU A 53 10.827 -6.875 -11.882 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.856 -7.861 -12.901 1.00 0.00 H new ATOM 0 HG2 GLU A 53 10.947 -6.771 -14.911 1.00 0.00 H new ATOM 0 HG3 GLU A 53 9.862 -5.815 -13.920 1.00 0.00 H new ATOM 897 N GLN A 54 11.225 -9.969 -13.769 1.00 0.00 N ATOM 898 CA GLN A 54 11.642 -10.892 -14.748 1.00 0.00 C ATOM 899 C GLN A 54 10.956 -12.241 -14.528 1.00 0.00 C ATOM 900 O GLN A 54 11.064 -13.163 -15.336 1.00 0.00 O ATOM 901 CB GLN A 54 13.154 -11.036 -14.822 1.00 0.00 C ATOM 902 CG GLN A 54 13.903 -9.743 -15.079 1.00 0.00 C ATOM 903 CD GLN A 54 15.396 -9.963 -15.134 1.00 0.00 C ATOM 904 OE1 GLN A 54 16.081 -9.889 -14.121 1.00 0.00 O ATOM 905 NE2 GLN A 54 15.909 -10.238 -16.298 1.00 0.00 N ATOM 0 H GLN A 54 11.853 -9.842 -12.975 1.00 0.00 H new ATOM 0 HA GLN A 54 11.336 -10.498 -15.717 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.510 -11.466 -13.886 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.399 -11.745 -15.613 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.565 -9.307 -16.019 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.670 -9.025 -14.293 1.00 0.00 H new ATOM 0 HE21 GLN A 54 15.308 -10.292 -17.120 1.00 0.00 H new ATOM 0 HE22 GLN A 54 16.912 -10.400 -16.388 1.00 0.00 H new ATOM 914 N VAL A 55 10.270 -12.332 -13.422 1.00 0.00 N ATOM 915 CA VAL A 55 9.603 -13.509 -13.001 1.00 0.00 C ATOM 916 C VAL A 55 8.105 -13.477 -13.428 1.00 0.00 C ATOM 917 O VAL A 55 7.376 -14.472 -13.292 1.00 0.00 O ATOM 918 CB VAL A 55 9.770 -13.525 -11.456 1.00 0.00 C ATOM 919 CG1 VAL A 55 8.831 -14.471 -10.767 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.202 -13.873 -11.093 1.00 0.00 C ATOM 0 H VAL A 55 10.163 -11.553 -12.773 1.00 0.00 H new ATOM 0 HA VAL A 55 10.014 -14.411 -13.455 1.00 0.00 H new ATOM 0 HB VAL A 55 9.522 -12.523 -11.107 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.001 -14.433 -9.691 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.802 -14.184 -10.983 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.007 -15.485 -11.126 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.311 -13.882 -10.008 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.449 -14.857 -11.491 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.876 -13.130 -11.519 1.00 0.00 H new ATOM 930 N LEU A 56 7.697 -12.337 -14.039 1.00 0.00 N ATOM 931 CA LEU A 56 6.406 -12.040 -14.607 1.00 0.00 C ATOM 932 C LEU A 56 5.210 -12.289 -13.628 1.00 0.00 C ATOM 933 O LEU A 56 4.031 -12.154 -13.982 1.00 0.00 O ATOM 934 CB LEU A 56 6.362 -13.051 -15.681 1.00 0.00 C ATOM 935 CG LEU A 56 5.100 -13.216 -16.390 1.00 0.00 C ATOM 936 CD1 LEU A 56 4.877 -12.121 -17.422 1.00 0.00 C ATOM 937 CD2 LEU A 56 4.899 -14.613 -16.939 1.00 0.00 C ATOM 0 H LEU A 56 8.336 -11.549 -14.144 1.00 0.00 H new ATOM 0 HA LEU A 56 6.305 -10.994 -14.897 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.130 -12.800 -16.413 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.635 -14.014 -15.250 1.00 0.00 H new ATOM 0 HG LEU A 56 4.312 -13.096 -15.646 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.924 -12.284 -17.926 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.863 -11.151 -16.926 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.683 -12.142 -18.155 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.940 -14.667 -17.455 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.701 -14.848 -17.639 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.911 -15.331 -16.119 1.00 0.00 H new ATOM 949 N LYS A 57 5.515 -12.505 -12.429 1.00 0.00 N ATOM 950 CA LYS A 57 4.520 -12.908 -11.483 1.00 0.00 C ATOM 951 C LYS A 57 4.389 -12.068 -10.170 1.00 0.00 C ATOM 952 O LYS A 57 5.293 -12.061 -9.352 1.00 0.00 O ATOM 953 CB LYS A 57 4.799 -14.378 -11.292 1.00 0.00 C ATOM 954 CG LYS A 57 3.840 -15.219 -10.454 1.00 0.00 C ATOM 955 CD LYS A 57 4.112 -15.118 -8.961 1.00 0.00 C ATOM 956 CE LYS A 57 3.207 -16.051 -8.178 1.00 0.00 C ATOM 957 NZ LYS A 57 1.784 -15.750 -8.415 1.00 0.00 N ATOM 0 H LYS A 57 6.457 -12.415 -12.048 1.00 0.00 H new ATOM 0 HA LYS A 57 3.519 -12.712 -11.866 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.853 -14.832 -12.281 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.789 -14.468 -10.845 1.00 0.00 H new ATOM 0 HG2 LYS A 57 2.817 -14.901 -10.654 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.916 -16.262 -10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 57 5.155 -15.364 -8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 57 3.957 -14.092 -8.628 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.414 -17.083 -8.462 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.426 -15.963 -7.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.194 -16.395 -7.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.586 -14.768 -8.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.566 -15.874 -9.424 1.00 0.00 H new ATOM 971 N VAL A 58 3.338 -11.233 -10.099 1.00 0.00 N ATOM 972 CA VAL A 58 2.754 -10.714 -8.826 1.00 0.00 C ATOM 973 C VAL A 58 2.737 -11.743 -7.691 1.00 0.00 C ATOM 974 O VAL A 58 2.207 -12.869 -7.816 1.00 0.00 O ATOM 975 CB VAL A 58 1.317 -10.151 -9.056 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.365 -11.210 -9.572 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.784 -9.525 -7.788 1.00 0.00 C ATOM 0 H VAL A 58 2.856 -10.888 -10.929 1.00 0.00 H new ATOM 0 HA VAL A 58 3.416 -9.908 -8.509 1.00 0.00 H new ATOM 0 HB VAL A 58 1.389 -9.382 -9.825 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.623 -10.772 -9.717 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.733 -11.598 -10.522 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.299 -12.023 -8.849 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.219 -9.138 -7.967 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.747 -10.276 -6.999 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.439 -8.709 -7.482 1.00 0.00 H new ATOM 987 N CYS A 59 3.326 -11.347 -6.603 1.00 0.00 N ATOM 988 CA CYS A 59 3.397 -12.156 -5.441 1.00 0.00 C ATOM 989 C CYS A 59 2.613 -11.588 -4.271 1.00 0.00 C ATOM 990 O CYS A 59 2.203 -12.347 -3.445 1.00 0.00 O ATOM 991 CB CYS A 59 4.842 -12.409 -5.035 1.00 0.00 C ATOM 992 SG CYS A 59 5.772 -13.429 -6.192 1.00 0.00 S ATOM 0 H CYS A 59 3.776 -10.437 -6.504 1.00 0.00 H new ATOM 0 HA CYS A 59 2.930 -13.105 -5.706 1.00 0.00 H new ATOM 0 HB2 CYS A 59 5.349 -11.450 -4.926 1.00 0.00 H new ATOM 0 HB3 CYS A 59 4.853 -12.889 -4.056 1.00 0.00 H new ATOM 0 HG CYS A 59 5.626 -12.962 -7.396 1.00 0.00 H new ATOM 998 N ALA A 60 2.390 -10.254 -4.193 1.00 0.00 N ATOM 999 CA ALA A 60 1.716 -9.716 -3.055 1.00 0.00 C ATOM 1000 C ALA A 60 0.851 -8.607 -3.417 1.00 0.00 C ATOM 1001 O ALA A 60 1.307 -7.640 -3.971 1.00 0.00 O ATOM 1002 CB ALA A 60 2.634 -9.235 -2.005 1.00 0.00 C ATOM 0 H ALA A 60 2.669 -9.572 -4.898 1.00 0.00 H new ATOM 0 HA ALA A 60 1.133 -10.550 -2.664 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.056 -8.839 -1.170 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.255 -10.061 -1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.271 -8.449 -2.411 1.00 0.00 H new ATOM 1008 N ASN A 61 -0.365 -8.761 -3.112 1.00 0.00 N ATOM 1009 CA ASN A 61 -1.355 -7.718 -3.255 1.00 0.00 C ATOM 1010 C ASN A 61 -1.723 -7.188 -1.916 1.00 0.00 C ATOM 1011 O ASN A 61 -2.531 -7.762 -1.174 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.582 -8.201 -3.934 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.660 -7.118 -4.183 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.721 -6.507 -5.256 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.493 -6.850 -3.189 1.00 0.00 N ATOM 0 H ASN A 61 -0.741 -9.634 -2.741 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.913 -6.934 -3.870 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.301 -8.640 -4.891 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -3.021 -8.999 -3.335 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -5.203 -6.127 -3.300 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.424 -7.367 -2.312 1.00 0.00 H new ATOM 1022 N HIS A 62 -1.096 -6.178 -1.599 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.315 -5.443 -0.382 1.00 0.00 C ATOM 1024 C HIS A 62 -2.145 -4.156 -0.618 1.00 0.00 C ATOM 1025 O HIS A 62 -1.825 -3.368 -1.452 1.00 0.00 O ATOM 1026 CB HIS A 62 0.061 -5.145 0.249 1.00 0.00 C ATOM 1027 CG HIS A 62 0.161 -3.890 1.052 1.00 0.00 C ATOM 1028 ND1 HIS A 62 0.886 -2.809 0.630 1.00 0.00 N ATOM 1029 CD2 HIS A 62 -0.347 -3.552 2.243 1.00 0.00 C ATOM 1030 CE1 HIS A 62 0.819 -1.863 1.523 1.00 0.00 C ATOM 1031 NE2 HIS A 62 0.077 -2.287 2.514 1.00 0.00 N ATOM 0 H HIS A 62 -0.362 -5.779 -2.184 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.910 -6.043 0.307 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.333 -5.984 0.890 1.00 0.00 H new ATOM 0 HB3 HIS A 62 0.802 -5.101 -0.550 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.975 -4.167 2.871 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.294 -0.895 1.457 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.148 -1.755 3.355 1.00 0.00 H new ATOM 1039 N TRP A 63 -3.189 -3.987 0.147 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.994 -2.768 0.141 1.00 0.00 C ATOM 1041 C TRP A 63 -3.347 -1.756 1.085 1.00 0.00 C ATOM 1042 O TRP A 63 -2.955 -2.108 2.195 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.387 -3.041 0.721 1.00 0.00 C ATOM 1044 CG TRP A 63 -6.110 -4.224 0.163 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.920 -4.252 -0.923 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.111 -5.557 0.698 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -7.411 -5.514 -1.112 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.937 -6.334 -0.128 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.488 -6.166 1.795 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.162 -7.688 0.103 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -5.714 -7.509 2.021 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -6.544 -8.256 1.180 1.00 0.00 C ATOM 0 H TRP A 63 -3.519 -4.693 0.805 1.00 0.00 H new ATOM 0 HA TRP A 63 -4.062 -2.409 -0.886 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.290 -3.175 1.798 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -6.004 -2.156 0.564 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.145 -3.401 -1.549 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -8.033 -5.798 -1.869 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -4.845 -5.597 2.450 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.802 -8.268 -0.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -5.241 -7.992 2.863 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.700 -9.305 1.386 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.260 -0.523 0.675 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.701 0.485 1.472 1.00 0.00 C ATOM 1065 C ILE A 64 -3.850 1.208 2.160 1.00 0.00 C ATOM 1066 O ILE A 64 -4.661 1.875 1.524 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.726 1.406 0.615 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.244 2.682 1.352 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.308 1.745 -0.758 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.278 3.765 1.420 1.00 0.00 C ATOM 0 H ILE A 64 -3.585 -0.204 -0.238 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.055 0.086 2.254 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.835 0.797 0.463 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.944 2.414 2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.358 3.069 0.849 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.607 2.375 -1.305 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.482 0.825 -1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.251 2.277 -0.632 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.869 4.626 1.949 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.561 4.061 0.410 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.156 3.397 1.950 1.00 0.00 H new ATOM 1082 N THR A 65 -3.992 0.935 3.416 1.00 0.00 N ATOM 1083 CA THR A 65 -5.022 1.521 4.212 1.00 0.00 C ATOM 1084 C THR A 65 -4.532 1.791 5.598 1.00 0.00 C ATOM 1085 O THR A 65 -3.548 1.210 6.045 1.00 0.00 O ATOM 1086 CB THR A 65 -6.293 0.622 4.232 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.314 1.133 5.117 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.957 -0.832 4.567 1.00 0.00 C ATOM 0 H THR A 65 -3.388 0.290 3.925 1.00 0.00 H new ATOM 0 HA THR A 65 -5.297 2.474 3.760 1.00 0.00 H new ATOM 0 HB THR A 65 -6.700 0.646 3.221 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.676 0.400 5.657 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.871 -1.425 4.571 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.270 -1.228 3.819 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.489 -0.880 5.550 1.00 0.00 H new ATOM 1096 N THR A 66 -5.250 2.636 6.272 1.00 0.00 N ATOM 1097 CA THR A 66 -5.057 2.995 7.659 1.00 0.00 C ATOM 1098 C THR A 66 -5.553 1.857 8.564 1.00 0.00 C ATOM 1099 O THR A 66 -5.456 1.918 9.779 1.00 0.00 O ATOM 1100 CB THR A 66 -5.865 4.230 7.954 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.631 4.565 6.776 1.00 0.00 O ATOM 1102 CG2 THR A 66 -4.986 5.387 8.394 1.00 0.00 C ATOM 0 H THR A 66 -6.037 3.128 5.849 1.00 0.00 H new ATOM 0 HA THR A 66 -3.998 3.175 7.845 1.00 0.00 H new ATOM 0 HB THR A 66 -6.540 4.030 8.786 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.381 5.461 6.467 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.607 6.259 8.597 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.444 5.109 9.298 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.275 5.625 7.603 1.00 0.00 H new ATOM 1110 N THR A 67 -6.093 0.825 7.932 1.00 0.00 N ATOM 1111 CA THR A 67 -6.623 -0.346 8.609 1.00 0.00 C ATOM 1112 C THR A 67 -5.438 -1.279 8.937 1.00 0.00 C ATOM 1113 O THR A 67 -5.539 -2.250 9.691 1.00 0.00 O ATOM 1114 CB THR A 67 -7.619 -1.057 7.639 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.676 -0.143 7.277 1.00 0.00 O ATOM 1116 CG2 THR A 67 -8.215 -2.327 8.239 1.00 0.00 C ATOM 0 H THR A 67 -6.176 0.779 6.916 1.00 0.00 H new ATOM 0 HA THR A 67 -7.143 -0.079 9.529 1.00 0.00 H new ATOM 0 HB THR A 67 -7.057 -1.354 6.754 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.300 -0.589 6.667 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.900 -2.781 7.523 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.415 -3.030 8.471 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.756 -2.079 9.152 1.00 0.00 H new ATOM 1124 N MET A 68 -4.313 -0.878 8.447 1.00 0.00 N ATOM 1125 CA MET A 68 -3.121 -1.548 8.523 1.00 0.00 C ATOM 1126 C MET A 68 -2.123 -0.499 8.929 1.00 0.00 C ATOM 1127 O MET A 68 -2.393 0.686 8.809 1.00 0.00 O ATOM 1128 CB MET A 68 -2.803 -2.002 7.140 1.00 0.00 C ATOM 1129 CG MET A 68 -1.518 -2.773 6.983 1.00 0.00 C ATOM 1130 SD MET A 68 -0.669 -2.325 5.471 1.00 0.00 S ATOM 1131 CE MET A 68 -0.236 -0.626 5.840 1.00 0.00 C ATOM 0 H MET A 68 -4.230 0.007 7.946 1.00 0.00 H new ATOM 0 HA MET A 68 -3.127 -2.395 9.209 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.624 -2.624 6.784 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.762 -1.127 6.491 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.869 -2.580 7.837 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.731 -3.842 6.980 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.775 -0.423 5.487 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.936 0.044 5.341 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.284 -0.464 6.917 1.00 0.00 H new ATOM 1141 N ASN A 69 -1.026 -0.927 9.357 1.00 0.00 N ATOM 1142 CA ASN A 69 0.058 -0.085 9.813 1.00 0.00 C ATOM 1143 C ASN A 69 1.382 -0.587 9.242 1.00 0.00 C ATOM 1144 O ASN A 69 1.566 -1.794 9.037 1.00 0.00 O ATOM 1145 CB ASN A 69 0.082 -0.184 11.323 1.00 0.00 C ATOM 1146 CG ASN A 69 1.120 0.693 12.027 1.00 0.00 C ATOM 1147 OD1 ASN A 69 1.674 0.298 13.055 1.00 0.00 O ATOM 1148 ND2 ASN A 69 1.304 1.908 11.566 1.00 0.00 N ATOM 0 H ASN A 69 -0.812 -1.922 9.417 1.00 0.00 H new ATOM 0 HA ASN A 69 -0.083 0.946 9.487 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.906 0.078 11.702 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.264 -1.223 11.598 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.919 2.554 12.061 1.00 0.00 H new ATOM 0 HD22 ASN A 69 0.832 2.207 10.713 1.00 0.00 H new ATOM 1155 N LEU A 70 2.255 0.344 8.941 1.00 0.00 N ATOM 1156 CA LEU A 70 3.528 0.111 8.499 1.00 0.00 C ATOM 1157 C LEU A 70 4.505 0.211 9.634 1.00 0.00 C ATOM 1158 O LEU A 70 4.371 1.035 10.535 1.00 0.00 O ATOM 1159 CB LEU A 70 3.854 0.977 7.288 1.00 0.00 C ATOM 1160 CG LEU A 70 3.702 2.511 7.322 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.543 3.093 8.405 1.00 0.00 C ATOM 1162 CD2 LEU A 70 4.233 2.984 6.024 1.00 0.00 C ATOM 0 H LEU A 70 2.039 1.338 9.018 1.00 0.00 H new ATOM 0 HA LEU A 70 3.612 -0.914 8.137 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.890 0.769 7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.234 0.617 6.467 1.00 0.00 H new ATOM 0 HG LEU A 70 2.665 2.800 7.496 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.424 4.176 8.415 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.232 2.685 9.367 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.589 2.844 8.227 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.158 4.070 5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.278 2.688 5.928 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.655 2.543 5.212 1.00 0.00 H new ATOM 1174 N LYS A 71 5.345 -0.689 9.652 1.00 0.00 N ATOM 1175 CA LYS A 71 6.390 -0.782 10.650 1.00 0.00 C ATOM 1176 C LYS A 71 7.745 -1.021 9.978 1.00 0.00 C ATOM 1177 O LYS A 71 7.850 -1.892 9.129 1.00 0.00 O ATOM 1178 CB LYS A 71 6.072 -1.925 11.626 1.00 0.00 C ATOM 1179 CG LYS A 71 7.123 -2.127 12.702 1.00 0.00 C ATOM 1180 CD LYS A 71 6.736 -3.234 13.661 1.00 0.00 C ATOM 1181 CE LYS A 71 7.828 -3.467 14.688 1.00 0.00 C ATOM 1182 NZ LYS A 71 8.104 -2.260 15.496 1.00 0.00 N ATOM 0 H LYS A 71 5.370 -1.441 8.963 1.00 0.00 H new ATOM 0 HA LYS A 71 6.439 0.156 11.203 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.112 -1.726 12.103 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.962 -2.851 11.062 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.079 -2.366 12.237 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.261 -1.198 13.255 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.806 -2.974 14.166 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.551 -4.154 13.106 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.535 -4.284 15.347 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.741 -3.778 14.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.687 -2.518 16.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.613 -1.563 14.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.207 -1.849 15.824 1.00 0.00 H new ATOM 1196 N PRO A 72 8.788 -0.234 10.311 1.00 0.00 N ATOM 1197 CA PRO A 72 10.132 -0.439 9.762 1.00 0.00 C ATOM 1198 C PRO A 72 10.767 -1.726 10.291 1.00 0.00 C ATOM 1199 O PRO A 72 10.551 -2.113 11.461 1.00 0.00 O ATOM 1200 CB PRO A 72 10.934 0.775 10.260 1.00 0.00 C ATOM 1201 CG PRO A 72 9.918 1.737 10.767 1.00 0.00 C ATOM 1202 CD PRO A 72 8.749 0.916 11.219 1.00 0.00 C ATOM 0 HA PRO A 72 10.111 -0.530 8.676 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.632 0.489 11.047 1.00 0.00 H new ATOM 0 HB3 PRO A 72 11.524 1.214 9.455 1.00 0.00 H new ATOM 0 HG2 PRO A 72 10.319 2.328 11.590 1.00 0.00 H new ATOM 0 HG3 PRO A 72 9.622 2.438 9.986 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.847 0.612 12.261 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.812 1.466 11.135 1.00 0.00 H new ATOM 1210 N LEU A 73 11.525 -2.397 9.437 1.00 0.00 N ATOM 1211 CA LEU A 73 12.213 -3.593 9.769 1.00 0.00 C ATOM 1212 C LEU A 73 13.301 -3.247 10.748 1.00 0.00 C ATOM 1213 O LEU A 73 13.743 -2.098 10.786 1.00 0.00 O ATOM 1214 CB LEU A 73 12.906 -4.147 8.531 1.00 0.00 C ATOM 1215 CG LEU A 73 12.335 -3.813 7.152 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.185 -4.457 6.062 1.00 0.00 C ATOM 1217 CD2 LEU A 73 10.895 -4.254 7.025 1.00 0.00 C ATOM 0 H LEU A 73 11.670 -2.100 8.472 1.00 0.00 H new ATOM 0 HA LEU A 73 11.505 -4.317 10.173 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.940 -3.804 8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.928 -5.233 8.624 1.00 0.00 H new ATOM 0 HG LEU A 73 12.361 -2.730 7.033 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.769 -4.213 5.084 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.206 -4.080 6.127 1.00 0.00 H new ATOM 0 HD13 LEU A 73 13.188 -5.539 6.195 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.523 -4.000 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.830 -5.332 7.172 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.292 -3.748 7.779 1.00 0.00 H new ATOM 1229 N SER A 74 13.750 -4.199 11.510 1.00 0.00 N ATOM 1230 CA SER A 74 14.837 -3.943 12.401 1.00 0.00 C ATOM 1231 C SER A 74 16.063 -3.590 11.665 1.00 0.00 C ATOM 1232 O SER A 74 16.467 -4.292 10.726 1.00 0.00 O ATOM 1233 CB SER A 74 15.150 -5.109 13.244 1.00 0.00 C ATOM 1234 OG SER A 74 14.137 -5.328 14.222 1.00 0.00 O ATOM 0 H SER A 74 13.384 -5.151 11.532 1.00 0.00 H new ATOM 0 HA SER A 74 14.514 -3.111 13.027 1.00 0.00 H new ATOM 0 HB2 SER A 74 15.252 -5.996 12.618 1.00 0.00 H new ATOM 0 HB3 SER A 74 16.109 -4.956 13.739 1.00 0.00 H new ATOM 0 HG SER A 74 14.371 -6.109 14.766 1.00 0.00 H new ATOM 1240 N GLY A 75 16.639 -2.506 12.032 1.00 0.00 N ATOM 1241 CA GLY A 75 17.847 -2.166 11.430 1.00 0.00 C ATOM 1242 C GLY A 75 17.645 -1.291 10.198 1.00 0.00 C ATOM 1243 O GLY A 75 18.584 -0.652 9.713 1.00 0.00 O ATOM 0 H GLY A 75 16.291 -1.856 12.736 1.00 0.00 H new ATOM 0 HA2 GLY A 75 18.475 -1.640 12.149 1.00 0.00 H new ATOM 0 HA3 GLY A 75 18.379 -3.074 11.146 1.00 0.00 H new ATOM 1247 N SER A 76 16.423 -1.279 9.689 1.00 0.00 N ATOM 1248 CA SER A 76 16.009 -0.448 8.661 1.00 0.00 C ATOM 1249 C SER A 76 15.254 0.688 9.290 1.00 0.00 C ATOM 1250 O SER A 76 14.629 0.525 10.344 1.00 0.00 O ATOM 1251 CB SER A 76 15.118 -1.282 7.791 1.00 0.00 C ATOM 1252 OG SER A 76 15.838 -2.405 7.276 1.00 0.00 O ATOM 0 H SER A 76 15.684 -1.895 10.026 1.00 0.00 H new ATOM 0 HA SER A 76 16.826 -0.039 8.067 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.257 -1.625 8.364 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.734 -0.679 6.968 1.00 0.00 H new ATOM 0 HG SER A 76 15.707 -2.461 6.306 1.00 0.00 H new ATOM 1258 N ASP A 77 15.342 1.815 8.704 1.00 0.00 N ATOM 1259 CA ASP A 77 14.693 2.938 9.177 1.00 0.00 C ATOM 1260 C ASP A 77 13.638 3.284 8.243 1.00 0.00 C ATOM 1261 O ASP A 77 12.558 3.740 8.648 1.00 0.00 O ATOM 1262 CB ASP A 77 15.636 4.137 9.388 1.00 0.00 C ATOM 1263 CG ASP A 77 16.630 4.391 8.275 1.00 0.00 C ATOM 1264 OD1 ASP A 77 16.295 5.082 7.306 1.00 0.00 O ATOM 1265 OD2 ASP A 77 17.797 3.925 8.379 1.00 0.00 O ATOM 0 H ASP A 77 15.888 1.972 7.857 1.00 0.00 H new ATOM 0 HA ASP A 77 14.282 2.703 10.159 1.00 0.00 H new ATOM 0 HB2 ASP A 77 15.030 5.033 9.522 1.00 0.00 H new ATOM 0 HB3 ASP A 77 16.188 3.984 10.316 1.00 0.00 H new ATOM 1270 N ARG A 78 13.879 3.015 6.975 1.00 0.00 N ATOM 1271 CA ARG A 78 12.944 3.448 6.047 1.00 0.00 C ATOM 1272 C ARG A 78 12.412 2.399 5.081 1.00 0.00 C ATOM 1273 O ARG A 78 11.650 2.701 4.193 1.00 0.00 O ATOM 1274 CB ARG A 78 13.319 4.766 5.446 1.00 0.00 C ATOM 1275 CG ARG A 78 12.185 5.749 5.544 1.00 0.00 C ATOM 1276 CD ARG A 78 11.935 6.245 6.964 1.00 0.00 C ATOM 1277 NE ARG A 78 12.943 7.226 7.385 1.00 0.00 N ATOM 1278 CZ ARG A 78 13.162 7.645 8.635 1.00 0.00 C ATOM 1279 NH1 ARG A 78 12.541 7.078 9.667 1.00 0.00 N ATOM 1280 NH2 ARG A 78 14.013 8.645 8.837 1.00 0.00 N ATOM 0 H ARG A 78 14.690 2.517 6.607 1.00 0.00 H new ATOM 0 HA ARG A 78 12.039 3.638 6.624 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.195 5.165 5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.594 4.627 4.401 1.00 0.00 H new ATOM 0 HG2 ARG A 78 12.398 6.603 4.901 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.276 5.283 5.165 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.944 6.695 7.023 1.00 0.00 H new ATOM 0 HD3 ARG A 78 11.942 5.399 7.651 1.00 0.00 H new ATOM 0 HE ARG A 78 13.532 7.626 6.654 1.00 0.00 H new ATOM 0 HH11 ARG A 78 11.887 6.312 9.510 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.720 7.410 10.615 1.00 0.00 H new ATOM 0 HH21 ARG A 78 14.487 9.080 8.045 1.00 0.00 H new ATOM 0 HH22 ARG A 78 14.193 8.978 9.784 1.00 0.00 H new ATOM 1294 N ALA A 79 12.718 1.185 5.359 1.00 0.00 N ATOM 1295 CA ALA A 79 12.162 0.046 4.663 1.00 0.00 C ATOM 1296 C ALA A 79 11.174 -0.551 5.650 1.00 0.00 C ATOM 1297 O ALA A 79 11.496 -0.699 6.845 1.00 0.00 O ATOM 1298 CB ALA A 79 13.261 -0.955 4.366 1.00 0.00 C ATOM 0 H ALA A 79 13.378 0.932 6.094 1.00 0.00 H new ATOM 0 HA ALA A 79 11.697 0.315 3.715 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.840 -1.813 3.841 1.00 0.00 H new ATOM 0 HB2 ALA A 79 14.022 -0.486 3.742 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.713 -1.287 5.301 1.00 0.00 H new ATOM 1304 N TRP A 80 10.002 -0.894 5.187 1.00 0.00 N ATOM 1305 CA TRP A 80 8.894 -1.142 6.054 1.00 0.00 C ATOM 1306 C TRP A 80 8.131 -2.360 5.660 1.00 0.00 C ATOM 1307 O TRP A 80 8.254 -2.860 4.534 1.00 0.00 O ATOM 1308 CB TRP A 80 7.976 0.108 6.134 1.00 0.00 C ATOM 1309 CG TRP A 80 7.972 0.930 4.869 1.00 0.00 C ATOM 1310 CD1 TRP A 80 8.741 2.018 4.624 1.00 0.00 C ATOM 1311 CD2 TRP A 80 7.200 0.721 3.687 1.00 0.00 C ATOM 1312 NE1 TRP A 80 8.508 2.500 3.368 1.00 0.00 N ATOM 1313 CE2 TRP A 80 7.564 1.725 2.770 1.00 0.00 C ATOM 1314 CE3 TRP A 80 6.244 -0.207 3.311 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 7.008 1.817 1.509 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 5.690 -0.114 2.052 1.00 0.00 C ATOM 1317 CH2 TRP A 80 6.072 0.890 1.166 1.00 0.00 C ATOM 0 H TRP A 80 9.794 -1.008 4.195 1.00 0.00 H new ATOM 0 HA TRP A 80 9.292 -1.338 7.050 1.00 0.00 H new ATOM 0 HB2 TRP A 80 6.957 -0.212 6.354 1.00 0.00 H new ATOM 0 HB3 TRP A 80 8.300 0.735 6.965 1.00 0.00 H new ATOM 0 HD1 TRP A 80 9.442 2.445 5.326 1.00 0.00 H new ATOM 0 HE1 TRP A 80 8.966 3.308 2.947 1.00 0.00 H new ATOM 0 HE3 TRP A 80 5.938 -0.989 3.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 7.305 2.595 0.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 4.945 -0.834 1.747 1.00 0.00 H new ATOM 0 HH2 TRP A 80 5.617 0.934 0.188 1.00 0.00 H new ATOM 1328 N MET A 81 7.376 -2.832 6.592 1.00 0.00 N ATOM 1329 CA MET A 81 6.597 -3.950 6.470 1.00 0.00 C ATOM 1330 C MET A 81 5.268 -3.578 6.911 1.00 0.00 C ATOM 1331 O MET A 81 5.078 -2.604 7.665 1.00 0.00 O ATOM 1332 CB MET A 81 7.116 -5.156 7.247 1.00 0.00 C ATOM 1333 CG MET A 81 7.291 -4.993 8.744 1.00 0.00 C ATOM 1334 SD MET A 81 7.966 -6.488 9.504 1.00 0.00 S ATOM 1335 CE MET A 81 8.026 -6.000 11.222 1.00 0.00 C ATOM 0 H MET A 81 7.304 -2.395 7.511 1.00 0.00 H new ATOM 0 HA MET A 81 6.606 -4.276 5.430 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.433 -5.988 7.075 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.079 -5.442 6.824 1.00 0.00 H new ATOM 0 HG2 MET A 81 7.955 -4.152 8.943 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.330 -4.755 9.199 1.00 0.00 H new ATOM 0 HE1 MET A 81 8.551 -6.762 11.798 1.00 0.00 H new ATOM 0 HE2 MET A 81 8.552 -5.050 11.312 1.00 0.00 H new ATOM 0 HE3 MET A 81 7.011 -5.891 11.605 1.00 0.00 H new ATOM 1345 N TRP A 82 4.392 -4.264 6.430 1.00 0.00 N ATOM 1346 CA TRP A 82 3.052 -4.024 6.610 1.00 0.00 C ATOM 1347 C TRP A 82 2.434 -5.324 6.916 1.00 0.00 C ATOM 1348 O TRP A 82 2.996 -6.367 6.540 1.00 0.00 O ATOM 1349 CB TRP A 82 2.433 -3.447 5.346 1.00 0.00 C ATOM 1350 CG TRP A 82 2.583 -4.325 4.123 1.00 0.00 C ATOM 1351 CD1 TRP A 82 1.853 -5.430 3.828 1.00 0.00 C ATOM 1352 CD2 TRP A 82 3.505 -4.172 3.046 1.00 0.00 C ATOM 1353 NE1 TRP A 82 2.252 -5.964 2.648 1.00 0.00 N ATOM 1354 CE2 TRP A 82 3.267 -5.220 2.145 1.00 0.00 C ATOM 1355 CE3 TRP A 82 4.500 -3.264 2.758 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 3.987 -5.379 0.976 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 5.217 -3.420 1.595 1.00 0.00 C ATOM 1358 CH2 TRP A 82 4.954 -4.473 0.718 1.00 0.00 C ATOM 0 H TRP A 82 4.584 -5.080 5.849 1.00 0.00 H new ATOM 0 HA TRP A 82 2.894 -3.302 7.412 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.372 -3.269 5.523 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.889 -2.478 5.142 1.00 0.00 H new ATOM 0 HD1 TRP A 82 1.063 -5.829 4.448 1.00 0.00 H new ATOM 0 HE1 TRP A 82 1.852 -6.793 2.209 1.00 0.00 H new ATOM 0 HE3 TRP A 82 4.713 -2.447 3.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 3.784 -6.194 0.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 5.999 -2.714 1.356 1.00 0.00 H new ATOM 0 HH2 TRP A 82 5.537 -4.565 -0.187 1.00 0.00 H new ATOM 1369 N LEU A 83 1.368 -5.342 7.588 1.00 0.00 N ATOM 1370 CA LEU A 83 0.743 -6.609 7.687 1.00 0.00 C ATOM 1371 C LEU A 83 -0.397 -6.644 6.706 1.00 0.00 C ATOM 1372 O LEU A 83 -1.252 -5.774 6.699 1.00 0.00 O ATOM 1373 CB LEU A 83 0.252 -6.997 9.100 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.805 -6.103 9.786 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.382 -6.829 10.989 1.00 0.00 C ATOM 1376 CD2 LEU A 83 -0.191 -4.785 10.250 1.00 0.00 C ATOM 0 H LEU A 83 0.919 -4.556 8.058 1.00 0.00 H new ATOM 0 HA LEU A 83 1.505 -7.354 7.456 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.155 -8.007 9.044 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.124 -7.040 9.753 1.00 0.00 H new ATOM 0 HG LEU A 83 -1.590 -5.888 9.061 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -2.127 -6.197 11.472 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.850 -7.758 10.663 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.583 -7.053 11.696 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.957 -4.175 10.729 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.610 -4.987 10.962 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.214 -4.250 9.391 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.384 -7.625 5.874 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.408 -7.779 4.873 1.00 0.00 C ATOM 1390 C ALA A 84 -1.679 -9.209 4.631 1.00 0.00 C ATOM 1391 O ALA A 84 -0.806 -10.063 4.846 1.00 0.00 O ATOM 1392 CB ALA A 84 -1.025 -7.119 3.552 1.00 0.00 C ATOM 0 H ALA A 84 0.333 -8.350 5.859 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.301 -7.286 5.257 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.827 -7.261 2.828 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.865 -6.053 3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.109 -7.571 3.172 1.00 0.00 H new ATOM 1398 N SER A 85 -2.853 -9.493 4.218 1.00 0.00 N ATOM 1399 CA SER A 85 -3.157 -10.727 3.725 1.00 0.00 C ATOM 1400 C SER A 85 -3.031 -10.735 2.282 1.00 0.00 C ATOM 1401 O SER A 85 -3.848 -10.183 1.538 1.00 0.00 O ATOM 1402 CB SER A 85 -4.466 -11.129 4.184 1.00 0.00 C ATOM 1403 OG SER A 85 -5.176 -10.009 4.741 1.00 0.00 O ATOM 0 H SER A 85 -3.634 -8.837 4.224 1.00 0.00 H new ATOM 0 HA SER A 85 -2.449 -11.465 4.101 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.034 -11.550 3.354 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.369 -11.914 4.934 1.00 0.00 H new ATOM 0 HG SER A 85 -6.061 -10.301 5.045 1.00 0.00 H new ATOM 1409 N ASP A 86 -1.981 -11.306 1.883 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.719 -11.402 0.512 1.00 0.00 C ATOM 1411 C ASP A 86 -2.207 -12.701 -0.100 1.00 0.00 C ATOM 1412 O ASP A 86 -1.981 -13.773 0.444 1.00 0.00 O ATOM 1413 CB ASP A 86 -0.278 -11.095 0.092 1.00 0.00 C ATOM 1414 CG ASP A 86 0.077 -11.834 -1.199 1.00 0.00 C ATOM 1415 OD1 ASP A 86 -0.480 -11.479 -2.319 1.00 0.00 O ATOM 1416 OD2 ASP A 86 0.845 -12.813 -1.106 1.00 0.00 O ATOM 0 H ASP A 86 -1.276 -11.722 2.491 1.00 0.00 H new ATOM 0 HA ASP A 86 -2.315 -10.590 0.095 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.157 -10.021 -0.052 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.408 -11.389 0.886 1.00 0.00 H new ATOM 1421 N PHE A 87 -2.901 -12.577 -1.204 1.00 0.00 N ATOM 1422 CA PHE A 87 -3.289 -13.679 -2.018 1.00 0.00 C ATOM 1423 C PHE A 87 -3.574 -13.142 -3.403 1.00 0.00 C ATOM 1424 O PHE A 87 -4.708 -13.144 -3.867 1.00 0.00 O ATOM 1425 CB PHE A 87 -4.510 -14.367 -1.484 1.00 0.00 C ATOM 1426 CG PHE A 87 -4.983 -15.655 -2.191 1.00 0.00 C ATOM 1427 CD1 PHE A 87 -4.225 -16.284 -3.174 1.00 0.00 C ATOM 1428 CD2 PHE A 87 -6.200 -16.220 -1.849 1.00 0.00 C ATOM 1429 CE1 PHE A 87 -4.668 -17.435 -3.786 1.00 0.00 C ATOM 1430 CE2 PHE A 87 -6.648 -17.370 -2.461 1.00 0.00 C ATOM 1431 CZ PHE A 87 -5.880 -17.980 -3.429 1.00 0.00 C ATOM 0 H PHE A 87 -3.216 -11.676 -1.563 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.486 -14.416 -2.031 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.326 -14.609 -0.437 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -5.333 -13.652 -1.506 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.273 -15.862 -3.462 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.808 -15.751 -1.090 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.065 -17.910 -4.546 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -7.601 -17.794 -2.182 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.229 -18.884 -3.906 1.00 0.00 H new ATOM 1441 N SER A 88 -2.564 -12.576 -4.018 1.00 0.00 N ATOM 1442 CA SER A 88 -2.703 -12.174 -5.443 1.00 0.00 C ATOM 1443 C SER A 88 -2.833 -13.471 -6.196 1.00 0.00 C ATOM 1444 O SER A 88 -3.614 -13.673 -7.122 1.00 0.00 O ATOM 1445 CB SER A 88 -1.408 -11.536 -5.889 1.00 0.00 C ATOM 1446 OG SER A 88 -0.974 -10.608 -4.969 1.00 0.00 O ATOM 0 H SER A 88 -1.657 -12.378 -3.594 1.00 0.00 H new ATOM 0 HA SER A 88 -3.537 -11.489 -5.600 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.647 -12.305 -6.023 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.549 -11.055 -6.857 1.00 0.00 H new ATOM 0 HG SER A 88 -0.164 -10.939 -4.528 1.00 0.00 H new ATOM 1452 N ASP A 89 -2.041 -14.327 -5.664 1.00 0.00 N ATOM 1453 CA ASP A 89 -1.844 -15.675 -5.955 1.00 0.00 C ATOM 1454 C ASP A 89 -0.743 -16.030 -4.985 1.00 0.00 C ATOM 1455 O ASP A 89 0.117 -16.853 -5.230 1.00 0.00 O ATOM 1456 CB ASP A 89 -1.378 -15.826 -7.389 1.00 0.00 C ATOM 1457 CG ASP A 89 -1.200 -17.258 -7.797 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -2.199 -17.992 -7.876 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -0.051 -17.671 -8.010 1.00 0.00 O ATOM 0 H ASP A 89 -1.430 -14.038 -4.900 1.00 0.00 H new ATOM 0 HA ASP A 89 -2.731 -16.302 -5.861 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.101 -15.352 -8.053 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.433 -15.297 -7.516 1.00 0.00 H new ATOM 1464 N GLY A 90 -0.809 -15.371 -3.815 1.00 0.00 N ATOM 1465 CA GLY A 90 0.274 -15.498 -2.860 1.00 0.00 C ATOM 1466 C GLY A 90 -0.105 -16.444 -1.818 1.00 0.00 C ATOM 1467 O GLY A 90 0.732 -16.943 -1.054 1.00 0.00 O ATOM 0 H GLY A 90 -1.579 -14.767 -3.526 1.00 0.00 H new ATOM 0 HA2 GLY A 90 1.179 -15.838 -3.363 1.00 0.00 H new ATOM 0 HA3 GLY A 90 0.500 -14.527 -2.420 1.00 0.00 H new ATOM 1471 N ASP A 91 -1.396 -16.708 -1.839 1.00 0.00 N ATOM 1472 CA ASP A 91 -2.089 -17.622 -0.950 1.00 0.00 C ATOM 1473 C ASP A 91 -2.361 -16.952 0.365 1.00 0.00 C ATOM 1474 O ASP A 91 -1.446 -16.464 1.031 1.00 0.00 O ATOM 1475 CB ASP A 91 -1.362 -18.945 -0.868 1.00 0.00 C ATOM 1476 CG ASP A 91 -1.635 -19.753 0.378 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -2.793 -20.132 0.625 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -0.683 -20.081 1.105 1.00 0.00 O ATOM 0 H ASP A 91 -2.024 -16.268 -2.512 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.070 -17.876 -1.351 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -1.633 -19.545 -1.737 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.290 -18.757 -0.932 1.00 0.00 H new ATOM 1483 N ALA A 92 -3.617 -16.970 0.751 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.116 -16.103 1.784 1.00 0.00 C ATOM 1485 C ALA A 92 -3.674 -16.484 3.153 1.00 0.00 C ATOM 1486 O ALA A 92 -4.165 -17.439 3.772 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.623 -16.009 1.723 1.00 0.00 C ATOM 0 H ALA A 92 -4.321 -17.591 0.353 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.682 -15.123 1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.979 -15.348 2.513 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.924 -15.610 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.055 -17.001 1.857 1.00 0.00 H new ATOM 1493 N LYS A 93 -2.694 -15.762 3.563 1.00 0.00 N ATOM 1494 CA LYS A 93 -2.159 -15.763 4.865 1.00 0.00 C ATOM 1495 C LYS A 93 -1.966 -14.319 5.190 1.00 0.00 C ATOM 1496 O LYS A 93 -1.793 -13.503 4.266 1.00 0.00 O ATOM 1497 CB LYS A 93 -0.786 -16.412 4.877 1.00 0.00 C ATOM 1498 CG LYS A 93 -0.628 -17.604 5.823 1.00 0.00 C ATOM 1499 CD LYS A 93 -1.484 -18.788 5.388 1.00 0.00 C ATOM 1500 CE LYS A 93 -1.114 -19.233 3.985 1.00 0.00 C ATOM 1501 NZ LYS A 93 -1.912 -20.371 3.512 1.00 0.00 N ATOM 0 H LYS A 93 -2.213 -15.108 2.945 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.807 -16.299 5.558 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.550 -16.740 3.865 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.049 -15.656 5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.419 -17.905 5.857 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.907 -17.306 6.834 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.349 -19.616 6.084 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.538 -18.512 5.421 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -1.244 -18.396 3.299 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.058 -19.503 3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -1.506 -20.736 2.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.906 -21.122 4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.890 -20.062 3.342 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.012 -13.970 6.417 1.00 0.00 N ATOM 1516 CA LEU A 94 -1.671 -12.641 6.762 1.00 0.00 C ATOM 1517 C LEU A 94 -0.321 -12.638 7.364 1.00 0.00 C ATOM 1518 O LEU A 94 -0.015 -13.407 8.280 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.762 -11.865 7.530 1.00 0.00 C ATOM 1520 CG LEU A 94 -3.337 -12.467 8.824 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -2.385 -12.337 9.993 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -4.664 -11.831 9.146 1.00 0.00 C ATOM 0 H LEU A 94 -2.279 -14.575 7.194 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.623 -12.043 5.852 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.356 -10.884 7.776 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.594 -11.703 6.845 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.482 -13.534 8.652 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.838 -12.777 10.882 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.455 -12.857 9.764 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.176 -11.283 10.176 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.062 -12.264 10.064 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.530 -10.758 9.280 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.361 -12.010 8.328 1.00 0.00 H new ATOM 1534 N GLU A 95 0.495 -11.847 6.808 1.00 0.00 N ATOM 1535 CA GLU A 95 1.822 -11.842 7.066 1.00 0.00 C ATOM 1536 C GLU A 95 2.232 -10.463 7.057 1.00 0.00 C ATOM 1537 O GLU A 95 1.516 -9.576 6.582 1.00 0.00 O ATOM 1538 CB GLU A 95 2.505 -12.653 5.953 1.00 0.00 C ATOM 1539 CG GLU A 95 4.003 -12.879 6.091 1.00 0.00 C ATOM 1540 CD GLU A 95 4.568 -13.654 4.929 1.00 0.00 C ATOM 1541 OE1 GLU A 95 4.911 -13.047 3.893 1.00 0.00 O ATOM 1542 OE2 GLU A 95 4.676 -14.883 5.030 1.00 0.00 O ATOM 0 H GLU A 95 0.211 -11.150 6.120 1.00 0.00 H new ATOM 0 HA GLU A 95 2.085 -12.287 8.026 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.018 -13.627 5.894 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.323 -12.148 5.004 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.509 -11.917 6.165 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.204 -13.417 7.017 1.00 0.00 H new ATOM 1549 N GLN A 96 3.304 -10.276 7.605 1.00 0.00 N ATOM 1550 CA GLN A 96 3.909 -9.089 7.547 1.00 0.00 C ATOM 1551 C GLN A 96 4.935 -9.251 6.514 1.00 0.00 C ATOM 1552 O GLN A 96 5.872 -10.014 6.645 1.00 0.00 O ATOM 1553 CB GLN A 96 4.501 -8.611 8.873 1.00 0.00 C ATOM 1554 CG GLN A 96 3.463 -8.206 9.889 1.00 0.00 C ATOM 1555 CD GLN A 96 4.050 -7.695 11.181 1.00 0.00 C ATOM 1556 OE1 GLN A 96 4.296 -8.463 12.114 1.00 0.00 O ATOM 1557 NE2 GLN A 96 4.250 -6.402 11.269 1.00 0.00 N ATOM 0 H GLN A 96 3.809 -10.986 8.135 1.00 0.00 H new ATOM 0 HA GLN A 96 3.188 -8.306 7.313 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.117 -9.406 9.293 1.00 0.00 H new ATOM 0 HB3 GLN A 96 5.160 -7.764 8.682 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.827 -7.433 9.458 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.823 -9.062 10.104 1.00 0.00 H new ATOM 0 HE21 GLN A 96 4.035 -5.798 10.476 1.00 0.00 H new ATOM 0 HE22 GLN A 96 4.621 -6.001 12.130 1.00 0.00 H new ATOM 1566 N LEU A 97 4.728 -8.587 5.521 1.00 0.00 N ATOM 1567 CA LEU A 97 5.583 -8.589 4.422 1.00 0.00 C ATOM 1568 C LEU A 97 6.149 -7.248 4.226 1.00 0.00 C ATOM 1569 O LEU A 97 5.535 -6.242 4.586 1.00 0.00 O ATOM 1570 CB LEU A 97 4.944 -9.186 3.153 1.00 0.00 C ATOM 1571 CG LEU A 97 3.530 -8.748 2.743 1.00 0.00 C ATOM 1572 CD1 LEU A 97 3.289 -9.120 1.312 1.00 0.00 C ATOM 1573 CD2 LEU A 97 2.467 -9.434 3.580 1.00 0.00 C ATOM 0 H LEU A 97 3.917 -7.978 5.412 1.00 0.00 H new ATOM 0 HA LEU A 97 6.409 -9.266 4.637 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.609 -8.967 2.318 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.929 -10.269 3.273 1.00 0.00 H new ATOM 0 HG LEU A 97 3.466 -7.670 2.892 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.286 -8.810 1.019 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.022 -8.622 0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.383 -10.200 1.196 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.480 -9.099 3.261 1.00 0.00 H new ATOM 0 HD22 LEU A 97 2.543 -10.514 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.613 -9.183 4.631 1.00 0.00 H new ATOM 1585 N ALA A 98 7.300 -7.221 3.685 1.00 0.00 N ATOM 1586 CA ALA A 98 8.051 -6.008 3.607 1.00 0.00 C ATOM 1587 C ALA A 98 8.440 -5.684 2.209 1.00 0.00 C ATOM 1588 O ALA A 98 8.398 -6.544 1.332 1.00 0.00 O ATOM 1589 CB ALA A 98 9.288 -6.102 4.482 1.00 0.00 C ATOM 0 H ALA A 98 7.762 -8.034 3.278 1.00 0.00 H new ATOM 0 HA ALA A 98 7.411 -5.202 3.967 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.853 -5.172 4.415 1.00 0.00 H new ATOM 0 HB2 ALA A 98 8.990 -6.271 5.517 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.911 -6.930 4.144 1.00 0.00 H new ATOM 1595 N ALA A 99 8.795 -4.454 2.000 1.00 0.00 N ATOM 1596 CA ALA A 99 9.316 -4.019 0.756 1.00 0.00 C ATOM 1597 C ALA A 99 10.285 -2.945 1.041 1.00 0.00 C ATOM 1598 O ALA A 99 10.082 -2.144 1.965 1.00 0.00 O ATOM 1599 CB ALA A 99 8.236 -3.526 -0.185 1.00 0.00 C ATOM 0 H ALA A 99 8.727 -3.719 2.704 1.00 0.00 H new ATOM 0 HA ALA A 99 9.792 -4.859 0.250 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.689 -3.205 -1.123 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.529 -4.332 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.712 -2.686 0.271 1.00 0.00 H new ATOM 1605 N LYS A 100 11.344 -2.919 0.316 1.00 0.00 N ATOM 1606 CA LYS A 100 12.296 -1.968 0.505 1.00 0.00 C ATOM 1607 C LYS A 100 12.727 -1.445 -0.784 1.00 0.00 C ATOM 1608 O LYS A 100 12.797 -2.149 -1.811 1.00 0.00 O ATOM 1609 CB LYS A 100 13.489 -2.474 1.269 1.00 0.00 C ATOM 1610 CG LYS A 100 14.249 -3.617 0.623 1.00 0.00 C ATOM 1611 CD LYS A 100 15.568 -3.894 1.337 1.00 0.00 C ATOM 1612 CE LYS A 100 16.500 -2.686 1.270 1.00 0.00 C ATOM 1613 NZ LYS A 100 17.814 -2.970 1.857 1.00 0.00 N ATOM 0 H LYS A 100 11.547 -3.584 -0.430 1.00 0.00 H new ATOM 0 HA LYS A 100 11.844 -1.179 1.106 1.00 0.00 H new ATOM 0 HB2 LYS A 100 14.179 -1.644 1.421 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.155 -2.796 2.256 1.00 0.00 H new ATOM 0 HG2 LYS A 100 13.633 -4.516 0.635 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.444 -3.379 -0.423 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.373 -4.148 2.379 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.055 -4.757 0.884 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.626 -2.383 0.231 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.043 -1.847 1.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.414 -2.123 1.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.698 -3.234 2.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.263 -3.754 1.341 1.00 0.00 H new ATOM 1627 N PHE A 101 12.974 -0.259 -0.721 1.00 0.00 N ATOM 1628 CA PHE A 101 13.474 0.509 -1.797 1.00 0.00 C ATOM 1629 C PHE A 101 14.991 0.589 -1.660 1.00 0.00 C ATOM 1630 O PHE A 101 15.519 0.377 -0.565 1.00 0.00 O ATOM 1631 CB PHE A 101 12.794 1.878 -1.802 1.00 0.00 C ATOM 1632 CG PHE A 101 11.328 1.809 -2.159 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.357 1.643 -1.182 1.00 0.00 C ATOM 1634 CD2 PHE A 101 10.928 1.903 -3.483 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.021 1.571 -1.521 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.592 1.834 -3.826 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.638 1.666 -2.844 1.00 0.00 C ATOM 0 H PHE A 101 12.837 0.286 0.130 1.00 0.00 H new ATOM 0 HA PHE A 101 13.251 0.049 -2.760 1.00 0.00 H new ATOM 0 HB2 PHE A 101 12.901 2.334 -0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.305 2.528 -2.512 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.650 1.569 -0.145 1.00 0.00 H new ATOM 0 HD2 PHE A 101 11.671 2.032 -4.256 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.275 1.440 -0.751 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.295 1.911 -4.861 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.593 1.609 -3.110 1.00 0.00 H new ATOM 1647 N LYS A 102 15.665 0.883 -2.756 1.00 0.00 N ATOM 1648 CA LYS A 102 17.148 0.871 -2.852 1.00 0.00 C ATOM 1649 C LYS A 102 17.820 1.750 -1.811 1.00 0.00 C ATOM 1650 O LYS A 102 18.907 1.446 -1.318 1.00 0.00 O ATOM 1651 CB LYS A 102 17.629 1.348 -4.239 1.00 0.00 C ATOM 1652 CG LYS A 102 17.274 0.490 -5.432 1.00 0.00 C ATOM 1653 CD LYS A 102 15.804 0.567 -5.786 1.00 0.00 C ATOM 1654 CE LYS A 102 15.551 -0.108 -7.097 1.00 0.00 C ATOM 1655 NZ LYS A 102 16.217 0.608 -8.210 1.00 0.00 N ATOM 0 H LYS A 102 15.208 1.144 -3.630 1.00 0.00 H new ATOM 0 HA LYS A 102 17.431 -0.167 -2.680 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.226 2.346 -4.410 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.714 1.444 -4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.868 0.804 -6.290 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.540 -0.546 -5.222 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.209 0.094 -5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.490 1.609 -5.839 1.00 0.00 H new ATOM 0 HE2 LYS A 102 15.913 -1.135 -7.055 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.478 -0.155 -7.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.737 0.382 -9.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 16.170 1.633 -8.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 17.212 0.312 -8.267 1.00 0.00 H new ATOM 1669 N THR A 103 17.180 2.810 -1.487 1.00 0.00 N ATOM 1670 CA THR A 103 17.718 3.798 -0.615 1.00 0.00 C ATOM 1671 C THR A 103 16.615 4.358 0.230 1.00 0.00 C ATOM 1672 O THR A 103 15.442 4.338 -0.206 1.00 0.00 O ATOM 1673 CB THR A 103 18.364 4.958 -1.455 1.00 0.00 C ATOM 1674 OG1 THR A 103 18.593 6.114 -0.648 1.00 0.00 O ATOM 1675 CG2 THR A 103 17.497 5.334 -2.652 1.00 0.00 C ATOM 0 H THR A 103 16.243 3.025 -1.827 1.00 0.00 H new ATOM 0 HA THR A 103 18.481 3.344 0.018 1.00 0.00 H new ATOM 0 HB THR A 103 19.321 4.587 -1.823 1.00 0.00 H new ATOM 0 HG1 THR A 103 18.997 6.820 -1.195 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.976 6.139 -3.209 1.00 0.00 H new ATOM 0 HG22 THR A 103 17.376 4.466 -3.300 1.00 0.00 H new ATOM 0 HG23 THR A 103 16.519 5.666 -2.303 1.00 0.00 H new ATOM 1683 N PRO A 104 16.933 4.860 1.461 1.00 0.00 N ATOM 1684 CA PRO A 104 15.993 5.609 2.280 1.00 0.00 C ATOM 1685 C PRO A 104 15.422 6.818 1.560 1.00 0.00 C ATOM 1686 O PRO A 104 14.632 7.435 2.048 1.00 0.00 O ATOM 1687 CB PRO A 104 16.812 6.084 3.469 1.00 0.00 C ATOM 1688 CG PRO A 104 17.874 5.061 3.602 1.00 0.00 C ATOM 1689 CD PRO A 104 18.219 4.662 2.185 1.00 0.00 C ATOM 0 HA PRO A 104 15.141 4.984 2.548 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.231 7.075 3.295 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.205 6.149 4.372 1.00 0.00 H new ATOM 0 HG2 PRO A 104 18.744 5.462 4.121 1.00 0.00 H new ATOM 0 HG3 PRO A 104 17.526 4.204 4.179 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.014 5.283 1.773 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.560 3.628 2.128 1.00 0.00 H new ATOM 1697 N GLU A 105 15.902 7.150 0.435 1.00 0.00 N ATOM 1698 CA GLU A 105 15.323 8.215 -0.360 1.00 0.00 C ATOM 1699 C GLU A 105 13.982 7.741 -0.885 1.00 0.00 C ATOM 1700 O GLU A 105 12.942 8.335 -0.635 1.00 0.00 O ATOM 1701 CB GLU A 105 16.237 8.626 -1.507 1.00 0.00 C ATOM 1702 CG GLU A 105 15.679 9.762 -2.344 1.00 0.00 C ATOM 1703 CD GLU A 105 16.626 10.205 -3.406 1.00 0.00 C ATOM 1704 OE1 GLU A 105 17.669 10.783 -3.069 1.00 0.00 O ATOM 1705 OE2 GLU A 105 16.332 10.024 -4.613 1.00 0.00 O ATOM 0 H GLU A 105 16.715 6.704 0.010 1.00 0.00 H new ATOM 0 HA GLU A 105 15.192 9.098 0.266 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.204 8.924 -1.102 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.412 7.763 -2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.744 9.444 -2.805 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.444 10.606 -1.695 1.00 0.00 H new ATOM 1712 N LEU A 106 14.034 6.577 -1.519 1.00 0.00 N ATOM 1713 CA LEU A 106 12.891 5.974 -2.152 1.00 0.00 C ATOM 1714 C LEU A 106 12.003 5.438 -1.090 1.00 0.00 C ATOM 1715 O LEU A 106 10.786 5.586 -1.119 1.00 0.00 O ATOM 1716 CB LEU A 106 13.349 4.882 -3.112 1.00 0.00 C ATOM 1717 CG LEU A 106 14.105 5.327 -4.362 1.00 0.00 C ATOM 1718 CD1 LEU A 106 14.553 4.112 -5.151 1.00 0.00 C ATOM 1719 CD2 LEU A 106 13.229 6.220 -5.233 1.00 0.00 C ATOM 0 H LEU A 106 14.888 6.025 -1.604 1.00 0.00 H new ATOM 0 HA LEU A 106 12.338 6.708 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 106 13.986 4.191 -2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.470 4.321 -3.430 1.00 0.00 H new ATOM 0 HG LEU A 106 14.980 5.900 -4.053 1.00 0.00 H new ATOM 0 HD11 LEU A 106 15.092 4.435 -6.042 1.00 0.00 H new ATOM 0 HD12 LEU A 106 15.208 3.498 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.681 3.528 -5.446 1.00 0.00 H new ATOM 0 HD21 LEU A 106 13.787 6.526 -6.118 1.00 0.00 H new ATOM 0 HD22 LEU A 106 12.338 5.670 -5.538 1.00 0.00 H new ATOM 0 HD23 LEU A 106 12.934 7.104 -4.667 1.00 0.00 H new ATOM 1731 N ALA A 107 12.654 4.876 -0.116 1.00 0.00 N ATOM 1732 CA ALA A 107 12.031 4.322 1.032 1.00 0.00 C ATOM 1733 C ALA A 107 11.419 5.435 1.877 1.00 0.00 C ATOM 1734 O ALA A 107 10.266 5.318 2.293 1.00 0.00 O ATOM 1735 CB ALA A 107 13.086 3.553 1.801 1.00 0.00 C ATOM 0 H ALA A 107 13.670 4.791 -0.106 1.00 0.00 H new ATOM 0 HA ALA A 107 11.222 3.647 0.754 1.00 0.00 H new ATOM 0 HB1 ALA A 107 12.638 3.113 2.692 1.00 0.00 H new ATOM 0 HB2 ALA A 107 13.491 2.762 1.170 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.888 4.230 2.094 1.00 0.00 H new ATOM 1741 N GLU A 108 12.158 6.540 2.104 1.00 0.00 N ATOM 1742 CA GLU A 108 11.615 7.601 3.004 1.00 0.00 C ATOM 1743 C GLU A 108 10.479 8.366 2.394 1.00 0.00 C ATOM 1744 O GLU A 108 9.461 8.568 3.058 1.00 0.00 O ATOM 1745 CB GLU A 108 12.708 8.499 3.609 1.00 0.00 C ATOM 1746 CG GLU A 108 12.333 9.314 4.813 1.00 0.00 C ATOM 1747 CD GLU A 108 13.568 9.916 5.424 1.00 0.00 C ATOM 1748 OE1 GLU A 108 14.374 9.164 6.035 1.00 0.00 O ATOM 1749 OE2 GLU A 108 13.783 11.138 5.293 1.00 0.00 O ATOM 0 H GLU A 108 13.079 6.725 1.708 1.00 0.00 H new ATOM 0 HA GLU A 108 11.180 7.073 3.852 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.555 7.867 3.878 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.054 9.181 2.833 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.636 10.102 4.528 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.823 8.687 5.544 1.00 0.00 H new ATOM 1756 N GLU A 109 10.619 8.738 1.135 1.00 0.00 N ATOM 1757 CA GLU A 109 9.549 9.449 0.431 1.00 0.00 C ATOM 1758 C GLU A 109 8.287 8.640 0.447 1.00 0.00 C ATOM 1759 O GLU A 109 7.212 9.152 0.772 1.00 0.00 O ATOM 1760 CB GLU A 109 9.918 9.697 -1.030 1.00 0.00 C ATOM 1761 CG GLU A 109 10.890 10.816 -1.274 1.00 0.00 C ATOM 1762 CD GLU A 109 10.290 12.159 -0.965 1.00 0.00 C ATOM 1763 OE1 GLU A 109 9.385 12.612 -1.718 1.00 0.00 O ATOM 1764 OE2 GLU A 109 10.721 12.801 0.001 1.00 0.00 O ATOM 0 H GLU A 109 11.454 8.565 0.576 1.00 0.00 H new ATOM 0 HA GLU A 109 9.405 10.400 0.944 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.338 8.779 -1.441 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.004 9.906 -1.586 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.778 10.665 -0.660 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.214 10.794 -2.314 1.00 0.00 H new ATOM 1771 N PHE A 110 8.429 7.362 0.171 1.00 0.00 N ATOM 1772 CA PHE A 110 7.296 6.505 0.064 1.00 0.00 C ATOM 1773 C PHE A 110 6.662 6.290 1.430 1.00 0.00 C ATOM 1774 O PHE A 110 5.487 6.359 1.545 1.00 0.00 O ATOM 1775 CB PHE A 110 7.695 5.181 -0.567 1.00 0.00 C ATOM 1776 CG PHE A 110 6.646 4.598 -1.473 1.00 0.00 C ATOM 1777 CD1 PHE A 110 5.639 3.795 -0.980 1.00 0.00 C ATOM 1778 CD2 PHE A 110 6.679 4.860 -2.836 1.00 0.00 C ATOM 1779 CE1 PHE A 110 4.686 3.261 -1.822 1.00 0.00 C ATOM 1780 CE2 PHE A 110 5.730 4.330 -3.683 1.00 0.00 C ATOM 1781 CZ PHE A 110 4.731 3.527 -3.176 1.00 0.00 C ATOM 0 H PHE A 110 9.327 6.903 0.018 1.00 0.00 H new ATOM 0 HA PHE A 110 6.556 6.979 -0.580 1.00 0.00 H new ATOM 0 HB2 PHE A 110 8.614 5.323 -1.135 1.00 0.00 H new ATOM 0 HB3 PHE A 110 7.917 4.465 0.224 1.00 0.00 H new ATOM 0 HD1 PHE A 110 5.596 3.582 0.078 1.00 0.00 H new ATOM 0 HD2 PHE A 110 7.460 5.488 -3.238 1.00 0.00 H new ATOM 0 HE1 PHE A 110 3.903 2.634 -1.421 1.00 0.00 H new ATOM 0 HE2 PHE A 110 5.769 4.543 -4.741 1.00 0.00 H new ATOM 0 HZ PHE A 110 3.986 3.107 -3.836 1.00 0.00 H new ATOM 1791 N LYS A 111 7.492 6.123 2.462 1.00 0.00 N ATOM 1792 CA LYS A 111 7.041 5.835 3.855 1.00 0.00 C ATOM 1793 C LYS A 111 6.104 6.925 4.349 1.00 0.00 C ATOM 1794 O LYS A 111 5.005 6.662 4.834 1.00 0.00 O ATOM 1795 CB LYS A 111 8.283 5.798 4.767 1.00 0.00 C ATOM 1796 CG LYS A 111 8.166 4.983 6.079 1.00 0.00 C ATOM 1797 CD LYS A 111 7.354 5.651 7.195 1.00 0.00 C ATOM 1798 CE LYS A 111 8.042 6.903 7.736 1.00 0.00 C ATOM 1799 NZ LYS A 111 7.358 7.435 8.929 1.00 0.00 N ATOM 0 H LYS A 111 8.506 6.181 2.370 1.00 0.00 H new ATOM 0 HA LYS A 111 6.512 4.882 3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.115 5.394 4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.543 6.824 5.027 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.712 4.019 5.849 1.00 0.00 H new ATOM 0 HG3 LYS A 111 9.170 4.782 6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 111 6.367 5.916 6.816 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.203 4.941 8.008 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.077 6.669 7.985 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.066 7.668 6.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.885 8.254 9.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 6.394 7.729 8.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.313 6.698 9.661 1.00 0.00 H new ATOM 1813 N GLN A 112 6.572 8.126 4.228 1.00 0.00 N ATOM 1814 CA GLN A 112 5.851 9.316 4.689 1.00 0.00 C ATOM 1815 C GLN A 112 4.543 9.478 3.982 1.00 0.00 C ATOM 1816 O GLN A 112 3.480 9.641 4.608 1.00 0.00 O ATOM 1817 CB GLN A 112 6.653 10.503 4.331 1.00 0.00 C ATOM 1818 CG GLN A 112 8.036 10.570 4.975 1.00 0.00 C ATOM 1819 CD GLN A 112 7.998 10.660 6.504 1.00 0.00 C ATOM 1820 OE1 GLN A 112 7.099 10.140 7.164 1.00 0.00 O ATOM 1821 NE2 GLN A 112 8.948 11.331 7.073 1.00 0.00 N ATOM 0 H GLN A 112 7.476 8.333 3.803 1.00 0.00 H new ATOM 0 HA GLN A 112 5.684 9.212 5.761 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.772 10.528 3.248 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.095 11.397 4.611 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.605 9.687 4.686 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.569 11.436 4.582 1.00 0.00 H new ATOM 0 HE21 GLN A 112 9.684 11.754 6.507 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.961 11.437 8.087 1.00 0.00 H new ATOM 1830 N LYS A 113 4.632 9.424 2.676 1.00 0.00 N ATOM 1831 CA LYS A 113 3.548 9.591 1.813 1.00 0.00 C ATOM 1832 C LYS A 113 2.566 8.486 1.985 1.00 0.00 C ATOM 1833 O LYS A 113 1.368 8.692 1.896 1.00 0.00 O ATOM 1834 CB LYS A 113 4.116 9.605 0.434 1.00 0.00 C ATOM 1835 CG LYS A 113 4.531 10.989 -0.034 1.00 0.00 C ATOM 1836 CD LYS A 113 5.427 10.957 -1.261 1.00 0.00 C ATOM 1837 CE LYS A 113 5.813 12.370 -1.670 1.00 0.00 C ATOM 1838 NZ LYS A 113 6.860 12.398 -2.711 1.00 0.00 N ATOM 0 H LYS A 113 5.512 9.254 2.190 1.00 0.00 H new ATOM 0 HA LYS A 113 3.009 10.515 2.020 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.981 8.943 0.399 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.378 9.202 -0.259 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.639 11.574 -0.258 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.052 11.500 0.776 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.324 10.375 -1.050 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.911 10.461 -2.083 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.929 12.892 -2.036 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.164 12.914 -0.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.895 13.343 -3.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.782 12.180 -2.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.642 11.691 -3.442 1.00 0.00 H new ATOM 1852 N PHE A 114 3.092 7.342 2.273 1.00 0.00 N ATOM 1853 CA PHE A 114 2.289 6.115 2.471 1.00 0.00 C ATOM 1854 C PHE A 114 1.319 6.307 3.635 1.00 0.00 C ATOM 1855 O PHE A 114 0.103 6.175 3.464 1.00 0.00 O ATOM 1856 CB PHE A 114 3.235 4.938 2.795 1.00 0.00 C ATOM 1857 CG PHE A 114 2.623 3.559 2.910 1.00 0.00 C ATOM 1858 CD1 PHE A 114 1.664 3.265 3.865 1.00 0.00 C ATOM 1859 CD2 PHE A 114 3.043 2.555 2.079 1.00 0.00 C ATOM 1860 CE1 PHE A 114 1.141 2.009 3.978 1.00 0.00 C ATOM 1861 CE2 PHE A 114 2.526 1.287 2.192 1.00 0.00 C ATOM 1862 CZ PHE A 114 1.574 1.015 3.141 1.00 0.00 C ATOM 0 H PHE A 114 4.096 7.200 2.385 1.00 0.00 H new ATOM 0 HA PHE A 114 1.725 5.906 1.562 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.003 4.901 2.022 1.00 0.00 H new ATOM 0 HB3 PHE A 114 3.739 5.161 3.735 1.00 0.00 H new ATOM 0 HD1 PHE A 114 1.324 4.043 4.532 1.00 0.00 H new ATOM 0 HD2 PHE A 114 3.789 2.762 1.326 1.00 0.00 H new ATOM 0 HE1 PHE A 114 0.389 1.800 4.724 1.00 0.00 H new ATOM 0 HE2 PHE A 114 2.870 0.504 1.533 1.00 0.00 H new ATOM 0 HZ PHE A 114 1.166 0.019 3.228 1.00 0.00 H new ATOM 1872 N GLU A 115 1.855 6.681 4.792 1.00 0.00 N ATOM 1873 CA GLU A 115 1.043 6.883 5.988 1.00 0.00 C ATOM 1874 C GLU A 115 0.071 8.014 5.766 1.00 0.00 C ATOM 1875 O GLU A 115 -1.093 7.919 6.149 1.00 0.00 O ATOM 1876 CB GLU A 115 1.918 7.267 7.159 1.00 0.00 C ATOM 1877 CG GLU A 115 3.005 6.297 7.493 1.00 0.00 C ATOM 1878 CD GLU A 115 3.776 6.756 8.686 1.00 0.00 C ATOM 1879 OE1 GLU A 115 3.374 6.437 9.807 1.00 0.00 O ATOM 1880 OE2 GLU A 115 4.782 7.483 8.521 1.00 0.00 O ATOM 0 H GLU A 115 2.852 6.851 4.928 1.00 0.00 H new ATOM 0 HA GLU A 115 0.515 5.952 6.194 1.00 0.00 H new ATOM 0 HB2 GLU A 115 2.371 8.236 6.950 1.00 0.00 H new ATOM 0 HB3 GLU A 115 1.285 7.394 8.037 1.00 0.00 H new ATOM 0 HG2 GLU A 115 2.575 5.315 7.688 1.00 0.00 H new ATOM 0 HG3 GLU A 115 3.676 6.188 6.641 1.00 0.00 H new ATOM 1887 N GLU A 116 0.546 9.091 5.139 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.277 10.236 4.925 1.00 0.00 C ATOM 1889 C GLU A 116 -1.471 9.869 4.074 1.00 0.00 C ATOM 1890 O GLU A 116 -2.596 10.227 4.399 1.00 0.00 O ATOM 1891 CB GLU A 116 0.474 11.414 4.318 1.00 0.00 C ATOM 1892 CG GLU A 116 -0.269 12.738 4.504 1.00 0.00 C ATOM 1893 CD GLU A 116 -0.313 13.159 5.974 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -0.968 12.476 6.794 1.00 0.00 O ATOM 1895 OE2 GLU A 116 0.349 14.160 6.337 1.00 0.00 O ATOM 0 H GLU A 116 1.497 9.175 4.779 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.616 10.566 5.907 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.461 11.487 4.775 1.00 0.00 H new ATOM 0 HB3 GLU A 116 0.628 11.234 3.254 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.220 13.516 3.917 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.285 12.642 4.122 1.00 0.00 H new ATOM 1902 N CYS A 117 -1.231 9.104 3.016 1.00 0.00 N ATOM 1903 CA CYS A 117 -2.235 8.632 2.191 1.00 0.00 C ATOM 1904 C CYS A 117 -3.192 7.745 2.951 1.00 0.00 C ATOM 1905 O CYS A 117 -4.381 7.797 2.717 1.00 0.00 O ATOM 1906 CB CYS A 117 -1.617 7.917 1.059 1.00 0.00 C ATOM 1907 SG CYS A 117 -0.730 8.975 -0.104 1.00 0.00 S ATOM 0 H CYS A 117 -0.295 8.811 2.737 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.821 9.469 1.810 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -0.926 7.171 1.451 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -2.395 7.378 0.519 1.00 0.00 H new ATOM 0 HG CYS A 117 0.463 9.216 0.352 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.678 6.968 3.906 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.534 6.113 4.695 1.00 0.00 C ATOM 1915 C GLN A 118 -4.604 6.950 5.407 1.00 0.00 C ATOM 1916 O GLN A 118 -5.774 6.634 5.336 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.729 5.354 5.764 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.737 4.337 5.279 1.00 0.00 C ATOM 1919 CD GLN A 118 -0.968 3.726 6.443 1.00 0.00 C ATOM 1920 OE1 GLN A 118 0.069 4.214 6.843 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -1.473 2.669 6.997 1.00 0.00 N ATOM 0 H GLN A 118 -1.687 6.920 4.142 1.00 0.00 H new ATOM 0 HA GLN A 118 -3.998 5.398 4.015 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.194 6.087 6.368 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.435 4.850 6.424 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.255 3.552 4.729 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.040 4.806 4.584 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.346 2.276 6.644 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.998 2.230 7.786 1.00 0.00 H new ATOM 1930 N ARG A 119 -4.197 8.006 6.103 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.182 8.875 6.784 1.00 0.00 C ATOM 1932 C ARG A 119 -5.985 9.750 5.853 1.00 0.00 C ATOM 1933 O ARG A 119 -7.195 9.909 5.958 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.593 9.732 7.913 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.013 8.987 9.113 1.00 0.00 C ATOM 1936 CD ARG A 119 -2.612 8.492 8.848 1.00 0.00 C ATOM 1937 NE ARG A 119 -1.709 9.621 8.523 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.408 9.684 8.814 1.00 0.00 C ATOM 1939 NH1 ARG A 119 0.150 8.769 9.597 1.00 0.00 N ATOM 1940 NH2 ARG A 119 0.319 10.695 8.347 1.00 0.00 N ATOM 0 H ARG A 119 -3.223 8.286 6.216 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.862 8.151 7.233 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.807 10.358 7.490 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.374 10.401 8.274 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -4.006 9.647 9.981 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -4.655 8.142 9.360 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.237 7.961 9.723 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -2.623 7.780 8.023 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.117 10.418 8.035 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.416 8.012 9.980 1.00 0.00 H new ATOM 0 HH12 ARG A 119 1.145 8.823 9.815 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.118 11.414 7.771 1.00 0.00 H new ATOM 0 HH22 ARG A 119 1.314 10.751 8.565 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.287 10.341 5.021 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.791 11.360 4.157 1.00 0.00 C ATOM 1956 C LEU A 120 -6.631 10.925 2.982 1.00 0.00 C ATOM 1957 O LEU A 120 -7.759 11.397 2.856 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.731 12.426 3.796 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.609 13.625 4.756 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -4.159 13.203 6.147 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.675 14.676 4.180 1.00 0.00 C ATOM 0 H LEU A 120 -4.295 10.146 4.887 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.537 11.844 4.788 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.759 11.935 3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.956 12.808 2.800 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.603 14.060 4.861 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.087 14.081 6.788 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.883 12.505 6.567 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.184 12.720 6.083 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.601 15.515 4.872 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.687 14.241 4.030 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.066 15.026 3.225 1.00 0.00 H new ATOM 1973 N LEU A 121 -6.177 9.903 2.244 1.00 0.00 N ATOM 1974 CA LEU A 121 -6.730 9.506 0.892 1.00 0.00 C ATOM 1975 C LEU A 121 -8.185 9.116 0.974 1.00 0.00 C ATOM 1976 O LEU A 121 -8.934 9.138 0.011 1.00 0.00 O ATOM 1977 CB LEU A 121 -5.866 8.420 0.257 1.00 0.00 C ATOM 1978 CG LEU A 121 -6.155 8.032 -1.185 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -6.077 9.244 -2.092 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -5.148 7.007 -1.627 1.00 0.00 C ATOM 0 H LEU A 121 -5.408 9.307 2.550 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.689 10.377 0.238 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.827 8.744 0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.954 7.522 0.869 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.162 7.620 -1.247 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -6.287 8.944 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -6.810 9.985 -1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.078 9.676 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.348 6.723 -2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.145 7.427 -1.554 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.220 6.127 -0.988 1.00 0.00 H new ATOM 1992 N LEU A 122 -8.528 8.815 2.141 1.00 0.00 N ATOM 1993 CA LEU A 122 -9.820 8.426 2.580 1.00 0.00 C ATOM 1994 C LEU A 122 -10.867 9.522 2.404 1.00 0.00 C ATOM 1995 O LEU A 122 -12.021 9.265 2.041 1.00 0.00 O ATOM 1996 CB LEU A 122 -9.625 8.386 4.033 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.783 7.229 4.612 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.828 7.241 6.134 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -9.255 5.876 4.084 1.00 0.00 C ATOM 0 H LEU A 122 -7.856 8.830 2.908 1.00 0.00 H new ATOM 0 HA LEU A 122 -10.152 7.530 2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -9.159 9.324 4.335 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.608 8.353 4.503 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.753 7.379 4.287 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.228 6.418 6.522 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.429 8.186 6.502 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.859 7.128 6.468 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.640 5.084 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.296 5.719 4.365 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.165 5.858 2.998 1.00 0.00 H new ATOM 2011 N ASP A 123 -10.475 10.719 2.697 1.00 0.00 N ATOM 2012 CA ASP A 123 -11.393 11.838 2.714 1.00 0.00 C ATOM 2013 C ASP A 123 -11.174 12.697 1.520 1.00 0.00 C ATOM 2014 O ASP A 123 -12.095 13.325 0.988 1.00 0.00 O ATOM 2015 CB ASP A 123 -11.131 12.660 3.958 1.00 0.00 C ATOM 2016 CG ASP A 123 -12.107 13.786 4.149 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -13.231 13.523 4.604 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -11.766 14.956 3.890 1.00 0.00 O ATOM 0 H ASP A 123 -9.513 10.961 2.933 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.417 11.465 2.706 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.167 12.007 4.830 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -10.122 13.069 3.908 1.00 0.00 H new ATOM 2023 N ILE A 124 -9.963 12.706 1.099 1.00 0.00 N ATOM 2024 CA ILE A 124 -9.542 13.531 0.044 1.00 0.00 C ATOM 2025 C ILE A 124 -9.613 12.788 -1.285 1.00 0.00 C ATOM 2026 O ILE A 124 -9.076 11.693 -1.424 1.00 0.00 O ATOM 2027 CB ILE A 124 -8.146 14.148 0.359 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -7.070 13.091 0.681 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -8.263 15.106 1.523 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -6.300 12.584 -0.525 1.00 0.00 C ATOM 0 H ILE A 124 -9.224 12.123 1.492 1.00 0.00 H new ATOM 0 HA ILE A 124 -10.224 14.375 -0.058 1.00 0.00 H new ATOM 0 HB ILE A 124 -7.826 14.668 -0.544 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.364 13.516 1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -7.548 12.244 1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.285 15.535 1.740 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -8.961 15.904 1.269 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -8.627 14.570 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -5.566 11.845 -0.204 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -6.992 12.125 -1.231 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -5.789 13.417 -1.007 1.00 0.00 H new ATOM 2042 N PRO A 125 -10.378 13.318 -2.227 1.00 0.00 N ATOM 2043 CA PRO A 125 -10.522 12.715 -3.530 1.00 0.00 C ATOM 2044 C PRO A 125 -9.249 12.838 -4.353 1.00 0.00 C ATOM 2045 O PRO A 125 -8.590 13.893 -4.361 1.00 0.00 O ATOM 2046 CB PRO A 125 -11.674 13.485 -4.179 1.00 0.00 C ATOM 2047 CG PRO A 125 -11.706 14.794 -3.474 1.00 0.00 C ATOM 2048 CD PRO A 125 -11.170 14.547 -2.090 1.00 0.00 C ATOM 0 HA PRO A 125 -10.718 11.645 -3.463 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -11.508 13.616 -5.248 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -12.618 12.952 -4.066 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -11.100 15.532 -3.999 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -12.722 15.187 -3.432 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.557 15.380 -1.745 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.976 14.423 -1.367 1.00 0.00 H new ATOM 2056 N LEU A 126 -8.887 11.780 -5.006 1.00 0.00 N ATOM 2057 CA LEU A 126 -7.742 11.779 -5.868 1.00 0.00 C ATOM 2058 C LEU A 126 -8.129 11.000 -7.089 1.00 0.00 C ATOM 2059 O LEU A 126 -8.088 9.788 -7.094 1.00 0.00 O ATOM 2060 CB LEU A 126 -6.497 11.168 -5.150 1.00 0.00 C ATOM 2061 CG LEU A 126 -5.093 11.324 -5.820 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -4.002 10.926 -4.843 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -4.946 10.481 -7.087 1.00 0.00 C ATOM 0 H LEU A 126 -9.378 10.887 -4.958 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.452 12.793 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.439 11.609 -4.155 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.683 10.102 -5.016 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.998 12.373 -6.100 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.028 11.038 -5.320 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.051 11.566 -3.962 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.142 9.887 -4.544 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.952 10.629 -7.509 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.083 9.428 -6.841 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.698 10.784 -7.815 1.00 0.00 H new ATOM 2075 N GLN A 127 -8.589 11.682 -8.082 1.00 0.00 N ATOM 2076 CA GLN A 127 -8.999 11.037 -9.292 1.00 0.00 C ATOM 2077 C GLN A 127 -8.120 11.461 -10.422 1.00 0.00 C ATOM 2078 O GLN A 127 -7.916 12.657 -10.662 1.00 0.00 O ATOM 2079 CB GLN A 127 -10.463 11.314 -9.595 1.00 0.00 C ATOM 2080 CG GLN A 127 -11.411 10.731 -8.561 1.00 0.00 C ATOM 2081 CD GLN A 127 -11.425 9.214 -8.566 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -10.645 8.556 -7.877 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -12.331 8.647 -9.293 1.00 0.00 N ATOM 0 H GLN A 127 -8.693 12.697 -8.083 1.00 0.00 H new ATOM 0 HA GLN A 127 -8.896 9.960 -9.162 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -10.617 12.391 -9.653 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -10.708 10.904 -10.575 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -11.123 11.084 -7.571 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -12.419 11.100 -8.750 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -12.964 9.216 -9.854 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -12.413 7.630 -9.305 1.00 0.00 H new ATOM 2092 N THR A 128 -7.583 10.496 -11.084 1.00 0.00 N ATOM 2093 CA THR A 128 -6.711 10.717 -12.183 1.00 0.00 C ATOM 2094 C THR A 128 -7.543 11.069 -13.431 1.00 0.00 C ATOM 2095 O THR A 128 -8.558 10.403 -13.716 1.00 0.00 O ATOM 2096 CB THR A 128 -5.876 9.443 -12.426 1.00 0.00 C ATOM 2097 OG1 THR A 128 -5.217 9.079 -11.193 1.00 0.00 O ATOM 2098 CG2 THR A 128 -4.830 9.663 -13.511 1.00 0.00 C ATOM 0 H THR A 128 -7.741 9.511 -10.872 1.00 0.00 H new ATOM 0 HA THR A 128 -6.036 11.546 -11.970 1.00 0.00 H new ATOM 0 HB THR A 128 -6.543 8.647 -12.757 1.00 0.00 H new ATOM 0 HG1 THR A 128 -4.306 8.773 -11.387 1.00 0.00 H new ATOM 0 HG21 THR A 128 -4.259 8.746 -13.657 1.00 0.00 H new ATOM 0 HG22 THR A 128 -5.325 9.935 -14.443 1.00 0.00 H new ATOM 0 HG23 THR A 128 -4.157 10.465 -13.210 1.00 0.00 H new ATOM 2106 N PRO A 129 -7.170 12.145 -14.154 1.00 0.00 N ATOM 2107 CA PRO A 129 -7.859 12.543 -15.367 1.00 0.00 C ATOM 2108 C PRO A 129 -7.793 11.448 -16.424 1.00 0.00 C ATOM 2109 O PRO A 129 -6.856 10.618 -16.446 1.00 0.00 O ATOM 2110 CB PRO A 129 -7.099 13.784 -15.842 1.00 0.00 C ATOM 2111 CG PRO A 129 -5.799 13.709 -15.156 1.00 0.00 C ATOM 2112 CD PRO A 129 -6.063 13.056 -13.841 1.00 0.00 C ATOM 0 HA PRO A 129 -8.918 12.733 -15.192 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -6.976 13.783 -16.925 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -7.632 14.699 -15.582 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -5.082 13.132 -15.741 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -5.372 14.703 -15.019 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -5.189 12.520 -13.472 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -6.339 13.782 -13.076 1.00 0.00 H new ATOM 2120 N LYS A 130 -8.747 11.430 -17.268 1.00 0.00 N ATOM 2121 CA LYS A 130 -8.844 10.447 -18.290 1.00 0.00 C ATOM 2122 C LYS A 130 -9.251 11.160 -19.549 1.00 0.00 C ATOM 2123 O LYS A 130 -8.423 11.291 -20.454 1.00 0.00 O ATOM 2124 CB LYS A 130 -9.848 9.341 -17.848 1.00 0.00 C ATOM 2125 CG LYS A 130 -10.003 8.119 -18.780 1.00 0.00 C ATOM 2126 CD LYS A 130 -10.793 8.418 -20.052 1.00 0.00 C ATOM 2127 CE LYS A 130 -12.228 8.832 -19.739 1.00 0.00 C ATOM 2128 NZ LYS A 130 -12.997 9.152 -20.956 1.00 0.00 N ATOM 2129 OXT LYS A 130 -10.372 11.691 -19.601 1.00 0.00 O ATOM 0 H LYS A 130 -9.506 12.112 -17.275 1.00 0.00 H new ATOM 0 HA LYS A 130 -7.898 9.938 -18.474 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -9.543 8.981 -16.865 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -10.828 9.802 -17.729 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -9.013 7.754 -19.054 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -10.499 7.317 -18.234 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -10.298 9.213 -20.610 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -10.800 7.536 -20.692 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -12.726 8.027 -19.198 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -12.218 9.700 -19.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.965 9.427 -20.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -12.538 9.938 -21.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -13.031 8.317 -21.575 1.00 0.00 H new TER 2143 LYS A 130