USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 942 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 91 LYS NZ :NH3+ -178:sc= 0.0203 (180deg=0) USER MOD Set 1.2: A 99 THR OG1 : rot -120:sc= 0.0165 USER MOD Set 2.1: A 44 LYS NZ :NH3+ -108:sc= -0.801 (180deg=0) USER MOD Set 2.2: A 46 ASN : amide:sc= -1.08 K(o=-1.9,f=-5.2!) USER MOD Set 3.1: A 24 GLN : amide:sc= -2.04 K(o=-1.8,f=-12!) USER MOD Set 3.2: A 26 THR OG1 : rot 73:sc= 0.224 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 18:sc= 1.55 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 CYS SG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0.042 USER MOD Single : A 32 ASN : amide:sc= -1.67! K(o=-1.7!,f=-0.68) USER MOD Single : A 34 SER OG : rot -115:sc= 0.439 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.599 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 62:sc= 0.00327 USER MOD Single : A 64 HIS : no HD1:sc= -4.18! K(o=-4.2!,f=-2.7) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -2.53 K(o=-2.5,f=-7.7!) USER MOD Single : A 79 GLN : amide:sc= -0.305 K(o=-0.3,f=-1.1) USER MOD Single : A 84 ASN : amide:sc= -0.909 K(o=-0.91,f=-0.38) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -2.43 K(o=-2.4,f=-8.2!) USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl 172:sc= -1.6 (180deg=-1.65) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -124:sc= -8.03! (180deg=-14.7!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -3.08! C(o=-3.1!,f=-3.6!) USER MOD Single : A 113 MET CE :methyl -165:sc= -0.21 (180deg=-0.753) USER MOD Single : A 115 GLN : amide:sc= -3.84! C(o=-3.8!,f=-4.5!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -39.118 67.724 -24.235 1.00 0.00 N ATOM 2 CA GLY A 1 -37.776 67.241 -24.510 1.00 0.00 C ATOM 3 C GLY A 1 -37.641 65.761 -24.149 1.00 0.00 C ATOM 4 O GLY A 1 -37.523 64.911 -25.031 1.00 0.00 O ATOM 0 H1 GLY A 1 -39.183 68.731 -24.488 1.00 0.00 H new ATOM 0 H2 GLY A 1 -39.804 67.180 -24.796 1.00 0.00 H new ATOM 0 H3 GLY A 1 -39.328 67.607 -23.223 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -37.543 67.384 -25.565 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -37.052 67.825 -23.942 1.00 0.00 H new ATOM 8 N SER A 2 -37.662 65.496 -22.851 1.00 0.00 N ATOM 9 CA SER A 2 -37.544 64.133 -22.362 1.00 0.00 C ATOM 10 C SER A 2 -36.270 63.489 -22.913 1.00 0.00 C ATOM 11 O SER A 2 -36.230 63.076 -24.071 1.00 0.00 O ATOM 12 CB SER A 2 -38.769 63.301 -22.748 1.00 0.00 C ATOM 13 OG SER A 2 -38.863 63.111 -24.157 1.00 0.00 O ATOM 0 H SER A 2 -37.759 66.203 -22.122 1.00 0.00 H new ATOM 0 HA SER A 2 -37.488 64.163 -21.274 1.00 0.00 H new ATOM 0 HB2 SER A 2 -38.718 62.331 -22.254 1.00 0.00 H new ATOM 0 HB3 SER A 2 -39.671 63.795 -22.388 1.00 0.00 H new ATOM 0 HG SER A 2 -37.994 63.297 -24.571 1.00 0.00 H new ATOM 19 N SER A 3 -35.261 63.423 -22.057 1.00 0.00 N ATOM 20 CA SER A 3 -33.989 62.836 -22.444 1.00 0.00 C ATOM 21 C SER A 3 -33.229 62.370 -21.201 1.00 0.00 C ATOM 22 O SER A 3 -33.150 63.093 -20.209 1.00 0.00 O ATOM 23 CB SER A 3 -33.143 63.830 -23.242 1.00 0.00 C ATOM 24 OG SER A 3 -32.979 63.424 -24.598 1.00 0.00 O ATOM 0 H SER A 3 -35.298 63.766 -21.097 1.00 0.00 H new ATOM 0 HA SER A 3 -34.189 61.976 -23.084 1.00 0.00 H new ATOM 0 HB2 SER A 3 -33.614 64.813 -23.212 1.00 0.00 H new ATOM 0 HB3 SER A 3 -32.164 63.931 -22.773 1.00 0.00 H new ATOM 0 HG SER A 3 -32.435 64.086 -25.074 1.00 0.00 H new ATOM 30 N GLY A 4 -32.687 61.164 -21.295 1.00 0.00 N ATOM 31 CA GLY A 4 -31.936 60.593 -20.190 1.00 0.00 C ATOM 32 C GLY A 4 -32.031 59.066 -20.193 1.00 0.00 C ATOM 33 O GLY A 4 -33.069 58.506 -20.542 1.00 0.00 O ATOM 0 H GLY A 4 -32.753 60.567 -22.119 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.891 60.896 -20.261 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -32.318 60.983 -19.246 1.00 0.00 H new ATOM 37 N SER A 5 -30.934 58.436 -19.800 1.00 0.00 N ATOM 38 CA SER A 5 -30.881 56.984 -19.753 1.00 0.00 C ATOM 39 C SER A 5 -29.558 56.529 -19.134 1.00 0.00 C ATOM 40 O SER A 5 -28.590 57.287 -19.102 1.00 0.00 O ATOM 41 CB SER A 5 -31.050 56.381 -21.149 1.00 0.00 C ATOM 42 OG SER A 5 -31.379 54.996 -21.096 1.00 0.00 O ATOM 0 H SER A 5 -30.075 58.904 -19.511 1.00 0.00 H new ATOM 0 HA SER A 5 -31.705 56.631 -19.133 1.00 0.00 H new ATOM 0 HB2 SER A 5 -31.832 56.919 -21.684 1.00 0.00 H new ATOM 0 HB3 SER A 5 -30.128 56.513 -21.715 1.00 0.00 H new ATOM 0 HG SER A 5 -31.480 54.649 -22.007 1.00 0.00 H new ATOM 48 N SER A 6 -29.559 55.292 -18.659 1.00 0.00 N ATOM 49 CA SER A 6 -28.370 54.726 -18.043 1.00 0.00 C ATOM 50 C SER A 6 -28.627 53.270 -17.650 1.00 0.00 C ATOM 51 O SER A 6 -29.776 52.861 -17.485 1.00 0.00 O ATOM 52 CB SER A 6 -27.944 55.539 -16.819 1.00 0.00 C ATOM 53 OG SER A 6 -26.575 55.929 -16.887 1.00 0.00 O ATOM 0 H SER A 6 -30.364 54.666 -18.688 1.00 0.00 H new ATOM 0 HA SER A 6 -27.558 54.762 -18.770 1.00 0.00 H new ATOM 0 HB2 SER A 6 -28.570 56.427 -16.738 1.00 0.00 H new ATOM 0 HB3 SER A 6 -28.109 54.950 -15.917 1.00 0.00 H new ATOM 0 HG SER A 6 -26.342 56.447 -16.088 1.00 0.00 H new ATOM 59 N GLY A 7 -27.539 52.528 -17.511 1.00 0.00 N ATOM 60 CA GLY A 7 -27.632 51.126 -17.140 1.00 0.00 C ATOM 61 C GLY A 7 -26.704 50.806 -15.966 1.00 0.00 C ATOM 62 O GLY A 7 -26.488 51.647 -15.094 1.00 0.00 O ATOM 0 H GLY A 7 -26.588 52.871 -17.649 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -28.660 50.885 -16.871 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -27.371 50.502 -17.995 1.00 0.00 H new ATOM 66 N LEU A 8 -26.180 49.589 -15.982 1.00 0.00 N ATOM 67 CA LEU A 8 -25.281 49.148 -14.929 1.00 0.00 C ATOM 68 C LEU A 8 -24.892 47.689 -15.175 1.00 0.00 C ATOM 69 O LEU A 8 -25.757 46.818 -15.255 1.00 0.00 O ATOM 70 CB LEU A 8 -25.903 49.396 -13.554 1.00 0.00 C ATOM 71 CG LEU A 8 -25.363 50.601 -12.780 1.00 0.00 C ATOM 72 CD1 LEU A 8 -26.497 51.538 -12.363 1.00 0.00 C ATOM 73 CD2 LEU A 8 -24.521 50.151 -11.584 1.00 0.00 C ATOM 0 H LEU A 8 -26.361 48.895 -16.707 1.00 0.00 H new ATOM 0 HA LEU A 8 -24.360 49.731 -14.945 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -26.978 49.523 -13.681 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -25.758 48.504 -12.945 1.00 0.00 H new ATOM 0 HG LEU A 8 -24.707 51.166 -13.442 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -26.086 52.386 -11.815 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -27.017 51.898 -13.251 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -27.198 50.999 -11.726 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -24.149 51.026 -11.051 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -25.135 49.551 -10.912 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -23.679 49.555 -11.936 1.00 0.00 H new ATOM 85 N LYS A 9 -23.591 47.467 -15.287 1.00 0.00 N ATOM 86 CA LYS A 9 -23.077 46.129 -15.522 1.00 0.00 C ATOM 87 C LYS A 9 -23.487 45.219 -14.361 1.00 0.00 C ATOM 88 O LYS A 9 -24.110 45.673 -13.403 1.00 0.00 O ATOM 89 CB LYS A 9 -21.568 46.169 -15.768 1.00 0.00 C ATOM 90 CG LYS A 9 -21.252 46.051 -17.260 1.00 0.00 C ATOM 91 CD LYS A 9 -20.188 47.068 -17.678 1.00 0.00 C ATOM 92 CE LYS A 9 -20.778 48.123 -18.616 1.00 0.00 C ATOM 93 NZ LYS A 9 -19.758 48.582 -19.586 1.00 0.00 N ATOM 0 H LYS A 9 -22.877 48.192 -15.219 1.00 0.00 H new ATOM 0 HA LYS A 9 -23.513 45.708 -16.428 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -21.157 47.100 -15.378 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -21.086 45.356 -15.225 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -20.903 45.043 -17.483 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -22.160 46.210 -17.841 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -19.775 47.553 -16.793 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -19.364 46.555 -18.174 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -21.634 47.707 -19.148 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -21.144 48.970 -18.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -20.175 49.298 -20.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -18.954 48.997 -19.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -19.428 47.774 -20.151 1.00 0.00 H new ATOM 107 N GLY A 10 -23.121 43.952 -14.487 1.00 0.00 N ATOM 108 CA GLY A 10 -23.442 42.975 -13.461 1.00 0.00 C ATOM 109 C GLY A 10 -22.304 41.968 -13.286 1.00 0.00 C ATOM 110 O GLY A 10 -21.775 41.807 -12.187 1.00 0.00 O ATOM 0 H GLY A 10 -22.605 43.580 -15.284 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -23.630 43.484 -12.516 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -24.359 42.450 -13.728 1.00 0.00 H new ATOM 114 N GLU A 11 -21.960 41.316 -14.387 1.00 0.00 N ATOM 115 CA GLU A 11 -20.894 40.328 -14.370 1.00 0.00 C ATOM 116 C GLU A 11 -21.282 39.144 -13.483 1.00 0.00 C ATOM 117 O GLU A 11 -21.438 39.295 -12.272 1.00 0.00 O ATOM 118 CB GLU A 11 -19.576 40.952 -13.906 1.00 0.00 C ATOM 119 CG GLU A 11 -18.875 41.673 -15.059 1.00 0.00 C ATOM 120 CD GLU A 11 -18.371 43.049 -14.620 1.00 0.00 C ATOM 121 OE1 GLU A 11 -17.445 43.073 -13.781 1.00 0.00 O ATOM 122 OE2 GLU A 11 -18.923 44.046 -15.133 1.00 0.00 O ATOM 0 H GLU A 11 -22.401 41.452 -15.297 1.00 0.00 H new ATOM 0 HA GLU A 11 -20.747 39.963 -15.386 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.768 41.655 -13.096 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.923 40.176 -13.507 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.038 41.071 -15.414 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.565 41.784 -15.896 1.00 0.00 H new ATOM 129 N PRO A 12 -21.431 37.960 -14.137 1.00 0.00 N ATOM 130 CA PRO A 12 -21.798 36.751 -13.421 1.00 0.00 C ATOM 131 C PRO A 12 -20.611 36.202 -12.627 1.00 0.00 C ATOM 132 O PRO A 12 -20.766 35.783 -11.481 1.00 0.00 O ATOM 133 CB PRO A 12 -22.289 35.792 -14.494 1.00 0.00 C ATOM 134 CG PRO A 12 -21.746 36.326 -15.810 1.00 0.00 C ATOM 135 CD PRO A 12 -21.255 37.744 -15.570 1.00 0.00 C ATOM 0 HA PRO A 12 -22.573 36.923 -12.674 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -21.932 34.780 -14.306 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -23.378 35.748 -14.510 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -20.933 35.696 -16.171 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.522 36.315 -16.576 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.211 37.856 -15.862 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -21.828 38.465 -16.152 1.00 0.00 H new ATOM 143 N ASP A 13 -19.451 36.222 -13.268 1.00 0.00 N ATOM 144 CA ASP A 13 -18.238 35.732 -12.636 1.00 0.00 C ATOM 145 C ASP A 13 -18.315 34.209 -12.507 1.00 0.00 C ATOM 146 O ASP A 13 -19.404 33.645 -12.411 1.00 0.00 O ATOM 147 CB ASP A 13 -18.073 36.318 -11.233 1.00 0.00 C ATOM 148 CG ASP A 13 -16.785 37.115 -11.012 1.00 0.00 C ATOM 149 OD1 ASP A 13 -16.223 37.577 -12.029 1.00 0.00 O ATOM 150 OD2 ASP A 13 -16.393 37.245 -9.833 1.00 0.00 O ATOM 0 H ASP A 13 -19.326 36.570 -14.219 1.00 0.00 H new ATOM 0 HA ASP A 13 -17.391 36.031 -13.253 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -18.924 36.966 -11.024 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -18.107 35.504 -10.509 1.00 0.00 H new ATOM 155 N CYS A 14 -17.145 33.587 -12.507 1.00 0.00 N ATOM 156 CA CYS A 14 -17.067 32.141 -12.391 1.00 0.00 C ATOM 157 C CYS A 14 -15.755 31.787 -11.687 1.00 0.00 C ATOM 158 O CYS A 14 -14.799 32.560 -11.721 1.00 0.00 O ATOM 159 CB CYS A 14 -17.186 31.457 -13.754 1.00 0.00 C ATOM 160 SG CYS A 14 -18.458 30.143 -13.685 1.00 0.00 S ATOM 0 H CYS A 14 -16.244 34.058 -12.585 1.00 0.00 H new ATOM 0 HA CYS A 14 -17.906 31.774 -11.800 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -17.449 32.190 -14.516 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -16.225 31.030 -14.041 1.00 0.00 H new ATOM 0 HG CYS A 14 -18.553 29.570 -14.848 1.00 0.00 H new ATOM 166 N TYR A 15 -15.753 30.617 -11.065 1.00 0.00 N ATOM 167 CA TYR A 15 -14.574 30.150 -10.354 1.00 0.00 C ATOM 168 C TYR A 15 -13.348 30.147 -11.268 1.00 0.00 C ATOM 169 O TYR A 15 -13.438 30.525 -12.435 1.00 0.00 O ATOM 170 CB TYR A 15 -14.881 28.713 -9.926 1.00 0.00 C ATOM 171 CG TYR A 15 -15.188 27.770 -11.091 1.00 0.00 C ATOM 172 CD1 TYR A 15 -14.181 27.393 -11.957 1.00 0.00 C ATOM 173 CD2 TYR A 15 -16.470 27.296 -11.276 1.00 0.00 C ATOM 174 CE1 TYR A 15 -14.470 26.505 -13.054 1.00 0.00 C ATOM 175 CE2 TYR A 15 -16.759 26.408 -12.372 1.00 0.00 C ATOM 176 CZ TYR A 15 -15.744 26.056 -13.207 1.00 0.00 C ATOM 177 OH TYR A 15 -16.017 25.218 -14.242 1.00 0.00 O ATOM 0 H TYR A 15 -16.548 29.979 -11.038 1.00 0.00 H new ATOM 0 HA TYR A 15 -14.354 30.800 -9.507 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -14.030 28.321 -9.369 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -15.732 28.721 -9.245 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -13.177 27.764 -11.812 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -17.258 27.591 -10.598 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -13.692 26.203 -13.739 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -17.759 26.030 -12.528 1.00 0.00 H new ATOM 0 HH TYR A 15 -16.967 24.978 -14.227 1.00 0.00 H new ATOM 187 N ALA A 16 -12.229 29.716 -10.703 1.00 0.00 N ATOM 188 CA ALA A 16 -10.986 29.659 -11.453 1.00 0.00 C ATOM 189 C ALA A 16 -10.639 28.198 -11.746 1.00 0.00 C ATOM 190 O ALA A 16 -10.712 27.348 -10.859 1.00 0.00 O ATOM 191 CB ALA A 16 -9.884 30.373 -10.669 1.00 0.00 C ATOM 0 H ALA A 16 -12.158 29.403 -9.735 1.00 0.00 H new ATOM 0 HA ALA A 16 -11.091 30.172 -12.409 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.951 30.330 -11.231 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -10.166 31.414 -10.512 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.749 29.884 -9.704 1.00 0.00 H new ATOM 197 N LEU A 17 -10.270 27.949 -12.994 1.00 0.00 N ATOM 198 CA LEU A 17 -9.913 26.606 -13.416 1.00 0.00 C ATOM 199 C LEU A 17 -10.921 25.610 -12.841 1.00 0.00 C ATOM 200 O LEU A 17 -11.986 26.003 -12.367 1.00 0.00 O ATOM 201 CB LEU A 17 -8.461 26.296 -13.042 1.00 0.00 C ATOM 202 CG LEU A 17 -8.144 26.274 -11.546 1.00 0.00 C ATOM 203 CD1 LEU A 17 -8.832 25.093 -10.857 1.00 0.00 C ATOM 204 CD2 LEU A 17 -6.633 26.276 -11.306 1.00 0.00 C ATOM 0 H LEU A 17 -10.211 28.656 -13.727 1.00 0.00 H new ATOM 0 HA LEU A 17 -9.965 26.521 -14.501 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -8.197 25.326 -13.463 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -7.818 27.036 -13.519 1.00 0.00 H new ATOM 0 HG LEU A 17 -8.543 27.185 -11.099 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -8.590 25.101 -9.794 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.911 25.176 -10.984 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -8.485 24.160 -11.301 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.435 26.260 -10.234 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -6.190 25.395 -11.770 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -6.196 27.174 -11.742 1.00 0.00 H new ATOM 216 N SER A 18 -10.551 24.339 -12.901 1.00 0.00 N ATOM 217 CA SER A 18 -11.410 23.284 -12.392 1.00 0.00 C ATOM 218 C SER A 18 -10.733 21.924 -12.575 1.00 0.00 C ATOM 219 O SER A 18 -9.687 21.828 -13.214 1.00 0.00 O ATOM 220 CB SER A 18 -12.772 23.297 -13.090 1.00 0.00 C ATOM 221 OG SER A 18 -12.679 22.878 -14.449 1.00 0.00 O ATOM 0 H SER A 18 -9.667 24.016 -13.295 1.00 0.00 H new ATOM 0 HA SER A 18 -11.575 23.461 -11.329 1.00 0.00 H new ATOM 0 HB2 SER A 18 -13.460 22.642 -12.555 1.00 0.00 H new ATOM 0 HB3 SER A 18 -13.191 24.302 -13.048 1.00 0.00 H new ATOM 0 HG SER A 18 -13.569 22.898 -14.859 1.00 0.00 H new ATOM 227 N LEU A 19 -11.358 20.906 -12.002 1.00 0.00 N ATOM 228 CA LEU A 19 -10.830 19.556 -12.094 1.00 0.00 C ATOM 229 C LEU A 19 -9.349 19.565 -11.708 1.00 0.00 C ATOM 230 O LEU A 19 -8.808 20.604 -11.333 1.00 0.00 O ATOM 231 CB LEU A 19 -11.100 18.967 -13.480 1.00 0.00 C ATOM 232 CG LEU A 19 -11.881 17.652 -13.510 1.00 0.00 C ATOM 233 CD1 LEU A 19 -13.288 17.862 -14.072 1.00 0.00 C ATOM 234 CD2 LEU A 19 -11.112 16.575 -14.278 1.00 0.00 C ATOM 0 H LEU A 19 -12.226 20.989 -11.472 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.340 18.899 -11.390 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -11.648 19.705 -14.066 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -10.144 18.810 -13.979 1.00 0.00 H new ATOM 0 HG LEU A 19 -11.994 17.299 -12.485 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -13.821 16.911 -14.082 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -13.827 18.574 -13.447 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -13.220 18.251 -15.088 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -11.689 15.650 -14.284 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -10.947 16.907 -15.303 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -10.151 16.399 -13.794 1.00 0.00 H new ATOM 246 N GLU A 20 -8.735 18.396 -11.813 1.00 0.00 N ATOM 247 CA GLU A 20 -7.328 18.256 -11.480 1.00 0.00 C ATOM 248 C GLU A 20 -6.985 19.110 -10.257 1.00 0.00 C ATOM 249 O GLU A 20 -6.547 20.251 -10.396 1.00 0.00 O ATOM 250 CB GLU A 20 -6.443 18.625 -12.672 1.00 0.00 C ATOM 251 CG GLU A 20 -6.902 17.902 -13.940 1.00 0.00 C ATOM 252 CD GLU A 20 -5.854 16.888 -14.403 1.00 0.00 C ATOM 253 OE1 GLU A 20 -5.945 15.729 -13.944 1.00 0.00 O ATOM 254 OE2 GLU A 20 -4.985 17.295 -15.204 1.00 0.00 O ATOM 0 H GLU A 20 -9.187 17.536 -12.124 1.00 0.00 H new ATOM 0 HA GLU A 20 -7.134 17.211 -11.236 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -6.473 19.703 -12.832 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -5.407 18.364 -12.455 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -7.847 17.393 -13.751 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.084 18.629 -14.731 1.00 0.00 H new ATOM 261 N SER A 21 -7.197 18.524 -9.088 1.00 0.00 N ATOM 262 CA SER A 21 -6.916 19.216 -7.842 1.00 0.00 C ATOM 263 C SER A 21 -5.925 18.405 -7.005 1.00 0.00 C ATOM 264 O SER A 21 -6.270 17.348 -6.480 1.00 0.00 O ATOM 265 CB SER A 21 -8.200 19.466 -7.049 1.00 0.00 C ATOM 266 OG SER A 21 -9.094 20.334 -7.741 1.00 0.00 O ATOM 0 H SER A 21 -7.560 17.577 -8.977 1.00 0.00 H new ATOM 0 HA SER A 21 -6.474 20.183 -8.080 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.696 18.515 -6.853 1.00 0.00 H new ATOM 0 HB3 SER A 21 -7.950 19.900 -6.081 1.00 0.00 H new ATOM 0 HG SER A 21 -9.902 20.468 -7.203 1.00 0.00 H new ATOM 272 N SER A 22 -4.713 18.932 -6.907 1.00 0.00 N ATOM 273 CA SER A 22 -3.669 18.270 -6.143 1.00 0.00 C ATOM 274 C SER A 22 -3.117 17.081 -6.932 1.00 0.00 C ATOM 275 O SER A 22 -3.379 16.948 -8.126 1.00 0.00 O ATOM 276 CB SER A 22 -4.193 17.807 -4.782 1.00 0.00 C ATOM 277 OG SER A 22 -3.169 17.798 -3.791 1.00 0.00 O ATOM 0 H SER A 22 -4.431 19.809 -7.344 1.00 0.00 H new ATOM 0 HA SER A 22 -2.866 18.986 -5.969 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.001 18.464 -4.462 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.614 16.806 -4.877 1.00 0.00 H new ATOM 0 HG SER A 22 -3.544 17.498 -2.936 1.00 0.00 H new ATOM 283 N GLU A 23 -2.361 16.248 -6.232 1.00 0.00 N ATOM 284 CA GLU A 23 -1.769 15.074 -6.852 1.00 0.00 C ATOM 285 C GLU A 23 -2.428 13.802 -6.317 1.00 0.00 C ATOM 286 O GLU A 23 -2.454 13.573 -5.108 1.00 0.00 O ATOM 287 CB GLU A 23 -0.256 15.042 -6.632 1.00 0.00 C ATOM 288 CG GLU A 23 0.488 15.583 -7.855 1.00 0.00 C ATOM 289 CD GLU A 23 1.862 16.130 -7.463 1.00 0.00 C ATOM 290 OE1 GLU A 23 1.889 17.242 -6.893 1.00 0.00 O ATOM 291 OE2 GLU A 23 2.855 15.424 -7.742 1.00 0.00 O ATOM 0 H GLU A 23 -2.145 16.362 -5.242 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.946 15.127 -7.926 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.000 15.636 -5.754 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.064 14.020 -6.430 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.605 14.790 -8.594 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.101 16.371 -8.324 1.00 0.00 H new ATOM 298 N GLN A 24 -2.945 13.007 -7.242 1.00 0.00 N ATOM 299 CA GLN A 24 -3.602 11.763 -6.878 1.00 0.00 C ATOM 300 C GLN A 24 -3.312 10.684 -7.923 1.00 0.00 C ATOM 301 O GLN A 24 -3.224 10.976 -9.115 1.00 0.00 O ATOM 302 CB GLN A 24 -5.109 11.969 -6.707 1.00 0.00 C ATOM 303 CG GLN A 24 -5.847 10.629 -6.691 1.00 0.00 C ATOM 304 CD GLN A 24 -6.388 10.285 -8.081 1.00 0.00 C ATOM 305 OE1 GLN A 24 -5.784 9.551 -8.846 1.00 0.00 O ATOM 306 NE2 GLN A 24 -7.556 10.854 -8.362 1.00 0.00 N ATOM 0 H GLN A 24 -2.922 13.200 -8.243 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.202 11.430 -5.920 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.303 12.506 -5.779 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.490 12.588 -7.519 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.172 9.842 -6.354 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.669 10.671 -5.977 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.007 11.458 -7.675 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.001 10.686 -9.264 1.00 0.00 H new ATOM 315 N LEU A 25 -3.170 9.459 -7.438 1.00 0.00 N ATOM 316 CA LEU A 25 -2.891 8.334 -8.315 1.00 0.00 C ATOM 317 C LEU A 25 -4.015 7.304 -8.189 1.00 0.00 C ATOM 318 O LEU A 25 -4.701 7.250 -7.170 1.00 0.00 O ATOM 319 CB LEU A 25 -1.500 7.765 -8.031 1.00 0.00 C ATOM 320 CG LEU A 25 -0.324 8.532 -8.640 1.00 0.00 C ATOM 321 CD1 LEU A 25 0.996 8.121 -7.986 1.00 0.00 C ATOM 322 CD2 LEU A 25 -0.288 8.361 -10.161 1.00 0.00 C ATOM 0 H LEU A 25 -3.243 9.221 -6.449 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.870 8.658 -9.356 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.360 7.723 -6.951 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.467 6.739 -8.397 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.466 9.594 -8.438 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.815 8.681 -8.437 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.955 8.335 -6.918 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.160 7.054 -8.136 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.557 8.916 -10.570 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.181 7.304 -10.406 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.214 8.741 -10.592 1.00 0.00 H new ATOM 334 N THR A 26 -4.168 6.511 -9.240 1.00 0.00 N ATOM 335 CA THR A 26 -5.197 5.485 -9.260 1.00 0.00 C ATOM 336 C THR A 26 -4.617 4.158 -9.751 1.00 0.00 C ATOM 337 O THR A 26 -4.322 4.005 -10.935 1.00 0.00 O ATOM 338 CB THR A 26 -6.357 5.995 -10.116 1.00 0.00 C ATOM 339 OG1 THR A 26 -6.666 7.270 -9.560 1.00 0.00 O ATOM 340 CG2 THR A 26 -7.637 5.181 -9.914 1.00 0.00 C ATOM 0 H THR A 26 -3.597 6.558 -10.084 1.00 0.00 H new ATOM 0 HA THR A 26 -5.577 5.287 -8.258 1.00 0.00 H new ATOM 0 HB THR A 26 -6.071 5.966 -11.167 1.00 0.00 H new ATOM 0 HG1 THR A 26 -5.968 7.912 -9.806 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.429 5.585 -10.545 1.00 0.00 H new ATOM 0 HG22 THR A 26 -7.453 4.141 -10.184 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.942 5.236 -8.869 1.00 0.00 H new ATOM 348 N LEU A 27 -4.470 3.231 -8.816 1.00 0.00 N ATOM 349 CA LEU A 27 -3.930 1.921 -9.138 1.00 0.00 C ATOM 350 C LEU A 27 -5.023 0.865 -8.961 1.00 0.00 C ATOM 351 O LEU A 27 -5.693 0.828 -7.930 1.00 0.00 O ATOM 352 CB LEU A 27 -2.669 1.644 -8.318 1.00 0.00 C ATOM 353 CG LEU A 27 -1.549 2.681 -8.437 1.00 0.00 C ATOM 354 CD1 LEU A 27 -1.015 2.748 -9.869 1.00 0.00 C ATOM 355 CD2 LEU A 27 -2.013 4.049 -7.934 1.00 0.00 C ATOM 0 H LEU A 27 -4.716 3.361 -7.835 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.618 1.885 -10.182 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.953 1.564 -7.269 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.272 0.674 -8.616 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.723 2.367 -7.799 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.220 3.492 -9.927 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.621 1.773 -10.156 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.823 3.027 -10.546 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.199 4.767 -8.030 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.864 4.385 -8.526 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.307 3.971 -6.887 1.00 0.00 H new ATOM 367 N GLU A 28 -5.170 0.034 -9.982 1.00 0.00 N ATOM 368 CA GLU A 28 -6.171 -1.019 -9.952 1.00 0.00 C ATOM 369 C GLU A 28 -5.536 -2.342 -9.516 1.00 0.00 C ATOM 370 O GLU A 28 -4.333 -2.539 -9.676 1.00 0.00 O ATOM 371 CB GLU A 28 -6.858 -1.162 -11.311 1.00 0.00 C ATOM 372 CG GLU A 28 -7.748 0.047 -11.605 1.00 0.00 C ATOM 373 CD GLU A 28 -7.909 0.256 -13.112 1.00 0.00 C ATOM 374 OE1 GLU A 28 -6.874 0.517 -13.763 1.00 0.00 O ATOM 375 OE2 GLU A 28 -9.064 0.150 -13.579 1.00 0.00 O ATOM 0 H GLU A 28 -4.613 0.068 -10.836 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.935 -0.747 -9.223 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.106 -1.264 -12.094 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.458 -2.072 -11.325 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.727 -0.098 -11.148 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.315 0.940 -11.155 1.00 0.00 H new ATOM 382 N ILE A 29 -6.375 -3.214 -8.976 1.00 0.00 N ATOM 383 CA ILE A 29 -5.911 -4.512 -8.517 1.00 0.00 C ATOM 384 C ILE A 29 -7.011 -5.551 -8.742 1.00 0.00 C ATOM 385 O ILE A 29 -8.124 -5.400 -8.239 1.00 0.00 O ATOM 386 CB ILE A 29 -5.432 -4.427 -7.066 1.00 0.00 C ATOM 387 CG1 ILE A 29 -4.106 -3.670 -6.969 1.00 0.00 C ATOM 388 CG2 ILE A 29 -5.344 -5.819 -6.436 1.00 0.00 C ATOM 389 CD1 ILE A 29 -3.572 -3.680 -5.535 1.00 0.00 C ATOM 0 H ILE A 29 -7.373 -3.047 -8.846 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.045 -4.834 -9.096 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.168 -3.860 -6.496 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.374 -4.125 -7.637 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.245 -2.641 -7.302 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.001 -5.731 -5.405 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.327 -6.289 -6.453 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.640 -6.430 -7.001 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.629 -3.135 -5.494 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.296 -3.203 -4.874 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.411 -4.709 -5.214 1.00 0.00 H new ATOM 401 N PRO A 30 -6.653 -6.609 -9.517 1.00 0.00 N ATOM 402 CA PRO A 30 -7.597 -7.672 -9.814 1.00 0.00 C ATOM 403 C PRO A 30 -7.797 -8.584 -8.602 1.00 0.00 C ATOM 404 O PRO A 30 -6.828 -9.005 -7.972 1.00 0.00 O ATOM 405 CB PRO A 30 -7.008 -8.398 -11.013 1.00 0.00 C ATOM 406 CG PRO A 30 -5.538 -8.012 -11.052 1.00 0.00 C ATOM 407 CD PRO A 30 -5.344 -6.820 -10.129 1.00 0.00 C ATOM 0 HA PRO A 30 -8.594 -7.296 -10.043 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.126 -9.477 -10.913 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.513 -8.106 -11.934 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.915 -8.848 -10.732 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.236 -7.760 -12.069 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.583 -7.022 -9.376 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.019 -5.939 -10.683 1.00 0.00 H new ATOM 415 N LEU A 31 -9.059 -8.861 -8.312 1.00 0.00 N ATOM 416 CA LEU A 31 -9.398 -9.715 -7.186 1.00 0.00 C ATOM 417 C LEU A 31 -9.990 -11.027 -7.706 1.00 0.00 C ATOM 418 O LEU A 31 -11.050 -11.456 -7.253 1.00 0.00 O ATOM 419 CB LEU A 31 -10.310 -8.974 -6.207 1.00 0.00 C ATOM 420 CG LEU A 31 -9.864 -7.566 -5.809 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.704 -7.032 -4.647 1.00 0.00 C ATOM 422 CD2 LEU A 31 -8.367 -7.533 -5.495 1.00 0.00 C ATOM 0 H LEU A 31 -9.860 -8.509 -8.837 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.503 -9.971 -6.620 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.305 -8.908 -6.647 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.402 -9.574 -5.302 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.030 -6.903 -6.658 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.366 -6.030 -4.384 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.753 -6.995 -4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.593 -7.690 -3.785 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.076 -6.521 -5.215 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.153 -8.213 -4.671 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.804 -7.842 -6.376 1.00 0.00 H new ATOM 434 N ASN A 32 -9.280 -11.626 -8.650 1.00 0.00 N ATOM 435 CA ASN A 32 -9.722 -12.880 -9.237 1.00 0.00 C ATOM 436 C ASN A 32 -9.412 -14.026 -8.272 1.00 0.00 C ATOM 437 O ASN A 32 -10.323 -14.690 -7.778 1.00 0.00 O ATOM 438 CB ASN A 32 -8.993 -13.160 -10.552 1.00 0.00 C ATOM 439 CG ASN A 32 -9.300 -12.078 -11.590 1.00 0.00 C ATOM 440 OD1 ASN A 32 -10.380 -12.011 -12.154 1.00 0.00 O ATOM 441 ND2 ASN A 32 -8.293 -11.238 -11.810 1.00 0.00 N ATOM 0 H ASN A 32 -8.401 -11.267 -9.023 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.793 -12.804 -9.427 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -7.919 -13.204 -10.374 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.292 -14.135 -10.938 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.399 -10.481 -12.485 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.415 -11.351 -11.303 1.00 0.00 H new ATOM 448 N ASP A 33 -8.125 -14.224 -8.032 1.00 0.00 N ATOM 449 CA ASP A 33 -7.684 -15.279 -7.135 1.00 0.00 C ATOM 450 C ASP A 33 -7.583 -14.724 -5.713 1.00 0.00 C ATOM 451 O ASP A 33 -7.830 -15.441 -4.744 1.00 0.00 O ATOM 452 CB ASP A 33 -6.304 -15.803 -7.537 1.00 0.00 C ATOM 453 CG ASP A 33 -6.141 -17.322 -7.457 1.00 0.00 C ATOM 454 OD1 ASP A 33 -6.941 -17.941 -6.723 1.00 0.00 O ATOM 455 OD2 ASP A 33 -5.219 -17.831 -8.132 1.00 0.00 O ATOM 0 H ASP A 33 -7.372 -13.672 -8.443 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.408 -16.092 -7.189 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -6.094 -15.483 -8.558 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.555 -15.338 -6.897 1.00 0.00 H new ATOM 460 N SER A 34 -7.219 -13.453 -5.632 1.00 0.00 N ATOM 461 CA SER A 34 -7.082 -12.793 -4.345 1.00 0.00 C ATOM 462 C SER A 34 -8.464 -12.497 -3.759 1.00 0.00 C ATOM 463 O SER A 34 -8.700 -12.715 -2.572 1.00 0.00 O ATOM 464 CB SER A 34 -6.271 -11.502 -4.470 1.00 0.00 C ATOM 465 OG SER A 34 -5.161 -11.481 -3.577 1.00 0.00 O ATOM 0 H SER A 34 -7.014 -12.862 -6.438 1.00 0.00 H new ATOM 0 HA SER A 34 -6.545 -13.463 -3.673 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.914 -11.396 -5.494 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.916 -10.647 -4.267 1.00 0.00 H new ATOM 0 HG SER A 34 -5.282 -10.763 -2.921 1.00 0.00 H new ATOM 471 N GLY A 35 -9.343 -12.003 -4.620 1.00 0.00 N ATOM 472 CA GLY A 35 -10.696 -11.675 -4.203 1.00 0.00 C ATOM 473 C GLY A 35 -11.246 -12.732 -3.245 1.00 0.00 C ATOM 474 O GLY A 35 -11.940 -12.403 -2.284 1.00 0.00 O ATOM 0 H GLY A 35 -9.144 -11.822 -5.604 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.704 -10.699 -3.717 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -11.342 -11.601 -5.078 1.00 0.00 H new ATOM 478 N SER A 36 -10.917 -13.981 -3.540 1.00 0.00 N ATOM 479 CA SER A 36 -11.370 -15.089 -2.716 1.00 0.00 C ATOM 480 C SER A 36 -11.366 -14.681 -1.242 1.00 0.00 C ATOM 481 O SER A 36 -12.419 -14.611 -0.610 1.00 0.00 O ATOM 482 CB SER A 36 -10.494 -16.326 -2.927 1.00 0.00 C ATOM 483 OG SER A 36 -11.055 -17.220 -3.885 1.00 0.00 O ATOM 0 H SER A 36 -10.342 -14.250 -4.338 1.00 0.00 H new ATOM 0 HA SER A 36 -12.388 -15.343 -3.013 1.00 0.00 H new ATOM 0 HB2 SER A 36 -9.503 -16.016 -3.257 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.366 -16.846 -1.978 1.00 0.00 H new ATOM 0 HG SER A 36 -10.466 -17.996 -3.993 1.00 0.00 H new ATOM 489 N ALA A 37 -10.169 -14.423 -0.735 1.00 0.00 N ATOM 490 CA ALA A 37 -10.014 -14.023 0.653 1.00 0.00 C ATOM 491 C ALA A 37 -9.987 -12.496 0.740 1.00 0.00 C ATOM 492 O ALA A 37 -10.372 -11.922 1.757 1.00 0.00 O ATOM 493 CB ALA A 37 -8.749 -14.663 1.230 1.00 0.00 C ATOM 0 H ALA A 37 -9.297 -14.483 -1.261 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.857 -14.371 1.249 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.632 -14.363 2.271 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.831 -15.748 1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -7.881 -14.334 0.658 1.00 0.00 H new ATOM 499 N GLY A 38 -9.528 -11.882 -0.340 1.00 0.00 N ATOM 500 CA GLY A 38 -9.446 -10.432 -0.399 1.00 0.00 C ATOM 501 C GLY A 38 -8.108 -9.982 -0.989 1.00 0.00 C ATOM 502 O GLY A 38 -7.259 -10.811 -1.315 1.00 0.00 O ATOM 0 H GLY A 38 -9.209 -12.362 -1.182 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -10.264 -10.042 -1.005 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.564 -10.016 0.602 1.00 0.00 H new ATOM 506 N LEU A 39 -7.962 -8.671 -1.110 1.00 0.00 N ATOM 507 CA LEU A 39 -6.742 -8.101 -1.656 1.00 0.00 C ATOM 508 C LEU A 39 -5.539 -8.895 -1.141 1.00 0.00 C ATOM 509 O LEU A 39 -4.865 -9.576 -1.912 1.00 0.00 O ATOM 510 CB LEU A 39 -6.667 -6.604 -1.350 1.00 0.00 C ATOM 511 CG LEU A 39 -7.441 -5.686 -2.299 1.00 0.00 C ATOM 512 CD1 LEU A 39 -7.734 -4.337 -1.639 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.704 -5.526 -3.630 1.00 0.00 C ATOM 0 H LEU A 39 -8.668 -7.987 -0.839 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.736 -8.181 -2.743 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.036 -6.441 -0.337 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.619 -6.303 -1.359 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.402 -6.152 -2.518 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.285 -3.704 -2.334 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.331 -4.494 -0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.796 -3.851 -1.371 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.276 -4.869 -4.286 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.720 -5.093 -3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.591 -6.502 -4.103 1.00 0.00 H new ATOM 525 N GLY A 40 -5.306 -8.779 0.158 1.00 0.00 N ATOM 526 CA GLY A 40 -4.196 -9.477 0.784 1.00 0.00 C ATOM 527 C GLY A 40 -3.170 -8.488 1.341 1.00 0.00 C ATOM 528 O GLY A 40 -1.988 -8.810 1.452 1.00 0.00 O ATOM 0 H GLY A 40 -5.867 -8.212 0.794 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.568 -10.112 1.588 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.717 -10.132 0.056 1.00 0.00 H new ATOM 532 N VAL A 41 -3.660 -7.304 1.677 1.00 0.00 N ATOM 533 CA VAL A 41 -2.801 -6.265 2.220 1.00 0.00 C ATOM 534 C VAL A 41 -3.412 -5.729 3.515 1.00 0.00 C ATOM 535 O VAL A 41 -4.633 -5.713 3.670 1.00 0.00 O ATOM 536 CB VAL A 41 -2.570 -5.175 1.171 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.575 -5.640 0.106 1.00 0.00 C ATOM 538 CG2 VAL A 41 -3.891 -4.740 0.534 1.00 0.00 C ATOM 0 H VAL A 41 -4.641 -7.041 1.584 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.820 -6.671 2.468 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.140 -4.310 1.676 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.429 -4.846 -0.627 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.622 -5.878 0.578 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.964 -6.528 -0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.699 -3.965 -0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.361 -5.596 0.051 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.555 -4.348 1.305 1.00 0.00 H new ATOM 548 N SER A 42 -2.537 -5.301 4.413 1.00 0.00 N ATOM 549 CA SER A 42 -2.976 -4.765 5.690 1.00 0.00 C ATOM 550 C SER A 42 -2.904 -3.237 5.669 1.00 0.00 C ATOM 551 O SER A 42 -1.965 -2.664 5.119 1.00 0.00 O ATOM 552 CB SER A 42 -2.132 -5.320 6.840 1.00 0.00 C ATOM 553 OG SER A 42 -2.896 -5.483 8.032 1.00 0.00 O ATOM 0 H SER A 42 -1.526 -5.315 4.281 1.00 0.00 H new ATOM 0 HA SER A 42 -4.009 -5.072 5.852 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.707 -6.280 6.547 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.296 -4.648 7.034 1.00 0.00 H new ATOM 0 HG SER A 42 -2.323 -5.841 8.742 1.00 0.00 H new ATOM 559 N LEU A 43 -3.908 -2.620 6.275 1.00 0.00 N ATOM 560 CA LEU A 43 -3.970 -1.170 6.333 1.00 0.00 C ATOM 561 C LEU A 43 -3.874 -0.717 7.791 1.00 0.00 C ATOM 562 O LEU A 43 -3.831 -1.545 8.700 1.00 0.00 O ATOM 563 CB LEU A 43 -5.218 -0.658 5.611 1.00 0.00 C ATOM 564 CG LEU A 43 -5.593 -1.389 4.320 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.515 -0.531 3.452 1.00 0.00 C ATOM 566 CD2 LEU A 43 -4.343 -1.837 3.560 1.00 0.00 C ATOM 0 H LEU A 43 -4.685 -3.098 6.730 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.122 -0.731 5.806 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.062 -0.719 6.298 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.072 0.397 5.379 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.147 -2.289 4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.766 -1.074 2.541 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.428 -0.305 4.003 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.009 0.399 3.192 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.638 -2.354 2.647 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.740 -0.965 3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.759 -2.512 4.186 1.00 0.00 H new ATOM 578 N LYS A 44 -3.842 0.595 7.969 1.00 0.00 N ATOM 579 CA LYS A 44 -3.752 1.168 9.301 1.00 0.00 C ATOM 580 C LYS A 44 -4.710 2.356 9.407 1.00 0.00 C ATOM 581 O LYS A 44 -4.997 3.017 8.410 1.00 0.00 O ATOM 582 CB LYS A 44 -2.300 1.517 9.637 1.00 0.00 C ATOM 583 CG LYS A 44 -2.165 2.993 10.018 1.00 0.00 C ATOM 584 CD LYS A 44 -0.695 3.389 10.163 1.00 0.00 C ATOM 585 CE LYS A 44 -0.338 4.531 9.209 1.00 0.00 C ATOM 586 NZ LYS A 44 -0.917 5.806 9.687 1.00 0.00 N ATOM 0 H LYS A 44 -3.877 1.278 7.212 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.063 0.440 10.050 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.953 0.892 10.460 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.662 1.299 8.780 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.639 3.613 9.258 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.690 3.180 10.955 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.496 3.693 11.191 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -0.060 2.527 9.958 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.745 4.623 9.132 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.711 4.308 8.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -1.708 6.081 9.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.263 5.687 10.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -0.188 6.548 9.667 1.00 0.00 H new ATOM 600 N GLY A 45 -5.178 2.591 10.624 1.00 0.00 N ATOM 601 CA GLY A 45 -6.098 3.688 10.873 1.00 0.00 C ATOM 602 C GLY A 45 -5.398 4.836 11.603 1.00 0.00 C ATOM 603 O GLY A 45 -4.689 4.613 12.583 1.00 0.00 O ATOM 0 H GLY A 45 -4.937 2.041 11.448 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.505 4.048 9.928 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -6.940 3.333 11.468 1.00 0.00 H new ATOM 607 N ASN A 46 -5.621 6.040 11.097 1.00 0.00 N ATOM 608 CA ASN A 46 -5.020 7.223 11.689 1.00 0.00 C ATOM 609 C ASN A 46 -6.120 8.106 12.282 1.00 0.00 C ATOM 610 O ASN A 46 -7.054 8.494 11.582 1.00 0.00 O ATOM 611 CB ASN A 46 -4.270 8.044 10.638 1.00 0.00 C ATOM 612 CG ASN A 46 -2.756 7.920 10.824 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.267 7.341 11.780 1.00 0.00 O ATOM 614 ND2 ASN A 46 -2.044 8.494 9.858 1.00 0.00 N ATOM 0 H ASN A 46 -6.209 6.222 10.284 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.320 6.897 12.459 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.547 7.704 9.640 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.565 9.091 10.711 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -1.025 8.465 9.890 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.517 8.963 9.085 1.00 0.00 H new ATOM 621 N LYS A 47 -5.973 8.398 13.566 1.00 0.00 N ATOM 622 CA LYS A 47 -6.943 9.228 14.260 1.00 0.00 C ATOM 623 C LYS A 47 -6.261 10.513 14.734 1.00 0.00 C ATOM 624 O LYS A 47 -5.057 10.526 14.982 1.00 0.00 O ATOM 625 CB LYS A 47 -7.616 8.438 15.385 1.00 0.00 C ATOM 626 CG LYS A 47 -8.213 9.379 16.434 1.00 0.00 C ATOM 627 CD LYS A 47 -7.140 9.864 17.410 1.00 0.00 C ATOM 628 CE LYS A 47 -7.349 9.260 18.800 1.00 0.00 C ATOM 629 NZ LYS A 47 -6.410 8.139 19.024 1.00 0.00 N ATOM 0 H LYS A 47 -5.197 8.075 14.144 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.746 9.523 13.584 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -8.400 7.805 14.971 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.888 7.777 15.856 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.674 10.235 15.940 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.002 8.864 16.982 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.153 9.591 17.036 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -7.167 10.952 17.475 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -7.200 10.025 19.562 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -8.376 8.908 18.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.565 7.740 19.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.572 7.402 18.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.432 8.485 18.950 1.00 0.00 H new ATOM 643 N SER A 48 -7.062 11.563 14.846 1.00 0.00 N ATOM 644 CA SER A 48 -6.551 12.850 15.286 1.00 0.00 C ATOM 645 C SER A 48 -7.210 13.251 16.607 1.00 0.00 C ATOM 646 O SER A 48 -8.431 13.186 16.740 1.00 0.00 O ATOM 647 CB SER A 48 -6.787 13.928 14.226 1.00 0.00 C ATOM 648 OG SER A 48 -5.577 14.574 13.842 1.00 0.00 O ATOM 0 H SER A 48 -8.061 11.548 14.640 1.00 0.00 H new ATOM 0 HA SER A 48 -5.476 12.757 15.438 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.252 13.478 13.349 1.00 0.00 H new ATOM 0 HB3 SER A 48 -7.487 14.669 14.612 1.00 0.00 H new ATOM 0 HG SER A 48 -5.770 15.254 13.163 1.00 0.00 H new ATOM 654 N ARG A 49 -6.372 13.657 17.550 1.00 0.00 N ATOM 655 CA ARG A 49 -6.858 14.069 18.856 1.00 0.00 C ATOM 656 C ARG A 49 -7.286 15.537 18.824 1.00 0.00 C ATOM 657 O ARG A 49 -8.369 15.882 19.295 1.00 0.00 O ATOM 658 CB ARG A 49 -5.783 13.881 19.928 1.00 0.00 C ATOM 659 CG ARG A 49 -6.267 12.936 21.030 1.00 0.00 C ATOM 660 CD ARG A 49 -6.011 13.533 22.415 1.00 0.00 C ATOM 661 NE ARG A 49 -7.293 13.718 23.131 1.00 0.00 N ATOM 662 CZ ARG A 49 -8.173 14.691 22.856 1.00 0.00 C ATOM 663 NH1 ARG A 49 -7.914 15.572 21.881 1.00 0.00 N ATOM 664 NH2 ARG A 49 -9.311 14.783 23.558 1.00 0.00 N ATOM 0 H ARG A 49 -5.360 13.709 17.435 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.715 13.443 19.104 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.877 13.481 19.473 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -5.523 14.847 20.361 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -7.332 12.741 20.905 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.755 11.978 20.943 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -5.356 12.876 22.988 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -5.497 14.490 22.319 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.521 13.065 23.880 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -7.047 15.502 21.348 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -8.584 16.312 21.672 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -9.507 14.113 24.301 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -9.981 15.523 23.349 1.00 0.00 H new ATOM 678 N GLU A 50 -6.414 16.363 18.264 1.00 0.00 N ATOM 679 CA GLU A 50 -6.688 17.786 18.165 1.00 0.00 C ATOM 680 C GLU A 50 -8.155 18.020 17.796 1.00 0.00 C ATOM 681 O GLU A 50 -8.881 18.696 18.523 1.00 0.00 O ATOM 682 CB GLU A 50 -5.755 18.455 17.154 1.00 0.00 C ATOM 683 CG GLU A 50 -4.401 18.779 17.788 1.00 0.00 C ATOM 684 CD GLU A 50 -4.226 20.289 17.967 1.00 0.00 C ATOM 685 OE1 GLU A 50 -4.756 20.806 18.974 1.00 0.00 O ATOM 686 OE2 GLU A 50 -3.567 20.891 17.093 1.00 0.00 O ATOM 0 H GLU A 50 -5.517 16.073 17.874 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.501 18.241 19.138 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.611 17.798 16.296 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.214 19.370 16.781 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.320 18.283 18.755 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.599 18.388 17.161 1.00 0.00 H new ATOM 693 N THR A 51 -8.546 17.448 16.667 1.00 0.00 N ATOM 694 CA THR A 51 -9.913 17.585 16.193 1.00 0.00 C ATOM 695 C THR A 51 -10.819 16.557 16.873 1.00 0.00 C ATOM 696 O THR A 51 -11.947 16.872 17.250 1.00 0.00 O ATOM 697 CB THR A 51 -9.898 17.468 14.668 1.00 0.00 C ATOM 698 OG1 THR A 51 -9.438 16.141 14.426 1.00 0.00 O ATOM 699 CG2 THR A 51 -8.832 18.355 14.022 1.00 0.00 C ATOM 0 H THR A 51 -7.940 16.889 16.066 1.00 0.00 H new ATOM 0 HA THR A 51 -10.327 18.559 16.455 1.00 0.00 H new ATOM 0 HB THR A 51 -10.879 17.735 14.275 1.00 0.00 H new ATOM 0 HG1 THR A 51 -9.400 15.979 13.460 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.865 18.233 12.939 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.023 19.398 14.276 1.00 0.00 H new ATOM 0 HG23 THR A 51 -7.847 18.067 14.390 1.00 0.00 H new ATOM 707 N GLY A 52 -10.292 15.349 17.009 1.00 0.00 N ATOM 708 CA GLY A 52 -11.039 14.273 17.637 1.00 0.00 C ATOM 709 C GLY A 52 -11.888 13.522 16.609 1.00 0.00 C ATOM 710 O GLY A 52 -13.079 13.302 16.823 1.00 0.00 O ATOM 0 H GLY A 52 -9.356 15.092 16.695 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.350 13.581 18.120 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.682 14.679 18.418 1.00 0.00 H new ATOM 714 N THR A 53 -11.241 13.149 15.514 1.00 0.00 N ATOM 715 CA THR A 53 -11.921 12.427 14.452 1.00 0.00 C ATOM 716 C THR A 53 -10.968 11.432 13.788 1.00 0.00 C ATOM 717 O THR A 53 -9.776 11.410 14.094 1.00 0.00 O ATOM 718 CB THR A 53 -12.501 13.455 13.479 1.00 0.00 C ATOM 719 OG1 THR A 53 -13.131 14.415 14.322 1.00 0.00 O ATOM 720 CG2 THR A 53 -13.648 12.886 12.641 1.00 0.00 C ATOM 0 H THR A 53 -10.253 13.333 15.340 1.00 0.00 H new ATOM 0 HA THR A 53 -12.743 11.828 14.844 1.00 0.00 H new ATOM 0 HB THR A 53 -11.712 13.814 12.818 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.533 15.120 13.772 1.00 0.00 H new ATOM 0 HG21 THR A 53 -14.023 13.656 11.967 1.00 0.00 H new ATOM 0 HG22 THR A 53 -13.287 12.039 12.058 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.452 12.557 13.300 1.00 0.00 H new ATOM 728 N ASP A 54 -11.527 10.632 12.892 1.00 0.00 N ATOM 729 CA ASP A 54 -10.742 9.637 12.182 1.00 0.00 C ATOM 730 C ASP A 54 -10.378 10.175 10.797 1.00 0.00 C ATOM 731 O ASP A 54 -11.235 10.276 9.921 1.00 0.00 O ATOM 732 CB ASP A 54 -11.534 8.342 11.994 1.00 0.00 C ATOM 733 CG ASP A 54 -12.271 7.847 13.240 1.00 0.00 C ATOM 734 OD1 ASP A 54 -11.626 7.125 14.031 1.00 0.00 O ATOM 735 OD2 ASP A 54 -13.462 8.202 13.374 1.00 0.00 O ATOM 0 H ASP A 54 -12.516 10.653 12.641 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.848 9.430 12.770 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -12.261 8.491 11.196 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -10.850 7.561 11.661 1.00 0.00 H new ATOM 740 N LEU A 55 -9.104 10.505 10.642 1.00 0.00 N ATOM 741 CA LEU A 55 -8.615 11.030 9.378 1.00 0.00 C ATOM 742 C LEU A 55 -9.121 10.147 8.235 1.00 0.00 C ATOM 743 O LEU A 55 -9.747 10.639 7.297 1.00 0.00 O ATOM 744 CB LEU A 55 -7.093 11.179 9.412 1.00 0.00 C ATOM 745 CG LEU A 55 -6.535 12.122 10.480 1.00 0.00 C ATOM 746 CD1 LEU A 55 -5.005 12.119 10.469 1.00 0.00 C ATOM 747 CD2 LEU A 55 -7.106 13.532 10.318 1.00 0.00 C ATOM 0 H LEU A 55 -8.396 10.419 11.371 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.006 12.033 9.205 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.654 10.192 9.562 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.760 11.531 8.435 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.851 11.756 11.457 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.634 12.797 11.237 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.642 11.111 10.669 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.648 12.447 9.493 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.693 14.182 11.089 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.841 13.921 9.335 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.191 13.498 10.414 1.00 0.00 H new ATOM 759 N GLY A 56 -8.832 8.860 8.351 1.00 0.00 N ATOM 760 CA GLY A 56 -9.249 7.904 7.339 1.00 0.00 C ATOM 761 C GLY A 56 -8.469 6.594 7.466 1.00 0.00 C ATOM 762 O GLY A 56 -8.138 6.170 8.572 1.00 0.00 O ATOM 0 H GLY A 56 -8.314 8.456 9.131 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.316 7.707 7.438 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.094 8.329 6.347 1.00 0.00 H new ATOM 766 N ILE A 57 -8.199 5.990 6.319 1.00 0.00 N ATOM 767 CA ILE A 57 -7.464 4.737 6.288 1.00 0.00 C ATOM 768 C ILE A 57 -6.154 4.938 5.523 1.00 0.00 C ATOM 769 O ILE A 57 -6.102 5.706 4.563 1.00 0.00 O ATOM 770 CB ILE A 57 -8.339 3.616 5.724 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.578 3.397 6.595 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.532 2.329 5.541 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.191 2.853 7.971 1.00 0.00 C ATOM 0 H ILE A 57 -8.476 6.345 5.404 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.199 4.426 7.299 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.688 3.919 4.737 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -10.117 4.337 6.710 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.255 2.700 6.102 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.178 1.549 5.139 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.709 2.511 4.850 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.133 2.010 6.504 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.090 2.706 8.570 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.674 1.901 7.853 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.533 3.564 8.471 1.00 0.00 H new ATOM 785 N PHE A 58 -5.127 4.235 5.977 1.00 0.00 N ATOM 786 CA PHE A 58 -3.820 4.326 5.348 1.00 0.00 C ATOM 787 C PHE A 58 -3.156 2.950 5.261 1.00 0.00 C ATOM 788 O PHE A 58 -3.088 2.226 6.253 1.00 0.00 O ATOM 789 CB PHE A 58 -2.963 5.238 6.228 1.00 0.00 C ATOM 790 CG PHE A 58 -3.559 6.630 6.447 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.714 6.773 7.151 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.934 7.726 5.938 1.00 0.00 C ATOM 793 CE1 PHE A 58 -5.267 8.065 7.355 1.00 0.00 C ATOM 794 CE2 PHE A 58 -3.487 9.018 6.141 1.00 0.00 C ATOM 795 CZ PHE A 58 -4.642 9.160 6.846 1.00 0.00 C ATOM 0 H PHE A 58 -5.173 3.599 6.773 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.921 4.715 4.335 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.818 4.760 7.197 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.978 5.343 5.774 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.211 5.903 7.555 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -2.017 7.613 5.379 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -6.184 8.178 7.914 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.991 9.888 5.736 1.00 0.00 H new ATOM 0 HZ PHE A 58 -5.062 10.143 7.001 1.00 0.00 H new ATOM 805 N ILE A 59 -2.684 2.632 4.065 1.00 0.00 N ATOM 806 CA ILE A 59 -2.027 1.356 3.836 1.00 0.00 C ATOM 807 C ILE A 59 -0.930 1.156 4.883 1.00 0.00 C ATOM 808 O ILE A 59 -0.376 2.125 5.399 1.00 0.00 O ATOM 809 CB ILE A 59 -1.525 1.263 2.393 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.673 1.458 1.400 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.778 -0.051 2.156 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.183 1.300 -0.041 1.00 0.00 C ATOM 0 H ILE A 59 -2.743 3.235 3.245 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.735 0.536 3.956 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.814 2.072 2.225 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.461 0.732 1.602 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -3.110 2.448 1.533 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.432 -0.092 1.123 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.078 -0.109 2.828 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.447 -0.890 2.348 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -3.018 1.443 -0.727 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.413 2.043 -0.247 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.769 0.301 -0.177 1.00 0.00 H new ATOM 824 N LYS A 60 -0.648 -0.107 5.165 1.00 0.00 N ATOM 825 CA LYS A 60 0.373 -0.447 6.141 1.00 0.00 C ATOM 826 C LYS A 60 1.603 -0.996 5.416 1.00 0.00 C ATOM 827 O LYS A 60 2.721 -0.535 5.644 1.00 0.00 O ATOM 828 CB LYS A 60 -0.192 -1.396 7.200 1.00 0.00 C ATOM 829 CG LYS A 60 0.862 -1.723 8.261 1.00 0.00 C ATOM 830 CD LYS A 60 1.406 -3.141 8.073 1.00 0.00 C ATOM 831 CE LYS A 60 0.946 -4.059 9.208 1.00 0.00 C ATOM 832 NZ LYS A 60 2.108 -4.722 9.840 1.00 0.00 N ATOM 0 H LYS A 60 -1.109 -0.908 4.734 1.00 0.00 H new ATOM 0 HA LYS A 60 0.693 0.443 6.683 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.062 -0.941 7.674 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.533 -2.316 6.725 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.680 -1.005 8.200 1.00 0.00 H new ATOM 0 HG3 LYS A 60 0.425 -1.626 9.255 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.067 -3.541 7.117 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.495 -3.115 8.040 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.400 -3.481 9.953 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.258 -4.810 8.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.779 -5.341 10.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.613 -5.290 9.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.750 -4.002 10.227 1.00 0.00 H new ATOM 846 N SER A 61 1.356 -1.974 4.557 1.00 0.00 N ATOM 847 CA SER A 61 2.430 -2.591 3.797 1.00 0.00 C ATOM 848 C SER A 61 1.854 -3.614 2.814 1.00 0.00 C ATOM 849 O SER A 61 0.825 -4.229 3.085 1.00 0.00 O ATOM 850 CB SER A 61 3.447 -3.260 4.724 1.00 0.00 C ATOM 851 OG SER A 61 4.728 -2.641 4.646 1.00 0.00 O ATOM 0 H SER A 61 0.428 -2.354 4.370 1.00 0.00 H new ATOM 0 HA SER A 61 2.947 -1.810 3.239 1.00 0.00 H new ATOM 0 HB2 SER A 61 3.085 -3.216 5.751 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.537 -4.314 4.463 1.00 0.00 H new ATOM 0 HG SER A 61 4.659 -1.709 4.940 1.00 0.00 H new ATOM 857 N ILE A 62 2.544 -3.762 1.693 1.00 0.00 N ATOM 858 CA ILE A 62 2.115 -4.699 0.669 1.00 0.00 C ATOM 859 C ILE A 62 2.822 -6.039 0.880 1.00 0.00 C ATOM 860 O ILE A 62 4.009 -6.074 1.200 1.00 0.00 O ATOM 861 CB ILE A 62 2.328 -4.104 -0.725 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.759 -2.686 -0.809 1.00 0.00 C ATOM 863 CG2 ILE A 62 1.749 -5.019 -1.806 1.00 0.00 C ATOM 864 CD1 ILE A 62 2.881 -1.649 -0.884 1.00 0.00 C ATOM 0 H ILE A 62 3.397 -3.249 1.471 1.00 0.00 H new ATOM 0 HA ILE A 62 1.044 -4.887 0.750 1.00 0.00 H new ATOM 0 HB ILE A 62 3.401 -4.032 -0.905 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.119 -2.599 -1.687 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.134 -2.489 0.062 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.914 -4.573 -2.787 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.241 -5.991 -1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.679 -5.146 -1.640 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.450 -0.650 -0.943 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.505 -1.723 0.007 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.489 -1.834 -1.769 1.00 0.00 H new ATOM 876 N ILE A 63 2.063 -7.109 0.692 1.00 0.00 N ATOM 877 CA ILE A 63 2.603 -8.448 0.859 1.00 0.00 C ATOM 878 C ILE A 63 3.066 -8.978 -0.499 1.00 0.00 C ATOM 879 O ILE A 63 2.260 -9.478 -1.283 1.00 0.00 O ATOM 880 CB ILE A 63 1.586 -9.352 1.558 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.364 -8.911 3.006 1.00 0.00 C ATOM 882 CG2 ILE A 63 2.002 -10.821 1.463 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.401 -7.724 3.077 1.00 0.00 C ATOM 0 H ILE A 63 1.079 -7.076 0.426 1.00 0.00 H new ATOM 0 HA ILE A 63 3.477 -8.429 1.510 1.00 0.00 H new ATOM 0 HB ILE A 63 0.631 -9.254 1.042 1.00 0.00 H new ATOM 0 HG12 ILE A 63 0.965 -9.743 3.586 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.318 -8.637 3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.262 -11.442 1.968 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.067 -11.114 0.415 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.974 -10.955 1.938 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.261 -7.431 4.117 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.815 -6.886 2.516 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.560 -8.009 2.648 1.00 0.00 H new ATOM 895 N HIS A 64 4.363 -8.852 -0.737 1.00 0.00 N ATOM 896 CA HIS A 64 4.943 -9.313 -1.987 1.00 0.00 C ATOM 897 C HIS A 64 4.539 -10.767 -2.235 1.00 0.00 C ATOM 898 O HIS A 64 3.768 -11.341 -1.467 1.00 0.00 O ATOM 899 CB HIS A 64 6.460 -9.110 -1.989 1.00 0.00 C ATOM 900 CG HIS A 64 6.897 -7.750 -2.477 1.00 0.00 C ATOM 901 ND1 HIS A 64 6.271 -6.578 -2.089 1.00 0.00 N ATOM 902 CD2 HIS A 64 7.904 -7.387 -3.323 1.00 0.00 C ATOM 903 CE1 HIS A 64 6.882 -5.562 -2.682 1.00 0.00 C ATOM 904 NE2 HIS A 64 7.893 -6.066 -3.447 1.00 0.00 N ATOM 0 H HIS A 64 5.029 -8.437 -0.085 1.00 0.00 H new ATOM 0 HA HIS A 64 4.554 -8.719 -2.814 1.00 0.00 H new ATOM 0 HB2 HIS A 64 6.838 -9.260 -0.978 1.00 0.00 H new ATOM 0 HB3 HIS A 64 6.918 -9.874 -2.617 1.00 0.00 H new ATOM 0 HD2 HIS A 64 8.594 -8.061 -3.810 1.00 0.00 H new ATOM 0 HE1 HIS A 64 6.625 -4.518 -2.578 1.00 0.00 H new ATOM 0 HE2 HIS A 64 8.535 -5.518 -4.020 1.00 0.00 H new ATOM 912 N GLY A 65 5.079 -11.323 -3.310 1.00 0.00 N ATOM 913 CA GLY A 65 4.784 -12.700 -3.669 1.00 0.00 C ATOM 914 C GLY A 65 3.289 -12.996 -3.526 1.00 0.00 C ATOM 915 O GLY A 65 2.906 -14.098 -3.140 1.00 0.00 O ATOM 0 H GLY A 65 5.719 -10.845 -3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 65 5.099 -12.887 -4.696 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.355 -13.376 -3.032 1.00 0.00 H new ATOM 919 N GLY A 66 2.487 -11.991 -3.846 1.00 0.00 N ATOM 920 CA GLY A 66 1.043 -12.130 -3.758 1.00 0.00 C ATOM 921 C GLY A 66 0.352 -11.431 -4.930 1.00 0.00 C ATOM 922 O GLY A 66 0.924 -11.318 -6.014 1.00 0.00 O ATOM 0 H GLY A 66 2.809 -11.078 -4.166 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.776 -13.187 -3.751 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.690 -11.706 -2.818 1.00 0.00 H new ATOM 926 N ALA A 67 -0.867 -10.980 -4.674 1.00 0.00 N ATOM 927 CA ALA A 67 -1.641 -10.296 -5.696 1.00 0.00 C ATOM 928 C ALA A 67 -1.345 -8.796 -5.635 1.00 0.00 C ATOM 929 O ALA A 67 -0.911 -8.205 -6.622 1.00 0.00 O ATOM 930 CB ALA A 67 -3.127 -10.604 -5.502 1.00 0.00 C ATOM 0 H ALA A 67 -1.338 -11.075 -3.774 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.361 -10.648 -6.689 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.708 -10.091 -6.268 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.289 -11.679 -5.582 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.444 -10.262 -4.517 1.00 0.00 H new ATOM 936 N ALA A 68 -1.590 -8.224 -4.465 1.00 0.00 N ATOM 937 CA ALA A 68 -1.355 -6.804 -4.262 1.00 0.00 C ATOM 938 C ALA A 68 0.080 -6.466 -4.672 1.00 0.00 C ATOM 939 O ALA A 68 0.354 -5.358 -5.130 1.00 0.00 O ATOM 940 CB ALA A 68 -1.646 -6.441 -2.805 1.00 0.00 C ATOM 0 H ALA A 68 -1.949 -8.718 -3.648 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.025 -6.211 -4.885 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.470 -5.376 -2.653 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.685 -6.673 -2.573 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.991 -7.014 -2.149 1.00 0.00 H new ATOM 946 N PHE A 69 0.958 -7.442 -4.492 1.00 0.00 N ATOM 947 CA PHE A 69 2.358 -7.261 -4.837 1.00 0.00 C ATOM 948 C PHE A 69 2.504 -6.492 -6.152 1.00 0.00 C ATOM 949 O PHE A 69 3.371 -5.628 -6.276 1.00 0.00 O ATOM 950 CB PHE A 69 2.960 -8.658 -5.008 1.00 0.00 C ATOM 951 CG PHE A 69 4.335 -8.665 -5.680 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.290 -7.782 -5.283 1.00 0.00 C ATOM 953 CD2 PHE A 69 4.601 -9.554 -6.674 1.00 0.00 C ATOM 954 CE1 PHE A 69 6.566 -7.789 -5.907 1.00 0.00 C ATOM 955 CE2 PHE A 69 5.877 -9.560 -7.298 1.00 0.00 C ATOM 956 CZ PHE A 69 6.832 -8.678 -6.901 1.00 0.00 C ATOM 0 H PHE A 69 0.727 -8.360 -4.112 1.00 0.00 H new ATOM 0 HA PHE A 69 2.863 -6.692 -4.056 1.00 0.00 H new ATOM 0 HB2 PHE A 69 3.043 -9.129 -4.029 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.276 -9.268 -5.598 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.078 -7.076 -4.494 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.842 -10.255 -6.989 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.325 -7.088 -5.592 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.088 -10.265 -8.088 1.00 0.00 H new ATOM 0 HZ PHE A 69 7.802 -8.683 -7.375 1.00 0.00 H new ATOM 966 N LYS A 70 1.643 -6.834 -7.099 1.00 0.00 N ATOM 967 CA LYS A 70 1.666 -6.186 -8.399 1.00 0.00 C ATOM 968 C LYS A 70 1.595 -4.669 -8.210 1.00 0.00 C ATOM 969 O LYS A 70 2.368 -3.928 -8.815 1.00 0.00 O ATOM 970 CB LYS A 70 0.559 -6.745 -9.296 1.00 0.00 C ATOM 971 CG LYS A 70 0.834 -8.207 -9.658 1.00 0.00 C ATOM 972 CD LYS A 70 -0.465 -8.940 -10.002 1.00 0.00 C ATOM 973 CE LYS A 70 -0.810 -8.778 -11.483 1.00 0.00 C ATOM 974 NZ LYS A 70 -1.273 -10.065 -12.051 1.00 0.00 N ATOM 0 H LYS A 70 0.925 -7.551 -6.992 1.00 0.00 H new ATOM 0 HA LYS A 70 2.602 -6.401 -8.914 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.401 -6.667 -8.786 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.487 -6.149 -10.205 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.517 -8.253 -10.506 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.327 -8.706 -8.824 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.364 -9.998 -9.762 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.279 -8.551 -9.391 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -1.586 -8.021 -11.601 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.065 -8.426 -12.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.503 -9.938 -13.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.521 -10.777 -11.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.120 -10.385 -11.540 1.00 0.00 H new ATOM 988 N ASP A 71 0.662 -4.253 -7.367 1.00 0.00 N ATOM 989 CA ASP A 71 0.480 -2.838 -7.091 1.00 0.00 C ATOM 990 C ASP A 71 1.418 -2.420 -5.956 1.00 0.00 C ATOM 991 O ASP A 71 1.617 -1.230 -5.717 1.00 0.00 O ATOM 992 CB ASP A 71 -0.955 -2.542 -6.650 1.00 0.00 C ATOM 993 CG ASP A 71 -1.409 -1.096 -6.854 1.00 0.00 C ATOM 994 OD1 ASP A 71 -0.563 -0.294 -7.305 1.00 0.00 O ATOM 995 OD2 ASP A 71 -2.592 -0.824 -6.555 1.00 0.00 O ATOM 0 H ASP A 71 0.024 -4.871 -6.866 1.00 0.00 H new ATOM 0 HA ASP A 71 0.697 -2.286 -8.005 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.630 -3.200 -7.198 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.053 -2.792 -5.594 1.00 0.00 H new ATOM 1000 N GLY A 72 1.970 -3.422 -5.288 1.00 0.00 N ATOM 1001 CA GLY A 72 2.882 -3.174 -4.185 1.00 0.00 C ATOM 1002 C GLY A 72 3.784 -1.973 -4.479 1.00 0.00 C ATOM 1003 O GLY A 72 4.218 -1.279 -3.561 1.00 0.00 O ATOM 0 H GLY A 72 1.803 -4.408 -5.490 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.314 -2.992 -3.273 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.494 -4.059 -4.008 1.00 0.00 H new ATOM 1007 N ARG A 73 4.038 -1.764 -5.762 1.00 0.00 N ATOM 1008 CA ARG A 73 4.880 -0.659 -6.188 1.00 0.00 C ATOM 1009 C ARG A 73 4.596 0.582 -5.339 1.00 0.00 C ATOM 1010 O ARG A 73 5.479 1.413 -5.135 1.00 0.00 O ATOM 1011 CB ARG A 73 4.645 -0.325 -7.663 1.00 0.00 C ATOM 1012 CG ARG A 73 3.329 0.434 -7.850 1.00 0.00 C ATOM 1013 CD ARG A 73 3.026 0.649 -9.334 1.00 0.00 C ATOM 1014 NE ARG A 73 2.905 -0.657 -10.021 1.00 0.00 N ATOM 1015 CZ ARG A 73 2.472 -0.806 -11.280 1.00 0.00 C ATOM 1016 NH1 ARG A 73 2.116 0.268 -11.998 1.00 0.00 N ATOM 1017 NH2 ARG A 73 2.395 -2.030 -11.821 1.00 0.00 N ATOM 0 H ARG A 73 3.676 -2.341 -6.521 1.00 0.00 H new ATOM 0 HA ARG A 73 5.919 -0.963 -6.057 1.00 0.00 H new ATOM 0 HB2 ARG A 73 5.472 0.276 -8.040 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.626 -1.244 -8.249 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.515 -0.123 -7.386 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.386 1.397 -7.343 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.101 1.215 -9.446 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.819 1.239 -9.794 1.00 0.00 H new ATOM 0 HE ARG A 73 3.168 -1.496 -9.503 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.175 1.199 -11.586 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.786 0.154 -12.957 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.666 -2.847 -11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.065 -2.144 -12.780 1.00 0.00 H new ATOM 1031 N LEU A 74 3.361 0.667 -4.868 1.00 0.00 N ATOM 1032 CA LEU A 74 2.951 1.793 -4.046 1.00 0.00 C ATOM 1033 C LEU A 74 3.687 1.735 -2.705 1.00 0.00 C ATOM 1034 O LEU A 74 4.466 0.816 -2.460 1.00 0.00 O ATOM 1035 CB LEU A 74 1.427 1.829 -3.909 1.00 0.00 C ATOM 1036 CG LEU A 74 0.662 2.432 -5.089 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -0.847 2.399 -4.839 1.00 0.00 C ATOM 1038 CD2 LEU A 74 1.161 3.844 -5.402 1.00 0.00 C ATOM 0 H LEU A 74 2.631 -0.025 -5.040 1.00 0.00 H new ATOM 0 HA LEU A 74 3.228 2.733 -4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.072 0.810 -3.754 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.176 2.394 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 74 0.855 1.820 -5.970 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.367 2.833 -5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.171 1.367 -4.704 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.080 2.973 -3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.601 4.249 -6.245 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.018 4.482 -4.530 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.221 3.808 -5.655 1.00 0.00 H new ATOM 1050 N ARG A 75 3.413 2.729 -1.873 1.00 0.00 N ATOM 1051 CA ARG A 75 4.040 2.803 -0.564 1.00 0.00 C ATOM 1052 C ARG A 75 2.977 2.963 0.525 1.00 0.00 C ATOM 1053 O ARG A 75 2.028 3.729 0.364 1.00 0.00 O ATOM 1054 CB ARG A 75 5.018 3.977 -0.488 1.00 0.00 C ATOM 1055 CG ARG A 75 6.152 3.813 -1.502 1.00 0.00 C ATOM 1056 CD ARG A 75 7.354 4.680 -1.126 1.00 0.00 C ATOM 1057 NE ARG A 75 8.085 5.089 -2.346 1.00 0.00 N ATOM 1058 CZ ARG A 75 9.070 5.998 -2.363 1.00 0.00 C ATOM 1059 NH1 ARG A 75 9.447 6.598 -1.226 1.00 0.00 N ATOM 1060 NH2 ARG A 75 9.677 6.307 -3.517 1.00 0.00 N ATOM 0 H ARG A 75 2.766 3.490 -2.080 1.00 0.00 H new ATOM 0 HA ARG A 75 4.590 1.875 -0.407 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.487 4.910 -0.678 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.432 4.045 0.518 1.00 0.00 H new ATOM 0 HG2 ARG A 75 6.454 2.767 -1.549 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.798 4.087 -2.496 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.020 5.562 -0.580 1.00 0.00 H new ATOM 0 HD3 ARG A 75 8.018 4.127 -0.462 1.00 0.00 H new ATOM 0 HE ARG A 75 7.823 4.652 -3.229 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.985 6.363 -0.348 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.197 7.290 -1.239 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.390 5.850 -4.383 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.426 6.999 -3.530 1.00 0.00 H new ATOM 1074 N MET A 76 3.171 2.226 1.609 1.00 0.00 N ATOM 1075 CA MET A 76 2.241 2.276 2.724 1.00 0.00 C ATOM 1076 C MET A 76 1.913 3.722 3.100 1.00 0.00 C ATOM 1077 O MET A 76 2.464 4.658 2.523 1.00 0.00 O ATOM 1078 CB MET A 76 2.852 1.561 3.931 1.00 0.00 C ATOM 1079 CG MET A 76 4.190 2.191 4.322 1.00 0.00 C ATOM 1080 SD MET A 76 5.534 1.117 3.844 1.00 0.00 S ATOM 1081 CE MET A 76 6.730 2.333 3.318 1.00 0.00 C ATOM 0 H MET A 76 3.959 1.591 1.739 1.00 0.00 H new ATOM 0 HA MET A 76 1.318 1.780 2.425 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.163 1.610 4.774 1.00 0.00 H new ATOM 0 HB3 MET A 76 2.997 0.506 3.698 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.300 3.162 3.838 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.218 2.366 5.397 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.638 1.830 2.985 1.00 0.00 H new ATOM 0 HE2 MET A 76 6.317 2.918 2.496 1.00 0.00 H new ATOM 0 HE3 MET A 76 6.967 2.995 4.151 1.00 0.00 H new ATOM 1091 N ASN A 77 1.016 3.860 4.065 1.00 0.00 N ATOM 1092 CA ASN A 77 0.607 5.177 4.525 1.00 0.00 C ATOM 1093 C ASN A 77 -0.079 5.922 3.378 1.00 0.00 C ATOM 1094 O ASN A 77 -0.061 7.151 3.333 1.00 0.00 O ATOM 1095 CB ASN A 77 1.815 6.004 4.970 1.00 0.00 C ATOM 1096 CG ASN A 77 2.042 5.874 6.477 1.00 0.00 C ATOM 1097 OD1 ASN A 77 1.120 5.707 7.259 1.00 0.00 O ATOM 1098 ND2 ASN A 77 3.319 5.959 6.841 1.00 0.00 N ATOM 0 H ASN A 77 0.561 3.082 4.541 1.00 0.00 H new ATOM 0 HA ASN A 77 -0.070 5.045 5.369 1.00 0.00 H new ATOM 0 HB2 ASN A 77 2.705 5.672 4.435 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.659 7.051 4.711 1.00 0.00 H new ATOM 0 HD21 ASN A 77 3.575 5.884 7.826 1.00 0.00 H new ATOM 0 HD22 ASN A 77 4.042 6.099 6.135 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.669 5.147 2.480 1.00 0.00 N ATOM 1106 CA ASP A 78 -1.361 5.718 1.337 1.00 0.00 C ATOM 1107 C ASP A 78 -2.829 5.953 1.699 1.00 0.00 C ATOM 1108 O ASP A 78 -3.657 5.055 1.558 1.00 0.00 O ATOM 1109 CB ASP A 78 -1.315 4.771 0.136 1.00 0.00 C ATOM 1110 CG ASP A 78 -0.053 4.876 -0.722 1.00 0.00 C ATOM 1111 OD1 ASP A 78 0.801 5.720 -0.376 1.00 0.00 O ATOM 1112 OD2 ASP A 78 0.030 4.108 -1.705 1.00 0.00 O ATOM 0 H ASP A 78 -0.682 4.128 2.521 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.867 6.654 1.077 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.407 3.746 0.497 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.182 4.966 -0.495 1.00 0.00 H new ATOM 1117 N GLN A 79 -3.105 7.164 2.158 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.459 7.528 2.542 1.00 0.00 C ATOM 1119 C GLN A 79 -5.436 7.203 1.410 1.00 0.00 C ATOM 1120 O GLN A 79 -5.231 7.616 0.270 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.541 9.005 2.930 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.810 9.292 3.735 1.00 0.00 C ATOM 1123 CD GLN A 79 -5.836 10.742 4.220 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -4.988 11.552 3.882 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -6.854 11.024 5.028 1.00 0.00 N ATOM 0 H GLN A 79 -2.415 7.906 2.273 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.738 6.941 3.417 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.664 9.280 3.517 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.529 9.622 2.031 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.688 9.095 3.119 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.863 8.618 4.590 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.529 10.298 5.271 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -6.960 11.966 5.405 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.479 6.466 1.765 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.489 6.082 0.793 1.00 0.00 C ATOM 1136 C LEU A 80 -8.546 7.184 0.700 1.00 0.00 C ATOM 1137 O LEU A 80 -9.512 7.187 1.461 1.00 0.00 O ATOM 1138 CB LEU A 80 -8.063 4.705 1.134 1.00 0.00 C ATOM 1139 CG LEU A 80 -7.049 3.567 1.257 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -6.292 3.647 2.584 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.724 2.207 1.063 1.00 0.00 C ATOM 0 H LEU A 80 -6.646 6.125 2.712 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.046 5.981 -0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.607 4.783 2.075 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.789 4.436 0.367 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.314 3.678 0.460 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.578 2.826 2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.760 4.596 2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.999 3.576 3.411 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.981 1.415 1.155 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.494 2.072 1.822 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.178 2.164 0.073 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.327 8.092 -0.240 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.249 9.196 -0.443 1.00 0.00 C ATOM 1155 C ILE A 81 -10.524 8.675 -1.110 1.00 0.00 C ATOM 1156 O ILE A 81 -11.490 9.418 -1.276 1.00 0.00 O ATOM 1157 CB ILE A 81 -8.569 10.327 -1.216 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.050 9.832 -2.568 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -7.463 10.975 -0.381 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -7.747 11.005 -3.502 1.00 0.00 C ATOM 0 H ILE A 81 -7.524 8.085 -0.869 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.543 9.627 0.514 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.313 11.097 -1.418 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.148 9.238 -2.420 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -8.790 9.178 -3.028 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.996 11.776 -0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.891 11.385 0.534 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.713 10.226 -0.127 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.380 10.625 -4.456 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -8.656 11.583 -3.667 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.989 11.644 -3.050 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.485 7.401 -1.473 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.624 6.772 -2.118 1.00 0.00 C ATOM 1174 C ALA A 82 -11.278 5.320 -2.454 1.00 0.00 C ATOM 1175 O ALA A 82 -10.177 4.857 -2.159 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.020 7.579 -3.357 1.00 0.00 C ATOM 0 H ALA A 82 -9.682 6.788 -1.332 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.484 6.759 -1.449 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.875 7.107 -3.841 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.286 8.594 -3.061 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.182 7.612 -4.053 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.237 4.643 -3.068 1.00 0.00 N ATOM 1183 CA VAL A 83 -12.046 3.253 -3.447 1.00 0.00 C ATOM 1184 C VAL A 83 -13.194 2.817 -4.360 1.00 0.00 C ATOM 1185 O VAL A 83 -14.360 2.891 -3.976 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.914 2.383 -2.196 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -13.044 2.670 -1.206 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.870 0.898 -2.563 1.00 0.00 C ATOM 0 H VAL A 83 -13.148 5.031 -3.312 1.00 0.00 H new ATOM 0 HA VAL A 83 -11.119 3.133 -4.009 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.972 2.636 -1.710 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.926 2.038 -0.326 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -13.009 3.718 -0.908 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -14.004 2.459 -1.678 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -11.776 0.302 -1.656 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.788 0.624 -3.083 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -11.015 0.709 -3.212 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.823 2.371 -5.552 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.807 1.922 -6.522 1.00 0.00 C ATOM 1200 C ASN A 84 -14.811 3.047 -6.781 1.00 0.00 C ATOM 1201 O ASN A 84 -15.915 2.799 -7.263 1.00 0.00 O ATOM 1202 CB ASN A 84 -14.579 0.708 -6.003 1.00 0.00 C ATOM 1203 CG ASN A 84 -14.419 -0.487 -6.944 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -14.733 -0.430 -8.121 1.00 0.00 O ATOM 1205 ND2 ASN A 84 -13.913 -1.571 -6.361 1.00 0.00 N ATOM 0 H ASN A 84 -11.855 2.311 -5.867 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.279 1.649 -7.436 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.220 0.443 -5.008 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.635 0.959 -5.905 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -13.767 -2.421 -6.905 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -13.671 -1.551 -5.370 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.392 4.259 -6.449 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.242 5.423 -6.639 1.00 0.00 C ATOM 1214 C GLY A 85 -15.990 5.772 -5.351 1.00 0.00 C ATOM 1215 O GLY A 85 -16.633 6.817 -5.266 1.00 0.00 O ATOM 0 H GLY A 85 -13.475 4.461 -6.050 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.636 6.273 -6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -15.958 5.229 -7.438 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.881 4.877 -4.380 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.539 5.078 -3.100 1.00 0.00 C ATOM 1221 C GLU A 86 -15.637 5.880 -2.159 1.00 0.00 C ATOM 1222 O GLU A 86 -14.463 5.553 -1.991 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.935 3.740 -2.471 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.430 3.933 -1.037 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.889 3.495 -0.896 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -19.113 2.265 -0.884 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -19.747 4.399 -0.805 1.00 0.00 O ATOM 0 H GLU A 86 -15.347 4.011 -4.454 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.453 5.648 -3.269 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.716 3.270 -3.069 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -16.080 3.064 -2.476 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.806 3.358 -0.353 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -17.332 4.981 -0.753 1.00 0.00 H new ATOM 1234 N THR A 87 -16.220 6.914 -1.571 1.00 0.00 N ATOM 1235 CA THR A 87 -15.484 7.765 -0.652 1.00 0.00 C ATOM 1236 C THR A 87 -15.194 7.018 0.651 1.00 0.00 C ATOM 1237 O THR A 87 -15.925 6.099 1.020 1.00 0.00 O ATOM 1238 CB THR A 87 -16.289 9.050 -0.449 1.00 0.00 C ATOM 1239 OG1 THR A 87 -15.298 10.068 -0.346 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.003 9.086 0.903 1.00 0.00 C ATOM 0 H THR A 87 -17.194 7.182 -1.713 1.00 0.00 H new ATOM 0 HA THR A 87 -14.510 8.036 -1.059 1.00 0.00 H new ATOM 0 HB THR A 87 -17.023 9.149 -1.249 1.00 0.00 H new ATOM 0 HG1 THR A 87 -15.733 10.936 -0.214 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.559 10.019 0.996 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.692 8.244 0.973 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.267 9.021 1.705 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.126 7.439 1.313 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.731 6.821 2.567 1.00 0.00 C ATOM 1250 C LEU A 88 -13.591 7.902 3.641 1.00 0.00 C ATOM 1251 O LEU A 88 -14.033 7.717 4.774 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.469 5.978 2.375 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.592 4.796 1.411 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -11.221 4.186 1.113 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.580 3.755 1.943 1.00 0.00 C ATOM 0 H LEU A 88 -13.522 8.201 1.004 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.500 6.128 2.909 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.671 6.630 2.019 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.159 5.597 3.348 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.991 5.166 0.467 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -11.337 3.348 0.426 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.578 4.940 0.660 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.770 3.834 2.041 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.649 2.926 1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -13.234 3.384 2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.562 4.213 2.062 1.00 0.00 H new ATOM 1267 N LEU A 89 -12.974 9.006 3.248 1.00 0.00 N ATOM 1268 CA LEU A 89 -12.771 10.116 4.162 1.00 0.00 C ATOM 1269 C LEU A 89 -14.086 10.430 4.878 1.00 0.00 C ATOM 1270 O LEU A 89 -14.092 10.723 6.073 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.171 11.315 3.425 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.106 10.993 2.374 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -10.257 12.225 2.059 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.250 9.802 2.810 1.00 0.00 C ATOM 0 H LEU A 89 -12.608 9.156 2.308 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.046 9.848 4.930 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.980 11.859 2.938 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.733 11.988 4.163 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.611 10.706 1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.508 11.969 1.310 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -10.897 13.020 1.676 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.760 12.566 2.967 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.501 9.593 2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.753 10.036 3.751 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -10.886 8.927 2.944 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.168 10.357 4.118 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.487 10.630 4.665 1.00 0.00 C ATOM 1288 C GLY A 90 -16.842 9.627 5.764 1.00 0.00 C ATOM 1289 O GLY A 90 -17.597 9.947 6.681 1.00 0.00 O ATOM 0 H GLY A 90 -15.159 10.113 3.128 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -16.515 11.642 5.068 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.231 10.583 3.870 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.280 8.434 5.637 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.528 7.382 6.609 1.00 0.00 C ATOM 1295 C LYS A 91 -15.414 7.389 7.656 1.00 0.00 C ATOM 1296 O LYS A 91 -14.541 8.255 7.634 1.00 0.00 O ATOM 1297 CB LYS A 91 -16.704 6.034 5.906 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.365 6.211 4.538 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.623 4.857 3.874 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.810 4.935 2.912 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.769 3.840 3.182 1.00 0.00 N ATOM 0 H LYS A 91 -15.654 8.172 4.876 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.464 7.564 7.138 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -15.733 5.553 5.785 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.312 5.374 6.525 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.306 6.749 4.652 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.726 6.818 3.897 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.732 4.538 3.333 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.819 4.105 4.638 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.309 5.898 3.018 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.456 4.871 1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.551 3.887 2.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.285 2.924 3.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -20.145 3.938 4.146 1.00 0.00 H new ATOM 1315 N SER A 92 -15.479 6.413 8.550 1.00 0.00 N ATOM 1316 CA SER A 92 -14.486 6.295 9.604 1.00 0.00 C ATOM 1317 C SER A 92 -13.510 5.162 9.280 1.00 0.00 C ATOM 1318 O SER A 92 -13.545 4.603 8.185 1.00 0.00 O ATOM 1319 CB SER A 92 -15.150 6.052 10.961 1.00 0.00 C ATOM 1320 OG SER A 92 -16.049 7.100 11.311 1.00 0.00 O ATOM 0 H SER A 92 -16.205 5.696 8.566 1.00 0.00 H new ATOM 0 HA SER A 92 -13.936 7.234 9.662 1.00 0.00 H new ATOM 0 HB2 SER A 92 -15.689 5.105 10.936 1.00 0.00 H new ATOM 0 HB3 SER A 92 -14.382 5.962 11.729 1.00 0.00 H new ATOM 0 HG SER A 92 -16.453 6.907 12.182 1.00 0.00 H new ATOM 1326 N ASN A 93 -12.663 4.858 10.251 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.679 3.802 10.083 1.00 0.00 C ATOM 1328 C ASN A 93 -12.399 2.470 9.861 1.00 0.00 C ATOM 1329 O ASN A 93 -12.105 1.753 8.907 1.00 0.00 O ATOM 1330 CB ASN A 93 -10.801 3.663 11.328 1.00 0.00 C ATOM 1331 CG ASN A 93 -9.688 4.713 11.335 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -8.890 4.814 10.418 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.679 5.485 12.417 1.00 0.00 N ATOM 0 H ASN A 93 -12.637 5.324 11.158 1.00 0.00 H new ATOM 0 HA ASN A 93 -11.053 4.058 9.228 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.414 3.771 12.223 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.364 2.665 11.360 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -8.974 6.216 12.516 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -10.377 5.347 13.148 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.330 2.181 10.759 1.00 0.00 N ATOM 1341 CA HIS A 94 -14.094 0.948 10.673 1.00 0.00 C ATOM 1342 C HIS A 94 -14.911 0.940 9.380 1.00 0.00 C ATOM 1343 O HIS A 94 -14.606 0.191 8.453 1.00 0.00 O ATOM 1344 CB HIS A 94 -14.958 0.757 11.921 1.00 0.00 C ATOM 1345 CG HIS A 94 -15.832 -0.474 11.881 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -15.382 -1.726 12.265 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -17.131 -0.633 11.500 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -16.374 -2.591 12.116 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -17.457 -1.912 11.641 1.00 0.00 N ATOM 0 H HIS A 94 -13.572 2.779 11.549 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.415 0.096 10.638 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -14.309 0.701 12.795 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -15.591 1.635 12.050 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -17.785 0.149 11.144 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -16.332 -3.648 12.333 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -18.368 -2.320 11.429 1.00 0.00 H new ATOM 1357 N GLU A 95 -15.934 1.782 9.358 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.798 1.881 8.194 1.00 0.00 C ATOM 1359 C GLU A 95 -15.973 1.764 6.910 1.00 0.00 C ATOM 1360 O GLU A 95 -16.119 0.800 6.161 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.598 3.185 8.214 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.238 3.414 9.585 1.00 0.00 C ATOM 1363 CD GLU A 95 -19.545 4.198 9.456 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -20.459 3.671 8.785 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -19.601 5.307 10.031 1.00 0.00 O ATOM 0 H GLU A 95 -16.184 2.402 10.128 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.510 1.056 8.223 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.943 4.021 7.970 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.373 3.153 7.448 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.431 2.455 10.065 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -17.545 3.958 10.227 1.00 0.00 H new ATOM 1372 N ALA A 96 -15.125 2.759 6.697 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.278 2.780 5.517 1.00 0.00 C ATOM 1374 C ALA A 96 -13.790 1.361 5.220 1.00 0.00 C ATOM 1375 O ALA A 96 -14.182 0.762 4.220 1.00 0.00 O ATOM 1376 CB ALA A 96 -13.123 3.760 5.734 1.00 0.00 C ATOM 0 H ALA A 96 -15.006 3.557 7.322 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.839 3.125 4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.488 3.775 4.848 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.522 4.759 5.912 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.536 3.445 6.596 1.00 0.00 H new ATOM 1382 N MET A 97 -12.940 0.864 6.107 1.00 0.00 N ATOM 1383 CA MET A 97 -12.394 -0.474 5.952 1.00 0.00 C ATOM 1384 C MET A 97 -13.498 -1.482 5.627 1.00 0.00 C ATOM 1385 O MET A 97 -13.291 -2.401 4.836 1.00 0.00 O ATOM 1386 CB MET A 97 -11.687 -0.890 7.244 1.00 0.00 C ATOM 1387 CG MET A 97 -10.291 -0.269 7.329 1.00 0.00 C ATOM 1388 SD MET A 97 -9.277 -0.862 5.986 1.00 0.00 S ATOM 1389 CE MET A 97 -8.190 -1.960 6.880 1.00 0.00 C ATOM 0 H MET A 97 -12.616 1.364 6.935 1.00 0.00 H new ATOM 0 HA MET A 97 -11.683 -0.463 5.126 1.00 0.00 H new ATOM 0 HB2 MET A 97 -12.280 -0.579 8.104 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.609 -1.976 7.287 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.364 0.818 7.288 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.829 -0.522 8.283 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.582 -2.525 6.173 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.540 -1.377 7.533 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.783 -2.650 7.480 1.00 0.00 H new ATOM 1399 N GLU A 98 -14.647 -1.277 6.254 1.00 0.00 N ATOM 1400 CA GLU A 98 -15.783 -2.157 6.041 1.00 0.00 C ATOM 1401 C GLU A 98 -16.242 -2.088 4.583 1.00 0.00 C ATOM 1402 O GLU A 98 -16.752 -3.068 4.043 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.930 -1.811 6.994 1.00 0.00 C ATOM 1404 CG GLU A 98 -18.118 -1.221 6.230 1.00 0.00 C ATOM 1405 CD GLU A 98 -18.903 -2.317 5.507 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -18.635 -3.500 5.808 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -19.755 -1.946 4.670 1.00 0.00 O ATOM 0 H GLU A 98 -14.816 -0.514 6.910 1.00 0.00 H new ATOM 0 HA GLU A 98 -15.471 -3.179 6.255 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -17.246 -2.707 7.529 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.584 -1.098 7.742 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.775 -0.694 6.922 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -17.762 -0.487 5.507 1.00 0.00 H new ATOM 1414 N THR A 99 -16.043 -0.921 3.988 1.00 0.00 N ATOM 1415 CA THR A 99 -16.430 -0.712 2.603 1.00 0.00 C ATOM 1416 C THR A 99 -15.407 -1.350 1.662 1.00 0.00 C ATOM 1417 O THR A 99 -15.777 -2.008 0.690 1.00 0.00 O ATOM 1418 CB THR A 99 -16.604 0.792 2.383 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.953 1.045 2.764 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.557 1.176 0.902 1.00 0.00 C ATOM 0 H THR A 99 -15.619 -0.111 4.440 1.00 0.00 H new ATOM 0 HA THR A 99 -17.379 -1.199 2.379 1.00 0.00 H new ATOM 0 HB THR A 99 -15.825 1.330 2.923 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.445 1.415 2.001 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.685 2.254 0.801 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.595 0.884 0.481 1.00 0.00 H new ATOM 0 HG23 THR A 99 -17.357 0.664 0.368 1.00 0.00 H new ATOM 1428 N LEU A 100 -14.140 -1.133 1.982 1.00 0.00 N ATOM 1429 CA LEU A 100 -13.060 -1.679 1.177 1.00 0.00 C ATOM 1430 C LEU A 100 -13.364 -3.142 0.848 1.00 0.00 C ATOM 1431 O LEU A 100 -13.727 -3.465 -0.282 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.714 -1.473 1.875 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.476 -1.543 0.979 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -10.463 -0.392 -0.029 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -9.196 -1.587 1.815 1.00 0.00 C ATOM 0 H LEU A 100 -13.837 -0.586 2.788 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.986 -1.147 0.229 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.727 -0.500 2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.614 -2.225 2.658 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.520 -2.471 0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.573 -0.465 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.352 -0.448 -0.657 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.455 0.559 0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.331 -1.637 1.154 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -9.132 -0.689 2.430 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -9.212 -2.467 2.458 1.00 0.00 H new ATOM 1447 N ARG A 101 -13.205 -3.987 1.856 1.00 0.00 N ATOM 1448 CA ARG A 101 -13.458 -5.408 1.688 1.00 0.00 C ATOM 1449 C ARG A 101 -14.788 -5.629 0.965 1.00 0.00 C ATOM 1450 O ARG A 101 -14.981 -6.651 0.309 1.00 0.00 O ATOM 1451 CB ARG A 101 -13.494 -6.125 3.039 1.00 0.00 C ATOM 1452 CG ARG A 101 -14.825 -5.881 3.753 1.00 0.00 C ATOM 1453 CD ARG A 101 -14.712 -6.198 5.246 1.00 0.00 C ATOM 1454 NE ARG A 101 -16.048 -6.513 5.799 1.00 0.00 N ATOM 1455 CZ ARG A 101 -16.309 -6.640 7.107 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -15.327 -6.480 8.005 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -17.552 -6.926 7.518 1.00 0.00 N ATOM 0 H ARG A 101 -12.904 -3.715 2.792 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.644 -5.821 1.092 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.347 -7.195 2.891 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.672 -5.774 3.663 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -15.128 -4.843 3.620 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -15.602 -6.500 3.304 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -14.039 -7.042 5.397 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.281 -5.348 5.775 1.00 0.00 H new ATOM 0 HE ARG A 101 -16.819 -6.642 5.143 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -14.381 -6.262 7.693 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -15.526 -6.577 9.001 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -18.300 -7.047 6.835 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.750 -7.023 8.514 1.00 0.00 H new ATOM 1471 N ARG A 102 -15.673 -4.653 1.110 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.980 -4.727 0.480 1.00 0.00 C ATOM 1473 C ARG A 102 -16.856 -4.493 -1.027 1.00 0.00 C ATOM 1474 O ARG A 102 -17.195 -5.367 -1.824 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.937 -3.692 1.073 1.00 0.00 C ATOM 1476 CG ARG A 102 -19.381 -4.197 1.039 1.00 0.00 C ATOM 1477 CD ARG A 102 -20.181 -3.651 2.224 1.00 0.00 C ATOM 1478 NE ARG A 102 -21.183 -4.649 2.660 1.00 0.00 N ATOM 1479 CZ ARG A 102 -22.169 -4.392 3.530 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -22.292 -3.168 4.062 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -23.033 -5.359 3.869 1.00 0.00 N ATOM 0 H ARG A 102 -15.510 -3.806 1.655 1.00 0.00 H new ATOM 0 HA ARG A 102 -17.382 -5.723 0.665 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.649 -3.472 2.101 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.861 -2.759 0.514 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.854 -3.893 0.105 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -19.390 -5.287 1.061 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -19.509 -3.414 3.049 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -20.679 -2.723 1.941 1.00 0.00 H new ATOM 0 HE ARG A 102 -21.119 -5.591 2.274 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -21.635 -2.432 3.805 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.043 -2.973 4.724 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -22.940 -6.291 3.465 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -23.784 -5.163 4.531 1.00 0.00 H new ATOM 1495 N SER A 103 -16.370 -3.310 -1.372 1.00 0.00 N ATOM 1496 CA SER A 103 -16.197 -2.951 -2.769 1.00 0.00 C ATOM 1497 C SER A 103 -15.254 -3.943 -3.453 1.00 0.00 C ATOM 1498 O SER A 103 -15.164 -3.976 -4.679 1.00 0.00 O ATOM 1499 CB SER A 103 -15.659 -1.525 -2.909 1.00 0.00 C ATOM 1500 OG SER A 103 -16.708 -0.564 -2.988 1.00 0.00 O ATOM 0 H SER A 103 -16.091 -2.588 -0.708 1.00 0.00 H new ATOM 0 HA SER A 103 -17.172 -2.993 -3.255 1.00 0.00 H new ATOM 0 HB2 SER A 103 -15.019 -1.294 -2.058 1.00 0.00 H new ATOM 0 HB3 SER A 103 -15.038 -1.458 -3.802 1.00 0.00 H new ATOM 0 HG SER A 103 -16.324 0.333 -3.075 1.00 0.00 H new ATOM 1506 N MET A 104 -14.576 -4.728 -2.629 1.00 0.00 N ATOM 1507 CA MET A 104 -13.643 -5.719 -3.139 1.00 0.00 C ATOM 1508 C MET A 104 -14.386 -6.922 -3.724 1.00 0.00 C ATOM 1509 O MET A 104 -14.060 -7.386 -4.816 1.00 0.00 O ATOM 1510 CB MET A 104 -12.726 -6.187 -2.007 1.00 0.00 C ATOM 1511 CG MET A 104 -11.584 -5.194 -1.781 1.00 0.00 C ATOM 1512 SD MET A 104 -10.307 -5.948 -0.788 1.00 0.00 S ATOM 1513 CE MET A 104 -10.415 -4.935 0.678 1.00 0.00 C ATOM 0 H MET A 104 -14.654 -4.698 -1.612 1.00 0.00 H new ATOM 0 HA MET A 104 -13.052 -5.260 -3.932 1.00 0.00 H new ATOM 0 HB2 MET A 104 -13.303 -6.298 -1.089 1.00 0.00 H new ATOM 0 HB3 MET A 104 -12.317 -7.168 -2.247 1.00 0.00 H new ATOM 0 HG2 MET A 104 -11.172 -4.877 -2.739 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.961 -4.300 -1.285 1.00 0.00 H new ATOM 0 HE1 MET A 104 -9.440 -4.495 0.889 1.00 0.00 H new ATOM 0 HE2 MET A 104 -11.145 -4.141 0.519 1.00 0.00 H new ATOM 0 HE3 MET A 104 -10.726 -5.550 1.523 1.00 0.00 H new ATOM 1523 N SER A 105 -15.371 -7.392 -2.972 1.00 0.00 N ATOM 1524 CA SER A 105 -16.163 -8.531 -3.403 1.00 0.00 C ATOM 1525 C SER A 105 -17.460 -8.050 -4.056 1.00 0.00 C ATOM 1526 O SER A 105 -17.933 -8.650 -5.021 1.00 0.00 O ATOM 1527 CB SER A 105 -16.474 -9.461 -2.228 1.00 0.00 C ATOM 1528 OG SER A 105 -15.903 -10.755 -2.406 1.00 0.00 O ATOM 0 H SER A 105 -15.638 -7.004 -2.067 1.00 0.00 H new ATOM 0 HA SER A 105 -15.583 -9.094 -4.134 1.00 0.00 H new ATOM 0 HB2 SER A 105 -16.094 -9.020 -1.306 1.00 0.00 H new ATOM 0 HB3 SER A 105 -17.554 -9.554 -2.115 1.00 0.00 H new ATOM 0 HG SER A 105 -16.122 -11.318 -1.635 1.00 0.00 H new ATOM 1534 N MET A 106 -17.998 -6.972 -3.505 1.00 0.00 N ATOM 1535 CA MET A 106 -19.231 -6.404 -4.023 1.00 0.00 C ATOM 1536 C MET A 106 -18.988 -5.683 -5.350 1.00 0.00 C ATOM 1537 O MET A 106 -19.537 -6.069 -6.381 1.00 0.00 O ATOM 1538 CB MET A 106 -19.806 -5.418 -3.004 1.00 0.00 C ATOM 1539 CG MET A 106 -21.326 -5.565 -2.895 1.00 0.00 C ATOM 1540 SD MET A 106 -22.105 -3.966 -3.033 1.00 0.00 S ATOM 1541 CE MET A 106 -22.529 -3.976 -4.767 1.00 0.00 C ATOM 0 H MET A 106 -17.603 -6.477 -2.705 1.00 0.00 H new ATOM 0 HA MET A 106 -19.938 -7.215 -4.196 1.00 0.00 H new ATOM 0 HB2 MET A 106 -19.350 -5.590 -2.029 1.00 0.00 H new ATOM 0 HB3 MET A 106 -19.556 -4.399 -3.298 1.00 0.00 H new ATOM 0 HG2 MET A 106 -21.693 -6.226 -3.680 1.00 0.00 H new ATOM 0 HG3 MET A 106 -21.588 -6.025 -1.942 1.00 0.00 H new ATOM 0 HE1 MET A 106 -23.028 -3.042 -5.025 1.00 0.00 H new ATOM 0 HE2 MET A 106 -21.622 -4.080 -5.363 1.00 0.00 H new ATOM 0 HE3 MET A 106 -23.196 -4.813 -4.974 1.00 0.00 H new ATOM 1551 N GLU A 107 -18.164 -4.647 -5.282 1.00 0.00 N ATOM 1552 CA GLU A 107 -17.841 -3.868 -6.465 1.00 0.00 C ATOM 1553 C GLU A 107 -16.883 -4.648 -7.368 1.00 0.00 C ATOM 1554 O GLU A 107 -16.752 -4.340 -8.552 1.00 0.00 O ATOM 1555 CB GLU A 107 -17.251 -2.509 -6.083 1.00 0.00 C ATOM 1556 CG GLU A 107 -18.336 -1.431 -6.049 1.00 0.00 C ATOM 1557 CD GLU A 107 -18.831 -1.105 -7.459 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -19.692 -1.868 -7.949 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -18.336 -0.101 -8.016 1.00 0.00 O ATOM 0 H GLU A 107 -17.710 -4.329 -4.425 1.00 0.00 H new ATOM 0 HA GLU A 107 -18.762 -3.684 -7.018 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -16.771 -2.578 -5.107 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -16.478 -2.230 -6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -19.171 -1.770 -5.436 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -17.943 -0.529 -5.580 1.00 0.00 H new ATOM 1566 N GLY A 108 -16.239 -5.642 -6.776 1.00 0.00 N ATOM 1567 CA GLY A 108 -15.297 -6.468 -7.512 1.00 0.00 C ATOM 1568 C GLY A 108 -15.979 -7.723 -8.059 1.00 0.00 C ATOM 1569 O GLY A 108 -15.387 -8.466 -8.840 1.00 0.00 O ATOM 0 H GLY A 108 -16.351 -5.895 -5.794 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -14.870 -5.894 -8.334 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -14.471 -6.753 -6.860 1.00 0.00 H new ATOM 1573 N ASN A 109 -17.216 -7.922 -7.626 1.00 0.00 N ATOM 1574 CA ASN A 109 -17.985 -9.075 -8.063 1.00 0.00 C ATOM 1575 C ASN A 109 -18.411 -8.877 -9.519 1.00 0.00 C ATOM 1576 O ASN A 109 -18.449 -9.832 -10.293 1.00 0.00 O ATOM 1577 CB ASN A 109 -19.250 -9.244 -7.219 1.00 0.00 C ATOM 1578 CG ASN A 109 -19.163 -10.496 -6.344 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -18.539 -11.486 -6.692 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -19.821 -10.399 -5.193 1.00 0.00 N ATOM 0 H ASN A 109 -17.704 -7.304 -6.977 1.00 0.00 H new ATOM 0 HA ASN A 109 -17.358 -9.960 -7.955 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -19.391 -8.365 -6.590 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -20.120 -9.312 -7.872 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -19.824 -11.182 -4.540 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -20.323 -9.541 -4.963 1.00 0.00 H new ATOM 1587 N ILE A 110 -18.719 -7.631 -9.848 1.00 0.00 N ATOM 1588 CA ILE A 110 -19.140 -7.296 -11.197 1.00 0.00 C ATOM 1589 C ILE A 110 -17.941 -6.762 -11.983 1.00 0.00 C ATOM 1590 O ILE A 110 -17.829 -6.996 -13.186 1.00 0.00 O ATOM 1591 CB ILE A 110 -20.330 -6.336 -11.164 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -19.910 -4.960 -10.643 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -21.489 -6.925 -10.357 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.881 -4.938 -9.113 1.00 0.00 C ATOM 0 H ILE A 110 -18.685 -6.841 -9.203 1.00 0.00 H new ATOM 0 HA ILE A 110 -19.493 -8.186 -11.718 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.686 -6.199 -12.185 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -18.924 -4.705 -11.033 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.603 -4.202 -11.008 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -22.322 -6.222 -10.350 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -21.810 -7.862 -10.812 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -21.162 -7.111 -9.334 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.579 -3.949 -8.769 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.874 -5.169 -8.727 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.169 -5.680 -8.752 1.00 0.00 H new ATOM 1606 N ARG A 111 -17.075 -6.056 -11.272 1.00 0.00 N ATOM 1607 CA ARG A 111 -15.888 -5.488 -11.888 1.00 0.00 C ATOM 1608 C ARG A 111 -14.804 -6.557 -12.039 1.00 0.00 C ATOM 1609 O ARG A 111 -14.484 -6.969 -13.152 1.00 0.00 O ATOM 1610 CB ARG A 111 -15.338 -4.327 -11.057 1.00 0.00 C ATOM 1611 CG ARG A 111 -16.293 -3.132 -11.085 1.00 0.00 C ATOM 1612 CD ARG A 111 -15.708 -1.982 -11.909 1.00 0.00 C ATOM 1613 NE ARG A 111 -16.019 -2.178 -13.343 1.00 0.00 N ATOM 1614 CZ ARG A 111 -15.911 -1.219 -14.272 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -15.500 0.008 -13.925 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -16.215 -1.487 -15.550 1.00 0.00 N ATOM 0 H ARG A 111 -17.171 -5.864 -10.275 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.172 -5.113 -12.871 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -15.186 -4.652 -10.028 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -14.364 -4.028 -11.444 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -17.250 -3.437 -11.508 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -16.487 -2.793 -10.067 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -16.118 -1.032 -11.566 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -14.629 -1.933 -11.766 1.00 0.00 H new ATOM 0 HE ARG A 111 -16.335 -3.100 -13.642 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -15.269 0.213 -12.953 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -15.418 0.738 -14.633 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -16.528 -2.421 -15.815 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -16.133 -0.757 -16.258 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.268 -6.975 -10.901 1.00 0.00 N ATOM 1631 CA GLY A 112 -13.226 -7.988 -10.892 1.00 0.00 C ATOM 1632 C GLY A 112 -11.925 -7.431 -10.311 1.00 0.00 C ATOM 1633 O GLY A 112 -10.880 -8.074 -10.392 1.00 0.00 O ATOM 0 H GLY A 112 -14.536 -6.630 -9.979 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.553 -8.846 -10.304 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -13.052 -8.345 -11.907 1.00 0.00 H new ATOM 1637 N MET A 113 -12.032 -6.242 -9.737 1.00 0.00 N ATOM 1638 CA MET A 113 -10.877 -5.592 -9.142 1.00 0.00 C ATOM 1639 C MET A 113 -11.307 -4.487 -8.175 1.00 0.00 C ATOM 1640 O MET A 113 -12.483 -4.384 -7.827 1.00 0.00 O ATOM 1641 CB MET A 113 -10.003 -4.992 -10.245 1.00 0.00 C ATOM 1642 CG MET A 113 -10.836 -4.130 -11.196 1.00 0.00 C ATOM 1643 SD MET A 113 -11.292 -2.602 -10.395 1.00 0.00 S ATOM 1644 CE MET A 113 -11.045 -1.459 -11.743 1.00 0.00 C ATOM 0 H MET A 113 -12.901 -5.712 -9.671 1.00 0.00 H new ATOM 0 HA MET A 113 -10.312 -6.339 -8.584 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.212 -4.388 -9.800 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.517 -5.791 -10.804 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.267 -3.920 -12.102 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.731 -4.672 -11.501 1.00 0.00 H new ATOM 0 HE1 MET A 113 -11.024 -0.440 -11.357 1.00 0.00 H new ATOM 0 HE2 MET A 113 -10.099 -1.679 -12.238 1.00 0.00 H new ATOM 0 HE3 MET A 113 -11.861 -1.559 -12.459 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.332 -3.688 -7.767 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.595 -2.595 -6.847 1.00 0.00 C ATOM 1656 C ILE A 114 -9.631 -1.444 -7.140 1.00 0.00 C ATOM 1657 O ILE A 114 -8.431 -1.660 -7.301 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.541 -3.088 -5.399 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -10.598 -1.915 -4.418 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -9.315 -3.972 -5.166 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -11.049 -2.381 -3.033 1.00 0.00 C ATOM 0 H ILE A 114 -9.358 -3.776 -8.057 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.605 -2.211 -6.992 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.421 -3.704 -5.215 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.616 -1.448 -4.347 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.285 -1.156 -4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.301 -4.309 -4.129 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.359 -4.837 -5.828 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.410 -3.401 -5.374 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.081 -1.528 -2.355 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -12.042 -2.826 -3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -10.346 -3.122 -2.652 1.00 0.00 H new ATOM 1673 N GLN A 115 -10.192 -0.245 -7.202 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.397 0.940 -7.473 1.00 0.00 C ATOM 1675 C GLN A 115 -9.004 1.627 -6.164 1.00 0.00 C ATOM 1676 O GLN A 115 -9.855 1.880 -5.312 1.00 0.00 O ATOM 1677 CB GLN A 115 -10.147 1.904 -8.394 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.472 3.278 -8.417 1.00 0.00 C ATOM 1679 CD GLN A 115 -10.255 4.258 -9.293 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -10.714 5.297 -8.848 1.00 0.00 O ATOM 1681 NE2 GLN A 115 -10.380 3.871 -10.559 1.00 0.00 N ATOM 0 H GLN A 115 -11.188 -0.069 -7.069 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.486 0.633 -7.987 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.182 1.495 -9.404 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -11.178 2.007 -8.056 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.400 3.669 -7.402 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.454 3.181 -8.794 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -9.971 2.988 -10.865 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -10.885 4.457 -11.224 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.715 1.910 -6.044 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.200 2.563 -4.853 1.00 0.00 C ATOM 1692 C LEU A 116 -6.694 3.959 -5.220 1.00 0.00 C ATOM 1693 O LEU A 116 -5.767 4.098 -6.016 1.00 0.00 O ATOM 1694 CB LEU A 116 -6.145 1.685 -4.175 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.571 0.251 -3.854 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -5.353 -0.635 -3.584 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.569 0.223 -2.694 1.00 0.00 C ATOM 0 H LEU A 116 -7.012 1.699 -6.752 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.993 2.695 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.266 1.646 -4.818 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.840 2.169 -3.247 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.080 -0.158 -4.727 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.683 -1.649 -3.358 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.711 -0.650 -4.465 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.795 -0.238 -2.736 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.856 -0.808 -2.486 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.108 0.658 -1.807 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.455 0.799 -2.962 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.326 4.958 -4.622 1.00 0.00 N ATOM 1710 CA VAL A 117 -6.952 6.339 -4.876 1.00 0.00 C ATOM 1711 C VAL A 117 -6.169 6.880 -3.678 1.00 0.00 C ATOM 1712 O VAL A 117 -6.635 6.804 -2.542 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.198 7.168 -5.199 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -7.818 8.594 -5.600 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.035 6.496 -6.289 1.00 0.00 C ATOM 0 H VAL A 117 -8.095 4.839 -3.962 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.300 6.404 -5.747 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.807 7.225 -4.297 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -8.721 9.162 -5.824 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.283 9.072 -4.780 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.179 8.566 -6.482 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.914 7.105 -6.500 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.438 6.394 -7.195 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.350 5.509 -5.949 1.00 0.00 H new ATOM 1725 N ILE A 118 -4.993 7.413 -3.973 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.141 7.966 -2.934 1.00 0.00 C ATOM 1727 C ILE A 118 -3.940 9.462 -3.187 1.00 0.00 C ATOM 1728 O ILE A 118 -3.921 9.904 -4.335 1.00 0.00 O ATOM 1729 CB ILE A 118 -2.833 7.178 -2.838 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -1.960 7.412 -4.073 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.104 5.691 -2.601 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -0.758 8.297 -3.735 1.00 0.00 C ATOM 0 H ILE A 118 -4.610 7.474 -4.916 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.618 7.868 -1.959 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.276 7.545 -1.976 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.613 6.456 -4.464 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.553 7.882 -4.858 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.157 5.154 -2.537 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.656 5.566 -1.670 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.692 5.292 -3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.154 8.448 -4.630 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.108 9.261 -3.367 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.154 7.813 -2.967 1.00 0.00 H new ATOM 1744 N LEU A 119 -3.797 10.200 -2.096 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.599 11.637 -2.185 1.00 0.00 C ATOM 1746 C LEU A 119 -2.212 11.991 -1.644 1.00 0.00 C ATOM 1747 O LEU A 119 -1.896 11.691 -0.494 1.00 0.00 O ATOM 1748 CB LEU A 119 -4.740 12.379 -1.487 1.00 0.00 C ATOM 1749 CG LEU A 119 -4.806 13.888 -1.730 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -3.823 14.634 -0.826 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -4.586 14.215 -3.209 1.00 0.00 C ATOM 0 H LEU A 119 -3.814 9.830 -1.146 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.628 11.962 -3.225 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.684 11.938 -1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.656 12.207 -0.414 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.807 14.232 -1.469 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.891 15.704 -1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.068 14.438 0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.809 14.292 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.638 15.294 -3.355 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.606 13.854 -3.520 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.358 13.731 -3.807 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.422 12.624 -2.498 1.00 0.00 N ATOM 1764 CA ARG A 120 -0.077 13.022 -2.120 1.00 0.00 C ATOM 1765 C ARG A 120 0.192 14.464 -2.556 1.00 0.00 C ATOM 1766 O ARG A 120 0.247 14.756 -3.749 1.00 0.00 O ATOM 1767 CB ARG A 120 0.968 12.102 -2.754 1.00 0.00 C ATOM 1768 CG ARG A 120 2.357 12.363 -2.166 1.00 0.00 C ATOM 1769 CD ARG A 120 3.338 11.259 -2.565 1.00 0.00 C ATOM 1770 NE ARG A 120 3.295 10.162 -1.572 1.00 0.00 N ATOM 1771 CZ ARG A 120 4.152 9.132 -1.553 1.00 0.00 C ATOM 1772 NH1 ARG A 120 5.124 9.052 -2.472 1.00 0.00 N ATOM 1773 NH2 ARG A 120 4.038 8.182 -0.615 1.00 0.00 N ATOM 0 H ARG A 120 -1.688 12.871 -3.451 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.001 12.946 -1.035 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.689 11.061 -2.589 1.00 0.00 H new ATOM 0 HB3 ARG A 120 0.990 12.259 -3.832 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.728 13.327 -2.514 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.291 12.420 -1.080 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.085 10.876 -3.554 1.00 0.00 H new ATOM 0 HD3 ARG A 120 4.348 11.664 -2.629 1.00 0.00 H new ATOM 0 HE ARG A 120 2.568 10.192 -0.858 1.00 0.00 H new ATOM 0 HH11 ARG A 120 5.212 9.775 -3.186 1.00 0.00 H new ATOM 0 HH12 ARG A 120 5.776 8.268 -2.457 1.00 0.00 H new ATOM 0 HH21 ARG A 120 3.299 8.243 0.085 1.00 0.00 H new ATOM 0 HH22 ARG A 120 4.691 7.398 -0.601 1.00 0.00 H new ATOM 1787 N ARG A 121 0.353 15.328 -1.564 1.00 0.00 N ATOM 1788 CA ARG A 121 0.615 16.732 -1.830 1.00 0.00 C ATOM 1789 C ARG A 121 2.079 17.064 -1.535 1.00 0.00 C ATOM 1790 O ARG A 121 2.778 17.615 -2.385 1.00 0.00 O ATOM 1791 CB ARG A 121 -0.286 17.631 -0.980 1.00 0.00 C ATOM 1792 CG ARG A 121 0.420 18.943 -0.633 1.00 0.00 C ATOM 1793 CD ARG A 121 -0.594 20.061 -0.382 1.00 0.00 C ATOM 1794 NE ARG A 121 -0.173 20.875 0.780 1.00 0.00 N ATOM 1795 CZ ARG A 121 0.860 21.729 0.765 1.00 0.00 C ATOM 1796 NH1 ARG A 121 1.583 21.885 -0.351 1.00 0.00 N ATOM 1797 NH2 ARG A 121 1.169 22.425 1.868 1.00 0.00 N ATOM 0 H ARG A 121 0.307 15.083 -0.575 1.00 0.00 H new ATOM 0 HA ARG A 121 0.402 16.915 -2.883 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -1.209 17.842 -1.520 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.565 17.111 -0.064 1.00 0.00 H new ATOM 0 HG2 ARG A 121 1.040 18.804 0.253 1.00 0.00 H new ATOM 0 HG3 ARG A 121 1.087 19.228 -1.447 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.678 20.692 -1.267 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.580 19.634 -0.199 1.00 0.00 H new ATOM 0 HE ARG A 121 -0.702 20.780 1.647 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.348 21.354 -1.190 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.369 22.535 -0.363 1.00 0.00 H new ATOM 0 HH21 ARG A 121 0.618 22.305 2.718 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.955 23.075 1.857 1.00 0.00 H new ATOM 1811 N SER A 122 2.500 16.715 -0.328 1.00 0.00 N ATOM 1812 CA SER A 122 3.869 16.968 0.089 1.00 0.00 C ATOM 1813 C SER A 122 4.759 15.782 -0.285 1.00 0.00 C ATOM 1814 O SER A 122 5.703 15.929 -1.059 1.00 0.00 O ATOM 1815 CB SER A 122 3.945 17.235 1.594 1.00 0.00 C ATOM 1816 OG SER A 122 4.657 18.434 1.888 1.00 0.00 O ATOM 0 H SER A 122 1.917 16.259 0.374 1.00 0.00 H new ATOM 0 HA SER A 122 4.225 17.858 -0.430 1.00 0.00 H new ATOM 0 HB2 SER A 122 2.936 17.303 2.002 1.00 0.00 H new ATOM 0 HB3 SER A 122 4.432 16.394 2.087 1.00 0.00 H new ATOM 0 HG SER A 122 4.682 18.570 2.858 1.00 0.00 H new ATOM 1822 N GLY A 123 4.426 14.631 0.281 1.00 0.00 N ATOM 1823 CA GLY A 123 5.183 13.420 0.016 1.00 0.00 C ATOM 1824 C GLY A 123 5.601 12.739 1.321 1.00 0.00 C ATOM 1825 O GLY A 123 5.228 13.184 2.405 1.00 0.00 O ATOM 0 H GLY A 123 3.642 14.512 0.922 1.00 0.00 H new ATOM 0 HA2 GLY A 123 4.581 12.734 -0.580 1.00 0.00 H new ATOM 0 HA3 GLY A 123 6.068 13.661 -0.572 1.00 0.00 H new ATOM 1829 N PRO A 124 6.391 11.642 1.169 1.00 0.00 N ATOM 1830 CA PRO A 124 6.864 10.895 2.322 1.00 0.00 C ATOM 1831 C PRO A 124 7.987 11.647 3.040 1.00 0.00 C ATOM 1832 O PRO A 124 9.118 11.169 3.101 1.00 0.00 O ATOM 1833 CB PRO A 124 7.309 9.552 1.766 1.00 0.00 C ATOM 1834 CG PRO A 124 7.504 9.764 0.273 1.00 0.00 C ATOM 1835 CD PRO A 124 6.853 11.086 -0.099 1.00 0.00 C ATOM 0 HA PRO A 124 6.093 10.761 3.081 1.00 0.00 H new ATOM 0 HB2 PRO A 124 8.234 9.221 2.238 1.00 0.00 H new ATOM 0 HB3 PRO A 124 6.561 8.783 1.957 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.565 9.778 0.025 1.00 0.00 H new ATOM 0 HG3 PRO A 124 7.056 8.946 -0.291 1.00 0.00 H new ATOM 0 HD2 PRO A 124 7.563 11.753 -0.588 1.00 0.00 H new ATOM 0 HD3 PRO A 124 6.025 10.938 -0.792 1.00 0.00 H new ATOM 1843 N SER A 125 7.635 12.811 3.564 1.00 0.00 N ATOM 1844 CA SER A 125 8.599 13.634 4.275 1.00 0.00 C ATOM 1845 C SER A 125 8.546 13.326 5.773 1.00 0.00 C ATOM 1846 O SER A 125 7.475 13.349 6.377 1.00 0.00 O ATOM 1847 CB SER A 125 8.340 15.122 4.029 1.00 0.00 C ATOM 1848 OG SER A 125 9.440 15.755 3.381 1.00 0.00 O ATOM 0 H SER A 125 6.695 13.204 3.511 1.00 0.00 H new ATOM 0 HA SER A 125 9.594 13.399 3.898 1.00 0.00 H new ATOM 0 HB2 SER A 125 7.444 15.238 3.419 1.00 0.00 H new ATOM 0 HB3 SER A 125 8.145 15.618 4.980 1.00 0.00 H new ATOM 0 HG SER A 125 9.235 16.703 3.240 1.00 0.00 H new ATOM 1854 N SER A 126 9.715 13.046 6.328 1.00 0.00 N ATOM 1855 CA SER A 126 9.815 12.734 7.744 1.00 0.00 C ATOM 1856 C SER A 126 11.280 12.769 8.185 1.00 0.00 C ATOM 1857 O SER A 126 12.181 12.562 7.375 1.00 0.00 O ATOM 1858 CB SER A 126 9.202 11.366 8.052 1.00 0.00 C ATOM 1859 OG SER A 126 8.203 11.445 9.065 1.00 0.00 O ATOM 0 H SER A 126 10.601 13.028 5.823 1.00 0.00 H new ATOM 0 HA SER A 126 9.256 13.486 8.300 1.00 0.00 H new ATOM 0 HB2 SER A 126 8.765 10.952 7.143 1.00 0.00 H new ATOM 0 HB3 SER A 126 9.987 10.680 8.370 1.00 0.00 H new ATOM 0 HG SER A 126 7.835 10.552 9.232 1.00 0.00 H new ATOM 1865 N GLY A 127 11.472 13.034 9.469 1.00 0.00 N ATOM 1866 CA GLY A 127 12.811 13.099 10.028 1.00 0.00 C ATOM 1867 C GLY A 127 13.039 11.975 11.041 1.00 0.00 C ATOM 1868 O GLY A 127 13.076 10.802 10.673 1.00 0.00 O ATOM 0 H GLY A 127 10.722 13.206 10.138 1.00 0.00 H new ATOM 0 HA2 GLY A 127 13.547 13.026 9.227 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.960 14.064 10.511 1.00 0.00 H new TER 1872 GLY A 127