USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1128 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 NoAdj-H: A 34 HIS HE2 : A 34 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 122 HIS HD1 : A 122 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 89 HIS : no HD1:sc= -0.278 X(o=-1.4,f=-1.2) USER MOD Set 1.2: A 120 HIS : no HE2:sc= -1.09 X(o=-1.4,f=-1.3) USER MOD Set 2.1: A 73 ASN : amide:sc= -5.14! C(o=-7.5!,f=-9.6!) USER MOD Set 2.2: A 113 THR OG1 : rot -105:sc= -2.4! USER MOD Set 3.1: A 83 MET CE :methyl -131:sc= -0.0618 (180deg=-0.729) USER MOD Set 3.2: A 125 MET CE :methyl 165:sc= -1.06 (180deg=-1.62) USER MOD Set 3.3: A 145 TYR OH : rot 59:sc= 0.938 USER MOD Set 4.1: A 79 HIS : no HE2:sc= -5.82! C(o=-6!,f=-10!) USER MOD Set 4.2: A 85 THR OG1 : rot 110:sc= -0.18 USER MOD Set 5.1: A 45 THR OG1 : rot 100:sc= 1.06 USER MOD Set 5.2: A 110 THR OG1 : rot 141:sc= 0.311 USER MOD Set 6.1: A 21 THR OG1 : rot 180:sc= 0.426 USER MOD Set 6.2: A 23 ASN : amide:sc= -0.519 K(o=-0.093,f=-1.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.00295) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.038) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -29:sc= 0.218 USER MOD Single : A 15 TYR OH : rot 64:sc= 0.114 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0214 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.57 USER MOD Single : A 52 ASN : amide:sc= -3.01! K(o=-3!,f=-0.86) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0386 USER MOD Single : A 56 LYS NZ :NH3+ -169:sc= -0.817 (180deg=-1.05) USER MOD Single : A 60 ASN : amide:sc= -3.08! K(o=-3.1!,f=-0.25) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 HIS : no HD1:sc= -5.68! C(o=-5.7!,f=-5.6!) USER MOD Single : A 67 MET CE :methyl -170:sc= -0.0101 (180deg=-0.173) USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0.0386 X(o=0.039,f=-0.015) USER MOD Single : A 84 HIS : no HD1:sc= -1.22 X(o=-1.2,f=-1.6!) USER MOD Single : A 87 TYR OH : rot 100:sc= 0 USER MOD Single : A 91 SER OG : rot -31:sc= 0.0679 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0129 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0246 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -8.04! K(o=-8!,f=-1.5) USER MOD Single : A 105 GLN : amide:sc= -1.55 K(o=-1.6,f=-0.033) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00869 USER MOD Single : A 129 ASN : amide:sc= -0.203 X(o=-0.2,f=-0.0056) USER MOD Single : A 131 ASN : amide:sc= -0.0258 K(o=-0.026,f=-1) USER MOD Single : A 133 GLN : amide:sc= -6.54! K(o=-6.5!,f=-2.9) USER MOD Single : A 134 ASN : amide:sc= -0.232 X(o=-0.23,f=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 40:sc= -0.0349 USER MOD Single : A 148 ASN : amide:sc= 0.376 X(o=0.38,f=0.0023) USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 THR OG1 : rot 46:sc= 0.159 USER MOD Single : A 156 THR OG1 : rot 35:sc= 0.0991 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.038 -2.915 -18.026 1.00 0.00 N ATOM 2 CA MET A 1 9.151 -3.293 -19.459 1.00 0.00 C ATOM 3 C MET A 1 7.791 -3.691 -20.025 1.00 0.00 C ATOM 4 O MET A 1 7.041 -4.436 -19.389 1.00 0.00 O ATOM 5 CB MET A 1 10.144 -4.447 -19.626 1.00 0.00 C ATOM 6 CG MET A 1 11.601 -4.016 -19.529 1.00 0.00 C ATOM 7 SD MET A 1 12.745 -5.410 -19.441 1.00 0.00 S ATOM 8 CE MET A 1 12.654 -5.827 -17.699 1.00 0.00 C ATOM 0 H1 MET A 1 9.969 -2.616 -17.672 1.00 0.00 H new ATOM 0 H2 MET A 1 8.361 -2.132 -17.926 1.00 0.00 H new ATOM 0 H3 MET A 1 8.705 -3.733 -17.476 1.00 0.00 H new ATOM 0 HA MET A 1 9.515 -2.426 -20.011 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.945 -5.200 -18.863 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.978 -4.921 -20.593 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.851 -3.402 -20.394 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.731 -3.390 -18.646 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.310 -6.673 -17.493 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.968 -4.970 -17.103 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.628 -6.091 -17.441 1.00 0.00 H new ATOM 20 N ARG A 2 7.490 -3.190 -21.230 1.00 0.00 N ATOM 21 CA ARG A 2 6.219 -3.473 -21.910 1.00 0.00 C ATOM 22 C ARG A 2 6.300 -4.764 -22.724 1.00 0.00 C ATOM 23 O ARG A 2 7.364 -5.107 -23.248 1.00 0.00 O ATOM 24 CB ARG A 2 5.829 -2.308 -22.827 1.00 0.00 C ATOM 25 CG ARG A 2 5.386 -1.059 -22.080 1.00 0.00 C ATOM 26 CD ARG A 2 4.952 0.036 -23.039 1.00 0.00 C ATOM 27 NE ARG A 2 4.580 1.267 -22.333 1.00 0.00 N ATOM 28 CZ ARG A 2 3.559 2.064 -22.676 1.00 0.00 C ATOM 29 NH1 ARG A 2 2.784 1.781 -23.722 1.00 0.00 N ATOM 30 NH2 ARG A 2 3.313 3.155 -21.963 1.00 0.00 N ATOM 0 H ARG A 2 8.115 -2.581 -21.758 1.00 0.00 H new ATOM 0 HA ARG A 2 5.456 -3.597 -21.142 1.00 0.00 H new ATOM 0 HB2 ARG A 2 6.679 -2.058 -23.462 1.00 0.00 H new ATOM 0 HB3 ARG A 2 5.023 -2.631 -23.486 1.00 0.00 H new ATOM 0 HG2 ARG A 2 4.562 -1.307 -21.411 1.00 0.00 H new ATOM 0 HG3 ARG A 2 6.204 -0.696 -21.457 1.00 0.00 H new ATOM 0 HD2 ARG A 2 5.762 0.249 -23.737 1.00 0.00 H new ATOM 0 HD3 ARG A 2 4.105 -0.314 -23.630 1.00 0.00 H new ATOM 0 HE ARG A 2 5.139 1.535 -21.523 1.00 0.00 H new ATOM 0 HH11 ARG A 2 2.963 0.945 -24.278 1.00 0.00 H new ATOM 0 HH12 ARG A 2 2.012 2.401 -23.967 1.00 0.00 H new ATOM 0 HH21 ARG A 2 3.899 3.382 -21.160 1.00 0.00 H new ATOM 0 HH22 ARG A 2 2.538 3.767 -22.218 1.00 0.00 H new ATOM 44 N GLY A 3 5.167 -5.468 -22.818 1.00 0.00 N ATOM 45 CA GLY A 3 5.110 -6.718 -23.563 1.00 0.00 C ATOM 46 C GLY A 3 3.826 -6.869 -24.353 1.00 0.00 C ATOM 47 O GLY A 3 3.861 -7.016 -25.579 1.00 0.00 O ATOM 0 H GLY A 3 4.285 -5.191 -22.388 1.00 0.00 H new ATOM 0 HA2 GLY A 3 5.959 -6.769 -24.244 1.00 0.00 H new ATOM 0 HA3 GLY A 3 5.206 -7.554 -22.870 1.00 0.00 H new ATOM 51 N SER A 4 2.691 -6.830 -23.646 1.00 0.00 N ATOM 52 CA SER A 4 1.373 -6.966 -24.269 1.00 0.00 C ATOM 53 C SER A 4 0.753 -5.598 -24.547 1.00 0.00 C ATOM 54 O SER A 4 1.022 -4.630 -23.829 1.00 0.00 O ATOM 55 CB SER A 4 0.444 -7.785 -23.371 1.00 0.00 C ATOM 56 OG SER A 4 0.957 -9.088 -23.159 1.00 0.00 O ATOM 0 H SER A 4 2.661 -6.704 -22.634 1.00 0.00 H new ATOM 0 HA SER A 4 1.502 -7.484 -25.219 1.00 0.00 H new ATOM 0 HB2 SER A 4 0.320 -7.279 -22.413 1.00 0.00 H new ATOM 0 HB3 SER A 4 -0.544 -7.850 -23.827 1.00 0.00 H new ATOM 0 HG SER A 4 0.346 -9.590 -22.581 1.00 0.00 H new ATOM 62 N HIS A 5 -0.076 -5.534 -25.594 1.00 0.00 N ATOM 63 CA HIS A 5 -0.746 -4.293 -25.984 1.00 0.00 C ATOM 64 C HIS A 5 -2.267 -4.480 -26.019 1.00 0.00 C ATOM 65 O HIS A 5 -3.010 -3.630 -25.519 1.00 0.00 O ATOM 66 CB HIS A 5 -0.232 -3.822 -27.351 1.00 0.00 C ATOM 67 CG HIS A 5 -0.254 -2.334 -27.527 1.00 0.00 C ATOM 68 ND1 HIS A 5 -1.401 -1.625 -27.817 1.00 0.00 N ATOM 69 CD2 HIS A 5 0.742 -1.419 -27.452 1.00 0.00 C ATOM 70 CE1 HIS A 5 -1.110 -0.340 -27.913 1.00 0.00 C ATOM 71 NE2 HIS A 5 0.183 -0.190 -27.697 1.00 0.00 N ATOM 0 H HIS A 5 -0.299 -6.333 -26.188 1.00 0.00 H new ATOM 0 HA HIS A 5 -0.517 -3.530 -25.240 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.789 -4.179 -27.487 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -0.837 -4.280 -28.133 1.00 0.00 H new ATOM 0 HD2 HIS A 5 1.782 -1.619 -27.239 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -1.811 0.452 -28.131 1.00 0.00 H new ATOM 0 HE2 HIS A 5 0.686 0.697 -27.710 1.00 0.00 H new ATOM 80 N HIS A 6 -2.715 -5.595 -26.611 1.00 0.00 N ATOM 81 CA HIS A 6 -4.142 -5.909 -26.713 1.00 0.00 C ATOM 82 C HIS A 6 -4.464 -7.207 -25.979 1.00 0.00 C ATOM 83 O HIS A 6 -3.633 -8.118 -25.921 1.00 0.00 O ATOM 84 CB HIS A 6 -4.563 -6.018 -28.181 1.00 0.00 C ATOM 85 CG HIS A 6 -4.654 -4.698 -28.883 1.00 0.00 C ATOM 86 ND1 HIS A 6 -5.833 -3.995 -29.014 1.00 0.00 N ATOM 87 CD2 HIS A 6 -3.704 -3.952 -29.496 1.00 0.00 C ATOM 88 CE1 HIS A 6 -5.606 -2.875 -29.678 1.00 0.00 C ATOM 89 NE2 HIS A 6 -4.321 -2.826 -29.980 1.00 0.00 N ATOM 0 H HIS A 6 -2.104 -6.297 -27.028 1.00 0.00 H new ATOM 0 HA HIS A 6 -4.701 -5.098 -26.246 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -3.849 -6.651 -28.708 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -5.531 -6.516 -28.236 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -2.656 -4.198 -29.587 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -6.344 -2.128 -29.930 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -3.861 -2.072 -30.491 1.00 0.00 H new ATOM 98 N HIS A 7 -5.678 -7.277 -25.424 1.00 0.00 N ATOM 99 CA HIS A 7 -6.133 -8.457 -24.681 1.00 0.00 C ATOM 100 C HIS A 7 -7.224 -9.209 -25.446 1.00 0.00 C ATOM 101 O HIS A 7 -8.113 -8.591 -26.039 1.00 0.00 O ATOM 102 CB HIS A 7 -6.632 -8.063 -23.276 1.00 0.00 C ATOM 103 CG HIS A 7 -7.626 -6.933 -23.249 1.00 0.00 C ATOM 104 ND1 HIS A 7 -8.987 -7.128 -23.136 1.00 0.00 N ATOM 105 CD2 HIS A 7 -7.445 -5.592 -23.315 1.00 0.00 C ATOM 106 CE1 HIS A 7 -9.600 -5.957 -23.137 1.00 0.00 C ATOM 107 NE2 HIS A 7 -8.687 -5.010 -23.246 1.00 0.00 N ATOM 0 H HIS A 7 -6.367 -6.526 -25.476 1.00 0.00 H new ATOM 0 HA HIS A 7 -5.279 -9.125 -24.569 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -7.086 -8.937 -22.809 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -5.772 -7.786 -22.666 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -6.500 -5.077 -23.405 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -10.666 -5.802 -23.062 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -8.874 -4.008 -23.274 1.00 0.00 H new ATOM 116 N HIS A 8 -7.141 -10.543 -25.416 1.00 0.00 N ATOM 117 CA HIS A 8 -8.111 -11.404 -26.095 1.00 0.00 C ATOM 118 C HIS A 8 -8.931 -12.217 -25.089 1.00 0.00 C ATOM 119 O HIS A 8 -10.154 -12.322 -25.222 1.00 0.00 O ATOM 120 CB HIS A 8 -7.398 -12.342 -27.074 1.00 0.00 C ATOM 121 CG HIS A 8 -7.664 -12.026 -28.512 1.00 0.00 C ATOM 122 ND1 HIS A 8 -8.679 -12.615 -29.237 1.00 0.00 N ATOM 123 CD2 HIS A 8 -7.038 -11.178 -29.365 1.00 0.00 C ATOM 124 CE1 HIS A 8 -8.666 -12.146 -30.473 1.00 0.00 C ATOM 125 NE2 HIS A 8 -7.680 -11.274 -30.575 1.00 0.00 N ATOM 0 H HIS A 8 -6.406 -11.052 -24.925 1.00 0.00 H new ATOM 0 HA HIS A 8 -8.795 -10.763 -26.651 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -6.324 -12.293 -26.893 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -7.709 -13.367 -26.873 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -6.193 -10.546 -29.136 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -9.345 -12.428 -31.264 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -7.434 -10.755 -31.418 1.00 0.00 H new ATOM 134 N HIS A 9 -8.246 -12.789 -24.089 1.00 0.00 N ATOM 135 CA HIS A 9 -8.899 -13.597 -23.057 1.00 0.00 C ATOM 136 C HIS A 9 -8.737 -12.960 -21.680 1.00 0.00 C ATOM 137 O HIS A 9 -7.702 -12.355 -21.386 1.00 0.00 O ATOM 138 CB HIS A 9 -8.321 -15.014 -23.041 1.00 0.00 C ATOM 139 CG HIS A 9 -8.745 -15.854 -24.207 1.00 0.00 C ATOM 140 ND1 HIS A 9 -8.021 -15.942 -25.376 1.00 0.00 N ATOM 141 CD2 HIS A 9 -9.825 -16.654 -24.374 1.00 0.00 C ATOM 142 CE1 HIS A 9 -8.637 -16.759 -26.213 1.00 0.00 C ATOM 143 NE2 HIS A 9 -9.733 -17.204 -25.629 1.00 0.00 N ATOM 0 H HIS A 9 -7.236 -12.705 -23.975 1.00 0.00 H new ATOM 0 HA HIS A 9 -9.962 -13.647 -23.295 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -7.233 -14.952 -23.026 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -8.624 -15.510 -22.119 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -10.612 -16.827 -23.655 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -8.300 -17.018 -27.206 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -10.404 -17.852 -26.043 1.00 0.00 H new ATOM 152 N HIS A 10 -9.769 -13.114 -20.843 1.00 0.00 N ATOM 153 CA HIS A 10 -9.772 -12.563 -19.483 1.00 0.00 C ATOM 154 C HIS A 10 -9.548 -13.663 -18.447 1.00 0.00 C ATOM 155 O HIS A 10 -9.938 -14.815 -18.662 1.00 0.00 O ATOM 156 CB HIS A 10 -11.099 -11.855 -19.204 1.00 0.00 C ATOM 157 CG HIS A 10 -11.054 -10.383 -19.470 1.00 0.00 C ATOM 158 ND1 HIS A 10 -11.284 -9.833 -20.714 1.00 0.00 N ATOM 159 CD2 HIS A 10 -10.790 -9.343 -18.643 1.00 0.00 C ATOM 160 CE1 HIS A 10 -11.161 -8.519 -20.641 1.00 0.00 C ATOM 161 NE2 HIS A 10 -10.862 -8.197 -19.397 1.00 0.00 N ATOM 0 H HIS A 10 -10.620 -13.620 -21.087 1.00 0.00 H new ATOM 0 HA HIS A 10 -8.956 -11.844 -19.408 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -11.879 -12.304 -19.819 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -11.379 -12.020 -18.164 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -10.565 -9.404 -17.588 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -11.284 -7.827 -21.461 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.709 -7.250 -19.051 1.00 0.00 H new ATOM 170 N GLY A 11 -8.907 -13.297 -17.331 1.00 0.00 N ATOM 171 CA GLY A 11 -8.633 -14.251 -16.261 1.00 0.00 C ATOM 172 C GLY A 11 -7.155 -14.365 -15.922 1.00 0.00 C ATOM 173 O GLY A 11 -6.721 -15.388 -15.383 1.00 0.00 O ATOM 0 H GLY A 11 -8.572 -12.351 -17.150 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -9.182 -13.952 -15.368 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.009 -15.232 -16.553 1.00 0.00 H new ATOM 177 N SER A 12 -6.385 -13.317 -16.240 1.00 0.00 N ATOM 178 CA SER A 12 -4.945 -13.292 -15.970 1.00 0.00 C ATOM 179 C SER A 12 -4.619 -12.521 -14.707 1.00 0.00 C ATOM 180 O SER A 12 -5.435 -11.733 -14.216 1.00 0.00 O ATOM 181 CB SER A 12 -4.186 -12.626 -17.110 1.00 0.00 C ATOM 182 OG SER A 12 -3.689 -13.581 -18.030 1.00 0.00 O ATOM 0 H SER A 12 -6.739 -12.471 -16.687 1.00 0.00 H new ATOM 0 HA SER A 12 -4.643 -14.333 -15.859 1.00 0.00 H new ATOM 0 HB2 SER A 12 -4.844 -11.928 -17.628 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.358 -12.043 -16.706 1.00 0.00 H new ATOM 0 HG SER A 12 -3.209 -13.122 -18.750 1.00 0.00 H new ATOM 188 N ALA A 13 -3.413 -12.773 -14.177 1.00 0.00 N ATOM 189 CA ALA A 13 -2.915 -12.079 -13.010 1.00 0.00 C ATOM 190 C ALA A 13 -1.392 -12.192 -12.921 1.00 0.00 C ATOM 191 O ALA A 13 -0.850 -13.267 -12.632 1.00 0.00 O ATOM 192 CB ALA A 13 -3.577 -12.584 -11.730 1.00 0.00 C ATOM 0 H ALA A 13 -2.766 -13.465 -14.555 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.174 -11.026 -13.117 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.178 -12.039 -10.874 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.654 -12.426 -11.790 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.373 -13.648 -11.610 1.00 0.00 H new ATOM 198 N THR A 14 -0.710 -11.070 -13.186 1.00 0.00 N ATOM 199 CA THR A 14 0.746 -11.004 -13.155 1.00 0.00 C ATOM 200 C THR A 14 1.280 -10.600 -11.769 1.00 0.00 C ATOM 201 O THR A 14 2.477 -10.741 -11.497 1.00 0.00 O ATOM 202 CB THR A 14 1.287 -10.041 -14.253 1.00 0.00 C ATOM 203 OG1 THR A 14 2.719 -10.090 -14.294 1.00 0.00 O ATOM 204 CG2 THR A 14 0.832 -8.592 -14.050 1.00 0.00 C ATOM 0 H THR A 14 -1.158 -10.186 -13.427 1.00 0.00 H new ATOM 0 HA THR A 14 1.112 -12.009 -13.364 1.00 0.00 H new ATOM 0 HB THR A 14 0.872 -10.384 -15.200 1.00 0.00 H new ATOM 0 HG1 THR A 14 3.064 -10.313 -13.404 1.00 0.00 H new ATOM 0 HG21 THR A 14 1.240 -7.968 -14.845 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.257 -8.546 -14.075 1.00 0.00 H new ATOM 0 HG23 THR A 14 1.189 -8.230 -13.086 1.00 0.00 H new ATOM 212 N TYR A 15 0.381 -10.102 -10.911 1.00 0.00 N ATOM 213 CA TYR A 15 0.736 -9.662 -9.578 1.00 0.00 C ATOM 214 C TYR A 15 0.472 -10.722 -8.545 1.00 0.00 C ATOM 215 O TYR A 15 -0.653 -11.207 -8.387 1.00 0.00 O ATOM 216 CB TYR A 15 0.020 -8.369 -9.235 1.00 0.00 C ATOM 217 CG TYR A 15 0.940 -7.167 -9.198 1.00 0.00 C ATOM 218 CD1 TYR A 15 0.921 -6.220 -10.214 1.00 0.00 C ATOM 219 CD2 TYR A 15 1.837 -6.988 -8.151 1.00 0.00 C ATOM 220 CE1 TYR A 15 1.770 -5.130 -10.187 1.00 0.00 C ATOM 221 CE2 TYR A 15 2.685 -5.902 -8.115 1.00 0.00 C ATOM 222 CZ TYR A 15 2.648 -4.976 -9.135 1.00 0.00 C ATOM 223 OH TYR A 15 3.496 -3.895 -9.104 1.00 0.00 O ATOM 0 H TYR A 15 -0.609 -9.997 -11.132 1.00 0.00 H new ATOM 0 HA TYR A 15 1.810 -9.473 -9.569 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -0.768 -8.193 -9.967 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -0.465 -8.477 -8.265 1.00 0.00 H new ATOM 0 HD1 TYR A 15 0.232 -6.337 -11.038 1.00 0.00 H new ATOM 0 HD2 TYR A 15 1.870 -7.713 -7.351 1.00 0.00 H new ATOM 0 HE1 TYR A 15 1.746 -4.403 -10.985 1.00 0.00 H new ATOM 0 HE2 TYR A 15 3.374 -5.778 -7.293 1.00 0.00 H new ATOM 0 HH TYR A 15 2.972 -3.070 -9.030 1.00 0.00 H new ATOM 233 N THR A 16 1.544 -11.062 -7.843 1.00 0.00 N ATOM 234 CA THR A 16 1.508 -12.083 -6.817 1.00 0.00 C ATOM 235 C THR A 16 1.376 -11.480 -5.414 1.00 0.00 C ATOM 236 O THR A 16 1.758 -10.327 -5.190 1.00 0.00 O ATOM 237 CB THR A 16 2.768 -12.973 -6.880 1.00 0.00 C ATOM 238 OG1 THR A 16 3.947 -12.158 -6.901 1.00 0.00 O ATOM 239 CG2 THR A 16 2.747 -13.870 -8.111 1.00 0.00 C ATOM 0 H THR A 16 2.461 -10.635 -7.972 1.00 0.00 H new ATOM 0 HA THR A 16 0.626 -12.693 -7.011 1.00 0.00 H new ATOM 0 HB THR A 16 2.776 -13.605 -5.992 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.741 -12.732 -6.939 1.00 0.00 H new ATOM 0 HG21 THR A 16 3.647 -14.485 -8.128 1.00 0.00 H new ATOM 0 HG22 THR A 16 1.868 -14.514 -8.077 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.711 -13.254 -9.010 1.00 0.00 H new ATOM 247 N ARG A 17 0.828 -12.273 -4.475 1.00 0.00 N ATOM 248 CA ARG A 17 0.645 -11.846 -3.094 1.00 0.00 C ATOM 249 C ARG A 17 1.924 -12.087 -2.270 1.00 0.00 C ATOM 250 O ARG A 17 2.293 -13.242 -2.030 1.00 0.00 O ATOM 251 CB ARG A 17 -0.526 -12.606 -2.447 1.00 0.00 C ATOM 252 CG ARG A 17 -1.601 -11.722 -1.819 1.00 0.00 C ATOM 253 CD ARG A 17 -2.975 -11.990 -2.426 1.00 0.00 C ATOM 254 NE ARG A 17 -3.394 -13.396 -2.292 1.00 0.00 N ATOM 255 CZ ARG A 17 -4.501 -13.810 -1.658 1.00 0.00 C ATOM 256 NH1 ARG A 17 -5.330 -12.944 -1.079 1.00 0.00 N ATOM 257 NH2 ARG A 17 -4.783 -15.105 -1.614 1.00 0.00 N ATOM 0 H ARG A 17 0.504 -13.222 -4.661 1.00 0.00 H new ATOM 0 HA ARG A 17 0.425 -10.779 -3.103 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -0.992 -13.237 -3.204 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -0.129 -13.270 -1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.637 -11.900 -0.744 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -1.339 -10.674 -1.960 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -3.712 -11.348 -1.943 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -2.960 -11.719 -3.482 1.00 0.00 H new ATOM 0 HE ARG A 17 -2.797 -14.108 -2.713 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -5.129 -11.945 -1.113 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -6.167 -13.280 -0.602 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -4.160 -15.778 -2.060 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -5.623 -15.428 -1.134 1.00 0.00 H new ATOM 271 N PRO A 18 2.630 -11.006 -1.825 1.00 0.00 N ATOM 272 CA PRO A 18 3.854 -11.138 -1.006 1.00 0.00 C ATOM 273 C PRO A 18 3.563 -11.631 0.416 1.00 0.00 C ATOM 274 O PRO A 18 4.445 -12.173 1.087 1.00 0.00 O ATOM 275 CB PRO A 18 4.418 -9.714 -0.944 1.00 0.00 C ATOM 276 CG PRO A 18 3.678 -8.936 -1.980 1.00 0.00 C ATOM 277 CD PRO A 18 2.336 -9.590 -2.117 1.00 0.00 C ATOM 0 HA PRO A 18 4.536 -11.869 -1.441 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.276 -9.280 0.046 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.490 -9.709 -1.143 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.574 -7.893 -1.682 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.214 -8.945 -2.929 1.00 0.00 H new ATOM 0 HD2 PRO A 18 1.611 -9.175 -1.417 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.923 -9.461 -3.118 1.00 0.00 H new ATOM 285 N LEU A 19 2.312 -11.440 0.849 1.00 0.00 N ATOM 286 CA LEU A 19 1.865 -11.842 2.162 1.00 0.00 C ATOM 287 C LEU A 19 0.508 -12.492 2.077 1.00 0.00 C ATOM 288 O LEU A 19 -0.033 -12.770 1.001 1.00 0.00 O ATOM 289 CB LEU A 19 1.750 -10.634 3.115 1.00 0.00 C ATOM 290 CG LEU A 19 2.601 -10.615 4.400 1.00 0.00 C ATOM 291 CD1 LEU A 19 2.089 -11.633 5.420 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.075 -10.861 4.109 1.00 0.00 C ATOM 0 H LEU A 19 1.586 -10.998 0.285 1.00 0.00 H new ATOM 0 HA LEU A 19 2.605 -12.543 2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.996 -9.739 2.544 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.705 -10.546 3.411 1.00 0.00 H new ATOM 0 HG LEU A 19 2.504 -9.616 4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.710 -11.595 6.315 1.00 0.00 H new ATOM 0 HD12 LEU A 19 1.058 -11.397 5.683 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.134 -12.633 4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.639 -10.839 5.042 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.195 -11.835 3.635 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.449 -10.085 3.441 1.00 0.00 H new ATOM 304 N ASP A 20 -0.001 -12.715 3.251 1.00 0.00 N ATOM 305 CA ASP A 20 -1.302 -13.271 3.484 1.00 0.00 C ATOM 306 C ASP A 20 -2.038 -12.384 4.462 1.00 0.00 C ATOM 307 O ASP A 20 -3.272 -12.343 4.489 1.00 0.00 O ATOM 308 CB ASP A 20 -1.199 -14.669 4.056 1.00 0.00 C ATOM 309 CG ASP A 20 -1.804 -15.722 3.148 1.00 0.00 C ATOM 310 OD1 ASP A 20 -1.063 -16.281 2.312 1.00 0.00 O ATOM 311 OD2 ASP A 20 -3.018 -15.987 3.273 1.00 0.00 O ATOM 0 H ASP A 20 0.502 -12.505 4.113 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.839 -13.327 2.537 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.150 -14.908 4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.700 -14.699 5.023 1.00 0.00 H new ATOM 316 N THR A 21 -1.240 -11.660 5.262 1.00 0.00 N ATOM 317 CA THR A 21 -1.744 -10.779 6.295 1.00 0.00 C ATOM 318 C THR A 21 -0.640 -9.856 6.865 1.00 0.00 C ATOM 319 O THR A 21 0.440 -9.713 6.301 1.00 0.00 O ATOM 320 CB THR A 21 -2.450 -11.604 7.418 1.00 0.00 C ATOM 321 OG1 THR A 21 -3.204 -10.742 8.279 1.00 0.00 O ATOM 322 CG2 THR A 21 -1.469 -12.432 8.256 1.00 0.00 C ATOM 0 H THR A 21 -0.222 -11.678 5.200 1.00 0.00 H new ATOM 0 HA THR A 21 -2.485 -10.122 5.840 1.00 0.00 H new ATOM 0 HB THR A 21 -3.118 -12.301 6.912 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.641 -11.276 8.975 1.00 0.00 H new ATOM 0 HG21 THR A 21 -2.018 -12.983 9.020 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.941 -13.134 7.610 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.749 -11.768 8.735 1.00 0.00 H new ATOM 330 N GLY A 22 -0.989 -9.202 7.957 1.00 0.00 N ATOM 331 CA GLY A 22 -0.101 -8.310 8.690 1.00 0.00 C ATOM 332 C GLY A 22 -0.852 -7.570 9.782 1.00 0.00 C ATOM 333 O GLY A 22 -1.689 -6.713 9.483 1.00 0.00 O ATOM 0 H GLY A 22 -1.918 -9.276 8.371 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.715 -8.884 9.130 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.348 -7.593 8.003 1.00 0.00 H new ATOM 337 N ASN A 23 -0.536 -7.880 11.056 1.00 0.00 N ATOM 338 CA ASN A 23 -1.222 -7.270 12.200 1.00 0.00 C ATOM 339 C ASN A 23 -0.359 -7.176 13.433 1.00 0.00 C ATOM 340 O ASN A 23 0.180 -8.170 13.926 1.00 0.00 O ATOM 341 CB ASN A 23 -2.536 -8.016 12.518 1.00 0.00 C ATOM 342 CG ASN A 23 -2.378 -9.532 12.518 1.00 0.00 C ATOM 343 OD1 ASN A 23 -2.298 -10.162 13.572 1.00 0.00 O ATOM 344 ND2 ASN A 23 -2.316 -10.113 11.324 1.00 0.00 N ATOM 0 H ASN A 23 0.190 -8.549 11.312 1.00 0.00 H new ATOM 0 HA ASN A 23 -1.453 -6.247 11.902 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -2.902 -7.695 13.493 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.293 -7.736 11.785 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -2.197 -11.124 11.254 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.387 -9.548 10.478 1.00 0.00 H new ATOM 351 N ILE A 24 -0.278 -5.943 13.927 1.00 0.00 N ATOM 352 CA ILE A 24 0.486 -5.625 15.121 1.00 0.00 C ATOM 353 C ILE A 24 -0.470 -5.458 16.293 1.00 0.00 C ATOM 354 O ILE A 24 -0.518 -4.427 16.976 1.00 0.00 O ATOM 355 CB ILE A 24 1.324 -4.339 14.965 1.00 0.00 C ATOM 356 CG1 ILE A 24 1.545 -3.971 13.490 1.00 0.00 C ATOM 357 CG2 ILE A 24 2.656 -4.454 15.698 1.00 0.00 C ATOM 358 CD1 ILE A 24 0.367 -3.239 12.879 1.00 0.00 C ATOM 0 H ILE A 24 -0.743 -5.138 13.507 1.00 0.00 H new ATOM 0 HA ILE A 24 1.180 -6.448 15.294 1.00 0.00 H new ATOM 0 HB ILE A 24 0.752 -3.531 15.421 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.436 -3.348 13.406 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.737 -4.880 12.919 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.223 -3.532 15.569 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.474 -4.622 16.759 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.225 -5.290 15.290 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.584 -3.007 11.836 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.521 -3.869 12.933 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.189 -2.314 13.427 1.00 0.00 H new ATOM 370 N THR A 25 -1.192 -6.521 16.514 1.00 0.00 N ATOM 371 CA THR A 25 -2.171 -6.622 17.598 1.00 0.00 C ATOM 372 C THR A 25 -1.614 -7.449 18.759 1.00 0.00 C ATOM 373 O THR A 25 -1.991 -7.248 19.917 1.00 0.00 O ATOM 374 CB THR A 25 -3.507 -7.231 17.083 1.00 0.00 C ATOM 375 OG1 THR A 25 -4.438 -7.395 18.162 1.00 0.00 O ATOM 376 CG2 THR A 25 -3.303 -8.572 16.370 1.00 0.00 C ATOM 0 H THR A 25 -1.127 -7.365 15.944 1.00 0.00 H new ATOM 0 HA THR A 25 -2.374 -5.615 17.963 1.00 0.00 H new ATOM 0 HB THR A 25 -3.911 -6.527 16.355 1.00 0.00 H new ATOM 0 HG1 THR A 25 -5.272 -7.778 17.819 1.00 0.00 H new ATOM 0 HG21 THR A 25 -4.266 -8.954 16.030 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.645 -8.432 15.512 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.852 -9.286 17.060 1.00 0.00 H new ATOM 384 N THR A 26 -0.712 -8.367 18.418 1.00 0.00 N ATOM 385 CA THR A 26 -0.079 -9.244 19.400 1.00 0.00 C ATOM 386 C THR A 26 1.423 -8.963 19.484 1.00 0.00 C ATOM 387 O THR A 26 1.920 -8.469 20.500 1.00 0.00 O ATOM 388 CB THR A 26 -0.335 -10.743 19.071 1.00 0.00 C ATOM 389 OG1 THR A 26 -1.670 -10.919 18.580 1.00 0.00 O ATOM 390 CG2 THR A 26 -0.138 -11.625 20.300 1.00 0.00 C ATOM 0 H THR A 26 -0.401 -8.523 17.459 1.00 0.00 H new ATOM 0 HA THR A 26 -0.528 -9.034 20.371 1.00 0.00 H new ATOM 0 HB THR A 26 0.386 -11.040 18.309 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.821 -11.865 18.374 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.325 -12.666 20.035 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.885 -11.521 20.662 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.833 -11.320 21.082 1.00 0.00 H new ATOM 398 N GLY A 27 2.114 -9.281 18.401 1.00 0.00 N ATOM 399 CA GLY A 27 3.554 -9.078 18.316 1.00 0.00 C ATOM 400 C GLY A 27 4.081 -9.269 16.909 1.00 0.00 C ATOM 401 O GLY A 27 3.906 -10.341 16.321 1.00 0.00 O ATOM 0 H GLY A 27 1.698 -9.684 17.561 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.797 -8.072 18.659 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.057 -9.774 18.987 1.00 0.00 H new ATOM 405 N PHE A 28 4.749 -8.234 16.376 1.00 0.00 N ATOM 406 CA PHE A 28 5.300 -8.266 15.023 1.00 0.00 C ATOM 407 C PHE A 28 6.556 -9.109 14.907 1.00 0.00 C ATOM 408 O PHE A 28 7.224 -9.398 15.902 1.00 0.00 O ATOM 409 CB PHE A 28 5.511 -6.854 14.466 1.00 0.00 C ATOM 410 CG PHE A 28 4.904 -6.681 13.092 1.00 0.00 C ATOM 411 CD1 PHE A 28 3.522 -6.686 12.905 1.00 0.00 C ATOM 412 CD2 PHE A 28 5.716 -6.537 11.983 1.00 0.00 C ATOM 413 CE1 PHE A 28 2.980 -6.549 11.644 1.00 0.00 C ATOM 414 CE2 PHE A 28 5.176 -6.396 10.720 1.00 0.00 C ATOM 415 CZ PHE A 28 3.808 -6.403 10.551 1.00 0.00 C ATOM 0 H PHE A 28 4.919 -7.359 16.872 1.00 0.00 H new ATOM 0 HA PHE A 28 4.551 -8.760 14.404 1.00 0.00 H new ATOM 0 HB2 PHE A 28 5.071 -6.127 15.149 1.00 0.00 H new ATOM 0 HB3 PHE A 28 6.579 -6.641 14.418 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.868 -6.798 13.757 1.00 0.00 H new ATOM 0 HD2 PHE A 28 6.789 -6.535 12.106 1.00 0.00 H new ATOM 0 HE1 PHE A 28 1.908 -6.556 11.513 1.00 0.00 H new ATOM 0 HE2 PHE A 28 5.825 -6.280 9.865 1.00 0.00 H new ATOM 0 HZ PHE A 28 3.385 -6.294 9.563 1.00 0.00 H new ATOM 425 N ASN A 29 6.805 -9.545 13.664 1.00 0.00 N ATOM 426 CA ASN A 29 7.910 -10.413 13.273 1.00 0.00 C ATOM 427 C ASN A 29 9.319 -9.913 13.643 1.00 0.00 C ATOM 428 O ASN A 29 10.301 -10.195 12.939 1.00 0.00 O ATOM 429 CB ASN A 29 7.808 -10.646 11.771 1.00 0.00 C ATOM 430 CG ASN A 29 6.643 -11.524 11.384 1.00 0.00 C ATOM 431 OD1 ASN A 29 6.709 -12.750 11.463 1.00 0.00 O ATOM 432 ND2 ASN A 29 5.572 -10.886 10.948 1.00 0.00 N ATOM 0 H ASN A 29 6.213 -9.288 12.874 1.00 0.00 H new ATOM 0 HA ASN A 29 7.802 -11.334 13.846 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.714 -9.685 11.266 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.732 -11.103 11.417 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.748 -11.412 10.657 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.569 -9.867 10.902 1.00 0.00 H new ATOM 439 N GLY A 30 9.408 -9.200 14.748 1.00 0.00 N ATOM 440 CA GLY A 30 10.681 -8.683 15.211 1.00 0.00 C ATOM 441 C GLY A 30 10.818 -7.215 14.908 1.00 0.00 C ATOM 442 O GLY A 30 11.848 -6.605 15.206 1.00 0.00 O ATOM 0 H GLY A 30 8.613 -8.965 15.343 1.00 0.00 H new ATOM 0 HA2 GLY A 30 10.773 -8.845 16.285 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.494 -9.232 14.735 1.00 0.00 H new ATOM 446 N TYR A 31 9.772 -6.668 14.287 1.00 0.00 N ATOM 447 CA TYR A 31 9.719 -5.241 13.946 1.00 0.00 C ATOM 448 C TYR A 31 8.827 -4.513 14.976 1.00 0.00 C ATOM 449 O TYR A 31 7.623 -4.340 14.740 1.00 0.00 O ATOM 450 CB TYR A 31 9.178 -5.016 12.515 1.00 0.00 C ATOM 451 CG TYR A 31 9.769 -5.918 11.437 1.00 0.00 C ATOM 452 CD1 TYR A 31 9.415 -7.263 11.343 1.00 0.00 C ATOM 453 CD2 TYR A 31 10.669 -5.415 10.507 1.00 0.00 C ATOM 454 CE1 TYR A 31 9.944 -8.074 10.356 1.00 0.00 C ATOM 455 CE2 TYR A 31 11.201 -6.221 9.519 1.00 0.00 C ATOM 456 CZ TYR A 31 10.836 -7.548 9.448 1.00 0.00 C ATOM 457 OH TYR A 31 11.363 -8.352 8.463 1.00 0.00 O ATOM 0 H TYR A 31 8.944 -7.194 14.007 1.00 0.00 H new ATOM 0 HA TYR A 31 10.731 -4.838 13.976 1.00 0.00 H new ATOM 0 HB2 TYR A 31 8.097 -5.156 12.528 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.361 -3.978 12.236 1.00 0.00 H new ATOM 0 HD1 TYR A 31 8.716 -7.679 12.053 1.00 0.00 H new ATOM 0 HD2 TYR A 31 10.958 -4.376 10.557 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.659 -9.114 10.297 1.00 0.00 H new ATOM 0 HE2 TYR A 31 11.901 -5.812 8.805 1.00 0.00 H new ATOM 0 HH TYR A 31 11.974 -7.827 7.905 1.00 0.00 H new ATOM 467 N PRO A 32 9.388 -4.083 16.153 1.00 0.00 N ATOM 468 CA PRO A 32 8.609 -3.405 17.204 1.00 0.00 C ATOM 469 C PRO A 32 8.308 -1.939 16.882 1.00 0.00 C ATOM 470 O PRO A 32 9.172 -1.219 16.372 1.00 0.00 O ATOM 471 CB PRO A 32 9.509 -3.492 18.452 1.00 0.00 C ATOM 472 CG PRO A 32 10.692 -4.319 18.056 1.00 0.00 C ATOM 473 CD PRO A 32 10.799 -4.217 16.564 1.00 0.00 C ATOM 0 HA PRO A 32 7.633 -3.875 17.325 1.00 0.00 H new ATOM 0 HB2 PRO A 32 9.819 -2.499 18.778 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.976 -3.949 19.286 1.00 0.00 H new ATOM 0 HG2 PRO A 32 11.600 -3.954 18.536 1.00 0.00 H new ATOM 0 HG3 PRO A 32 10.562 -5.356 18.366 1.00 0.00 H new ATOM 0 HD2 PRO A 32 11.395 -3.357 16.257 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.267 -5.100 16.129 1.00 0.00 H new ATOM 481 N GLY A 33 7.075 -1.515 17.187 1.00 0.00 N ATOM 482 CA GLY A 33 6.658 -0.135 16.935 1.00 0.00 C ATOM 483 C GLY A 33 6.029 0.058 15.563 1.00 0.00 C ATOM 484 O GLY A 33 5.672 1.180 15.191 1.00 0.00 O ATOM 0 H GLY A 33 6.356 -2.105 17.605 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.944 0.168 17.701 1.00 0.00 H new ATOM 0 HA3 GLY A 33 7.523 0.522 17.027 1.00 0.00 H new ATOM 488 N HIS A 34 5.869 -1.052 14.830 1.00 0.00 N ATOM 489 CA HIS A 34 5.301 -1.066 13.496 1.00 0.00 C ATOM 490 C HIS A 34 3.779 -0.890 13.552 1.00 0.00 C ATOM 491 O HIS A 34 3.095 -1.580 14.311 1.00 0.00 O ATOM 492 CB HIS A 34 5.677 -2.391 12.810 1.00 0.00 C ATOM 493 CG HIS A 34 5.692 -2.341 11.309 1.00 0.00 C ATOM 494 ND1 HIS A 34 4.986 -3.210 10.513 1.00 0.00 N ATOM 495 CD2 HIS A 34 6.321 -1.489 10.456 1.00 0.00 C ATOM 496 CE1 HIS A 34 5.200 -2.862 9.239 1.00 0.00 C ATOM 497 NE2 HIS A 34 5.999 -1.822 9.157 1.00 0.00 N ATOM 0 H HIS A 34 6.139 -1.977 15.163 1.00 0.00 H new ATOM 0 HA HIS A 34 5.704 -0.234 12.919 1.00 0.00 H new ATOM 0 HB2 HIS A 34 6.663 -2.698 13.159 1.00 0.00 H new ATOM 0 HB3 HIS A 34 4.973 -3.161 13.127 1.00 0.00 H new ATOM 0 HD1 HIS A 34 4.403 -3.982 10.836 1.00 0.00 H new ATOM 0 HD2 HIS A 34 6.971 -0.678 10.750 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.771 -3.370 8.388 1.00 0.00 H new ATOM 505 N VAL A 35 3.282 0.068 12.775 1.00 0.00 N ATOM 506 CA VAL A 35 1.851 0.376 12.704 1.00 0.00 C ATOM 507 C VAL A 35 1.183 -0.250 11.474 1.00 0.00 C ATOM 508 O VAL A 35 -0.045 -0.309 11.402 1.00 0.00 O ATOM 509 CB VAL A 35 1.579 1.905 12.679 1.00 0.00 C ATOM 510 CG1 VAL A 35 1.199 2.431 14.060 1.00 0.00 C ATOM 511 CG2 VAL A 35 2.763 2.696 12.117 1.00 0.00 C ATOM 0 H VAL A 35 3.859 0.656 12.174 1.00 0.00 H new ATOM 0 HA VAL A 35 1.421 -0.054 13.609 1.00 0.00 H new ATOM 0 HB VAL A 35 0.733 2.054 12.009 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.016 3.504 14.003 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.296 1.927 14.406 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.013 2.238 14.759 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.524 3.760 12.120 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.644 2.520 12.734 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.965 2.372 11.096 1.00 0.00 H new ATOM 521 N GLY A 36 1.989 -0.714 10.513 1.00 0.00 N ATOM 522 CA GLY A 36 1.452 -1.313 9.307 1.00 0.00 C ATOM 523 C GLY A 36 2.013 -2.691 9.051 1.00 0.00 C ATOM 524 O GLY A 36 2.352 -3.420 9.986 1.00 0.00 O ATOM 0 H GLY A 36 3.008 -0.683 10.555 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.367 -1.374 9.387 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.673 -0.670 8.455 1.00 0.00 H new ATOM 528 N VAL A 37 2.088 -3.038 7.772 1.00 0.00 N ATOM 529 CA VAL A 37 2.617 -4.328 7.325 1.00 0.00 C ATOM 530 C VAL A 37 3.693 -4.104 6.242 1.00 0.00 C ATOM 531 O VAL A 37 3.638 -3.116 5.505 1.00 0.00 O ATOM 532 CB VAL A 37 1.472 -5.279 6.836 1.00 0.00 C ATOM 533 CG1 VAL A 37 0.667 -4.661 5.699 1.00 0.00 C ATOM 534 CG2 VAL A 37 2.005 -6.657 6.434 1.00 0.00 C ATOM 0 H VAL A 37 1.783 -2.433 7.010 1.00 0.00 H new ATOM 0 HA VAL A 37 3.088 -4.828 8.171 1.00 0.00 H new ATOM 0 HB VAL A 37 0.801 -5.416 7.684 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.116 -5.353 5.390 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.215 -3.729 6.038 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.326 -4.458 4.855 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.178 -7.284 6.101 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.725 -6.546 5.623 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.492 -7.123 7.291 1.00 0.00 H new ATOM 544 N ASP A 38 4.649 -5.038 6.147 1.00 0.00 N ATOM 545 CA ASP A 38 5.745 -4.926 5.184 1.00 0.00 C ATOM 546 C ASP A 38 5.858 -6.152 4.288 1.00 0.00 C ATOM 547 O ASP A 38 5.872 -7.292 4.761 1.00 0.00 O ATOM 548 CB ASP A 38 7.058 -4.644 5.936 1.00 0.00 C ATOM 549 CG ASP A 38 7.074 -3.258 6.545 1.00 0.00 C ATOM 550 OD1 ASP A 38 6.373 -2.367 6.015 1.00 0.00 O ATOM 551 OD2 ASP A 38 7.693 -3.099 7.617 1.00 0.00 O ATOM 0 H ASP A 38 4.683 -5.877 6.726 1.00 0.00 H new ATOM 0 HA ASP A 38 5.532 -4.091 4.517 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.193 -5.387 6.722 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.899 -4.749 5.250 1.00 0.00 H new ATOM 556 N TYR A 39 5.943 -5.879 2.979 1.00 0.00 N ATOM 557 CA TYR A 39 6.043 -6.913 1.948 1.00 0.00 C ATOM 558 C TYR A 39 7.305 -6.701 1.112 1.00 0.00 C ATOM 559 O TYR A 39 7.395 -5.742 0.333 1.00 0.00 O ATOM 560 CB TYR A 39 4.834 -6.893 0.992 1.00 0.00 C ATOM 561 CG TYR A 39 3.465 -6.663 1.610 1.00 0.00 C ATOM 562 CD1 TYR A 39 3.100 -5.407 2.065 1.00 0.00 C ATOM 563 CD2 TYR A 39 2.520 -7.685 1.689 1.00 0.00 C ATOM 564 CE1 TYR A 39 1.847 -5.170 2.579 1.00 0.00 C ATOM 565 CE2 TYR A 39 1.261 -7.449 2.212 1.00 0.00 C ATOM 566 CZ TYR A 39 0.930 -6.194 2.651 1.00 0.00 C ATOM 567 OH TYR A 39 -0.327 -5.958 3.158 1.00 0.00 O ATOM 0 H TYR A 39 5.944 -4.929 2.607 1.00 0.00 H new ATOM 0 HA TYR A 39 6.073 -7.872 2.465 1.00 0.00 H new ATOM 0 HB2 TYR A 39 5.004 -6.115 0.248 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.809 -7.843 0.459 1.00 0.00 H new ATOM 0 HD1 TYR A 39 3.814 -4.598 2.015 1.00 0.00 H new ATOM 0 HD2 TYR A 39 2.774 -8.674 1.337 1.00 0.00 H new ATOM 0 HE1 TYR A 39 1.583 -4.182 2.926 1.00 0.00 H new ATOM 0 HE2 TYR A 39 0.541 -8.252 2.274 1.00 0.00 H new ATOM 0 HH TYR A 39 -0.849 -6.787 3.137 1.00 0.00 H new ATOM 577 N ALA A 40 8.274 -7.599 1.282 1.00 0.00 N ATOM 578 CA ALA A 40 9.542 -7.557 0.541 1.00 0.00 C ATOM 579 C ALA A 40 9.333 -7.679 -0.978 1.00 0.00 C ATOM 580 O ALA A 40 9.038 -8.763 -1.499 1.00 0.00 O ATOM 581 CB ALA A 40 10.482 -8.646 1.047 1.00 0.00 C ATOM 0 H ALA A 40 8.206 -8.378 1.937 1.00 0.00 H new ATOM 0 HA ALA A 40 9.996 -6.582 0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 40 11.419 -8.606 0.491 1.00 0.00 H new ATOM 0 HB2 ALA A 40 10.682 -8.490 2.107 1.00 0.00 H new ATOM 0 HB3 ALA A 40 10.018 -9.622 0.905 1.00 0.00 H new ATOM 587 N VAL A 41 9.477 -6.541 -1.670 1.00 0.00 N ATOM 588 CA VAL A 41 9.303 -6.465 -3.116 1.00 0.00 C ATOM 589 C VAL A 41 10.287 -5.427 -3.715 1.00 0.00 C ATOM 590 O VAL A 41 10.290 -4.269 -3.286 1.00 0.00 O ATOM 591 CB VAL A 41 7.812 -6.156 -3.505 1.00 0.00 C ATOM 592 CG1 VAL A 41 7.349 -4.776 -3.034 1.00 0.00 C ATOM 593 CG2 VAL A 41 7.581 -6.324 -5.005 1.00 0.00 C ATOM 0 H VAL A 41 9.718 -5.649 -1.237 1.00 0.00 H new ATOM 0 HA VAL A 41 9.536 -7.440 -3.544 1.00 0.00 H new ATOM 0 HB VAL A 41 7.202 -6.890 -2.979 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.312 -4.619 -3.331 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.428 -4.717 -1.949 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.976 -4.008 -3.486 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.540 -6.103 -5.240 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.230 -5.640 -5.552 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.808 -7.350 -5.296 1.00 0.00 H new ATOM 603 N PRO A 42 11.140 -5.828 -4.710 1.00 0.00 N ATOM 604 CA PRO A 42 12.127 -4.924 -5.354 1.00 0.00 C ATOM 605 C PRO A 42 11.580 -3.583 -5.823 1.00 0.00 C ATOM 606 O PRO A 42 10.461 -3.460 -6.326 1.00 0.00 O ATOM 607 CB PRO A 42 12.627 -5.738 -6.549 1.00 0.00 C ATOM 608 CG PRO A 42 12.465 -7.157 -6.138 1.00 0.00 C ATOM 609 CD PRO A 42 11.238 -7.204 -5.267 1.00 0.00 C ATOM 0 HA PRO A 42 12.893 -4.638 -4.633 1.00 0.00 H new ATOM 0 HB2 PRO A 42 12.049 -5.518 -7.447 1.00 0.00 H new ATOM 0 HB3 PRO A 42 13.668 -5.509 -6.776 1.00 0.00 H new ATOM 0 HG2 PRO A 42 12.350 -7.804 -7.008 1.00 0.00 H new ATOM 0 HG3 PRO A 42 13.342 -7.507 -5.594 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.350 -7.466 -5.842 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.337 -7.948 -4.477 1.00 0.00 H new ATOM 617 N VAL A 43 12.443 -2.598 -5.620 1.00 0.00 N ATOM 618 CA VAL A 43 12.234 -1.193 -5.952 1.00 0.00 C ATOM 619 C VAL A 43 12.023 -0.944 -7.452 1.00 0.00 C ATOM 620 O VAL A 43 12.674 -1.572 -8.293 1.00 0.00 O ATOM 621 CB VAL A 43 13.459 -0.377 -5.424 1.00 0.00 C ATOM 622 CG1 VAL A 43 14.789 -0.977 -5.883 1.00 0.00 C ATOM 623 CG2 VAL A 43 13.399 1.109 -5.800 1.00 0.00 C ATOM 0 H VAL A 43 13.356 -2.764 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 43 11.312 -0.867 -5.471 1.00 0.00 H new ATOM 0 HB VAL A 43 13.401 -0.444 -4.338 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.612 -0.378 -5.493 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.875 -1.998 -5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 43 14.829 -0.983 -6.972 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.277 1.620 -5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.379 1.209 -6.885 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.499 1.555 -5.378 1.00 0.00 H new ATOM 633 N GLY A 44 11.107 -0.021 -7.756 1.00 0.00 N ATOM 634 CA GLY A 44 10.850 0.342 -9.129 1.00 0.00 C ATOM 635 C GLY A 44 9.621 -0.314 -9.727 1.00 0.00 C ATOM 636 O GLY A 44 9.328 -0.113 -10.910 1.00 0.00 O ATOM 0 H GLY A 44 10.542 0.478 -7.069 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.737 1.424 -9.192 1.00 0.00 H new ATOM 0 HA3 GLY A 44 11.719 0.077 -9.732 1.00 0.00 H new ATOM 640 N THR A 45 8.902 -1.096 -8.915 1.00 0.00 N ATOM 641 CA THR A 45 7.696 -1.766 -9.355 1.00 0.00 C ATOM 642 C THR A 45 6.480 -0.852 -9.129 1.00 0.00 C ATOM 643 O THR A 45 6.284 -0.382 -8.005 1.00 0.00 O ATOM 644 CB THR A 45 7.495 -3.111 -8.616 1.00 0.00 C ATOM 645 OG1 THR A 45 8.762 -3.743 -8.386 1.00 0.00 O ATOM 646 CG2 THR A 45 6.608 -4.059 -9.418 1.00 0.00 C ATOM 0 H THR A 45 9.146 -1.275 -7.941 1.00 0.00 H new ATOM 0 HA THR A 45 7.797 -1.981 -10.419 1.00 0.00 H new ATOM 0 HB THR A 45 7.008 -2.894 -7.665 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.047 -3.578 -7.463 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.487 -4.994 -8.871 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.631 -3.600 -9.573 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.071 -4.261 -10.384 1.00 0.00 H new ATOM 654 N PRO A 46 5.639 -0.580 -10.182 1.00 0.00 N ATOM 655 CA PRO A 46 4.459 0.298 -10.041 1.00 0.00 C ATOM 656 C PRO A 46 3.498 -0.161 -8.943 1.00 0.00 C ATOM 657 O PRO A 46 3.063 -1.318 -8.922 1.00 0.00 O ATOM 658 CB PRO A 46 3.770 0.222 -11.411 1.00 0.00 C ATOM 659 CG PRO A 46 4.836 -0.202 -12.359 1.00 0.00 C ATOM 660 CD PRO A 46 5.765 -1.086 -11.575 1.00 0.00 C ATOM 0 HA PRO A 46 4.756 1.306 -9.753 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.947 -0.492 -11.399 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.351 1.187 -11.695 1.00 0.00 H new ATOM 0 HG2 PRO A 46 4.412 -0.738 -13.208 1.00 0.00 H new ATOM 0 HG3 PRO A 46 5.366 0.662 -12.760 1.00 0.00 H new ATOM 0 HD2 PRO A 46 5.477 -2.135 -11.648 1.00 0.00 H new ATOM 0 HD3 PRO A 46 6.790 -1.011 -11.937 1.00 0.00 H new ATOM 668 N VAL A 47 3.185 0.762 -8.035 1.00 0.00 N ATOM 669 CA VAL A 47 2.297 0.510 -6.931 1.00 0.00 C ATOM 670 C VAL A 47 0.929 1.019 -7.276 1.00 0.00 C ATOM 671 O VAL A 47 0.736 2.199 -7.585 1.00 0.00 O ATOM 672 CB VAL A 47 2.781 1.150 -5.598 1.00 0.00 C ATOM 673 CG1 VAL A 47 2.041 0.560 -4.398 1.00 0.00 C ATOM 674 CG2 VAL A 47 4.286 0.981 -5.407 1.00 0.00 C ATOM 0 H VAL A 47 3.552 1.713 -8.057 1.00 0.00 H new ATOM 0 HA VAL A 47 2.278 -0.568 -6.768 1.00 0.00 H new ATOM 0 HB VAL A 47 2.557 2.215 -5.661 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.402 1.028 -3.482 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.972 0.745 -4.503 1.00 0.00 H new ATOM 0 HG13 VAL A 47 2.221 -0.514 -4.352 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.587 1.440 -4.466 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.533 -0.080 -5.388 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.814 1.462 -6.231 1.00 0.00 H new ATOM 684 N ARG A 48 0.008 0.087 -7.234 1.00 0.00 N ATOM 685 CA ARG A 48 -1.367 0.355 -7.534 1.00 0.00 C ATOM 686 C ARG A 48 -2.196 0.467 -6.281 1.00 0.00 C ATOM 687 O ARG A 48 -1.905 -0.167 -5.262 1.00 0.00 O ATOM 688 CB ARG A 48 -1.954 -0.708 -8.476 1.00 0.00 C ATOM 689 CG ARG A 48 -1.403 -0.650 -9.897 1.00 0.00 C ATOM 690 CD ARG A 48 -1.126 -2.035 -10.467 1.00 0.00 C ATOM 691 NE ARG A 48 -2.354 -2.715 -10.895 1.00 0.00 N ATOM 692 CZ ARG A 48 -2.394 -3.758 -11.737 1.00 0.00 C ATOM 693 NH1 ARG A 48 -1.277 -4.266 -12.257 1.00 0.00 N ATOM 694 NH2 ARG A 48 -3.563 -4.292 -12.064 1.00 0.00 N ATOM 0 H ARG A 48 0.199 -0.884 -6.988 1.00 0.00 H new ATOM 0 HA ARG A 48 -1.400 1.317 -8.046 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -1.756 -1.696 -8.061 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.037 -0.589 -8.512 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.115 -0.131 -10.539 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -0.483 -0.066 -9.904 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -0.447 -1.948 -11.315 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -0.621 -2.641 -9.715 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.240 -2.370 -10.526 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -0.372 -3.861 -12.016 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -1.327 -5.060 -12.896 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -4.425 -3.909 -11.676 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -3.600 -5.085 -12.704 1.00 0.00 H new ATOM 708 N ALA A 49 -3.260 1.265 -6.390 1.00 0.00 N ATOM 709 CA ALA A 49 -4.157 1.517 -5.282 1.00 0.00 C ATOM 710 C ALA A 49 -4.991 0.283 -4.955 1.00 0.00 C ATOM 711 O ALA A 49 -5.677 -0.264 -5.817 1.00 0.00 O ATOM 712 CB ALA A 49 -5.052 2.709 -5.581 1.00 0.00 C ATOM 0 H ALA A 49 -3.516 1.749 -7.250 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.552 1.751 -4.406 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.720 2.884 -4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.437 3.594 -5.746 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.642 2.506 -6.475 1.00 0.00 H new ATOM 718 N VAL A 50 -4.878 -0.176 -3.714 1.00 0.00 N ATOM 719 CA VAL A 50 -5.618 -1.358 -3.245 1.00 0.00 C ATOM 720 C VAL A 50 -7.139 -1.097 -3.136 1.00 0.00 C ATOM 721 O VAL A 50 -7.929 -2.042 -3.036 1.00 0.00 O ATOM 722 CB VAL A 50 -5.056 -1.884 -1.901 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.673 -3.226 -1.503 1.00 0.00 C ATOM 724 CG2 VAL A 50 -3.538 -2.020 -1.957 1.00 0.00 C ATOM 0 H VAL A 50 -4.280 0.250 -3.006 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.475 -2.130 -4.001 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.325 -1.147 -1.144 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.248 -3.555 -0.554 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.752 -3.113 -1.398 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.459 -3.967 -2.273 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.170 -2.391 -1.000 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.264 -2.719 -2.747 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.093 -1.047 -2.164 1.00 0.00 H new ATOM 734 N ALA A 51 -7.536 0.184 -3.183 1.00 0.00 N ATOM 735 CA ALA A 51 -8.932 0.595 -3.115 1.00 0.00 C ATOM 736 C ALA A 51 -9.066 2.078 -3.400 1.00 0.00 C ATOM 737 O ALA A 51 -8.197 2.877 -3.044 1.00 0.00 O ATOM 738 CB ALA A 51 -9.546 0.272 -1.763 1.00 0.00 C ATOM 0 H ALA A 51 -6.885 0.965 -3.270 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.473 0.033 -3.876 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.588 0.593 -1.750 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.495 -0.803 -1.588 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.996 0.794 -0.980 1.00 0.00 H new ATOM 744 N ASN A 52 -10.161 2.421 -4.077 1.00 0.00 N ATOM 745 CA ASN A 52 -10.490 3.786 -4.442 1.00 0.00 C ATOM 746 C ASN A 52 -10.702 4.683 -3.217 1.00 0.00 C ATOM 747 O ASN A 52 -11.018 4.194 -2.129 1.00 0.00 O ATOM 748 CB ASN A 52 -11.745 3.795 -5.331 1.00 0.00 C ATOM 749 CG ASN A 52 -12.869 2.863 -4.887 1.00 0.00 C ATOM 750 OD1 ASN A 52 -13.553 2.260 -5.714 1.00 0.00 O ATOM 751 ND2 ASN A 52 -13.062 2.753 -3.590 1.00 0.00 N ATOM 0 H ASN A 52 -10.853 1.740 -4.390 1.00 0.00 H new ATOM 0 HA ASN A 52 -9.642 4.194 -4.993 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.134 4.812 -5.371 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -11.452 3.526 -6.346 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -13.803 2.149 -3.234 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -12.471 3.272 -2.941 1.00 0.00 H new ATOM 758 N GLY A 53 -10.531 5.990 -3.420 1.00 0.00 N ATOM 759 CA GLY A 53 -10.704 6.948 -2.340 1.00 0.00 C ATOM 760 C GLY A 53 -10.181 8.333 -2.666 1.00 0.00 C ATOM 761 O GLY A 53 -10.517 8.903 -3.708 1.00 0.00 O ATOM 0 H GLY A 53 -10.275 6.402 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.764 7.018 -2.094 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.194 6.576 -1.451 1.00 0.00 H new ATOM 765 N THR A 54 -9.340 8.860 -1.766 1.00 0.00 N ATOM 766 CA THR A 54 -8.770 10.177 -1.879 1.00 0.00 C ATOM 767 C THR A 54 -7.381 10.191 -1.249 1.00 0.00 C ATOM 768 O THR A 54 -7.173 9.595 -0.195 1.00 0.00 O ATOM 769 CB THR A 54 -9.661 11.205 -1.170 1.00 0.00 C ATOM 770 OG1 THR A 54 -11.032 11.022 -1.550 1.00 0.00 O ATOM 771 CG2 THR A 54 -9.244 12.646 -1.466 1.00 0.00 C ATOM 0 H THR A 54 -9.041 8.360 -0.929 1.00 0.00 H new ATOM 0 HA THR A 54 -8.697 10.438 -2.935 1.00 0.00 H new ATOM 0 HB THR A 54 -9.542 11.037 -0.100 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.590 11.683 -1.090 1.00 0.00 H new ATOM 0 HG21 THR A 54 -9.907 13.332 -0.940 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.219 12.804 -1.131 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.308 12.830 -2.538 1.00 0.00 H new ATOM 779 N VAL A 55 -6.462 10.908 -1.891 1.00 0.00 N ATOM 780 CA VAL A 55 -5.090 11.047 -1.441 1.00 0.00 C ATOM 781 C VAL A 55 -5.018 12.164 -0.395 1.00 0.00 C ATOM 782 O VAL A 55 -5.254 13.334 -0.693 1.00 0.00 O ATOM 783 CB VAL A 55 -4.126 11.382 -2.619 1.00 0.00 C ATOM 784 CG1 VAL A 55 -2.662 11.251 -2.213 1.00 0.00 C ATOM 785 CG2 VAL A 55 -4.400 10.517 -3.846 1.00 0.00 C ATOM 0 H VAL A 55 -6.659 11.416 -2.753 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.776 10.096 -1.011 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.320 12.422 -2.880 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.025 11.493 -3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.449 11.937 -1.393 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.464 10.229 -1.891 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.705 10.784 -4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.268 9.466 -3.587 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.422 10.681 -4.186 1.00 0.00 H new ATOM 795 N LYS A 56 -4.729 11.764 0.821 1.00 0.00 N ATOM 796 CA LYS A 56 -4.607 12.679 1.962 1.00 0.00 C ATOM 797 C LYS A 56 -3.154 13.079 2.183 1.00 0.00 C ATOM 798 O LYS A 56 -2.859 14.026 2.917 1.00 0.00 O ATOM 799 CB LYS A 56 -5.168 12.069 3.273 1.00 0.00 C ATOM 800 CG LYS A 56 -6.233 10.976 3.112 1.00 0.00 C ATOM 801 CD LYS A 56 -7.365 11.384 2.171 1.00 0.00 C ATOM 802 CE LYS A 56 -8.506 12.090 2.897 1.00 0.00 C ATOM 803 NZ LYS A 56 -9.676 12.307 2.003 1.00 0.00 N ATOM 0 H LYS A 56 -4.568 10.786 1.062 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.201 13.559 1.714 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.335 11.655 3.841 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.593 12.875 3.871 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.761 10.069 2.733 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.649 10.734 4.090 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.970 12.042 1.397 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.752 10.498 1.669 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.812 11.497 3.759 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -8.156 13.049 3.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -10.353 12.947 2.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -9.356 12.730 1.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.138 11.396 1.809 1.00 0.00 H new ATOM 817 N PHE A 57 -2.259 12.324 1.545 1.00 0.00 N ATOM 818 CA PHE A 57 -0.827 12.548 1.618 1.00 0.00 C ATOM 819 C PHE A 57 -0.145 11.960 0.392 1.00 0.00 C ATOM 820 O PHE A 57 -0.510 10.885 -0.092 1.00 0.00 O ATOM 821 CB PHE A 57 -0.218 11.937 2.892 1.00 0.00 C ATOM 822 CG PHE A 57 1.093 12.555 3.296 1.00 0.00 C ATOM 823 CD1 PHE A 57 1.133 13.603 4.200 1.00 0.00 C ATOM 824 CD2 PHE A 57 2.283 12.092 2.755 1.00 0.00 C ATOM 825 CE1 PHE A 57 2.338 14.179 4.558 1.00 0.00 C ATOM 826 CE2 PHE A 57 3.488 12.662 3.110 1.00 0.00 C ATOM 827 CZ PHE A 57 3.517 13.707 4.013 1.00 0.00 C ATOM 0 H PHE A 57 -2.518 11.532 0.957 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.663 13.625 1.650 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.928 12.047 3.711 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.072 10.868 2.737 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.214 13.974 4.630 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.266 11.276 2.048 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.358 14.997 5.263 1.00 0.00 H new ATOM 0 HE2 PHE A 57 4.408 12.292 2.682 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.459 14.154 4.293 1.00 0.00 H new ATOM 837 N ALA A 58 0.858 12.687 -0.078 1.00 0.00 N ATOM 838 CA ALA A 58 1.651 12.323 -1.232 1.00 0.00 C ATOM 839 C ALA A 58 3.084 12.799 -1.022 1.00 0.00 C ATOM 840 O ALA A 58 3.444 13.944 -1.328 1.00 0.00 O ATOM 841 CB ALA A 58 1.057 12.894 -2.522 1.00 0.00 C ATOM 0 H ALA A 58 1.146 13.568 0.347 1.00 0.00 H new ATOM 0 HA ALA A 58 1.647 11.238 -1.339 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.678 12.601 -3.369 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.048 12.506 -2.661 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.022 13.981 -2.456 1.00 0.00 H new ATOM 847 N GLY A 59 3.876 11.893 -0.468 1.00 0.00 N ATOM 848 CA GLY A 59 5.276 12.148 -0.182 1.00 0.00 C ATOM 849 C GLY A 59 6.193 11.733 -1.314 1.00 0.00 C ATOM 850 O GLY A 59 6.663 10.587 -1.350 1.00 0.00 O ATOM 0 H GLY A 59 3.563 10.959 -0.204 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.413 13.210 0.019 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.560 11.613 0.724 1.00 0.00 H new ATOM 854 N ASN A 60 6.438 12.684 -2.232 1.00 0.00 N ATOM 855 CA ASN A 60 7.292 12.486 -3.408 1.00 0.00 C ATOM 856 C ASN A 60 8.766 12.363 -3.054 1.00 0.00 C ATOM 857 O ASN A 60 9.362 13.245 -2.430 1.00 0.00 O ATOM 858 CB ASN A 60 7.087 13.630 -4.408 1.00 0.00 C ATOM 859 CG ASN A 60 5.737 13.575 -5.086 1.00 0.00 C ATOM 860 OD1 ASN A 60 5.621 13.813 -6.288 1.00 0.00 O ATOM 861 ND2 ASN A 60 4.706 13.276 -4.312 1.00 0.00 N ATOM 0 H ASN A 60 6.042 13.622 -2.174 1.00 0.00 H new ATOM 0 HA ASN A 60 6.993 11.540 -3.860 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.191 14.583 -3.890 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.871 13.591 -5.164 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.767 13.235 -4.707 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.851 13.086 -3.320 1.00 0.00 H new ATOM 868 N GLY A 61 9.313 11.237 -3.480 1.00 0.00 N ATOM 869 CA GLY A 61 10.715 10.895 -3.259 1.00 0.00 C ATOM 870 C GLY A 61 11.666 11.554 -4.246 1.00 0.00 C ATOM 871 O GLY A 61 12.881 11.348 -4.171 1.00 0.00 O ATOM 0 H GLY A 61 8.794 10.525 -3.994 1.00 0.00 H new ATOM 0 HA2 GLY A 61 10.996 11.186 -2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.831 9.813 -3.323 1.00 0.00 H new ATOM 875 N ALA A 62 11.109 12.335 -5.177 1.00 0.00 N ATOM 876 CA ALA A 62 11.893 13.019 -6.200 1.00 0.00 C ATOM 877 C ALA A 62 12.600 14.261 -5.672 1.00 0.00 C ATOM 878 O ALA A 62 13.704 14.593 -6.117 1.00 0.00 O ATOM 879 CB ALA A 62 11.004 13.387 -7.376 1.00 0.00 C ATOM 0 H ALA A 62 10.106 12.508 -5.239 1.00 0.00 H new ATOM 0 HA ALA A 62 12.669 12.325 -6.523 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.597 13.897 -8.135 1.00 0.00 H new ATOM 0 HB2 ALA A 62 10.571 12.482 -7.802 1.00 0.00 H new ATOM 0 HB3 ALA A 62 10.205 14.046 -7.036 1.00 0.00 H new ATOM 885 N ASN A 63 11.957 14.930 -4.720 1.00 0.00 N ATOM 886 CA ASN A 63 12.487 16.153 -4.132 1.00 0.00 C ATOM 887 C ASN A 63 12.280 16.181 -2.617 1.00 0.00 C ATOM 888 O ASN A 63 12.127 17.253 -2.013 1.00 0.00 O ATOM 889 CB ASN A 63 11.829 17.365 -4.768 1.00 0.00 C ATOM 890 CG ASN A 63 12.820 18.425 -5.174 1.00 0.00 C ATOM 891 OD1 ASN A 63 13.291 19.213 -4.354 1.00 0.00 O ATOM 892 ND2 ASN A 63 13.123 18.453 -6.458 1.00 0.00 N ATOM 0 H ASN A 63 11.057 14.640 -4.336 1.00 0.00 H new ATOM 0 HA ASN A 63 13.559 16.180 -4.325 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.265 17.047 -5.645 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.113 17.794 -4.066 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.776 19.151 -6.813 1.00 0.00 H new ATOM 0 HD22 ASN A 63 12.704 17.776 -7.096 1.00 0.00 H new ATOM 899 N HIS A 64 12.274 14.998 -2.004 1.00 0.00 N ATOM 900 CA HIS A 64 12.054 14.865 -0.590 1.00 0.00 C ATOM 901 C HIS A 64 13.305 15.168 0.271 1.00 0.00 C ATOM 902 O HIS A 64 14.285 14.416 0.229 1.00 0.00 O ATOM 903 CB HIS A 64 11.509 13.460 -0.277 1.00 0.00 C ATOM 904 CG HIS A 64 12.371 12.292 -0.713 1.00 0.00 C ATOM 905 ND1 HIS A 64 12.095 10.991 -0.347 1.00 0.00 N ATOM 906 CD2 HIS A 64 13.499 12.229 -1.472 1.00 0.00 C ATOM 907 CE1 HIS A 64 13.010 10.186 -0.857 1.00 0.00 C ATOM 908 NE2 HIS A 64 13.870 10.912 -1.543 1.00 0.00 N ATOM 0 H HIS A 64 12.423 14.112 -2.487 1.00 0.00 H new ATOM 0 HA HIS A 64 11.319 15.622 -0.318 1.00 0.00 H new ATOM 0 HB2 HIS A 64 11.352 13.386 0.799 1.00 0.00 H new ATOM 0 HB3 HIS A 64 10.532 13.359 -0.750 1.00 0.00 H new ATOM 0 HD2 HIS A 64 14.008 13.063 -1.933 1.00 0.00 H new ATOM 0 HE1 HIS A 64 13.047 9.114 -0.733 1.00 0.00 H new ATOM 0 HE2 HIS A 64 14.681 10.551 -2.046 1.00 0.00 H new ATOM 917 N PRO A 65 13.297 16.287 1.059 1.00 0.00 N ATOM 918 CA PRO A 65 14.390 16.653 1.964 1.00 0.00 C ATOM 919 C PRO A 65 14.493 15.697 3.122 1.00 0.00 C ATOM 920 O PRO A 65 13.606 14.897 3.349 1.00 0.00 O ATOM 921 CB PRO A 65 13.987 18.043 2.491 1.00 0.00 C ATOM 922 CG PRO A 65 12.997 18.534 1.524 1.00 0.00 C ATOM 923 CD PRO A 65 12.246 17.314 1.131 1.00 0.00 C ATOM 0 HA PRO A 65 15.355 16.635 1.457 1.00 0.00 H new ATOM 0 HB2 PRO A 65 13.564 17.979 3.494 1.00 0.00 H new ATOM 0 HB3 PRO A 65 14.848 18.709 2.550 1.00 0.00 H new ATOM 0 HG2 PRO A 65 12.340 19.281 1.969 1.00 0.00 H new ATOM 0 HG3 PRO A 65 13.476 19.002 0.664 1.00 0.00 H new ATOM 0 HD2 PRO A 65 11.481 17.058 1.864 1.00 0.00 H new ATOM 0 HD3 PRO A 65 11.741 17.442 0.174 1.00 0.00 H new ATOM 931 N TRP A 66 15.619 15.714 3.781 1.00 0.00 N ATOM 932 CA TRP A 66 15.801 14.903 4.963 1.00 0.00 C ATOM 933 C TRP A 66 15.526 15.772 6.184 1.00 0.00 C ATOM 934 O TRP A 66 15.761 15.369 7.331 1.00 0.00 O ATOM 935 CB TRP A 66 17.197 14.316 5.060 1.00 0.00 C ATOM 936 CG TRP A 66 17.563 13.385 3.935 1.00 0.00 C ATOM 937 CD1 TRP A 66 17.859 13.733 2.647 1.00 0.00 C ATOM 938 CD2 TRP A 66 17.670 11.953 3.998 1.00 0.00 C ATOM 939 NE1 TRP A 66 18.135 12.610 1.906 1.00 0.00 N ATOM 940 CE2 TRP A 66 18.029 11.507 2.711 1.00 0.00 C ATOM 941 CE3 TRP A 66 17.498 11.005 5.014 1.00 0.00 C ATOM 942 CZ2 TRP A 66 18.217 10.159 2.415 1.00 0.00 C ATOM 943 CZ3 TRP A 66 17.685 9.668 4.718 1.00 0.00 C ATOM 944 CH2 TRP A 66 18.042 9.257 3.428 1.00 0.00 C ATOM 0 H TRP A 66 16.428 16.280 3.523 1.00 0.00 H new ATOM 0 HA TRP A 66 15.109 14.063 4.910 1.00 0.00 H new ATOM 0 HB2 TRP A 66 17.919 15.132 5.089 1.00 0.00 H new ATOM 0 HB3 TRP A 66 17.286 13.778 6.004 1.00 0.00 H new ATOM 0 HD1 TRP A 66 17.874 14.744 2.267 1.00 0.00 H new ATOM 0 HE1 TRP A 66 18.380 12.599 0.916 1.00 0.00 H new ATOM 0 HE3 TRP A 66 17.224 11.313 6.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 18.491 9.838 1.421 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 17.554 8.928 5.494 1.00 0.00 H new ATOM 0 HH2 TRP A 66 18.182 8.205 3.229 1.00 0.00 H new ATOM 955 N MET A 67 14.993 16.977 5.907 1.00 0.00 N ATOM 956 CA MET A 67 14.673 17.940 6.941 1.00 0.00 C ATOM 957 C MET A 67 13.394 17.548 7.647 1.00 0.00 C ATOM 958 O MET A 67 13.313 17.603 8.878 1.00 0.00 O ATOM 959 CB MET A 67 14.565 19.353 6.361 1.00 0.00 C ATOM 960 CG MET A 67 15.913 20.007 6.087 1.00 0.00 C ATOM 961 SD MET A 67 15.764 21.653 5.359 1.00 0.00 S ATOM 962 CE MET A 67 15.486 21.253 3.634 1.00 0.00 C ATOM 0 H MET A 67 14.779 17.295 4.962 1.00 0.00 H new ATOM 0 HA MET A 67 15.483 17.941 7.670 1.00 0.00 H new ATOM 0 HB2 MET A 67 13.995 19.313 5.433 1.00 0.00 H new ATOM 0 HB3 MET A 67 14.002 19.978 7.054 1.00 0.00 H new ATOM 0 HG2 MET A 67 16.473 20.078 7.020 1.00 0.00 H new ATOM 0 HG3 MET A 67 16.490 19.370 5.417 1.00 0.00 H new ATOM 0 HE1 MET A 67 15.552 22.161 3.035 1.00 0.00 H new ATOM 0 HE2 MET A 67 16.241 20.542 3.299 1.00 0.00 H new ATOM 0 HE3 MET A 67 14.496 20.813 3.518 1.00 0.00 H new ATOM 972 N LEU A 68 12.405 17.141 6.859 1.00 0.00 N ATOM 973 CA LEU A 68 11.155 16.688 7.418 1.00 0.00 C ATOM 974 C LEU A 68 10.885 15.244 6.986 1.00 0.00 C ATOM 975 O LEU A 68 9.777 14.734 7.183 1.00 0.00 O ATOM 976 CB LEU A 68 9.991 17.655 7.071 1.00 0.00 C ATOM 977 CG LEU A 68 9.576 17.781 5.602 1.00 0.00 C ATOM 978 CD1 LEU A 68 8.432 16.816 5.282 1.00 0.00 C ATOM 979 CD2 LEU A 68 9.165 19.212 5.290 1.00 0.00 C ATOM 0 H LEU A 68 12.452 17.119 5.840 1.00 0.00 H new ATOM 0 HA LEU A 68 11.227 16.695 8.506 1.00 0.00 H new ATOM 0 HB2 LEU A 68 9.116 17.342 7.640 1.00 0.00 H new ATOM 0 HB3 LEU A 68 10.264 18.648 7.427 1.00 0.00 H new ATOM 0 HG LEU A 68 10.431 17.520 4.978 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.151 16.920 4.234 1.00 0.00 H new ATOM 0 HD12 LEU A 68 8.756 15.792 5.471 1.00 0.00 H new ATOM 0 HD13 LEU A 68 7.574 17.047 5.913 1.00 0.00 H new ATOM 0 HD21 LEU A 68 8.873 19.286 4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 68 8.324 19.495 5.923 1.00 0.00 H new ATOM 0 HD23 LEU A 68 10.004 19.881 5.481 1.00 0.00 H new ATOM 991 N TRP A 69 11.912 14.577 6.392 1.00 0.00 N ATOM 992 CA TRP A 69 11.732 13.200 5.934 1.00 0.00 C ATOM 993 C TRP A 69 12.836 12.284 6.451 1.00 0.00 C ATOM 994 O TRP A 69 13.949 12.734 6.741 1.00 0.00 O ATOM 995 CB TRP A 69 11.652 13.117 4.391 1.00 0.00 C ATOM 996 CG TRP A 69 10.901 14.255 3.727 1.00 0.00 C ATOM 997 CD1 TRP A 69 11.197 15.585 3.822 1.00 0.00 C ATOM 998 CD2 TRP A 69 9.767 14.170 2.855 1.00 0.00 C ATOM 999 NE1 TRP A 69 10.306 16.325 3.111 1.00 0.00 N ATOM 1000 CE2 TRP A 69 9.423 15.487 2.494 1.00 0.00 C ATOM 1001 CE3 TRP A 69 8.999 13.121 2.351 1.00 0.00 C ATOM 1002 CZ2 TRP A 69 8.356 15.783 1.660 1.00 0.00 C ATOM 1003 CZ3 TRP A 69 7.941 13.418 1.519 1.00 0.00 C ATOM 1004 CH2 TRP A 69 7.628 14.741 1.180 1.00 0.00 C ATOM 0 H TRP A 69 12.840 14.968 6.229 1.00 0.00 H new ATOM 0 HA TRP A 69 10.783 12.857 6.346 1.00 0.00 H new ATOM 0 HB2 TRP A 69 12.665 13.088 3.991 1.00 0.00 H new ATOM 0 HB3 TRP A 69 11.174 12.177 4.117 1.00 0.00 H new ATOM 0 HD1 TRP A 69 12.024 15.992 4.384 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.298 17.343 3.049 1.00 0.00 H new ATOM 0 HE3 TRP A 69 9.228 12.097 2.607 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 8.113 16.803 1.402 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 7.341 12.614 1.120 1.00 0.00 H new ATOM 0 HH2 TRP A 69 6.792 14.936 0.525 1.00 0.00 H new ATOM 1015 N MET A 70 12.483 11.002 6.617 1.00 0.00 N ATOM 1016 CA MET A 70 13.414 9.970 7.088 1.00 0.00 C ATOM 1017 C MET A 70 13.108 8.626 6.426 1.00 0.00 C ATOM 1018 O MET A 70 14.027 7.878 6.082 1.00 0.00 O ATOM 1019 CB MET A 70 13.355 9.825 8.613 1.00 0.00 C ATOM 1020 CG MET A 70 14.243 10.816 9.348 1.00 0.00 C ATOM 1021 SD MET A 70 14.216 10.583 11.136 1.00 0.00 S ATOM 1022 CE MET A 70 15.524 11.698 11.640 1.00 0.00 C ATOM 0 H MET A 70 11.544 10.652 6.428 1.00 0.00 H new ATOM 0 HA MET A 70 14.421 10.282 6.810 1.00 0.00 H new ATOM 0 HB2 MET A 70 12.325 9.957 8.944 1.00 0.00 H new ATOM 0 HB3 MET A 70 13.650 8.812 8.886 1.00 0.00 H new ATOM 0 HG2 MET A 70 15.267 10.716 8.988 1.00 0.00 H new ATOM 0 HG3 MET A 70 13.920 11.830 9.113 1.00 0.00 H new ATOM 0 HE1 MET A 70 15.631 11.667 12.724 1.00 0.00 H new ATOM 0 HE2 MET A 70 16.461 11.393 11.174 1.00 0.00 H new ATOM 0 HE3 MET A 70 15.277 12.713 11.328 1.00 0.00 H new ATOM 1032 N ALA A 71 11.810 8.347 6.221 1.00 0.00 N ATOM 1033 CA ALA A 71 11.361 7.094 5.600 1.00 0.00 C ATOM 1034 C ALA A 71 11.342 7.189 4.076 1.00 0.00 C ATOM 1035 O ALA A 71 11.431 6.172 3.381 1.00 0.00 O ATOM 1036 CB ALA A 71 9.985 6.710 6.123 1.00 0.00 C ATOM 0 H ALA A 71 11.051 8.978 6.479 1.00 0.00 H new ATOM 0 HA ALA A 71 12.077 6.318 5.871 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.664 5.780 5.654 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.031 6.575 7.204 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.272 7.500 5.886 1.00 0.00 H new ATOM 1042 N GLY A 72 11.240 8.420 3.575 1.00 0.00 N ATOM 1043 CA GLY A 72 11.230 8.661 2.141 1.00 0.00 C ATOM 1044 C GLY A 72 9.846 8.889 1.562 1.00 0.00 C ATOM 1045 O GLY A 72 9.157 9.841 1.938 1.00 0.00 O ATOM 0 H GLY A 72 11.163 9.263 4.145 1.00 0.00 H new ATOM 0 HA2 GLY A 72 11.851 9.531 1.925 1.00 0.00 H new ATOM 0 HA3 GLY A 72 11.688 7.810 1.637 1.00 0.00 H new ATOM 1049 N ASN A 73 9.452 7.999 0.639 1.00 0.00 N ATOM 1050 CA ASN A 73 8.167 8.076 -0.049 1.00 0.00 C ATOM 1051 C ASN A 73 7.031 7.478 0.770 1.00 0.00 C ATOM 1052 O ASN A 73 7.161 6.383 1.329 1.00 0.00 O ATOM 1053 CB ASN A 73 8.239 7.349 -1.389 1.00 0.00 C ATOM 1054 CG ASN A 73 9.152 8.019 -2.396 1.00 0.00 C ATOM 1055 OD1 ASN A 73 8.688 8.658 -3.337 1.00 0.00 O ATOM 1056 ND2 ASN A 73 10.457 7.867 -2.203 1.00 0.00 N ATOM 0 H ASN A 73 10.023 7.204 0.352 1.00 0.00 H new ATOM 0 HA ASN A 73 7.958 9.135 -0.200 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.584 6.329 -1.221 1.00 0.00 H new ATOM 0 HB3 ASN A 73 7.236 7.281 -1.810 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.121 8.290 -2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.795 7.327 -1.406 1.00 0.00 H new ATOM 1063 N ALA A 74 5.902 8.194 0.800 1.00 0.00 N ATOM 1064 CA ALA A 74 4.720 7.759 1.533 1.00 0.00 C ATOM 1065 C ALA A 74 3.452 8.288 0.884 1.00 0.00 C ATOM 1066 O ALA A 74 3.442 9.389 0.339 1.00 0.00 O ATOM 1067 CB ALA A 74 4.787 8.183 2.999 1.00 0.00 C ATOM 0 H ALA A 74 5.787 9.086 0.318 1.00 0.00 H new ATOM 0 HA ALA A 74 4.696 6.670 1.498 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.890 7.843 3.517 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.666 7.740 3.466 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.852 9.269 3.061 1.00 0.00 H new ATOM 1073 N VAL A 75 2.378 7.496 0.960 1.00 0.00 N ATOM 1074 CA VAL A 75 1.094 7.871 0.371 1.00 0.00 C ATOM 1075 C VAL A 75 -0.041 7.489 1.302 1.00 0.00 C ATOM 1076 O VAL A 75 -0.221 6.317 1.627 1.00 0.00 O ATOM 1077 CB VAL A 75 0.812 7.202 -1.012 1.00 0.00 C ATOM 1078 CG1 VAL A 75 -0.073 8.102 -1.868 1.00 0.00 C ATOM 1079 CG2 VAL A 75 2.087 6.861 -1.769 1.00 0.00 C ATOM 0 H VAL A 75 2.375 6.589 1.426 1.00 0.00 H new ATOM 0 HA VAL A 75 1.152 8.949 0.220 1.00 0.00 H new ATOM 0 HB VAL A 75 0.295 6.265 -0.807 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.260 7.621 -2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.021 8.273 -1.357 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.428 9.056 -2.031 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.831 6.399 -2.722 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.658 7.772 -1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.686 6.168 -1.179 1.00 0.00 H new ATOM 1089 N LEU A 76 -0.814 8.482 1.701 1.00 0.00 N ATOM 1090 CA LEU A 76 -1.949 8.259 2.557 1.00 0.00 C ATOM 1091 C LEU A 76 -3.179 8.613 1.793 1.00 0.00 C ATOM 1092 O LEU A 76 -3.277 9.669 1.171 1.00 0.00 O ATOM 1093 CB LEU A 76 -1.859 9.055 3.847 1.00 0.00 C ATOM 1094 CG LEU A 76 -2.207 8.294 5.131 1.00 0.00 C ATOM 1095 CD1 LEU A 76 -1.082 8.426 6.146 1.00 0.00 C ATOM 1096 CD2 LEU A 76 -3.513 8.806 5.722 1.00 0.00 C ATOM 0 H LEU A 76 -0.669 9.457 1.439 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.975 7.210 2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -0.845 9.443 3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.523 9.916 3.767 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.332 7.240 4.881 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.344 7.880 7.052 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.164 8.014 5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.931 9.478 6.387 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.742 8.253 6.633 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.415 9.866 5.956 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.318 8.666 5.001 1.00 0.00 H new ATOM 1108 N ILE A 77 -4.090 7.687 1.856 1.00 0.00 N ATOM 1109 CA ILE A 77 -5.344 7.739 1.155 1.00 0.00 C ATOM 1110 C ILE A 77 -6.465 7.190 2.037 1.00 0.00 C ATOM 1111 O ILE A 77 -6.244 6.359 2.920 1.00 0.00 O ATOM 1112 CB ILE A 77 -5.242 6.931 -0.182 1.00 0.00 C ATOM 1113 CG1 ILE A 77 -4.346 7.660 -1.191 1.00 0.00 C ATOM 1114 CG2 ILE A 77 -6.609 6.637 -0.818 1.00 0.00 C ATOM 1115 CD1 ILE A 77 -3.502 6.735 -2.051 1.00 0.00 C ATOM 0 H ILE A 77 -3.978 6.843 2.417 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.576 8.777 0.915 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.797 5.971 0.079 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.972 8.272 -1.840 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.686 8.339 -0.651 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.467 6.075 -1.741 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -7.214 6.052 -0.126 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.117 7.576 -1.039 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.897 7.328 -2.738 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.849 6.140 -1.413 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.154 6.073 -2.621 1.00 0.00 H new ATOM 1127 N GLN A 78 -7.648 7.710 1.789 1.00 0.00 N ATOM 1128 CA GLN A 78 -8.854 7.317 2.465 1.00 0.00 C ATOM 1129 C GLN A 78 -9.619 6.351 1.569 1.00 0.00 C ATOM 1130 O GLN A 78 -10.051 6.702 0.470 1.00 0.00 O ATOM 1131 CB GLN A 78 -9.710 8.538 2.802 1.00 0.00 C ATOM 1132 CG GLN A 78 -11.036 8.196 3.473 1.00 0.00 C ATOM 1133 CD GLN A 78 -12.180 8.973 2.894 1.00 0.00 C ATOM 1134 OE1 GLN A 78 -12.552 10.043 3.376 1.00 0.00 O ATOM 1135 NE2 GLN A 78 -12.730 8.420 1.836 1.00 0.00 N ATOM 0 H GLN A 78 -7.796 8.438 1.090 1.00 0.00 H new ATOM 0 HA GLN A 78 -8.604 6.826 3.405 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.142 9.198 3.457 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.910 9.093 1.886 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -11.232 7.129 3.365 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -10.964 8.400 4.541 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -12.376 7.531 1.484 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -13.510 8.880 1.367 1.00 0.00 H new ATOM 1144 N HIS A 79 -9.769 5.143 2.070 1.00 0.00 N ATOM 1145 CA HIS A 79 -10.454 4.062 1.363 1.00 0.00 C ATOM 1146 C HIS A 79 -11.952 4.258 1.236 1.00 0.00 C ATOM 1147 O HIS A 79 -12.511 5.272 1.665 1.00 0.00 O ATOM 1148 CB HIS A 79 -10.174 2.718 2.030 1.00 0.00 C ATOM 1149 CG HIS A 79 -8.892 2.082 1.592 1.00 0.00 C ATOM 1150 ND1 HIS A 79 -8.336 2.300 0.350 1.00 0.00 N ATOM 1151 CD2 HIS A 79 -8.056 1.235 2.234 1.00 0.00 C ATOM 1152 CE1 HIS A 79 -7.210 1.616 0.246 1.00 0.00 C ATOM 1153 NE2 HIS A 79 -7.019 0.961 1.375 1.00 0.00 N ATOM 0 H HIS A 79 -9.418 4.873 2.989 1.00 0.00 H new ATOM 0 HA HIS A 79 -10.048 4.076 0.352 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -10.149 2.857 3.111 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -10.998 2.038 1.815 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -8.732 2.897 -0.376 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -8.180 0.847 3.234 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -6.558 1.597 -0.615 1.00 0.00 H new ATOM 1162 N ALA A 80 -12.578 3.247 0.628 1.00 0.00 N ATOM 1163 CA ALA A 80 -14.004 3.232 0.370 1.00 0.00 C ATOM 1164 C ALA A 80 -14.862 3.190 1.642 1.00 0.00 C ATOM 1165 O ALA A 80 -16.056 3.504 1.599 1.00 0.00 O ATOM 1166 CB ALA A 80 -14.364 2.075 -0.548 1.00 0.00 C ATOM 0 H ALA A 80 -12.095 2.410 0.301 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.233 4.178 -0.120 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.438 2.077 -0.732 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.833 2.182 -1.494 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -14.079 1.134 -0.077 1.00 0.00 H new ATOM 1172 N ASP A 81 -14.241 2.814 2.763 1.00 0.00 N ATOM 1173 CA ASP A 81 -14.925 2.720 4.042 1.00 0.00 C ATOM 1174 C ASP A 81 -14.695 3.976 4.870 1.00 0.00 C ATOM 1175 O ASP A 81 -15.377 4.210 5.875 1.00 0.00 O ATOM 1176 CB ASP A 81 -14.462 1.494 4.808 1.00 0.00 C ATOM 1177 CG ASP A 81 -15.592 0.524 5.086 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -16.135 0.552 6.210 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -15.936 -0.262 4.179 1.00 0.00 O ATOM 0 H ASP A 81 -13.252 2.568 2.803 1.00 0.00 H new ATOM 0 HA ASP A 81 -15.993 2.625 3.848 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.683 0.986 4.239 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.015 1.806 5.752 1.00 0.00 H new ATOM 1184 N GLY A 82 -13.725 4.775 4.425 1.00 0.00 N ATOM 1185 CA GLY A 82 -13.390 6.016 5.086 1.00 0.00 C ATOM 1186 C GLY A 82 -12.116 5.901 5.879 1.00 0.00 C ATOM 1187 O GLY A 82 -11.616 6.899 6.406 1.00 0.00 O ATOM 0 H GLY A 82 -13.158 4.574 3.601 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.286 6.807 4.343 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.205 6.307 5.748 1.00 0.00 H new ATOM 1191 N MET A 83 -11.580 4.674 5.950 1.00 0.00 N ATOM 1192 CA MET A 83 -10.363 4.396 6.656 1.00 0.00 C ATOM 1193 C MET A 83 -9.154 4.984 5.935 1.00 0.00 C ATOM 1194 O MET A 83 -9.249 5.362 4.764 1.00 0.00 O ATOM 1195 CB MET A 83 -10.209 2.888 6.866 1.00 0.00 C ATOM 1196 CG MET A 83 -10.419 2.004 5.641 1.00 0.00 C ATOM 1197 SD MET A 83 -10.264 0.243 6.014 1.00 0.00 S ATOM 1198 CE MET A 83 -11.844 -0.114 6.785 1.00 0.00 C ATOM 0 H MET A 83 -11.997 3.854 5.509 1.00 0.00 H new ATOM 0 HA MET A 83 -10.416 4.876 7.633 1.00 0.00 H new ATOM 0 HB2 MET A 83 -9.209 2.698 7.256 1.00 0.00 H new ATOM 0 HB3 MET A 83 -10.915 2.577 7.636 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.408 2.197 5.225 1.00 0.00 H new ATOM 0 HG3 MET A 83 -9.692 2.274 4.875 1.00 0.00 H new ATOM 0 HE1 MET A 83 -11.680 -0.656 7.716 1.00 0.00 H new ATOM 0 HE2 MET A 83 -12.365 0.820 6.996 1.00 0.00 H new ATOM 0 HE3 MET A 83 -12.448 -0.723 6.112 1.00 0.00 H new ATOM 1208 N HIS A 84 -8.025 5.050 6.633 1.00 0.00 N ATOM 1209 CA HIS A 84 -6.833 5.603 6.054 1.00 0.00 C ATOM 1210 C HIS A 84 -5.813 4.516 5.787 1.00 0.00 C ATOM 1211 O HIS A 84 -5.648 3.604 6.600 1.00 0.00 O ATOM 1212 CB HIS A 84 -6.228 6.679 6.955 1.00 0.00 C ATOM 1213 CG HIS A 84 -7.025 7.946 7.022 1.00 0.00 C ATOM 1214 ND1 HIS A 84 -6.699 9.080 6.309 1.00 0.00 N ATOM 1215 CD2 HIS A 84 -8.127 8.260 7.742 1.00 0.00 C ATOM 1216 CE1 HIS A 84 -7.566 10.039 6.588 1.00 0.00 C ATOM 1217 NE2 HIS A 84 -8.442 9.565 7.453 1.00 0.00 N ATOM 0 H HIS A 84 -7.923 4.726 7.595 1.00 0.00 H new ATOM 0 HA HIS A 84 -7.111 6.066 5.107 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -6.123 6.276 7.962 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -5.225 6.913 6.599 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -8.659 7.607 8.417 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.558 11.038 6.178 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -9.228 10.085 7.844 1.00 0.00 H new ATOM 1226 N THR A 85 -5.127 4.613 4.646 1.00 0.00 N ATOM 1227 CA THR A 85 -4.138 3.653 4.272 1.00 0.00 C ATOM 1228 C THR A 85 -2.906 4.347 3.737 1.00 0.00 C ATOM 1229 O THR A 85 -2.991 5.198 2.847 1.00 0.00 O ATOM 1230 CB THR A 85 -4.678 2.693 3.211 1.00 0.00 C ATOM 1231 OG1 THR A 85 -5.820 3.255 2.548 1.00 0.00 O ATOM 1232 CG2 THR A 85 -5.046 1.365 3.843 1.00 0.00 C ATOM 0 H THR A 85 -5.256 5.366 3.970 1.00 0.00 H new ATOM 0 HA THR A 85 -3.876 3.082 5.163 1.00 0.00 H new ATOM 0 HB THR A 85 -3.895 2.529 2.470 1.00 0.00 H new ATOM 0 HG1 THR A 85 -5.582 3.486 1.626 1.00 0.00 H new ATOM 0 HG21 THR A 85 -5.429 0.691 3.077 1.00 0.00 H new ATOM 0 HG22 THR A 85 -4.162 0.925 4.305 1.00 0.00 H new ATOM 0 HG23 THR A 85 -5.812 1.523 4.603 1.00 0.00 H new ATOM 1240 N GLY A 86 -1.773 3.992 4.317 1.00 0.00 N ATOM 1241 CA GLY A 86 -0.509 4.546 3.893 1.00 0.00 C ATOM 1242 C GLY A 86 0.281 3.560 3.061 1.00 0.00 C ATOM 1243 O GLY A 86 0.092 2.342 3.182 1.00 0.00 O ATOM 0 H GLY A 86 -1.707 3.322 5.083 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -0.685 5.453 3.314 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.074 4.834 4.768 1.00 0.00 H new ATOM 1247 N TYR A 87 1.166 4.100 2.222 1.00 0.00 N ATOM 1248 CA TYR A 87 2.020 3.337 1.350 1.00 0.00 C ATOM 1249 C TYR A 87 3.417 3.923 1.542 1.00 0.00 C ATOM 1250 O TYR A 87 3.733 4.994 1.008 1.00 0.00 O ATOM 1251 CB TYR A 87 1.544 3.450 -0.125 1.00 0.00 C ATOM 1252 CG TYR A 87 0.100 3.007 -0.390 1.00 0.00 C ATOM 1253 CD1 TYR A 87 -0.993 3.722 0.115 1.00 0.00 C ATOM 1254 CD2 TYR A 87 -0.172 1.871 -1.154 1.00 0.00 C ATOM 1255 CE1 TYR A 87 -2.291 3.316 -0.131 1.00 0.00 C ATOM 1256 CE2 TYR A 87 -1.477 1.466 -1.404 1.00 0.00 C ATOM 1257 CZ TYR A 87 -2.526 2.192 -0.888 1.00 0.00 C ATOM 1258 OH TYR A 87 -3.819 1.789 -1.131 1.00 0.00 O ATOM 0 H TYR A 87 1.302 5.107 2.138 1.00 0.00 H new ATOM 0 HA TYR A 87 2.004 2.273 1.585 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.652 4.487 -0.445 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.209 2.853 -0.749 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -0.818 4.608 0.708 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.648 1.296 -1.558 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -3.120 3.881 0.271 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -1.667 0.586 -2.000 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.090 2.080 -2.027 1.00 0.00 H new ATOM 1268 N ALA A 88 4.231 3.258 2.359 1.00 0.00 N ATOM 1269 CA ALA A 88 5.566 3.765 2.659 1.00 0.00 C ATOM 1270 C ALA A 88 6.672 2.887 2.095 1.00 0.00 C ATOM 1271 O ALA A 88 6.437 1.747 1.682 1.00 0.00 O ATOM 1272 CB ALA A 88 5.728 3.973 4.163 1.00 0.00 C ATOM 0 H ALA A 88 3.993 2.379 2.819 1.00 0.00 H new ATOM 0 HA ALA A 88 5.666 4.729 2.160 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.729 4.351 4.372 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.987 4.692 4.513 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.584 3.024 4.679 1.00 0.00 H new ATOM 1278 N HIS A 89 7.902 3.445 2.116 1.00 0.00 N ATOM 1279 CA HIS A 89 9.122 2.794 1.598 1.00 0.00 C ATOM 1280 C HIS A 89 9.054 2.595 0.071 1.00 0.00 C ATOM 1281 O HIS A 89 9.427 1.546 -0.457 1.00 0.00 O ATOM 1282 CB HIS A 89 9.410 1.466 2.330 1.00 0.00 C ATOM 1283 CG HIS A 89 9.806 1.645 3.765 1.00 0.00 C ATOM 1284 ND1 HIS A 89 10.988 2.243 4.153 1.00 0.00 N ATOM 1285 CD2 HIS A 89 9.173 1.299 4.911 1.00 0.00 C ATOM 1286 CE1 HIS A 89 11.061 2.253 5.473 1.00 0.00 C ATOM 1287 NE2 HIS A 89 9.973 1.687 5.953 1.00 0.00 N ATOM 0 H HIS A 89 8.076 4.374 2.499 1.00 0.00 H new ATOM 0 HA HIS A 89 9.957 3.464 1.800 1.00 0.00 H new ATOM 0 HB2 HIS A 89 8.523 0.835 2.283 1.00 0.00 H new ATOM 0 HB3 HIS A 89 10.206 0.937 1.806 1.00 0.00 H new ATOM 0 HD2 HIS A 89 8.214 0.808 4.989 1.00 0.00 H new ATOM 0 HE1 HIS A 89 11.874 2.657 6.058 1.00 0.00 H new ATOM 0 HE2 HIS A 89 9.760 1.558 6.942 1.00 0.00 H new ATOM 1296 N LEU A 90 8.546 3.622 -0.615 1.00 0.00 N ATOM 1297 CA LEU A 90 8.442 3.646 -2.068 1.00 0.00 C ATOM 1298 C LEU A 90 9.574 4.495 -2.656 1.00 0.00 C ATOM 1299 O LEU A 90 10.301 5.159 -1.910 1.00 0.00 O ATOM 1300 CB LEU A 90 7.060 4.181 -2.496 1.00 0.00 C ATOM 1301 CG LEU A 90 5.850 3.645 -1.706 1.00 0.00 C ATOM 1302 CD1 LEU A 90 4.621 4.491 -1.988 1.00 0.00 C ATOM 1303 CD2 LEU A 90 5.582 2.188 -2.044 1.00 0.00 C ATOM 0 H LEU A 90 8.193 4.468 -0.168 1.00 0.00 H new ATOM 0 HA LEU A 90 8.540 2.631 -2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.071 5.268 -2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.913 3.946 -3.550 1.00 0.00 H new ATOM 0 HG LEU A 90 6.082 3.707 -0.643 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.774 4.101 -1.424 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.813 5.522 -1.690 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.393 4.458 -3.053 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.723 1.834 -1.473 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.373 2.094 -3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.457 1.589 -1.792 1.00 0.00 H new ATOM 1315 N SER A 91 9.736 4.455 -3.982 1.00 0.00 N ATOM 1316 CA SER A 91 10.775 5.212 -4.651 1.00 0.00 C ATOM 1317 C SER A 91 10.202 6.422 -5.372 1.00 0.00 C ATOM 1318 O SER A 91 10.949 7.335 -5.739 1.00 0.00 O ATOM 1319 CB SER A 91 11.544 4.331 -5.643 1.00 0.00 C ATOM 1320 OG SER A 91 12.713 4.984 -6.113 1.00 0.00 O ATOM 0 H SER A 91 9.152 3.900 -4.608 1.00 0.00 H new ATOM 0 HA SER A 91 11.465 5.563 -3.883 1.00 0.00 H new ATOM 0 HB2 SER A 91 11.818 3.392 -5.162 1.00 0.00 H new ATOM 0 HB3 SER A 91 10.900 4.082 -6.486 1.00 0.00 H new ATOM 0 HG SER A 91 12.558 5.951 -6.141 1.00 0.00 H new ATOM 1326 N LYS A 92 8.872 6.435 -5.567 1.00 0.00 N ATOM 1327 CA LYS A 92 8.211 7.516 -6.270 1.00 0.00 C ATOM 1328 C LYS A 92 6.702 7.442 -6.129 1.00 0.00 C ATOM 1329 O LYS A 92 6.132 6.396 -5.804 1.00 0.00 O ATOM 1330 CB LYS A 92 8.576 7.506 -7.755 1.00 0.00 C ATOM 1331 CG LYS A 92 9.111 8.827 -8.242 1.00 0.00 C ATOM 1332 CD LYS A 92 9.698 8.685 -9.633 1.00 0.00 C ATOM 1333 CE LYS A 92 10.078 10.032 -10.227 1.00 0.00 C ATOM 1334 NZ LYS A 92 10.791 9.884 -11.526 1.00 0.00 N ATOM 0 H LYS A 92 8.244 5.701 -5.241 1.00 0.00 H new ATOM 0 HA LYS A 92 8.558 8.444 -5.815 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.321 6.731 -7.934 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.694 7.241 -8.338 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.311 9.568 -8.253 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.874 9.192 -7.555 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.579 8.045 -9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.976 8.192 -10.284 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.179 10.631 -10.372 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.712 10.573 -9.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.033 10.824 -11.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.662 9.334 -11.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.177 9.390 -12.205 1.00 0.00 H new ATOM 1348 N ILE A 93 6.089 8.585 -6.385 1.00 0.00 N ATOM 1349 CA ILE A 93 4.654 8.756 -6.330 1.00 0.00 C ATOM 1350 C ILE A 93 4.115 9.273 -7.660 1.00 0.00 C ATOM 1351 O ILE A 93 4.799 9.991 -8.397 1.00 0.00 O ATOM 1352 CB ILE A 93 4.263 9.717 -5.165 1.00 0.00 C ATOM 1353 CG1 ILE A 93 3.830 8.940 -3.926 1.00 0.00 C ATOM 1354 CG2 ILE A 93 3.195 10.727 -5.537 1.00 0.00 C ATOM 1355 CD1 ILE A 93 4.980 8.570 -3.007 1.00 0.00 C ATOM 0 H ILE A 93 6.589 9.436 -6.642 1.00 0.00 H new ATOM 0 HA ILE A 93 4.202 7.782 -6.140 1.00 0.00 H new ATOM 0 HB ILE A 93 5.169 10.281 -4.944 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.108 9.536 -3.368 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.319 8.030 -4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.977 11.359 -4.676 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.551 11.346 -6.361 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.289 10.203 -5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.597 8.020 -2.148 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.692 7.947 -3.548 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.478 9.477 -2.664 1.00 0.00 H new ATOM 1367 N SER A 94 2.883 8.881 -7.937 1.00 0.00 N ATOM 1368 CA SER A 94 2.167 9.284 -9.122 1.00 0.00 C ATOM 1369 C SER A 94 0.975 10.155 -8.747 1.00 0.00 C ATOM 1370 O SER A 94 0.281 10.694 -9.620 1.00 0.00 O ATOM 1371 CB SER A 94 1.641 8.057 -9.831 1.00 0.00 C ATOM 1372 OG SER A 94 1.429 8.302 -11.210 1.00 0.00 O ATOM 0 H SER A 94 2.347 8.262 -7.329 1.00 0.00 H new ATOM 0 HA SER A 94 2.848 9.842 -9.765 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.348 7.236 -9.711 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.705 7.742 -9.369 1.00 0.00 H new ATOM 0 HG SER A 94 1.090 7.488 -11.639 1.00 0.00 H new ATOM 1378 N VAL A 95 0.752 10.285 -7.441 1.00 0.00 N ATOM 1379 CA VAL A 95 -0.353 11.008 -6.921 1.00 0.00 C ATOM 1380 C VAL A 95 0.063 12.342 -6.304 1.00 0.00 C ATOM 1381 O VAL A 95 1.229 12.743 -6.364 1.00 0.00 O ATOM 1382 CB VAL A 95 -1.159 10.171 -5.897 1.00 0.00 C ATOM 1383 CG1 VAL A 95 -2.377 9.554 -6.564 1.00 0.00 C ATOM 1384 CG2 VAL A 95 -0.308 9.090 -5.231 1.00 0.00 C ATOM 0 H VAL A 95 1.354 9.878 -6.725 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.999 11.223 -7.772 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.486 10.850 -5.109 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.935 8.968 -5.833 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -3.015 10.345 -6.959 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.056 8.906 -7.379 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.919 8.531 -4.522 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.078 8.411 -5.991 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.525 9.556 -4.704 1.00 0.00 H new ATOM 1394 N SER A 96 -0.920 13.018 -5.716 1.00 0.00 N ATOM 1395 CA SER A 96 -0.751 14.310 -5.094 1.00 0.00 C ATOM 1396 C SER A 96 -1.809 14.489 -4.031 1.00 0.00 C ATOM 1397 O SER A 96 -2.947 14.042 -4.188 1.00 0.00 O ATOM 1398 CB SER A 96 -0.838 15.448 -6.121 1.00 0.00 C ATOM 1399 OG SER A 96 0.173 15.325 -7.105 1.00 0.00 O ATOM 0 H SER A 96 -1.876 12.666 -5.662 1.00 0.00 H new ATOM 0 HA SER A 96 0.241 14.350 -4.645 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.818 15.437 -6.598 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.741 16.408 -5.614 1.00 0.00 H new ATOM 0 HG SER A 96 0.095 16.061 -7.748 1.00 0.00 H new ATOM 1405 N THR A 97 -1.420 15.158 -2.955 1.00 0.00 N ATOM 1406 CA THR A 97 -2.297 15.420 -1.816 1.00 0.00 C ATOM 1407 C THR A 97 -3.587 16.139 -2.244 1.00 0.00 C ATOM 1408 O THR A 97 -3.533 17.143 -2.960 1.00 0.00 O ATOM 1409 CB THR A 97 -1.564 16.268 -0.750 1.00 0.00 C ATOM 1410 OG1 THR A 97 -0.217 15.801 -0.590 1.00 0.00 O ATOM 1411 CG2 THR A 97 -2.274 16.219 0.601 1.00 0.00 C ATOM 0 H THR A 97 -0.480 15.538 -2.844 1.00 0.00 H new ATOM 0 HA THR A 97 -2.568 14.454 -1.390 1.00 0.00 H new ATOM 0 HB THR A 97 -1.564 17.300 -1.100 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.240 16.345 0.085 1.00 0.00 H new ATOM 0 HG21 THR A 97 -1.727 16.827 1.322 1.00 0.00 H new ATOM 0 HG22 THR A 97 -3.287 16.606 0.494 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.315 15.188 0.953 1.00 0.00 H new ATOM 1419 N ASP A 98 -4.735 15.578 -1.812 1.00 0.00 N ATOM 1420 CA ASP A 98 -6.092 16.110 -2.086 1.00 0.00 C ATOM 1421 C ASP A 98 -6.654 15.583 -3.410 1.00 0.00 C ATOM 1422 O ASP A 98 -7.820 15.841 -3.736 1.00 0.00 O ATOM 1423 CB ASP A 98 -6.152 17.652 -2.055 1.00 0.00 C ATOM 1424 CG ASP A 98 -7.386 18.167 -1.342 1.00 0.00 C ATOM 1425 OD1 ASP A 98 -8.434 18.323 -2.004 1.00 0.00 O ATOM 1426 OD2 ASP A 98 -7.305 18.411 -0.120 1.00 0.00 O ATOM 0 H ASP A 98 -4.748 14.726 -1.252 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.720 15.745 -1.273 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -5.261 18.038 -1.559 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -6.139 18.034 -3.076 1.00 0.00 H new ATOM 1431 N SER A 99 -5.833 14.828 -4.162 1.00 0.00 N ATOM 1432 CA SER A 99 -6.256 14.252 -5.423 1.00 0.00 C ATOM 1433 C SER A 99 -7.041 12.970 -5.185 1.00 0.00 C ATOM 1434 O SER A 99 -6.793 12.259 -4.212 1.00 0.00 O ATOM 1435 CB SER A 99 -5.047 13.944 -6.297 1.00 0.00 C ATOM 1436 OG SER A 99 -5.431 13.677 -7.635 1.00 0.00 O ATOM 0 H SER A 99 -4.870 14.610 -3.905 1.00 0.00 H new ATOM 0 HA SER A 99 -6.894 14.976 -5.930 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.357 14.787 -6.276 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.513 13.085 -5.892 1.00 0.00 H new ATOM 0 HG SER A 99 -4.634 13.485 -8.172 1.00 0.00 H new ATOM 1442 N THR A 100 -7.998 12.697 -6.065 1.00 0.00 N ATOM 1443 CA THR A 100 -8.804 11.496 -5.975 1.00 0.00 C ATOM 1444 C THR A 100 -8.106 10.312 -6.617 1.00 0.00 C ATOM 1445 O THR A 100 -7.386 10.463 -7.609 1.00 0.00 O ATOM 1446 CB THR A 100 -10.183 11.666 -6.617 1.00 0.00 C ATOM 1447 OG1 THR A 100 -10.084 12.397 -7.847 1.00 0.00 O ATOM 1448 CG2 THR A 100 -11.122 12.373 -5.661 1.00 0.00 C ATOM 0 H THR A 100 -8.232 13.300 -6.854 1.00 0.00 H new ATOM 0 HA THR A 100 -8.940 11.308 -4.910 1.00 0.00 H new ATOM 0 HB THR A 100 -10.584 10.677 -6.838 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.975 12.494 -8.243 1.00 0.00 H new ATOM 0 HG21 THR A 100 -12.099 12.488 -6.129 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.224 11.785 -4.749 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.719 13.356 -5.416 1.00 0.00 H new ATOM 1456 N VAL A 101 -8.328 9.140 -6.037 1.00 0.00 N ATOM 1457 CA VAL A 101 -7.728 7.929 -6.512 1.00 0.00 C ATOM 1458 C VAL A 101 -8.754 6.836 -6.774 1.00 0.00 C ATOM 1459 O VAL A 101 -9.916 6.935 -6.369 1.00 0.00 O ATOM 1460 CB VAL A 101 -6.673 7.379 -5.534 1.00 0.00 C ATOM 1461 CG1 VAL A 101 -5.279 7.752 -5.996 1.00 0.00 C ATOM 1462 CG2 VAL A 101 -6.911 7.834 -4.098 1.00 0.00 C ATOM 0 H VAL A 101 -8.932 9.016 -5.224 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.246 8.201 -7.451 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.768 6.293 -5.536 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.545 7.356 -5.294 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.099 7.331 -6.985 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.189 8.837 -6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.139 7.417 -3.452 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.876 8.922 -4.051 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.889 7.488 -3.764 1.00 0.00 H new ATOM 1472 N LYS A 102 -8.280 5.782 -7.442 1.00 0.00 N ATOM 1473 CA LYS A 102 -9.061 4.641 -7.794 1.00 0.00 C ATOM 1474 C LYS A 102 -8.228 3.386 -7.658 1.00 0.00 C ATOM 1475 O LYS A 102 -7.016 3.392 -7.876 1.00 0.00 O ATOM 1476 CB LYS A 102 -9.594 4.793 -9.204 1.00 0.00 C ATOM 1477 CG LYS A 102 -10.738 3.846 -9.540 1.00 0.00 C ATOM 1478 CD LYS A 102 -11.008 3.789 -11.032 1.00 0.00 C ATOM 1479 CE LYS A 102 -12.233 2.941 -11.337 1.00 0.00 C ATOM 1480 NZ LYS A 102 -12.453 2.787 -12.800 1.00 0.00 N ATOM 0 H LYS A 102 -7.311 5.717 -7.753 1.00 0.00 H new ATOM 0 HA LYS A 102 -9.912 4.561 -7.117 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.933 5.819 -9.345 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -8.780 4.627 -9.909 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.500 2.846 -9.176 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.640 4.168 -9.020 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.156 4.798 -11.416 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.140 3.377 -11.546 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -12.115 1.957 -10.882 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -13.113 3.398 -10.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -13.297 2.203 -12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -12.591 3.723 -13.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.625 2.327 -13.229 1.00 0.00 H new ATOM 1494 N GLN A 103 -8.915 2.310 -7.314 1.00 0.00 N ATOM 1495 CA GLN A 103 -8.321 1.003 -7.123 1.00 0.00 C ATOM 1496 C GLN A 103 -7.590 0.534 -8.385 1.00 0.00 C ATOM 1497 O GLN A 103 -8.066 0.720 -9.509 1.00 0.00 O ATOM 1498 CB GLN A 103 -9.411 0.005 -6.716 1.00 0.00 C ATOM 1499 CG GLN A 103 -8.903 -1.260 -6.016 1.00 0.00 C ATOM 1500 CD GLN A 103 -8.670 -2.403 -6.974 1.00 0.00 C ATOM 1501 OE1 GLN A 103 -8.714 -3.573 -6.593 1.00 0.00 O ATOM 1502 NE2 GLN A 103 -8.436 -2.067 -8.225 1.00 0.00 N ATOM 0 H GLN A 103 -9.923 2.324 -7.157 1.00 0.00 H new ATOM 0 HA GLN A 103 -7.579 1.066 -6.327 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -10.116 0.509 -6.055 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -9.965 -0.289 -7.608 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -7.973 -1.033 -5.495 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -9.626 -1.567 -5.260 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -8.409 -1.083 -8.492 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -8.281 -2.791 -8.927 1.00 0.00 H new ATOM 1511 N GLY A 104 -6.424 -0.059 -8.156 1.00 0.00 N ATOM 1512 CA GLY A 104 -5.575 -0.576 -9.218 1.00 0.00 C ATOM 1513 C GLY A 104 -4.802 0.490 -9.969 1.00 0.00 C ATOM 1514 O GLY A 104 -4.002 0.170 -10.851 1.00 0.00 O ATOM 0 H GLY A 104 -6.040 -0.195 -7.221 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -4.869 -1.287 -8.790 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.193 -1.128 -9.926 1.00 0.00 H new ATOM 1518 N GLN A 105 -5.062 1.755 -9.636 1.00 0.00 N ATOM 1519 CA GLN A 105 -4.397 2.885 -10.262 1.00 0.00 C ATOM 1520 C GLN A 105 -2.991 3.010 -9.735 1.00 0.00 C ATOM 1521 O GLN A 105 -2.733 2.785 -8.552 1.00 0.00 O ATOM 1522 CB GLN A 105 -5.210 4.159 -10.011 1.00 0.00 C ATOM 1523 CG GLN A 105 -4.745 5.413 -10.738 1.00 0.00 C ATOM 1524 CD GLN A 105 -5.746 6.536 -10.577 1.00 0.00 C ATOM 1525 OE1 GLN A 105 -6.544 6.808 -11.475 1.00 0.00 O ATOM 1526 NE2 GLN A 105 -5.730 7.172 -9.413 1.00 0.00 N ATOM 0 H GLN A 105 -5.742 2.019 -8.923 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.334 2.729 -11.339 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -6.245 3.965 -10.293 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.204 4.363 -8.940 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.776 5.726 -10.348 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.606 5.194 -11.797 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -5.050 6.912 -8.699 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.398 7.921 -9.232 1.00 0.00 H new ATOM 1535 N ILE A 106 -2.086 3.341 -10.639 1.00 0.00 N ATOM 1536 CA ILE A 106 -0.696 3.486 -10.301 1.00 0.00 C ATOM 1537 C ILE A 106 -0.498 4.760 -9.489 1.00 0.00 C ATOM 1538 O ILE A 106 -0.481 5.874 -10.023 1.00 0.00 O ATOM 1539 CB ILE A 106 0.223 3.431 -11.539 1.00 0.00 C ATOM 1540 CG1 ILE A 106 0.142 2.037 -12.196 1.00 0.00 C ATOM 1541 CG2 ILE A 106 1.680 3.771 -11.181 1.00 0.00 C ATOM 1542 CD1 ILE A 106 0.499 2.011 -13.671 1.00 0.00 C ATOM 0 H ILE A 106 -2.300 3.514 -11.621 1.00 0.00 H new ATOM 0 HA ILE A 106 -0.403 2.635 -9.687 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.125 4.183 -12.248 1.00 0.00 H new ATOM 0 HG12 ILE A 106 0.809 1.359 -11.663 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.870 1.651 -12.074 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.296 3.722 -12.079 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.727 4.777 -10.763 1.00 0.00 H new ATOM 0 HG23 ILE A 106 2.051 3.056 -10.447 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.414 0.992 -14.048 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.183 2.659 -14.222 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.522 2.363 -13.804 1.00 0.00 H new ATOM 1554 N ILE A 107 -0.386 4.550 -8.192 1.00 0.00 N ATOM 1555 CA ILE A 107 -0.214 5.610 -7.231 1.00 0.00 C ATOM 1556 C ILE A 107 1.261 5.893 -6.896 1.00 0.00 C ATOM 1557 O ILE A 107 1.559 6.840 -6.161 1.00 0.00 O ATOM 1558 CB ILE A 107 -0.985 5.295 -5.926 1.00 0.00 C ATOM 1559 CG1 ILE A 107 -0.875 3.807 -5.531 1.00 0.00 C ATOM 1560 CG2 ILE A 107 -2.447 5.703 -6.062 1.00 0.00 C ATOM 1561 CD1 ILE A 107 -0.704 3.580 -4.043 1.00 0.00 C ATOM 0 H ILE A 107 -0.413 3.620 -7.774 1.00 0.00 H new ATOM 0 HA ILE A 107 -0.619 6.507 -7.699 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.524 5.877 -5.128 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.770 3.284 -5.868 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.029 3.363 -6.056 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.976 5.475 -5.137 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.509 6.773 -6.262 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.903 5.153 -6.885 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -0.634 2.511 -3.844 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.206 4.073 -3.702 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.561 3.993 -3.511 1.00 0.00 H new ATOM 1573 N GLY A 108 2.169 5.071 -7.433 1.00 0.00 N ATOM 1574 CA GLY A 108 3.582 5.257 -7.207 1.00 0.00 C ATOM 1575 C GLY A 108 4.404 4.084 -7.695 1.00 0.00 C ATOM 1576 O GLY A 108 3.961 3.298 -8.535 1.00 0.00 O ATOM 0 H GLY A 108 1.937 4.274 -8.026 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.912 6.164 -7.714 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.760 5.404 -6.142 1.00 0.00 H new ATOM 1580 N TYR A 109 5.609 4.002 -7.155 1.00 0.00 N ATOM 1581 CA TYR A 109 6.576 2.966 -7.456 1.00 0.00 C ATOM 1582 C TYR A 109 7.274 2.571 -6.163 1.00 0.00 C ATOM 1583 O TYR A 109 7.632 3.436 -5.359 1.00 0.00 O ATOM 1584 CB TYR A 109 7.624 3.436 -8.483 1.00 0.00 C ATOM 1585 CG TYR A 109 7.048 4.015 -9.762 1.00 0.00 C ATOM 1586 CD1 TYR A 109 6.977 3.261 -10.926 1.00 0.00 C ATOM 1587 CD2 TYR A 109 6.581 5.321 -9.797 1.00 0.00 C ATOM 1588 CE1 TYR A 109 6.456 3.796 -12.091 1.00 0.00 C ATOM 1589 CE2 TYR A 109 6.057 5.863 -10.955 1.00 0.00 C ATOM 1590 CZ TYR A 109 5.998 5.096 -12.099 1.00 0.00 C ATOM 1591 OH TYR A 109 5.478 5.632 -13.256 1.00 0.00 O ATOM 0 H TYR A 109 5.950 4.679 -6.472 1.00 0.00 H new ATOM 0 HA TYR A 109 6.050 2.117 -7.892 1.00 0.00 H new ATOM 0 HB2 TYR A 109 8.259 4.188 -8.015 1.00 0.00 H new ATOM 0 HB3 TYR A 109 8.265 2.592 -8.739 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.334 2.242 -10.922 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.628 5.925 -8.903 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.408 3.198 -12.989 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.696 6.881 -10.964 1.00 0.00 H new ATOM 0 HH TYR A 109 5.200 6.557 -13.092 1.00 0.00 H new ATOM 1601 N THR A 110 7.480 1.269 -5.991 1.00 0.00 N ATOM 1602 CA THR A 110 8.114 0.697 -4.799 1.00 0.00 C ATOM 1603 C THR A 110 9.557 1.170 -4.621 1.00 0.00 C ATOM 1604 O THR A 110 10.232 1.470 -5.610 1.00 0.00 O ATOM 1605 CB THR A 110 8.104 -0.839 -4.863 1.00 0.00 C ATOM 1606 OG1 THR A 110 8.134 -1.286 -6.225 1.00 0.00 O ATOM 1607 CG2 THR A 110 6.882 -1.409 -4.161 1.00 0.00 C ATOM 0 H THR A 110 7.209 0.569 -6.682 1.00 0.00 H new ATOM 0 HA THR A 110 7.530 1.043 -3.946 1.00 0.00 H new ATOM 0 HB THR A 110 8.996 -1.198 -4.350 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.713 -2.074 -6.298 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.902 -2.497 -4.222 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.888 -1.104 -3.114 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.978 -1.035 -4.642 1.00 0.00 H new ATOM 1615 N GLY A 111 10.025 1.252 -3.361 1.00 0.00 N ATOM 1616 CA GLY A 111 11.387 1.691 -3.123 1.00 0.00 C ATOM 1617 C GLY A 111 11.956 1.245 -1.803 1.00 0.00 C ATOM 1618 O GLY A 111 11.426 0.339 -1.152 1.00 0.00 O ATOM 0 H GLY A 111 9.488 1.025 -2.524 1.00 0.00 H new ATOM 0 HA2 GLY A 111 12.023 1.317 -3.925 1.00 0.00 H new ATOM 0 HA3 GLY A 111 11.420 2.779 -3.171 1.00 0.00 H new ATOM 1622 N ALA A 112 13.064 1.884 -1.426 1.00 0.00 N ATOM 1623 CA ALA A 112 13.742 1.615 -0.178 1.00 0.00 C ATOM 1624 C ALA A 112 14.441 2.894 0.297 1.00 0.00 C ATOM 1625 O ALA A 112 15.648 2.906 0.580 1.00 0.00 O ATOM 1626 CB ALA A 112 14.741 0.463 -0.324 1.00 0.00 C ATOM 0 H ALA A 112 13.512 2.607 -1.989 1.00 0.00 H new ATOM 0 HA ALA A 112 13.008 1.307 0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.234 0.286 0.632 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.213 -0.439 -0.633 1.00 0.00 H new ATOM 0 HB3 ALA A 112 15.488 0.722 -1.075 1.00 0.00 H new ATOM 1632 N THR A 113 13.661 3.975 0.372 1.00 0.00 N ATOM 1633 CA THR A 113 14.173 5.295 0.756 1.00 0.00 C ATOM 1634 C THR A 113 14.324 5.472 2.278 1.00 0.00 C ATOM 1635 O THR A 113 14.731 6.544 2.743 1.00 0.00 O ATOM 1636 CB THR A 113 13.264 6.410 0.197 1.00 0.00 C ATOM 1637 OG1 THR A 113 11.905 6.174 0.587 1.00 0.00 O ATOM 1638 CG2 THR A 113 13.352 6.481 -1.325 1.00 0.00 C ATOM 0 H THR A 113 12.661 3.962 0.170 1.00 0.00 H new ATOM 0 HA THR A 113 15.171 5.369 0.323 1.00 0.00 H new ATOM 0 HB THR A 113 13.605 7.360 0.607 1.00 0.00 H new ATOM 0 HG1 THR A 113 11.397 5.842 -0.182 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.701 7.275 -1.690 1.00 0.00 H new ATOM 0 HG22 THR A 113 14.380 6.689 -1.621 1.00 0.00 H new ATOM 0 HG23 THR A 113 13.038 5.529 -1.752 1.00 0.00 H new ATOM 1646 N GLY A 114 14.009 4.420 3.040 1.00 0.00 N ATOM 1647 CA GLY A 114 14.129 4.473 4.491 1.00 0.00 C ATOM 1648 C GLY A 114 15.334 3.700 4.996 1.00 0.00 C ATOM 1649 O GLY A 114 16.237 3.380 4.217 1.00 0.00 O ATOM 0 H GLY A 114 13.672 3.529 2.675 1.00 0.00 H new ATOM 0 HA2 GLY A 114 14.207 5.512 4.810 1.00 0.00 H new ATOM 0 HA3 GLY A 114 13.224 4.068 4.944 1.00 0.00 H new ATOM 1653 N GLN A 115 15.340 3.389 6.298 1.00 0.00 N ATOM 1654 CA GLN A 115 16.445 2.646 6.914 1.00 0.00 C ATOM 1655 C GLN A 115 16.159 1.137 6.911 1.00 0.00 C ATOM 1656 O GLN A 115 15.553 0.597 7.845 1.00 0.00 O ATOM 1657 CB GLN A 115 16.695 3.150 8.342 1.00 0.00 C ATOM 1658 CG GLN A 115 17.583 4.381 8.406 1.00 0.00 C ATOM 1659 CD GLN A 115 17.869 4.822 9.828 1.00 0.00 C ATOM 1660 OE1 GLN A 115 18.831 4.370 10.448 1.00 0.00 O ATOM 1661 NE2 GLN A 115 17.034 5.711 10.352 1.00 0.00 N ATOM 0 H GLN A 115 14.592 3.640 6.945 1.00 0.00 H new ATOM 0 HA GLN A 115 17.345 2.817 6.324 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.738 3.378 8.811 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.153 2.351 8.925 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.525 4.172 7.898 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.104 5.198 7.866 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.249 6.059 9.802 1.00 0.00 H new ATOM 0 HE22 GLN A 115 17.178 6.046 11.305 1.00 0.00 H new ATOM 1670 N VAL A 116 16.617 0.472 5.843 1.00 0.00 N ATOM 1671 CA VAL A 116 16.432 -0.975 5.666 1.00 0.00 C ATOM 1672 C VAL A 116 17.561 -1.573 4.817 1.00 0.00 C ATOM 1673 O VAL A 116 18.322 -0.838 4.179 1.00 0.00 O ATOM 1674 CB VAL A 116 15.051 -1.340 5.025 1.00 0.00 C ATOM 1675 CG1 VAL A 116 13.948 -1.309 6.074 1.00 0.00 C ATOM 1676 CG2 VAL A 116 14.693 -0.421 3.852 1.00 0.00 C ATOM 0 H VAL A 116 17.124 0.919 5.080 1.00 0.00 H new ATOM 0 HA VAL A 116 16.456 -1.405 6.667 1.00 0.00 H new ATOM 0 HB VAL A 116 15.141 -2.352 4.630 1.00 0.00 H new ATOM 0 HG11 VAL A 116 12.996 -1.565 5.609 1.00 0.00 H new ATOM 0 HG12 VAL A 116 14.173 -2.029 6.860 1.00 0.00 H new ATOM 0 HG13 VAL A 116 13.884 -0.310 6.505 1.00 0.00 H new ATOM 0 HG21 VAL A 116 13.727 -0.715 3.441 1.00 0.00 H new ATOM 0 HG22 VAL A 116 14.641 0.610 4.201 1.00 0.00 H new ATOM 0 HG23 VAL A 116 15.456 -0.504 3.078 1.00 0.00 H new ATOM 1686 N THR A 117 17.645 -2.909 4.805 1.00 0.00 N ATOM 1687 CA THR A 117 18.672 -3.622 4.039 1.00 0.00 C ATOM 1688 C THR A 117 18.211 -3.941 2.611 1.00 0.00 C ATOM 1689 O THR A 117 19.023 -4.353 1.776 1.00 0.00 O ATOM 1690 CB THR A 117 19.090 -4.936 4.734 1.00 0.00 C ATOM 1691 OG1 THR A 117 17.929 -5.667 5.147 1.00 0.00 O ATOM 1692 CG2 THR A 117 19.981 -4.659 5.937 1.00 0.00 C ATOM 0 H THR A 117 17.010 -3.519 5.320 1.00 0.00 H new ATOM 0 HA THR A 117 19.529 -2.950 3.990 1.00 0.00 H new ATOM 0 HB THR A 117 19.655 -5.532 4.018 1.00 0.00 H new ATOM 0 HG1 THR A 117 18.205 -6.499 5.585 1.00 0.00 H new ATOM 0 HG21 THR A 117 20.260 -5.602 6.408 1.00 0.00 H new ATOM 0 HG22 THR A 117 20.880 -4.136 5.611 1.00 0.00 H new ATOM 0 HG23 THR A 117 19.441 -4.041 6.655 1.00 0.00 H new ATOM 1700 N GLY A 118 16.913 -3.742 2.337 1.00 0.00 N ATOM 1701 CA GLY A 118 16.375 -4.010 1.010 1.00 0.00 C ATOM 1702 C GLY A 118 15.061 -3.278 0.732 1.00 0.00 C ATOM 1703 O GLY A 118 14.482 -2.699 1.657 1.00 0.00 O ATOM 0 H GLY A 118 16.230 -3.400 3.013 1.00 0.00 H new ATOM 0 HA2 GLY A 118 17.111 -3.718 0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 118 16.216 -5.083 0.900 1.00 0.00 H new ATOM 1707 N PRO A 119 14.556 -3.277 -0.545 1.00 0.00 N ATOM 1708 CA PRO A 119 13.295 -2.603 -0.918 1.00 0.00 C ATOM 1709 C PRO A 119 12.060 -3.422 -0.543 1.00 0.00 C ATOM 1710 O PRO A 119 12.117 -4.654 -0.537 1.00 0.00 O ATOM 1711 CB PRO A 119 13.400 -2.458 -2.451 1.00 0.00 C ATOM 1712 CG PRO A 119 14.747 -2.992 -2.833 1.00 0.00 C ATOM 1713 CD PRO A 119 15.162 -3.915 -1.730 1.00 0.00 C ATOM 0 HA PRO A 119 13.175 -1.654 -0.395 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.606 -3.014 -2.949 1.00 0.00 H new ATOM 0 HB3 PRO A 119 13.296 -1.415 -2.751 1.00 0.00 H new ATOM 0 HG2 PRO A 119 14.700 -3.521 -3.785 1.00 0.00 H new ATOM 0 HG3 PRO A 119 15.466 -2.182 -2.953 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.788 -4.927 -1.884 1.00 0.00 H new ATOM 0 HD3 PRO A 119 16.246 -3.986 -1.645 1.00 0.00 H new ATOM 1721 N HIS A 120 10.957 -2.732 -0.181 1.00 0.00 N ATOM 1722 CA HIS A 120 9.719 -3.395 0.193 1.00 0.00 C ATOM 1723 C HIS A 120 8.516 -2.451 0.100 1.00 0.00 C ATOM 1724 O HIS A 120 8.587 -1.371 -0.495 1.00 0.00 O ATOM 1725 CB HIS A 120 9.842 -4.025 1.607 1.00 0.00 C ATOM 1726 CG HIS A 120 10.021 -3.029 2.717 1.00 0.00 C ATOM 1727 ND1 HIS A 120 11.162 -2.270 2.871 1.00 0.00 N ATOM 1728 CD2 HIS A 120 9.186 -2.656 3.715 1.00 0.00 C ATOM 1729 CE1 HIS A 120 11.020 -1.475 3.916 1.00 0.00 C ATOM 1730 NE2 HIS A 120 9.831 -1.691 4.445 1.00 0.00 N ATOM 0 H HIS A 120 10.913 -1.714 -0.144 1.00 0.00 H new ATOM 0 HA HIS A 120 9.543 -4.199 -0.522 1.00 0.00 H new ATOM 0 HB2 HIS A 120 8.949 -4.617 1.807 1.00 0.00 H new ATOM 0 HB3 HIS A 120 10.688 -4.713 1.613 1.00 0.00 H new ATOM 0 HD1 HIS A 120 11.986 -2.315 2.272 1.00 0.00 H new ATOM 0 HD2 HIS A 120 8.196 -3.046 3.902 1.00 0.00 H new ATOM 0 HE1 HIS A 120 11.753 -0.768 4.276 1.00 0.00 H new ATOM 1739 N LEU A 121 7.420 -2.912 0.688 1.00 0.00 N ATOM 1740 CA LEU A 121 6.169 -2.219 0.711 1.00 0.00 C ATOM 1741 C LEU A 121 5.634 -2.144 2.130 1.00 0.00 C ATOM 1742 O LEU A 121 5.696 -3.111 2.895 1.00 0.00 O ATOM 1743 CB LEU A 121 5.160 -2.913 -0.230 1.00 0.00 C ATOM 1744 CG LEU A 121 3.663 -2.580 -0.050 1.00 0.00 C ATOM 1745 CD1 LEU A 121 3.353 -1.151 -0.488 1.00 0.00 C ATOM 1746 CD2 LEU A 121 2.808 -3.568 -0.829 1.00 0.00 C ATOM 0 H LEU A 121 7.392 -3.809 1.173 1.00 0.00 H new ATOM 0 HA LEU A 121 6.320 -1.200 0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.436 -2.670 -1.256 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.280 -3.990 -0.114 1.00 0.00 H new ATOM 0 HG LEU A 121 3.426 -2.662 1.011 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.291 -0.950 -0.348 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.937 -0.452 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.610 -1.029 -1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.755 -3.323 -0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 121 3.061 -3.512 -1.888 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.995 -4.578 -0.464 1.00 0.00 H new ATOM 1758 N HIS A 122 5.117 -0.979 2.452 1.00 0.00 N ATOM 1759 CA HIS A 122 4.540 -0.715 3.743 1.00 0.00 C ATOM 1760 C HIS A 122 3.084 -0.286 3.591 1.00 0.00 C ATOM 1761 O HIS A 122 2.796 0.789 3.060 1.00 0.00 O ATOM 1762 CB HIS A 122 5.358 0.350 4.500 1.00 0.00 C ATOM 1763 CG HIS A 122 4.708 0.872 5.762 1.00 0.00 C ATOM 1764 ND1 HIS A 122 5.084 0.417 7.000 1.00 0.00 N ATOM 1765 CD2 HIS A 122 3.688 1.763 5.914 1.00 0.00 C ATOM 1766 CE1 HIS A 122 4.288 1.026 7.866 1.00 0.00 C ATOM 1767 NE2 HIS A 122 3.434 1.848 7.252 1.00 0.00 N ATOM 0 H HIS A 122 5.087 -0.183 1.815 1.00 0.00 H new ATOM 0 HA HIS A 122 4.566 -1.632 4.332 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.329 -0.073 4.757 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.543 1.189 3.830 1.00 0.00 H new ATOM 0 HD2 HIS A 122 3.179 2.299 5.127 1.00 0.00 H new ATOM 0 HE1 HIS A 122 4.325 0.876 8.935 1.00 0.00 H new ATOM 0 HE2 HIS A 122 2.725 2.430 7.699 1.00 0.00 H new ATOM 1775 N PHE A 123 2.189 -1.114 4.106 1.00 0.00 N ATOM 1776 CA PHE A 123 0.765 -0.844 4.054 1.00 0.00 C ATOM 1777 C PHE A 123 0.194 -0.739 5.474 1.00 0.00 C ATOM 1778 O PHE A 123 0.082 -1.735 6.196 1.00 0.00 O ATOM 1779 CB PHE A 123 0.064 -1.955 3.259 1.00 0.00 C ATOM 1780 CG PHE A 123 -1.301 -1.599 2.733 1.00 0.00 C ATOM 1781 CD1 PHE A 123 -2.449 -1.907 3.453 1.00 0.00 C ATOM 1782 CD2 PHE A 123 -1.433 -0.964 1.509 1.00 0.00 C ATOM 1783 CE1 PHE A 123 -3.697 -1.588 2.955 1.00 0.00 C ATOM 1784 CE2 PHE A 123 -2.678 -0.641 1.012 1.00 0.00 C ATOM 1785 CZ PHE A 123 -3.811 -0.954 1.734 1.00 0.00 C ATOM 0 H PHE A 123 2.431 -1.989 4.570 1.00 0.00 H new ATOM 0 HA PHE A 123 0.592 0.108 3.552 1.00 0.00 H new ATOM 0 HB2 PHE A 123 0.699 -2.235 2.418 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -0.027 -2.835 3.896 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -2.365 -2.400 4.410 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -0.550 -0.719 0.937 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -4.583 -1.834 3.521 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -2.766 -0.143 0.058 1.00 0.00 H new ATOM 0 HZ PHE A 123 -4.787 -0.703 1.344 1.00 0.00 H new ATOM 1795 N GLU A 124 -0.137 0.489 5.860 1.00 0.00 N ATOM 1796 CA GLU A 124 -0.703 0.790 7.141 1.00 0.00 C ATOM 1797 C GLU A 124 -2.136 1.262 6.939 1.00 0.00 C ATOM 1798 O GLU A 124 -2.407 2.167 6.156 1.00 0.00 O ATOM 1799 CB GLU A 124 0.170 1.833 7.876 1.00 0.00 C ATOM 1800 CG GLU A 124 0.152 3.246 7.291 1.00 0.00 C ATOM 1801 CD GLU A 124 0.975 4.225 8.105 1.00 0.00 C ATOM 1802 OE1 GLU A 124 2.154 4.444 7.755 1.00 0.00 O ATOM 1803 OE2 GLU A 124 0.441 4.771 9.093 1.00 0.00 O ATOM 0 H GLU A 124 -0.011 1.310 5.268 1.00 0.00 H new ATOM 0 HA GLU A 124 -0.724 -0.098 7.773 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.157 1.886 8.914 1.00 0.00 H new ATOM 0 HB3 GLU A 124 1.200 1.476 7.884 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.533 3.217 6.270 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.878 3.600 7.237 1.00 0.00 H new ATOM 1810 N MET A 125 -3.029 0.626 7.658 1.00 0.00 N ATOM 1811 CA MET A 125 -4.436 0.894 7.590 1.00 0.00 C ATOM 1812 C MET A 125 -4.939 1.264 8.971 1.00 0.00 C ATOM 1813 O MET A 125 -4.628 0.615 9.974 1.00 0.00 O ATOM 1814 CB MET A 125 -5.131 -0.331 6.993 1.00 0.00 C ATOM 1815 CG MET A 125 -6.611 -0.525 7.310 1.00 0.00 C ATOM 1816 SD MET A 125 -7.398 -1.712 6.206 1.00 0.00 S ATOM 1817 CE MET A 125 -8.665 -2.377 7.282 1.00 0.00 C ATOM 0 H MET A 125 -2.786 -0.110 8.322 1.00 0.00 H new ATOM 0 HA MET A 125 -4.658 1.742 6.942 1.00 0.00 H new ATOM 0 HB2 MET A 125 -5.022 -0.285 5.909 1.00 0.00 H new ATOM 0 HB3 MET A 125 -4.596 -1.219 7.329 1.00 0.00 H new ATOM 0 HG2 MET A 125 -6.718 -0.864 8.340 1.00 0.00 H new ATOM 0 HG3 MET A 125 -7.125 0.433 7.235 1.00 0.00 H new ATOM 0 HE1 MET A 125 -9.400 -2.919 6.687 1.00 0.00 H new ATOM 0 HE2 MET A 125 -8.210 -3.055 8.004 1.00 0.00 H new ATOM 0 HE3 MET A 125 -9.158 -1.561 7.811 1.00 0.00 H new ATOM 1827 N LEU A 126 -5.726 2.314 8.972 1.00 0.00 N ATOM 1828 CA LEU A 126 -6.295 2.893 10.167 1.00 0.00 C ATOM 1829 C LEU A 126 -7.737 3.358 9.895 1.00 0.00 C ATOM 1830 O LEU A 126 -8.127 3.440 8.738 1.00 0.00 O ATOM 1831 CB LEU A 126 -5.449 4.105 10.602 1.00 0.00 C ATOM 1832 CG LEU A 126 -4.305 3.810 11.569 1.00 0.00 C ATOM 1833 CD1 LEU A 126 -3.008 3.548 10.815 1.00 0.00 C ATOM 1834 CD2 LEU A 126 -4.139 4.960 12.546 1.00 0.00 C ATOM 0 H LEU A 126 -5.996 2.803 8.118 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.302 2.141 10.956 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.033 4.572 9.709 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.110 4.837 11.065 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.550 2.908 12.130 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.209 3.341 11.527 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.138 2.690 10.155 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.748 4.425 10.223 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.321 4.740 13.231 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -3.916 5.875 11.997 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.061 5.092 13.112 1.00 0.00 H new ATOM 1846 N PRO A 127 -8.567 3.644 10.945 1.00 0.00 N ATOM 1847 CA PRO A 127 -9.944 4.145 10.765 1.00 0.00 C ATOM 1848 C PRO A 127 -10.005 5.498 10.084 1.00 0.00 C ATOM 1849 O PRO A 127 -8.973 6.084 9.740 1.00 0.00 O ATOM 1850 CB PRO A 127 -10.464 4.335 12.194 1.00 0.00 C ATOM 1851 CG PRO A 127 -9.260 4.320 13.063 1.00 0.00 C ATOM 1852 CD PRO A 127 -8.267 3.449 12.372 1.00 0.00 C ATOM 0 HA PRO A 127 -10.511 3.451 10.145 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.006 5.275 12.292 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.155 3.538 12.469 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -8.866 5.327 13.202 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.498 3.931 14.053 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -7.244 3.741 12.610 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.377 2.405 12.666 1.00 0.00 H new ATOM 1860 N ALA A 128 -11.234 5.999 9.930 1.00 0.00 N ATOM 1861 CA ALA A 128 -11.459 7.311 9.375 1.00 0.00 C ATOM 1862 C ALA A 128 -10.964 8.364 10.370 1.00 0.00 C ATOM 1863 O ALA A 128 -10.526 9.455 9.992 1.00 0.00 O ATOM 1864 CB ALA A 128 -12.933 7.515 9.079 1.00 0.00 C ATOM 0 H ALA A 128 -12.086 5.501 10.188 1.00 0.00 H new ATOM 0 HA ALA A 128 -10.910 7.409 8.438 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.086 8.510 8.661 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.267 6.765 8.362 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.506 7.417 10.001 1.00 0.00 H new ATOM 1870 N ASN A 129 -11.028 7.974 11.658 1.00 0.00 N ATOM 1871 CA ASN A 129 -10.610 8.800 12.787 1.00 0.00 C ATOM 1872 C ASN A 129 -10.307 7.905 13.956 1.00 0.00 C ATOM 1873 O ASN A 129 -11.213 7.395 14.627 1.00 0.00 O ATOM 1874 CB ASN A 129 -11.639 9.888 13.147 1.00 0.00 C ATOM 1875 CG ASN A 129 -11.193 11.272 12.712 1.00 0.00 C ATOM 1876 OD1 ASN A 129 -10.609 12.023 13.494 1.00 0.00 O ATOM 1877 ND2 ASN A 129 -11.466 11.616 11.459 1.00 0.00 N ATOM 0 H ASN A 129 -11.379 7.058 11.939 1.00 0.00 H new ATOM 0 HA ASN A 129 -9.709 9.344 12.502 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -12.593 9.652 12.676 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -11.806 9.885 14.224 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -11.190 12.534 11.110 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -11.952 10.962 10.845 1.00 0.00 H new ATOM 1884 N PRO A 130 -9.000 7.701 14.210 1.00 0.00 N ATOM 1885 CA PRO A 130 -8.538 6.810 15.252 1.00 0.00 C ATOM 1886 C PRO A 130 -8.724 7.271 16.682 1.00 0.00 C ATOM 1887 O PRO A 130 -8.957 8.449 16.973 1.00 0.00 O ATOM 1888 CB PRO A 130 -7.045 6.616 14.994 1.00 0.00 C ATOM 1889 CG PRO A 130 -6.774 7.296 13.688 1.00 0.00 C ATOM 1890 CD PRO A 130 -7.869 8.287 13.475 1.00 0.00 C ATOM 0 HA PRO A 130 -9.147 5.908 15.189 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -6.448 7.052 15.795 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -6.789 5.558 14.946 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -5.804 7.792 13.706 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -6.747 6.571 12.874 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -7.603 9.270 13.863 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -8.098 8.413 12.417 1.00 0.00 H new ATOM 1898 N ASN A 131 -8.610 6.276 17.551 1.00 0.00 N ATOM 1899 CA ASN A 131 -8.698 6.426 18.966 1.00 0.00 C ATOM 1900 C ASN A 131 -7.363 6.014 19.554 1.00 0.00 C ATOM 1901 O ASN A 131 -7.243 4.996 20.249 1.00 0.00 O ATOM 1902 CB ASN A 131 -9.813 5.558 19.493 1.00 0.00 C ATOM 1903 CG ASN A 131 -10.615 6.232 20.569 1.00 0.00 C ATOM 1904 OD1 ASN A 131 -10.288 6.163 21.754 1.00 0.00 O ATOM 1905 ND2 ASN A 131 -11.680 6.890 20.149 1.00 0.00 N ATOM 0 H ASN A 131 -8.448 5.312 17.261 1.00 0.00 H new ATOM 0 HA ASN A 131 -8.918 7.457 19.242 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -10.474 5.284 18.671 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -9.392 4.632 19.885 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -12.278 7.374 20.819 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -11.905 6.915 19.154 1.00 0.00 H new ATOM 1912 N TRP A 132 -6.360 6.857 19.287 1.00 0.00 N ATOM 1913 CA TRP A 132 -4.976 6.639 19.733 1.00 0.00 C ATOM 1914 C TRP A 132 -4.851 6.612 21.268 1.00 0.00 C ATOM 1915 O TRP A 132 -3.745 6.647 21.825 1.00 0.00 O ATOM 1916 CB TRP A 132 -4.048 7.737 19.184 1.00 0.00 C ATOM 1917 CG TRP A 132 -4.296 8.106 17.752 1.00 0.00 C ATOM 1918 CD1 TRP A 132 -3.928 7.393 16.653 1.00 0.00 C ATOM 1919 CD2 TRP A 132 -4.978 9.270 17.268 1.00 0.00 C ATOM 1920 NE1 TRP A 132 -4.321 8.048 15.515 1.00 0.00 N ATOM 1921 CE2 TRP A 132 -4.969 9.195 15.866 1.00 0.00 C ATOM 1922 CE3 TRP A 132 -5.593 10.370 17.878 1.00 0.00 C ATOM 1923 CZ2 TRP A 132 -5.545 10.165 15.064 1.00 0.00 C ATOM 1924 CZ3 TRP A 132 -6.169 11.338 17.077 1.00 0.00 C ATOM 1925 CH2 TRP A 132 -6.141 11.229 15.681 1.00 0.00 C ATOM 0 H TRP A 132 -6.485 7.716 18.752 1.00 0.00 H new ATOM 0 HA TRP A 132 -4.679 5.665 19.345 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -4.159 8.629 19.800 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -3.015 7.406 19.286 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -3.403 6.449 16.674 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -4.156 7.729 14.560 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.617 10.460 18.954 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -5.524 10.084 13.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -6.648 12.191 17.534 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -6.599 12.001 15.080 1.00 0.00 H new ATOM 1936 N GLN A 133 -6.002 6.529 21.927 1.00 0.00 N ATOM 1937 CA GLN A 133 -6.117 6.522 23.366 1.00 0.00 C ATOM 1938 C GLN A 133 -5.862 5.141 23.975 1.00 0.00 C ATOM 1939 O GLN A 133 -6.454 4.751 24.990 1.00 0.00 O ATOM 1940 CB GLN A 133 -7.501 7.021 23.732 1.00 0.00 C ATOM 1941 CG GLN A 133 -7.764 8.489 23.383 1.00 0.00 C ATOM 1942 CD GLN A 133 -8.179 8.687 21.927 1.00 0.00 C ATOM 1943 OE1 GLN A 133 -9.363 8.829 21.622 1.00 0.00 O ATOM 1944 NE2 GLN A 133 -7.202 8.661 21.022 1.00 0.00 N ATOM 0 H GLN A 133 -6.903 6.463 21.453 1.00 0.00 H new ATOM 0 HA GLN A 133 -5.349 7.177 23.778 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -8.241 6.403 23.225 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -7.651 6.884 24.803 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -8.546 8.878 24.035 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -6.864 9.072 23.582 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -6.234 8.541 21.320 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -7.422 8.761 20.031 1.00 0.00 H new ATOM 1953 N ASN A 134 -4.967 4.421 23.310 1.00 0.00 N ATOM 1954 CA ASN A 134 -4.514 3.075 23.673 1.00 0.00 C ATOM 1955 C ASN A 134 -5.585 2.054 23.381 1.00 0.00 C ATOM 1956 O ASN A 134 -6.742 2.215 23.784 1.00 0.00 O ATOM 1957 CB ASN A 134 -4.059 2.994 25.137 1.00 0.00 C ATOM 1958 CG ASN A 134 -2.754 3.723 25.354 1.00 0.00 C ATOM 1959 OD1 ASN A 134 -1.691 3.110 25.450 1.00 0.00 O ATOM 1960 ND2 ASN A 134 -2.828 5.046 25.409 1.00 0.00 N ATOM 0 H ASN A 134 -4.515 4.771 22.465 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.644 2.848 23.056 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -4.827 3.422 25.782 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -3.945 1.949 25.426 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -1.981 5.599 25.536 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -3.732 5.510 25.325 1.00 0.00 H new ATOM 1967 N GLY A 135 -5.186 1.015 22.666 1.00 0.00 N ATOM 1968 CA GLY A 135 -6.112 -0.028 22.312 1.00 0.00 C ATOM 1969 C GLY A 135 -5.782 -0.687 20.990 1.00 0.00 C ATOM 1970 O GLY A 135 -5.776 -1.918 20.900 1.00 0.00 O ATOM 0 H GLY A 135 -4.234 0.879 22.326 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.117 -0.784 23.097 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -7.118 0.388 22.263 1.00 0.00 H new ATOM 1974 N PHE A 136 -5.533 0.127 19.955 1.00 0.00 N ATOM 1975 CA PHE A 136 -5.183 -0.389 18.624 1.00 0.00 C ATOM 1976 C PHE A 136 -4.324 0.589 17.841 1.00 0.00 C ATOM 1977 O PHE A 136 -3.666 0.203 16.878 1.00 0.00 O ATOM 1978 CB PHE A 136 -6.440 -0.749 17.793 1.00 0.00 C ATOM 1979 CG PHE A 136 -7.667 0.143 17.958 1.00 0.00 C ATOM 1980 CD1 PHE A 136 -8.931 -0.415 17.833 1.00 0.00 C ATOM 1981 CD2 PHE A 136 -7.576 1.514 18.216 1.00 0.00 C ATOM 1982 CE1 PHE A 136 -10.067 0.359 17.958 1.00 0.00 C ATOM 1983 CE2 PHE A 136 -8.711 2.285 18.342 1.00 0.00 C ATOM 1984 CZ PHE A 136 -9.958 1.710 18.211 1.00 0.00 C ATOM 0 H PHE A 136 -5.567 1.145 20.014 1.00 0.00 H new ATOM 0 HA PHE A 136 -4.606 -1.297 18.798 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -6.160 -0.746 16.740 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -6.729 -1.770 18.043 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -9.028 -1.472 17.635 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -6.604 1.974 18.318 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -11.042 -0.094 17.858 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -8.624 3.342 18.544 1.00 0.00 H new ATOM 0 HZ PHE A 136 -10.847 2.316 18.306 1.00 0.00 H new ATOM 1994 N SER A 137 -4.344 1.863 18.263 1.00 0.00 N ATOM 1995 CA SER A 137 -3.607 2.971 17.623 1.00 0.00 C ATOM 1996 C SER A 137 -4.194 3.197 16.246 1.00 0.00 C ATOM 1997 O SER A 137 -3.611 3.851 15.372 1.00 0.00 O ATOM 1998 CB SER A 137 -2.090 2.695 17.558 1.00 0.00 C ATOM 1999 OG SER A 137 -1.488 2.852 18.830 1.00 0.00 O ATOM 0 H SER A 137 -4.884 2.161 19.076 1.00 0.00 H new ATOM 0 HA SER A 137 -3.718 3.874 18.223 1.00 0.00 H new ATOM 0 HB2 SER A 137 -1.917 1.683 17.193 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.624 3.375 16.845 1.00 0.00 H new ATOM 0 HG SER A 137 -0.527 2.670 18.762 1.00 0.00 H new ATOM 2005 N GLY A 138 -5.405 2.649 16.109 1.00 0.00 N ATOM 2006 CA GLY A 138 -6.163 2.726 14.892 1.00 0.00 C ATOM 2007 C GLY A 138 -5.641 1.793 13.819 1.00 0.00 C ATOM 2008 O GLY A 138 -6.291 1.583 12.797 1.00 0.00 O ATOM 0 H GLY A 138 -5.876 2.139 16.856 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.205 2.485 15.102 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.141 3.750 14.519 1.00 0.00 H new ATOM 2012 N ARG A 139 -4.455 1.227 14.050 1.00 0.00 N ATOM 2013 CA ARG A 139 -3.846 0.326 13.072 1.00 0.00 C ATOM 2014 C ARG A 139 -4.449 -1.081 13.144 1.00 0.00 C ATOM 2015 O ARG A 139 -4.405 -1.732 14.193 1.00 0.00 O ATOM 2016 CB ARG A 139 -2.310 0.287 13.211 1.00 0.00 C ATOM 2017 CG ARG A 139 -1.781 0.179 14.645 1.00 0.00 C ATOM 2018 CD ARG A 139 -1.506 -1.259 15.067 1.00 0.00 C ATOM 2019 NE ARG A 139 -0.111 -1.432 15.486 1.00 0.00 N ATOM 2020 CZ ARG A 139 0.292 -1.584 16.756 1.00 0.00 C ATOM 2021 NH1 ARG A 139 -0.581 -1.591 17.762 1.00 0.00 N ATOM 2022 NH2 ARG A 139 1.585 -1.729 17.018 1.00 0.00 N ATOM 0 H ARG A 139 -3.903 1.374 14.895 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.074 0.727 12.084 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -1.932 -0.560 12.638 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.898 1.188 12.757 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -0.863 0.760 14.733 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.506 0.621 15.329 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.171 -1.534 15.886 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.726 -1.932 14.238 1.00 0.00 H new ATOM 0 HE ARG A 139 0.604 -1.437 14.759 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -1.577 -1.479 17.574 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -0.253 -1.708 18.721 1.00 0.00 H new ATOM 0 HH21 ARG A 139 2.263 -1.724 16.256 1.00 0.00 H new ATOM 0 HH22 ARG A 139 1.900 -1.845 17.981 1.00 0.00 H new ATOM 2036 N ILE A 140 -5.005 -1.535 12.013 1.00 0.00 N ATOM 2037 CA ILE A 140 -5.639 -2.847 11.936 1.00 0.00 C ATOM 2038 C ILE A 140 -5.105 -3.689 10.766 1.00 0.00 C ATOM 2039 O ILE A 140 -4.176 -3.276 10.063 1.00 0.00 O ATOM 2040 CB ILE A 140 -7.191 -2.778 11.857 1.00 0.00 C ATOM 2041 CG1 ILE A 140 -7.742 -1.362 12.085 1.00 0.00 C ATOM 2042 CG2 ILE A 140 -7.801 -3.738 12.866 1.00 0.00 C ATOM 2043 CD1 ILE A 140 -7.796 -0.519 10.828 1.00 0.00 C ATOM 0 H ILE A 140 -5.026 -1.008 11.140 1.00 0.00 H new ATOM 0 HA ILE A 140 -5.373 -3.336 12.873 1.00 0.00 H new ATOM 0 HB ILE A 140 -7.470 -3.067 10.844 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -8.745 -1.436 12.506 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.122 -0.856 12.825 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -8.888 -3.686 12.807 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -7.474 -4.754 12.645 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -7.479 -3.463 13.870 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -8.195 0.466 11.068 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.792 -0.413 10.417 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -8.440 -1.002 10.093 1.00 0.00 H new ATOM 2055 N ASP A 141 -5.747 -4.851 10.543 1.00 0.00 N ATOM 2056 CA ASP A 141 -5.351 -5.813 9.509 1.00 0.00 C ATOM 2057 C ASP A 141 -5.827 -5.417 8.089 1.00 0.00 C ATOM 2058 O ASP A 141 -7.009 -5.106 7.910 1.00 0.00 O ATOM 2059 CB ASP A 141 -5.877 -7.220 9.862 1.00 0.00 C ATOM 2060 CG ASP A 141 -7.373 -7.265 10.152 1.00 0.00 C ATOM 2061 OD1 ASP A 141 -7.747 -7.242 11.344 1.00 0.00 O ATOM 2062 OD2 ASP A 141 -8.164 -7.321 9.187 1.00 0.00 O ATOM 0 H ASP A 141 -6.561 -5.147 11.082 1.00 0.00 H new ATOM 0 HA ASP A 141 -4.261 -5.813 9.489 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -5.656 -7.897 9.037 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -5.337 -7.591 10.733 1.00 0.00 H new ATOM 2067 N PRO A 142 -4.910 -5.391 7.061 1.00 0.00 N ATOM 2068 CA PRO A 142 -5.275 -5.062 5.666 1.00 0.00 C ATOM 2069 C PRO A 142 -5.978 -6.218 4.927 1.00 0.00 C ATOM 2070 O PRO A 142 -6.429 -6.047 3.791 1.00 0.00 O ATOM 2071 CB PRO A 142 -3.933 -4.778 4.978 1.00 0.00 C ATOM 2072 CG PRO A 142 -2.879 -4.875 6.033 1.00 0.00 C ATOM 2073 CD PRO A 142 -3.462 -5.671 7.163 1.00 0.00 C ATOM 0 HA PRO A 142 -5.978 -4.230 5.650 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -3.748 -5.496 4.179 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -3.934 -3.788 4.522 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -1.985 -5.359 5.641 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -2.581 -3.883 6.373 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -3.249 -6.735 7.058 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -3.058 -5.359 8.126 1.00 0.00 H new ATOM 2081 N THR A 143 -6.105 -7.374 5.608 1.00 0.00 N ATOM 2082 CA THR A 143 -6.697 -8.604 5.066 1.00 0.00 C ATOM 2083 C THR A 143 -8.068 -8.420 4.417 1.00 0.00 C ATOM 2084 O THR A 143 -8.473 -9.221 3.568 1.00 0.00 O ATOM 2085 CB THR A 143 -6.810 -9.674 6.164 1.00 0.00 C ATOM 2086 OG1 THR A 143 -7.063 -9.068 7.438 1.00 0.00 O ATOM 2087 CG2 THR A 143 -5.547 -10.519 6.233 1.00 0.00 C ATOM 0 H THR A 143 -5.790 -7.476 6.573 1.00 0.00 H new ATOM 0 HA THR A 143 -6.016 -8.918 4.276 1.00 0.00 H new ATOM 0 HB THR A 143 -7.648 -10.323 5.910 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.693 -8.326 7.328 1.00 0.00 H new ATOM 0 HG21 THR A 143 -5.653 -11.268 7.018 1.00 0.00 H new ATOM 0 HG22 THR A 143 -5.389 -11.016 5.276 1.00 0.00 H new ATOM 0 HG23 THR A 143 -4.693 -9.879 6.455 1.00 0.00 H new ATOM 2095 N GLY A 144 -8.764 -7.362 4.822 1.00 0.00 N ATOM 2096 CA GLY A 144 -10.098 -7.076 4.299 1.00 0.00 C ATOM 2097 C GLY A 144 -10.070 -6.639 2.844 1.00 0.00 C ATOM 2098 O GLY A 144 -11.003 -6.920 2.087 1.00 0.00 O ATOM 0 H GLY A 144 -8.428 -6.688 5.510 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -10.721 -7.965 4.396 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -10.561 -6.294 4.901 1.00 0.00 H new ATOM 2102 N TYR A 145 -8.967 -5.991 2.458 1.00 0.00 N ATOM 2103 CA TYR A 145 -8.778 -5.488 1.105 1.00 0.00 C ATOM 2104 C TYR A 145 -7.817 -6.364 0.307 1.00 0.00 C ATOM 2105 O TYR A 145 -7.694 -6.217 -0.914 1.00 0.00 O ATOM 2106 CB TYR A 145 -8.261 -4.045 1.137 1.00 0.00 C ATOM 2107 CG TYR A 145 -9.210 -3.086 1.812 1.00 0.00 C ATOM 2108 CD1 TYR A 145 -9.308 -3.050 3.195 1.00 0.00 C ATOM 2109 CD2 TYR A 145 -10.015 -2.237 1.070 1.00 0.00 C ATOM 2110 CE1 TYR A 145 -10.190 -2.190 3.823 1.00 0.00 C ATOM 2111 CE2 TYR A 145 -10.897 -1.371 1.688 1.00 0.00 C ATOM 2112 CZ TYR A 145 -10.981 -1.351 3.063 1.00 0.00 C ATOM 2113 OH TYR A 145 -11.864 -0.493 3.678 1.00 0.00 O ATOM 0 H TYR A 145 -8.181 -5.803 3.081 1.00 0.00 H new ATOM 0 HA TYR A 145 -9.749 -5.513 0.610 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -7.302 -4.021 1.655 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -8.080 -3.708 0.116 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -8.687 -3.703 3.790 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.952 -2.252 -0.008 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -10.260 -2.175 4.901 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -11.517 -0.714 1.096 1.00 0.00 H new ATOM 0 HH TYR A 145 -11.373 0.106 4.279 1.00 0.00 H new ATOM 2123 N ILE A 146 -7.141 -7.271 1.013 1.00 0.00 N ATOM 2124 CA ILE A 146 -6.186 -8.185 0.395 1.00 0.00 C ATOM 2125 C ILE A 146 -6.845 -9.539 0.090 1.00 0.00 C ATOM 2126 O ILE A 146 -6.256 -10.390 -0.579 1.00 0.00 O ATOM 2127 CB ILE A 146 -4.916 -8.399 1.287 1.00 0.00 C ATOM 2128 CG1 ILE A 146 -4.369 -7.060 1.865 1.00 0.00 C ATOM 2129 CG2 ILE A 146 -3.806 -9.145 0.530 1.00 0.00 C ATOM 2130 CD1 ILE A 146 -4.003 -5.984 0.842 1.00 0.00 C ATOM 0 H ILE A 146 -7.240 -7.391 2.021 1.00 0.00 H new ATOM 0 HA ILE A 146 -5.865 -7.724 -0.539 1.00 0.00 H new ATOM 0 HB ILE A 146 -5.235 -9.019 2.125 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -5.117 -6.648 2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -3.484 -7.280 2.462 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -2.943 -9.273 1.183 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -4.173 -10.123 0.217 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -3.514 -8.569 -0.348 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -3.635 -5.099 1.361 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -3.228 -6.363 0.176 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -4.885 -5.722 0.258 1.00 0.00 H new ATOM 2142 N ALA A 147 -8.068 -9.719 0.586 1.00 0.00 N ATOM 2143 CA ALA A 147 -8.847 -10.930 0.341 1.00 0.00 C ATOM 2144 C ALA A 147 -9.446 -10.925 -1.060 1.00 0.00 C ATOM 2145 O ALA A 147 -9.813 -11.973 -1.599 1.00 0.00 O ATOM 2146 CB ALA A 147 -9.948 -11.060 1.365 1.00 0.00 C ATOM 0 H ALA A 147 -8.545 -9.031 1.168 1.00 0.00 H new ATOM 0 HA ALA A 147 -8.173 -11.783 0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -10.521 -11.967 1.170 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -9.512 -11.113 2.363 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -10.607 -10.194 1.302 1.00 0.00 H new ATOM 2152 N ASN A 148 -9.547 -9.723 -1.621 1.00 0.00 N ATOM 2153 CA ASN A 148 -10.080 -9.505 -2.931 1.00 0.00 C ATOM 2154 C ASN A 148 -8.945 -9.278 -3.903 1.00 0.00 C ATOM 2155 O ASN A 148 -9.132 -8.805 -5.032 1.00 0.00 O ATOM 2156 CB ASN A 148 -11.027 -8.301 -2.892 1.00 0.00 C ATOM 2157 CG ASN A 148 -11.727 -8.134 -1.556 1.00 0.00 C ATOM 2158 OD1 ASN A 148 -12.834 -8.629 -1.345 1.00 0.00 O ATOM 2159 ND2 ASN A 148 -11.066 -7.431 -0.655 1.00 0.00 N ATOM 0 H ASN A 148 -9.250 -8.866 -1.155 1.00 0.00 H new ATOM 0 HA ASN A 148 -10.643 -10.378 -3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -10.462 -7.396 -3.115 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -11.776 -8.411 -3.676 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -11.471 -7.276 0.268 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -10.151 -7.043 -0.882 1.00 0.00 H new ATOM 2166 N ALA A 149 -7.760 -9.640 -3.432 1.00 0.00 N ATOM 2167 CA ALA A 149 -6.559 -9.498 -4.171 1.00 0.00 C ATOM 2168 C ALA A 149 -6.242 -10.743 -5.033 1.00 0.00 C ATOM 2169 O ALA A 149 -6.895 -11.781 -4.886 1.00 0.00 O ATOM 2170 CB ALA A 149 -5.443 -9.178 -3.183 1.00 0.00 C ATOM 0 H ALA A 149 -7.627 -10.046 -2.506 1.00 0.00 H new ATOM 0 HA ALA A 149 -6.664 -8.684 -4.888 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -4.502 -9.062 -3.722 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -5.677 -8.252 -2.658 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.351 -9.991 -2.462 1.00 0.00 H new ATOM 2176 N PRO A 150 -5.241 -10.637 -5.961 1.00 0.00 N ATOM 2177 CA PRO A 150 -4.811 -11.735 -6.862 1.00 0.00 C ATOM 2178 C PRO A 150 -4.419 -13.034 -6.134 1.00 0.00 C ATOM 2179 O PRO A 150 -4.429 -13.096 -4.902 1.00 0.00 O ATOM 2180 CB PRO A 150 -3.600 -11.141 -7.606 1.00 0.00 C ATOM 2181 CG PRO A 150 -3.207 -9.948 -6.817 1.00 0.00 C ATOM 2182 CD PRO A 150 -4.476 -9.415 -6.234 1.00 0.00 C ATOM 0 HA PRO A 150 -5.630 -12.042 -7.513 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -2.783 -11.860 -7.666 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -3.861 -10.869 -8.629 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.497 -10.213 -6.034 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -2.722 -9.203 -7.448 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -4.295 -8.839 -5.327 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.997 -8.758 -6.930 1.00 0.00 H new ATOM 2190 N VAL A 151 -4.051 -14.051 -6.926 1.00 0.00 N ATOM 2191 CA VAL A 151 -3.705 -15.369 -6.427 1.00 0.00 C ATOM 2192 C VAL A 151 -2.208 -15.624 -6.519 1.00 0.00 C ATOM 2193 O VAL A 151 -1.577 -15.418 -7.560 1.00 0.00 O ATOM 2194 CB VAL A 151 -4.453 -16.477 -7.197 1.00 0.00 C ATOM 2195 CG1 VAL A 151 -4.029 -17.868 -6.734 1.00 0.00 C ATOM 2196 CG2 VAL A 151 -5.964 -16.309 -7.072 1.00 0.00 C ATOM 0 H VAL A 151 -3.988 -13.970 -7.941 1.00 0.00 H new ATOM 0 HA VAL A 151 -4.007 -15.395 -5.380 1.00 0.00 H new ATOM 0 HB VAL A 151 -4.182 -16.378 -8.248 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -4.577 -18.622 -7.299 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -2.959 -17.996 -6.900 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -4.247 -17.980 -5.672 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -6.465 -17.104 -7.624 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -6.250 -16.361 -6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -6.258 -15.342 -7.481 1.00 0.00 H new ATOM 2206 N PHE A 152 -1.692 -16.111 -5.411 1.00 0.00 N ATOM 2207 CA PHE A 152 -0.288 -16.469 -5.249 1.00 0.00 C ATOM 2208 C PHE A 152 -0.143 -17.996 -5.344 1.00 0.00 C ATOM 2209 O PHE A 152 -0.390 -18.715 -4.368 1.00 0.00 O ATOM 2210 CB PHE A 152 0.229 -15.917 -3.893 1.00 0.00 C ATOM 2211 CG PHE A 152 1.622 -16.349 -3.508 1.00 0.00 C ATOM 2212 CD1 PHE A 152 1.829 -17.545 -2.847 1.00 0.00 C ATOM 2213 CD2 PHE A 152 2.714 -15.565 -3.820 1.00 0.00 C ATOM 2214 CE1 PHE A 152 3.103 -17.957 -2.508 1.00 0.00 C ATOM 2215 CE2 PHE A 152 3.993 -15.965 -3.483 1.00 0.00 C ATOM 2216 CZ PHE A 152 4.188 -17.164 -2.827 1.00 0.00 C ATOM 0 H PHE A 152 -2.248 -16.276 -4.572 1.00 0.00 H new ATOM 0 HA PHE A 152 0.317 -16.026 -6.040 1.00 0.00 H new ATOM 0 HB2 PHE A 152 0.201 -14.828 -3.929 1.00 0.00 H new ATOM 0 HB3 PHE A 152 -0.460 -16.227 -3.107 1.00 0.00 H new ATOM 0 HD1 PHE A 152 0.983 -18.166 -2.592 1.00 0.00 H new ATOM 0 HD2 PHE A 152 2.567 -14.627 -4.334 1.00 0.00 H new ATOM 0 HE1 PHE A 152 3.250 -18.896 -1.995 1.00 0.00 H new ATOM 0 HE2 PHE A 152 4.838 -15.341 -3.732 1.00 0.00 H new ATOM 0 HZ PHE A 152 5.186 -17.481 -2.564 1.00 0.00 H new ATOM 2226 N ASN A 153 0.247 -18.477 -6.541 1.00 0.00 N ATOM 2227 CA ASN A 153 0.456 -19.920 -6.832 1.00 0.00 C ATOM 2228 C ASN A 153 -0.853 -20.727 -6.849 1.00 0.00 C ATOM 2229 O ASN A 153 -1.022 -21.617 -7.687 1.00 0.00 O ATOM 2230 CB ASN A 153 1.451 -20.562 -5.848 1.00 0.00 C ATOM 2231 CG ASN A 153 2.891 -20.392 -6.288 1.00 0.00 C ATOM 2232 OD1 ASN A 153 3.490 -21.303 -6.861 1.00 0.00 O ATOM 2233 ND2 ASN A 153 3.449 -19.217 -6.035 1.00 0.00 N ATOM 0 H ASN A 153 0.429 -17.874 -7.344 1.00 0.00 H new ATOM 0 HA ASN A 153 0.877 -19.955 -7.837 1.00 0.00 H new ATOM 0 HB2 ASN A 153 1.321 -20.117 -4.862 1.00 0.00 H new ATOM 0 HB3 ASN A 153 1.227 -21.624 -5.750 1.00 0.00 H new ATOM 0 HD21 ASN A 153 4.413 -19.039 -6.318 1.00 0.00 H new ATOM 0 HD22 ASN A 153 2.915 -18.491 -5.558 1.00 0.00 H new ATOM 2240 N GLY A 154 -1.769 -20.398 -5.930 1.00 0.00 N ATOM 2241 CA GLY A 154 -3.040 -21.100 -5.836 1.00 0.00 C ATOM 2242 C GLY A 154 -3.540 -21.176 -4.406 1.00 0.00 C ATOM 2243 O GLY A 154 -3.359 -22.197 -3.735 1.00 0.00 O ATOM 0 H GLY A 154 -1.648 -19.651 -5.246 1.00 0.00 H new ATOM 0 HA2 GLY A 154 -3.781 -20.593 -6.453 1.00 0.00 H new ATOM 0 HA3 GLY A 154 -2.928 -22.108 -6.236 1.00 0.00 H new ATOM 2247 N THR A 155 -4.173 -20.091 -3.949 1.00 0.00 N ATOM 2248 CA THR A 155 -4.700 -19.986 -2.609 1.00 0.00 C ATOM 2249 C THR A 155 -6.149 -20.456 -2.547 1.00 0.00 C ATOM 2250 O THR A 155 -7.072 -19.769 -3.003 1.00 0.00 O ATOM 2251 CB THR A 155 -4.611 -18.530 -2.118 1.00 0.00 C ATOM 2252 OG1 THR A 155 -5.050 -17.631 -3.146 1.00 0.00 O ATOM 2253 CG2 THR A 155 -3.191 -18.178 -1.698 1.00 0.00 C ATOM 0 H THR A 155 -4.329 -19.258 -4.516 1.00 0.00 H new ATOM 0 HA THR A 155 -4.101 -20.628 -1.963 1.00 0.00 H new ATOM 0 HB THR A 155 -5.262 -18.429 -1.249 1.00 0.00 H new ATOM 0 HG1 THR A 155 -5.884 -17.965 -3.539 1.00 0.00 H new ATOM 0 HG21 THR A 155 -3.159 -17.144 -1.356 1.00 0.00 H new ATOM 0 HG22 THR A 155 -2.877 -18.838 -0.889 1.00 0.00 H new ATOM 0 HG23 THR A 155 -2.519 -18.300 -2.548 1.00 0.00 H new ATOM 2261 N THR A 156 -6.320 -21.646 -1.988 1.00 0.00 N ATOM 2262 CA THR A 156 -7.639 -22.260 -1.818 1.00 0.00 C ATOM 2263 C THR A 156 -8.151 -22.044 -0.385 1.00 0.00 C ATOM 2264 O THR A 156 -7.428 -22.362 0.565 1.00 0.00 O ATOM 2265 CB THR A 156 -7.609 -23.776 -2.113 1.00 0.00 C ATOM 2266 OG1 THR A 156 -6.500 -24.389 -1.443 1.00 0.00 O ATOM 2267 CG2 THR A 156 -7.518 -24.042 -3.610 1.00 0.00 C ATOM 0 H THR A 156 -5.551 -22.217 -1.638 1.00 0.00 H new ATOM 0 HA THR A 156 -8.308 -21.779 -2.531 1.00 0.00 H new ATOM 0 HB THR A 156 -8.538 -24.209 -1.743 1.00 0.00 H new ATOM 0 HG1 THR A 156 -6.351 -23.944 -0.583 1.00 0.00 H new ATOM 0 HG21 THR A 156 -7.499 -25.117 -3.788 1.00 0.00 H new ATOM 0 HG22 THR A 156 -8.383 -23.607 -4.110 1.00 0.00 H new ATOM 0 HG23 THR A 156 -6.607 -23.592 -4.005 1.00 0.00 H new ATOM 2275 N PRO A 157 -9.395 -21.495 -0.186 1.00 0.00 N ATOM 2276 CA PRO A 157 -9.943 -21.265 1.152 1.00 0.00 C ATOM 2277 C PRO A 157 -10.565 -22.513 1.776 1.00 0.00 C ATOM 2278 O PRO A 157 -10.346 -22.811 2.955 1.00 0.00 O ATOM 2279 CB PRO A 157 -11.012 -20.175 0.946 1.00 0.00 C ATOM 2280 CG PRO A 157 -11.139 -19.967 -0.533 1.00 0.00 C ATOM 2281 CD PRO A 157 -10.347 -21.050 -1.218 1.00 0.00 C ATOM 0 HA PRO A 157 -9.154 -20.976 1.846 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -11.965 -20.482 1.376 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -10.721 -19.250 1.443 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -12.185 -20.008 -0.836 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -10.764 -18.983 -0.814 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -10.989 -21.866 -1.549 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -9.832 -20.671 -2.101 1.00 0.00 H new ATOM 2289 N THR A 158 -11.329 -23.232 0.959 1.00 0.00 N ATOM 2290 CA THR A 158 -12.020 -24.453 1.368 1.00 0.00 C ATOM 2291 C THR A 158 -12.455 -25.253 0.139 1.00 0.00 C ATOM 2292 O THR A 158 -11.964 -26.357 -0.114 1.00 0.00 O ATOM 2293 CB THR A 158 -13.246 -24.159 2.307 1.00 0.00 C ATOM 2294 OG1 THR A 158 -13.915 -25.377 2.661 1.00 0.00 O ATOM 2295 CG2 THR A 158 -14.264 -23.174 1.711 1.00 0.00 C ATOM 0 H THR A 158 -11.488 -22.981 -0.017 1.00 0.00 H new ATOM 0 HA THR A 158 -11.315 -25.049 1.948 1.00 0.00 H new ATOM 0 HB THR A 158 -12.827 -23.684 3.194 1.00 0.00 H new ATOM 0 HG1 THR A 158 -14.674 -25.175 3.247 1.00 0.00 H new ATOM 0 HG21 THR A 158 -15.080 -23.022 2.417 1.00 0.00 H new ATOM 0 HG22 THR A 158 -13.774 -22.221 1.512 1.00 0.00 H new ATOM 0 HG23 THR A 158 -14.661 -23.579 0.780 1.00 0.00 H new ATOM 2303 N GLU A 159 -13.384 -24.661 -0.602 1.00 0.00 N ATOM 2304 CA GLU A 159 -13.933 -25.243 -1.823 1.00 0.00 C ATOM 2305 C GLU A 159 -13.016 -24.996 -3.026 1.00 0.00 C ATOM 2306 O GLU A 159 -12.779 -23.814 -3.363 1.00 0.00 O ATOM 2307 CB GLU A 159 -15.336 -24.685 -2.102 1.00 0.00 C ATOM 2308 CG GLU A 159 -16.433 -25.292 -1.232 1.00 0.00 C ATOM 2309 CD GLU A 159 -16.930 -26.628 -1.754 1.00 0.00 C ATOM 2310 OE1 GLU A 159 -17.834 -26.630 -2.615 1.00 0.00 O ATOM 2311 OE2 GLU A 159 -16.414 -27.672 -1.302 1.00 0.00 O ATOM 2312 OXT GLU A 159 -12.544 -25.988 -3.620 1.00 0.00 O ATOM 0 H GLU A 159 -13.783 -23.752 -0.370 1.00 0.00 H new ATOM 0 HA GLU A 159 -14.004 -26.320 -1.671 1.00 0.00 H new ATOM 0 HB2 GLU A 159 -15.323 -23.606 -1.950 1.00 0.00 H new ATOM 0 HB3 GLU A 159 -15.582 -24.857 -3.150 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -16.055 -25.422 -0.218 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -17.270 -24.596 -1.174 1.00 0.00 H new TER 2319 GLU A 159 HETATM 2320 ZN ZN A 201 6.574 -0.938 7.409 1.00 0.00 ZN HETATM 2321 O UNL A 202 8.294 0.093 7.821 1.00 0.00 O