USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1089 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 HIS : no HD1:sc= -0.936 K(o=-1.1,f=-0.41) USER MOD Set 1.2: A 110 SER OG : rot 100:sc= -0.208 USER MOD Set 2.1: A 54 THR OG1 : rot 180:sc= -0.298 USER MOD Set 2.2: A 56 SER OG : rot 180:sc= -1.43! USER MOD Set 2.3: A 57 MET CE :methyl 177:sc= -1.81 (180deg=-1.93) USER MOD Set 3.1: A 30 GLN : amide:sc= -0.056 K(o=-1.9,f=-0.52) USER MOD Set 3.2: A 33 ASN : amide:sc= -1.82! K(o=-1.9!,f=-0.52) USER MOD Single : A 1 GLY N :NH3+ -137:sc= 0.0448 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -67:sc= 0.456 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0753 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -1.48 K(o=-1.5,f=-5.4!) USER MOD Single : A 29 GLN : amide:sc= -0.0321 K(o=-0.032,f=-1.3!) USER MOD Single : A 31 HIS : no HD1:sc= 0.304 K(o=0.3,f=-1.9!) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.341 K(o=-0.34,f=-2.3!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0545 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.6!) USER MOD Single : A 42 GLN : amide:sc= -0.0746 K(o=-0.075,f=-1.3!) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.003) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 SER OG : rot 60:sc= 0.0509 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 GLN : amide:sc= -2.12! C(o=-2.1!,f=-2.7!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.044) USER MOD Single : A 69 MET CE :methyl 160:sc= -2.14 (180deg=-2.45!) USER MOD Single : A 79 GLN : amide:sc= -1 K(o=-1,f=-3.3!) USER MOD Single : A 81 MET CE :methyl 170:sc= -1.51 (180deg=-1.57) USER MOD Single : A 82 HIS : no HD1:sc= -4.79! C(o=-4.8!,f=-9!) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -114:sc= 0.455 (180deg=-1.18) USER MOD Single : A 90 THR OG1 : rot -100:sc= -2.71! USER MOD Single : A 92 MET CE :methyl 149:sc= -1.35 (180deg=-3.57!) USER MOD Single : A 98 ASN : amide:sc= -0.573 K(o=-0.57,f=-3.4!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -169:sc= -7.55! (180deg=-8.58!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ -155:sc= -0.0824 (180deg=-0.712) USER MOD Single : A 123 GLN : amide:sc= -0.475 K(o=-0.47,f=-1.6) USER MOD Single : A 125 HIS : no HD1:sc= -2.19 K(o=-2.2,f=-1.6) USER MOD Single : A 126 GLN : amide:sc= -0.348 K(o=-0.35,f=-0.89) USER MOD Single : A 128 LYS NZ :NH3+ -151:sc= -0.384 (180deg=-1.73) USER MOD Single : A 132 GLN : amide:sc= -0.0637 X(o=-0.064,f=-0.46) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.199 -24.171 -4.904 1.00 0.00 N ATOM 2 CA GLY A 1 -8.079 -25.628 -5.183 1.00 0.00 C ATOM 3 C GLY A 1 -9.319 -26.197 -5.851 1.00 0.00 C ATOM 4 O GLY A 1 -10.070 -25.457 -6.487 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.309 -23.695 -5.154 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.975 -23.772 -5.470 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.397 -24.026 -3.893 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.214 -25.802 -5.823 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.897 -26.160 -4.249 1.00 0.00 H new ATOM 10 N PRO A 2 -9.565 -27.516 -5.731 1.00 0.00 N ATOM 11 CA PRO A 2 -8.708 -28.441 -4.978 1.00 0.00 C ATOM 12 C PRO A 2 -7.386 -28.718 -5.688 1.00 0.00 C ATOM 13 O PRO A 2 -6.322 -28.698 -5.068 1.00 0.00 O ATOM 14 CB PRO A 2 -9.540 -29.731 -4.888 1.00 0.00 C ATOM 15 CG PRO A 2 -10.906 -29.365 -5.370 1.00 0.00 C ATOM 16 CD PRO A 2 -10.722 -28.209 -6.307 1.00 0.00 C ATOM 0 HA PRO A 2 -8.435 -28.028 -4.007 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -9.106 -30.520 -5.502 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.573 -30.105 -3.865 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -11.378 -30.206 -5.877 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -11.553 -29.092 -4.536 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -10.530 -28.540 -7.328 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -11.604 -27.569 -6.340 1.00 0.00 H new ATOM 24 N LEU A 3 -7.461 -28.981 -6.988 1.00 0.00 N ATOM 25 CA LEU A 3 -6.269 -29.267 -7.780 1.00 0.00 C ATOM 26 C LEU A 3 -5.765 -28.012 -8.482 1.00 0.00 C ATOM 27 O LEU A 3 -6.553 -27.207 -8.978 1.00 0.00 O ATOM 28 CB LEU A 3 -6.565 -30.360 -8.809 1.00 0.00 C ATOM 29 CG LEU A 3 -6.410 -31.792 -8.294 1.00 0.00 C ATOM 30 CD1 LEU A 3 -7.744 -32.522 -8.336 1.00 0.00 C ATOM 31 CD2 LEU A 3 -5.363 -32.540 -9.106 1.00 0.00 C ATOM 0 H LEU A 3 -8.334 -29.002 -7.516 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.490 -29.617 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.584 -30.229 -9.173 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.902 -30.223 -9.663 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.075 -31.751 -7.258 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.614 -33.539 -7.966 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.466 -31.997 -7.710 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.109 -32.553 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.266 -33.557 -8.726 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -5.668 -32.571 -10.152 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.404 -32.028 -9.023 1.00 0.00 H new ATOM 43 N GLY A 4 -4.446 -27.854 -8.521 1.00 0.00 N ATOM 44 CA GLY A 4 -3.855 -26.693 -9.162 1.00 0.00 C ATOM 45 C GLY A 4 -3.300 -27.006 -10.538 1.00 0.00 C ATOM 46 O GLY A 4 -2.136 -27.382 -10.674 1.00 0.00 O ATOM 0 H GLY A 4 -3.775 -28.509 -8.120 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.606 -25.908 -9.247 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.056 -26.302 -8.532 1.00 0.00 H new ATOM 50 N SER A 5 -4.135 -26.848 -11.561 1.00 0.00 N ATOM 51 CA SER A 5 -3.721 -27.112 -12.934 1.00 0.00 C ATOM 52 C SER A 5 -3.221 -25.835 -13.604 1.00 0.00 C ATOM 53 O SER A 5 -3.681 -25.468 -14.685 1.00 0.00 O ATOM 54 CB SER A 5 -4.885 -27.702 -13.734 1.00 0.00 C ATOM 55 OG SER A 5 -4.416 -28.497 -14.809 1.00 0.00 O ATOM 0 H SER A 5 -5.102 -26.538 -11.464 1.00 0.00 H new ATOM 0 HA SER A 5 -2.904 -27.833 -12.911 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.512 -28.306 -13.078 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.510 -26.897 -14.119 1.00 0.00 H new ATOM 0 HG SER A 5 -5.179 -28.863 -15.303 1.00 0.00 H new ATOM 61 N ALA A 6 -2.278 -25.161 -12.946 1.00 0.00 N ATOM 62 CA ALA A 6 -1.707 -23.918 -13.462 1.00 0.00 C ATOM 63 C ALA A 6 -2.759 -22.814 -13.536 1.00 0.00 C ATOM 64 O ALA A 6 -3.960 -23.085 -13.576 1.00 0.00 O ATOM 65 CB ALA A 6 -1.074 -24.146 -14.828 1.00 0.00 C ATOM 0 H ALA A 6 -1.892 -25.457 -12.050 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.931 -23.594 -12.769 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.655 -23.209 -15.196 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.282 -24.890 -14.742 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -1.832 -24.502 -15.525 1.00 0.00 H new ATOM 71 N ALA A 7 -2.297 -21.568 -13.546 1.00 0.00 N ATOM 72 CA ALA A 7 -3.195 -20.419 -13.610 1.00 0.00 C ATOM 73 C ALA A 7 -2.436 -19.148 -13.973 1.00 0.00 C ATOM 74 O ALA A 7 -2.862 -18.042 -13.638 1.00 0.00 O ATOM 75 CB ALA A 7 -3.921 -20.243 -12.284 1.00 0.00 C ATOM 0 H ALA A 7 -1.306 -21.327 -13.511 1.00 0.00 H new ATOM 0 HA ALA A 7 -3.930 -20.607 -14.392 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -4.587 -19.383 -12.345 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -4.503 -21.138 -12.066 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.193 -20.082 -11.489 1.00 0.00 H new ATOM 81 N ALA A 8 -1.308 -19.317 -14.662 1.00 0.00 N ATOM 82 CA ALA A 8 -0.481 -18.188 -15.076 1.00 0.00 C ATOM 83 C ALA A 8 -0.010 -17.378 -13.869 1.00 0.00 C ATOM 84 O ALA A 8 1.025 -17.683 -13.274 1.00 0.00 O ATOM 85 CB ALA A 8 -1.239 -17.303 -16.056 1.00 0.00 C ATOM 0 H ALA A 8 -0.947 -20.228 -14.945 1.00 0.00 H new ATOM 0 HA ALA A 8 0.402 -18.583 -15.578 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -0.607 -16.466 -16.354 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -1.510 -17.885 -16.937 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.143 -16.924 -15.579 1.00 0.00 H new ATOM 91 N ALA A 9 -0.773 -16.348 -13.510 1.00 0.00 N ATOM 92 CA ALA A 9 -0.428 -15.503 -12.374 1.00 0.00 C ATOM 93 C ALA A 9 -1.498 -15.584 -11.285 1.00 0.00 C ATOM 94 O ALA A 9 -1.473 -16.486 -10.449 1.00 0.00 O ATOM 95 CB ALA A 9 -0.228 -14.064 -12.826 1.00 0.00 C ATOM 0 H ALA A 9 -1.632 -16.080 -13.990 1.00 0.00 H new ATOM 0 HA ALA A 9 0.508 -15.867 -11.950 1.00 0.00 H new ATOM 0 HB1 ALA A 9 0.029 -13.445 -11.966 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.578 -14.021 -13.558 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.148 -13.693 -13.278 1.00 0.00 H new ATOM 101 N THR A 10 -2.435 -14.637 -11.301 1.00 0.00 N ATOM 102 CA THR A 10 -3.509 -14.609 -10.315 1.00 0.00 C ATOM 103 C THR A 10 -4.572 -13.576 -10.691 1.00 0.00 C ATOM 104 O THR A 10 -4.599 -12.472 -10.144 1.00 0.00 O ATOM 105 CB THR A 10 -2.945 -14.302 -8.923 1.00 0.00 C ATOM 106 OG1 THR A 10 -3.984 -13.939 -8.030 1.00 0.00 O ATOM 107 CG2 THR A 10 -1.923 -13.184 -8.919 1.00 0.00 C ATOM 0 H THR A 10 -2.470 -13.881 -11.985 1.00 0.00 H new ATOM 0 HA THR A 10 -3.979 -15.592 -10.299 1.00 0.00 H new ATOM 0 HB THR A 10 -2.452 -15.220 -8.605 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.363 -13.078 -8.302 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.567 -13.021 -7.902 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.083 -13.456 -9.558 1.00 0.00 H new ATOM 0 HG23 THR A 10 -2.383 -12.269 -9.294 1.00 0.00 H new ATOM 115 N PRO A 11 -5.471 -13.924 -11.629 1.00 0.00 N ATOM 116 CA PRO A 11 -6.537 -13.026 -12.072 1.00 0.00 C ATOM 117 C PRO A 11 -7.737 -13.041 -11.130 1.00 0.00 C ATOM 118 O PRO A 11 -8.886 -13.006 -11.572 1.00 0.00 O ATOM 119 CB PRO A 11 -6.917 -13.598 -13.435 1.00 0.00 C ATOM 120 CG PRO A 11 -6.663 -15.062 -13.309 1.00 0.00 C ATOM 121 CD PRO A 11 -5.516 -15.218 -12.340 1.00 0.00 C ATOM 0 HA PRO A 11 -6.217 -11.984 -12.100 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -7.961 -13.395 -13.673 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -6.317 -13.158 -14.231 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -7.551 -15.580 -12.945 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -6.415 -15.497 -14.277 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.685 -16.046 -11.652 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.579 -15.421 -12.859 1.00 0.00 H new ATOM 129 N ALA A 12 -7.462 -13.097 -9.830 1.00 0.00 N ATOM 130 CA ALA A 12 -8.520 -13.124 -8.825 1.00 0.00 C ATOM 131 C ALA A 12 -9.029 -11.719 -8.524 1.00 0.00 C ATOM 132 O ALA A 12 -8.438 -10.992 -7.724 1.00 0.00 O ATOM 133 CB ALA A 12 -8.020 -13.792 -7.553 1.00 0.00 C ATOM 0 H ALA A 12 -6.517 -13.125 -9.448 1.00 0.00 H new ATOM 0 HA ALA A 12 -9.352 -13.704 -9.224 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -8.819 -13.806 -6.811 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -7.713 -14.814 -7.775 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.169 -13.235 -7.160 1.00 0.00 H new ATOM 139 N VAL A 13 -10.129 -11.344 -9.169 1.00 0.00 N ATOM 140 CA VAL A 13 -10.724 -10.027 -8.964 1.00 0.00 C ATOM 141 C VAL A 13 -12.020 -10.135 -8.166 1.00 0.00 C ATOM 142 O VAL A 13 -13.108 -10.211 -8.736 1.00 0.00 O ATOM 143 CB VAL A 13 -11.011 -9.322 -10.304 1.00 0.00 C ATOM 144 CG1 VAL A 13 -11.438 -7.881 -10.070 1.00 0.00 C ATOM 145 CG2 VAL A 13 -9.792 -9.384 -11.213 1.00 0.00 C ATOM 0 H VAL A 13 -10.626 -11.932 -9.837 1.00 0.00 H new ATOM 0 HA VAL A 13 -10.001 -9.434 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 13 -11.831 -9.843 -10.798 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -11.636 -7.400 -11.028 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -12.342 -7.864 -9.461 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.642 -7.345 -9.553 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.014 -8.881 -12.154 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.950 -8.890 -10.727 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.537 -10.425 -11.409 1.00 0.00 H new ATOM 155 N ARG A 14 -11.892 -10.150 -6.842 1.00 0.00 N ATOM 156 CA ARG A 14 -13.051 -10.255 -5.963 1.00 0.00 C ATOM 157 C ARG A 14 -13.872 -8.970 -5.987 1.00 0.00 C ATOM 158 O ARG A 14 -13.323 -7.869 -5.944 1.00 0.00 O ATOM 159 CB ARG A 14 -12.604 -10.561 -4.532 1.00 0.00 C ATOM 160 CG ARG A 14 -13.714 -11.120 -3.656 1.00 0.00 C ATOM 161 CD ARG A 14 -13.173 -12.108 -2.636 1.00 0.00 C ATOM 162 NE ARG A 14 -13.200 -13.480 -3.136 1.00 0.00 N ATOM 163 CZ ARG A 14 -13.255 -14.551 -2.349 1.00 0.00 C ATOM 164 NH1 ARG A 14 -13.292 -14.410 -1.031 1.00 0.00 N ATOM 165 NH2 ARG A 14 -13.275 -15.766 -2.881 1.00 0.00 N ATOM 0 H ARG A 14 -10.998 -10.091 -6.355 1.00 0.00 H new ATOM 0 HA ARG A 14 -13.677 -11.071 -6.325 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.781 -11.275 -4.562 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -12.218 -9.649 -4.077 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -14.219 -10.303 -3.141 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.460 -11.612 -4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -12.150 -11.837 -2.376 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.762 -12.044 -1.721 1.00 0.00 H new ATOM 0 HE ARG A 14 -13.175 -13.625 -4.145 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -13.278 -13.478 -0.617 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.334 -15.234 -0.431 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -13.248 -15.880 -3.894 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -13.317 -16.587 -2.277 1.00 0.00 H new ATOM 179 N THR A 15 -15.192 -9.120 -6.050 1.00 0.00 N ATOM 180 CA THR A 15 -16.091 -7.972 -6.076 1.00 0.00 C ATOM 181 C THR A 15 -16.506 -7.577 -4.663 1.00 0.00 C ATOM 182 O THR A 15 -17.001 -8.403 -3.896 1.00 0.00 O ATOM 183 CB THR A 15 -17.331 -8.289 -6.914 1.00 0.00 C ATOM 184 OG1 THR A 15 -17.481 -9.688 -7.075 1.00 0.00 O ATOM 185 CG2 THR A 15 -17.298 -7.666 -8.292 1.00 0.00 C ATOM 0 H THR A 15 -15.662 -10.025 -6.084 1.00 0.00 H new ATOM 0 HA THR A 15 -15.560 -7.134 -6.528 1.00 0.00 H new ATOM 0 HB THR A 15 -18.170 -7.863 -6.363 1.00 0.00 H new ATOM 0 HG1 THR A 15 -18.280 -9.872 -7.612 1.00 0.00 H new ATOM 0 HG21 THR A 15 -18.207 -7.931 -8.833 1.00 0.00 H new ATOM 0 HG22 THR A 15 -17.233 -6.582 -8.200 1.00 0.00 H new ATOM 0 HG23 THR A 15 -16.430 -8.036 -8.838 1.00 0.00 H new ATOM 193 N VAL A 16 -16.301 -6.306 -4.326 1.00 0.00 N ATOM 194 CA VAL A 16 -16.655 -5.799 -3.005 1.00 0.00 C ATOM 195 C VAL A 16 -17.860 -4.861 -3.082 1.00 0.00 C ATOM 196 O VAL A 16 -17.940 -4.014 -3.971 1.00 0.00 O ATOM 197 CB VAL A 16 -15.476 -5.050 -2.352 1.00 0.00 C ATOM 198 CG1 VAL A 16 -14.567 -6.024 -1.618 1.00 0.00 C ATOM 199 CG2 VAL A 16 -14.695 -4.262 -3.394 1.00 0.00 C ATOM 0 H VAL A 16 -15.892 -5.610 -4.949 1.00 0.00 H new ATOM 0 HA VAL A 16 -16.907 -6.664 -2.392 1.00 0.00 H new ATOM 0 HB VAL A 16 -15.878 -4.344 -1.626 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -13.740 -5.478 -1.163 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -15.134 -6.536 -0.841 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -14.174 -6.757 -2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -13.868 -3.741 -2.912 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -14.304 -4.945 -4.148 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -15.354 -3.535 -3.869 1.00 0.00 H new ATOM 209 N PRO A 17 -18.818 -5.002 -2.146 1.00 0.00 N ATOM 210 CA PRO A 17 -20.021 -4.162 -2.117 1.00 0.00 C ATOM 211 C PRO A 17 -19.700 -2.704 -1.809 1.00 0.00 C ATOM 212 O PRO A 17 -19.128 -2.391 -0.764 1.00 0.00 O ATOM 213 CB PRO A 17 -20.863 -4.775 -0.993 1.00 0.00 C ATOM 214 CG PRO A 17 -19.882 -5.484 -0.125 1.00 0.00 C ATOM 215 CD PRO A 17 -18.806 -5.985 -1.046 1.00 0.00 C ATOM 0 HA PRO A 17 -20.528 -4.145 -3.082 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -21.400 -4.006 -0.437 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -21.610 -5.463 -1.389 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -19.470 -4.813 0.628 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -20.356 -6.309 0.408 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -17.836 -6.022 -0.550 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -19.019 -6.992 -1.404 1.00 0.00 H new ATOM 223 N GLN A 18 -20.070 -1.816 -2.727 1.00 0.00 N ATOM 224 CA GLN A 18 -19.821 -0.389 -2.556 1.00 0.00 C ATOM 225 C GLN A 18 -20.857 0.237 -1.628 1.00 0.00 C ATOM 226 O GLN A 18 -21.935 0.640 -2.067 1.00 0.00 O ATOM 227 CB GLN A 18 -19.840 0.317 -3.913 1.00 0.00 C ATOM 228 CG GLN A 18 -18.515 0.243 -4.657 1.00 0.00 C ATOM 229 CD GLN A 18 -18.585 0.861 -6.041 1.00 0.00 C ATOM 230 OE1 GLN A 18 -19.566 1.517 -6.392 1.00 0.00 O ATOM 231 NE2 GLN A 18 -17.541 0.655 -6.835 1.00 0.00 N ATOM 0 H GLN A 18 -20.543 -2.060 -3.597 1.00 0.00 H new ATOM 0 HA GLN A 18 -18.837 -0.268 -2.104 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -20.620 -0.126 -4.532 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -20.106 1.364 -3.765 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -17.747 0.752 -4.075 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.210 -0.800 -4.744 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -16.749 0.105 -6.503 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -17.531 1.047 -7.777 1.00 0.00 H new ATOM 240 N TYR A 19 -20.522 0.314 -0.344 1.00 0.00 N ATOM 241 CA TYR A 19 -21.422 0.888 0.649 1.00 0.00 C ATOM 242 C TYR A 19 -21.575 2.392 0.441 1.00 0.00 C ATOM 243 O TYR A 19 -20.600 3.140 0.515 1.00 0.00 O ATOM 244 CB TYR A 19 -20.903 0.609 2.061 1.00 0.00 C ATOM 245 CG TYR A 19 -21.560 -0.579 2.726 1.00 0.00 C ATOM 246 CD1 TYR A 19 -22.736 -0.430 3.453 1.00 0.00 C ATOM 247 CD2 TYR A 19 -21.005 -1.848 2.629 1.00 0.00 C ATOM 248 CE1 TYR A 19 -23.339 -1.514 4.062 1.00 0.00 C ATOM 249 CE2 TYR A 19 -21.602 -2.937 3.236 1.00 0.00 C ATOM 250 CZ TYR A 19 -22.769 -2.765 3.950 1.00 0.00 C ATOM 251 OH TYR A 19 -23.366 -3.846 4.557 1.00 0.00 O ATOM 0 H TYR A 19 -19.633 -0.014 0.033 1.00 0.00 H new ATOM 0 HA TYR A 19 -22.399 0.421 0.529 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -19.827 0.440 2.016 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -21.062 1.493 2.678 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -23.185 0.548 3.543 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -20.091 -1.987 2.070 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -24.252 -1.382 4.623 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -21.157 -3.917 3.151 1.00 0.00 H new ATOM 0 HH TYR A 19 -22.839 -4.653 4.380 1.00 0.00 H new ATOM 261 N LYS A 20 -22.804 2.826 0.180 1.00 0.00 N ATOM 262 CA LYS A 20 -23.084 4.240 -0.042 1.00 0.00 C ATOM 263 C LYS A 20 -23.588 4.903 1.238 1.00 0.00 C ATOM 264 O LYS A 20 -24.514 5.713 1.207 1.00 0.00 O ATOM 265 CB LYS A 20 -24.115 4.408 -1.160 1.00 0.00 C ATOM 266 CG LYS A 20 -23.591 4.025 -2.534 1.00 0.00 C ATOM 267 CD LYS A 20 -23.030 5.228 -3.273 1.00 0.00 C ATOM 268 CE LYS A 20 -21.587 5.003 -3.692 1.00 0.00 C ATOM 269 NZ LYS A 20 -21.475 4.654 -5.136 1.00 0.00 N ATOM 0 H LYS A 20 -23.621 2.219 0.117 1.00 0.00 H new ATOM 0 HA LYS A 20 -22.155 4.727 -0.339 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -24.989 3.799 -0.931 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -24.447 5.446 -1.183 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -22.815 3.267 -2.430 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -24.395 3.580 -3.120 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -23.638 5.430 -4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -23.091 6.109 -2.634 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -21.006 5.903 -3.490 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -21.155 4.203 -3.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -20.475 4.509 -5.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -22.008 3.781 -5.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -21.864 5.428 -5.711 1.00 0.00 H new ATOM 283 N TYR A 21 -22.968 4.555 2.362 1.00 0.00 N ATOM 284 CA TYR A 21 -23.350 5.118 3.651 1.00 0.00 C ATOM 285 C TYR A 21 -22.584 6.408 3.929 1.00 0.00 C ATOM 286 O TYR A 21 -22.522 6.872 5.068 1.00 0.00 O ATOM 287 CB TYR A 21 -23.091 4.106 4.769 1.00 0.00 C ATOM 288 CG TYR A 21 -24.353 3.583 5.417 1.00 0.00 C ATOM 289 CD1 TYR A 21 -25.073 2.544 4.841 1.00 0.00 C ATOM 290 CD2 TYR A 21 -24.827 4.130 6.603 1.00 0.00 C ATOM 291 CE1 TYR A 21 -26.228 2.064 5.428 1.00 0.00 C ATOM 292 CE2 TYR A 21 -25.981 3.656 7.196 1.00 0.00 C ATOM 293 CZ TYR A 21 -26.677 2.623 6.605 1.00 0.00 C ATOM 294 OH TYR A 21 -27.827 2.148 7.193 1.00 0.00 O ATOM 0 H TYR A 21 -22.199 3.886 2.405 1.00 0.00 H new ATOM 0 HA TYR A 21 -24.415 5.349 3.618 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -22.526 3.267 4.364 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -22.467 4.572 5.532 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -24.724 2.104 3.919 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -24.284 4.939 7.069 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -26.776 1.255 4.967 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -26.336 4.092 8.118 1.00 0.00 H new ATOM 0 HH TYR A 21 -28.004 2.649 8.016 1.00 0.00 H new ATOM 304 N ALA A 22 -22.002 6.980 2.879 1.00 0.00 N ATOM 305 CA ALA A 22 -21.241 8.218 3.006 1.00 0.00 C ATOM 306 C ALA A 22 -22.170 9.417 3.161 1.00 0.00 C ATOM 307 O ALA A 22 -23.376 9.261 3.352 1.00 0.00 O ATOM 308 CB ALA A 22 -20.332 8.402 1.801 1.00 0.00 C ATOM 0 H ALA A 22 -22.043 6.606 1.931 1.00 0.00 H new ATOM 0 HA ALA A 22 -20.626 8.150 3.903 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -19.769 9.330 1.908 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -19.639 7.563 1.736 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -20.935 8.446 0.894 1.00 0.00 H new ATOM 314 N ALA A 23 -21.600 10.615 3.074 1.00 0.00 N ATOM 315 CA ALA A 23 -22.375 11.843 3.204 1.00 0.00 C ATOM 316 C ALA A 23 -22.951 12.272 1.856 1.00 0.00 C ATOM 317 O ALA A 23 -22.750 13.403 1.414 1.00 0.00 O ATOM 318 CB ALA A 23 -21.515 12.951 3.793 1.00 0.00 C ATOM 0 H ALA A 23 -20.603 10.761 2.914 1.00 0.00 H new ATOM 0 HA ALA A 23 -23.208 11.650 3.880 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -22.107 13.862 3.884 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -21.158 12.650 4.778 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -20.663 13.136 3.139 1.00 0.00 H new ATOM 324 N GLY A 24 -23.667 11.358 1.209 1.00 0.00 N ATOM 325 CA GLY A 24 -24.262 11.659 -0.081 1.00 0.00 C ATOM 326 C GLY A 24 -25.596 12.366 0.047 1.00 0.00 C ATOM 327 O GLY A 24 -26.640 11.802 -0.284 1.00 0.00 O ATOM 0 H GLY A 24 -23.846 10.415 1.554 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -23.578 12.282 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -24.397 10.733 -0.640 1.00 0.00 H new ATOM 331 N VAL A 25 -25.563 13.603 0.533 1.00 0.00 N ATOM 332 CA VAL A 25 -26.779 14.390 0.707 1.00 0.00 C ATOM 333 C VAL A 25 -26.823 15.555 -0.277 1.00 0.00 C ATOM 334 O VAL A 25 -27.858 16.200 -0.444 1.00 0.00 O ATOM 335 CB VAL A 25 -26.906 14.942 2.142 1.00 0.00 C ATOM 336 CG1 VAL A 25 -28.002 14.208 2.901 1.00 0.00 C ATOM 337 CG2 VAL A 25 -25.579 14.844 2.882 1.00 0.00 C ATOM 0 H VAL A 25 -24.707 14.082 0.813 1.00 0.00 H new ATOM 0 HA VAL A 25 -27.615 13.717 0.515 1.00 0.00 H new ATOM 0 HB VAL A 25 -27.178 15.996 2.078 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -28.077 14.611 3.911 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -28.953 14.341 2.386 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -27.762 13.146 2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -25.695 15.240 3.891 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -25.268 13.801 2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -24.823 15.422 2.351 1.00 0.00 H new ATOM 347 N ARG A 26 -25.693 15.817 -0.928 1.00 0.00 N ATOM 348 CA ARG A 26 -25.604 16.902 -1.898 1.00 0.00 C ATOM 349 C ARG A 26 -26.122 16.457 -3.261 1.00 0.00 C ATOM 350 O ARG A 26 -26.405 17.283 -4.129 1.00 0.00 O ATOM 351 CB ARG A 26 -24.156 17.383 -2.025 1.00 0.00 C ATOM 352 CG ARG A 26 -23.650 18.121 -0.796 1.00 0.00 C ATOM 353 CD ARG A 26 -22.526 19.082 -1.147 1.00 0.00 C ATOM 354 NE ARG A 26 -21.360 18.900 -0.287 1.00 0.00 N ATOM 355 CZ ARG A 26 -20.435 17.965 -0.482 1.00 0.00 C ATOM 356 NH1 ARG A 26 -20.540 17.126 -1.505 1.00 0.00 N ATOM 357 NH2 ARG A 26 -19.404 17.865 0.346 1.00 0.00 N ATOM 0 H ARG A 26 -24.827 15.293 -0.801 1.00 0.00 H new ATOM 0 HA ARG A 26 -26.225 17.724 -1.543 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -23.512 16.524 -2.214 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -24.075 18.039 -2.892 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -24.471 18.672 -0.337 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -23.297 17.401 -0.057 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -22.235 18.935 -2.187 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -22.885 20.107 -1.058 1.00 0.00 H new ATOM 0 HE ARG A 26 -21.249 19.527 0.510 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -21.332 17.198 -2.144 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -19.829 16.410 -1.652 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -19.319 18.506 1.135 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -18.696 17.147 0.194 1.00 0.00 H new ATOM 371 N ASN A 27 -26.245 15.145 -3.442 1.00 0.00 N ATOM 372 CA ASN A 27 -26.729 14.589 -4.700 1.00 0.00 C ATOM 373 C ASN A 27 -28.223 14.276 -4.620 1.00 0.00 C ATOM 374 O ASN A 27 -28.704 13.786 -3.598 1.00 0.00 O ATOM 375 CB ASN A 27 -25.949 13.321 -5.053 1.00 0.00 C ATOM 376 CG ASN A 27 -25.443 13.332 -6.482 1.00 0.00 C ATOM 377 OD1 ASN A 27 -25.070 14.378 -7.013 1.00 0.00 O ATOM 378 ND2 ASN A 27 -25.430 12.164 -7.113 1.00 0.00 N ATOM 0 H ASN A 27 -26.016 14.448 -2.733 1.00 0.00 H new ATOM 0 HA ASN A 27 -26.574 15.333 -5.481 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -25.104 13.216 -4.372 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -26.589 12.451 -4.904 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -25.102 12.109 -8.077 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -25.748 11.322 -6.634 1.00 0.00 H new ATOM 385 N PRO A 28 -28.984 14.554 -5.699 1.00 0.00 N ATOM 386 CA PRO A 28 -28.457 15.132 -6.943 1.00 0.00 C ATOM 387 C PRO A 28 -28.070 16.598 -6.780 1.00 0.00 C ATOM 388 O PRO A 28 -28.607 17.302 -5.924 1.00 0.00 O ATOM 389 CB PRO A 28 -29.623 14.999 -7.937 1.00 0.00 C ATOM 390 CG PRO A 28 -30.628 14.119 -7.266 1.00 0.00 C ATOM 391 CD PRO A 28 -30.426 14.308 -5.793 1.00 0.00 C ATOM 0 HA PRO A 28 -27.548 14.625 -7.266 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -30.051 15.974 -8.172 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -29.287 14.563 -8.878 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -31.642 14.391 -7.559 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -30.484 13.076 -7.549 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -31.007 15.146 -5.408 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -30.725 13.426 -5.226 1.00 0.00 H new ATOM 399 N GLN A 29 -27.131 17.053 -7.604 1.00 0.00 N ATOM 400 CA GLN A 29 -26.669 18.434 -7.548 1.00 0.00 C ATOM 401 C GLN A 29 -27.442 19.309 -8.529 1.00 0.00 C ATOM 402 O GLN A 29 -28.357 20.036 -8.139 1.00 0.00 O ATOM 403 CB GLN A 29 -25.171 18.504 -7.851 1.00 0.00 C ATOM 404 CG GLN A 29 -24.323 17.651 -6.922 1.00 0.00 C ATOM 405 CD GLN A 29 -22.905 17.471 -7.427 1.00 0.00 C ATOM 406 OE1 GLN A 29 -22.653 17.504 -8.632 1.00 0.00 O ATOM 407 NE2 GLN A 29 -21.968 17.280 -6.506 1.00 0.00 N ATOM 0 H GLN A 29 -26.676 16.485 -8.318 1.00 0.00 H new ATOM 0 HA GLN A 29 -26.847 18.810 -6.540 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -25.001 18.185 -8.879 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -24.842 19.541 -7.780 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -24.297 18.112 -5.934 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -24.790 16.673 -6.805 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -22.221 17.260 -5.518 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -20.995 17.154 -6.786 1.00 0.00 H new ATOM 416 N GLN A 30 -27.067 19.237 -9.802 1.00 0.00 N ATOM 417 CA GLN A 30 -27.727 20.024 -10.838 1.00 0.00 C ATOM 418 C GLN A 30 -28.734 19.178 -11.609 1.00 0.00 C ATOM 419 O GLN A 30 -28.357 18.299 -12.384 1.00 0.00 O ATOM 420 CB GLN A 30 -26.689 20.607 -11.800 1.00 0.00 C ATOM 421 CG GLN A 30 -26.876 22.092 -12.066 1.00 0.00 C ATOM 422 CD GLN A 30 -25.679 22.916 -11.638 1.00 0.00 C ATOM 423 OE1 GLN A 30 -25.085 22.671 -10.587 1.00 0.00 O ATOM 424 NE2 GLN A 30 -25.316 23.901 -12.452 1.00 0.00 N ATOM 0 H GLN A 30 -26.311 18.643 -10.141 1.00 0.00 H new ATOM 0 HA GLN A 30 -28.264 20.839 -10.353 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -25.692 20.442 -11.390 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -26.738 20.067 -12.746 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -27.057 22.247 -13.130 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -27.762 22.443 -11.537 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -25.836 24.069 -13.313 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -24.517 24.489 -12.216 1.00 0.00 H new ATOM 433 N HIS A 31 -30.017 19.453 -11.393 1.00 0.00 N ATOM 434 CA HIS A 31 -31.081 18.722 -12.072 1.00 0.00 C ATOM 435 C HIS A 31 -31.641 19.537 -13.234 1.00 0.00 C ATOM 436 O HIS A 31 -32.661 19.179 -13.821 1.00 0.00 O ATOM 437 CB HIS A 31 -32.202 18.379 -11.089 1.00 0.00 C ATOM 438 CG HIS A 31 -32.783 19.575 -10.401 1.00 0.00 C ATOM 439 ND1 HIS A 31 -32.105 20.222 -9.394 1.00 0.00 N ATOM 440 CD2 HIS A 31 -33.969 20.198 -10.610 1.00 0.00 C ATOM 441 CE1 HIS A 31 -32.887 21.217 -9.014 1.00 0.00 C ATOM 442 NE2 HIS A 31 -34.026 21.241 -9.722 1.00 0.00 N ATOM 0 H HIS A 31 -30.345 20.177 -10.753 1.00 0.00 H new ATOM 0 HA HIS A 31 -30.659 17.798 -12.467 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -32.995 17.857 -11.624 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -31.817 17.690 -10.338 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -34.722 19.926 -11.335 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -32.641 21.921 -8.233 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -34.790 21.909 -9.619 1.00 0.00 H new ATOM 450 N LEU A 32 -30.964 20.634 -13.560 1.00 0.00 N ATOM 451 CA LEU A 32 -31.393 21.504 -14.649 1.00 0.00 C ATOM 452 C LEU A 32 -30.625 21.193 -15.929 1.00 0.00 C ATOM 453 O LEU A 32 -31.164 20.587 -16.857 1.00 0.00 O ATOM 454 CB LEU A 32 -31.192 22.971 -14.266 1.00 0.00 C ATOM 455 CG LEU A 32 -32.187 23.947 -14.898 1.00 0.00 C ATOM 456 CD1 LEU A 32 -32.401 25.148 -13.989 1.00 0.00 C ATOM 457 CD2 LEU A 32 -31.700 24.394 -16.268 1.00 0.00 C ATOM 0 H LEU A 32 -30.115 20.941 -13.085 1.00 0.00 H new ATOM 0 HA LEU A 32 -32.453 21.323 -14.829 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -31.258 23.060 -13.182 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -30.183 23.270 -14.550 1.00 0.00 H new ATOM 0 HG LEU A 32 -33.141 23.435 -15.024 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -33.111 25.833 -14.452 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -32.794 24.812 -13.029 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -31.452 25.660 -13.833 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -32.420 25.088 -16.702 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -30.735 24.890 -16.167 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -31.596 23.525 -16.918 1.00 0.00 H new ATOM 469 N ASN A 33 -29.364 21.613 -15.973 1.00 0.00 N ATOM 470 CA ASN A 33 -28.519 21.382 -17.139 1.00 0.00 C ATOM 471 C ASN A 33 -27.501 20.279 -16.861 1.00 0.00 C ATOM 472 O ASN A 33 -26.298 20.471 -17.038 1.00 0.00 O ATOM 473 CB ASN A 33 -27.798 22.672 -17.538 1.00 0.00 C ATOM 474 CG ASN A 33 -27.460 23.542 -16.342 1.00 0.00 C ATOM 475 OD1 ASN A 33 -26.463 23.317 -15.658 1.00 0.00 O ATOM 476 ND2 ASN A 33 -28.293 24.544 -16.085 1.00 0.00 N ATOM 0 H ASN A 33 -28.905 22.116 -15.213 1.00 0.00 H new ATOM 0 HA ASN A 33 -29.157 21.064 -17.963 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -26.881 22.422 -18.072 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -28.425 23.236 -18.228 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -28.117 25.163 -15.294 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -29.109 24.694 -16.679 1.00 0.00 H new ATOM 483 N ALA A 34 -27.994 19.123 -16.426 1.00 0.00 N ATOM 484 CA ALA A 34 -27.130 17.988 -16.123 1.00 0.00 C ATOM 485 C ALA A 34 -26.612 17.338 -17.402 1.00 0.00 C ATOM 486 O ALA A 34 -26.744 17.896 -18.491 1.00 0.00 O ATOM 487 CB ALA A 34 -27.876 16.971 -15.274 1.00 0.00 C ATOM 0 H ALA A 34 -28.988 18.948 -16.276 1.00 0.00 H new ATOM 0 HA ALA A 34 -26.271 18.354 -15.560 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -27.220 16.129 -15.055 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -28.192 17.438 -14.341 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -28.752 16.617 -15.817 1.00 0.00 H new ATOM 493 N GLN A 35 -26.020 16.156 -17.261 1.00 0.00 N ATOM 494 CA GLN A 35 -25.482 15.427 -18.403 1.00 0.00 C ATOM 495 C GLN A 35 -26.370 14.235 -18.758 1.00 0.00 C ATOM 496 O GLN A 35 -26.247 13.164 -18.165 1.00 0.00 O ATOM 497 CB GLN A 35 -24.061 14.947 -18.103 1.00 0.00 C ATOM 498 CG GLN A 35 -23.141 16.045 -17.595 1.00 0.00 C ATOM 499 CD GLN A 35 -22.731 17.014 -18.685 1.00 0.00 C ATOM 500 OE1 GLN A 35 -22.032 16.644 -19.630 1.00 0.00 O ATOM 501 NE2 GLN A 35 -23.164 18.263 -18.562 1.00 0.00 N ATOM 0 H GLN A 35 -25.901 15.683 -16.365 1.00 0.00 H new ATOM 0 HA GLN A 35 -25.458 16.105 -19.256 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -24.105 14.150 -17.361 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -23.633 14.517 -19.009 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -23.642 16.593 -16.797 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -22.249 15.594 -17.161 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -23.741 18.526 -17.763 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -22.920 18.959 -19.266 1.00 0.00 H new ATOM 510 N PRO A 36 -27.281 14.405 -19.736 1.00 0.00 N ATOM 511 CA PRO A 36 -28.189 13.334 -20.160 1.00 0.00 C ATOM 512 C PRO A 36 -27.467 12.232 -20.928 1.00 0.00 C ATOM 513 O PRO A 36 -28.038 11.177 -21.201 1.00 0.00 O ATOM 514 CB PRO A 36 -29.187 14.055 -21.068 1.00 0.00 C ATOM 515 CG PRO A 36 -28.437 15.228 -21.597 1.00 0.00 C ATOM 516 CD PRO A 36 -27.500 15.650 -20.499 1.00 0.00 C ATOM 0 HA PRO A 36 -28.652 12.831 -19.311 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -29.529 13.407 -21.875 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -30.072 14.368 -20.514 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -27.886 14.964 -22.500 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -29.116 16.038 -21.863 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -26.566 16.046 -20.898 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -27.937 16.431 -19.876 1.00 0.00 H new ATOM 524 N GLN A 37 -26.208 12.485 -21.274 1.00 0.00 N ATOM 525 CA GLN A 37 -25.407 11.517 -22.014 1.00 0.00 C ATOM 526 C GLN A 37 -24.534 10.694 -21.071 1.00 0.00 C ATOM 527 O GLN A 37 -23.407 11.079 -20.758 1.00 0.00 O ATOM 528 CB GLN A 37 -24.532 12.230 -23.047 1.00 0.00 C ATOM 529 CG GLN A 37 -25.317 13.103 -24.012 1.00 0.00 C ATOM 530 CD GLN A 37 -25.389 12.512 -25.407 1.00 0.00 C ATOM 531 OE1 GLN A 37 -24.565 11.681 -25.786 1.00 0.00 O ATOM 532 NE2 GLN A 37 -26.379 12.944 -26.180 1.00 0.00 N ATOM 0 H GLN A 37 -25.721 13.353 -21.053 1.00 0.00 H new ATOM 0 HA GLN A 37 -26.088 10.840 -22.530 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -23.799 12.847 -22.526 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -23.975 11.485 -23.615 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -26.328 13.244 -23.629 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -24.855 14.089 -24.063 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -27.040 13.635 -25.824 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -26.478 12.585 -27.130 1.00 0.00 H new ATOM 541 N VAL A 38 -25.063 9.560 -20.622 1.00 0.00 N ATOM 542 CA VAL A 38 -24.334 8.682 -19.715 1.00 0.00 C ATOM 543 C VAL A 38 -23.482 7.679 -20.488 1.00 0.00 C ATOM 544 O VAL A 38 -22.821 6.825 -19.896 1.00 0.00 O ATOM 545 CB VAL A 38 -25.290 7.915 -18.783 1.00 0.00 C ATOM 546 CG1 VAL A 38 -25.871 8.847 -17.731 1.00 0.00 C ATOM 547 CG2 VAL A 38 -26.396 7.243 -19.582 1.00 0.00 C ATOM 0 H VAL A 38 -25.994 9.228 -20.872 1.00 0.00 H new ATOM 0 HA VAL A 38 -23.686 9.319 -19.112 1.00 0.00 H new ATOM 0 HB VAL A 38 -24.722 7.137 -18.273 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -26.544 8.288 -17.081 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -25.063 9.273 -17.136 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -26.423 9.649 -18.221 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -27.060 6.707 -18.904 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -26.964 7.999 -20.124 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -25.957 6.541 -20.291 1.00 0.00 H new ATOM 557 N THR A 39 -23.502 7.788 -21.813 1.00 0.00 N ATOM 558 CA THR A 39 -22.732 6.890 -22.667 1.00 0.00 C ATOM 559 C THR A 39 -21.338 7.453 -22.930 1.00 0.00 C ATOM 560 O THR A 39 -20.701 7.120 -23.930 1.00 0.00 O ATOM 561 CB THR A 39 -23.462 6.663 -23.992 1.00 0.00 C ATOM 562 OG1 THR A 39 -24.696 7.359 -24.010 1.00 0.00 O ATOM 563 CG2 THR A 39 -23.749 5.205 -24.276 1.00 0.00 C ATOM 0 H THR A 39 -24.043 8.489 -22.319 1.00 0.00 H new ATOM 0 HA THR A 39 -22.627 5.936 -22.150 1.00 0.00 H new ATOM 0 HB THR A 39 -22.787 7.038 -24.762 1.00 0.00 H new ATOM 0 HG1 THR A 39 -25.147 7.203 -24.866 1.00 0.00 H new ATOM 0 HG21 THR A 39 -24.268 5.116 -25.230 1.00 0.00 H new ATOM 0 HG22 THR A 39 -22.811 4.651 -24.320 1.00 0.00 H new ATOM 0 HG23 THR A 39 -24.375 4.796 -23.483 1.00 0.00 H new ATOM 571 N MET A 40 -20.872 8.307 -22.025 1.00 0.00 N ATOM 572 CA MET A 40 -19.553 8.917 -22.157 1.00 0.00 C ATOM 573 C MET A 40 -18.521 8.174 -21.317 1.00 0.00 C ATOM 574 O MET A 40 -18.794 7.095 -20.790 1.00 0.00 O ATOM 575 CB MET A 40 -19.606 10.387 -21.734 1.00 0.00 C ATOM 576 CG MET A 40 -18.858 11.317 -22.676 1.00 0.00 C ATOM 577 SD MET A 40 -19.710 11.545 -24.248 1.00 0.00 S ATOM 578 CE MET A 40 -19.107 13.163 -24.728 1.00 0.00 C ATOM 0 H MET A 40 -21.387 8.593 -21.192 1.00 0.00 H new ATOM 0 HA MET A 40 -19.255 8.854 -23.204 1.00 0.00 H new ATOM 0 HB2 MET A 40 -20.648 10.703 -21.676 1.00 0.00 H new ATOM 0 HB3 MET A 40 -19.187 10.484 -20.732 1.00 0.00 H new ATOM 0 HG2 MET A 40 -18.726 12.286 -22.195 1.00 0.00 H new ATOM 0 HG3 MET A 40 -17.862 10.915 -22.862 1.00 0.00 H new ATOM 0 HE1 MET A 40 -19.546 13.446 -25.685 1.00 0.00 H new ATOM 0 HE2 MET A 40 -19.387 13.895 -23.970 1.00 0.00 H new ATOM 0 HE3 MET A 40 -18.021 13.134 -24.821 1.00 0.00 H new ATOM 588 N GLN A 41 -17.333 8.760 -21.195 1.00 0.00 N ATOM 589 CA GLN A 41 -16.257 8.156 -20.417 1.00 0.00 C ATOM 590 C GLN A 41 -16.510 8.320 -18.921 1.00 0.00 C ATOM 591 O GLN A 41 -17.646 8.530 -18.494 1.00 0.00 O ATOM 592 CB GLN A 41 -14.914 8.786 -20.797 1.00 0.00 C ATOM 593 CG GLN A 41 -14.718 8.945 -22.295 1.00 0.00 C ATOM 594 CD GLN A 41 -14.021 7.754 -22.924 1.00 0.00 C ATOM 595 OE1 GLN A 41 -13.213 7.082 -22.282 1.00 0.00 O ATOM 596 NE2 GLN A 41 -14.331 7.486 -24.187 1.00 0.00 N ATOM 0 H GLN A 41 -17.092 9.653 -21.625 1.00 0.00 H new ATOM 0 HA GLN A 41 -16.227 7.090 -20.644 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -14.834 9.764 -20.323 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -14.108 8.171 -20.397 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -15.688 9.086 -22.771 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -14.135 9.845 -22.487 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -15.006 8.069 -24.681 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -13.894 6.697 -24.663 1.00 0.00 H new ATOM 605 N GLN A 42 -15.447 8.220 -18.128 1.00 0.00 N ATOM 606 CA GLN A 42 -15.560 8.352 -16.679 1.00 0.00 C ATOM 607 C GLN A 42 -14.684 9.493 -16.161 1.00 0.00 C ATOM 608 O GLN A 42 -13.583 9.261 -15.662 1.00 0.00 O ATOM 609 CB GLN A 42 -15.166 7.041 -15.995 1.00 0.00 C ATOM 610 CG GLN A 42 -16.305 6.040 -15.894 1.00 0.00 C ATOM 611 CD GLN A 42 -16.056 4.975 -14.843 1.00 0.00 C ATOM 612 OE1 GLN A 42 -15.412 5.230 -13.825 1.00 0.00 O ATOM 613 NE2 GLN A 42 -16.568 3.774 -15.084 1.00 0.00 N ATOM 0 H GLN A 42 -14.499 8.048 -18.464 1.00 0.00 H new ATOM 0 HA GLN A 42 -16.599 8.582 -16.442 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -14.342 6.587 -16.546 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -14.797 7.260 -14.993 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -17.228 6.569 -15.658 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -16.450 5.562 -16.863 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -17.095 3.607 -15.941 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -16.434 3.018 -14.412 1.00 0.00 H new ATOM 622 N PRO A 43 -15.165 10.746 -16.270 1.00 0.00 N ATOM 623 CA PRO A 43 -14.418 11.919 -15.802 1.00 0.00 C ATOM 624 C PRO A 43 -14.330 11.976 -14.281 1.00 0.00 C ATOM 625 O PRO A 43 -15.155 12.610 -13.623 1.00 0.00 O ATOM 626 CB PRO A 43 -15.234 13.098 -16.337 1.00 0.00 C ATOM 627 CG PRO A 43 -16.619 12.566 -16.479 1.00 0.00 C ATOM 628 CD PRO A 43 -16.470 11.117 -16.851 1.00 0.00 C ATOM 0 HA PRO A 43 -13.384 11.910 -16.148 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.203 13.945 -15.651 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -14.844 13.448 -17.293 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -17.176 12.675 -15.548 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -17.170 13.111 -17.246 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -17.279 10.512 -16.441 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.483 10.976 -17.932 1.00 0.00 H new ATOM 636 N ALA A 44 -13.325 11.305 -13.728 1.00 0.00 N ATOM 637 CA ALA A 44 -13.131 11.270 -12.283 1.00 0.00 C ATOM 638 C ALA A 44 -12.313 12.467 -11.807 1.00 0.00 C ATOM 639 O ALA A 44 -11.420 12.330 -10.971 1.00 0.00 O ATOM 640 CB ALA A 44 -12.458 9.968 -11.874 1.00 0.00 C ATOM 0 H ALA A 44 -12.632 10.778 -14.259 1.00 0.00 H new ATOM 0 HA ALA A 44 -14.110 11.325 -11.808 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.319 9.954 -10.793 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.084 9.126 -12.170 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -11.488 9.890 -12.366 1.00 0.00 H new ATOM 646 N VAL A 45 -12.629 13.643 -12.341 1.00 0.00 N ATOM 647 CA VAL A 45 -11.927 14.865 -11.973 1.00 0.00 C ATOM 648 C VAL A 45 -12.611 15.559 -10.798 1.00 0.00 C ATOM 649 O VAL A 45 -12.214 16.652 -10.394 1.00 0.00 O ATOM 650 CB VAL A 45 -11.847 15.843 -13.158 1.00 0.00 C ATOM 651 CG1 VAL A 45 -10.935 15.296 -14.244 1.00 0.00 C ATOM 652 CG2 VAL A 45 -13.235 16.130 -13.711 1.00 0.00 C ATOM 0 H VAL A 45 -13.368 13.774 -13.031 1.00 0.00 H new ATOM 0 HA VAL A 45 -10.917 14.576 -11.682 1.00 0.00 H new ATOM 0 HB VAL A 45 -11.423 16.781 -12.800 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -10.892 16.002 -15.073 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -9.934 15.150 -13.839 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.325 14.342 -14.600 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -13.157 16.824 -14.548 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -13.690 15.200 -14.051 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -13.854 16.572 -12.930 1.00 0.00 H new ATOM 662 N HIS A 46 -13.642 14.917 -10.257 1.00 0.00 N ATOM 663 CA HIS A 46 -14.386 15.474 -9.133 1.00 0.00 C ATOM 664 C HIS A 46 -13.911 14.877 -7.813 1.00 0.00 C ATOM 665 O HIS A 46 -14.586 14.990 -6.790 1.00 0.00 O ATOM 666 CB HIS A 46 -15.885 15.220 -9.309 1.00 0.00 C ATOM 667 CG HIS A 46 -16.358 15.368 -10.722 1.00 0.00 C ATOM 668 ND1 HIS A 46 -16.372 16.592 -11.348 1.00 0.00 N ATOM 669 CD2 HIS A 46 -16.822 14.426 -11.579 1.00 0.00 C ATOM 670 CE1 HIS A 46 -16.840 16.371 -12.564 1.00 0.00 C ATOM 671 NE2 HIS A 46 -17.125 15.074 -12.749 1.00 0.00 N ATOM 0 H HIS A 46 -13.981 14.011 -10.579 1.00 0.00 H new ATOM 0 HA HIS A 46 -14.206 16.549 -9.110 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -16.117 14.214 -8.961 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -16.439 15.913 -8.675 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -16.932 13.370 -11.379 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -16.976 17.137 -13.313 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -17.497 14.650 -13.599 1.00 0.00 H new ATOM 679 N VAL A 47 -12.743 14.241 -7.841 1.00 0.00 N ATOM 680 CA VAL A 47 -12.180 13.623 -6.646 1.00 0.00 C ATOM 681 C VAL A 47 -11.200 14.564 -5.950 1.00 0.00 C ATOM 682 O VAL A 47 -10.487 15.327 -6.602 1.00 0.00 O ATOM 683 CB VAL A 47 -11.465 12.298 -6.981 1.00 0.00 C ATOM 684 CG1 VAL A 47 -10.254 12.548 -7.868 1.00 0.00 C ATOM 685 CG2 VAL A 47 -11.064 11.567 -5.709 1.00 0.00 C ATOM 0 H VAL A 47 -12.169 14.141 -8.678 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.012 13.413 -5.974 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.161 11.664 -7.531 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.765 11.600 -8.092 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.575 13.019 -8.797 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.554 13.204 -7.351 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -10.561 10.635 -5.968 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.389 12.194 -5.127 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.954 11.347 -5.120 1.00 0.00 H new ATOM 695 N GLN A 48 -11.175 14.506 -4.622 1.00 0.00 N ATOM 696 CA GLN A 48 -10.284 15.352 -3.835 1.00 0.00 C ATOM 697 C GLN A 48 -8.891 14.736 -3.745 1.00 0.00 C ATOM 698 O GLN A 48 -8.725 13.526 -3.900 1.00 0.00 O ATOM 699 CB GLN A 48 -10.851 15.563 -2.430 1.00 0.00 C ATOM 700 CG GLN A 48 -12.358 15.765 -2.403 1.00 0.00 C ATOM 701 CD GLN A 48 -12.884 16.032 -1.006 1.00 0.00 C ATOM 702 OE1 GLN A 48 -12.620 15.271 -0.075 1.00 0.00 O ATOM 703 NE2 GLN A 48 -13.630 17.119 -0.852 1.00 0.00 N ATOM 0 H GLN A 48 -11.762 13.882 -4.068 1.00 0.00 H new ATOM 0 HA GLN A 48 -10.206 16.317 -4.335 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -10.598 14.701 -1.812 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -10.369 16.431 -1.980 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -12.621 16.600 -3.052 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -12.847 14.879 -2.809 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -13.824 17.722 -1.652 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -14.009 17.351 0.066 1.00 0.00 H new ATOM 712 N GLY A 49 -7.894 15.579 -3.492 1.00 0.00 N ATOM 713 CA GLY A 49 -6.527 15.102 -3.384 1.00 0.00 C ATOM 714 C GLY A 49 -6.230 14.498 -2.026 1.00 0.00 C ATOM 715 O GLY A 49 -6.043 15.219 -1.045 1.00 0.00 O ATOM 0 H GLY A 49 -8.009 16.584 -3.360 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.343 14.357 -4.158 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.841 15.929 -3.568 1.00 0.00 H new ATOM 719 N GLN A 50 -6.188 13.170 -1.967 1.00 0.00 N ATOM 720 CA GLN A 50 -5.910 12.468 -0.719 1.00 0.00 C ATOM 721 C GLN A 50 -4.502 11.881 -0.727 1.00 0.00 C ATOM 722 O GLN A 50 -4.288 10.761 -1.192 1.00 0.00 O ATOM 723 CB GLN A 50 -6.938 11.356 -0.490 1.00 0.00 C ATOM 724 CG GLN A 50 -7.409 10.685 -1.771 1.00 0.00 C ATOM 725 CD GLN A 50 -7.920 9.276 -1.538 1.00 0.00 C ATOM 726 OE1 GLN A 50 -7.141 8.330 -1.435 1.00 0.00 O ATOM 727 NE2 GLN A 50 -9.238 9.131 -1.453 1.00 0.00 N ATOM 0 H GLN A 50 -6.343 12.559 -2.769 1.00 0.00 H new ATOM 0 HA GLN A 50 -5.980 13.189 0.096 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.504 10.602 0.166 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -7.801 11.772 0.030 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -8.200 11.285 -2.221 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.586 10.656 -2.485 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -9.847 9.944 -1.544 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -9.640 8.207 -1.296 1.00 0.00 H new ATOM 736 N GLU A 51 -3.547 12.646 -0.211 1.00 0.00 N ATOM 737 CA GLU A 51 -2.158 12.206 -0.159 1.00 0.00 C ATOM 738 C GLU A 51 -1.893 11.380 1.099 1.00 0.00 C ATOM 739 O GLU A 51 -1.973 11.896 2.214 1.00 0.00 O ATOM 740 CB GLU A 51 -1.218 13.412 -0.196 1.00 0.00 C ATOM 741 CG GLU A 51 -1.105 14.053 -1.569 1.00 0.00 C ATOM 742 CD GLU A 51 0.023 15.063 -1.649 1.00 0.00 C ATOM 743 OE1 GLU A 51 0.170 15.866 -0.704 1.00 0.00 O ATOM 744 OE2 GLU A 51 0.758 15.053 -2.660 1.00 0.00 O ATOM 0 H GLU A 51 -3.709 13.575 0.178 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.970 11.579 -1.030 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.570 14.158 0.516 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.227 13.100 0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.946 13.276 -2.317 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.046 14.545 -1.815 1.00 0.00 H new ATOM 751 N PRO A 52 -1.571 10.084 0.937 1.00 0.00 N ATOM 752 CA PRO A 52 -1.302 9.192 2.066 1.00 0.00 C ATOM 753 C PRO A 52 0.122 9.331 2.594 1.00 0.00 C ATOM 754 O PRO A 52 0.981 9.931 1.946 1.00 0.00 O ATOM 755 CB PRO A 52 -1.513 7.808 1.459 1.00 0.00 C ATOM 756 CG PRO A 52 -1.112 7.963 0.033 1.00 0.00 C ATOM 757 CD PRO A 52 -1.459 9.379 -0.357 1.00 0.00 C ATOM 0 HA PRO A 52 -1.939 9.407 2.924 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.905 7.056 1.963 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -2.552 7.490 1.547 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.046 7.776 -0.093 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -1.638 7.247 -0.598 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.687 9.821 -0.988 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -2.393 9.422 -0.918 1.00 0.00 H new ATOM 765 N LEU A 53 0.365 8.766 3.773 1.00 0.00 N ATOM 766 CA LEU A 53 1.686 8.814 4.390 1.00 0.00 C ATOM 767 C LEU A 53 2.513 7.599 3.986 1.00 0.00 C ATOM 768 O LEU A 53 1.969 6.527 3.722 1.00 0.00 O ATOM 769 CB LEU A 53 1.554 8.865 5.914 1.00 0.00 C ATOM 770 CG LEU A 53 2.488 9.849 6.621 1.00 0.00 C ATOM 771 CD1 LEU A 53 1.688 10.952 7.295 1.00 0.00 C ATOM 772 CD2 LEU A 53 3.353 9.123 7.640 1.00 0.00 C ATOM 0 H LEU A 53 -0.337 8.269 4.321 1.00 0.00 H new ATOM 0 HA LEU A 53 2.193 9.714 4.042 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.525 9.123 6.164 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.738 7.867 6.311 1.00 0.00 H new ATOM 0 HG LEU A 53 3.140 10.302 5.874 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.368 11.643 7.793 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.108 11.491 6.546 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.013 10.514 8.030 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.011 9.838 8.134 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.715 8.644 8.383 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.953 8.366 7.135 1.00 0.00 H new ATOM 784 N THR A 54 3.830 7.775 3.931 1.00 0.00 N ATOM 785 CA THR A 54 4.734 6.690 3.574 1.00 0.00 C ATOM 786 C THR A 54 6.176 7.084 3.860 1.00 0.00 C ATOM 787 O THR A 54 6.430 8.083 4.530 1.00 0.00 O ATOM 788 CB THR A 54 4.575 6.310 2.100 1.00 0.00 C ATOM 789 OG1 THR A 54 3.740 7.238 1.427 1.00 0.00 O ATOM 790 CG2 THR A 54 3.987 4.929 1.901 1.00 0.00 C ATOM 0 H THR A 54 4.294 8.661 4.130 1.00 0.00 H new ATOM 0 HA THR A 54 4.478 5.823 4.183 1.00 0.00 H new ATOM 0 HB THR A 54 5.584 6.321 1.687 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.653 6.977 0.486 1.00 0.00 H new ATOM 0 HG21 THR A 54 3.900 4.721 0.835 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.637 4.187 2.364 1.00 0.00 H new ATOM 0 HG23 THR A 54 3.000 4.884 2.361 1.00 0.00 H new ATOM 798 N ALA A 55 7.114 6.297 3.346 1.00 0.00 N ATOM 799 CA ALA A 55 8.532 6.546 3.573 1.00 0.00 C ATOM 800 C ALA A 55 8.922 7.977 3.214 1.00 0.00 C ATOM 801 O ALA A 55 9.667 8.624 3.949 1.00 0.00 O ATOM 802 CB ALA A 55 9.370 5.557 2.787 1.00 0.00 C ATOM 0 H ALA A 55 6.917 5.480 2.768 1.00 0.00 H new ATOM 0 HA ALA A 55 8.725 6.412 4.637 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.427 5.754 2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.131 4.543 3.106 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.155 5.663 1.724 1.00 0.00 H new ATOM 808 N SER A 56 8.430 8.461 2.076 1.00 0.00 N ATOM 809 CA SER A 56 8.736 9.818 1.631 1.00 0.00 C ATOM 810 C SER A 56 8.311 10.839 2.680 1.00 0.00 C ATOM 811 O SER A 56 9.100 11.693 3.087 1.00 0.00 O ATOM 812 CB SER A 56 8.039 10.114 0.302 1.00 0.00 C ATOM 813 OG SER A 56 7.753 8.920 -0.404 1.00 0.00 O ATOM 0 H SER A 56 7.821 7.937 1.448 1.00 0.00 H new ATOM 0 HA SER A 56 9.814 9.893 1.489 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.114 10.660 0.487 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.673 10.758 -0.308 1.00 0.00 H new ATOM 0 HG SER A 56 7.306 9.138 -1.248 1.00 0.00 H new ATOM 819 N MET A 57 7.062 10.735 3.122 1.00 0.00 N ATOM 820 CA MET A 57 6.531 11.635 4.138 1.00 0.00 C ATOM 821 C MET A 57 7.372 11.555 5.404 1.00 0.00 C ATOM 822 O MET A 57 7.623 12.561 6.067 1.00 0.00 O ATOM 823 CB MET A 57 5.081 11.267 4.463 1.00 0.00 C ATOM 824 CG MET A 57 4.067 11.712 3.417 1.00 0.00 C ATOM 825 SD MET A 57 4.805 12.070 1.810 1.00 0.00 S ATOM 826 CE MET A 57 4.598 10.494 0.983 1.00 0.00 C ATOM 0 H MET A 57 6.398 10.035 2.791 1.00 0.00 H new ATOM 0 HA MET A 57 6.565 12.653 3.750 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.012 10.186 4.581 1.00 0.00 H new ATOM 0 HB3 MET A 57 4.813 11.710 5.422 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.314 10.933 3.297 1.00 0.00 H new ATOM 0 HG3 MET A 57 3.551 12.602 3.778 1.00 0.00 H new ATOM 0 HE1 MET A 57 4.958 10.571 -0.043 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.167 9.729 1.511 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.542 10.222 0.977 1.00 0.00 H new ATOM 836 N LEU A 58 7.803 10.342 5.726 1.00 0.00 N ATOM 837 CA LEU A 58 8.621 10.098 6.904 1.00 0.00 C ATOM 838 C LEU A 58 9.965 10.805 6.793 1.00 0.00 C ATOM 839 O LEU A 58 10.452 11.394 7.758 1.00 0.00 O ATOM 840 CB LEU A 58 8.842 8.596 7.069 1.00 0.00 C ATOM 841 CG LEU A 58 7.566 7.768 7.209 1.00 0.00 C ATOM 842 CD1 LEU A 58 7.832 6.320 6.827 1.00 0.00 C ATOM 843 CD2 LEU A 58 7.017 7.869 8.623 1.00 0.00 C ATOM 0 H LEU A 58 7.596 9.505 5.181 1.00 0.00 H new ATOM 0 HA LEU A 58 8.098 10.493 7.775 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.402 8.230 6.209 1.00 0.00 H new ATOM 0 HB3 LEU A 58 9.464 8.430 7.949 1.00 0.00 H new ATOM 0 HG LEU A 58 6.814 8.166 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.914 5.742 6.932 1.00 0.00 H new ATOM 0 HD12 LEU A 58 8.175 6.273 5.793 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.598 5.906 7.482 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.108 7.273 8.704 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.759 7.497 9.329 1.00 0.00 H new ATOM 0 HD23 LEU A 58 6.789 8.910 8.851 1.00 0.00 H new ATOM 855 N ALA A 59 10.563 10.729 5.610 1.00 0.00 N ATOM 856 CA ALA A 59 11.856 11.354 5.361 1.00 0.00 C ATOM 857 C ALA A 59 11.764 12.871 5.484 1.00 0.00 C ATOM 858 O ALA A 59 12.780 13.558 5.594 1.00 0.00 O ATOM 859 CB ALA A 59 12.375 10.964 3.984 1.00 0.00 C ATOM 0 H ALA A 59 10.171 10.239 4.806 1.00 0.00 H new ATOM 0 HA ALA A 59 12.557 10.996 6.115 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.341 11.438 3.812 1.00 0.00 H new ATOM 0 HB2 ALA A 59 12.487 9.881 3.931 1.00 0.00 H new ATOM 0 HB3 ALA A 59 11.668 11.293 3.222 1.00 0.00 H new ATOM 865 N SER A 60 10.539 13.386 5.465 1.00 0.00 N ATOM 866 CA SER A 60 10.311 14.822 5.580 1.00 0.00 C ATOM 867 C SER A 60 10.545 15.297 7.011 1.00 0.00 C ATOM 868 O SER A 60 10.535 16.496 7.287 1.00 0.00 O ATOM 869 CB SER A 60 8.887 15.171 5.144 1.00 0.00 C ATOM 870 OG SER A 60 8.674 14.839 3.783 1.00 0.00 O ATOM 0 H SER A 60 9.689 12.830 5.371 1.00 0.00 H new ATOM 0 HA SER A 60 11.020 15.330 4.925 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.171 14.636 5.768 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.708 16.236 5.294 1.00 0.00 H new ATOM 0 HG SER A 60 8.822 13.879 3.653 1.00 0.00 H new ATOM 876 N ALA A 61 10.763 14.347 7.916 1.00 0.00 N ATOM 877 CA ALA A 61 11.000 14.664 9.319 1.00 0.00 C ATOM 878 C ALA A 61 12.201 13.888 9.862 1.00 0.00 C ATOM 879 O ALA A 61 12.061 13.090 10.790 1.00 0.00 O ATOM 880 CB ALA A 61 9.754 14.362 10.139 1.00 0.00 C ATOM 0 H ALA A 61 10.780 13.350 7.701 1.00 0.00 H new ATOM 0 HA ALA A 61 11.226 15.727 9.398 1.00 0.00 H new ATOM 0 HB1 ALA A 61 9.940 14.602 11.186 1.00 0.00 H new ATOM 0 HB2 ALA A 61 8.922 14.963 9.772 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.506 13.305 10.048 1.00 0.00 H new ATOM 886 N PRO A 62 13.404 14.114 9.297 1.00 0.00 N ATOM 887 CA PRO A 62 14.620 13.408 9.718 1.00 0.00 C ATOM 888 C PRO A 62 14.918 13.555 11.218 1.00 0.00 C ATOM 889 O PRO A 62 15.088 12.552 11.911 1.00 0.00 O ATOM 890 CB PRO A 62 15.729 14.035 8.867 1.00 0.00 C ATOM 891 CG PRO A 62 15.023 14.607 7.684 1.00 0.00 C ATOM 892 CD PRO A 62 13.667 15.035 8.173 1.00 0.00 C ATOM 0 HA PRO A 62 14.523 12.332 9.572 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.264 14.807 9.420 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.466 13.290 8.566 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.574 15.453 7.273 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.935 13.868 6.888 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.667 16.076 8.497 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.911 14.944 7.393 1.00 0.00 H new ATOM 900 N PRO A 63 14.975 14.795 11.757 1.00 0.00 N ATOM 901 CA PRO A 63 15.270 15.024 13.163 1.00 0.00 C ATOM 902 C PRO A 63 14.014 15.250 13.998 1.00 0.00 C ATOM 903 O PRO A 63 14.067 15.884 15.052 1.00 0.00 O ATOM 904 CB PRO A 63 16.099 16.301 13.099 1.00 0.00 C ATOM 905 CG PRO A 63 15.524 17.072 11.949 1.00 0.00 C ATOM 906 CD PRO A 63 14.809 16.080 11.056 1.00 0.00 C ATOM 0 HA PRO A 63 15.764 14.175 13.635 1.00 0.00 H new ATOM 0 HB2 PRO A 63 16.029 16.866 14.029 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.154 16.080 12.939 1.00 0.00 H new ATOM 0 HG2 PRO A 63 14.833 17.836 12.305 1.00 0.00 H new ATOM 0 HG3 PRO A 63 16.312 17.586 11.399 1.00 0.00 H new ATOM 0 HD2 PRO A 63 13.757 16.337 10.935 1.00 0.00 H new ATOM 0 HD3 PRO A 63 15.247 16.051 10.058 1.00 0.00 H new ATOM 914 N GLN A 64 12.882 14.744 13.518 1.00 0.00 N ATOM 915 CA GLN A 64 11.617 14.924 14.217 1.00 0.00 C ATOM 916 C GLN A 64 10.880 13.597 14.406 1.00 0.00 C ATOM 917 O GLN A 64 11.116 12.884 15.382 1.00 0.00 O ATOM 918 CB GLN A 64 10.734 15.920 13.459 1.00 0.00 C ATOM 919 CG GLN A 64 9.639 16.539 14.313 1.00 0.00 C ATOM 920 CD GLN A 64 9.832 18.030 14.518 1.00 0.00 C ATOM 921 OE1 GLN A 64 10.109 18.485 15.628 1.00 0.00 O ATOM 922 NE2 GLN A 64 9.687 18.798 13.444 1.00 0.00 N ATOM 0 H GLN A 64 12.816 14.209 12.652 1.00 0.00 H new ATOM 0 HA GLN A 64 11.838 15.321 15.208 1.00 0.00 H new ATOM 0 HB2 GLN A 64 11.362 16.715 13.056 1.00 0.00 H new ATOM 0 HB3 GLN A 64 10.277 15.413 12.609 1.00 0.00 H new ATOM 0 HG2 GLN A 64 8.672 16.363 13.841 1.00 0.00 H new ATOM 0 HG3 GLN A 64 9.616 16.043 15.283 1.00 0.00 H new ATOM 0 HE21 GLN A 64 9.457 18.377 12.544 1.00 0.00 H new ATOM 0 HE22 GLN A 64 9.806 19.808 13.520 1.00 0.00 H new ATOM 931 N GLU A 65 9.966 13.286 13.489 1.00 0.00 N ATOM 932 CA GLU A 65 9.165 12.070 13.591 1.00 0.00 C ATOM 933 C GLU A 65 9.593 11.018 12.569 1.00 0.00 C ATOM 934 O GLU A 65 8.759 10.287 12.035 1.00 0.00 O ATOM 935 CB GLU A 65 7.681 12.397 13.401 1.00 0.00 C ATOM 936 CG GLU A 65 7.332 13.853 13.673 1.00 0.00 C ATOM 937 CD GLU A 65 6.448 14.025 14.892 1.00 0.00 C ATOM 938 OE1 GLU A 65 5.276 13.595 14.842 1.00 0.00 O ATOM 939 OE2 GLU A 65 6.926 14.592 15.898 1.00 0.00 O ATOM 0 H GLU A 65 9.763 13.858 12.669 1.00 0.00 H new ATOM 0 HA GLU A 65 9.327 11.657 14.587 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.392 12.149 12.380 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.091 11.762 14.062 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.251 14.423 13.812 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.827 14.270 12.802 1.00 0.00 H new ATOM 946 N GLN A 66 10.894 10.926 12.314 1.00 0.00 N ATOM 947 CA GLN A 66 11.413 9.945 11.365 1.00 0.00 C ATOM 948 C GLN A 66 11.206 8.529 11.883 1.00 0.00 C ATOM 949 O GLN A 66 11.173 7.571 11.110 1.00 0.00 O ATOM 950 CB GLN A 66 12.898 10.182 11.108 1.00 0.00 C ATOM 951 CG GLN A 66 13.232 10.333 9.636 1.00 0.00 C ATOM 952 CD GLN A 66 14.647 9.892 9.310 1.00 0.00 C ATOM 953 OE1 GLN A 66 15.172 8.955 9.911 1.00 0.00 O ATOM 954 NE2 GLN A 66 15.272 10.569 8.353 1.00 0.00 N ATOM 0 H GLN A 66 11.605 11.514 12.748 1.00 0.00 H new ATOM 0 HA GLN A 66 10.865 10.062 10.430 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.214 11.080 11.640 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.469 9.350 11.520 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.528 9.747 9.046 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.104 11.375 9.343 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.799 11.339 7.881 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.225 10.319 8.090 1.00 0.00 H new ATOM 963 N LYS A 67 11.081 8.406 13.197 1.00 0.00 N ATOM 964 CA LYS A 67 10.877 7.108 13.833 1.00 0.00 C ATOM 965 C LYS A 67 9.693 7.155 14.796 1.00 0.00 C ATOM 966 O LYS A 67 9.644 6.404 15.771 1.00 0.00 O ATOM 967 CB LYS A 67 12.141 6.673 14.579 1.00 0.00 C ATOM 968 CG LYS A 67 13.431 7.108 13.902 1.00 0.00 C ATOM 969 CD LYS A 67 14.038 8.321 14.586 1.00 0.00 C ATOM 970 CE LYS A 67 15.556 8.267 14.574 1.00 0.00 C ATOM 971 NZ LYS A 67 16.163 9.572 14.957 1.00 0.00 N ATOM 0 H LYS A 67 11.117 9.191 13.847 1.00 0.00 H new ATOM 0 HA LYS A 67 10.659 6.380 13.052 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.115 7.082 15.589 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.140 5.587 14.675 1.00 0.00 H new ATOM 0 HG2 LYS A 67 14.146 6.285 13.916 1.00 0.00 H new ATOM 0 HG3 LYS A 67 13.233 7.340 12.856 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.701 9.229 14.085 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.683 8.375 15.615 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.897 7.493 15.261 1.00 0.00 H new ATOM 0 HE3 LYS A 67 15.901 7.984 13.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 17.200 9.492 14.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 15.859 10.306 14.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.855 9.830 15.916 1.00 0.00 H new ATOM 985 N GLN A 68 8.731 8.029 14.507 1.00 0.00 N ATOM 986 CA GLN A 68 7.559 8.180 15.361 1.00 0.00 C ATOM 987 C GLN A 68 6.259 8.180 14.554 1.00 0.00 C ATOM 988 O GLN A 68 5.352 7.395 14.828 1.00 0.00 O ATOM 989 CB GLN A 68 7.669 9.478 16.162 1.00 0.00 C ATOM 990 CG GLN A 68 6.577 9.649 17.204 1.00 0.00 C ATOM 991 CD GLN A 68 7.127 9.743 18.614 1.00 0.00 C ATOM 992 OE1 GLN A 68 6.648 9.068 19.525 1.00 0.00 O ATOM 993 NE2 GLN A 68 8.139 10.582 18.799 1.00 0.00 N ATOM 0 H GLN A 68 8.741 8.640 13.691 1.00 0.00 H new ATOM 0 HA GLN A 68 7.529 7.325 16.037 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.639 9.507 16.658 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.637 10.323 15.474 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.004 10.549 16.981 1.00 0.00 H new ATOM 0 HG3 GLN A 68 5.886 8.808 17.143 1.00 0.00 H new ATOM 0 HE21 GLN A 68 8.504 11.122 18.014 1.00 0.00 H new ATOM 0 HE22 GLN A 68 8.552 10.687 19.726 1.00 0.00 H new ATOM 1002 N MET A 69 6.170 9.074 13.570 1.00 0.00 N ATOM 1003 CA MET A 69 4.958 9.213 12.759 1.00 0.00 C ATOM 1004 C MET A 69 4.809 8.084 11.738 1.00 0.00 C ATOM 1005 O MET A 69 4.056 8.208 10.772 1.00 0.00 O ATOM 1006 CB MET A 69 4.967 10.564 12.040 1.00 0.00 C ATOM 1007 CG MET A 69 5.948 10.636 10.882 1.00 0.00 C ATOM 1008 SD MET A 69 5.263 11.478 9.444 1.00 0.00 S ATOM 1009 CE MET A 69 6.644 12.514 8.969 1.00 0.00 C ATOM 0 H MET A 69 6.922 9.714 13.314 1.00 0.00 H new ATOM 0 HA MET A 69 4.105 9.155 13.435 1.00 0.00 H new ATOM 0 HB2 MET A 69 3.964 10.774 11.668 1.00 0.00 H new ATOM 0 HB3 MET A 69 5.210 11.346 12.759 1.00 0.00 H new ATOM 0 HG2 MET A 69 6.850 11.155 11.207 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.245 9.626 10.599 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.528 12.820 7.929 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.672 13.398 9.607 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.573 11.956 9.082 1.00 0.00 H new ATOM 1019 N LEU A 70 5.526 6.989 11.953 1.00 0.00 N ATOM 1020 CA LEU A 70 5.464 5.839 11.054 1.00 0.00 C ATOM 1021 C LEU A 70 4.369 4.884 11.490 1.00 0.00 C ATOM 1022 O LEU A 70 3.749 4.208 10.671 1.00 0.00 O ATOM 1023 CB LEU A 70 6.807 5.104 11.028 1.00 0.00 C ATOM 1024 CG LEU A 70 7.812 5.573 12.077 1.00 0.00 C ATOM 1025 CD1 LEU A 70 8.948 4.574 12.224 1.00 0.00 C ATOM 1026 CD2 LEU A 70 8.335 6.949 11.709 1.00 0.00 C ATOM 0 H LEU A 70 6.160 6.871 12.744 1.00 0.00 H new ATOM 0 HA LEU A 70 5.240 6.204 10.052 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.625 4.039 11.170 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.252 5.223 10.040 1.00 0.00 H new ATOM 0 HG LEU A 70 7.310 5.640 13.042 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.651 4.931 12.977 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.546 3.608 12.531 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.463 4.466 11.269 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.052 7.279 12.461 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.825 6.904 10.736 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.505 7.654 11.665 1.00 0.00 H new ATOM 1038 N GLY A 71 4.152 4.820 12.795 1.00 0.00 N ATOM 1039 CA GLY A 71 3.131 3.952 13.328 1.00 0.00 C ATOM 1040 C GLY A 71 2.280 4.648 14.367 1.00 0.00 C ATOM 1041 O GLY A 71 1.495 4.007 15.066 1.00 0.00 O ATOM 0 H GLY A 71 4.667 5.356 13.493 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.495 3.599 12.516 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.598 3.073 13.772 1.00 0.00 H new ATOM 1045 N GLU A 72 2.422 5.969 14.461 1.00 0.00 N ATOM 1046 CA GLU A 72 1.665 6.740 15.441 1.00 0.00 C ATOM 1047 C GLU A 72 0.955 7.933 14.805 1.00 0.00 C ATOM 1048 O GLU A 72 0.143 8.596 15.451 1.00 0.00 O ATOM 1049 CB GLU A 72 2.594 7.206 16.568 1.00 0.00 C ATOM 1050 CG GLU A 72 3.084 8.641 16.424 1.00 0.00 C ATOM 1051 CD GLU A 72 2.511 9.563 17.482 1.00 0.00 C ATOM 1052 OE1 GLU A 72 1.358 9.337 17.907 1.00 0.00 O ATOM 1053 OE2 GLU A 72 3.215 10.513 17.886 1.00 0.00 O ATOM 0 H GLU A 72 3.048 6.522 13.876 1.00 0.00 H new ATOM 0 HA GLU A 72 0.894 6.090 15.854 1.00 0.00 H new ATOM 0 HB2 GLU A 72 2.070 7.107 17.519 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.457 6.542 16.609 1.00 0.00 H new ATOM 0 HG2 GLU A 72 4.172 8.657 16.485 1.00 0.00 H new ATOM 0 HG3 GLU A 72 2.814 9.016 15.437 1.00 0.00 H new ATOM 1060 N ARG A 73 1.256 8.200 13.540 1.00 0.00 N ATOM 1061 CA ARG A 73 0.635 9.314 12.833 1.00 0.00 C ATOM 1062 C ARG A 73 0.021 8.851 11.519 1.00 0.00 C ATOM 1063 O ARG A 73 -0.777 9.564 10.911 1.00 0.00 O ATOM 1064 CB ARG A 73 1.658 10.419 12.569 1.00 0.00 C ATOM 1065 CG ARG A 73 1.056 11.815 12.552 1.00 0.00 C ATOM 1066 CD ARG A 73 0.785 12.286 11.134 1.00 0.00 C ATOM 1067 NE ARG A 73 -0.027 13.501 11.106 1.00 0.00 N ATOM 1068 CZ ARG A 73 0.217 14.533 10.306 1.00 0.00 C ATOM 1069 NH1 ARG A 73 1.248 14.503 9.470 1.00 0.00 N ATOM 1070 NH2 ARG A 73 -0.570 15.601 10.340 1.00 0.00 N ATOM 0 H ARG A 73 1.923 7.664 12.985 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.159 9.710 13.466 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.433 10.376 13.335 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.145 10.231 11.612 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.127 11.819 13.122 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.735 12.511 13.045 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.732 12.471 10.626 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.276 11.497 10.581 1.00 0.00 H new ATOM 0 HE ARG A 73 -0.827 13.560 11.737 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.857 13.685 9.440 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.431 15.298 8.858 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.363 15.630 10.981 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.382 16.393 9.725 1.00 0.00 H new ATOM 1084 N LEU A 74 0.384 7.646 11.092 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.136 7.092 9.853 1.00 0.00 C ATOM 1086 C LEU A 74 -1.555 6.575 10.027 1.00 0.00 C ATOM 1087 O LEU A 74 -2.218 6.234 9.050 1.00 0.00 O ATOM 1088 CB LEU A 74 0.752 5.955 9.369 1.00 0.00 C ATOM 1089 CG LEU A 74 1.562 6.273 8.130 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.954 5.687 8.255 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.852 5.755 6.890 1.00 0.00 C ATOM 0 H LEU A 74 1.036 7.037 11.587 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.145 7.895 9.115 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.435 5.677 10.172 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.128 5.085 9.166 1.00 0.00 H new ATOM 0 HG LEU A 74 1.658 7.354 8.032 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.529 5.921 7.359 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.451 6.113 9.127 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.884 4.605 8.369 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.445 5.990 6.006 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.728 4.675 6.967 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.127 6.228 6.807 1.00 0.00 H new ATOM 1103 N PHE A 75 -2.003 6.493 11.274 1.00 0.00 N ATOM 1104 CA PHE A 75 -3.336 5.976 11.570 1.00 0.00 C ATOM 1105 C PHE A 75 -4.408 6.636 10.692 1.00 0.00 C ATOM 1106 O PHE A 75 -5.157 5.940 10.007 1.00 0.00 O ATOM 1107 CB PHE A 75 -3.674 6.156 13.054 1.00 0.00 C ATOM 1108 CG PHE A 75 -5.095 5.805 13.391 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -5.691 4.670 12.859 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -5.840 6.615 14.235 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -7.003 4.356 13.158 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -7.150 6.299 14.544 1.00 0.00 C ATOM 1113 CZ PHE A 75 -7.731 5.167 14.006 1.00 0.00 C ATOM 0 H PHE A 75 -1.467 6.776 12.094 1.00 0.00 H new ATOM 0 HA PHE A 75 -3.329 4.910 11.341 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -3.004 5.536 13.649 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.486 7.191 13.338 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -5.123 4.025 12.204 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.392 7.503 14.656 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.459 3.476 12.728 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.718 6.936 15.205 1.00 0.00 H new ATOM 0 HZ PHE A 75 -8.753 4.917 14.248 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.508 7.983 10.693 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.510 8.692 9.885 1.00 0.00 C ATOM 1125 C PRO A 76 -5.315 8.457 8.391 1.00 0.00 C ATOM 1126 O PRO A 76 -6.162 8.830 7.579 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.282 10.170 10.229 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.517 10.160 11.507 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.676 8.919 11.468 1.00 0.00 C ATOM 0 HA PRO A 76 -6.521 8.347 10.102 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.725 10.676 9.441 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.229 10.699 10.341 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.896 11.051 11.598 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.189 10.151 12.365 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.714 9.098 10.988 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.467 8.541 12.469 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.192 7.841 8.035 1.00 0.00 N ATOM 1138 CA LEU A 77 -3.878 7.568 6.637 1.00 0.00 C ATOM 1139 C LEU A 77 -4.220 6.129 6.255 1.00 0.00 C ATOM 1140 O LEU A 77 -4.505 5.844 5.092 1.00 0.00 O ATOM 1141 CB LEU A 77 -2.395 7.838 6.360 1.00 0.00 C ATOM 1142 CG LEU A 77 -1.976 9.310 6.382 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -3.010 10.189 5.689 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -1.755 9.763 7.812 1.00 0.00 C ATOM 0 H LEU A 77 -3.484 7.521 8.696 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.488 8.236 6.028 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.802 7.299 7.098 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.144 7.422 5.384 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.040 9.410 5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.684 11.229 5.721 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.118 9.874 4.651 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.969 10.094 6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.457 10.811 7.820 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.679 9.644 8.378 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.970 9.159 8.268 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.173 5.220 7.227 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.468 3.816 6.957 1.00 0.00 C ATOM 1158 C ILE A 78 -5.947 3.609 6.670 1.00 0.00 C ATOM 1159 O ILE A 78 -6.313 2.843 5.782 1.00 0.00 O ATOM 1160 CB ILE A 78 -4.055 2.893 8.113 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.708 3.323 8.696 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -3.991 1.454 7.629 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.550 3.173 7.733 1.00 0.00 C ATOM 0 H ILE A 78 -3.936 5.428 8.197 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.879 3.552 6.078 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.803 2.967 8.902 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.775 4.365 9.010 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.504 2.733 9.589 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.697 0.805 8.454 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -4.971 1.150 7.260 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.259 1.373 6.825 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.629 3.498 8.218 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.456 2.128 7.437 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.730 3.785 6.849 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.796 4.300 7.427 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.238 4.221 7.225 1.00 0.00 C ATOM 1177 C GLN A 79 -8.579 4.503 5.766 1.00 0.00 C ATOM 1178 O GLN A 79 -9.659 4.164 5.284 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.945 5.235 8.123 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.411 4.659 9.450 1.00 0.00 C ATOM 1181 CD GLN A 79 -9.555 5.716 10.527 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -10.540 5.740 11.263 1.00 0.00 O ATOM 1183 NE2 GLN A 79 -8.567 6.600 10.625 1.00 0.00 N ATOM 0 H GLN A 79 -6.509 4.920 8.185 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.575 3.217 7.482 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.269 6.068 8.316 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.806 5.640 7.591 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.368 4.158 9.308 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.701 3.902 9.782 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.768 6.544 9.994 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.608 7.335 11.331 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.638 5.136 5.079 1.00 0.00 N ATOM 1193 CA ALA A 80 -7.790 5.469 3.669 1.00 0.00 C ATOM 1194 C ALA A 80 -7.494 4.260 2.788 1.00 0.00 C ATOM 1195 O ALA A 80 -8.150 4.050 1.767 1.00 0.00 O ATOM 1196 CB ALA A 80 -6.870 6.621 3.301 1.00 0.00 C ATOM 0 H ALA A 80 -6.749 5.433 5.482 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.824 5.770 3.500 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -6.992 6.861 2.245 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.121 7.494 3.903 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.835 6.335 3.491 1.00 0.00 H new ATOM 1202 N MET A 81 -6.485 3.482 3.174 1.00 0.00 N ATOM 1203 CA MET A 81 -6.114 2.289 2.420 1.00 0.00 C ATOM 1204 C MET A 81 -7.146 1.192 2.633 1.00 0.00 C ATOM 1205 O MET A 81 -7.631 0.578 1.682 1.00 0.00 O ATOM 1206 CB MET A 81 -4.732 1.777 2.842 1.00 0.00 C ATOM 1207 CG MET A 81 -3.755 2.871 3.244 1.00 0.00 C ATOM 1208 SD MET A 81 -2.695 2.379 4.614 1.00 0.00 S ATOM 1209 CE MET A 81 -1.136 2.140 3.770 1.00 0.00 C ATOM 0 H MET A 81 -5.913 3.656 4.000 1.00 0.00 H new ATOM 0 HA MET A 81 -6.079 2.558 1.364 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.852 1.088 3.678 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.302 1.207 2.019 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.136 3.134 2.386 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.311 3.766 3.522 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.341 2.007 4.504 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.197 1.255 3.137 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.918 3.012 3.154 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.476 0.961 3.895 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.450 -0.051 4.269 1.00 0.00 C ATOM 1221 C HIS A 82 -9.706 0.601 4.832 1.00 0.00 C ATOM 1222 O HIS A 82 -9.622 1.639 5.481 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.841 -0.987 5.311 1.00 0.00 C ATOM 1224 CG HIS A 82 -7.083 -2.133 4.718 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -7.294 -3.424 5.132 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -6.127 -2.125 3.756 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -6.476 -4.172 4.411 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -5.743 -3.427 3.574 1.00 0.00 N ATOM 0 H HIS A 82 -7.077 1.468 4.685 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.723 -0.622 3.382 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.173 -0.415 5.955 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.637 -1.378 5.945 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -5.743 -1.260 3.235 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -6.408 -5.247 4.487 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -5.033 -3.765 2.924 1.00 0.00 H new ATOM 1236 N PRO A 83 -10.890 0.004 4.592 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.162 0.541 5.094 1.00 0.00 C ATOM 1238 C PRO A 83 -12.160 0.691 6.613 1.00 0.00 C ATOM 1239 O PRO A 83 -12.722 -0.139 7.330 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.195 -0.505 4.660 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.556 -1.231 3.528 1.00 0.00 C ATOM 1242 CD PRO A 83 -11.082 -1.239 3.824 1.00 0.00 C ATOM 0 HA PRO A 83 -12.365 1.539 4.705 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -13.437 -1.184 5.478 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -14.128 -0.034 4.350 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.944 -2.246 3.447 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -12.761 -0.734 2.580 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.791 -2.118 4.400 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -10.487 -1.245 2.911 1.00 0.00 H new ATOM 1250 N THR A 84 -11.513 1.751 7.092 1.00 0.00 N ATOM 1251 CA THR A 84 -11.411 2.017 8.522 1.00 0.00 C ATOM 1252 C THR A 84 -10.979 0.765 9.284 1.00 0.00 C ATOM 1253 O THR A 84 -11.445 0.511 10.396 1.00 0.00 O ATOM 1254 CB THR A 84 -12.750 2.523 9.063 1.00 0.00 C ATOM 1255 OG1 THR A 84 -13.461 3.227 8.059 1.00 0.00 O ATOM 1256 CG2 THR A 84 -12.607 3.443 10.256 1.00 0.00 C ATOM 0 H THR A 84 -11.049 2.444 6.504 1.00 0.00 H new ATOM 0 HA THR A 84 -10.652 2.786 8.669 1.00 0.00 H new ATOM 0 HB THR A 84 -13.290 1.630 9.379 1.00 0.00 H new ATOM 0 HG1 THR A 84 -14.315 3.541 8.422 1.00 0.00 H new ATOM 0 HG21 THR A 84 -13.594 3.764 10.588 1.00 0.00 H new ATOM 0 HG22 THR A 84 -12.106 2.913 11.066 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.017 4.315 9.974 1.00 0.00 H new ATOM 1264 N LEU A 85 -10.090 -0.016 8.678 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.606 -1.248 9.292 1.00 0.00 C ATOM 1266 C LEU A 85 -8.330 -1.003 10.094 1.00 0.00 C ATOM 1267 O LEU A 85 -7.723 -1.940 10.611 1.00 0.00 O ATOM 1268 CB LEU A 85 -9.351 -2.309 8.221 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.490 -3.310 8.019 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -10.751 -3.528 6.536 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -10.169 -4.628 8.705 1.00 0.00 C ATOM 0 H LEU A 85 -9.690 0.183 7.761 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.376 -1.605 9.976 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.156 -1.807 7.273 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.447 -2.858 8.483 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.394 -2.900 8.470 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.564 -4.243 6.411 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.026 -2.581 6.072 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.850 -3.917 6.061 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.990 -5.328 8.551 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.254 -5.044 8.284 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.032 -4.458 9.773 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.933 0.262 10.193 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.735 0.635 10.938 1.00 0.00 C ATOM 1285 C ALA A 86 -6.945 0.447 12.440 1.00 0.00 C ATOM 1286 O ALA A 86 -7.529 -0.548 12.872 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.354 2.072 10.617 1.00 0.00 C ATOM 0 H ALA A 86 -8.424 1.047 9.766 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.917 -0.019 10.636 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.459 2.345 11.176 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.157 2.166 9.549 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.172 2.736 10.895 1.00 0.00 H new ATOM 1293 N GLY A 87 -6.464 1.399 13.235 1.00 0.00 N ATOM 1294 CA GLY A 87 -6.598 1.298 14.676 1.00 0.00 C ATOM 1295 C GLY A 87 -5.528 0.415 15.279 1.00 0.00 C ATOM 1296 O GLY A 87 -5.364 0.360 16.497 1.00 0.00 O ATOM 0 H GLY A 87 -5.985 2.237 12.907 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.539 2.293 15.117 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.581 0.897 14.922 1.00 0.00 H new ATOM 1300 N LYS A 88 -4.795 -0.276 14.412 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.730 -1.168 14.847 1.00 0.00 C ATOM 1302 C LYS A 88 -2.741 -1.453 13.718 1.00 0.00 C ATOM 1303 O LYS A 88 -1.594 -1.804 13.976 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.320 -2.484 15.365 1.00 0.00 C ATOM 1305 CG LYS A 88 -3.282 -3.568 15.618 1.00 0.00 C ATOM 1306 CD LYS A 88 -2.460 -3.275 16.864 1.00 0.00 C ATOM 1307 CE LYS A 88 -0.969 -3.310 16.570 1.00 0.00 C ATOM 1308 NZ LYS A 88 -0.161 -3.494 17.807 1.00 0.00 N ATOM 0 H LYS A 88 -4.921 -0.234 13.401 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.190 -0.670 15.652 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.860 -2.289 16.291 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.048 -2.853 14.643 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -3.780 -4.531 15.728 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.621 -3.648 14.755 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.731 -2.295 17.258 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.697 -4.006 17.637 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.756 -4.121 15.874 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.674 -2.382 16.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.403 -2.638 17.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.795 -3.663 18.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.474 -4.309 17.689 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.185 -1.309 12.466 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.334 -1.591 11.320 1.00 0.00 C ATOM 1324 C ILE A 89 -0.975 -0.899 11.435 1.00 0.00 C ATOM 1325 O ILE A 89 0.008 -1.519 11.827 1.00 0.00 O ATOM 1326 CB ILE A 89 -3.010 -1.181 10.002 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.351 -1.905 9.854 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -2.095 -1.501 8.832 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.233 -1.347 8.759 1.00 0.00 C ATOM 0 H ILE A 89 -4.127 -0.999 12.227 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.173 -2.669 11.314 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.198 -0.107 10.012 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.163 -2.960 9.653 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.888 -1.852 10.801 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.579 -1.208 7.901 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.159 -0.953 8.942 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.889 -2.571 8.813 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.164 -1.913 8.718 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.454 -0.300 8.968 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.718 -1.425 7.802 1.00 0.00 H new ATOM 1341 N THR A 90 -0.924 0.381 11.072 1.00 0.00 N ATOM 1342 CA THR A 90 0.320 1.149 11.140 1.00 0.00 C ATOM 1343 C THR A 90 0.899 1.112 12.550 1.00 0.00 C ATOM 1344 O THR A 90 2.114 1.030 12.727 1.00 0.00 O ATOM 1345 CB THR A 90 0.057 2.588 10.687 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.825 2.892 9.536 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.357 3.643 11.728 1.00 0.00 C ATOM 0 H THR A 90 -1.727 0.908 10.728 1.00 0.00 H new ATOM 0 HA THR A 90 1.056 0.701 10.472 1.00 0.00 H new ATOM 0 HB THR A 90 -1.014 2.620 10.485 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.619 3.403 9.798 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.141 4.630 11.319 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.263 3.472 12.608 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.409 3.589 12.008 1.00 0.00 H new ATOM 1355 N GLY A 91 0.025 1.159 13.553 1.00 0.00 N ATOM 1356 CA GLY A 91 0.483 1.066 14.924 1.00 0.00 C ATOM 1357 C GLY A 91 1.254 -0.217 15.143 1.00 0.00 C ATOM 1358 O GLY A 91 2.163 -0.282 15.972 1.00 0.00 O ATOM 0 H GLY A 91 -0.984 1.259 13.440 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.116 1.921 15.160 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.370 1.104 15.601 1.00 0.00 H new ATOM 1362 N MET A 92 0.903 -1.229 14.358 1.00 0.00 N ATOM 1363 CA MET A 92 1.588 -2.514 14.400 1.00 0.00 C ATOM 1364 C MET A 92 2.912 -2.410 13.678 1.00 0.00 C ATOM 1365 O MET A 92 3.893 -3.050 14.047 1.00 0.00 O ATOM 1366 CB MET A 92 0.745 -3.598 13.727 1.00 0.00 C ATOM 1367 CG MET A 92 0.935 -4.974 14.338 1.00 0.00 C ATOM 1368 SD MET A 92 -0.535 -6.007 14.207 1.00 0.00 S ATOM 1369 CE MET A 92 -0.867 -5.886 12.453 1.00 0.00 C ATOM 0 H MET A 92 0.142 -1.183 13.680 1.00 0.00 H new ATOM 0 HA MET A 92 1.749 -2.781 15.444 1.00 0.00 H new ATOM 0 HB2 MET A 92 -0.307 -3.322 13.792 1.00 0.00 H new ATOM 0 HB3 MET A 92 0.999 -3.640 12.668 1.00 0.00 H new ATOM 0 HG2 MET A 92 1.769 -5.473 13.845 1.00 0.00 H new ATOM 0 HG3 MET A 92 1.205 -4.866 15.389 1.00 0.00 H new ATOM 0 HE1 MET A 92 -1.330 -6.810 12.106 1.00 0.00 H new ATOM 0 HE2 MET A 92 -1.541 -5.050 12.267 1.00 0.00 H new ATOM 0 HE3 MET A 92 0.068 -5.724 11.916 1.00 0.00 H new ATOM 1379 N LEU A 93 2.915 -1.592 12.637 1.00 0.00 N ATOM 1380 CA LEU A 93 4.086 -1.394 11.804 1.00 0.00 C ATOM 1381 C LEU A 93 5.263 -0.848 12.602 1.00 0.00 C ATOM 1382 O LEU A 93 6.368 -0.705 12.079 1.00 0.00 O ATOM 1383 CB LEU A 93 3.733 -0.458 10.663 1.00 0.00 C ATOM 1384 CG LEU A 93 3.172 -1.146 9.414 1.00 0.00 C ATOM 1385 CD1 LEU A 93 4.228 -2.041 8.784 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.926 -1.951 9.760 1.00 0.00 C ATOM 0 H LEU A 93 2.103 -1.047 12.347 1.00 0.00 H new ATOM 0 HA LEU A 93 4.394 -2.361 11.405 1.00 0.00 H new ATOM 0 HB2 LEU A 93 3.002 0.267 11.020 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.625 0.101 10.382 1.00 0.00 H new ATOM 0 HG LEU A 93 2.893 -0.378 8.692 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.815 -2.523 7.898 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.092 -1.440 8.501 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.535 -2.802 9.501 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.542 -2.432 8.860 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.178 -2.712 10.499 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.165 -1.286 10.169 1.00 0.00 H new ATOM 1398 N LEU A 94 5.023 -0.553 13.872 1.00 0.00 N ATOM 1399 CA LEU A 94 6.079 -0.098 14.758 1.00 0.00 C ATOM 1400 C LEU A 94 6.376 -1.189 15.777 1.00 0.00 C ATOM 1401 O LEU A 94 6.829 -0.919 16.891 1.00 0.00 O ATOM 1402 CB LEU A 94 5.671 1.199 15.456 1.00 0.00 C ATOM 1403 CG LEU A 94 6.333 2.467 14.905 1.00 0.00 C ATOM 1404 CD1 LEU A 94 6.136 2.564 13.398 1.00 0.00 C ATOM 1405 CD2 LEU A 94 5.778 3.701 15.599 1.00 0.00 C ATOM 0 H LEU A 94 4.104 -0.622 14.310 1.00 0.00 H new ATOM 0 HA LEU A 94 6.979 0.106 14.177 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.589 1.310 15.381 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.910 1.114 16.516 1.00 0.00 H new ATOM 0 HG LEU A 94 7.403 2.412 15.106 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.613 3.471 13.026 1.00 0.00 H new ATOM 0 HD12 LEU A 94 6.583 1.695 12.916 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.070 2.596 13.172 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.259 4.592 15.196 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.703 3.761 15.430 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.974 3.636 16.669 1.00 0.00 H new ATOM 1417 N GLU A 95 6.085 -2.426 15.381 1.00 0.00 N ATOM 1418 CA GLU A 95 6.286 -3.584 16.242 1.00 0.00 C ATOM 1419 C GLU A 95 6.156 -4.890 15.458 1.00 0.00 C ATOM 1420 O GLU A 95 6.293 -5.975 16.024 1.00 0.00 O ATOM 1421 CB GLU A 95 5.274 -3.570 17.392 1.00 0.00 C ATOM 1422 CG GLU A 95 3.868 -3.975 16.974 1.00 0.00 C ATOM 1423 CD GLU A 95 2.974 -4.288 18.157 1.00 0.00 C ATOM 1424 OE1 GLU A 95 3.049 -3.558 19.167 1.00 0.00 O ATOM 1425 OE2 GLU A 95 2.198 -5.263 18.072 1.00 0.00 O ATOM 0 H GLU A 95 5.706 -2.651 14.461 1.00 0.00 H new ATOM 0 HA GLU A 95 7.297 -3.526 16.646 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.619 -4.244 18.176 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.241 -2.570 17.823 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.421 -3.171 16.389 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.924 -4.849 16.325 1.00 0.00 H new ATOM 1432 N ILE A 96 5.919 -4.784 14.149 1.00 0.00 N ATOM 1433 CA ILE A 96 5.766 -5.971 13.301 1.00 0.00 C ATOM 1434 C ILE A 96 7.042 -6.807 13.254 1.00 0.00 C ATOM 1435 O ILE A 96 7.870 -6.768 14.166 1.00 0.00 O ATOM 1436 CB ILE A 96 5.405 -5.615 11.838 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.539 -4.831 11.167 1.00 0.00 C ATOM 1438 CG2 ILE A 96 4.094 -4.855 11.752 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.880 -3.528 11.842 1.00 0.00 C ATOM 0 H ILE A 96 5.829 -3.896 13.655 1.00 0.00 H new ATOM 0 HA ILE A 96 4.953 -6.536 13.758 1.00 0.00 H new ATOM 0 HB ILE A 96 5.274 -6.553 11.298 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.431 -5.457 11.141 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.262 -4.628 10.133 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.875 -4.623 10.710 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.291 -5.467 12.164 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.173 -3.928 12.321 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.691 -3.040 11.302 1.00 0.00 H new ATOM 0 HD12 ILE A 96 6.004 -2.879 11.844 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.192 -3.721 12.869 1.00 0.00 H new ATOM 1451 N ASP A 97 7.199 -7.541 12.153 1.00 0.00 N ATOM 1452 CA ASP A 97 8.369 -8.370 11.918 1.00 0.00 C ATOM 1453 C ASP A 97 9.647 -7.535 11.906 1.00 0.00 C ATOM 1454 O ASP A 97 10.743 -8.072 11.741 1.00 0.00 O ATOM 1455 CB ASP A 97 8.210 -9.089 10.578 1.00 0.00 C ATOM 1456 CG ASP A 97 8.957 -10.408 10.531 1.00 0.00 C ATOM 1457 OD1 ASP A 97 9.286 -10.944 11.610 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.213 -10.906 9.415 1.00 0.00 O ATOM 0 H ASP A 97 6.513 -7.574 11.399 1.00 0.00 H new ATOM 0 HA ASP A 97 8.450 -9.095 12.728 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.151 -9.268 10.390 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.571 -8.443 9.778 1.00 0.00 H new ATOM 1463 N ASN A 98 9.485 -6.217 12.052 1.00 0.00 N ATOM 1464 CA ASN A 98 10.601 -5.271 12.052 1.00 0.00 C ATOM 1465 C ASN A 98 11.068 -4.973 10.636 1.00 0.00 C ATOM 1466 O ASN A 98 11.453 -3.847 10.321 1.00 0.00 O ATOM 1467 CB ASN A 98 11.768 -5.781 12.906 1.00 0.00 C ATOM 1468 CG ASN A 98 13.022 -6.059 12.096 1.00 0.00 C ATOM 1469 OD1 ASN A 98 13.721 -5.136 11.677 1.00 0.00 O ATOM 1470 ND2 ASN A 98 13.321 -7.335 11.884 1.00 0.00 N ATOM 0 H ASN A 98 8.573 -5.776 12.174 1.00 0.00 H new ATOM 0 HA ASN A 98 10.239 -4.343 12.495 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.996 -5.044 13.676 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.464 -6.694 13.418 1.00 0.00 H new ATOM 0 HD21 ASN A 98 14.158 -7.582 11.356 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.714 -8.069 12.249 1.00 0.00 H new ATOM 1477 N SER A 99 11.035 -5.988 9.790 1.00 0.00 N ATOM 1478 CA SER A 99 11.432 -5.825 8.398 1.00 0.00 C ATOM 1479 C SER A 99 10.464 -4.887 7.691 1.00 0.00 C ATOM 1480 O SER A 99 10.826 -4.203 6.735 1.00 0.00 O ATOM 1481 CB SER A 99 11.479 -7.172 7.681 1.00 0.00 C ATOM 1482 OG SER A 99 12.069 -8.167 8.500 1.00 0.00 O ATOM 0 H SER A 99 10.739 -6.932 10.039 1.00 0.00 H new ATOM 0 HA SER A 99 12.433 -5.394 8.374 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.469 -7.476 7.405 1.00 0.00 H new ATOM 0 HB3 SER A 99 12.047 -7.075 6.756 1.00 0.00 H new ATOM 0 HG SER A 99 12.085 -9.020 8.018 1.00 0.00 H new ATOM 1488 N GLU A 100 9.233 -4.853 8.187 1.00 0.00 N ATOM 1489 CA GLU A 100 8.213 -3.962 7.650 1.00 0.00 C ATOM 1490 C GLU A 100 8.369 -2.580 8.264 1.00 0.00 C ATOM 1491 O GLU A 100 8.007 -1.576 7.656 1.00 0.00 O ATOM 1492 CB GLU A 100 6.820 -4.522 7.920 1.00 0.00 C ATOM 1493 CG GLU A 100 6.785 -6.039 7.993 1.00 0.00 C ATOM 1494 CD GLU A 100 5.553 -6.629 7.335 1.00 0.00 C ATOM 1495 OE1 GLU A 100 4.466 -6.028 7.462 1.00 0.00 O ATOM 1496 OE2 GLU A 100 5.676 -7.694 6.693 1.00 0.00 O ATOM 0 H GLU A 100 8.917 -5.435 8.963 1.00 0.00 H new ATOM 0 HA GLU A 100 8.339 -3.883 6.570 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.447 -4.112 8.858 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.143 -4.187 7.134 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.677 -6.442 7.513 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.818 -6.349 9.037 1.00 0.00 H new ATOM 1503 N LEU A 101 8.950 -2.540 9.459 1.00 0.00 N ATOM 1504 CA LEU A 101 9.231 -1.281 10.130 1.00 0.00 C ATOM 1505 C LEU A 101 10.431 -0.607 9.476 1.00 0.00 C ATOM 1506 O LEU A 101 10.580 0.613 9.522 1.00 0.00 O ATOM 1507 CB LEU A 101 9.504 -1.516 11.620 1.00 0.00 C ATOM 1508 CG LEU A 101 10.271 -0.397 12.332 1.00 0.00 C ATOM 1509 CD1 LEU A 101 9.308 0.647 12.876 1.00 0.00 C ATOM 1510 CD2 LEU A 101 11.130 -0.970 13.449 1.00 0.00 C ATOM 0 H LEU A 101 9.235 -3.368 9.981 1.00 0.00 H new ATOM 0 HA LEU A 101 8.361 -0.631 10.038 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.551 -1.660 12.128 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.066 -2.444 11.727 1.00 0.00 H new ATOM 0 HG LEU A 101 10.927 0.088 11.609 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.870 1.434 13.378 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.736 1.078 12.054 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.626 0.178 13.586 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.668 -0.162 13.945 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.494 -1.480 14.172 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.844 -1.679 13.031 1.00 0.00 H new ATOM 1522 N LEU A 102 11.276 -1.424 8.859 1.00 0.00 N ATOM 1523 CA LEU A 102 12.476 -0.931 8.194 1.00 0.00 C ATOM 1524 C LEU A 102 12.199 -0.584 6.738 1.00 0.00 C ATOM 1525 O LEU A 102 12.600 0.475 6.254 1.00 0.00 O ATOM 1526 CB LEU A 102 13.582 -1.986 8.259 1.00 0.00 C ATOM 1527 CG LEU A 102 14.598 -1.793 9.388 1.00 0.00 C ATOM 1528 CD1 LEU A 102 13.927 -1.949 10.745 1.00 0.00 C ATOM 1529 CD2 LEU A 102 15.748 -2.779 9.244 1.00 0.00 C ATOM 0 H LEU A 102 11.152 -2.435 8.805 1.00 0.00 H new ATOM 0 HA LEU A 102 12.795 -0.026 8.712 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.121 -2.967 8.370 1.00 0.00 H new ATOM 0 HB3 LEU A 102 14.115 -1.990 7.308 1.00 0.00 H new ATOM 0 HG LEU A 102 15.000 -0.782 9.319 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.665 -1.808 11.534 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.138 -1.204 10.849 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.496 -2.947 10.825 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.461 -2.628 10.055 1.00 0.00 H new ATOM 0 HD22 LEU A 102 15.362 -3.797 9.286 1.00 0.00 H new ATOM 0 HD23 LEU A 102 16.247 -2.619 8.288 1.00 0.00 H new ATOM 1541 N HIS A 103 11.540 -1.498 6.035 1.00 0.00 N ATOM 1542 CA HIS A 103 11.244 -1.311 4.626 1.00 0.00 C ATOM 1543 C HIS A 103 10.286 -0.145 4.408 1.00 0.00 C ATOM 1544 O HIS A 103 10.411 0.593 3.430 1.00 0.00 O ATOM 1545 CB HIS A 103 10.648 -2.598 4.055 1.00 0.00 C ATOM 1546 CG HIS A 103 11.280 -3.042 2.771 1.00 0.00 C ATOM 1547 ND1 HIS A 103 11.357 -4.372 2.434 1.00 0.00 N ATOM 1548 CD2 HIS A 103 11.843 -2.301 1.784 1.00 0.00 C ATOM 1549 CE1 HIS A 103 11.961 -4.414 1.260 1.00 0.00 C ATOM 1550 NE2 HIS A 103 12.273 -3.184 0.828 1.00 0.00 N ATOM 0 H HIS A 103 11.201 -2.378 6.423 1.00 0.00 H new ATOM 0 HA HIS A 103 12.174 -1.076 4.108 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.751 -3.393 4.793 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.580 -2.451 3.891 1.00 0.00 H new ATOM 0 HD2 HIS A 103 11.935 -1.225 1.757 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.176 -5.323 0.718 1.00 0.00 H new ATOM 0 HE2 HIS A 103 12.742 -2.949 -0.047 1.00 0.00 H new ATOM 1558 N MET A 104 9.330 0.017 5.317 1.00 0.00 N ATOM 1559 CA MET A 104 8.357 1.099 5.216 1.00 0.00 C ATOM 1560 C MET A 104 9.045 2.458 5.233 1.00 0.00 C ATOM 1561 O MET A 104 8.616 3.389 4.555 1.00 0.00 O ATOM 1562 CB MET A 104 7.364 1.026 6.372 1.00 0.00 C ATOM 1563 CG MET A 104 7.987 1.398 7.700 1.00 0.00 C ATOM 1564 SD MET A 104 6.973 0.926 9.113 1.00 0.00 S ATOM 1565 CE MET A 104 5.341 1.337 8.506 1.00 0.00 C ATOM 0 H MET A 104 9.208 -0.586 6.131 1.00 0.00 H new ATOM 0 HA MET A 104 7.829 0.983 4.270 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.526 1.693 6.169 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.959 0.016 6.435 1.00 0.00 H new ATOM 0 HG2 MET A 104 8.962 0.919 7.784 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.157 2.474 7.726 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.625 1.288 9.326 1.00 0.00 H new ATOM 0 HE2 MET A 104 5.350 2.345 8.091 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.052 0.628 7.730 1.00 0.00 H new ATOM 1575 N LEU A 105 10.089 2.576 6.049 1.00 0.00 N ATOM 1576 CA LEU A 105 10.818 3.829 6.183 1.00 0.00 C ATOM 1577 C LEU A 105 11.820 3.997 5.056 1.00 0.00 C ATOM 1578 O LEU A 105 12.392 5.072 4.878 1.00 0.00 O ATOM 1579 CB LEU A 105 11.552 3.875 7.524 1.00 0.00 C ATOM 1580 CG LEU A 105 10.695 3.549 8.746 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.552 3.497 10.001 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.583 4.572 8.898 1.00 0.00 C ATOM 0 H LEU A 105 10.448 1.816 6.627 1.00 0.00 H new ATOM 0 HA LEU A 105 10.095 4.643 6.135 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.386 3.174 7.488 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.977 4.870 7.653 1.00 0.00 H new ATOM 0 HG LEU A 105 10.243 2.567 8.601 1.00 0.00 H new ATOM 0 HD11 LEU A 105 10.924 3.264 10.861 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.315 2.727 9.889 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.032 4.464 10.154 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.980 4.327 9.773 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.016 5.565 9.022 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.953 4.560 8.008 1.00 0.00 H new ATOM 1594 N GLU A 106 12.040 2.927 4.304 1.00 0.00 N ATOM 1595 CA GLU A 106 13.010 2.961 3.224 1.00 0.00 C ATOM 1596 C GLU A 106 12.337 2.921 1.854 1.00 0.00 C ATOM 1597 O GLU A 106 12.995 3.113 0.831 1.00 0.00 O ATOM 1598 CB GLU A 106 13.998 1.795 3.372 1.00 0.00 C ATOM 1599 CG GLU A 106 13.702 0.606 2.471 1.00 0.00 C ATOM 1600 CD GLU A 106 14.625 -0.568 2.730 1.00 0.00 C ATOM 1601 OE1 GLU A 106 15.040 -0.752 3.894 1.00 0.00 O ATOM 1602 OE2 GLU A 106 14.933 -1.304 1.770 1.00 0.00 O ATOM 0 H GLU A 106 11.563 2.033 4.422 1.00 0.00 H new ATOM 0 HA GLU A 106 13.552 3.904 3.291 1.00 0.00 H new ATOM 0 HB2 GLU A 106 15.004 2.157 3.158 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.994 1.460 4.409 1.00 0.00 H new ATOM 0 HG2 GLU A 106 12.669 0.291 2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 106 13.795 0.913 1.429 1.00 0.00 H new ATOM 1609 N SER A 107 11.031 2.676 1.833 1.00 0.00 N ATOM 1610 CA SER A 107 10.304 2.608 0.567 1.00 0.00 C ATOM 1611 C SER A 107 8.924 3.258 0.673 1.00 0.00 C ATOM 1612 O SER A 107 8.130 2.907 1.544 1.00 0.00 O ATOM 1613 CB SER A 107 10.160 1.154 0.117 1.00 0.00 C ATOM 1614 OG SER A 107 10.148 1.054 -1.296 1.00 0.00 O ATOM 0 H SER A 107 10.460 2.523 2.664 1.00 0.00 H new ATOM 0 HA SER A 107 10.881 3.162 -0.174 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.983 0.563 0.519 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.239 0.735 0.522 1.00 0.00 H new ATOM 0 HG SER A 107 10.057 0.114 -1.557 1.00 0.00 H new ATOM 1620 N PRO A 108 8.614 4.205 -0.237 1.00 0.00 N ATOM 1621 CA PRO A 108 7.321 4.903 -0.253 1.00 0.00 C ATOM 1622 C PRO A 108 6.169 3.979 -0.632 1.00 0.00 C ATOM 1623 O PRO A 108 5.037 4.423 -0.820 1.00 0.00 O ATOM 1624 CB PRO A 108 7.500 5.991 -1.323 1.00 0.00 C ATOM 1625 CG PRO A 108 8.969 6.061 -1.580 1.00 0.00 C ATOM 1626 CD PRO A 108 9.499 4.684 -1.309 1.00 0.00 C ATOM 0 HA PRO A 108 7.067 5.296 0.731 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.954 5.740 -2.233 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.116 6.950 -0.975 1.00 0.00 H new ATOM 0 HG2 PRO A 108 9.172 6.363 -2.608 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.444 6.797 -0.932 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.446 4.048 -2.193 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.542 4.706 -0.994 1.00 0.00 H new ATOM 1634 N GLU A 109 6.470 2.691 -0.749 1.00 0.00 N ATOM 1635 CA GLU A 109 5.472 1.692 -1.104 1.00 0.00 C ATOM 1636 C GLU A 109 5.482 0.551 -0.103 1.00 0.00 C ATOM 1637 O GLU A 109 4.466 -0.107 0.109 1.00 0.00 O ATOM 1638 CB GLU A 109 5.746 1.165 -2.517 1.00 0.00 C ATOM 1639 CG GLU A 109 5.465 -0.320 -2.701 1.00 0.00 C ATOM 1640 CD GLU A 109 5.583 -0.761 -4.146 1.00 0.00 C ATOM 1641 OE1 GLU A 109 5.304 0.062 -5.044 1.00 0.00 O ATOM 1642 OE2 GLU A 109 5.955 -1.930 -4.381 1.00 0.00 O ATOM 0 H GLU A 109 7.406 2.313 -0.602 1.00 0.00 H new ATOM 0 HA GLU A 109 4.486 2.156 -1.083 1.00 0.00 H new ATOM 0 HB2 GLU A 109 5.138 1.728 -3.225 1.00 0.00 H new ATOM 0 HB3 GLU A 109 6.789 1.359 -2.768 1.00 0.00 H new ATOM 0 HG2 GLU A 109 6.161 -0.896 -2.091 1.00 0.00 H new ATOM 0 HG3 GLU A 109 4.462 -0.544 -2.337 1.00 0.00 H new ATOM 1649 N SER A 110 6.628 0.332 0.534 1.00 0.00 N ATOM 1650 CA SER A 110 6.739 -0.724 1.522 1.00 0.00 C ATOM 1651 C SER A 110 5.815 -0.445 2.683 1.00 0.00 C ATOM 1652 O SER A 110 5.058 -1.308 3.098 1.00 0.00 O ATOM 1653 CB SER A 110 8.170 -0.863 2.025 1.00 0.00 C ATOM 1654 OG SER A 110 8.771 -2.047 1.529 1.00 0.00 O ATOM 0 H SER A 110 7.482 0.868 0.383 1.00 0.00 H new ATOM 0 HA SER A 110 6.453 -1.661 1.045 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.754 0.003 1.714 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.176 -0.877 3.115 1.00 0.00 H new ATOM 0 HG SER A 110 9.344 -1.828 0.765 1.00 0.00 H new ATOM 1660 N LEU A 111 5.843 0.783 3.165 1.00 0.00 N ATOM 1661 CA LEU A 111 4.970 1.183 4.253 1.00 0.00 C ATOM 1662 C LEU A 111 3.531 0.790 3.962 1.00 0.00 C ATOM 1663 O LEU A 111 2.725 0.624 4.874 1.00 0.00 O ATOM 1664 CB LEU A 111 5.058 2.684 4.465 1.00 0.00 C ATOM 1665 CG LEU A 111 4.339 3.183 5.708 1.00 0.00 C ATOM 1666 CD1 LEU A 111 5.205 4.184 6.440 1.00 0.00 C ATOM 1667 CD2 LEU A 111 2.992 3.785 5.343 1.00 0.00 C ATOM 0 H LEU A 111 6.459 1.520 2.822 1.00 0.00 H new ATOM 0 HA LEU A 111 5.294 0.670 5.158 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.108 2.969 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.642 3.188 3.592 1.00 0.00 H new ATOM 0 HG LEU A 111 4.155 2.339 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.682 4.536 7.329 1.00 0.00 H new ATOM 0 HD12 LEU A 111 6.141 3.709 6.734 1.00 0.00 H new ATOM 0 HD13 LEU A 111 5.417 5.029 5.785 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.494 4.136 6.247 1.00 0.00 H new ATOM 0 HD22 LEU A 111 3.140 4.623 4.662 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.375 3.028 4.859 1.00 0.00 H new ATOM 1679 N ARG A 112 3.223 0.635 2.683 1.00 0.00 N ATOM 1680 CA ARG A 112 1.885 0.260 2.255 1.00 0.00 C ATOM 1681 C ARG A 112 1.758 -1.244 2.103 1.00 0.00 C ATOM 1682 O ARG A 112 0.981 -1.880 2.806 1.00 0.00 O ATOM 1683 CB ARG A 112 1.555 0.952 0.944 1.00 0.00 C ATOM 1684 CG ARG A 112 1.227 2.407 1.149 1.00 0.00 C ATOM 1685 CD ARG A 112 1.435 3.218 -0.119 1.00 0.00 C ATOM 1686 NE ARG A 112 0.397 2.959 -1.113 1.00 0.00 N ATOM 1687 CZ ARG A 112 -0.293 3.916 -1.726 1.00 0.00 C ATOM 1688 NH1 ARG A 112 -0.058 5.192 -1.448 1.00 0.00 N ATOM 1689 NH2 ARG A 112 -1.221 3.598 -2.619 1.00 0.00 N ATOM 0 H ARG A 112 3.887 0.764 1.920 1.00 0.00 H new ATOM 0 HA ARG A 112 1.177 0.578 3.020 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.401 0.862 0.262 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.710 0.452 0.471 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.192 2.503 1.476 1.00 0.00 H new ATOM 0 HG3 ARG A 112 1.852 2.811 1.945 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.443 4.280 0.128 1.00 0.00 H new ATOM 0 HD3 ARG A 112 2.410 2.982 -0.544 1.00 0.00 H new ATOM 0 HE ARG A 112 0.190 1.989 -1.350 1.00 0.00 H new ATOM 0 HH11 ARG A 112 0.654 5.442 -0.762 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -0.590 5.923 -1.921 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.406 2.619 -2.836 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -1.750 4.333 -3.089 1.00 0.00 H new ATOM 1703 N SER A 113 2.526 -1.808 1.183 1.00 0.00 N ATOM 1704 CA SER A 113 2.518 -3.248 0.970 1.00 0.00 C ATOM 1705 C SER A 113 2.691 -3.967 2.301 1.00 0.00 C ATOM 1706 O SER A 113 2.235 -5.095 2.478 1.00 0.00 O ATOM 1707 CB SER A 113 3.631 -3.653 0.003 1.00 0.00 C ATOM 1708 OG SER A 113 3.434 -4.971 -0.479 1.00 0.00 O ATOM 0 H SER A 113 3.161 -1.293 0.573 1.00 0.00 H new ATOM 0 HA SER A 113 1.561 -3.533 0.532 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.660 -2.957 -0.835 1.00 0.00 H new ATOM 0 HB3 SER A 113 4.596 -3.587 0.506 1.00 0.00 H new ATOM 0 HG SER A 113 4.158 -5.205 -1.096 1.00 0.00 H new ATOM 1714 N LYS A 114 3.392 -3.310 3.220 1.00 0.00 N ATOM 1715 CA LYS A 114 3.597 -3.846 4.559 1.00 0.00 C ATOM 1716 C LYS A 114 2.382 -3.583 5.434 1.00 0.00 C ATOM 1717 O LYS A 114 1.959 -4.453 6.192 1.00 0.00 O ATOM 1718 CB LYS A 114 4.847 -3.246 5.209 1.00 0.00 C ATOM 1719 CG LYS A 114 6.139 -3.605 4.492 1.00 0.00 C ATOM 1720 CD LYS A 114 6.353 -5.110 4.434 1.00 0.00 C ATOM 1721 CE LYS A 114 6.247 -5.632 3.010 1.00 0.00 C ATOM 1722 NZ LYS A 114 5.078 -6.538 2.835 1.00 0.00 N ATOM 0 H LYS A 114 3.829 -2.402 3.060 1.00 0.00 H new ATOM 0 HA LYS A 114 3.740 -4.923 4.466 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.746 -2.161 5.237 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.908 -3.587 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.117 -3.202 3.480 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.981 -3.138 5.003 1.00 0.00 H new ATOM 0 HD2 LYS A 114 7.334 -5.355 4.841 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.614 -5.608 5.062 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.161 -4.792 2.321 1.00 0.00 H new ATOM 0 HE3 LYS A 114 7.161 -6.165 2.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.256 -7.185 2.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.933 -7.089 3.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.228 -5.973 2.637 1.00 0.00 H new ATOM 1736 N VAL A 115 1.832 -2.369 5.344 1.00 0.00 N ATOM 1737 CA VAL A 115 0.655 -2.017 6.136 1.00 0.00 C ATOM 1738 C VAL A 115 -0.533 -2.886 5.721 1.00 0.00 C ATOM 1739 O VAL A 115 -1.074 -3.634 6.536 1.00 0.00 O ATOM 1740 CB VAL A 115 0.304 -0.510 6.030 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.203 -0.279 5.998 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.920 0.254 7.190 1.00 0.00 C ATOM 0 H VAL A 115 2.178 -1.624 4.739 1.00 0.00 H new ATOM 0 HA VAL A 115 0.890 -2.210 7.183 1.00 0.00 H new ATOM 0 HB VAL A 115 0.717 -0.142 5.091 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.406 0.789 5.923 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.631 -0.791 5.136 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.651 -0.670 6.912 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.667 1.311 7.105 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.532 -0.138 8.130 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.004 0.138 7.168 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.896 -2.827 4.440 1.00 0.00 N ATOM 1753 CA ASP A 116 -1.991 -3.636 3.914 1.00 0.00 C ATOM 1754 C ASP A 116 -1.813 -5.105 4.293 1.00 0.00 C ATOM 1755 O ASP A 116 -2.771 -5.775 4.687 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.071 -3.491 2.390 1.00 0.00 C ATOM 1757 CG ASP A 116 -2.714 -4.690 1.720 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -3.817 -5.091 2.148 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -2.115 -5.228 0.765 1.00 0.00 O ATOM 0 H ASP A 116 -0.447 -2.227 3.749 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.922 -3.279 4.355 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -2.640 -2.594 2.144 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.067 -3.351 1.989 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.584 -5.599 4.180 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.285 -6.983 4.533 1.00 0.00 C ATOM 1766 C GLU A 117 -0.369 -7.174 6.040 1.00 0.00 C ATOM 1767 O GLU A 117 -0.745 -8.244 6.521 1.00 0.00 O ATOM 1768 CB GLU A 117 1.107 -7.376 4.034 1.00 0.00 C ATOM 1769 CG GLU A 117 1.103 -8.002 2.649 1.00 0.00 C ATOM 1770 CD GLU A 117 2.210 -9.021 2.466 1.00 0.00 C ATOM 1771 OE1 GLU A 117 2.036 -10.174 2.913 1.00 0.00 O ATOM 1772 OE2 GLU A 117 3.253 -8.665 1.877 1.00 0.00 O ATOM 0 H GLU A 117 0.218 -5.064 3.848 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.023 -7.626 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.743 -6.491 4.021 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.552 -8.078 4.739 1.00 0.00 H new ATOM 0 HG2 GLU A 117 0.140 -8.482 2.474 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.209 -7.218 1.900 1.00 0.00 H new ATOM 1779 N ALA A 118 -0.021 -6.128 6.783 1.00 0.00 N ATOM 1780 CA ALA A 118 -0.089 -6.178 8.234 1.00 0.00 C ATOM 1781 C ALA A 118 -1.536 -6.229 8.687 1.00 0.00 C ATOM 1782 O ALA A 118 -1.836 -6.725 9.767 1.00 0.00 O ATOM 1783 CB ALA A 118 0.628 -4.994 8.859 1.00 0.00 C ATOM 0 H ALA A 118 0.309 -5.241 6.404 1.00 0.00 H new ATOM 0 HA ALA A 118 0.416 -7.084 8.569 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.560 -5.059 9.945 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.676 -5.004 8.560 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.163 -4.068 8.521 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.431 -5.723 7.844 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.854 -5.772 8.132 1.00 0.00 C ATOM 1791 C VAL A 119 -4.311 -7.211 8.194 1.00 0.00 C ATOM 1792 O VAL A 119 -5.021 -7.616 9.111 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.674 -5.044 7.068 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -6.125 -4.955 7.504 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -4.089 -3.672 6.806 1.00 0.00 C ATOM 0 H VAL A 119 -2.193 -5.276 6.959 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.012 -5.276 9.090 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.636 -5.606 6.135 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.703 -4.435 6.740 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.526 -5.959 7.641 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.189 -4.407 8.444 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.682 -3.163 6.046 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.102 -3.089 7.727 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.062 -3.775 6.456 1.00 0.00 H new ATOM 1805 N ALA A 120 -3.878 -7.980 7.208 1.00 0.00 N ATOM 1806 CA ALA A 120 -4.186 -9.393 7.153 1.00 0.00 C ATOM 1807 C ALA A 120 -3.670 -10.081 8.409 1.00 0.00 C ATOM 1808 O ALA A 120 -4.201 -11.103 8.844 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.563 -10.001 5.908 1.00 0.00 C ATOM 0 H ALA A 120 -3.309 -7.643 6.432 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.266 -9.532 7.104 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.795 -11.065 5.867 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.964 -9.508 5.023 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.482 -9.867 5.940 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.639 -9.482 8.993 1.00 0.00 N ATOM 1816 CA VAL A 121 -2.029 -9.990 10.209 1.00 0.00 C ATOM 1817 C VAL A 121 -2.750 -9.449 11.443 1.00 0.00 C ATOM 1818 O VAL A 121 -2.849 -10.126 12.469 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.535 -9.598 10.257 1.00 0.00 C ATOM 1820 CG1 VAL A 121 0.014 -9.656 11.671 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.272 -10.489 9.325 1.00 0.00 C ATOM 0 H VAL A 121 -2.205 -8.631 8.635 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.114 -11.077 10.208 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.447 -8.566 9.919 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.067 -9.374 11.664 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.542 -8.967 12.306 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.088 -10.669 12.059 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.323 -10.203 9.368 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.166 -11.529 9.634 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.094 -10.374 8.305 1.00 0.00 H new ATOM 1831 N LEU A 122 -3.257 -8.226 11.330 1.00 0.00 N ATOM 1832 CA LEU A 122 -3.979 -7.597 12.427 1.00 0.00 C ATOM 1833 C LEU A 122 -5.312 -8.297 12.639 1.00 0.00 C ATOM 1834 O LEU A 122 -5.748 -8.497 13.771 1.00 0.00 O ATOM 1835 CB LEU A 122 -4.181 -6.101 12.147 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.637 -5.626 12.083 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -6.014 -4.911 13.370 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.854 -4.721 10.884 1.00 0.00 C ATOM 0 H LEU A 122 -3.181 -7.652 10.490 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.391 -7.691 13.340 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.667 -5.533 12.922 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.698 -5.859 11.201 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.281 -6.498 11.969 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.050 -4.579 13.311 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.899 -5.593 14.212 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.364 -4.048 13.511 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.894 -4.395 10.857 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.203 -3.850 10.963 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.621 -5.267 9.970 1.00 0.00 H new ATOM 1850 N GLN A 123 -5.945 -8.686 11.537 1.00 0.00 N ATOM 1851 CA GLN A 123 -7.208 -9.406 11.594 1.00 0.00 C ATOM 1852 C GLN A 123 -6.967 -10.846 12.035 1.00 0.00 C ATOM 1853 O GLN A 123 -7.833 -11.479 12.637 1.00 0.00 O ATOM 1854 CB GLN A 123 -7.896 -9.377 10.228 1.00 0.00 C ATOM 1855 CG GLN A 123 -8.430 -8.006 9.842 1.00 0.00 C ATOM 1856 CD GLN A 123 -9.556 -7.542 10.745 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -9.329 -7.152 11.891 1.00 0.00 O ATOM 1858 NE2 GLN A 123 -10.781 -7.578 10.231 1.00 0.00 N ATOM 0 H GLN A 123 -5.601 -8.513 10.592 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.859 -8.920 12.320 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -7.189 -9.709 9.468 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.720 -10.091 10.231 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.617 -7.280 9.879 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -8.784 -8.035 8.812 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -10.924 -7.908 9.277 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -11.578 -7.275 10.791 1.00 0.00 H new ATOM 1867 N ALA A 124 -5.764 -11.342 11.748 1.00 0.00 N ATOM 1868 CA ALA A 124 -5.372 -12.695 12.125 1.00 0.00 C ATOM 1869 C ALA A 124 -4.876 -12.740 13.559 1.00 0.00 C ATOM 1870 O ALA A 124 -4.556 -13.808 14.079 1.00 0.00 O ATOM 1871 CB ALA A 124 -4.300 -13.208 11.178 1.00 0.00 C ATOM 0 H ALA A 124 -5.041 -10.821 11.252 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.249 -13.339 12.053 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.013 -14.219 11.467 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.689 -13.218 10.160 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.428 -12.555 11.227 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.830 -11.580 14.203 1.00 0.00 N ATOM 1878 CA HIS A 125 -4.393 -11.504 15.587 1.00 0.00 C ATOM 1879 C HIS A 125 -5.476 -10.898 16.470 1.00 0.00 C ATOM 1880 O HIS A 125 -5.532 -11.160 17.672 1.00 0.00 O ATOM 1881 CB HIS A 125 -3.107 -10.682 15.701 1.00 0.00 C ATOM 1882 CG HIS A 125 -2.174 -11.160 16.771 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -1.137 -10.375 17.219 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -2.162 -12.336 17.448 1.00 0.00 C ATOM 1885 CE1 HIS A 125 -0.521 -11.083 18.148 1.00 0.00 C ATOM 1886 NE2 HIS A 125 -1.107 -12.276 18.321 1.00 0.00 N ATOM 0 H HIS A 125 -5.089 -10.684 13.789 1.00 0.00 H new ATOM 0 HA HIS A 125 -4.196 -12.520 15.930 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -2.587 -10.704 14.743 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -3.368 -9.642 15.898 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -2.850 -13.159 17.323 1.00 0.00 H new ATOM 0 HE1 HIS A 125 0.344 -10.744 18.698 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -0.822 -13.002 18.978 1.00 0.00 H new ATOM 1894 N GLN A 126 -6.332 -10.083 15.866 1.00 0.00 N ATOM 1895 CA GLN A 126 -7.431 -9.459 16.591 1.00 0.00 C ATOM 1896 C GLN A 126 -8.612 -10.414 16.669 1.00 0.00 C ATOM 1897 O GLN A 126 -9.293 -10.500 17.691 1.00 0.00 O ATOM 1898 CB GLN A 126 -7.852 -8.156 15.909 1.00 0.00 C ATOM 1899 CG GLN A 126 -7.133 -6.927 16.444 1.00 0.00 C ATOM 1900 CD GLN A 126 -7.381 -6.704 17.923 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -8.443 -7.045 18.444 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -6.401 -6.126 18.607 1.00 0.00 N ATOM 0 H GLN A 126 -6.286 -9.839 14.877 1.00 0.00 H new ATOM 0 HA GLN A 126 -7.094 -9.227 17.601 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -7.664 -8.239 14.839 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -8.926 -8.021 16.034 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.062 -7.033 16.271 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.460 -6.048 15.888 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.537 -5.860 18.134 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.512 -5.948 19.605 1.00 0.00 H new ATOM 1911 N ALA A 127 -8.837 -11.140 15.580 1.00 0.00 N ATOM 1912 CA ALA A 127 -9.915 -12.114 15.518 1.00 0.00 C ATOM 1913 C ALA A 127 -9.402 -13.510 15.854 1.00 0.00 C ATOM 1914 O ALA A 127 -9.861 -14.135 16.812 1.00 0.00 O ATOM 1915 CB ALA A 127 -10.561 -12.102 14.142 1.00 0.00 C ATOM 0 H ALA A 127 -8.284 -11.070 14.726 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.667 -11.840 16.258 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -11.366 -12.836 14.112 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.966 -11.111 13.939 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -9.815 -12.350 13.387 1.00 0.00 H new ATOM 1921 N LYS A 128 -8.490 -14.018 15.027 1.00 0.00 N ATOM 1922 CA LYS A 128 -7.913 -15.332 15.250 1.00 0.00 C ATOM 1923 C LYS A 128 -6.568 -15.232 15.936 1.00 0.00 C ATOM 1924 O LYS A 128 -6.006 -14.151 16.109 1.00 0.00 O ATOM 1925 CB LYS A 128 -7.734 -16.113 13.937 1.00 0.00 C ATOM 1926 CG LYS A 128 -7.343 -15.260 12.739 1.00 0.00 C ATOM 1927 CD LYS A 128 -8.504 -14.433 12.208 1.00 0.00 C ATOM 1928 CE LYS A 128 -9.713 -15.295 11.874 1.00 0.00 C ATOM 1929 NZ LYS A 128 -10.729 -15.275 12.963 1.00 0.00 N ATOM 0 H LYS A 128 -8.139 -13.537 14.199 1.00 0.00 H new ATOM 0 HA LYS A 128 -8.615 -15.867 15.890 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -6.972 -16.878 14.086 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -8.665 -16.631 13.708 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -6.527 -14.595 13.022 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -6.968 -15.905 11.945 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -8.786 -13.686 12.950 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -8.186 -13.893 11.316 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.166 -14.941 10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -9.390 -16.321 11.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -11.254 -16.173 12.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -10.253 -15.150 13.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -11.390 -14.488 12.806 1.00 0.00 H new ATOM 1943 N GLU A 129 -6.100 -16.381 16.368 1.00 0.00 N ATOM 1944 CA GLU A 129 -4.766 -16.520 16.921 1.00 0.00 C ATOM 1945 C GLU A 129 -3.810 -16.878 15.795 1.00 0.00 C ATOM 1946 O GLU A 129 -2.761 -17.485 16.016 1.00 0.00 O ATOM 1947 CB GLU A 129 -4.741 -17.598 18.007 1.00 0.00 C ATOM 1948 CG GLU A 129 -4.015 -17.171 19.272 1.00 0.00 C ATOM 1949 CD GLU A 129 -4.929 -17.123 20.482 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -6.075 -16.648 20.341 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -4.497 -17.560 21.570 1.00 0.00 O ATOM 0 H GLU A 129 -6.633 -17.250 16.347 1.00 0.00 H new ATOM 0 HA GLU A 129 -4.461 -15.580 17.380 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.766 -17.870 18.261 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -4.263 -18.493 17.608 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -3.196 -17.863 19.467 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -3.571 -16.187 19.117 1.00 0.00 H new ATOM 1958 N ALA A 130 -4.219 -16.540 14.573 1.00 0.00 N ATOM 1959 CA ALA A 130 -3.467 -16.894 13.382 1.00 0.00 C ATOM 1960 C ALA A 130 -2.039 -16.359 13.440 1.00 0.00 C ATOM 1961 O ALA A 130 -1.101 -17.020 12.996 1.00 0.00 O ATOM 1962 CB ALA A 130 -4.172 -16.376 12.139 1.00 0.00 C ATOM 0 H ALA A 130 -5.075 -16.017 14.387 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.414 -17.982 13.335 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.597 -16.649 11.254 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -5.167 -16.816 12.075 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.258 -15.291 12.195 1.00 0.00 H new ATOM 1968 N ALA A 131 -1.882 -15.158 13.988 1.00 0.00 N ATOM 1969 CA ALA A 131 -0.566 -14.537 14.101 1.00 0.00 C ATOM 1970 C ALA A 131 0.204 -15.101 15.289 1.00 0.00 C ATOM 1971 O ALA A 131 -0.037 -14.720 16.435 1.00 0.00 O ATOM 1972 CB ALA A 131 -0.703 -13.028 14.223 1.00 0.00 C ATOM 0 H ALA A 131 -2.648 -14.596 14.360 1.00 0.00 H new ATOM 0 HA ALA A 131 -0.003 -14.765 13.196 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.286 -12.578 14.307 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -1.206 -12.636 13.339 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -1.287 -12.786 15.111 1.00 0.00 H new ATOM 1978 N GLN A 132 1.129 -16.012 15.008 1.00 0.00 N ATOM 1979 CA GLN A 132 1.937 -16.630 16.053 1.00 0.00 C ATOM 1980 C GLN A 132 3.224 -15.845 16.280 1.00 0.00 C ATOM 1981 O GLN A 132 3.607 -15.012 15.459 1.00 0.00 O ATOM 1982 CB GLN A 132 2.269 -18.078 15.681 1.00 0.00 C ATOM 1983 CG GLN A 132 1.078 -19.018 15.773 1.00 0.00 C ATOM 1984 CD GLN A 132 1.410 -20.312 16.490 1.00 0.00 C ATOM 1985 OE1 GLN A 132 2.537 -20.801 16.424 1.00 0.00 O ATOM 1986 NE2 GLN A 132 0.425 -20.875 17.181 1.00 0.00 N ATOM 0 H GLN A 132 1.338 -16.339 14.065 1.00 0.00 H new ATOM 0 HA GLN A 132 1.359 -16.622 16.977 1.00 0.00 H new ATOM 0 HB2 GLN A 132 2.663 -18.102 14.665 1.00 0.00 H new ATOM 0 HB3 GLN A 132 3.059 -18.441 16.338 1.00 0.00 H new ATOM 0 HG2 GLN A 132 0.263 -18.516 16.295 1.00 0.00 H new ATOM 0 HG3 GLN A 132 0.721 -19.245 14.769 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -0.495 -20.435 17.209 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.589 -21.747 17.684 1.00 0.00 H new ATOM 1995 N LYS A 133 3.889 -16.116 17.399 1.00 0.00 N ATOM 1996 CA LYS A 133 5.134 -15.435 17.734 1.00 0.00 C ATOM 1997 C LYS A 133 6.276 -15.922 16.847 1.00 0.00 C ATOM 1998 O LYS A 133 7.360 -15.338 16.837 1.00 0.00 O ATOM 1999 CB LYS A 133 5.484 -15.662 19.206 1.00 0.00 C ATOM 2000 CG LYS A 133 5.415 -17.120 19.631 1.00 0.00 C ATOM 2001 CD LYS A 133 6.677 -17.548 20.363 1.00 0.00 C ATOM 2002 CE LYS A 133 6.386 -18.635 21.386 1.00 0.00 C ATOM 2003 NZ LYS A 133 5.794 -18.079 22.633 1.00 0.00 N ATOM 0 H LYS A 133 3.586 -16.803 18.089 1.00 0.00 H new ATOM 0 HA LYS A 133 4.993 -14.368 17.562 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.489 -15.285 19.394 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.804 -15.079 19.827 1.00 0.00 H new ATOM 0 HG2 LYS A 133 4.550 -17.271 20.277 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.271 -17.750 18.753 1.00 0.00 H new ATOM 0 HD2 LYS A 133 7.411 -17.911 19.643 1.00 0.00 H new ATOM 0 HD3 LYS A 133 7.119 -16.686 20.862 1.00 0.00 H new ATOM 0 HE2 LYS A 133 5.703 -19.366 20.954 1.00 0.00 H new ATOM 0 HE3 LYS A 133 7.308 -19.164 21.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.610 -18.852 23.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.457 -17.400 23.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 4.901 -17.596 22.408 1.00 0.00 H new ATOM 2017 N ALA A 134 6.023 -16.993 16.102 1.00 0.00 N ATOM 2018 CA ALA A 134 7.027 -17.560 15.208 1.00 0.00 C ATOM 2019 C ALA A 134 7.167 -16.726 13.940 1.00 0.00 C ATOM 2020 O ALA A 134 6.184 -16.456 13.250 1.00 0.00 O ATOM 2021 CB ALA A 134 6.669 -18.998 14.860 1.00 0.00 C ATOM 0 H ALA A 134 5.130 -17.486 16.099 1.00 0.00 H new ATOM 0 HA ALA A 134 7.987 -17.550 15.725 1.00 0.00 H new ATOM 0 HB1 ALA A 134 7.426 -19.410 14.192 1.00 0.00 H new ATOM 0 HB2 ALA A 134 6.627 -19.593 15.772 1.00 0.00 H new ATOM 0 HB3 ALA A 134 5.698 -19.022 14.366 1.00 0.00 H new ATOM 2027 N VAL A 135 8.398 -16.323 13.636 1.00 0.00 N ATOM 2028 CA VAL A 135 8.668 -15.522 12.447 1.00 0.00 C ATOM 2029 C VAL A 135 9.100 -16.401 11.277 1.00 0.00 C ATOM 2030 O VAL A 135 9.634 -15.909 10.283 1.00 0.00 O ATOM 2031 CB VAL A 135 9.758 -14.465 12.713 1.00 0.00 C ATOM 2032 CG1 VAL A 135 9.247 -13.400 13.671 1.00 0.00 C ATOM 2033 CG2 VAL A 135 11.019 -15.120 13.255 1.00 0.00 C ATOM 0 H VAL A 135 9.223 -16.538 14.196 1.00 0.00 H new ATOM 0 HA VAL A 135 7.738 -15.014 12.192 1.00 0.00 H new ATOM 0 HB VAL A 135 10.006 -13.982 11.768 1.00 0.00 H new ATOM 0 HG11 VAL A 135 10.030 -12.663 13.847 1.00 0.00 H new ATOM 0 HG12 VAL A 135 8.376 -12.908 13.237 1.00 0.00 H new ATOM 0 HG13 VAL A 135 8.968 -13.865 14.616 1.00 0.00 H new ATOM 0 HG21 VAL A 135 11.776 -14.357 13.436 1.00 0.00 H new ATOM 0 HG22 VAL A 135 10.790 -15.633 14.189 1.00 0.00 H new ATOM 0 HG23 VAL A 135 11.396 -15.840 12.529 1.00 0.00 H new ATOM 2043 N ASN A 136 8.863 -17.703 11.405 1.00 0.00 N ATOM 2044 CA ASN A 136 9.227 -18.652 10.357 1.00 0.00 C ATOM 2045 C ASN A 136 8.194 -18.648 9.235 1.00 0.00 C ATOM 2046 O ASN A 136 8.543 -18.722 8.056 1.00 0.00 O ATOM 2047 CB ASN A 136 9.358 -20.060 10.940 1.00 0.00 C ATOM 2048 CG ASN A 136 9.898 -21.056 9.931 1.00 0.00 C ATOM 2049 OD1 ASN A 136 10.792 -20.739 9.147 1.00 0.00 O ATOM 2050 ND2 ASN A 136 9.358 -22.269 9.950 1.00 0.00 N ATOM 0 H ASN A 136 8.421 -18.125 12.222 1.00 0.00 H new ATOM 0 HA ASN A 136 10.187 -18.346 9.942 1.00 0.00 H new ATOM 0 HB2 ASN A 136 10.018 -20.031 11.807 1.00 0.00 H new ATOM 0 HB3 ASN A 136 8.383 -20.396 11.293 1.00 0.00 H new ATOM 0 HD21 ASN A 136 9.683 -22.982 9.297 1.00 0.00 H new ATOM 0 HD22 ASN A 136 8.619 -22.488 10.618 1.00 0.00 H new ATOM 2057 N SER A 137 6.921 -18.562 9.609 1.00 0.00 N ATOM 2058 CA SER A 137 5.837 -18.551 8.633 1.00 0.00 C ATOM 2059 C SER A 137 5.738 -17.195 7.943 1.00 0.00 C ATOM 2060 O SER A 137 4.975 -17.028 6.990 1.00 0.00 O ATOM 2061 CB SER A 137 4.508 -18.888 9.312 1.00 0.00 C ATOM 2062 OG SER A 137 3.737 -19.768 8.514 1.00 0.00 O ATOM 0 H SER A 137 6.615 -18.499 10.580 1.00 0.00 H new ATOM 0 HA SER A 137 6.055 -19.307 7.878 1.00 0.00 H new ATOM 0 HB2 SER A 137 4.698 -19.345 10.283 1.00 0.00 H new ATOM 0 HB3 SER A 137 3.947 -17.972 9.495 1.00 0.00 H new ATOM 0 HG SER A 137 2.893 -19.969 8.970 1.00 0.00 H new ATOM 2068 N ALA A 138 6.511 -16.230 8.429 1.00 0.00 N ATOM 2069 CA ALA A 138 6.511 -14.889 7.856 1.00 0.00 C ATOM 2070 C ALA A 138 7.359 -14.835 6.589 1.00 0.00 C ATOM 2071 O ALA A 138 8.469 -14.299 6.593 1.00 0.00 O ATOM 2072 CB ALA A 138 7.014 -13.878 8.877 1.00 0.00 C ATOM 0 H ALA A 138 7.146 -16.351 9.218 1.00 0.00 H new ATOM 0 HA ALA A 138 5.486 -14.634 7.586 1.00 0.00 H new ATOM 0 HB1 ALA A 138 7.009 -12.881 8.435 1.00 0.00 H new ATOM 0 HB2 ALA A 138 6.364 -13.891 9.752 1.00 0.00 H new ATOM 0 HB3 ALA A 138 8.030 -14.137 9.176 1.00 0.00 H new ATOM 2078 N THR A 139 6.830 -15.396 5.506 1.00 0.00 N ATOM 2079 CA THR A 139 7.536 -15.413 4.231 1.00 0.00 C ATOM 2080 C THR A 139 6.783 -14.603 3.182 1.00 0.00 C ATOM 2081 O THR A 139 5.788 -13.945 3.488 1.00 0.00 O ATOM 2082 CB THR A 139 7.720 -16.853 3.747 1.00 0.00 C ATOM 2083 OG1 THR A 139 6.512 -17.582 3.875 1.00 0.00 O ATOM 2084 CG2 THR A 139 8.795 -17.606 4.500 1.00 0.00 C ATOM 0 H THR A 139 5.914 -15.845 5.487 1.00 0.00 H new ATOM 0 HA THR A 139 8.516 -14.959 4.379 1.00 0.00 H new ATOM 0 HB THR A 139 8.023 -16.771 2.703 1.00 0.00 H new ATOM 0 HG1 THR A 139 6.649 -18.500 3.559 1.00 0.00 H new ATOM 0 HG21 THR A 139 8.873 -18.619 4.106 1.00 0.00 H new ATOM 0 HG22 THR A 139 9.750 -17.095 4.378 1.00 0.00 H new ATOM 0 HG23 THR A 139 8.537 -17.647 5.558 1.00 0.00 H new ATOM 2092 N GLY A 140 7.266 -14.651 1.944 1.00 0.00 N ATOM 2093 CA GLY A 140 6.627 -13.914 0.869 1.00 0.00 C ATOM 2094 C GLY A 140 5.507 -14.697 0.213 1.00 0.00 C ATOM 2095 O GLY A 140 4.332 -14.372 0.381 1.00 0.00 O ATOM 0 H GLY A 140 8.088 -15.187 1.666 1.00 0.00 H new ATOM 0 HA2 GLY A 140 6.230 -12.978 1.261 1.00 0.00 H new ATOM 0 HA3 GLY A 140 7.373 -13.654 0.118 1.00 0.00 H new ATOM 2099 N VAL A 141 5.872 -15.731 -0.539 1.00 0.00 N ATOM 2100 CA VAL A 141 4.891 -16.564 -1.225 1.00 0.00 C ATOM 2101 C VAL A 141 4.541 -17.797 -0.394 1.00 0.00 C ATOM 2102 O VAL A 141 5.384 -18.322 0.334 1.00 0.00 O ATOM 2103 CB VAL A 141 5.403 -17.016 -2.607 1.00 0.00 C ATOM 2104 CG1 VAL A 141 5.397 -15.854 -3.586 1.00 0.00 C ATOM 2105 CG2 VAL A 141 6.795 -17.619 -2.491 1.00 0.00 C ATOM 0 H VAL A 141 6.841 -16.012 -0.689 1.00 0.00 H new ATOM 0 HA VAL A 141 3.998 -15.954 -1.361 1.00 0.00 H new ATOM 0 HB VAL A 141 4.731 -17.784 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 141 5.762 -16.193 -4.556 1.00 0.00 H new ATOM 0 HG12 VAL A 141 4.381 -15.474 -3.693 1.00 0.00 H new ATOM 0 HG13 VAL A 141 6.044 -15.060 -3.212 1.00 0.00 H new ATOM 0 HG21 VAL A 141 7.139 -17.932 -3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 141 7.481 -16.875 -2.086 1.00 0.00 H new ATOM 0 HG23 VAL A 141 6.763 -18.483 -1.827 1.00 0.00 H new ATOM 2115 N PRO A 142 3.286 -18.276 -0.489 1.00 0.00 N ATOM 2116 CA PRO A 142 2.834 -19.454 0.261 1.00 0.00 C ATOM 2117 C PRO A 142 3.561 -20.725 -0.165 1.00 0.00 C ATOM 2118 O PRO A 142 3.818 -20.937 -1.349 1.00 0.00 O ATOM 2119 CB PRO A 142 1.344 -19.551 -0.079 1.00 0.00 C ATOM 2120 CG PRO A 142 1.196 -18.818 -1.368 1.00 0.00 C ATOM 2121 CD PRO A 142 2.215 -17.715 -1.332 1.00 0.00 C ATOM 0 HA PRO A 142 3.032 -19.355 1.328 1.00 0.00 H new ATOM 0 HB2 PRO A 142 1.028 -20.590 -0.177 1.00 0.00 H new ATOM 0 HB3 PRO A 142 0.730 -19.103 0.703 1.00 0.00 H new ATOM 0 HG2 PRO A 142 1.367 -19.481 -2.216 1.00 0.00 H new ATOM 0 HG3 PRO A 142 0.189 -18.416 -1.476 1.00 0.00 H new ATOM 0 HD2 PRO A 142 2.576 -17.467 -2.330 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.804 -16.800 -0.905 1.00 0.00 H new ATOM 2129 N THR A 143 3.891 -21.567 0.811 1.00 0.00 N ATOM 2130 CA THR A 143 4.593 -22.817 0.538 1.00 0.00 C ATOM 2131 C THR A 143 3.646 -24.010 0.639 1.00 0.00 C ATOM 2132 O THR A 143 3.403 -24.705 -0.347 1.00 0.00 O ATOM 2133 CB THR A 143 5.763 -22.994 1.510 1.00 0.00 C ATOM 2134 OG1 THR A 143 6.107 -24.363 1.636 1.00 0.00 O ATOM 2135 CG2 THR A 143 5.482 -22.460 2.898 1.00 0.00 C ATOM 0 H THR A 143 3.684 -21.406 1.797 1.00 0.00 H new ATOM 0 HA THR A 143 4.980 -22.770 -0.480 1.00 0.00 H new ATOM 0 HB THR A 143 6.582 -22.418 1.080 1.00 0.00 H new ATOM 0 HG1 THR A 143 6.857 -24.456 2.260 1.00 0.00 H new ATOM 0 HG21 THR A 143 6.354 -22.619 3.532 1.00 0.00 H new ATOM 0 HG22 THR A 143 5.265 -21.393 2.840 1.00 0.00 H new ATOM 0 HG23 THR A 143 4.624 -22.982 3.322 1.00 0.00 H new ATOM 2143 N VAL A 144 3.114 -24.240 1.836 1.00 0.00 N ATOM 2144 CA VAL A 144 2.195 -25.350 2.063 1.00 0.00 C ATOM 2145 C VAL A 144 0.757 -24.945 1.758 1.00 0.00 C ATOM 2146 O VAL A 144 0.189 -25.472 0.778 1.00 0.00 O ATOM 2147 CB VAL A 144 2.277 -25.863 3.513 1.00 0.00 C ATOM 2148 CG1 VAL A 144 1.629 -27.235 3.632 1.00 0.00 C ATOM 2149 CG2 VAL A 144 3.722 -25.906 3.987 1.00 0.00 C ATOM 2150 OXT VAL A 144 0.210 -24.103 2.502 1.00 0.00 O ATOM 0 H VAL A 144 3.303 -23.673 2.663 1.00 0.00 H new ATOM 0 HA VAL A 144 2.495 -26.151 1.387 1.00 0.00 H new ATOM 0 HB VAL A 144 1.731 -25.170 4.153 1.00 0.00 H new ATOM 0 HG11 VAL A 144 1.697 -27.581 4.663 1.00 0.00 H new ATOM 0 HG12 VAL A 144 0.581 -27.169 3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 144 2.145 -27.939 2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.758 -26.271 5.013 1.00 0.00 H new ATOM 0 HG22 VAL A 144 4.296 -26.574 3.344 1.00 0.00 H new ATOM 0 HG23 VAL A 144 4.149 -24.904 3.943 1.00 0.00 H new TER 2160 VAL A 144