USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1145 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 79 CYS SG : rot 180:sc= -0.597 USER MOD Set 1.2: A 88 MET CE :methyl -179:sc= -0.592 (180deg=-0.0463) USER MOD Single : A 4 SER OG : rot 180:sc= 0.0311 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -153:sc= 1.29 (180deg=0.986) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0329 USER MOD Single : A 13 GLN : amide:sc= -0.114 K(o=-0.11,f=-2!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.0669 K(o=-0.067,f=-2!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.415 K(o=-0.41,f=-1.9!) USER MOD Single : A 31 MET CE :methyl 167:sc= 0 (180deg=-0.178) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= 0.703 K(o=0.7,f=-0.3) USER MOD Single : A 60 SER OG : rot 79:sc= 0.171 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -69:sc= 0.581 USER MOD Single : A 68 MET CE :methyl 168:sc= 0 (180deg=-0.174) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 147:sc= -0.22 (180deg=-0.533) USER MOD Single : A 78 SER OG : rot -40:sc= 0.0228 USER MOD Single : A 80 GLN : amide:sc= -0.344 X(o=-0.34,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0275 USER MOD Single : A 84 SER OG : rot 180:sc= -0.0784 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.535 K(o=-0.53,f=-3.2!) USER MOD Single : A 104 SER OG : rot 6:sc= 0.315 USER MOD Single : A 106 HIS : no HD1:sc= -2.31 K(o=-2.3,f=-6.2!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00163) USER MOD Single : A 118 LYS NZ :NH3+ 142:sc= 0.802 (180deg=0.175) USER MOD Single : A 126 THR OG1 : rot 83:sc= 1.19 USER MOD Single : A 131 HIS : no HE2:sc= 0.59 K(o=0.59,f=-1.9!) USER MOD Single : A 132 HIS : no HE2:sc= -1.36 K(o=-1.4,f=-3.7!) USER MOD Single : A 134 HIS : no HE2:sc= -0.241 K(o=-0.24,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 26.567 -19.644 -34.353 1.00 0.00 N ATOM 2 CA PRO A 1 25.797 -20.254 -33.258 1.00 0.00 C ATOM 3 C PRO A 1 26.733 -20.834 -32.196 1.00 0.00 C ATOM 4 O PRO A 1 27.657 -21.575 -32.528 1.00 0.00 O ATOM 5 CB PRO A 1 24.933 -21.345 -33.908 1.00 0.00 C ATOM 6 CG PRO A 1 25.740 -21.765 -35.144 1.00 0.00 C ATOM 7 CD PRO A 1 26.422 -20.461 -35.568 1.00 0.00 C ATOM 0 H2 PRO A 1 27.551 -19.574 -34.093 1.00 0.00 H new ATOM 0 H3 PRO A 1 26.237 -18.695 -34.527 1.00 0.00 H new ATOM 0 HA PRO A 1 25.175 -19.521 -32.744 1.00 0.00 H new ATOM 0 HB2 PRO A 1 24.773 -22.184 -33.231 1.00 0.00 H new ATOM 0 HB3 PRO A 1 23.949 -20.965 -34.183 1.00 0.00 H new ATOM 0 HG2 PRO A 1 26.467 -22.542 -34.907 1.00 0.00 H new ATOM 0 HG3 PRO A 1 25.097 -22.159 -35.931 1.00 0.00 H new ATOM 0 HD2 PRO A 1 27.394 -20.662 -36.018 1.00 0.00 H new ATOM 0 HD3 PRO A 1 25.826 -19.939 -36.317 1.00 0.00 H new ATOM 15 N ALA A 2 26.516 -20.470 -30.933 1.00 0.00 N ATOM 16 CA ALA A 2 27.271 -20.912 -29.768 1.00 0.00 C ATOM 17 C ALA A 2 26.292 -21.058 -28.597 1.00 0.00 C ATOM 18 O ALA A 2 25.163 -20.567 -28.670 1.00 0.00 O ATOM 19 CB ALA A 2 28.374 -19.896 -29.447 1.00 0.00 C ATOM 0 H ALA A 2 25.767 -19.823 -30.685 1.00 0.00 H new ATOM 0 HA ALA A 2 27.753 -21.871 -29.959 1.00 0.00 H new ATOM 0 HB1 ALA A 2 28.935 -20.232 -28.575 1.00 0.00 H new ATOM 0 HB2 ALA A 2 29.047 -19.808 -30.300 1.00 0.00 H new ATOM 0 HB3 ALA A 2 27.925 -18.925 -29.238 1.00 0.00 H new ATOM 25 N ALA A 3 26.716 -21.728 -27.528 1.00 0.00 N ATOM 26 CA ALA A 3 25.929 -21.965 -26.327 1.00 0.00 C ATOM 27 C ALA A 3 26.881 -22.013 -25.133 1.00 0.00 C ATOM 28 O ALA A 3 28.073 -22.273 -25.310 1.00 0.00 O ATOM 29 CB ALA A 3 25.196 -23.306 -26.473 1.00 0.00 C ATOM 0 H ALA A 3 27.650 -22.134 -27.475 1.00 0.00 H new ATOM 0 HA ALA A 3 25.196 -21.172 -26.179 1.00 0.00 H new ATOM 0 HB1 ALA A 3 24.602 -23.495 -25.579 1.00 0.00 H new ATOM 0 HB2 ALA A 3 24.540 -23.269 -27.343 1.00 0.00 H new ATOM 0 HB3 ALA A 3 25.924 -24.107 -26.601 1.00 0.00 H new ATOM 35 N SER A 4 26.370 -21.737 -23.937 1.00 0.00 N ATOM 36 CA SER A 4 27.140 -21.768 -22.699 1.00 0.00 C ATOM 37 C SER A 4 27.033 -23.176 -22.091 1.00 0.00 C ATOM 38 O SER A 4 26.140 -23.935 -22.484 1.00 0.00 O ATOM 39 CB SER A 4 26.573 -20.699 -21.742 1.00 0.00 C ATOM 40 OG SER A 4 25.155 -20.697 -21.711 1.00 0.00 O ATOM 0 H SER A 4 25.392 -21.481 -23.799 1.00 0.00 H new ATOM 0 HA SER A 4 28.192 -21.548 -22.881 1.00 0.00 H new ATOM 0 HB2 SER A 4 26.955 -20.876 -20.737 1.00 0.00 H new ATOM 0 HB3 SER A 4 26.928 -19.715 -22.049 1.00 0.00 H new ATOM 0 HG SER A 4 24.842 -20.006 -21.091 1.00 0.00 H new ATOM 46 N PRO A 5 27.912 -23.577 -21.156 1.00 0.00 N ATOM 47 CA PRO A 5 27.792 -24.891 -20.532 1.00 0.00 C ATOM 48 C PRO A 5 26.551 -24.856 -19.621 1.00 0.00 C ATOM 49 O PRO A 5 26.075 -23.772 -19.264 1.00 0.00 O ATOM 50 CB PRO A 5 29.091 -25.080 -19.743 1.00 0.00 C ATOM 51 CG PRO A 5 29.497 -23.650 -19.384 1.00 0.00 C ATOM 52 CD PRO A 5 29.027 -22.832 -20.588 1.00 0.00 C ATOM 0 HA PRO A 5 27.664 -25.716 -21.233 1.00 0.00 H new ATOM 0 HB2 PRO A 5 28.936 -25.689 -18.853 1.00 0.00 H new ATOM 0 HB3 PRO A 5 29.855 -25.577 -20.340 1.00 0.00 H new ATOM 0 HG2 PRO A 5 29.020 -23.317 -18.462 1.00 0.00 H new ATOM 0 HG3 PRO A 5 30.573 -23.564 -19.236 1.00 0.00 H new ATOM 0 HD2 PRO A 5 28.717 -21.832 -20.285 1.00 0.00 H new ATOM 0 HD3 PRO A 5 29.829 -22.710 -21.316 1.00 0.00 H new ATOM 60 N SER A 6 26.008 -26.010 -19.239 1.00 0.00 N ATOM 61 CA SER A 6 24.839 -26.084 -18.370 1.00 0.00 C ATOM 62 C SER A 6 25.238 -26.656 -17.011 1.00 0.00 C ATOM 63 O SER A 6 26.346 -27.169 -16.830 1.00 0.00 O ATOM 64 CB SER A 6 23.722 -26.873 -19.065 1.00 0.00 C ATOM 65 OG SER A 6 24.147 -28.158 -19.469 1.00 0.00 O ATOM 0 H SER A 6 26.368 -26.921 -19.525 1.00 0.00 H new ATOM 0 HA SER A 6 24.441 -25.087 -18.181 1.00 0.00 H new ATOM 0 HB2 SER A 6 22.873 -26.969 -18.389 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.375 -26.317 -19.936 1.00 0.00 H new ATOM 0 HG SER A 6 23.405 -28.626 -19.905 1.00 0.00 H new ATOM 71 N ALA A 7 24.346 -26.528 -16.030 1.00 0.00 N ATOM 72 CA ALA A 7 24.543 -27.020 -14.681 1.00 0.00 C ATOM 73 C ALA A 7 23.197 -27.361 -14.055 1.00 0.00 C ATOM 74 O ALA A 7 22.139 -26.974 -14.553 1.00 0.00 O ATOM 75 CB ALA A 7 25.237 -25.959 -13.829 1.00 0.00 C ATOM 0 H ALA A 7 23.446 -26.067 -16.162 1.00 0.00 H new ATOM 0 HA ALA A 7 25.166 -27.913 -14.723 1.00 0.00 H new ATOM 0 HB1 ALA A 7 25.379 -26.340 -12.818 1.00 0.00 H new ATOM 0 HB2 ALA A 7 26.206 -25.718 -14.266 1.00 0.00 H new ATOM 0 HB3 ALA A 7 24.621 -25.060 -13.794 1.00 0.00 H new ATOM 81 N LEU A 8 23.266 -28.061 -12.924 1.00 0.00 N ATOM 82 CA LEU A 8 22.143 -28.523 -12.126 1.00 0.00 C ATOM 83 C LEU A 8 22.572 -28.245 -10.691 1.00 0.00 C ATOM 84 O LEU A 8 23.615 -28.766 -10.271 1.00 0.00 O ATOM 85 CB LEU A 8 21.886 -30.024 -12.382 1.00 0.00 C ATOM 86 CG LEU A 8 21.760 -30.390 -13.879 1.00 0.00 C ATOM 87 CD1 LEU A 8 23.064 -30.989 -14.430 1.00 0.00 C ATOM 88 CD2 LEU A 8 20.637 -31.407 -14.107 1.00 0.00 C ATOM 0 H LEU A 8 24.162 -28.334 -12.521 1.00 0.00 H new ATOM 0 HA LEU A 8 21.204 -28.024 -12.366 1.00 0.00 H new ATOM 0 HB2 LEU A 8 22.699 -30.602 -11.944 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.972 -30.319 -11.867 1.00 0.00 H new ATOM 0 HG LEU A 8 21.536 -29.461 -14.403 1.00 0.00 H new ATOM 0 HD11 LEU A 8 22.935 -31.233 -15.484 1.00 0.00 H new ATOM 0 HD12 LEU A 8 23.871 -30.265 -14.321 1.00 0.00 H new ATOM 0 HD13 LEU A 8 23.311 -31.894 -13.876 1.00 0.00 H new ATOM 0 HD21 LEU A 8 20.572 -31.645 -15.169 1.00 0.00 H new ATOM 0 HD22 LEU A 8 20.849 -32.316 -13.543 1.00 0.00 H new ATOM 0 HD23 LEU A 8 19.690 -30.985 -13.771 1.00 0.00 H new ATOM 100 N LYS A 9 21.884 -27.363 -9.959 1.00 0.00 N ATOM 101 CA LYS A 9 22.253 -27.033 -8.579 1.00 0.00 C ATOM 102 C LYS A 9 21.011 -26.628 -7.775 1.00 0.00 C ATOM 103 O LYS A 9 19.910 -27.091 -8.069 1.00 0.00 O ATOM 104 CB LYS A 9 23.403 -25.993 -8.593 1.00 0.00 C ATOM 105 CG LYS A 9 24.414 -26.103 -7.432 1.00 0.00 C ATOM 106 CD LYS A 9 25.381 -27.304 -7.506 1.00 0.00 C ATOM 107 CE LYS A 9 24.803 -28.586 -6.881 1.00 0.00 C ATOM 108 NZ LYS A 9 24.608 -29.678 -7.859 1.00 0.00 N ATOM 0 H LYS A 9 21.064 -26.862 -10.302 1.00 0.00 H new ATOM 0 HA LYS A 9 22.646 -27.905 -8.056 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.945 -26.090 -9.534 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.966 -24.994 -8.578 1.00 0.00 H new ATOM 0 HG2 LYS A 9 25.003 -25.186 -7.397 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.860 -26.162 -6.495 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.632 -27.497 -8.549 1.00 0.00 H new ATOM 0 HD3 LYS A 9 26.310 -27.046 -6.997 1.00 0.00 H new ATOM 0 HE2 LYS A 9 25.471 -28.930 -6.091 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.847 -28.354 -6.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 23.842 -30.302 -7.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.357 -29.275 -8.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.487 -30.226 -7.947 1.00 0.00 H new ATOM 122 N GLY A 10 21.186 -25.808 -6.736 1.00 0.00 N ATOM 123 CA GLY A 10 20.106 -25.356 -5.880 1.00 0.00 C ATOM 124 C GLY A 10 19.960 -26.368 -4.759 1.00 0.00 C ATOM 125 O GLY A 10 19.104 -27.248 -4.839 1.00 0.00 O ATOM 0 H GLY A 10 22.098 -25.439 -6.469 1.00 0.00 H new ATOM 0 HA2 GLY A 10 20.324 -24.367 -5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 10 19.178 -25.273 -6.445 1.00 0.00 H new ATOM 129 N VAL A 11 20.825 -26.300 -3.745 1.00 0.00 N ATOM 130 CA VAL A 11 20.817 -27.196 -2.587 1.00 0.00 C ATOM 131 C VAL A 11 20.352 -26.389 -1.371 1.00 0.00 C ATOM 132 O VAL A 11 20.674 -25.203 -1.253 1.00 0.00 O ATOM 133 CB VAL A 11 22.198 -27.875 -2.445 1.00 0.00 C ATOM 134 CG1 VAL A 11 23.350 -26.894 -2.170 1.00 0.00 C ATOM 135 CG2 VAL A 11 22.191 -28.973 -1.374 1.00 0.00 C ATOM 0 H VAL A 11 21.569 -25.603 -3.706 1.00 0.00 H new ATOM 0 HA VAL A 11 20.114 -28.022 -2.699 1.00 0.00 H new ATOM 0 HB VAL A 11 22.383 -28.324 -3.421 1.00 0.00 H new ATOM 0 HG11 VAL A 11 24.286 -27.447 -2.083 1.00 0.00 H new ATOM 0 HG12 VAL A 11 23.425 -26.181 -2.991 1.00 0.00 H new ATOM 0 HG13 VAL A 11 23.158 -26.358 -1.241 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.181 -29.423 -1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 11 21.925 -28.539 -0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 11 21.462 -29.738 -1.642 1.00 0.00 H new ATOM 145 N SER A 12 19.625 -27.013 -0.447 1.00 0.00 N ATOM 146 CA SER A 12 19.086 -26.382 0.750 1.00 0.00 C ATOM 147 C SER A 12 20.047 -26.246 1.914 1.00 0.00 C ATOM 148 O SER A 12 19.869 -25.409 2.791 1.00 0.00 O ATOM 149 CB SER A 12 17.806 -27.123 1.142 1.00 0.00 C ATOM 150 OG SER A 12 18.062 -28.516 1.160 1.00 0.00 O ATOM 0 H SER A 12 19.389 -28.003 -0.515 1.00 0.00 H new ATOM 0 HA SER A 12 18.876 -25.343 0.496 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.465 -26.791 2.123 1.00 0.00 H new ATOM 0 HB3 SER A 12 17.009 -26.897 0.434 1.00 0.00 H new ATOM 0 HG SER A 12 17.245 -28.995 1.412 1.00 0.00 H new ATOM 156 N GLN A 13 21.106 -27.026 1.870 1.00 0.00 N ATOM 157 CA GLN A 13 22.144 -27.043 2.903 1.00 0.00 C ATOM 158 C GLN A 13 22.734 -25.632 3.001 1.00 0.00 C ATOM 159 O GLN A 13 22.734 -25.026 4.068 1.00 0.00 O ATOM 160 CB GLN A 13 23.202 -28.132 2.631 1.00 0.00 C ATOM 161 CG GLN A 13 23.931 -28.596 3.910 1.00 0.00 C ATOM 162 CD GLN A 13 24.585 -27.457 4.693 1.00 0.00 C ATOM 163 OE1 GLN A 13 24.136 -27.120 5.786 1.00 0.00 O ATOM 164 NE2 GLN A 13 25.595 -26.827 4.112 1.00 0.00 N ATOM 0 H GLN A 13 21.281 -27.680 1.107 1.00 0.00 H new ATOM 0 HA GLN A 13 21.716 -27.310 3.869 1.00 0.00 H new ATOM 0 HB2 GLN A 13 22.720 -28.990 2.162 1.00 0.00 H new ATOM 0 HB3 GLN A 13 23.935 -27.750 1.920 1.00 0.00 H new ATOM 0 HG2 GLN A 13 23.219 -29.108 4.557 1.00 0.00 H new ATOM 0 HG3 GLN A 13 24.696 -29.324 3.638 1.00 0.00 H new ATOM 0 HE21 GLN A 13 25.937 -27.140 3.203 1.00 0.00 H new ATOM 0 HE22 GLN A 13 26.031 -26.029 4.573 1.00 0.00 H new ATOM 173 N ALA A 14 23.128 -25.060 1.858 1.00 0.00 N ATOM 174 CA ALA A 14 23.702 -23.723 1.792 1.00 0.00 C ATOM 175 C ALA A 14 22.738 -22.612 2.244 1.00 0.00 C ATOM 176 O ALA A 14 23.105 -21.438 2.216 1.00 0.00 O ATOM 177 CB ALA A 14 24.250 -23.476 0.383 1.00 0.00 C ATOM 0 H ALA A 14 23.055 -25.519 0.950 1.00 0.00 H new ATOM 0 HA ALA A 14 24.521 -23.680 2.510 1.00 0.00 H new ATOM 0 HB1 ALA A 14 24.680 -22.476 0.330 1.00 0.00 H new ATOM 0 HB2 ALA A 14 25.019 -24.215 0.157 1.00 0.00 H new ATOM 0 HB3 ALA A 14 23.441 -23.562 -0.342 1.00 0.00 H new ATOM 183 N LEU A 15 21.461 -22.928 2.466 1.00 0.00 N ATOM 184 CA LEU A 15 20.437 -22.014 2.952 1.00 0.00 C ATOM 185 C LEU A 15 20.389 -22.209 4.472 1.00 0.00 C ATOM 186 O LEU A 15 20.508 -21.248 5.232 1.00 0.00 O ATOM 187 CB LEU A 15 19.084 -22.252 2.241 1.00 0.00 C ATOM 188 CG LEU A 15 18.910 -21.496 0.906 1.00 0.00 C ATOM 189 CD1 LEU A 15 18.646 -20.003 1.105 1.00 0.00 C ATOM 190 CD2 LEU A 15 20.116 -21.649 -0.032 1.00 0.00 C ATOM 0 H LEU A 15 21.101 -23.869 2.304 1.00 0.00 H new ATOM 0 HA LEU A 15 20.669 -20.973 2.725 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.971 -23.320 2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 15 18.279 -21.959 2.915 1.00 0.00 H new ATOM 0 HG LEU A 15 18.039 -21.961 0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.532 -19.521 0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.734 -19.869 1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.484 -19.553 1.637 1.00 0.00 H new ATOM 0 HD21 LEU A 15 19.933 -21.095 -0.953 1.00 0.00 H new ATOM 0 HD22 LEU A 15 21.008 -21.257 0.456 1.00 0.00 H new ATOM 0 HD23 LEU A 15 20.264 -22.703 -0.266 1.00 0.00 H new ATOM 202 N LEU A 16 20.255 -23.464 4.912 1.00 0.00 N ATOM 203 CA LEU A 16 20.182 -23.887 6.307 1.00 0.00 C ATOM 204 C LEU A 16 21.384 -23.435 7.127 1.00 0.00 C ATOM 205 O LEU A 16 21.195 -22.870 8.205 1.00 0.00 O ATOM 206 CB LEU A 16 20.115 -25.419 6.407 1.00 0.00 C ATOM 207 CG LEU A 16 18.827 -26.058 5.876 1.00 0.00 C ATOM 208 CD1 LEU A 16 19.007 -27.579 5.835 1.00 0.00 C ATOM 209 CD2 LEU A 16 17.614 -25.707 6.734 1.00 0.00 C ATOM 0 H LEU A 16 20.191 -24.252 4.267 1.00 0.00 H new ATOM 0 HA LEU A 16 19.281 -23.422 6.706 1.00 0.00 H new ATOM 0 HB2 LEU A 16 20.960 -25.839 5.861 1.00 0.00 H new ATOM 0 HB3 LEU A 16 20.237 -25.703 7.452 1.00 0.00 H new ATOM 0 HG LEU A 16 18.642 -25.666 4.876 1.00 0.00 H new ATOM 0 HD11 LEU A 16 18.096 -28.043 5.458 1.00 0.00 H new ATOM 0 HD12 LEU A 16 19.840 -27.829 5.178 1.00 0.00 H new ATOM 0 HD13 LEU A 16 19.214 -27.948 6.840 1.00 0.00 H new ATOM 0 HD21 LEU A 16 16.725 -26.182 6.319 1.00 0.00 H new ATOM 0 HD22 LEU A 16 17.773 -26.062 7.752 1.00 0.00 H new ATOM 0 HD23 LEU A 16 17.476 -24.626 6.744 1.00 0.00 H new ATOM 221 N GLU A 17 22.605 -23.635 6.622 1.00 0.00 N ATOM 222 CA GLU A 17 23.845 -23.280 7.316 1.00 0.00 C ATOM 223 C GLU A 17 23.909 -21.804 7.732 1.00 0.00 C ATOM 224 O GLU A 17 24.581 -21.445 8.699 1.00 0.00 O ATOM 225 CB GLU A 17 25.045 -23.657 6.421 1.00 0.00 C ATOM 226 CG GLU A 17 25.306 -22.608 5.325 1.00 0.00 C ATOM 227 CD GLU A 17 26.260 -23.017 4.205 1.00 0.00 C ATOM 228 OE1 GLU A 17 26.563 -24.219 4.055 1.00 0.00 O ATOM 229 OE2 GLU A 17 26.598 -22.093 3.424 1.00 0.00 O ATOM 0 H GLU A 17 22.761 -24.055 5.706 1.00 0.00 H new ATOM 0 HA GLU A 17 23.878 -23.845 8.247 1.00 0.00 H new ATOM 0 HB2 GLU A 17 25.937 -23.764 7.038 1.00 0.00 H new ATOM 0 HB3 GLU A 17 24.860 -24.626 5.957 1.00 0.00 H new ATOM 0 HG2 GLU A 17 24.350 -22.337 4.877 1.00 0.00 H new ATOM 0 HG3 GLU A 17 25.702 -21.710 5.799 1.00 0.00 H new ATOM 236 N ARG A 18 23.201 -20.929 7.011 1.00 0.00 N ATOM 237 CA ARG A 18 23.218 -19.502 7.301 1.00 0.00 C ATOM 238 C ARG A 18 22.186 -19.084 8.326 1.00 0.00 C ATOM 239 O ARG A 18 22.297 -17.954 8.783 1.00 0.00 O ATOM 240 CB ARG A 18 23.101 -18.715 5.989 1.00 0.00 C ATOM 241 CG ARG A 18 24.428 -18.835 5.221 1.00 0.00 C ATOM 242 CD ARG A 18 24.252 -18.773 3.708 1.00 0.00 C ATOM 243 NE ARG A 18 25.278 -19.589 3.042 1.00 0.00 N ATOM 244 CZ ARG A 18 25.684 -19.493 1.780 1.00 0.00 C ATOM 245 NH1 ARG A 18 25.211 -18.529 0.998 1.00 0.00 N ATOM 246 NH2 ARG A 18 26.567 -20.371 1.326 1.00 0.00 N ATOM 0 H ARG A 18 22.610 -21.190 6.222 1.00 0.00 H new ATOM 0 HA ARG A 18 24.174 -19.265 7.769 1.00 0.00 H new ATOM 0 HB2 ARG A 18 22.280 -19.104 5.387 1.00 0.00 H new ATOM 0 HB3 ARG A 18 22.877 -17.668 6.195 1.00 0.00 H new ATOM 0 HG2 ARG A 18 25.097 -18.034 5.536 1.00 0.00 H new ATOM 0 HG3 ARG A 18 24.910 -19.776 5.486 1.00 0.00 H new ATOM 0 HD2 ARG A 18 23.259 -19.131 3.435 1.00 0.00 H new ATOM 0 HD3 ARG A 18 24.323 -17.740 3.369 1.00 0.00 H new ATOM 0 HE ARG A 18 25.727 -20.307 3.610 1.00 0.00 H new ATOM 0 HH11 ARG A 18 24.534 -17.860 1.366 1.00 0.00 H new ATOM 0 HH12 ARG A 18 25.524 -18.458 0.030 1.00 0.00 H new ATOM 0 HH21 ARG A 18 26.922 -21.103 1.942 1.00 0.00 H new ATOM 0 HH22 ARG A 18 26.892 -20.315 0.361 1.00 0.00 H new ATOM 260 N ILE A 19 21.232 -19.929 8.728 1.00 0.00 N ATOM 261 CA ILE A 19 20.221 -19.545 9.717 1.00 0.00 C ATOM 262 C ILE A 19 20.946 -19.080 10.987 1.00 0.00 C ATOM 263 O ILE A 19 20.668 -17.986 11.483 1.00 0.00 O ATOM 264 CB ILE A 19 19.205 -20.687 9.947 1.00 0.00 C ATOM 265 CG1 ILE A 19 18.462 -21.006 8.630 1.00 0.00 C ATOM 266 CG2 ILE A 19 18.181 -20.319 11.036 1.00 0.00 C ATOM 267 CD1 ILE A 19 17.595 -22.261 8.701 1.00 0.00 C ATOM 0 H ILE A 19 21.139 -20.884 8.383 1.00 0.00 H new ATOM 0 HA ILE A 19 19.618 -18.712 9.357 1.00 0.00 H new ATOM 0 HB ILE A 19 19.760 -21.564 10.281 1.00 0.00 H new ATOM 0 HG12 ILE A 19 17.834 -20.156 8.363 1.00 0.00 H new ATOM 0 HG13 ILE A 19 19.193 -21.125 7.831 1.00 0.00 H new ATOM 0 HG21 ILE A 19 17.482 -21.144 11.172 1.00 0.00 H new ATOM 0 HG22 ILE A 19 18.701 -20.126 11.974 1.00 0.00 H new ATOM 0 HG23 ILE A 19 17.634 -19.426 10.734 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.106 -22.420 7.740 1.00 0.00 H new ATOM 0 HD12 ILE A 19 18.220 -23.122 8.937 1.00 0.00 H new ATOM 0 HD13 ILE A 19 16.840 -22.138 9.477 1.00 0.00 H new ATOM 279 N ARG A 20 21.918 -19.862 11.474 1.00 0.00 N ATOM 280 CA ARG A 20 22.696 -19.520 12.659 1.00 0.00 C ATOM 281 C ARG A 20 23.437 -18.211 12.421 1.00 0.00 C ATOM 282 O ARG A 20 23.337 -17.286 13.223 1.00 0.00 O ATOM 283 CB ARG A 20 23.649 -20.691 12.978 1.00 0.00 C ATOM 284 CG ARG A 20 24.714 -20.424 14.056 1.00 0.00 C ATOM 285 CD ARG A 20 24.121 -19.822 15.335 1.00 0.00 C ATOM 286 NE ARG A 20 24.966 -20.055 16.519 1.00 0.00 N ATOM 287 CZ ARG A 20 25.017 -21.177 17.252 1.00 0.00 C ATOM 288 NH1 ARG A 20 24.346 -22.271 16.891 1.00 0.00 N ATOM 289 NH2 ARG A 20 25.758 -21.184 18.356 1.00 0.00 N ATOM 0 H ARG A 20 22.183 -20.752 11.052 1.00 0.00 H new ATOM 0 HA ARG A 20 22.049 -19.368 13.523 1.00 0.00 H new ATOM 0 HB2 ARG A 20 23.049 -21.545 13.293 1.00 0.00 H new ATOM 0 HB3 ARG A 20 24.157 -20.980 12.058 1.00 0.00 H new ATOM 0 HG2 ARG A 20 25.221 -21.358 14.300 1.00 0.00 H new ATOM 0 HG3 ARG A 20 25.468 -19.747 13.656 1.00 0.00 H new ATOM 0 HD2 ARG A 20 23.984 -18.749 15.197 1.00 0.00 H new ATOM 0 HD3 ARG A 20 23.134 -20.250 15.509 1.00 0.00 H new ATOM 0 HE ARG A 20 25.572 -19.288 16.810 1.00 0.00 H new ATOM 0 HH11 ARG A 20 23.780 -22.265 16.043 1.00 0.00 H new ATOM 0 HH12 ARG A 20 24.399 -23.114 17.463 1.00 0.00 H new ATOM 0 HH21 ARG A 20 26.273 -20.347 18.630 1.00 0.00 H new ATOM 0 HH22 ARG A 20 25.812 -22.026 18.929 1.00 0.00 H new ATOM 303 N ALA A 21 24.170 -18.116 11.311 1.00 0.00 N ATOM 304 CA ALA A 21 24.934 -16.920 10.987 1.00 0.00 C ATOM 305 C ALA A 21 24.054 -15.664 10.882 1.00 0.00 C ATOM 306 O ALA A 21 24.498 -14.572 11.240 1.00 0.00 O ATOM 307 CB ALA A 21 25.712 -17.158 9.689 1.00 0.00 C ATOM 0 H ALA A 21 24.248 -18.861 10.619 1.00 0.00 H new ATOM 0 HA ALA A 21 25.630 -16.731 11.805 1.00 0.00 H new ATOM 0 HB1 ALA A 21 26.287 -16.266 9.440 1.00 0.00 H new ATOM 0 HB2 ALA A 21 26.390 -18.001 9.821 1.00 0.00 H new ATOM 0 HB3 ALA A 21 25.014 -17.377 8.881 1.00 0.00 H new ATOM 313 N LYS A 22 22.814 -15.797 10.405 1.00 0.00 N ATOM 314 CA LYS A 22 21.864 -14.699 10.259 1.00 0.00 C ATOM 315 C LYS A 22 21.438 -14.193 11.628 1.00 0.00 C ATOM 316 O LYS A 22 21.250 -12.987 11.794 1.00 0.00 O ATOM 317 CB LYS A 22 20.666 -15.139 9.421 1.00 0.00 C ATOM 318 CG LYS A 22 21.070 -14.984 7.948 1.00 0.00 C ATOM 319 CD LYS A 22 20.404 -16.007 7.050 1.00 0.00 C ATOM 320 CE LYS A 22 19.002 -15.625 6.575 1.00 0.00 C ATOM 321 NZ LYS A 22 19.044 -14.609 5.503 1.00 0.00 N ATOM 0 H LYS A 22 22.436 -16.695 10.103 1.00 0.00 H new ATOM 0 HA LYS A 22 22.346 -13.875 9.733 1.00 0.00 H new ATOM 0 HB2 LYS A 22 20.400 -16.173 9.641 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.791 -14.529 9.648 1.00 0.00 H new ATOM 0 HG2 LYS A 22 20.809 -13.982 7.607 1.00 0.00 H new ATOM 0 HG3 LYS A 22 22.152 -15.079 7.860 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.036 -16.170 6.177 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.346 -16.956 7.584 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.486 -16.514 6.213 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.425 -15.242 7.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.075 -14.376 5.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 19.514 -13.751 5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.573 -14.984 4.690 1.00 0.00 H new ATOM 335 N GLU A 23 21.293 -15.089 12.604 1.00 0.00 N ATOM 336 CA GLU A 23 20.908 -14.716 13.959 1.00 0.00 C ATOM 337 C GLU A 23 22.080 -13.992 14.625 1.00 0.00 C ATOM 338 O GLU A 23 21.863 -13.002 15.320 1.00 0.00 O ATOM 339 CB GLU A 23 20.388 -15.936 14.735 1.00 0.00 C ATOM 340 CG GLU A 23 19.048 -16.360 14.112 1.00 0.00 C ATOM 341 CD GLU A 23 18.305 -17.458 14.868 1.00 0.00 C ATOM 342 OE1 GLU A 23 18.824 -18.589 15.015 1.00 0.00 O ATOM 343 OE2 GLU A 23 17.129 -17.209 15.225 1.00 0.00 O ATOM 0 H GLU A 23 21.439 -16.090 12.475 1.00 0.00 H new ATOM 0 HA GLU A 23 20.071 -14.018 13.946 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.107 -16.754 14.685 1.00 0.00 H new ATOM 0 HB3 GLU A 23 20.257 -15.690 15.789 1.00 0.00 H new ATOM 0 HG2 GLU A 23 18.402 -15.484 14.045 1.00 0.00 H new ATOM 0 HG3 GLU A 23 19.230 -16.700 13.093 1.00 0.00 H new ATOM 350 N VAL A 24 23.327 -14.391 14.342 1.00 0.00 N ATOM 351 CA VAL A 24 24.514 -13.739 14.903 1.00 0.00 C ATOM 352 C VAL A 24 24.546 -12.258 14.505 1.00 0.00 C ATOM 353 O VAL A 24 24.963 -11.394 15.279 1.00 0.00 O ATOM 354 CB VAL A 24 25.786 -14.542 14.546 1.00 0.00 C ATOM 355 CG1 VAL A 24 27.089 -13.825 14.921 1.00 0.00 C ATOM 356 CG2 VAL A 24 25.777 -15.900 15.270 1.00 0.00 C ATOM 0 H VAL A 24 23.539 -15.171 13.720 1.00 0.00 H new ATOM 0 HA VAL A 24 24.472 -13.741 15.992 1.00 0.00 H new ATOM 0 HB VAL A 24 25.762 -14.662 13.463 1.00 0.00 H new ATOM 0 HG11 VAL A 24 27.940 -14.447 14.642 1.00 0.00 H new ATOM 0 HG12 VAL A 24 27.146 -12.873 14.392 1.00 0.00 H new ATOM 0 HG13 VAL A 24 27.109 -13.645 15.996 1.00 0.00 H new ATOM 0 HG21 VAL A 24 26.678 -16.456 15.011 1.00 0.00 H new ATOM 0 HG22 VAL A 24 25.748 -15.738 16.347 1.00 0.00 H new ATOM 0 HG23 VAL A 24 24.899 -16.469 14.965 1.00 0.00 H new ATOM 366 N GLN A 25 24.019 -11.937 13.327 1.00 0.00 N ATOM 367 CA GLN A 25 23.976 -10.581 12.806 1.00 0.00 C ATOM 368 C GLN A 25 22.900 -9.745 13.499 1.00 0.00 C ATOM 369 O GLN A 25 22.993 -8.515 13.493 1.00 0.00 O ATOM 370 CB GLN A 25 23.769 -10.666 11.295 1.00 0.00 C ATOM 371 CG GLN A 25 24.983 -11.361 10.645 1.00 0.00 C ATOM 372 CD GLN A 25 26.046 -10.392 10.123 1.00 0.00 C ATOM 373 OE1 GLN A 25 25.794 -9.207 9.918 1.00 0.00 O ATOM 374 NE2 GLN A 25 27.244 -10.875 9.854 1.00 0.00 N ATOM 0 H GLN A 25 23.604 -12.626 12.700 1.00 0.00 H new ATOM 0 HA GLN A 25 24.916 -10.068 13.012 1.00 0.00 H new ATOM 0 HB2 GLN A 25 22.858 -11.221 11.073 1.00 0.00 H new ATOM 0 HB3 GLN A 25 23.643 -9.667 10.878 1.00 0.00 H new ATOM 0 HG2 GLN A 25 25.441 -12.028 11.375 1.00 0.00 H new ATOM 0 HG3 GLN A 25 24.635 -11.982 9.820 1.00 0.00 H new ATOM 0 HE21 GLN A 25 27.447 -11.860 10.026 1.00 0.00 H new ATOM 0 HE22 GLN A 25 27.967 -10.264 9.474 1.00 0.00 H new ATOM 383 N LYS A 26 21.879 -10.369 14.100 1.00 0.00 N ATOM 384 CA LYS A 26 20.833 -9.635 14.810 1.00 0.00 C ATOM 385 C LYS A 26 21.456 -8.973 16.039 1.00 0.00 C ATOM 386 O LYS A 26 21.043 -7.875 16.410 1.00 0.00 O ATOM 387 CB LYS A 26 19.698 -10.563 15.271 1.00 0.00 C ATOM 388 CG LYS A 26 18.893 -11.261 14.168 1.00 0.00 C ATOM 389 CD LYS A 26 17.941 -10.319 13.417 1.00 0.00 C ATOM 390 CE LYS A 26 16.850 -9.655 14.278 1.00 0.00 C ATOM 391 NZ LYS A 26 15.953 -10.610 14.969 1.00 0.00 N ATOM 0 H LYS A 26 21.758 -11.382 14.107 1.00 0.00 H new ATOM 0 HA LYS A 26 20.410 -8.895 14.130 1.00 0.00 H new ATOM 0 HB2 LYS A 26 20.125 -11.329 15.918 1.00 0.00 H new ATOM 0 HB3 LYS A 26 19.007 -9.980 15.880 1.00 0.00 H new ATOM 0 HG2 LYS A 26 19.583 -11.712 13.455 1.00 0.00 H new ATOM 0 HG3 LYS A 26 18.315 -12.073 14.609 1.00 0.00 H new ATOM 0 HD2 LYS A 26 18.532 -9.536 12.943 1.00 0.00 H new ATOM 0 HD3 LYS A 26 17.457 -10.881 12.618 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.328 -9.020 15.023 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.249 -9.004 13.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.249 -10.084 15.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 15.467 -11.201 14.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.513 -11.216 15.602 1.00 0.00 H new ATOM 405 N GLN A 27 22.469 -9.611 16.636 1.00 0.00 N ATOM 406 CA GLN A 27 23.181 -9.120 17.810 1.00 0.00 C ATOM 407 C GLN A 27 23.886 -7.791 17.518 1.00 0.00 C ATOM 408 O GLN A 27 24.077 -6.983 18.424 1.00 0.00 O ATOM 409 CB GLN A 27 24.225 -10.146 18.262 1.00 0.00 C ATOM 410 CG GLN A 27 23.690 -11.559 18.546 1.00 0.00 C ATOM 411 CD GLN A 27 24.827 -12.519 18.893 1.00 0.00 C ATOM 412 OE1 GLN A 27 24.915 -13.621 18.361 1.00 0.00 O ATOM 413 NE2 GLN A 27 25.731 -12.126 19.776 1.00 0.00 N ATOM 0 H GLN A 27 22.822 -10.508 16.303 1.00 0.00 H new ATOM 0 HA GLN A 27 22.445 -8.963 18.599 1.00 0.00 H new ATOM 0 HB2 GLN A 27 24.995 -10.216 17.494 1.00 0.00 H new ATOM 0 HB3 GLN A 27 24.708 -9.772 19.165 1.00 0.00 H new ATOM 0 HG2 GLN A 27 22.977 -11.522 19.370 1.00 0.00 H new ATOM 0 HG3 GLN A 27 23.151 -11.929 17.674 1.00 0.00 H new ATOM 0 HE21 GLN A 27 25.651 -11.208 20.214 1.00 0.00 H new ATOM 0 HE22 GLN A 27 26.508 -12.741 20.019 1.00 0.00 H new ATOM 422 N LEU A 28 24.303 -7.567 16.266 1.00 0.00 N ATOM 423 CA LEU A 28 24.964 -6.323 15.857 1.00 0.00 C ATOM 424 C LEU A 28 23.964 -5.164 15.869 1.00 0.00 C ATOM 425 O LEU A 28 24.369 -4.009 15.961 1.00 0.00 O ATOM 426 CB LEU A 28 25.516 -6.415 14.419 1.00 0.00 C ATOM 427 CG LEU A 28 26.577 -7.498 14.171 1.00 0.00 C ATOM 428 CD1 LEU A 28 26.866 -7.589 12.670 1.00 0.00 C ATOM 429 CD2 LEU A 28 27.875 -7.193 14.921 1.00 0.00 C ATOM 0 H LEU A 28 24.192 -8.242 15.510 1.00 0.00 H new ATOM 0 HA LEU A 28 25.779 -6.159 16.562 1.00 0.00 H new ATOM 0 HB2 LEU A 28 24.681 -6.591 13.741 1.00 0.00 H new ATOM 0 HB3 LEU A 28 25.944 -5.448 14.153 1.00 0.00 H new ATOM 0 HG LEU A 28 26.188 -8.447 14.540 1.00 0.00 H new ATOM 0 HD11 LEU A 28 27.619 -8.357 12.490 1.00 0.00 H new ATOM 0 HD12 LEU A 28 25.950 -7.847 12.138 1.00 0.00 H new ATOM 0 HD13 LEU A 28 27.235 -6.628 12.312 1.00 0.00 H new ATOM 0 HD21 LEU A 28 28.603 -7.980 14.723 1.00 0.00 H new ATOM 0 HD22 LEU A 28 28.274 -6.236 14.584 1.00 0.00 H new ATOM 0 HD23 LEU A 28 27.674 -7.146 15.991 1.00 0.00 H new ATOM 441 N ALA A 29 22.675 -5.473 15.686 1.00 0.00 N ATOM 442 CA ALA A 29 21.495 -4.612 15.631 1.00 0.00 C ATOM 443 C ALA A 29 21.533 -3.428 14.657 1.00 0.00 C ATOM 444 O ALA A 29 20.572 -2.662 14.573 1.00 0.00 O ATOM 445 CB ALA A 29 21.055 -4.229 17.048 1.00 0.00 C ATOM 0 H ALA A 29 22.406 -6.449 15.558 1.00 0.00 H new ATOM 0 HA ALA A 29 20.723 -5.226 15.167 1.00 0.00 H new ATOM 0 HB1 ALA A 29 20.175 -3.588 16.995 1.00 0.00 H new ATOM 0 HB2 ALA A 29 20.813 -5.131 17.610 1.00 0.00 H new ATOM 0 HB3 ALA A 29 21.863 -3.696 17.548 1.00 0.00 H new ATOM 451 N ARG A 30 22.607 -3.306 13.891 1.00 0.00 N ATOM 452 CA ARG A 30 22.838 -2.265 12.894 1.00 0.00 C ATOM 453 C ARG A 30 22.498 -2.800 11.514 1.00 0.00 C ATOM 454 O ARG A 30 22.433 -4.019 11.329 1.00 0.00 O ATOM 455 CB ARG A 30 24.293 -1.773 12.949 1.00 0.00 C ATOM 456 CG ARG A 30 25.299 -2.612 12.147 1.00 0.00 C ATOM 457 CD ARG A 30 26.726 -2.358 12.648 1.00 0.00 C ATOM 458 NE ARG A 30 27.181 -0.970 12.444 1.00 0.00 N ATOM 459 CZ ARG A 30 28.226 -0.388 13.050 1.00 0.00 C ATOM 460 NH1 ARG A 30 28.968 -1.023 13.950 1.00 0.00 N ATOM 461 NH2 ARG A 30 28.542 0.857 12.739 1.00 0.00 N ATOM 0 H ARG A 30 23.384 -3.965 13.950 1.00 0.00 H new ATOM 0 HA ARG A 30 22.193 -1.414 13.111 1.00 0.00 H new ATOM 0 HB2 ARG A 30 24.327 -0.747 12.583 1.00 0.00 H new ATOM 0 HB3 ARG A 30 24.613 -1.750 13.991 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.057 -3.670 12.242 1.00 0.00 H new ATOM 0 HG3 ARG A 30 25.228 -2.362 11.088 1.00 0.00 H new ATOM 0 HD2 ARG A 30 26.778 -2.597 13.710 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.409 -3.035 12.135 1.00 0.00 H new ATOM 0 HE ARG A 30 26.653 -0.401 11.782 1.00 0.00 H new ATOM 0 HH11 ARG A 30 28.750 -1.987 14.202 1.00 0.00 H new ATOM 0 HH12 ARG A 30 29.755 -0.546 14.390 1.00 0.00 H new ATOM 0 HH21 ARG A 30 27.993 1.364 12.045 1.00 0.00 H new ATOM 0 HH22 ARG A 30 29.335 1.311 13.193 1.00 0.00 H new ATOM 475 N MET A 31 22.339 -1.904 10.547 1.00 0.00 N ATOM 476 CA MET A 31 22.035 -2.184 9.150 1.00 0.00 C ATOM 477 C MET A 31 21.974 -0.854 8.397 1.00 0.00 C ATOM 478 O MET A 31 22.169 0.219 8.974 1.00 0.00 O ATOM 479 CB MET A 31 20.736 -3.010 8.989 1.00 0.00 C ATOM 480 CG MET A 31 19.502 -2.432 9.696 1.00 0.00 C ATOM 481 SD MET A 31 18.092 -3.577 9.764 1.00 0.00 S ATOM 482 CE MET A 31 18.686 -4.757 11.007 1.00 0.00 C ATOM 0 H MET A 31 22.424 -0.904 10.729 1.00 0.00 H new ATOM 0 HA MET A 31 22.823 -2.805 8.724 1.00 0.00 H new ATOM 0 HB2 MET A 31 20.514 -3.105 7.926 1.00 0.00 H new ATOM 0 HB3 MET A 31 20.915 -4.016 9.369 1.00 0.00 H new ATOM 0 HG2 MET A 31 19.777 -2.148 10.712 1.00 0.00 H new ATOM 0 HG3 MET A 31 19.194 -1.521 9.183 1.00 0.00 H new ATOM 0 HE1 MET A 31 17.859 -5.387 11.335 1.00 0.00 H new ATOM 0 HE2 MET A 31 19.467 -5.381 10.573 1.00 0.00 H new ATOM 0 HE3 MET A 31 19.089 -4.213 11.862 1.00 0.00 H new ATOM 492 N THR A 32 21.735 -0.934 7.098 1.00 0.00 N ATOM 493 CA THR A 32 21.609 0.195 6.194 1.00 0.00 C ATOM 494 C THR A 32 20.609 -0.173 5.098 1.00 0.00 C ATOM 495 O THR A 32 20.325 -1.357 4.893 1.00 0.00 O ATOM 496 CB THR A 32 22.998 0.567 5.640 1.00 0.00 C ATOM 497 OG1 THR A 32 22.946 1.812 4.982 1.00 0.00 O ATOM 498 CG2 THR A 32 23.556 -0.461 4.653 1.00 0.00 C ATOM 0 H THR A 32 21.618 -1.830 6.624 1.00 0.00 H new ATOM 0 HA THR A 32 21.230 1.077 6.709 1.00 0.00 H new ATOM 0 HB THR A 32 23.659 0.601 6.506 1.00 0.00 H new ATOM 0 HG1 THR A 32 23.835 2.037 4.637 1.00 0.00 H new ATOM 0 HG21 THR A 32 24.536 -0.135 4.303 1.00 0.00 H new ATOM 0 HG22 THR A 32 23.650 -1.427 5.149 1.00 0.00 H new ATOM 0 HG23 THR A 32 22.880 -0.554 3.803 1.00 0.00 H new ATOM 506 N ARG A 33 20.073 0.825 4.396 1.00 0.00 N ATOM 507 CA ARG A 33 19.118 0.667 3.305 1.00 0.00 C ATOM 508 C ARG A 33 19.110 1.946 2.482 1.00 0.00 C ATOM 509 O ARG A 33 19.486 3.000 2.996 1.00 0.00 O ATOM 510 CB ARG A 33 17.711 0.375 3.858 1.00 0.00 C ATOM 511 CG ARG A 33 17.106 1.538 4.670 1.00 0.00 C ATOM 512 CD ARG A 33 15.821 1.113 5.382 1.00 0.00 C ATOM 513 NE ARG A 33 16.115 0.158 6.460 1.00 0.00 N ATOM 514 CZ ARG A 33 15.930 0.307 7.773 1.00 0.00 C ATOM 515 NH1 ARG A 33 15.321 1.377 8.266 1.00 0.00 N ATOM 516 NH2 ARG A 33 16.379 -0.640 8.586 1.00 0.00 N ATOM 0 H ARG A 33 20.302 1.802 4.580 1.00 0.00 H new ATOM 0 HA ARG A 33 19.411 -0.175 2.678 1.00 0.00 H new ATOM 0 HB2 ARG A 33 17.046 0.140 3.027 1.00 0.00 H new ATOM 0 HB3 ARG A 33 17.756 -0.512 4.490 1.00 0.00 H new ATOM 0 HG2 ARG A 33 17.832 1.887 5.404 1.00 0.00 H new ATOM 0 HG3 ARG A 33 16.896 2.376 4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 33 15.320 1.990 5.793 1.00 0.00 H new ATOM 0 HD3 ARG A 33 15.135 0.661 4.666 1.00 0.00 H new ATOM 0 HE ARG A 33 16.512 -0.734 6.166 1.00 0.00 H new ATOM 0 HH11 ARG A 33 14.983 2.106 7.638 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.190 1.471 9.273 1.00 0.00 H new ATOM 0 HH21 ARG A 33 16.853 -1.458 8.203 1.00 0.00 H new ATOM 0 HH22 ARG A 33 16.250 -0.550 9.594 1.00 0.00 H new ATOM 530 N CYS A 34 18.656 1.853 1.234 1.00 0.00 N ATOM 531 CA CYS A 34 18.550 2.956 0.289 1.00 0.00 C ATOM 532 C CYS A 34 17.746 2.499 -0.939 1.00 0.00 C ATOM 533 O CYS A 34 16.667 3.057 -1.160 1.00 0.00 O ATOM 534 CB CYS A 34 19.931 3.537 -0.055 1.00 0.00 C ATOM 535 SG CYS A 34 19.794 4.922 -1.210 1.00 0.00 S ATOM 0 H CYS A 34 18.339 0.967 0.839 1.00 0.00 H new ATOM 0 HA CYS A 34 18.003 3.781 0.745 1.00 0.00 H new ATOM 0 HB2 CYS A 34 20.425 3.870 0.858 1.00 0.00 H new ATOM 0 HB3 CYS A 34 20.557 2.758 -0.491 1.00 0.00 H new ATOM 0 HG CYS A 34 20.979 5.386 -1.474 1.00 0.00 H new ATOM 541 N PRO A 35 18.179 1.479 -1.712 1.00 0.00 N ATOM 542 CA PRO A 35 17.440 1.010 -2.885 1.00 0.00 C ATOM 543 C PRO A 35 16.067 0.426 -2.520 1.00 0.00 C ATOM 544 O PRO A 35 15.201 0.296 -3.385 1.00 0.00 O ATOM 545 CB PRO A 35 18.357 -0.015 -3.559 1.00 0.00 C ATOM 546 CG PRO A 35 19.237 -0.529 -2.431 1.00 0.00 C ATOM 547 CD PRO A 35 19.420 0.725 -1.586 1.00 0.00 C ATOM 0 HA PRO A 35 17.203 1.832 -3.561 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.784 -0.822 -4.016 1.00 0.00 H new ATOM 0 HB3 PRO A 35 18.951 0.442 -4.350 1.00 0.00 H new ATOM 0 HG2 PRO A 35 18.758 -1.333 -1.872 1.00 0.00 H new ATOM 0 HG3 PRO A 35 20.187 -0.918 -2.798 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.617 0.469 -0.545 1.00 0.00 H new ATOM 0 HD3 PRO A 35 20.270 1.311 -1.936 1.00 0.00 H new ATOM 555 N GLU A 36 15.840 0.105 -1.242 1.00 0.00 N ATOM 556 CA GLU A 36 14.590 -0.437 -0.724 1.00 0.00 C ATOM 557 C GLU A 36 13.465 0.623 -0.786 1.00 0.00 C ATOM 558 O GLU A 36 12.310 0.291 -0.529 1.00 0.00 O ATOM 559 CB GLU A 36 14.824 -0.931 0.720 1.00 0.00 C ATOM 560 CG GLU A 36 13.796 -1.978 1.205 1.00 0.00 C ATOM 561 CD GLU A 36 14.220 -3.450 1.138 1.00 0.00 C ATOM 562 OE1 GLU A 36 15.290 -3.777 0.582 1.00 0.00 O ATOM 563 OE2 GLU A 36 13.453 -4.313 1.643 1.00 0.00 O ATOM 0 H GLU A 36 16.550 0.221 -0.519 1.00 0.00 H new ATOM 0 HA GLU A 36 14.269 -1.277 -1.339 1.00 0.00 H new ATOM 0 HB2 GLU A 36 15.823 -1.361 0.788 1.00 0.00 H new ATOM 0 HB3 GLU A 36 14.799 -0.075 1.394 1.00 0.00 H new ATOM 0 HG2 GLU A 36 13.538 -1.746 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 36 12.887 -1.860 0.615 1.00 0.00 H new ATOM 570 N GLN A 37 13.752 1.892 -1.133 1.00 0.00 N ATOM 571 CA GLN A 37 12.735 2.954 -1.227 1.00 0.00 C ATOM 572 C GLN A 37 11.535 2.554 -2.105 1.00 0.00 C ATOM 573 O GLN A 37 10.405 3.000 -1.876 1.00 0.00 O ATOM 574 CB GLN A 37 13.350 4.262 -1.766 1.00 0.00 C ATOM 575 CG GLN A 37 13.677 4.216 -3.272 1.00 0.00 C ATOM 576 CD GLN A 37 13.993 5.589 -3.857 1.00 0.00 C ATOM 577 OE1 GLN A 37 13.169 6.492 -3.784 1.00 0.00 O ATOM 578 NE2 GLN A 37 15.135 5.761 -4.500 1.00 0.00 N ATOM 0 H GLN A 37 14.696 2.209 -1.356 1.00 0.00 H new ATOM 0 HA GLN A 37 12.368 3.111 -0.213 1.00 0.00 H new ATOM 0 HB2 GLN A 37 12.658 5.083 -1.578 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.262 4.480 -1.211 1.00 0.00 H new ATOM 0 HG2 GLN A 37 14.528 3.554 -3.433 1.00 0.00 H new ATOM 0 HG3 GLN A 37 12.832 3.785 -3.808 1.00 0.00 H new ATOM 0 HE21 GLN A 37 15.811 4.999 -4.552 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.340 6.656 -4.944 1.00 0.00 H new ATOM 587 N GLU A 38 11.786 1.700 -3.106 1.00 0.00 N ATOM 588 CA GLU A 38 10.782 1.223 -4.041 1.00 0.00 C ATOM 589 C GLU A 38 9.621 0.569 -3.306 1.00 0.00 C ATOM 590 O GLU A 38 8.511 0.574 -3.818 1.00 0.00 O ATOM 591 CB GLU A 38 11.419 0.315 -5.093 1.00 0.00 C ATOM 592 CG GLU A 38 11.923 -1.028 -4.542 1.00 0.00 C ATOM 593 CD GLU A 38 12.705 -1.821 -5.588 1.00 0.00 C ATOM 594 OE1 GLU A 38 12.682 -1.480 -6.794 1.00 0.00 O ATOM 595 OE2 GLU A 38 13.410 -2.781 -5.207 1.00 0.00 O ATOM 0 H GLU A 38 12.715 1.319 -3.284 1.00 0.00 H new ATOM 0 HA GLU A 38 10.360 2.073 -4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 38 10.690 0.122 -5.880 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.254 0.842 -5.555 1.00 0.00 H new ATOM 0 HG2 GLU A 38 12.558 -0.848 -3.675 1.00 0.00 H new ATOM 0 HG3 GLU A 38 11.075 -1.620 -4.199 1.00 0.00 H new ATOM 602 N LEU A 39 9.843 0.048 -2.093 1.00 0.00 N ATOM 603 CA LEU A 39 8.792 -0.563 -1.296 1.00 0.00 C ATOM 604 C LEU A 39 7.712 0.486 -1.050 1.00 0.00 C ATOM 605 O LEU A 39 6.524 0.172 -1.110 1.00 0.00 O ATOM 606 CB LEU A 39 9.393 -1.151 0.006 1.00 0.00 C ATOM 607 CG LEU A 39 9.462 -0.278 1.286 1.00 0.00 C ATOM 608 CD1 LEU A 39 8.139 -0.227 2.054 1.00 0.00 C ATOM 609 CD2 LEU A 39 10.507 -0.811 2.268 1.00 0.00 C ATOM 0 H LEU A 39 10.759 0.042 -1.644 1.00 0.00 H new ATOM 0 HA LEU A 39 8.329 -1.401 -1.817 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.821 -2.046 0.253 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.409 -1.475 -0.222 1.00 0.00 H new ATOM 0 HG LEU A 39 9.718 0.718 0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.255 0.400 2.938 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.362 0.190 1.413 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.856 -1.235 2.358 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.530 -0.177 3.154 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.248 -1.830 2.557 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.488 -0.807 1.793 1.00 0.00 H new ATOM 621 N ARG A 40 8.128 1.719 -0.743 1.00 0.00 N ATOM 622 CA ARG A 40 7.207 2.825 -0.480 1.00 0.00 C ATOM 623 C ARG A 40 6.513 3.204 -1.767 1.00 0.00 C ATOM 624 O ARG A 40 5.285 3.233 -1.798 1.00 0.00 O ATOM 625 CB ARG A 40 7.893 4.085 0.082 1.00 0.00 C ATOM 626 CG ARG A 40 8.503 3.910 1.473 1.00 0.00 C ATOM 627 CD ARG A 40 10.016 3.682 1.424 1.00 0.00 C ATOM 628 NE ARG A 40 10.546 3.489 2.781 1.00 0.00 N ATOM 629 CZ ARG A 40 11.246 4.364 3.512 1.00 0.00 C ATOM 630 NH1 ARG A 40 11.719 5.499 3.007 1.00 0.00 N ATOM 631 NH2 ARG A 40 11.474 4.091 4.787 1.00 0.00 N ATOM 0 H ARG A 40 9.112 1.976 -0.670 1.00 0.00 H new ATOM 0 HA ARG A 40 6.508 2.470 0.277 1.00 0.00 H new ATOM 0 HB2 ARG A 40 8.678 4.394 -0.608 1.00 0.00 H new ATOM 0 HB3 ARG A 40 7.164 4.894 0.119 1.00 0.00 H new ATOM 0 HG2 ARG A 40 8.291 4.795 2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 40 8.027 3.065 1.971 1.00 0.00 H new ATOM 0 HD2 ARG A 40 10.240 2.809 0.811 1.00 0.00 H new ATOM 0 HD3 ARG A 40 10.504 4.535 0.953 1.00 0.00 H new ATOM 0 HE ARG A 40 10.359 2.585 3.215 1.00 0.00 H new ATOM 0 HH11 ARG A 40 11.553 5.730 2.027 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.248 6.139 3.599 1.00 0.00 H new ATOM 0 HH21 ARG A 40 11.118 3.227 5.195 1.00 0.00 H new ATOM 0 HH22 ARG A 40 12.006 4.745 5.361 1.00 0.00 H new ATOM 645 N LEU A 41 7.308 3.468 -2.809 1.00 0.00 N ATOM 646 CA LEU A 41 6.782 3.873 -4.114 1.00 0.00 C ATOM 647 C LEU A 41 5.694 2.903 -4.580 1.00 0.00 C ATOM 648 O LEU A 41 4.559 3.299 -4.845 1.00 0.00 O ATOM 649 CB LEU A 41 7.910 3.986 -5.154 1.00 0.00 C ATOM 650 CG LEU A 41 9.150 4.779 -4.704 1.00 0.00 C ATOM 651 CD1 LEU A 41 10.144 4.841 -5.862 1.00 0.00 C ATOM 652 CD2 LEU A 41 8.817 6.184 -4.189 1.00 0.00 C ATOM 0 H LEU A 41 8.326 3.407 -2.772 1.00 0.00 H new ATOM 0 HA LEU A 41 6.332 4.860 -4.009 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.225 2.981 -5.433 1.00 0.00 H new ATOM 0 HB3 LEU A 41 7.507 4.455 -6.052 1.00 0.00 H new ATOM 0 HG LEU A 41 9.591 4.255 -3.856 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.027 5.401 -5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.436 3.830 -6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.679 5.337 -6.714 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.735 6.688 -3.888 1.00 0.00 H new ATOM 0 HD22 LEU A 41 8.331 6.756 -4.980 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.147 6.108 -3.332 1.00 0.00 H new ATOM 664 N GLN A 42 6.030 1.616 -4.586 1.00 0.00 N ATOM 665 CA GLN A 42 5.168 0.529 -4.992 1.00 0.00 C ATOM 666 C GLN A 42 3.888 0.485 -4.169 1.00 0.00 C ATOM 667 O GLN A 42 2.826 0.234 -4.724 1.00 0.00 O ATOM 668 CB GLN A 42 5.963 -0.776 -4.870 1.00 0.00 C ATOM 669 CG GLN A 42 5.131 -2.000 -5.250 1.00 0.00 C ATOM 670 CD GLN A 42 6.007 -3.112 -5.798 1.00 0.00 C ATOM 671 OE1 GLN A 42 6.211 -4.138 -5.146 1.00 0.00 O ATOM 672 NE2 GLN A 42 6.501 -2.951 -7.009 1.00 0.00 N ATOM 0 H GLN A 42 6.953 1.297 -4.294 1.00 0.00 H new ATOM 0 HA GLN A 42 4.854 0.676 -6.025 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.843 -0.724 -5.511 1.00 0.00 H new ATOM 0 HB3 GLN A 42 6.321 -0.886 -3.846 1.00 0.00 H new ATOM 0 HG2 GLN A 42 4.588 -2.359 -4.376 1.00 0.00 H new ATOM 0 HG3 GLN A 42 4.386 -1.720 -5.995 1.00 0.00 H new ATOM 0 HE21 GLN A 42 6.316 -2.091 -7.525 1.00 0.00 H new ATOM 0 HE22 GLN A 42 7.069 -3.686 -7.430 1.00 0.00 H new ATOM 681 N ARG A 43 3.956 0.692 -2.853 1.00 0.00 N ATOM 682 CA ARG A 43 2.759 0.656 -2.011 1.00 0.00 C ATOM 683 C ARG A 43 1.792 1.773 -2.381 1.00 0.00 C ATOM 684 O ARG A 43 0.585 1.567 -2.295 1.00 0.00 O ATOM 685 CB ARG A 43 3.157 0.707 -0.534 1.00 0.00 C ATOM 686 CG ARG A 43 3.716 -0.657 -0.118 1.00 0.00 C ATOM 687 CD ARG A 43 4.522 -0.552 1.183 1.00 0.00 C ATOM 688 NE ARG A 43 5.092 -1.833 1.652 1.00 0.00 N ATOM 689 CZ ARG A 43 5.857 -2.722 1.001 1.00 0.00 C ATOM 690 NH1 ARG A 43 6.207 -2.525 -0.266 1.00 0.00 N ATOM 691 NH2 ARG A 43 6.291 -3.807 1.634 1.00 0.00 N ATOM 0 H ARG A 43 4.822 0.885 -2.349 1.00 0.00 H new ATOM 0 HA ARG A 43 2.234 -0.283 -2.185 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.904 1.484 -0.372 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.293 0.962 0.080 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.897 -1.364 0.014 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.351 -1.050 -0.912 1.00 0.00 H new ATOM 0 HD2 ARG A 43 5.333 0.161 1.037 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.878 -0.147 1.964 1.00 0.00 H new ATOM 0 HE ARG A 43 4.870 -2.078 2.617 1.00 0.00 H new ATOM 0 HH11 ARG A 43 5.893 -1.688 -0.758 1.00 0.00 H new ATOM 0 HH12 ARG A 43 6.789 -3.211 -0.747 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.042 -3.961 2.611 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.873 -4.486 1.143 1.00 0.00 H new ATOM 705 N LEU A 44 2.297 2.942 -2.778 1.00 0.00 N ATOM 706 CA LEU A 44 1.448 4.061 -3.171 1.00 0.00 C ATOM 707 C LEU A 44 0.787 3.696 -4.501 1.00 0.00 C ATOM 708 O LEU A 44 -0.436 3.709 -4.621 1.00 0.00 O ATOM 709 CB LEU A 44 2.267 5.363 -3.276 1.00 0.00 C ATOM 710 CG LEU A 44 2.933 5.793 -1.953 1.00 0.00 C ATOM 711 CD1 LEU A 44 3.979 6.883 -2.194 1.00 0.00 C ATOM 712 CD2 LEU A 44 1.915 6.277 -0.917 1.00 0.00 C ATOM 0 H LEU A 44 3.297 3.136 -2.835 1.00 0.00 H new ATOM 0 HA LEU A 44 0.681 4.243 -2.418 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.039 5.234 -4.035 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.613 6.165 -3.619 1.00 0.00 H new ATOM 0 HG LEU A 44 3.422 4.905 -1.552 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.433 7.168 -1.245 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.750 6.506 -2.866 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.501 7.753 -2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.435 6.568 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.372 7.134 -1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.213 5.474 -0.694 1.00 0.00 H new ATOM 724 N GLU A 45 1.586 3.290 -5.489 1.00 0.00 N ATOM 725 CA GLU A 45 1.150 2.905 -6.822 1.00 0.00 C ATOM 726 C GLU A 45 0.319 1.615 -6.835 1.00 0.00 C ATOM 727 O GLU A 45 -0.252 1.282 -7.875 1.00 0.00 O ATOM 728 CB GLU A 45 2.379 2.740 -7.731 1.00 0.00 C ATOM 729 CG GLU A 45 3.079 4.073 -8.032 1.00 0.00 C ATOM 730 CD GLU A 45 4.139 3.915 -9.120 1.00 0.00 C ATOM 731 OE1 GLU A 45 3.789 3.444 -10.225 1.00 0.00 O ATOM 732 OE2 GLU A 45 5.324 4.271 -8.908 1.00 0.00 O ATOM 0 H GLU A 45 2.597 3.219 -5.372 1.00 0.00 H new ATOM 0 HA GLU A 45 0.501 3.700 -7.191 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.088 2.062 -7.256 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.072 2.276 -8.668 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.340 4.810 -8.347 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.543 4.455 -7.123 1.00 0.00 H new ATOM 739 N ARG A 46 0.246 0.868 -5.727 1.00 0.00 N ATOM 740 CA ARG A 46 -0.520 -0.377 -5.614 1.00 0.00 C ATOM 741 C ARG A 46 -1.999 -0.085 -5.418 1.00 0.00 C ATOM 742 O ARG A 46 -2.812 -0.999 -5.510 1.00 0.00 O ATOM 743 CB ARG A 46 0.007 -1.240 -4.457 1.00 0.00 C ATOM 744 CG ARG A 46 0.876 -2.404 -4.942 1.00 0.00 C ATOM 745 CD ARG A 46 1.345 -3.191 -3.718 1.00 0.00 C ATOM 746 NE ARG A 46 2.122 -4.379 -4.098 1.00 0.00 N ATOM 747 CZ ARG A 46 3.159 -4.880 -3.419 1.00 0.00 C ATOM 748 NH1 ARG A 46 3.530 -4.368 -2.249 1.00 0.00 N ATOM 749 NH2 ARG A 46 3.832 -5.906 -3.913 1.00 0.00 N ATOM 0 H ARG A 46 0.729 1.119 -4.865 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.396 -0.931 -6.544 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.588 -0.616 -3.778 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.836 -1.632 -3.888 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.309 -3.048 -5.614 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.732 -2.031 -5.505 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.953 -2.547 -3.083 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.480 -3.496 -3.128 1.00 0.00 H new ATOM 0 HE ARG A 46 1.847 -4.863 -4.953 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.020 -3.578 -1.853 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.324 -4.765 -1.747 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.559 -6.311 -4.808 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.624 -6.292 -3.399 1.00 0.00 H new ATOM 763 N LEU A 47 -2.360 1.174 -5.182 1.00 0.00 N ATOM 764 CA LEU A 47 -3.711 1.677 -4.990 1.00 0.00 C ATOM 765 C LEU A 47 -4.764 0.978 -5.865 1.00 0.00 C ATOM 766 O LEU A 47 -5.704 0.361 -5.332 1.00 0.00 O ATOM 767 CB LEU A 47 -3.681 3.196 -5.275 1.00 0.00 C ATOM 768 CG LEU A 47 -3.877 4.001 -3.998 1.00 0.00 C ATOM 769 CD1 LEU A 47 -3.420 5.443 -4.196 1.00 0.00 C ATOM 770 CD2 LEU A 47 -5.378 3.975 -3.677 1.00 0.00 C ATOM 0 H LEU A 47 -1.666 1.918 -5.116 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.016 1.466 -3.965 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.729 3.464 -5.734 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.463 3.450 -5.991 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.289 3.574 -3.186 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.568 6.002 -3.272 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.363 5.456 -4.463 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.002 5.903 -4.995 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.565 4.542 -2.765 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.934 4.420 -4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.702 2.944 -3.536 1.00 0.00 H new ATOM 782 N PRO A 48 -4.619 1.036 -7.205 1.00 0.00 N ATOM 783 CA PRO A 48 -5.586 0.424 -8.096 1.00 0.00 C ATOM 784 C PRO A 48 -5.633 -1.100 -7.990 1.00 0.00 C ATOM 785 O PRO A 48 -6.680 -1.692 -8.262 1.00 0.00 O ATOM 786 CB PRO A 48 -5.196 0.912 -9.491 1.00 0.00 C ATOM 787 CG PRO A 48 -3.693 1.135 -9.397 1.00 0.00 C ATOM 788 CD PRO A 48 -3.576 1.706 -7.989 1.00 0.00 C ATOM 0 HA PRO A 48 -6.603 0.716 -7.835 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.443 0.175 -10.255 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.720 1.831 -9.753 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.130 0.209 -9.516 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.330 1.828 -10.156 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.588 1.517 -7.570 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.720 2.786 -7.991 1.00 0.00 H new ATOM 796 N GLU A 49 -4.521 -1.730 -7.617 1.00 0.00 N ATOM 797 CA GLU A 49 -4.395 -3.166 -7.450 1.00 0.00 C ATOM 798 C GLU A 49 -5.155 -3.595 -6.199 1.00 0.00 C ATOM 799 O GLU A 49 -5.886 -4.582 -6.250 1.00 0.00 O ATOM 800 CB GLU A 49 -2.909 -3.563 -7.379 1.00 0.00 C ATOM 801 CG GLU A 49 -2.609 -4.821 -8.209 1.00 0.00 C ATOM 802 CD GLU A 49 -2.815 -4.586 -9.709 1.00 0.00 C ATOM 803 OE1 GLU A 49 -3.944 -4.802 -10.203 1.00 0.00 O ATOM 804 OE2 GLU A 49 -1.883 -4.129 -10.404 1.00 0.00 O ATOM 0 H GLU A 49 -3.654 -1.231 -7.417 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.829 -3.680 -8.308 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.295 -2.737 -7.738 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.630 -3.739 -6.340 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.581 -5.136 -8.030 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.254 -5.635 -7.878 1.00 0.00 H new ATOM 811 N LEU A 50 -5.029 -2.858 -5.086 1.00 0.00 N ATOM 812 CA LEU A 50 -5.743 -3.194 -3.854 1.00 0.00 C ATOM 813 C LEU A 50 -7.238 -3.179 -4.158 1.00 0.00 C ATOM 814 O LEU A 50 -7.942 -4.095 -3.729 1.00 0.00 O ATOM 815 CB LEU A 50 -5.459 -2.211 -2.703 1.00 0.00 C ATOM 816 CG LEU A 50 -4.280 -2.501 -1.752 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.202 -3.958 -1.280 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.954 -2.129 -2.411 1.00 0.00 C ATOM 0 H LEU A 50 -4.440 -2.028 -5.017 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.399 -4.175 -3.526 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.294 -1.227 -3.142 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.363 -2.142 -2.097 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.464 -1.885 -0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.347 -4.080 -0.615 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.116 -4.217 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.087 -4.614 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.134 -2.341 -1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.824 -2.713 -3.322 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.955 -1.067 -2.658 1.00 0.00 H new ATOM 830 N ALA A 51 -7.723 -2.166 -4.893 1.00 0.00 N ATOM 831 CA ALA A 51 -9.145 -2.107 -5.237 1.00 0.00 C ATOM 832 C ALA A 51 -9.567 -3.362 -6.024 1.00 0.00 C ATOM 833 O ALA A 51 -10.577 -3.998 -5.717 1.00 0.00 O ATOM 834 CB ALA A 51 -9.429 -0.856 -6.068 1.00 0.00 C ATOM 0 H ALA A 51 -7.162 -1.394 -5.252 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.722 -2.066 -4.313 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.489 -0.819 -6.320 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.162 0.031 -5.493 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.839 -0.886 -6.984 1.00 0.00 H new ATOM 840 N ARG A 52 -8.788 -3.730 -7.045 1.00 0.00 N ATOM 841 CA ARG A 52 -9.054 -4.890 -7.893 1.00 0.00 C ATOM 842 C ARG A 52 -9.090 -6.190 -7.103 1.00 0.00 C ATOM 843 O ARG A 52 -10.016 -6.979 -7.309 1.00 0.00 O ATOM 844 CB ARG A 52 -7.980 -4.987 -8.977 1.00 0.00 C ATOM 845 CG ARG A 52 -8.177 -3.953 -10.091 1.00 0.00 C ATOM 846 CD ARG A 52 -6.871 -3.878 -10.874 1.00 0.00 C ATOM 847 NE ARG A 52 -6.814 -2.736 -11.796 1.00 0.00 N ATOM 848 CZ ARG A 52 -5.696 -2.037 -12.027 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.536 -2.409 -11.496 1.00 0.00 N ATOM 850 NH2 ARG A 52 -5.717 -0.957 -12.799 1.00 0.00 N ATOM 0 H ARG A 52 -7.943 -3.222 -7.308 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.038 -4.748 -8.340 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.998 -4.847 -8.525 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.993 -5.988 -9.408 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.000 -4.243 -10.744 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.430 -2.979 -9.672 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.038 -3.813 -10.174 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.741 -4.800 -11.440 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.667 -2.463 -12.284 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.489 -3.238 -10.903 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.693 -1.866 -11.681 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.592 -0.651 -13.224 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.858 -0.433 -12.967 1.00 0.00 H new ATOM 864 N VAL A 53 -8.113 -6.439 -6.228 1.00 0.00 N ATOM 865 CA VAL A 53 -8.097 -7.673 -5.452 1.00 0.00 C ATOM 866 C VAL A 53 -9.357 -7.731 -4.581 1.00 0.00 C ATOM 867 O VAL A 53 -9.970 -8.795 -4.528 1.00 0.00 O ATOM 868 CB VAL A 53 -6.766 -7.863 -4.696 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.743 -9.181 -3.905 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.595 -7.944 -5.693 1.00 0.00 C ATOM 0 H VAL A 53 -7.333 -5.808 -6.043 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.135 -8.537 -6.115 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.671 -7.012 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.789 -9.278 -3.387 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.554 -9.182 -3.176 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.870 -10.019 -4.590 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.661 -8.078 -5.147 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.747 -8.789 -6.365 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.547 -7.023 -6.273 1.00 0.00 H new ATOM 880 N LEU A 54 -9.805 -6.627 -3.966 1.00 0.00 N ATOM 881 CA LEU A 54 -11.022 -6.648 -3.149 1.00 0.00 C ATOM 882 C LEU A 54 -12.207 -7.116 -4.000 1.00 0.00 C ATOM 883 O LEU A 54 -12.917 -8.040 -3.595 1.00 0.00 O ATOM 884 CB LEU A 54 -11.265 -5.286 -2.485 1.00 0.00 C ATOM 885 CG LEU A 54 -12.718 -5.103 -1.986 1.00 0.00 C ATOM 886 CD1 LEU A 54 -12.790 -4.542 -0.574 1.00 0.00 C ATOM 887 CD2 LEU A 54 -13.475 -4.161 -2.919 1.00 0.00 C ATOM 0 H LEU A 54 -9.346 -5.717 -4.019 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.900 -7.362 -2.335 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.581 -5.172 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -11.029 -4.495 -3.197 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.171 -6.095 -1.980 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.834 -4.435 -0.278 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.285 -5.221 0.113 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.303 -3.567 -0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -14.497 -4.038 -2.561 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -12.978 -3.191 -2.939 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.491 -4.581 -3.925 1.00 0.00 H new ATOM 899 N ARG A 55 -12.411 -6.517 -5.179 1.00 0.00 N ATOM 900 CA ARG A 55 -13.500 -6.897 -6.081 1.00 0.00 C ATOM 901 C ARG A 55 -13.440 -8.401 -6.341 1.00 0.00 C ATOM 902 O ARG A 55 -14.472 -9.059 -6.261 1.00 0.00 O ATOM 903 CB ARG A 55 -13.395 -6.096 -7.396 1.00 0.00 C ATOM 904 CG ARG A 55 -14.430 -6.520 -8.457 1.00 0.00 C ATOM 905 CD ARG A 55 -14.375 -5.637 -9.710 1.00 0.00 C ATOM 906 NE ARG A 55 -13.176 -5.903 -10.526 1.00 0.00 N ATOM 907 CZ ARG A 55 -13.043 -5.716 -11.844 1.00 0.00 C ATOM 908 NH1 ARG A 55 -13.999 -5.150 -12.569 1.00 0.00 N ATOM 909 NH2 ARG A 55 -11.912 -6.090 -12.426 1.00 0.00 N ATOM 0 H ARG A 55 -11.827 -5.758 -5.532 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.461 -6.664 -5.622 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.523 -5.036 -7.178 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.393 -6.218 -7.808 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.254 -7.558 -8.739 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.430 -6.472 -8.025 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.267 -5.807 -10.312 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.386 -4.588 -9.414 1.00 0.00 H new ATOM 0 HE ARG A 55 -12.361 -6.269 -10.033 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.864 -4.844 -12.123 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -13.869 -5.021 -13.572 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -11.167 -6.510 -11.870 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.787 -5.958 -13.430 1.00 0.00 H new ATOM 923 N ASN A 56 -12.256 -8.945 -6.634 1.00 0.00 N ATOM 924 CA ASN A 56 -12.062 -10.360 -6.918 1.00 0.00 C ATOM 925 C ASN A 56 -12.635 -11.250 -5.816 1.00 0.00 C ATOM 926 O ASN A 56 -13.485 -12.094 -6.096 1.00 0.00 O ATOM 927 CB ASN A 56 -10.573 -10.637 -7.226 1.00 0.00 C ATOM 928 CG ASN A 56 -9.913 -11.692 -6.350 1.00 0.00 C ATOM 929 OD1 ASN A 56 -10.070 -12.890 -6.556 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.189 -11.285 -5.328 1.00 0.00 N ATOM 0 H ASN A 56 -11.394 -8.401 -6.680 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.629 -10.622 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.486 -10.947 -8.267 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.018 -9.704 -7.124 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.757 -11.967 -4.705 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.060 -10.287 -5.159 1.00 0.00 H new ATOM 937 N VAL A 57 -12.220 -11.047 -4.568 1.00 0.00 N ATOM 938 CA VAL A 57 -12.687 -11.869 -3.464 1.00 0.00 C ATOM 939 C VAL A 57 -14.157 -11.636 -3.151 1.00 0.00 C ATOM 940 O VAL A 57 -14.898 -12.604 -3.014 1.00 0.00 O ATOM 941 CB VAL A 57 -11.725 -11.736 -2.280 1.00 0.00 C ATOM 942 CG1 VAL A 57 -11.578 -10.317 -1.723 1.00 0.00 C ATOM 943 CG2 VAL A 57 -12.046 -12.743 -1.170 1.00 0.00 C ATOM 0 H VAL A 57 -11.560 -10.317 -4.300 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.665 -12.920 -3.750 1.00 0.00 H new ATOM 0 HB VAL A 57 -10.746 -11.977 -2.695 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -10.877 -10.325 -0.888 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -11.204 -9.656 -2.505 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.548 -9.959 -1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.341 -12.616 -0.348 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -13.060 -12.574 -0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -11.966 -13.756 -1.564 1.00 0.00 H new ATOM 953 N PHE A 58 -14.637 -10.392 -3.099 1.00 0.00 N ATOM 954 CA PHE A 58 -16.042 -10.134 -2.808 1.00 0.00 C ATOM 955 C PHE A 58 -16.953 -10.729 -3.877 1.00 0.00 C ATOM 956 O PHE A 58 -18.121 -11.038 -3.606 1.00 0.00 O ATOM 957 CB PHE A 58 -16.272 -8.636 -2.737 1.00 0.00 C ATOM 958 CG PHE A 58 -16.367 -8.091 -1.337 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.191 -7.795 -0.635 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.625 -7.808 -0.775 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.265 -7.119 0.594 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.700 -7.129 0.453 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.519 -6.772 1.130 1.00 0.00 C ATOM 0 H PHE A 58 -14.075 -9.555 -3.254 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.282 -10.604 -1.854 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.459 -8.130 -3.257 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.191 -8.395 -3.272 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.232 -8.085 -1.037 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.528 -8.111 -1.284 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.360 -6.866 1.127 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.662 -6.882 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.575 -6.231 2.063 1.00 0.00 H new ATOM 973 N VAL A 59 -16.466 -10.822 -5.114 1.00 0.00 N ATOM 974 CA VAL A 59 -17.272 -11.409 -6.178 1.00 0.00 C ATOM 975 C VAL A 59 -17.256 -12.928 -5.968 1.00 0.00 C ATOM 976 O VAL A 59 -18.311 -13.563 -6.065 1.00 0.00 O ATOM 977 CB VAL A 59 -16.783 -10.984 -7.576 1.00 0.00 C ATOM 978 CG1 VAL A 59 -17.497 -11.786 -8.671 1.00 0.00 C ATOM 979 CG2 VAL A 59 -17.103 -9.508 -7.856 1.00 0.00 C ATOM 0 H VAL A 59 -15.539 -10.506 -5.398 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.298 -11.045 -6.131 1.00 0.00 H new ATOM 0 HB VAL A 59 -15.707 -11.160 -7.588 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -17.135 -11.468 -9.649 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.293 -12.848 -8.536 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.571 -11.612 -8.607 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -16.745 -9.240 -8.850 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.181 -9.353 -7.805 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -16.611 -8.882 -7.112 1.00 0.00 H new ATOM 989 N SER A 60 -16.097 -13.519 -5.660 1.00 0.00 N ATOM 990 CA SER A 60 -15.958 -14.951 -5.431 1.00 0.00 C ATOM 991 C SER A 60 -16.795 -15.380 -4.238 1.00 0.00 C ATOM 992 O SER A 60 -17.392 -16.456 -4.270 1.00 0.00 O ATOM 993 CB SER A 60 -14.499 -15.323 -5.177 1.00 0.00 C ATOM 994 OG SER A 60 -13.739 -15.179 -6.357 1.00 0.00 O ATOM 0 H SER A 60 -15.221 -13.005 -5.563 1.00 0.00 H new ATOM 0 HA SER A 60 -16.306 -15.466 -6.326 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.087 -14.688 -4.393 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.437 -16.351 -4.821 1.00 0.00 H new ATOM 0 HG SER A 60 -13.526 -14.233 -6.495 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.924 -14.510 -3.234 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.680 -14.812 -2.043 1.00 0.00 C ATOM 1002 C GLU A 61 -19.167 -14.997 -2.347 1.00 0.00 C ATOM 1003 O GLU A 61 -19.881 -15.634 -1.574 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.460 -13.654 -1.063 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.608 -14.076 0.401 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.698 -15.249 0.784 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.471 -15.049 0.936 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.219 -16.381 0.938 1.00 0.00 O ATOM 0 H GLU A 61 -16.503 -13.581 -3.235 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.340 -15.754 -1.613 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.464 -13.239 -1.217 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.174 -12.860 -1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.382 -13.224 1.043 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.645 -14.352 0.590 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.651 -14.453 -3.470 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.042 -14.520 -3.908 1.00 0.00 C ATOM 1017 C ARG A 62 -21.985 -13.759 -2.958 1.00 0.00 C ATOM 1018 O ARG A 62 -23.187 -14.023 -2.951 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.446 -15.989 -4.147 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.491 -16.203 -5.250 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.881 -16.493 -6.631 1.00 0.00 C ATOM 1022 NE ARG A 62 -21.488 -15.271 -7.358 1.00 0.00 N ATOM 1023 CZ ARG A 62 -21.125 -15.198 -8.647 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -21.124 -16.273 -9.431 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -20.794 -14.015 -9.145 1.00 0.00 N ATOM 0 H ARG A 62 -19.059 -13.936 -4.120 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.140 -14.003 -4.863 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.552 -16.560 -4.399 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -21.834 -16.400 -3.215 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.140 -17.032 -4.968 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.120 -15.316 -5.319 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.007 -17.133 -6.508 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -22.602 -17.049 -7.230 1.00 0.00 H new ATOM 0 HE ARG A 62 -21.493 -14.398 -6.830 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -21.404 -17.179 -9.055 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -20.844 -16.191 -10.408 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -20.819 -13.186 -8.551 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -20.514 -13.933 -10.123 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.463 -12.820 -2.153 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.242 -12.016 -1.212 1.00 0.00 C ATOM 1041 C LYS A 63 -21.735 -10.583 -1.180 1.00 0.00 C ATOM 1042 O LYS A 63 -20.524 -10.371 -1.210 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.338 -12.645 0.186 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.022 -13.245 0.667 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.027 -13.588 2.153 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.922 -14.786 2.460 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.948 -15.036 3.909 1.00 0.00 N ATOM 0 H LYS A 63 -20.468 -12.598 -2.142 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.268 -11.995 -1.579 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -22.665 -11.886 0.897 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -23.102 -13.422 0.176 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.810 -14.147 0.093 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.214 -12.542 0.466 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.009 -13.803 2.479 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -21.369 -12.724 2.723 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -22.932 -14.598 2.097 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -21.554 -15.669 1.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -22.559 -15.853 4.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.984 -15.235 4.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -22.319 -14.197 4.399 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.631 -9.582 -1.158 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.261 -8.182 -1.103 1.00 0.00 C ATOM 1063 C PRO A 64 -22.115 -7.685 0.342 1.00 0.00 C ATOM 1064 O PRO A 64 -21.656 -6.560 0.526 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.455 -7.474 -1.748 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.637 -8.267 -1.191 1.00 0.00 C ATOM 1067 CD PRO A 64 -24.086 -9.692 -1.150 1.00 0.00 C ATOM 0 HA PRO A 64 -21.305 -7.999 -1.593 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.503 -6.421 -1.470 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.414 -7.515 -2.836 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.931 -7.917 -0.202 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.516 -8.190 -1.831 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.429 -10.214 -0.257 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.435 -10.266 -2.008 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.520 -8.482 1.342 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.468 -8.117 2.758 1.00 0.00 C ATOM 1077 C ALA A 65 -21.630 -9.102 3.555 1.00 0.00 C ATOM 1078 O ALA A 65 -21.970 -10.288 3.590 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.883 -8.075 3.339 1.00 0.00 C ATOM 0 H ALA A 65 -22.899 -9.415 1.182 1.00 0.00 H new ATOM 0 HA ALA A 65 -22.006 -7.132 2.830 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.835 -7.803 4.393 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -24.476 -7.336 2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.347 -9.056 3.238 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.557 -8.613 4.178 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.624 -9.391 4.989 1.00 0.00 C ATOM 1087 C LEU A 66 -19.450 -8.707 6.345 1.00 0.00 C ATOM 1088 O LEU A 66 -19.524 -7.475 6.406 1.00 0.00 O ATOM 1089 CB LEU A 66 -18.244 -9.432 4.316 1.00 0.00 C ATOM 1090 CG LEU A 66 -18.139 -9.768 2.817 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -16.659 -9.865 2.439 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.823 -11.063 2.394 1.00 0.00 C ATOM 0 H LEU A 66 -20.306 -7.626 4.129 1.00 0.00 H new ATOM 0 HA LEU A 66 -20.020 -10.400 5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.779 -8.457 4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.639 -10.160 4.857 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.660 -8.964 2.297 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -16.569 -10.103 1.379 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -16.169 -8.912 2.640 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -16.184 -10.649 3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.692 -11.210 1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -18.380 -11.901 2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -19.887 -11.005 2.625 1.00 0.00 H new ATOM 1104 N THR A 67 -19.208 -9.465 7.416 1.00 0.00 N ATOM 1105 CA THR A 67 -18.996 -8.865 8.733 1.00 0.00 C ATOM 1106 C THR A 67 -17.613 -8.187 8.721 1.00 0.00 C ATOM 1107 O THR A 67 -16.713 -8.624 8.004 1.00 0.00 O ATOM 1108 CB THR A 67 -19.087 -9.922 9.854 1.00 0.00 C ATOM 1109 OG1 THR A 67 -20.052 -10.922 9.586 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.461 -9.258 11.180 1.00 0.00 C ATOM 0 H THR A 67 -19.154 -10.483 7.398 1.00 0.00 H new ATOM 0 HA THR A 67 -19.775 -8.130 8.937 1.00 0.00 H new ATOM 0 HB THR A 67 -18.104 -10.389 9.909 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.950 -10.533 9.641 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.522 -10.015 11.962 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.702 -8.522 11.445 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.427 -8.762 11.079 1.00 0.00 H new ATOM 1118 N MET A 68 -17.405 -7.149 9.532 1.00 0.00 N ATOM 1119 CA MET A 68 -16.148 -6.411 9.635 1.00 0.00 C ATOM 1120 C MET A 68 -14.992 -7.365 9.933 1.00 0.00 C ATOM 1121 O MET A 68 -13.941 -7.256 9.303 1.00 0.00 O ATOM 1122 CB MET A 68 -16.293 -5.337 10.719 1.00 0.00 C ATOM 1123 CG MET A 68 -15.050 -4.453 10.873 1.00 0.00 C ATOM 1124 SD MET A 68 -14.702 -3.376 9.456 1.00 0.00 S ATOM 1125 CE MET A 68 -16.004 -2.137 9.684 1.00 0.00 C ATOM 0 H MET A 68 -18.129 -6.789 10.154 1.00 0.00 H new ATOM 0 HA MET A 68 -15.922 -5.922 8.687 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.150 -4.707 10.483 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.506 -5.821 11.672 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.170 -3.833 11.762 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.185 -5.093 11.046 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.813 -1.285 9.032 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.971 -2.575 9.435 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.013 -1.805 10.722 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.208 -8.307 10.859 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.242 -9.320 11.270 1.00 0.00 C ATOM 1137 C GLU A 69 -13.803 -10.131 10.048 1.00 0.00 C ATOM 1138 O GLU A 69 -12.612 -10.300 9.806 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.907 -10.248 12.304 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.964 -11.351 12.821 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.719 -12.555 13.399 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -15.765 -12.372 14.072 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.320 -13.712 13.128 1.00 0.00 O ATOM 0 H GLU A 69 -16.094 -8.383 11.358 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.367 -8.845 11.713 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.256 -9.652 13.147 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.786 -10.711 11.856 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.323 -11.687 12.006 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.311 -10.935 13.588 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.778 -10.624 9.283 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.580 -11.430 8.089 1.00 0.00 C ATOM 1152 C VAL A 70 -13.670 -10.690 7.109 1.00 0.00 C ATOM 1153 O VAL A 70 -12.613 -11.207 6.751 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.956 -11.811 7.503 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.854 -12.567 6.180 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.775 -12.658 8.494 1.00 0.00 C ATOM 0 H VAL A 70 -15.764 -10.464 9.491 1.00 0.00 H new ATOM 0 HA VAL A 70 -14.070 -12.364 8.325 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.462 -10.864 7.317 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.854 -12.806 5.820 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -15.342 -11.946 5.445 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -15.292 -13.489 6.330 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.738 -12.909 8.049 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.232 -13.575 8.724 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.935 -12.091 9.411 1.00 0.00 H new ATOM 1166 N VAL A 71 -14.035 -9.469 6.696 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.200 -8.721 5.749 1.00 0.00 C ATOM 1168 C VAL A 71 -11.820 -8.398 6.342 1.00 0.00 C ATOM 1169 O VAL A 71 -10.859 -8.224 5.590 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.875 -7.430 5.222 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -13.426 -7.162 3.777 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -15.403 -7.474 5.224 1.00 0.00 C ATOM 0 H VAL A 71 -14.883 -8.987 6.995 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.068 -9.382 4.893 1.00 0.00 H new ATOM 0 HB VAL A 71 -13.564 -6.642 5.908 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -13.903 -6.253 3.410 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -12.343 -7.040 3.749 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.713 -8.003 3.145 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -15.795 -6.532 4.840 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -15.744 -8.293 4.591 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -15.761 -7.628 6.242 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.714 -8.279 7.665 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.475 -7.963 8.361 1.00 0.00 C ATOM 1184 C CYS A 72 -9.532 -9.149 8.235 1.00 0.00 C ATOM 1185 O CYS A 72 -8.427 -8.995 7.714 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.736 -7.609 9.830 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.248 -6.847 10.522 1.00 0.00 S ATOM 0 H CYS A 72 -12.508 -8.403 8.294 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.016 -7.085 7.906 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.581 -6.925 9.909 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -10.997 -8.505 10.393 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.457 -6.540 11.768 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.977 -10.327 8.684 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.196 -11.549 8.624 1.00 0.00 C ATOM 1195 C ALA A 73 -8.800 -11.838 7.175 1.00 0.00 C ATOM 1196 O ALA A 73 -7.658 -12.208 6.901 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.985 -12.708 9.225 1.00 0.00 C ATOM 0 H ALA A 73 -10.899 -10.451 9.102 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.285 -11.427 9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.389 -13.619 9.174 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.221 -12.486 10.266 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.910 -12.848 8.665 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.732 -11.642 6.240 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.517 -11.851 4.813 1.00 0.00 C ATOM 1205 C ARG A 74 -8.399 -10.958 4.277 1.00 0.00 C ATOM 1206 O ARG A 74 -7.648 -11.406 3.412 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.839 -11.559 4.079 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.737 -12.803 3.976 1.00 0.00 C ATOM 1209 CD ARG A 74 -11.419 -13.581 2.689 1.00 0.00 C ATOM 1210 NE ARG A 74 -11.852 -14.986 2.763 1.00 0.00 N ATOM 1211 CZ ARG A 74 -11.068 -16.061 2.917 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -9.743 -15.943 2.947 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -11.613 -17.264 3.048 1.00 0.00 N ATOM 0 H ARG A 74 -10.676 -11.327 6.462 1.00 0.00 H new ATOM 0 HA ARG A 74 -9.209 -12.883 4.643 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.376 -10.769 4.603 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.622 -11.187 3.078 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.584 -13.444 4.844 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.786 -12.505 3.980 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.908 -13.097 1.844 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.346 -13.543 2.500 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.854 -15.159 2.689 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.311 -15.024 2.852 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.160 -16.771 3.065 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -12.627 -17.369 3.031 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.017 -18.084 3.165 1.00 0.00 H new ATOM 1227 N MET A 75 -8.298 -9.716 4.760 1.00 0.00 N ATOM 1228 CA MET A 75 -7.288 -8.771 4.316 1.00 0.00 C ATOM 1229 C MET A 75 -5.940 -9.008 4.994 1.00 0.00 C ATOM 1230 O MET A 75 -4.914 -9.058 4.314 1.00 0.00 O ATOM 1231 CB MET A 75 -7.760 -7.337 4.606 1.00 0.00 C ATOM 1232 CG MET A 75 -7.122 -6.344 3.633 1.00 0.00 C ATOM 1233 SD MET A 75 -7.702 -6.404 1.913 1.00 0.00 S ATOM 1234 CE MET A 75 -9.504 -6.297 2.114 1.00 0.00 C ATOM 0 H MET A 75 -8.923 -9.343 5.475 1.00 0.00 H new ATOM 0 HA MET A 75 -7.151 -8.916 3.244 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.846 -7.284 4.526 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.503 -7.065 5.630 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.291 -5.337 4.014 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.045 -6.509 3.635 1.00 0.00 H new ATOM 0 HE1 MET A 75 -9.933 -5.758 1.270 1.00 0.00 H new ATOM 0 HE2 MET A 75 -9.926 -7.301 2.155 1.00 0.00 H new ATOM 0 HE3 MET A 75 -9.736 -5.768 3.038 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.924 -9.145 6.324 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.695 -9.345 7.083 1.00 0.00 C ATOM 1246 C VAL A 76 -3.962 -10.616 6.654 1.00 0.00 C ATOM 1247 O VAL A 76 -2.738 -10.636 6.692 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.964 -9.218 8.595 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.519 -10.500 9.220 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.706 -8.749 9.334 1.00 0.00 C ATOM 0 H VAL A 76 -6.765 -9.120 6.900 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.992 -8.546 6.848 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.742 -8.463 8.706 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.686 -10.343 10.286 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.462 -10.760 8.739 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.805 -11.311 9.081 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.920 -8.666 10.400 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.903 -9.470 9.180 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.399 -7.776 8.949 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.669 -11.629 6.140 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.054 -12.876 5.664 1.00 0.00 C ATOM 1262 C ASP A 77 -3.036 -12.591 4.545 1.00 0.00 C ATOM 1263 O ASP A 77 -2.161 -13.401 4.254 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.144 -13.781 5.069 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.878 -15.279 5.230 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -4.078 -15.870 4.464 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -5.523 -15.894 6.109 1.00 0.00 O ATOM 0 H ASP A 77 -5.684 -11.608 6.042 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.555 -13.351 6.509 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.097 -13.541 5.541 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.248 -13.555 4.008 1.00 0.00 H new ATOM 1272 N SER A 78 -3.164 -11.446 3.870 1.00 0.00 N ATOM 1273 CA SER A 78 -2.312 -11.021 2.776 1.00 0.00 C ATOM 1274 C SER A 78 -0.987 -10.465 3.292 1.00 0.00 C ATOM 1275 O SER A 78 -0.095 -10.187 2.494 1.00 0.00 O ATOM 1276 CB SER A 78 -3.077 -9.979 1.947 1.00 0.00 C ATOM 1277 OG SER A 78 -2.523 -9.841 0.651 1.00 0.00 O ATOM 0 H SER A 78 -3.895 -10.769 4.085 1.00 0.00 H new ATOM 0 HA SER A 78 -2.064 -11.875 2.146 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.124 -10.273 1.867 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.054 -9.017 2.458 1.00 0.00 H new ATOM 0 HG SER A 78 -1.545 -9.876 0.708 1.00 0.00 H new ATOM 1283 N CYS A 79 -0.818 -10.293 4.601 1.00 0.00 N ATOM 1284 CA CYS A 79 0.396 -9.763 5.191 1.00 0.00 C ATOM 1285 C CYS A 79 1.582 -10.725 5.144 1.00 0.00 C ATOM 1286 O CYS A 79 2.662 -10.358 5.612 1.00 0.00 O ATOM 1287 CB CYS A 79 0.135 -9.370 6.630 1.00 0.00 C ATOM 1288 SG CYS A 79 -1.045 -8.005 6.776 1.00 0.00 S ATOM 0 H CYS A 79 -1.536 -10.524 5.288 1.00 0.00 H new ATOM 0 HA CYS A 79 0.670 -8.898 4.588 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -0.245 -10.234 7.175 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.076 -9.084 7.101 1.00 0.00 H new ATOM 0 HG CYS A 79 -1.226 -7.720 8.031 1.00 0.00 H new ATOM 1294 N GLN A 80 1.417 -11.926 4.592 1.00 0.00 N ATOM 1295 CA GLN A 80 2.453 -12.951 4.443 1.00 0.00 C ATOM 1296 C GLN A 80 3.487 -12.544 3.364 1.00 0.00 C ATOM 1297 O GLN A 80 3.789 -13.314 2.451 1.00 0.00 O ATOM 1298 CB GLN A 80 1.758 -14.287 4.124 1.00 0.00 C ATOM 1299 CG GLN A 80 0.829 -14.212 2.892 1.00 0.00 C ATOM 1300 CD GLN A 80 0.263 -15.550 2.427 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -0.252 -15.632 1.313 1.00 0.00 O ATOM 1302 NE2 GLN A 80 0.370 -16.614 3.200 1.00 0.00 N ATOM 0 H GLN A 80 0.517 -12.226 4.219 1.00 0.00 H new ATOM 0 HA GLN A 80 3.019 -13.060 5.368 1.00 0.00 H new ATOM 0 HB2 GLN A 80 2.516 -15.051 3.953 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.177 -14.602 4.990 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.001 -13.544 3.122 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.381 -13.762 2.067 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.799 -16.534 4.122 1.00 0.00 H new ATOM 0 HE22 GLN A 80 0.024 -17.517 2.876 1.00 0.00 H new ATOM 1311 N THR A 81 4.010 -11.321 3.439 1.00 0.00 N ATOM 1312 CA THR A 81 4.963 -10.725 2.524 1.00 0.00 C ATOM 1313 C THR A 81 6.062 -10.003 3.321 1.00 0.00 C ATOM 1314 O THR A 81 6.965 -10.674 3.826 1.00 0.00 O ATOM 1315 CB THR A 81 4.181 -9.879 1.490 1.00 0.00 C ATOM 1316 OG1 THR A 81 5.027 -9.021 0.764 1.00 0.00 O ATOM 1317 CG2 THR A 81 3.065 -9.033 2.112 1.00 0.00 C ATOM 0 H THR A 81 3.757 -10.683 4.194 1.00 0.00 H new ATOM 0 HA THR A 81 5.509 -11.463 1.936 1.00 0.00 H new ATOM 0 HB THR A 81 3.729 -10.614 0.824 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.497 -8.506 0.121 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.559 -8.466 1.330 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.347 -9.686 2.609 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.493 -8.344 2.840 1.00 0.00 H new ATOM 1325 N ALA A 82 6.004 -8.670 3.459 1.00 0.00 N ATOM 1326 CA ALA A 82 7.002 -7.866 4.158 1.00 0.00 C ATOM 1327 C ALA A 82 6.509 -6.443 4.468 1.00 0.00 C ATOM 1328 O ALA A 82 7.255 -5.469 4.315 1.00 0.00 O ATOM 1329 CB ALA A 82 8.287 -7.823 3.313 1.00 0.00 C ATOM 0 H ALA A 82 5.240 -8.113 3.076 1.00 0.00 H new ATOM 0 HA ALA A 82 7.199 -8.336 5.122 1.00 0.00 H new ATOM 0 HB1 ALA A 82 9.040 -7.225 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.663 -8.836 3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 82 8.069 -7.378 2.342 1.00 0.00 H new ATOM 1335 N LEU A 83 5.237 -6.285 4.822 1.00 0.00 N ATOM 1336 CA LEU A 83 4.604 -5.013 5.180 1.00 0.00 C ATOM 1337 C LEU A 83 4.111 -5.109 6.621 1.00 0.00 C ATOM 1338 O LEU A 83 4.001 -6.212 7.159 1.00 0.00 O ATOM 1339 CB LEU A 83 3.499 -4.590 4.185 1.00 0.00 C ATOM 1340 CG LEU A 83 2.515 -5.681 3.735 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.641 -6.230 4.863 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.598 -5.154 2.632 1.00 0.00 C ATOM 0 H LEU A 83 4.589 -7.071 4.870 1.00 0.00 H new ATOM 0 HA LEU A 83 5.341 -4.213 5.111 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.925 -3.782 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.981 -4.180 3.297 1.00 0.00 H new ATOM 0 HG LEU A 83 3.139 -6.498 3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.973 -6.995 4.467 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.275 -6.666 5.635 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.051 -5.421 5.293 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.908 -5.940 2.326 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.033 -4.300 3.006 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.198 -4.845 1.776 1.00 0.00 H new ATOM 1354 N SER A 84 3.879 -3.970 7.270 1.00 0.00 N ATOM 1355 CA SER A 84 3.400 -3.968 8.647 1.00 0.00 C ATOM 1356 C SER A 84 1.872 -4.142 8.641 1.00 0.00 C ATOM 1357 O SER A 84 1.242 -3.718 7.668 1.00 0.00 O ATOM 1358 CB SER A 84 3.870 -2.678 9.325 1.00 0.00 C ATOM 1359 OG SER A 84 4.330 -2.913 10.639 1.00 0.00 O ATOM 0 H SER A 84 4.014 -3.043 6.866 1.00 0.00 H new ATOM 0 HA SER A 84 3.808 -4.798 9.224 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.669 -2.228 8.735 1.00 0.00 H new ATOM 0 HB3 SER A 84 3.049 -1.961 9.350 1.00 0.00 H new ATOM 0 HG SER A 84 4.623 -2.068 11.039 1.00 0.00 H new ATOM 1365 N PRO A 85 1.237 -4.665 9.705 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.211 -4.856 9.708 1.00 0.00 C ATOM 1367 C PRO A 85 -0.968 -3.527 9.608 1.00 0.00 C ATOM 1368 O PRO A 85 -2.020 -3.458 8.969 1.00 0.00 O ATOM 1369 CB PRO A 85 -0.523 -5.657 10.975 1.00 0.00 C ATOM 1370 CG PRO A 85 0.663 -5.381 11.898 1.00 0.00 C ATOM 1371 CD PRO A 85 1.828 -5.196 10.928 1.00 0.00 C ATOM 0 HA PRO A 85 -0.550 -5.405 8.829 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.462 -5.337 11.427 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -0.620 -6.721 10.759 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.501 -4.491 12.506 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.839 -6.209 12.585 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.572 -4.510 11.334 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.336 -6.142 10.740 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.418 -2.446 10.170 1.00 0.00 N ATOM 1380 CA GLY A 86 -1.050 -1.135 10.119 1.00 0.00 C ATOM 1381 C GLY A 86 -1.127 -0.602 8.687 1.00 0.00 C ATOM 1382 O GLY A 86 -2.012 0.209 8.400 1.00 0.00 O ATOM 0 H GLY A 86 0.472 -2.460 10.669 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.054 -1.198 10.539 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.489 -0.436 10.738 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.228 -1.012 7.780 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.268 -0.569 6.392 1.00 0.00 C ATOM 1388 C GLU A 87 -1.592 -1.062 5.795 1.00 0.00 C ATOM 1389 O GLU A 87 -2.238 -0.348 5.028 1.00 0.00 O ATOM 1390 CB GLU A 87 0.882 -1.188 5.574 1.00 0.00 C ATOM 1391 CG GLU A 87 2.271 -0.529 5.560 1.00 0.00 C ATOM 1392 CD GLU A 87 3.079 -0.404 6.852 1.00 0.00 C ATOM 1393 OE1 GLU A 87 2.582 0.167 7.853 1.00 0.00 O ATOM 1394 OE2 GLU A 87 4.295 -0.735 6.810 1.00 0.00 O ATOM 0 H GLU A 87 0.537 -1.653 7.992 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.173 0.516 6.358 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.014 -2.211 5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.544 -1.250 4.539 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.884 -1.083 4.849 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.147 0.477 5.159 1.00 0.00 H new ATOM 1401 N MET A 88 -2.009 -2.287 6.141 1.00 0.00 N ATOM 1402 CA MET A 88 -3.240 -2.886 5.651 1.00 0.00 C ATOM 1403 C MET A 88 -4.415 -1.953 5.939 1.00 0.00 C ATOM 1404 O MET A 88 -5.184 -1.626 5.035 1.00 0.00 O ATOM 1405 CB MET A 88 -3.427 -4.294 6.242 1.00 0.00 C ATOM 1406 CG MET A 88 -4.298 -5.147 5.311 1.00 0.00 C ATOM 1407 SD MET A 88 -3.607 -5.414 3.644 1.00 0.00 S ATOM 1408 CE MET A 88 -2.237 -6.528 4.038 1.00 0.00 C ATOM 0 H MET A 88 -1.489 -2.891 6.777 1.00 0.00 H new ATOM 0 HA MET A 88 -3.188 -3.014 4.570 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.456 -4.770 6.381 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.892 -4.225 7.225 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.463 -6.117 5.780 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.273 -4.671 5.212 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.696 -6.776 3.125 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.561 -6.039 4.739 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.628 -7.441 4.488 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.509 -1.469 7.178 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.555 -0.558 7.621 1.00 0.00 C ATOM 1420 C GLU A 89 -5.524 0.736 6.814 1.00 0.00 C ATOM 1421 O GLU A 89 -6.584 1.257 6.470 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.354 -0.275 9.104 1.00 0.00 C ATOM 1423 CG GLU A 89 -6.594 0.323 9.787 1.00 0.00 C ATOM 1424 CD GLU A 89 -7.692 -0.698 10.104 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -7.457 -1.584 10.965 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -8.815 -0.564 9.566 1.00 0.00 O ATOM 0 H GLU A 89 -3.844 -1.707 7.914 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.531 -1.016 7.464 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -5.082 -1.202 9.609 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.516 0.411 9.225 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.286 0.808 10.713 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.010 1.099 9.144 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.333 1.266 6.498 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.241 2.485 5.700 1.00 0.00 C ATOM 1435 C LYS A 90 -4.895 2.242 4.347 1.00 0.00 C ATOM 1436 O LYS A 90 -5.508 3.165 3.825 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.793 2.957 5.506 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.139 3.471 6.796 1.00 0.00 C ATOM 1439 CD LYS A 90 -2.707 4.786 7.351 1.00 0.00 C ATOM 1440 CE LYS A 90 -2.566 5.909 6.317 1.00 0.00 C ATOM 1441 NZ LYS A 90 -2.908 7.246 6.843 1.00 0.00 N ATOM 0 H LYS A 90 -3.436 0.872 6.781 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.760 3.277 6.240 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.200 2.132 5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.775 3.750 4.758 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.236 2.702 7.562 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.073 3.605 6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.757 4.654 7.613 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.182 5.058 8.267 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.540 5.925 5.948 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.208 5.689 5.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.790 7.955 6.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.895 7.248 7.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.279 7.477 7.639 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.777 1.040 3.769 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.405 0.781 2.476 1.00 0.00 C ATOM 1457 C HIS A 91 -6.922 0.703 2.640 1.00 0.00 C ATOM 1458 O HIS A 91 -7.652 1.069 1.718 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.940 -0.519 1.813 1.00 0.00 C ATOM 1460 CG HIS A 91 -3.458 -0.708 1.638 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -2.671 -1.421 2.499 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -2.689 -0.375 0.552 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -1.460 -1.547 1.951 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -1.410 -0.918 0.761 1.00 0.00 N ATOM 0 H HIS A 91 -4.265 0.252 4.167 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.107 1.610 1.834 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -5.320 -1.354 2.402 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.407 -0.583 0.830 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -3.008 0.199 -0.306 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -0.635 -2.080 2.400 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -0.606 -0.850 0.137 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.410 0.195 3.776 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.841 0.072 4.032 1.00 0.00 C ATOM 1474 C LEU A 92 -9.517 1.438 3.976 1.00 0.00 C ATOM 1475 O LEU A 92 -10.489 1.597 3.227 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.139 -0.628 5.371 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.633 -2.074 5.504 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -9.206 -2.720 6.769 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.002 -2.937 4.294 1.00 0.00 C ATOM 0 H LEU A 92 -6.823 -0.141 4.539 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.254 -0.558 3.244 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.700 -0.035 6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.218 -0.626 5.527 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.546 -2.022 5.562 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.841 -3.744 6.852 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.891 -2.150 7.643 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.295 -2.727 6.713 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -8.621 -3.948 4.439 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.086 -2.969 4.187 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -8.561 -2.509 3.394 1.00 0.00 H new ATOM 1491 N VAL A 93 -9.004 2.406 4.741 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.571 3.741 4.792 1.00 0.00 C ATOM 1493 C VAL A 93 -9.381 4.408 3.442 1.00 0.00 C ATOM 1494 O VAL A 93 -10.340 4.900 2.867 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.983 4.519 5.987 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.449 4.610 5.967 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.581 5.927 6.113 1.00 0.00 C ATOM 0 H VAL A 93 -8.187 2.279 5.338 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.646 3.712 4.972 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.265 3.934 6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.106 5.171 6.837 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.025 3.606 5.992 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.126 5.118 5.058 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.136 6.436 6.968 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.373 6.493 5.205 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.659 5.853 6.255 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.170 4.355 2.889 1.00 0.00 N ATOM 1508 CA LEU A 94 -7.816 4.949 1.614 1.00 0.00 C ATOM 1509 C LEU A 94 -8.814 4.626 0.507 1.00 0.00 C ATOM 1510 O LEU A 94 -9.228 5.511 -0.239 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.424 4.418 1.279 1.00 0.00 C ATOM 1512 CG LEU A 94 -5.945 4.649 -0.148 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -5.755 6.137 -0.465 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.600 3.917 -0.261 1.00 0.00 C ATOM 0 H LEU A 94 -7.386 3.880 3.337 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.831 6.036 1.688 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.708 4.878 1.960 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.409 3.346 1.477 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.685 4.279 -0.857 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.413 6.249 -1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.703 6.660 -0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.014 6.562 0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.200 4.044 -1.267 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.899 4.331 0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.745 2.856 -0.060 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.161 3.350 0.362 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.085 2.925 -0.675 1.00 0.00 C ATOM 1528 C LEU A 95 -11.517 3.375 -0.387 1.00 0.00 C ATOM 1529 O LEU A 95 -12.217 3.796 -1.307 1.00 0.00 O ATOM 1530 CB LEU A 95 -9.999 1.397 -0.841 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.760 0.906 -2.277 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -10.736 1.531 -3.269 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -8.306 1.155 -2.690 1.00 0.00 C ATOM 0 H LEU A 95 -8.813 2.594 0.953 1.00 0.00 H new ATOM 0 HA LEU A 95 -9.796 3.403 -1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.194 1.024 -0.208 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.925 0.955 -0.473 1.00 0.00 H new ATOM 0 HG LEU A 95 -9.945 -0.168 -2.295 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -10.528 1.154 -4.270 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -11.757 1.271 -2.988 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.621 2.615 -3.258 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.152 0.802 -3.710 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.091 2.222 -2.639 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -7.639 0.618 -2.015 1.00 0.00 H new ATOM 1545 N ALA A 96 -11.963 3.248 0.865 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.318 3.636 1.253 1.00 0.00 C ATOM 1547 C ALA A 96 -13.512 5.154 1.273 1.00 0.00 C ATOM 1548 O ALA A 96 -14.637 5.630 1.117 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.634 3.071 2.638 1.00 0.00 C ATOM 0 H ALA A 96 -11.400 2.877 1.630 1.00 0.00 H new ATOM 0 HA ALA A 96 -13.997 3.227 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.644 3.360 2.927 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.561 1.984 2.613 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.922 3.466 3.363 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.443 5.933 1.426 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.525 7.383 1.477 1.00 0.00 C ATOM 1557 C GLU A 97 -12.891 7.928 0.099 1.00 0.00 C ATOM 1558 O GLU A 97 -13.791 8.761 -0.008 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.211 7.964 2.024 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.394 9.317 2.719 1.00 0.00 C ATOM 1561 CD GLU A 97 -11.672 10.489 1.782 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -10.743 10.919 1.068 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -12.800 11.039 1.857 1.00 0.00 O ATOM 0 H GLU A 97 -11.494 5.570 1.518 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.315 7.692 2.162 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -10.774 7.257 2.729 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.502 8.077 1.204 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -12.217 9.236 3.429 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.496 9.537 3.296 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.245 7.434 -0.965 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.511 7.896 -2.320 1.00 0.00 C ATOM 1572 C LEU A 98 -13.723 7.209 -2.935 1.00 0.00 C ATOM 1573 O LEU A 98 -14.323 7.768 -3.853 1.00 0.00 O ATOM 1574 CB LEU A 98 -11.293 7.626 -3.230 1.00 0.00 C ATOM 1575 CG LEU A 98 -10.099 8.591 -3.108 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -10.564 10.045 -3.141 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.229 8.332 -1.876 1.00 0.00 C ATOM 0 H LEU A 98 -11.530 6.709 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.710 8.965 -2.249 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.935 6.617 -3.025 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.634 7.639 -4.265 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.469 8.398 -3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.701 10.705 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -11.077 10.242 -4.082 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -11.247 10.228 -2.311 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.407 9.048 -1.854 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.832 8.443 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.827 7.320 -1.921 1.00 0.00 H new ATOM 1589 N LEU A 99 -14.089 6.010 -2.465 1.00 0.00 N ATOM 1590 CA LEU A 99 -15.211 5.253 -3.012 1.00 0.00 C ATOM 1591 C LEU A 99 -16.242 4.879 -1.924 1.00 0.00 C ATOM 1592 O LEU A 99 -16.534 3.690 -1.759 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.657 4.017 -3.762 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.400 4.185 -4.650 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -13.108 2.849 -5.331 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -13.525 5.261 -5.733 1.00 0.00 C ATOM 0 H LEU A 99 -13.613 5.541 -1.695 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.758 5.875 -3.721 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.436 3.251 -3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.457 3.628 -4.392 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.596 4.506 -3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.225 2.948 -5.962 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.930 2.086 -4.573 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.961 2.559 -5.944 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -12.599 5.309 -6.306 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.352 5.013 -6.399 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -13.713 6.228 -5.266 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.860 5.844 -1.213 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.833 5.560 -0.157 1.00 0.00 C ATOM 1610 C PRO A 100 -19.144 4.985 -0.697 1.00 0.00 C ATOM 1611 O PRO A 100 -19.861 4.285 0.020 1.00 0.00 O ATOM 1612 CB PRO A 100 -18.060 6.895 0.562 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.757 7.938 -0.512 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.635 7.276 -1.306 1.00 0.00 C ATOM 0 HA PRO A 100 -17.454 4.792 0.518 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -19.082 6.984 0.930 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.401 7.004 1.423 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.628 8.145 -1.134 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.442 8.887 -0.079 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.648 7.605 -2.345 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.660 7.544 -0.899 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.486 5.270 -1.955 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.714 4.755 -2.560 1.00 0.00 C ATOM 1624 C ASP A 101 -20.517 3.305 -3.002 1.00 0.00 C ATOM 1625 O ASP A 101 -21.493 2.598 -3.271 1.00 0.00 O ATOM 1626 CB ASP A 101 -21.137 5.615 -3.755 1.00 0.00 C ATOM 1627 CG ASP A 101 -21.471 7.041 -3.338 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -22.402 7.229 -2.526 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -20.758 7.963 -3.794 1.00 0.00 O ATOM 0 H ASP A 101 -18.928 5.856 -2.575 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.505 4.795 -1.811 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.335 5.631 -4.493 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -22.005 5.165 -4.237 1.00 0.00 H new ATOM 1634 N TRP A 102 -19.258 2.873 -3.133 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.862 1.538 -3.530 1.00 0.00 C ATOM 1636 C TRP A 102 -18.754 0.696 -2.265 1.00 0.00 C ATOM 1637 O TRP A 102 -19.485 -0.289 -2.141 1.00 0.00 O ATOM 1638 CB TRP A 102 -17.542 1.617 -4.302 1.00 0.00 C ATOM 1639 CG TRP A 102 -17.052 0.356 -4.932 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.758 -0.420 -5.779 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.734 -0.260 -4.832 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.956 -1.433 -6.263 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.683 -1.366 -5.731 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.574 0.007 -4.076 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.515 -2.125 -5.906 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -13.406 -0.760 -4.239 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.367 -1.803 -5.174 1.00 0.00 C ATOM 0 H TRP A 102 -18.458 3.481 -2.954 1.00 0.00 H new ATOM 0 HA TRP A 102 -19.591 1.073 -4.194 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -17.651 2.367 -5.085 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.771 1.977 -3.621 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.795 -0.271 -6.039 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.264 -2.141 -6.929 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.582 0.815 -3.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.503 -2.952 -6.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.534 -0.544 -3.640 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.453 -2.357 -5.329 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.825 1.048 -1.364 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.613 0.363 -0.096 1.00 0.00 C ATOM 1660 C LEU A 103 -18.376 1.161 0.937 1.00 0.00 C ATOM 1661 O LEU A 103 -18.100 2.342 1.129 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.132 0.366 0.336 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.247 -0.581 -0.482 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -13.774 -0.155 -0.418 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -15.400 -2.012 0.044 1.00 0.00 C ATOM 0 H LEU A 103 -17.191 1.834 -1.507 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.934 -0.674 -0.192 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.740 1.379 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.070 0.088 1.388 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.567 -0.537 -1.523 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.170 -0.845 -1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -13.669 0.853 -0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -13.436 -0.170 0.618 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.770 -2.683 -0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -15.098 -2.049 1.091 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -16.441 -2.323 -0.045 1.00 0.00 H new ATOM 1677 N SER A 104 -19.278 0.513 1.648 1.00 0.00 N ATOM 1678 CA SER A 104 -20.087 1.131 2.693 1.00 0.00 C ATOM 1679 C SER A 104 -19.965 0.291 3.965 1.00 0.00 C ATOM 1680 O SER A 104 -19.640 -0.894 3.889 1.00 0.00 O ATOM 1681 CB SER A 104 -21.521 1.267 2.175 1.00 0.00 C ATOM 1682 OG SER A 104 -21.648 2.372 1.296 1.00 0.00 O ATOM 0 H SER A 104 -19.477 -0.479 1.516 1.00 0.00 H new ATOM 0 HA SER A 104 -19.744 2.134 2.946 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.811 0.353 1.658 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.204 1.388 3.016 1.00 0.00 H new ATOM 0 HG SER A 104 -20.763 2.758 1.126 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.222 0.869 5.141 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.129 0.169 6.425 1.00 0.00 C ATOM 1690 C LEU A 105 -21.312 0.542 7.302 1.00 0.00 C ATOM 1691 O LEU A 105 -21.838 1.652 7.202 1.00 0.00 O ATOM 1692 CB LEU A 105 -18.778 0.462 7.113 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.623 1.906 7.640 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -19.089 2.067 9.098 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.164 2.364 7.580 1.00 0.00 C ATOM 0 H LEU A 105 -20.503 1.845 5.230 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.168 -0.907 6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -18.652 -0.230 7.946 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -17.974 0.259 6.406 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.253 2.514 6.991 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -18.955 3.103 9.410 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.142 1.798 9.175 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -18.500 1.415 9.742 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -17.087 3.384 7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -16.550 1.703 8.192 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -16.815 2.332 6.548 1.00 0.00 H new ATOM 1707 N HIS A 106 -21.774 -0.393 8.128 1.00 0.00 N ATOM 1708 CA HIS A 106 -22.883 -0.185 9.038 1.00 0.00 C ATOM 1709 C HIS A 106 -22.718 -1.039 10.291 1.00 0.00 C ATOM 1710 O HIS A 106 -22.523 -2.256 10.192 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.192 -0.480 8.317 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.302 -1.832 7.685 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.051 -2.880 8.156 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.820 -2.165 6.453 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.047 -3.832 7.216 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.336 -3.426 6.149 1.00 0.00 N ATOM 0 H HIS A 106 -21.377 -1.331 8.180 1.00 0.00 H new ATOM 0 HA HIS A 106 -22.899 0.856 9.362 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -25.010 -0.366 9.029 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -24.335 0.274 7.543 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -23.166 -1.569 5.833 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -25.543 -4.788 7.302 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -24.199 -3.943 5.280 1.00 0.00 H new ATOM 1724 N ARG A 107 -22.781 -0.434 11.478 1.00 0.00 N ATOM 1725 CA ARG A 107 -22.662 -1.183 12.724 1.00 0.00 C ATOM 1726 C ARG A 107 -24.047 -1.661 13.126 1.00 0.00 C ATOM 1727 O ARG A 107 -25.032 -0.940 12.938 1.00 0.00 O ATOM 1728 CB ARG A 107 -21.937 -0.375 13.804 1.00 0.00 C ATOM 1729 CG ARG A 107 -21.335 -1.280 14.897 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.149 -1.301 16.189 1.00 0.00 C ATOM 1731 NE ARG A 107 -21.414 -1.952 17.282 1.00 0.00 N ATOM 1732 CZ ARG A 107 -21.577 -1.752 18.593 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -22.428 -0.845 19.062 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -20.885 -2.468 19.468 1.00 0.00 N ATOM 0 H ARG A 107 -22.913 0.570 11.600 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.033 -2.062 12.584 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -21.144 0.215 13.344 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -22.634 0.329 14.259 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.254 -2.296 14.512 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -20.323 -0.942 15.120 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -22.401 -0.281 16.477 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -23.089 -1.826 16.019 1.00 0.00 H new ATOM 0 HE ARG A 107 -20.702 -2.630 17.011 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -22.978 -0.279 18.416 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -22.531 -0.715 20.068 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -20.226 -3.174 19.141 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -21.012 -2.313 20.468 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.132 -2.863 13.678 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.348 -3.525 14.117 1.00 0.00 C ATOM 1750 C ILE A 108 -25.180 -3.875 15.591 1.00 0.00 C ATOM 1751 O ILE A 108 -24.063 -4.050 16.076 1.00 0.00 O ATOM 1752 CB ILE A 108 -25.559 -4.815 13.279 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.395 -4.609 11.759 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -26.901 -5.503 13.582 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.388 -3.615 11.137 1.00 0.00 C ATOM 0 H ILE A 108 -23.303 -3.435 13.840 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.215 -2.879 13.983 1.00 0.00 H new ATOM 0 HB ILE A 108 -24.753 -5.476 13.597 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.381 -4.262 11.560 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.506 -5.572 11.261 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -26.997 -6.399 12.969 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -26.939 -5.779 14.636 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -27.719 -4.819 13.356 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.199 -3.533 10.067 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.406 -3.968 11.299 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.264 -2.637 11.603 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.306 -4.092 16.270 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.420 -4.458 17.681 1.00 0.00 C ATOM 1769 C ARG A 109 -25.606 -5.683 18.119 1.00 0.00 C ATOM 1770 O ARG A 109 -25.614 -5.989 19.311 1.00 0.00 O ATOM 1771 CB ARG A 109 -27.912 -4.698 18.002 1.00 0.00 C ATOM 1772 CG ARG A 109 -28.524 -5.834 17.155 1.00 0.00 C ATOM 1773 CD ARG A 109 -29.924 -6.258 17.601 1.00 0.00 C ATOM 1774 NE ARG A 109 -29.892 -7.021 18.856 1.00 0.00 N ATOM 1775 CZ ARG A 109 -30.793 -7.911 19.283 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -31.895 -8.149 18.578 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -30.577 -8.553 20.425 1.00 0.00 N ATOM 0 H ARG A 109 -27.219 -4.012 15.822 1.00 0.00 H new ATOM 0 HA ARG A 109 -25.996 -3.624 18.240 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.018 -4.940 19.059 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.470 -3.778 17.828 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -28.567 -5.514 16.114 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -27.863 -6.700 17.196 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.547 -5.373 17.730 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.386 -6.862 16.820 1.00 0.00 H new ATOM 0 HE ARG A 109 -29.094 -6.853 19.469 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -32.058 -7.651 17.703 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.577 -8.830 18.912 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -29.732 -8.364 20.964 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -31.256 -9.235 20.763 1.00 0.00 H new ATOM 1791 N THR A 110 -24.944 -6.390 17.203 1.00 0.00 N ATOM 1792 CA THR A 110 -24.167 -7.576 17.502 1.00 0.00 C ATOM 1793 C THR A 110 -22.762 -7.591 16.890 1.00 0.00 C ATOM 1794 O THR A 110 -21.966 -8.420 17.319 1.00 0.00 O ATOM 1795 CB THR A 110 -25.024 -8.758 17.027 1.00 0.00 C ATOM 1796 OG1 THR A 110 -24.770 -9.882 17.837 1.00 0.00 O ATOM 1797 CG2 THR A 110 -24.865 -9.095 15.537 1.00 0.00 C ATOM 0 H THR A 110 -24.938 -6.142 16.214 1.00 0.00 H new ATOM 0 HA THR A 110 -23.959 -7.621 18.571 1.00 0.00 H new ATOM 0 HB THR A 110 -26.065 -8.452 17.133 1.00 0.00 H new ATOM 0 HG1 THR A 110 -25.319 -10.635 17.533 1.00 0.00 H new ATOM 0 HG21 THR A 110 -25.505 -9.941 15.285 1.00 0.00 H new ATOM 0 HG22 THR A 110 -25.152 -8.232 14.936 1.00 0.00 H new ATOM 0 HG23 THR A 110 -23.826 -9.352 15.331 1.00 0.00 H new ATOM 1805 N ASP A 111 -22.470 -6.749 15.888 1.00 0.00 N ATOM 1806 CA ASP A 111 -21.172 -6.649 15.193 1.00 0.00 C ATOM 1807 C ASP A 111 -21.302 -5.559 14.117 1.00 0.00 C ATOM 1808 O ASP A 111 -22.379 -4.997 13.924 1.00 0.00 O ATOM 1809 CB ASP A 111 -20.730 -7.977 14.519 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.200 -8.135 14.441 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -18.469 -7.130 14.299 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -18.697 -9.278 14.560 1.00 0.00 O ATOM 0 H ASP A 111 -23.158 -6.091 15.522 1.00 0.00 H new ATOM 0 HA ASP A 111 -20.411 -6.410 15.936 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -21.148 -8.816 15.075 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.146 -8.023 13.512 1.00 0.00 H new ATOM 1817 N THR A 112 -20.231 -5.228 13.418 1.00 0.00 N ATOM 1818 CA THR A 112 -20.144 -4.248 12.352 1.00 0.00 C ATOM 1819 C THR A 112 -20.074 -5.026 11.040 1.00 0.00 C ATOM 1820 O THR A 112 -19.502 -6.113 11.010 1.00 0.00 O ATOM 1821 CB THR A 112 -18.896 -3.367 12.562 1.00 0.00 C ATOM 1822 OG1 THR A 112 -18.757 -2.950 13.907 1.00 0.00 O ATOM 1823 CG2 THR A 112 -18.928 -2.118 11.678 1.00 0.00 C ATOM 0 H THR A 112 -19.330 -5.672 13.595 1.00 0.00 H new ATOM 0 HA THR A 112 -21.007 -3.582 12.339 1.00 0.00 H new ATOM 0 HB THR A 112 -18.047 -3.993 12.287 1.00 0.00 H new ATOM 0 HG1 THR A 112 -17.954 -2.396 13.996 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.032 -1.524 11.855 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.965 -2.415 10.630 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.810 -1.525 11.918 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.641 -4.505 9.952 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.624 -5.159 8.649 1.00 0.00 C ATOM 1833 C TYR A 113 -20.251 -4.122 7.598 1.00 0.00 C ATOM 1834 O TYR A 113 -20.298 -2.913 7.850 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.973 -5.835 8.315 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.449 -6.910 9.288 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.837 -6.570 10.597 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.506 -8.262 8.892 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.248 -7.554 11.510 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.925 -9.258 9.797 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.287 -8.906 11.116 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.714 -9.839 12.011 1.00 0.00 O ATOM 0 H TYR A 113 -21.129 -3.609 9.953 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.884 -5.959 8.664 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.739 -5.061 8.258 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.896 -6.281 7.323 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.818 -5.535 10.904 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -22.226 -8.537 7.886 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.534 -7.275 12.513 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.969 -10.290 9.482 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.687 -10.726 11.596 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.873 -4.604 6.421 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.489 -3.805 5.272 1.00 0.00 C ATOM 1854 C VAL A 114 -20.366 -4.290 4.123 1.00 0.00 C ATOM 1855 O VAL A 114 -20.860 -5.427 4.112 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.958 -3.903 5.028 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.513 -3.889 3.556 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.244 -2.734 5.720 1.00 0.00 C ATOM 0 H VAL A 114 -19.825 -5.606 6.237 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.656 -2.737 5.408 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.688 -4.877 5.436 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.427 -3.962 3.504 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.959 -4.735 3.033 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.837 -2.960 3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.171 -2.808 5.545 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.613 -1.792 5.316 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.440 -2.771 6.792 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.597 -3.395 3.177 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.378 -3.563 1.975 1.00 0.00 C ATOM 1870 C LYS A 115 -20.480 -3.181 0.821 1.00 0.00 C ATOM 1871 O LYS A 115 -19.655 -2.273 0.956 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.582 -2.608 2.009 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.784 -3.212 2.732 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.585 -4.209 1.884 1.00 0.00 C ATOM 1875 CE LYS A 115 -25.174 -3.626 0.589 1.00 0.00 C ATOM 1876 NZ LYS A 115 -25.995 -2.419 0.815 1.00 0.00 N ATOM 0 H LYS A 115 -20.207 -2.455 3.241 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.742 -4.586 1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.293 -1.680 2.503 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.867 -2.350 0.989 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.437 -3.715 3.635 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.446 -2.407 3.050 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -23.938 -5.048 1.627 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.399 -4.608 2.489 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -24.361 -3.382 -0.095 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -25.784 -4.386 0.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -26.377 -2.084 -0.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.780 -2.648 1.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.407 -1.674 1.239 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.632 -3.884 -0.293 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.867 -3.600 -1.484 1.00 0.00 C ATOM 1892 C LEU A 116 -20.745 -3.785 -2.697 1.00 0.00 C ATOM 1893 O LEU A 116 -21.447 -4.797 -2.811 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.643 -4.508 -1.599 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.857 -4.217 -2.893 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -17.405 -2.754 -2.983 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.707 -5.204 -2.992 1.00 0.00 C ATOM 0 H LEU A 116 -21.286 -4.661 -0.390 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.516 -2.570 -1.423 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.995 -4.361 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.958 -5.551 -1.588 1.00 0.00 H new ATOM 0 HG LEU A 116 -18.510 -4.356 -3.755 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.856 -2.599 -3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -18.278 -2.102 -2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -16.759 -2.520 -2.136 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.140 -5.012 -3.903 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.054 -5.089 -2.127 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.101 -6.220 -3.017 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.655 -2.846 -3.633 1.00 0.00 N ATOM 1910 CA ASP A 117 -21.400 -2.898 -4.863 1.00 0.00 C ATOM 1911 C ASP A 117 -20.439 -3.408 -5.921 1.00 0.00 C ATOM 1912 O ASP A 117 -19.763 -2.639 -6.605 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.959 -1.519 -5.215 1.00 0.00 C ATOM 1914 CG ASP A 117 -23.312 -1.268 -4.558 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.439 -1.389 -3.315 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -24.282 -1.052 -5.314 1.00 0.00 O ATOM 0 H ASP A 117 -20.055 -2.025 -3.548 1.00 0.00 H new ATOM 0 HA ASP A 117 -22.263 -3.559 -4.783 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.254 -0.750 -4.899 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -22.060 -1.434 -6.297 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.433 -4.726 -6.135 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.573 -5.340 -7.127 1.00 0.00 C ATOM 1923 C LYS A 118 -19.957 -4.916 -8.540 1.00 0.00 C ATOM 1924 O LYS A 118 -19.118 -4.970 -9.444 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.683 -6.858 -7.000 1.00 0.00 C ATOM 1926 CG LYS A 118 -19.013 -7.426 -5.744 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.813 -7.491 -4.443 1.00 0.00 C ATOM 1928 CE LYS A 118 -21.000 -8.469 -4.496 1.00 0.00 C ATOM 1929 NZ LYS A 118 -20.581 -9.893 -4.515 1.00 0.00 N ATOM 0 H LYS A 118 -21.022 -5.385 -5.626 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.548 -5.014 -6.949 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.737 -7.137 -6.996 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -19.235 -7.320 -7.880 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -18.681 -8.438 -5.977 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -18.119 -6.833 -5.551 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.147 -7.785 -3.632 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -20.185 -6.494 -4.205 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -21.643 -8.297 -3.633 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -21.596 -8.260 -5.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.240 -10.457 -3.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -20.587 -10.244 -5.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -19.621 -9.978 -4.123 1.00 0.00 H new ATOM 1943 N ALA A 119 -21.212 -4.511 -8.724 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.748 -4.095 -10.003 1.00 0.00 C ATOM 1945 C ALA A 119 -21.081 -2.840 -10.570 1.00 0.00 C ATOM 1946 O ALA A 119 -21.003 -2.744 -11.793 1.00 0.00 O ATOM 1947 CB ALA A 119 -23.257 -3.885 -9.853 1.00 0.00 C ATOM 0 H ALA A 119 -21.894 -4.465 -7.967 1.00 0.00 H new ATOM 0 HA ALA A 119 -21.536 -4.885 -10.723 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -23.677 -3.571 -10.808 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -23.725 -4.818 -9.540 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -23.445 -3.116 -9.104 1.00 0.00 H new ATOM 1953 N VAL A 120 -20.551 -1.938 -9.739 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.937 -0.692 -10.196 1.00 0.00 C ATOM 1955 C VAL A 120 -18.715 -0.965 -11.080 1.00 0.00 C ATOM 1956 O VAL A 120 -17.908 -1.857 -10.785 1.00 0.00 O ATOM 1957 CB VAL A 120 -19.622 0.185 -8.969 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -19.050 1.551 -9.348 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -20.874 0.472 -8.127 1.00 0.00 C ATOM 0 H VAL A 120 -20.537 -2.054 -8.726 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.631 -0.142 -10.831 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.890 -0.395 -8.407 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -18.848 2.124 -8.443 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -18.124 1.415 -9.906 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.770 2.089 -9.965 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -20.604 1.093 -7.273 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -21.611 0.994 -8.737 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -21.297 -0.468 -7.772 1.00 0.00 H new ATOM 1969 N ASP A 121 -18.559 -0.179 -12.151 1.00 0.00 N ATOM 1970 CA ASP A 121 -17.461 -0.316 -13.098 1.00 0.00 C ATOM 1971 C ASP A 121 -16.127 0.108 -12.494 1.00 0.00 C ATOM 1972 O ASP A 121 -15.931 1.273 -12.141 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.704 0.447 -14.400 1.00 0.00 C ATOM 1974 CG ASP A 121 -16.763 -0.170 -15.426 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -15.594 0.254 -15.530 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -17.154 -1.195 -16.033 1.00 0.00 O ATOM 0 H ASP A 121 -19.203 0.578 -12.382 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.415 -1.379 -13.335 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -18.743 0.356 -14.718 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -17.501 1.510 -14.273 1.00 0.00 H new ATOM 1981 N LEU A 122 -15.193 -0.832 -12.386 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.877 -0.593 -11.809 1.00 0.00 C ATOM 1983 C LEU A 122 -13.004 0.355 -12.630 1.00 0.00 C ATOM 1984 O LEU A 122 -12.127 0.998 -12.063 1.00 0.00 O ATOM 1985 CB LEU A 122 -13.176 -1.941 -11.606 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.354 -2.083 -10.313 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -11.136 -1.182 -10.254 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -13.177 -1.902 -9.034 1.00 0.00 C ATOM 0 H LEU A 122 -15.332 -1.792 -12.701 1.00 0.00 H new ATOM 0 HA LEU A 122 -14.026 -0.089 -10.854 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.931 -2.727 -11.622 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -12.515 -2.116 -12.455 1.00 0.00 H new ATOM 0 HG LEU A 122 -12.010 -3.116 -10.356 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.611 -1.342 -9.312 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.470 -1.415 -11.085 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.450 -0.140 -10.322 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.529 -2.016 -8.165 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.623 -0.907 -9.026 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.966 -2.653 -9.000 1.00 0.00 H new ATOM 2000 N ALA A 123 -13.194 0.469 -13.944 1.00 0.00 N ATOM 2001 CA ALA A 123 -12.375 1.377 -14.752 1.00 0.00 C ATOM 2002 C ALA A 123 -12.558 2.815 -14.264 1.00 0.00 C ATOM 2003 O ALA A 123 -11.569 3.525 -14.056 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.681 1.264 -16.246 1.00 0.00 C ATOM 0 H ALA A 123 -13.899 -0.049 -14.469 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.333 1.084 -14.625 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -12.048 1.957 -16.800 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -12.485 0.246 -16.582 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.728 1.509 -16.422 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.810 3.224 -14.050 1.00 0.00 N ATOM 2011 CA GLY A 124 -14.130 4.558 -13.566 1.00 0.00 C ATOM 2012 C GLY A 124 -13.643 4.720 -12.128 1.00 0.00 C ATOM 2013 O GLY A 124 -13.073 5.754 -11.783 1.00 0.00 O ATOM 0 H GLY A 124 -14.628 2.635 -14.209 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.662 5.308 -14.204 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -15.206 4.724 -13.616 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.811 3.685 -11.289 1.00 0.00 N ATOM 2018 CA LEU A 125 -13.370 3.733 -9.896 1.00 0.00 C ATOM 2019 C LEU A 125 -11.864 3.950 -9.867 1.00 0.00 C ATOM 2020 O LEU A 125 -11.406 4.873 -9.202 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.784 2.482 -9.114 1.00 0.00 C ATOM 2022 CG LEU A 125 -15.304 2.350 -8.913 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -15.610 1.031 -8.204 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.934 3.518 -8.142 1.00 0.00 C ATOM 0 H LEU A 125 -14.251 2.805 -11.558 1.00 0.00 H new ATOM 0 HA LEU A 125 -13.863 4.567 -9.396 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -13.418 1.599 -9.639 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -13.298 2.497 -8.139 1.00 0.00 H new ATOM 0 HG LEU A 125 -15.752 2.369 -9.906 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -16.686 0.936 -8.061 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -15.250 0.200 -8.810 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -15.112 1.015 -7.234 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -17.006 3.351 -8.042 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -15.483 3.586 -7.152 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -15.761 4.448 -8.684 1.00 0.00 H new ATOM 2036 N THR A 126 -11.104 3.166 -10.636 1.00 0.00 N ATOM 2037 CA THR A 126 -9.656 3.287 -10.732 1.00 0.00 C ATOM 2038 C THR A 126 -9.255 4.728 -11.068 1.00 0.00 C ATOM 2039 O THR A 126 -8.307 5.249 -10.478 1.00 0.00 O ATOM 2040 CB THR A 126 -9.140 2.355 -11.848 1.00 0.00 C ATOM 2041 OG1 THR A 126 -9.457 1.007 -11.591 1.00 0.00 O ATOM 2042 CG2 THR A 126 -7.626 2.441 -12.018 1.00 0.00 C ATOM 0 H THR A 126 -11.488 2.420 -11.216 1.00 0.00 H new ATOM 0 HA THR A 126 -9.220 3.010 -9.772 1.00 0.00 H new ATOM 0 HB THR A 126 -9.635 2.695 -12.758 1.00 0.00 H new ATOM 0 HG1 THR A 126 -10.377 0.827 -11.878 1.00 0.00 H new ATOM 0 HG21 THR A 126 -7.310 1.767 -12.815 1.00 0.00 H new ATOM 0 HG22 THR A 126 -7.346 3.463 -12.275 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.138 2.155 -11.086 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.959 5.354 -12.017 1.00 0.00 N ATOM 2051 CA ALA A 127 -9.663 6.704 -12.453 1.00 0.00 C ATOM 2052 C ALA A 127 -9.839 7.719 -11.331 1.00 0.00 C ATOM 2053 O ALA A 127 -8.880 8.405 -10.964 1.00 0.00 O ATOM 2054 CB ALA A 127 -10.500 7.054 -13.683 1.00 0.00 C ATOM 0 H ALA A 127 -10.751 4.929 -12.500 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.611 6.748 -12.735 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -10.270 8.070 -14.002 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.269 6.359 -14.490 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -11.559 6.983 -13.435 1.00 0.00 H new ATOM 2060 N ARG A 128 -11.046 7.829 -10.768 1.00 0.00 N ATOM 2061 CA ARG A 128 -11.278 8.792 -9.693 1.00 0.00 C ATOM 2062 C ARG A 128 -10.386 8.497 -8.488 1.00 0.00 C ATOM 2063 O ARG A 128 -9.886 9.429 -7.858 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.768 8.866 -9.322 1.00 0.00 C ATOM 2065 CG ARG A 128 -13.316 7.626 -8.601 1.00 0.00 C ATOM 2066 CD ARG A 128 -14.750 7.851 -8.113 1.00 0.00 C ATOM 2067 NE ARG A 128 -15.723 7.696 -9.198 1.00 0.00 N ATOM 2068 CZ ARG A 128 -17.049 7.667 -9.047 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -17.619 7.960 -7.885 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -17.811 7.329 -10.074 1.00 0.00 N ATOM 0 H ARG A 128 -11.860 7.275 -11.033 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.999 9.781 -10.056 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -12.927 9.738 -8.687 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -13.347 9.025 -10.232 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -13.290 6.770 -9.275 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -12.675 7.384 -7.753 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -14.978 7.143 -7.316 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -14.837 8.850 -7.687 1.00 0.00 H new ATOM 0 HE ARG A 128 -15.357 7.603 -10.146 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -17.042 8.214 -7.083 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -18.634 7.931 -7.793 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -17.384 7.094 -10.970 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -18.825 7.304 -9.970 1.00 0.00 H new ATOM 2084 N LEU A 129 -10.160 7.217 -8.181 1.00 0.00 N ATOM 2085 CA LEU A 129 -9.342 6.782 -7.063 1.00 0.00 C ATOM 2086 C LEU A 129 -7.929 7.322 -7.219 1.00 0.00 C ATOM 2087 O LEU A 129 -7.455 8.005 -6.320 1.00 0.00 O ATOM 2088 CB LEU A 129 -9.360 5.245 -6.961 1.00 0.00 C ATOM 2089 CG LEU A 129 -8.425 4.665 -5.884 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.842 5.093 -4.473 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -8.429 3.134 -5.974 1.00 0.00 C ATOM 0 H LEU A 129 -10.552 6.444 -8.718 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.750 7.178 -6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -10.379 4.919 -6.753 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.083 4.826 -7.928 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.424 5.054 -6.069 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -8.156 4.662 -3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.814 6.180 -4.399 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.854 4.742 -4.270 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.767 2.723 -5.212 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.441 2.763 -5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.081 2.827 -6.960 1.00 0.00 H new ATOM 2103 N ALA A 130 -7.272 7.031 -8.344 1.00 0.00 N ATOM 2104 CA ALA A 130 -5.910 7.468 -8.607 1.00 0.00 C ATOM 2105 C ALA A 130 -5.769 8.988 -8.701 1.00 0.00 C ATOM 2106 O ALA A 130 -4.676 9.493 -8.468 1.00 0.00 O ATOM 2107 CB ALA A 130 -5.412 6.806 -9.898 1.00 0.00 C ATOM 0 H ALA A 130 -7.679 6.481 -9.101 1.00 0.00 H new ATOM 0 HA ALA A 130 -5.299 7.160 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -4.391 7.129 -10.102 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -5.434 5.722 -9.783 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -6.057 7.096 -10.728 1.00 0.00 H new ATOM 2113 N HIS A 131 -6.827 9.723 -9.047 1.00 0.00 N ATOM 2114 CA HIS A 131 -6.771 11.170 -9.164 1.00 0.00 C ATOM 2115 C HIS A 131 -6.875 11.921 -7.835 1.00 0.00 C ATOM 2116 O HIS A 131 -6.587 13.117 -7.845 1.00 0.00 O ATOM 2117 CB HIS A 131 -7.876 11.642 -10.118 1.00 0.00 C ATOM 2118 CG HIS A 131 -7.447 11.562 -11.555 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -7.777 10.588 -12.466 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -6.617 12.452 -12.169 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -7.183 10.906 -13.629 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -6.466 12.039 -13.500 1.00 0.00 N ATOM 0 H HIS A 131 -7.744 9.326 -9.253 1.00 0.00 H new ATOM 0 HA HIS A 131 -5.782 11.406 -9.556 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -8.768 11.032 -9.971 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -8.149 12.669 -9.877 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -8.365 9.773 -12.292 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -6.159 13.317 -11.713 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -7.269 10.333 -14.540 1.00 0.00 H new ATOM 2130 N HIS A 132 -7.312 11.286 -6.735 1.00 0.00 N ATOM 2131 CA HIS A 132 -7.469 11.886 -5.404 1.00 0.00 C ATOM 2132 C HIS A 132 -7.924 13.355 -5.440 1.00 0.00 C ATOM 2133 O HIS A 132 -7.322 14.200 -4.783 1.00 0.00 O ATOM 2134 CB HIS A 132 -6.158 11.734 -4.621 1.00 0.00 C ATOM 2135 CG HIS A 132 -5.781 10.311 -4.342 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -6.506 9.353 -3.673 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -4.624 9.741 -4.761 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -5.788 8.218 -3.709 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -4.619 8.408 -4.344 1.00 0.00 N ATOM 0 H HIS A 132 -7.576 10.301 -6.752 1.00 0.00 H new ATOM 0 HA HIS A 132 -8.271 11.347 -4.899 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -5.354 12.210 -5.182 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -6.247 12.269 -3.675 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -7.417 9.480 -3.232 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -3.842 10.233 -5.320 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -6.108 7.278 -3.284 1.00 0.00 H new ATOM 2147 N VAL A 133 -8.987 13.681 -6.181 1.00 0.00 N ATOM 2148 CA VAL A 133 -9.457 15.063 -6.279 1.00 0.00 C ATOM 2149 C VAL A 133 -9.724 15.697 -4.914 1.00 0.00 C ATOM 2150 O VAL A 133 -9.269 16.803 -4.638 1.00 0.00 O ATOM 2151 CB VAL A 133 -10.680 15.168 -7.198 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -10.241 15.060 -8.661 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -11.776 14.123 -6.979 1.00 0.00 C ATOM 0 H VAL A 133 -9.535 13.009 -6.719 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.647 15.637 -6.728 1.00 0.00 H new ATOM 0 HB VAL A 133 -11.113 16.136 -6.947 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -11.114 15.135 -9.309 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -9.546 15.867 -8.893 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.750 14.101 -8.824 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -12.589 14.295 -7.684 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -11.365 13.126 -7.136 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -12.156 14.202 -5.960 1.00 0.00 H new ATOM 2163 N HIS A 134 -10.436 14.962 -4.070 1.00 0.00 N ATOM 2164 CA HIS A 134 -10.810 15.337 -2.715 1.00 0.00 C ATOM 2165 C HIS A 134 -9.981 14.568 -1.669 1.00 0.00 C ATOM 2166 O HIS A 134 -10.451 14.364 -0.553 1.00 0.00 O ATOM 2167 CB HIS A 134 -12.332 15.192 -2.546 1.00 0.00 C ATOM 2168 CG HIS A 134 -12.903 13.841 -2.893 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -13.846 13.605 -3.868 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -12.621 12.649 -2.281 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -14.110 12.290 -3.863 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -13.383 11.669 -2.924 1.00 0.00 N ATOM 0 H HIS A 134 -10.786 14.039 -4.327 1.00 0.00 H new ATOM 0 HA HIS A 134 -10.571 16.386 -2.539 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -12.587 15.419 -1.511 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -12.821 15.943 -3.167 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -14.267 14.303 -4.482 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -11.939 12.495 -1.458 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -14.810 11.800 -4.523 1.00 0.00 H new ATOM 2180 N ALA A 135 -8.818 14.028 -2.059 1.00 0.00 N ATOM 2181 CA ALA A 135 -7.918 13.273 -1.194 1.00 0.00 C ATOM 2182 C ALA A 135 -6.471 13.725 -1.422 1.00 0.00 C ATOM 2183 O ALA A 135 -6.227 14.757 -2.047 1.00 0.00 O ATOM 2184 CB ALA A 135 -8.114 11.768 -1.411 1.00 0.00 C ATOM 0 H ALA A 135 -8.473 14.110 -3.015 1.00 0.00 H new ATOM 0 HA ALA A 135 -8.154 13.473 -0.149 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -7.437 11.215 -0.760 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.144 11.498 -1.177 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -7.901 11.520 -2.451 1.00 0.00 H new ATOM 2190 N GLU A 136 -5.515 12.940 -0.922 1.00 0.00 N ATOM 2191 CA GLU A 136 -4.090 13.205 -1.024 1.00 0.00 C ATOM 2192 C GLU A 136 -3.352 11.933 -1.452 1.00 0.00 C ATOM 2193 O GLU A 136 -2.735 11.898 -2.511 1.00 0.00 O ATOM 2194 CB GLU A 136 -3.571 13.802 0.306 1.00 0.00 C ATOM 2195 CG GLU A 136 -3.685 12.893 1.556 1.00 0.00 C ATOM 2196 CD GLU A 136 -3.234 13.519 2.879 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -3.215 14.759 3.048 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -2.872 12.753 3.803 1.00 0.00 O ATOM 0 H GLU A 136 -5.724 12.077 -0.420 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.896 13.950 -1.796 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -2.523 14.073 0.174 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.116 14.725 0.503 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -4.724 12.579 1.660 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.096 11.993 1.382 1.00 0.00 H new ATOM 2205 N GLY A 137 -3.501 10.857 -0.680 1.00 0.00 N ATOM 2206 CA GLY A 137 -2.880 9.558 -0.863 1.00 0.00 C ATOM 2207 C GLY A 137 -2.632 9.016 0.541 1.00 0.00 C ATOM 2208 O GLY A 137 -1.504 9.027 1.044 1.00 0.00 O ATOM 0 H GLY A 137 -4.101 10.878 0.145 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -3.528 8.891 -1.431 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.947 9.645 -1.419 1.00 0.00 H new ATOM 2212 N LEU A 138 -3.737 8.647 1.198 1.00 0.00 N ATOM 2213 CA LEU A 138 -3.799 8.112 2.557 1.00 0.00 C ATOM 2214 C LEU A 138 -2.850 6.933 2.677 1.00 0.00 C ATOM 2215 O LEU A 138 -2.082 6.908 3.663 1.00 0.00 O ATOM 2216 CB LEU A 138 -5.260 7.767 2.946 1.00 0.00 C ATOM 2217 CG LEU A 138 -6.182 9.007 2.903 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -7.653 8.609 2.830 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -5.960 9.938 4.093 1.00 0.00 C ATOM 0 H LEU A 138 -4.660 8.719 0.770 1.00 0.00 H new ATOM 0 HA LEU A 138 -3.472 8.867 3.272 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.645 7.006 2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -5.276 7.338 3.948 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.916 9.549 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.272 9.506 2.801 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.826 8.020 1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.914 8.016 3.707 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.631 10.793 4.016 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.163 9.400 5.019 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -4.927 10.286 4.095 1.00 0.00 H new TER 2231 LEU A 138