USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 919 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 19 HIS : no HD1:sc= 0.0036 K(o=-0.15,f=-4.2) USER MOD Set 1.2: A 103 GLN : amide:sc= -0.153 K(o=-0.15,f=-2.8!) USER MOD Set 2.1: A 60 ASN : amide:sc= -1.26 K(o=-0.68,f=-1.9!) USER MOD Set 2.2: A 88 SER OG : rot 95:sc= 0.581 USER MOD Set 3.1: A 58 SER OG : rot 61:sc= 1.3 USER MOD Set 3.2: A 90 GLN : amide:sc= -2.5! C(o=-1.2!,f=-2!) USER MOD Set 4.1: A 29 SER OG : rot -160:sc= 0 USER MOD Set 4.2: A 37 ASN : amide:sc= -0.0884 X(o=-0.088,f=-0.016) USER MOD Set 5.1: A 16 GLN : amide:sc= -8.04! C(o=-10!,f=-20!) USER MOD Set 5.2: A 47 ASN : amide:sc= -2.41 K(o=-10,f=-12!) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.134 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 23 HIS : no HD1:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -72:sc= -0.172! USER MOD Single : A 39 THR OG1 : rot 30:sc= -0.659 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.06) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 90:sc= 0 USER MOD Single : A 57 MET CE :methyl 176:sc= -1.56 (180deg=-1.64) USER MOD Single : A 61 ASN : amide:sc= -0.482 K(o=-0.48,f=-3.3!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -52:sc= 0.519! USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 154:sc= 0.243 (180deg=-0.861) USER MOD Single : A 89 TYR OH : rot 80:sc= -0.261! USER MOD Single : A 94 CYS SG : rot -118:sc= -1.89! USER MOD Single : A 97 ASN : amide:sc= -3.8! C(o=-3.8!,f=-14!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 160:sc= -1.19 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 90:sc= 0.386 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.581 -20.452 -17.812 1.00 0.00 N ATOM 2 CA GLY A 1 4.924 -19.977 -17.526 1.00 0.00 C ATOM 3 C GLY A 1 5.742 -21.049 -16.801 1.00 0.00 C ATOM 4 O GLY A 1 5.250 -22.149 -16.554 1.00 0.00 O ATOM 0 H1 GLY A 1 3.437 -20.487 -18.841 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.457 -21.404 -17.412 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.886 -19.805 -17.387 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.422 -19.701 -18.456 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.873 -19.077 -16.913 1.00 0.00 H new ATOM 8 N SER A 2 6.976 -20.690 -16.482 1.00 0.00 N ATOM 9 CA SER A 2 7.867 -21.607 -15.790 1.00 0.00 C ATOM 10 C SER A 2 8.540 -20.896 -14.614 1.00 0.00 C ATOM 11 O SER A 2 8.424 -19.680 -14.471 1.00 0.00 O ATOM 12 CB SER A 2 8.922 -22.173 -16.743 1.00 0.00 C ATOM 13 OG SER A 2 8.436 -23.296 -17.472 1.00 0.00 O ATOM 0 H SER A 2 7.381 -19.777 -16.690 1.00 0.00 H new ATOM 0 HA SER A 2 7.274 -22.440 -15.411 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.234 -21.396 -17.440 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.805 -22.465 -16.174 1.00 0.00 H new ATOM 0 HG SER A 2 9.138 -23.627 -18.070 1.00 0.00 H new ATOM 19 N SER A 3 9.228 -21.685 -13.803 1.00 0.00 N ATOM 20 CA SER A 3 9.920 -21.147 -12.644 1.00 0.00 C ATOM 21 C SER A 3 11.179 -21.967 -12.358 1.00 0.00 C ATOM 22 O SER A 3 11.110 -23.187 -12.217 1.00 0.00 O ATOM 23 CB SER A 3 9.007 -21.130 -11.416 1.00 0.00 C ATOM 24 OG SER A 3 9.479 -20.237 -10.412 1.00 0.00 O ATOM 0 H SER A 3 9.321 -22.693 -13.925 1.00 0.00 H new ATOM 0 HA SER A 3 10.207 -20.119 -12.864 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.001 -20.838 -11.717 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.937 -22.136 -11.002 1.00 0.00 H new ATOM 0 HG SER A 3 8.868 -20.254 -9.646 1.00 0.00 H new ATOM 30 N GLY A 4 12.300 -21.265 -12.281 1.00 0.00 N ATOM 31 CA GLY A 4 13.572 -21.913 -12.014 1.00 0.00 C ATOM 32 C GLY A 4 13.648 -22.397 -10.564 1.00 0.00 C ATOM 33 O GLY A 4 13.337 -23.551 -10.274 1.00 0.00 O ATOM 0 H GLY A 4 12.353 -20.253 -12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.703 -22.758 -12.690 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.387 -21.217 -12.212 1.00 0.00 H new ATOM 37 N SER A 5 14.064 -21.490 -9.692 1.00 0.00 N ATOM 38 CA SER A 5 14.184 -21.810 -8.280 1.00 0.00 C ATOM 39 C SER A 5 15.216 -22.922 -8.082 1.00 0.00 C ATOM 40 O SER A 5 14.975 -24.070 -8.453 1.00 0.00 O ATOM 41 CB SER A 5 12.834 -22.227 -7.693 1.00 0.00 C ATOM 42 OG SER A 5 12.003 -21.103 -7.414 1.00 0.00 O ATOM 0 H SER A 5 14.322 -20.534 -9.936 1.00 0.00 H new ATOM 0 HA SER A 5 14.517 -20.916 -7.753 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.324 -22.890 -8.392 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.997 -22.794 -6.776 1.00 0.00 H new ATOM 0 HG SER A 5 11.150 -21.411 -7.042 1.00 0.00 H new ATOM 48 N SER A 6 16.342 -22.543 -7.497 1.00 0.00 N ATOM 49 CA SER A 6 17.412 -23.494 -7.245 1.00 0.00 C ATOM 50 C SER A 6 17.544 -23.746 -5.741 1.00 0.00 C ATOM 51 O SER A 6 17.342 -22.838 -4.936 1.00 0.00 O ATOM 52 CB SER A 6 18.739 -22.996 -7.819 1.00 0.00 C ATOM 53 OG SER A 6 19.260 -23.881 -8.807 1.00 0.00 O ATOM 0 H SER A 6 16.537 -21.590 -7.190 1.00 0.00 H new ATOM 0 HA SER A 6 17.162 -24.431 -7.743 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.596 -22.008 -8.257 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.464 -22.886 -7.013 1.00 0.00 H new ATOM 0 HG SER A 6 20.107 -23.526 -9.150 1.00 0.00 H new ATOM 59 N GLY A 7 17.884 -24.982 -5.408 1.00 0.00 N ATOM 60 CA GLY A 7 18.047 -25.365 -4.016 1.00 0.00 C ATOM 61 C GLY A 7 19.487 -25.143 -3.551 1.00 0.00 C ATOM 62 O GLY A 7 19.762 -24.219 -2.788 1.00 0.00 O ATOM 0 H GLY A 7 18.051 -25.732 -6.079 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.366 -24.784 -3.393 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.778 -26.414 -3.890 1.00 0.00 H new ATOM 66 N ARG A 8 20.369 -26.008 -4.031 1.00 0.00 N ATOM 67 CA ARG A 8 21.775 -25.918 -3.674 1.00 0.00 C ATOM 68 C ARG A 8 21.942 -25.984 -2.154 1.00 0.00 C ATOM 69 O ARG A 8 20.973 -25.833 -1.413 1.00 0.00 O ATOM 70 CB ARG A 8 22.393 -24.619 -4.192 1.00 0.00 C ATOM 71 CG ARG A 8 22.232 -24.502 -5.709 1.00 0.00 C ATOM 72 CD ARG A 8 23.594 -24.389 -6.398 1.00 0.00 C ATOM 73 NE ARG A 8 23.552 -25.063 -7.715 1.00 0.00 N ATOM 74 CZ ARG A 8 23.738 -26.378 -7.892 1.00 0.00 C ATOM 75 NH1 ARG A 8 23.979 -27.168 -6.837 1.00 0.00 N ATOM 76 NH2 ARG A 8 23.683 -26.903 -9.123 1.00 0.00 N ATOM 0 H ARG A 8 20.137 -26.774 -4.664 1.00 0.00 H new ATOM 0 HA ARG A 8 22.289 -26.761 -4.137 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.918 -23.767 -3.706 1.00 0.00 H new ATOM 0 HB3 ARG A 8 23.451 -24.586 -3.931 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.699 -25.373 -6.090 1.00 0.00 H new ATOM 0 HG3 ARG A 8 21.626 -23.628 -5.948 1.00 0.00 H new ATOM 0 HD2 ARG A 8 23.860 -23.340 -6.525 1.00 0.00 H new ATOM 0 HD3 ARG A 8 24.365 -24.840 -5.774 1.00 0.00 H new ATOM 0 HE ARG A 8 23.370 -24.491 -8.539 1.00 0.00 H new ATOM 0 HH11 ARG A 8 24.021 -26.768 -5.900 1.00 0.00 H new ATOM 0 HH12 ARG A 8 24.121 -28.169 -6.971 1.00 0.00 H new ATOM 0 HH21 ARG A 8 23.499 -26.302 -9.926 1.00 0.00 H new ATOM 0 HH22 ARG A 8 23.825 -27.904 -9.257 1.00 0.00 H new ATOM 90 N SER A 9 23.179 -26.210 -1.736 1.00 0.00 N ATOM 91 CA SER A 9 23.485 -26.297 -0.318 1.00 0.00 C ATOM 92 C SER A 9 24.227 -25.038 0.135 1.00 0.00 C ATOM 93 O SER A 9 24.994 -24.456 -0.630 1.00 0.00 O ATOM 94 CB SER A 9 24.318 -27.544 -0.011 1.00 0.00 C ATOM 95 OG SER A 9 23.688 -28.734 -0.477 1.00 0.00 O ATOM 0 H SER A 9 23.981 -26.335 -2.354 1.00 0.00 H new ATOM 0 HA SER A 9 22.547 -26.375 0.231 1.00 0.00 H new ATOM 0 HB2 SER A 9 25.300 -27.448 -0.475 1.00 0.00 H new ATOM 0 HB3 SER A 9 24.480 -27.616 1.065 1.00 0.00 H new ATOM 0 HG SER A 9 24.251 -29.507 -0.264 1.00 0.00 H new ATOM 101 N ALA A 10 23.973 -24.656 1.378 1.00 0.00 N ATOM 102 CA ALA A 10 24.607 -23.477 1.943 1.00 0.00 C ATOM 103 C ALA A 10 24.221 -23.352 3.418 1.00 0.00 C ATOM 104 O ALA A 10 23.252 -23.965 3.863 1.00 0.00 O ATOM 105 CB ALA A 10 24.209 -22.244 1.130 1.00 0.00 C ATOM 0 H ALA A 10 23.337 -25.142 2.010 1.00 0.00 H new ATOM 0 HA ALA A 10 25.692 -23.564 1.893 1.00 0.00 H new ATOM 0 HB1 ALA A 10 24.685 -21.360 1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 10 24.532 -22.370 0.097 1.00 0.00 H new ATOM 0 HB3 ALA A 10 23.126 -22.123 1.159 1.00 0.00 H new ATOM 111 N HIS A 11 25.000 -22.555 4.135 1.00 0.00 N ATOM 112 CA HIS A 11 24.751 -22.343 5.551 1.00 0.00 C ATOM 113 C HIS A 11 24.945 -20.863 5.889 1.00 0.00 C ATOM 114 O HIS A 11 25.131 -20.038 4.997 1.00 0.00 O ATOM 115 CB HIS A 11 25.627 -23.265 6.401 1.00 0.00 C ATOM 116 CG HIS A 11 26.920 -23.670 5.734 1.00 0.00 C ATOM 117 ND1 HIS A 11 27.099 -24.902 5.131 1.00 0.00 N ATOM 118 CD2 HIS A 11 28.094 -22.992 5.582 1.00 0.00 C ATOM 119 CE1 HIS A 11 28.330 -24.954 4.642 1.00 0.00 C ATOM 120 NE2 HIS A 11 28.945 -23.769 4.923 1.00 0.00 N ATOM 0 H HIS A 11 25.803 -22.049 3.762 1.00 0.00 H new ATOM 0 HA HIS A 11 23.719 -22.602 5.786 1.00 0.00 H new ATOM 0 HB2 HIS A 11 25.857 -22.765 7.342 1.00 0.00 H new ATOM 0 HB3 HIS A 11 25.060 -24.163 6.647 1.00 0.00 H new ATOM 0 HD2 HIS A 11 28.297 -21.993 5.938 1.00 0.00 H new ATOM 0 HE1 HIS A 11 28.769 -25.788 4.114 1.00 0.00 H new ATOM 0 HE2 HIS A 11 29.901 -23.521 4.669 1.00 0.00 H new ATOM 128 N LEU A 12 24.896 -20.574 7.181 1.00 0.00 N ATOM 129 CA LEU A 12 25.064 -19.208 7.649 1.00 0.00 C ATOM 130 C LEU A 12 23.968 -18.328 7.044 1.00 0.00 C ATOM 131 O LEU A 12 23.101 -18.818 6.323 1.00 0.00 O ATOM 132 CB LEU A 12 26.482 -18.713 7.357 1.00 0.00 C ATOM 133 CG LEU A 12 27.526 -18.994 8.439 1.00 0.00 C ATOM 134 CD1 LEU A 12 28.941 -18.964 7.857 1.00 0.00 C ATOM 135 CD2 LEU A 12 27.371 -18.029 9.616 1.00 0.00 C ATOM 0 H LEU A 12 24.742 -21.262 7.918 1.00 0.00 H new ATOM 0 HA LEU A 12 24.951 -19.159 8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 12 26.820 -19.169 6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 12 26.442 -17.637 7.189 1.00 0.00 H new ATOM 0 HG LEU A 12 27.356 -20.000 8.823 1.00 0.00 H new ATOM 0 HD11 LEU A 12 29.664 -19.167 8.647 1.00 0.00 H new ATOM 0 HD12 LEU A 12 29.031 -19.723 7.080 1.00 0.00 H new ATOM 0 HD13 LEU A 12 29.138 -17.981 7.429 1.00 0.00 H new ATOM 0 HD21 LEU A 12 28.126 -18.251 10.370 1.00 0.00 H new ATOM 0 HD22 LEU A 12 27.499 -17.005 9.266 1.00 0.00 H new ATOM 0 HD23 LEU A 12 26.378 -18.143 10.051 1.00 0.00 H new ATOM 147 N ARG A 13 24.044 -17.044 7.360 1.00 0.00 N ATOM 148 CA ARG A 13 23.069 -16.090 6.857 1.00 0.00 C ATOM 149 C ARG A 13 22.912 -16.241 5.342 1.00 0.00 C ATOM 150 O ARG A 13 23.834 -15.938 4.586 1.00 0.00 O ATOM 151 CB ARG A 13 23.486 -14.654 7.179 1.00 0.00 C ATOM 152 CG ARG A 13 23.339 -14.362 8.674 1.00 0.00 C ATOM 153 CD ARG A 13 24.675 -13.934 9.283 1.00 0.00 C ATOM 154 NE ARG A 13 24.463 -12.824 10.238 1.00 0.00 N ATOM 155 CZ ARG A 13 25.404 -12.359 11.071 1.00 0.00 C ATOM 156 NH1 ARG A 13 26.628 -12.905 11.071 1.00 0.00 N ATOM 157 NH2 ARG A 13 25.122 -11.347 11.904 1.00 0.00 N ATOM 0 H ARG A 13 24.765 -16.641 7.958 1.00 0.00 H new ATOM 0 HA ARG A 13 22.118 -16.298 7.347 1.00 0.00 H new ATOM 0 HB2 ARG A 13 24.520 -14.495 6.874 1.00 0.00 H new ATOM 0 HB3 ARG A 13 22.874 -13.957 6.607 1.00 0.00 H new ATOM 0 HG2 ARG A 13 22.599 -13.576 8.824 1.00 0.00 H new ATOM 0 HG3 ARG A 13 22.969 -15.250 9.187 1.00 0.00 H new ATOM 0 HD2 ARG A 13 25.139 -14.779 9.792 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.360 -13.621 8.495 1.00 0.00 H new ATOM 0 HE ARG A 13 23.543 -12.385 10.264 1.00 0.00 H new ATOM 0 HH11 ARG A 13 26.843 -13.674 10.437 1.00 0.00 H new ATOM 0 HH12 ARG A 13 27.344 -12.551 11.705 1.00 0.00 H new ATOM 0 HH21 ARG A 13 24.191 -10.931 11.904 1.00 0.00 H new ATOM 0 HH22 ARG A 13 25.839 -10.993 12.538 1.00 0.00 H new ATOM 171 N VAL A 14 21.739 -16.710 4.945 1.00 0.00 N ATOM 172 CA VAL A 14 21.449 -16.905 3.535 1.00 0.00 C ATOM 173 C VAL A 14 20.612 -15.731 3.023 1.00 0.00 C ATOM 174 O VAL A 14 19.571 -15.410 3.596 1.00 0.00 O ATOM 175 CB VAL A 14 20.772 -18.261 3.322 1.00 0.00 C ATOM 176 CG1 VAL A 14 19.301 -18.210 3.739 1.00 0.00 C ATOM 177 CG2 VAL A 14 20.914 -18.722 1.870 1.00 0.00 C ATOM 0 H VAL A 14 20.978 -16.961 5.576 1.00 0.00 H new ATOM 0 HA VAL A 14 22.371 -16.923 2.955 1.00 0.00 H new ATOM 0 HB VAL A 14 21.275 -18.991 3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 14 18.843 -19.186 3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 14 19.231 -17.946 4.794 1.00 0.00 H new ATOM 0 HG13 VAL A 14 18.779 -17.461 3.143 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.424 -19.688 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.448 -17.991 1.209 1.00 0.00 H new ATOM 0 HG23 VAL A 14 21.971 -18.816 1.620 1.00 0.00 H new ATOM 187 N ARG A 15 21.096 -15.123 1.951 1.00 0.00 N ATOM 188 CA ARG A 15 20.405 -13.991 1.356 1.00 0.00 C ATOM 189 C ARG A 15 19.321 -14.479 0.393 1.00 0.00 C ATOM 190 O ARG A 15 19.597 -14.739 -0.778 1.00 0.00 O ATOM 191 CB ARG A 15 21.380 -13.086 0.600 1.00 0.00 C ATOM 192 CG ARG A 15 22.190 -12.223 1.569 1.00 0.00 C ATOM 193 CD ARG A 15 23.055 -11.213 0.812 1.00 0.00 C ATOM 194 NE ARG A 15 24.472 -11.641 0.837 1.00 0.00 N ATOM 195 CZ ARG A 15 25.252 -11.593 1.925 1.00 0.00 C ATOM 196 NH1 ARG A 15 24.758 -11.137 3.084 1.00 0.00 N ATOM 197 NH2 ARG A 15 26.526 -12.003 1.855 1.00 0.00 N ATOM 0 H ARG A 15 21.959 -15.392 1.478 1.00 0.00 H new ATOM 0 HA ARG A 15 19.948 -13.419 2.163 1.00 0.00 H new ATOM 0 HB2 ARG A 15 22.055 -13.695 -0.002 1.00 0.00 H new ATOM 0 HB3 ARG A 15 20.828 -12.446 -0.089 1.00 0.00 H new ATOM 0 HG2 ARG A 15 21.515 -11.696 2.243 1.00 0.00 H new ATOM 0 HG3 ARG A 15 22.824 -12.860 2.186 1.00 0.00 H new ATOM 0 HD2 ARG A 15 22.711 -11.127 -0.219 1.00 0.00 H new ATOM 0 HD3 ARG A 15 22.957 -10.226 1.264 1.00 0.00 H new ATOM 0 HE ARG A 15 24.880 -11.995 -0.028 1.00 0.00 H new ATOM 0 HH11 ARG A 15 23.788 -10.826 3.138 1.00 0.00 H new ATOM 0 HH12 ARG A 15 25.352 -11.101 3.912 1.00 0.00 H new ATOM 0 HH21 ARG A 15 26.902 -12.352 0.973 1.00 0.00 H new ATOM 0 HH22 ARG A 15 27.120 -11.966 2.684 1.00 0.00 H new ATOM 211 N GLN A 16 18.111 -14.587 0.921 1.00 0.00 N ATOM 212 CA GLN A 16 16.984 -15.039 0.122 1.00 0.00 C ATOM 213 C GLN A 16 16.072 -13.860 -0.223 1.00 0.00 C ATOM 214 O GLN A 16 16.327 -12.730 0.192 1.00 0.00 O ATOM 215 CB GLN A 16 16.206 -16.141 0.845 1.00 0.00 C ATOM 216 CG GLN A 16 15.597 -15.618 2.147 1.00 0.00 C ATOM 217 CD GLN A 16 16.544 -15.851 3.327 1.00 0.00 C ATOM 218 OE1 GLN A 16 17.226 -14.955 3.795 1.00 0.00 O ATOM 219 NE2 GLN A 16 16.547 -17.102 3.779 1.00 0.00 N ATOM 0 H GLN A 16 17.886 -14.370 1.892 1.00 0.00 H new ATOM 0 HA GLN A 16 17.368 -15.461 -0.807 1.00 0.00 H new ATOM 0 HB2 GLN A 16 15.416 -16.519 0.196 1.00 0.00 H new ATOM 0 HB3 GLN A 16 16.870 -16.978 1.060 1.00 0.00 H new ATOM 0 HG2 GLN A 16 15.384 -14.553 2.051 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.646 -16.117 2.335 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.951 -17.804 3.341 1.00 0.00 H new ATOM 0 HE22 GLN A 16 17.145 -17.359 4.564 1.00 0.00 H new ATOM 228 N LEU A 17 15.026 -14.163 -0.978 1.00 0.00 N ATOM 229 CA LEU A 17 14.074 -13.143 -1.383 1.00 0.00 C ATOM 230 C LEU A 17 13.028 -12.961 -0.281 1.00 0.00 C ATOM 231 O LEU A 17 12.584 -13.934 0.325 1.00 0.00 O ATOM 232 CB LEU A 17 13.476 -13.481 -2.750 1.00 0.00 C ATOM 233 CG LEU A 17 14.338 -13.132 -3.965 1.00 0.00 C ATOM 234 CD1 LEU A 17 13.631 -13.515 -5.267 1.00 0.00 C ATOM 235 CD2 LEU A 17 14.742 -11.657 -3.945 1.00 0.00 C ATOM 0 H LEU A 17 14.817 -15.101 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 17 14.574 -12.183 -1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 17 13.262 -14.549 -2.776 1.00 0.00 H new ATOM 0 HB3 LEU A 17 12.522 -12.962 -2.845 1.00 0.00 H new ATOM 0 HG LEU A 17 15.256 -13.718 -3.912 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.265 -13.256 -6.115 1.00 0.00 H new ATOM 0 HD12 LEU A 17 13.436 -14.587 -5.273 1.00 0.00 H new ATOM 0 HD13 LEU A 17 12.687 -12.974 -5.341 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.354 -11.435 -4.819 1.00 0.00 H new ATOM 0 HD22 LEU A 17 13.847 -11.034 -3.961 1.00 0.00 H new ATOM 0 HD23 LEU A 17 15.313 -11.448 -3.040 1.00 0.00 H new ATOM 247 N PRO A 18 12.655 -11.673 -0.050 1.00 0.00 N ATOM 248 CA PRO A 18 11.670 -11.351 0.968 1.00 0.00 C ATOM 249 C PRO A 18 10.259 -11.712 0.499 1.00 0.00 C ATOM 250 O PRO A 18 10.024 -11.887 -0.695 1.00 0.00 O ATOM 251 CB PRO A 18 11.847 -9.864 1.231 1.00 0.00 C ATOM 252 CG PRO A 18 12.597 -9.316 0.028 1.00 0.00 C ATOM 253 CD PRO A 18 13.160 -10.495 -0.748 1.00 0.00 C ATOM 0 HA PRO A 18 11.810 -11.923 1.885 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.882 -9.370 1.348 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.406 -9.694 2.151 1.00 0.00 H new ATOM 0 HG2 PRO A 18 11.930 -8.728 -0.602 1.00 0.00 H new ATOM 0 HG3 PRO A 18 13.400 -8.652 0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 18 12.831 -10.479 -1.787 1.00 0.00 H new ATOM 0 HD3 PRO A 18 14.250 -10.478 -0.759 1.00 0.00 H new ATOM 261 N HIS A 19 9.357 -11.812 1.464 1.00 0.00 N ATOM 262 CA HIS A 19 7.975 -12.149 1.165 1.00 0.00 C ATOM 263 C HIS A 19 7.124 -10.878 1.174 1.00 0.00 C ATOM 264 O HIS A 19 7.560 -9.837 1.664 1.00 0.00 O ATOM 265 CB HIS A 19 7.456 -13.217 2.129 1.00 0.00 C ATOM 266 CG HIS A 19 7.301 -14.584 1.505 1.00 0.00 C ATOM 267 ND1 HIS A 19 6.071 -15.195 1.332 1.00 0.00 N ATOM 268 CD2 HIS A 19 8.234 -15.451 1.016 1.00 0.00 C ATOM 269 CE1 HIS A 19 6.267 -16.375 0.764 1.00 0.00 C ATOM 270 NE2 HIS A 19 7.608 -16.532 0.569 1.00 0.00 N ATOM 0 H HIS A 19 9.556 -11.666 2.454 1.00 0.00 H new ATOM 0 HA HIS A 19 7.910 -12.581 0.167 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.139 -13.291 2.976 1.00 0.00 H new ATOM 0 HB3 HIS A 19 6.492 -12.898 2.524 1.00 0.00 H new ATOM 0 HD2 HIS A 19 9.301 -15.285 0.996 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.500 -17.088 0.501 1.00 0.00 H new ATOM 0 HE2 HIS A 19 8.056 -17.346 0.149 1.00 0.00 H new ATOM 278 N ALA A 20 5.924 -11.004 0.626 1.00 0.00 N ATOM 279 CA ALA A 20 5.007 -9.878 0.564 1.00 0.00 C ATOM 280 C ALA A 20 4.596 -9.483 1.984 1.00 0.00 C ATOM 281 O ALA A 20 4.784 -10.252 2.925 1.00 0.00 O ATOM 282 CB ALA A 20 3.807 -10.244 -0.311 1.00 0.00 C ATOM 0 H ALA A 20 5.565 -11.869 0.221 1.00 0.00 H new ATOM 0 HA ALA A 20 5.490 -9.014 0.108 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.119 -9.399 -0.357 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.151 -10.488 -1.316 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.295 -11.106 0.116 1.00 0.00 H new ATOM 288 N PRO A 21 4.026 -8.253 2.096 1.00 0.00 N ATOM 289 CA PRO A 21 3.586 -7.747 3.385 1.00 0.00 C ATOM 290 C PRO A 21 2.288 -8.426 3.827 1.00 0.00 C ATOM 291 O PRO A 21 1.603 -9.050 3.017 1.00 0.00 O ATOM 292 CB PRO A 21 3.434 -6.247 3.187 1.00 0.00 C ATOM 293 CG PRO A 21 3.344 -6.032 1.685 1.00 0.00 C ATOM 294 CD PRO A 21 3.787 -7.316 1.003 1.00 0.00 C ATOM 0 HA PRO A 21 4.295 -7.961 4.185 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.541 -5.875 3.689 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.283 -5.709 3.608 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.324 -5.779 1.396 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.978 -5.199 1.380 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.021 -7.688 0.323 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.689 -7.159 0.411 1.00 0.00 H new ATOM 302 N GLU A 22 1.990 -8.282 5.109 1.00 0.00 N ATOM 303 CA GLU A 22 0.786 -8.874 5.669 1.00 0.00 C ATOM 304 C GLU A 22 -0.142 -7.783 6.206 1.00 0.00 C ATOM 305 O GLU A 22 0.184 -6.599 6.141 1.00 0.00 O ATOM 306 CB GLU A 22 1.131 -9.888 6.762 1.00 0.00 C ATOM 307 CG GLU A 22 1.095 -11.317 6.215 1.00 0.00 C ATOM 308 CD GLU A 22 0.481 -12.278 7.235 1.00 0.00 C ATOM 309 OE1 GLU A 22 0.986 -12.292 8.378 1.00 0.00 O ATOM 310 OE2 GLU A 22 -0.479 -12.978 6.847 1.00 0.00 O ATOM 0 H GLU A 22 2.561 -7.764 5.777 1.00 0.00 H new ATOM 0 HA GLU A 22 0.264 -9.408 4.875 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.122 -9.673 7.163 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.425 -9.793 7.587 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.516 -11.342 5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.106 -11.641 5.967 1.00 0.00 H new ATOM 317 N HIS A 23 -1.279 -8.221 6.725 1.00 0.00 N ATOM 318 CA HIS A 23 -2.257 -7.296 7.273 1.00 0.00 C ATOM 319 C HIS A 23 -2.309 -6.033 6.410 1.00 0.00 C ATOM 320 O HIS A 23 -2.148 -4.924 6.917 1.00 0.00 O ATOM 321 CB HIS A 23 -1.958 -6.997 8.743 1.00 0.00 C ATOM 322 CG HIS A 23 -3.123 -7.247 9.670 1.00 0.00 C ATOM 323 ND1 HIS A 23 -4.298 -6.518 9.610 1.00 0.00 N ATOM 324 CD2 HIS A 23 -3.282 -8.151 10.679 1.00 0.00 C ATOM 325 CE1 HIS A 23 -5.120 -6.972 10.545 1.00 0.00 C ATOM 326 NE2 HIS A 23 -4.488 -7.984 11.207 1.00 0.00 N ATOM 0 H HIS A 23 -1.545 -9.204 6.778 1.00 0.00 H new ATOM 0 HA HIS A 23 -3.247 -7.752 7.249 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -1.114 -7.609 9.063 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -1.650 -5.956 8.836 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.550 -8.880 10.995 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -6.115 -6.605 10.748 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -4.878 -8.523 11.980 1.00 0.00 H new ATOM 334 N PRO A 24 -2.540 -6.250 5.088 1.00 0.00 N ATOM 335 CA PRO A 24 -2.615 -5.143 4.150 1.00 0.00 C ATOM 336 C PRO A 24 -3.940 -4.391 4.294 1.00 0.00 C ATOM 337 O PRO A 24 -4.891 -4.657 3.561 1.00 0.00 O ATOM 338 CB PRO A 24 -2.437 -5.775 2.779 1.00 0.00 C ATOM 339 CG PRO A 24 -2.734 -7.255 2.961 1.00 0.00 C ATOM 340 CD PRO A 24 -2.735 -7.550 4.452 1.00 0.00 C ATOM 0 HA PRO A 24 -1.849 -4.389 4.328 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.114 -5.327 2.052 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.424 -5.623 2.407 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.699 -7.508 2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.984 -7.860 2.453 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.674 -8.007 4.765 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.938 -8.245 4.719 1.00 0.00 H new ATOM 348 N VAL A 25 -3.960 -3.468 5.244 1.00 0.00 N ATOM 349 CA VAL A 25 -5.152 -2.676 5.493 1.00 0.00 C ATOM 350 C VAL A 25 -5.029 -1.334 4.770 1.00 0.00 C ATOM 351 O VAL A 25 -3.999 -0.667 4.862 1.00 0.00 O ATOM 352 CB VAL A 25 -5.374 -2.525 7.000 1.00 0.00 C ATOM 353 CG1 VAL A 25 -6.855 -2.303 7.316 1.00 0.00 C ATOM 354 CG2 VAL A 25 -4.827 -3.735 7.759 1.00 0.00 C ATOM 0 H VAL A 25 -3.169 -3.251 5.851 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.034 -3.179 5.096 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.824 -1.645 7.333 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.986 -2.199 8.393 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.201 -1.397 6.819 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.434 -3.155 6.961 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.998 -3.602 8.827 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.336 -4.638 7.420 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.757 -3.829 7.571 1.00 0.00 H new ATOM 364 N ALA A 26 -6.093 -0.977 4.065 1.00 0.00 N ATOM 365 CA ALA A 26 -6.116 0.273 3.326 1.00 0.00 C ATOM 366 C ALA A 26 -7.434 1.000 3.603 1.00 0.00 C ATOM 367 O ALA A 26 -8.488 0.587 3.121 1.00 0.00 O ATOM 368 CB ALA A 26 -5.908 -0.010 1.837 1.00 0.00 C ATOM 0 H ALA A 26 -6.945 -1.532 3.990 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.305 0.925 3.650 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.925 0.928 1.282 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.946 -0.500 1.691 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.705 -0.660 1.475 1.00 0.00 H new ATOM 374 N THR A 27 -7.332 2.069 4.378 1.00 0.00 N ATOM 375 CA THR A 27 -8.503 2.857 4.725 1.00 0.00 C ATOM 376 C THR A 27 -8.252 4.339 4.442 1.00 0.00 C ATOM 377 O THR A 27 -7.103 4.773 4.362 1.00 0.00 O ATOM 378 CB THR A 27 -8.851 2.568 6.186 1.00 0.00 C ATOM 379 OG1 THR A 27 -7.612 2.172 6.767 1.00 0.00 O ATOM 380 CG2 THR A 27 -9.746 1.336 6.343 1.00 0.00 C ATOM 0 H THR A 27 -6.456 2.409 4.776 1.00 0.00 H new ATOM 0 HA THR A 27 -9.361 2.582 4.111 1.00 0.00 H new ATOM 0 HB THR A 27 -9.349 3.436 6.618 1.00 0.00 H new ATOM 0 HG1 THR A 27 -7.746 1.967 7.716 1.00 0.00 H new ATOM 0 HG21 THR A 27 -9.963 1.176 7.399 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.679 1.492 5.801 1.00 0.00 H new ATOM 0 HG23 THR A 27 -9.235 0.461 5.941 1.00 0.00 H new ATOM 388 N LEU A 28 -9.344 5.075 4.297 1.00 0.00 N ATOM 389 CA LEU A 28 -9.256 6.499 4.025 1.00 0.00 C ATOM 390 C LEU A 28 -8.252 7.137 4.987 1.00 0.00 C ATOM 391 O LEU A 28 -7.753 6.477 5.897 1.00 0.00 O ATOM 392 CB LEU A 28 -10.645 7.140 4.072 1.00 0.00 C ATOM 393 CG LEU A 28 -11.263 7.501 2.720 1.00 0.00 C ATOM 394 CD1 LEU A 28 -12.634 8.156 2.901 1.00 0.00 C ATOM 395 CD2 LEU A 28 -10.313 8.376 1.899 1.00 0.00 C ATOM 0 H LEU A 28 -10.295 4.711 4.363 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.884 6.671 3.015 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.321 6.458 4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.585 8.046 4.675 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.418 6.580 2.158 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -13.051 8.403 1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -13.302 7.466 3.417 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -12.527 9.067 3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.776 8.618 0.943 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.103 9.296 2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.382 7.837 1.725 1.00 0.00 H new ATOM 407 N SER A 29 -7.984 8.413 4.752 1.00 0.00 N ATOM 408 CA SER A 29 -7.048 9.148 5.586 1.00 0.00 C ATOM 409 C SER A 29 -7.809 10.079 6.532 1.00 0.00 C ATOM 410 O SER A 29 -7.336 10.380 7.626 1.00 0.00 O ATOM 411 CB SER A 29 -6.062 9.948 4.733 1.00 0.00 C ATOM 412 OG SER A 29 -4.713 9.741 5.141 1.00 0.00 O ATOM 0 H SER A 29 -8.399 8.957 3.996 1.00 0.00 H new ATOM 0 HA SER A 29 -6.478 8.430 6.175 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.172 9.662 3.687 1.00 0.00 H new ATOM 0 HB3 SER A 29 -6.302 11.009 4.800 1.00 0.00 H new ATOM 0 HG SER A 29 -4.155 10.476 4.811 1.00 0.00 H new ATOM 418 N THR A 30 -8.977 10.509 6.075 1.00 0.00 N ATOM 419 CA THR A 30 -9.808 11.399 6.867 1.00 0.00 C ATOM 420 C THR A 30 -8.998 12.611 7.333 1.00 0.00 C ATOM 421 O THR A 30 -9.272 13.176 8.390 1.00 0.00 O ATOM 422 CB THR A 30 -10.405 10.589 8.019 1.00 0.00 C ATOM 423 OG1 THR A 30 -9.340 10.484 8.959 1.00 0.00 O ATOM 424 CG2 THR A 30 -10.698 9.139 7.625 1.00 0.00 C ATOM 0 H THR A 30 -9.367 10.257 5.167 1.00 0.00 H new ATOM 0 HA THR A 30 -10.629 11.804 6.275 1.00 0.00 H new ATOM 0 HB THR A 30 -11.324 11.066 8.359 1.00 0.00 H new ATOM 0 HG1 THR A 30 -8.664 9.862 8.619 1.00 0.00 H new ATOM 0 HG21 THR A 30 -11.120 8.608 8.478 1.00 0.00 H new ATOM 0 HG22 THR A 30 -11.410 9.123 6.799 1.00 0.00 H new ATOM 0 HG23 THR A 30 -9.773 8.652 7.316 1.00 0.00 H new ATOM 432 N VAL A 31 -8.016 12.974 6.521 1.00 0.00 N ATOM 433 CA VAL A 31 -7.165 14.108 6.836 1.00 0.00 C ATOM 434 C VAL A 31 -6.669 14.746 5.537 1.00 0.00 C ATOM 435 O VAL A 31 -6.843 15.945 5.324 1.00 0.00 O ATOM 436 CB VAL A 31 -6.025 13.667 7.758 1.00 0.00 C ATOM 437 CG1 VAL A 31 -6.570 13.118 9.078 1.00 0.00 C ATOM 438 CG2 VAL A 31 -5.127 12.640 7.065 1.00 0.00 C ATOM 0 H VAL A 31 -7.791 12.502 5.645 1.00 0.00 H new ATOM 0 HA VAL A 31 -7.728 14.868 7.377 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.418 14.543 7.985 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -5.740 12.812 9.715 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -7.148 13.892 9.583 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -7.210 12.259 8.878 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.325 12.343 7.741 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.717 11.764 6.795 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.698 13.080 6.165 1.00 0.00 H new ATOM 448 N GLU A 32 -6.062 13.916 4.702 1.00 0.00 N ATOM 449 CA GLU A 32 -5.541 14.383 3.429 1.00 0.00 C ATOM 450 C GLU A 32 -6.576 14.175 2.322 1.00 0.00 C ATOM 451 O GLU A 32 -7.007 13.050 2.074 1.00 0.00 O ATOM 452 CB GLU A 32 -4.224 13.685 3.086 1.00 0.00 C ATOM 453 CG GLU A 32 -3.034 14.624 3.296 1.00 0.00 C ATOM 454 CD GLU A 32 -2.014 14.009 4.256 1.00 0.00 C ATOM 455 OE1 GLU A 32 -1.391 13.002 3.854 1.00 0.00 O ATOM 456 OE2 GLU A 32 -1.879 14.560 5.370 1.00 0.00 O ATOM 0 H GLU A 32 -5.919 12.922 4.882 1.00 0.00 H new ATOM 0 HA GLU A 32 -5.337 15.451 3.513 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -4.106 12.798 3.708 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -4.247 13.347 2.050 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -2.557 14.833 2.338 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -3.384 15.577 3.693 1.00 0.00 H new ATOM 463 N ARG A 33 -6.947 15.277 1.686 1.00 0.00 N ATOM 464 CA ARG A 33 -7.924 15.229 0.612 1.00 0.00 C ATOM 465 C ARG A 33 -7.508 14.196 -0.437 1.00 0.00 C ATOM 466 O ARG A 33 -6.385 14.231 -0.938 1.00 0.00 O ATOM 467 CB ARG A 33 -8.072 16.596 -0.059 1.00 0.00 C ATOM 468 CG ARG A 33 -8.724 17.605 0.889 1.00 0.00 C ATOM 469 CD ARG A 33 -10.208 17.784 0.563 1.00 0.00 C ATOM 470 NE ARG A 33 -10.703 19.054 1.139 1.00 0.00 N ATOM 471 CZ ARG A 33 -11.805 19.690 0.719 1.00 0.00 C ATOM 472 NH1 ARG A 33 -12.533 19.178 -0.283 1.00 0.00 N ATOM 473 NH2 ARG A 33 -12.179 20.838 1.300 1.00 0.00 N ATOM 0 H ARG A 33 -6.588 16.209 1.894 1.00 0.00 H new ATOM 0 HA ARG A 33 -8.882 14.945 1.047 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -7.093 16.962 -0.367 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -8.674 16.498 -0.962 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.613 17.266 1.919 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -8.213 18.565 0.812 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -10.354 17.784 -0.517 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.780 16.947 0.962 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.172 19.471 1.903 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -12.248 18.304 -0.726 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -13.372 19.662 -0.603 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -11.625 21.228 2.062 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -13.018 21.322 0.980 1.00 0.00 H new ATOM 487 N ARG A 34 -8.437 13.301 -0.740 1.00 0.00 N ATOM 488 CA ARG A 34 -8.181 12.260 -1.721 1.00 0.00 C ATOM 489 C ARG A 34 -6.922 11.475 -1.346 1.00 0.00 C ATOM 490 O ARG A 34 -6.026 11.303 -2.171 1.00 0.00 O ATOM 491 CB ARG A 34 -8.008 12.852 -3.120 1.00 0.00 C ATOM 492 CG ARG A 34 -9.083 13.901 -3.409 1.00 0.00 C ATOM 493 CD ARG A 34 -10.362 13.245 -3.933 1.00 0.00 C ATOM 494 NE ARG A 34 -11.432 13.336 -2.914 1.00 0.00 N ATOM 495 CZ ARG A 34 -11.985 14.487 -2.506 1.00 0.00 C ATOM 496 NH1 ARG A 34 -11.573 15.650 -3.028 1.00 0.00 N ATOM 497 NH2 ARG A 34 -12.950 14.474 -1.577 1.00 0.00 N ATOM 0 H ARG A 34 -9.368 13.275 -0.324 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.042 11.591 -1.727 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.020 13.305 -3.207 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -8.061 12.057 -3.864 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -9.303 14.461 -2.500 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -8.710 14.616 -4.142 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -10.682 13.735 -4.853 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -10.170 12.200 -4.179 1.00 0.00 H new ATOM 0 HE ARG A 34 -11.770 12.469 -2.496 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -10.839 15.660 -3.736 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -11.994 16.526 -2.718 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -13.264 13.588 -1.180 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -13.371 15.350 -1.266 1.00 0.00 H new ATOM 511 N ALA A 35 -6.894 11.021 -0.102 1.00 0.00 N ATOM 512 CA ALA A 35 -5.760 10.259 0.392 1.00 0.00 C ATOM 513 C ALA A 35 -6.267 9.056 1.189 1.00 0.00 C ATOM 514 O ALA A 35 -7.392 9.066 1.686 1.00 0.00 O ATOM 515 CB ALA A 35 -4.856 11.171 1.224 1.00 0.00 C ATOM 0 H ALA A 35 -7.639 11.166 0.579 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.164 9.877 -0.437 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.005 10.600 1.595 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.499 11.993 0.604 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.420 11.571 2.067 1.00 0.00 H new ATOM 521 N ILE A 36 -5.413 8.048 1.285 1.00 0.00 N ATOM 522 CA ILE A 36 -5.760 6.840 2.014 1.00 0.00 C ATOM 523 C ILE A 36 -4.605 6.459 2.942 1.00 0.00 C ATOM 524 O ILE A 36 -3.442 6.702 2.623 1.00 0.00 O ATOM 525 CB ILE A 36 -6.163 5.727 1.044 1.00 0.00 C ATOM 526 CG1 ILE A 36 -7.416 6.113 0.256 1.00 0.00 C ATOM 527 CG2 ILE A 36 -6.336 4.396 1.779 1.00 0.00 C ATOM 528 CD1 ILE A 36 -7.860 4.972 -0.661 1.00 0.00 C ATOM 0 H ILE A 36 -4.481 8.043 0.870 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.632 7.013 2.645 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.357 5.595 0.322 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.221 6.364 0.946 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.216 7.005 -0.338 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.622 3.622 1.067 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.396 4.120 2.257 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -7.113 4.497 2.537 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.753 5.272 -1.210 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.062 4.740 -1.366 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.083 4.089 -0.062 1.00 0.00 H new ATOM 540 N ASN A 37 -4.965 5.868 4.071 1.00 0.00 N ATOM 541 CA ASN A 37 -3.973 5.451 5.048 1.00 0.00 C ATOM 542 C ASN A 37 -3.627 3.978 4.820 1.00 0.00 C ATOM 543 O ASN A 37 -4.397 3.092 5.187 1.00 0.00 O ATOM 544 CB ASN A 37 -4.509 5.595 6.473 1.00 0.00 C ATOM 545 CG ASN A 37 -3.624 6.531 7.299 1.00 0.00 C ATOM 546 OD1 ASN A 37 -2.427 6.337 7.435 1.00 0.00 O ATOM 547 ND2 ASN A 37 -4.278 7.555 7.842 1.00 0.00 N ATOM 0 H ASN A 37 -5.931 5.668 4.332 1.00 0.00 H new ATOM 0 HA ASN A 37 -3.094 6.084 4.928 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.528 5.982 6.445 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -4.553 4.616 6.950 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -3.776 8.236 8.412 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -5.281 7.659 7.688 1.00 0.00 H new ATOM 554 N LEU A 38 -2.469 3.762 4.215 1.00 0.00 N ATOM 555 CA LEU A 38 -2.011 2.412 3.934 1.00 0.00 C ATOM 556 C LEU A 38 -1.259 1.869 5.150 1.00 0.00 C ATOM 557 O LEU A 38 -0.345 2.516 5.659 1.00 0.00 O ATOM 558 CB LEU A 38 -1.194 2.381 2.641 1.00 0.00 C ATOM 559 CG LEU A 38 -1.486 1.219 1.690 1.00 0.00 C ATOM 560 CD1 LEU A 38 -0.585 0.021 1.995 1.00 0.00 C ATOM 561 CD2 LEU A 38 -2.969 0.843 1.722 1.00 0.00 C ATOM 0 H LEU A 38 -1.833 4.500 3.911 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.860 1.750 3.763 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.364 3.315 2.105 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.136 2.352 2.904 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.258 1.544 0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.813 -0.791 1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.459 0.312 1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.758 -0.313 3.018 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.149 0.014 1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.247 0.545 2.733 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.569 1.701 1.419 1.00 0.00 H new ATOM 573 N THR A 39 -1.671 0.686 5.582 1.00 0.00 N ATOM 574 CA THR A 39 -1.047 0.049 6.729 1.00 0.00 C ATOM 575 C THR A 39 -0.880 -1.451 6.480 1.00 0.00 C ATOM 576 O THR A 39 -1.846 -2.143 6.161 1.00 0.00 O ATOM 577 CB THR A 39 -1.890 0.370 7.965 1.00 0.00 C ATOM 578 OG1 THR A 39 -3.191 -0.104 7.630 1.00 0.00 O ATOM 579 CG2 THR A 39 -2.082 1.874 8.167 1.00 0.00 C ATOM 0 H THR A 39 -2.430 0.152 5.158 1.00 0.00 H new ATOM 0 HA THR A 39 -0.041 0.433 6.896 1.00 0.00 H new ATOM 0 HB THR A 39 -1.417 -0.058 8.849 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.114 -0.867 7.020 1.00 0.00 H new ATOM 0 HG21 THR A 39 -2.687 2.047 9.057 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.110 2.352 8.290 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.586 2.296 7.298 1.00 0.00 H new ATOM 587 N TRP A 40 0.353 -1.911 6.637 1.00 0.00 N ATOM 588 CA TRP A 40 0.659 -3.317 6.433 1.00 0.00 C ATOM 589 C TRP A 40 1.634 -3.752 7.530 1.00 0.00 C ATOM 590 O TRP A 40 2.175 -2.916 8.252 1.00 0.00 O ATOM 591 CB TRP A 40 1.198 -3.562 5.023 1.00 0.00 C ATOM 592 CG TRP A 40 2.524 -2.856 4.731 1.00 0.00 C ATOM 593 CD1 TRP A 40 3.761 -3.368 4.790 1.00 0.00 C ATOM 594 CD2 TRP A 40 2.696 -1.480 4.331 1.00 0.00 C ATOM 595 NE1 TRP A 40 4.714 -2.426 4.458 1.00 0.00 N ATOM 596 CE2 TRP A 40 4.045 -1.242 4.170 1.00 0.00 C ATOM 597 CE3 TRP A 40 1.742 -0.471 4.111 1.00 0.00 C ATOM 598 CZ2 TRP A 40 4.564 0.000 3.783 1.00 0.00 C ATOM 599 CZ3 TRP A 40 2.276 0.764 3.725 1.00 0.00 C ATOM 600 CH2 TRP A 40 3.632 1.020 3.559 1.00 0.00 C ATOM 0 H TRP A 40 1.152 -1.335 6.903 1.00 0.00 H new ATOM 0 HA TRP A 40 -0.244 -3.923 6.508 1.00 0.00 H new ATOM 0 HB2 TRP A 40 1.329 -4.634 4.877 1.00 0.00 H new ATOM 0 HB3 TRP A 40 0.454 -3.230 4.298 1.00 0.00 H new ATOM 0 HD1 TRP A 40 3.984 -4.389 5.063 1.00 0.00 H new ATOM 0 HE1 TRP A 40 5.723 -2.572 4.429 1.00 0.00 H new ATOM 0 HE3 TRP A 40 0.681 -0.636 4.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 5.625 0.162 3.664 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 1.586 1.575 3.543 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.965 2.002 3.258 1.00 0.00 H new ATOM 611 N THR A 41 1.828 -5.060 7.619 1.00 0.00 N ATOM 612 CA THR A 41 2.728 -5.616 8.615 1.00 0.00 C ATOM 613 C THR A 41 4.125 -5.811 8.022 1.00 0.00 C ATOM 614 O THR A 41 4.277 -5.920 6.807 1.00 0.00 O ATOM 615 CB THR A 41 2.106 -6.910 9.144 1.00 0.00 C ATOM 616 OG1 THR A 41 1.139 -6.468 10.092 1.00 0.00 O ATOM 617 CG2 THR A 41 3.091 -7.736 9.974 1.00 0.00 C ATOM 0 H THR A 41 1.378 -5.750 7.018 1.00 0.00 H new ATOM 0 HA THR A 41 2.858 -4.934 9.455 1.00 0.00 H new ATOM 0 HB THR A 41 1.746 -7.508 8.307 1.00 0.00 H new ATOM 0 HG1 THR A 41 0.686 -7.244 10.483 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.599 -8.643 10.325 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.950 -8.004 9.359 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.426 -7.150 10.830 1.00 0.00 H new ATOM 625 N LYS A 42 5.109 -5.849 8.909 1.00 0.00 N ATOM 626 CA LYS A 42 6.488 -6.028 8.488 1.00 0.00 C ATOM 627 C LYS A 42 6.727 -7.502 8.154 1.00 0.00 C ATOM 628 O LYS A 42 6.703 -8.355 9.040 1.00 0.00 O ATOM 629 CB LYS A 42 7.447 -5.474 9.544 1.00 0.00 C ATOM 630 CG LYS A 42 8.716 -4.920 8.895 1.00 0.00 C ATOM 631 CD LYS A 42 9.801 -5.995 8.805 1.00 0.00 C ATOM 632 CE LYS A 42 10.917 -5.570 7.849 1.00 0.00 C ATOM 633 NZ LYS A 42 11.589 -4.349 8.346 1.00 0.00 N ATOM 0 H LYS A 42 4.979 -5.759 9.917 1.00 0.00 H new ATOM 0 HA LYS A 42 6.686 -5.458 7.580 1.00 0.00 H new ATOM 0 HB2 LYS A 42 6.952 -4.687 10.113 1.00 0.00 H new ATOM 0 HB3 LYS A 42 7.710 -6.261 10.251 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.485 -4.547 7.897 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.085 -4.074 9.474 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.217 -6.181 9.795 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.362 -6.932 8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 42 11.644 -6.376 7.748 1.00 0.00 H new ATOM 0 HE3 LYS A 42 10.504 -5.387 6.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.407 -4.132 7.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 10.921 -3.552 8.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 11.912 -4.503 9.323 1.00 0.00 H new ATOM 647 N PRO A 43 6.957 -7.764 6.839 1.00 0.00 N ATOM 648 CA PRO A 43 7.200 -9.119 6.377 1.00 0.00 C ATOM 649 C PRO A 43 8.609 -9.582 6.752 1.00 0.00 C ATOM 650 O PRO A 43 9.394 -8.811 7.302 1.00 0.00 O ATOM 651 CB PRO A 43 6.970 -9.070 4.875 1.00 0.00 C ATOM 652 CG PRO A 43 7.063 -7.603 4.487 1.00 0.00 C ATOM 653 CD PRO A 43 6.992 -6.779 5.762 1.00 0.00 C ATOM 0 HA PRO A 43 6.538 -9.848 6.844 1.00 0.00 H new ATOM 0 HB2 PRO A 43 7.717 -9.662 4.346 1.00 0.00 H new ATOM 0 HB3 PRO A 43 5.995 -9.482 4.616 1.00 0.00 H new ATOM 0 HG2 PRO A 43 7.995 -7.407 3.957 1.00 0.00 H new ATOM 0 HG3 PRO A 43 6.250 -7.334 3.813 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.855 -6.120 5.856 1.00 0.00 H new ATOM 0 HD3 PRO A 43 6.105 -6.146 5.775 1.00 0.00 H new ATOM 661 N PHE A 44 8.887 -10.839 6.438 1.00 0.00 N ATOM 662 CA PHE A 44 10.189 -11.414 6.735 1.00 0.00 C ATOM 663 C PHE A 44 11.184 -11.128 5.609 1.00 0.00 C ATOM 664 O PHE A 44 10.903 -11.403 4.443 1.00 0.00 O ATOM 665 CB PHE A 44 9.993 -12.927 6.855 1.00 0.00 C ATOM 666 CG PHE A 44 11.299 -13.719 6.935 1.00 0.00 C ATOM 667 CD1 PHE A 44 12.096 -13.829 5.839 1.00 0.00 C ATOM 668 CD2 PHE A 44 11.663 -14.313 8.103 1.00 0.00 C ATOM 669 CE1 PHE A 44 13.309 -14.564 5.914 1.00 0.00 C ATOM 670 CE2 PHE A 44 12.876 -15.048 8.178 1.00 0.00 C ATOM 671 CZ PHE A 44 13.673 -15.158 7.082 1.00 0.00 C ATOM 0 H PHE A 44 8.234 -11.475 5.981 1.00 0.00 H new ATOM 0 HA PHE A 44 10.586 -10.981 7.653 1.00 0.00 H new ATOM 0 HB2 PHE A 44 9.398 -13.137 7.744 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.419 -13.278 5.997 1.00 0.00 H new ATOM 0 HD1 PHE A 44 11.807 -13.358 4.911 1.00 0.00 H new ATOM 0 HD2 PHE A 44 11.030 -14.226 8.973 1.00 0.00 H new ATOM 0 HE1 PHE A 44 13.942 -14.651 5.044 1.00 0.00 H new ATOM 0 HE2 PHE A 44 13.165 -15.519 9.106 1.00 0.00 H new ATOM 0 HZ PHE A 44 14.595 -15.717 7.139 1.00 0.00 H new ATOM 681 N ASP A 45 12.326 -10.581 5.996 1.00 0.00 N ATOM 682 CA ASP A 45 13.365 -10.255 5.034 1.00 0.00 C ATOM 683 C ASP A 45 14.287 -11.463 4.856 1.00 0.00 C ATOM 684 O ASP A 45 14.405 -12.296 5.754 1.00 0.00 O ATOM 685 CB ASP A 45 14.215 -9.079 5.518 1.00 0.00 C ATOM 686 CG ASP A 45 15.308 -9.442 6.525 1.00 0.00 C ATOM 687 OD1 ASP A 45 15.177 -10.523 7.139 1.00 0.00 O ATOM 688 OD2 ASP A 45 16.249 -8.631 6.659 1.00 0.00 O ATOM 0 H ASP A 45 12.555 -10.355 6.964 1.00 0.00 H new ATOM 0 HA ASP A 45 12.882 -9.988 4.094 1.00 0.00 H new ATOM 0 HB2 ASP A 45 14.681 -8.607 4.653 1.00 0.00 H new ATOM 0 HB3 ASP A 45 13.557 -8.337 5.970 1.00 0.00 H new ATOM 693 N GLY A 46 14.915 -11.521 3.691 1.00 0.00 N ATOM 694 CA GLY A 46 15.823 -12.614 3.384 1.00 0.00 C ATOM 695 C GLY A 46 17.189 -12.392 4.036 1.00 0.00 C ATOM 696 O GLY A 46 18.204 -12.314 3.346 1.00 0.00 O ATOM 0 H GLY A 46 14.813 -10.829 2.948 1.00 0.00 H new ATOM 0 HA2 GLY A 46 15.397 -13.554 3.734 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.941 -12.701 2.304 1.00 0.00 H new ATOM 700 N ASN A 47 17.170 -12.296 5.357 1.00 0.00 N ATOM 701 CA ASN A 47 18.394 -12.084 6.110 1.00 0.00 C ATOM 702 C ASN A 47 18.826 -10.622 5.973 1.00 0.00 C ATOM 703 O ASN A 47 19.183 -9.982 6.961 1.00 0.00 O ATOM 704 CB ASN A 47 19.528 -12.963 5.577 1.00 0.00 C ATOM 705 CG ASN A 47 20.122 -13.826 6.691 1.00 0.00 C ATOM 706 OD1 ASN A 47 20.712 -13.339 7.641 1.00 0.00 O ATOM 707 ND2 ASN A 47 19.936 -15.132 6.521 1.00 0.00 N ATOM 0 H ASN A 47 16.326 -12.361 5.925 1.00 0.00 H new ATOM 0 HA ASN A 47 18.197 -12.340 7.151 1.00 0.00 H new ATOM 0 HB2 ASN A 47 19.153 -13.602 4.778 1.00 0.00 H new ATOM 0 HB3 ASN A 47 20.307 -12.335 5.144 1.00 0.00 H new ATOM 0 HD21 ASN A 47 20.297 -15.792 7.210 1.00 0.00 H new ATOM 0 HD22 ASN A 47 19.433 -15.473 5.702 1.00 0.00 H new ATOM 714 N SER A 48 18.778 -10.137 4.741 1.00 0.00 N ATOM 715 CA SER A 48 19.159 -8.763 4.463 1.00 0.00 C ATOM 716 C SER A 48 17.942 -7.845 4.594 1.00 0.00 C ATOM 717 O SER A 48 16.810 -8.273 4.370 1.00 0.00 O ATOM 718 CB SER A 48 19.773 -8.633 3.068 1.00 0.00 C ATOM 719 OG SER A 48 21.111 -8.146 3.116 1.00 0.00 O ATOM 0 H SER A 48 18.481 -10.671 3.924 1.00 0.00 H new ATOM 0 HA SER A 48 19.912 -8.464 5.192 1.00 0.00 H new ATOM 0 HB2 SER A 48 19.759 -9.604 2.574 1.00 0.00 H new ATOM 0 HB3 SER A 48 19.164 -7.960 2.465 1.00 0.00 H new ATOM 0 HG SER A 48 21.468 -8.079 2.206 1.00 0.00 H new ATOM 725 N PRO A 49 18.222 -6.568 4.967 1.00 0.00 N ATOM 726 CA PRO A 49 17.164 -5.586 5.131 1.00 0.00 C ATOM 727 C PRO A 49 16.641 -5.112 3.773 1.00 0.00 C ATOM 728 O PRO A 49 17.423 -4.765 2.890 1.00 0.00 O ATOM 729 CB PRO A 49 17.787 -4.468 5.951 1.00 0.00 C ATOM 730 CG PRO A 49 19.291 -4.645 5.820 1.00 0.00 C ATOM 731 CD PRO A 49 19.550 -6.026 5.241 1.00 0.00 C ATOM 0 HA PRO A 49 16.288 -5.992 5.638 1.00 0.00 H new ATOM 0 HB2 PRO A 49 17.475 -3.491 5.581 1.00 0.00 H new ATOM 0 HB3 PRO A 49 17.476 -4.528 6.994 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.711 -3.875 5.173 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.773 -4.542 6.792 1.00 0.00 H new ATOM 0 HD2 PRO A 49 20.149 -5.968 4.332 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.097 -6.654 5.944 1.00 0.00 H new ATOM 739 N LEU A 50 15.322 -5.113 3.650 1.00 0.00 N ATOM 740 CA LEU A 50 14.685 -4.687 2.416 1.00 0.00 C ATOM 741 C LEU A 50 15.240 -3.321 2.005 1.00 0.00 C ATOM 742 O LEU A 50 15.681 -2.546 2.852 1.00 0.00 O ATOM 743 CB LEU A 50 13.162 -4.713 2.561 1.00 0.00 C ATOM 744 CG LEU A 50 12.580 -5.918 3.302 1.00 0.00 C ATOM 745 CD1 LEU A 50 13.389 -7.184 3.011 1.00 0.00 C ATOM 746 CD2 LEU A 50 12.470 -5.640 4.802 1.00 0.00 C ATOM 0 H LEU A 50 14.677 -5.402 4.385 1.00 0.00 H new ATOM 0 HA LEU A 50 14.917 -5.382 1.609 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.851 -3.807 3.081 1.00 0.00 H new ATOM 0 HB3 LEU A 50 12.721 -4.676 1.565 1.00 0.00 H new ATOM 0 HG LEU A 50 11.569 -6.090 2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 50 12.954 -8.026 3.550 1.00 0.00 H new ATOM 0 HD12 LEU A 50 13.370 -7.390 1.941 1.00 0.00 H new ATOM 0 HD13 LEU A 50 14.420 -7.040 3.335 1.00 0.00 H new ATOM 0 HD21 LEU A 50 12.053 -6.513 5.304 1.00 0.00 H new ATOM 0 HD22 LEU A 50 13.460 -5.427 5.206 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.818 -4.782 4.966 1.00 0.00 H new ATOM 758 N ILE A 51 15.200 -3.068 0.705 1.00 0.00 N ATOM 759 CA ILE A 51 15.694 -1.810 0.172 1.00 0.00 C ATOM 760 C ILE A 51 14.529 -0.828 0.033 1.00 0.00 C ATOM 761 O ILE A 51 14.590 0.290 0.543 1.00 0.00 O ATOM 762 CB ILE A 51 16.460 -2.044 -1.131 1.00 0.00 C ATOM 763 CG1 ILE A 51 17.872 -2.564 -0.851 1.00 0.00 C ATOM 764 CG2 ILE A 51 16.476 -0.780 -1.993 1.00 0.00 C ATOM 765 CD1 ILE A 51 18.562 -3.001 -2.145 1.00 0.00 C ATOM 0 H ILE A 51 14.833 -3.713 0.005 1.00 0.00 H new ATOM 0 HA ILE A 51 16.411 -1.360 0.859 1.00 0.00 H new ATOM 0 HB ILE A 51 15.939 -2.815 -1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 51 18.461 -1.785 -0.366 1.00 0.00 H new ATOM 0 HG13 ILE A 51 17.823 -3.405 -0.159 1.00 0.00 H new ATOM 0 HG21 ILE A 51 17.027 -0.974 -2.913 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.453 -0.493 -2.236 1.00 0.00 H new ATOM 0 HG23 ILE A 51 16.959 0.028 -1.444 1.00 0.00 H new ATOM 0 HD11 ILE A 51 19.564 -3.366 -1.918 1.00 0.00 H new ATOM 0 HD12 ILE A 51 17.984 -3.796 -2.615 1.00 0.00 H new ATOM 0 HD13 ILE A 51 18.631 -2.152 -2.825 1.00 0.00 H new ATOM 777 N ARG A 52 13.495 -1.281 -0.661 1.00 0.00 N ATOM 778 CA ARG A 52 12.318 -0.457 -0.874 1.00 0.00 C ATOM 779 C ARG A 52 11.091 -1.337 -1.121 1.00 0.00 C ATOM 780 O ARG A 52 11.186 -2.563 -1.091 1.00 0.00 O ATOM 781 CB ARG A 52 12.511 0.483 -2.066 1.00 0.00 C ATOM 782 CG ARG A 52 12.556 -0.301 -3.380 1.00 0.00 C ATOM 783 CD ARG A 52 12.682 0.644 -4.577 1.00 0.00 C ATOM 784 NE ARG A 52 14.107 0.819 -4.936 1.00 0.00 N ATOM 785 CZ ARG A 52 14.557 1.740 -5.799 1.00 0.00 C ATOM 786 NH1 ARG A 52 13.696 2.575 -6.396 1.00 0.00 N ATOM 787 NH2 ARG A 52 15.867 1.826 -6.064 1.00 0.00 N ATOM 0 H ARG A 52 13.448 -2.208 -1.083 1.00 0.00 H new ATOM 0 HA ARG A 52 12.166 0.141 0.025 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.697 1.207 -2.098 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.435 1.047 -1.943 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.399 -0.992 -3.367 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.652 -0.902 -3.480 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.131 0.242 -5.427 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.238 1.610 -4.337 1.00 0.00 H new ATOM 0 HE ARG A 52 14.790 0.200 -4.499 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.698 2.509 -6.193 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.038 3.276 -7.053 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.522 1.190 -5.609 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.209 2.527 -6.721 1.00 0.00 H new ATOM 801 N TYR A 53 9.967 -0.677 -1.360 1.00 0.00 N ATOM 802 CA TYR A 53 8.723 -1.384 -1.612 1.00 0.00 C ATOM 803 C TYR A 53 7.969 -0.764 -2.790 1.00 0.00 C ATOM 804 O TYR A 53 7.823 0.455 -2.866 1.00 0.00 O ATOM 805 CB TYR A 53 7.883 -1.224 -0.343 1.00 0.00 C ATOM 806 CG TYR A 53 8.204 -2.247 0.749 1.00 0.00 C ATOM 807 CD1 TYR A 53 9.438 -2.230 1.367 1.00 0.00 C ATOM 808 CD2 TYR A 53 7.261 -3.185 1.115 1.00 0.00 C ATOM 809 CE1 TYR A 53 9.740 -3.193 2.395 1.00 0.00 C ATOM 810 CE2 TYR A 53 7.563 -4.147 2.143 1.00 0.00 C ATOM 811 CZ TYR A 53 8.788 -4.104 2.732 1.00 0.00 C ATOM 812 OH TYR A 53 9.074 -5.012 3.703 1.00 0.00 O ATOM 0 H TYR A 53 9.892 0.340 -1.384 1.00 0.00 H new ATOM 0 HA TYR A 53 8.917 -2.428 -1.856 1.00 0.00 H new ATOM 0 HB2 TYR A 53 8.035 -0.221 0.057 1.00 0.00 H new ATOM 0 HB3 TYR A 53 6.828 -1.306 -0.605 1.00 0.00 H new ATOM 0 HD1 TYR A 53 10.176 -1.496 1.080 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.296 -3.198 0.630 1.00 0.00 H new ATOM 0 HE1 TYR A 53 10.701 -3.192 2.887 1.00 0.00 H new ATOM 0 HE2 TYR A 53 6.833 -4.886 2.440 1.00 0.00 H new ATOM 0 HH TYR A 53 8.815 -4.650 4.576 1.00 0.00 H new ATOM 822 N ILE A 54 7.510 -1.631 -3.680 1.00 0.00 N ATOM 823 CA ILE A 54 6.774 -1.184 -4.850 1.00 0.00 C ATOM 824 C ILE A 54 5.273 -1.293 -4.577 1.00 0.00 C ATOM 825 O ILE A 54 4.699 -2.377 -4.667 1.00 0.00 O ATOM 826 CB ILE A 54 7.230 -1.950 -6.094 1.00 0.00 C ATOM 827 CG1 ILE A 54 8.741 -1.821 -6.295 1.00 0.00 C ATOM 828 CG2 ILE A 54 6.447 -1.503 -7.331 1.00 0.00 C ATOM 829 CD1 ILE A 54 9.186 -2.525 -7.578 1.00 0.00 C ATOM 0 H ILE A 54 7.634 -2.641 -3.614 1.00 0.00 H new ATOM 0 HA ILE A 54 6.985 -0.134 -5.054 1.00 0.00 H new ATOM 0 HB ILE A 54 7.015 -3.008 -5.941 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.017 -0.767 -6.340 1.00 0.00 H new ATOM 0 HG13 ILE A 54 9.263 -2.251 -5.440 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.791 -2.063 -8.201 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.384 -1.689 -7.176 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.608 -0.438 -7.498 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.264 -2.418 -7.697 1.00 0.00 H new ATOM 0 HD12 ILE A 54 8.931 -3.583 -7.520 1.00 0.00 H new ATOM 0 HD13 ILE A 54 8.681 -2.076 -8.433 1.00 0.00 H new ATOM 841 N LEU A 55 4.680 -0.155 -4.248 1.00 0.00 N ATOM 842 CA LEU A 55 3.256 -0.109 -3.960 1.00 0.00 C ATOM 843 C LEU A 55 2.487 0.150 -5.257 1.00 0.00 C ATOM 844 O LEU A 55 2.671 1.184 -5.897 1.00 0.00 O ATOM 845 CB LEU A 55 2.965 0.912 -2.858 1.00 0.00 C ATOM 846 CG LEU A 55 1.492 1.264 -2.642 1.00 0.00 C ATOM 847 CD1 LEU A 55 0.892 0.435 -1.504 1.00 0.00 C ATOM 848 CD2 LEU A 55 1.314 2.766 -2.413 1.00 0.00 C ATOM 0 H LEU A 55 5.159 0.742 -4.174 1.00 0.00 H new ATOM 0 HA LEU A 55 2.914 -1.068 -3.572 1.00 0.00 H new ATOM 0 HB2 LEU A 55 3.368 0.530 -1.920 1.00 0.00 H new ATOM 0 HB3 LEU A 55 3.507 1.829 -3.087 1.00 0.00 H new ATOM 0 HG LEU A 55 0.944 1.011 -3.549 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.156 0.704 -1.371 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.966 -0.625 -1.748 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.438 0.634 -0.582 1.00 0.00 H new ATOM 0 HD21 LEU A 55 0.258 2.988 -2.262 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.878 3.069 -1.531 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.679 3.312 -3.283 1.00 0.00 H new ATOM 860 N GLU A 56 1.640 -0.808 -5.606 1.00 0.00 N ATOM 861 CA GLU A 56 0.842 -0.697 -6.815 1.00 0.00 C ATOM 862 C GLU A 56 -0.634 -0.499 -6.461 1.00 0.00 C ATOM 863 O GLU A 56 -1.215 -1.307 -5.738 1.00 0.00 O ATOM 864 CB GLU A 56 1.031 -1.922 -7.712 1.00 0.00 C ATOM 865 CG GLU A 56 2.176 -1.704 -8.703 1.00 0.00 C ATOM 866 CD GLU A 56 2.284 -2.876 -9.682 1.00 0.00 C ATOM 867 OE1 GLU A 56 2.871 -3.902 -9.276 1.00 0.00 O ATOM 868 OE2 GLU A 56 1.777 -2.718 -10.813 1.00 0.00 O ATOM 0 H GLU A 56 1.489 -1.664 -5.073 1.00 0.00 H new ATOM 0 HA GLU A 56 1.182 0.176 -7.372 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.239 -2.798 -7.098 1.00 0.00 H new ATOM 0 HB3 GLU A 56 0.108 -2.125 -8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.013 -0.778 -9.255 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.115 -1.591 -8.161 1.00 0.00 H new ATOM 875 N MET A 57 -1.196 0.579 -6.986 1.00 0.00 N ATOM 876 CA MET A 57 -2.593 0.892 -6.734 1.00 0.00 C ATOM 877 C MET A 57 -3.468 0.487 -7.922 1.00 0.00 C ATOM 878 O MET A 57 -3.108 0.726 -9.073 1.00 0.00 O ATOM 879 CB MET A 57 -2.741 2.394 -6.479 1.00 0.00 C ATOM 880 CG MET A 57 -4.202 2.763 -6.214 1.00 0.00 C ATOM 881 SD MET A 57 -4.388 4.538 -6.187 1.00 0.00 S ATOM 882 CE MET A 57 -4.224 4.893 -7.929 1.00 0.00 C ATOM 0 H MET A 57 -0.710 1.247 -7.585 1.00 0.00 H new ATOM 0 HA MET A 57 -2.920 0.332 -5.858 1.00 0.00 H new ATOM 0 HB2 MET A 57 -2.128 2.684 -5.625 1.00 0.00 H new ATOM 0 HB3 MET A 57 -2.372 2.951 -7.340 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.840 2.334 -6.987 1.00 0.00 H new ATOM 0 HG3 MET A 57 -4.526 2.341 -5.263 1.00 0.00 H new ATOM 0 HE1 MET A 57 -4.386 5.957 -8.100 1.00 0.00 H new ATOM 0 HE2 MET A 57 -3.223 4.620 -8.263 1.00 0.00 H new ATOM 0 HE3 MET A 57 -4.962 4.319 -8.488 1.00 0.00 H new ATOM 892 N SER A 58 -4.602 -0.119 -7.600 1.00 0.00 N ATOM 893 CA SER A 58 -5.532 -0.559 -8.626 1.00 0.00 C ATOM 894 C SER A 58 -6.917 0.038 -8.368 1.00 0.00 C ATOM 895 O SER A 58 -7.659 -0.451 -7.518 1.00 0.00 O ATOM 896 CB SER A 58 -5.613 -2.086 -8.677 1.00 0.00 C ATOM 897 OG SER A 58 -6.872 -2.538 -9.169 1.00 0.00 O ATOM 0 H SER A 58 -4.897 -0.315 -6.644 1.00 0.00 H new ATOM 0 HA SER A 58 -5.167 -0.209 -9.592 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.816 -2.470 -9.314 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.447 -2.491 -7.679 1.00 0.00 H new ATOM 0 HG SER A 58 -7.006 -2.204 -10.081 1.00 0.00 H new ATOM 903 N GLU A 59 -7.223 1.086 -9.118 1.00 0.00 N ATOM 904 CA GLU A 59 -8.506 1.755 -8.981 1.00 0.00 C ATOM 905 C GLU A 59 -9.646 0.793 -9.324 1.00 0.00 C ATOM 906 O GLU A 59 -9.543 -0.408 -9.081 1.00 0.00 O ATOM 907 CB GLU A 59 -8.566 3.010 -9.855 1.00 0.00 C ATOM 908 CG GLU A 59 -9.466 4.074 -9.224 1.00 0.00 C ATOM 909 CD GLU A 59 -9.996 5.043 -10.284 1.00 0.00 C ATOM 910 OE1 GLU A 59 -10.449 4.541 -11.335 1.00 0.00 O ATOM 911 OE2 GLU A 59 -9.936 6.263 -10.018 1.00 0.00 O ATOM 0 H GLU A 59 -6.605 1.489 -9.823 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.621 2.069 -7.943 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.562 3.412 -9.991 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.942 2.751 -10.845 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.302 3.593 -8.715 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.908 4.626 -8.468 1.00 0.00 H new ATOM 918 N ASN A 60 -10.706 1.358 -9.883 1.00 0.00 N ATOM 919 CA ASN A 60 -11.863 0.565 -10.262 1.00 0.00 C ATOM 920 C ASN A 60 -11.512 -0.294 -11.479 1.00 0.00 C ATOM 921 O ASN A 60 -11.578 0.175 -12.614 1.00 0.00 O ATOM 922 CB ASN A 60 -13.044 1.461 -10.641 1.00 0.00 C ATOM 923 CG ASN A 60 -13.932 1.741 -9.426 1.00 0.00 C ATOM 924 OD1 ASN A 60 -14.366 0.844 -8.723 1.00 0.00 O ATOM 925 ND2 ASN A 60 -14.176 3.032 -9.221 1.00 0.00 N ATOM 0 H ASN A 60 -10.788 2.355 -10.083 1.00 0.00 H new ATOM 0 HA ASN A 60 -12.140 -0.056 -9.410 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -12.675 2.401 -11.051 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -13.632 0.982 -11.423 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -14.759 3.323 -8.436 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -13.781 3.732 -9.849 1.00 0.00 H new ATOM 932 N ASN A 61 -11.146 -1.536 -11.200 1.00 0.00 N ATOM 933 CA ASN A 61 -10.784 -2.465 -12.258 1.00 0.00 C ATOM 934 C ASN A 61 -9.521 -1.963 -12.961 1.00 0.00 C ATOM 935 O ASN A 61 -9.157 -2.465 -14.023 1.00 0.00 O ATOM 936 CB ASN A 61 -11.897 -2.570 -13.303 1.00 0.00 C ATOM 937 CG ASN A 61 -12.384 -4.013 -13.442 1.00 0.00 C ATOM 938 OD1 ASN A 61 -11.970 -4.907 -12.722 1.00 0.00 O ATOM 939 ND2 ASN A 61 -13.283 -4.190 -14.406 1.00 0.00 N ATOM 0 H ASN A 61 -11.092 -1.921 -10.257 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.620 -3.443 -11.807 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.730 -1.927 -13.018 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.532 -2.211 -14.265 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -13.669 -5.118 -14.579 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.586 -3.398 -14.972 1.00 0.00 H new ATOM 946 N ALA A 62 -8.887 -0.980 -12.339 1.00 0.00 N ATOM 947 CA ALA A 62 -7.672 -0.405 -12.891 1.00 0.00 C ATOM 948 C ALA A 62 -6.515 -1.388 -12.699 1.00 0.00 C ATOM 949 O ALA A 62 -6.475 -2.119 -11.711 1.00 0.00 O ATOM 950 CB ALA A 62 -7.403 0.949 -12.233 1.00 0.00 C ATOM 0 H ALA A 62 -9.192 -0.567 -11.458 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.782 -0.230 -13.961 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.492 1.380 -12.647 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.241 1.619 -12.424 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -7.284 0.814 -11.158 1.00 0.00 H new ATOM 956 N PRO A 63 -5.578 -1.372 -13.685 1.00 0.00 N ATOM 957 CA PRO A 63 -4.424 -2.253 -13.633 1.00 0.00 C ATOM 958 C PRO A 63 -3.402 -1.758 -12.607 1.00 0.00 C ATOM 959 O PRO A 63 -3.254 -0.554 -12.404 1.00 0.00 O ATOM 960 CB PRO A 63 -3.879 -2.270 -15.052 1.00 0.00 C ATOM 961 CG PRO A 63 -4.462 -1.045 -15.738 1.00 0.00 C ATOM 962 CD PRO A 63 -5.593 -0.520 -14.870 1.00 0.00 C ATOM 0 HA PRO A 63 -4.678 -3.261 -13.305 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.790 -2.236 -15.052 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -4.170 -3.183 -15.571 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -3.696 -0.281 -15.871 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -4.831 -1.303 -16.731 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.437 0.526 -14.607 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.550 -0.580 -15.388 1.00 0.00 H new ATOM 970 N TRP A 64 -2.724 -2.713 -11.987 1.00 0.00 N ATOM 971 CA TRP A 64 -1.721 -2.389 -10.987 1.00 0.00 C ATOM 972 C TRP A 64 -0.801 -1.315 -11.570 1.00 0.00 C ATOM 973 O TRP A 64 -0.050 -1.578 -12.508 1.00 0.00 O ATOM 974 CB TRP A 64 -0.967 -3.644 -10.541 1.00 0.00 C ATOM 975 CG TRP A 64 -1.871 -4.757 -10.008 1.00 0.00 C ATOM 976 CD1 TRP A 64 -2.063 -5.980 -10.520 1.00 0.00 C ATOM 977 CD2 TRP A 64 -2.704 -4.698 -8.831 1.00 0.00 C ATOM 978 NE1 TRP A 64 -2.955 -6.711 -9.762 1.00 0.00 N ATOM 979 CE2 TRP A 64 -3.357 -5.907 -8.702 1.00 0.00 C ATOM 980 CE3 TRP A 64 -2.900 -3.658 -7.905 1.00 0.00 C ATOM 981 CZ2 TRP A 64 -4.249 -6.189 -7.660 1.00 0.00 C ATOM 982 CZ3 TRP A 64 -3.794 -3.956 -6.870 1.00 0.00 C ATOM 983 CH2 TRP A 64 -4.459 -5.168 -6.727 1.00 0.00 C ATOM 0 H TRP A 64 -2.850 -3.711 -12.158 1.00 0.00 H new ATOM 0 HA TRP A 64 -2.189 -1.994 -10.085 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -0.393 -4.029 -11.384 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -0.251 -3.369 -9.766 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -1.580 -6.348 -11.414 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -3.263 -7.666 -9.946 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.400 -2.704 -7.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -4.748 -7.144 -7.581 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.980 -3.191 -6.131 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -5.135 -5.321 -5.899 1.00 0.00 H new ATOM 994 N THR A 65 -0.890 -0.127 -10.991 1.00 0.00 N ATOM 995 CA THR A 65 -0.075 0.989 -11.441 1.00 0.00 C ATOM 996 C THR A 65 0.946 1.371 -10.368 1.00 0.00 C ATOM 997 O THR A 65 0.574 1.812 -9.281 1.00 0.00 O ATOM 998 CB THR A 65 -1.013 2.136 -11.823 1.00 0.00 C ATOM 999 OG1 THR A 65 -0.287 2.865 -12.809 1.00 0.00 O ATOM 1000 CG2 THR A 65 -1.206 3.139 -10.684 1.00 0.00 C ATOM 0 H THR A 65 -1.514 0.088 -10.214 1.00 0.00 H new ATOM 0 HA THR A 65 0.510 0.722 -12.321 1.00 0.00 H new ATOM 0 HB THR A 65 -1.981 1.730 -12.117 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.823 3.627 -13.114 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.880 3.932 -11.008 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.633 2.630 -9.820 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.243 3.570 -10.412 1.00 0.00 H new ATOM 1008 N VAL A 66 2.213 1.188 -10.710 1.00 0.00 N ATOM 1009 CA VAL A 66 3.290 1.508 -9.790 1.00 0.00 C ATOM 1010 C VAL A 66 3.183 2.977 -9.377 1.00 0.00 C ATOM 1011 O VAL A 66 3.579 3.868 -10.127 1.00 0.00 O ATOM 1012 CB VAL A 66 4.640 1.162 -10.423 1.00 0.00 C ATOM 1013 CG1 VAL A 66 5.796 1.578 -9.511 1.00 0.00 C ATOM 1014 CG2 VAL A 66 4.719 -0.327 -10.764 1.00 0.00 C ATOM 0 H VAL A 66 2.517 0.822 -11.612 1.00 0.00 H new ATOM 0 HA VAL A 66 3.208 0.908 -8.883 1.00 0.00 H new ATOM 0 HB VAL A 66 4.728 1.724 -11.353 1.00 0.00 H new ATOM 0 HG11 VAL A 66 6.744 1.321 -9.984 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.756 2.654 -9.340 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.713 1.056 -8.558 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.688 -0.547 -11.212 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.598 -0.915 -9.854 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.927 -0.581 -11.468 1.00 0.00 H new ATOM 1024 N LEU A 67 2.645 3.186 -8.184 1.00 0.00 N ATOM 1025 CA LEU A 67 2.481 4.532 -7.662 1.00 0.00 C ATOM 1026 C LEU A 67 3.777 4.972 -6.979 1.00 0.00 C ATOM 1027 O LEU A 67 4.407 5.941 -7.400 1.00 0.00 O ATOM 1028 CB LEU A 67 1.251 4.609 -6.755 1.00 0.00 C ATOM 1029 CG LEU A 67 -0.048 5.063 -7.423 1.00 0.00 C ATOM 1030 CD1 LEU A 67 -1.132 5.344 -6.380 1.00 0.00 C ATOM 1031 CD2 LEU A 67 0.196 6.266 -8.336 1.00 0.00 C ATOM 0 H LEU A 67 2.317 2.445 -7.564 1.00 0.00 H new ATOM 0 HA LEU A 67 2.294 5.235 -8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.086 3.625 -6.316 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.472 5.291 -5.934 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.411 4.250 -8.052 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.045 5.665 -6.882 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.331 4.437 -5.809 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.793 6.130 -5.706 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.744 6.568 -8.798 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.594 7.093 -7.749 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.911 5.994 -9.112 1.00 0.00 H new ATOM 1043 N LEU A 68 4.137 4.238 -5.936 1.00 0.00 N ATOM 1044 CA LEU A 68 5.347 4.540 -5.191 1.00 0.00 C ATOM 1045 C LEU A 68 6.402 3.470 -5.484 1.00 0.00 C ATOM 1046 O LEU A 68 6.262 2.323 -5.063 1.00 0.00 O ATOM 1047 CB LEU A 68 5.033 4.701 -3.702 1.00 0.00 C ATOM 1048 CG LEU A 68 5.321 6.079 -3.102 1.00 0.00 C ATOM 1049 CD1 LEU A 68 4.673 6.223 -1.724 1.00 0.00 C ATOM 1050 CD2 LEU A 68 6.825 6.356 -3.060 1.00 0.00 C ATOM 0 H LEU A 68 3.612 3.435 -5.590 1.00 0.00 H new ATOM 0 HA LEU A 68 5.763 5.495 -5.511 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.979 4.472 -3.546 1.00 0.00 H new ATOM 0 HB3 LEU A 68 5.606 3.958 -3.147 1.00 0.00 H new ATOM 0 HG LEU A 68 4.873 6.833 -3.749 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.893 7.211 -1.320 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.594 6.100 -1.815 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.070 5.460 -1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 68 7.002 7.342 -2.629 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.317 5.599 -2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.229 6.325 -4.072 1.00 0.00 H new ATOM 1062 N ALA A 69 7.435 3.885 -6.204 1.00 0.00 N ATOM 1063 CA ALA A 69 8.512 2.977 -6.558 1.00 0.00 C ATOM 1064 C ALA A 69 9.594 3.030 -5.477 1.00 0.00 C ATOM 1065 O ALA A 69 10.286 2.042 -5.237 1.00 0.00 O ATOM 1066 CB ALA A 69 9.053 3.342 -7.942 1.00 0.00 C ATOM 0 H ALA A 69 7.548 4.837 -6.551 1.00 0.00 H new ATOM 0 HA ALA A 69 8.148 1.951 -6.610 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.861 2.661 -8.208 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.253 3.261 -8.678 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.430 4.364 -7.927 1.00 0.00 H new ATOM 1072 N SER A 70 9.706 4.194 -4.854 1.00 0.00 N ATOM 1073 CA SER A 70 10.692 4.388 -3.804 1.00 0.00 C ATOM 1074 C SER A 70 9.992 4.562 -2.455 1.00 0.00 C ATOM 1075 O SER A 70 9.494 5.643 -2.144 1.00 0.00 O ATOM 1076 CB SER A 70 11.581 5.598 -4.100 1.00 0.00 C ATOM 1077 OG SER A 70 11.872 6.348 -2.924 1.00 0.00 O ATOM 0 H SER A 70 9.131 5.012 -5.056 1.00 0.00 H new ATOM 0 HA SER A 70 11.329 3.504 -3.765 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.513 5.261 -4.554 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.086 6.242 -4.827 1.00 0.00 H new ATOM 0 HG SER A 70 11.037 6.568 -2.461 1.00 0.00 H new ATOM 1083 N VAL A 71 9.976 3.481 -1.689 1.00 0.00 N ATOM 1084 CA VAL A 71 9.345 3.500 -0.380 1.00 0.00 C ATOM 1085 C VAL A 71 10.349 3.025 0.672 1.00 0.00 C ATOM 1086 O VAL A 71 11.261 2.259 0.364 1.00 0.00 O ATOM 1087 CB VAL A 71 8.064 2.664 -0.404 1.00 0.00 C ATOM 1088 CG1 VAL A 71 7.611 2.314 1.015 1.00 0.00 C ATOM 1089 CG2 VAL A 71 6.954 3.385 -1.172 1.00 0.00 C ATOM 0 H VAL A 71 10.390 2.586 -1.950 1.00 0.00 H new ATOM 0 HA VAL A 71 9.050 4.515 -0.113 1.00 0.00 H new ATOM 0 HB VAL A 71 8.282 1.732 -0.925 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.698 1.720 0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.392 1.742 1.516 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.419 3.231 1.572 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.054 2.770 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.740 4.339 -0.691 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.276 3.560 -2.198 1.00 0.00 H new ATOM 1099 N ASP A 72 10.148 3.499 1.893 1.00 0.00 N ATOM 1100 CA ASP A 72 11.024 3.132 2.992 1.00 0.00 C ATOM 1101 C ASP A 72 10.810 1.657 3.339 1.00 0.00 C ATOM 1102 O ASP A 72 9.674 1.192 3.415 1.00 0.00 O ATOM 1103 CB ASP A 72 10.718 3.960 4.241 1.00 0.00 C ATOM 1104 CG ASP A 72 11.803 4.966 4.633 1.00 0.00 C ATOM 1105 OD1 ASP A 72 12.591 5.329 3.733 1.00 0.00 O ATOM 1106 OD2 ASP A 72 11.819 5.349 5.822 1.00 0.00 O ATOM 0 H ASP A 72 9.391 4.134 2.145 1.00 0.00 H new ATOM 0 HA ASP A 72 12.052 3.317 2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 72 9.784 4.499 4.081 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.554 3.281 5.078 1.00 0.00 H new ATOM 1111 N PRO A 73 11.949 0.944 3.546 1.00 0.00 N ATOM 1112 CA PRO A 73 11.897 -0.469 3.883 1.00 0.00 C ATOM 1113 C PRO A 73 11.466 -0.670 5.337 1.00 0.00 C ATOM 1114 O PRO A 73 10.847 -1.679 5.671 1.00 0.00 O ATOM 1115 CB PRO A 73 13.296 -0.993 3.599 1.00 0.00 C ATOM 1116 CG PRO A 73 14.198 0.229 3.559 1.00 0.00 C ATOM 1117 CD PRO A 73 13.312 1.461 3.464 1.00 0.00 C ATOM 0 HA PRO A 73 11.156 -1.014 3.298 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.617 -1.690 4.373 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.326 -1.532 2.652 1.00 0.00 H new ATOM 0 HG2 PRO A 73 14.819 0.274 4.453 1.00 0.00 H new ATOM 0 HG3 PRO A 73 14.873 0.177 2.704 1.00 0.00 H new ATOM 0 HD2 PRO A 73 13.519 2.161 4.273 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.477 1.996 2.529 1.00 0.00 H new ATOM 1125 N LYS A 74 11.811 0.306 6.163 1.00 0.00 N ATOM 1126 CA LYS A 74 11.468 0.249 7.574 1.00 0.00 C ATOM 1127 C LYS A 74 10.086 0.870 7.784 1.00 0.00 C ATOM 1128 O LYS A 74 9.676 1.114 8.918 1.00 0.00 O ATOM 1129 CB LYS A 74 12.567 0.896 8.419 1.00 0.00 C ATOM 1130 CG LYS A 74 13.590 -0.145 8.878 1.00 0.00 C ATOM 1131 CD LYS A 74 15.004 0.441 8.883 1.00 0.00 C ATOM 1132 CE LYS A 74 15.132 1.555 9.923 1.00 0.00 C ATOM 1133 NZ LYS A 74 15.817 1.056 11.136 1.00 0.00 N ATOM 0 H LYS A 74 12.325 1.141 5.882 1.00 0.00 H new ATOM 0 HA LYS A 74 11.407 -0.786 7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 74 13.067 1.672 7.839 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.124 1.383 9.288 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.334 -0.495 9.878 1.00 0.00 H new ATOM 0 HG3 LYS A 74 13.554 -1.011 8.218 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.727 -0.346 9.097 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.243 0.833 7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 74 15.689 2.392 9.502 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.143 1.931 10.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.895 1.825 11.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.270 0.273 11.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.768 0.719 10.884 1.00 0.00 H new ATOM 1147 N ALA A 75 9.404 1.107 6.673 1.00 0.00 N ATOM 1148 CA ALA A 75 8.076 1.694 6.720 1.00 0.00 C ATOM 1149 C ALA A 75 7.032 0.605 6.464 1.00 0.00 C ATOM 1150 O ALA A 75 7.200 -0.222 5.569 1.00 0.00 O ATOM 1151 CB ALA A 75 7.986 2.838 5.708 1.00 0.00 C ATOM 0 H ALA A 75 9.747 0.903 5.734 1.00 0.00 H new ATOM 0 HA ALA A 75 7.878 2.115 7.706 1.00 0.00 H new ATOM 0 HB1 ALA A 75 6.989 3.278 5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 75 8.727 3.599 5.952 1.00 0.00 H new ATOM 0 HB3 ALA A 75 8.177 2.453 4.706 1.00 0.00 H new ATOM 1157 N THR A 76 5.977 0.641 7.265 1.00 0.00 N ATOM 1158 CA THR A 76 4.906 -0.332 7.136 1.00 0.00 C ATOM 1159 C THR A 76 3.579 0.371 6.844 1.00 0.00 C ATOM 1160 O THR A 76 2.543 -0.280 6.714 1.00 0.00 O ATOM 1161 CB THR A 76 4.879 -1.178 8.410 1.00 0.00 C ATOM 1162 OG1 THR A 76 4.599 -0.238 9.444 1.00 0.00 O ATOM 1163 CG2 THR A 76 6.258 -1.732 8.775 1.00 0.00 C ATOM 0 H THR A 76 5.841 1.329 8.006 1.00 0.00 H new ATOM 0 HA THR A 76 5.077 -0.998 6.291 1.00 0.00 H new ATOM 0 HB THR A 76 4.178 -2.003 8.283 1.00 0.00 H new ATOM 0 HG1 THR A 76 4.562 -0.702 10.306 1.00 0.00 H new ATOM 0 HG21 THR A 76 6.182 -2.325 9.687 1.00 0.00 H new ATOM 0 HG22 THR A 76 6.624 -2.360 7.963 1.00 0.00 H new ATOM 0 HG23 THR A 76 6.951 -0.906 8.936 1.00 0.00 H new ATOM 1171 N SER A 77 3.653 1.690 6.751 1.00 0.00 N ATOM 1172 CA SER A 77 2.470 2.489 6.478 1.00 0.00 C ATOM 1173 C SER A 77 2.814 3.618 5.505 1.00 0.00 C ATOM 1174 O SER A 77 3.953 4.081 5.463 1.00 0.00 O ATOM 1175 CB SER A 77 1.881 3.061 7.769 1.00 0.00 C ATOM 1176 OG SER A 77 2.879 3.659 8.591 1.00 0.00 O ATOM 0 H SER A 77 4.514 2.226 6.860 1.00 0.00 H new ATOM 0 HA SER A 77 1.719 1.843 6.024 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.121 3.803 7.523 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.383 2.266 8.324 1.00 0.00 H new ATOM 0 HG SER A 77 2.463 4.014 9.404 1.00 0.00 H new ATOM 1182 N VAL A 78 1.809 4.030 4.746 1.00 0.00 N ATOM 1183 CA VAL A 78 1.991 5.097 3.777 1.00 0.00 C ATOM 1184 C VAL A 78 0.649 5.789 3.528 1.00 0.00 C ATOM 1185 O VAL A 78 -0.407 5.187 3.715 1.00 0.00 O ATOM 1186 CB VAL A 78 2.623 4.541 2.499 1.00 0.00 C ATOM 1187 CG1 VAL A 78 1.610 3.722 1.698 1.00 0.00 C ATOM 1188 CG2 VAL A 78 3.217 5.664 1.647 1.00 0.00 C ATOM 0 H VAL A 78 0.866 3.644 4.783 1.00 0.00 H new ATOM 0 HA VAL A 78 2.678 5.850 4.163 1.00 0.00 H new ATOM 0 HB VAL A 78 3.436 3.876 2.790 1.00 0.00 H new ATOM 0 HG11 VAL A 78 2.085 3.339 0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.256 2.888 2.304 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.766 4.355 1.423 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.660 5.241 0.745 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.430 6.366 1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 78 3.985 6.186 2.218 1.00 0.00 H new ATOM 1198 N THR A 79 0.735 7.043 3.109 1.00 0.00 N ATOM 1199 CA THR A 79 -0.459 7.823 2.833 1.00 0.00 C ATOM 1200 C THR A 79 -0.527 8.186 1.348 1.00 0.00 C ATOM 1201 O THR A 79 0.214 9.050 0.882 1.00 0.00 O ATOM 1202 CB THR A 79 -0.452 9.042 3.757 1.00 0.00 C ATOM 1203 OG1 THR A 79 -0.838 8.518 5.025 1.00 0.00 O ATOM 1204 CG2 THR A 79 -1.558 10.042 3.415 1.00 0.00 C ATOM 0 H THR A 79 1.613 7.538 2.954 1.00 0.00 H new ATOM 0 HA THR A 79 -1.363 7.249 3.037 1.00 0.00 H new ATOM 0 HB THR A 79 0.517 9.538 3.697 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.858 9.242 5.686 1.00 0.00 H new ATOM 0 HG21 THR A 79 -1.508 10.888 4.101 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.426 10.395 2.392 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.529 9.556 3.508 1.00 0.00 H new ATOM 1212 N VAL A 80 -1.423 7.508 0.646 1.00 0.00 N ATOM 1213 CA VAL A 80 -1.597 7.748 -0.777 1.00 0.00 C ATOM 1214 C VAL A 80 -2.313 9.085 -0.979 1.00 0.00 C ATOM 1215 O VAL A 80 -3.105 9.503 -0.136 1.00 0.00 O ATOM 1216 CB VAL A 80 -2.334 6.572 -1.420 1.00 0.00 C ATOM 1217 CG1 VAL A 80 -2.626 6.849 -2.896 1.00 0.00 C ATOM 1218 CG2 VAL A 80 -1.544 5.272 -1.252 1.00 0.00 C ATOM 0 H VAL A 80 -2.036 6.792 1.036 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.630 7.818 -1.274 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.288 6.453 -0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.150 5.997 -3.329 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.247 7.740 -2.983 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.688 7.007 -3.429 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.090 4.452 -1.718 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.569 5.375 -1.727 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.410 5.062 -0.191 1.00 0.00 H new ATOM 1228 N LYS A 81 -2.008 9.718 -2.103 1.00 0.00 N ATOM 1229 CA LYS A 81 -2.613 10.999 -2.427 1.00 0.00 C ATOM 1230 C LYS A 81 -3.042 10.999 -3.895 1.00 0.00 C ATOM 1231 O LYS A 81 -2.874 10.001 -4.595 1.00 0.00 O ATOM 1232 CB LYS A 81 -1.667 12.146 -2.063 1.00 0.00 C ATOM 1233 CG LYS A 81 -1.331 12.127 -0.571 1.00 0.00 C ATOM 1234 CD LYS A 81 0.071 12.684 -0.317 1.00 0.00 C ATOM 1235 CE LYS A 81 0.383 12.722 1.180 1.00 0.00 C ATOM 1236 NZ LYS A 81 0.091 14.061 1.737 1.00 0.00 N ATOM 0 H LYS A 81 -1.351 9.368 -2.800 1.00 0.00 H new ATOM 0 HA LYS A 81 -3.512 11.157 -1.832 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -0.750 12.065 -2.647 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -2.128 13.099 -2.324 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -2.065 12.716 -0.022 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -1.395 11.106 -0.193 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.809 12.068 -0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 81 0.148 13.688 -0.734 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -0.209 11.969 1.700 1.00 0.00 H new ATOM 0 HE3 LYS A 81 1.431 12.474 1.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.123 13.976 2.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 0.918 14.679 1.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -0.728 14.471 1.244 1.00 0.00 H new ATOM 1250 N GLY A 82 -3.588 12.129 -4.320 1.00 0.00 N ATOM 1251 CA GLY A 82 -4.043 12.271 -5.693 1.00 0.00 C ATOM 1252 C GLY A 82 -4.997 11.137 -6.074 1.00 0.00 C ATOM 1253 O GLY A 82 -4.722 10.376 -7.000 1.00 0.00 O ATOM 0 H GLY A 82 -3.726 12.955 -3.738 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.545 13.231 -5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.186 12.271 -6.366 1.00 0.00 H new ATOM 1257 N LEU A 83 -6.098 11.062 -5.342 1.00 0.00 N ATOM 1258 CA LEU A 83 -7.094 10.034 -5.592 1.00 0.00 C ATOM 1259 C LEU A 83 -8.392 10.692 -6.066 1.00 0.00 C ATOM 1260 O LEU A 83 -8.519 11.915 -6.033 1.00 0.00 O ATOM 1261 CB LEU A 83 -7.270 9.146 -4.358 1.00 0.00 C ATOM 1262 CG LEU A 83 -6.029 8.372 -3.907 1.00 0.00 C ATOM 1263 CD1 LEU A 83 -6.334 7.519 -2.674 1.00 0.00 C ATOM 1264 CD2 LEU A 83 -5.456 7.538 -5.054 1.00 0.00 C ATOM 0 H LEU A 83 -6.323 11.696 -4.575 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.763 9.369 -6.390 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.605 9.771 -3.530 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.067 8.430 -4.560 1.00 0.00 H new ATOM 0 HG LEU A 83 -5.263 9.092 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.436 6.979 -2.374 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.660 8.163 -1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.124 6.806 -2.911 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.575 6.998 -4.707 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.207 6.826 -5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.177 8.195 -5.878 1.00 0.00 H new ATOM 1276 N VAL A 84 -9.322 9.852 -6.494 1.00 0.00 N ATOM 1277 CA VAL A 84 -10.605 10.337 -6.973 1.00 0.00 C ATOM 1278 C VAL A 84 -11.688 10.000 -5.946 1.00 0.00 C ATOM 1279 O VAL A 84 -11.651 8.941 -5.323 1.00 0.00 O ATOM 1280 CB VAL A 84 -10.897 9.761 -8.360 1.00 0.00 C ATOM 1281 CG1 VAL A 84 -12.316 10.111 -8.812 1.00 0.00 C ATOM 1282 CG2 VAL A 84 -9.863 10.239 -9.381 1.00 0.00 C ATOM 0 H VAL A 84 -9.213 8.838 -6.519 1.00 0.00 H new ATOM 0 HA VAL A 84 -10.587 11.421 -7.083 1.00 0.00 H new ATOM 0 HB VAL A 84 -10.825 8.675 -8.293 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.497 9.690 -9.801 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -13.035 9.699 -8.104 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -12.428 11.194 -8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.094 9.815 -10.358 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.888 11.327 -9.442 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -8.869 9.916 -9.071 1.00 0.00 H new ATOM 1292 N PRO A 85 -12.654 10.947 -5.798 1.00 0.00 N ATOM 1293 CA PRO A 85 -13.746 10.762 -4.858 1.00 0.00 C ATOM 1294 C PRO A 85 -14.766 9.756 -5.394 1.00 0.00 C ATOM 1295 O PRO A 85 -14.905 9.592 -6.605 1.00 0.00 O ATOM 1296 CB PRO A 85 -14.330 12.150 -4.656 1.00 0.00 C ATOM 1297 CG PRO A 85 -13.850 12.981 -5.835 1.00 0.00 C ATOM 1298 CD PRO A 85 -12.731 12.214 -6.520 1.00 0.00 C ATOM 0 HA PRO A 85 -13.417 10.341 -3.908 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -15.419 12.114 -4.621 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.995 12.581 -3.713 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.669 13.165 -6.531 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -13.494 13.954 -5.497 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -12.949 12.055 -7.576 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -11.788 12.758 -6.467 1.00 0.00 H new ATOM 1306 N ALA A 86 -15.454 9.108 -4.465 1.00 0.00 N ATOM 1307 CA ALA A 86 -16.458 8.122 -4.829 1.00 0.00 C ATOM 1308 C ALA A 86 -15.865 7.150 -5.851 1.00 0.00 C ATOM 1309 O ALA A 86 -16.383 7.015 -6.958 1.00 0.00 O ATOM 1310 CB ALA A 86 -17.705 8.834 -5.357 1.00 0.00 C ATOM 0 H ALA A 86 -15.336 9.246 -3.461 1.00 0.00 H new ATOM 0 HA ALA A 86 -16.759 7.541 -3.957 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -18.458 8.095 -5.630 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -18.104 9.490 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -17.442 9.425 -6.234 1.00 0.00 H new ATOM 1316 N ARG A 87 -14.787 6.497 -5.442 1.00 0.00 N ATOM 1317 CA ARG A 87 -14.118 5.541 -6.308 1.00 0.00 C ATOM 1318 C ARG A 87 -13.379 4.494 -5.472 1.00 0.00 C ATOM 1319 O ARG A 87 -12.831 4.810 -4.418 1.00 0.00 O ATOM 1320 CB ARG A 87 -13.120 6.241 -7.234 1.00 0.00 C ATOM 1321 CG ARG A 87 -13.821 6.798 -8.474 1.00 0.00 C ATOM 1322 CD ARG A 87 -12.857 6.876 -9.660 1.00 0.00 C ATOM 1323 NE ARG A 87 -13.498 7.588 -10.788 1.00 0.00 N ATOM 1324 CZ ARG A 87 -12.838 8.041 -11.863 1.00 0.00 C ATOM 1325 NH1 ARG A 87 -11.515 7.859 -11.963 1.00 0.00 N ATOM 1326 NH2 ARG A 87 -13.503 8.676 -12.838 1.00 0.00 N ATOM 0 H ARG A 87 -14.360 6.611 -4.523 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.881 5.054 -6.916 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.626 7.050 -6.697 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.343 5.538 -7.536 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -14.670 6.165 -8.732 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -14.218 7.790 -8.257 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -11.945 7.394 -9.364 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -12.568 5.872 -9.970 1.00 0.00 H new ATOM 0 HE ARG A 87 -14.505 7.744 -10.745 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -11.009 7.375 -11.221 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -11.013 8.204 -12.781 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -14.511 8.814 -12.762 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -13.001 9.021 -13.656 1.00 0.00 H new ATOM 1340 N SER A 88 -13.390 3.268 -5.975 1.00 0.00 N ATOM 1341 CA SER A 88 -12.728 2.172 -5.288 1.00 0.00 C ATOM 1342 C SER A 88 -11.224 2.213 -5.564 1.00 0.00 C ATOM 1343 O SER A 88 -10.793 2.707 -6.605 1.00 0.00 O ATOM 1344 CB SER A 88 -13.309 0.823 -5.715 1.00 0.00 C ATOM 1345 OG SER A 88 -14.674 0.682 -5.329 1.00 0.00 O ATOM 0 H SER A 88 -13.847 3.010 -6.850 1.00 0.00 H new ATOM 0 HA SER A 88 -12.898 2.288 -4.218 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.226 0.719 -6.797 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.722 0.019 -5.271 1.00 0.00 H new ATOM 0 HG SER A 88 -15.254 0.945 -6.074 1.00 0.00 H new ATOM 1351 N TYR A 89 -10.465 1.688 -4.613 1.00 0.00 N ATOM 1352 CA TYR A 89 -9.018 1.658 -4.741 1.00 0.00 C ATOM 1353 C TYR A 89 -8.436 0.400 -4.093 1.00 0.00 C ATOM 1354 O TYR A 89 -8.919 -0.048 -3.054 1.00 0.00 O ATOM 1355 CB TYR A 89 -8.504 2.888 -3.990 1.00 0.00 C ATOM 1356 CG TYR A 89 -8.490 4.168 -4.829 1.00 0.00 C ATOM 1357 CD1 TYR A 89 -7.641 4.274 -5.912 1.00 0.00 C ATOM 1358 CD2 TYR A 89 -9.326 5.216 -4.502 1.00 0.00 C ATOM 1359 CE1 TYR A 89 -7.628 5.478 -6.701 1.00 0.00 C ATOM 1360 CE2 TYR A 89 -9.313 6.421 -5.292 1.00 0.00 C ATOM 1361 CZ TYR A 89 -8.464 6.492 -6.352 1.00 0.00 C ATOM 1362 OH TYR A 89 -8.452 7.630 -7.097 1.00 0.00 O ATOM 0 H TYR A 89 -10.825 1.280 -3.750 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.725 1.656 -5.791 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -9.126 3.050 -3.109 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.493 2.688 -3.634 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -6.987 3.454 -6.167 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -9.990 5.133 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -6.969 5.574 -7.551 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -9.962 7.249 -5.048 1.00 0.00 H new ATOM 0 HH TYR A 89 -8.981 7.494 -7.911 1.00 0.00 H new ATOM 1372 N GLN A 90 -7.407 -0.134 -4.734 1.00 0.00 N ATOM 1373 CA GLN A 90 -6.754 -1.332 -4.233 1.00 0.00 C ATOM 1374 C GLN A 90 -5.238 -1.129 -4.185 1.00 0.00 C ATOM 1375 O GLN A 90 -4.627 -0.746 -5.181 1.00 0.00 O ATOM 1376 CB GLN A 90 -7.117 -2.551 -5.084 1.00 0.00 C ATOM 1377 CG GLN A 90 -8.250 -3.351 -4.439 1.00 0.00 C ATOM 1378 CD GLN A 90 -8.603 -4.578 -5.282 1.00 0.00 C ATOM 1379 OE1 GLN A 90 -8.177 -4.728 -6.416 1.00 0.00 O ATOM 1380 NE2 GLN A 90 -9.404 -5.445 -4.668 1.00 0.00 N ATOM 0 H GLN A 90 -7.009 0.240 -5.595 1.00 0.00 H new ATOM 0 HA GLN A 90 -7.109 -1.519 -3.219 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -7.417 -2.227 -6.081 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -6.241 -3.188 -5.206 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -7.954 -3.666 -3.438 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -9.130 -2.717 -4.327 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -9.724 -5.259 -3.718 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -9.698 -6.296 -5.148 1.00 0.00 H new ATOM 1389 N PHE A 91 -4.675 -1.395 -3.015 1.00 0.00 N ATOM 1390 CA PHE A 91 -3.242 -1.246 -2.824 1.00 0.00 C ATOM 1391 C PHE A 91 -2.578 -2.602 -2.580 1.00 0.00 C ATOM 1392 O PHE A 91 -3.213 -3.528 -2.078 1.00 0.00 O ATOM 1393 CB PHE A 91 -3.045 -0.366 -1.588 1.00 0.00 C ATOM 1394 CG PHE A 91 -3.354 1.114 -1.822 1.00 0.00 C ATOM 1395 CD1 PHE A 91 -2.612 1.832 -2.707 1.00 0.00 C ATOM 1396 CD2 PHE A 91 -4.370 1.712 -1.144 1.00 0.00 C ATOM 1397 CE1 PHE A 91 -2.899 3.205 -2.925 1.00 0.00 C ATOM 1398 CE2 PHE A 91 -4.657 3.086 -1.362 1.00 0.00 C ATOM 1399 CZ PHE A 91 -3.915 3.804 -2.247 1.00 0.00 C ATOM 0 H PHE A 91 -5.185 -1.713 -2.191 1.00 0.00 H new ATOM 0 HA PHE A 91 -2.792 -0.805 -3.714 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.682 -0.737 -0.785 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.014 -0.462 -1.247 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -1.804 1.357 -3.244 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.958 1.142 -0.440 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -2.311 3.774 -3.629 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -5.465 3.561 -0.825 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.132 4.849 -2.411 1.00 0.00 H new ATOM 1409 N ARG A 92 -1.307 -2.678 -2.949 1.00 0.00 N ATOM 1410 CA ARG A 92 -0.550 -3.906 -2.777 1.00 0.00 C ATOM 1411 C ARG A 92 0.934 -3.657 -3.055 1.00 0.00 C ATOM 1412 O ARG A 92 1.328 -3.451 -4.202 1.00 0.00 O ATOM 1413 CB ARG A 92 -1.060 -5.003 -3.713 1.00 0.00 C ATOM 1414 CG ARG A 92 -1.236 -4.472 -5.137 1.00 0.00 C ATOM 1415 CD ARG A 92 -1.207 -5.613 -6.155 1.00 0.00 C ATOM 1416 NE ARG A 92 -0.182 -5.344 -7.188 1.00 0.00 N ATOM 1417 CZ ARG A 92 0.411 -6.294 -7.924 1.00 0.00 C ATOM 1418 NH1 ARG A 92 0.084 -7.581 -7.745 1.00 0.00 N ATOM 1419 NH2 ARG A 92 1.331 -5.957 -8.838 1.00 0.00 N ATOM 0 H ARG A 92 -0.783 -1.909 -3.366 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.680 -4.235 -1.746 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.359 -5.838 -3.717 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.011 -5.387 -3.344 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.181 -3.935 -5.214 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -0.444 -3.758 -5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -0.989 -6.555 -5.652 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -2.186 -5.720 -6.622 1.00 0.00 H new ATOM 0 HE ARG A 92 0.090 -4.374 -7.350 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -0.616 -7.837 -7.049 1.00 0.00 H new ATOM 0 HH12 ARG A 92 0.535 -8.304 -8.305 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.580 -4.977 -8.974 1.00 0.00 H new ATOM 0 HH22 ARG A 92 1.782 -6.680 -9.398 1.00 0.00 H new ATOM 1433 N LEU A 93 1.717 -3.686 -1.986 1.00 0.00 N ATOM 1434 CA LEU A 93 3.148 -3.466 -2.101 1.00 0.00 C ATOM 1435 C LEU A 93 3.885 -4.779 -1.827 1.00 0.00 C ATOM 1436 O LEU A 93 3.341 -5.679 -1.190 1.00 0.00 O ATOM 1437 CB LEU A 93 3.588 -2.315 -1.194 1.00 0.00 C ATOM 1438 CG LEU A 93 3.273 -2.475 0.295 1.00 0.00 C ATOM 1439 CD1 LEU A 93 4.277 -1.704 1.153 1.00 0.00 C ATOM 1440 CD2 LEU A 93 1.829 -2.068 0.596 1.00 0.00 C ATOM 0 H LEU A 93 1.387 -3.859 -1.036 1.00 0.00 H new ATOM 0 HA LEU A 93 3.406 -3.160 -3.115 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.664 -2.182 -1.305 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.116 -1.399 -1.548 1.00 0.00 H new ATOM 0 HG LEU A 93 3.371 -3.529 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.031 -1.834 2.207 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.282 -2.083 0.966 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.235 -0.645 0.899 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.631 -2.191 1.661 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.679 -1.025 0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.147 -2.698 0.025 1.00 0.00 H new ATOM 1452 N CYS A 94 5.111 -4.847 -2.324 1.00 0.00 N ATOM 1453 CA CYS A 94 5.928 -6.035 -2.142 1.00 0.00 C ATOM 1454 C CYS A 94 7.217 -5.627 -1.428 1.00 0.00 C ATOM 1455 O CYS A 94 7.453 -4.442 -1.193 1.00 0.00 O ATOM 1456 CB CYS A 94 6.210 -6.737 -3.472 1.00 0.00 C ATOM 1457 SG CYS A 94 6.989 -5.568 -4.644 1.00 0.00 S ATOM 0 H CYS A 94 5.559 -4.099 -2.853 1.00 0.00 H new ATOM 0 HA CYS A 94 5.389 -6.759 -1.531 1.00 0.00 H new ATOM 0 HB2 CYS A 94 6.866 -7.593 -3.309 1.00 0.00 H new ATOM 0 HB3 CYS A 94 5.282 -7.122 -3.893 1.00 0.00 H new ATOM 0 HG CYS A 94 6.224 -5.423 -5.685 1.00 0.00 H new ATOM 1463 N ALA A 95 8.019 -6.630 -1.101 1.00 0.00 N ATOM 1464 CA ALA A 95 9.279 -6.390 -0.419 1.00 0.00 C ATOM 1465 C ALA A 95 10.431 -6.542 -1.414 1.00 0.00 C ATOM 1466 O ALA A 95 10.589 -7.596 -2.029 1.00 0.00 O ATOM 1467 CB ALA A 95 9.405 -7.345 0.770 1.00 0.00 C ATOM 0 H ALA A 95 7.820 -7.611 -1.296 1.00 0.00 H new ATOM 0 HA ALA A 95 9.316 -5.374 -0.027 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.350 -7.166 1.282 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.580 -7.176 1.462 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.375 -8.375 0.414 1.00 0.00 H new ATOM 1473 N VAL A 96 11.205 -5.475 -1.542 1.00 0.00 N ATOM 1474 CA VAL A 96 12.338 -5.477 -2.452 1.00 0.00 C ATOM 1475 C VAL A 96 13.628 -5.272 -1.655 1.00 0.00 C ATOM 1476 O VAL A 96 13.719 -4.354 -0.841 1.00 0.00 O ATOM 1477 CB VAL A 96 12.134 -4.423 -3.543 1.00 0.00 C ATOM 1478 CG1 VAL A 96 13.208 -4.542 -4.627 1.00 0.00 C ATOM 1479 CG2 VAL A 96 10.732 -4.523 -4.146 1.00 0.00 C ATOM 0 H VAL A 96 11.070 -4.603 -1.031 1.00 0.00 H new ATOM 0 HA VAL A 96 12.420 -6.439 -2.959 1.00 0.00 H new ATOM 0 HB VAL A 96 12.231 -3.440 -3.082 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.040 -3.782 -5.390 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.192 -4.398 -4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 96 13.157 -5.531 -5.082 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.613 -3.763 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.594 -5.511 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 96 9.988 -4.366 -3.365 1.00 0.00 H new ATOM 1489 N ASN A 97 14.593 -6.140 -1.918 1.00 0.00 N ATOM 1490 CA ASN A 97 15.873 -6.066 -1.235 1.00 0.00 C ATOM 1491 C ASN A 97 16.999 -6.298 -2.245 1.00 0.00 C ATOM 1492 O ASN A 97 16.751 -6.743 -3.365 1.00 0.00 O ATOM 1493 CB ASN A 97 15.983 -7.139 -0.150 1.00 0.00 C ATOM 1494 CG ASN A 97 16.104 -8.533 -0.768 1.00 0.00 C ATOM 1495 OD1 ASN A 97 15.975 -8.723 -1.966 1.00 0.00 O ATOM 1496 ND2 ASN A 97 16.359 -9.495 0.114 1.00 0.00 N ATOM 0 H ASN A 97 14.514 -6.899 -2.595 1.00 0.00 H new ATOM 0 HA ASN A 97 15.953 -5.081 -0.776 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.851 -6.939 0.478 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.106 -7.099 0.497 1.00 0.00 H new ATOM 0 HD21 ASN A 97 16.458 -10.461 -0.199 1.00 0.00 H new ATOM 0 HD22 ASN A 97 16.455 -9.267 1.104 1.00 0.00 H new ATOM 1503 N ASP A 98 18.212 -5.987 -1.813 1.00 0.00 N ATOM 1504 CA ASP A 98 19.377 -6.157 -2.665 1.00 0.00 C ATOM 1505 C ASP A 98 19.237 -7.457 -3.459 1.00 0.00 C ATOM 1506 O ASP A 98 19.433 -7.471 -4.673 1.00 0.00 O ATOM 1507 CB ASP A 98 20.659 -6.244 -1.835 1.00 0.00 C ATOM 1508 CG ASP A 98 21.953 -6.306 -2.648 1.00 0.00 C ATOM 1509 OD1 ASP A 98 22.345 -5.242 -3.173 1.00 0.00 O ATOM 1510 OD2 ASP A 98 22.521 -7.417 -2.727 1.00 0.00 O ATOM 0 H ASP A 98 18.414 -5.618 -0.884 1.00 0.00 H new ATOM 0 HA ASP A 98 19.437 -5.296 -3.330 1.00 0.00 H new ATOM 0 HB2 ASP A 98 20.705 -5.379 -1.173 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.604 -7.129 -1.200 1.00 0.00 H new ATOM 1515 N VAL A 99 18.901 -8.518 -2.740 1.00 0.00 N ATOM 1516 CA VAL A 99 18.733 -9.821 -3.362 1.00 0.00 C ATOM 1517 C VAL A 99 17.802 -9.689 -4.570 1.00 0.00 C ATOM 1518 O VAL A 99 18.127 -10.151 -5.662 1.00 0.00 O ATOM 1519 CB VAL A 99 18.233 -10.833 -2.330 1.00 0.00 C ATOM 1520 CG1 VAL A 99 18.276 -12.256 -2.892 1.00 0.00 C ATOM 1521 CG2 VAL A 99 19.035 -10.733 -1.031 1.00 0.00 C ATOM 0 H VAL A 99 18.741 -8.502 -1.733 1.00 0.00 H new ATOM 0 HA VAL A 99 19.689 -10.195 -3.728 1.00 0.00 H new ATOM 0 HB VAL A 99 17.194 -10.594 -2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 99 17.915 -12.956 -2.138 1.00 0.00 H new ATOM 0 HG12 VAL A 99 17.642 -12.317 -3.777 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.301 -12.510 -3.162 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.659 -11.463 -0.314 1.00 0.00 H new ATOM 0 HG22 VAL A 99 20.086 -10.934 -1.236 1.00 0.00 H new ATOM 0 HG23 VAL A 99 18.931 -9.731 -0.616 1.00 0.00 H new ATOM 1531 N GLY A 100 16.663 -9.056 -4.331 1.00 0.00 N ATOM 1532 CA GLY A 100 15.683 -8.857 -5.385 1.00 0.00 C ATOM 1533 C GLY A 100 14.304 -8.544 -4.800 1.00 0.00 C ATOM 1534 O GLY A 100 14.191 -8.178 -3.631 1.00 0.00 O ATOM 0 H GLY A 100 16.397 -8.674 -3.423 1.00 0.00 H new ATOM 0 HA2 GLY A 100 16.001 -8.040 -6.033 1.00 0.00 H new ATOM 0 HA3 GLY A 100 15.624 -9.751 -6.005 1.00 0.00 H new ATOM 1538 N LYS A 101 13.291 -8.698 -5.640 1.00 0.00 N ATOM 1539 CA LYS A 101 11.925 -8.436 -5.221 1.00 0.00 C ATOM 1540 C LYS A 101 11.193 -9.764 -5.022 1.00 0.00 C ATOM 1541 O LYS A 101 11.424 -10.721 -5.760 1.00 0.00 O ATOM 1542 CB LYS A 101 11.233 -7.494 -6.208 1.00 0.00 C ATOM 1543 CG LYS A 101 9.757 -7.309 -5.847 1.00 0.00 C ATOM 1544 CD LYS A 101 8.929 -6.966 -7.087 1.00 0.00 C ATOM 1545 CE LYS A 101 9.366 -5.627 -7.685 1.00 0.00 C ATOM 1546 NZ LYS A 101 9.581 -5.756 -9.143 1.00 0.00 N ATOM 0 H LYS A 101 13.389 -9.001 -6.609 1.00 0.00 H new ATOM 0 HA LYS A 101 11.914 -7.919 -4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.735 -6.527 -6.206 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.317 -7.895 -7.218 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.373 -8.221 -5.390 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.656 -6.515 -5.107 1.00 0.00 H new ATOM 0 HD2 LYS A 101 9.039 -7.754 -7.832 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.872 -6.923 -6.823 1.00 0.00 H new ATOM 0 HE2 LYS A 101 8.607 -4.870 -7.489 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.284 -5.290 -7.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 9.877 -4.838 -9.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 10.321 -6.464 -9.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.696 -6.057 -9.599 1.00 0.00 H new ATOM 1560 N GLY A 102 10.325 -9.782 -4.021 1.00 0.00 N ATOM 1561 CA GLY A 102 9.558 -10.977 -3.716 1.00 0.00 C ATOM 1562 C GLY A 102 8.180 -10.929 -4.380 1.00 0.00 C ATOM 1563 O GLY A 102 8.075 -10.987 -5.604 1.00 0.00 O ATOM 0 H GLY A 102 10.136 -8.987 -3.410 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.100 -11.858 -4.058 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.442 -11.073 -2.636 1.00 0.00 H new ATOM 1567 N GLN A 103 7.159 -10.823 -3.542 1.00 0.00 N ATOM 1568 CA GLN A 103 5.792 -10.766 -4.033 1.00 0.00 C ATOM 1569 C GLN A 103 5.034 -9.620 -3.360 1.00 0.00 C ATOM 1570 O GLN A 103 5.511 -9.045 -2.382 1.00 0.00 O ATOM 1571 CB GLN A 103 5.076 -12.100 -3.814 1.00 0.00 C ATOM 1572 CG GLN A 103 5.418 -12.689 -2.444 1.00 0.00 C ATOM 1573 CD GLN A 103 4.237 -13.478 -1.876 1.00 0.00 C ATOM 1574 OE1 GLN A 103 3.166 -13.547 -2.456 1.00 0.00 O ATOM 1575 NE2 GLN A 103 4.492 -14.069 -0.712 1.00 0.00 N ATOM 0 H GLN A 103 7.251 -10.775 -2.527 1.00 0.00 H new ATOM 0 HA GLN A 103 5.819 -10.577 -5.106 1.00 0.00 H new ATOM 0 HB2 GLN A 103 3.999 -11.955 -3.893 1.00 0.00 H new ATOM 0 HB3 GLN A 103 5.361 -12.803 -4.597 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.287 -13.341 -2.531 1.00 0.00 H new ATOM 0 HG3 GLN A 103 5.689 -11.887 -1.757 1.00 0.00 H new ATOM 0 HE21 GLN A 103 5.411 -13.971 -0.281 1.00 0.00 H new ATOM 0 HE22 GLN A 103 3.769 -14.621 -0.251 1.00 0.00 H new ATOM 1584 N PHE A 104 3.867 -9.321 -3.910 1.00 0.00 N ATOM 1585 CA PHE A 104 3.038 -8.254 -3.376 1.00 0.00 C ATOM 1586 C PHE A 104 1.904 -8.818 -2.518 1.00 0.00 C ATOM 1587 O PHE A 104 1.474 -9.953 -2.719 1.00 0.00 O ATOM 1588 CB PHE A 104 2.438 -7.512 -4.571 1.00 0.00 C ATOM 1589 CG PHE A 104 3.475 -6.837 -5.470 1.00 0.00 C ATOM 1590 CD1 PHE A 104 4.390 -7.591 -6.137 1.00 0.00 C ATOM 1591 CD2 PHE A 104 3.483 -5.484 -5.602 1.00 0.00 C ATOM 1592 CE1 PHE A 104 5.353 -6.965 -6.972 1.00 0.00 C ATOM 1593 CE2 PHE A 104 4.447 -4.858 -6.437 1.00 0.00 C ATOM 1594 CZ PHE A 104 5.361 -5.611 -7.104 1.00 0.00 C ATOM 0 H PHE A 104 3.475 -9.800 -4.721 1.00 0.00 H new ATOM 0 HA PHE A 104 3.638 -7.595 -2.749 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.858 -8.216 -5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.743 -6.756 -4.205 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.384 -8.666 -6.031 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.757 -4.885 -5.072 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.079 -7.564 -7.502 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.454 -3.783 -6.542 1.00 0.00 H new ATOM 0 HZ PHE A 104 6.094 -5.135 -7.739 1.00 0.00 H new ATOM 1604 N SER A 105 1.451 -8.000 -1.579 1.00 0.00 N ATOM 1605 CA SER A 105 0.375 -8.403 -0.690 1.00 0.00 C ATOM 1606 C SER A 105 -0.942 -8.480 -1.465 1.00 0.00 C ATOM 1607 O SER A 105 -1.057 -7.927 -2.557 1.00 0.00 O ATOM 1608 CB SER A 105 0.242 -7.435 0.487 1.00 0.00 C ATOM 1609 OG SER A 105 0.572 -6.098 0.120 1.00 0.00 O ATOM 0 H SER A 105 1.810 -7.059 -1.415 1.00 0.00 H new ATOM 0 HA SER A 105 0.612 -9.389 -0.290 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.779 -7.465 0.867 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.894 -7.759 1.298 1.00 0.00 H new ATOM 0 HG SER A 105 0.182 -5.475 0.768 1.00 0.00 H new ATOM 1615 N LYS A 106 -1.902 -9.172 -0.868 1.00 0.00 N ATOM 1616 CA LYS A 106 -3.207 -9.329 -1.489 1.00 0.00 C ATOM 1617 C LYS A 106 -3.884 -7.961 -1.596 1.00 0.00 C ATOM 1618 O LYS A 106 -3.532 -7.032 -0.871 1.00 0.00 O ATOM 1619 CB LYS A 106 -4.037 -10.369 -0.734 1.00 0.00 C ATOM 1620 CG LYS A 106 -3.728 -11.783 -1.230 1.00 0.00 C ATOM 1621 CD LYS A 106 -4.657 -12.808 -0.578 1.00 0.00 C ATOM 1622 CE LYS A 106 -4.737 -14.086 -1.416 1.00 0.00 C ATOM 1623 NZ LYS A 106 -5.704 -15.036 -0.822 1.00 0.00 N ATOM 0 H LYS A 106 -1.802 -9.630 0.038 1.00 0.00 H new ATOM 0 HA LYS A 106 -3.103 -9.713 -2.504 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.828 -10.301 0.334 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.098 -10.158 -0.865 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -3.839 -11.824 -2.314 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -2.691 -12.032 -1.006 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -4.296 -13.047 0.422 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.653 -12.381 -0.464 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.038 -13.842 -2.435 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.753 -14.550 -1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.746 -15.898 -1.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.401 -15.283 0.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.646 -14.596 -0.787 1.00 0.00 H new ATOM 1637 N ASP A 107 -4.844 -7.882 -2.505 1.00 0.00 N ATOM 1638 CA ASP A 107 -5.574 -6.643 -2.716 1.00 0.00 C ATOM 1639 C ASP A 107 -6.268 -6.236 -1.414 1.00 0.00 C ATOM 1640 O ASP A 107 -7.193 -6.910 -0.963 1.00 0.00 O ATOM 1641 CB ASP A 107 -6.650 -6.814 -3.791 1.00 0.00 C ATOM 1642 CG ASP A 107 -7.556 -8.033 -3.611 1.00 0.00 C ATOM 1643 OD1 ASP A 107 -8.464 -7.944 -2.756 1.00 0.00 O ATOM 1644 OD2 ASP A 107 -7.321 -9.026 -4.332 1.00 0.00 O ATOM 0 H ASP A 107 -5.134 -8.655 -3.104 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.862 -5.883 -3.036 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.271 -5.918 -3.808 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.163 -6.883 -4.764 1.00 0.00 H new ATOM 1649 N THR A 108 -5.794 -5.137 -0.847 1.00 0.00 N ATOM 1650 CA THR A 108 -6.356 -4.632 0.394 1.00 0.00 C ATOM 1651 C THR A 108 -7.872 -4.467 0.264 1.00 0.00 C ATOM 1652 O THR A 108 -8.399 -4.399 -0.845 1.00 0.00 O ATOM 1653 CB THR A 108 -5.631 -3.333 0.748 1.00 0.00 C ATOM 1654 OG1 THR A 108 -5.787 -2.521 -0.413 1.00 0.00 O ATOM 1655 CG2 THR A 108 -4.118 -3.521 0.871 1.00 0.00 C ATOM 0 H THR A 108 -5.026 -4.581 -1.224 1.00 0.00 H new ATOM 0 HA THR A 108 -6.206 -5.337 1.212 1.00 0.00 H new ATOM 0 HB THR A 108 -6.025 -2.942 1.686 1.00 0.00 H new ATOM 0 HG1 THR A 108 -6.608 -1.992 -0.334 1.00 0.00 H new ATOM 0 HG21 THR A 108 -3.652 -2.568 1.123 1.00 0.00 H new ATOM 0 HG22 THR A 108 -3.904 -4.248 1.654 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.718 -3.881 -0.077 1.00 0.00 H new ATOM 1663 N GLU A 109 -8.529 -4.407 1.413 1.00 0.00 N ATOM 1664 CA GLU A 109 -9.973 -4.250 1.441 1.00 0.00 C ATOM 1665 C GLU A 109 -10.401 -3.103 0.524 1.00 0.00 C ATOM 1666 O GLU A 109 -10.046 -1.949 0.760 1.00 0.00 O ATOM 1667 CB GLU A 109 -10.472 -4.025 2.870 1.00 0.00 C ATOM 1668 CG GLU A 109 -11.336 -5.197 3.340 1.00 0.00 C ATOM 1669 CD GLU A 109 -12.003 -4.883 4.681 1.00 0.00 C ATOM 1670 OE1 GLU A 109 -11.255 -4.784 5.677 1.00 0.00 O ATOM 1671 OE2 GLU A 109 -13.246 -4.750 4.679 1.00 0.00 O ATOM 0 H GLU A 109 -8.088 -4.464 2.331 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.426 -5.171 1.073 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -9.622 -3.903 3.541 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.049 -3.102 2.916 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -12.099 -5.414 2.592 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.721 -6.091 3.436 1.00 0.00 H new ATOM 1678 N ARG A 110 -11.158 -3.460 -0.504 1.00 0.00 N ATOM 1679 CA ARG A 110 -11.638 -2.474 -1.458 1.00 0.00 C ATOM 1680 C ARG A 110 -12.000 -1.173 -0.740 1.00 0.00 C ATOM 1681 O ARG A 110 -13.098 -1.041 -0.203 1.00 0.00 O ATOM 1682 CB ARG A 110 -12.864 -2.991 -2.213 1.00 0.00 C ATOM 1683 CG ARG A 110 -12.609 -3.017 -3.721 1.00 0.00 C ATOM 1684 CD ARG A 110 -13.857 -3.470 -4.481 1.00 0.00 C ATOM 1685 NE ARG A 110 -14.748 -2.314 -4.727 1.00 0.00 N ATOM 1686 CZ ARG A 110 -15.952 -2.403 -5.307 1.00 0.00 C ATOM 1687 NH1 ARG A 110 -16.418 -3.595 -5.704 1.00 0.00 N ATOM 1688 NH2 ARG A 110 -16.691 -1.301 -5.490 1.00 0.00 N ATOM 0 H ARG A 110 -11.451 -4.418 -0.697 1.00 0.00 H new ATOM 0 HA ARG A 110 -10.837 -2.287 -2.173 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -13.113 -3.994 -1.865 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -13.723 -2.356 -1.997 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -12.313 -2.024 -4.060 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -11.780 -3.690 -3.942 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -13.570 -3.926 -5.428 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -14.386 -4.231 -3.907 1.00 0.00 H new ATOM 0 HE ARG A 110 -14.425 -1.391 -4.436 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -15.856 -4.435 -5.564 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -17.335 -3.663 -6.146 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -16.337 -0.393 -5.188 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -17.608 -1.369 -5.932 1.00 0.00 H new ATOM 1702 N VAL A 111 -11.055 -0.244 -0.754 1.00 0.00 N ATOM 1703 CA VAL A 111 -11.261 1.042 -0.110 1.00 0.00 C ATOM 1704 C VAL A 111 -11.824 2.034 -1.131 1.00 0.00 C ATOM 1705 O VAL A 111 -11.228 2.251 -2.185 1.00 0.00 O ATOM 1706 CB VAL A 111 -9.957 1.521 0.532 1.00 0.00 C ATOM 1707 CG1 VAL A 111 -8.987 2.051 -0.526 1.00 0.00 C ATOM 1708 CG2 VAL A 111 -10.229 2.577 1.605 1.00 0.00 C ATOM 0 H VAL A 111 -10.145 -0.356 -1.201 1.00 0.00 H new ATOM 0 HA VAL A 111 -11.991 0.954 0.695 1.00 0.00 H new ATOM 0 HB VAL A 111 -9.488 0.665 1.017 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -8.069 2.385 -0.043 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -8.755 1.258 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -9.445 2.888 -1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -9.286 2.900 2.045 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -10.731 3.433 1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -10.865 2.151 2.382 1.00 0.00 H new ATOM 1718 N SER A 112 -12.965 2.609 -0.782 1.00 0.00 N ATOM 1719 CA SER A 112 -13.615 3.572 -1.654 1.00 0.00 C ATOM 1720 C SER A 112 -13.463 4.983 -1.082 1.00 0.00 C ATOM 1721 O SER A 112 -13.497 5.170 0.134 1.00 0.00 O ATOM 1722 CB SER A 112 -15.095 3.233 -1.844 1.00 0.00 C ATOM 1723 OG SER A 112 -15.853 4.366 -2.258 1.00 0.00 O ATOM 0 H SER A 112 -13.456 2.426 0.093 1.00 0.00 H new ATOM 0 HA SER A 112 -13.132 3.529 -2.630 1.00 0.00 H new ATOM 0 HB2 SER A 112 -15.193 2.440 -2.586 1.00 0.00 H new ATOM 0 HB3 SER A 112 -15.501 2.847 -0.909 1.00 0.00 H new ATOM 0 HG SER A 112 -16.792 4.108 -2.370 1.00 0.00 H new ATOM 1729 N LEU A 113 -13.298 5.939 -1.984 1.00 0.00 N ATOM 1730 CA LEU A 113 -13.141 7.327 -1.584 1.00 0.00 C ATOM 1731 C LEU A 113 -14.517 7.990 -1.508 1.00 0.00 C ATOM 1732 O LEU A 113 -15.466 7.534 -2.143 1.00 0.00 O ATOM 1733 CB LEU A 113 -12.162 8.045 -2.516 1.00 0.00 C ATOM 1734 CG LEU A 113 -10.996 8.766 -1.837 1.00 0.00 C ATOM 1735 CD1 LEU A 113 -9.667 8.079 -2.155 1.00 0.00 C ATOM 1736 CD2 LEU A 113 -10.977 10.250 -2.208 1.00 0.00 C ATOM 0 H LEU A 113 -13.270 5.780 -2.991 1.00 0.00 H new ATOM 0 HA LEU A 113 -12.702 7.390 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -11.754 7.314 -3.215 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -12.720 8.773 -3.105 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.140 8.706 -0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -8.855 8.611 -1.660 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -9.696 7.049 -1.799 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.502 8.086 -3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -10.138 10.738 -1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -10.870 10.354 -3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -11.909 10.717 -1.889 1.00 0.00 H new ATOM 1748 N PRO A 114 -14.583 9.085 -0.704 1.00 0.00 N ATOM 1749 CA PRO A 114 -15.828 9.816 -0.536 1.00 0.00 C ATOM 1750 C PRO A 114 -16.138 10.662 -1.773 1.00 0.00 C ATOM 1751 O PRO A 114 -15.227 11.162 -2.432 1.00 0.00 O ATOM 1752 CB PRO A 114 -15.629 10.650 0.719 1.00 0.00 C ATOM 1753 CG PRO A 114 -14.127 10.711 0.945 1.00 0.00 C ATOM 1754 CD PRO A 114 -13.480 9.654 0.064 1.00 0.00 C ATOM 0 HA PRO A 114 -16.690 9.158 -0.428 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -16.046 11.649 0.594 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -16.134 10.198 1.572 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -13.744 11.701 0.698 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -13.891 10.531 1.994 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -12.726 10.092 -0.591 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -12.980 8.892 0.662 1.00 0.00 H new ATOM 1762 N GLU A 115 -17.426 10.797 -2.050 1.00 0.00 N ATOM 1763 CA GLU A 115 -17.868 11.574 -3.196 1.00 0.00 C ATOM 1764 C GLU A 115 -17.457 13.039 -3.034 1.00 0.00 C ATOM 1765 O GLU A 115 -17.397 13.551 -1.917 1.00 0.00 O ATOM 1766 CB GLU A 115 -19.379 11.447 -3.395 1.00 0.00 C ATOM 1767 CG GLU A 115 -19.740 11.469 -4.882 1.00 0.00 C ATOM 1768 CD GLU A 115 -21.130 10.874 -5.117 1.00 0.00 C ATOM 1769 OE1 GLU A 115 -22.110 11.555 -4.743 1.00 0.00 O ATOM 1770 OE2 GLU A 115 -21.182 9.752 -5.666 1.00 0.00 O ATOM 0 H GLU A 115 -18.178 10.381 -1.501 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.383 11.177 -4.088 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -19.732 10.519 -2.945 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -19.887 12.263 -2.882 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -19.712 12.494 -5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.999 10.905 -5.448 1.00 0.00 H new ATOM 1777 N SER A 116 -17.184 13.672 -4.166 1.00 0.00 N ATOM 1778 CA SER A 116 -16.781 15.068 -4.163 1.00 0.00 C ATOM 1779 C SER A 116 -16.820 15.627 -5.587 1.00 0.00 C ATOM 1780 O SER A 116 -16.232 15.050 -6.500 1.00 0.00 O ATOM 1781 CB SER A 116 -15.382 15.236 -3.566 1.00 0.00 C ATOM 1782 OG SER A 116 -15.219 16.505 -2.939 1.00 0.00 O ATOM 0 H SER A 116 -17.234 13.244 -5.091 1.00 0.00 H new ATOM 0 HA SER A 116 -17.482 15.625 -3.541 1.00 0.00 H new ATOM 0 HB2 SER A 116 -15.201 14.446 -2.837 1.00 0.00 H new ATOM 0 HB3 SER A 116 -14.636 15.121 -4.352 1.00 0.00 H new ATOM 0 HG SER A 116 -14.314 16.573 -2.569 1.00 0.00 H new ATOM 1788 N GLY A 117 -17.519 16.743 -5.731 1.00 0.00 N ATOM 1789 CA GLY A 117 -17.643 17.386 -7.028 1.00 0.00 C ATOM 1790 C GLY A 117 -18.555 16.579 -7.955 1.00 0.00 C ATOM 1791 O GLY A 117 -19.094 15.548 -7.558 1.00 0.00 O ATOM 0 H GLY A 117 -18.005 17.218 -4.971 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -18.044 18.392 -6.902 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -16.658 17.490 -7.482 1.00 0.00 H new ATOM 1795 N PRO A 118 -18.704 17.094 -9.205 1.00 0.00 N ATOM 1796 CA PRO A 118 -19.541 16.433 -10.192 1.00 0.00 C ATOM 1797 C PRO A 118 -18.852 15.186 -10.749 1.00 0.00 C ATOM 1798 O PRO A 118 -19.456 14.116 -10.817 1.00 0.00 O ATOM 1799 CB PRO A 118 -19.807 17.488 -11.253 1.00 0.00 C ATOM 1800 CG PRO A 118 -18.737 18.550 -11.062 1.00 0.00 C ATOM 1801 CD PRO A 118 -18.081 18.313 -9.711 1.00 0.00 C ATOM 0 HA PRO A 118 -20.477 16.066 -9.771 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -19.756 17.058 -12.253 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -20.804 17.913 -11.140 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -17.997 18.494 -11.861 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -19.177 19.547 -11.103 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -17.002 18.194 -9.810 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.249 19.153 -9.037 1.00 0.00 H new ATOM 1809 N SER A 119 -17.597 15.365 -11.134 1.00 0.00 N ATOM 1810 CA SER A 119 -16.819 14.267 -11.683 1.00 0.00 C ATOM 1811 C SER A 119 -17.621 13.550 -12.771 1.00 0.00 C ATOM 1812 O SER A 119 -18.449 12.690 -12.471 1.00 0.00 O ATOM 1813 CB SER A 119 -16.409 13.281 -10.588 1.00 0.00 C ATOM 1814 OG SER A 119 -15.493 12.300 -11.069 1.00 0.00 O ATOM 0 H SER A 119 -17.100 16.254 -11.077 1.00 0.00 H new ATOM 0 HA SER A 119 -15.910 14.678 -12.122 1.00 0.00 H new ATOM 0 HB2 SER A 119 -15.955 13.826 -9.761 1.00 0.00 H new ATOM 0 HB3 SER A 119 -17.297 12.786 -10.195 1.00 0.00 H new ATOM 0 HG SER A 119 -15.254 11.690 -10.340 1.00 0.00 H new ATOM 1820 N SER A 120 -17.348 13.929 -14.010 1.00 0.00 N ATOM 1821 CA SER A 120 -18.035 13.333 -15.144 1.00 0.00 C ATOM 1822 C SER A 120 -17.355 12.019 -15.535 1.00 0.00 C ATOM 1823 O SER A 120 -16.151 11.988 -15.783 1.00 0.00 O ATOM 1824 CB SER A 120 -18.064 14.290 -16.337 1.00 0.00 C ATOM 1825 OG SER A 120 -19.360 14.374 -16.923 1.00 0.00 O ATOM 0 H SER A 120 -16.660 14.642 -14.254 1.00 0.00 H new ATOM 0 HA SER A 120 -19.065 13.130 -14.851 1.00 0.00 H new ATOM 0 HB2 SER A 120 -17.747 15.282 -16.014 1.00 0.00 H new ATOM 0 HB3 SER A 120 -17.348 13.955 -17.088 1.00 0.00 H new ATOM 0 HG SER A 120 -19.337 14.996 -17.680 1.00 0.00 H new ATOM 1831 N GLY A 121 -18.157 10.965 -15.577 1.00 0.00 N ATOM 1832 CA GLY A 121 -17.648 9.651 -15.934 1.00 0.00 C ATOM 1833 C GLY A 121 -18.654 8.557 -15.573 1.00 0.00 C ATOM 1834 O GLY A 121 -18.269 7.474 -15.135 1.00 0.00 O ATOM 0 H GLY A 121 -19.155 10.994 -15.370 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -17.436 9.617 -17.003 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -16.706 9.469 -15.417 1.00 0.00 H new TER 1838 GLY A 121