USER MOD reduce.3.24.130724 H: found=0, std=0, add=533, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 530 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 Single : A 1 GLY N :NH3+ -113:sc= 0.0621 (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 36:sc= 0.785 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 9 GLN : amide:sc= -0.02 K(o=-0.02,f=-1.2) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0618 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0587 USER MOD Single : A 27 MET CE :methyl 164:sc= -0.965 (180deg=-1.69!) USER MOD Single : A 29 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0016) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ -146:sc= 0.552 (180deg=0.0951) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 63:sc= 0.954 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.138 K(o=-0.14,f=-2.4!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.595 36.724 14.401 1.00 0.00 N ATOM 2 CA GLY A 1 11.787 35.521 14.460 1.00 0.00 C ATOM 3 C GLY A 1 11.421 34.998 13.086 1.00 0.00 C ATOM 4 O GLY A 1 11.498 35.728 12.097 1.00 0.00 O ATOM 0 H1 GLY A 1 13.549 36.520 14.762 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.660 37.051 13.416 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.156 37.466 14.983 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.330 34.749 15.006 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.876 35.727 15.021 1.00 0.00 H new ATOM 8 N SER A 2 11.024 33.731 13.022 1.00 0.00 N ATOM 9 CA SER A 2 10.651 33.111 11.756 1.00 0.00 C ATOM 10 C SER A 2 9.276 32.457 11.856 1.00 0.00 C ATOM 11 O SER A 2 9.005 31.695 12.786 1.00 0.00 O ATOM 12 CB SER A 2 11.694 32.070 11.347 1.00 0.00 C ATOM 13 OG SER A 2 12.991 32.640 11.297 1.00 0.00 O ATOM 0 H SER A 2 10.952 33.114 13.831 1.00 0.00 H new ATOM 0 HA SER A 2 10.609 33.891 10.996 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.684 31.242 12.056 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.437 31.657 10.372 1.00 0.00 H new ATOM 0 HG SER A 2 13.640 31.954 11.035 1.00 0.00 H new ATOM 19 N SER A 3 8.412 32.759 10.894 1.00 0.00 N ATOM 20 CA SER A 3 7.063 32.205 10.874 1.00 0.00 C ATOM 21 C SER A 3 7.054 30.820 10.233 1.00 0.00 C ATOM 22 O SER A 3 7.937 30.483 9.445 1.00 0.00 O ATOM 23 CB SER A 3 6.117 33.137 10.116 1.00 0.00 C ATOM 24 OG SER A 3 6.192 34.460 10.618 1.00 0.00 O ATOM 0 H SER A 3 8.622 33.385 10.117 1.00 0.00 H new ATOM 0 HA SER A 3 6.720 32.111 11.904 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.370 33.132 9.056 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.094 32.770 10.202 1.00 0.00 H new ATOM 0 HG SER A 3 5.579 35.036 10.115 1.00 0.00 H new ATOM 30 N GLY A 4 6.049 30.021 10.578 1.00 0.00 N ATOM 31 CA GLY A 4 5.943 28.683 10.029 1.00 0.00 C ATOM 32 C GLY A 4 6.440 27.621 10.989 1.00 0.00 C ATOM 33 O GLY A 4 7.212 27.913 11.902 1.00 0.00 O ATOM 0 H GLY A 4 5.306 30.277 11.228 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.903 28.480 9.774 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.515 28.627 9.103 1.00 0.00 H new ATOM 37 N SER A 5 5.996 26.385 10.783 1.00 0.00 N ATOM 38 CA SER A 5 6.397 25.276 11.641 1.00 0.00 C ATOM 39 C SER A 5 5.938 23.944 11.057 1.00 0.00 C ATOM 40 O SER A 5 4.751 23.618 11.080 1.00 0.00 O ATOM 41 CB SER A 5 5.818 25.456 13.046 1.00 0.00 C ATOM 42 OG SER A 5 4.401 25.468 13.017 1.00 0.00 O ATOM 0 H SER A 5 5.359 26.126 10.030 1.00 0.00 H new ATOM 0 HA SER A 5 7.485 25.271 11.702 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.165 24.649 13.692 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.184 26.388 13.477 1.00 0.00 H new ATOM 0 HG SER A 5 4.082 24.836 12.340 1.00 0.00 H new ATOM 48 N SER A 6 6.888 23.176 10.533 1.00 0.00 N ATOM 49 CA SER A 6 6.583 21.880 9.939 1.00 0.00 C ATOM 50 C SER A 6 7.338 20.763 10.652 1.00 0.00 C ATOM 51 O SER A 6 8.423 20.978 11.192 1.00 0.00 O ATOM 52 CB SER A 6 6.939 21.880 8.450 1.00 0.00 C ATOM 53 OG SER A 6 8.293 22.245 8.250 1.00 0.00 O ATOM 0 H SER A 6 7.876 23.429 10.508 1.00 0.00 H new ATOM 0 HA SER A 6 5.514 21.701 10.050 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.760 20.890 8.030 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.289 22.575 7.917 1.00 0.00 H new ATOM 0 HG SER A 6 8.496 22.236 7.291 1.00 0.00 H new ATOM 59 N GLY A 7 6.755 19.568 10.652 1.00 0.00 N ATOM 60 CA GLY A 7 7.386 18.434 11.302 1.00 0.00 C ATOM 61 C GLY A 7 7.045 17.118 10.632 1.00 0.00 C ATOM 62 O GLY A 7 6.246 16.338 11.150 1.00 0.00 O ATOM 0 H GLY A 7 5.857 19.365 10.213 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.467 18.571 11.296 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.075 18.398 12.346 1.00 0.00 H new ATOM 66 N HIS A 8 7.651 16.871 9.475 1.00 0.00 N ATOM 67 CA HIS A 8 7.407 15.640 8.732 1.00 0.00 C ATOM 68 C HIS A 8 8.722 14.990 8.309 1.00 0.00 C ATOM 69 O HIS A 8 9.602 15.651 7.757 1.00 0.00 O ATOM 70 CB HIS A 8 6.548 15.925 7.500 1.00 0.00 C ATOM 71 CG HIS A 8 6.217 14.700 6.704 1.00 0.00 C ATOM 72 ND1 HIS A 8 6.980 14.266 5.640 1.00 0.00 N ATOM 73 CD2 HIS A 8 5.200 13.815 6.823 1.00 0.00 C ATOM 74 CE1 HIS A 8 6.444 13.167 5.138 1.00 0.00 C ATOM 75 NE2 HIS A 8 5.363 12.872 5.838 1.00 0.00 N ATOM 0 H HIS A 8 8.314 17.507 9.032 1.00 0.00 H new ATOM 0 HA HIS A 8 6.874 14.950 9.386 1.00 0.00 H new ATOM 0 HB2 HIS A 8 5.621 16.404 7.816 1.00 0.00 H new ATOM 0 HB3 HIS A 8 7.071 16.635 6.859 1.00 0.00 H new ATOM 0 HD2 HIS A 8 4.408 13.845 7.556 1.00 0.00 H new ATOM 0 HE1 HIS A 8 6.825 12.605 4.298 1.00 0.00 H new ATOM 0 HE2 HIS A 8 4.749 12.074 5.674 1.00 0.00 H new ATOM 83 N GLN A 9 8.847 13.694 8.574 1.00 0.00 N ATOM 84 CA GLN A 9 10.055 12.957 8.222 1.00 0.00 C ATOM 85 C GLN A 9 9.725 11.513 7.856 1.00 0.00 C ATOM 86 O GLN A 9 8.915 10.865 8.518 1.00 0.00 O ATOM 87 CB GLN A 9 11.052 12.986 9.383 1.00 0.00 C ATOM 88 CG GLN A 9 10.528 12.332 10.651 1.00 0.00 C ATOM 89 CD GLN A 9 11.627 12.033 11.651 1.00 0.00 C ATOM 90 OE1 GLN A 9 12.794 12.355 11.423 1.00 0.00 O ATOM 91 NE2 GLN A 9 11.261 11.415 12.768 1.00 0.00 N ATOM 0 H GLN A 9 8.128 13.133 9.031 1.00 0.00 H new ATOM 0 HA GLN A 9 10.504 13.439 7.354 1.00 0.00 H new ATOM 0 HB2 GLN A 9 11.969 12.482 9.076 1.00 0.00 H new ATOM 0 HB3 GLN A 9 11.314 14.021 9.600 1.00 0.00 H new ATOM 0 HG2 GLN A 9 9.789 12.986 11.114 1.00 0.00 H new ATOM 0 HG3 GLN A 9 10.016 11.405 10.392 1.00 0.00 H new ATOM 0 HE21 GLN A 9 10.283 11.166 12.916 1.00 0.00 H new ATOM 0 HE22 GLN A 9 11.958 11.189 13.478 1.00 0.00 H new ATOM 100 N GLU A 10 10.358 11.017 6.797 1.00 0.00 N ATOM 101 CA GLU A 10 10.129 9.650 6.343 1.00 0.00 C ATOM 102 C GLU A 10 11.253 9.189 5.420 1.00 0.00 C ATOM 103 O GLU A 10 11.880 9.998 4.735 1.00 0.00 O ATOM 104 CB GLU A 10 8.784 9.549 5.620 1.00 0.00 C ATOM 105 CG GLU A 10 8.670 10.467 4.415 1.00 0.00 C ATOM 106 CD GLU A 10 9.730 10.189 3.367 1.00 0.00 C ATOM 107 OE1 GLU A 10 10.026 8.999 3.124 1.00 0.00 O ATOM 108 OE2 GLU A 10 10.263 11.159 2.789 1.00 0.00 O ATOM 0 H GLU A 10 11.032 11.540 6.238 1.00 0.00 H new ATOM 0 HA GLU A 10 10.112 9.000 7.218 1.00 0.00 H new ATOM 0 HB2 GLU A 10 8.631 8.519 5.297 1.00 0.00 H new ATOM 0 HB3 GLU A 10 7.985 9.785 6.323 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.683 10.352 3.967 1.00 0.00 H new ATOM 0 HG3 GLU A 10 8.752 11.503 4.743 1.00 0.00 H new ATOM 115 N ILE A 11 11.501 7.884 5.406 1.00 0.00 N ATOM 116 CA ILE A 11 12.548 7.314 4.568 1.00 0.00 C ATOM 117 C ILE A 11 11.994 6.214 3.669 1.00 0.00 C ATOM 118 O ILE A 11 11.014 5.552 4.011 1.00 0.00 O ATOM 119 CB ILE A 11 13.698 6.739 5.415 1.00 0.00 C ATOM 120 CG1 ILE A 11 14.807 6.199 4.509 1.00 0.00 C ATOM 121 CG2 ILE A 11 13.181 5.646 6.338 1.00 0.00 C ATOM 122 CD1 ILE A 11 16.082 5.864 5.250 1.00 0.00 C ATOM 0 H ILE A 11 10.991 7.201 5.966 1.00 0.00 H new ATOM 0 HA ILE A 11 12.934 8.125 3.951 1.00 0.00 H new ATOM 0 HB ILE A 11 14.113 7.539 6.028 1.00 0.00 H new ATOM 0 HG12 ILE A 11 14.446 5.305 4.000 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.027 6.938 3.738 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.006 5.250 6.930 1.00 0.00 H new ATOM 0 HG22 ILE A 11 12.423 6.060 7.003 1.00 0.00 H new ATOM 0 HG23 ILE A 11 12.743 4.844 5.743 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.824 5.487 4.546 1.00 0.00 H new ATOM 0 HD12 ILE A 11 16.466 6.760 5.737 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.876 5.103 6.002 1.00 0.00 H new ATOM 134 N LYS A 12 12.629 6.022 2.517 1.00 0.00 N ATOM 135 CA LYS A 12 12.204 4.999 1.570 1.00 0.00 C ATOM 136 C LYS A 12 13.175 4.906 0.397 1.00 0.00 C ATOM 137 O LYS A 12 13.872 5.868 0.079 1.00 0.00 O ATOM 138 CB LYS A 12 10.795 5.305 1.056 1.00 0.00 C ATOM 139 CG LYS A 12 10.736 6.497 0.115 1.00 0.00 C ATOM 140 CD LYS A 12 9.350 7.118 0.090 1.00 0.00 C ATOM 141 CE LYS A 12 9.090 7.847 -1.220 1.00 0.00 C ATOM 142 NZ LYS A 12 7.646 7.841 -1.580 1.00 0.00 N ATOM 0 H LYS A 12 13.440 6.562 2.217 1.00 0.00 H new ATOM 0 HA LYS A 12 12.195 4.040 2.089 1.00 0.00 H new ATOM 0 HB2 LYS A 12 10.407 4.426 0.541 1.00 0.00 H new ATOM 0 HB3 LYS A 12 10.140 5.491 1.907 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.465 7.245 0.427 1.00 0.00 H new ATOM 0 HG3 LYS A 12 11.013 6.182 -0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 12 8.599 6.341 0.230 1.00 0.00 H new ATOM 0 HD3 LYS A 12 9.247 7.815 0.922 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.440 8.876 -1.139 1.00 0.00 H new ATOM 0 HE3 LYS A 12 9.665 7.377 -2.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 7.510 8.347 -2.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 7.318 6.859 -1.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 7.100 8.312 -0.831 1.00 0.00 H new ATOM 156 N GLY A 13 13.214 3.741 -0.243 1.00 0.00 N ATOM 157 CA GLY A 13 14.102 3.545 -1.374 1.00 0.00 C ATOM 158 C GLY A 13 14.644 2.132 -1.447 1.00 0.00 C ATOM 159 O GLY A 13 15.769 1.869 -1.021 1.00 0.00 O ATOM 0 H GLY A 13 12.646 2.930 0.002 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.567 3.774 -2.296 1.00 0.00 H new ATOM 0 HA3 GLY A 13 14.933 4.247 -1.305 1.00 0.00 H new ATOM 163 N ARG A 14 13.843 1.220 -1.987 1.00 0.00 N ATOM 164 CA ARG A 14 14.249 -0.175 -2.112 1.00 0.00 C ATOM 165 C ARG A 14 13.522 -0.851 -3.271 1.00 0.00 C ATOM 166 O ARG A 14 12.411 -0.464 -3.632 1.00 0.00 O ATOM 167 CB ARG A 14 13.967 -0.929 -0.810 1.00 0.00 C ATOM 168 CG ARG A 14 12.490 -1.204 -0.574 1.00 0.00 C ATOM 169 CD ARG A 14 12.284 -2.469 0.245 1.00 0.00 C ATOM 170 NE ARG A 14 12.385 -2.215 1.679 1.00 0.00 N ATOM 171 CZ ARG A 14 12.425 -3.178 2.594 1.00 0.00 C ATOM 172 NH1 ARG A 14 12.373 -4.450 2.227 1.00 0.00 N ATOM 173 NH2 ARG A 14 12.516 -2.867 3.881 1.00 0.00 N ATOM 0 H ARG A 14 12.909 1.421 -2.345 1.00 0.00 H new ATOM 0 HA ARG A 14 15.320 -0.199 -2.314 1.00 0.00 H new ATOM 0 HB2 ARG A 14 14.507 -1.876 -0.824 1.00 0.00 H new ATOM 0 HB3 ARG A 14 14.359 -0.351 0.027 1.00 0.00 H new ATOM 0 HG2 ARG A 14 12.039 -0.357 -0.057 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.979 -1.302 -1.532 1.00 0.00 H new ATOM 0 HD2 ARG A 14 11.305 -2.891 0.020 1.00 0.00 H new ATOM 0 HD3 ARG A 14 13.026 -3.213 -0.044 1.00 0.00 H new ATOM 0 HE ARG A 14 12.427 -1.246 1.996 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.302 -4.693 1.239 1.00 0.00 H new ATOM 0 HH12 ARG A 14 12.404 -5.186 2.932 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.555 -1.889 4.168 1.00 0.00 H new ATOM 0 HH22 ARG A 14 12.547 -3.606 4.583 1.00 0.00 H new ATOM 187 N LYS A 15 14.158 -1.863 -3.851 1.00 0.00 N ATOM 188 CA LYS A 15 13.574 -2.595 -4.969 1.00 0.00 C ATOM 189 C LYS A 15 12.454 -3.514 -4.492 1.00 0.00 C ATOM 190 O LYS A 15 12.658 -4.713 -4.301 1.00 0.00 O ATOM 191 CB LYS A 15 14.649 -3.414 -5.686 1.00 0.00 C ATOM 192 CG LYS A 15 15.345 -2.658 -6.804 1.00 0.00 C ATOM 193 CD LYS A 15 15.954 -3.606 -7.824 1.00 0.00 C ATOM 194 CE LYS A 15 16.237 -2.900 -9.142 1.00 0.00 C ATOM 195 NZ LYS A 15 15.017 -2.795 -9.988 1.00 0.00 N ATOM 0 H LYS A 15 15.079 -2.195 -3.565 1.00 0.00 H new ATOM 0 HA LYS A 15 13.153 -1.870 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS A 15 15.394 -3.736 -4.958 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.194 -4.315 -6.097 1.00 0.00 H new ATOM 0 HG2 LYS A 15 14.631 -2.000 -7.299 1.00 0.00 H new ATOM 0 HG3 LYS A 15 16.126 -2.023 -6.384 1.00 0.00 H new ATOM 0 HD2 LYS A 15 16.880 -4.023 -7.427 1.00 0.00 H new ATOM 0 HD3 LYS A 15 15.276 -4.442 -7.996 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.628 -1.902 -8.943 1.00 0.00 H new ATOM 0 HE3 LYS A 15 17.010 -3.442 -9.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.252 -2.308 -10.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 14.658 -3.748 -10.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 14.288 -2.255 -9.480 1.00 0.00 H new ATOM 209 N THR A 16 11.267 -2.944 -4.302 1.00 0.00 N ATOM 210 CA THR A 16 10.115 -3.712 -3.848 1.00 0.00 C ATOM 211 C THR A 16 10.043 -5.064 -4.549 1.00 0.00 C ATOM 212 O THR A 16 10.425 -5.191 -5.714 1.00 0.00 O ATOM 213 CB THR A 16 8.799 -2.948 -4.094 1.00 0.00 C ATOM 214 OG1 THR A 16 9.019 -1.540 -3.966 1.00 0.00 O ATOM 215 CG2 THR A 16 7.725 -3.392 -3.112 1.00 0.00 C ATOM 0 H THR A 16 11.079 -1.953 -4.456 1.00 0.00 H new ATOM 0 HA THR A 16 10.242 -3.868 -2.777 1.00 0.00 H new ATOM 0 HB THR A 16 8.458 -3.170 -5.105 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.179 -1.062 -4.125 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.805 -2.840 -3.304 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.539 -4.459 -3.234 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.060 -3.196 -2.093 1.00 0.00 H new ATOM 223 N LEU A 17 9.553 -6.070 -3.834 1.00 0.00 N ATOM 224 CA LEU A 17 9.431 -7.414 -4.389 1.00 0.00 C ATOM 225 C LEU A 17 8.029 -7.648 -4.946 1.00 0.00 C ATOM 226 O LEU A 17 7.103 -7.969 -4.202 1.00 0.00 O ATOM 227 CB LEU A 17 9.749 -8.459 -3.318 1.00 0.00 C ATOM 228 CG LEU A 17 10.166 -9.838 -3.831 1.00 0.00 C ATOM 229 CD1 LEU A 17 9.401 -10.193 -5.095 1.00 0.00 C ATOM 230 CD2 LEU A 17 11.667 -9.881 -4.082 1.00 0.00 C ATOM 0 H LEU A 17 9.234 -5.981 -2.869 1.00 0.00 H new ATOM 0 HA LEU A 17 10.146 -7.511 -5.206 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.548 -8.071 -2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.871 -8.579 -2.684 1.00 0.00 H new ATOM 0 HG LEU A 17 9.924 -10.577 -3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 17 9.712 -11.178 -5.444 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.332 -10.204 -4.882 1.00 0.00 H new ATOM 0 HD13 LEU A 17 9.609 -9.452 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.947 -10.869 -4.447 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.933 -9.131 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.197 -9.674 -3.153 1.00 0.00 H new ATOM 242 N ALA A 18 7.885 -7.488 -6.256 1.00 0.00 N ATOM 243 CA ALA A 18 6.598 -7.687 -6.913 1.00 0.00 C ATOM 244 C ALA A 18 6.730 -7.562 -8.427 1.00 0.00 C ATOM 245 O ALA A 18 7.642 -6.905 -8.930 1.00 0.00 O ATOM 246 CB ALA A 18 5.577 -6.689 -6.385 1.00 0.00 C ATOM 0 H ALA A 18 8.643 -7.221 -6.884 1.00 0.00 H new ATOM 0 HA ALA A 18 6.254 -8.696 -6.687 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.621 -6.848 -6.884 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.454 -6.828 -5.311 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.924 -5.675 -6.582 1.00 0.00 H new ATOM 252 N THR A 19 5.813 -8.197 -9.150 1.00 0.00 N ATOM 253 CA THR A 19 5.826 -8.159 -10.607 1.00 0.00 C ATOM 254 C THR A 19 5.665 -6.732 -11.121 1.00 0.00 C ATOM 255 O THR A 19 5.198 -5.840 -10.411 1.00 0.00 O ATOM 256 CB THR A 19 4.711 -9.037 -11.203 1.00 0.00 C ATOM 257 OG1 THR A 19 3.595 -9.086 -10.307 1.00 0.00 O ATOM 258 CG2 THR A 19 5.216 -10.447 -11.469 1.00 0.00 C ATOM 0 H THR A 19 5.051 -8.744 -8.750 1.00 0.00 H new ATOM 0 HA THR A 19 6.793 -8.550 -10.924 1.00 0.00 H new ATOM 0 HB THR A 19 4.398 -8.596 -12.149 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.889 -9.645 -10.694 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.410 -11.049 -11.890 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.047 -10.409 -12.174 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.553 -10.895 -10.534 1.00 0.00 H new ATOM 266 N PRO A 20 6.056 -6.509 -12.384 1.00 0.00 N ATOM 267 CA PRO A 20 5.962 -5.193 -13.022 1.00 0.00 C ATOM 268 C PRO A 20 4.519 -4.782 -13.293 1.00 0.00 C ATOM 269 O PRO A 20 4.148 -3.624 -13.106 1.00 0.00 O ATOM 270 CB PRO A 20 6.722 -5.381 -14.337 1.00 0.00 C ATOM 271 CG PRO A 20 6.625 -6.839 -14.625 1.00 0.00 C ATOM 272 CD PRO A 20 6.621 -7.526 -13.287 1.00 0.00 C ATOM 0 HA PRO A 20 6.367 -4.403 -12.390 1.00 0.00 H new ATOM 0 HB2 PRO A 20 6.280 -4.789 -15.138 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.761 -5.064 -14.243 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.717 -7.067 -15.183 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.466 -7.173 -15.233 1.00 0.00 H new ATOM 0 HD2 PRO A 20 6.015 -8.432 -13.302 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.626 -7.820 -12.983 1.00 0.00 H new ATOM 280 N ALA A 21 3.710 -5.739 -13.735 1.00 0.00 N ATOM 281 CA ALA A 21 2.306 -5.476 -14.030 1.00 0.00 C ATOM 282 C ALA A 21 1.560 -5.016 -12.783 1.00 0.00 C ATOM 283 O ALA A 21 0.684 -4.153 -12.853 1.00 0.00 O ATOM 284 CB ALA A 21 1.648 -6.718 -14.613 1.00 0.00 C ATOM 0 H ALA A 21 4.002 -6.703 -13.897 1.00 0.00 H new ATOM 0 HA ALA A 21 2.259 -4.673 -14.766 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.600 -6.508 -14.828 1.00 0.00 H new ATOM 0 HB2 ALA A 21 2.158 -7.002 -15.534 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.714 -7.536 -13.895 1.00 0.00 H new ATOM 290 N VAL A 22 1.912 -5.598 -11.640 1.00 0.00 N ATOM 291 CA VAL A 22 1.275 -5.247 -10.376 1.00 0.00 C ATOM 292 C VAL A 22 1.810 -3.925 -9.839 1.00 0.00 C ATOM 293 O VAL A 22 1.057 -3.107 -9.311 1.00 0.00 O ATOM 294 CB VAL A 22 1.490 -6.343 -9.316 1.00 0.00 C ATOM 295 CG1 VAL A 22 1.084 -5.842 -7.938 1.00 0.00 C ATOM 296 CG2 VAL A 22 0.716 -7.600 -9.684 1.00 0.00 C ATOM 0 H VAL A 22 2.634 -6.314 -11.564 1.00 0.00 H new ATOM 0 HA VAL A 22 0.208 -5.149 -10.576 1.00 0.00 H new ATOM 0 HB VAL A 22 2.551 -6.592 -9.288 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.243 -6.631 -7.203 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.687 -4.973 -7.675 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.030 -5.563 -7.948 1.00 0.00 H new ATOM 0 HG21 VAL A 22 0.880 -8.364 -8.924 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.347 -7.368 -9.743 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.060 -7.970 -10.650 1.00 0.00 H new ATOM 306 N ARG A 23 3.116 -3.720 -9.980 1.00 0.00 N ATOM 307 CA ARG A 23 3.752 -2.496 -9.509 1.00 0.00 C ATOM 308 C ARG A 23 3.037 -1.265 -10.058 1.00 0.00 C ATOM 309 O ARG A 23 2.960 -0.232 -9.393 1.00 0.00 O ATOM 310 CB ARG A 23 5.225 -2.470 -9.923 1.00 0.00 C ATOM 311 CG ARG A 23 6.121 -3.321 -9.037 1.00 0.00 C ATOM 312 CD ARG A 23 7.511 -3.475 -9.635 1.00 0.00 C ATOM 313 NE ARG A 23 8.238 -2.209 -9.665 1.00 0.00 N ATOM 314 CZ ARG A 23 9.520 -2.106 -9.995 1.00 0.00 C ATOM 315 NH1 ARG A 23 10.214 -3.189 -10.322 1.00 0.00 N ATOM 316 NH2 ARG A 23 10.112 -0.918 -10.000 1.00 0.00 N ATOM 0 H ARG A 23 3.754 -4.386 -10.417 1.00 0.00 H new ATOM 0 HA ARG A 23 3.686 -2.478 -8.421 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.311 -2.817 -10.953 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.581 -1.440 -9.903 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.197 -2.865 -8.050 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.671 -4.305 -8.901 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.076 -4.204 -9.054 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.428 -3.869 -10.648 1.00 0.00 H new ATOM 0 HE ARG A 23 7.733 -1.357 -9.419 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.763 -4.104 -10.320 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.199 -3.107 -10.575 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.582 -0.083 -9.750 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.097 -0.840 -10.254 1.00 0.00 H new ATOM 330 N ARG A 24 2.518 -1.383 -11.276 1.00 0.00 N ATOM 331 CA ARG A 24 1.810 -0.280 -11.915 1.00 0.00 C ATOM 332 C ARG A 24 0.432 -0.083 -11.292 1.00 0.00 C ATOM 333 O ARG A 24 0.047 1.034 -10.948 1.00 0.00 O ATOM 334 CB ARG A 24 1.672 -0.536 -13.416 1.00 0.00 C ATOM 335 CG ARG A 24 0.596 0.306 -14.081 1.00 0.00 C ATOM 336 CD ARG A 24 0.830 0.429 -15.579 1.00 0.00 C ATOM 337 NE ARG A 24 1.651 1.589 -15.911 1.00 0.00 N ATOM 338 CZ ARG A 24 2.380 1.681 -17.018 1.00 0.00 C ATOM 339 NH1 ARG A 24 2.386 0.688 -17.896 1.00 0.00 N ATOM 340 NH2 ARG A 24 3.102 2.770 -17.250 1.00 0.00 N ATOM 0 H ARG A 24 2.575 -2.231 -11.840 1.00 0.00 H new ATOM 0 HA ARG A 24 2.391 0.629 -11.761 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.628 -0.336 -13.899 1.00 0.00 H new ATOM 0 HB3 ARG A 24 1.448 -1.590 -13.577 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.381 -0.142 -13.900 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.580 1.299 -13.632 1.00 0.00 H new ATOM 0 HD2 ARG A 24 1.315 -0.475 -15.945 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -0.129 0.506 -16.091 1.00 0.00 H new ATOM 0 HE ARG A 24 1.666 2.372 -15.257 1.00 0.00 H new ATOM 0 HH11 ARG A 24 1.830 -0.149 -17.723 1.00 0.00 H new ATOM 0 HH12 ARG A 24 2.947 0.761 -18.745 1.00 0.00 H new ATOM 0 HH21 ARG A 24 3.098 3.537 -16.578 1.00 0.00 H new ATOM 0 HH22 ARG A 24 3.661 2.840 -18.100 1.00 0.00 H new ATOM 354 N LEU A 25 -0.308 -1.178 -11.151 1.00 0.00 N ATOM 355 CA LEU A 25 -1.646 -1.127 -10.570 1.00 0.00 C ATOM 356 C LEU A 25 -1.714 -0.094 -9.449 1.00 0.00 C ATOM 357 O LEU A 25 -2.761 0.503 -9.206 1.00 0.00 O ATOM 358 CB LEU A 25 -2.043 -2.504 -10.035 1.00 0.00 C ATOM 359 CG LEU A 25 -3.539 -2.734 -9.817 1.00 0.00 C ATOM 360 CD1 LEU A 25 -4.303 -2.542 -11.118 1.00 0.00 C ATOM 361 CD2 LEU A 25 -3.788 -4.124 -9.252 1.00 0.00 C ATOM 0 H LEU A 25 -0.005 -2.111 -11.431 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.345 -0.833 -11.353 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.677 -3.261 -10.729 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.529 -2.665 -9.087 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.899 -2.000 -9.096 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.366 -2.710 -10.944 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.151 -1.526 -11.483 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.941 -3.252 -11.861 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.858 -4.270 -9.103 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.413 -4.873 -9.950 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.272 -4.227 -8.298 1.00 0.00 H new ATOM 373 N ALA A 26 -0.589 0.111 -8.773 1.00 0.00 N ATOM 374 CA ALA A 26 -0.521 1.075 -7.680 1.00 0.00 C ATOM 375 C ALA A 26 -0.252 2.480 -8.206 1.00 0.00 C ATOM 376 O ALA A 26 -0.897 3.443 -7.791 1.00 0.00 O ATOM 377 CB ALA A 26 0.555 0.667 -6.684 1.00 0.00 C ATOM 0 H ALA A 26 0.287 -0.376 -8.962 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.486 1.083 -7.173 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.595 1.395 -5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.320 -0.317 -6.277 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.521 0.630 -7.187 1.00 0.00 H new ATOM 383 N MET A 27 0.706 2.593 -9.120 1.00 0.00 N ATOM 384 CA MET A 27 1.060 3.883 -9.702 1.00 0.00 C ATOM 385 C MET A 27 -0.158 4.541 -10.343 1.00 0.00 C ATOM 386 O MET A 27 -0.188 5.757 -10.534 1.00 0.00 O ATOM 387 CB MET A 27 2.168 3.710 -10.743 1.00 0.00 C ATOM 388 CG MET A 27 1.648 3.474 -12.151 1.00 0.00 C ATOM 389 SD MET A 27 2.973 3.237 -13.350 1.00 0.00 S ATOM 390 CE MET A 27 2.671 4.608 -14.463 1.00 0.00 C ATOM 0 H MET A 27 1.251 1.807 -9.474 1.00 0.00 H new ATOM 0 HA MET A 27 1.422 4.529 -8.902 1.00 0.00 H new ATOM 0 HB2 MET A 27 2.798 4.599 -10.742 1.00 0.00 H new ATOM 0 HB3 MET A 27 2.800 2.871 -10.453 1.00 0.00 H new ATOM 0 HG2 MET A 27 1.001 2.597 -12.153 1.00 0.00 H new ATOM 0 HG3 MET A 27 1.036 4.323 -12.455 1.00 0.00 H new ATOM 0 HE1 MET A 27 3.551 4.773 -15.084 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.816 4.379 -15.099 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.462 5.507 -13.884 1.00 0.00 H new ATOM 400 N GLU A 28 -1.158 3.731 -10.675 1.00 0.00 N ATOM 401 CA GLU A 28 -2.377 4.237 -11.296 1.00 0.00 C ATOM 402 C GLU A 28 -3.437 4.546 -10.243 1.00 0.00 C ATOM 403 O GLU A 28 -4.339 5.348 -10.472 1.00 0.00 O ATOM 404 CB GLU A 28 -2.922 3.221 -12.302 1.00 0.00 C ATOM 405 CG GLU A 28 -2.010 2.996 -13.495 1.00 0.00 C ATOM 406 CD GLU A 28 -2.163 4.068 -14.558 1.00 0.00 C ATOM 407 OE1 GLU A 28 -2.532 5.206 -14.204 1.00 0.00 O ATOM 408 OE2 GLU A 28 -1.913 3.765 -15.744 1.00 0.00 O ATOM 0 H GLU A 28 -1.148 2.722 -10.525 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.131 5.161 -11.820 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.083 2.270 -11.794 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -3.895 3.561 -12.658 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.974 2.971 -13.156 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.225 2.022 -13.933 1.00 0.00 H new ATOM 415 N ASN A 29 -3.318 3.900 -9.087 1.00 0.00 N ATOM 416 CA ASN A 29 -4.266 4.105 -7.997 1.00 0.00 C ATOM 417 C ASN A 29 -3.614 4.860 -6.843 1.00 0.00 C ATOM 418 O ASN A 29 -4.151 4.906 -5.736 1.00 0.00 O ATOM 419 CB ASN A 29 -4.805 2.761 -7.504 1.00 0.00 C ATOM 420 CG ASN A 29 -5.849 2.179 -8.436 1.00 0.00 C ATOM 421 OD1 ASN A 29 -7.043 2.440 -8.290 1.00 0.00 O ATOM 422 ND2 ASN A 29 -5.403 1.384 -9.402 1.00 0.00 N ATOM 0 H ASN A 29 -2.576 3.231 -8.881 1.00 0.00 H new ATOM 0 HA ASN A 29 -5.094 4.704 -8.376 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -3.979 2.057 -7.403 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.238 2.888 -6.512 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -6.059 0.963 -10.060 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.404 1.195 -9.486 1.00 0.00 H new ATOM 429 N ASN A 30 -2.454 5.450 -7.109 1.00 0.00 N ATOM 430 CA ASN A 30 -1.727 6.203 -6.092 1.00 0.00 C ATOM 431 C ASN A 30 -1.617 5.402 -4.799 1.00 0.00 C ATOM 432 O ASN A 30 -1.980 5.886 -3.725 1.00 0.00 O ATOM 433 CB ASN A 30 -2.425 7.537 -5.822 1.00 0.00 C ATOM 434 CG ASN A 30 -2.212 8.539 -6.941 1.00 0.00 C ATOM 435 OD1 ASN A 30 -2.858 8.465 -7.987 1.00 0.00 O ATOM 436 ND2 ASN A 30 -1.301 9.482 -6.726 1.00 0.00 N ATOM 0 H ASN A 30 -1.996 5.422 -8.020 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.721 6.396 -6.465 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.493 7.365 -5.691 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -2.053 7.956 -4.887 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -1.113 10.183 -7.443 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -0.789 9.505 -5.844 1.00 0.00 H new ATOM 443 N ILE A 31 -1.114 4.178 -4.908 1.00 0.00 N ATOM 444 CA ILE A 31 -0.954 3.311 -3.746 1.00 0.00 C ATOM 445 C ILE A 31 0.518 3.142 -3.386 1.00 0.00 C ATOM 446 O ILE A 31 1.378 3.057 -4.263 1.00 0.00 O ATOM 447 CB ILE A 31 -1.575 1.924 -3.990 1.00 0.00 C ATOM 448 CG1 ILE A 31 -3.089 2.045 -4.184 1.00 0.00 C ATOM 449 CG2 ILE A 31 -1.257 0.990 -2.831 1.00 0.00 C ATOM 450 CD1 ILE A 31 -3.771 0.722 -4.453 1.00 0.00 C ATOM 0 H ILE A 31 -0.810 3.763 -5.789 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.475 3.792 -2.918 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.144 1.504 -4.899 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.526 2.496 -3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.288 2.723 -5.014 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.703 0.013 -3.018 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.176 0.883 -2.736 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.664 1.404 -1.908 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.841 0.884 -4.580 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.361 0.279 -5.360 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -3.603 0.049 -3.613 1.00 0.00 H new ATOM 462 N LYS A 32 0.801 3.090 -2.089 1.00 0.00 N ATOM 463 CA LYS A 32 2.169 2.926 -1.610 1.00 0.00 C ATOM 464 C LYS A 32 2.523 1.449 -1.468 1.00 0.00 C ATOM 465 O LYS A 32 2.274 0.838 -0.427 1.00 0.00 O ATOM 466 CB LYS A 32 2.349 3.637 -0.266 1.00 0.00 C ATOM 467 CG LYS A 32 2.538 5.138 -0.393 1.00 0.00 C ATOM 468 CD LYS A 32 1.209 5.873 -0.357 1.00 0.00 C ATOM 469 CE LYS A 32 0.629 6.045 -1.752 1.00 0.00 C ATOM 470 NZ LYS A 32 -0.193 7.282 -1.862 1.00 0.00 N ATOM 0 H LYS A 32 0.101 3.159 -1.350 1.00 0.00 H new ATOM 0 HA LYS A 32 2.840 3.373 -2.343 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.478 3.441 0.359 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.212 3.213 0.247 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.174 5.495 0.417 1.00 0.00 H new ATOM 0 HG3 LYS A 32 3.054 5.363 -1.327 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.504 5.322 0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.345 6.851 0.105 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.439 6.081 -2.480 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.016 5.178 -2.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.984 7.116 -2.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.566 7.535 -0.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.397 8.060 -2.221 1.00 0.00 H new ATOM 484 N LEU A 33 3.105 0.881 -2.518 1.00 0.00 N ATOM 485 CA LEU A 33 3.494 -0.525 -2.509 1.00 0.00 C ATOM 486 C LEU A 33 3.944 -0.956 -1.117 1.00 0.00 C ATOM 487 O LEU A 33 3.382 -1.882 -0.532 1.00 0.00 O ATOM 488 CB LEU A 33 4.617 -0.769 -3.520 1.00 0.00 C ATOM 489 CG LEU A 33 4.177 -1.170 -4.928 1.00 0.00 C ATOM 490 CD1 LEU A 33 5.370 -1.205 -5.870 1.00 0.00 C ATOM 491 CD2 LEU A 33 3.475 -2.520 -4.903 1.00 0.00 C ATOM 0 H LEU A 33 3.318 1.372 -3.386 1.00 0.00 H new ATOM 0 HA LEU A 33 2.625 -1.120 -2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.216 0.138 -3.593 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.268 -1.550 -3.128 1.00 0.00 H new ATOM 0 HG LEU A 33 3.473 -0.423 -5.294 1.00 0.00 H new ATOM 0 HD11 LEU A 33 5.038 -1.492 -6.868 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.830 -0.218 -5.911 1.00 0.00 H new ATOM 0 HD13 LEU A 33 6.099 -1.930 -5.507 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.169 -2.790 -5.914 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.157 -3.277 -4.516 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.596 -2.461 -4.261 1.00 0.00 H new ATOM 503 N SER A 34 4.959 -0.278 -0.592 1.00 0.00 N ATOM 504 CA SER A 34 5.486 -0.592 0.731 1.00 0.00 C ATOM 505 C SER A 34 4.352 -0.797 1.732 1.00 0.00 C ATOM 506 O SER A 34 4.377 -1.732 2.531 1.00 0.00 O ATOM 507 CB SER A 34 6.412 0.525 1.213 1.00 0.00 C ATOM 508 OG SER A 34 7.132 0.129 2.367 1.00 0.00 O ATOM 0 H SER A 34 5.433 0.493 -1.063 1.00 0.00 H new ATOM 0 HA SER A 34 6.055 -1.519 0.658 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.110 0.791 0.419 1.00 0.00 H new ATOM 0 HB3 SER A 34 5.826 1.417 1.435 1.00 0.00 H new ATOM 0 HG SER A 34 7.718 0.860 2.654 1.00 0.00 H new ATOM 514 N GLU A 35 3.361 0.086 1.682 1.00 0.00 N ATOM 515 CA GLU A 35 2.219 0.004 2.585 1.00 0.00 C ATOM 516 C GLU A 35 1.356 -1.213 2.261 1.00 0.00 C ATOM 517 O GLU A 35 0.714 -1.785 3.142 1.00 0.00 O ATOM 518 CB GLU A 35 1.376 1.278 2.495 1.00 0.00 C ATOM 519 CG GLU A 35 2.145 2.542 2.841 1.00 0.00 C ATOM 520 CD GLU A 35 2.705 2.518 4.250 1.00 0.00 C ATOM 521 OE1 GLU A 35 1.917 2.684 5.205 1.00 0.00 O ATOM 522 OE2 GLU A 35 3.931 2.331 4.398 1.00 0.00 O ATOM 0 H GLU A 35 3.325 0.866 1.026 1.00 0.00 H new ATOM 0 HA GLU A 35 2.599 -0.101 3.601 1.00 0.00 H new ATOM 0 HB2 GLU A 35 0.978 1.370 1.484 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.522 1.187 3.166 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.962 2.671 2.132 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.488 3.404 2.730 1.00 0.00 H new ATOM 529 N VAL A 36 1.346 -1.603 0.991 1.00 0.00 N ATOM 530 CA VAL A 36 0.563 -2.751 0.549 1.00 0.00 C ATOM 531 C VAL A 36 1.150 -4.053 1.084 1.00 0.00 C ATOM 532 O VAL A 36 2.093 -4.602 0.515 1.00 0.00 O ATOM 533 CB VAL A 36 0.493 -2.826 -0.988 1.00 0.00 C ATOM 534 CG1 VAL A 36 -0.423 -3.958 -1.426 1.00 0.00 C ATOM 535 CG2 VAL A 36 0.028 -1.498 -1.565 1.00 0.00 C ATOM 0 H VAL A 36 1.872 -1.141 0.249 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.444 -2.619 0.944 1.00 0.00 H new ATOM 0 HB VAL A 36 1.493 -3.032 -1.371 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.460 -3.996 -2.515 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.041 -4.904 -1.043 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.426 -3.787 -1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.016 -1.569 -2.652 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.962 -1.259 -1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.728 -0.713 -1.281 1.00 0.00 H new ATOM 545 N VAL A 37 0.584 -4.543 2.183 1.00 0.00 N ATOM 546 CA VAL A 37 1.048 -5.782 2.795 1.00 0.00 C ATOM 547 C VAL A 37 1.046 -6.927 1.788 1.00 0.00 C ATOM 548 O VAL A 37 -0.005 -7.469 1.451 1.00 0.00 O ATOM 549 CB VAL A 37 0.175 -6.173 4.003 1.00 0.00 C ATOM 550 CG1 VAL A 37 -1.277 -6.335 3.582 1.00 0.00 C ATOM 551 CG2 VAL A 37 0.698 -7.449 4.646 1.00 0.00 C ATOM 0 H VAL A 37 -0.197 -4.100 2.667 1.00 0.00 H new ATOM 0 HA VAL A 37 2.068 -5.604 3.136 1.00 0.00 H new ATOM 0 HB VAL A 37 0.227 -5.373 4.742 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.878 -6.611 4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.644 -5.395 3.171 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.351 -7.116 2.825 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.070 -7.711 5.498 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.677 -8.259 3.917 1.00 0.00 H new ATOM 0 HG23 VAL A 37 1.722 -7.292 4.985 1.00 0.00 H new ATOM 561 N GLY A 38 2.233 -7.290 1.311 1.00 0.00 N ATOM 562 CA GLY A 38 2.346 -8.370 0.348 1.00 0.00 C ATOM 563 C GLY A 38 1.913 -9.705 0.919 1.00 0.00 C ATOM 564 O GLY A 38 2.074 -9.958 2.114 1.00 0.00 O ATOM 0 H GLY A 38 3.118 -6.856 1.574 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.738 -8.138 -0.526 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.379 -8.442 0.007 1.00 0.00 H new ATOM 568 N SER A 39 1.363 -10.563 0.066 1.00 0.00 N ATOM 569 CA SER A 39 0.902 -11.878 0.494 1.00 0.00 C ATOM 570 C SER A 39 1.960 -12.942 0.222 1.00 0.00 C ATOM 571 O SER A 39 2.221 -13.805 1.059 1.00 0.00 O ATOM 572 CB SER A 39 -0.401 -12.244 -0.221 1.00 0.00 C ATOM 573 OG SER A 39 -1.508 -11.580 0.363 1.00 0.00 O ATOM 0 H SER A 39 1.226 -10.371 -0.926 1.00 0.00 H new ATOM 0 HA SER A 39 0.720 -11.838 1.568 1.00 0.00 H new ATOM 0 HB2 SER A 39 -0.328 -11.977 -1.275 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.554 -13.322 -0.175 1.00 0.00 H new ATOM 0 HG SER A 39 -1.402 -10.612 0.257 1.00 0.00 H new ATOM 579 N GLY A 40 2.569 -12.872 -0.958 1.00 0.00 N ATOM 580 CA GLY A 40 3.595 -13.833 -1.322 1.00 0.00 C ATOM 581 C GLY A 40 4.479 -14.210 -0.151 1.00 0.00 C ATOM 582 O GLY A 40 4.599 -13.454 0.815 1.00 0.00 O ATOM 0 H GLY A 40 2.370 -12.167 -1.668 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.122 -14.731 -1.720 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.211 -13.417 -2.119 1.00 0.00 H new ATOM 586 N LYS A 41 5.099 -15.382 -0.232 1.00 0.00 N ATOM 587 CA LYS A 41 5.976 -15.859 0.830 1.00 0.00 C ATOM 588 C LYS A 41 7.074 -14.842 1.127 1.00 0.00 C ATOM 589 O LYS A 41 7.210 -14.373 2.257 1.00 0.00 O ATOM 590 CB LYS A 41 6.602 -17.199 0.438 1.00 0.00 C ATOM 591 CG LYS A 41 7.096 -18.010 1.625 1.00 0.00 C ATOM 592 CD LYS A 41 5.941 -18.625 2.398 1.00 0.00 C ATOM 593 CE LYS A 41 6.430 -19.354 3.641 1.00 0.00 C ATOM 594 NZ LYS A 41 5.345 -20.152 4.278 1.00 0.00 N ATOM 0 H LYS A 41 5.010 -16.020 -1.023 1.00 0.00 H new ATOM 0 HA LYS A 41 5.376 -15.993 1.730 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.867 -17.787 -0.112 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.436 -17.017 -0.239 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.763 -18.799 1.276 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.679 -17.370 2.287 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.237 -17.844 2.686 1.00 0.00 H new ATOM 0 HD3 LYS A 41 5.401 -19.320 1.756 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.257 -20.012 3.374 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.817 -18.630 4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.717 -20.634 5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.567 -19.520 4.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 4.992 -20.860 3.603 1.00 0.00 H new ATOM 608 N ASP A 42 7.853 -14.503 0.105 1.00 0.00 N ATOM 609 CA ASP A 42 8.936 -13.539 0.257 1.00 0.00 C ATOM 610 C ASP A 42 8.404 -12.110 0.205 1.00 0.00 C ATOM 611 O ASP A 42 8.943 -11.261 -0.503 1.00 0.00 O ATOM 612 CB ASP A 42 9.987 -13.744 -0.837 1.00 0.00 C ATOM 613 CG ASP A 42 10.892 -14.927 -0.554 1.00 0.00 C ATOM 614 OD1 ASP A 42 10.374 -16.056 -0.433 1.00 0.00 O ATOM 615 OD2 ASP A 42 12.120 -14.722 -0.454 1.00 0.00 O ATOM 0 H ASP A 42 7.754 -14.882 -0.837 1.00 0.00 H new ATOM 0 HA ASP A 42 9.398 -13.700 1.231 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.487 -13.893 -1.794 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.591 -12.842 -0.930 1.00 0.00 H new ATOM 620 N GLY A 43 7.341 -11.853 0.961 1.00 0.00 N ATOM 621 CA GLY A 43 6.751 -10.527 0.987 1.00 0.00 C ATOM 622 C GLY A 43 6.383 -10.030 -0.397 1.00 0.00 C ATOM 623 O GLY A 43 6.158 -8.835 -0.595 1.00 0.00 O ATOM 0 H GLY A 43 6.878 -12.540 1.556 1.00 0.00 H new ATOM 0 HA2 GLY A 43 5.859 -10.541 1.614 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.452 -9.830 1.446 1.00 0.00 H new ATOM 627 N ARG A 44 6.324 -10.946 -1.357 1.00 0.00 N ATOM 628 CA ARG A 44 5.984 -10.593 -2.730 1.00 0.00 C ATOM 629 C ARG A 44 4.534 -10.131 -2.829 1.00 0.00 C ATOM 630 O ARG A 44 3.606 -10.917 -2.630 1.00 0.00 O ATOM 631 CB ARG A 44 6.214 -11.788 -3.658 1.00 0.00 C ATOM 632 CG ARG A 44 5.587 -11.621 -5.032 1.00 0.00 C ATOM 633 CD ARG A 44 5.522 -12.944 -5.779 1.00 0.00 C ATOM 634 NE ARG A 44 4.684 -12.859 -6.972 1.00 0.00 N ATOM 635 CZ ARG A 44 4.707 -13.754 -7.953 1.00 0.00 C ATOM 636 NH1 ARG A 44 5.522 -14.798 -7.883 1.00 0.00 N ATOM 637 NH2 ARG A 44 3.915 -13.608 -9.007 1.00 0.00 N ATOM 0 H ARG A 44 6.507 -11.939 -1.210 1.00 0.00 H new ATOM 0 HA ARG A 44 6.631 -9.772 -3.038 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.286 -11.946 -3.774 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.808 -12.685 -3.189 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.582 -11.211 -4.927 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.166 -10.902 -5.612 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.529 -13.249 -6.064 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.131 -13.716 -5.116 1.00 0.00 H new ATOM 0 HE ARG A 44 4.045 -12.068 -7.057 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.133 -14.915 -7.075 1.00 0.00 H new ATOM 0 HH12 ARG A 44 5.538 -15.484 -8.638 1.00 0.00 H new ATOM 0 HH21 ARG A 44 3.286 -12.807 -9.065 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.935 -14.297 -9.759 1.00 0.00 H new ATOM 651 N ILE A 45 4.345 -8.852 -3.137 1.00 0.00 N ATOM 652 CA ILE A 45 3.008 -8.286 -3.262 1.00 0.00 C ATOM 653 C ILE A 45 2.331 -8.753 -4.547 1.00 0.00 C ATOM 654 O ILE A 45 2.849 -8.545 -5.645 1.00 0.00 O ATOM 655 CB ILE A 45 3.044 -6.747 -3.245 1.00 0.00 C ATOM 656 CG1 ILE A 45 3.805 -6.247 -2.016 1.00 0.00 C ATOM 657 CG2 ILE A 45 1.632 -6.183 -3.265 1.00 0.00 C ATOM 658 CD1 ILE A 45 4.436 -4.885 -2.208 1.00 0.00 C ATOM 0 H ILE A 45 5.101 -8.188 -3.305 1.00 0.00 H new ATOM 0 HA ILE A 45 2.436 -8.637 -2.404 1.00 0.00 H new ATOM 0 HB ILE A 45 3.565 -6.401 -4.138 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.122 -6.205 -1.168 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.584 -6.967 -1.763 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.675 -5.094 -3.253 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.120 -6.516 -4.168 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.087 -6.535 -2.389 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.959 -4.594 -1.297 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.145 -4.926 -3.035 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.660 -4.153 -2.431 1.00 0.00 H new ATOM 670 N LEU A 46 1.171 -9.384 -4.402 1.00 0.00 N ATOM 671 CA LEU A 46 0.421 -9.880 -5.550 1.00 0.00 C ATOM 672 C LEU A 46 -0.717 -8.930 -5.909 1.00 0.00 C ATOM 673 O LEU A 46 -1.267 -8.248 -5.043 1.00 0.00 O ATOM 674 CB LEU A 46 -0.136 -11.274 -5.258 1.00 0.00 C ATOM 675 CG LEU A 46 0.835 -12.263 -4.612 1.00 0.00 C ATOM 676 CD1 LEU A 46 0.154 -13.601 -4.372 1.00 0.00 C ATOM 677 CD2 LEU A 46 2.072 -12.440 -5.479 1.00 0.00 C ATOM 0 H LEU A 46 0.729 -9.564 -3.500 1.00 0.00 H new ATOM 0 HA LEU A 46 1.102 -9.939 -6.399 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.003 -11.168 -4.605 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -0.492 -11.704 -6.194 1.00 0.00 H new ATOM 0 HG LEU A 46 1.146 -11.859 -3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.861 -14.292 -3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.700 -13.461 -3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.187 -14.011 -5.322 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.752 -13.147 -5.003 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.779 -12.820 -6.458 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.573 -11.479 -5.598 1.00 0.00 H new ATOM 689 N LYS A 47 -1.068 -8.891 -7.190 1.00 0.00 N ATOM 690 CA LYS A 47 -2.143 -8.028 -7.664 1.00 0.00 C ATOM 691 C LYS A 47 -3.250 -7.917 -6.621 1.00 0.00 C ATOM 692 O LYS A 47 -3.733 -6.823 -6.331 1.00 0.00 O ATOM 693 CB LYS A 47 -2.716 -8.567 -8.977 1.00 0.00 C ATOM 694 CG LYS A 47 -3.913 -7.782 -9.485 1.00 0.00 C ATOM 695 CD LYS A 47 -4.419 -8.333 -10.807 1.00 0.00 C ATOM 696 CE LYS A 47 -5.858 -7.914 -11.071 1.00 0.00 C ATOM 697 NZ LYS A 47 -6.832 -8.899 -10.522 1.00 0.00 N ATOM 0 H LYS A 47 -0.623 -9.448 -7.919 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.729 -7.034 -7.836 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -1.935 -8.555 -9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.008 -9.608 -8.836 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.713 -7.816 -8.745 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.637 -6.735 -9.608 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.781 -7.980 -11.618 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.351 -9.421 -10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.039 -6.936 -10.625 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -6.014 -7.808 -12.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.801 -8.578 -10.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.676 -9.826 -10.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.700 -8.981 -9.494 1.00 0.00 H new ATOM 711 N GLU A 48 -3.648 -9.056 -6.061 1.00 0.00 N ATOM 712 CA GLU A 48 -4.698 -9.083 -5.051 1.00 0.00 C ATOM 713 C GLU A 48 -4.421 -8.063 -3.950 1.00 0.00 C ATOM 714 O GLU A 48 -5.210 -7.143 -3.729 1.00 0.00 O ATOM 715 CB GLU A 48 -4.816 -10.484 -4.445 1.00 0.00 C ATOM 716 CG GLU A 48 -4.858 -11.594 -5.481 1.00 0.00 C ATOM 717 CD GLU A 48 -3.475 -12.088 -5.862 1.00 0.00 C ATOM 718 OE1 GLU A 48 -2.948 -12.975 -5.156 1.00 0.00 O ATOM 719 OE2 GLU A 48 -2.922 -11.590 -6.864 1.00 0.00 O ATOM 0 H GLU A 48 -3.259 -9.971 -6.290 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.639 -8.823 -5.535 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -3.972 -10.654 -3.777 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.719 -10.532 -3.836 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.443 -12.427 -5.092 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.370 -11.234 -6.373 1.00 0.00 H new ATOM 726 N ASP A 49 -3.297 -8.233 -3.264 1.00 0.00 N ATOM 727 CA ASP A 49 -2.915 -7.327 -2.187 1.00 0.00 C ATOM 728 C ASP A 49 -3.359 -5.900 -2.494 1.00 0.00 C ATOM 729 O ASP A 49 -3.829 -5.182 -1.611 1.00 0.00 O ATOM 730 CB ASP A 49 -1.402 -7.368 -1.968 1.00 0.00 C ATOM 731 CG ASP A 49 -0.960 -8.609 -1.219 1.00 0.00 C ATOM 732 OD1 ASP A 49 -1.383 -8.784 -0.057 1.00 0.00 O ATOM 733 OD2 ASP A 49 -0.189 -9.406 -1.794 1.00 0.00 O ATOM 0 H ASP A 49 -2.634 -8.989 -3.434 1.00 0.00 H new ATOM 0 HA ASP A 49 -3.414 -7.656 -1.276 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.897 -7.330 -2.933 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.094 -6.482 -1.412 1.00 0.00 H new ATOM 738 N ILE A 50 -3.204 -5.495 -3.750 1.00 0.00 N ATOM 739 CA ILE A 50 -3.588 -4.154 -4.173 1.00 0.00 C ATOM 740 C ILE A 50 -5.072 -3.903 -3.926 1.00 0.00 C ATOM 741 O ILE A 50 -5.452 -2.898 -3.325 1.00 0.00 O ATOM 742 CB ILE A 50 -3.281 -3.924 -5.664 1.00 0.00 C ATOM 743 CG1 ILE A 50 -1.797 -4.170 -5.945 1.00 0.00 C ATOM 744 CG2 ILE A 50 -3.678 -2.514 -6.075 1.00 0.00 C ATOM 745 CD1 ILE A 50 -0.916 -2.986 -5.615 1.00 0.00 C ATOM 0 H ILE A 50 -2.815 -6.076 -4.492 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.000 -3.455 -3.578 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.865 -4.631 -6.254 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.464 -5.032 -5.368 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.672 -4.424 -6.998 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.455 -2.367 -7.132 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.746 -2.373 -5.906 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.118 -1.791 -5.482 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.122 -3.231 -5.839 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.223 -2.127 -6.212 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.012 -2.745 -4.556 1.00 0.00 H new ATOM 757 N LEU A 51 -5.907 -4.826 -4.393 1.00 0.00 N ATOM 758 CA LEU A 51 -7.351 -4.708 -4.222 1.00 0.00 C ATOM 759 C LEU A 51 -7.724 -4.678 -2.743 1.00 0.00 C ATOM 760 O LEU A 51 -8.819 -4.254 -2.377 1.00 0.00 O ATOM 761 CB LEU A 51 -8.063 -5.869 -4.916 1.00 0.00 C ATOM 762 CG LEU A 51 -8.023 -5.864 -6.444 1.00 0.00 C ATOM 763 CD1 LEU A 51 -8.309 -7.254 -6.991 1.00 0.00 C ATOM 764 CD2 LEU A 51 -9.018 -4.855 -7.001 1.00 0.00 C ATOM 0 H LEU A 51 -5.609 -5.664 -4.893 1.00 0.00 H new ATOM 0 HA LEU A 51 -7.670 -3.770 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.622 -6.802 -4.564 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.106 -5.870 -4.600 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.022 -5.570 -6.760 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.276 -7.230 -8.080 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.559 -7.952 -6.620 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.298 -7.577 -6.665 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.976 -4.865 -8.090 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -10.024 -5.118 -6.675 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.768 -3.858 -6.638 1.00 0.00 H new ATOM 776 N ASN A 52 -6.803 -5.129 -1.897 1.00 0.00 N ATOM 777 CA ASN A 52 -7.034 -5.154 -0.457 1.00 0.00 C ATOM 778 C ASN A 52 -6.597 -3.841 0.186 1.00 0.00 C ATOM 779 O ASN A 52 -7.006 -3.518 1.302 1.00 0.00 O ATOM 780 CB ASN A 52 -6.282 -6.323 0.182 1.00 0.00 C ATOM 781 CG ASN A 52 -6.846 -7.669 -0.233 1.00 0.00 C ATOM 782 OD1 ASN A 52 -7.314 -7.837 -1.359 1.00 0.00 O ATOM 783 ND2 ASN A 52 -6.803 -8.634 0.678 1.00 0.00 N ATOM 0 H ASN A 52 -5.890 -5.482 -2.184 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.103 -5.284 -0.288 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -5.230 -6.271 -0.098 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -6.328 -6.232 1.267 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -7.167 -9.561 0.457 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -6.406 -8.449 1.599 1.00 0.00 H new ATOM 790 N TYR A 53 -5.764 -3.089 -0.525 1.00 0.00 N ATOM 791 CA TYR A 53 -5.270 -1.812 -0.023 1.00 0.00 C ATOM 792 C TYR A 53 -6.225 -0.678 -0.384 1.00 0.00 C ATOM 793 O TYR A 53 -6.221 0.378 0.250 1.00 0.00 O ATOM 794 CB TYR A 53 -3.879 -1.523 -0.589 1.00 0.00 C ATOM 795 CG TYR A 53 -3.329 -0.174 -0.183 1.00 0.00 C ATOM 796 CD1 TYR A 53 -3.840 0.999 -0.724 1.00 0.00 C ATOM 797 CD2 TYR A 53 -2.297 -0.073 0.742 1.00 0.00 C ATOM 798 CE1 TYR A 53 -3.340 2.233 -0.356 1.00 0.00 C ATOM 799 CE2 TYR A 53 -1.792 1.157 1.118 1.00 0.00 C ATOM 800 CZ TYR A 53 -2.316 2.307 0.566 1.00 0.00 C ATOM 801 OH TYR A 53 -1.815 3.534 0.936 1.00 0.00 O ATOM 0 H TYR A 53 -5.417 -3.341 -1.450 1.00 0.00 H new ATOM 0 HA TYR A 53 -5.207 -1.877 1.063 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.192 -2.301 -0.257 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -3.920 -1.577 -1.677 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -4.642 0.945 -1.445 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -1.882 -0.972 1.175 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -3.748 3.135 -0.788 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -0.991 1.217 1.840 1.00 0.00 H new ATOM 0 HH TYR A 53 -1.099 3.410 1.594 1.00 0.00 H new ATOM 811 N LEU A 54 -7.043 -0.906 -1.405 1.00 0.00 N ATOM 812 CA LEU A 54 -8.005 0.095 -1.851 1.00 0.00 C ATOM 813 C LEU A 54 -9.318 -0.031 -1.085 1.00 0.00 C ATOM 814 O LEU A 54 -9.930 0.970 -0.715 1.00 0.00 O ATOM 815 CB LEU A 54 -8.262 -0.049 -3.352 1.00 0.00 C ATOM 816 CG LEU A 54 -7.064 0.214 -4.267 1.00 0.00 C ATOM 817 CD1 LEU A 54 -7.173 -0.611 -5.539 1.00 0.00 C ATOM 818 CD2 LEU A 54 -6.960 1.695 -4.598 1.00 0.00 C ATOM 0 H LEU A 54 -7.059 -1.775 -1.939 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.584 1.081 -1.653 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.625 -1.059 -3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.063 0.635 -3.630 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.157 -0.085 -3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.312 -0.411 -6.177 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.197 -1.671 -5.284 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.087 -0.344 -6.069 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.102 1.863 -5.249 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.869 2.019 -5.104 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.834 2.265 -3.678 1.00 0.00 H new ATOM 830 N GLU A 55 -9.743 -1.268 -0.850 1.00 0.00 N ATOM 831 CA GLU A 55 -10.983 -1.525 -0.126 1.00 0.00 C ATOM 832 C GLU A 55 -11.046 -0.699 1.155 1.00 0.00 C ATOM 833 O GLU A 55 -12.126 -0.364 1.639 1.00 0.00 O ATOM 834 CB GLU A 55 -11.105 -3.014 0.207 1.00 0.00 C ATOM 835 CG GLU A 55 -9.859 -3.598 0.850 1.00 0.00 C ATOM 836 CD GLU A 55 -9.884 -3.506 2.363 1.00 0.00 C ATOM 837 OE1 GLU A 55 -10.845 -2.923 2.906 1.00 0.00 O ATOM 838 OE2 GLU A 55 -8.942 -4.018 3.004 1.00 0.00 O ATOM 0 H GLU A 55 -9.248 -2.108 -1.150 1.00 0.00 H new ATOM 0 HA GLU A 55 -11.815 -1.234 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -11.952 -3.159 0.878 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.324 -3.565 -0.707 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.758 -4.643 0.555 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -8.981 -3.074 0.473 1.00 0.00 H new ATOM 845 N LYS A 56 -9.878 -0.374 1.700 1.00 0.00 N ATOM 846 CA LYS A 56 -9.799 0.414 2.925 1.00 0.00 C ATOM 847 C LYS A 56 -9.997 1.897 2.631 1.00 0.00 C ATOM 848 O LYS A 56 -10.482 2.647 3.478 1.00 0.00 O ATOM 849 CB LYS A 56 -8.447 0.195 3.609 1.00 0.00 C ATOM 850 CG LYS A 56 -8.291 -1.188 4.218 1.00 0.00 C ATOM 851 CD LYS A 56 -7.068 -1.266 5.116 1.00 0.00 C ATOM 852 CE LYS A 56 -6.660 -2.708 5.379 1.00 0.00 C ATOM 853 NZ LYS A 56 -5.511 -2.798 6.321 1.00 0.00 N ATOM 0 H LYS A 56 -8.974 -0.644 1.313 1.00 0.00 H new ATOM 0 HA LYS A 56 -10.595 0.084 3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.651 0.355 2.882 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.319 0.944 4.391 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.183 -1.436 4.794 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -8.208 -1.929 3.423 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.240 -0.731 4.651 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.278 -0.768 6.062 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -7.509 -3.256 5.788 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -6.395 -3.188 4.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -5.264 -3.797 6.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.693 -2.297 5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -5.772 -2.363 7.229 1.00 0.00 H new ATOM 867 N GLN A 57 -9.620 2.313 1.426 1.00 0.00 N ATOM 868 CA GLN A 57 -9.757 3.708 1.022 1.00 0.00 C ATOM 869 C GLN A 57 -11.158 3.983 0.486 1.00 0.00 C ATOM 870 O GLN A 57 -11.810 4.948 0.887 1.00 0.00 O ATOM 871 CB GLN A 57 -8.714 4.058 -0.040 1.00 0.00 C ATOM 872 CG GLN A 57 -7.359 3.413 0.202 1.00 0.00 C ATOM 873 CD GLN A 57 -6.474 4.239 1.114 1.00 0.00 C ATOM 874 OE1 GLN A 57 -6.296 3.913 2.289 1.00 0.00 O ATOM 875 NE2 GLN A 57 -5.912 5.316 0.578 1.00 0.00 N ATOM 0 H GLN A 57 -9.218 1.705 0.713 1.00 0.00 H new ATOM 0 HA GLN A 57 -9.594 4.333 1.900 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.085 3.749 -1.017 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.591 5.141 -0.074 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.504 2.425 0.640 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.854 3.267 -0.753 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.086 5.549 -0.400 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.306 5.910 1.144 1.00 0.00 H new ATOM 884 N THR A 58 -11.618 3.128 -0.423 1.00 0.00 N ATOM 885 CA THR A 58 -12.940 3.281 -1.015 1.00 0.00 C ATOM 886 C THR A 58 -14.021 3.334 0.058 1.00 0.00 C ATOM 887 O THR A 58 -15.150 3.747 -0.202 1.00 0.00 O ATOM 888 CB THR A 58 -13.256 2.129 -1.989 1.00 0.00 C ATOM 889 OG1 THR A 58 -13.261 0.881 -1.286 1.00 0.00 O ATOM 890 CG2 THR A 58 -12.236 2.078 -3.115 1.00 0.00 C ATOM 0 H THR A 58 -11.094 2.323 -0.765 1.00 0.00 H new ATOM 0 HA THR A 58 -12.932 4.222 -1.566 1.00 0.00 H new ATOM 0 HB THR A 58 -14.241 2.307 -2.420 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.464 0.154 -1.911 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.480 1.257 -3.790 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.255 3.018 -3.666 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.241 1.922 -2.698 1.00 0.00 H new ATOM 898 N GLY A 59 -13.667 2.912 1.269 1.00 0.00 N ATOM 899 CA GLY A 59 -14.618 2.920 2.365 1.00 0.00 C ATOM 900 C GLY A 59 -14.433 4.111 3.285 1.00 0.00 C ATOM 901 O GLY A 59 -15.389 4.590 3.892 1.00 0.00 O ATOM 0 H GLY A 59 -12.739 2.565 1.510 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.631 2.929 1.963 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -14.512 2.000 2.941 1.00 0.00 H new ATOM 905 N ALA A 60 -13.197 4.588 3.390 1.00 0.00 N ATOM 906 CA ALA A 60 -12.889 5.730 4.242 1.00 0.00 C ATOM 907 C ALA A 60 -13.569 6.996 3.732 1.00 0.00 C ATOM 908 O ALA A 60 -13.868 7.114 2.543 1.00 0.00 O ATOM 909 CB ALA A 60 -11.384 5.935 4.327 1.00 0.00 C ATOM 0 H ALA A 60 -12.393 4.201 2.896 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.273 5.520 5.240 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.169 6.791 4.966 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.918 5.043 4.746 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.985 6.118 3.329 1.00 0.00 H new ATOM 915 N ILE A 61 -13.812 7.938 4.637 1.00 0.00 N ATOM 916 CA ILE A 61 -14.456 9.194 4.277 1.00 0.00 C ATOM 917 C ILE A 61 -13.529 10.067 3.437 1.00 0.00 C ATOM 918 O ILE A 61 -13.894 11.173 3.037 1.00 0.00 O ATOM 919 CB ILE A 61 -14.892 9.982 5.527 1.00 0.00 C ATOM 920 CG1 ILE A 61 -13.671 10.573 6.235 1.00 0.00 C ATOM 921 CG2 ILE A 61 -15.675 9.084 6.472 1.00 0.00 C ATOM 922 CD1 ILE A 61 -12.833 9.542 6.957 1.00 0.00 C ATOM 0 H ILE A 61 -13.572 7.855 5.625 1.00 0.00 H new ATOM 0 HA ILE A 61 -15.339 8.939 3.692 1.00 0.00 H new ATOM 0 HB ILE A 61 -15.540 10.801 5.215 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -13.049 11.086 5.502 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -14.005 11.324 6.951 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -15.976 9.655 7.350 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -16.562 8.706 5.963 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -15.049 8.247 6.781 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -11.985 10.032 7.435 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -13.440 9.046 7.714 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -12.469 8.804 6.242 1.00 0.00 H new ATOM 934 N LEU A 62 -12.329 9.562 3.174 1.00 0.00 N ATOM 935 CA LEU A 62 -11.349 10.294 2.379 1.00 0.00 C ATOM 936 C LEU A 62 -11.511 9.986 0.895 1.00 0.00 C ATOM 937 O LEU A 62 -11.821 8.861 0.499 1.00 0.00 O ATOM 938 CB LEU A 62 -9.931 9.945 2.833 1.00 0.00 C ATOM 939 CG LEU A 62 -9.291 8.730 2.162 1.00 0.00 C ATOM 940 CD1 LEU A 62 -8.532 9.148 0.912 1.00 0.00 C ATOM 941 CD2 LEU A 62 -8.370 8.007 3.132 1.00 0.00 C ATOM 0 H LEU A 62 -12.011 8.649 3.499 1.00 0.00 H new ATOM 0 HA LEU A 62 -11.520 11.360 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.292 10.810 2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.948 9.774 3.909 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.084 8.043 1.867 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -8.083 8.270 0.448 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.220 9.618 0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.748 9.856 1.182 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.924 7.145 2.636 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.582 8.685 3.460 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.943 7.672 3.997 1.00 0.00 H new ATOM 953 N PRO A 63 -11.293 11.005 0.050 1.00 0.00 N ATOM 954 CA PRO A 63 -11.406 10.865 -1.404 1.00 0.00 C ATOM 955 C PRO A 63 -10.289 10.011 -1.993 1.00 0.00 C ATOM 956 O PRO A 63 -9.164 9.987 -1.494 1.00 0.00 O ATOM 957 CB PRO A 63 -11.299 12.307 -1.909 1.00 0.00 C ATOM 958 CG PRO A 63 -10.535 13.022 -0.849 1.00 0.00 C ATOM 959 CD PRO A 63 -10.920 12.372 0.451 1.00 0.00 C ATOM 0 HA PRO A 63 -12.330 10.364 -1.694 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -10.784 12.354 -2.868 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -12.284 12.750 -2.054 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -9.462 12.943 -1.022 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -10.779 14.084 -0.841 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -10.093 12.371 1.161 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.750 12.891 0.930 1.00 0.00 H new ATOM 967 N PRO A 64 -10.603 9.293 -3.081 1.00 0.00 N ATOM 968 CA PRO A 64 -9.638 8.424 -3.763 1.00 0.00 C ATOM 969 C PRO A 64 -8.550 9.217 -4.480 1.00 0.00 C ATOM 970 O PRO A 64 -8.736 9.656 -5.615 1.00 0.00 O ATOM 971 CB PRO A 64 -10.498 7.661 -4.773 1.00 0.00 C ATOM 972 CG PRO A 64 -11.666 8.552 -5.026 1.00 0.00 C ATOM 973 CD PRO A 64 -11.924 9.273 -3.731 1.00 0.00 C ATOM 0 HA PRO A 64 -9.106 7.779 -3.064 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -9.946 7.461 -5.692 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -10.814 6.697 -4.375 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -11.452 9.257 -5.829 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -12.538 7.975 -5.332 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -12.303 10.281 -3.901 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -12.663 8.753 -3.122 1.00 0.00 H new ATOM 981 N SER A 65 -7.417 9.395 -3.811 1.00 0.00 N ATOM 982 CA SER A 65 -6.300 10.138 -4.384 1.00 0.00 C ATOM 983 C SER A 65 -6.206 9.904 -5.888 1.00 0.00 C ATOM 984 O SER A 65 -5.761 8.849 -6.337 1.00 0.00 O ATOM 985 CB SER A 65 -4.988 9.729 -3.710 1.00 0.00 C ATOM 986 OG SER A 65 -4.009 10.745 -3.841 1.00 0.00 O ATOM 0 H SER A 65 -7.247 9.035 -2.872 1.00 0.00 H new ATOM 0 HA SER A 65 -6.475 11.200 -4.209 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.166 9.525 -2.654 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.619 8.805 -4.155 1.00 0.00 H new ATOM 0 HG SER A 65 -3.181 10.460 -3.401 1.00 0.00 H new ATOM 992 N GLY A 66 -6.631 10.897 -6.664 1.00 0.00 N ATOM 993 CA GLY A 66 -6.588 10.781 -8.109 1.00 0.00 C ATOM 994 C GLY A 66 -7.971 10.741 -8.730 1.00 0.00 C ATOM 995 O GLY A 66 -8.919 10.209 -8.151 1.00 0.00 O ATOM 0 H GLY A 66 -7.005 11.780 -6.316 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.032 11.623 -8.521 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.045 9.876 -8.382 1.00 0.00 H new ATOM 999 N PRO A 67 -8.100 11.316 -9.934 1.00 0.00 N ATOM 1000 CA PRO A 67 -9.374 11.358 -10.659 1.00 0.00 C ATOM 1001 C PRO A 67 -9.801 9.982 -11.160 1.00 0.00 C ATOM 1002 O PRO A 67 -9.061 9.318 -11.886 1.00 0.00 O ATOM 1003 CB PRO A 67 -9.082 12.289 -11.837 1.00 0.00 C ATOM 1004 CG PRO A 67 -7.610 12.186 -12.045 1.00 0.00 C ATOM 1005 CD PRO A 67 -7.013 11.969 -10.682 1.00 0.00 C ATOM 0 HA PRO A 67 -10.193 11.696 -10.024 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -9.630 11.984 -12.728 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -9.380 13.314 -11.615 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -7.367 11.360 -12.713 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -7.216 13.093 -12.504 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.123 11.341 -10.728 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.715 12.910 -10.219 1.00 0.00 H new ATOM 1013 N SER A 68 -10.999 9.560 -10.770 1.00 0.00 N ATOM 1014 CA SER A 68 -11.523 8.262 -11.177 1.00 0.00 C ATOM 1015 C SER A 68 -13.048 8.271 -11.188 1.00 0.00 C ATOM 1016 O SER A 68 -13.688 8.289 -10.136 1.00 0.00 O ATOM 1017 CB SER A 68 -11.015 7.166 -10.238 1.00 0.00 C ATOM 1018 OG SER A 68 -11.235 5.880 -10.790 1.00 0.00 O ATOM 0 H SER A 68 -11.626 10.099 -10.172 1.00 0.00 H new ATOM 0 HA SER A 68 -11.171 8.057 -12.188 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.951 7.308 -10.051 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.521 7.244 -9.276 1.00 0.00 H new ATOM 0 HG SER A 68 -10.900 5.197 -10.172 1.00 0.00 H new ATOM 1024 N SER A 69 -13.626 8.258 -12.385 1.00 0.00 N ATOM 1025 CA SER A 69 -15.076 8.268 -12.535 1.00 0.00 C ATOM 1026 C SER A 69 -15.731 7.311 -11.545 1.00 0.00 C ATOM 1027 O SER A 69 -15.301 6.168 -11.390 1.00 0.00 O ATOM 1028 CB SER A 69 -15.464 7.886 -13.965 1.00 0.00 C ATOM 1029 OG SER A 69 -15.409 9.010 -14.826 1.00 0.00 O ATOM 0 H SER A 69 -13.111 8.241 -13.266 1.00 0.00 H new ATOM 0 HA SER A 69 -15.432 9.277 -12.327 1.00 0.00 H new ATOM 0 HB2 SER A 69 -14.793 7.110 -14.332 1.00 0.00 H new ATOM 0 HB3 SER A 69 -16.470 7.467 -13.973 1.00 0.00 H new ATOM 0 HG SER A 69 -15.660 8.739 -15.734 1.00 0.00 H new ATOM 1035 N GLY A 70 -16.777 7.787 -10.874 1.00 0.00 N ATOM 1036 CA GLY A 70 -17.475 6.961 -9.907 1.00 0.00 C ATOM 1037 C GLY A 70 -17.089 7.290 -8.478 1.00 0.00 C ATOM 1038 O GLY A 70 -17.634 8.215 -7.877 1.00 0.00 O ATOM 0 H GLY A 70 -17.152 8.729 -10.983 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -18.550 7.093 -10.029 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -17.258 5.912 -10.106 1.00 0.00 H new TER 1042 GLY A 70