USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 687 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: p 41 CYS SG : rot 180:sc= -0.526 USER MOD Set 1.2: p 44 MET CE :methyl -149:sc= -0.499 (180deg=0) USER MOD Set 1.3: p 51 GLN : amide:sc= -0.0118 K(o=-1,f=-4.8!) USER MOD Set 2.1: p 42 SER OG : rot 180:sc= 0 USER MOD Set 2.2: p 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: p 2 GLN : amide:sc= -2.63! K(o=-3.3!,f=1.2) USER MOD Set 3.2: p 6 LYS NZ :NH3+ -167:sc= -0.665 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 143:sc= -0.03 (180deg=-0.153) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 16 GLN : amide:sc= 0.273 X(o=0.27,f=0) USER MOD Single : p 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 33 ASN : amide:sc= -1.11 K(o=-1.1,f=-9.2!) USER MOD Single : p 34 CYS SG : rot 180:sc= -0.451 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 48 TYR OH : rot 180:sc= 0 USER MOD Single : p 49 SER OG : rot 96:sc= 0.0956 USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 56 LYS NZ :NH3+ 144:sc= -0.465 (180deg=-0.999) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN : amide:sc= -0.255 K(o=-0.26,f=-3.3!) USER MOD Single : p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -7.401 24.983 2.135 1.00 0.00 N ATOM 2 CA MET p 1 -7.218 23.713 1.379 1.00 0.00 C ATOM 3 C MET p 1 -5.829 23.110 1.646 1.00 0.00 C ATOM 4 O MET p 1 -5.165 22.588 0.741 1.00 0.00 O ATOM 5 CB MET p 1 -7.427 23.965 -0.123 1.00 0.00 C ATOM 6 CG MET p 1 -8.880 24.195 -0.512 1.00 0.00 C ATOM 7 SD MET p 1 -9.088 24.475 -2.282 1.00 0.00 S ATOM 8 CE MET p 1 -10.862 24.703 -2.381 1.00 0.00 C ATOM 0 H1 MET p 1 -7.945 25.656 1.557 1.00 0.00 H new ATOM 0 H2 MET p 1 -7.915 24.790 3.018 1.00 0.00 H new ATOM 0 H3 MET p 1 -6.471 25.391 2.358 1.00 0.00 H new ATOM 0 HA MET p 1 -7.961 22.993 1.720 1.00 0.00 H new ATOM 0 HB2 MET p 1 -6.839 24.833 -0.421 1.00 0.00 H new ATOM 0 HB3 MET p 1 -7.042 23.112 -0.682 1.00 0.00 H new ATOM 0 HG2 MET p 1 -9.474 23.331 -0.212 1.00 0.00 H new ATOM 0 HG3 MET p 1 -9.267 25.054 0.036 1.00 0.00 H new ATOM 0 HE1 MET p 1 -11.148 24.887 -3.417 1.00 0.00 H new ATOM 0 HE2 MET p 1 -11.365 23.806 -2.019 1.00 0.00 H new ATOM 0 HE3 MET p 1 -11.154 25.555 -1.767 1.00 0.00 H new ATOM 20 N GLN p 2 -5.402 23.194 2.906 1.00 0.00 N ATOM 21 CA GLN p 2 -4.134 22.669 3.355 1.00 0.00 C ATOM 22 C GLN p 2 -4.325 21.758 4.576 1.00 0.00 C ATOM 23 O GLN p 2 -3.369 21.202 5.106 1.00 0.00 O ATOM 24 CB GLN p 2 -3.248 23.851 3.725 1.00 0.00 C ATOM 25 CG GLN p 2 -2.631 24.553 2.530 1.00 0.00 C ATOM 26 CD GLN p 2 -1.544 25.536 2.922 1.00 0.00 C ATOM 27 OE1 GLN p 2 -1.817 26.710 3.172 1.00 0.00 O ATOM 28 NE2 GLN p 2 -0.305 25.063 2.974 1.00 0.00 N ATOM 0 H GLN p 2 -5.944 23.638 3.647 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.676 22.075 2.564 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -3.837 24.571 4.293 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -2.451 23.503 4.382 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -2.214 23.808 1.852 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -3.411 25.081 1.982 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -0.124 24.083 2.759 1.00 0.00 H new ATOM 0 HE22 GLN p 2 0.466 25.680 3.229 1.00 0.00 H new ATOM 37 N ALA p 3 -5.580 21.612 5.001 1.00 0.00 N ATOM 38 CA ALA p 3 -5.932 20.824 6.181 1.00 0.00 C ATOM 39 C ALA p 3 -6.256 19.382 5.838 1.00 0.00 C ATOM 40 O ALA p 3 -5.698 18.465 6.419 1.00 0.00 O ATOM 41 CB ALA p 3 -7.089 21.479 6.929 1.00 0.00 C ATOM 0 H ALA p 3 -6.382 22.038 4.536 1.00 0.00 H new ATOM 0 HA ALA p 3 -5.057 20.803 6.831 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -7.340 20.882 7.805 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -6.798 22.481 7.244 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -7.957 21.543 6.273 1.00 0.00 H new ATOM 47 N LEU p 4 -7.145 19.230 4.867 1.00 0.00 N ATOM 48 CA LEU p 4 -7.650 17.963 4.384 1.00 0.00 C ATOM 49 C LEU p 4 -6.815 17.523 3.208 1.00 0.00 C ATOM 50 O LEU p 4 -6.417 16.375 3.109 1.00 0.00 O ATOM 51 CB LEU p 4 -9.106 18.165 3.956 1.00 0.00 C ATOM 52 CG LEU p 4 -10.025 16.946 3.972 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.423 17.420 3.667 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.593 15.903 2.951 1.00 0.00 C ATOM 0 H LEU p 4 -7.549 20.027 4.375 1.00 0.00 H new ATOM 0 HA LEU p 4 -7.598 17.198 5.159 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.544 18.924 4.604 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.105 18.571 2.945 1.00 0.00 H new ATOM 0 HG LEU p 4 -9.979 16.472 4.952 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.105 16.569 3.671 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -11.736 18.140 4.423 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.440 17.894 2.686 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.271 15.051 2.992 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.619 16.339 1.952 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -8.579 15.571 3.176 1.00 0.00 H new ATOM 66 N GLU p 5 -6.604 18.475 2.304 1.00 0.00 N ATOM 67 CA GLU p 5 -5.781 18.285 1.097 1.00 0.00 C ATOM 68 C GLU p 5 -4.373 17.858 1.476 1.00 0.00 C ATOM 69 O GLU p 5 -3.702 17.170 0.716 1.00 0.00 O ATOM 70 CB GLU p 5 -5.716 19.566 0.268 1.00 0.00 C ATOM 71 CG GLU p 5 -7.032 20.316 0.221 1.00 0.00 C ATOM 72 CD GLU p 5 -7.512 20.585 -1.192 1.00 0.00 C ATOM 73 OE1 GLU p 5 -6.941 21.479 -1.853 1.00 0.00 O ATOM 74 OE2 GLU p 5 -8.458 19.903 -1.637 1.00 0.00 O ATOM 0 H GLU p 5 -7.000 19.412 2.382 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.248 17.503 0.498 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.948 20.220 0.681 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.410 19.318 -0.748 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.790 19.741 0.753 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.922 21.264 0.748 1.00 0.00 H new ATOM 81 N LYS p 6 -3.956 18.307 2.663 1.00 0.00 N ATOM 82 CA LYS p 6 -2.650 17.958 3.236 1.00 0.00 C ATOM 83 C LYS p 6 -2.754 16.692 4.084 1.00 0.00 C ATOM 84 O LYS p 6 -1.741 16.099 4.435 1.00 0.00 O ATOM 85 CB LYS p 6 -2.068 19.095 4.064 1.00 0.00 C ATOM 86 CG LYS p 6 -1.215 20.061 3.258 1.00 0.00 C ATOM 87 CD LYS p 6 -0.446 21.011 4.160 1.00 0.00 C ATOM 88 CE LYS p 6 0.506 21.886 3.359 1.00 0.00 C ATOM 89 NZ LYS p 6 1.189 22.894 4.217 1.00 0.00 N ATOM 0 H LYS p 6 -4.513 18.923 3.255 1.00 0.00 H new ATOM 0 HA LYS p 6 -1.973 17.775 2.402 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -2.883 19.647 4.532 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -1.464 18.675 4.869 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.516 19.500 2.638 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.851 20.633 2.583 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -1.146 21.640 4.710 1.00 0.00 H new ATOM 0 HD3 LYS p 6 0.116 20.439 4.898 1.00 0.00 H new ATOM 0 HE2 LYS p 6 1.252 21.259 2.872 1.00 0.00 H new ATOM 0 HE3 LYS p 6 -0.047 22.396 2.570 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 1.653 23.604 3.616 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 0.489 23.361 4.828 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 1.903 22.421 4.807 1.00 0.00 H new ATOM 103 N GLU p 7 -3.999 16.325 4.428 1.00 0.00 N ATOM 104 CA GLU p 7 -4.327 15.091 5.169 1.00 0.00 C ATOM 105 C GLU p 7 -4.407 13.986 4.156 1.00 0.00 C ATOM 106 O GLU p 7 -4.125 12.815 4.402 1.00 0.00 O ATOM 107 CB GLU p 7 -5.688 15.240 5.806 1.00 0.00 C ATOM 108 CG GLU p 7 -5.658 16.086 7.029 1.00 0.00 C ATOM 109 CD GLU p 7 -6.095 15.353 8.283 1.00 0.00 C ATOM 110 OE1 GLU p 7 -7.307 15.363 8.584 1.00 0.00 O ATOM 111 OE2 GLU p 7 -5.225 14.770 8.964 1.00 0.00 O ATOM 0 H GLU p 7 -4.820 16.884 4.197 1.00 0.00 H new ATOM 0 HA GLU p 7 -3.581 14.889 5.938 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.377 15.677 5.083 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.076 14.254 6.060 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -4.647 16.466 7.174 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.305 16.950 6.879 1.00 0.00 H new ATOM 118 N LEU p 8 -4.869 14.465 3.023 1.00 0.00 N ATOM 119 CA LEU p 8 -5.040 13.739 1.786 1.00 0.00 C ATOM 120 C LEU p 8 -3.689 13.662 1.098 1.00 0.00 C ATOM 121 O LEU p 8 -3.400 12.694 0.420 1.00 0.00 O ATOM 122 CB LEU p 8 -6.094 14.449 0.901 1.00 0.00 C ATOM 123 CG LEU p 8 -6.472 13.791 -0.446 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.629 14.374 -1.566 1.00 0.00 C ATOM 125 CD2 LEU p 8 -6.308 12.280 -0.393 1.00 0.00 C ATOM 0 H LEU p 8 -5.155 15.440 2.936 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.404 12.729 1.973 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -7.006 14.556 1.488 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.731 15.455 0.691 1.00 0.00 H new ATOM 0 HG LEU p 8 -7.523 14.004 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.903 13.904 -2.510 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.803 15.448 -1.631 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -4.574 14.189 -1.361 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -6.582 11.850 -1.356 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -5.270 12.034 -0.168 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.954 11.871 0.384 1.00 0.00 H new ATOM 137 N ALA p 9 -2.888 14.716 1.312 1.00 0.00 N ATOM 138 CA ALA p 9 -1.511 14.807 0.805 1.00 0.00 C ATOM 139 C ALA p 9 -0.630 14.070 1.785 1.00 0.00 C ATOM 140 O ALA p 9 0.511 13.717 1.489 1.00 0.00 O ATOM 141 CB ALA p 9 -1.034 16.242 0.632 1.00 0.00 C ATOM 0 H ALA p 9 -3.180 15.535 1.846 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.466 14.363 -0.190 1.00 0.00 H new ATOM 0 HB1 ALA p 9 -0.011 16.243 0.255 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.682 16.758 -0.077 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.067 16.755 1.593 1.00 0.00 H new ATOM 147 N GLN p 10 -1.215 13.876 2.978 1.00 0.00 N ATOM 148 CA GLN p 10 -0.627 13.111 4.047 1.00 0.00 C ATOM 149 C GLN p 10 -1.055 11.682 3.786 1.00 0.00 C ATOM 150 O GLN p 10 -0.357 10.746 4.128 1.00 0.00 O ATOM 151 CB GLN p 10 -1.132 13.629 5.397 1.00 0.00 C ATOM 152 CG GLN p 10 -1.227 12.593 6.502 1.00 0.00 C ATOM 153 CD GLN p 10 -0.214 12.813 7.608 1.00 0.00 C ATOM 154 OE1 GLN p 10 0.900 12.295 7.558 1.00 0.00 O ATOM 155 NE2 GLN p 10 -0.600 13.587 8.617 1.00 0.00 N ATOM 0 H GLN p 10 -2.129 14.262 3.214 1.00 0.00 H new ATOM 0 HA GLN p 10 0.460 13.190 4.082 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -0.471 14.429 5.729 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.118 14.070 5.251 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -2.231 12.614 6.927 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.082 11.600 6.076 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -1.534 13.996 8.617 1.00 0.00 H new ATOM 0 HE22 GLN p 10 0.038 13.772 9.391 1.00 0.00 H new ATOM 164 N ASN p 11 -2.234 11.589 3.145 1.00 0.00 N ATOM 165 CA ASN p 11 -2.849 10.332 2.710 1.00 0.00 C ATOM 166 C ASN p 11 -2.225 9.962 1.378 1.00 0.00 C ATOM 167 O ASN p 11 -2.278 8.813 0.946 1.00 0.00 O ATOM 168 CB ASN p 11 -4.370 10.462 2.576 1.00 0.00 C ATOM 169 CG ASN p 11 -5.092 9.137 2.743 1.00 0.00 C ATOM 170 OD1 ASN p 11 -5.356 8.696 3.862 1.00 0.00 O ATOM 171 ND2 ASN p 11 -5.429 8.501 1.627 1.00 0.00 N ATOM 0 H ASN p 11 -2.795 12.408 2.912 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.670 9.555 3.453 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.737 11.167 3.322 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.609 10.880 1.598 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -5.926 7.612 1.677 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -5.191 8.902 0.720 1.00 0.00 H new ATOM 178 N GLU p 12 -1.650 10.998 0.738 1.00 0.00 N ATOM 179 CA GLU p 12 -0.895 10.854 -0.509 1.00 0.00 C ATOM 180 C GLU p 12 0.487 10.490 -0.077 1.00 0.00 C ATOM 181 O GLU p 12 1.221 9.813 -0.769 1.00 0.00 O ATOM 182 CB GLU p 12 -0.825 12.134 -1.334 1.00 0.00 C ATOM 183 CG GLU p 12 -2.174 12.611 -1.779 1.00 0.00 C ATOM 184 CD GLU p 12 -2.280 12.800 -3.279 1.00 0.00 C ATOM 185 OE1 GLU p 12 -1.985 13.915 -3.761 1.00 0.00 O ATOM 186 OE2 GLU p 12 -2.655 11.832 -3.974 1.00 0.00 O ATOM 0 H GLU p 12 -1.700 11.959 1.077 1.00 0.00 H new ATOM 0 HA GLU p 12 -1.380 10.115 -1.147 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -0.344 12.915 -0.745 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.198 11.963 -2.209 1.00 0.00 H new ATOM 0 HG2 GLU p 12 -2.929 11.895 -1.456 1.00 0.00 H new ATOM 0 HG3 GLU p 12 -2.399 13.556 -1.284 1.00 0.00 H new ATOM 193 N TRP p 13 0.776 10.999 1.119 1.00 0.00 N ATOM 194 CA TRP p 13 2.033 10.752 1.842 1.00 0.00 C ATOM 195 C TRP p 13 1.933 9.412 2.558 1.00 0.00 C ATOM 196 O TRP p 13 2.945 8.837 2.940 1.00 0.00 O ATOM 197 CB TRP p 13 2.346 11.865 2.843 1.00 0.00 C ATOM 198 CG TRP p 13 3.817 12.049 3.095 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.559 11.444 4.068 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.724 12.892 2.365 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.867 11.855 3.992 1.00 0.00 N ATOM 202 CE2 TRP p 13 5.994 12.743 2.955 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.589 13.757 1.271 1.00 0.00 C ATOM 204 CZ2 TRP p 13 7.117 13.424 2.491 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.706 14.432 0.813 1.00 0.00 C ATOM 206 CH2 TRP p 13 6.955 14.261 1.422 1.00 0.00 C ATOM 0 H TRP p 13 0.134 11.607 1.627 1.00 0.00 H new ATOM 0 HA TRP p 13 2.849 10.734 1.120 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.929 12.802 2.475 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.849 11.644 3.787 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.173 10.743 4.793 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.621 11.549 4.607 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.630 13.894 0.794 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 8.082 13.295 2.959 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 5.613 15.102 -0.029 1.00 0.00 H new ATOM 0 HH2 TRP p 13 7.808 14.801 1.039 1.00 0.00 H new ATOM 217 N GLU p 14 0.679 8.964 2.765 1.00 0.00 N ATOM 218 CA GLU p 14 0.378 7.636 3.344 1.00 0.00 C ATOM 219 C GLU p 14 0.280 6.710 2.177 1.00 0.00 C ATOM 220 O GLU p 14 0.328 5.490 2.300 1.00 0.00 O ATOM 221 CB GLU p 14 -0.927 7.577 4.126 1.00 0.00 C ATOM 222 CG GLU p 14 -0.983 8.601 5.216 1.00 0.00 C ATOM 223 CD GLU p 14 -1.504 8.054 6.531 1.00 0.00 C ATOM 224 OE1 GLU p 14 -0.684 7.579 7.343 1.00 0.00 O ATOM 225 OE2 GLU p 14 -2.733 8.103 6.748 1.00 0.00 O ATOM 0 H GLU p 14 -0.152 9.509 2.537 1.00 0.00 H new ATOM 0 HA GLU p 14 1.159 7.377 4.059 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.764 7.729 3.444 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.045 6.583 4.558 1.00 0.00 H new ATOM 0 HG2 GLU p 14 0.015 9.010 5.371 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.620 9.426 4.897 1.00 0.00 H new ATOM 232 N LEU p 15 0.078 7.379 1.045 1.00 0.00 N ATOM 233 CA LEU p 15 0.033 6.767 -0.273 1.00 0.00 C ATOM 234 C LEU p 15 1.475 6.635 -0.749 1.00 0.00 C ATOM 235 O LEU p 15 1.831 5.681 -1.417 1.00 0.00 O ATOM 236 CB LEU p 15 -0.803 7.611 -1.255 1.00 0.00 C ATOM 237 CG LEU p 15 -1.018 7.065 -2.685 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.029 7.646 -3.619 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.967 5.547 -2.716 1.00 0.00 C ATOM 0 H LEU p 15 -0.062 8.389 1.022 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.448 5.790 -0.226 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.784 7.768 -0.807 1.00 0.00 H new ATOM 0 HB3 LEU p 15 -0.330 8.590 -1.339 1.00 0.00 H new ATOM 0 HG LEU p 15 -2.010 7.368 -3.018 1.00 0.00 H new ATOM 0 HD11 LEU p 15 -0.126 7.258 -4.626 1.00 0.00 H new ATOM 0 HD12 LEU p 15 -0.057 8.733 -3.631 1.00 0.00 H new ATOM 0 HD13 LEU p 15 1.023 7.365 -3.271 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -1.122 5.199 -3.737 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.006 5.208 -2.361 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -1.749 5.143 -2.072 1.00 0.00 H new ATOM 251 N GLN p 16 2.271 7.632 -0.346 1.00 0.00 N ATOM 252 CA GLN p 16 3.722 7.716 -0.613 1.00 0.00 C ATOM 253 C GLN p 16 4.380 6.831 0.387 1.00 0.00 C ATOM 254 O GLN p 16 5.476 6.337 0.190 1.00 0.00 O ATOM 255 CB GLN p 16 4.269 9.129 -0.437 1.00 0.00 C ATOM 256 CG GLN p 16 3.630 10.120 -1.362 1.00 0.00 C ATOM 257 CD GLN p 16 4.630 10.900 -2.193 1.00 0.00 C ATOM 258 OE1 GLN p 16 4.994 10.489 -3.294 1.00 0.00 O ATOM 259 NE2 GLN p 16 5.080 12.035 -1.668 1.00 0.00 N ATOM 0 H GLN p 16 1.920 8.426 0.189 1.00 0.00 H new ATOM 0 HA GLN p 16 3.915 7.423 -1.645 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.113 9.448 0.593 1.00 0.00 H new ATOM 0 HB3 GLN p 16 5.345 9.121 -0.609 1.00 0.00 H new ATOM 0 HG2 GLN p 16 2.946 9.595 -2.029 1.00 0.00 H new ATOM 0 HG3 GLN p 16 3.032 10.818 -0.777 1.00 0.00 H new ATOM 0 HE21 GLN p 16 4.751 12.339 -0.751 1.00 0.00 H new ATOM 0 HE22 GLN p 16 5.754 12.603 -2.182 1.00 0.00 H new ATOM 268 N ALA p 17 3.658 6.724 1.496 1.00 0.00 N ATOM 269 CA ALA p 17 4.008 5.843 2.611 1.00 0.00 C ATOM 270 C ALA p 17 3.437 4.475 2.301 1.00 0.00 C ATOM 271 O ALA p 17 3.792 3.490 2.933 1.00 0.00 O ATOM 272 CB ALA p 17 3.501 6.343 3.955 1.00 0.00 C ATOM 0 H ALA p 17 2.800 7.253 1.651 1.00 0.00 H new ATOM 0 HA ALA p 17 5.093 5.812 2.706 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.795 5.644 4.738 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.930 7.323 4.164 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.414 6.421 3.928 1.00 0.00 H new ATOM 278 N LEU p 18 2.500 4.469 1.330 1.00 0.00 N ATOM 279 CA LEU p 18 1.893 3.255 0.800 1.00 0.00 C ATOM 280 C LEU p 18 2.755 2.807 -0.372 1.00 0.00 C ATOM 281 O LEU p 18 2.785 1.634 -0.730 1.00 0.00 O ATOM 282 CB LEU p 18 0.441 3.499 0.344 1.00 0.00 C ATOM 283 CG LEU p 18 -0.378 2.273 -0.113 1.00 0.00 C ATOM 284 CD1 LEU p 18 -0.305 2.141 -1.623 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.113 0.999 0.556 1.00 0.00 C ATOM 0 H LEU p 18 2.148 5.322 0.895 1.00 0.00 H new ATOM 0 HA LEU p 18 1.848 2.488 1.573 1.00 0.00 H new ATOM 0 HB2 LEU p 18 -0.094 3.974 1.166 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.462 4.215 -0.478 1.00 0.00 H new ATOM 0 HG LEU p 18 -1.416 2.423 0.185 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -0.885 1.274 -1.941 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.712 3.040 -2.087 1.00 0.00 H new ATOM 0 HD13 LEU p 18 0.734 2.014 -1.927 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.484 0.154 0.213 1.00 0.00 H new ATOM 0 HD22 LEU p 18 1.159 0.832 0.298 1.00 0.00 H new ATOM 0 HD23 LEU p 18 0.017 1.096 1.637 1.00 0.00 H new ATOM 297 N GLU p 19 3.425 3.803 -0.959 1.00 0.00 N ATOM 298 CA GLU p 19 4.381 3.602 -2.065 1.00 0.00 C ATOM 299 C GLU p 19 5.715 3.320 -1.439 1.00 0.00 C ATOM 300 O GLU p 19 6.568 2.661 -2.016 1.00 0.00 O ATOM 301 CB GLU p 19 4.528 4.819 -2.979 1.00 0.00 C ATOM 302 CG GLU p 19 3.221 5.316 -3.527 1.00 0.00 C ATOM 303 CD GLU p 19 3.184 5.354 -5.043 1.00 0.00 C ATOM 304 OE1 GLU p 19 3.560 6.395 -5.620 1.00 0.00 O ATOM 305 OE2 GLU p 19 2.777 4.342 -5.652 1.00 0.00 O ATOM 0 H GLU p 19 3.323 4.779 -0.682 1.00 0.00 H new ATOM 0 HA GLU p 19 4.012 2.787 -2.688 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.010 5.624 -2.425 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.187 4.563 -3.808 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.416 4.675 -3.166 1.00 0.00 H new ATOM 0 HG3 GLU p 19 3.029 6.317 -3.140 1.00 0.00 H new ATOM 312 N LYS p 20 5.862 3.914 -0.257 1.00 0.00 N ATOM 313 CA LYS p 20 7.037 3.739 0.603 1.00 0.00 C ATOM 314 C LYS p 20 6.868 2.471 1.425 1.00 0.00 C ATOM 315 O LYS p 20 7.837 1.924 1.947 1.00 0.00 O ATOM 316 CB LYS p 20 7.227 4.936 1.527 1.00 0.00 C ATOM 317 CG LYS p 20 8.571 5.626 1.383 1.00 0.00 C ATOM 318 CD LYS p 20 9.460 5.378 2.591 1.00 0.00 C ATOM 319 CE LYS p 20 10.799 6.084 2.452 1.00 0.00 C ATOM 320 NZ LYS p 20 11.671 5.859 3.638 1.00 0.00 N ATOM 0 H LYS p 20 5.160 4.540 0.139 1.00 0.00 H new ATOM 0 HA LYS p 20 7.923 3.659 -0.027 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.436 5.661 1.332 1.00 0.00 H new ATOM 0 HB3 LYS p 20 7.109 4.606 2.559 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.070 5.267 0.483 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.419 6.698 1.257 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.956 5.726 3.493 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.623 4.307 2.710 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.306 5.727 1.556 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.634 7.153 2.321 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.574 6.357 3.504 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 11.198 6.222 4.490 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 11.850 4.841 3.749 1.00 0.00 H new ATOM 334 N GLU p 21 5.601 2.037 1.529 1.00 0.00 N ATOM 335 CA GLU p 21 5.219 0.798 2.191 1.00 0.00 C ATOM 336 C GLU p 21 5.314 -0.256 1.113 1.00 0.00 C ATOM 337 O GLU p 21 5.636 -1.421 1.359 1.00 0.00 O ATOM 338 CB GLU p 21 3.805 0.902 2.784 1.00 0.00 C ATOM 339 CG GLU p 21 2.965 -0.366 2.721 1.00 0.00 C ATOM 340 CD GLU p 21 2.661 -0.938 4.092 1.00 0.00 C ATOM 341 OE1 GLU p 21 3.460 -1.763 4.583 1.00 0.00 O ATOM 342 OE2 GLU p 21 1.622 -0.559 4.675 1.00 0.00 O ATOM 0 H GLU p 21 4.808 2.552 1.147 1.00 0.00 H new ATOM 0 HA GLU p 21 5.863 0.559 3.038 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.890 1.207 3.827 1.00 0.00 H new ATOM 0 HB3 GLU p 21 3.270 1.696 2.262 1.00 0.00 H new ATOM 0 HG2 GLU p 21 2.029 -0.151 2.206 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.490 -1.115 2.128 1.00 0.00 H new ATOM 349 N LEU p 22 5.013 0.221 -0.105 1.00 0.00 N ATOM 350 CA LEU p 22 5.137 -0.565 -1.314 1.00 0.00 C ATOM 351 C LEU p 22 6.623 -0.708 -1.573 1.00 0.00 C ATOM 352 O LEU p 22 7.117 -1.774 -1.946 1.00 0.00 O ATOM 353 CB LEU p 22 4.473 0.182 -2.469 1.00 0.00 C ATOM 354 CG LEU p 22 4.024 -0.622 -3.687 1.00 0.00 C ATOM 355 CD1 LEU p 22 3.336 0.329 -4.635 1.00 0.00 C ATOM 356 CD2 LEU p 22 5.200 -1.290 -4.380 1.00 0.00 C ATOM 0 H LEU p 22 4.676 1.170 -0.265 1.00 0.00 H new ATOM 0 HA LEU p 22 4.659 -1.540 -1.219 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.600 0.700 -2.072 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.168 0.947 -2.814 1.00 0.00 H new ATOM 0 HG LEU p 22 3.347 -1.415 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU p 22 3.002 -0.216 -5.518 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.476 0.778 -4.139 1.00 0.00 H new ATOM 0 HD13 LEU p 22 4.033 1.112 -4.934 1.00 0.00 H new ATOM 0 HD21 LEU p 22 4.842 -1.853 -5.242 1.00 0.00 H new ATOM 0 HD22 LEU p 22 5.907 -0.529 -4.711 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.695 -1.967 -3.684 1.00 0.00 H new ATOM 368 N ALA p 23 7.311 0.421 -1.353 1.00 0.00 N ATOM 369 CA ALA p 23 8.771 0.494 -1.478 1.00 0.00 C ATOM 370 C ALA p 23 9.454 -0.184 -0.285 1.00 0.00 C ATOM 371 O ALA p 23 10.649 -0.440 -0.322 1.00 0.00 O ATOM 372 CB ALA p 23 9.256 1.932 -1.606 1.00 0.00 C ATOM 0 H ALA p 23 6.874 1.303 -1.085 1.00 0.00 H new ATOM 0 HA ALA p 23 9.042 -0.036 -2.391 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.342 1.943 -1.696 1.00 0.00 H new ATOM 0 HB2 ALA p 23 8.814 2.388 -2.492 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.960 2.496 -0.722 1.00 0.00 H new ATOM 378 N GLN p 24 8.660 -0.456 0.765 1.00 0.00 N ATOM 379 CA GLN p 24 9.101 -1.114 1.988 1.00 0.00 C ATOM 380 C GLN p 24 9.029 -2.637 1.832 1.00 0.00 C ATOM 381 O GLN p 24 9.712 -3.379 2.529 1.00 0.00 O ATOM 382 CB GLN p 24 8.179 -0.645 3.109 1.00 0.00 C ATOM 383 CG GLN p 24 8.216 -1.495 4.348 1.00 0.00 C ATOM 384 CD GLN p 24 8.456 -0.698 5.616 1.00 0.00 C ATOM 385 OE1 GLN p 24 9.598 -0.494 6.028 1.00 0.00 O ATOM 386 NE2 GLN p 24 7.377 -0.244 6.242 1.00 0.00 N ATOM 0 H GLN p 24 7.669 -0.214 0.778 1.00 0.00 H new ATOM 0 HA GLN p 24 10.137 -0.859 2.212 1.00 0.00 H new ATOM 0 HB2 GLN p 24 8.446 0.377 3.378 1.00 0.00 H new ATOM 0 HB3 GLN p 24 7.156 -0.619 2.733 1.00 0.00 H new ATOM 0 HG2 GLN p 24 7.273 -2.034 4.439 1.00 0.00 H new ATOM 0 HG3 GLN p 24 9.002 -2.243 4.243 1.00 0.00 H new ATOM 0 HE21 GLN p 24 6.449 -0.437 5.864 1.00 0.00 H new ATOM 0 HE22 GLN p 24 7.476 0.298 7.101 1.00 0.00 H new ATOM 395 N LEU p 25 8.159 -3.044 0.916 1.00 0.00 N ATOM 396 CA LEU p 25 7.898 -4.434 0.554 1.00 0.00 C ATOM 397 C LEU p 25 8.886 -4.830 -0.527 1.00 0.00 C ATOM 398 O LEU p 25 9.274 -5.984 -0.694 1.00 0.00 O ATOM 399 CB LEU p 25 6.469 -4.528 0.014 1.00 0.00 C ATOM 400 CG LEU p 25 5.856 -5.936 -0.140 1.00 0.00 C ATOM 401 CD1 LEU p 25 6.013 -6.397 -1.574 1.00 0.00 C ATOM 402 CD2 LEU p 25 6.501 -6.939 0.805 1.00 0.00 C ATOM 0 H LEU p 25 7.591 -2.387 0.381 1.00 0.00 H new ATOM 0 HA LEU p 25 8.007 -5.096 1.413 1.00 0.00 H new ATOM 0 HB2 LEU p 25 5.822 -3.950 0.673 1.00 0.00 H new ATOM 0 HB3 LEU p 25 6.446 -4.043 -0.962 1.00 0.00 H new ATOM 0 HG LEU p 25 4.799 -5.877 0.118 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.581 -7.391 -1.686 1.00 0.00 H new ATOM 0 HD12 LEU p 25 5.500 -5.702 -2.238 1.00 0.00 H new ATOM 0 HD13 LEU p 25 7.072 -6.430 -1.832 1.00 0.00 H new ATOM 0 HD21 LEU p 25 6.042 -7.918 0.666 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.568 -7.005 0.592 1.00 0.00 H new ATOM 0 HD23 LEU p 25 6.356 -6.614 1.835 1.00 0.00 H new ATOM 414 N GLU p 26 9.235 -3.780 -1.237 1.00 0.00 N ATOM 415 CA GLU p 26 10.167 -3.724 -2.310 1.00 0.00 C ATOM 416 C GLU p 26 11.554 -3.660 -1.715 1.00 0.00 C ATOM 417 O GLU p 26 12.506 -4.152 -2.282 1.00 0.00 O ATOM 418 CB GLU p 26 9.857 -2.446 -3.045 1.00 0.00 C ATOM 419 CG GLU p 26 10.606 -2.277 -4.318 1.00 0.00 C ATOM 420 CD GLU p 26 9.730 -2.354 -5.552 1.00 0.00 C ATOM 421 OE1 GLU p 26 9.538 -3.472 -6.076 1.00 0.00 O ATOM 422 OE2 GLU p 26 9.233 -1.298 -5.996 1.00 0.00 O ATOM 0 H GLU p 26 8.827 -2.864 -1.049 1.00 0.00 H new ATOM 0 HA GLU p 26 10.109 -4.584 -2.977 1.00 0.00 H new ATOM 0 HB2 GLU p 26 8.789 -2.413 -3.258 1.00 0.00 H new ATOM 0 HB3 GLU p 26 10.078 -1.602 -2.392 1.00 0.00 H new ATOM 0 HG2 GLU p 26 11.116 -1.314 -4.304 1.00 0.00 H new ATOM 0 HG3 GLU p 26 11.377 -3.045 -4.381 1.00 0.00 H new ATOM 429 N LYS p 27 11.611 -2.926 -0.607 1.00 0.00 N ATOM 430 CA LYS p 27 12.815 -2.793 0.221 1.00 0.00 C ATOM 431 C LYS p 27 12.912 -4.016 1.108 1.00 0.00 C ATOM 432 O LYS p 27 13.989 -4.398 1.559 1.00 0.00 O ATOM 433 CB LYS p 27 12.816 -1.520 1.066 1.00 0.00 C ATOM 434 CG LYS p 27 13.539 -0.356 0.411 1.00 0.00 C ATOM 435 CD LYS p 27 13.822 0.755 1.410 1.00 0.00 C ATOM 436 CE LYS p 27 14.541 1.924 0.757 1.00 0.00 C ATOM 437 NZ LYS p 27 14.821 3.017 1.729 1.00 0.00 N ATOM 0 H LYS p 27 10.814 -2.398 -0.251 1.00 0.00 H new ATOM 0 HA LYS p 27 13.681 -2.718 -0.437 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.786 -1.228 1.270 1.00 0.00 H new ATOM 0 HB3 LYS p 27 13.283 -1.732 2.027 1.00 0.00 H new ATOM 0 HG2 LYS p 27 14.476 -0.705 -0.022 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.935 0.035 -0.408 1.00 0.00 H new ATOM 0 HD2 LYS p 27 12.885 1.101 1.846 1.00 0.00 H new ATOM 0 HD3 LYS p 27 14.428 0.365 2.227 1.00 0.00 H new ATOM 0 HE2 LYS p 27 15.478 1.576 0.322 1.00 0.00 H new ATOM 0 HE3 LYS p 27 13.934 2.312 -0.061 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 15.312 3.795 1.244 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 13.925 3.366 2.126 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 15.421 2.654 2.497 1.00 0.00 H new ATOM 451 N GLU p 28 11.749 -4.628 1.364 1.00 0.00 N ATOM 452 CA GLU p 28 11.667 -5.862 2.080 1.00 0.00 C ATOM 453 C GLU p 28 12.223 -6.906 1.134 1.00 0.00 C ATOM 454 O GLU p 28 12.871 -7.884 1.512 1.00 0.00 O ATOM 455 CB GLU p 28 10.205 -6.115 2.349 1.00 0.00 C ATOM 456 CG GLU p 28 9.940 -7.341 3.142 1.00 0.00 C ATOM 457 CD GLU p 28 9.345 -7.063 4.509 1.00 0.00 C ATOM 458 OE1 GLU p 28 8.103 -7.011 4.616 1.00 0.00 O ATOM 459 OE2 GLU p 28 10.123 -6.897 5.472 1.00 0.00 O ATOM 0 H GLU p 28 10.844 -4.261 1.069 1.00 0.00 H new ATOM 0 HA GLU p 28 12.211 -5.868 3.025 1.00 0.00 H new ATOM 0 HB2 GLU p 28 9.789 -5.257 2.877 1.00 0.00 H new ATOM 0 HB3 GLU p 28 9.679 -6.189 1.397 1.00 0.00 H new ATOM 0 HG2 GLU p 28 9.261 -7.985 2.584 1.00 0.00 H new ATOM 0 HG3 GLU p 28 10.872 -7.892 3.266 1.00 0.00 H new ATOM 466 N LEU p 29 11.901 -6.625 -0.122 1.00 0.00 N ATOM 467 CA LEU p 29 12.328 -7.393 -1.266 1.00 0.00 C ATOM 468 C LEU p 29 13.784 -7.096 -1.644 1.00 0.00 C ATOM 469 O LEU p 29 14.582 -8.015 -1.848 1.00 0.00 O ATOM 470 CB LEU p 29 11.421 -7.021 -2.442 1.00 0.00 C ATOM 471 CG LEU p 29 11.085 -8.112 -3.458 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.245 -7.494 -4.551 1.00 0.00 C ATOM 473 CD2 LEU p 29 12.339 -8.735 -4.048 1.00 0.00 C ATOM 0 H LEU p 29 11.316 -5.828 -0.372 1.00 0.00 H new ATOM 0 HA LEU p 29 12.261 -8.454 -1.023 1.00 0.00 H new ATOM 0 HB2 LEU p 29 10.483 -6.643 -2.035 1.00 0.00 H new ATOM 0 HB3 LEU p 29 11.891 -6.197 -2.979 1.00 0.00 H new ATOM 0 HG LEU p 29 10.537 -8.910 -2.957 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.992 -8.255 -5.290 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.330 -7.088 -4.121 1.00 0.00 H new ATOM 0 HD13 LEU p 29 10.806 -6.693 -5.032 1.00 0.00 H new ATOM 0 HD21 LEU p 29 12.059 -9.506 -4.766 1.00 0.00 H new ATOM 0 HD22 LEU p 29 12.925 -7.966 -4.551 1.00 0.00 H new ATOM 0 HD23 LEU p 29 12.934 -9.180 -3.251 1.00 0.00 H new ATOM 485 N GLN p 30 14.106 -5.805 -1.729 1.00 0.00 N ATOM 486 CA GLN p 30 15.444 -5.359 -2.155 1.00 0.00 C ATOM 487 C GLN p 30 16.453 -5.159 -1.012 1.00 0.00 C ATOM 488 O GLN p 30 17.549 -5.728 -1.045 1.00 0.00 O ATOM 489 CB GLN p 30 15.283 -4.089 -3.030 1.00 0.00 C ATOM 490 CG GLN p 30 16.347 -3.014 -2.857 1.00 0.00 C ATOM 491 CD GLN p 30 17.255 -2.885 -4.065 1.00 0.00 C ATOM 492 OE1 GLN p 30 16.979 -2.115 -4.984 1.00 0.00 O ATOM 493 NE2 GLN p 30 18.345 -3.642 -4.068 1.00 0.00 N ATOM 0 H GLN p 30 13.462 -5.045 -1.510 1.00 0.00 H new ATOM 0 HA GLN p 30 15.888 -6.165 -2.739 1.00 0.00 H new ATOM 0 HB2 GLN p 30 15.271 -4.393 -4.077 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.310 -3.646 -2.815 1.00 0.00 H new ATOM 0 HG2 GLN p 30 15.862 -2.056 -2.669 1.00 0.00 H new ATOM 0 HG3 GLN p 30 16.950 -3.244 -1.978 1.00 0.00 H new ATOM 0 HE21 GLN p 30 18.534 -4.267 -3.284 1.00 0.00 H new ATOM 0 HE22 GLN p 30 18.994 -3.599 -4.854 1.00 0.00 H new ATOM 502 N ALA p 31 16.080 -4.361 -0.022 1.00 0.00 N ATOM 503 CA ALA p 31 16.965 -4.023 1.116 1.00 0.00 C ATOM 504 C ALA p 31 17.287 -5.216 2.032 1.00 0.00 C ATOM 505 O ALA p 31 18.173 -5.114 2.888 1.00 0.00 O ATOM 506 CB ALA p 31 16.375 -2.877 1.927 1.00 0.00 C ATOM 0 H ALA p 31 15.160 -3.923 0.028 1.00 0.00 H new ATOM 0 HA ALA p 31 17.914 -3.716 0.676 1.00 0.00 H new ATOM 0 HB1 ALA p 31 17.038 -2.641 2.759 1.00 0.00 H new ATOM 0 HB2 ALA p 31 16.266 -1.999 1.290 1.00 0.00 H new ATOM 0 HB3 ALA p 31 15.398 -3.169 2.313 1.00 0.00 H new ATOM 512 N TRP p 32 16.582 -6.338 1.847 1.00 0.00 N ATOM 513 CA TRP p 32 16.818 -7.537 2.657 1.00 0.00 C ATOM 514 C TRP p 32 17.813 -8.481 1.966 1.00 0.00 C ATOM 515 O TRP p 32 18.918 -8.691 2.473 1.00 0.00 O ATOM 516 CB TRP p 32 15.498 -8.255 2.966 1.00 0.00 C ATOM 517 CG TRP p 32 14.997 -8.008 4.362 1.00 0.00 C ATOM 518 CD1 TRP p 32 14.373 -6.880 4.819 1.00 0.00 C ATOM 519 CD2 TRP p 32 15.073 -8.905 5.482 1.00 0.00 C ATOM 520 NE1 TRP p 32 14.061 -7.020 6.149 1.00 0.00 N ATOM 521 CE2 TRP p 32 14.478 -8.252 6.578 1.00 0.00 C ATOM 522 CE3 TRP p 32 15.585 -10.197 5.666 1.00 0.00 C ATOM 523 CZ2 TRP p 32 14.382 -8.844 7.836 1.00 0.00 C ATOM 524 CZ3 TRP p 32 15.488 -10.781 6.915 1.00 0.00 C ATOM 525 CH2 TRP p 32 14.891 -10.105 7.985 1.00 0.00 C ATOM 0 H TRP p 32 15.847 -6.440 1.147 1.00 0.00 H new ATOM 0 HA TRP p 32 17.259 -7.224 3.603 1.00 0.00 H new ATOM 0 HB2 TRP p 32 14.740 -7.930 2.253 1.00 0.00 H new ATOM 0 HB3 TRP p 32 15.633 -9.327 2.821 1.00 0.00 H new ATOM 0 HD1 TRP p 32 14.157 -6.007 4.221 1.00 0.00 H new ATOM 0 HE1 TRP p 32 13.594 -6.319 6.725 1.00 0.00 H new ATOM 0 HE3 TRP p 32 16.047 -10.727 4.846 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 13.922 -8.325 8.664 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 15.880 -11.776 7.068 1.00 0.00 H new ATOM 0 HH2 TRP p 32 14.831 -10.589 8.949 1.00 0.00 H new ATOM 536 N ASN p 33 17.415 -9.047 0.811 1.00 0.00 N ATOM 537 CA ASN p 33 18.278 -9.959 0.043 1.00 0.00 C ATOM 538 C ASN p 33 17.930 -9.909 -1.458 1.00 0.00 C ATOM 539 O ASN p 33 18.486 -9.082 -2.187 1.00 0.00 O ATOM 540 CB ASN p 33 18.238 -11.409 0.603 1.00 0.00 C ATOM 541 CG ASN p 33 16.834 -11.922 0.899 1.00 0.00 C ATOM 542 OD1 ASN p 33 16.208 -12.566 0.058 1.00 0.00 O ATOM 543 ND2 ASN p 33 16.339 -11.636 2.097 1.00 0.00 N ATOM 0 H ASN p 33 16.500 -8.887 0.390 1.00 0.00 H new ATOM 0 HA ASN p 33 19.306 -9.615 0.156 1.00 0.00 H new ATOM 0 HB2 ASN p 33 18.714 -12.078 -0.114 1.00 0.00 H new ATOM 0 HB3 ASN p 33 18.829 -11.450 1.518 1.00 0.00 H new ATOM 0 HD21 ASN p 33 15.404 -11.953 2.351 1.00 0.00 H new ATOM 0 HD22 ASN p 33 16.894 -11.099 2.763 1.00 0.00 H new ATOM 550 N CYS p 34 17.014 -10.788 -1.917 1.00 0.00 N ATOM 551 CA CYS p 34 16.594 -10.835 -3.328 1.00 0.00 C ATOM 552 C CYS p 34 15.270 -11.587 -3.484 1.00 0.00 C ATOM 553 O CYS p 34 14.331 -11.077 -4.101 1.00 0.00 O ATOM 554 CB CYS p 34 17.672 -11.491 -4.210 1.00 0.00 C ATOM 555 SG CYS p 34 18.125 -13.166 -3.703 1.00 0.00 S ATOM 0 H CYS p 34 16.551 -11.477 -1.325 1.00 0.00 H new ATOM 0 HA CYS p 34 16.454 -9.805 -3.657 1.00 0.00 H new ATOM 0 HB2 CYS p 34 17.316 -11.519 -5.240 1.00 0.00 H new ATOM 0 HB3 CYS p 34 18.565 -10.866 -4.199 1.00 0.00 H new ATOM 0 HG CYS p 34 19.035 -13.632 -4.507 1.00 0.00 H new ATOM 561 N ILE p 35 15.204 -12.812 -2.912 1.00 0.00 N ATOM 562 CA ILE p 35 14.006 -13.688 -2.971 1.00 0.00 C ATOM 563 C ILE p 35 13.576 -13.939 -4.435 1.00 0.00 C ATOM 564 O ILE p 35 12.599 -13.357 -4.924 1.00 0.00 O ATOM 565 CB ILE p 35 12.799 -13.136 -2.126 1.00 0.00 C ATOM 566 CG1 ILE p 35 13.246 -12.714 -0.720 1.00 0.00 C ATOM 567 CG2 ILE p 35 11.684 -14.175 -2.007 1.00 0.00 C ATOM 568 CD1 ILE p 35 13.522 -11.233 -0.587 1.00 0.00 C ATOM 0 H ILE p 35 15.981 -13.223 -2.395 1.00 0.00 H new ATOM 0 HA ILE p 35 14.297 -14.637 -2.520 1.00 0.00 H new ATOM 0 HB ILE p 35 12.418 -12.262 -2.655 1.00 0.00 H new ATOM 0 HG12 ILE p 35 12.475 -12.996 -0.003 1.00 0.00 H new ATOM 0 HG13 ILE p 35 14.146 -13.267 -0.454 1.00 0.00 H new ATOM 0 HG21 ILE p 35 10.865 -13.763 -1.418 1.00 0.00 H new ATOM 0 HG22 ILE p 35 11.321 -14.435 -3.001 1.00 0.00 H new ATOM 0 HG23 ILE p 35 12.070 -15.069 -1.517 1.00 0.00 H new ATOM 0 HD11 ILE p 35 13.833 -11.011 0.434 1.00 0.00 H new ATOM 0 HD12 ILE p 35 14.315 -10.947 -1.278 1.00 0.00 H new ATOM 0 HD13 ILE p 35 12.617 -10.672 -0.821 1.00 0.00 H new ATOM 580 N CYS p 36 14.339 -14.799 -5.124 1.00 0.00 N ATOM 581 CA CYS p 36 14.068 -15.145 -6.526 1.00 0.00 C ATOM 582 C CYS p 36 14.387 -16.617 -6.804 1.00 0.00 C ATOM 583 O CYS p 36 13.636 -17.294 -7.511 1.00 0.00 O ATOM 584 CB CYS p 36 14.881 -14.249 -7.471 1.00 0.00 C ATOM 585 SG CYS p 36 14.483 -14.462 -9.223 1.00 0.00 S ATOM 0 H CYS p 36 15.153 -15.270 -4.730 1.00 0.00 H new ATOM 0 HA CYS p 36 13.006 -14.981 -6.707 1.00 0.00 H new ATOM 0 HB2 CYS p 36 14.716 -13.207 -7.197 1.00 0.00 H new ATOM 0 HB3 CYS p 36 15.942 -14.453 -7.324 1.00 0.00 H new ATOM 0 HG CYS p 36 15.219 -13.662 -9.936 1.00 0.00 H new ATOM 591 N ASP p 37 15.504 -17.099 -6.242 1.00 0.00 N ATOM 592 CA ASP p 37 15.941 -18.487 -6.427 1.00 0.00 C ATOM 593 C ASP p 37 15.440 -19.395 -5.301 1.00 0.00 C ATOM 594 O ASP p 37 15.067 -20.544 -5.550 1.00 0.00 O ATOM 595 CB ASP p 37 17.469 -18.558 -6.510 1.00 0.00 C ATOM 596 CG ASP p 37 18.013 -17.963 -7.796 1.00 0.00 C ATOM 597 OD1 ASP p 37 18.151 -18.713 -8.785 1.00 0.00 O ATOM 598 OD2 ASP p 37 18.300 -16.747 -7.813 1.00 0.00 O ATOM 0 H ASP p 37 16.124 -16.543 -5.652 1.00 0.00 H new ATOM 0 HA ASP p 37 15.510 -18.842 -7.363 1.00 0.00 H new ATOM 0 HB2 ASP p 37 17.900 -18.030 -5.659 1.00 0.00 H new ATOM 0 HB3 ASP p 37 17.785 -19.598 -6.433 1.00 0.00 H new ATOM 603 N ILE p 38 15.436 -18.869 -4.068 1.00 0.00 N ATOM 604 CA ILE p 38 14.984 -19.630 -2.894 1.00 0.00 C ATOM 605 C ILE p 38 13.490 -19.419 -2.628 1.00 0.00 C ATOM 606 O ILE p 38 13.054 -18.306 -2.323 1.00 0.00 O ATOM 607 CB ILE p 38 15.808 -19.301 -1.609 1.00 0.00 C ATOM 608 CG1 ILE p 38 16.002 -17.785 -1.401 1.00 0.00 C ATOM 609 CG2 ILE p 38 17.159 -19.999 -1.659 1.00 0.00 C ATOM 610 CD1 ILE p 38 15.079 -17.192 -0.360 1.00 0.00 C ATOM 0 H ILE p 38 15.741 -17.919 -3.857 1.00 0.00 H new ATOM 0 HA ILE p 38 15.154 -20.680 -3.134 1.00 0.00 H new ATOM 0 HB ILE p 38 15.235 -19.671 -0.759 1.00 0.00 H new ATOM 0 HG12 ILE p 38 17.035 -17.597 -1.108 1.00 0.00 H new ATOM 0 HG13 ILE p 38 15.842 -17.273 -2.350 1.00 0.00 H new ATOM 0 HG21 ILE p 38 17.725 -19.762 -0.758 1.00 0.00 H new ATOM 0 HG22 ILE p 38 17.010 -21.077 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE p 38 17.712 -19.659 -2.534 1.00 0.00 H new ATOM 0 HD11 ILE p 38 15.273 -16.123 -0.268 1.00 0.00 H new ATOM 0 HD12 ILE p 38 14.043 -17.348 -0.661 1.00 0.00 H new ATOM 0 HD13 ILE p 38 15.255 -17.676 0.600 1.00 0.00 H new ATOM 622 N GLU p 39 12.719 -20.503 -2.762 1.00 0.00 N ATOM 623 CA GLU p 39 11.271 -20.473 -2.541 1.00 0.00 C ATOM 624 C GLU p 39 10.839 -21.617 -1.630 1.00 0.00 C ATOM 625 O GLU p 39 11.458 -22.686 -1.627 1.00 0.00 O ATOM 626 CB GLU p 39 10.517 -20.559 -3.874 1.00 0.00 C ATOM 627 CG GLU p 39 10.725 -19.354 -4.780 1.00 0.00 C ATOM 628 CD GLU p 39 9.761 -19.330 -5.951 1.00 0.00 C ATOM 629 OE1 GLU p 39 10.100 -19.900 -7.011 1.00 0.00 O ATOM 630 OE2 GLU p 39 8.668 -18.743 -5.809 1.00 0.00 O ATOM 0 H GLU p 39 13.079 -21.420 -3.025 1.00 0.00 H new ATOM 0 HA GLU p 39 11.027 -19.527 -2.058 1.00 0.00 H new ATOM 0 HB2 GLU p 39 10.835 -21.458 -4.403 1.00 0.00 H new ATOM 0 HB3 GLU p 39 9.452 -20.669 -3.671 1.00 0.00 H new ATOM 0 HG2 GLU p 39 10.605 -18.441 -4.197 1.00 0.00 H new ATOM 0 HG3 GLU p 39 11.748 -19.360 -5.157 1.00 0.00 H new ATOM 637 N ASN p 40 9.772 -21.383 -0.861 1.00 0.00 N ATOM 638 CA ASN p 40 9.239 -22.385 0.062 1.00 0.00 C ATOM 639 C ASN p 40 7.746 -22.601 -0.172 1.00 0.00 C ATOM 640 O ASN p 40 6.966 -21.642 -0.180 1.00 0.00 O ATOM 641 CB ASN p 40 9.486 -21.966 1.515 1.00 0.00 C ATOM 642 CG ASN p 40 10.951 -22.045 1.905 1.00 0.00 C ATOM 643 OD1 ASN p 40 11.697 -21.077 1.758 1.00 0.00 O ATOM 644 ND2 ASN p 40 11.368 -23.202 2.406 1.00 0.00 N ATOM 0 H ASN p 40 9.258 -20.502 -0.861 1.00 0.00 H new ATOM 0 HA ASN p 40 9.759 -23.324 -0.127 1.00 0.00 H new ATOM 0 HB2 ASN p 40 9.130 -20.946 1.661 1.00 0.00 H new ATOM 0 HB3 ASN p 40 8.903 -22.605 2.178 1.00 0.00 H new ATOM 0 HD21 ASN p 40 12.342 -23.315 2.687 1.00 0.00 H new ATOM 0 HD22 ASN p 40 10.714 -23.978 2.510 1.00 0.00 H new ATOM 651 N CYS p 41 7.362 -23.867 -0.364 1.00 0.00 N ATOM 652 CA CYS p 41 5.966 -24.233 -0.600 1.00 0.00 C ATOM 653 C CYS p 41 5.532 -25.348 0.350 1.00 0.00 C ATOM 654 O CYS p 41 6.111 -26.440 0.344 1.00 0.00 O ATOM 655 CB CYS p 41 5.769 -24.672 -2.054 1.00 0.00 C ATOM 656 SG CYS p 41 6.368 -23.478 -3.272 1.00 0.00 S ATOM 0 H CYS p 41 8.005 -24.659 -0.360 1.00 0.00 H new ATOM 0 HA CYS p 41 5.346 -23.357 -0.410 1.00 0.00 H new ATOM 0 HB2 CYS p 41 6.282 -25.621 -2.209 1.00 0.00 H new ATOM 0 HB3 CYS p 41 4.708 -24.851 -2.228 1.00 0.00 H new ATOM 0 HG CYS p 41 6.160 -23.938 -4.470 1.00 0.00 H new ATOM 662 N SER p 42 4.516 -25.057 1.173 1.00 0.00 N ATOM 663 CA SER p 42 3.991 -26.025 2.141 1.00 0.00 C ATOM 664 C SER p 42 2.461 -26.010 2.176 1.00 0.00 C ATOM 665 O SER p 42 1.828 -27.069 2.128 1.00 0.00 O ATOM 666 CB SER p 42 4.557 -25.746 3.542 1.00 0.00 C ATOM 667 OG SER p 42 4.321 -24.404 3.933 1.00 0.00 O ATOM 0 H SER p 42 4.041 -24.155 1.186 1.00 0.00 H new ATOM 0 HA SER p 42 4.309 -27.017 1.821 1.00 0.00 H new ATOM 0 HB2 SER p 42 4.100 -26.423 4.263 1.00 0.00 H new ATOM 0 HB3 SER p 42 5.628 -25.947 3.551 1.00 0.00 H new ATOM 0 HG SER p 42 4.690 -24.255 4.829 1.00 0.00 H new ATOM 673 N ASN p 43 1.876 -24.804 2.260 1.00 0.00 N ATOM 674 CA ASN p 43 0.416 -24.644 2.310 1.00 0.00 C ATOM 675 C ASN p 43 -0.068 -23.503 1.412 1.00 0.00 C ATOM 676 O ASN p 43 -1.221 -23.507 0.972 1.00 0.00 O ATOM 677 CB ASN p 43 -0.047 -24.391 3.751 1.00 0.00 C ATOM 678 CG ASN p 43 0.102 -25.615 4.637 1.00 0.00 C ATOM 679 OD1 ASN p 43 1.141 -25.818 5.265 1.00 0.00 O ATOM 680 ND2 ASN p 43 -0.940 -26.437 4.691 1.00 0.00 N ATOM 0 H ASN p 43 2.393 -23.926 2.295 1.00 0.00 H new ATOM 0 HA ASN p 43 -0.019 -25.573 1.941 1.00 0.00 H new ATOM 0 HB2 ASN p 43 0.529 -23.568 4.174 1.00 0.00 H new ATOM 0 HB3 ASN p 43 -1.091 -24.078 3.743 1.00 0.00 H new ATOM 0 HD21 ASN p 43 -0.898 -27.276 5.270 1.00 0.00 H new ATOM 0 HD22 ASN p 43 -1.782 -26.229 4.154 1.00 0.00 H new ATOM 687 N MET p 44 0.823 -22.519 1.147 1.00 0.00 N ATOM 688 CA MET p 44 0.517 -21.332 0.302 1.00 0.00 C ATOM 689 C MET p 44 -0.566 -20.430 0.931 1.00 0.00 C ATOM 690 O MET p 44 -1.154 -19.576 0.255 1.00 0.00 O ATOM 691 CB MET p 44 0.106 -21.750 -1.127 1.00 0.00 C ATOM 692 CG MET p 44 1.271 -22.199 -1.994 1.00 0.00 C ATOM 693 SD MET p 44 2.442 -20.867 -2.327 1.00 0.00 S ATOM 694 CE MET p 44 3.565 -21.679 -3.461 1.00 0.00 C ATOM 0 H MET p 44 1.776 -22.522 1.511 1.00 0.00 H new ATOM 0 HA MET p 44 1.436 -20.749 0.242 1.00 0.00 H new ATOM 0 HB2 MET p 44 -0.621 -22.560 -1.064 1.00 0.00 H new ATOM 0 HB3 MET p 44 -0.393 -20.911 -1.612 1.00 0.00 H new ATOM 0 HG2 MET p 44 1.791 -23.020 -1.500 1.00 0.00 H new ATOM 0 HG3 MET p 44 0.888 -22.586 -2.938 1.00 0.00 H new ATOM 0 HE1 MET p 44 4.566 -21.264 -3.341 1.00 0.00 H new ATOM 0 HE2 MET p 44 3.587 -22.748 -3.248 1.00 0.00 H new ATOM 0 HE3 MET p 44 3.226 -21.520 -4.485 1.00 0.00 H new ATOM 704 N ALA p 45 -0.799 -20.616 2.237 1.00 0.00 N ATOM 705 CA ALA p 45 -1.796 -19.842 2.980 1.00 0.00 C ATOM 706 C ALA p 45 -1.200 -18.577 3.637 1.00 0.00 C ATOM 707 O ALA p 45 -1.853 -17.530 3.608 1.00 0.00 O ATOM 708 CB ALA p 45 -2.472 -20.716 4.028 1.00 0.00 C ATOM 0 H ALA p 45 -0.303 -21.304 2.804 1.00 0.00 H new ATOM 0 HA ALA p 45 -2.538 -19.504 2.257 1.00 0.00 H new ATOM 0 HB1 ALA p 45 -3.210 -20.127 4.572 1.00 0.00 H new ATOM 0 HB2 ALA p 45 -2.967 -21.555 3.538 1.00 0.00 H new ATOM 0 HB3 ALA p 45 -1.724 -21.093 4.725 1.00 0.00 H new ATOM 714 N PRO p 46 0.041 -18.626 4.245 1.00 0.00 N ATOM 715 CA PRO p 46 0.654 -17.439 4.896 1.00 0.00 C ATOM 716 C PRO p 46 0.883 -16.266 3.936 1.00 0.00 C ATOM 717 O PRO p 46 0.884 -16.443 2.714 1.00 0.00 O ATOM 718 CB PRO p 46 1.999 -17.964 5.420 1.00 0.00 C ATOM 719 CG PRO p 46 1.834 -19.437 5.508 1.00 0.00 C ATOM 720 CD PRO p 46 0.935 -19.808 4.368 1.00 0.00 C ATOM 0 HA PRO p 46 -0.001 -17.038 5.669 1.00 0.00 H new ATOM 0 HB2 PRO p 46 2.814 -17.699 4.747 1.00 0.00 H new ATOM 0 HB3 PRO p 46 2.237 -17.535 6.394 1.00 0.00 H new ATOM 0 HG2 PRO p 46 2.795 -19.945 5.431 1.00 0.00 H new ATOM 0 HG3 PRO p 46 1.396 -19.726 6.463 1.00 0.00 H new ATOM 0 HD2 PRO p 46 1.498 -19.985 3.452 1.00 0.00 H new ATOM 0 HD3 PRO p 46 0.373 -20.718 4.577 1.00 0.00 H new ATOM 728 N LEU p 47 1.077 -15.072 4.513 1.00 0.00 N ATOM 729 CA LEU p 47 1.303 -13.839 3.747 1.00 0.00 C ATOM 730 C LEU p 47 2.764 -13.689 3.304 1.00 0.00 C ATOM 731 O LEU p 47 3.094 -12.807 2.503 1.00 0.00 O ATOM 732 CB LEU p 47 0.913 -12.631 4.603 1.00 0.00 C ATOM 733 CG LEU p 47 -0.576 -12.511 4.950 1.00 0.00 C ATOM 734 CD1 LEU p 47 -0.909 -13.288 6.219 1.00 0.00 C ATOM 735 CD2 LEU p 47 -0.961 -11.052 5.108 1.00 0.00 C ATOM 0 H LEU p 47 1.082 -14.934 5.524 1.00 0.00 H new ATOM 0 HA LEU p 47 0.687 -13.893 2.850 1.00 0.00 H new ATOM 0 HB2 LEU p 47 1.481 -12.670 5.532 1.00 0.00 H new ATOM 0 HB3 LEU p 47 1.219 -11.725 4.080 1.00 0.00 H new ATOM 0 HG LEU p 47 -1.151 -12.942 4.131 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -1.971 -13.185 6.441 1.00 0.00 H new ATOM 0 HD12 LEU p 47 -0.669 -14.341 6.074 1.00 0.00 H new ATOM 0 HD13 LEU p 47 -0.325 -12.894 7.051 1.00 0.00 H new ATOM 0 HD21 LEU p 47 -2.020 -10.980 5.354 1.00 0.00 H new ATOM 0 HD22 LEU p 47 -0.371 -10.605 5.908 1.00 0.00 H new ATOM 0 HD23 LEU p 47 -0.768 -10.522 4.175 1.00 0.00 H new ATOM 747 N TYR p 48 3.618 -14.562 3.831 1.00 0.00 N ATOM 748 CA TYR p 48 5.058 -14.552 3.534 1.00 0.00 C ATOM 749 C TYR p 48 5.401 -15.468 2.346 1.00 0.00 C ATOM 750 O TYR p 48 6.572 -15.801 2.120 1.00 0.00 O ATOM 751 CB TYR p 48 5.850 -14.981 4.784 1.00 0.00 C ATOM 752 CG TYR p 48 5.591 -14.123 6.007 1.00 0.00 C ATOM 753 CD1 TYR p 48 4.494 -14.364 6.826 1.00 0.00 C ATOM 754 CD2 TYR p 48 6.438 -13.072 6.337 1.00 0.00 C ATOM 755 CE1 TYR p 48 4.250 -13.586 7.941 1.00 0.00 C ATOM 756 CE2 TYR p 48 6.200 -12.289 7.452 1.00 0.00 C ATOM 757 CZ TYR p 48 5.104 -12.549 8.249 1.00 0.00 C ATOM 758 OH TYR p 48 4.864 -11.771 9.357 1.00 0.00 O ATOM 0 H TYR p 48 3.337 -15.299 4.477 1.00 0.00 H new ATOM 0 HA TYR p 48 5.338 -13.536 3.256 1.00 0.00 H new ATOM 0 HB2 TYR p 48 5.602 -16.016 5.020 1.00 0.00 H new ATOM 0 HB3 TYR p 48 6.915 -14.953 4.553 1.00 0.00 H new ATOM 0 HD1 TYR p 48 3.821 -15.174 6.586 1.00 0.00 H new ATOM 0 HD2 TYR p 48 7.295 -12.863 5.714 1.00 0.00 H new ATOM 0 HE1 TYR p 48 3.395 -13.789 8.568 1.00 0.00 H new ATOM 0 HE2 TYR p 48 6.869 -11.478 7.698 1.00 0.00 H new ATOM 0 HH TYR p 48 5.560 -11.085 9.432 1.00 0.00 H new ATOM 768 N SER p 49 4.372 -15.848 1.575 1.00 0.00 N ATOM 769 CA SER p 49 4.543 -16.721 0.411 1.00 0.00 C ATOM 770 C SER p 49 4.821 -15.903 -0.863 1.00 0.00 C ATOM 771 O SER p 49 5.044 -14.691 -0.792 1.00 0.00 O ATOM 772 CB SER p 49 3.297 -17.604 0.240 1.00 0.00 C ATOM 773 OG SER p 49 3.052 -18.371 1.406 1.00 0.00 O ATOM 0 H SER p 49 3.407 -15.561 1.741 1.00 0.00 H new ATOM 0 HA SER p 49 5.409 -17.362 0.578 1.00 0.00 H new ATOM 0 HB2 SER p 49 2.431 -16.978 0.024 1.00 0.00 H new ATOM 0 HB3 SER p 49 3.432 -18.268 -0.614 1.00 0.00 H new ATOM 0 HG SER p 49 2.395 -17.911 1.968 1.00 0.00 H new ATOM 779 N ASP p 50 4.805 -16.581 -2.020 1.00 0.00 N ATOM 780 CA ASP p 50 5.064 -15.940 -3.317 1.00 0.00 C ATOM 781 C ASP p 50 3.754 -15.578 -4.015 1.00 0.00 C ATOM 782 O ASP p 50 3.635 -14.502 -4.608 1.00 0.00 O ATOM 783 CB ASP p 50 5.903 -16.858 -4.214 1.00 0.00 C ATOM 784 CG ASP p 50 7.332 -17.006 -3.725 1.00 0.00 C ATOM 785 OD1 ASP p 50 8.188 -16.197 -4.140 1.00 0.00 O ATOM 786 OD2 ASP p 50 7.594 -17.930 -2.927 1.00 0.00 O ATOM 0 H ASP p 50 4.614 -17.581 -2.083 1.00 0.00 H new ATOM 0 HA ASP p 50 5.623 -15.023 -3.134 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.435 -17.841 -4.260 1.00 0.00 H new ATOM 0 HB3 ASP p 50 5.910 -16.461 -5.229 1.00 0.00 H new ATOM 791 N GLN p 51 2.777 -16.492 -3.934 1.00 0.00 N ATOM 792 CA GLN p 51 1.447 -16.295 -4.527 1.00 0.00 C ATOM 793 C GLN p 51 0.575 -15.406 -3.628 1.00 0.00 C ATOM 794 O GLN p 51 -0.521 -15.004 -4.011 1.00 0.00 O ATOM 795 CB GLN p 51 0.757 -17.645 -4.759 1.00 0.00 C ATOM 796 CG GLN p 51 1.342 -18.444 -5.915 1.00 0.00 C ATOM 797 CD GLN p 51 0.644 -19.775 -6.115 1.00 0.00 C ATOM 798 OE1 GLN p 51 1.036 -20.788 -5.536 1.00 0.00 O ATOM 799 NE2 GLN p 51 -0.398 -19.779 -6.937 1.00 0.00 N ATOM 0 H GLN p 51 2.886 -17.387 -3.457 1.00 0.00 H new ATOM 0 HA GLN p 51 1.576 -15.796 -5.487 1.00 0.00 H new ATOM 0 HB2 GLN p 51 0.826 -18.239 -3.848 1.00 0.00 H new ATOM 0 HB3 GLN p 51 -0.303 -17.473 -4.948 1.00 0.00 H new ATOM 0 HG2 GLN p 51 1.268 -17.858 -6.831 1.00 0.00 H new ATOM 0 HG3 GLN p 51 2.402 -18.618 -5.732 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -0.689 -18.916 -7.396 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -0.908 -20.645 -7.110 1.00 0.00 H new ATOM 808 N ALA p 52 1.087 -15.136 -2.424 1.00 0.00 N ATOM 809 CA ALA p 52 0.409 -14.308 -1.425 1.00 0.00 C ATOM 810 C ALA p 52 0.864 -12.838 -1.483 1.00 0.00 C ATOM 811 O ALA p 52 0.326 -11.992 -0.775 1.00 0.00 O ATOM 812 CB ALA p 52 0.673 -14.887 -0.040 1.00 0.00 C ATOM 0 H ALA p 52 1.992 -15.490 -2.113 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.659 -14.318 -1.641 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.172 -14.277 0.711 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.291 -15.907 0.007 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.746 -14.892 0.154 1.00 0.00 H new ATOM 818 N LEU p 53 1.877 -12.565 -2.308 1.00 0.00 N ATOM 819 CA LEU p 53 2.465 -11.250 -2.461 1.00 0.00 C ATOM 820 C LEU p 53 1.859 -10.512 -3.650 1.00 0.00 C ATOM 821 O LEU p 53 1.091 -9.574 -3.483 1.00 0.00 O ATOM 822 CB LEU p 53 3.976 -11.442 -2.634 1.00 0.00 C ATOM 823 CG LEU p 53 4.858 -10.218 -2.449 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.191 -10.671 -1.904 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.040 -9.493 -3.772 1.00 0.00 C ATOM 0 H LEU p 53 2.315 -13.273 -2.897 1.00 0.00 H new ATOM 0 HA LEU p 53 2.261 -10.637 -1.583 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.303 -12.204 -1.926 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.154 -11.838 -3.634 1.00 0.00 H new ATOM 0 HG LEU p 53 4.391 -9.523 -1.751 1.00 0.00 H new ATOM 0 HD11 LEU p 53 6.840 -9.806 -1.764 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.042 -11.172 -0.947 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.655 -11.363 -2.607 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.674 -8.619 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.509 -10.163 -4.493 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.068 -9.176 -4.150 1.00 0.00 H new ATOM 837 N LYS p 54 2.187 -11.006 -4.847 1.00 0.00 N ATOM 838 CA LYS p 54 1.717 -10.437 -6.131 1.00 0.00 C ATOM 839 C LYS p 54 0.189 -10.478 -6.260 1.00 0.00 C ATOM 840 O LYS p 54 -0.383 -9.856 -7.151 1.00 0.00 O ATOM 841 CB LYS p 54 2.352 -11.191 -7.305 1.00 0.00 C ATOM 842 CG LYS p 54 3.832 -10.895 -7.501 1.00 0.00 C ATOM 843 CD LYS p 54 4.407 -11.683 -8.667 1.00 0.00 C ATOM 844 CE LYS p 54 5.887 -11.396 -8.859 1.00 0.00 C ATOM 845 NZ LYS p 54 6.463 -12.169 -9.994 1.00 0.00 N ATOM 0 H LYS p 54 2.791 -11.820 -4.962 1.00 0.00 H new ATOM 0 HA LYS p 54 2.023 -9.391 -6.151 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.224 -12.262 -7.148 1.00 0.00 H new ATOM 0 HB3 LYS p 54 1.817 -10.936 -8.220 1.00 0.00 H new ATOM 0 HG2 LYS p 54 3.971 -9.828 -7.677 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.377 -11.141 -6.590 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.262 -12.749 -8.493 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.866 -11.432 -9.579 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.029 -10.330 -9.037 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.425 -11.641 -7.943 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.474 -11.944 -10.090 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.351 -13.187 -9.813 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.967 -11.917 -10.873 1.00 0.00 H new ATOM 859 N LYS p 55 -0.435 -11.237 -5.363 1.00 0.00 N ATOM 860 CA LYS p 55 -1.869 -11.406 -5.292 1.00 0.00 C ATOM 861 C LYS p 55 -2.441 -10.454 -4.265 1.00 0.00 C ATOM 862 O LYS p 55 -3.474 -9.831 -4.499 1.00 0.00 O ATOM 863 CB LYS p 55 -2.215 -12.849 -4.947 1.00 0.00 C ATOM 864 CG LYS p 55 -2.449 -13.739 -6.162 1.00 0.00 C ATOM 865 CD LYS p 55 -3.912 -13.748 -6.586 1.00 0.00 C ATOM 866 CE LYS p 55 -4.136 -14.641 -7.797 1.00 0.00 C ATOM 867 NZ LYS p 55 -5.563 -14.653 -8.224 1.00 0.00 N ATOM 0 H LYS p 55 0.066 -11.764 -4.647 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.308 -11.178 -6.263 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.407 -13.272 -4.350 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -3.110 -12.858 -4.325 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -1.833 -13.391 -6.991 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -2.131 -14.756 -5.934 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.530 -14.095 -5.758 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -4.231 -12.732 -6.818 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.513 -14.296 -8.622 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.819 -15.657 -7.562 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -5.672 -15.273 -9.052 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -6.155 -15.007 -7.446 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -5.859 -13.688 -8.473 1.00 0.00 H new ATOM 881 N LYS p 56 -1.744 -10.353 -3.120 1.00 0.00 N ATOM 882 CA LYS p 56 -2.161 -9.434 -2.034 1.00 0.00 C ATOM 883 C LYS p 56 -1.786 -7.988 -2.381 1.00 0.00 C ATOM 884 O LYS p 56 -2.223 -7.036 -1.733 1.00 0.00 O ATOM 885 CB LYS p 56 -1.547 -9.827 -0.695 1.00 0.00 C ATOM 886 CG LYS p 56 -2.356 -10.876 0.055 1.00 0.00 C ATOM 887 CD LYS p 56 -1.992 -10.919 1.531 1.00 0.00 C ATOM 888 CE LYS p 56 -2.913 -11.851 2.306 1.00 0.00 C ATOM 889 NZ LYS p 56 -2.556 -13.283 2.105 1.00 0.00 N ATOM 0 H LYS p 56 -0.899 -10.887 -2.919 1.00 0.00 H new ATOM 0 HA LYS p 56 -3.244 -9.510 -1.940 1.00 0.00 H new ATOM 0 HB2 LYS p 56 -0.539 -10.207 -0.863 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -1.452 -8.938 -0.072 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -3.419 -10.660 -0.051 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -2.184 -11.856 -0.391 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -0.960 -11.250 1.643 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -2.052 -9.915 1.951 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -2.862 -11.610 3.368 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -3.943 -11.687 1.991 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -2.712 -13.807 2.990 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -3.151 -13.687 1.354 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -1.555 -13.356 1.831 1.00 0.00 H new ATOM 903 N LEU p 57 -0.963 -7.884 -3.421 1.00 0.00 N ATOM 904 CA LEU p 57 -0.476 -6.641 -3.993 1.00 0.00 C ATOM 905 C LEU p 57 -1.420 -6.267 -5.098 1.00 0.00 C ATOM 906 O LEU p 57 -1.815 -5.113 -5.254 1.00 0.00 O ATOM 907 CB LEU p 57 0.916 -6.843 -4.580 1.00 0.00 C ATOM 908 CG LEU p 57 2.102 -6.338 -3.766 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.215 -7.066 -2.432 1.00 0.00 C ATOM 910 CD2 LEU p 57 3.350 -6.537 -4.592 1.00 0.00 C ATOM 0 H LEU p 57 -0.603 -8.705 -3.908 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.422 -5.865 -3.229 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.057 -7.910 -4.753 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.944 -6.355 -5.554 1.00 0.00 H new ATOM 0 HG LEU p 57 1.964 -5.282 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.071 -6.680 -1.878 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.306 -6.906 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.349 -8.133 -2.610 1.00 0.00 H new ATOM 0 HD21 LEU p 57 4.216 -6.184 -4.033 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.472 -7.596 -4.818 1.00 0.00 H new ATOM 0 HD23 LEU p 57 3.264 -5.975 -5.522 1.00 0.00 H new ATOM 922 N ALA p 58 -1.750 -7.303 -5.880 1.00 0.00 N ATOM 923 CA ALA p 58 -2.727 -7.173 -6.982 1.00 0.00 C ATOM 924 C ALA p 58 -4.131 -6.933 -6.416 1.00 0.00 C ATOM 925 O ALA p 58 -5.038 -6.496 -7.127 1.00 0.00 O ATOM 926 CB ALA p 58 -2.723 -8.399 -7.881 1.00 0.00 C ATOM 0 H ALA p 58 -1.359 -8.239 -5.775 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.434 -6.317 -7.589 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.453 -8.267 -8.679 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -1.731 -8.529 -8.314 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -2.981 -9.281 -7.295 1.00 0.00 H new ATOM 932 N GLN p 59 -4.270 -7.240 -5.121 1.00 0.00 N ATOM 933 CA GLN p 59 -5.478 -7.045 -4.363 1.00 0.00 C ATOM 934 C GLN p 59 -5.372 -5.701 -3.645 1.00 0.00 C ATOM 935 O GLN p 59 -6.373 -5.079 -3.319 1.00 0.00 O ATOM 936 CB GLN p 59 -5.601 -8.205 -3.372 1.00 0.00 C ATOM 937 CG GLN p 59 -6.525 -7.945 -2.208 1.00 0.00 C ATOM 938 CD GLN p 59 -7.608 -8.995 -2.058 1.00 0.00 C ATOM 939 OE1 GLN p 59 -7.426 -9.996 -1.364 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.743 -8.773 -2.710 1.00 0.00 N ATOM 0 H GLN p 59 -3.513 -7.642 -4.569 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.365 -7.031 -4.996 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.953 -9.087 -3.908 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.610 -8.441 -2.986 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.939 -7.903 -1.290 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.991 -6.968 -2.334 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.851 -7.930 -3.274 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.507 -9.446 -2.647 1.00 0.00 H new ATOM 949 N LEU p 60 -4.118 -5.305 -3.408 1.00 0.00 N ATOM 950 CA LEU p 60 -3.737 -4.048 -2.757 1.00 0.00 C ATOM 951 C LEU p 60 -3.923 -2.874 -3.713 1.00 0.00 C ATOM 952 O LEU p 60 -4.327 -1.791 -3.325 1.00 0.00 O ATOM 953 CB LEU p 60 -2.263 -4.154 -2.349 1.00 0.00 C ATOM 954 CG LEU p 60 -1.616 -2.908 -1.749 1.00 0.00 C ATOM 955 CD1 LEU p 60 -2.362 -2.476 -0.508 1.00 0.00 C ATOM 956 CD2 LEU p 60 -0.160 -3.192 -1.457 1.00 0.00 C ATOM 0 H LEU p 60 -3.312 -5.871 -3.673 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.366 -3.878 -1.883 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.169 -4.965 -1.627 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.688 -4.443 -3.229 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.668 -2.085 -2.462 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -1.890 -1.587 -0.091 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -3.397 -2.250 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -2.338 -3.279 0.229 1.00 0.00 H new ATOM 0 HD21 LEU p 60 0.305 -2.304 -1.028 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -0.085 -4.018 -0.750 1.00 0.00 H new ATOM 0 HD23 LEU p 60 0.351 -3.459 -2.382 1.00 0.00 H new ATOM 968 N LYS p 61 -3.527 -3.152 -4.941 1.00 0.00 N ATOM 969 CA LYS p 61 -3.611 -2.282 -6.099 1.00 0.00 C ATOM 970 C LYS p 61 -5.060 -2.207 -6.532 1.00 0.00 C ATOM 971 O LYS p 61 -5.538 -1.187 -7.036 1.00 0.00 O ATOM 972 CB LYS p 61 -2.739 -2.852 -7.222 1.00 0.00 C ATOM 973 CG LYS p 61 -1.662 -1.897 -7.695 1.00 0.00 C ATOM 974 CD LYS p 61 -1.340 -2.102 -9.166 1.00 0.00 C ATOM 975 CE LYS p 61 -0.269 -1.135 -9.641 1.00 0.00 C ATOM 976 NZ LYS p 61 0.033 -1.307 -11.089 1.00 0.00 N ATOM 0 H LYS p 61 -3.109 -4.054 -5.171 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.253 -1.281 -5.859 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -2.270 -3.773 -6.875 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.375 -3.117 -8.067 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -1.989 -0.870 -7.533 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -0.760 -2.042 -7.101 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -1.004 -3.126 -9.327 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -2.244 -1.966 -9.760 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -0.597 -0.112 -9.458 1.00 0.00 H new ATOM 0 HE3 LYS p 61 0.641 -1.287 -9.060 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 0.768 -0.629 -11.373 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 0.370 -2.276 -11.261 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -0.829 -1.137 -11.646 1.00 0.00 H new ATOM 990 N TRP p 62 -5.739 -3.339 -6.311 1.00 0.00 N ATOM 991 CA TRP p 62 -7.166 -3.470 -6.553 1.00 0.00 C ATOM 992 C TRP p 62 -7.858 -2.754 -5.415 1.00 0.00 C ATOM 993 O TRP p 62 -8.953 -2.204 -5.566 1.00 0.00 O ATOM 994 CB TRP p 62 -7.586 -4.939 -6.600 1.00 0.00 C ATOM 995 CG TRP p 62 -8.544 -5.250 -7.715 1.00 0.00 C ATOM 996 CD1 TRP p 62 -9.906 -5.182 -7.660 1.00 0.00 C ATOM 997 CD2 TRP p 62 -8.216 -5.679 -9.047 1.00 0.00 C ATOM 998 NE1 TRP p 62 -10.446 -5.540 -8.871 1.00 0.00 N ATOM 999 CE2 TRP p 62 -9.431 -5.850 -9.738 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -7.016 -5.936 -9.724 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -9.482 -6.263 -11.068 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -7.069 -6.346 -11.043 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -8.295 -6.506 -11.703 1.00 0.00 C ATOM 0 H TRP p 62 -5.304 -4.191 -5.957 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.437 -3.039 -7.517 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -6.697 -5.560 -6.711 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.047 -5.208 -5.649 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -10.476 -4.889 -6.791 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -11.442 -5.570 -9.090 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -6.066 -5.816 -9.224 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -10.425 -6.387 -11.579 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -6.150 -6.546 -11.574 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -8.303 -6.828 -12.734 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.170 -2.787 -4.263 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.617 -2.077 -3.064 1.00 0.00 C ATOM 1016 C LYS p 63 -7.130 -0.624 -3.097 1.00 0.00 C ATOM 1017 O LYS p 63 -7.593 0.202 -2.320 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.121 -2.762 -1.794 1.00 0.00 C ATOM 1019 CG LYS p 63 -8.083 -3.803 -1.249 1.00 0.00 C ATOM 1020 CD LYS p 63 -7.692 -4.248 0.151 1.00 0.00 C ATOM 1021 CE LYS p 63 -8.647 -5.304 0.687 1.00 0.00 C ATOM 1022 NZ LYS p 63 -8.266 -5.756 2.054 1.00 0.00 N ATOM 0 H LYS p 63 -6.298 -3.302 -4.141 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.707 -2.093 -3.054 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.162 -3.238 -1.999 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -6.945 -2.006 -1.029 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -9.093 -3.393 -1.232 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -8.101 -4.666 -1.914 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -6.678 -4.647 0.137 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.687 -3.387 0.820 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -9.660 -4.901 0.707 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -8.658 -6.160 0.012 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -8.942 -6.475 2.383 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -7.310 -6.164 2.031 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -8.280 -4.945 2.704 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.169 -0.355 -3.999 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.583 0.972 -4.205 1.00 0.00 C ATOM 1038 C LEU p 64 -6.376 1.739 -5.263 1.00 0.00 C ATOM 1039 O LEU p 64 -6.263 2.950 -5.401 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.107 0.817 -4.642 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.240 2.090 -4.751 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -3.263 2.610 -6.176 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.711 3.163 -3.787 1.00 0.00 C ATOM 0 H LEU p 64 -5.775 -1.068 -4.613 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.622 1.535 -3.273 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.620 0.142 -3.938 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.098 0.324 -5.614 1.00 0.00 H new ATOM 0 HG LEU p 64 -2.216 1.830 -4.482 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -2.649 3.508 -6.246 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -2.868 1.848 -6.848 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -4.288 2.848 -6.460 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.080 4.046 -3.889 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -4.744 3.427 -4.013 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.648 2.788 -2.766 1.00 0.00 H new ATOM 1055 N GLN p 65 -7.145 0.963 -5.988 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.035 1.378 -7.043 1.00 0.00 C ATOM 1057 C GLN p 65 -9.399 1.519 -6.394 1.00 0.00 C ATOM 1058 O GLN p 65 -10.294 2.187 -6.892 1.00 0.00 O ATOM 1059 CB GLN p 65 -8.015 0.298 -8.137 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.276 0.216 -8.974 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.001 0.209 -10.465 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -8.944 1.261 -11.103 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -8.829 -0.981 -11.030 1.00 0.00 N ATOM 0 H GLN p 65 -7.166 -0.047 -5.845 1.00 0.00 H new ATOM 0 HA GLN p 65 -7.753 2.320 -7.513 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.169 0.486 -8.798 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -7.844 -0.671 -7.668 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -9.824 -0.688 -8.707 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -9.920 1.062 -8.733 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -8.885 -1.827 -10.463 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -8.641 -1.048 -12.030 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.482 0.826 -5.260 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.643 0.784 -4.384 1.00 0.00 C ATOM 1074 C ALA p 66 -10.434 1.825 -3.307 1.00 0.00 C ATOM 1075 O ALA p 66 -11.373 2.263 -2.652 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.831 -0.596 -3.773 1.00 0.00 C ATOM 0 H ALA p 66 -8.709 0.257 -4.916 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.548 0.996 -4.954 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.707 -0.591 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -10.972 -1.329 -4.567 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -9.949 -0.859 -3.189 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.146 2.178 -3.142 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.700 3.214 -2.220 1.00 0.00 C ATOM 1084 C LEU p 67 -8.718 4.518 -3.006 1.00 0.00 C ATOM 1085 O LEU p 67 -9.056 5.576 -2.493 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.280 2.910 -1.677 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.674 3.898 -0.649 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -5.545 4.681 -1.290 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -7.721 4.855 -0.128 1.00 0.00 C ATOM 0 H LEU p 67 -8.383 1.740 -3.657 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.352 3.269 -1.349 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.301 1.921 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -6.601 2.853 -2.528 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.290 3.318 0.190 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.123 5.374 -0.562 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -4.770 3.992 -1.627 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -5.929 5.241 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -7.266 5.536 0.591 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -8.136 5.428 -0.958 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -8.518 4.293 0.359 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.341 4.377 -4.266 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.338 5.470 -5.244 1.00 0.00 C ATOM 1103 C LYS p 68 -9.764 5.744 -5.657 1.00 0.00 C ATOM 1104 O LYS p 68 -10.122 6.880 -5.976 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.476 5.162 -6.472 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.099 5.818 -6.444 1.00 0.00 C ATOM 1107 CD LYS p 68 -6.124 7.220 -7.041 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.752 7.872 -6.988 1.00 0.00 C ATOM 1109 NZ LYS p 68 -4.768 9.248 -7.557 1.00 0.00 N ATOM 0 H LYS p 68 -8.022 3.488 -4.652 1.00 0.00 H new ATOM 0 HA LYS p 68 -7.897 6.349 -4.774 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.351 4.082 -6.554 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.005 5.490 -7.366 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -5.742 5.868 -5.415 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.392 5.200 -6.997 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -6.465 7.170 -8.075 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.842 7.835 -6.498 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.408 7.911 -5.954 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -4.038 7.260 -7.539 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -3.814 9.658 -7.502 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -5.071 9.209 -8.551 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -5.430 9.840 -7.016 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.573 4.671 -5.658 1.00 0.00 N ATOM 1124 CA LYS p 69 -11.997 4.793 -5.921 1.00 0.00 C ATOM 1125 C LYS p 69 -12.650 5.329 -4.658 1.00 0.00 C ATOM 1126 O LYS p 69 -13.682 5.984 -4.714 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.620 3.460 -6.315 1.00 0.00 C ATOM 1128 CG LYS p 69 -12.933 3.349 -7.796 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.010 2.310 -8.066 1.00 0.00 C ATOM 1130 CE LYS p 69 -14.329 2.211 -9.548 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.389 1.201 -9.822 1.00 0.00 N ATOM 0 H LYS p 69 -10.257 3.718 -5.479 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.154 5.469 -6.761 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -11.941 2.654 -6.034 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.539 3.316 -5.746 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.260 4.318 -8.173 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.027 3.084 -8.341 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -13.680 1.338 -7.698 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -14.914 2.570 -7.515 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -14.652 3.185 -9.916 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -13.425 1.947 -10.097 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -15.577 1.164 -10.844 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -15.071 0.267 -9.495 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -16.260 1.466 -9.319 1.00 0.00 H new ATOM 1145 N LYS p 70 -11.971 5.049 -3.529 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.361 5.506 -2.196 1.00 0.00 C ATOM 1147 C LYS p 70 -11.791 6.889 -1.981 1.00 0.00 C ATOM 1148 O LYS p 70 -12.239 7.630 -1.115 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.839 4.563 -1.124 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.920 3.752 -0.425 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.400 4.428 0.853 1.00 0.00 C ATOM 1152 CE LYS p 70 -14.483 3.616 1.551 1.00 0.00 C ATOM 1153 NZ LYS p 70 -13.935 2.397 2.211 1.00 0.00 N ATOM 0 H LYS p 70 -11.120 4.487 -3.526 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.449 5.526 -2.125 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.122 3.878 -1.577 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.297 5.144 -0.378 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.764 3.613 -1.101 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.534 2.760 -0.188 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -12.557 4.566 1.530 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -13.785 5.420 0.617 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -14.979 4.239 2.296 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -15.241 3.324 0.824 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -14.707 1.875 2.673 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -13.485 1.789 1.498 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -13.230 2.675 2.924 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.746 7.174 -2.771 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.098 8.486 -2.815 1.00 0.00 C ATOM 1169 C ASN p 71 -10.893 9.320 -3.813 1.00 0.00 C ATOM 1170 O ASN p 71 -10.741 10.532 -3.910 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.632 8.389 -3.249 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.795 9.549 -2.741 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.223 9.488 -1.653 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -7.720 10.614 -3.532 1.00 0.00 N ATOM 0 H ASN p 71 -10.325 6.492 -3.402 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.090 8.937 -1.823 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.210 7.453 -2.883 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.580 8.358 -4.337 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.172 11.425 -3.245 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -8.211 10.621 -4.426 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.722 8.575 -4.565 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.661 9.087 -5.548 1.00 0.00 C ATOM 1183 C ALA p 72 -13.983 9.262 -4.833 1.00 0.00 C ATOM 1184 O ALA p 72 -14.831 10.049 -5.242 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.804 8.138 -6.728 1.00 0.00 C ATOM 0 H ALA p 72 -11.748 7.558 -4.492 1.00 0.00 H new ATOM 0 HA ALA p 72 -12.308 10.033 -5.958 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.514 8.552 -7.444 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.835 8.009 -7.211 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.166 7.172 -6.376 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.125 8.461 -3.755 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.263 8.496 -2.846 1.00 0.00 C ATOM 1193 C GLN p 73 -14.961 9.560 -1.839 1.00 0.00 C ATOM 1194 O GLN p 73 -15.845 10.180 -1.268 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.424 7.178 -2.117 1.00 0.00 C ATOM 1196 CG GLN p 73 -15.695 6.021 -3.034 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.046 5.375 -2.800 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.046 5.764 -3.404 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.084 4.383 -1.919 1.00 0.00 N ATOM 0 H GLN p 73 -13.429 7.761 -3.498 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.181 8.687 -3.402 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -14.519 6.975 -1.545 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -16.241 7.264 -1.401 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.638 6.364 -4.067 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -14.914 5.272 -2.903 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.231 4.093 -1.441 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -17.966 3.911 -1.720 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.654 9.682 -1.617 1.00 0.00 N ATOM 1209 CA LEU p 74 -13.063 10.695 -0.747 1.00 0.00 C ATOM 1210 C LEU p 74 -13.015 12.005 -1.510 1.00 0.00 C ATOM 1211 O LEU p 74 -13.130 13.064 -0.943 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.656 10.282 -0.323 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.066 10.956 0.922 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.763 10.506 2.204 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.590 10.638 0.979 1.00 0.00 C ATOM 0 H LEU p 74 -12.963 9.067 -2.046 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.666 10.805 0.155 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.658 9.205 -0.154 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.983 10.472 -1.159 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.221 12.032 0.847 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.312 11.009 3.059 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.822 10.760 2.151 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.654 9.428 2.318 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.150 11.109 1.858 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.452 9.558 1.038 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.101 11.017 0.082 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.873 11.878 -2.825 1.00 0.00 N ATOM 1228 CA LYS p 75 -12.870 13.010 -3.749 1.00 0.00 C ATOM 1229 C LYS p 75 -14.317 13.340 -4.018 1.00 0.00 C ATOM 1230 O LYS p 75 -14.668 14.440 -4.454 1.00 0.00 O ATOM 1231 CB LYS p 75 -12.162 12.658 -5.052 1.00 0.00 C ATOM 1232 CG LYS p 75 -10.956 13.529 -5.368 1.00 0.00 C ATOM 1233 CD LYS p 75 -11.222 14.442 -6.552 1.00 0.00 C ATOM 1234 CE LYS p 75 -10.020 15.320 -6.860 1.00 0.00 C ATOM 1235 NZ LYS p 75 -10.273 16.226 -8.014 1.00 0.00 N ATOM 0 H LYS p 75 -12.755 10.976 -3.286 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.336 13.856 -3.318 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.841 11.617 -5.007 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -12.876 12.736 -5.872 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -10.701 14.129 -4.495 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -10.095 12.896 -5.582 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -11.469 13.841 -7.427 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -12.088 15.070 -6.341 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -9.770 15.914 -5.981 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -9.157 14.690 -7.076 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -9.429 16.807 -8.191 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -10.487 15.660 -8.860 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -11.081 16.845 -7.799 1.00 0.00 H new ATOM 1249 N LYS p 76 -15.143 12.323 -3.737 1.00 0.00 N ATOM 1250 CA LYS p 76 -16.590 12.435 -3.850 1.00 0.00 C ATOM 1251 C LYS p 76 -17.125 12.931 -2.526 1.00 0.00 C ATOM 1252 O LYS p 76 -18.122 13.658 -2.472 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.221 11.096 -4.208 1.00 0.00 C ATOM 1254 CG LYS p 76 -17.748 11.015 -5.632 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.246 11.275 -5.692 1.00 0.00 C ATOM 1256 CE LYS p 76 -19.776 11.169 -7.112 1.00 0.00 C ATOM 1257 NZ LYS p 76 -21.253 11.351 -7.169 1.00 0.00 N ATOM 0 H LYS p 76 -14.821 11.406 -3.427 1.00 0.00 H new ATOM 0 HA LYS p 76 -16.841 13.133 -4.649 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.482 10.308 -4.061 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -18.041 10.897 -3.518 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.227 11.742 -6.255 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.533 10.029 -6.044 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.766 10.560 -5.055 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -19.460 12.268 -5.297 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -19.293 11.921 -7.737 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -19.514 10.195 -7.525 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -21.575 11.272 -8.155 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -21.716 10.618 -6.594 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -21.502 12.290 -6.798 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.435 12.520 -1.456 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.769 12.957 -0.114 1.00 0.00 C ATOM 1273 C LYS p 77 -16.064 14.271 0.199 1.00 0.00 C ATOM 1274 O LYS p 77 -16.437 14.975 1.141 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.394 11.893 0.909 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.533 10.950 1.254 1.00 0.00 C ATOM 1277 CD LYS p 77 -17.235 10.152 2.513 1.00 0.00 C ATOM 1278 CE LYS p 77 -18.380 9.216 2.863 1.00 0.00 C ATOM 1279 NZ LYS p 77 -18.104 8.436 4.101 1.00 0.00 N ATOM 0 H LYS p 77 -15.640 11.883 -1.504 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.846 13.115 -0.059 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.556 11.311 0.525 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -16.051 12.383 1.820 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.450 11.522 1.393 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.706 10.267 0.422 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -16.322 9.574 2.371 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -17.055 10.835 3.344 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -19.294 9.795 2.995 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.554 8.530 2.034 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.910 7.810 4.304 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -17.246 7.863 3.967 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.963 9.089 4.898 1.00 0.00 H new ATOM 1293 N LEU p 78 -15.033 14.591 -0.609 1.00 0.00 N ATOM 1294 CA LEU p 78 -14.269 15.838 -0.457 1.00 0.00 C ATOM 1295 C LEU p 78 -15.152 17.081 -0.574 1.00 0.00 C ATOM 1296 O LEU p 78 -15.246 17.889 0.355 1.00 0.00 O ATOM 1297 CB LEU p 78 -13.180 15.899 -1.532 1.00 0.00 C ATOM 1298 CG LEU p 78 -11.737 15.809 -1.042 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -10.804 15.679 -2.229 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -11.375 17.030 -0.215 1.00 0.00 C ATOM 0 H LEU p 78 -14.712 13.998 -1.375 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.832 15.833 0.542 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -13.352 15.087 -2.239 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -13.296 16.832 -2.083 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.634 14.928 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -9.774 15.615 -1.877 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -11.052 14.778 -2.790 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -10.913 16.550 -2.875 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -10.343 16.946 0.125 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -11.485 17.927 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -12.037 17.094 0.649 1.00 0.00 H new ATOM 1312 N GLN p 79 -15.785 17.202 -1.731 1.00 0.00 N ATOM 1313 CA GLN p 79 -16.681 18.306 -2.055 1.00 0.00 C ATOM 1314 C GLN p 79 -18.100 18.067 -1.540 1.00 0.00 C ATOM 1315 O GLN p 79 -18.744 18.978 -1.010 1.00 0.00 O ATOM 1316 CB GLN p 79 -16.702 18.538 -3.575 1.00 0.00 C ATOM 1317 CG GLN p 79 -16.621 17.274 -4.433 1.00 0.00 C ATOM 1318 CD GLN p 79 -16.651 17.575 -5.919 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -17.717 17.628 -6.531 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -15.476 17.774 -6.506 1.00 0.00 N ATOM 0 H GLN p 79 -15.690 16.524 -2.487 1.00 0.00 H new ATOM 0 HA GLN p 79 -16.299 19.196 -1.554 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -17.617 19.073 -3.831 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -15.868 19.189 -3.838 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -15.704 16.735 -4.194 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -17.453 16.615 -4.183 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -14.617 17.720 -5.959 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -15.433 17.981 -7.504 1.00 0.00 H new ATOM 1329 N ALA p 80 -18.559 16.836 -1.705 1.00 0.00 N ATOM 1330 CA ALA p 80 -19.897 16.428 -1.277 1.00 0.00 C ATOM 1331 C ALA p 80 -19.856 15.724 0.080 1.00 0.00 C ATOM 1332 O ALA p 80 -20.435 16.269 1.042 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.541 15.537 -2.331 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.239 14.641 0.174 1.00 0.00 O ATOM 0 H ALA p 80 -18.018 16.088 -2.139 1.00 0.00 H new ATOM 0 HA ALA p 80 -20.504 17.326 -1.163 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.536 15.241 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -20.620 16.084 -3.271 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -19.929 14.647 -2.479 1.00 0.00 H new TER 1340 ALA p 80