USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 757 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 CYS SG : rot 126:sc= -4.25 USER MOD Set 1.2: A 93 SER OG : rot -95:sc= -1.43 USER MOD Single : A 8 SER OG : rot 82:sc= -0.654! USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.129 K(o=-0.13,f=-1.8) USER MOD Single : A 13 SER OG : rot 170:sc= -0.189 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -4.86! C(o=-4.9!,f=-7.4!) USER MOD Single : A 19 TYR OH : rot 150:sc= -3.99! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 150:sc=-0.00679 USER MOD Single : A 23 TYR OH : rot 30:sc= -0.815 USER MOD Single : A 25 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.037) USER MOD Single : A 30 ASN : amide:sc=-0.00108 X(o=-0.0011,f=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0348 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot -82:sc= -0.0248! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 12:sc= 1.12 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -95:sc= -2.51! USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.96 K(o=-0.96,f=-0.2) USER MOD Single : A 84 GLN : amide:sc= -0.362 K(o=-0.36,f=-3.1!) USER MOD Single : A 85 ASN : amide:sc= -1.64 K(o=-1.6,f=-2.5) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot -68:sc= 1.2 USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 7 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA LEU A 7 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C LEU A 7 1.097 -0.066 -2.422 1.00 0.00 C ATOM 4 O LEU A 7 -0.114 0.039 -2.235 1.00 0.00 O ATOM 5 CB LEU A 7 3.113 -1.122 -1.246 1.00 0.00 C ATOM 6 CG LEU A 7 4.476 -0.774 -0.642 1.00 0.00 C ATOM 7 CD1 LEU A 7 5.219 -2.036 -0.201 1.00 0.00 C ATOM 8 CD2 LEU A 7 5.305 0.070 -1.612 1.00 0.00 C ATOM 0 HA LEU A 7 2.637 0.927 -1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.702 -1.972 -0.701 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.266 -1.448 -2.275 1.00 0.00 H new ATOM 0 HG LEU A 7 4.310 -0.170 0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 7 6.184 -1.760 0.224 1.00 0.00 H new ATOM 0 HD12 LEU A 7 4.629 -2.562 0.549 1.00 0.00 H new ATOM 0 HD13 LEU A 7 5.374 -2.686 -1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.268 0.304 -1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 7 5.464 -0.487 -2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 7 4.774 0.996 -1.834 1.00 0.00 H new ATOM 20 N SER A 8 1.661 -0.240 -3.608 1.00 0.00 N ATOM 21 CA SER A 8 0.856 -0.321 -4.815 1.00 0.00 C ATOM 22 C SER A 8 1.747 -0.174 -6.050 1.00 0.00 C ATOM 23 O SER A 8 2.966 -0.057 -5.930 1.00 0.00 O ATOM 24 CB SER A 8 -0.238 0.748 -4.820 1.00 0.00 C ATOM 25 OG SER A 8 -0.760 0.972 -6.127 1.00 0.00 O ATOM 0 H SER A 8 2.666 -0.327 -3.759 1.00 0.00 H new ATOM 0 HA SER A 8 0.373 -1.298 -4.838 1.00 0.00 H new ATOM 0 HB2 SER A 8 -1.046 0.443 -4.154 1.00 0.00 H new ATOM 0 HB3 SER A 8 0.165 1.681 -4.426 1.00 0.00 H new ATOM 0 HG SER A 8 -1.430 0.288 -6.333 1.00 0.00 H new ATOM 31 N LEU A 9 1.105 -0.186 -7.209 1.00 0.00 N ATOM 32 CA LEU A 9 1.824 -0.056 -8.464 1.00 0.00 C ATOM 33 C LEU A 9 2.764 1.149 -8.386 1.00 0.00 C ATOM 34 O LEU A 9 3.883 1.103 -8.895 1.00 0.00 O ATOM 35 CB LEU A 9 0.846 0.003 -9.639 1.00 0.00 C ATOM 36 CG LEU A 9 -0.379 -0.909 -9.538 1.00 0.00 C ATOM 37 CD1 LEU A 9 -1.092 -1.020 -10.887 1.00 0.00 C ATOM 38 CD2 LEU A 9 0.004 -2.280 -8.978 1.00 0.00 C ATOM 0 H LEU A 9 0.094 -0.284 -7.305 1.00 0.00 H new ATOM 0 HA LEU A 9 2.445 -0.935 -8.640 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.501 1.031 -9.748 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.388 -0.249 -10.550 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.083 -0.460 -8.838 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -1.959 -1.674 -10.788 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -1.418 -0.031 -11.209 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.408 -1.435 -11.627 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.884 -2.909 -8.916 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.736 -2.750 -9.635 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.433 -2.160 -7.983 1.00 0.00 H new ATOM 50 N THR A 10 2.275 2.200 -7.744 1.00 0.00 N ATOM 51 CA THR A 10 3.057 3.415 -7.593 1.00 0.00 C ATOM 52 C THR A 10 4.478 3.081 -7.136 1.00 0.00 C ATOM 53 O THR A 10 5.415 3.119 -7.932 1.00 0.00 O ATOM 54 CB THR A 10 2.311 4.341 -6.629 1.00 0.00 C ATOM 55 OG1 THR A 10 1.285 4.921 -7.430 1.00 0.00 O ATOM 56 CG2 THR A 10 3.160 5.535 -6.189 1.00 0.00 C ATOM 0 H THR A 10 1.347 2.235 -7.322 1.00 0.00 H new ATOM 0 HA THR A 10 3.169 3.934 -8.545 1.00 0.00 H new ATOM 0 HB THR A 10 1.998 3.775 -5.751 1.00 0.00 H new ATOM 0 HG1 THR A 10 0.751 5.535 -6.884 1.00 0.00 H new ATOM 0 HG21 THR A 10 2.584 6.159 -5.506 1.00 0.00 H new ATOM 0 HG22 THR A 10 4.057 5.177 -5.684 1.00 0.00 H new ATOM 0 HG23 THR A 10 3.445 6.120 -7.063 1.00 0.00 H new ATOM 64 N GLN A 11 4.594 2.762 -5.855 1.00 0.00 N ATOM 65 CA GLN A 11 5.886 2.421 -5.283 1.00 0.00 C ATOM 66 C GLN A 11 6.510 1.248 -6.042 1.00 0.00 C ATOM 67 O GLN A 11 7.729 1.180 -6.191 1.00 0.00 O ATOM 68 CB GLN A 11 5.758 2.103 -3.792 1.00 0.00 C ATOM 69 CG GLN A 11 6.405 3.197 -2.941 1.00 0.00 C ATOM 70 CD GLN A 11 7.922 3.224 -3.143 1.00 0.00 C ATOM 71 OE1 GLN A 11 8.509 2.339 -3.744 1.00 0.00 O ATOM 72 NE2 GLN A 11 8.520 4.285 -2.609 1.00 0.00 N ATOM 0 H GLN A 11 3.815 2.732 -5.197 1.00 0.00 H new ATOM 0 HA GLN A 11 6.545 3.284 -5.382 1.00 0.00 H new ATOM 0 HB2 GLN A 11 4.705 2.005 -3.526 1.00 0.00 H new ATOM 0 HB3 GLN A 11 6.231 1.144 -3.579 1.00 0.00 H new ATOM 0 HG2 GLN A 11 5.982 4.166 -3.205 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.178 3.026 -1.889 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.968 4.989 -2.119 1.00 0.00 H new ATOM 0 HE22 GLN A 11 9.531 4.395 -2.690 1.00 0.00 H new ATOM 81 N LEU A 12 5.646 0.355 -6.502 1.00 0.00 N ATOM 82 CA LEU A 12 6.098 -0.811 -7.242 1.00 0.00 C ATOM 83 C LEU A 12 6.825 -0.355 -8.509 1.00 0.00 C ATOM 84 O LEU A 12 7.509 -1.147 -9.155 1.00 0.00 O ATOM 85 CB LEU A 12 4.928 -1.760 -7.512 1.00 0.00 C ATOM 86 CG LEU A 12 5.287 -3.240 -7.665 1.00 0.00 C ATOM 87 CD1 LEU A 12 6.135 -3.471 -8.917 1.00 0.00 C ATOM 88 CD2 LEU A 12 5.971 -3.771 -6.404 1.00 0.00 C ATOM 0 H LEU A 12 4.636 0.415 -6.377 1.00 0.00 H new ATOM 0 HA LEU A 12 6.814 -1.384 -6.652 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.211 -1.663 -6.697 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.423 -1.433 -8.421 1.00 0.00 H new ATOM 0 HG LEU A 12 4.363 -3.805 -7.792 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.377 -4.530 -9.002 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.577 -3.154 -9.798 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.057 -2.894 -8.844 1.00 0.00 H new ATOM 0 HD21 LEU A 12 6.216 -4.825 -6.539 1.00 0.00 H new ATOM 0 HD22 LEU A 12 6.885 -3.207 -6.221 1.00 0.00 H new ATOM 0 HD23 LEU A 12 5.300 -3.661 -5.552 1.00 0.00 H new ATOM 100 N SER A 13 6.651 0.919 -8.827 1.00 0.00 N ATOM 101 CA SER A 13 7.282 1.490 -10.005 1.00 0.00 C ATOM 102 C SER A 13 7.611 2.964 -9.760 1.00 0.00 C ATOM 103 O SER A 13 7.484 3.790 -10.663 1.00 0.00 O ATOM 104 CB SER A 13 6.386 1.343 -11.235 1.00 0.00 C ATOM 105 OG SER A 13 7.059 0.697 -12.313 1.00 0.00 O ATOM 0 H SER A 13 6.082 1.573 -8.289 1.00 0.00 H new ATOM 0 HA SER A 13 8.207 0.945 -10.196 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.496 0.772 -10.969 1.00 0.00 H new ATOM 0 HB3 SER A 13 6.048 2.328 -11.557 1.00 0.00 H new ATOM 0 HG SER A 13 6.414 0.477 -13.017 1.00 0.00 H new ATOM 111 N SER A 14 8.027 3.249 -8.535 1.00 0.00 N ATOM 112 CA SER A 14 8.374 4.610 -8.161 1.00 0.00 C ATOM 113 C SER A 14 7.399 5.596 -8.807 1.00 0.00 C ATOM 114 O SER A 14 7.761 6.736 -9.092 1.00 0.00 O ATOM 115 CB SER A 14 9.812 4.942 -8.567 1.00 0.00 C ATOM 116 OG SER A 14 10.592 5.379 -7.457 1.00 0.00 O ATOM 0 H SER A 14 8.132 2.561 -7.789 1.00 0.00 H new ATOM 0 HA SER A 14 8.301 4.696 -7.077 1.00 0.00 H new ATOM 0 HB2 SER A 14 10.276 4.062 -9.012 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.803 5.718 -9.332 1.00 0.00 H new ATOM 0 HG SER A 14 11.503 5.579 -7.756 1.00 0.00 H new ATOM 122 N GLY A 15 6.180 5.121 -9.018 1.00 0.00 N ATOM 123 CA GLY A 15 5.150 5.946 -9.625 1.00 0.00 C ATOM 124 C GLY A 15 5.220 5.876 -11.152 1.00 0.00 C ATOM 125 O GLY A 15 5.400 6.896 -11.816 1.00 0.00 O ATOM 0 H GLY A 15 5.883 4.175 -8.779 1.00 0.00 H new ATOM 0 HA2 GLY A 15 4.168 5.615 -9.287 1.00 0.00 H new ATOM 0 HA3 GLY A 15 5.268 6.979 -9.299 1.00 0.00 H new ATOM 129 N ASN A 16 5.074 4.663 -11.664 1.00 0.00 N ATOM 130 CA ASN A 16 5.119 4.447 -13.100 1.00 0.00 C ATOM 131 C ASN A 16 3.914 3.603 -13.522 1.00 0.00 C ATOM 132 O ASN A 16 3.891 2.393 -13.302 1.00 0.00 O ATOM 133 CB ASN A 16 6.388 3.694 -13.505 1.00 0.00 C ATOM 134 CG ASN A 16 6.859 4.123 -14.896 1.00 0.00 C ATOM 135 OD1 ASN A 16 6.094 4.594 -15.721 1.00 0.00 O ATOM 136 ND2 ASN A 16 8.158 3.933 -15.109 1.00 0.00 N ATOM 0 H ASN A 16 4.924 3.820 -11.110 1.00 0.00 H new ATOM 0 HA ASN A 16 5.107 5.422 -13.588 1.00 0.00 H new ATOM 0 HB2 ASN A 16 7.176 3.883 -12.776 1.00 0.00 H new ATOM 0 HB3 ASN A 16 6.197 2.621 -13.497 1.00 0.00 H new ATOM 0 HD21 ASN A 16 8.570 4.187 -16.007 1.00 0.00 H new ATOM 0 HD22 ASN A 16 8.742 3.534 -14.374 1.00 0.00 H new ATOM 143 N PRO A 17 2.916 4.294 -14.137 1.00 0.00 N ATOM 144 CA PRO A 17 1.711 3.621 -14.591 1.00 0.00 C ATOM 145 C PRO A 17 1.981 2.812 -15.862 1.00 0.00 C ATOM 146 O PRO A 17 1.117 2.068 -16.323 1.00 0.00 O ATOM 147 CB PRO A 17 0.695 4.732 -14.799 1.00 0.00 C ATOM 148 CG PRO A 17 1.499 6.018 -14.902 1.00 0.00 C ATOM 149 CD PRO A 17 2.908 5.727 -14.414 1.00 0.00 C ATOM 0 HA PRO A 17 1.341 2.890 -13.872 1.00 0.00 H new ATOM 0 HB2 PRO A 17 0.111 4.563 -15.704 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.010 4.777 -13.969 1.00 0.00 H new ATOM 0 HG2 PRO A 17 1.518 6.375 -15.932 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.041 6.804 -14.301 1.00 0.00 H new ATOM 0 HD2 PRO A 17 3.650 5.989 -15.168 1.00 0.00 H new ATOM 0 HD3 PRO A 17 3.145 6.304 -13.520 1.00 0.00 H new ATOM 157 N VAL A 18 3.183 2.985 -16.391 1.00 0.00 N ATOM 158 CA VAL A 18 3.578 2.280 -17.599 1.00 0.00 C ATOM 159 C VAL A 18 3.076 0.837 -17.529 1.00 0.00 C ATOM 160 O VAL A 18 2.433 0.353 -18.459 1.00 0.00 O ATOM 161 CB VAL A 18 5.092 2.378 -17.791 1.00 0.00 C ATOM 162 CG1 VAL A 18 5.835 1.890 -16.545 1.00 0.00 C ATOM 163 CG2 VAL A 18 5.538 1.605 -19.033 1.00 0.00 C ATOM 0 H VAL A 18 3.897 3.603 -16.005 1.00 0.00 H new ATOM 0 HA VAL A 18 3.123 2.740 -18.476 1.00 0.00 H new ATOM 0 HB VAL A 18 5.344 3.428 -17.942 1.00 0.00 H new ATOM 0 HG11 VAL A 18 6.910 1.970 -16.708 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.551 2.502 -15.689 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.574 0.850 -16.350 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.619 1.691 -19.146 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.267 0.555 -18.925 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.047 2.018 -19.914 1.00 0.00 H new ATOM 173 N TYR A 19 3.389 0.188 -16.416 1.00 0.00 N ATOM 174 CA TYR A 19 2.978 -1.190 -16.213 1.00 0.00 C ATOM 175 C TYR A 19 1.453 -1.312 -16.200 1.00 0.00 C ATOM 176 O TYR A 19 0.899 -2.282 -16.716 1.00 0.00 O ATOM 177 CB TYR A 19 3.521 -1.594 -14.840 1.00 0.00 C ATOM 178 CG TYR A 19 4.992 -2.015 -14.853 1.00 0.00 C ATOM 179 CD1 TYR A 19 5.781 -1.734 -15.949 1.00 0.00 C ATOM 180 CD2 TYR A 19 5.529 -2.677 -13.767 1.00 0.00 C ATOM 181 CE1 TYR A 19 7.165 -2.130 -15.960 1.00 0.00 C ATOM 182 CE2 TYR A 19 6.913 -3.073 -13.778 1.00 0.00 C ATOM 183 CZ TYR A 19 7.663 -2.780 -14.875 1.00 0.00 C ATOM 184 OH TYR A 19 8.971 -3.155 -14.885 1.00 0.00 O ATOM 0 H TYR A 19 3.922 0.592 -15.646 1.00 0.00 H new ATOM 0 HA TYR A 19 3.354 -1.824 -17.016 1.00 0.00 H new ATOM 0 HB2 TYR A 19 3.399 -0.758 -14.152 1.00 0.00 H new ATOM 0 HB3 TYR A 19 2.921 -2.417 -14.451 1.00 0.00 H new ATOM 0 HD1 TYR A 19 5.360 -1.217 -16.799 1.00 0.00 H new ATOM 0 HD2 TYR A 19 4.911 -2.898 -12.909 1.00 0.00 H new ATOM 0 HE1 TYR A 19 7.794 -1.915 -16.811 1.00 0.00 H new ATOM 0 HE2 TYR A 19 7.346 -3.591 -12.935 1.00 0.00 H new ATOM 0 HH TYR A 19 9.318 -3.155 -13.969 1.00 0.00 H new ATOM 194 N GLU A 20 0.816 -0.313 -15.605 1.00 0.00 N ATOM 195 CA GLU A 20 -0.634 -0.296 -15.519 1.00 0.00 C ATOM 196 C GLU A 20 -1.251 -0.536 -16.898 1.00 0.00 C ATOM 197 O GLU A 20 -2.240 -1.256 -17.023 1.00 0.00 O ATOM 198 CB GLU A 20 -1.132 1.020 -14.917 1.00 0.00 C ATOM 199 CG GLU A 20 -1.946 0.768 -13.646 1.00 0.00 C ATOM 200 CD GLU A 20 -3.435 1.025 -13.890 1.00 0.00 C ATOM 201 OE1 GLU A 20 -4.203 0.073 -14.096 1.00 0.00 O ATOM 202 OE2 GLU A 20 -3.786 2.266 -13.858 1.00 0.00 O ATOM 0 H GLU A 20 1.278 0.490 -15.178 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.948 -1.103 -14.857 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.283 1.664 -14.688 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.745 1.549 -15.647 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -1.800 -0.260 -13.314 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -1.588 1.415 -12.846 1.00 0.00 H new ATOM 210 N LYS A 21 -0.641 0.082 -17.899 1.00 0.00 N ATOM 211 CA LYS A 21 -1.118 -0.055 -19.265 1.00 0.00 C ATOM 212 C LYS A 21 -1.374 -1.534 -19.565 1.00 0.00 C ATOM 213 O LYS A 21 -2.508 -1.928 -19.835 1.00 0.00 O ATOM 214 CB LYS A 21 -0.147 0.611 -20.241 1.00 0.00 C ATOM 215 CG LYS A 21 -0.862 1.658 -21.097 1.00 0.00 C ATOM 216 CD LYS A 21 0.110 2.325 -22.073 1.00 0.00 C ATOM 217 CE LYS A 21 -0.629 2.866 -23.299 1.00 0.00 C ATOM 218 NZ LYS A 21 0.188 2.680 -24.519 1.00 0.00 N ATOM 0 H LYS A 21 0.179 0.679 -17.791 1.00 0.00 H new ATOM 0 HA LYS A 21 -2.067 0.466 -19.391 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.665 1.082 -19.687 1.00 0.00 H new ATOM 0 HB3 LYS A 21 0.303 -0.145 -20.885 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.674 1.187 -21.651 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -1.312 2.414 -20.453 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.634 3.139 -21.571 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.866 1.606 -22.388 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.584 2.353 -23.412 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.851 3.924 -23.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -0.327 3.052 -25.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.088 3.190 -24.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.378 1.667 -24.659 1.00 0.00 H new ATOM 229 N TYR A 22 -0.303 -2.311 -19.507 1.00 0.00 N ATOM 230 CA TYR A 22 -0.397 -3.737 -19.769 1.00 0.00 C ATOM 231 C TYR A 22 -1.387 -4.406 -18.812 1.00 0.00 C ATOM 232 O TYR A 22 -2.249 -5.171 -19.241 1.00 0.00 O ATOM 233 CB TYR A 22 1.000 -4.305 -19.517 1.00 0.00 C ATOM 234 CG TYR A 22 2.125 -3.511 -20.185 1.00 0.00 C ATOM 235 CD1 TYR A 22 1.980 -3.069 -21.484 1.00 0.00 C ATOM 236 CD2 TYR A 22 3.284 -3.237 -19.488 1.00 0.00 C ATOM 237 CE1 TYR A 22 3.038 -2.321 -22.112 1.00 0.00 C ATOM 238 CE2 TYR A 22 4.342 -2.489 -20.116 1.00 0.00 C ATOM 239 CZ TYR A 22 4.167 -2.068 -21.398 1.00 0.00 C ATOM 240 OH TYR A 22 5.166 -1.362 -21.991 1.00 0.00 O ATOM 0 H TYR A 22 0.635 -1.980 -19.282 1.00 0.00 H new ATOM 0 HA TYR A 22 -0.745 -3.918 -20.786 1.00 0.00 H new ATOM 0 HB2 TYR A 22 1.180 -4.336 -18.442 1.00 0.00 H new ATOM 0 HB3 TYR A 22 1.033 -5.334 -19.876 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.073 -3.284 -22.030 1.00 0.00 H new ATOM 0 HD2 TYR A 22 3.398 -3.584 -18.471 1.00 0.00 H new ATOM 0 HE1 TYR A 22 2.937 -1.969 -23.128 1.00 0.00 H new ATOM 0 HE2 TYR A 22 5.254 -2.267 -19.582 1.00 0.00 H new ATOM 0 HH TYR A 22 5.656 -0.855 -21.311 1.00 0.00 H new ATOM 250 N TYR A 23 -1.229 -4.093 -17.535 1.00 0.00 N ATOM 251 CA TYR A 23 -2.097 -4.654 -16.514 1.00 0.00 C ATOM 252 C TYR A 23 -3.569 -4.402 -16.847 1.00 0.00 C ATOM 253 O TYR A 23 -4.443 -5.157 -16.424 1.00 0.00 O ATOM 254 CB TYR A 23 -1.749 -3.923 -15.215 1.00 0.00 C ATOM 255 CG TYR A 23 -2.895 -3.872 -14.203 1.00 0.00 C ATOM 256 CD1 TYR A 23 -3.928 -2.973 -14.375 1.00 0.00 C ATOM 257 CD2 TYR A 23 -2.896 -4.725 -13.119 1.00 0.00 C ATOM 258 CE1 TYR A 23 -5.006 -2.925 -13.423 1.00 0.00 C ATOM 259 CE2 TYR A 23 -3.975 -4.677 -12.166 1.00 0.00 C ATOM 260 CZ TYR A 23 -4.977 -3.779 -12.365 1.00 0.00 C ATOM 261 OH TYR A 23 -5.996 -3.734 -11.465 1.00 0.00 O ATOM 0 H TYR A 23 -0.512 -3.458 -17.184 1.00 0.00 H new ATOM 0 HA TYR A 23 -1.953 -5.732 -16.439 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.892 -4.413 -14.753 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.444 -2.904 -15.454 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -3.927 -2.306 -15.224 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -2.088 -5.429 -12.985 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -5.820 -2.226 -13.546 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -3.988 -5.339 -11.313 1.00 0.00 H new ATOM 0 HH TYR A 23 -6.818 -3.450 -11.916 1.00 0.00 H new ATOM 271 N ARG A 24 -3.798 -3.338 -17.603 1.00 0.00 N ATOM 272 CA ARG A 24 -5.149 -2.978 -17.999 1.00 0.00 C ATOM 273 C ARG A 24 -5.630 -3.885 -19.133 1.00 0.00 C ATOM 274 O ARG A 24 -6.822 -4.165 -19.245 1.00 0.00 O ATOM 275 CB ARG A 24 -5.218 -1.520 -18.456 1.00 0.00 C ATOM 276 CG ARG A 24 -6.669 -1.075 -18.653 1.00 0.00 C ATOM 277 CD ARG A 24 -7.111 -1.271 -20.104 1.00 0.00 C ATOM 278 NE ARG A 24 -7.557 0.019 -20.676 1.00 0.00 N ATOM 279 CZ ARG A 24 -7.695 0.253 -21.999 1.00 0.00 C ATOM 280 NH1 ARG A 24 -7.423 -0.716 -22.898 1.00 0.00 N ATOM 281 NH2 ARG A 24 -8.100 1.444 -22.399 1.00 0.00 N ATOM 0 H ARG A 24 -3.071 -2.714 -17.952 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.794 -3.105 -17.130 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -4.735 -0.880 -17.717 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -4.668 -1.401 -19.389 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.321 -1.645 -17.991 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.772 -0.026 -18.376 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.287 -1.674 -20.693 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -7.921 -1.999 -20.151 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.774 0.779 -20.031 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.111 -1.633 -22.580 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -7.530 -0.531 -23.895 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -8.303 2.171 -21.713 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -8.210 1.638 -23.394 1.00 0.00 H new ATOM 294 N GLN A 25 -4.677 -4.318 -19.946 1.00 0.00 N ATOM 295 CA GLN A 25 -4.989 -5.187 -21.068 1.00 0.00 C ATOM 296 C GLN A 25 -5.563 -6.514 -20.568 1.00 0.00 C ATOM 297 O GLN A 25 -6.402 -7.122 -21.231 1.00 0.00 O ATOM 298 CB GLN A 25 -3.755 -5.418 -21.942 1.00 0.00 C ATOM 299 CG GLN A 25 -3.701 -4.411 -23.092 1.00 0.00 C ATOM 300 CD GLN A 25 -3.324 -5.098 -24.406 1.00 0.00 C ATOM 301 OE1 GLN A 25 -3.868 -4.817 -25.461 1.00 0.00 O ATOM 302 NE2 GLN A 25 -2.366 -6.012 -24.283 1.00 0.00 N ATOM 0 H GLN A 25 -3.689 -4.083 -19.850 1.00 0.00 H new ATOM 0 HA GLN A 25 -5.743 -4.697 -21.684 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -2.854 -5.331 -21.335 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -3.773 -6.432 -22.342 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.670 -3.922 -23.198 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -2.974 -3.632 -22.864 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -1.953 -6.198 -23.369 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.044 -6.527 -25.103 1.00 0.00 H new ATOM 311 N VAL A 26 -5.087 -6.926 -19.401 1.00 0.00 N ATOM 312 CA VAL A 26 -5.543 -8.170 -18.804 1.00 0.00 C ATOM 313 C VAL A 26 -6.838 -7.915 -18.031 1.00 0.00 C ATOM 314 O VAL A 26 -7.545 -8.855 -17.671 1.00 0.00 O ATOM 315 CB VAL A 26 -4.435 -8.769 -17.935 1.00 0.00 C ATOM 316 CG1 VAL A 26 -3.055 -8.319 -18.418 1.00 0.00 C ATOM 317 CG2 VAL A 26 -4.643 -8.416 -16.461 1.00 0.00 C ATOM 0 H VAL A 26 -4.391 -6.420 -18.854 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.766 -8.906 -19.576 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.485 -9.854 -18.030 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -2.286 -8.759 -17.783 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -2.906 -8.645 -19.447 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -2.989 -7.232 -18.368 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.842 -8.854 -15.865 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.633 -7.333 -16.341 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.602 -8.810 -16.124 1.00 0.00 H new ATOM 327 N GLU A 27 -7.109 -6.640 -17.797 1.00 0.00 N ATOM 328 CA GLU A 27 -8.307 -6.250 -17.073 1.00 0.00 C ATOM 329 C GLU A 27 -9.550 -6.502 -17.928 1.00 0.00 C ATOM 330 O GLU A 27 -9.514 -6.337 -19.146 1.00 0.00 O ATOM 331 CB GLU A 27 -8.231 -4.786 -16.635 1.00 0.00 C ATOM 332 CG GLU A 27 -9.392 -4.430 -15.704 1.00 0.00 C ATOM 333 CD GLU A 27 -10.020 -3.092 -16.098 1.00 0.00 C ATOM 334 OE1 GLU A 27 -11.050 -3.070 -16.788 1.00 0.00 O ATOM 335 OE2 GLU A 27 -9.400 -2.049 -15.659 1.00 0.00 O ATOM 0 H GLU A 27 -6.519 -5.863 -18.096 1.00 0.00 H new ATOM 0 HA GLU A 27 -8.379 -6.861 -16.173 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.284 -4.604 -16.127 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -8.252 -4.139 -17.512 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -10.147 -5.215 -15.742 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -9.036 -4.380 -14.675 1.00 0.00 H new ATOM 343 N ALA A 28 -10.621 -6.899 -17.256 1.00 0.00 N ATOM 344 CA ALA A 28 -11.873 -7.176 -17.938 1.00 0.00 C ATOM 345 C ALA A 28 -12.928 -6.161 -17.493 1.00 0.00 C ATOM 346 O ALA A 28 -12.903 -5.694 -16.355 1.00 0.00 O ATOM 347 CB ALA A 28 -12.298 -8.619 -17.660 1.00 0.00 C ATOM 0 H ALA A 28 -10.647 -7.035 -16.245 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.752 -7.074 -19.016 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -13.238 -8.827 -18.172 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.529 -9.301 -18.022 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.431 -8.759 -16.587 1.00 0.00 H new ATOM 353 N GLY A 29 -13.830 -5.850 -18.412 1.00 0.00 N ATOM 354 CA GLY A 29 -14.891 -4.900 -18.128 1.00 0.00 C ATOM 355 C GLY A 29 -14.318 -3.513 -17.826 1.00 0.00 C ATOM 356 O GLY A 29 -13.124 -3.279 -18.002 1.00 0.00 O ATOM 0 H GLY A 29 -13.848 -6.240 -19.354 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -15.568 -4.840 -18.980 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -15.478 -5.248 -17.278 1.00 0.00 H new ATOM 360 N ASN A 30 -15.198 -2.630 -17.376 1.00 0.00 N ATOM 361 CA ASN A 30 -14.795 -1.273 -17.048 1.00 0.00 C ATOM 362 C ASN A 30 -15.001 -1.032 -15.551 1.00 0.00 C ATOM 363 O ASN A 30 -15.549 -0.005 -15.153 1.00 0.00 O ATOM 364 CB ASN A 30 -15.637 -0.249 -17.811 1.00 0.00 C ATOM 365 CG ASN A 30 -15.023 0.055 -19.179 1.00 0.00 C ATOM 366 OD1 ASN A 30 -14.937 -0.793 -20.052 1.00 0.00 O ATOM 367 ND2 ASN A 30 -14.602 1.309 -19.317 1.00 0.00 N ATOM 0 H ASN A 30 -16.188 -2.828 -17.231 1.00 0.00 H new ATOM 0 HA ASN A 30 -13.747 -1.157 -17.324 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -16.650 -0.629 -17.940 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -15.713 0.670 -17.230 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -14.177 1.611 -20.194 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -14.704 1.969 -18.546 1.00 0.00 H new ATOM 374 N THR A 31 -14.550 -1.997 -14.762 1.00 0.00 N ATOM 375 CA THR A 31 -14.678 -1.903 -13.317 1.00 0.00 C ATOM 376 C THR A 31 -13.336 -1.527 -12.687 1.00 0.00 C ATOM 377 O THR A 31 -13.292 -1.020 -11.567 1.00 0.00 O ATOM 378 CB THR A 31 -15.240 -3.230 -12.805 1.00 0.00 C ATOM 379 OG1 THR A 31 -14.120 -4.111 -12.823 1.00 0.00 O ATOM 380 CG2 THR A 31 -16.229 -3.865 -13.785 1.00 0.00 C ATOM 0 H THR A 31 -14.096 -2.847 -15.096 1.00 0.00 H new ATOM 0 HA THR A 31 -15.369 -1.110 -13.031 1.00 0.00 H new ATOM 0 HB THR A 31 -15.732 -3.069 -11.846 1.00 0.00 H new ATOM 0 HG1 THR A 31 -14.395 -4.996 -12.504 1.00 0.00 H new ATOM 0 HG21 THR A 31 -16.597 -4.804 -13.373 1.00 0.00 H new ATOM 0 HG22 THR A 31 -17.067 -3.187 -13.947 1.00 0.00 H new ATOM 0 HG23 THR A 31 -15.728 -4.057 -14.734 1.00 0.00 H new ATOM 388 N GLY A 32 -12.273 -1.790 -13.433 1.00 0.00 N ATOM 389 CA GLY A 32 -10.933 -1.486 -12.961 1.00 0.00 C ATOM 390 C GLY A 32 -10.348 -2.663 -12.178 1.00 0.00 C ATOM 391 O GLY A 32 -9.345 -2.512 -11.481 1.00 0.00 O ATOM 0 H GLY A 32 -12.313 -2.210 -14.361 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -10.289 -1.253 -13.809 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.959 -0.600 -12.327 1.00 0.00 H new ATOM 395 N ARG A 33 -10.999 -3.808 -12.318 1.00 0.00 N ATOM 396 CA ARG A 33 -10.555 -5.010 -11.632 1.00 0.00 C ATOM 397 C ARG A 33 -10.020 -6.030 -12.640 1.00 0.00 C ATOM 398 O ARG A 33 -10.538 -6.141 -13.750 1.00 0.00 O ATOM 399 CB ARG A 33 -11.698 -5.643 -10.835 1.00 0.00 C ATOM 400 CG ARG A 33 -12.085 -4.766 -9.642 1.00 0.00 C ATOM 401 CD ARG A 33 -13.597 -4.796 -9.408 1.00 0.00 C ATOM 402 NE ARG A 33 -14.090 -3.433 -9.110 1.00 0.00 N ATOM 403 CZ ARG A 33 -15.394 -3.082 -9.116 1.00 0.00 C ATOM 404 NH1 ARG A 33 -16.347 -3.992 -9.406 1.00 0.00 N ATOM 405 NH2 ARG A 33 -15.722 -1.834 -8.835 1.00 0.00 N ATOM 0 H ARG A 33 -11.830 -3.929 -12.896 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.761 -4.724 -10.943 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.563 -5.785 -11.483 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.398 -6.630 -10.483 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.568 -5.113 -8.748 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -11.761 -3.741 -9.819 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.102 -5.190 -10.290 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.832 -5.466 -8.581 1.00 0.00 H new ATOM 0 HE ARG A 33 -13.402 -2.714 -8.886 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -16.085 -4.954 -9.623 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -17.330 -3.718 -9.408 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -14.995 -1.152 -8.618 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -16.702 -1.552 -8.835 1.00 0.00 H new ATOM 418 N VAL A 34 -8.990 -6.748 -12.217 1.00 0.00 N ATOM 419 CA VAL A 34 -8.379 -7.754 -13.069 1.00 0.00 C ATOM 420 C VAL A 34 -9.049 -9.106 -12.814 1.00 0.00 C ATOM 421 O VAL A 34 -9.007 -9.623 -11.698 1.00 0.00 O ATOM 422 CB VAL A 34 -6.867 -7.784 -12.842 1.00 0.00 C ATOM 423 CG1 VAL A 34 -6.180 -8.717 -13.841 1.00 0.00 C ATOM 424 CG2 VAL A 34 -6.274 -6.375 -12.910 1.00 0.00 C ATOM 0 H VAL A 34 -8.563 -6.653 -11.295 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.531 -7.508 -14.120 1.00 0.00 H new ATOM 0 HB VAL A 34 -6.687 -8.175 -11.841 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -5.106 -8.719 -13.657 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -6.571 -9.728 -13.723 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.374 -8.370 -14.856 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.198 -6.425 -12.745 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.471 -5.944 -13.892 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.730 -5.751 -12.142 1.00 0.00 H new ATOM 434 N LEU A 35 -9.650 -9.641 -13.866 1.00 0.00 N ATOM 435 CA LEU A 35 -10.327 -10.923 -13.770 1.00 0.00 C ATOM 436 C LEU A 35 -9.313 -12.003 -13.391 1.00 0.00 C ATOM 437 O LEU A 35 -9.692 -13.117 -13.031 1.00 0.00 O ATOM 438 CB LEU A 35 -11.092 -11.223 -15.061 1.00 0.00 C ATOM 439 CG LEU A 35 -12.618 -11.204 -14.957 1.00 0.00 C ATOM 440 CD1 LEU A 35 -13.262 -11.129 -16.342 1.00 0.00 C ATOM 441 CD2 LEU A 35 -13.127 -12.402 -14.152 1.00 0.00 C ATOM 0 H LEU A 35 -9.682 -9.210 -14.790 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.078 -10.899 -12.980 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.790 -10.497 -15.816 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -10.785 -12.204 -15.422 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.912 -10.304 -14.417 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.347 -11.117 -16.239 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.935 -10.220 -16.846 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.963 -11.997 -16.930 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.215 -12.365 -14.093 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.822 -13.326 -14.643 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.708 -12.369 -13.146 1.00 0.00 H new ATOM 453 N ALA A 36 -8.043 -11.637 -13.485 1.00 0.00 N ATOM 454 CA ALA A 36 -6.971 -12.561 -13.156 1.00 0.00 C ATOM 455 C ALA A 36 -6.757 -13.524 -14.326 1.00 0.00 C ATOM 456 O ALA A 36 -5.647 -13.642 -14.842 1.00 0.00 O ATOM 457 CB ALA A 36 -7.308 -13.291 -11.854 1.00 0.00 C ATOM 0 H ALA A 36 -7.732 -10.713 -13.784 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.036 -12.024 -12.996 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.504 -13.984 -11.607 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.422 -12.565 -11.049 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.239 -13.844 -11.978 1.00 0.00 H new ATOM 463 N LEU A 37 -7.837 -14.187 -14.710 1.00 0.00 N ATOM 464 CA LEU A 37 -7.782 -15.136 -15.810 1.00 0.00 C ATOM 465 C LEU A 37 -6.979 -14.528 -16.962 1.00 0.00 C ATOM 466 O LEU A 37 -6.037 -15.143 -17.459 1.00 0.00 O ATOM 467 CB LEU A 37 -9.191 -15.577 -16.208 1.00 0.00 C ATOM 468 CG LEU A 37 -9.710 -16.851 -15.537 1.00 0.00 C ATOM 469 CD1 LEU A 37 -10.376 -16.532 -14.197 1.00 0.00 C ATOM 470 CD2 LEU A 37 -10.643 -17.623 -16.472 1.00 0.00 C ATOM 0 H LEU A 37 -8.756 -14.086 -14.279 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.264 -16.045 -15.504 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.882 -14.764 -15.983 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.213 -15.724 -17.288 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.858 -17.498 -15.327 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.736 -17.454 -13.741 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.652 -16.058 -13.534 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.215 -15.856 -14.360 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.997 -18.524 -15.970 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -11.495 -16.996 -16.736 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.103 -17.901 -17.377 1.00 0.00 H new ATOM 482 N ASP A 38 -7.382 -13.327 -17.352 1.00 0.00 N ATOM 483 CA ASP A 38 -6.712 -12.630 -18.437 1.00 0.00 C ATOM 484 C ASP A 38 -5.238 -12.432 -18.076 1.00 0.00 C ATOM 485 O ASP A 38 -4.359 -12.626 -18.915 1.00 0.00 O ATOM 486 CB ASP A 38 -7.331 -11.250 -18.669 1.00 0.00 C ATOM 487 CG ASP A 38 -8.155 -11.119 -19.951 1.00 0.00 C ATOM 488 OD1 ASP A 38 -7.712 -10.508 -20.936 1.00 0.00 O ATOM 489 OD2 ASP A 38 -9.314 -11.684 -19.915 1.00 0.00 O ATOM 0 H ASP A 38 -8.163 -12.820 -16.936 1.00 0.00 H new ATOM 0 HA ASP A 38 -6.818 -13.230 -19.341 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -7.968 -11.007 -17.819 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -6.532 -10.509 -18.691 1.00 0.00 H new ATOM 495 N ALA A 39 -5.013 -12.049 -16.828 1.00 0.00 N ATOM 496 CA ALA A 39 -3.661 -11.823 -16.347 1.00 0.00 C ATOM 497 C ALA A 39 -2.794 -13.038 -16.684 1.00 0.00 C ATOM 498 O ALA A 39 -1.724 -12.897 -17.273 1.00 0.00 O ATOM 499 CB ALA A 39 -3.696 -11.530 -14.846 1.00 0.00 C ATOM 0 H ALA A 39 -5.744 -11.889 -16.135 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.219 -10.956 -16.838 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.682 -11.360 -14.485 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.300 -10.641 -14.663 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.131 -12.379 -14.320 1.00 0.00 H new ATOM 505 N ALA A 40 -3.290 -14.204 -16.295 1.00 0.00 N ATOM 506 CA ALA A 40 -2.574 -15.442 -16.549 1.00 0.00 C ATOM 507 C ALA A 40 -2.298 -15.569 -18.048 1.00 0.00 C ATOM 508 O ALA A 40 -1.359 -16.253 -18.455 1.00 0.00 O ATOM 509 CB ALA A 40 -3.383 -16.621 -16.004 1.00 0.00 C ATOM 0 H ALA A 40 -4.178 -14.317 -15.806 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.612 -15.441 -16.036 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -2.846 -17.550 -16.195 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -3.526 -16.499 -14.930 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.354 -16.655 -16.498 1.00 0.00 H new ATOM 515 N ALA A 41 -3.132 -14.899 -18.830 1.00 0.00 N ATOM 516 CA ALA A 41 -2.989 -14.928 -20.276 1.00 0.00 C ATOM 517 C ALA A 41 -1.844 -14.002 -20.690 1.00 0.00 C ATOM 518 O ALA A 41 -0.940 -14.413 -21.415 1.00 0.00 O ATOM 519 CB ALA A 41 -4.318 -14.541 -20.928 1.00 0.00 C ATOM 0 H ALA A 41 -3.909 -14.333 -18.490 1.00 0.00 H new ATOM 0 HA ALA A 41 -2.739 -15.933 -20.617 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -4.211 -14.563 -22.013 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.091 -15.247 -20.625 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.600 -13.537 -20.611 1.00 0.00 H new ATOM 525 N PHE A 42 -1.920 -12.769 -20.210 1.00 0.00 N ATOM 526 CA PHE A 42 -0.901 -11.781 -20.521 1.00 0.00 C ATOM 527 C PHE A 42 0.483 -12.264 -20.084 1.00 0.00 C ATOM 528 O PHE A 42 1.462 -12.091 -20.808 1.00 0.00 O ATOM 529 CB PHE A 42 -1.255 -10.513 -19.742 1.00 0.00 C ATOM 530 CG PHE A 42 -0.097 -9.524 -19.604 1.00 0.00 C ATOM 531 CD1 PHE A 42 0.117 -8.587 -20.567 1.00 0.00 C ATOM 532 CD2 PHE A 42 0.720 -9.580 -18.518 1.00 0.00 C ATOM 533 CE1 PHE A 42 1.193 -7.669 -20.439 1.00 0.00 C ATOM 534 CE2 PHE A 42 1.796 -8.662 -18.389 1.00 0.00 C ATOM 535 CZ PHE A 42 2.009 -7.726 -19.353 1.00 0.00 C ATOM 0 H PHE A 42 -2.671 -12.432 -19.608 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.871 -11.603 -21.596 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.088 -10.015 -20.238 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -1.599 -10.795 -18.747 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.532 -8.541 -21.429 1.00 0.00 H new ATOM 0 HD2 PHE A 42 0.550 -10.323 -17.753 1.00 0.00 H new ATOM 0 HE1 PHE A 42 1.363 -6.926 -21.204 1.00 0.00 H new ATOM 0 HE2 PHE A 42 2.444 -8.707 -17.527 1.00 0.00 H new ATOM 0 HZ PHE A 42 2.827 -7.028 -19.256 1.00 0.00 H new ATOM 545 N LEU A 43 0.520 -12.861 -18.902 1.00 0.00 N ATOM 546 CA LEU A 43 1.768 -13.371 -18.360 1.00 0.00 C ATOM 547 C LEU A 43 2.387 -14.355 -19.354 1.00 0.00 C ATOM 548 O LEU A 43 3.571 -14.260 -19.672 1.00 0.00 O ATOM 549 CB LEU A 43 1.544 -13.964 -16.967 1.00 0.00 C ATOM 550 CG LEU A 43 1.265 -12.959 -15.847 1.00 0.00 C ATOM 551 CD1 LEU A 43 0.841 -13.673 -14.563 1.00 0.00 C ATOM 552 CD2 LEU A 43 2.467 -12.040 -15.622 1.00 0.00 C ATOM 0 H LEU A 43 -0.294 -13.003 -18.304 1.00 0.00 H new ATOM 0 HA LEU A 43 2.484 -12.560 -18.226 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.707 -14.660 -17.020 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.425 -14.545 -16.695 1.00 0.00 H new ATOM 0 HG LEU A 43 0.431 -12.328 -16.155 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.649 -12.936 -13.783 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.066 -14.249 -14.749 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.637 -14.344 -14.240 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.242 -11.336 -14.821 1.00 0.00 H new ATOM 0 HD22 LEU A 43 3.336 -12.638 -15.346 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.681 -11.490 -16.539 1.00 0.00 H new ATOM 564 N LYS A 44 1.558 -15.278 -19.819 1.00 0.00 N ATOM 565 CA LYS A 44 2.009 -16.279 -20.771 1.00 0.00 C ATOM 566 C LYS A 44 2.740 -15.587 -21.923 1.00 0.00 C ATOM 567 O LYS A 44 3.544 -16.209 -22.615 1.00 0.00 O ATOM 568 CB LYS A 44 0.838 -17.154 -21.223 1.00 0.00 C ATOM 569 CG LYS A 44 0.711 -18.398 -20.341 1.00 0.00 C ATOM 570 CD LYS A 44 0.314 -19.620 -21.171 1.00 0.00 C ATOM 571 CE LYS A 44 -1.204 -19.810 -21.176 1.00 0.00 C ATOM 572 NZ LYS A 44 -1.711 -19.899 -22.564 1.00 0.00 N ATOM 0 H LYS A 44 0.576 -15.354 -19.554 1.00 0.00 H new ATOM 0 HA LYS A 44 2.722 -16.958 -20.302 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.087 -16.579 -21.182 1.00 0.00 H new ATOM 0 HB3 LYS A 44 0.982 -17.453 -22.261 1.00 0.00 H new ATOM 0 HG2 LYS A 44 1.658 -18.589 -19.836 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -0.034 -18.223 -19.565 1.00 0.00 H new ATOM 0 HD2 LYS A 44 0.673 -19.502 -22.193 1.00 0.00 H new ATOM 0 HD3 LYS A 44 0.794 -20.511 -20.766 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.465 -20.716 -20.629 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.682 -18.977 -20.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.743 -20.028 -22.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.479 -19.024 -23.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -1.268 -20.708 -23.044 1.00 0.00 H new ATOM 583 N LYS A 45 2.436 -14.309 -22.092 1.00 0.00 N ATOM 584 CA LYS A 45 3.054 -13.525 -23.149 1.00 0.00 C ATOM 585 C LYS A 45 4.440 -13.066 -22.692 1.00 0.00 C ATOM 586 O LYS A 45 5.000 -12.123 -23.249 1.00 0.00 O ATOM 587 CB LYS A 45 2.135 -12.378 -23.573 1.00 0.00 C ATOM 588 CG LYS A 45 0.696 -12.866 -23.753 1.00 0.00 C ATOM 589 CD LYS A 45 -0.139 -11.840 -24.522 1.00 0.00 C ATOM 590 CE LYS A 45 -1.553 -12.366 -24.778 1.00 0.00 C ATOM 591 NZ LYS A 45 -1.771 -12.579 -26.227 1.00 0.00 N ATOM 0 H LYS A 45 1.770 -13.796 -21.515 1.00 0.00 H new ATOM 0 HA LYS A 45 3.197 -14.134 -24.042 1.00 0.00 H new ATOM 0 HB2 LYS A 45 2.164 -11.588 -22.823 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.495 -11.945 -24.506 1.00 0.00 H new ATOM 0 HG2 LYS A 45 0.695 -13.816 -24.288 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.246 -13.049 -22.777 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -0.190 -10.910 -23.956 1.00 0.00 H new ATOM 0 HD3 LYS A 45 0.345 -11.610 -25.471 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -1.702 -13.302 -24.240 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -2.286 -11.657 -24.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.735 -12.936 -26.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -1.649 -11.678 -26.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.083 -13.272 -26.583 1.00 0.00 H new ATOM 602 N SER A 46 4.954 -13.754 -21.682 1.00 0.00 N ATOM 603 CA SER A 46 6.264 -13.428 -21.145 1.00 0.00 C ATOM 604 C SER A 46 7.336 -14.279 -21.828 1.00 0.00 C ATOM 605 O SER A 46 8.155 -13.761 -22.585 1.00 0.00 O ATOM 606 CB SER A 46 6.305 -13.639 -19.630 1.00 0.00 C ATOM 607 OG SER A 46 6.285 -15.020 -19.282 1.00 0.00 O ATOM 0 H SER A 46 4.487 -14.535 -21.222 1.00 0.00 H new ATOM 0 HA SER A 46 6.464 -12.375 -21.344 1.00 0.00 H new ATOM 0 HB2 SER A 46 7.204 -13.176 -19.224 1.00 0.00 H new ATOM 0 HB3 SER A 46 5.453 -13.137 -19.171 1.00 0.00 H new ATOM 0 HG SER A 46 5.362 -15.348 -19.298 1.00 0.00 H new ATOM 613 N GLY A 47 7.297 -15.571 -21.536 1.00 0.00 N ATOM 614 CA GLY A 47 8.255 -16.498 -22.113 1.00 0.00 C ATOM 615 C GLY A 47 8.391 -17.753 -21.249 1.00 0.00 C ATOM 616 O GLY A 47 8.542 -18.857 -21.771 1.00 0.00 O ATOM 0 H GLY A 47 6.617 -15.997 -20.907 1.00 0.00 H new ATOM 0 HA2 GLY A 47 7.937 -16.776 -23.118 1.00 0.00 H new ATOM 0 HA3 GLY A 47 9.225 -16.011 -22.209 1.00 0.00 H new ATOM 620 N LEU A 48 8.333 -17.543 -19.942 1.00 0.00 N ATOM 621 CA LEU A 48 8.448 -18.644 -19.001 1.00 0.00 C ATOM 622 C LEU A 48 7.338 -19.660 -19.273 1.00 0.00 C ATOM 623 O LEU A 48 6.353 -19.345 -19.939 1.00 0.00 O ATOM 624 CB LEU A 48 8.464 -18.120 -17.563 1.00 0.00 C ATOM 625 CG LEU A 48 9.824 -17.664 -17.030 1.00 0.00 C ATOM 626 CD1 LEU A 48 9.663 -16.528 -16.018 1.00 0.00 C ATOM 627 CD2 LEU A 48 10.608 -18.843 -16.449 1.00 0.00 C ATOM 0 H LEU A 48 8.208 -16.626 -19.513 1.00 0.00 H new ATOM 0 HA LEU A 48 9.396 -19.164 -19.137 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.770 -17.282 -17.495 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.083 -18.903 -16.908 1.00 0.00 H new ATOM 0 HG LEU A 48 10.404 -17.271 -17.865 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.644 -16.223 -15.655 1.00 0.00 H new ATOM 0 HD12 LEU A 48 9.174 -15.680 -16.497 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.056 -16.871 -15.180 1.00 0.00 H new ATOM 0 HD21 LEU A 48 11.571 -18.492 -16.077 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.043 -19.288 -15.630 1.00 0.00 H new ATOM 0 HD23 LEU A 48 10.770 -19.590 -17.226 1.00 0.00 H new ATOM 639 N PRO A 49 7.539 -20.891 -18.730 1.00 0.00 N ATOM 640 CA PRO A 49 6.566 -21.956 -18.908 1.00 0.00 C ATOM 641 C PRO A 49 5.338 -21.729 -18.025 1.00 0.00 C ATOM 642 O PRO A 49 5.134 -20.631 -17.508 1.00 0.00 O ATOM 643 CB PRO A 49 7.315 -23.234 -18.567 1.00 0.00 C ATOM 644 CG PRO A 49 8.534 -22.802 -17.768 1.00 0.00 C ATOM 645 CD PRO A 49 8.694 -21.300 -17.936 1.00 0.00 C ATOM 0 HA PRO A 49 6.171 -22.000 -19.923 1.00 0.00 H new ATOM 0 HB2 PRO A 49 6.688 -23.911 -17.987 1.00 0.00 H new ATOM 0 HB3 PRO A 49 7.609 -23.767 -19.471 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.410 -23.057 -16.716 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.425 -23.322 -18.120 1.00 0.00 H new ATOM 0 HD2 PRO A 49 8.711 -20.793 -16.971 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.628 -21.055 -18.441 1.00 0.00 H new ATOM 653 N ASP A 50 4.551 -22.785 -17.879 1.00 0.00 N ATOM 654 CA ASP A 50 3.348 -22.715 -17.067 1.00 0.00 C ATOM 655 C ASP A 50 3.652 -23.248 -15.665 1.00 0.00 C ATOM 656 O ASP A 50 3.103 -22.758 -14.679 1.00 0.00 O ATOM 657 CB ASP A 50 2.229 -23.569 -17.665 1.00 0.00 C ATOM 658 CG ASP A 50 0.843 -23.335 -17.062 1.00 0.00 C ATOM 659 OD1 ASP A 50 0.708 -23.049 -15.863 1.00 0.00 O ATOM 660 OD2 ASP A 50 -0.140 -23.459 -17.888 1.00 0.00 O ATOM 0 H ASP A 50 4.723 -23.694 -18.309 1.00 0.00 H new ATOM 0 HA ASP A 50 3.027 -21.674 -17.030 1.00 0.00 H new ATOM 0 HB2 ASP A 50 2.179 -23.377 -18.737 1.00 0.00 H new ATOM 0 HB3 ASP A 50 2.489 -24.620 -17.541 1.00 0.00 H new ATOM 666 N LEU A 51 4.525 -24.243 -15.622 1.00 0.00 N ATOM 667 CA LEU A 51 4.908 -24.848 -14.358 1.00 0.00 C ATOM 668 C LEU A 51 5.520 -23.779 -13.451 1.00 0.00 C ATOM 669 O LEU A 51 5.080 -23.595 -12.317 1.00 0.00 O ATOM 670 CB LEU A 51 5.823 -26.051 -14.595 1.00 0.00 C ATOM 671 CG LEU A 51 7.320 -25.805 -14.393 1.00 0.00 C ATOM 672 CD1 LEU A 51 8.036 -27.092 -13.979 1.00 0.00 C ATOM 673 CD2 LEU A 51 7.946 -25.177 -15.640 1.00 0.00 C ATOM 0 H LEU A 51 4.978 -24.646 -16.442 1.00 0.00 H new ATOM 0 HA LEU A 51 4.032 -25.241 -13.842 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.514 -26.855 -13.927 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.667 -26.406 -15.614 1.00 0.00 H new ATOM 0 HG LEU A 51 7.442 -25.092 -13.578 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.098 -26.889 -13.842 1.00 0.00 H new ATOM 0 HD12 LEU A 51 7.613 -27.459 -13.044 1.00 0.00 H new ATOM 0 HD13 LEU A 51 7.908 -27.846 -14.756 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.010 -25.013 -15.470 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.814 -25.846 -16.490 1.00 0.00 H new ATOM 0 HD23 LEU A 51 7.461 -24.224 -15.850 1.00 0.00 H new ATOM 685 N ILE A 52 6.526 -23.101 -13.984 1.00 0.00 N ATOM 686 CA ILE A 52 7.204 -22.055 -13.237 1.00 0.00 C ATOM 687 C ILE A 52 6.214 -20.928 -12.934 1.00 0.00 C ATOM 688 O ILE A 52 6.286 -20.301 -11.878 1.00 0.00 O ATOM 689 CB ILE A 52 8.456 -21.590 -13.982 1.00 0.00 C ATOM 690 CG1 ILE A 52 9.581 -22.620 -13.862 1.00 0.00 C ATOM 691 CG2 ILE A 52 8.895 -20.204 -13.505 1.00 0.00 C ATOM 692 CD1 ILE A 52 10.595 -22.203 -12.795 1.00 0.00 C ATOM 0 H ILE A 52 6.888 -23.256 -14.925 1.00 0.00 H new ATOM 0 HA ILE A 52 7.556 -22.438 -12.279 1.00 0.00 H new ATOM 0 HB ILE A 52 8.210 -21.504 -15.040 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.162 -23.594 -13.609 1.00 0.00 H new ATOM 0 HG13 ILE A 52 10.083 -22.729 -14.823 1.00 0.00 H new ATOM 0 HG21 ILE A 52 9.787 -19.897 -14.051 1.00 0.00 H new ATOM 0 HG22 ILE A 52 8.094 -19.487 -13.686 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.116 -20.240 -12.438 1.00 0.00 H new ATOM 0 HD11 ILE A 52 11.384 -22.952 -12.730 1.00 0.00 H new ATOM 0 HD12 ILE A 52 11.030 -21.240 -13.063 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.094 -22.119 -11.830 1.00 0.00 H new ATOM 704 N LEU A 53 5.312 -20.706 -13.879 1.00 0.00 N ATOM 705 CA LEU A 53 4.309 -19.666 -13.726 1.00 0.00 C ATOM 706 C LEU A 53 3.417 -19.996 -12.528 1.00 0.00 C ATOM 707 O LEU A 53 3.246 -19.172 -11.631 1.00 0.00 O ATOM 708 CB LEU A 53 3.538 -19.470 -15.033 1.00 0.00 C ATOM 709 CG LEU A 53 4.005 -18.315 -15.921 1.00 0.00 C ATOM 710 CD1 LEU A 53 3.351 -18.386 -17.302 1.00 0.00 C ATOM 711 CD2 LEU A 53 3.761 -16.966 -15.240 1.00 0.00 C ATOM 0 H LEU A 53 5.255 -21.229 -14.753 1.00 0.00 H new ATOM 0 HA LEU A 53 4.783 -18.707 -13.516 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.599 -20.393 -15.610 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.487 -19.314 -14.791 1.00 0.00 H new ATOM 0 HG LEU A 53 5.081 -18.411 -16.069 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.700 -17.554 -17.913 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.618 -19.327 -17.783 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.268 -18.328 -17.195 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.102 -16.162 -15.892 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.696 -16.846 -15.042 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.311 -16.928 -14.300 1.00 0.00 H new ATOM 723 N GLY A 54 2.870 -21.203 -12.553 1.00 0.00 N ATOM 724 CA GLY A 54 1.999 -21.652 -11.480 1.00 0.00 C ATOM 725 C GLY A 54 2.548 -21.231 -10.116 1.00 0.00 C ATOM 726 O GLY A 54 1.796 -20.784 -9.251 1.00 0.00 O ATOM 0 H GLY A 54 3.013 -21.883 -13.299 1.00 0.00 H new ATOM 0 HA2 GLY A 54 1.001 -21.236 -11.619 1.00 0.00 H new ATOM 0 HA3 GLY A 54 1.900 -22.737 -11.517 1.00 0.00 H new ATOM 730 N LYS A 55 3.855 -21.389 -9.965 1.00 0.00 N ATOM 731 CA LYS A 55 4.514 -21.031 -8.720 1.00 0.00 C ATOM 732 C LYS A 55 4.380 -19.524 -8.493 1.00 0.00 C ATOM 733 O LYS A 55 4.102 -19.083 -7.378 1.00 0.00 O ATOM 734 CB LYS A 55 5.961 -21.527 -8.718 1.00 0.00 C ATOM 735 CG LYS A 55 6.017 -23.056 -8.717 1.00 0.00 C ATOM 736 CD LYS A 55 5.824 -23.611 -7.305 1.00 0.00 C ATOM 737 CE LYS A 55 4.720 -24.670 -7.278 1.00 0.00 C ATOM 738 NZ LYS A 55 5.277 -25.989 -6.903 1.00 0.00 N ATOM 0 H LYS A 55 4.476 -21.760 -10.684 1.00 0.00 H new ATOM 0 HA LYS A 55 4.031 -21.525 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 55 6.483 -21.141 -9.594 1.00 0.00 H new ATOM 0 HB3 LYS A 55 6.481 -21.140 -7.841 1.00 0.00 H new ATOM 0 HG2 LYS A 55 5.244 -23.452 -9.376 1.00 0.00 H new ATOM 0 HG3 LYS A 55 6.976 -23.389 -9.114 1.00 0.00 H new ATOM 0 HD2 LYS A 55 6.759 -24.046 -6.950 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.571 -22.799 -6.623 1.00 0.00 H new ATOM 0 HE2 LYS A 55 3.947 -24.380 -6.567 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.245 -24.734 -8.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.515 -26.696 -6.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.999 -26.271 -7.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.709 -25.928 -5.959 1.00 0.00 H new ATOM 749 N ILE A 56 4.583 -18.775 -9.567 1.00 0.00 N ATOM 750 CA ILE A 56 4.489 -17.327 -9.498 1.00 0.00 C ATOM 751 C ILE A 56 3.104 -16.934 -8.978 1.00 0.00 C ATOM 752 O ILE A 56 2.991 -16.214 -7.987 1.00 0.00 O ATOM 753 CB ILE A 56 4.837 -16.702 -10.851 1.00 0.00 C ATOM 754 CG1 ILE A 56 6.349 -16.523 -10.999 1.00 0.00 C ATOM 755 CG2 ILE A 56 4.081 -15.389 -11.060 1.00 0.00 C ATOM 756 CD1 ILE A 56 6.677 -15.538 -12.123 1.00 0.00 C ATOM 0 H ILE A 56 4.812 -19.144 -10.490 1.00 0.00 H new ATOM 0 HA ILE A 56 5.220 -16.932 -8.792 1.00 0.00 H new ATOM 0 HB ILE A 56 4.515 -17.386 -11.636 1.00 0.00 H new ATOM 0 HG12 ILE A 56 6.770 -16.162 -10.060 1.00 0.00 H new ATOM 0 HG13 ILE A 56 6.814 -17.486 -11.208 1.00 0.00 H new ATOM 0 HG21 ILE A 56 4.347 -14.966 -12.029 1.00 0.00 H new ATOM 0 HG22 ILE A 56 3.008 -15.578 -11.029 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.349 -14.686 -10.272 1.00 0.00 H new ATOM 0 HD11 ILE A 56 7.758 -15.429 -12.207 1.00 0.00 H new ATOM 0 HD12 ILE A 56 6.276 -15.913 -13.064 1.00 0.00 H new ATOM 0 HD13 ILE A 56 6.231 -14.569 -11.899 1.00 0.00 H new ATOM 768 N TRP A 57 2.087 -17.425 -9.670 1.00 0.00 N ATOM 769 CA TRP A 57 0.714 -17.135 -9.290 1.00 0.00 C ATOM 770 C TRP A 57 0.533 -17.542 -7.827 1.00 0.00 C ATOM 771 O TRP A 57 0.117 -16.731 -7.000 1.00 0.00 O ATOM 772 CB TRP A 57 -0.273 -17.828 -10.231 1.00 0.00 C ATOM 773 CG TRP A 57 -1.719 -17.352 -10.076 1.00 0.00 C ATOM 774 CD1 TRP A 57 -2.586 -17.653 -9.099 1.00 0.00 C ATOM 775 CD2 TRP A 57 -2.435 -16.474 -10.969 1.00 0.00 C ATOM 776 NE1 TRP A 57 -3.804 -17.034 -9.297 1.00 0.00 N ATOM 777 CE2 TRP A 57 -3.709 -16.295 -10.470 1.00 0.00 C ATOM 778 CE3 TRP A 57 -2.021 -15.851 -12.159 1.00 0.00 C ATOM 779 CZ2 TRP A 57 -4.673 -15.494 -11.096 1.00 0.00 C ATOM 780 CZ3 TRP A 57 -2.995 -15.054 -12.773 1.00 0.00 C ATOM 781 CH2 TRP A 57 -4.282 -14.864 -12.283 1.00 0.00 C ATOM 0 H TRP A 57 2.185 -18.022 -10.491 1.00 0.00 H new ATOM 0 HA TRP A 57 0.504 -16.069 -9.383 1.00 0.00 H new ATOM 0 HB2 TRP A 57 0.045 -17.662 -11.260 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -0.234 -18.903 -10.054 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -2.360 -18.298 -8.263 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -4.623 -17.106 -8.693 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -1.029 -15.977 -12.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -5.664 -15.369 -10.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -2.728 -14.552 -13.691 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -4.977 -14.233 -12.816 1.00 0.00 H new ATOM 792 N ASP A 58 0.852 -18.797 -7.551 1.00 0.00 N ATOM 793 CA ASP A 58 0.729 -19.322 -6.201 1.00 0.00 C ATOM 794 C ASP A 58 1.323 -18.317 -5.212 1.00 0.00 C ATOM 795 O ASP A 58 0.761 -18.088 -4.142 1.00 0.00 O ATOM 796 CB ASP A 58 1.492 -20.640 -6.051 1.00 0.00 C ATOM 797 CG ASP A 58 0.857 -21.648 -5.092 1.00 0.00 C ATOM 798 OD1 ASP A 58 1.433 -21.987 -4.047 1.00 0.00 O ATOM 799 OD2 ASP A 58 -0.295 -22.099 -5.459 1.00 0.00 O ATOM 0 H ASP A 58 1.196 -19.467 -8.239 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.329 -19.493 -6.000 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.583 -21.103 -7.033 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.503 -20.420 -5.707 1.00 0.00 H new ATOM 805 N LEU A 59 2.451 -17.744 -5.605 1.00 0.00 N ATOM 806 CA LEU A 59 3.127 -16.768 -4.767 1.00 0.00 C ATOM 807 C LEU A 59 2.407 -15.423 -4.875 1.00 0.00 C ATOM 808 O LEU A 59 2.401 -14.640 -3.927 1.00 0.00 O ATOM 809 CB LEU A 59 4.614 -16.700 -5.117 1.00 0.00 C ATOM 810 CG LEU A 59 5.423 -15.616 -4.400 1.00 0.00 C ATOM 811 CD1 LEU A 59 5.316 -14.277 -5.132 1.00 0.00 C ATOM 812 CD2 LEU A 59 5.006 -15.502 -2.932 1.00 0.00 C ATOM 0 H LEU A 59 2.914 -17.937 -6.493 1.00 0.00 H new ATOM 0 HA LEU A 59 3.083 -17.069 -3.720 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.064 -17.668 -4.895 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.707 -16.544 -6.192 1.00 0.00 H new ATOM 0 HG LEU A 59 6.473 -15.907 -4.415 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.900 -13.525 -4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.700 -14.385 -6.146 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.272 -13.966 -5.170 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.596 -14.725 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.948 -15.245 -2.873 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.176 -16.455 -2.430 1.00 0.00 H new ATOM 824 N ALA A 60 1.817 -15.196 -6.039 1.00 0.00 N ATOM 825 CA ALA A 60 1.095 -13.958 -6.284 1.00 0.00 C ATOM 826 C ALA A 60 -0.209 -13.966 -5.484 1.00 0.00 C ATOM 827 O ALA A 60 -0.374 -13.180 -4.553 1.00 0.00 O ATOM 828 CB ALA A 60 0.856 -13.795 -7.787 1.00 0.00 C ATOM 0 H ALA A 60 1.824 -15.848 -6.823 1.00 0.00 H new ATOM 0 HA ALA A 60 1.680 -13.100 -5.952 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.315 -12.867 -7.971 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.814 -13.766 -8.307 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.269 -14.636 -8.155 1.00 0.00 H new ATOM 834 N ASP A 61 -1.101 -14.864 -5.876 1.00 0.00 N ATOM 835 CA ASP A 61 -2.385 -14.985 -5.206 1.00 0.00 C ATOM 836 C ASP A 61 -2.190 -14.792 -3.701 1.00 0.00 C ATOM 837 O ASP A 61 -1.338 -15.438 -3.094 1.00 0.00 O ATOM 838 CB ASP A 61 -2.995 -16.370 -5.430 1.00 0.00 C ATOM 839 CG ASP A 61 -4.450 -16.516 -4.982 1.00 0.00 C ATOM 840 OD1 ASP A 61 -5.382 -16.115 -5.695 1.00 0.00 O ATOM 841 OD2 ASP A 61 -4.612 -17.076 -3.831 1.00 0.00 O ATOM 0 H ASP A 61 -0.960 -15.515 -6.649 1.00 0.00 H new ATOM 0 HA ASP A 61 -3.052 -14.227 -5.616 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -2.931 -16.611 -6.491 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.392 -17.106 -4.899 1.00 0.00 H new ATOM 847 N THR A 62 -2.995 -13.900 -3.142 1.00 0.00 N ATOM 848 CA THR A 62 -2.922 -13.614 -1.719 1.00 0.00 C ATOM 849 C THR A 62 -4.239 -13.008 -1.229 1.00 0.00 C ATOM 850 O THR A 62 -4.746 -13.387 -0.175 1.00 0.00 O ATOM 851 CB THR A 62 -1.711 -12.711 -1.480 1.00 0.00 C ATOM 852 OG1 THR A 62 -0.609 -13.613 -1.430 1.00 0.00 O ATOM 853 CG2 THR A 62 -1.727 -12.064 -0.093 1.00 0.00 C ATOM 0 H THR A 62 -3.701 -13.366 -3.649 1.00 0.00 H new ATOM 0 HA THR A 62 -2.785 -14.526 -1.138 1.00 0.00 H new ATOM 0 HB THR A 62 -1.683 -11.933 -2.243 1.00 0.00 H new ATOM 0 HG1 THR A 62 -0.894 -14.495 -1.747 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.846 -11.434 0.025 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.625 -11.456 0.014 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.722 -12.841 0.671 1.00 0.00 H new ATOM 861 N ASP A 63 -4.754 -12.077 -2.018 1.00 0.00 N ATOM 862 CA ASP A 63 -6.002 -11.414 -1.677 1.00 0.00 C ATOM 863 C ASP A 63 -7.126 -12.451 -1.623 1.00 0.00 C ATOM 864 O ASP A 63 -7.819 -12.567 -0.614 1.00 0.00 O ATOM 865 CB ASP A 63 -6.374 -10.367 -2.729 1.00 0.00 C ATOM 866 CG ASP A 63 -7.122 -9.146 -2.189 1.00 0.00 C ATOM 867 OD1 ASP A 63 -7.621 -9.153 -1.054 1.00 0.00 O ATOM 868 OD2 ASP A 63 -7.182 -8.143 -2.997 1.00 0.00 O ATOM 0 H ASP A 63 -4.330 -11.766 -2.892 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.872 -10.925 -0.712 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.462 -10.028 -3.221 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.989 -10.843 -3.492 1.00 0.00 H new ATOM 874 N GLY A 64 -7.272 -13.177 -2.722 1.00 0.00 N ATOM 875 CA GLY A 64 -8.300 -14.199 -2.812 1.00 0.00 C ATOM 876 C GLY A 64 -8.103 -15.067 -4.057 1.00 0.00 C ATOM 877 O GLY A 64 -7.189 -15.889 -4.107 1.00 0.00 O ATOM 0 H GLY A 64 -6.695 -13.077 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -8.274 -14.825 -1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -9.283 -13.729 -2.844 1.00 0.00 H new ATOM 881 N LYS A 65 -8.975 -14.854 -5.032 1.00 0.00 N ATOM 882 CA LYS A 65 -8.908 -15.606 -6.273 1.00 0.00 C ATOM 883 C LYS A 65 -9.966 -15.075 -7.243 1.00 0.00 C ATOM 884 O LYS A 65 -10.865 -14.336 -6.844 1.00 0.00 O ATOM 885 CB LYS A 65 -9.024 -17.106 -5.998 1.00 0.00 C ATOM 886 CG LYS A 65 -10.489 -17.546 -5.964 1.00 0.00 C ATOM 887 CD LYS A 65 -10.751 -18.658 -6.983 1.00 0.00 C ATOM 888 CE LYS A 65 -11.015 -19.992 -6.282 1.00 0.00 C ATOM 889 NZ LYS A 65 -11.928 -20.830 -7.092 1.00 0.00 N ATOM 0 H LYS A 65 -9.732 -14.171 -4.987 1.00 0.00 H new ATOM 0 HA LYS A 65 -7.938 -15.467 -6.750 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -8.491 -17.663 -6.769 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -8.547 -17.343 -5.047 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -10.744 -17.897 -4.964 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -11.134 -16.693 -6.177 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -11.607 -18.393 -7.604 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -9.893 -18.756 -7.648 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.074 -20.518 -6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -11.451 -19.813 -5.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.097 -21.732 -6.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.832 -20.332 -7.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -11.497 -21.015 -8.020 1.00 0.00 H new ATOM 900 N GLY A 66 -9.825 -15.474 -8.499 1.00 0.00 N ATOM 901 CA GLY A 66 -10.757 -15.048 -9.528 1.00 0.00 C ATOM 902 C GLY A 66 -10.479 -13.606 -9.958 1.00 0.00 C ATOM 903 O GLY A 66 -10.965 -13.159 -10.995 1.00 0.00 O ATOM 0 H GLY A 66 -9.079 -16.088 -8.827 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -10.679 -15.710 -10.391 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -11.778 -15.129 -9.155 1.00 0.00 H new ATOM 907 N VAL A 67 -9.698 -12.919 -9.137 1.00 0.00 N ATOM 908 CA VAL A 67 -9.349 -11.536 -9.419 1.00 0.00 C ATOM 909 C VAL A 67 -7.986 -11.223 -8.800 1.00 0.00 C ATOM 910 O VAL A 67 -7.609 -11.812 -7.788 1.00 0.00 O ATOM 911 CB VAL A 67 -10.459 -10.606 -8.925 1.00 0.00 C ATOM 912 CG1 VAL A 67 -10.299 -9.202 -9.513 1.00 0.00 C ATOM 913 CG2 VAL A 67 -11.840 -11.181 -9.246 1.00 0.00 C ATOM 0 H VAL A 67 -9.297 -13.294 -8.277 1.00 0.00 H new ATOM 0 HA VAL A 67 -9.262 -11.374 -10.493 1.00 0.00 H new ATOM 0 HB VAL A 67 -10.373 -10.528 -7.841 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -11.100 -8.560 -9.146 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -9.337 -8.789 -9.211 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -10.346 -9.256 -10.601 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -12.611 -10.500 -8.884 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -11.941 -11.304 -10.324 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.953 -12.149 -8.759 1.00 0.00 H new ATOM 923 N LEU A 68 -7.283 -10.295 -9.433 1.00 0.00 N ATOM 924 CA LEU A 68 -5.970 -9.896 -8.957 1.00 0.00 C ATOM 925 C LEU A 68 -6.072 -8.529 -8.277 1.00 0.00 C ATOM 926 O LEU A 68 -7.027 -7.788 -8.506 1.00 0.00 O ATOM 927 CB LEU A 68 -4.950 -9.940 -10.097 1.00 0.00 C ATOM 928 CG LEU A 68 -4.751 -11.302 -10.766 1.00 0.00 C ATOM 929 CD1 LEU A 68 -3.918 -11.169 -12.043 1.00 0.00 C ATOM 930 CD2 LEU A 68 -4.144 -12.310 -9.788 1.00 0.00 C ATOM 0 H LEU A 68 -7.599 -9.808 -10.272 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.607 -10.600 -8.208 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.256 -9.224 -10.860 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.988 -9.603 -9.711 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.729 -11.685 -11.058 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.791 -12.151 -12.499 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.428 -10.507 -12.743 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.940 -10.754 -11.798 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.013 -13.269 -10.289 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.176 -11.945 -9.444 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.810 -12.434 -8.934 1.00 0.00 H new ATOM 942 N SER A 69 -5.075 -8.237 -7.455 1.00 0.00 N ATOM 943 CA SER A 69 -5.041 -6.972 -6.740 1.00 0.00 C ATOM 944 C SER A 69 -4.205 -5.954 -7.517 1.00 0.00 C ATOM 945 O SER A 69 -4.148 -5.999 -8.745 1.00 0.00 O ATOM 946 CB SER A 69 -4.481 -7.153 -5.328 1.00 0.00 C ATOM 947 OG SER A 69 -4.930 -8.364 -4.726 1.00 0.00 O ATOM 0 H SER A 69 -4.285 -8.854 -7.268 1.00 0.00 H new ATOM 0 HA SER A 69 -6.062 -6.601 -6.652 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.392 -7.150 -5.367 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.780 -6.308 -4.708 1.00 0.00 H new ATOM 0 HG SER A 69 -5.722 -8.183 -4.178 1.00 0.00 H new ATOM 953 N LYS A 70 -3.576 -5.059 -6.769 1.00 0.00 N ATOM 954 CA LYS A 70 -2.745 -4.031 -7.373 1.00 0.00 C ATOM 955 C LYS A 70 -1.296 -4.520 -7.428 1.00 0.00 C ATOM 956 O LYS A 70 -0.920 -5.257 -8.339 1.00 0.00 O ATOM 957 CB LYS A 70 -2.917 -2.702 -6.636 1.00 0.00 C ATOM 958 CG LYS A 70 -4.349 -2.180 -6.774 1.00 0.00 C ATOM 959 CD LYS A 70 -4.990 -1.967 -5.401 1.00 0.00 C ATOM 960 CE LYS A 70 -6.416 -1.431 -5.539 1.00 0.00 C ATOM 961 NZ LYS A 70 -6.656 -0.340 -4.568 1.00 0.00 N ATOM 0 H LYS A 70 -3.625 -5.024 -5.751 1.00 0.00 H new ATOM 0 HA LYS A 70 -3.058 -3.843 -8.400 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -2.674 -2.833 -5.582 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -2.218 -1.967 -7.036 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.346 -1.241 -7.327 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.944 -2.888 -7.351 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.003 -2.908 -4.852 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.389 -1.267 -4.820 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.577 -1.065 -6.553 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.131 -2.237 -5.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.629 0.012 -4.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.523 -0.700 -3.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.986 0.435 -4.744 1.00 0.00 H new ATOM 972 N GLN A 71 -0.522 -4.091 -6.442 1.00 0.00 N ATOM 973 CA GLN A 71 0.877 -4.476 -6.367 1.00 0.00 C ATOM 974 C GLN A 71 1.028 -5.978 -6.615 1.00 0.00 C ATOM 975 O GLN A 71 2.068 -6.430 -7.092 1.00 0.00 O ATOM 976 CB GLN A 71 1.484 -4.078 -5.020 1.00 0.00 C ATOM 977 CG GLN A 71 0.441 -4.159 -3.904 1.00 0.00 C ATOM 978 CD GLN A 71 1.096 -4.508 -2.566 1.00 0.00 C ATOM 979 OE1 GLN A 71 1.557 -5.614 -2.341 1.00 0.00 O ATOM 980 NE2 GLN A 71 1.110 -3.504 -1.693 1.00 0.00 N ATOM 0 H GLN A 71 -0.837 -3.480 -5.688 1.00 0.00 H new ATOM 0 HA GLN A 71 1.423 -3.943 -7.145 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.323 -4.734 -4.787 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.879 -3.064 -5.080 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.081 -3.206 -3.820 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.307 -4.911 -4.154 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.706 -2.602 -1.946 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.525 -3.636 -0.770 1.00 0.00 H new ATOM 989 N GLU A 72 -0.024 -6.709 -6.279 1.00 0.00 N ATOM 990 CA GLU A 72 -0.022 -8.151 -6.459 1.00 0.00 C ATOM 991 C GLU A 72 0.400 -8.507 -7.886 1.00 0.00 C ATOM 992 O GLU A 72 1.510 -8.988 -8.108 1.00 0.00 O ATOM 993 CB GLU A 72 -1.390 -8.748 -6.126 1.00 0.00 C ATOM 994 CG GLU A 72 -1.612 -8.801 -4.613 1.00 0.00 C ATOM 995 CD GLU A 72 -2.755 -9.755 -4.260 1.00 0.00 C ATOM 996 OE1 GLU A 72 -3.068 -10.664 -5.042 1.00 0.00 O ATOM 997 OE2 GLU A 72 -3.326 -9.525 -3.126 1.00 0.00 O ATOM 0 H GLU A 72 -0.884 -6.330 -5.883 1.00 0.00 H new ATOM 0 HA GLU A 72 0.703 -8.582 -5.768 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.174 -8.151 -6.591 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -1.464 -9.752 -6.543 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.696 -9.126 -4.119 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.839 -7.802 -4.240 1.00 0.00 H new ATOM 1005 N PHE A 73 -0.510 -8.257 -8.817 1.00 0.00 N ATOM 1006 CA PHE A 73 -0.246 -8.546 -10.217 1.00 0.00 C ATOM 1007 C PHE A 73 1.093 -7.950 -10.657 1.00 0.00 C ATOM 1008 O PHE A 73 1.866 -8.602 -11.357 1.00 0.00 O ATOM 1009 CB PHE A 73 -1.371 -7.896 -11.026 1.00 0.00 C ATOM 1010 CG PHE A 73 -1.057 -7.745 -12.516 1.00 0.00 C ATOM 1011 CD1 PHE A 73 -0.172 -6.799 -12.932 1.00 0.00 C ATOM 1012 CD2 PHE A 73 -1.663 -8.556 -13.424 1.00 0.00 C ATOM 1013 CE1 PHE A 73 0.119 -6.659 -14.315 1.00 0.00 C ATOM 1014 CE2 PHE A 73 -1.372 -8.415 -14.807 1.00 0.00 C ATOM 1015 CZ PHE A 73 -0.488 -7.469 -15.223 1.00 0.00 C ATOM 0 H PHE A 73 -1.430 -7.858 -8.629 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.202 -9.624 -10.373 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -2.277 -8.492 -10.914 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.584 -6.912 -10.608 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.309 -6.155 -12.211 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -2.365 -9.307 -13.094 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.822 -5.909 -14.646 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -1.853 -9.059 -15.528 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.268 -7.361 -16.275 1.00 0.00 H new ATOM 1025 N PHE A 74 1.325 -6.718 -10.229 1.00 0.00 N ATOM 1026 CA PHE A 74 2.557 -6.027 -10.570 1.00 0.00 C ATOM 1027 C PHE A 74 3.774 -6.774 -10.020 1.00 0.00 C ATOM 1028 O PHE A 74 4.839 -6.771 -10.636 1.00 0.00 O ATOM 1029 CB PHE A 74 2.488 -4.643 -9.922 1.00 0.00 C ATOM 1030 CG PHE A 74 2.215 -3.507 -10.910 1.00 0.00 C ATOM 1031 CD1 PHE A 74 1.064 -3.496 -11.633 1.00 0.00 C ATOM 1032 CD2 PHE A 74 3.125 -2.508 -11.065 1.00 0.00 C ATOM 1033 CE1 PHE A 74 0.811 -2.441 -12.550 1.00 0.00 C ATOM 1034 CE2 PHE A 74 2.873 -1.454 -11.982 1.00 0.00 C ATOM 1035 CZ PHE A 74 1.721 -1.442 -12.705 1.00 0.00 C ATOM 0 H PHE A 74 0.681 -6.180 -9.649 1.00 0.00 H new ATOM 0 HA PHE A 74 2.661 -5.964 -11.653 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.706 -4.647 -9.163 1.00 0.00 H new ATOM 0 HB3 PHE A 74 3.429 -4.446 -9.408 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.342 -4.289 -11.510 1.00 0.00 H new ATOM 0 HD2 PHE A 74 4.039 -2.517 -10.490 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.104 -2.432 -13.124 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.596 -0.661 -12.106 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.529 -0.640 -13.402 1.00 0.00 H new ATOM 1045 N VAL A 75 3.576 -7.396 -8.867 1.00 0.00 N ATOM 1046 CA VAL A 75 4.645 -8.145 -8.228 1.00 0.00 C ATOM 1047 C VAL A 75 4.963 -9.386 -9.064 1.00 0.00 C ATOM 1048 O VAL A 75 6.124 -9.647 -9.377 1.00 0.00 O ATOM 1049 CB VAL A 75 4.259 -8.479 -6.785 1.00 0.00 C ATOM 1050 CG1 VAL A 75 4.835 -9.832 -6.363 1.00 0.00 C ATOM 1051 CG2 VAL A 75 4.703 -7.371 -5.828 1.00 0.00 C ATOM 0 H VAL A 75 2.692 -7.397 -8.359 1.00 0.00 H new ATOM 0 HA VAL A 75 5.554 -7.546 -8.177 1.00 0.00 H new ATOM 0 HB VAL A 75 3.172 -8.548 -6.736 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.546 -10.045 -5.334 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.448 -10.613 -7.018 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.922 -9.803 -6.436 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.416 -7.633 -4.810 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.786 -7.256 -5.882 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.224 -6.433 -6.110 1.00 0.00 H new ATOM 1061 N ALA A 76 3.912 -10.118 -9.403 1.00 0.00 N ATOM 1062 CA ALA A 76 4.065 -11.325 -10.197 1.00 0.00 C ATOM 1063 C ALA A 76 4.762 -10.978 -11.514 1.00 0.00 C ATOM 1064 O ALA A 76 5.592 -11.745 -12.002 1.00 0.00 O ATOM 1065 CB ALA A 76 2.695 -11.970 -10.415 1.00 0.00 C ATOM 0 H ALA A 76 2.951 -9.898 -9.142 1.00 0.00 H new ATOM 0 HA ALA A 76 4.688 -12.052 -9.675 1.00 0.00 H new ATOM 0 HB1 ALA A 76 2.810 -12.876 -11.011 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.255 -12.223 -9.451 1.00 0.00 H new ATOM 0 HB3 ALA A 76 2.043 -11.271 -10.939 1.00 0.00 H new ATOM 1071 N LEU A 77 4.400 -9.823 -12.053 1.00 0.00 N ATOM 1072 CA LEU A 77 4.981 -9.366 -13.304 1.00 0.00 C ATOM 1073 C LEU A 77 6.506 -9.437 -13.209 1.00 0.00 C ATOM 1074 O LEU A 77 7.132 -10.282 -13.847 1.00 0.00 O ATOM 1075 CB LEU A 77 4.451 -7.977 -13.664 1.00 0.00 C ATOM 1076 CG LEU A 77 3.846 -7.831 -15.062 1.00 0.00 C ATOM 1077 CD1 LEU A 77 3.476 -6.375 -15.350 1.00 0.00 C ATOM 1078 CD2 LEU A 77 4.783 -8.406 -16.127 1.00 0.00 C ATOM 0 H LEU A 77 3.711 -9.190 -11.646 1.00 0.00 H new ATOM 0 HA LEU A 77 4.682 -10.019 -14.124 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.694 -7.698 -12.931 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.268 -7.262 -13.567 1.00 0.00 H new ATOM 0 HG LEU A 77 2.923 -8.410 -15.098 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.048 -6.299 -16.350 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.746 -6.033 -14.616 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.370 -5.754 -15.290 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.330 -8.290 -17.111 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.734 -7.874 -16.100 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.953 -9.464 -15.929 1.00 0.00 H new ATOM 1090 N ARG A 78 7.060 -8.538 -12.409 1.00 0.00 N ATOM 1091 CA ARG A 78 8.500 -8.488 -12.223 1.00 0.00 C ATOM 1092 C ARG A 78 9.030 -9.864 -11.813 1.00 0.00 C ATOM 1093 O ARG A 78 10.126 -10.255 -12.213 1.00 0.00 O ATOM 1094 CB ARG A 78 8.882 -7.463 -11.153 1.00 0.00 C ATOM 1095 CG ARG A 78 8.888 -6.045 -11.729 1.00 0.00 C ATOM 1096 CD ARG A 78 9.764 -5.966 -12.981 1.00 0.00 C ATOM 1097 NE ARG A 78 8.930 -6.122 -14.194 1.00 0.00 N ATOM 1098 CZ ARG A 78 9.284 -5.676 -15.418 1.00 0.00 C ATOM 1099 NH1 ARG A 78 10.460 -5.041 -15.602 1.00 0.00 N ATOM 1100 NH2 ARG A 78 8.461 -5.870 -16.432 1.00 0.00 N ATOM 0 H ARG A 78 6.537 -7.838 -11.882 1.00 0.00 H new ATOM 0 HA ARG A 78 8.947 -8.190 -13.172 1.00 0.00 H new ATOM 0 HB2 ARG A 78 8.178 -7.519 -10.323 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.867 -7.701 -10.752 1.00 0.00 H new ATOM 0 HG2 ARG A 78 7.869 -5.744 -11.974 1.00 0.00 H new ATOM 0 HG3 ARG A 78 9.256 -5.345 -10.979 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.286 -5.010 -13.009 1.00 0.00 H new ATOM 0 HD3 ARG A 78 10.526 -6.745 -12.951 1.00 0.00 H new ATOM 0 HE ARG A 78 8.032 -6.596 -14.099 1.00 0.00 H new ATOM 0 HH11 ARG A 78 11.090 -4.895 -14.813 1.00 0.00 H new ATOM 0 HH12 ARG A 78 10.720 -4.707 -16.530 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.573 -6.350 -16.284 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.713 -5.539 -17.364 1.00 0.00 H new ATOM 1113 N LEU A 79 8.229 -10.560 -11.021 1.00 0.00 N ATOM 1114 CA LEU A 79 8.604 -11.883 -10.553 1.00 0.00 C ATOM 1115 C LEU A 79 9.001 -12.749 -11.750 1.00 0.00 C ATOM 1116 O LEU A 79 9.953 -13.524 -11.671 1.00 0.00 O ATOM 1117 CB LEU A 79 7.485 -12.487 -9.701 1.00 0.00 C ATOM 1118 CG LEU A 79 7.920 -13.511 -8.651 1.00 0.00 C ATOM 1119 CD1 LEU A 79 6.751 -13.894 -7.741 1.00 0.00 C ATOM 1120 CD2 LEU A 79 8.558 -14.736 -9.311 1.00 0.00 C ATOM 0 H LEU A 79 7.321 -10.233 -10.691 1.00 0.00 H new ATOM 0 HA LEU A 79 9.474 -11.824 -9.899 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.963 -11.675 -9.194 1.00 0.00 H new ATOM 0 HB3 LEU A 79 6.765 -12.962 -10.367 1.00 0.00 H new ATOM 0 HG LEU A 79 8.681 -13.051 -8.021 1.00 0.00 H new ATOM 0 HD11 LEU A 79 7.087 -14.623 -7.004 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.381 -13.005 -7.230 1.00 0.00 H new ATOM 0 HD13 LEU A 79 5.950 -14.327 -8.340 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.858 -15.448 -8.543 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.837 -15.206 -9.980 1.00 0.00 H new ATOM 0 HD23 LEU A 79 9.434 -14.427 -9.882 1.00 0.00 H new ATOM 1132 N VAL A 80 8.251 -12.588 -12.831 1.00 0.00 N ATOM 1133 CA VAL A 80 8.513 -13.346 -14.043 1.00 0.00 C ATOM 1134 C VAL A 80 9.948 -13.083 -14.503 1.00 0.00 C ATOM 1135 O VAL A 80 10.649 -14.004 -14.920 1.00 0.00 O ATOM 1136 CB VAL A 80 7.471 -13.003 -15.109 1.00 0.00 C ATOM 1137 CG1 VAL A 80 7.676 -13.849 -16.368 1.00 0.00 C ATOM 1138 CG2 VAL A 80 6.052 -13.169 -14.562 1.00 0.00 C ATOM 0 H VAL A 80 7.462 -11.944 -12.893 1.00 0.00 H new ATOM 0 HA VAL A 80 8.424 -14.415 -13.852 1.00 0.00 H new ATOM 0 HB VAL A 80 7.604 -11.956 -15.383 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.922 -13.586 -17.110 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.669 -13.659 -16.776 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.583 -14.905 -16.116 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.331 -12.919 -15.340 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.902 -14.202 -14.247 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.911 -12.505 -13.709 1.00 0.00 H new ATOM 1148 N ALA A 81 10.343 -11.822 -14.412 1.00 0.00 N ATOM 1149 CA ALA A 81 11.683 -11.426 -14.814 1.00 0.00 C ATOM 1150 C ALA A 81 12.707 -12.142 -13.932 1.00 0.00 C ATOM 1151 O ALA A 81 13.886 -12.212 -14.275 1.00 0.00 O ATOM 1152 CB ALA A 81 11.810 -9.903 -14.738 1.00 0.00 C ATOM 0 H ALA A 81 9.759 -11.061 -14.066 1.00 0.00 H new ATOM 0 HA ALA A 81 11.876 -11.717 -15.846 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.815 -9.606 -15.039 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.080 -9.443 -15.405 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.626 -9.573 -13.716 1.00 0.00 H new ATOM 1158 N CYS A 82 12.221 -12.655 -12.811 1.00 0.00 N ATOM 1159 CA CYS A 82 13.079 -13.363 -11.877 1.00 0.00 C ATOM 1160 C CYS A 82 13.412 -14.733 -12.473 1.00 0.00 C ATOM 1161 O CYS A 82 14.540 -14.970 -12.902 1.00 0.00 O ATOM 1162 CB CYS A 82 12.434 -13.483 -10.495 1.00 0.00 C ATOM 1163 SG CYS A 82 13.730 -13.593 -9.207 1.00 0.00 S ATOM 0 H CYS A 82 11.243 -12.594 -12.529 1.00 0.00 H new ATOM 0 HA CYS A 82 14.000 -12.800 -11.727 1.00 0.00 H new ATOM 0 HB2 CYS A 82 11.795 -12.620 -10.307 1.00 0.00 H new ATOM 0 HB3 CYS A 82 11.796 -14.366 -10.458 1.00 0.00 H new ATOM 0 HG CYS A 82 13.528 -12.675 -8.309 1.00 0.00 H new ATOM 1169 N ALA A 83 12.409 -15.598 -12.481 1.00 0.00 N ATOM 1170 CA ALA A 83 12.580 -16.938 -13.017 1.00 0.00 C ATOM 1171 C ALA A 83 13.198 -16.848 -14.414 1.00 0.00 C ATOM 1172 O ALA A 83 13.806 -17.805 -14.890 1.00 0.00 O ATOM 1173 CB ALA A 83 11.233 -17.663 -13.021 1.00 0.00 C ATOM 0 H ALA A 83 11.475 -15.397 -12.125 1.00 0.00 H new ATOM 0 HA ALA A 83 13.259 -17.517 -12.392 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.362 -18.668 -13.423 1.00 0.00 H new ATOM 0 HB2 ALA A 83 10.851 -17.726 -12.002 1.00 0.00 H new ATOM 0 HB3 ALA A 83 10.525 -17.112 -13.641 1.00 0.00 H new ATOM 1179 N GLN A 84 13.021 -15.689 -15.031 1.00 0.00 N ATOM 1180 CA GLN A 84 13.553 -15.462 -16.364 1.00 0.00 C ATOM 1181 C GLN A 84 15.071 -15.657 -16.369 1.00 0.00 C ATOM 1182 O GLN A 84 15.662 -15.921 -17.415 1.00 0.00 O ATOM 1183 CB GLN A 84 13.178 -14.069 -16.874 1.00 0.00 C ATOM 1184 CG GLN A 84 11.752 -14.055 -17.428 1.00 0.00 C ATOM 1185 CD GLN A 84 11.752 -13.797 -18.937 1.00 0.00 C ATOM 1186 OE1 GLN A 84 12.764 -13.475 -19.537 1.00 0.00 O ATOM 1187 NE2 GLN A 84 10.564 -13.956 -19.513 1.00 0.00 N ATOM 0 H GLN A 84 12.517 -14.897 -14.632 1.00 0.00 H new ATOM 0 HA GLN A 84 13.109 -16.192 -17.041 1.00 0.00 H new ATOM 0 HB2 GLN A 84 13.264 -13.345 -16.063 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.877 -13.762 -17.652 1.00 0.00 H new ATOM 0 HG2 GLN A 84 11.267 -15.009 -17.219 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.170 -13.284 -16.924 1.00 0.00 H new ATOM 0 HE21 GLN A 84 9.757 -14.227 -18.951 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.460 -13.807 -20.517 1.00 0.00 H new ATOM 1196 N ASN A 85 15.658 -15.519 -15.189 1.00 0.00 N ATOM 1197 CA ASN A 85 17.095 -15.677 -15.045 1.00 0.00 C ATOM 1198 C ASN A 85 17.397 -17.067 -14.481 1.00 0.00 C ATOM 1199 O ASN A 85 18.524 -17.550 -14.582 1.00 0.00 O ATOM 1200 CB ASN A 85 17.669 -14.640 -14.079 1.00 0.00 C ATOM 1201 CG ASN A 85 19.108 -14.280 -14.451 1.00 0.00 C ATOM 1202 OD1 ASN A 85 19.440 -14.048 -15.602 1.00 0.00 O ATOM 1203 ND2 ASN A 85 19.943 -14.248 -13.416 1.00 0.00 N ATOM 0 H ASN A 85 15.164 -15.299 -14.324 1.00 0.00 H new ATOM 0 HA ASN A 85 17.549 -15.545 -16.027 1.00 0.00 H new ATOM 0 HB2 ASN A 85 17.051 -13.743 -14.094 1.00 0.00 H new ATOM 0 HB3 ASN A 85 17.640 -15.030 -13.062 1.00 0.00 H new ATOM 0 HD21 ASN A 85 20.926 -14.019 -13.561 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.600 -14.453 -12.477 1.00 0.00 H new ATOM 1210 N GLY A 86 16.370 -17.671 -13.900 1.00 0.00 N ATOM 1211 CA GLY A 86 16.512 -18.995 -13.320 1.00 0.00 C ATOM 1212 C GLY A 86 16.458 -18.934 -11.792 1.00 0.00 C ATOM 1213 O GLY A 86 16.744 -19.921 -11.117 1.00 0.00 O ATOM 0 H GLY A 86 15.437 -17.267 -13.819 1.00 0.00 H new ATOM 0 HA2 GLY A 86 15.719 -19.645 -13.690 1.00 0.00 H new ATOM 0 HA3 GLY A 86 17.458 -19.435 -13.637 1.00 0.00 H new ATOM 1217 N LEU A 87 16.090 -17.763 -11.292 1.00 0.00 N ATOM 1218 CA LEU A 87 15.995 -17.560 -9.857 1.00 0.00 C ATOM 1219 C LEU A 87 14.698 -18.187 -9.341 1.00 0.00 C ATOM 1220 O LEU A 87 13.835 -18.571 -10.129 1.00 0.00 O ATOM 1221 CB LEU A 87 16.138 -16.075 -9.515 1.00 0.00 C ATOM 1222 CG LEU A 87 17.407 -15.389 -10.024 1.00 0.00 C ATOM 1223 CD1 LEU A 87 17.265 -13.866 -9.975 1.00 0.00 C ATOM 1224 CD2 LEU A 87 18.638 -15.874 -9.257 1.00 0.00 C ATOM 0 H LEU A 87 15.854 -16.946 -11.855 1.00 0.00 H new ATOM 0 HA LEU A 87 16.817 -18.062 -9.347 1.00 0.00 H new ATOM 0 HB2 LEU A 87 15.275 -15.545 -9.919 1.00 0.00 H new ATOM 0 HB3 LEU A 87 16.100 -15.967 -8.431 1.00 0.00 H new ATOM 0 HG LEU A 87 17.549 -15.666 -11.069 1.00 0.00 H new ATOM 0 HD11 LEU A 87 18.181 -13.403 -10.342 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.427 -13.558 -10.600 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.086 -13.550 -8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 87 19.526 -15.371 -9.639 1.00 0.00 H new ATOM 0 HD22 LEU A 87 18.519 -15.647 -8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 87 18.747 -16.951 -9.387 1.00 0.00 H new ATOM 1236 N GLU A 88 14.603 -18.272 -8.022 1.00 0.00 N ATOM 1237 CA GLU A 88 13.426 -18.846 -7.393 1.00 0.00 C ATOM 1238 C GLU A 88 12.157 -18.183 -7.933 1.00 0.00 C ATOM 1239 O GLU A 88 12.220 -17.107 -8.526 1.00 0.00 O ATOM 1240 CB GLU A 88 13.503 -18.722 -5.870 1.00 0.00 C ATOM 1241 CG GLU A 88 12.951 -19.976 -5.189 1.00 0.00 C ATOM 1242 CD GLU A 88 13.826 -20.385 -4.002 1.00 0.00 C ATOM 1243 OE1 GLU A 88 13.540 -19.999 -2.859 1.00 0.00 O ATOM 1244 OE2 GLU A 88 14.834 -21.133 -4.300 1.00 0.00 O ATOM 0 H GLU A 88 15.322 -17.953 -7.372 1.00 0.00 H new ATOM 0 HA GLU A 88 13.390 -19.908 -7.638 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.538 -18.565 -5.566 1.00 0.00 H new ATOM 0 HB3 GLU A 88 12.939 -17.848 -5.544 1.00 0.00 H new ATOM 0 HG2 GLU A 88 11.933 -19.791 -4.848 1.00 0.00 H new ATOM 0 HG3 GLU A 88 12.902 -20.793 -5.908 1.00 0.00 H new ATOM 1252 N VAL A 89 11.036 -18.852 -7.710 1.00 0.00 N ATOM 1253 CA VAL A 89 9.755 -18.341 -8.167 1.00 0.00 C ATOM 1254 C VAL A 89 8.995 -17.747 -6.979 1.00 0.00 C ATOM 1255 O VAL A 89 7.875 -17.263 -7.135 1.00 0.00 O ATOM 1256 CB VAL A 89 8.976 -19.446 -8.883 1.00 0.00 C ATOM 1257 CG1 VAL A 89 7.685 -18.899 -9.494 1.00 0.00 C ATOM 1258 CG2 VAL A 89 9.841 -20.125 -9.947 1.00 0.00 C ATOM 0 H VAL A 89 10.988 -19.744 -7.218 1.00 0.00 H new ATOM 0 HA VAL A 89 9.900 -17.541 -8.893 1.00 0.00 H new ATOM 0 HB VAL A 89 8.704 -20.198 -8.142 1.00 0.00 H new ATOM 0 HG11 VAL A 89 7.150 -19.705 -9.997 1.00 0.00 H new ATOM 0 HG12 VAL A 89 7.057 -18.483 -8.706 1.00 0.00 H new ATOM 0 HG13 VAL A 89 7.926 -18.118 -10.215 1.00 0.00 H new ATOM 0 HG21 VAL A 89 9.264 -20.906 -10.441 1.00 0.00 H new ATOM 0 HG22 VAL A 89 10.158 -19.387 -10.684 1.00 0.00 H new ATOM 0 HG23 VAL A 89 10.719 -20.566 -9.475 1.00 0.00 H new ATOM 1268 N SER A 90 9.634 -17.804 -5.820 1.00 0.00 N ATOM 1269 CA SER A 90 9.032 -17.278 -4.607 1.00 0.00 C ATOM 1270 C SER A 90 9.493 -15.837 -4.376 1.00 0.00 C ATOM 1271 O SER A 90 10.456 -15.384 -4.993 1.00 0.00 O ATOM 1272 CB SER A 90 9.381 -18.147 -3.397 1.00 0.00 C ATOM 1273 OG SER A 90 8.541 -19.295 -3.305 1.00 0.00 O ATOM 0 H SER A 90 10.563 -18.207 -5.695 1.00 0.00 H new ATOM 0 HA SER A 90 7.949 -17.291 -4.730 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.422 -18.464 -3.466 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.288 -17.555 -2.486 1.00 0.00 H new ATOM 0 HG SER A 90 8.796 -19.825 -2.521 1.00 0.00 H new ATOM 1279 N LEU A 91 8.784 -15.158 -3.487 1.00 0.00 N ATOM 1280 CA LEU A 91 9.108 -13.778 -3.167 1.00 0.00 C ATOM 1281 C LEU A 91 10.567 -13.694 -2.715 1.00 0.00 C ATOM 1282 O LEU A 91 11.170 -12.622 -2.747 1.00 0.00 O ATOM 1283 CB LEU A 91 8.115 -13.217 -2.148 1.00 0.00 C ATOM 1284 CG LEU A 91 7.084 -12.225 -2.692 1.00 0.00 C ATOM 1285 CD1 LEU A 91 6.188 -11.695 -1.570 1.00 0.00 C ATOM 1286 CD2 LEU A 91 7.767 -11.093 -3.463 1.00 0.00 C ATOM 0 H LEU A 91 7.986 -15.538 -2.978 1.00 0.00 H new ATOM 0 HA LEU A 91 9.011 -13.148 -4.051 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.582 -14.051 -1.692 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.678 -12.727 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 91 6.440 -12.752 -3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.465 -10.992 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.660 -12.526 -1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.800 -11.188 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.013 -10.402 -3.839 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.448 -10.560 -2.800 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.327 -11.509 -4.300 1.00 0.00 H new ATOM 1298 N SER A 92 11.093 -14.838 -2.304 1.00 0.00 N ATOM 1299 CA SER A 92 12.471 -14.907 -1.846 1.00 0.00 C ATOM 1300 C SER A 92 13.424 -14.651 -3.014 1.00 0.00 C ATOM 1301 O SER A 92 14.633 -14.530 -2.819 1.00 0.00 O ATOM 1302 CB SER A 92 12.770 -16.263 -1.203 1.00 0.00 C ATOM 1303 OG SER A 92 12.072 -16.437 0.027 1.00 0.00 O ATOM 0 H SER A 92 10.590 -15.725 -2.278 1.00 0.00 H new ATOM 0 HA SER A 92 12.619 -14.136 -1.090 1.00 0.00 H new ATOM 0 HB2 SER A 92 12.493 -17.060 -1.893 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.842 -16.352 -1.027 1.00 0.00 H new ATOM 0 HG SER A 92 12.288 -17.315 0.404 1.00 0.00 H new ATOM 1309 N SER A 93 12.845 -14.576 -4.204 1.00 0.00 N ATOM 1310 CA SER A 93 13.629 -14.337 -5.404 1.00 0.00 C ATOM 1311 C SER A 93 13.596 -12.850 -5.762 1.00 0.00 C ATOM 1312 O SER A 93 14.427 -12.376 -6.535 1.00 0.00 O ATOM 1313 CB SER A 93 13.113 -15.176 -6.575 1.00 0.00 C ATOM 1314 OG SER A 93 14.175 -15.668 -7.388 1.00 0.00 O ATOM 0 H SER A 93 11.842 -14.677 -4.363 1.00 0.00 H new ATOM 0 HA SER A 93 14.659 -14.634 -5.205 1.00 0.00 H new ATOM 0 HB2 SER A 93 12.531 -16.014 -6.192 1.00 0.00 H new ATOM 0 HB3 SER A 93 12.440 -14.573 -7.184 1.00 0.00 H new ATOM 0 HG SER A 93 14.316 -15.061 -8.145 1.00 0.00 H new ATOM 1320 N LEU A 94 12.628 -12.156 -5.183 1.00 0.00 N ATOM 1321 CA LEU A 94 12.476 -10.732 -5.432 1.00 0.00 C ATOM 1322 C LEU A 94 13.396 -9.953 -4.489 1.00 0.00 C ATOM 1323 O LEU A 94 14.117 -10.547 -3.689 1.00 0.00 O ATOM 1324 CB LEU A 94 11.005 -10.324 -5.331 1.00 0.00 C ATOM 1325 CG LEU A 94 10.194 -10.411 -6.626 1.00 0.00 C ATOM 1326 CD1 LEU A 94 8.823 -9.754 -6.459 1.00 0.00 C ATOM 1327 CD2 LEU A 94 10.975 -9.820 -7.802 1.00 0.00 C ATOM 0 H LEU A 94 11.941 -12.553 -4.542 1.00 0.00 H new ATOM 0 HA LEU A 94 12.781 -10.489 -6.450 1.00 0.00 H new ATOM 0 HB2 LEU A 94 10.525 -10.953 -4.582 1.00 0.00 H new ATOM 0 HB3 LEU A 94 10.957 -9.299 -4.964 1.00 0.00 H new ATOM 0 HG LEU A 94 10.021 -11.463 -6.851 1.00 0.00 H new ATOM 0 HD11 LEU A 94 8.267 -9.830 -7.394 1.00 0.00 H new ATOM 0 HD12 LEU A 94 8.271 -10.260 -5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 94 8.952 -8.704 -6.198 1.00 0.00 H new ATOM 0 HD21 LEU A 94 10.377 -9.894 -8.710 1.00 0.00 H new ATOM 0 HD22 LEU A 94 11.200 -8.773 -7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 94 11.906 -10.372 -7.935 1.00 0.00 H new ATOM 1339 N SER A 95 13.340 -8.636 -4.615 1.00 0.00 N ATOM 1340 CA SER A 95 14.159 -7.769 -3.784 1.00 0.00 C ATOM 1341 C SER A 95 15.617 -7.827 -4.246 1.00 0.00 C ATOM 1342 O SER A 95 16.503 -7.285 -3.586 1.00 0.00 O ATOM 1343 CB SER A 95 14.054 -8.161 -2.309 1.00 0.00 C ATOM 1344 OG SER A 95 15.075 -9.078 -1.926 1.00 0.00 O ATOM 0 H SER A 95 12.740 -8.147 -5.280 1.00 0.00 H new ATOM 0 HA SER A 95 13.792 -6.748 -3.888 1.00 0.00 H new ATOM 0 HB2 SER A 95 14.120 -7.266 -1.691 1.00 0.00 H new ATOM 0 HB3 SER A 95 13.077 -8.607 -2.121 1.00 0.00 H new ATOM 0 HG SER A 95 14.924 -9.939 -2.368 1.00 0.00 H new ATOM 1350 N LEU A 96 15.821 -8.489 -5.376 1.00 0.00 N ATOM 1351 CA LEU A 96 17.155 -8.624 -5.933 1.00 0.00 C ATOM 1352 C LEU A 96 17.255 -7.792 -7.214 1.00 0.00 C ATOM 1353 O LEU A 96 16.408 -6.938 -7.471 1.00 0.00 O ATOM 1354 CB LEU A 96 17.507 -10.100 -6.130 1.00 0.00 C ATOM 1355 CG LEU A 96 16.721 -11.096 -5.275 1.00 0.00 C ATOM 1356 CD1 LEU A 96 16.909 -12.526 -5.787 1.00 0.00 C ATOM 1357 CD2 LEU A 96 17.092 -10.963 -3.797 1.00 0.00 C ATOM 0 H LEU A 96 15.084 -8.937 -5.920 1.00 0.00 H new ATOM 0 HA LEU A 96 17.899 -8.233 -5.239 1.00 0.00 H new ATOM 0 HB2 LEU A 96 17.355 -10.353 -7.179 1.00 0.00 H new ATOM 0 HB3 LEU A 96 18.569 -10.231 -5.921 1.00 0.00 H new ATOM 0 HG LEU A 96 15.661 -10.859 -5.363 1.00 0.00 H new ATOM 0 HD11 LEU A 96 16.340 -13.214 -5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 96 16.555 -12.594 -6.816 1.00 0.00 H new ATOM 0 HD13 LEU A 96 17.966 -12.790 -5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 96 16.519 -11.682 -3.212 1.00 0.00 H new ATOM 0 HD22 LEU A 96 18.157 -11.158 -3.670 1.00 0.00 H new ATOM 0 HD23 LEU A 96 16.865 -9.954 -3.454 1.00 0.00 H new ATOM 1369 N ALA A 97 18.298 -8.070 -7.982 1.00 0.00 N ATOM 1370 CA ALA A 97 18.520 -7.358 -9.229 1.00 0.00 C ATOM 1371 C ALA A 97 18.157 -8.270 -10.403 1.00 0.00 C ATOM 1372 O ALA A 97 18.998 -8.559 -11.253 1.00 0.00 O ATOM 1373 CB ALA A 97 19.971 -6.877 -9.292 1.00 0.00 C ATOM 0 H ALA A 97 18.999 -8.779 -7.765 1.00 0.00 H new ATOM 0 HA ALA A 97 17.882 -6.476 -9.286 1.00 0.00 H new ATOM 0 HB1 ALA A 97 20.137 -6.343 -10.228 1.00 0.00 H new ATOM 0 HB2 ALA A 97 20.170 -6.210 -8.453 1.00 0.00 H new ATOM 0 HB3 ALA A 97 20.641 -7.735 -9.240 1.00 0.00 H new ATOM 1379 N VAL A 98 16.903 -8.697 -10.413 1.00 0.00 N ATOM 1380 CA VAL A 98 16.418 -9.570 -11.469 1.00 0.00 C ATOM 1381 C VAL A 98 16.540 -8.852 -12.815 1.00 0.00 C ATOM 1382 O VAL A 98 16.465 -7.626 -12.877 1.00 0.00 O ATOM 1383 CB VAL A 98 14.989 -10.022 -11.160 1.00 0.00 C ATOM 1384 CG1 VAL A 98 14.904 -10.660 -9.772 1.00 0.00 C ATOM 1385 CG2 VAL A 98 14.006 -8.857 -11.290 1.00 0.00 C ATOM 0 H VAL A 98 16.208 -8.455 -9.707 1.00 0.00 H new ATOM 0 HA VAL A 98 17.025 -10.473 -11.526 1.00 0.00 H new ATOM 0 HB VAL A 98 14.710 -10.779 -11.893 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.878 -10.972 -9.577 1.00 0.00 H new ATOM 0 HG12 VAL A 98 15.562 -11.528 -9.730 1.00 0.00 H new ATOM 0 HG13 VAL A 98 15.212 -9.935 -9.019 1.00 0.00 H new ATOM 0 HG21 VAL A 98 12.998 -9.205 -11.065 1.00 0.00 H new ATOM 0 HG22 VAL A 98 14.282 -8.068 -10.590 1.00 0.00 H new ATOM 0 HG23 VAL A 98 14.037 -8.467 -12.307 1.00 0.00 H new ATOM 1395 N PRO A 99 16.731 -9.668 -13.886 1.00 0.00 N ATOM 1396 CA PRO A 99 16.864 -9.123 -15.227 1.00 0.00 C ATOM 1397 C PRO A 99 15.509 -8.668 -15.771 1.00 0.00 C ATOM 1398 O PRO A 99 14.477 -8.885 -15.137 1.00 0.00 O ATOM 1399 CB PRO A 99 17.488 -10.242 -16.045 1.00 0.00 C ATOM 1400 CG PRO A 99 17.253 -11.518 -15.254 1.00 0.00 C ATOM 1401 CD PRO A 99 16.825 -11.124 -13.850 1.00 0.00 C ATOM 0 HA PRO A 99 17.487 -8.229 -15.259 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.031 -10.305 -17.033 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.553 -10.067 -16.197 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.484 -12.126 -15.731 1.00 0.00 H new ATOM 0 HG3 PRO A 99 18.161 -12.120 -15.221 1.00 0.00 H new ATOM 0 HD2 PRO A 99 15.869 -11.576 -13.586 1.00 0.00 H new ATOM 0 HD3 PRO A 99 17.550 -11.456 -13.107 1.00 0.00 H new ATOM 1409 N PRO A 100 15.556 -8.029 -16.970 1.00 0.00 N ATOM 1410 CA PRO A 100 14.345 -7.542 -17.607 1.00 0.00 C ATOM 1411 C PRO A 100 13.542 -8.694 -18.214 1.00 0.00 C ATOM 1412 O PRO A 100 14.117 -9.647 -18.739 1.00 0.00 O ATOM 1413 CB PRO A 100 14.822 -6.539 -18.645 1.00 0.00 C ATOM 1414 CG PRO A 100 16.294 -6.843 -18.872 1.00 0.00 C ATOM 1415 CD PRO A 100 16.760 -7.755 -17.749 1.00 0.00 C ATOM 0 HA PRO A 100 13.660 -7.071 -16.902 1.00 0.00 H new ATOM 0 HB2 PRO A 100 14.256 -6.636 -19.571 1.00 0.00 H new ATOM 0 HB3 PRO A 100 14.684 -5.517 -18.293 1.00 0.00 H new ATOM 0 HG2 PRO A 100 16.440 -7.324 -19.839 1.00 0.00 H new ATOM 0 HG3 PRO A 100 16.877 -5.922 -18.883 1.00 0.00 H new ATOM 0 HD2 PRO A 100 17.196 -8.674 -18.140 1.00 0.00 H new ATOM 0 HD3 PRO A 100 17.525 -7.274 -17.140 1.00 0.00 H new ATOM 1423 N PRO A 101 12.192 -8.567 -18.120 1.00 0.00 N ATOM 1424 CA PRO A 101 11.304 -9.586 -18.653 1.00 0.00 C ATOM 1425 C PRO A 101 11.240 -9.512 -20.180 1.00 0.00 C ATOM 1426 O PRO A 101 12.085 -8.879 -20.811 1.00 0.00 O ATOM 1427 CB PRO A 101 9.962 -9.327 -17.989 1.00 0.00 C ATOM 1428 CG PRO A 101 10.024 -7.900 -17.468 1.00 0.00 C ATOM 1429 CD PRO A 101 11.476 -7.452 -17.505 1.00 0.00 C ATOM 0 HA PRO A 101 11.649 -10.598 -18.440 1.00 0.00 H new ATOM 0 HB2 PRO A 101 9.145 -9.448 -18.700 1.00 0.00 H new ATOM 0 HB3 PRO A 101 9.785 -10.032 -17.177 1.00 0.00 H new ATOM 0 HG2 PRO A 101 9.406 -7.243 -18.080 1.00 0.00 H new ATOM 0 HG3 PRO A 101 9.634 -7.848 -16.451 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.594 -6.537 -18.086 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.852 -7.244 -16.503 1.00 0.00 H new ATOM 1437 N ARG A 102 10.228 -10.169 -20.730 1.00 0.00 N ATOM 1438 CA ARG A 102 10.042 -10.185 -22.171 1.00 0.00 C ATOM 1439 C ARG A 102 8.975 -9.168 -22.580 1.00 0.00 C ATOM 1440 O ARG A 102 9.035 -8.605 -23.672 1.00 0.00 O ATOM 1441 CB ARG A 102 9.625 -11.575 -22.656 1.00 0.00 C ATOM 1442 CG ARG A 102 10.320 -11.928 -23.973 1.00 0.00 C ATOM 1443 CD ARG A 102 11.800 -12.241 -23.744 1.00 0.00 C ATOM 1444 NE ARG A 102 12.504 -12.338 -25.043 1.00 0.00 N ATOM 1445 CZ ARG A 102 13.705 -12.931 -25.211 1.00 0.00 C ATOM 1446 NH1 ARG A 102 14.348 -13.485 -24.161 1.00 0.00 N ATOM 1447 NH2 ARG A 102 14.241 -12.960 -26.416 1.00 0.00 N ATOM 0 H ARG A 102 9.529 -10.693 -20.204 1.00 0.00 H new ATOM 0 HA ARG A 102 10.994 -9.922 -22.632 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.874 -12.318 -21.899 1.00 0.00 H new ATOM 0 HB3 ARG A 102 8.544 -11.608 -22.791 1.00 0.00 H new ATOM 0 HG2 ARG A 102 9.829 -12.788 -24.429 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.224 -11.098 -24.673 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.254 -11.462 -23.132 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.902 -13.177 -23.195 1.00 0.00 H new ATOM 0 HE ARG A 102 12.053 -11.931 -25.862 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.927 -13.457 -23.233 1.00 0.00 H new ATOM 0 HH12 ARG A 102 15.255 -13.931 -24.296 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.749 -12.538 -27.203 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.148 -13.404 -26.560 1.00 0.00 H new ATOM 1460 N PHE A 103 8.024 -8.962 -21.682 1.00 0.00 N ATOM 1461 CA PHE A 103 6.945 -8.023 -21.936 1.00 0.00 C ATOM 1462 C PHE A 103 7.462 -6.775 -22.655 1.00 0.00 C ATOM 1463 O PHE A 103 8.661 -6.499 -22.641 1.00 0.00 O ATOM 1464 CB PHE A 103 6.378 -7.614 -20.575 1.00 0.00 C ATOM 1465 CG PHE A 103 6.136 -8.788 -19.624 1.00 0.00 C ATOM 1466 CD1 PHE A 103 5.191 -9.720 -19.920 1.00 0.00 C ATOM 1467 CD2 PHE A 103 6.866 -8.899 -18.481 1.00 0.00 C ATOM 1468 CE1 PHE A 103 4.966 -10.810 -19.038 1.00 0.00 C ATOM 1469 CE2 PHE A 103 6.641 -9.989 -17.599 1.00 0.00 C ATOM 1470 CZ PHE A 103 5.696 -10.921 -17.896 1.00 0.00 C ATOM 0 H PHE A 103 7.978 -9.430 -20.777 1.00 0.00 H new ATOM 0 HA PHE A 103 6.189 -8.488 -22.569 1.00 0.00 H new ATOM 0 HB2 PHE A 103 7.065 -6.912 -20.102 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.438 -7.084 -20.729 1.00 0.00 H new ATOM 0 HD1 PHE A 103 4.611 -9.631 -20.827 1.00 0.00 H new ATOM 0 HD2 PHE A 103 7.616 -8.159 -18.245 1.00 0.00 H new ATOM 0 HE1 PHE A 103 4.216 -11.550 -19.274 1.00 0.00 H new ATOM 0 HE2 PHE A 103 7.221 -10.078 -16.692 1.00 0.00 H new ATOM 0 HZ PHE A 103 5.525 -11.750 -17.225 1.00 0.00 H new ATOM 1480 N HIS A 104 6.533 -6.055 -23.265 1.00 0.00 N ATOM 1481 CA HIS A 104 6.880 -4.843 -23.988 1.00 0.00 C ATOM 1482 C HIS A 104 7.385 -3.785 -23.004 1.00 0.00 C ATOM 1483 O HIS A 104 7.250 -3.945 -21.792 1.00 0.00 O ATOM 1484 CB HIS A 104 5.699 -4.355 -24.829 1.00 0.00 C ATOM 1485 CG HIS A 104 5.753 -4.791 -26.274 1.00 0.00 C ATOM 1486 ND1 HIS A 104 5.577 -3.912 -27.329 1.00 0.00 N ATOM 1487 CD2 HIS A 104 5.965 -6.019 -26.827 1.00 0.00 C ATOM 1488 CE1 HIS A 104 5.680 -4.593 -28.461 1.00 0.00 C ATOM 1489 NE2 HIS A 104 5.920 -5.898 -28.148 1.00 0.00 N ATOM 0 H HIS A 104 5.540 -6.287 -23.274 1.00 0.00 H new ATOM 0 HA HIS A 104 7.688 -5.052 -24.689 1.00 0.00 H new ATOM 0 HB2 HIS A 104 4.774 -4.721 -24.384 1.00 0.00 H new ATOM 0 HB3 HIS A 104 5.663 -3.266 -24.790 1.00 0.00 H new ATOM 0 HD2 HIS A 104 6.140 -6.935 -26.282 1.00 0.00 H new ATOM 0 HE1 HIS A 104 5.590 -4.186 -29.457 1.00 0.00 H new ATOM 0 HE2 HIS A 104 6.044 -6.656 -28.819 1.00 0.00 H new ATOM 1497 N ASP A 105 7.956 -2.728 -23.563 1.00 0.00 N ATOM 1498 CA ASP A 105 8.481 -1.644 -22.750 1.00 0.00 C ATOM 1499 C ASP A 105 8.860 -0.471 -23.656 1.00 0.00 C ATOM 1500 O ASP A 105 8.180 0.554 -23.666 1.00 0.00 O ATOM 1501 CB ASP A 105 9.737 -2.082 -21.993 1.00 0.00 C ATOM 1502 CG ASP A 105 9.684 -1.875 -20.478 1.00 0.00 C ATOM 1503 OD1 ASP A 105 8.710 -1.327 -19.942 1.00 0.00 O ATOM 1504 OD2 ASP A 105 10.713 -2.310 -19.833 1.00 0.00 O ATOM 0 H ASP A 105 8.067 -2.599 -24.569 1.00 0.00 H new ATOM 0 HA ASP A 105 7.711 -1.355 -22.035 1.00 0.00 H new ATOM 0 HB2 ASP A 105 9.914 -3.138 -22.194 1.00 0.00 H new ATOM 0 HB3 ASP A 105 10.592 -1.534 -22.390 1.00 0.00 H new TER 1510 ASP A 105