USER MOD reduce.3.24.130724 H: found=0, std=0, add=849, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 850 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 104 ASN : amide:sc= 0 K(o=0.92,f=-2.6) USER MOD Set 1.2: A 106 LYS NZ :NH3+ -159:sc= 0.918 (180deg=0.664) USER MOD Set 2.1: A 63 THR OG1 : rot 180:sc= -0.0143 USER MOD Set 2.2: A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.371 K(o=0.37,f=-4.6!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 71:sc= 0.363 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 171:sc= 0.442 (180deg=0.401) USER MOD Single : A 28 LYS NZ :NH3+ -150:sc= 1.15 (180deg=-0.0975!) USER MOD Single : A 29 THR OG1 : rot 180:sc=-0.00209 USER MOD Single : A 33 GLN : amide:sc= -0.49 K(o=-0.49,f=-1) USER MOD Single : A 37 SER OG : rot 180:sc= -0.182 USER MOD Single : A 38 GLN : amide:sc= 0.713 K(o=0.71,f=-0.015) USER MOD Single : A 39 GLN : amide:sc=-0.00906 X(o=-0.0091,f=0) USER MOD Single : A 40 GLN : amide:sc= 0.599 K(o=0.6,f=-2.9!) USER MOD Single : A 43 GLN : amide:sc= 0.334 X(o=0.33,f=-0.055) USER MOD Single : A 44 LYS NZ :NH3+ -122:sc= 0.977 (180deg=-0.382) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0.109 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -90:sc= 0.843 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 GLN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 69 GLN : amide:sc= 0.707 K(o=0.71,f=-2.2) USER MOD Single : A 72 LYS NZ :NH3+ -133:sc= 1.23 (180deg=0.252) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.0427 USER MOD Single : A 84 ASN : amide:sc= -0.065 X(o=-0.065,f=-0.065) USER MOD Single : A 85 ASN : amide:sc= 0.781 K(o=0.78,f=-5.5!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -159:sc= 0.384 (180deg=0.187) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 HIS : no HD1:sc=-0.00764 X(o=-0.0076,f=-0.11) USER MOD Single : A 114 HIS : no HD1:sc= -0.483 K(o=-0.48,f=-8.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 13 -5.105 -16.766 2.665 1.00 0.00 N ATOM 2 CA GLU A 13 -3.654 -17.022 2.691 1.00 0.00 C ATOM 3 C GLU A 13 -2.939 -15.996 3.561 1.00 0.00 C ATOM 4 O GLU A 13 -3.196 -14.804 3.352 1.00 0.00 O ATOM 5 CB GLU A 13 -3.158 -16.944 1.246 1.00 0.00 C ATOM 6 CG GLU A 13 -1.651 -16.845 1.031 1.00 0.00 C ATOM 7 CD GLU A 13 -1.069 -17.200 -0.334 1.00 0.00 C ATOM 8 OE1 GLU A 13 -1.670 -16.679 -1.285 1.00 0.00 O ATOM 9 OE2 GLU A 13 -0.035 -17.889 -0.480 1.00 0.00 O ATOM 0 HA GLU A 13 -3.445 -18.003 3.118 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.517 -17.827 0.717 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.624 -16.079 0.775 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.354 -15.821 1.258 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.171 -17.488 1.769 1.00 0.00 H new ATOM 18 N ASN A 14 -2.179 -16.294 4.607 1.00 0.00 N ATOM 19 CA ASN A 14 -1.523 -15.318 5.464 1.00 0.00 C ATOM 20 C ASN A 14 -0.205 -14.834 4.889 1.00 0.00 C ATOM 21 O ASN A 14 0.561 -15.479 4.158 1.00 0.00 O ATOM 22 CB ASN A 14 -1.289 -16.003 6.797 1.00 0.00 C ATOM 23 CG ASN A 14 -1.051 -15.139 8.036 1.00 0.00 C ATOM 24 OD1 ASN A 14 0.005 -14.525 8.154 1.00 0.00 O ATOM 25 ND2 ASN A 14 -1.924 -15.157 9.042 1.00 0.00 N ATOM 0 H ASN A 14 -1.997 -17.257 4.891 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.153 -14.434 5.562 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -2.152 -16.638 6.998 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -0.428 -16.662 6.683 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.714 -14.661 9.908 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.802 -15.667 8.946 1.00 0.00 H new ATOM 32 N ALA A 15 0.146 -13.600 5.248 1.00 0.00 N ATOM 33 CA ALA A 15 1.303 -12.935 4.711 1.00 0.00 C ATOM 34 C ALA A 15 2.487 -12.632 5.626 1.00 0.00 C ATOM 35 O ALA A 15 3.465 -11.974 5.252 1.00 0.00 O ATOM 36 CB ALA A 15 0.870 -11.632 4.039 1.00 0.00 C ATOM 0 H ALA A 15 -0.375 -13.042 5.924 1.00 0.00 H new ATOM 0 HA ALA A 15 1.702 -13.687 4.030 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.744 -11.125 3.631 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.170 -11.853 3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.387 -10.987 4.773 1.00 0.00 H new ATOM 42 N GLU A 16 2.385 -13.113 6.872 1.00 0.00 N ATOM 43 CA GLU A 16 3.321 -12.908 7.961 1.00 0.00 C ATOM 44 C GLU A 16 4.553 -13.768 8.064 1.00 0.00 C ATOM 45 O GLU A 16 5.391 -13.624 8.948 1.00 0.00 O ATOM 46 CB GLU A 16 2.573 -12.962 9.292 1.00 0.00 C ATOM 47 CG GLU A 16 1.436 -11.938 9.354 1.00 0.00 C ATOM 48 CD GLU A 16 1.881 -10.508 9.606 1.00 0.00 C ATOM 49 OE1 GLU A 16 2.147 -10.163 10.772 1.00 0.00 O ATOM 50 OE2 GLU A 16 2.050 -9.669 8.705 1.00 0.00 O ATOM 0 H GLU A 16 1.593 -13.691 7.154 1.00 0.00 H new ATOM 0 HA GLU A 16 3.735 -11.930 7.714 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.168 -13.963 9.439 1.00 0.00 H new ATOM 0 HB3 GLU A 16 3.272 -12.778 10.108 1.00 0.00 H new ATOM 0 HG2 GLU A 16 0.884 -11.972 8.415 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.743 -12.232 10.142 1.00 0.00 H new ATOM 57 N LEU A 17 4.650 -14.666 7.066 1.00 0.00 N ATOM 58 CA LEU A 17 5.569 -15.761 6.843 1.00 0.00 C ATOM 59 C LEU A 17 6.925 -15.246 6.374 1.00 0.00 C ATOM 60 O LEU A 17 7.926 -15.942 6.519 1.00 0.00 O ATOM 61 CB LEU A 17 4.927 -16.690 5.812 1.00 0.00 C ATOM 62 CG LEU A 17 3.564 -17.280 6.193 1.00 0.00 C ATOM 63 CD1 LEU A 17 3.220 -18.522 5.365 1.00 0.00 C ATOM 64 CD2 LEU A 17 3.518 -17.687 7.657 1.00 0.00 C ATOM 0 H LEU A 17 3.982 -14.618 6.297 1.00 0.00 H new ATOM 0 HA LEU A 17 5.754 -16.306 7.769 1.00 0.00 H new ATOM 0 HB2 LEU A 17 4.814 -16.140 4.878 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.615 -17.513 5.616 1.00 0.00 H new ATOM 0 HG LEU A 17 2.841 -16.489 5.995 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.246 -18.905 5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.191 -18.258 4.308 1.00 0.00 H new ATOM 0 HD13 LEU A 17 3.978 -19.289 5.527 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.537 -18.101 7.889 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.283 -18.439 7.850 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.701 -16.814 8.283 1.00 0.00 H new ATOM 76 N GLU A 18 6.907 -14.117 5.649 1.00 0.00 N ATOM 77 CA GLU A 18 7.802 -13.769 4.569 1.00 0.00 C ATOM 78 C GLU A 18 8.474 -12.413 4.643 1.00 0.00 C ATOM 79 O GLU A 18 9.111 -11.910 3.719 1.00 0.00 O ATOM 80 CB GLU A 18 7.149 -13.966 3.204 1.00 0.00 C ATOM 81 CG GLU A 18 5.914 -13.122 2.876 1.00 0.00 C ATOM 82 CD GLU A 18 5.425 -13.252 1.451 1.00 0.00 C ATOM 83 OE1 GLU A 18 5.442 -14.359 0.875 1.00 0.00 O ATOM 84 OE2 GLU A 18 4.896 -12.310 0.814 1.00 0.00 O ATOM 0 H GLU A 18 6.218 -13.386 5.824 1.00 0.00 H new ATOM 0 HA GLU A 18 8.618 -14.479 4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.902 -13.769 2.441 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.871 -15.016 3.114 1.00 0.00 H new ATOM 0 HG2 GLU A 18 5.106 -13.405 3.551 1.00 0.00 H new ATOM 0 HG3 GLU A 18 6.142 -12.075 3.074 1.00 0.00 H new ATOM 91 N ILE A 19 8.269 -11.828 5.830 1.00 0.00 N ATOM 92 CA ILE A 19 8.541 -10.473 6.265 1.00 0.00 C ATOM 93 C ILE A 19 9.726 -10.426 7.221 1.00 0.00 C ATOM 94 O ILE A 19 10.150 -11.446 7.746 1.00 0.00 O ATOM 95 CB ILE A 19 7.265 -9.962 6.936 1.00 0.00 C ATOM 96 CG1 ILE A 19 6.851 -10.706 8.193 1.00 0.00 C ATOM 97 CG2 ILE A 19 6.113 -9.806 5.953 1.00 0.00 C ATOM 98 CD1 ILE A 19 5.821 -10.029 9.086 1.00 0.00 C ATOM 0 H ILE A 19 7.859 -12.368 6.592 1.00 0.00 H new ATOM 0 HA ILE A 19 8.811 -9.842 5.418 1.00 0.00 H new ATOM 0 HB ILE A 19 7.534 -8.967 7.290 1.00 0.00 H new ATOM 0 HG12 ILE A 19 6.457 -11.678 7.897 1.00 0.00 H new ATOM 0 HG13 ILE A 19 7.746 -10.892 8.787 1.00 0.00 H new ATOM 0 HG21 ILE A 19 5.232 -9.441 6.480 1.00 0.00 H new ATOM 0 HG22 ILE A 19 6.392 -9.094 5.176 1.00 0.00 H new ATOM 0 HG23 ILE A 19 5.890 -10.771 5.498 1.00 0.00 H new ATOM 0 HD11 ILE A 19 5.613 -10.664 9.948 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.210 -9.070 9.427 1.00 0.00 H new ATOM 0 HD13 ILE A 19 4.901 -9.868 8.524 1.00 0.00 H new ATOM 110 N VAL A 20 10.298 -9.266 7.537 1.00 0.00 N ATOM 111 CA VAL A 20 11.091 -9.204 8.759 1.00 0.00 C ATOM 112 C VAL A 20 10.202 -9.105 9.987 1.00 0.00 C ATOM 113 O VAL A 20 8.986 -8.896 9.901 1.00 0.00 O ATOM 114 CB VAL A 20 11.998 -7.988 8.700 1.00 0.00 C ATOM 115 CG1 VAL A 20 12.988 -8.011 7.534 1.00 0.00 C ATOM 116 CG2 VAL A 20 11.405 -6.580 8.658 1.00 0.00 C ATOM 0 H VAL A 20 10.234 -8.402 6.998 1.00 0.00 H new ATOM 0 HA VAL A 20 11.681 -10.118 8.835 1.00 0.00 H new ATOM 0 HB VAL A 20 12.442 -8.126 9.686 1.00 0.00 H new ATOM 0 HG11 VAL A 20 13.601 -7.110 7.559 1.00 0.00 H new ATOM 0 HG12 VAL A 20 13.629 -8.888 7.618 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.440 -8.051 6.592 1.00 0.00 H new ATOM 0 HG21 VAL A 20 12.211 -5.847 8.618 1.00 0.00 H new ATOM 0 HG22 VAL A 20 10.776 -6.476 7.774 1.00 0.00 H new ATOM 0 HG23 VAL A 20 10.805 -6.411 9.552 1.00 0.00 H new ATOM 126 N THR A 21 10.762 -9.197 11.203 1.00 0.00 N ATOM 127 CA THR A 21 10.287 -8.940 12.538 1.00 0.00 C ATOM 128 C THR A 21 9.490 -7.647 12.551 1.00 0.00 C ATOM 129 O THR A 21 8.264 -7.661 12.548 1.00 0.00 O ATOM 130 CB THR A 21 11.349 -9.072 13.640 1.00 0.00 C ATOM 131 OG1 THR A 21 11.839 -10.384 13.511 1.00 0.00 O ATOM 132 CG2 THR A 21 10.809 -8.749 15.030 1.00 0.00 C ATOM 0 H THR A 21 11.731 -9.511 11.256 1.00 0.00 H new ATOM 0 HA THR A 21 9.606 -9.745 12.814 1.00 0.00 H new ATOM 0 HB THR A 21 12.150 -8.342 13.523 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.530 -10.543 14.188 1.00 0.00 H new ATOM 0 HG21 THR A 21 11.606 -8.860 15.765 1.00 0.00 H new ATOM 0 HG22 THR A 21 10.440 -7.724 15.048 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.995 -9.432 15.272 1.00 0.00 H new ATOM 140 N ASP A 22 10.175 -6.507 12.664 1.00 0.00 N ATOM 141 CA ASP A 22 9.663 -5.181 12.960 1.00 0.00 C ATOM 142 C ASP A 22 9.302 -4.320 11.769 1.00 0.00 C ATOM 143 O ASP A 22 9.713 -3.152 11.721 1.00 0.00 O ATOM 144 CB ASP A 22 10.623 -4.609 13.996 1.00 0.00 C ATOM 145 CG ASP A 22 10.135 -3.386 14.767 1.00 0.00 C ATOM 146 OD1 ASP A 22 9.013 -3.501 15.317 1.00 0.00 O ATOM 147 OD2 ASP A 22 10.856 -2.380 14.915 1.00 0.00 O ATOM 0 H ASP A 22 11.187 -6.495 12.539 1.00 0.00 H new ATOM 0 HA ASP A 22 8.658 -5.223 13.380 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.859 -5.394 14.714 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.554 -4.347 13.492 1.00 0.00 H new ATOM 152 N TYR A 23 8.626 -4.856 10.751 1.00 0.00 N ATOM 153 CA TYR A 23 8.302 -4.215 9.486 1.00 0.00 C ATOM 154 C TYR A 23 7.200 -3.225 9.828 1.00 0.00 C ATOM 155 O TYR A 23 6.186 -3.492 10.455 1.00 0.00 O ATOM 156 CB TYR A 23 7.681 -5.214 8.515 1.00 0.00 C ATOM 157 CG TYR A 23 7.619 -4.520 7.173 1.00 0.00 C ATOM 158 CD1 TYR A 23 8.656 -4.598 6.221 1.00 0.00 C ATOM 159 CD2 TYR A 23 6.359 -4.085 6.772 1.00 0.00 C ATOM 160 CE1 TYR A 23 8.440 -4.078 4.946 1.00 0.00 C ATOM 161 CE2 TYR A 23 6.124 -3.529 5.507 1.00 0.00 C ATOM 162 CZ TYR A 23 7.244 -3.399 4.646 1.00 0.00 C ATOM 163 OH TYR A 23 6.969 -2.873 3.435 1.00 0.00 O ATOM 0 H TYR A 23 8.270 -5.811 10.796 1.00 0.00 H new ATOM 0 HA TYR A 23 9.194 -3.779 9.037 1.00 0.00 H new ATOM 0 HB2 TYR A 23 8.281 -6.122 8.456 1.00 0.00 H new ATOM 0 HB3 TYR A 23 6.686 -5.510 8.846 1.00 0.00 H new ATOM 0 HD1 TYR A 23 9.602 -5.053 6.475 1.00 0.00 H new ATOM 0 HD2 TYR A 23 5.532 -4.179 7.461 1.00 0.00 H new ATOM 0 HE1 TYR A 23 9.195 -4.197 4.183 1.00 0.00 H new ATOM 0 HE2 TYR A 23 5.137 -3.214 5.202 1.00 0.00 H new ATOM 0 HH TYR A 23 6.807 -3.596 2.794 1.00 0.00 H new ATOM 173 N TYR A 24 7.280 -2.006 9.276 1.00 0.00 N ATOM 174 CA TYR A 24 6.494 -0.846 9.676 1.00 0.00 C ATOM 175 C TYR A 24 5.033 -0.956 9.296 1.00 0.00 C ATOM 176 O TYR A 24 4.677 -1.818 8.501 1.00 0.00 O ATOM 177 CB TYR A 24 7.132 0.427 9.168 1.00 0.00 C ATOM 178 CG TYR A 24 6.873 0.925 7.767 1.00 0.00 C ATOM 179 CD1 TYR A 24 7.086 0.097 6.645 1.00 0.00 C ATOM 180 CD2 TYR A 24 6.560 2.256 7.500 1.00 0.00 C ATOM 181 CE1 TYR A 24 6.907 0.584 5.347 1.00 0.00 C ATOM 182 CE2 TYR A 24 6.331 2.773 6.223 1.00 0.00 C ATOM 183 CZ TYR A 24 6.449 1.900 5.120 1.00 0.00 C ATOM 184 OH TYR A 24 6.102 2.350 3.889 1.00 0.00 O ATOM 0 H TYR A 24 7.921 -1.800 8.510 1.00 0.00 H new ATOM 0 HA TYR A 24 6.499 -0.812 10.765 1.00 0.00 H new ATOM 0 HB2 TYR A 24 6.837 1.225 9.849 1.00 0.00 H new ATOM 0 HB3 TYR A 24 8.210 0.305 9.268 1.00 0.00 H new ATOM 0 HD1 TYR A 24 7.392 -0.928 6.791 1.00 0.00 H new ATOM 0 HD2 TYR A 24 6.490 2.934 8.338 1.00 0.00 H new ATOM 0 HE1 TYR A 24 7.122 -0.057 4.505 1.00 0.00 H new ATOM 0 HE2 TYR A 24 6.071 3.812 6.083 1.00 0.00 H new ATOM 0 HH TYR A 24 5.813 3.284 3.952 1.00 0.00 H new ATOM 194 N LYS A 25 4.130 -0.223 9.962 1.00 0.00 N ATOM 195 CA LYS A 25 2.765 -0.594 10.282 1.00 0.00 C ATOM 196 C LYS A 25 1.780 0.562 10.149 1.00 0.00 C ATOM 197 O LYS A 25 0.707 0.597 10.741 1.00 0.00 O ATOM 198 CB LYS A 25 2.766 -1.081 11.730 1.00 0.00 C ATOM 199 CG LYS A 25 3.695 -2.287 11.874 1.00 0.00 C ATOM 200 CD LYS A 25 3.280 -3.075 13.123 1.00 0.00 C ATOM 201 CE LYS A 25 3.892 -4.448 13.249 1.00 0.00 C ATOM 202 NZ LYS A 25 5.366 -4.379 13.279 1.00 0.00 N ATOM 0 H LYS A 25 4.361 0.707 10.311 1.00 0.00 H new ATOM 0 HA LYS A 25 2.439 -1.359 9.578 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.092 -0.279 12.392 1.00 0.00 H new ATOM 0 HB3 LYS A 25 1.754 -1.352 12.032 1.00 0.00 H new ATOM 0 HG2 LYS A 25 3.634 -2.920 10.989 1.00 0.00 H new ATOM 0 HG3 LYS A 25 4.731 -1.959 11.960 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.547 -2.493 14.005 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.195 -3.177 13.125 1.00 0.00 H new ATOM 0 HE2 LYS A 25 3.530 -4.927 14.158 1.00 0.00 H new ATOM 0 HE3 LYS A 25 3.572 -5.069 12.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 5.753 -5.314 13.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 5.719 -4.087 12.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 5.667 -3.687 13.995 1.00 0.00 H new ATOM 216 N ILE A 26 2.109 1.690 9.515 1.00 0.00 N ATOM 217 CA ILE A 26 1.291 2.861 9.311 1.00 0.00 C ATOM 218 C ILE A 26 -0.190 2.550 9.080 1.00 0.00 C ATOM 219 O ILE A 26 -1.092 3.189 9.607 1.00 0.00 O ATOM 220 CB ILE A 26 1.771 3.830 8.241 1.00 0.00 C ATOM 221 CG1 ILE A 26 2.597 3.087 7.189 1.00 0.00 C ATOM 222 CG2 ILE A 26 2.634 4.928 8.869 1.00 0.00 C ATOM 223 CD1 ILE A 26 2.670 3.861 5.881 1.00 0.00 C ATOM 0 H ILE A 26 3.034 1.805 9.101 1.00 0.00 H new ATOM 0 HA ILE A 26 1.405 3.369 10.269 1.00 0.00 H new ATOM 0 HB ILE A 26 0.897 4.280 7.769 1.00 0.00 H new ATOM 0 HG12 ILE A 26 3.605 2.919 7.569 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.158 2.106 7.007 1.00 0.00 H new ATOM 0 HG21 ILE A 26 2.971 5.615 8.092 1.00 0.00 H new ATOM 0 HG22 ILE A 26 2.047 5.475 9.607 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.499 4.477 9.355 1.00 0.00 H new ATOM 0 HD11 ILE A 26 3.265 3.301 5.160 1.00 0.00 H new ATOM 0 HD12 ILE A 26 1.664 4.006 5.487 1.00 0.00 H new ATOM 0 HD13 ILE A 26 3.134 4.832 6.058 1.00 0.00 H new ATOM 235 N ILE A 27 -0.407 1.733 8.044 1.00 0.00 N ATOM 236 CA ILE A 27 -1.723 1.565 7.465 1.00 0.00 C ATOM 237 C ILE A 27 -2.181 0.111 7.576 1.00 0.00 C ATOM 238 O ILE A 27 -3.241 -0.189 7.046 1.00 0.00 O ATOM 239 CB ILE A 27 -1.823 2.096 6.043 1.00 0.00 C ATOM 240 CG1 ILE A 27 -0.722 1.639 5.093 1.00 0.00 C ATOM 241 CG2 ILE A 27 -1.790 3.610 6.156 1.00 0.00 C ATOM 242 CD1 ILE A 27 -1.069 1.798 3.621 1.00 0.00 C ATOM 0 H ILE A 27 0.323 1.180 7.595 1.00 0.00 H new ATOM 0 HA ILE A 27 -2.409 2.179 8.048 1.00 0.00 H new ATOM 0 HB ILE A 27 -2.740 1.702 5.606 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.185 2.205 5.305 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -0.497 0.591 5.291 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.859 4.051 5.161 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.631 3.948 6.762 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.857 3.920 6.626 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.235 1.451 3.011 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.957 1.209 3.391 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.264 2.848 3.405 1.00 0.00 H new ATOM 254 N LYS A 28 -1.402 -0.748 8.230 1.00 0.00 N ATOM 255 CA LYS A 28 -1.626 -2.173 8.361 1.00 0.00 C ATOM 256 C LYS A 28 -3.049 -2.568 8.778 1.00 0.00 C ATOM 257 O LYS A 28 -3.706 -3.210 7.961 1.00 0.00 O ATOM 258 CB LYS A 28 -0.523 -2.831 9.180 1.00 0.00 C ATOM 259 CG LYS A 28 -0.440 -4.327 8.907 1.00 0.00 C ATOM 260 CD LYS A 28 0.690 -5.063 9.622 1.00 0.00 C ATOM 261 CE LYS A 28 0.886 -6.530 9.234 1.00 0.00 C ATOM 262 NZ LYS A 28 1.924 -7.307 9.938 1.00 0.00 N ATOM 0 H LYS A 28 -0.553 -0.445 8.706 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.558 -2.585 7.354 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.433 -2.364 8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.708 -2.664 10.241 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.387 -4.784 9.194 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.326 -4.477 7.833 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.622 -4.530 9.432 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.507 -5.013 10.695 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.066 -7.042 9.376 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.110 -6.565 8.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 2.299 -8.040 9.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.695 -6.673 10.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.510 -7.757 10.780 1.00 0.00 H new ATOM 276 N THR A 29 -3.528 -2.213 9.964 1.00 0.00 N ATOM 277 CA THR A 29 -4.808 -2.605 10.526 1.00 0.00 C ATOM 278 C THR A 29 -6.026 -2.322 9.663 1.00 0.00 C ATOM 279 O THR A 29 -6.872 -3.185 9.423 1.00 0.00 O ATOM 280 CB THR A 29 -4.989 -2.098 11.953 1.00 0.00 C ATOM 281 OG1 THR A 29 -4.749 -0.722 11.813 1.00 0.00 O ATOM 282 CG2 THR A 29 -3.924 -2.590 12.929 1.00 0.00 C ATOM 0 H THR A 29 -3.000 -1.608 10.593 1.00 0.00 H new ATOM 0 HA THR A 29 -4.755 -3.693 10.553 1.00 0.00 H new ATOM 0 HB THR A 29 -5.957 -2.417 12.341 1.00 0.00 H new ATOM 0 HG1 THR A 29 -4.841 -0.284 12.685 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.124 -2.185 13.921 1.00 0.00 H new ATOM 0 HG22 THR A 29 -3.944 -3.679 12.971 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.942 -2.258 12.593 1.00 0.00 H new ATOM 290 N ALA A 30 -5.960 -1.073 9.181 1.00 0.00 N ATOM 291 CA ALA A 30 -6.853 -0.407 8.266 1.00 0.00 C ATOM 292 C ALA A 30 -7.118 -1.162 6.980 1.00 0.00 C ATOM 293 O ALA A 30 -8.239 -1.279 6.511 1.00 0.00 O ATOM 294 CB ALA A 30 -6.193 0.974 8.144 1.00 0.00 C ATOM 0 H ALA A 30 -5.198 -0.456 9.460 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.884 -0.335 8.612 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -6.776 1.597 7.466 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.152 1.446 9.126 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -5.182 0.861 7.753 1.00 0.00 H new ATOM 300 N ARG A 31 -6.093 -1.731 6.336 1.00 0.00 N ATOM 301 CA ARG A 31 -6.251 -2.656 5.229 1.00 0.00 C ATOM 302 C ARG A 31 -7.265 -3.757 5.520 1.00 0.00 C ATOM 303 O ARG A 31 -8.165 -3.975 4.714 1.00 0.00 O ATOM 304 CB ARG A 31 -4.902 -3.137 4.714 1.00 0.00 C ATOM 305 CG ARG A 31 -4.198 -1.980 3.996 1.00 0.00 C ATOM 306 CD ARG A 31 -2.956 -2.326 3.161 1.00 0.00 C ATOM 307 NE ARG A 31 -3.326 -3.155 2.014 1.00 0.00 N ATOM 308 CZ ARG A 31 -2.556 -3.637 1.034 1.00 0.00 C ATOM 309 NH1 ARG A 31 -1.223 -3.524 0.968 1.00 0.00 N ATOM 310 NH2 ARG A 31 -3.166 -4.472 0.166 1.00 0.00 N ATOM 0 H ARG A 31 -5.119 -1.553 6.580 1.00 0.00 H new ATOM 0 HA ARG A 31 -6.698 -2.114 4.396 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.289 -3.495 5.542 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -5.037 -3.976 4.032 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.923 -1.498 3.340 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.907 -1.244 4.745 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.476 -1.410 2.816 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.230 -2.853 3.779 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.314 -3.401 1.954 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.715 -3.037 1.707 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.716 -3.925 0.179 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.154 -4.697 0.284 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.639 -4.878 -0.607 1.00 0.00 H new ATOM 324 N GLU A 32 -7.247 -4.380 6.689 1.00 0.00 N ATOM 325 CA GLU A 32 -8.241 -5.391 6.980 1.00 0.00 C ATOM 326 C GLU A 32 -9.635 -4.850 7.228 1.00 0.00 C ATOM 327 O GLU A 32 -10.636 -5.378 6.749 1.00 0.00 O ATOM 328 CB GLU A 32 -7.751 -6.192 8.194 1.00 0.00 C ATOM 329 CG GLU A 32 -7.981 -7.670 7.936 1.00 0.00 C ATOM 330 CD GLU A 32 -7.121 -8.548 8.849 1.00 0.00 C ATOM 331 OE1 GLU A 32 -7.685 -8.874 9.919 1.00 0.00 O ATOM 332 OE2 GLU A 32 -6.006 -8.981 8.514 1.00 0.00 O ATOM 0 H GLU A 32 -6.571 -4.207 7.433 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.342 -6.018 6.094 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -6.692 -6.001 8.369 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.284 -5.879 9.092 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -9.034 -7.906 8.091 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -7.753 -7.897 6.894 1.00 0.00 H new ATOM 339 N GLN A 33 -9.743 -3.816 8.065 1.00 0.00 N ATOM 340 CA GLN A 33 -10.936 -3.266 8.673 1.00 0.00 C ATOM 341 C GLN A 33 -11.846 -2.637 7.633 1.00 0.00 C ATOM 342 O GLN A 33 -13.068 -2.665 7.822 1.00 0.00 O ATOM 343 CB GLN A 33 -10.439 -2.188 9.631 1.00 0.00 C ATOM 344 CG GLN A 33 -9.953 -2.611 11.028 1.00 0.00 C ATOM 345 CD GLN A 33 -9.057 -1.539 11.637 1.00 0.00 C ATOM 346 OE1 GLN A 33 -8.237 -1.721 12.523 1.00 0.00 O ATOM 347 NE2 GLN A 33 -9.346 -0.249 11.421 1.00 0.00 N ATOM 0 H GLN A 33 -8.912 -3.300 8.356 1.00 0.00 H new ATOM 0 HA GLN A 33 -11.514 -4.043 9.173 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.620 -1.662 9.141 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -11.246 -1.467 9.765 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.810 -2.787 11.678 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.407 -3.552 10.959 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -10.021 0.009 10.701 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -8.891 0.475 11.977 1.00 0.00 H new ATOM 356 N LEU A 34 -11.295 -2.192 6.506 1.00 0.00 N ATOM 357 CA LEU A 34 -11.949 -1.462 5.430 1.00 0.00 C ATOM 358 C LEU A 34 -12.547 -2.433 4.419 1.00 0.00 C ATOM 359 O LEU A 34 -13.621 -2.124 3.890 1.00 0.00 O ATOM 360 CB LEU A 34 -10.950 -0.474 4.839 1.00 0.00 C ATOM 361 CG LEU A 34 -10.526 0.660 5.750 1.00 0.00 C ATOM 362 CD1 LEU A 34 -9.516 1.559 5.040 1.00 0.00 C ATOM 363 CD2 LEU A 34 -11.615 1.576 6.318 1.00 0.00 C ATOM 0 H LEU A 34 -10.306 -2.345 6.310 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.794 -0.880 5.800 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.059 -1.024 4.537 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.383 -0.046 3.935 1.00 0.00 H new ATOM 0 HG LEU A 34 -10.121 0.121 6.606 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -9.220 2.370 5.706 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -8.638 0.974 4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -9.969 1.975 4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.157 2.337 6.950 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.149 2.058 5.499 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -12.315 0.986 6.910 1.00 0.00 H new ATOM 375 N GLY A 35 -12.110 -3.693 4.450 1.00 0.00 N ATOM 376 CA GLY A 35 -12.647 -4.705 3.565 1.00 0.00 C ATOM 377 C GLY A 35 -12.311 -4.485 2.098 1.00 0.00 C ATOM 378 O GLY A 35 -12.696 -5.240 1.189 1.00 0.00 O ATOM 0 H GLY A 35 -11.384 -4.029 5.083 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -12.268 -5.680 3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -13.731 -4.734 3.679 1.00 0.00 H new ATOM 382 N ILE A 36 -11.396 -3.553 1.858 1.00 0.00 N ATOM 383 CA ILE A 36 -10.834 -3.125 0.586 1.00 0.00 C ATOM 384 C ILE A 36 -9.824 -4.092 -0.005 1.00 0.00 C ATOM 385 O ILE A 36 -9.091 -4.734 0.745 1.00 0.00 O ATOM 386 CB ILE A 36 -10.244 -1.726 0.749 1.00 0.00 C ATOM 387 CG1 ILE A 36 -9.034 -1.732 1.687 1.00 0.00 C ATOM 388 CG2 ILE A 36 -11.320 -0.718 1.166 1.00 0.00 C ATOM 389 CD1 ILE A 36 -8.073 -0.543 1.696 1.00 0.00 C ATOM 0 H ILE A 36 -10.989 -3.025 2.630 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.648 -3.107 -0.138 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.872 -1.399 -0.222 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.411 -1.853 2.703 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.448 -2.622 1.456 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.871 0.269 1.275 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.099 -0.681 0.404 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.757 -1.024 2.116 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.279 -0.723 2.420 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.638 -0.419 0.704 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.616 0.362 1.970 1.00 0.00 H new ATOM 401 N SER A 37 -9.759 -4.252 -1.319 1.00 0.00 N ATOM 402 CA SER A 37 -8.881 -5.227 -1.946 1.00 0.00 C ATOM 403 C SER A 37 -7.503 -4.694 -2.364 1.00 0.00 C ATOM 404 O SER A 37 -7.198 -3.513 -2.307 1.00 0.00 O ATOM 405 CB SER A 37 -9.477 -5.970 -3.124 1.00 0.00 C ATOM 406 OG SER A 37 -9.419 -5.223 -4.320 1.00 0.00 O ATOM 0 H SER A 37 -10.314 -3.709 -1.980 1.00 0.00 H new ATOM 0 HA SER A 37 -8.748 -5.929 -1.123 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.946 -6.912 -3.262 1.00 0.00 H new ATOM 0 HB3 SER A 37 -10.515 -6.219 -2.905 1.00 0.00 H new ATOM 0 HG SER A 37 -9.813 -5.744 -5.050 1.00 0.00 H new ATOM 412 N GLN A 38 -6.612 -5.651 -2.668 1.00 0.00 N ATOM 413 CA GLN A 38 -5.315 -5.352 -3.222 1.00 0.00 C ATOM 414 C GLN A 38 -5.386 -4.595 -4.531 1.00 0.00 C ATOM 415 O GLN A 38 -4.599 -3.660 -4.730 1.00 0.00 O ATOM 416 CB GLN A 38 -4.497 -6.625 -3.328 1.00 0.00 C ATOM 417 CG GLN A 38 -3.075 -6.253 -3.749 1.00 0.00 C ATOM 418 CD GLN A 38 -2.148 -7.458 -3.934 1.00 0.00 C ATOM 419 OE1 GLN A 38 -1.204 -7.757 -3.214 1.00 0.00 O ATOM 420 NE2 GLN A 38 -2.565 -8.252 -4.929 1.00 0.00 N ATOM 0 H GLN A 38 -6.786 -6.647 -2.531 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.808 -4.672 -2.537 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.485 -7.148 -2.372 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.943 -7.302 -4.056 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -3.118 -5.693 -4.683 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.646 -5.589 -2.999 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.355 -7.970 -5.509 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.092 -9.138 -5.107 1.00 0.00 H new ATOM 429 N GLN A 39 -6.397 -4.915 -5.357 1.00 0.00 N ATOM 430 CA GLN A 39 -6.607 -4.255 -6.622 1.00 0.00 C ATOM 431 C GLN A 39 -7.077 -2.824 -6.341 1.00 0.00 C ATOM 432 O GLN A 39 -6.547 -1.947 -7.008 1.00 0.00 O ATOM 433 CB GLN A 39 -7.557 -5.023 -7.521 1.00 0.00 C ATOM 434 CG GLN A 39 -7.414 -4.631 -9.004 1.00 0.00 C ATOM 435 CD GLN A 39 -8.286 -5.481 -9.918 1.00 0.00 C ATOM 436 OE1 GLN A 39 -9.492 -5.350 -10.029 1.00 0.00 O ATOM 437 NE2 GLN A 39 -7.583 -6.371 -10.606 1.00 0.00 N ATOM 0 H GLN A 39 -7.083 -5.641 -5.151 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.670 -4.219 -7.178 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.371 -6.091 -7.412 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.582 -4.843 -7.198 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -7.680 -3.581 -9.126 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.371 -4.732 -9.304 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -6.574 -6.437 -10.473 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.052 -6.989 -11.268 1.00 0.00 H new ATOM 446 N GLN A 40 -7.897 -2.541 -5.332 1.00 0.00 N ATOM 447 CA GLN A 40 -8.394 -1.225 -4.984 1.00 0.00 C ATOM 448 C GLN A 40 -7.290 -0.291 -4.485 1.00 0.00 C ATOM 449 O GLN A 40 -7.512 0.909 -4.616 1.00 0.00 O ATOM 450 CB GLN A 40 -9.467 -1.545 -3.948 1.00 0.00 C ATOM 451 CG GLN A 40 -10.714 -2.163 -4.568 1.00 0.00 C ATOM 452 CD GLN A 40 -11.882 -2.333 -3.595 1.00 0.00 C ATOM 453 OE1 GLN A 40 -12.034 -3.232 -2.773 1.00 0.00 O ATOM 454 NE2 GLN A 40 -12.679 -1.257 -3.479 1.00 0.00 N ATOM 0 H GLN A 40 -8.247 -3.266 -4.706 1.00 0.00 H new ATOM 0 HA GLN A 40 -8.793 -0.664 -5.829 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -9.057 -2.230 -3.206 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -9.742 -0.631 -3.421 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -11.038 -1.540 -5.401 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -10.455 -3.138 -4.981 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -12.591 -0.484 -4.138 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -13.372 -1.214 -2.732 1.00 0.00 H new ATOM 463 N LEU A 41 -6.239 -0.839 -3.851 1.00 0.00 N ATOM 464 CA LEU A 41 -5.088 -0.076 -3.400 1.00 0.00 C ATOM 465 C LEU A 41 -4.132 0.229 -4.538 1.00 0.00 C ATOM 466 O LEU A 41 -3.502 1.277 -4.702 1.00 0.00 O ATOM 467 CB LEU A 41 -4.544 -0.767 -2.157 1.00 0.00 C ATOM 468 CG LEU A 41 -3.332 -0.137 -1.492 1.00 0.00 C ATOM 469 CD1 LEU A 41 -3.445 -0.256 0.032 1.00 0.00 C ATOM 470 CD2 LEU A 41 -2.080 -0.853 -1.985 1.00 0.00 C ATOM 0 H LEU A 41 -6.175 -1.835 -3.641 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.342 0.935 -3.083 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.346 -0.819 -1.420 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -4.289 -1.793 -2.424 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.277 0.921 -1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -2.571 0.199 0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.345 0.257 0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.499 -1.308 0.312 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.200 -0.412 -1.516 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -2.139 -1.910 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.004 -0.750 -3.067 1.00 0.00 H new ATOM 482 N ALA A 42 -4.019 -0.750 -5.434 1.00 0.00 N ATOM 483 CA ALA A 42 -3.392 -0.607 -6.725 1.00 0.00 C ATOM 484 C ALA A 42 -3.984 0.552 -7.531 1.00 0.00 C ATOM 485 O ALA A 42 -3.280 1.196 -8.312 1.00 0.00 O ATOM 486 CB ALA A 42 -3.367 -1.938 -7.458 1.00 0.00 C ATOM 0 H ALA A 42 -4.376 -1.690 -5.266 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.350 -0.325 -6.578 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -2.890 -1.809 -8.430 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -2.806 -2.666 -6.872 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.387 -2.295 -7.599 1.00 0.00 H new ATOM 492 N GLN A 43 -5.297 0.770 -7.521 1.00 0.00 N ATOM 493 CA GLN A 43 -5.898 1.869 -8.238 1.00 0.00 C ATOM 494 C GLN A 43 -5.557 3.215 -7.572 1.00 0.00 C ATOM 495 O GLN A 43 -5.442 4.212 -8.264 1.00 0.00 O ATOM 496 CB GLN A 43 -7.389 1.601 -8.399 1.00 0.00 C ATOM 497 CG GLN A 43 -7.918 0.393 -9.172 1.00 0.00 C ATOM 498 CD GLN A 43 -6.943 -0.013 -10.268 1.00 0.00 C ATOM 499 OE1 GLN A 43 -7.000 0.430 -11.415 1.00 0.00 O ATOM 500 NE2 GLN A 43 -6.113 -0.971 -9.847 1.00 0.00 N ATOM 0 H GLN A 43 -5.964 0.187 -7.015 1.00 0.00 H new ATOM 0 HA GLN A 43 -5.482 1.946 -9.243 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -7.807 1.538 -7.394 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -7.818 2.486 -8.868 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -8.074 -0.442 -8.489 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -8.887 0.631 -9.610 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -6.137 -1.275 -8.874 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -5.455 -1.398 -10.499 1.00 0.00 H new ATOM 509 N LYS A 44 -5.487 3.314 -6.251 1.00 0.00 N ATOM 510 CA LYS A 44 -5.322 4.498 -5.416 1.00 0.00 C ATOM 511 C LYS A 44 -3.953 5.116 -5.637 1.00 0.00 C ATOM 512 O LYS A 44 -3.782 6.302 -5.361 1.00 0.00 O ATOM 513 CB LYS A 44 -5.517 4.120 -3.953 1.00 0.00 C ATOM 514 CG LYS A 44 -6.993 3.949 -3.645 1.00 0.00 C ATOM 515 CD LYS A 44 -7.231 3.404 -2.233 1.00 0.00 C ATOM 516 CE LYS A 44 -8.743 3.313 -2.037 1.00 0.00 C ATOM 517 NZ LYS A 44 -9.325 2.244 -2.843 1.00 0.00 N ATOM 0 H LYS A 44 -5.552 2.475 -5.675 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.072 5.240 -5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -4.984 3.195 -3.735 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.092 4.892 -3.311 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.498 4.909 -3.752 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.438 3.272 -4.374 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.767 2.425 -2.115 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.784 4.060 -1.486 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.964 3.138 -0.984 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.203 4.264 -2.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.048 2.641 -3.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.580 1.791 -3.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.763 1.537 -2.218 1.00 0.00 H new ATOM 531 N LEU A 45 -3.034 4.386 -6.276 1.00 0.00 N ATOM 532 CA LEU A 45 -1.612 4.583 -6.349 1.00 0.00 C ATOM 533 C LEU A 45 -1.079 4.511 -7.774 1.00 0.00 C ATOM 534 O LEU A 45 0.080 4.712 -8.140 1.00 0.00 O ATOM 535 CB LEU A 45 -0.807 3.600 -5.502 1.00 0.00 C ATOM 536 CG LEU A 45 -0.855 3.742 -3.980 1.00 0.00 C ATOM 537 CD1 LEU A 45 -0.283 2.470 -3.339 1.00 0.00 C ATOM 538 CD2 LEU A 45 -0.187 5.029 -3.495 1.00 0.00 C ATOM 0 H LEU A 45 -3.314 3.560 -6.805 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.476 5.588 -5.949 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.143 2.594 -5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.236 3.674 -5.810 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.892 3.840 -3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.314 2.564 -2.254 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.877 1.609 -3.646 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.749 2.332 -3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.247 5.083 -2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.859 5.034 -3.801 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.696 5.889 -3.930 1.00 0.00 H new ATOM 550 N LYS A 46 -1.997 4.249 -8.693 1.00 0.00 N ATOM 551 CA LYS A 46 -1.838 3.772 -10.057 1.00 0.00 C ATOM 552 C LYS A 46 -1.094 2.475 -10.356 1.00 0.00 C ATOM 553 O LYS A 46 -1.298 1.975 -11.473 1.00 0.00 O ATOM 554 CB LYS A 46 -1.402 4.893 -10.993 1.00 0.00 C ATOM 555 CG LYS A 46 -2.453 5.999 -11.028 1.00 0.00 C ATOM 556 CD LYS A 46 -2.163 7.023 -12.113 1.00 0.00 C ATOM 557 CE LYS A 46 -0.943 7.817 -11.673 1.00 0.00 C ATOM 558 NZ LYS A 46 -0.317 8.535 -12.796 1.00 0.00 N ATOM 0 H LYS A 46 -2.984 4.381 -8.474 1.00 0.00 H new ATOM 0 HA LYS A 46 -2.859 3.445 -10.254 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.447 5.301 -10.661 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.248 4.497 -11.997 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.436 5.560 -11.197 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.488 6.497 -10.059 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.976 6.529 -13.067 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -3.019 7.682 -12.257 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.234 8.532 -10.903 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.215 7.143 -11.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.510 9.063 -12.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.016 7.852 -13.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.003 9.198 -13.210 1.00 0.00 H new ATOM 572 N VAL A 47 -0.154 2.004 -9.536 1.00 0.00 N ATOM 573 CA VAL A 47 0.803 0.929 -9.746 1.00 0.00 C ATOM 574 C VAL A 47 0.185 -0.433 -9.443 1.00 0.00 C ATOM 575 O VAL A 47 -0.888 -0.494 -8.871 1.00 0.00 O ATOM 576 CB VAL A 47 2.028 1.144 -8.883 1.00 0.00 C ATOM 577 CG1 VAL A 47 2.862 2.318 -9.378 1.00 0.00 C ATOM 578 CG2 VAL A 47 1.790 1.304 -7.371 1.00 0.00 C ATOM 0 H VAL A 47 -0.036 2.414 -8.610 1.00 0.00 H new ATOM 0 HA VAL A 47 1.095 0.942 -10.796 1.00 0.00 H new ATOM 0 HB VAL A 47 2.563 0.201 -8.995 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.733 2.443 -8.735 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.190 2.126 -10.400 1.00 0.00 H new ATOM 0 HG13 VAL A 47 2.261 3.227 -9.355 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.745 1.451 -6.866 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.148 2.167 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.308 0.407 -6.982 1.00 0.00 H new ATOM 588 N SER A 48 0.848 -1.558 -9.721 1.00 0.00 N ATOM 589 CA SER A 48 0.230 -2.844 -10.011 1.00 0.00 C ATOM 590 C SER A 48 0.079 -3.679 -8.755 1.00 0.00 C ATOM 591 O SER A 48 0.778 -3.352 -7.798 1.00 0.00 O ATOM 592 CB SER A 48 0.994 -3.673 -11.054 1.00 0.00 C ATOM 593 OG SER A 48 2.247 -4.049 -10.543 1.00 0.00 O ATOM 0 H SER A 48 1.867 -1.594 -9.750 1.00 0.00 H new ATOM 0 HA SER A 48 -0.748 -2.597 -10.426 1.00 0.00 H new ATOM 0 HB2 SER A 48 0.419 -4.560 -11.318 1.00 0.00 H new ATOM 0 HB3 SER A 48 1.124 -3.093 -11.968 1.00 0.00 H new ATOM 0 HG SER A 48 2.728 -4.579 -11.213 1.00 0.00 H new ATOM 599 N GLU A 49 -0.831 -4.660 -8.740 1.00 0.00 N ATOM 600 CA GLU A 49 -1.073 -5.587 -7.649 1.00 0.00 C ATOM 601 C GLU A 49 0.207 -6.389 -7.417 1.00 0.00 C ATOM 602 O GLU A 49 0.484 -6.741 -6.267 1.00 0.00 O ATOM 603 CB GLU A 49 -2.239 -6.511 -8.003 1.00 0.00 C ATOM 604 CG GLU A 49 -3.626 -5.931 -7.805 1.00 0.00 C ATOM 605 CD GLU A 49 -4.707 -7.004 -7.664 1.00 0.00 C ATOM 606 OE1 GLU A 49 -4.900 -7.508 -6.532 1.00 0.00 O ATOM 607 OE2 GLU A 49 -5.359 -7.340 -8.663 1.00 0.00 O ATOM 0 H GLU A 49 -1.447 -4.830 -9.535 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.338 -5.050 -6.738 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.137 -6.810 -9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.155 -7.416 -7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.627 -5.302 -6.915 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.869 -5.287 -8.650 1.00 0.00 H new ATOM 614 N ASN A 50 0.979 -6.660 -8.462 1.00 0.00 N ATOM 615 CA ASN A 50 2.312 -7.200 -8.289 1.00 0.00 C ATOM 616 C ASN A 50 3.325 -6.291 -7.599 1.00 0.00 C ATOM 617 O ASN A 50 4.216 -6.783 -6.913 1.00 0.00 O ATOM 618 CB ASN A 50 2.733 -7.781 -9.629 1.00 0.00 C ATOM 619 CG ASN A 50 4.104 -8.443 -9.630 1.00 0.00 C ATOM 620 OD1 ASN A 50 5.153 -7.867 -9.908 1.00 0.00 O ATOM 621 ND2 ASN A 50 4.186 -9.689 -9.139 1.00 0.00 N ATOM 0 H ASN A 50 0.702 -6.514 -9.433 1.00 0.00 H new ATOM 0 HA ASN A 50 2.284 -7.995 -7.544 1.00 0.00 H new ATOM 0 HB2 ASN A 50 1.990 -8.514 -9.942 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.728 -6.985 -10.373 1.00 0.00 H new ATOM 0 HD21 ASN A 50 5.098 -10.127 -9.008 1.00 0.00 H new ATOM 0 HD22 ASN A 50 3.336 -10.199 -8.897 1.00 0.00 H new ATOM 628 N ILE A 51 3.226 -4.972 -7.757 1.00 0.00 N ATOM 629 CA ILE A 51 4.030 -4.001 -7.038 1.00 0.00 C ATOM 630 C ILE A 51 3.701 -3.956 -5.552 1.00 0.00 C ATOM 631 O ILE A 51 4.537 -3.841 -4.659 1.00 0.00 O ATOM 632 CB ILE A 51 4.001 -2.662 -7.766 1.00 0.00 C ATOM 633 CG1 ILE A 51 4.918 -2.688 -8.978 1.00 0.00 C ATOM 634 CG2 ILE A 51 4.361 -1.473 -6.869 1.00 0.00 C ATOM 635 CD1 ILE A 51 4.631 -1.652 -10.064 1.00 0.00 C ATOM 0 H ILE A 51 2.566 -4.544 -8.406 1.00 0.00 H new ATOM 0 HA ILE A 51 5.073 -4.317 -7.042 1.00 0.00 H new ATOM 0 HB ILE A 51 2.969 -2.518 -8.086 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.943 -2.549 -8.635 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.864 -3.680 -9.428 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.321 -0.553 -7.451 1.00 0.00 H new ATOM 0 HG22 ILE A 51 3.651 -1.412 -6.044 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.367 -1.608 -6.473 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.349 -1.768 -10.876 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.621 -1.798 -10.448 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.718 -0.650 -9.643 1.00 0.00 H new ATOM 647 N VAL A 52 2.431 -4.071 -5.155 1.00 0.00 N ATOM 648 CA VAL A 52 2.005 -3.974 -3.774 1.00 0.00 C ATOM 649 C VAL A 52 2.218 -5.251 -2.964 1.00 0.00 C ATOM 650 O VAL A 52 2.664 -5.086 -1.827 1.00 0.00 O ATOM 651 CB VAL A 52 0.638 -3.328 -3.621 1.00 0.00 C ATOM 652 CG1 VAL A 52 0.804 -1.938 -4.239 1.00 0.00 C ATOM 653 CG2 VAL A 52 -0.537 -4.092 -4.251 1.00 0.00 C ATOM 0 H VAL A 52 1.662 -4.237 -5.804 1.00 0.00 H new ATOM 0 HA VAL A 52 2.690 -3.271 -3.300 1.00 0.00 H new ATOM 0 HB VAL A 52 0.358 -3.312 -2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.139 -1.395 -4.173 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.576 -1.390 -3.700 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.093 -2.037 -5.285 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -1.462 -3.541 -4.082 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -0.369 -4.198 -5.323 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.615 -5.080 -3.796 1.00 0.00 H new ATOM 663 N LYS A 53 2.144 -6.416 -3.608 1.00 0.00 N ATOM 664 CA LYS A 53 2.765 -7.668 -3.202 1.00 0.00 C ATOM 665 C LYS A 53 4.249 -7.453 -2.965 1.00 0.00 C ATOM 666 O LYS A 53 4.767 -8.024 -2.021 1.00 0.00 O ATOM 667 CB LYS A 53 2.481 -8.703 -4.277 1.00 0.00 C ATOM 668 CG LYS A 53 2.646 -10.094 -3.674 1.00 0.00 C ATOM 669 CD LYS A 53 1.770 -11.077 -4.466 1.00 0.00 C ATOM 670 CE LYS A 53 2.014 -12.487 -3.932 1.00 0.00 C ATOM 671 NZ LYS A 53 0.915 -13.354 -4.396 1.00 0.00 N ATOM 0 H LYS A 53 1.618 -6.512 -4.476 1.00 0.00 H new ATOM 0 HA LYS A 53 2.353 -8.031 -2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 53 1.470 -8.577 -4.665 1.00 0.00 H new ATOM 0 HB3 LYS A 53 3.163 -8.572 -5.117 1.00 0.00 H new ATOM 0 HG2 LYS A 53 3.691 -10.402 -3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 53 2.354 -10.088 -2.624 1.00 0.00 H new ATOM 0 HD2 LYS A 53 0.718 -10.811 -4.366 1.00 0.00 H new ATOM 0 HD3 LYS A 53 2.011 -11.028 -5.528 1.00 0.00 H new ATOM 0 HE2 LYS A 53 2.973 -12.867 -4.286 1.00 0.00 H new ATOM 0 HE3 LYS A 53 2.057 -12.478 -2.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 1.063 -14.321 -4.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 0.010 -12.989 -4.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 0.897 -13.365 -5.436 1.00 0.00 H new ATOM 685 N ARG A 54 4.944 -6.644 -3.772 1.00 0.00 N ATOM 686 CA ARG A 54 6.381 -6.433 -3.748 1.00 0.00 C ATOM 687 C ARG A 54 6.666 -5.619 -2.493 1.00 0.00 C ATOM 688 O ARG A 54 7.709 -5.834 -1.892 1.00 0.00 O ATOM 689 CB ARG A 54 6.971 -5.633 -4.918 1.00 0.00 C ATOM 690 CG ARG A 54 8.331 -6.101 -5.426 1.00 0.00 C ATOM 691 CD ARG A 54 8.285 -7.515 -6.023 1.00 0.00 C ATOM 692 NE ARG A 54 9.628 -8.019 -6.287 1.00 0.00 N ATOM 693 CZ ARG A 54 9.956 -9.233 -6.750 1.00 0.00 C ATOM 694 NH1 ARG A 54 8.982 -10.125 -6.980 1.00 0.00 N ATOM 695 NH2 ARG A 54 11.180 -9.735 -6.939 1.00 0.00 N ATOM 0 H ARG A 54 4.486 -6.092 -4.497 1.00 0.00 H new ATOM 0 HA ARG A 54 6.835 -7.423 -3.798 1.00 0.00 H new ATOM 0 HB2 ARG A 54 6.264 -5.665 -5.747 1.00 0.00 H new ATOM 0 HB3 ARG A 54 7.058 -4.590 -4.613 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.692 -5.403 -6.182 1.00 0.00 H new ATOM 0 HG3 ARG A 54 9.048 -6.081 -4.605 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.770 -8.186 -5.336 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.709 -7.503 -6.949 1.00 0.00 H new ATOM 0 HE ARG A 54 10.400 -7.379 -6.099 1.00 0.00 H new ATOM 0 HH11 ARG A 54 8.009 -9.875 -6.803 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.214 -11.054 -7.332 1.00 0.00 H new ATOM 0 HH21 ARG A 54 12.002 -9.171 -6.722 1.00 0.00 H new ATOM 0 HH22 ARG A 54 11.293 -10.682 -7.301 1.00 0.00 H new ATOM 709 N PHE A 55 5.849 -4.649 -2.091 1.00 0.00 N ATOM 710 CA PHE A 55 5.975 -3.922 -0.850 1.00 0.00 C ATOM 711 C PHE A 55 5.705 -4.882 0.309 1.00 0.00 C ATOM 712 O PHE A 55 6.429 -4.973 1.294 1.00 0.00 O ATOM 713 CB PHE A 55 4.899 -2.856 -0.779 1.00 0.00 C ATOM 714 CG PHE A 55 4.987 -1.679 -1.730 1.00 0.00 C ATOM 715 CD1 PHE A 55 6.005 -1.649 -2.699 1.00 0.00 C ATOM 716 CD2 PHE A 55 4.028 -0.669 -1.650 1.00 0.00 C ATOM 717 CE1 PHE A 55 6.037 -0.595 -3.613 1.00 0.00 C ATOM 718 CE2 PHE A 55 3.959 0.270 -2.688 1.00 0.00 C ATOM 719 CZ PHE A 55 5.011 0.351 -3.595 1.00 0.00 C ATOM 0 H PHE A 55 5.052 -4.343 -2.650 1.00 0.00 H new ATOM 0 HA PHE A 55 6.971 -3.484 -0.794 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.938 -3.343 -0.942 1.00 0.00 H new ATOM 0 HB3 PHE A 55 4.889 -2.462 0.237 1.00 0.00 H new ATOM 0 HD1 PHE A 55 6.751 -2.429 -2.736 1.00 0.00 H new ATOM 0 HD2 PHE A 55 3.354 -0.612 -0.808 1.00 0.00 H new ATOM 0 HE1 PHE A 55 6.845 -0.512 -4.325 1.00 0.00 H new ATOM 0 HE2 PHE A 55 3.102 0.921 -2.782 1.00 0.00 H new ATOM 0 HZ PHE A 55 5.034 1.166 -4.303 1.00 0.00 H new ATOM 729 N GLU A 56 4.698 -5.753 0.176 1.00 0.00 N ATOM 730 CA GLU A 56 4.299 -6.567 1.302 1.00 0.00 C ATOM 731 C GLU A 56 5.345 -7.621 1.628 1.00 0.00 C ATOM 732 O GLU A 56 5.357 -7.983 2.814 1.00 0.00 O ATOM 733 CB GLU A 56 2.950 -7.207 1.000 1.00 0.00 C ATOM 734 CG GLU A 56 1.767 -6.272 0.740 1.00 0.00 C ATOM 735 CD GLU A 56 0.714 -6.456 1.825 1.00 0.00 C ATOM 736 OE1 GLU A 56 0.931 -6.075 2.999 1.00 0.00 O ATOM 737 OE2 GLU A 56 -0.317 -7.111 1.597 1.00 0.00 O ATOM 0 H GLU A 56 4.164 -5.902 -0.680 1.00 0.00 H new ATOM 0 HA GLU A 56 4.208 -5.931 2.183 1.00 0.00 H new ATOM 0 HB2 GLU A 56 3.070 -7.848 0.127 1.00 0.00 H new ATOM 0 HB3 GLU A 56 2.690 -7.854 1.838 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.107 -5.237 0.723 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.334 -6.482 -0.238 1.00 0.00 H new ATOM 744 N SER A 57 6.331 -7.958 0.800 1.00 0.00 N ATOM 745 CA SER A 57 7.286 -9.021 1.029 1.00 0.00 C ATOM 746 C SER A 57 8.685 -8.466 1.232 1.00 0.00 C ATOM 747 O SER A 57 9.597 -9.282 1.387 1.00 0.00 O ATOM 748 CB SER A 57 7.218 -9.847 -0.253 1.00 0.00 C ATOM 749 OG SER A 57 7.405 -8.979 -1.361 1.00 0.00 O ATOM 0 H SER A 57 6.486 -7.473 -0.084 1.00 0.00 H new ATOM 0 HA SER A 57 7.061 -9.600 1.925 1.00 0.00 H new ATOM 0 HB2 SER A 57 7.985 -10.621 -0.245 1.00 0.00 H new ATOM 0 HB3 SER A 57 6.255 -10.353 -0.327 1.00 0.00 H new ATOM 0 HG SER A 57 6.536 -8.640 -1.662 1.00 0.00 H new ATOM 755 N GLY A 58 8.764 -7.130 1.125 1.00 0.00 N ATOM 756 CA GLY A 58 9.938 -6.286 1.245 1.00 0.00 C ATOM 757 C GLY A 58 11.055 -6.413 0.215 1.00 0.00 C ATOM 758 O GLY A 58 12.173 -6.165 0.633 1.00 0.00 O ATOM 0 H GLY A 58 7.929 -6.576 0.936 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.599 -5.250 1.235 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.375 -6.469 2.227 1.00 0.00 H new ATOM 762 N LYS A 59 10.783 -6.811 -1.036 1.00 0.00 N ATOM 763 CA LYS A 59 11.650 -7.171 -2.138 1.00 0.00 C ATOM 764 C LYS A 59 12.115 -5.972 -2.952 1.00 0.00 C ATOM 765 O LYS A 59 12.802 -6.150 -3.961 1.00 0.00 O ATOM 766 CB LYS A 59 11.025 -8.273 -2.980 1.00 0.00 C ATOM 767 CG LYS A 59 10.999 -9.522 -2.096 1.00 0.00 C ATOM 768 CD LYS A 59 10.657 -10.722 -2.958 1.00 0.00 C ATOM 769 CE LYS A 59 10.482 -11.802 -1.889 1.00 0.00 C ATOM 770 NZ LYS A 59 10.288 -13.115 -2.513 1.00 0.00 N ATOM 0 H LYS A 59 9.808 -6.895 -1.324 1.00 0.00 H new ATOM 0 HA LYS A 59 12.567 -7.577 -1.712 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.019 -7.998 -3.296 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.606 -8.449 -3.885 1.00 0.00 H new ATOM 0 HG2 LYS A 59 11.967 -9.665 -1.616 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.263 -9.406 -1.300 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.749 -10.567 -3.541 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.452 -10.964 -3.664 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.358 -11.826 -1.241 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.626 -11.562 -1.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 10.171 -13.837 -1.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 9.438 -13.092 -3.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.117 -13.348 -3.096 1.00 0.00 H new ATOM 784 N LEU A 60 11.791 -4.772 -2.456 1.00 0.00 N ATOM 785 CA LEU A 60 11.858 -3.496 -3.131 1.00 0.00 C ATOM 786 C LEU A 60 12.441 -2.450 -2.186 1.00 0.00 C ATOM 787 O LEU A 60 12.206 -2.445 -0.971 1.00 0.00 O ATOM 788 CB LEU A 60 10.457 -3.080 -3.550 1.00 0.00 C ATOM 789 CG LEU A 60 10.214 -1.655 -4.068 1.00 0.00 C ATOM 790 CD1 LEU A 60 9.227 -1.599 -5.222 1.00 0.00 C ATOM 791 CD2 LEU A 60 9.756 -0.763 -2.926 1.00 0.00 C ATOM 0 H LEU A 60 11.451 -4.674 -1.499 1.00 0.00 H new ATOM 0 HA LEU A 60 12.494 -3.579 -4.012 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.130 -3.770 -4.328 1.00 0.00 H new ATOM 0 HB3 LEU A 60 9.801 -3.232 -2.693 1.00 0.00 H new ATOM 0 HG LEU A 60 11.163 -1.291 -4.462 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.099 -0.565 -5.542 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.606 -2.192 -6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.266 -2.000 -4.899 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.585 0.247 -3.299 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.830 -1.156 -2.506 1.00 0.00 H new ATOM 0 HD23 LEU A 60 10.524 -0.739 -2.153 1.00 0.00 H new ATOM 803 N LYS A 61 13.230 -1.526 -2.758 1.00 0.00 N ATOM 804 CA LYS A 61 13.817 -0.480 -1.948 1.00 0.00 C ATOM 805 C LYS A 61 12.827 0.648 -1.752 1.00 0.00 C ATOM 806 O LYS A 61 12.247 1.057 -2.769 1.00 0.00 O ATOM 807 CB LYS A 61 15.027 0.018 -2.747 1.00 0.00 C ATOM 808 CG LYS A 61 15.830 1.038 -1.939 1.00 0.00 C ATOM 809 CD LYS A 61 17.253 1.250 -2.484 1.00 0.00 C ATOM 810 CE LYS A 61 18.178 2.004 -1.553 1.00 0.00 C ATOM 811 NZ LYS A 61 19.284 2.630 -2.306 1.00 0.00 N ATOM 0 H LYS A 61 13.463 -1.491 -3.750 1.00 0.00 H new ATOM 0 HA LYS A 61 14.098 -0.841 -0.959 1.00 0.00 H new ATOM 0 HB2 LYS A 61 15.665 -0.825 -3.013 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.691 0.470 -3.680 1.00 0.00 H new ATOM 0 HG2 LYS A 61 15.301 1.991 -1.939 1.00 0.00 H new ATOM 0 HG3 LYS A 61 15.889 0.707 -0.902 1.00 0.00 H new ATOM 0 HD2 LYS A 61 17.693 0.277 -2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 61 17.190 1.791 -3.428 1.00 0.00 H new ATOM 0 HE2 LYS A 61 17.617 2.770 -1.018 1.00 0.00 H new ATOM 0 HE3 LYS A 61 18.582 1.323 -0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 19.906 3.142 -1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 19.830 1.894 -2.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 18.896 3.296 -3.004 1.00 0.00 H new ATOM 825 N PRO A 62 12.530 1.077 -0.533 1.00 0.00 N ATOM 826 CA PRO A 62 11.438 1.967 -0.220 1.00 0.00 C ATOM 827 C PRO A 62 11.788 3.424 -0.463 1.00 0.00 C ATOM 828 O PRO A 62 12.940 3.787 -0.223 1.00 0.00 O ATOM 829 CB PRO A 62 11.197 1.788 1.282 1.00 0.00 C ATOM 830 CG PRO A 62 12.608 1.534 1.763 1.00 0.00 C ATOM 831 CD PRO A 62 13.336 0.787 0.648 1.00 0.00 C ATOM 0 HA PRO A 62 10.577 1.732 -0.846 1.00 0.00 H new ATOM 0 HB2 PRO A 62 10.757 2.674 1.739 1.00 0.00 H new ATOM 0 HB3 PRO A 62 10.530 0.954 1.498 1.00 0.00 H new ATOM 0 HG2 PRO A 62 13.112 2.473 1.990 1.00 0.00 H new ATOM 0 HG3 PRO A 62 12.602 0.946 2.680 1.00 0.00 H new ATOM 0 HD2 PRO A 62 14.361 1.138 0.531 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.387 -0.283 0.847 1.00 0.00 H new ATOM 839 N THR A 63 10.842 4.309 -0.801 1.00 0.00 N ATOM 840 CA THR A 63 11.116 5.720 -0.937 1.00 0.00 C ATOM 841 C THR A 63 10.248 6.600 -0.047 1.00 0.00 C ATOM 842 O THR A 63 9.259 6.193 0.571 1.00 0.00 O ATOM 843 CB THR A 63 10.917 6.094 -2.400 1.00 0.00 C ATOM 844 OG1 THR A 63 9.515 6.069 -2.627 1.00 0.00 O ATOM 845 CG2 THR A 63 11.383 5.122 -3.472 1.00 0.00 C ATOM 0 H THR A 63 9.872 4.054 -0.985 1.00 0.00 H new ATOM 0 HA THR A 63 12.141 5.897 -0.612 1.00 0.00 H new ATOM 0 HB THR A 63 11.482 7.021 -2.498 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.330 6.306 -3.560 1.00 0.00 H new ATOM 0 HG21 THR A 63 11.169 5.537 -4.457 1.00 0.00 H new ATOM 0 HG22 THR A 63 12.456 4.958 -3.373 1.00 0.00 H new ATOM 0 HG23 THR A 63 10.859 4.174 -3.356 1.00 0.00 H new ATOM 853 N ILE A 64 10.636 7.859 0.127 1.00 0.00 N ATOM 854 CA ILE A 64 9.858 8.854 0.858 1.00 0.00 C ATOM 855 C ILE A 64 8.510 9.150 0.226 1.00 0.00 C ATOM 856 O ILE A 64 7.526 8.951 0.947 1.00 0.00 O ATOM 857 CB ILE A 64 10.561 10.169 1.175 1.00 0.00 C ATOM 858 CG1 ILE A 64 11.179 10.781 -0.068 1.00 0.00 C ATOM 859 CG2 ILE A 64 11.592 9.950 2.286 1.00 0.00 C ATOM 860 CD1 ILE A 64 11.762 12.183 0.129 1.00 0.00 C ATOM 0 H ILE A 64 11.514 8.223 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 64 9.715 8.348 1.813 1.00 0.00 H new ATOM 0 HB ILE A 64 9.823 10.886 1.534 1.00 0.00 H new ATOM 0 HG12 ILE A 64 11.969 10.121 -0.426 1.00 0.00 H new ATOM 0 HG13 ILE A 64 10.421 10.825 -0.850 1.00 0.00 H new ATOM 0 HG21 ILE A 64 12.092 10.892 2.509 1.00 0.00 H new ATOM 0 HG22 ILE A 64 11.090 9.585 3.182 1.00 0.00 H new ATOM 0 HG23 ILE A 64 12.329 9.217 1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 64 12.181 12.538 -0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.974 12.862 0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 64 12.546 12.148 0.885 1.00 0.00 H new ATOM 872 N SER A 65 8.389 9.443 -1.067 1.00 0.00 N ATOM 873 CA SER A 65 7.096 9.522 -1.722 1.00 0.00 C ATOM 874 C SER A 65 6.193 8.301 -1.601 1.00 0.00 C ATOM 875 O SER A 65 4.981 8.424 -1.748 1.00 0.00 O ATOM 876 CB SER A 65 7.331 9.889 -3.181 1.00 0.00 C ATOM 877 OG SER A 65 8.039 8.852 -3.809 1.00 0.00 O ATOM 0 H SER A 65 9.181 9.630 -1.682 1.00 0.00 H new ATOM 0 HA SER A 65 6.532 10.288 -1.189 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.379 10.053 -3.685 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.892 10.821 -3.248 1.00 0.00 H new ATOM 0 HG SER A 65 8.192 9.083 -4.749 1.00 0.00 H new ATOM 883 N GLN A 66 6.771 7.129 -1.315 1.00 0.00 N ATOM 884 CA GLN A 66 5.964 5.927 -1.139 1.00 0.00 C ATOM 885 C GLN A 66 5.237 5.919 0.209 1.00 0.00 C ATOM 886 O GLN A 66 4.033 6.129 0.245 1.00 0.00 O ATOM 887 CB GLN A 66 6.852 4.728 -1.435 1.00 0.00 C ATOM 888 CG GLN A 66 6.902 4.352 -2.912 1.00 0.00 C ATOM 889 CD GLN A 66 7.853 3.188 -3.162 1.00 0.00 C ATOM 890 OE1 GLN A 66 8.248 2.345 -2.352 1.00 0.00 O ATOM 891 NE2 GLN A 66 8.212 2.990 -4.440 1.00 0.00 N ATOM 0 H GLN A 66 7.776 6.992 -1.203 1.00 0.00 H new ATOM 0 HA GLN A 66 5.135 5.889 -1.846 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.863 4.942 -1.089 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.494 3.872 -0.863 1.00 0.00 H new ATOM 0 HG2 GLN A 66 5.902 4.086 -3.254 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.220 5.215 -3.497 1.00 0.00 H new ATOM 0 HE21 GLN A 66 7.918 3.650 -5.160 1.00 0.00 H new ATOM 0 HE22 GLN A 66 8.778 2.180 -4.691 1.00 0.00 H new ATOM 900 N ALA A 67 5.882 5.651 1.345 1.00 0.00 N ATOM 901 CA ALA A 67 5.577 6.138 2.674 1.00 0.00 C ATOM 902 C ALA A 67 4.580 7.287 2.802 1.00 0.00 C ATOM 903 O ALA A 67 3.505 7.004 3.345 1.00 0.00 O ATOM 904 CB ALA A 67 6.918 6.334 3.357 1.00 0.00 C ATOM 0 H ALA A 67 6.696 5.037 1.350 1.00 0.00 H new ATOM 0 HA ALA A 67 4.976 5.395 3.197 1.00 0.00 H new ATOM 0 HB1 ALA A 67 6.760 6.703 4.370 1.00 0.00 H new ATOM 0 HB2 ALA A 67 7.449 5.383 3.396 1.00 0.00 H new ATOM 0 HB3 ALA A 67 7.510 7.057 2.796 1.00 0.00 H new ATOM 910 N ARG A 68 4.868 8.476 2.253 1.00 0.00 N ATOM 911 CA ARG A 68 4.063 9.675 2.281 1.00 0.00 C ATOM 912 C ARG A 68 2.701 9.335 1.681 1.00 0.00 C ATOM 913 O ARG A 68 1.692 9.770 2.231 1.00 0.00 O ATOM 914 CB ARG A 68 4.766 10.825 1.575 1.00 0.00 C ATOM 915 CG ARG A 68 5.855 11.513 2.407 1.00 0.00 C ATOM 916 CD ARG A 68 6.572 12.596 1.610 1.00 0.00 C ATOM 917 NE ARG A 68 7.837 12.994 2.212 1.00 0.00 N ATOM 918 CZ ARG A 68 8.716 13.793 1.578 1.00 0.00 C ATOM 919 NH1 ARG A 68 8.626 13.995 0.255 1.00 0.00 N ATOM 920 NH2 ARG A 68 9.695 14.324 2.314 1.00 0.00 N ATOM 0 H ARG A 68 5.739 8.620 1.742 1.00 0.00 H new ATOM 0 HA ARG A 68 3.915 10.022 3.304 1.00 0.00 H new ATOM 0 HB2 ARG A 68 5.213 10.450 0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 68 4.022 11.568 1.289 1.00 0.00 H new ATOM 0 HG2 ARG A 68 5.409 11.953 3.299 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.578 10.771 2.745 1.00 0.00 H new ATOM 0 HD2 ARG A 68 6.754 12.236 0.598 1.00 0.00 H new ATOM 0 HD3 ARG A 68 5.924 13.468 1.526 1.00 0.00 H new ATOM 0 HE ARG A 68 8.065 12.656 3.147 1.00 0.00 H new ATOM 0 HH11 ARG A 68 7.886 13.541 -0.281 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.297 14.602 -0.215 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.753 14.118 3.311 1.00 0.00 H new ATOM 0 HH22 ARG A 68 10.385 14.936 1.879 1.00 0.00 H new ATOM 934 N GLN A 69 2.610 8.704 0.510 1.00 0.00 N ATOM 935 CA GLN A 69 1.357 8.338 -0.122 1.00 0.00 C ATOM 936 C GLN A 69 0.661 7.359 0.811 1.00 0.00 C ATOM 937 O GLN A 69 -0.560 7.427 0.859 1.00 0.00 O ATOM 938 CB GLN A 69 1.492 7.605 -1.463 1.00 0.00 C ATOM 939 CG GLN A 69 1.665 8.570 -2.633 1.00 0.00 C ATOM 940 CD GLN A 69 2.225 7.708 -3.762 1.00 0.00 C ATOM 941 OE1 GLN A 69 1.418 7.250 -4.562 1.00 0.00 O ATOM 942 NE2 GLN A 69 3.548 7.629 -3.898 1.00 0.00 N ATOM 0 H GLN A 69 3.429 8.430 -0.033 1.00 0.00 H new ATOM 0 HA GLN A 69 0.826 9.271 -0.310 1.00 0.00 H new ATOM 0 HB2 GLN A 69 2.347 6.930 -1.422 1.00 0.00 H new ATOM 0 HB3 GLN A 69 0.608 6.990 -1.629 1.00 0.00 H new ATOM 0 HG2 GLN A 69 0.716 9.025 -2.915 1.00 0.00 H new ATOM 0 HG3 GLN A 69 2.346 9.383 -2.380 1.00 0.00 H new ATOM 0 HE21 GLN A 69 4.159 8.035 -3.189 1.00 0.00 H new ATOM 0 HE22 GLN A 69 3.950 7.163 -4.711 1.00 0.00 H new ATOM 951 N LEU A 70 1.365 6.377 1.372 1.00 0.00 N ATOM 952 CA LEU A 70 0.666 5.298 2.036 1.00 0.00 C ATOM 953 C LEU A 70 -0.112 5.843 3.234 1.00 0.00 C ATOM 954 O LEU A 70 -1.254 5.385 3.376 1.00 0.00 O ATOM 955 CB LEU A 70 1.628 4.191 2.450 1.00 0.00 C ATOM 956 CG LEU A 70 2.208 3.396 1.277 1.00 0.00 C ATOM 957 CD1 LEU A 70 3.457 2.657 1.733 1.00 0.00 C ATOM 958 CD2 LEU A 70 1.135 2.484 0.663 1.00 0.00 C ATOM 0 H LEU A 70 2.383 6.312 1.378 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.044 4.857 1.336 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.448 4.631 3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.109 3.505 3.119 1.00 0.00 H new ATOM 0 HG LEU A 70 2.516 4.069 0.477 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.870 2.091 0.898 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.197 3.376 2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.200 1.974 2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.564 1.926 -0.169 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.774 1.787 1.419 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.304 3.091 0.303 1.00 0.00 H new ATOM 970 N GLU A 71 0.454 6.670 4.110 1.00 0.00 N ATOM 971 CA GLU A 71 -0.212 7.397 5.170 1.00 0.00 C ATOM 972 C GLU A 71 -1.434 8.205 4.784 1.00 0.00 C ATOM 973 O GLU A 71 -2.310 8.553 5.576 1.00 0.00 O ATOM 974 CB GLU A 71 0.865 8.339 5.680 1.00 0.00 C ATOM 975 CG GLU A 71 1.703 7.606 6.733 1.00 0.00 C ATOM 976 CD GLU A 71 2.716 8.544 7.389 1.00 0.00 C ATOM 977 OE1 GLU A 71 2.256 9.651 7.757 1.00 0.00 O ATOM 978 OE2 GLU A 71 3.896 8.236 7.645 1.00 0.00 O ATOM 0 H GLU A 71 1.456 6.857 4.091 1.00 0.00 H new ATOM 0 HA GLU A 71 -0.611 6.680 5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 71 1.498 8.669 4.857 1.00 0.00 H new ATOM 0 HB3 GLU A 71 0.412 9.231 6.112 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.047 7.186 7.495 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.226 6.771 6.267 1.00 0.00 H new ATOM 985 N LYS A 72 -1.512 8.559 3.494 1.00 0.00 N ATOM 986 CA LYS A 72 -2.574 9.387 2.951 1.00 0.00 C ATOM 987 C LYS A 72 -3.748 8.624 2.346 1.00 0.00 C ATOM 988 O LYS A 72 -4.861 9.101 2.504 1.00 0.00 O ATOM 989 CB LYS A 72 -1.929 10.372 1.970 1.00 0.00 C ATOM 990 CG LYS A 72 -1.307 11.559 2.712 1.00 0.00 C ATOM 991 CD LYS A 72 -0.549 12.421 1.705 1.00 0.00 C ATOM 992 CE LYS A 72 0.543 13.262 2.354 1.00 0.00 C ATOM 993 NZ LYS A 72 1.801 12.518 2.432 1.00 0.00 N ATOM 0 H LYS A 72 -0.826 8.270 2.797 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.050 9.919 3.775 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.163 9.861 1.387 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.678 10.732 1.265 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.083 12.146 3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.632 11.206 3.491 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.104 11.778 0.946 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.252 13.078 1.194 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.692 14.177 1.780 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.230 13.561 3.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.203 12.615 3.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.623 11.513 2.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.472 12.896 1.733 1.00 0.00 H new ATOM 1007 N ILE A 73 -3.509 7.688 1.432 1.00 0.00 N ATOM 1008 CA ILE A 73 -4.475 7.037 0.570 1.00 0.00 C ATOM 1009 C ILE A 73 -5.758 6.599 1.244 1.00 0.00 C ATOM 1010 O ILE A 73 -6.787 6.794 0.601 1.00 0.00 O ATOM 1011 CB ILE A 73 -3.862 5.902 -0.236 1.00 0.00 C ATOM 1012 CG1 ILE A 73 -3.095 4.917 0.656 1.00 0.00 C ATOM 1013 CG2 ILE A 73 -3.089 6.502 -1.413 1.00 0.00 C ATOM 1014 CD1 ILE A 73 -2.636 3.619 -0.013 1.00 0.00 C ATOM 0 H ILE A 73 -2.563 7.343 1.267 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.775 7.828 -0.118 1.00 0.00 H new ATOM 0 HB ILE A 73 -4.632 5.267 -0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.218 5.427 1.054 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.727 4.660 1.506 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.643 5.700 -2.002 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.770 7.077 -2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.303 7.156 -1.036 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -2.106 3.003 0.713 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.504 3.075 -0.385 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.971 3.853 -0.844 1.00 0.00 H new ATOM 1026 N LEU A 74 -5.746 5.888 2.374 1.00 0.00 N ATOM 1027 CA LEU A 74 -6.933 5.255 2.942 1.00 0.00 C ATOM 1028 C LEU A 74 -7.794 6.303 3.648 1.00 0.00 C ATOM 1029 O LEU A 74 -8.843 5.899 4.145 1.00 0.00 O ATOM 1030 CB LEU A 74 -6.430 4.109 3.798 1.00 0.00 C ATOM 1031 CG LEU A 74 -5.393 3.135 3.237 1.00 0.00 C ATOM 1032 CD1 LEU A 74 -5.355 1.937 4.183 1.00 0.00 C ATOM 1033 CD2 LEU A 74 -5.720 2.643 1.830 1.00 0.00 C ATOM 0 H LEU A 74 -4.901 5.735 2.925 1.00 0.00 H new ATOM 0 HA LEU A 74 -7.610 4.832 2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.010 4.542 4.706 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -7.298 3.522 4.097 1.00 0.00 H new ATOM 0 HG LEU A 74 -4.437 3.653 3.166 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -4.626 1.212 3.822 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.072 2.271 5.181 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -6.340 1.473 4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -4.943 1.956 1.495 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -6.680 2.128 1.839 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -5.771 3.493 1.150 1.00 0.00 H new ATOM 1045 N GLY A 75 -7.350 7.554 3.693 1.00 0.00 N ATOM 1046 CA GLY A 75 -7.940 8.602 4.502 1.00 0.00 C ATOM 1047 C GLY A 75 -7.593 8.443 5.975 1.00 0.00 C ATOM 1048 O GLY A 75 -7.996 9.231 6.826 1.00 0.00 O ATOM 0 H GLY A 75 -6.547 7.871 3.150 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -7.592 9.573 4.149 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.023 8.589 4.380 1.00 0.00 H new ATOM 1052 N ILE A 76 -6.821 7.434 6.382 1.00 0.00 N ATOM 1053 CA ILE A 76 -6.400 7.078 7.715 1.00 0.00 C ATOM 1054 C ILE A 76 -5.032 6.390 7.764 1.00 0.00 C ATOM 1055 O ILE A 76 -4.553 5.867 6.770 1.00 0.00 O ATOM 1056 CB ILE A 76 -7.492 6.215 8.343 1.00 0.00 C ATOM 1057 CG1 ILE A 76 -7.846 4.989 7.499 1.00 0.00 C ATOM 1058 CG2 ILE A 76 -8.786 6.911 8.774 1.00 0.00 C ATOM 1059 CD1 ILE A 76 -8.679 3.969 8.275 1.00 0.00 C ATOM 0 H ILE A 76 -6.439 6.780 5.699 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.264 7.994 8.289 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.001 5.918 9.270 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.398 5.307 6.614 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -6.929 4.515 7.149 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -9.469 6.177 9.202 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -8.558 7.673 9.519 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -9.253 7.379 7.908 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -8.904 3.118 7.632 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.118 3.628 9.145 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.610 4.433 8.602 1.00 0.00 H new ATOM 1071 N LYS A 77 -4.453 6.253 8.941 1.00 0.00 N ATOM 1072 CA LYS A 77 -3.144 5.680 9.208 1.00 0.00 C ATOM 1073 C LYS A 77 -2.870 5.713 10.714 1.00 0.00 C ATOM 1074 O LYS A 77 -3.559 6.467 11.403 1.00 0.00 O ATOM 1075 CB LYS A 77 -2.093 6.531 8.507 1.00 0.00 C ATOM 1076 CG LYS A 77 -1.679 7.882 9.100 1.00 0.00 C ATOM 1077 CD LYS A 77 -2.773 8.946 9.185 1.00 0.00 C ATOM 1078 CE LYS A 77 -2.216 10.327 9.546 1.00 0.00 C ATOM 1079 NZ LYS A 77 -2.250 10.608 10.990 1.00 0.00 N ATOM 0 H LYS A 77 -4.916 6.560 9.797 1.00 0.00 H new ATOM 0 HA LYS A 77 -3.111 4.651 8.849 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.191 5.925 8.420 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -2.450 6.718 7.494 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.289 7.711 10.103 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.859 8.281 8.503 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.294 9.005 8.229 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.509 8.648 9.931 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.187 10.400 9.193 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -2.789 11.091 9.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.860 11.556 11.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.233 10.568 11.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.681 9.899 11.495 1.00 0.00 H new ATOM 1093 N LEU A 78 -1.898 4.970 11.257 1.00 0.00 N ATOM 1094 CA LEU A 78 -1.706 4.891 12.691 1.00 0.00 C ATOM 1095 C LEU A 78 -0.238 4.636 13.006 1.00 0.00 C ATOM 1096 O LEU A 78 0.549 4.185 12.164 1.00 0.00 O ATOM 1097 CB LEU A 78 -2.435 3.741 13.380 1.00 0.00 C ATOM 1098 CG LEU A 78 -3.900 4.011 13.713 1.00 0.00 C ATOM 1099 CD1 LEU A 78 -4.535 2.851 14.466 1.00 0.00 C ATOM 1100 CD2 LEU A 78 -4.129 5.231 14.609 1.00 0.00 C ATOM 0 H LEU A 78 -1.235 4.417 10.714 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.094 5.842 13.055 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.380 2.861 12.739 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.908 3.497 14.302 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.347 4.173 12.732 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -5.577 3.085 14.683 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.485 1.950 13.855 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.998 2.686 15.400 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.196 5.350 14.796 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.608 5.090 15.556 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.746 6.123 14.114 1.00 0.00 H new ATOM 1112 N VAL A 79 0.291 5.159 14.105 1.00 0.00 N ATOM 1113 CA VAL A 79 -0.333 5.529 15.363 1.00 0.00 C ATOM 1114 C VAL A 79 -0.330 6.999 15.796 1.00 0.00 C ATOM 1115 O VAL A 79 0.497 7.730 15.259 1.00 0.00 O ATOM 1116 CB VAL A 79 0.293 4.744 16.504 1.00 0.00 C ATOM 1117 CG1 VAL A 79 -0.504 3.462 16.775 1.00 0.00 C ATOM 1118 CG2 VAL A 79 1.817 4.592 16.541 1.00 0.00 C ATOM 0 H VAL A 79 1.291 5.357 14.135 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.378 5.296 15.156 1.00 0.00 H new ATOM 0 HB VAL A 79 0.194 5.402 17.368 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -0.041 2.913 17.595 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.528 3.720 17.044 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.509 2.841 15.879 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.103 4.007 17.415 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.154 4.083 15.638 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.280 5.577 16.597 1.00 0.00 H new ATOM 1128 N THR A 80 -1.206 7.440 16.685 1.00 0.00 N ATOM 1129 CA THR A 80 -1.368 8.780 17.231 1.00 0.00 C ATOM 1130 C THR A 80 -0.729 8.951 18.591 1.00 0.00 C ATOM 1131 O THR A 80 -0.425 7.941 19.219 1.00 0.00 O ATOM 1132 CB THR A 80 -2.887 8.903 17.395 1.00 0.00 C ATOM 1133 OG1 THR A 80 -3.388 7.931 18.271 1.00 0.00 O ATOM 1134 CG2 THR A 80 -3.640 8.766 16.072 1.00 0.00 C ATOM 0 H THR A 80 -1.894 6.801 17.084 1.00 0.00 H new ATOM 0 HA THR A 80 -0.900 9.523 16.585 1.00 0.00 H new ATOM 0 HB THR A 80 -3.050 9.903 17.797 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.359 8.037 18.356 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.711 8.862 16.251 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.316 9.548 15.386 1.00 0.00 H new ATOM 0 HG23 THR A 80 -3.431 7.790 15.634 1.00 0.00 H new ATOM 1142 N PRO A 81 -0.649 10.175 19.122 1.00 0.00 N ATOM 1143 CA PRO A 81 -0.216 10.450 20.477 1.00 0.00 C ATOM 1144 C PRO A 81 -1.091 9.771 21.526 1.00 0.00 C ATOM 1145 O PRO A 81 -0.806 10.080 22.682 1.00 0.00 O ATOM 1146 CB PRO A 81 -0.471 11.953 20.632 1.00 0.00 C ATOM 1147 CG PRO A 81 -0.064 12.435 19.236 1.00 0.00 C ATOM 1148 CD PRO A 81 -0.688 11.381 18.324 1.00 0.00 C ATOM 0 HA PRO A 81 0.809 10.109 20.621 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -1.512 12.178 20.864 1.00 0.00 H new ATOM 0 HB3 PRO A 81 0.135 12.400 21.421 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.448 13.433 19.024 1.00 0.00 H new ATOM 0 HG3 PRO A 81 1.019 12.479 19.122 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -1.708 11.645 18.046 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -0.124 11.268 17.398 1.00 0.00 H new ATOM 1156 N LEU A 82 -1.977 8.841 21.201 1.00 0.00 N ATOM 1157 CA LEU A 82 -2.382 7.761 22.081 1.00 0.00 C ATOM 1158 C LEU A 82 -1.168 6.910 22.452 1.00 0.00 C ATOM 1159 O LEU A 82 -1.114 6.408 23.575 1.00 0.00 O ATOM 1160 CB LEU A 82 -3.510 7.023 21.364 1.00 0.00 C ATOM 1161 CG LEU A 82 -4.195 5.924 22.170 1.00 0.00 C ATOM 1162 CD1 LEU A 82 -4.810 6.456 23.466 1.00 0.00 C ATOM 1163 CD2 LEU A 82 -5.201 5.231 21.268 1.00 0.00 C ATOM 0 H LEU A 82 -2.444 8.818 20.295 1.00 0.00 H new ATOM 0 HA LEU A 82 -2.768 8.102 23.042 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.263 7.751 21.063 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -3.109 6.583 20.451 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.458 5.191 22.500 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.286 5.637 24.006 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.028 6.894 24.087 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.554 7.217 23.230 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.704 4.440 21.824 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.938 5.955 20.921 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.684 4.800 20.411 1.00 0.00 H new ATOM 1175 N GLU A 83 -0.172 6.730 21.580 1.00 0.00 N ATOM 1176 CA GLU A 83 1.074 6.091 21.952 1.00 0.00 C ATOM 1177 C GLU A 83 2.274 6.639 21.212 1.00 0.00 C ATOM 1178 O GLU A 83 3.369 6.097 21.307 1.00 0.00 O ATOM 1179 CB GLU A 83 0.948 4.575 21.824 1.00 0.00 C ATOM 1180 CG GLU A 83 0.839 4.092 20.394 1.00 0.00 C ATOM 1181 CD GLU A 83 1.015 2.583 20.423 1.00 0.00 C ATOM 1182 OE1 GLU A 83 2.131 2.006 20.349 1.00 0.00 O ATOM 1183 OE2 GLU A 83 0.006 1.840 20.503 1.00 0.00 O ATOM 0 H GLU A 83 -0.215 7.024 20.604 1.00 0.00 H new ATOM 0 HA GLU A 83 1.262 6.330 22.999 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.814 4.107 22.291 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.069 4.244 22.378 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.128 4.360 19.969 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.602 4.558 19.770 1.00 0.00 H new ATOM 1190 N ASN A 84 2.135 7.696 20.401 1.00 0.00 N ATOM 1191 CA ASN A 84 3.174 8.074 19.458 1.00 0.00 C ATOM 1192 C ASN A 84 2.806 9.356 18.714 1.00 0.00 C ATOM 1193 O ASN A 84 1.782 9.393 18.035 1.00 0.00 O ATOM 1194 CB ASN A 84 3.469 6.971 18.451 1.00 0.00 C ATOM 1195 CG ASN A 84 4.617 7.348 17.521 1.00 0.00 C ATOM 1196 OD1 ASN A 84 4.507 7.680 16.345 1.00 0.00 O ATOM 1197 ND2 ASN A 84 5.751 7.146 18.207 1.00 0.00 N ATOM 0 H ASN A 84 1.312 8.298 20.385 1.00 0.00 H new ATOM 0 HA ASN A 84 4.074 8.246 20.048 1.00 0.00 H new ATOM 0 HB2 ASN A 84 3.717 6.051 18.981 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.575 6.768 17.862 1.00 0.00 H new ATOM 0 HD21 ASN A 84 6.654 7.268 17.748 1.00 0.00 H new ATOM 0 HD22 ASN A 84 5.711 6.870 19.188 1.00 0.00 H new ATOM 1204 N ASN A 85 3.831 10.186 18.545 1.00 0.00 N ATOM 1205 CA ASN A 85 3.813 11.504 17.936 1.00 0.00 C ATOM 1206 C ASN A 85 5.005 11.537 16.994 1.00 0.00 C ATOM 1207 O ASN A 85 5.906 10.691 16.942 1.00 0.00 O ATOM 1208 CB ASN A 85 3.989 12.528 19.047 1.00 0.00 C ATOM 1209 CG ASN A 85 3.518 13.948 18.746 1.00 0.00 C ATOM 1210 OD1 ASN A 85 3.346 14.328 17.592 1.00 0.00 O ATOM 1211 ND2 ASN A 85 3.216 14.787 19.733 1.00 0.00 N ATOM 0 H ASN A 85 4.768 9.930 18.856 1.00 0.00 H new ATOM 0 HA ASN A 85 2.889 11.719 17.399 1.00 0.00 H new ATOM 0 HB2 ASN A 85 3.455 12.171 19.928 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.046 12.568 19.310 1.00 0.00 H new ATOM 0 HD21 ASN A 85 2.853 15.716 19.520 1.00 0.00 H new ATOM 0 HD22 ASN A 85 3.348 14.501 20.703 1.00 0.00 H new ATOM 1218 N GLU A 86 5.096 12.640 16.237 1.00 0.00 N ATOM 1219 CA GLU A 86 5.980 12.819 15.108 1.00 0.00 C ATOM 1220 C GLU A 86 6.007 14.299 14.771 1.00 0.00 C ATOM 1221 O GLU A 86 5.098 15.077 15.067 1.00 0.00 O ATOM 1222 CB GLU A 86 5.547 12.078 13.859 1.00 0.00 C ATOM 1223 CG GLU A 86 6.575 12.031 12.723 1.00 0.00 C ATOM 1224 CD GLU A 86 7.951 11.663 13.238 1.00 0.00 C ATOM 1225 OE1 GLU A 86 8.255 10.478 13.421 1.00 0.00 O ATOM 1226 OE2 GLU A 86 8.812 12.570 13.381 1.00 0.00 O ATOM 0 H GLU A 86 4.521 13.464 16.416 1.00 0.00 H new ATOM 0 HA GLU A 86 6.951 12.419 15.400 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.292 11.055 14.136 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.636 12.542 13.481 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.259 11.305 11.974 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.617 13.001 12.228 1.00 0.00 H new ATOM 1233 N GLU A 87 7.133 14.759 14.220 1.00 0.00 N ATOM 1234 CA GLU A 87 7.241 16.071 13.622 1.00 0.00 C ATOM 1235 C GLU A 87 6.104 16.341 12.636 1.00 0.00 C ATOM 1236 O GLU A 87 5.909 15.559 11.708 1.00 0.00 O ATOM 1237 CB GLU A 87 8.641 16.193 13.052 1.00 0.00 C ATOM 1238 CG GLU A 87 9.020 17.586 12.560 1.00 0.00 C ATOM 1239 CD GLU A 87 8.872 18.657 13.622 1.00 0.00 C ATOM 1240 OE1 GLU A 87 7.757 18.907 14.133 1.00 0.00 O ATOM 1241 OE2 GLU A 87 9.880 19.255 14.083 1.00 0.00 O ATOM 0 H GLU A 87 7.997 14.218 14.181 1.00 0.00 H new ATOM 0 HA GLU A 87 7.113 16.862 14.361 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.356 15.888 13.816 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.742 15.492 12.223 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.052 17.572 12.209 1.00 0.00 H new ATOM 0 HG3 GLU A 87 8.396 17.844 11.704 1.00 0.00 H new ATOM 1248 N SER A 88 5.430 17.478 12.767 1.00 0.00 N ATOM 1249 CA SER A 88 4.170 17.806 12.133 1.00 0.00 C ATOM 1250 C SER A 88 4.438 18.163 10.672 1.00 0.00 C ATOM 1251 O SER A 88 3.534 18.020 9.856 1.00 0.00 O ATOM 1252 CB SER A 88 3.512 18.974 12.890 1.00 0.00 C ATOM 1253 OG SER A 88 3.360 18.675 14.253 1.00 0.00 O ATOM 0 H SER A 88 5.774 18.237 13.355 1.00 0.00 H new ATOM 0 HA SER A 88 3.486 16.958 12.163 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.120 19.872 12.778 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.538 19.192 12.452 1.00 0.00 H new ATOM 0 HG SER A 88 2.941 19.434 14.710 1.00 0.00 H new ATOM 1259 N GLU A 89 5.608 18.668 10.251 1.00 0.00 N ATOM 1260 CA GLU A 89 5.966 18.951 8.883 1.00 0.00 C ATOM 1261 C GLU A 89 6.206 17.709 8.040 1.00 0.00 C ATOM 1262 O GLU A 89 6.076 17.839 6.828 1.00 0.00 O ATOM 1263 CB GLU A 89 7.117 19.946 8.761 1.00 0.00 C ATOM 1264 CG GLU A 89 6.759 21.294 9.381 1.00 0.00 C ATOM 1265 CD GLU A 89 7.892 22.078 10.010 1.00 0.00 C ATOM 1266 OE1 GLU A 89 8.207 21.767 11.177 1.00 0.00 O ATOM 1267 OE2 GLU A 89 8.381 23.034 9.366 1.00 0.00 O ATOM 0 H GLU A 89 6.358 18.896 10.903 1.00 0.00 H new ATOM 0 HA GLU A 89 5.082 19.432 8.465 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.002 19.542 9.252 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.371 20.084 7.710 1.00 0.00 H new ATOM 0 HG2 GLU A 89 6.305 21.914 8.608 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.998 21.126 10.143 1.00 0.00 H new ATOM 1274 N LYS A 90 6.186 16.503 8.610 1.00 0.00 N ATOM 1275 CA LYS A 90 6.303 15.333 7.766 1.00 0.00 C ATOM 1276 C LYS A 90 5.049 15.113 6.939 1.00 0.00 C ATOM 1277 O LYS A 90 5.062 14.587 5.821 1.00 0.00 O ATOM 1278 CB LYS A 90 6.768 14.130 8.590 1.00 0.00 C ATOM 1279 CG LYS A 90 8.233 14.278 9.014 1.00 0.00 C ATOM 1280 CD LYS A 90 8.720 13.223 9.981 1.00 0.00 C ATOM 1281 CE LYS A 90 10.238 13.157 9.935 1.00 0.00 C ATOM 1282 NZ LYS A 90 10.697 12.194 10.957 1.00 0.00 N ATOM 0 H LYS A 90 6.094 16.322 9.610 1.00 0.00 H new ATOM 0 HA LYS A 90 7.082 15.491 7.021 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.140 14.028 9.475 1.00 0.00 H new ATOM 0 HB3 LYS A 90 6.647 13.218 8.006 1.00 0.00 H new ATOM 0 HG2 LYS A 90 8.860 14.251 8.123 1.00 0.00 H new ATOM 0 HG3 LYS A 90 8.368 15.259 9.469 1.00 0.00 H new ATOM 0 HD2 LYS A 90 8.386 13.458 10.991 1.00 0.00 H new ATOM 0 HD3 LYS A 90 8.295 12.253 9.722 1.00 0.00 H new ATOM 0 HE2 LYS A 90 10.574 12.848 8.945 1.00 0.00 H new ATOM 0 HE3 LYS A 90 10.666 14.142 10.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 11.692 12.385 11.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 10.114 12.292 11.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 10.609 11.226 10.587 1.00 0.00 H new ATOM 1296 N GLU A 91 3.892 15.545 7.456 1.00 0.00 N ATOM 1297 CA GLU A 91 2.533 15.285 7.026 1.00 0.00 C ATOM 1298 C GLU A 91 2.143 15.666 5.620 1.00 0.00 C ATOM 1299 O GLU A 91 1.288 15.023 5.009 1.00 0.00 O ATOM 1300 CB GLU A 91 1.617 16.030 8.009 1.00 0.00 C ATOM 1301 CG GLU A 91 0.139 15.876 7.701 1.00 0.00 C ATOM 1302 CD GLU A 91 -0.699 16.167 8.937 1.00 0.00 C ATOM 1303 OE1 GLU A 91 -0.842 15.190 9.710 1.00 0.00 O ATOM 1304 OE2 GLU A 91 -1.262 17.274 9.115 1.00 0.00 O ATOM 0 H GLU A 91 3.899 16.151 8.276 1.00 0.00 H new ATOM 0 HA GLU A 91 2.435 14.199 7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 91 1.809 15.666 9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 91 1.873 17.089 7.999 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.143 16.555 6.896 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.061 14.864 7.349 1.00 0.00 H new ATOM 1311 N PHE A 92 2.890 16.586 5.003 1.00 0.00 N ATOM 1312 CA PHE A 92 2.681 17.034 3.643 1.00 0.00 C ATOM 1313 C PHE A 92 3.102 16.088 2.534 1.00 0.00 C ATOM 1314 O PHE A 92 3.581 14.981 2.784 1.00 0.00 O ATOM 1315 CB PHE A 92 3.366 18.400 3.522 1.00 0.00 C ATOM 1316 CG PHE A 92 2.805 19.410 4.497 1.00 0.00 C ATOM 1317 CD1 PHE A 92 1.706 20.188 4.094 1.00 0.00 C ATOM 1318 CD2 PHE A 92 3.348 19.597 5.755 1.00 0.00 C ATOM 1319 CE1 PHE A 92 1.190 21.193 4.925 1.00 0.00 C ATOM 1320 CE2 PHE A 92 2.858 20.568 6.649 1.00 0.00 C ATOM 1321 CZ PHE A 92 1.784 21.329 6.183 1.00 0.00 C ATOM 0 H PHE A 92 3.678 17.047 5.459 1.00 0.00 H new ATOM 0 HA PHE A 92 1.604 17.086 3.482 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.436 18.285 3.697 1.00 0.00 H new ATOM 0 HB3 PHE A 92 3.248 18.775 2.505 1.00 0.00 H new ATOM 0 HD1 PHE A 92 1.252 20.009 3.130 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.177 18.977 6.062 1.00 0.00 H new ATOM 0 HE1 PHE A 92 0.376 21.829 4.609 1.00 0.00 H new ATOM 0 HE2 PHE A 92 3.285 20.715 7.630 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.381 22.081 6.846 1.00 0.00 H new ATOM 1331 N ASP A 93 2.974 16.458 1.248 1.00 0.00 N ATOM 1332 CA ASP A 93 3.425 15.708 0.100 1.00 0.00 C ATOM 1333 C ASP A 93 4.894 15.826 -0.251 1.00 0.00 C ATOM 1334 O ASP A 93 5.459 14.767 -0.499 1.00 0.00 O ATOM 1335 CB ASP A 93 2.531 16.127 -1.073 1.00 0.00 C ATOM 1336 CG ASP A 93 3.146 15.661 -2.382 1.00 0.00 C ATOM 1337 OD1 ASP A 93 3.911 16.405 -3.035 1.00 0.00 O ATOM 1338 OD2 ASP A 93 2.683 14.614 -2.913 1.00 0.00 O ATOM 0 H ASP A 93 2.528 17.337 0.985 1.00 0.00 H new ATOM 0 HA ASP A 93 3.335 14.650 0.345 1.00 0.00 H new ATOM 0 HB2 ASP A 93 1.536 15.698 -0.955 1.00 0.00 H new ATOM 0 HB3 ASP A 93 2.412 17.210 -1.082 1.00 0.00 H new ATOM 1343 N ASP A 94 5.561 16.963 -0.006 1.00 0.00 N ATOM 1344 CA ASP A 94 7.014 16.981 -0.099 1.00 0.00 C ATOM 1345 C ASP A 94 7.684 17.773 1.013 1.00 0.00 C ATOM 1346 O ASP A 94 8.863 17.533 1.297 1.00 0.00 O ATOM 1347 CB ASP A 94 7.501 17.471 -1.455 1.00 0.00 C ATOM 1348 CG ASP A 94 8.975 17.404 -1.808 1.00 0.00 C ATOM 1349 OD1 ASP A 94 9.413 16.227 -1.893 1.00 0.00 O ATOM 1350 OD2 ASP A 94 9.672 18.388 -2.146 1.00 0.00 O ATOM 0 H ASP A 94 5.129 17.851 0.249 1.00 0.00 H new ATOM 0 HA ASP A 94 7.312 15.939 0.021 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.961 16.907 -2.215 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.193 18.512 -1.552 1.00 0.00 H new ATOM 1355 N THR A 95 7.074 18.902 1.392 1.00 0.00 N ATOM 1356 CA THR A 95 7.635 19.956 2.213 1.00 0.00 C ATOM 1357 C THR A 95 6.511 20.654 2.951 1.00 0.00 C ATOM 1358 O THR A 95 5.392 20.778 2.450 1.00 0.00 O ATOM 1359 CB THR A 95 8.290 21.048 1.377 1.00 0.00 C ATOM 1360 OG1 THR A 95 7.571 21.231 0.168 1.00 0.00 O ATOM 1361 CG2 THR A 95 9.657 20.550 0.910 1.00 0.00 C ATOM 0 H THR A 95 6.115 19.107 1.110 1.00 0.00 H new ATOM 0 HA THR A 95 8.366 19.485 2.870 1.00 0.00 H new ATOM 0 HB THR A 95 8.332 21.954 1.981 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.998 21.936 -0.363 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.139 21.321 0.309 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.278 20.324 1.777 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.530 19.649 0.310 1.00 0.00 H new ATOM 1369 N GLY A 96 6.841 21.238 4.111 1.00 0.00 N ATOM 1370 CA GLY A 96 5.866 21.918 4.944 1.00 0.00 C ATOM 1371 C GLY A 96 5.462 23.229 4.301 1.00 0.00 C ATOM 1372 O GLY A 96 6.165 23.768 3.448 1.00 0.00 O ATOM 0 H GLY A 96 7.789 21.247 4.488 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.989 21.286 5.082 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.285 22.102 5.933 1.00 0.00 H new ATOM 1376 N LEU A 97 4.317 23.744 4.758 1.00 0.00 N ATOM 1377 CA LEU A 97 3.575 24.767 4.064 1.00 0.00 C ATOM 1378 C LEU A 97 3.893 26.210 4.452 1.00 0.00 C ATOM 1379 O LEU A 97 4.016 27.126 3.645 1.00 0.00 O ATOM 1380 CB LEU A 97 2.093 24.417 4.116 1.00 0.00 C ATOM 1381 CG LEU A 97 1.043 25.383 3.591 1.00 0.00 C ATOM 1382 CD1 LEU A 97 1.147 25.705 2.102 1.00 0.00 C ATOM 1383 CD2 LEU A 97 -0.362 24.827 3.803 1.00 0.00 C ATOM 0 H LEU A 97 3.885 23.449 5.634 1.00 0.00 H new ATOM 0 HA LEU A 97 3.912 24.760 3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.966 23.481 3.572 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.849 24.215 5.159 1.00 0.00 H new ATOM 0 HG LEU A 97 1.230 26.295 4.158 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.356 26.401 1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.117 26.157 1.894 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.043 24.787 1.523 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -1.096 25.536 3.419 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -0.462 23.879 3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.534 24.668 4.868 1.00 0.00 H new ATOM 1395 N THR A 98 4.239 26.331 5.744 1.00 0.00 N ATOM 1396 CA THR A 98 4.388 27.546 6.507 1.00 0.00 C ATOM 1397 C THR A 98 5.793 27.739 7.055 1.00 0.00 C ATOM 1398 O THR A 98 6.417 26.741 7.404 1.00 0.00 O ATOM 1399 CB THR A 98 3.392 27.511 7.666 1.00 0.00 C ATOM 1400 OG1 THR A 98 2.174 27.670 6.977 1.00 0.00 O ATOM 1401 CG2 THR A 98 3.603 28.630 8.661 1.00 0.00 C ATOM 0 H THR A 98 4.434 25.506 6.312 1.00 0.00 H new ATOM 0 HA THR A 98 4.196 28.384 5.837 1.00 0.00 H new ATOM 0 HB THR A 98 3.468 26.609 8.273 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.432 27.663 7.618 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.865 28.551 9.460 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.605 28.557 9.084 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.491 29.590 8.158 1.00 0.00 H new ATOM 1409 N LEU A 99 6.309 28.982 7.052 1.00 0.00 N ATOM 1410 CA LEU A 99 7.576 29.349 7.646 1.00 0.00 C ATOM 1411 C LEU A 99 7.367 29.821 9.076 1.00 0.00 C ATOM 1412 O LEU A 99 6.370 30.488 9.293 1.00 0.00 O ATOM 1413 CB LEU A 99 8.136 30.521 6.839 1.00 0.00 C ATOM 1414 CG LEU A 99 9.228 31.371 7.517 1.00 0.00 C ATOM 1415 CD1 LEU A 99 10.504 30.550 7.643 1.00 0.00 C ATOM 1416 CD2 LEU A 99 9.381 32.724 6.824 1.00 0.00 C ATOM 0 H LEU A 99 5.829 29.771 6.619 1.00 0.00 H new ATOM 0 HA LEU A 99 8.250 28.492 7.644 1.00 0.00 H new ATOM 0 HB2 LEU A 99 8.541 30.129 5.906 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.308 31.179 6.575 1.00 0.00 H new ATOM 0 HG LEU A 99 8.939 31.629 8.536 1.00 0.00 H new ATOM 0 HD11 LEU A 99 11.277 31.150 8.122 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.308 29.663 8.245 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.842 30.248 6.652 1.00 0.00 H new ATOM 0 HD21 LEU A 99 10.158 33.303 7.323 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.657 32.569 5.781 1.00 0.00 H new ATOM 0 HD23 LEU A 99 8.437 33.267 6.873 1.00 0.00 H new ATOM 1428 N GLY A 100 8.106 29.253 10.035 1.00 0.00 N ATOM 1429 CA GLY A 100 7.935 29.572 11.443 1.00 0.00 C ATOM 1430 C GLY A 100 8.756 30.783 11.865 1.00 0.00 C ATOM 1431 O GLY A 100 8.479 31.332 12.932 1.00 0.00 O ATOM 0 H GLY A 100 8.834 28.563 9.851 1.00 0.00 H new ATOM 0 HA2 GLY A 100 6.881 29.762 11.645 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.225 28.711 12.046 1.00 0.00 H new ATOM 1435 N ASP A 101 9.739 31.222 11.087 1.00 0.00 N ATOM 1436 CA ASP A 101 10.903 31.834 11.683 1.00 0.00 C ATOM 1437 C ASP A 101 10.913 33.349 11.868 1.00 0.00 C ATOM 1438 O ASP A 101 11.949 33.978 12.034 1.00 0.00 O ATOM 1439 CB ASP A 101 12.210 31.324 11.079 1.00 0.00 C ATOM 1440 CG ASP A 101 13.389 31.388 12.043 1.00 0.00 C ATOM 1441 OD1 ASP A 101 13.221 31.755 13.221 1.00 0.00 O ATOM 1442 OD2 ASP A 101 14.527 31.071 11.658 1.00 0.00 O ATOM 0 H ASP A 101 9.749 31.165 10.069 1.00 0.00 H new ATOM 0 HA ASP A 101 10.819 31.482 12.711 1.00 0.00 H new ATOM 0 HB2 ASP A 101 12.073 30.293 10.753 1.00 0.00 H new ATOM 0 HB3 ASP A 101 12.444 31.911 10.191 1.00 0.00 H new ATOM 1447 N VAL A 102 9.688 33.865 12.008 1.00 0.00 N ATOM 1448 CA VAL A 102 9.176 35.195 11.737 1.00 0.00 C ATOM 1449 C VAL A 102 8.185 35.728 12.781 1.00 0.00 C ATOM 1450 O VAL A 102 7.648 34.901 13.530 1.00 0.00 O ATOM 1451 CB VAL A 102 8.277 35.060 10.511 1.00 0.00 C ATOM 1452 CG1 VAL A 102 9.072 35.414 9.253 1.00 0.00 C ATOM 1453 CG2 VAL A 102 7.421 33.836 10.208 1.00 0.00 C ATOM 0 H VAL A 102 8.939 33.271 12.363 1.00 0.00 H new ATOM 0 HA VAL A 102 10.048 35.846 11.674 1.00 0.00 H new ATOM 0 HB VAL A 102 7.494 35.751 10.823 1.00 0.00 H new ATOM 0 HG11 VAL A 102 8.430 35.317 8.378 1.00 0.00 H new ATOM 0 HG12 VAL A 102 9.433 36.440 9.327 1.00 0.00 H new ATOM 0 HG13 VAL A 102 9.921 34.737 9.157 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.877 33.994 9.277 1.00 0.00 H new ATOM 0 HG22 VAL A 102 8.061 32.959 10.110 1.00 0.00 H new ATOM 0 HG23 VAL A 102 6.712 33.678 11.020 1.00 0.00 H new ATOM 1463 N VAL A 103 7.801 36.953 13.134 1.00 0.00 N ATOM 1464 CA VAL A 103 8.196 37.951 12.154 1.00 0.00 C ATOM 1465 C VAL A 103 9.488 38.636 12.605 1.00 0.00 C ATOM 1466 O VAL A 103 9.865 39.618 11.968 1.00 0.00 O ATOM 1467 CB VAL A 103 7.074 38.959 11.935 1.00 0.00 C ATOM 1468 CG1 VAL A 103 5.968 38.291 11.121 1.00 0.00 C ATOM 1469 CG2 VAL A 103 6.405 39.533 13.178 1.00 0.00 C ATOM 0 H VAL A 103 7.291 37.251 13.966 1.00 0.00 H new ATOM 0 HA VAL A 103 8.386 37.462 11.198 1.00 0.00 H new ATOM 0 HB VAL A 103 7.569 39.795 11.441 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.158 39.001 10.957 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.368 37.968 10.160 1.00 0.00 H new ATOM 0 HG13 VAL A 103 5.588 37.426 11.665 1.00 0.00 H new ATOM 0 HG21 VAL A 103 5.626 40.235 12.881 1.00 0.00 H new ATOM 0 HG22 VAL A 103 5.962 38.724 13.759 1.00 0.00 H new ATOM 0 HG23 VAL A 103 7.148 40.051 13.785 1.00 0.00 H new ATOM 1479 N ASN A 104 10.165 38.178 13.650 1.00 0.00 N ATOM 1480 CA ASN A 104 11.413 38.774 14.106 1.00 0.00 C ATOM 1481 C ASN A 104 12.495 38.744 13.046 1.00 0.00 C ATOM 1482 O ASN A 104 12.946 37.681 12.629 1.00 0.00 O ATOM 1483 CB ASN A 104 11.710 37.963 15.360 1.00 0.00 C ATOM 1484 CG ASN A 104 13.033 38.339 16.001 1.00 0.00 C ATOM 1485 OD1 ASN A 104 14.113 37.906 15.616 1.00 0.00 O ATOM 1486 ND2 ASN A 104 13.097 39.354 16.861 1.00 0.00 N ATOM 0 H ASN A 104 9.862 37.379 14.207 1.00 0.00 H new ATOM 0 HA ASN A 104 11.355 39.842 14.316 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.907 38.110 16.082 1.00 0.00 H new ATOM 0 HB3 ASN A 104 11.722 36.903 15.108 1.00 0.00 H new ATOM 0 HD21 ASN A 104 14.004 39.717 17.154 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.239 39.768 17.226 1.00 0.00 H new ATOM 1493 N ILE A 105 13.005 39.936 12.695 1.00 0.00 N ATOM 1494 CA ILE A 105 14.029 40.177 11.711 1.00 0.00 C ATOM 1495 C ILE A 105 15.385 40.405 12.387 1.00 0.00 C ATOM 1496 O ILE A 105 15.473 40.980 13.457 1.00 0.00 O ATOM 1497 CB ILE A 105 13.766 41.275 10.683 1.00 0.00 C ATOM 1498 CG1 ILE A 105 12.517 40.922 9.866 1.00 0.00 C ATOM 1499 CG2 ILE A 105 14.878 41.512 9.677 1.00 0.00 C ATOM 1500 CD1 ILE A 105 11.997 42.174 9.137 1.00 0.00 C ATOM 0 H ILE A 105 12.681 40.800 13.129 1.00 0.00 H new ATOM 0 HA ILE A 105 14.027 39.261 11.121 1.00 0.00 H new ATOM 0 HB ILE A 105 13.663 42.181 11.280 1.00 0.00 H new ATOM 0 HG12 ILE A 105 12.753 40.141 9.143 1.00 0.00 H new ATOM 0 HG13 ILE A 105 11.743 40.525 10.522 1.00 0.00 H new ATOM 0 HG21 ILE A 105 14.588 42.311 8.995 1.00 0.00 H new ATOM 0 HG22 ILE A 105 15.789 41.797 10.203 1.00 0.00 H new ATOM 0 HG23 ILE A 105 15.057 40.598 9.110 1.00 0.00 H new ATOM 0 HD11 ILE A 105 11.110 41.916 8.559 1.00 0.00 H new ATOM 0 HD12 ILE A 105 11.743 42.942 9.868 1.00 0.00 H new ATOM 0 HD13 ILE A 105 12.769 42.552 8.467 1.00 0.00 H new ATOM 1512 N LYS A 106 16.427 39.754 11.845 1.00 0.00 N ATOM 1513 CA LYS A 106 17.684 39.524 12.515 1.00 0.00 C ATOM 1514 C LYS A 106 18.708 40.506 11.954 1.00 0.00 C ATOM 1515 O LYS A 106 19.776 40.644 12.551 1.00 0.00 O ATOM 1516 CB LYS A 106 18.163 38.118 12.191 1.00 0.00 C ATOM 1517 CG LYS A 106 17.248 36.926 12.407 1.00 0.00 C ATOM 1518 CD LYS A 106 16.779 36.877 13.860 1.00 0.00 C ATOM 1519 CE LYS A 106 15.905 35.698 14.269 1.00 0.00 C ATOM 1520 NZ LYS A 106 14.664 35.646 13.491 1.00 0.00 N ATOM 0 H LYS A 106 16.401 39.369 10.901 1.00 0.00 H new ATOM 0 HA LYS A 106 17.566 39.649 13.591 1.00 0.00 H new ATOM 0 HB2 LYS A 106 18.458 38.112 11.142 1.00 0.00 H new ATOM 0 HB3 LYS A 106 19.065 37.942 12.777 1.00 0.00 H new ATOM 0 HG2 LYS A 106 16.387 36.994 11.742 1.00 0.00 H new ATOM 0 HG3 LYS A 106 17.774 36.005 12.156 1.00 0.00 H new ATOM 0 HD2 LYS A 106 17.661 36.882 14.500 1.00 0.00 H new ATOM 0 HD3 LYS A 106 16.228 37.794 14.069 1.00 0.00 H new ATOM 0 HE2 LYS A 106 16.459 34.770 14.132 1.00 0.00 H new ATOM 0 HE3 LYS A 106 15.666 35.773 15.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 13.955 35.085 14.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 14.304 36.611 13.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 14.851 35.205 12.568 1.00 0.00 H new ATOM 1534 N GLU A 107 18.408 41.071 10.786 1.00 0.00 N ATOM 1535 CA GLU A 107 18.865 42.354 10.313 1.00 0.00 C ATOM 1536 C GLU A 107 18.258 43.459 11.159 1.00 0.00 C ATOM 1537 O GLU A 107 18.450 44.661 10.932 1.00 0.00 O ATOM 1538 CB GLU A 107 18.397 42.364 8.859 1.00 0.00 C ATOM 1539 CG GLU A 107 18.515 43.626 8.019 1.00 0.00 C ATOM 1540 CD GLU A 107 18.153 43.253 6.584 1.00 0.00 C ATOM 1541 OE1 GLU A 107 19.001 42.680 5.864 1.00 0.00 O ATOM 1542 OE2 GLU A 107 17.137 43.759 6.058 1.00 0.00 O ATOM 0 H GLU A 107 17.801 40.607 10.111 1.00 0.00 H new ATOM 0 HA GLU A 107 19.940 42.517 10.383 1.00 0.00 H new ATOM 0 HB2 GLU A 107 18.946 41.579 8.339 1.00 0.00 H new ATOM 0 HB3 GLU A 107 17.346 42.073 8.857 1.00 0.00 H new ATOM 0 HG2 GLU A 107 17.847 44.401 8.395 1.00 0.00 H new ATOM 0 HG3 GLU A 107 19.528 44.027 8.068 1.00 0.00 H new ATOM 1549 N GLY A 108 17.304 43.142 12.043 1.00 0.00 N ATOM 1550 CA GLY A 108 16.417 44.125 12.625 1.00 0.00 C ATOM 1551 C GLY A 108 16.952 45.015 13.726 1.00 0.00 C ATOM 1552 O GLY A 108 16.183 45.653 14.445 1.00 0.00 O ATOM 0 H GLY A 108 17.135 42.190 12.368 1.00 0.00 H new ATOM 0 HA2 GLY A 108 16.062 44.769 11.821 1.00 0.00 H new ATOM 0 HA3 GLY A 108 15.548 43.597 13.018 1.00 0.00 H new ATOM 1556 N LYS A 109 18.265 44.943 14.009 1.00 0.00 N ATOM 1557 CA LYS A 109 19.003 45.872 14.854 1.00 0.00 C ATOM 1558 C LYS A 109 20.216 46.439 14.133 1.00 0.00 C ATOM 1559 O LYS A 109 21.191 46.682 14.828 1.00 0.00 O ATOM 1560 CB LYS A 109 19.412 45.096 16.100 1.00 0.00 C ATOM 1561 CG LYS A 109 18.298 44.575 17.012 1.00 0.00 C ATOM 1562 CD LYS A 109 18.960 43.908 18.226 1.00 0.00 C ATOM 1563 CE LYS A 109 17.896 43.429 19.210 1.00 0.00 C ATOM 1564 NZ LYS A 109 17.273 44.499 19.998 1.00 0.00 N ATOM 0 H LYS A 109 18.857 44.201 13.635 1.00 0.00 H new ATOM 0 HA LYS A 109 18.383 46.730 15.116 1.00 0.00 H new ATOM 0 HB2 LYS A 109 20.011 44.243 15.782 1.00 0.00 H new ATOM 0 HB3 LYS A 109 20.061 45.737 16.696 1.00 0.00 H new ATOM 0 HG2 LYS A 109 17.651 45.393 17.331 1.00 0.00 H new ATOM 0 HG3 LYS A 109 17.670 43.861 16.479 1.00 0.00 H new ATOM 0 HD2 LYS A 109 19.570 43.065 17.900 1.00 0.00 H new ATOM 0 HD3 LYS A 109 19.629 44.614 18.718 1.00 0.00 H new ATOM 0 HE2 LYS A 109 17.118 42.902 18.657 1.00 0.00 H new ATOM 0 HE3 LYS A 109 18.347 42.708 19.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 16.564 44.090 20.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 18.002 44.989 20.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 16.811 45.177 19.359 1.00 0.00 H new ATOM 1578 N LYS A 110 20.283 46.499 12.807 1.00 0.00 N ATOM 1579 CA LYS A 110 21.282 47.091 11.926 1.00 0.00 C ATOM 1580 C LYS A 110 21.300 48.611 11.922 1.00 0.00 C ATOM 1581 O LYS A 110 20.732 49.228 11.015 1.00 0.00 O ATOM 1582 CB LYS A 110 21.165 46.386 10.578 1.00 0.00 C ATOM 1583 CG LYS A 110 22.303 46.857 9.689 1.00 0.00 C ATOM 1584 CD LYS A 110 22.726 45.747 8.718 1.00 0.00 C ATOM 1585 CE LYS A 110 23.556 46.302 7.577 1.00 0.00 C ATOM 1586 NZ LYS A 110 23.874 45.245 6.611 1.00 0.00 N ATOM 0 H LYS A 110 19.538 46.077 12.253 1.00 0.00 H new ATOM 0 HA LYS A 110 22.289 46.914 12.304 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.210 45.305 10.710 1.00 0.00 H new ATOM 0 HB3 LYS A 110 20.204 46.611 10.115 1.00 0.00 H new ATOM 0 HG2 LYS A 110 21.993 47.739 9.129 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.153 47.153 10.304 1.00 0.00 H new ATOM 0 HD2 LYS A 110 23.300 44.991 9.254 1.00 0.00 H new ATOM 0 HD3 LYS A 110 21.840 45.252 8.319 1.00 0.00 H new ATOM 0 HE2 LYS A 110 23.011 47.105 7.080 1.00 0.00 H new ATOM 0 HE3 LYS A 110 24.477 46.736 7.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 24.443 45.642 5.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 24.413 44.492 7.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 22.992 44.850 6.226 1.00 0.00 H new ATOM 1600 N LEU A 111 21.873 49.251 12.940 1.00 0.00 N ATOM 1601 CA LEU A 111 21.885 50.642 13.324 1.00 0.00 C ATOM 1602 C LEU A 111 22.871 50.792 14.467 1.00 0.00 C ATOM 1603 O LEU A 111 23.445 49.783 14.895 1.00 0.00 O ATOM 1604 CB LEU A 111 20.477 51.214 13.524 1.00 0.00 C ATOM 1605 CG LEU A 111 19.478 50.460 14.398 1.00 0.00 C ATOM 1606 CD1 LEU A 111 19.877 50.411 15.877 1.00 0.00 C ATOM 1607 CD2 LEU A 111 18.088 51.066 14.193 1.00 0.00 C ATOM 0 H LEU A 111 22.421 48.710 13.609 1.00 0.00 H new ATOM 0 HA LEU A 111 22.246 51.283 12.519 1.00 0.00 H new ATOM 0 HB2 LEU A 111 20.587 52.215 13.942 1.00 0.00 H new ATOM 0 HB3 LEU A 111 20.027 51.328 12.538 1.00 0.00 H new ATOM 0 HG LEU A 111 19.470 49.416 14.084 1.00 0.00 H new ATOM 0 HD11 LEU A 111 19.123 49.860 16.439 1.00 0.00 H new ATOM 0 HD12 LEU A 111 20.841 49.912 15.978 1.00 0.00 H new ATOM 0 HD13 LEU A 111 19.952 51.426 16.268 1.00 0.00 H new ATOM 0 HD21 LEU A 111 17.365 50.536 14.812 1.00 0.00 H new ATOM 0 HD22 LEU A 111 18.105 52.119 14.475 1.00 0.00 H new ATOM 0 HD23 LEU A 111 17.803 50.976 13.145 1.00 0.00 H new ATOM 1619 N GLU A 112 23.055 52.007 14.976 1.00 0.00 N ATOM 1620 CA GLU A 112 24.021 52.312 16.008 1.00 0.00 C ATOM 1621 C GLU A 112 23.409 53.419 16.847 1.00 0.00 C ATOM 1622 O GLU A 112 22.495 53.226 17.655 1.00 0.00 O ATOM 1623 CB GLU A 112 25.431 52.455 15.473 1.00 0.00 C ATOM 1624 CG GLU A 112 26.419 52.859 16.559 1.00 0.00 C ATOM 1625 CD GLU A 112 27.818 52.633 15.973 1.00 0.00 C ATOM 1626 OE1 GLU A 112 28.263 53.301 15.005 1.00 0.00 O ATOM 1627 OE2 GLU A 112 28.497 51.699 16.446 1.00 0.00 O ATOM 0 H GLU A 112 22.521 52.820 14.670 1.00 0.00 H new ATOM 0 HA GLU A 112 24.209 51.489 16.698 1.00 0.00 H new ATOM 0 HB2 GLU A 112 25.747 51.511 15.029 1.00 0.00 H new ATOM 0 HB3 GLU A 112 25.442 53.201 14.678 1.00 0.00 H new ATOM 0 HG2 GLU A 112 26.280 53.902 16.843 1.00 0.00 H new ATOM 0 HG3 GLU A 112 26.273 52.262 17.459 1.00 0.00 H new ATOM 1634 N HIS A 113 23.927 54.637 16.639 1.00 0.00 N ATOM 1635 CA HIS A 113 23.683 55.820 17.434 1.00 0.00 C ATOM 1636 C HIS A 113 22.466 56.657 17.064 1.00 0.00 C ATOM 1637 O HIS A 113 22.141 57.615 17.776 1.00 0.00 O ATOM 1638 CB HIS A 113 24.953 56.659 17.564 1.00 0.00 C ATOM 1639 CG HIS A 113 25.432 57.439 16.378 1.00 0.00 C ATOM 1640 ND1 HIS A 113 25.392 57.124 15.016 1.00 0.00 N ATOM 1641 CD2 HIS A 113 26.112 58.608 16.593 1.00 0.00 C ATOM 1642 CE1 HIS A 113 25.975 58.198 14.487 1.00 0.00 C ATOM 1643 NE2 HIS A 113 26.400 59.146 15.348 1.00 0.00 N ATOM 0 H HIS A 113 24.563 54.820 15.863 1.00 0.00 H new ATOM 0 HA HIS A 113 23.405 55.431 18.414 1.00 0.00 H new ATOM 0 HB2 HIS A 113 24.800 57.364 18.381 1.00 0.00 H new ATOM 0 HB3 HIS A 113 25.759 55.991 17.866 1.00 0.00 H new ATOM 0 HD2 HIS A 113 26.374 59.031 17.551 1.00 0.00 H new ATOM 0 HE1 HIS A 113 26.102 58.305 13.420 1.00 0.00 H new ATOM 0 HE2 HIS A 113 26.831 60.045 15.134 1.00 0.00 H new ATOM 1651 N HIS A 114 21.859 56.266 15.950 1.00 0.00 N ATOM 1652 CA HIS A 114 20.619 56.709 15.362 1.00 0.00 C ATOM 1653 C HIS A 114 19.743 57.357 16.425 1.00 0.00 C ATOM 1654 O HIS A 114 19.196 56.626 17.281 1.00 0.00 O ATOM 1655 CB HIS A 114 20.028 55.473 14.716 1.00 0.00 C ATOM 1656 CG HIS A 114 20.779 54.807 13.597 1.00 0.00 C ATOM 1657 ND1 HIS A 114 22.091 54.343 13.698 1.00 0.00 N ATOM 1658 CD2 HIS A 114 20.288 54.574 12.326 1.00 0.00 C ATOM 1659 CE1 HIS A 114 22.306 53.814 12.501 1.00 0.00 C ATOM 1660 NE2 HIS A 114 21.265 53.864 11.669 1.00 0.00 N ATOM 0 H HIS A 114 22.285 55.541 15.373 1.00 0.00 H new ATOM 0 HA HIS A 114 20.737 57.485 14.606 1.00 0.00 H new ATOM 0 HB2 HIS A 114 19.879 54.731 15.500 1.00 0.00 H new ATOM 0 HB3 HIS A 114 19.041 55.739 14.338 1.00 0.00 H new ATOM 0 HD2 HIS A 114 19.333 54.886 11.930 1.00 0.00 H new ATOM 0 HE1 HIS A 114 23.253 53.376 12.221 1.00 0.00 H new ATOM 0 HE2 HIS A 114 21.206 53.458 10.735 1.00 0.00 H new TER 1668 HIS A 114