USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 946 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 78 SER OG : rot 178:sc= 0.37 USER MOD Set 1.2: A 127 TYR OH : rot 180:sc= 0.301 USER MOD Set 2.1: A 19 GLN : amide:sc= 2.65 K(o=2,f=-7.6!) USER MOD Set 2.2: A 93 MET CE :methyl -168:sc= -0.639 (180deg=-1.02) USER MOD Set 3.1: A 37 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 69 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 12 MET CE :methyl -120:sc= 0 (180deg=-0.104) USER MOD Set 4.2: A 68 THR OG1 : rot -66:sc= 1.18 USER MOD Set 5.1: A 63 LYS NZ :NH3+ 160:sc= 1.05 (180deg=0) USER MOD Set 5.2: A 65 THR OG1 : rot 171:sc= 0.914 USER MOD Set 6.1: A 25 SER OG : rot -160:sc= 0 USER MOD Set 6.2: A 90 ASN : amide:sc= 0.266 X(o=0.27,f=0.45) USER MOD Single : A 1 GLY N :NH3+ -122:sc= 1.32 (180deg=-0.604) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 150:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= 1.43 (180deg=1.11) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.103 K(o=-0.1,f=-1.7!) USER MOD Single : A 38 GLN : amide:sc= -0.229 K(o=-0.23,f=-2.5!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 158:sc= 0.961 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot -78:sc= 0.728 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0.325 USER MOD Single : A 71 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.119) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.075) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0273) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 18:sc= 1.27 USER MOD Single : A 117 LYS NZ :NH3+ -163:sc= -0.0316 (180deg=-0.304) USER MOD Single : A 120 SER OG : rot 34:sc= 1.11 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.0707 USER MOD Single : A 125 ASN : amide:sc= -0.0801 X(o=-0.08,f=-0.1) USER MOD Single : A 128 TYR OH : rot 30:sc= -0.171 USER MOD Single : A 129 ASN : amide:sc= -0.295 K(o=-0.29,f=-2.2) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 33.778 -15.707 -2.765 1.00 0.00 N ATOM 2 CA GLY A 1 34.264 -14.331 -2.651 1.00 0.00 C ATOM 3 C GLY A 1 33.344 -13.673 -1.663 1.00 0.00 C ATOM 4 O GLY A 1 33.749 -13.500 -0.518 1.00 0.00 O ATOM 0 H1 GLY A 1 34.542 -16.367 -2.514 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.974 -15.846 -2.120 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.472 -15.887 -3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 1 35.297 -14.305 -2.305 1.00 0.00 H new ATOM 0 HA3 GLY A 1 34.237 -13.822 -3.615 1.00 0.00 H new ATOM 8 N ASP A 2 32.092 -13.502 -2.089 1.00 0.00 N ATOM 9 CA ASP A 2 30.925 -13.223 -1.267 1.00 0.00 C ATOM 10 C ASP A 2 31.069 -11.758 -0.875 1.00 0.00 C ATOM 11 O ASP A 2 31.426 -11.382 0.241 1.00 0.00 O ATOM 12 CB ASP A 2 30.736 -14.275 -0.151 1.00 0.00 C ATOM 13 CG ASP A 2 30.675 -15.701 -0.725 1.00 0.00 C ATOM 14 OD1 ASP A 2 31.724 -16.259 -1.135 1.00 0.00 O ATOM 15 OD2 ASP A 2 29.555 -16.248 -0.861 1.00 0.00 O ATOM 0 H ASP A 2 31.856 -13.559 -3.080 1.00 0.00 H new ATOM 0 HA ASP A 2 29.969 -13.333 -1.779 1.00 0.00 H new ATOM 0 HB2 ASP A 2 31.558 -14.203 0.561 1.00 0.00 H new ATOM 0 HB3 ASP A 2 29.819 -14.063 0.399 1.00 0.00 H new ATOM 20 N ASP A 3 30.916 -10.940 -1.913 1.00 0.00 N ATOM 21 CA ASP A 3 31.711 -9.798 -2.294 1.00 0.00 C ATOM 22 C ASP A 3 30.786 -8.876 -3.077 1.00 0.00 C ATOM 23 O ASP A 3 29.829 -9.318 -3.714 1.00 0.00 O ATOM 24 CB ASP A 3 32.911 -10.223 -3.175 1.00 0.00 C ATOM 25 CG ASP A 3 32.571 -11.078 -4.397 1.00 0.00 C ATOM 26 OD1 ASP A 3 31.951 -10.536 -5.337 1.00 0.00 O ATOM 27 OD2 ASP A 3 32.919 -12.285 -4.406 1.00 0.00 O ATOM 0 H ASP A 3 30.149 -11.085 -2.570 1.00 0.00 H new ATOM 0 HA ASP A 3 32.123 -9.303 -1.414 1.00 0.00 H new ATOM 0 HB2 ASP A 3 33.424 -9.323 -3.516 1.00 0.00 H new ATOM 0 HB3 ASP A 3 33.616 -10.775 -2.554 1.00 0.00 H new ATOM 32 N ASP A 4 31.064 -7.588 -2.977 1.00 0.00 N ATOM 33 CA ASP A 4 30.386 -6.461 -3.622 1.00 0.00 C ATOM 34 C ASP A 4 31.235 -5.214 -3.352 1.00 0.00 C ATOM 35 O ASP A 4 32.006 -5.202 -2.389 1.00 0.00 O ATOM 36 CB ASP A 4 28.990 -6.239 -3.003 1.00 0.00 C ATOM 37 CG ASP A 4 27.896 -7.118 -3.623 1.00 0.00 C ATOM 38 OD1 ASP A 4 27.675 -6.990 -4.850 1.00 0.00 O ATOM 39 OD2 ASP A 4 27.194 -7.856 -2.885 1.00 0.00 O ATOM 0 H ASP A 4 31.837 -7.269 -2.393 1.00 0.00 H new ATOM 0 HA ASP A 4 30.269 -6.658 -4.688 1.00 0.00 H new ATOM 0 HB2 ASP A 4 29.041 -6.438 -1.932 1.00 0.00 H new ATOM 0 HB3 ASP A 4 28.712 -5.191 -3.120 1.00 0.00 H new ATOM 44 N GLU A 5 31.004 -4.125 -4.088 1.00 0.00 N ATOM 45 CA GLU A 5 31.695 -2.841 -3.946 1.00 0.00 C ATOM 46 C GLU A 5 30.726 -1.767 -4.457 1.00 0.00 C ATOM 47 O GLU A 5 30.714 -1.457 -5.654 1.00 0.00 O ATOM 48 CB GLU A 5 33.019 -2.779 -4.738 1.00 0.00 C ATOM 49 CG GLU A 5 34.210 -3.452 -4.043 1.00 0.00 C ATOM 50 CD GLU A 5 35.535 -2.988 -4.664 1.00 0.00 C ATOM 51 OE1 GLU A 5 35.791 -3.356 -5.833 1.00 0.00 O ATOM 52 OE2 GLU A 5 36.267 -2.242 -3.973 1.00 0.00 O ATOM 0 H GLU A 5 30.303 -4.113 -4.829 1.00 0.00 H new ATOM 0 HA GLU A 5 31.967 -2.690 -2.901 1.00 0.00 H new ATOM 0 HB2 GLU A 5 32.869 -3.250 -5.710 1.00 0.00 H new ATOM 0 HB3 GLU A 5 33.267 -1.734 -4.925 1.00 0.00 H new ATOM 0 HG2 GLU A 5 34.198 -3.214 -2.979 1.00 0.00 H new ATOM 0 HG3 GLU A 5 34.122 -4.535 -4.128 1.00 0.00 H new ATOM 59 N PRO A 6 29.813 -1.270 -3.609 1.00 0.00 N ATOM 60 CA PRO A 6 28.908 -0.195 -3.981 1.00 0.00 C ATOM 61 C PRO A 6 29.616 1.165 -3.907 1.00 0.00 C ATOM 62 O PRO A 6 30.626 1.337 -3.226 1.00 0.00 O ATOM 63 CB PRO A 6 27.760 -0.321 -2.985 1.00 0.00 C ATOM 64 CG PRO A 6 28.457 -0.798 -1.713 1.00 0.00 C ATOM 65 CD PRO A 6 29.551 -1.719 -2.248 1.00 0.00 C ATOM 0 HA PRO A 6 28.552 -0.264 -5.009 1.00 0.00 H new ATOM 0 HB2 PRO A 6 27.251 0.631 -2.833 1.00 0.00 H new ATOM 0 HB3 PRO A 6 27.008 -1.034 -3.324 1.00 0.00 H new ATOM 0 HG2 PRO A 6 28.872 0.034 -1.144 1.00 0.00 H new ATOM 0 HG3 PRO A 6 27.772 -1.327 -1.051 1.00 0.00 H new ATOM 0 HD2 PRO A 6 30.450 -1.656 -1.635 1.00 0.00 H new ATOM 0 HD3 PRO A 6 29.228 -2.760 -2.234 1.00 0.00 H new ATOM 73 N GLY A 7 29.052 2.171 -4.574 1.00 0.00 N ATOM 74 CA GLY A 7 29.657 3.491 -4.729 1.00 0.00 C ATOM 75 C GLY A 7 28.602 4.564 -4.979 1.00 0.00 C ATOM 76 O GLY A 7 28.835 5.501 -5.746 1.00 0.00 O ATOM 0 H GLY A 7 28.144 2.088 -5.030 1.00 0.00 H new ATOM 0 HA2 GLY A 7 30.225 3.740 -3.832 1.00 0.00 H new ATOM 0 HA3 GLY A 7 30.363 3.473 -5.559 1.00 0.00 H new ATOM 80 N GLY A 8 27.413 4.402 -4.399 1.00 0.00 N ATOM 81 CA GLY A 8 26.237 5.215 -4.657 1.00 0.00 C ATOM 82 C GLY A 8 25.465 5.482 -3.375 1.00 0.00 C ATOM 83 O GLY A 8 25.895 5.110 -2.284 1.00 0.00 O ATOM 0 H GLY A 8 27.242 3.670 -3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 8 26.537 6.161 -5.108 1.00 0.00 H new ATOM 0 HA3 GLY A 8 25.592 4.709 -5.375 1.00 0.00 H new ATOM 87 N LYS A 9 24.306 6.130 -3.484 1.00 0.00 N ATOM 88 CA LYS A 9 23.422 6.468 -2.386 1.00 0.00 C ATOM 89 C LYS A 9 21.994 6.386 -2.933 1.00 0.00 C ATOM 90 O LYS A 9 21.775 6.164 -4.123 1.00 0.00 O ATOM 91 CB LYS A 9 23.804 7.846 -1.802 1.00 0.00 C ATOM 92 CG LYS A 9 23.374 7.977 -0.333 1.00 0.00 C ATOM 93 CD LYS A 9 23.775 9.313 0.303 1.00 0.00 C ATOM 94 CE LYS A 9 23.273 9.325 1.756 1.00 0.00 C ATOM 95 NZ LYS A 9 23.131 10.685 2.323 1.00 0.00 N ATOM 0 H LYS A 9 23.947 6.445 -4.385 1.00 0.00 H new ATOM 0 HA LYS A 9 23.508 5.778 -1.547 1.00 0.00 H new ATOM 0 HB2 LYS A 9 24.882 7.989 -1.880 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.334 8.634 -2.391 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.292 7.862 -0.267 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.816 7.163 0.241 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.857 9.438 0.274 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.343 10.144 -0.255 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.309 8.819 1.803 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.964 8.753 2.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.789 10.619 3.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.054 11.165 2.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.450 11.228 1.755 1.00 0.00 H new ATOM 109 N GLY A 10 21.034 6.378 -2.031 1.00 0.00 N ATOM 110 CA GLY A 10 19.598 6.364 -2.257 1.00 0.00 C ATOM 111 C GLY A 10 18.936 6.434 -0.893 1.00 0.00 C ATOM 112 O GLY A 10 19.401 7.200 -0.046 1.00 0.00 O ATOM 0 H GLY A 10 21.255 6.381 -1.035 1.00 0.00 H new ATOM 0 HA2 GLY A 10 19.296 7.209 -2.876 1.00 0.00 H new ATOM 0 HA3 GLY A 10 19.299 5.459 -2.785 1.00 0.00 H new ATOM 116 N ALA A 11 17.911 5.621 -0.648 1.00 0.00 N ATOM 117 CA ALA A 11 17.133 5.643 0.596 1.00 0.00 C ATOM 118 C ALA A 11 16.670 4.213 0.930 1.00 0.00 C ATOM 119 O ALA A 11 16.903 3.302 0.153 1.00 0.00 O ATOM 120 CB ALA A 11 15.969 6.632 0.391 1.00 0.00 C ATOM 0 H ALA A 11 17.590 4.918 -1.314 1.00 0.00 H new ATOM 0 HA ALA A 11 17.721 5.981 1.450 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.365 6.676 1.297 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.368 7.623 0.172 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.350 6.298 -0.441 1.00 0.00 H new ATOM 126 N MET A 12 16.037 3.961 2.072 1.00 0.00 N ATOM 127 CA MET A 12 15.115 2.826 2.238 1.00 0.00 C ATOM 128 C MET A 12 13.725 3.227 1.736 1.00 0.00 C ATOM 129 O MET A 12 13.556 4.367 1.308 1.00 0.00 O ATOM 130 CB MET A 12 15.063 2.467 3.730 1.00 0.00 C ATOM 131 CG MET A 12 16.310 1.674 4.095 1.00 0.00 C ATOM 132 SD MET A 12 16.171 0.506 5.465 1.00 0.00 S ATOM 133 CE MET A 12 15.171 -0.760 4.637 1.00 0.00 C ATOM 0 H MET A 12 16.144 4.532 2.910 1.00 0.00 H new ATOM 0 HA MET A 12 15.455 1.963 1.665 1.00 0.00 H new ATOM 0 HB2 MET A 12 15.004 3.373 4.333 1.00 0.00 H new ATOM 0 HB3 MET A 12 14.169 1.882 3.945 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.631 1.122 3.211 1.00 0.00 H new ATOM 0 HG3 MET A 12 17.103 2.382 4.334 1.00 0.00 H new ATOM 0 HE1 MET A 12 14.230 -0.888 5.173 1.00 0.00 H new ATOM 0 HE2 MET A 12 14.966 -0.449 3.613 1.00 0.00 H new ATOM 0 HE3 MET A 12 15.715 -1.705 4.628 1.00 0.00 H new ATOM 143 N TYR A 13 12.719 2.371 1.914 1.00 0.00 N ATOM 144 CA TYR A 13 11.314 2.789 2.044 1.00 0.00 C ATOM 145 C TYR A 13 10.521 1.761 2.865 1.00 0.00 C ATOM 146 O TYR A 13 10.824 0.565 2.799 1.00 0.00 O ATOM 147 CB TYR A 13 10.652 2.993 0.666 1.00 0.00 C ATOM 148 CG TYR A 13 11.122 4.210 -0.117 1.00 0.00 C ATOM 149 CD1 TYR A 13 10.972 5.486 0.456 1.00 0.00 C ATOM 150 CD2 TYR A 13 11.775 4.077 -1.361 1.00 0.00 C ATOM 151 CE1 TYR A 13 11.541 6.609 -0.166 1.00 0.00 C ATOM 152 CE2 TYR A 13 12.307 5.205 -2.017 1.00 0.00 C ATOM 153 CZ TYR A 13 12.232 6.468 -1.388 1.00 0.00 C ATOM 154 OH TYR A 13 12.833 7.563 -1.924 1.00 0.00 O ATOM 0 H TYR A 13 12.852 1.361 1.973 1.00 0.00 H new ATOM 0 HA TYR A 13 11.303 3.746 2.565 1.00 0.00 H new ATOM 0 HB2 TYR A 13 10.831 2.104 0.062 1.00 0.00 H new ATOM 0 HB3 TYR A 13 9.574 3.070 0.809 1.00 0.00 H new ATOM 0 HD1 TYR A 13 10.418 5.602 1.376 1.00 0.00 H new ATOM 0 HD2 TYR A 13 11.868 3.101 -1.815 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.449 7.583 0.292 1.00 0.00 H new ATOM 0 HE2 TYR A 13 12.767 5.105 -2.989 1.00 0.00 H new ATOM 0 HH TYR A 13 13.619 7.285 -2.439 1.00 0.00 H new ATOM 164 N GLU A 14 9.506 2.223 3.604 1.00 0.00 N ATOM 165 CA GLU A 14 8.523 1.428 4.342 1.00 0.00 C ATOM 166 C GLU A 14 7.155 2.118 4.223 1.00 0.00 C ATOM 167 O GLU A 14 7.092 3.345 4.181 1.00 0.00 O ATOM 168 CB GLU A 14 8.979 1.264 5.807 1.00 0.00 C ATOM 169 CG GLU A 14 7.882 0.769 6.765 1.00 0.00 C ATOM 170 CD GLU A 14 8.403 0.345 8.142 1.00 0.00 C ATOM 171 OE1 GLU A 14 8.530 1.196 9.063 1.00 0.00 O ATOM 172 OE2 GLU A 14 8.648 -0.871 8.334 1.00 0.00 O ATOM 0 H GLU A 14 9.341 3.224 3.708 1.00 0.00 H new ATOM 0 HA GLU A 14 8.436 0.425 3.925 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.814 0.564 5.838 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.353 2.222 6.167 1.00 0.00 H new ATOM 0 HG2 GLU A 14 7.143 1.560 6.895 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.367 -0.076 6.307 1.00 0.00 H new ATOM 179 N VAL A 15 6.074 1.341 4.146 1.00 0.00 N ATOM 180 CA VAL A 15 4.684 1.775 4.116 1.00 0.00 C ATOM 181 C VAL A 15 3.822 0.853 5.000 1.00 0.00 C ATOM 182 O VAL A 15 4.099 -0.343 5.149 1.00 0.00 O ATOM 183 CB VAL A 15 4.212 1.795 2.642 1.00 0.00 C ATOM 184 CG1 VAL A 15 4.165 0.389 2.010 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.844 2.460 2.443 1.00 0.00 C ATOM 0 H VAL A 15 6.156 0.325 4.100 1.00 0.00 H new ATOM 0 HA VAL A 15 4.582 2.781 4.524 1.00 0.00 H new ATOM 0 HB VAL A 15 4.968 2.396 2.137 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.827 0.466 0.977 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.160 -0.054 2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.474 -0.240 2.572 1.00 0.00 H new ATOM 0 HG21 VAL A 15 2.579 2.437 1.386 1.00 0.00 H new ATOM 0 HG22 VAL A 15 2.091 1.922 3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.889 3.494 2.783 1.00 0.00 H new ATOM 195 N THR A 16 2.716 1.386 5.509 1.00 0.00 N ATOM 196 CA THR A 16 1.633 0.642 6.149 1.00 0.00 C ATOM 197 C THR A 16 0.372 0.764 5.301 1.00 0.00 C ATOM 198 O THR A 16 0.198 1.757 4.592 1.00 0.00 O ATOM 199 CB THR A 16 1.388 1.157 7.592 1.00 0.00 C ATOM 200 OG1 THR A 16 1.814 2.504 7.757 1.00 0.00 O ATOM 201 CG2 THR A 16 2.098 0.311 8.655 1.00 0.00 C ATOM 0 H THR A 16 2.541 2.391 5.487 1.00 0.00 H new ATOM 0 HA THR A 16 1.912 -0.409 6.222 1.00 0.00 H new ATOM 0 HB THR A 16 0.310 1.083 7.733 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.641 2.791 8.678 1.00 0.00 H new ATOM 0 HG21 THR A 16 1.890 0.719 9.644 1.00 0.00 H new ATOM 0 HG22 THR A 16 1.737 -0.716 8.603 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.173 0.327 8.475 1.00 0.00 H new ATOM 209 N ILE A 17 -0.524 -0.222 5.397 1.00 0.00 N ATOM 210 CA ILE A 17 -1.943 -0.024 5.095 1.00 0.00 C ATOM 211 C ILE A 17 -2.638 0.006 6.446 1.00 0.00 C ATOM 212 O ILE A 17 -2.218 -0.702 7.361 1.00 0.00 O ATOM 213 CB ILE A 17 -2.479 -1.132 4.142 1.00 0.00 C ATOM 214 CG1 ILE A 17 -3.699 -0.750 3.284 1.00 0.00 C ATOM 215 CG2 ILE A 17 -2.984 -2.403 4.844 1.00 0.00 C ATOM 216 CD1 ILE A 17 -3.313 0.208 2.178 1.00 0.00 C ATOM 0 H ILE A 17 -0.289 -1.172 5.684 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.131 0.903 4.554 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.578 -1.286 3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.139 -1.649 2.853 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.461 -0.293 3.915 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.337 -3.115 4.098 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -2.171 -2.850 5.416 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -3.803 -2.146 5.516 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -4.196 0.459 1.590 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -2.896 1.117 2.613 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -2.569 -0.261 1.534 1.00 0.00 H new ATOM 228 N GLU A 18 -3.715 0.767 6.541 1.00 0.00 N ATOM 229 CA GLU A 18 -4.684 0.783 7.618 1.00 0.00 C ATOM 230 C GLU A 18 -6.024 0.929 6.903 1.00 0.00 C ATOM 231 O GLU A 18 -6.236 1.887 6.151 1.00 0.00 O ATOM 232 CB GLU A 18 -4.429 1.939 8.597 1.00 0.00 C ATOM 233 CG GLU A 18 -3.077 1.823 9.313 1.00 0.00 C ATOM 234 CD GLU A 18 -2.971 2.783 10.497 1.00 0.00 C ATOM 235 OE1 GLU A 18 -3.417 2.385 11.602 1.00 0.00 O ATOM 236 OE2 GLU A 18 -2.429 3.903 10.350 1.00 0.00 O ATOM 0 H GLU A 18 -3.950 1.439 5.811 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.637 -0.115 8.234 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.468 2.884 8.055 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.227 1.964 9.339 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.939 0.800 9.663 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.274 2.030 8.606 1.00 0.00 H new ATOM 243 N GLN A 19 -6.866 -0.088 7.012 1.00 0.00 N ATOM 244 CA GLN A 19 -8.198 -0.159 6.438 1.00 0.00 C ATOM 245 C GLN A 19 -9.195 0.052 7.569 1.00 0.00 C ATOM 246 O GLN A 19 -9.114 -0.636 8.590 1.00 0.00 O ATOM 247 CB GLN A 19 -8.415 -1.533 5.785 1.00 0.00 C ATOM 248 CG GLN A 19 -7.287 -1.913 4.819 1.00 0.00 C ATOM 249 CD GLN A 19 -7.740 -2.971 3.820 1.00 0.00 C ATOM 250 OE1 GLN A 19 -8.503 -2.693 2.896 1.00 0.00 O ATOM 251 NE2 GLN A 19 -7.262 -4.185 3.974 1.00 0.00 N ATOM 0 H GLN A 19 -6.623 -0.931 7.532 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.329 0.603 5.669 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.493 -2.292 6.563 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.363 -1.530 5.247 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.951 -1.025 4.283 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.433 -2.287 5.384 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.631 -4.390 4.749 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.522 -4.922 3.319 1.00 0.00 H new ATOM 260 N SER A 20 -10.139 0.974 7.401 1.00 0.00 N ATOM 261 CA SER A 20 -11.107 1.306 8.436 1.00 0.00 C ATOM 262 C SER A 20 -12.503 1.480 7.834 1.00 0.00 C ATOM 263 O SER A 20 -12.669 1.439 6.613 1.00 0.00 O ATOM 264 CB SER A 20 -10.650 2.570 9.182 1.00 0.00 C ATOM 265 OG SER A 20 -9.248 2.643 9.415 1.00 0.00 O ATOM 0 H SER A 20 -10.252 1.511 6.541 1.00 0.00 H new ATOM 0 HA SER A 20 -11.165 0.487 9.153 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.956 3.445 8.609 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.168 2.618 10.140 1.00 0.00 H new ATOM 0 HG SER A 20 -9.038 3.474 9.891 1.00 0.00 H new ATOM 271 N GLY A 21 -13.516 1.664 8.677 1.00 0.00 N ATOM 272 CA GLY A 21 -14.910 1.744 8.284 1.00 0.00 C ATOM 273 C GLY A 21 -15.471 0.343 8.103 1.00 0.00 C ATOM 274 O GLY A 21 -16.126 -0.167 9.019 1.00 0.00 O ATOM 0 H GLY A 21 -13.379 1.764 9.683 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.481 2.280 9.042 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.005 2.307 7.356 1.00 0.00 H new ATOM 278 N ASP A 22 -15.245 -0.277 6.944 1.00 0.00 N ATOM 279 CA ASP A 22 -15.636 -1.659 6.674 1.00 0.00 C ATOM 280 C ASP A 22 -15.018 -2.214 5.383 1.00 0.00 C ATOM 281 O ASP A 22 -15.462 -1.888 4.290 1.00 0.00 O ATOM 282 CB ASP A 22 -17.164 -1.816 6.588 1.00 0.00 C ATOM 283 CG ASP A 22 -17.516 -3.281 6.855 1.00 0.00 C ATOM 284 OD1 ASP A 22 -16.620 -4.154 6.759 1.00 0.00 O ATOM 285 OD2 ASP A 22 -18.593 -3.553 7.432 1.00 0.00 O ATOM 0 H ASP A 22 -14.779 0.174 6.157 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.253 -2.231 7.519 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -17.653 -1.170 7.317 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.521 -1.514 5.604 1.00 0.00 H new ATOM 290 N PHE A 23 -13.997 -3.067 5.472 1.00 0.00 N ATOM 291 CA PHE A 23 -13.317 -3.638 4.305 1.00 0.00 C ATOM 292 C PHE A 23 -13.860 -5.036 3.934 1.00 0.00 C ATOM 293 O PHE A 23 -13.130 -5.846 3.353 1.00 0.00 O ATOM 294 CB PHE A 23 -11.791 -3.571 4.527 1.00 0.00 C ATOM 295 CG PHE A 23 -11.295 -4.217 5.808 1.00 0.00 C ATOM 296 CD1 PHE A 23 -10.996 -5.590 5.830 1.00 0.00 C ATOM 297 CD2 PHE A 23 -11.192 -3.463 6.994 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.668 -6.223 7.039 1.00 0.00 C ATOM 299 CE2 PHE A 23 -10.816 -4.087 8.197 1.00 0.00 C ATOM 300 CZ PHE A 23 -10.564 -5.470 8.221 1.00 0.00 C ATOM 0 H PHE A 23 -13.614 -3.385 6.362 1.00 0.00 H new ATOM 0 HA PHE A 23 -13.536 -3.041 3.420 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.296 -4.050 3.682 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.485 -2.525 4.525 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -11.019 -6.160 4.913 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.402 -2.404 6.979 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.496 -7.289 7.061 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -10.721 -3.504 9.101 1.00 0.00 H new ATOM 0 HZ PHE A 23 -10.291 -5.953 9.147 1.00 0.00 H new ATOM 310 N ARG A 24 -15.110 -5.368 4.296 1.00 0.00 N ATOM 311 CA ARG A 24 -15.688 -6.712 4.136 1.00 0.00 C ATOM 312 C ARG A 24 -15.960 -7.159 2.698 1.00 0.00 C ATOM 313 O ARG A 24 -15.612 -8.303 2.389 1.00 0.00 O ATOM 314 CB ARG A 24 -16.967 -6.842 4.977 1.00 0.00 C ATOM 315 CG ARG A 24 -16.620 -7.156 6.436 1.00 0.00 C ATOM 316 CD ARG A 24 -17.874 -7.071 7.313 1.00 0.00 C ATOM 317 NE ARG A 24 -17.545 -7.314 8.726 1.00 0.00 N ATOM 318 CZ ARG A 24 -17.089 -6.428 9.613 1.00 0.00 C ATOM 319 NH1 ARG A 24 -16.992 -5.139 9.321 1.00 0.00 N ATOM 320 NH2 ARG A 24 -16.737 -6.847 10.820 1.00 0.00 N ATOM 0 H ARG A 24 -15.757 -4.700 4.714 1.00 0.00 H new ATOM 0 HA ARG A 24 -14.911 -7.387 4.493 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -17.540 -5.916 4.924 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -17.599 -7.631 4.569 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -16.186 -8.153 6.507 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.868 -6.454 6.797 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -18.331 -6.087 7.206 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -18.609 -7.802 6.976 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.681 -8.266 9.065 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -17.270 -4.803 8.399 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -16.640 -4.483 10.018 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -16.816 -7.835 11.060 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.387 -6.181 11.509 1.00 0.00 H new ATOM 334 N SER A 25 -16.585 -6.334 1.853 1.00 0.00 N ATOM 335 CA SER A 25 -16.935 -6.680 0.472 1.00 0.00 C ATOM 336 C SER A 25 -16.396 -5.609 -0.473 1.00 0.00 C ATOM 337 O SER A 25 -17.160 -4.857 -1.078 1.00 0.00 O ATOM 338 CB SER A 25 -18.451 -6.839 0.283 1.00 0.00 C ATOM 339 OG SER A 25 -19.019 -7.979 0.903 1.00 0.00 O ATOM 0 H SER A 25 -16.867 -5.389 2.114 1.00 0.00 H new ATOM 0 HA SER A 25 -16.479 -7.643 0.241 1.00 0.00 H new ATOM 0 HB2 SER A 25 -18.945 -5.949 0.673 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.666 -6.881 -0.785 1.00 0.00 H new ATOM 0 HG SER A 25 -19.884 -8.180 0.488 1.00 0.00 H new ATOM 345 N PHE A 26 -15.075 -5.539 -0.617 1.00 0.00 N ATOM 346 CA PHE A 26 -14.400 -4.543 -1.442 1.00 0.00 C ATOM 347 C PHE A 26 -13.210 -5.201 -2.106 1.00 0.00 C ATOM 348 O PHE A 26 -12.316 -5.642 -1.394 1.00 0.00 O ATOM 349 CB PHE A 26 -13.968 -3.358 -0.566 1.00 0.00 C ATOM 350 CG PHE A 26 -15.144 -2.518 -0.146 1.00 0.00 C ATOM 351 CD1 PHE A 26 -15.730 -1.646 -1.080 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.717 -2.692 1.125 1.00 0.00 C ATOM 353 CE1 PHE A 26 -16.950 -1.023 -0.766 1.00 0.00 C ATOM 354 CE2 PHE A 26 -16.901 -2.021 1.457 1.00 0.00 C ATOM 355 CZ PHE A 26 -17.527 -1.201 0.506 1.00 0.00 C ATOM 0 H PHE A 26 -14.434 -6.184 -0.156 1.00 0.00 H new ATOM 0 HA PHE A 26 -15.069 -4.161 -2.213 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.451 -3.729 0.319 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.257 -2.740 -1.115 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.248 -1.457 -2.028 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -15.245 -3.343 1.846 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -17.446 -0.407 -1.501 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -17.330 -2.134 2.441 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.455 -0.705 0.750 1.00 0.00 H new ATOM 365 N ILE A 27 -13.168 -5.280 -3.436 1.00 0.00 N ATOM 366 CA ILE A 27 -12.028 -5.825 -4.165 1.00 0.00 C ATOM 367 C ILE A 27 -11.020 -4.683 -4.327 1.00 0.00 C ATOM 368 O ILE A 27 -10.956 -4.007 -5.356 1.00 0.00 O ATOM 369 CB ILE A 27 -12.477 -6.475 -5.492 1.00 0.00 C ATOM 370 CG1 ILE A 27 -13.631 -7.492 -5.332 1.00 0.00 C ATOM 371 CG2 ILE A 27 -11.292 -7.144 -6.217 1.00 0.00 C ATOM 372 CD1 ILE A 27 -13.345 -8.637 -4.362 1.00 0.00 C ATOM 0 H ILE A 27 -13.928 -4.966 -4.039 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.546 -6.638 -3.623 1.00 0.00 H new ATOM 0 HB ILE A 27 -12.861 -5.653 -6.096 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -14.520 -6.961 -4.993 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.864 -7.913 -6.310 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -11.641 -7.592 -7.147 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.531 -6.395 -6.438 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.865 -7.918 -5.579 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -14.210 -9.299 -4.315 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.477 -9.199 -4.708 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -13.144 -8.232 -3.370 1.00 0.00 H new ATOM 384 N LYS A 28 -10.274 -4.414 -3.261 1.00 0.00 N ATOM 385 CA LYS A 28 -9.093 -3.556 -3.255 1.00 0.00 C ATOM 386 C LYS A 28 -7.912 -4.350 -3.801 1.00 0.00 C ATOM 387 O LYS A 28 -7.805 -5.543 -3.510 1.00 0.00 O ATOM 388 CB LYS A 28 -8.803 -2.993 -1.840 1.00 0.00 C ATOM 389 CG LYS A 28 -8.557 -3.977 -0.668 1.00 0.00 C ATOM 390 CD LYS A 28 -9.773 -4.837 -0.337 1.00 0.00 C ATOM 391 CE LYS A 28 -9.813 -5.540 1.016 1.00 0.00 C ATOM 392 NZ LYS A 28 -11.001 -6.418 1.071 1.00 0.00 N ATOM 0 H LYS A 28 -10.483 -4.802 -2.341 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.270 -2.691 -3.894 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.927 -2.349 -1.917 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.643 -2.356 -1.562 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.718 -4.627 -0.918 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.269 -3.411 0.218 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -10.658 -4.204 -0.410 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.862 -5.599 -1.111 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.906 -6.126 1.162 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.851 -4.805 1.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.219 -6.645 2.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.813 -5.931 0.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.808 -7.297 0.549 1.00 0.00 H new ATOM 406 N SER A 29 -7.009 -3.684 -4.520 1.00 0.00 N ATOM 407 CA SER A 29 -5.721 -4.236 -4.934 1.00 0.00 C ATOM 408 C SER A 29 -4.652 -3.166 -4.692 1.00 0.00 C ATOM 409 O SER A 29 -4.976 -2.046 -4.295 1.00 0.00 O ATOM 410 CB SER A 29 -5.773 -4.671 -6.405 1.00 0.00 C ATOM 411 OG SER A 29 -6.776 -5.651 -6.623 1.00 0.00 O ATOM 0 H SER A 29 -7.156 -2.726 -4.837 1.00 0.00 H new ATOM 0 HA SER A 29 -5.477 -5.126 -4.354 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.968 -3.803 -7.035 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.803 -5.070 -6.702 1.00 0.00 H new ATOM 0 HG SER A 29 -6.784 -5.906 -7.569 1.00 0.00 H new ATOM 417 N VAL A 30 -3.373 -3.480 -4.897 1.00 0.00 N ATOM 418 CA VAL A 30 -2.259 -2.526 -4.814 1.00 0.00 C ATOM 419 C VAL A 30 -1.273 -2.886 -5.938 1.00 0.00 C ATOM 420 O VAL A 30 -1.305 -4.010 -6.439 1.00 0.00 O ATOM 421 CB VAL A 30 -1.642 -2.576 -3.385 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.352 -1.769 -3.213 1.00 0.00 C ATOM 423 CG2 VAL A 30 -2.609 -2.070 -2.300 1.00 0.00 C ATOM 0 H VAL A 30 -3.072 -4.426 -5.131 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.574 -1.493 -4.961 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.424 -3.637 -3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.003 -1.864 -2.187 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.408 -2.148 -3.896 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.547 -0.720 -3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.125 -2.128 -1.325 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.881 -1.035 -2.509 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.507 -2.688 -2.296 1.00 0.00 H new ATOM 433 N VAL A 31 -0.391 -1.971 -6.340 1.00 0.00 N ATOM 434 CA VAL A 31 0.865 -2.256 -7.039 1.00 0.00 C ATOM 435 C VAL A 31 1.990 -1.833 -6.084 1.00 0.00 C ATOM 436 O VAL A 31 1.805 -0.879 -5.321 1.00 0.00 O ATOM 437 CB VAL A 31 0.940 -1.480 -8.380 1.00 0.00 C ATOM 438 CG1 VAL A 31 0.741 0.035 -8.235 1.00 0.00 C ATOM 439 CG2 VAL A 31 2.266 -1.712 -9.126 1.00 0.00 C ATOM 0 H VAL A 31 -0.536 -0.974 -6.183 1.00 0.00 H new ATOM 0 HA VAL A 31 0.948 -3.312 -7.294 1.00 0.00 H new ATOM 0 HB VAL A 31 0.110 -1.888 -8.956 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.807 0.506 -9.216 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.240 0.233 -7.803 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.514 0.443 -7.584 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.264 -1.145 -10.057 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.097 -1.382 -8.502 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.378 -2.773 -9.348 1.00 0.00 H new ATOM 449 N VAL A 32 3.162 -2.462 -6.160 1.00 0.00 N ATOM 450 CA VAL A 32 4.391 -1.923 -5.599 1.00 0.00 C ATOM 451 C VAL A 32 5.562 -2.168 -6.548 1.00 0.00 C ATOM 452 O VAL A 32 5.695 -3.263 -7.104 1.00 0.00 O ATOM 453 CB VAL A 32 4.599 -2.436 -4.166 1.00 0.00 C ATOM 454 CG1 VAL A 32 4.505 -3.955 -4.058 1.00 0.00 C ATOM 455 CG2 VAL A 32 5.932 -1.945 -3.580 1.00 0.00 C ATOM 0 H VAL A 32 3.282 -3.366 -6.617 1.00 0.00 H new ATOM 0 HA VAL A 32 4.319 -0.839 -5.506 1.00 0.00 H new ATOM 0 HB VAL A 32 3.781 -2.018 -3.579 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.661 -4.256 -3.022 1.00 0.00 H new ATOM 0 HG12 VAL A 32 3.519 -4.283 -4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.268 -4.412 -4.687 1.00 0.00 H new ATOM 0 HG21 VAL A 32 6.046 -2.327 -2.565 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.755 -2.304 -4.198 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.942 -0.855 -3.561 1.00 0.00 H new ATOM 465 N VAL A 33 6.441 -1.173 -6.691 1.00 0.00 N ATOM 466 CA VAL A 33 7.735 -1.246 -7.370 1.00 0.00 C ATOM 467 C VAL A 33 8.778 -0.734 -6.366 1.00 0.00 C ATOM 468 O VAL A 33 8.468 0.165 -5.579 1.00 0.00 O ATOM 469 CB VAL A 33 7.725 -0.416 -8.678 1.00 0.00 C ATOM 470 CG1 VAL A 33 8.985 -0.712 -9.512 1.00 0.00 C ATOM 471 CG2 VAL A 33 6.475 -0.673 -9.543 1.00 0.00 C ATOM 0 H VAL A 33 6.257 -0.243 -6.314 1.00 0.00 H new ATOM 0 HA VAL A 33 7.970 -2.266 -7.674 1.00 0.00 H new ATOM 0 HB VAL A 33 7.709 0.631 -8.376 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.962 -0.121 -10.428 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.873 -0.453 -8.935 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.013 -1.772 -9.765 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.525 -0.063 -10.445 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.434 -1.727 -9.819 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.581 -0.411 -8.977 1.00 0.00 H new ATOM 481 N ALA A 34 9.987 -1.308 -6.380 1.00 0.00 N ATOM 482 CA ALA A 34 11.073 -0.992 -5.460 1.00 0.00 C ATOM 483 C ALA A 34 12.403 -1.113 -6.199 1.00 0.00 C ATOM 484 O ALA A 34 12.930 -2.218 -6.352 1.00 0.00 O ATOM 485 CB ALA A 34 11.021 -1.932 -4.254 1.00 0.00 C ATOM 0 H ALA A 34 10.239 -2.028 -7.057 1.00 0.00 H new ATOM 0 HA ALA A 34 10.969 0.029 -5.093 1.00 0.00 H new ATOM 0 HB1 ALA A 34 11.835 -1.691 -3.570 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.067 -1.812 -3.740 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.124 -2.963 -4.592 1.00 0.00 H new ATOM 491 N ASN A 35 12.910 0.009 -6.705 1.00 0.00 N ATOM 492 CA ASN A 35 14.147 0.104 -7.477 1.00 0.00 C ATOM 493 C ASN A 35 15.340 -0.328 -6.615 1.00 0.00 C ATOM 494 O ASN A 35 15.807 0.471 -5.809 1.00 0.00 O ATOM 495 CB ASN A 35 14.300 1.564 -7.945 1.00 0.00 C ATOM 496 CG ASN A 35 15.470 1.848 -8.877 1.00 0.00 C ATOM 497 OD1 ASN A 35 16.381 1.050 -9.069 1.00 0.00 O ATOM 498 ND2 ASN A 35 15.474 3.020 -9.489 1.00 0.00 N ATOM 0 H ASN A 35 12.452 0.912 -6.584 1.00 0.00 H new ATOM 0 HA ASN A 35 14.113 -0.557 -8.343 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.380 1.861 -8.448 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.401 2.198 -7.064 1.00 0.00 H new ATOM 0 HD21 ASN A 35 16.236 3.262 -10.122 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.715 3.682 -9.328 1.00 0.00 H new ATOM 505 N GLY A 36 15.843 -1.557 -6.757 1.00 0.00 N ATOM 506 CA GLY A 36 17.197 -1.912 -6.334 1.00 0.00 C ATOM 507 C GLY A 36 17.336 -2.882 -5.161 1.00 0.00 C ATOM 508 O GLY A 36 18.472 -3.164 -4.783 1.00 0.00 O ATOM 0 H GLY A 36 15.323 -2.332 -7.168 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.715 -2.343 -7.191 1.00 0.00 H new ATOM 0 HA3 GLY A 36 17.721 -0.992 -6.074 1.00 0.00 H new ATOM 512 N THR A 37 16.258 -3.401 -4.568 1.00 0.00 N ATOM 513 CA THR A 37 16.346 -4.423 -3.517 1.00 0.00 C ATOM 514 C THR A 37 15.016 -5.187 -3.447 1.00 0.00 C ATOM 515 O THR A 37 14.096 -4.876 -4.213 1.00 0.00 O ATOM 516 CB THR A 37 16.781 -3.761 -2.194 1.00 0.00 C ATOM 517 OG1 THR A 37 17.348 -4.689 -1.292 1.00 0.00 O ATOM 518 CG2 THR A 37 15.630 -3.030 -1.515 1.00 0.00 C ATOM 0 H THR A 37 15.303 -3.128 -4.800 1.00 0.00 H new ATOM 0 HA THR A 37 17.110 -5.168 -3.740 1.00 0.00 H new ATOM 0 HB THR A 37 17.545 -3.033 -2.466 1.00 0.00 H new ATOM 0 HG1 THR A 37 17.611 -4.227 -0.469 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.982 -2.579 -0.587 1.00 0.00 H new ATOM 0 HG22 THR A 37 15.253 -2.250 -2.177 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.830 -3.737 -1.294 1.00 0.00 H new ATOM 526 N GLN A 38 14.893 -6.181 -2.559 1.00 0.00 N ATOM 527 CA GLN A 38 13.636 -6.899 -2.349 1.00 0.00 C ATOM 528 C GLN A 38 12.820 -6.235 -1.241 1.00 0.00 C ATOM 529 O GLN A 38 13.335 -5.444 -0.448 1.00 0.00 O ATOM 530 CB GLN A 38 13.862 -8.404 -2.102 1.00 0.00 C ATOM 531 CG GLN A 38 13.604 -9.208 -3.393 1.00 0.00 C ATOM 532 CD GLN A 38 13.510 -10.723 -3.176 1.00 0.00 C ATOM 533 OE1 GLN A 38 13.202 -11.214 -2.097 1.00 0.00 O ATOM 534 NE2 GLN A 38 13.710 -11.530 -4.209 1.00 0.00 N ATOM 0 H GLN A 38 15.659 -6.507 -1.970 1.00 0.00 H new ATOM 0 HA GLN A 38 13.052 -6.836 -3.267 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.883 -8.573 -1.759 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.198 -8.752 -1.311 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.677 -8.858 -3.847 1.00 0.00 H new ATOM 0 HG3 GLN A 38 14.405 -9.002 -4.103 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.967 -11.142 -5.117 1.00 0.00 H new ATOM 0 HE22 GLN A 38 13.607 -12.538 -4.096 1.00 0.00 H new ATOM 543 N LEU A 39 11.524 -6.537 -1.212 1.00 0.00 N ATOM 544 CA LEU A 39 10.614 -6.082 -0.169 1.00 0.00 C ATOM 545 C LEU A 39 10.688 -7.028 1.029 1.00 0.00 C ATOM 546 O LEU A 39 11.254 -8.119 0.934 1.00 0.00 O ATOM 547 CB LEU A 39 9.157 -6.044 -0.651 1.00 0.00 C ATOM 548 CG LEU A 39 8.863 -5.283 -1.950 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.361 -5.354 -2.236 1.00 0.00 C ATOM 550 CD2 LEU A 39 9.298 -3.819 -1.846 1.00 0.00 C ATOM 0 H LEU A 39 11.072 -7.112 -1.923 1.00 0.00 H new ATOM 0 HA LEU A 39 10.921 -5.073 0.105 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.817 -7.072 -0.779 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.551 -5.604 0.141 1.00 0.00 H new ATOM 0 HG LEU A 39 9.426 -5.744 -2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.140 -4.816 -3.158 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.060 -6.396 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 39 6.812 -4.901 -1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.077 -3.306 -2.782 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.758 -3.336 -1.031 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.369 -3.771 -1.651 1.00 0.00 H new ATOM 562 N LYS A 40 10.036 -6.651 2.128 1.00 0.00 N ATOM 563 CA LYS A 40 9.821 -7.493 3.296 1.00 0.00 C ATOM 564 C LYS A 40 8.378 -7.332 3.745 1.00 0.00 C ATOM 565 O LYS A 40 7.935 -6.191 3.909 1.00 0.00 O ATOM 566 CB LYS A 40 10.793 -7.080 4.407 1.00 0.00 C ATOM 567 CG LYS A 40 10.811 -8.120 5.534 1.00 0.00 C ATOM 568 CD LYS A 40 11.736 -7.700 6.681 1.00 0.00 C ATOM 569 CE LYS A 40 11.704 -8.811 7.732 1.00 0.00 C ATOM 570 NZ LYS A 40 12.477 -8.488 8.946 1.00 0.00 N ATOM 0 H LYS A 40 9.631 -5.720 2.230 1.00 0.00 H new ATOM 0 HA LYS A 40 10.005 -8.540 3.057 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.796 -6.967 3.995 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.502 -6.109 4.808 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.800 -8.260 5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.138 -9.081 5.137 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.752 -7.547 6.317 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.406 -6.755 7.113 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.669 -9.008 8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.096 -9.728 7.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.415 -9.280 9.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.472 -8.327 8.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.089 -7.629 9.386 1.00 0.00 H new ATOM 584 N ASP A 41 7.671 -8.444 3.936 1.00 0.00 N ATOM 585 CA ASP A 41 6.319 -8.484 4.491 1.00 0.00 C ATOM 586 C ASP A 41 6.387 -8.603 6.006 1.00 0.00 C ATOM 587 O ASP A 41 6.886 -9.595 6.536 1.00 0.00 O ATOM 588 CB ASP A 41 5.463 -9.627 3.919 1.00 0.00 C ATOM 589 CG ASP A 41 3.972 -9.303 4.113 1.00 0.00 C ATOM 590 OD1 ASP A 41 3.615 -8.812 5.210 1.00 0.00 O ATOM 591 OD2 ASP A 41 3.191 -9.463 3.154 1.00 0.00 O ATOM 0 H ASP A 41 8.033 -9.369 3.702 1.00 0.00 H new ATOM 0 HA ASP A 41 5.834 -7.551 4.204 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.681 -9.763 2.860 1.00 0.00 H new ATOM 0 HB3 ASP A 41 5.710 -10.564 4.418 1.00 0.00 H new ATOM 596 N GLY A 42 5.877 -7.602 6.716 1.00 0.00 N ATOM 597 CA GLY A 42 5.758 -7.581 8.164 1.00 0.00 C ATOM 598 C GLY A 42 4.644 -8.481 8.718 1.00 0.00 C ATOM 599 O GLY A 42 4.295 -8.346 9.893 1.00 0.00 O ATOM 0 H GLY A 42 5.522 -6.752 6.279 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.709 -7.889 8.600 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.576 -6.556 8.487 1.00 0.00 H new ATOM 603 N ALA A 43 4.042 -9.368 7.923 1.00 0.00 N ATOM 604 CA ALA A 43 3.153 -10.415 8.405 1.00 0.00 C ATOM 605 C ALA A 43 3.979 -11.464 9.152 1.00 0.00 C ATOM 606 O ALA A 43 3.635 -11.878 10.265 1.00 0.00 O ATOM 607 CB ALA A 43 2.417 -11.046 7.214 1.00 0.00 C ATOM 0 H ALA A 43 4.164 -9.375 6.910 1.00 0.00 H new ATOM 0 HA ALA A 43 2.412 -9.999 9.087 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.751 -11.831 7.572 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.834 -10.282 6.700 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.143 -11.474 6.523 1.00 0.00 H new ATOM 613 N THR A 44 5.074 -11.894 8.530 1.00 0.00 N ATOM 614 CA THR A 44 5.850 -13.065 8.928 1.00 0.00 C ATOM 615 C THR A 44 7.357 -12.863 8.676 1.00 0.00 C ATOM 616 O THR A 44 8.174 -13.631 9.187 1.00 0.00 O ATOM 617 CB THR A 44 5.271 -14.303 8.195 1.00 0.00 C ATOM 618 OG1 THR A 44 4.680 -13.944 6.960 1.00 0.00 O ATOM 619 CG2 THR A 44 4.156 -14.964 9.012 1.00 0.00 C ATOM 0 H THR A 44 5.457 -11.423 7.710 1.00 0.00 H new ATOM 0 HA THR A 44 5.764 -13.224 10.003 1.00 0.00 H new ATOM 0 HB THR A 44 6.113 -14.980 8.050 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.641 -14.730 6.375 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.772 -15.828 8.470 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.552 -15.286 9.975 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.350 -14.248 9.173 1.00 0.00 H new ATOM 627 N GLY A 45 7.753 -11.796 7.975 1.00 0.00 N ATOM 628 CA GLY A 45 9.131 -11.436 7.656 1.00 0.00 C ATOM 629 C GLY A 45 9.583 -11.962 6.295 1.00 0.00 C ATOM 630 O GLY A 45 10.786 -11.988 6.024 1.00 0.00 O ATOM 0 H GLY A 45 7.082 -11.127 7.596 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.231 -10.351 7.672 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.792 -11.828 8.429 1.00 0.00 H new ATOM 634 N GLU A 46 8.655 -12.422 5.456 1.00 0.00 N ATOM 635 CA GLU A 46 8.933 -13.055 4.175 1.00 0.00 C ATOM 636 C GLU A 46 9.494 -11.981 3.247 1.00 0.00 C ATOM 637 O GLU A 46 9.042 -10.834 3.264 1.00 0.00 O ATOM 638 CB GLU A 46 7.668 -13.736 3.597 1.00 0.00 C ATOM 639 CG GLU A 46 6.935 -14.522 4.700 1.00 0.00 C ATOM 640 CD GLU A 46 5.811 -15.482 4.286 1.00 0.00 C ATOM 641 OE1 GLU A 46 5.613 -15.767 3.078 1.00 0.00 O ATOM 642 OE2 GLU A 46 5.115 -15.954 5.221 1.00 0.00 O ATOM 0 H GLU A 46 7.657 -12.360 5.660 1.00 0.00 H new ATOM 0 HA GLU A 46 9.665 -13.854 4.291 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.003 -12.984 3.173 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.947 -14.408 2.786 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.680 -15.099 5.248 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.514 -13.799 5.399 1.00 0.00 H new ATOM 649 N SER A 47 10.516 -12.325 2.474 1.00 0.00 N ATOM 650 CA SER A 47 11.001 -11.452 1.412 1.00 0.00 C ATOM 651 C SER A 47 9.962 -11.454 0.286 1.00 0.00 C ATOM 652 O SER A 47 9.325 -12.490 0.061 1.00 0.00 O ATOM 653 CB SER A 47 12.350 -11.966 0.899 1.00 0.00 C ATOM 654 OG SER A 47 13.205 -12.320 1.976 1.00 0.00 O ATOM 0 H SER A 47 11.026 -13.204 2.563 1.00 0.00 H new ATOM 0 HA SER A 47 11.142 -10.437 1.782 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.192 -12.832 0.256 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.827 -11.199 0.289 1.00 0.00 H new ATOM 0 HG SER A 47 14.059 -12.647 1.622 1.00 0.00 H new ATOM 660 N LEU A 48 9.798 -10.339 -0.432 1.00 0.00 N ATOM 661 CA LEU A 48 8.965 -10.282 -1.632 1.00 0.00 C ATOM 662 C LEU A 48 9.745 -9.639 -2.761 1.00 0.00 C ATOM 663 O LEU A 48 10.661 -8.851 -2.534 1.00 0.00 O ATOM 664 CB LEU A 48 7.654 -9.507 -1.434 1.00 0.00 C ATOM 665 CG LEU A 48 7.058 -9.543 -0.021 1.00 0.00 C ATOM 666 CD1 LEU A 48 5.971 -8.482 0.047 1.00 0.00 C ATOM 667 CD2 LEU A 48 6.552 -10.958 0.262 1.00 0.00 C ATOM 0 H LEU A 48 10.240 -9.451 -0.196 1.00 0.00 H new ATOM 0 HA LEU A 48 8.698 -11.312 -1.869 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.826 -8.466 -1.708 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.913 -9.902 -2.129 1.00 0.00 H new ATOM 0 HG LEU A 48 7.792 -9.315 0.751 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.525 -8.481 1.042 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.405 -7.503 -0.157 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.203 -8.700 -0.695 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.125 -10.998 1.264 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.788 -11.224 -0.469 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.381 -11.662 0.192 1.00 0.00 H new ATOM 679 N ALA A 49 9.308 -9.907 -3.980 1.00 0.00 N ATOM 680 CA ALA A 49 9.944 -9.538 -5.232 1.00 0.00 C ATOM 681 C ALA A 49 9.007 -8.612 -5.987 1.00 0.00 C ATOM 682 O ALA A 49 7.993 -9.042 -6.538 1.00 0.00 O ATOM 683 CB ALA A 49 10.306 -10.788 -6.041 1.00 0.00 C ATOM 0 H ALA A 49 8.441 -10.423 -4.130 1.00 0.00 H new ATOM 0 HA ALA A 49 10.880 -9.012 -5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 49 10.782 -10.491 -6.976 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.993 -11.408 -5.465 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.401 -11.355 -6.258 1.00 0.00 H new ATOM 689 N SER A 50 9.318 -7.323 -5.970 1.00 0.00 N ATOM 690 CA SER A 50 8.641 -6.360 -6.826 1.00 0.00 C ATOM 691 C SER A 50 9.118 -6.517 -8.290 1.00 0.00 C ATOM 692 O SER A 50 10.168 -7.117 -8.544 1.00 0.00 O ATOM 693 CB SER A 50 8.892 -4.938 -6.301 1.00 0.00 C ATOM 694 OG SER A 50 7.783 -4.412 -5.606 1.00 0.00 O ATOM 0 H SER A 50 10.038 -6.920 -5.370 1.00 0.00 H new ATOM 0 HA SER A 50 7.567 -6.546 -6.808 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.759 -4.946 -5.641 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.135 -4.283 -7.138 1.00 0.00 H new ATOM 0 HG SER A 50 7.111 -4.104 -6.249 1.00 0.00 H new ATOM 700 N PRO A 51 8.402 -5.927 -9.266 1.00 0.00 N ATOM 701 CA PRO A 51 7.104 -5.296 -9.088 1.00 0.00 C ATOM 702 C PRO A 51 6.027 -6.371 -8.884 1.00 0.00 C ATOM 703 O PRO A 51 6.067 -7.408 -9.552 1.00 0.00 O ATOM 704 CB PRO A 51 6.897 -4.463 -10.353 1.00 0.00 C ATOM 705 CG PRO A 51 7.629 -5.249 -11.431 1.00 0.00 C ATOM 706 CD PRO A 51 8.802 -5.867 -10.667 1.00 0.00 C ATOM 0 HA PRO A 51 7.044 -4.659 -8.205 1.00 0.00 H new ATOM 0 HB2 PRO A 51 5.839 -4.351 -10.589 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.307 -3.459 -10.242 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.991 -6.012 -11.878 1.00 0.00 H new ATOM 0 HG3 PRO A 51 7.969 -4.604 -12.241 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.031 -6.863 -11.048 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.703 -5.265 -10.787 1.00 0.00 H new ATOM 714 N VAL A 52 5.065 -6.157 -7.983 1.00 0.00 N ATOM 715 CA VAL A 52 4.018 -7.125 -7.658 1.00 0.00 C ATOM 716 C VAL A 52 2.690 -6.420 -7.384 1.00 0.00 C ATOM 717 O VAL A 52 2.673 -5.221 -7.091 1.00 0.00 O ATOM 718 CB VAL A 52 4.506 -8.021 -6.502 1.00 0.00 C ATOM 719 CG1 VAL A 52 4.811 -7.242 -5.221 1.00 0.00 C ATOM 720 CG2 VAL A 52 3.539 -9.171 -6.181 1.00 0.00 C ATOM 0 H VAL A 52 4.992 -5.290 -7.450 1.00 0.00 H new ATOM 0 HA VAL A 52 3.821 -7.777 -8.509 1.00 0.00 H new ATOM 0 HB VAL A 52 5.438 -8.448 -6.872 1.00 0.00 H new ATOM 0 HG11 VAL A 52 5.149 -7.932 -4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.592 -6.507 -5.419 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.910 -6.731 -4.882 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.939 -9.764 -5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 52 2.570 -8.762 -5.895 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.421 -9.803 -7.061 1.00 0.00 H new ATOM 730 N ILE A 53 1.592 -7.178 -7.485 1.00 0.00 N ATOM 731 CA ILE A 53 0.219 -6.754 -7.292 1.00 0.00 C ATOM 732 C ILE A 53 -0.345 -7.570 -6.123 1.00 0.00 C ATOM 733 O ILE A 53 -0.283 -8.803 -6.131 1.00 0.00 O ATOM 734 CB ILE A 53 -0.578 -6.957 -8.606 1.00 0.00 C ATOM 735 CG1 ILE A 53 0.052 -6.246 -9.827 1.00 0.00 C ATOM 736 CG2 ILE A 53 -2.060 -6.558 -8.486 1.00 0.00 C ATOM 737 CD1 ILE A 53 0.401 -4.769 -9.660 1.00 0.00 C ATOM 0 H ILE A 53 1.654 -8.169 -7.720 1.00 0.00 H new ATOM 0 HA ILE A 53 0.147 -5.694 -7.050 1.00 0.00 H new ATOM 0 HB ILE A 53 -0.526 -8.032 -8.778 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.962 -6.781 -10.099 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.636 -6.339 -10.667 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.560 -6.725 -9.440 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.538 -7.162 -7.715 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.132 -5.504 -8.218 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.834 -4.391 -10.586 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.502 -4.206 -9.425 1.00 0.00 H new ATOM 0 HD13 ILE A 53 1.121 -4.655 -8.849 1.00 0.00 H new ATOM 749 N LEU A 54 -0.866 -6.879 -5.108 1.00 0.00 N ATOM 750 CA LEU A 54 -1.694 -7.483 -4.064 1.00 0.00 C ATOM 751 C LEU A 54 -3.124 -7.580 -4.566 1.00 0.00 C ATOM 752 O LEU A 54 -3.613 -6.652 -5.213 1.00 0.00 O ATOM 753 CB LEU A 54 -1.725 -6.625 -2.790 1.00 0.00 C ATOM 754 CG LEU A 54 -0.398 -6.513 -2.027 1.00 0.00 C ATOM 755 CD1 LEU A 54 -0.609 -5.642 -0.783 1.00 0.00 C ATOM 756 CD2 LEU A 54 0.102 -7.892 -1.599 1.00 0.00 C ATOM 0 H LEU A 54 -0.724 -5.876 -4.987 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.268 -8.459 -3.833 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.054 -5.621 -3.059 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.476 -7.036 -2.116 1.00 0.00 H new ATOM 0 HG LEU A 54 0.347 -6.063 -2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.329 -5.557 -0.235 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.943 -4.650 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.363 -6.099 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.044 -7.787 -1.060 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.637 -8.362 -0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 54 0.257 -8.513 -2.481 1.00 0.00 H new ATOM 768 N SER A 55 -3.799 -8.650 -4.168 1.00 0.00 N ATOM 769 CA SER A 55 -5.192 -8.960 -4.430 1.00 0.00 C ATOM 770 C SER A 55 -5.990 -8.896 -3.115 1.00 0.00 C ATOM 771 O SER A 55 -5.427 -8.712 -2.031 1.00 0.00 O ATOM 772 CB SER A 55 -5.287 -10.340 -5.125 1.00 0.00 C ATOM 773 OG SER A 55 -4.060 -11.064 -5.176 1.00 0.00 O ATOM 0 H SER A 55 -3.350 -9.377 -3.611 1.00 0.00 H new ATOM 0 HA SER A 55 -5.631 -8.226 -5.106 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.029 -10.945 -4.604 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.651 -10.196 -6.142 1.00 0.00 H new ATOM 0 HG SER A 55 -4.205 -11.922 -5.627 1.00 0.00 H new ATOM 779 N ASP A 56 -7.310 -9.071 -3.201 1.00 0.00 N ATOM 780 CA ASP A 56 -8.243 -8.946 -2.079 1.00 0.00 C ATOM 781 C ASP A 56 -7.945 -9.916 -0.926 1.00 0.00 C ATOM 782 O ASP A 56 -8.131 -9.551 0.235 1.00 0.00 O ATOM 783 CB ASP A 56 -9.672 -9.147 -2.601 1.00 0.00 C ATOM 784 CG ASP A 56 -10.676 -9.347 -1.463 1.00 0.00 C ATOM 785 OD1 ASP A 56 -11.137 -8.344 -0.878 1.00 0.00 O ATOM 786 OD2 ASP A 56 -10.998 -10.513 -1.132 1.00 0.00 O ATOM 0 H ASP A 56 -7.773 -9.310 -4.078 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.125 -7.947 -1.660 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.966 -8.282 -3.196 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.698 -10.012 -3.263 1.00 0.00 H new ATOM 791 N GLU A 57 -7.481 -11.138 -1.211 1.00 0.00 N ATOM 792 CA GLU A 57 -7.168 -12.122 -0.167 1.00 0.00 C ATOM 793 C GLU A 57 -5.923 -11.749 0.638 1.00 0.00 C ATOM 794 O GLU A 57 -5.818 -12.118 1.813 1.00 0.00 O ATOM 795 CB GLU A 57 -6.959 -13.516 -0.772 1.00 0.00 C ATOM 796 CG GLU A 57 -8.291 -14.219 -1.054 1.00 0.00 C ATOM 797 CD GLU A 57 -8.166 -15.734 -0.906 1.00 0.00 C ATOM 798 OE1 GLU A 57 -7.615 -16.402 -1.814 1.00 0.00 O ATOM 799 OE2 GLU A 57 -8.703 -16.268 0.089 1.00 0.00 O ATOM 0 H GLU A 57 -7.313 -11.471 -2.160 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.025 -12.128 0.506 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.391 -13.429 -1.698 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.365 -14.123 -0.089 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -9.052 -13.847 -0.368 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -8.625 -13.977 -2.063 1.00 0.00 H new ATOM 806 N GLU A 58 -4.992 -11.024 0.019 1.00 0.00 N ATOM 807 CA GLU A 58 -3.821 -10.483 0.689 1.00 0.00 C ATOM 808 C GLU A 58 -4.303 -9.366 1.617 1.00 0.00 C ATOM 809 O GLU A 58 -4.053 -9.370 2.823 1.00 0.00 O ATOM 810 CB GLU A 58 -2.801 -9.918 -0.322 1.00 0.00 C ATOM 811 CG GLU A 58 -2.696 -10.620 -1.684 1.00 0.00 C ATOM 812 CD GLU A 58 -2.144 -12.031 -1.588 1.00 0.00 C ATOM 813 OE1 GLU A 58 -0.899 -12.154 -1.598 1.00 0.00 O ATOM 814 OE2 GLU A 58 -2.939 -12.996 -1.629 1.00 0.00 O ATOM 0 H GLU A 58 -5.035 -10.796 -0.974 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.319 -11.274 1.246 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.047 -8.871 -0.500 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.816 -9.939 0.145 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.683 -10.653 -2.145 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.057 -10.030 -2.341 1.00 0.00 H new ATOM 821 N LEU A 59 -5.056 -8.426 1.040 1.00 0.00 N ATOM 822 CA LEU A 59 -5.574 -7.215 1.667 1.00 0.00 C ATOM 823 C LEU A 59 -6.787 -7.521 2.559 1.00 0.00 C ATOM 824 O LEU A 59 -7.628 -6.654 2.789 1.00 0.00 O ATOM 825 CB LEU A 59 -5.899 -6.191 0.562 1.00 0.00 C ATOM 826 CG LEU A 59 -4.639 -5.669 -0.163 1.00 0.00 C ATOM 827 CD1 LEU A 59 -4.995 -5.085 -1.532 1.00 0.00 C ATOM 828 CD2 LEU A 59 -3.922 -4.594 0.665 1.00 0.00 C ATOM 0 H LEU A 59 -5.336 -8.498 0.062 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.820 -6.789 2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.567 -6.650 -0.167 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.435 -5.349 1.000 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.973 -6.522 -0.294 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.090 -4.725 -2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.457 -5.857 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.692 -4.257 -1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.040 -4.248 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.597 -3.755 0.834 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.620 -5.015 1.624 1.00 0.00 H new ATOM 840 N ALA A 60 -6.910 -8.750 3.056 1.00 0.00 N ATOM 841 CA ALA A 60 -7.949 -9.161 3.986 1.00 0.00 C ATOM 842 C ALA A 60 -7.655 -8.701 5.425 1.00 0.00 C ATOM 843 O ALA A 60 -8.523 -8.825 6.294 1.00 0.00 O ATOM 844 CB ALA A 60 -8.045 -10.683 3.918 1.00 0.00 C ATOM 0 H ALA A 60 -6.269 -9.506 2.813 1.00 0.00 H new ATOM 0 HA ALA A 60 -8.894 -8.695 3.705 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -8.817 -11.030 4.605 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.300 -10.987 2.903 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.087 -11.121 4.198 1.00 0.00 H new ATOM 850 N VAL A 61 -6.441 -8.213 5.694 1.00 0.00 N ATOM 851 CA VAL A 61 -6.009 -7.756 7.009 1.00 0.00 C ATOM 852 C VAL A 61 -6.448 -6.303 7.235 1.00 0.00 C ATOM 853 O VAL A 61 -6.460 -5.492 6.309 1.00 0.00 O ATOM 854 CB VAL A 61 -4.476 -7.915 7.141 1.00 0.00 C ATOM 855 CG1 VAL A 61 -4.059 -9.392 7.106 1.00 0.00 C ATOM 856 CG2 VAL A 61 -3.679 -7.153 6.069 1.00 0.00 C ATOM 0 H VAL A 61 -5.716 -8.124 4.982 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.479 -8.367 7.780 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.234 -7.477 8.110 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.976 -9.467 7.201 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.533 -9.924 7.931 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.372 -9.836 6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.612 -7.312 6.227 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.958 -7.518 5.080 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.901 -6.088 6.139 1.00 0.00 H new ATOM 866 N GLU A 62 -6.728 -5.939 8.488 1.00 0.00 N ATOM 867 CA GLU A 62 -7.022 -4.554 8.871 1.00 0.00 C ATOM 868 C GLU A 62 -5.839 -3.613 8.598 1.00 0.00 C ATOM 869 O GLU A 62 -6.032 -2.433 8.323 1.00 0.00 O ATOM 870 CB GLU A 62 -7.409 -4.454 10.360 1.00 0.00 C ATOM 871 CG GLU A 62 -6.445 -5.212 11.297 1.00 0.00 C ATOM 872 CD GLU A 62 -6.251 -4.609 12.697 1.00 0.00 C ATOM 873 OE1 GLU A 62 -6.914 -3.617 13.089 1.00 0.00 O ATOM 874 OE2 GLU A 62 -5.377 -5.127 13.429 1.00 0.00 O ATOM 0 H GLU A 62 -6.758 -6.596 9.268 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.865 -4.242 8.254 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.436 -3.404 10.651 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.417 -4.847 10.493 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.809 -6.233 11.410 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.471 -5.273 10.811 1.00 0.00 H new ATOM 881 N LYS A 63 -4.607 -4.106 8.731 1.00 0.00 N ATOM 882 CA LYS A 63 -3.385 -3.316 8.780 1.00 0.00 C ATOM 883 C LYS A 63 -2.279 -4.226 8.299 1.00 0.00 C ATOM 884 O LYS A 63 -2.306 -5.414 8.616 1.00 0.00 O ATOM 885 CB LYS A 63 -3.190 -2.813 10.228 1.00 0.00 C ATOM 886 CG LYS A 63 -2.028 -1.844 10.526 1.00 0.00 C ATOM 887 CD LYS A 63 -0.642 -2.486 10.619 1.00 0.00 C ATOM 888 CE LYS A 63 0.279 -1.702 11.566 1.00 0.00 C ATOM 889 NZ LYS A 63 1.580 -2.377 11.761 1.00 0.00 N ATOM 0 H LYS A 63 -4.431 -5.107 8.810 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.405 -2.429 8.147 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.115 -2.324 10.535 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.064 -3.687 10.867 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.005 -1.082 9.747 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.236 -1.333 11.466 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.738 -3.513 10.971 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.193 -2.530 9.627 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.446 -0.703 11.164 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.213 -1.579 12.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.279 -1.690 12.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.473 -3.144 12.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 1.905 -2.773 10.856 1.00 0.00 H new ATOM 903 N VAL A 64 -1.337 -3.706 7.525 1.00 0.00 N ATOM 904 CA VAL A 64 -0.228 -4.483 6.994 1.00 0.00 C ATOM 905 C VAL A 64 0.975 -3.553 7.077 1.00 0.00 C ATOM 906 O VAL A 64 0.808 -2.331 7.111 1.00 0.00 O ATOM 907 CB VAL A 64 -0.518 -4.975 5.545 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.138 -3.994 4.421 1.00 0.00 C ATOM 909 CG2 VAL A 64 0.085 -6.341 5.214 1.00 0.00 C ATOM 0 H VAL A 64 -1.322 -2.725 7.246 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.053 -5.399 7.558 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.605 -5.054 5.566 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.382 -4.436 3.455 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -0.694 -3.065 4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.931 -3.786 4.466 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -0.163 -6.609 4.187 1.00 0.00 H new ATOM 0 HG22 VAL A 64 1.168 -6.297 5.326 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -0.320 -7.092 5.893 1.00 0.00 H new ATOM 919 N THR A 65 2.171 -4.116 7.074 1.00 0.00 N ATOM 920 CA THR A 65 3.424 -3.399 7.239 1.00 0.00 C ATOM 921 C THR A 65 4.373 -3.932 6.173 1.00 0.00 C ATOM 922 O THR A 65 4.635 -5.138 6.151 1.00 0.00 O ATOM 923 CB THR A 65 3.973 -3.638 8.658 1.00 0.00 C ATOM 924 OG1 THR A 65 2.945 -3.651 9.636 1.00 0.00 O ATOM 925 CG2 THR A 65 5.005 -2.565 9.005 1.00 0.00 C ATOM 0 H THR A 65 2.301 -5.120 6.952 1.00 0.00 H new ATOM 0 HA THR A 65 3.298 -2.323 7.122 1.00 0.00 H new ATOM 0 HB THR A 65 4.444 -4.621 8.664 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.314 -3.948 10.494 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.389 -2.741 10.010 1.00 0.00 H new ATOM 0 HG22 THR A 65 5.827 -2.606 8.290 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.536 -1.582 8.962 1.00 0.00 H new ATOM 933 N LEU A 66 4.861 -3.090 5.264 1.00 0.00 N ATOM 934 CA LEU A 66 5.647 -3.526 4.117 1.00 0.00 C ATOM 935 C LEU A 66 6.831 -2.600 3.930 1.00 0.00 C ATOM 936 O LEU A 66 6.724 -1.388 4.073 1.00 0.00 O ATOM 937 CB LEU A 66 4.765 -3.576 2.865 1.00 0.00 C ATOM 938 CG LEU A 66 3.948 -4.877 2.801 1.00 0.00 C ATOM 939 CD1 LEU A 66 2.778 -4.702 1.857 1.00 0.00 C ATOM 940 CD2 LEU A 66 4.792 -6.038 2.274 1.00 0.00 C ATOM 0 H LEU A 66 4.720 -2.081 5.305 1.00 0.00 H new ATOM 0 HA LEU A 66 6.029 -4.532 4.293 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.089 -2.721 2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.390 -3.494 1.975 1.00 0.00 H new ATOM 0 HG LEU A 66 3.609 -5.098 3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.203 -5.627 1.815 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.140 -3.893 2.214 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.148 -4.460 0.861 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.185 -6.943 2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.148 -5.803 1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 66 5.645 -6.197 2.934 1.00 0.00 H new ATOM 952 N SER A 67 7.985 -3.180 3.639 1.00 0.00 N ATOM 953 CA SER A 67 9.260 -2.466 3.663 1.00 0.00 C ATOM 954 C SER A 67 10.188 -3.043 2.602 1.00 0.00 C ATOM 955 O SER A 67 9.749 -3.780 1.720 1.00 0.00 O ATOM 956 CB SER A 67 9.832 -2.506 5.093 1.00 0.00 C ATOM 957 OG SER A 67 10.993 -1.706 5.258 1.00 0.00 O ATOM 0 H SER A 67 8.068 -4.163 3.378 1.00 0.00 H new ATOM 0 HA SER A 67 9.133 -1.414 3.410 1.00 0.00 H new ATOM 0 HB2 SER A 67 9.066 -2.170 5.792 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.071 -3.537 5.352 1.00 0.00 H new ATOM 0 HG SER A 67 11.307 -1.772 6.184 1.00 0.00 H new ATOM 963 N THR A 68 11.456 -2.663 2.665 1.00 0.00 N ATOM 964 CA THR A 68 12.550 -3.113 1.832 1.00 0.00 C ATOM 965 C THR A 68 13.580 -3.819 2.705 1.00 0.00 C ATOM 966 O THR A 68 13.788 -3.438 3.858 1.00 0.00 O ATOM 967 CB THR A 68 13.169 -1.910 1.109 1.00 0.00 C ATOM 968 OG1 THR A 68 13.115 -0.704 1.866 1.00 0.00 O ATOM 969 CG2 THR A 68 12.448 -1.668 -0.212 1.00 0.00 C ATOM 0 H THR A 68 11.765 -1.979 3.355 1.00 0.00 H new ATOM 0 HA THR A 68 12.191 -3.815 1.079 1.00 0.00 H new ATOM 0 HB THR A 68 14.218 -2.163 0.953 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.181 -0.430 1.979 1.00 0.00 H new ATOM 0 HG21 THR A 68 12.894 -0.812 -0.718 1.00 0.00 H new ATOM 0 HG22 THR A 68 12.540 -2.552 -0.844 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.394 -1.467 -0.020 1.00 0.00 H new ATOM 977 N THR A 69 14.269 -4.827 2.169 1.00 0.00 N ATOM 978 CA THR A 69 15.326 -5.477 2.926 1.00 0.00 C ATOM 979 C THR A 69 16.575 -4.590 3.014 1.00 0.00 C ATOM 980 O THR A 69 17.394 -4.762 3.922 1.00 0.00 O ATOM 981 CB THR A 69 15.627 -6.873 2.360 1.00 0.00 C ATOM 982 OG1 THR A 69 16.055 -6.843 1.010 1.00 0.00 O ATOM 983 CG2 THR A 69 14.409 -7.800 2.443 1.00 0.00 C ATOM 0 H THR A 69 14.115 -5.201 1.233 1.00 0.00 H new ATOM 0 HA THR A 69 14.978 -5.620 3.949 1.00 0.00 H new ATOM 0 HB THR A 69 16.436 -7.255 2.983 1.00 0.00 H new ATOM 0 HG1 THR A 69 16.233 -7.756 0.703 1.00 0.00 H new ATOM 0 HG21 THR A 69 14.666 -8.776 2.032 1.00 0.00 H new ATOM 0 HG22 THR A 69 14.108 -7.913 3.484 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.586 -7.371 1.872 1.00 0.00 H new ATOM 991 N GLY A 70 16.728 -3.620 2.108 1.00 0.00 N ATOM 992 CA GLY A 70 17.878 -2.737 2.043 1.00 0.00 C ATOM 993 C GLY A 70 17.529 -1.436 1.334 1.00 0.00 C ATOM 994 O GLY A 70 16.381 -1.002 1.321 1.00 0.00 O ATOM 0 H GLY A 70 16.034 -3.429 1.385 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.233 -2.522 3.051 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.693 -3.234 1.517 1.00 0.00 H new ATOM 998 N LYS A 71 18.541 -0.772 0.784 1.00 0.00 N ATOM 999 CA LYS A 71 18.393 0.487 0.074 1.00 0.00 C ATOM 1000 C LYS A 71 17.621 0.261 -1.224 1.00 0.00 C ATOM 1001 O LYS A 71 17.924 -0.681 -1.956 1.00 0.00 O ATOM 1002 CB LYS A 71 19.787 1.054 -0.223 1.00 0.00 C ATOM 1003 CG LYS A 71 19.754 2.563 -0.488 1.00 0.00 C ATOM 1004 CD LYS A 71 21.099 3.041 -1.030 1.00 0.00 C ATOM 1005 CE LYS A 71 21.063 3.053 -2.558 1.00 0.00 C ATOM 1006 NZ LYS A 71 22.423 3.078 -3.142 1.00 0.00 N ATOM 0 H LYS A 71 19.505 -1.104 0.822 1.00 0.00 H new ATOM 0 HA LYS A 71 17.837 1.197 0.685 1.00 0.00 H new ATOM 0 HB2 LYS A 71 20.448 0.849 0.619 1.00 0.00 H new ATOM 0 HB3 LYS A 71 20.208 0.544 -1.089 1.00 0.00 H new ATOM 0 HG2 LYS A 71 18.964 2.795 -1.202 1.00 0.00 H new ATOM 0 HG3 LYS A 71 19.517 3.095 0.433 1.00 0.00 H new ATOM 0 HD2 LYS A 71 21.319 4.040 -0.654 1.00 0.00 H new ATOM 0 HD3 LYS A 71 21.897 2.386 -0.680 1.00 0.00 H new ATOM 0 HE2 LYS A 71 20.531 2.172 -2.916 1.00 0.00 H new ATOM 0 HE3 LYS A 71 20.504 3.924 -2.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 22.358 3.256 -4.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 22.979 3.834 -2.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 22.888 2.162 -2.979 1.00 0.00 H new ATOM 1020 N ALA A 72 16.690 1.154 -1.541 1.00 0.00 N ATOM 1021 CA ALA A 72 15.962 1.219 -2.789 1.00 0.00 C ATOM 1022 C ALA A 72 15.841 2.676 -3.243 1.00 0.00 C ATOM 1023 O ALA A 72 16.258 3.597 -2.537 1.00 0.00 O ATOM 1024 CB ALA A 72 14.578 0.598 -2.610 1.00 0.00 C ATOM 0 H ALA A 72 16.412 1.891 -0.893 1.00 0.00 H new ATOM 0 HA ALA A 72 16.501 0.659 -3.554 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.032 0.649 -3.552 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.683 -0.444 -2.307 1.00 0.00 H new ATOM 0 HB3 ALA A 72 14.030 1.145 -1.843 1.00 0.00 H new ATOM 1030 N ILE A 73 15.289 2.889 -4.438 1.00 0.00 N ATOM 1031 CA ILE A 73 15.200 4.201 -5.060 1.00 0.00 C ATOM 1032 C ILE A 73 13.796 4.380 -5.685 1.00 0.00 C ATOM 1033 O ILE A 73 13.666 5.138 -6.635 1.00 0.00 O ATOM 1034 CB ILE A 73 16.309 4.370 -6.142 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.581 3.503 -6.049 1.00 0.00 C ATOM 1036 CG2 ILE A 73 16.746 5.843 -6.195 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.641 3.849 -4.995 1.00 0.00 C ATOM 0 H ILE A 73 14.887 2.142 -5.005 1.00 0.00 H new ATOM 0 HA ILE A 73 15.352 4.968 -4.301 1.00 0.00 H new ATOM 0 HB ILE A 73 15.812 4.010 -7.043 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.266 2.474 -5.874 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.067 3.526 -7.024 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.522 5.965 -6.951 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.890 6.468 -6.449 1.00 0.00 H new ATOM 0 HG23 ILE A 73 17.137 6.142 -5.222 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.468 3.142 -5.065 1.00 0.00 H new ATOM 0 HD12 ILE A 73 19.011 4.859 -5.169 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.198 3.791 -4.001 1.00 0.00 H new ATOM 1049 N GLU A 74 12.748 3.645 -5.286 1.00 0.00 N ATOM 1050 CA GLU A 74 11.357 3.950 -5.668 1.00 0.00 C ATOM 1051 C GLU A 74 10.405 3.374 -4.619 1.00 0.00 C ATOM 1052 O GLU A 74 10.774 2.408 -3.952 1.00 0.00 O ATOM 1053 CB GLU A 74 10.973 3.346 -7.036 1.00 0.00 C ATOM 1054 CG GLU A 74 11.307 4.268 -8.218 1.00 0.00 C ATOM 1055 CD GLU A 74 10.215 4.224 -9.287 1.00 0.00 C ATOM 1056 OE1 GLU A 74 10.055 3.154 -9.919 1.00 0.00 O ATOM 1057 OE2 GLU A 74 9.488 5.232 -9.459 1.00 0.00 O ATOM 0 H GLU A 74 12.838 2.822 -4.690 1.00 0.00 H new ATOM 0 HA GLU A 74 11.277 5.035 -5.734 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.492 2.397 -7.166 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.905 3.129 -7.043 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.427 5.291 -7.861 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.259 3.969 -8.656 1.00 0.00 H new ATOM 1064 N PHE A 75 9.178 3.899 -4.525 1.00 0.00 N ATOM 1065 CA PHE A 75 8.027 3.246 -3.896 1.00 0.00 C ATOM 1066 C PHE A 75 6.767 3.737 -4.616 1.00 0.00 C ATOM 1067 O PHE A 75 6.152 4.735 -4.225 1.00 0.00 O ATOM 1068 CB PHE A 75 8.000 3.461 -2.358 1.00 0.00 C ATOM 1069 CG PHE A 75 7.922 2.221 -1.467 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.533 1.003 -1.838 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.337 2.316 -0.185 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.645 -0.060 -0.926 1.00 0.00 C ATOM 1073 CE2 PHE A 75 7.448 1.251 0.721 1.00 0.00 C ATOM 1074 CZ PHE A 75 8.130 0.079 0.370 1.00 0.00 C ATOM 0 H PHE A 75 8.953 4.821 -4.898 1.00 0.00 H new ATOM 0 HA PHE A 75 8.092 2.163 -4.005 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.896 4.016 -2.082 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.146 4.096 -2.123 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.921 0.887 -2.839 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.803 3.211 0.098 1.00 0.00 H new ATOM 0 HE1 PHE A 75 9.126 -0.980 -1.222 1.00 0.00 H new ATOM 0 HE2 PHE A 75 7.002 1.336 1.701 1.00 0.00 H new ATOM 0 HZ PHE A 75 8.258 -0.713 1.093 1.00 0.00 H new ATOM 1084 N ALA A 76 6.432 3.076 -5.726 1.00 0.00 N ATOM 1085 CA ALA A 76 5.174 3.294 -6.427 1.00 0.00 C ATOM 1086 C ALA A 76 4.063 2.553 -5.692 1.00 0.00 C ATOM 1087 O ALA A 76 4.277 1.418 -5.273 1.00 0.00 O ATOM 1088 CB ALA A 76 5.286 2.830 -7.879 1.00 0.00 C ATOM 0 H ALA A 76 7.030 2.374 -6.162 1.00 0.00 H new ATOM 0 HA ALA A 76 4.938 4.358 -6.442 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.338 3.000 -8.389 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.074 3.392 -8.381 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.526 1.767 -7.904 1.00 0.00 H new ATOM 1094 N VAL A 77 2.902 3.187 -5.540 1.00 0.00 N ATOM 1095 CA VAL A 77 1.750 2.725 -4.784 1.00 0.00 C ATOM 1096 C VAL A 77 0.509 3.292 -5.492 1.00 0.00 C ATOM 1097 O VAL A 77 0.229 4.487 -5.387 1.00 0.00 O ATOM 1098 CB VAL A 77 1.857 3.183 -3.305 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.662 2.661 -2.498 1.00 0.00 C ATOM 1100 CG2 VAL A 77 3.174 2.763 -2.629 1.00 0.00 C ATOM 0 H VAL A 77 2.735 4.096 -5.972 1.00 0.00 H new ATOM 0 HA VAL A 77 1.690 1.637 -4.753 1.00 0.00 H new ATOM 0 HB VAL A 77 1.848 4.273 -3.320 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.751 2.990 -1.463 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.263 3.050 -2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.648 1.572 -2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.182 3.115 -1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.259 1.676 -2.642 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.015 3.199 -3.168 1.00 0.00 H new ATOM 1110 N SER A 78 -0.234 2.443 -6.209 1.00 0.00 N ATOM 1111 CA SER A 78 -1.472 2.801 -6.904 1.00 0.00 C ATOM 1112 C SER A 78 -2.512 1.671 -6.800 1.00 0.00 C ATOM 1113 O SER A 78 -2.197 0.596 -6.275 1.00 0.00 O ATOM 1114 CB SER A 78 -1.170 3.165 -8.370 1.00 0.00 C ATOM 1115 OG SER A 78 -0.256 4.242 -8.448 1.00 0.00 O ATOM 0 H SER A 78 0.017 1.461 -6.324 1.00 0.00 H new ATOM 0 HA SER A 78 -1.904 3.677 -6.421 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.760 2.297 -8.887 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.096 3.431 -8.880 1.00 0.00 H new ATOM 0 HG SER A 78 -0.057 4.435 -9.388 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.750 1.898 -7.262 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.752 0.850 -7.468 1.00 0.00 C ATOM 1123 C GLY A 79 -6.164 1.431 -7.511 1.00 0.00 C ATOM 1124 O GLY A 79 -6.629 1.819 -8.586 1.00 0.00 O ATOM 0 H GLY A 79 -4.085 2.830 -7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.545 0.324 -8.400 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.683 0.116 -6.665 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.825 1.530 -6.354 1.00 0.00 N ATOM 1129 CA GLY A 80 -8.147 2.133 -6.189 1.00 0.00 C ATOM 1130 C GLY A 80 -9.197 1.022 -6.176 1.00 0.00 C ATOM 1131 O GLY A 80 -9.151 0.100 -7.000 1.00 0.00 O ATOM 0 H GLY A 80 -6.439 1.180 -5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.189 2.703 -5.261 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.347 2.832 -7.001 1.00 0.00 H new ATOM 1135 N VAL A 81 -10.128 1.064 -5.226 1.00 0.00 N ATOM 1136 CA VAL A 81 -11.163 0.045 -5.071 1.00 0.00 C ATOM 1137 C VAL A 81 -12.428 0.534 -5.783 1.00 0.00 C ATOM 1138 O VAL A 81 -12.534 1.697 -6.179 1.00 0.00 O ATOM 1139 CB VAL A 81 -11.338 -0.301 -3.569 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -11.761 0.863 -2.671 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -12.236 -1.507 -3.313 1.00 0.00 C ATOM 0 H VAL A 81 -10.186 1.813 -4.536 1.00 0.00 H new ATOM 0 HA VAL A 81 -10.890 -0.899 -5.543 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.320 -0.562 -3.280 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -11.855 0.514 -1.643 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -11.010 1.651 -2.719 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -12.720 1.254 -3.010 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -12.309 -1.685 -2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -13.230 -1.313 -3.717 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -11.812 -2.386 -3.799 1.00 0.00 H new ATOM 1151 N VAL A 82 -13.410 -0.341 -5.953 1.00 0.00 N ATOM 1152 CA VAL A 82 -14.708 -0.010 -6.518 1.00 0.00 C ATOM 1153 C VAL A 82 -15.765 -0.475 -5.507 1.00 0.00 C ATOM 1154 O VAL A 82 -15.424 -0.911 -4.404 1.00 0.00 O ATOM 1155 CB VAL A 82 -14.772 -0.569 -7.962 1.00 0.00 C ATOM 1156 CG1 VAL A 82 -14.449 -2.068 -8.053 1.00 0.00 C ATOM 1157 CG2 VAL A 82 -16.091 -0.278 -8.689 1.00 0.00 C ATOM 0 H VAL A 82 -13.322 -1.324 -5.695 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.902 1.054 -6.656 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.985 -0.019 -8.478 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -14.513 -2.391 -9.092 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -13.441 -2.246 -7.679 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -15.164 -2.631 -7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -16.055 -0.702 -9.692 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -16.917 -0.724 -8.136 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -16.239 0.800 -8.756 1.00 0.00 H new ATOM 1167 N ASP A 83 -17.042 -0.317 -5.820 1.00 0.00 N ATOM 1168 CA ASP A 83 -18.152 -0.808 -5.020 1.00 0.00 C ATOM 1169 C ASP A 83 -18.763 -1.901 -5.887 1.00 0.00 C ATOM 1170 O ASP A 83 -19.267 -1.630 -6.979 1.00 0.00 O ATOM 1171 CB ASP A 83 -19.088 0.354 -4.663 1.00 0.00 C ATOM 1172 CG ASP A 83 -19.620 0.245 -3.238 1.00 0.00 C ATOM 1173 OD1 ASP A 83 -20.306 -0.749 -2.916 1.00 0.00 O ATOM 1174 OD2 ASP A 83 -19.305 1.151 -2.422 1.00 0.00 O ATOM 0 H ASP A 83 -17.343 0.171 -6.663 1.00 0.00 H new ATOM 0 HA ASP A 83 -17.881 -1.221 -4.049 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -18.555 1.297 -4.779 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.925 0.373 -5.361 1.00 0.00 H new ATOM 1179 N GLY A 84 -18.520 -3.160 -5.521 1.00 0.00 N ATOM 1180 CA GLY A 84 -18.761 -4.328 -6.365 1.00 0.00 C ATOM 1181 C GLY A 84 -20.117 -4.974 -6.104 1.00 0.00 C ATOM 1182 O GLY A 84 -20.382 -6.062 -6.622 1.00 0.00 O ATOM 0 H GLY A 84 -18.140 -3.401 -4.605 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -18.700 -4.033 -7.412 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -17.974 -5.063 -6.194 1.00 0.00 H new ATOM 1186 N GLU A 85 -20.964 -4.339 -5.298 1.00 0.00 N ATOM 1187 CA GLU A 85 -22.314 -4.772 -4.981 1.00 0.00 C ATOM 1188 C GLU A 85 -23.268 -3.632 -5.386 1.00 0.00 C ATOM 1189 O GLU A 85 -22.819 -2.602 -5.893 1.00 0.00 O ATOM 1190 CB GLU A 85 -22.406 -5.189 -3.497 1.00 0.00 C ATOM 1191 CG GLU A 85 -21.336 -6.203 -3.028 1.00 0.00 C ATOM 1192 CD GLU A 85 -21.728 -7.080 -1.815 1.00 0.00 C ATOM 1193 OE1 GLU A 85 -21.533 -6.723 -0.630 1.00 0.00 O ATOM 1194 OE2 GLU A 85 -22.138 -8.240 -2.059 1.00 0.00 O ATOM 0 H GLU A 85 -20.712 -3.469 -4.829 1.00 0.00 H new ATOM 0 HA GLU A 85 -22.605 -5.663 -5.538 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -22.330 -4.294 -2.880 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -23.392 -5.617 -3.317 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -21.093 -6.859 -3.864 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -20.428 -5.655 -2.778 1.00 0.00 H new ATOM 1201 N ASP A 86 -24.582 -3.827 -5.248 1.00 0.00 N ATOM 1202 CA ASP A 86 -25.631 -2.837 -5.498 1.00 0.00 C ATOM 1203 C ASP A 86 -26.914 -3.408 -4.900 1.00 0.00 C ATOM 1204 O ASP A 86 -27.254 -4.563 -5.178 1.00 0.00 O ATOM 1205 CB ASP A 86 -25.848 -2.546 -6.997 1.00 0.00 C ATOM 1206 CG ASP A 86 -26.876 -1.434 -7.256 1.00 0.00 C ATOM 1207 OD1 ASP A 86 -27.252 -0.702 -6.312 1.00 0.00 O ATOM 1208 OD2 ASP A 86 -27.253 -1.254 -8.439 1.00 0.00 O ATOM 0 H ASP A 86 -24.961 -4.724 -4.944 1.00 0.00 H new ATOM 0 HA ASP A 86 -25.340 -1.888 -5.047 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -24.896 -2.264 -7.447 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -26.177 -3.459 -7.494 1.00 0.00 H new ATOM 1213 N GLY A 87 -27.574 -2.658 -4.023 1.00 0.00 N ATOM 1214 CA GLY A 87 -28.819 -3.047 -3.376 1.00 0.00 C ATOM 1215 C GLY A 87 -28.610 -4.149 -2.337 1.00 0.00 C ATOM 1216 O GLY A 87 -29.493 -4.987 -2.146 1.00 0.00 O ATOM 0 H GLY A 87 -27.246 -1.736 -3.736 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -29.264 -2.176 -2.895 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -29.527 -3.391 -4.130 1.00 0.00 H new ATOM 1220 N VAL A 88 -27.442 -4.185 -1.696 1.00 0.00 N ATOM 1221 CA VAL A 88 -27.068 -5.139 -0.660 1.00 0.00 C ATOM 1222 C VAL A 88 -27.165 -4.475 0.722 1.00 0.00 C ATOM 1223 O VAL A 88 -27.780 -3.418 0.875 1.00 0.00 O ATOM 1224 CB VAL A 88 -25.663 -5.679 -0.981 1.00 0.00 C ATOM 1225 CG1 VAL A 88 -25.698 -6.555 -2.242 1.00 0.00 C ATOM 1226 CG2 VAL A 88 -24.618 -4.561 -1.086 1.00 0.00 C ATOM 0 H VAL A 88 -26.698 -3.517 -1.897 1.00 0.00 H new ATOM 0 HA VAL A 88 -27.752 -5.988 -0.637 1.00 0.00 H new ATOM 0 HB VAL A 88 -25.351 -6.304 -0.145 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -24.696 -6.928 -2.454 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -26.372 -7.396 -2.082 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -26.051 -5.963 -3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -23.644 -4.994 -1.314 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -24.903 -3.870 -1.880 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -24.564 -4.023 -0.139 1.00 0.00 H new ATOM 1236 N VAL A 89 -26.569 -5.085 1.747 1.00 0.00 N ATOM 1237 CA VAL A 89 -26.210 -4.419 2.985 1.00 0.00 C ATOM 1238 C VAL A 89 -24.718 -4.655 3.222 1.00 0.00 C ATOM 1239 O VAL A 89 -24.293 -5.786 3.472 1.00 0.00 O ATOM 1240 CB VAL A 89 -27.157 -4.861 4.113 1.00 0.00 C ATOM 1241 CG1 VAL A 89 -27.183 -6.365 4.400 1.00 0.00 C ATOM 1242 CG2 VAL A 89 -26.875 -4.115 5.419 1.00 0.00 C ATOM 0 H VAL A 89 -26.321 -6.074 1.733 1.00 0.00 H new ATOM 0 HA VAL A 89 -26.345 -3.338 2.943 1.00 0.00 H new ATOM 0 HB VAL A 89 -28.142 -4.600 3.726 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -27.882 -6.569 5.211 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -27.500 -6.901 3.505 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -26.186 -6.698 4.688 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -27.566 -4.457 6.190 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -25.851 -4.312 5.736 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -27.007 -3.044 5.262 1.00 0.00 H new ATOM 1252 N ASN A 90 -23.932 -3.586 3.098 1.00 0.00 N ATOM 1253 CA ASN A 90 -22.549 -3.483 3.550 1.00 0.00 C ATOM 1254 C ASN A 90 -22.361 -2.073 4.120 1.00 0.00 C ATOM 1255 O ASN A 90 -23.316 -1.288 4.134 1.00 0.00 O ATOM 1256 CB ASN A 90 -21.555 -3.824 2.417 1.00 0.00 C ATOM 1257 CG ASN A 90 -20.831 -5.106 2.798 1.00 0.00 C ATOM 1258 OD1 ASN A 90 -20.034 -5.119 3.731 1.00 0.00 O ATOM 1259 ND2 ASN A 90 -21.130 -6.218 2.151 1.00 0.00 N ATOM 0 H ASN A 90 -24.261 -2.727 2.657 1.00 0.00 H new ATOM 0 HA ASN A 90 -22.337 -4.214 4.330 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -22.083 -3.951 1.472 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -20.843 -3.011 2.277 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -20.697 -7.100 2.425 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -21.794 -6.195 1.377 1.00 0.00 H new ATOM 1266 N GLU A 91 -21.169 -1.720 4.592 1.00 0.00 N ATOM 1267 CA GLU A 91 -20.808 -0.365 5.011 1.00 0.00 C ATOM 1268 C GLU A 91 -19.640 0.137 4.159 1.00 0.00 C ATOM 1269 O GLU A 91 -18.929 -0.685 3.585 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.395 -0.395 6.484 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.599 -0.460 7.417 1.00 0.00 C ATOM 1272 CD GLU A 91 -21.975 0.897 8.013 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -22.365 1.819 7.264 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -22.046 0.977 9.264 1.00 0.00 O ATOM 0 H GLU A 91 -20.404 -2.386 4.697 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.659 0.303 4.881 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.752 -1.257 6.662 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.807 0.494 6.713 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.453 -0.858 6.869 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -21.386 -1.158 8.226 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.415 1.459 4.090 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.292 2.034 3.362 1.00 0.00 C ATOM 1283 C PRO A 92 -17.010 2.059 4.197 1.00 0.00 C ATOM 1284 O PRO A 92 -17.013 1.679 5.373 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.765 3.446 3.009 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.663 3.825 4.186 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.297 2.501 4.599 1.00 0.00 C ATOM 0 HA PRO A 92 -18.030 1.446 2.482 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.927 4.136 2.905 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.311 3.463 2.066 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -19.089 4.266 5.001 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -20.417 4.556 3.895 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.394 2.436 5.683 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -21.300 2.402 4.183 1.00 0.00 H new ATOM 1295 N MET A 93 -15.901 2.543 3.626 1.00 0.00 N ATOM 1296 CA MET A 93 -14.591 2.405 4.238 1.00 0.00 C ATOM 1297 C MET A 93 -13.679 3.575 3.910 1.00 0.00 C ATOM 1298 O MET A 93 -14.018 4.447 3.111 1.00 0.00 O ATOM 1299 CB MET A 93 -13.962 1.052 3.869 1.00 0.00 C ATOM 1300 CG MET A 93 -13.953 0.681 2.385 1.00 0.00 C ATOM 1301 SD MET A 93 -12.889 -0.734 1.951 1.00 0.00 S ATOM 1302 CE MET A 93 -11.288 -0.292 2.681 1.00 0.00 C ATOM 0 H MET A 93 -15.894 3.036 2.733 1.00 0.00 H new ATOM 0 HA MET A 93 -14.724 2.424 5.320 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.933 1.046 4.228 1.00 0.00 H new ATOM 0 HB3 MET A 93 -14.493 0.270 4.412 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.974 0.457 2.076 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.629 1.549 1.811 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.518 -0.965 2.304 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.036 0.734 2.412 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.346 -0.379 3.766 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.532 3.613 4.577 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.472 4.594 4.432 1.00 0.00 C ATOM 1314 C GLN A 94 -10.148 3.853 4.512 1.00 0.00 C ATOM 1315 O GLN A 94 -10.079 2.735 5.038 1.00 0.00 O ATOM 1316 CB GLN A 94 -11.597 5.655 5.542 1.00 0.00 C ATOM 1317 CG GLN A 94 -12.557 6.757 5.093 1.00 0.00 C ATOM 1318 CD GLN A 94 -13.123 7.602 6.226 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -12.411 8.107 7.092 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -14.423 7.830 6.205 1.00 0.00 N ATOM 0 H GLN A 94 -12.306 2.910 5.280 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.538 5.114 3.476 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.961 5.194 6.460 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.618 6.080 5.765 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -12.037 7.411 4.393 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.384 6.301 4.549 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -15.004 7.406 5.482 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -14.847 8.431 6.912 1.00 0.00 H new ATOM 1329 N TRP A 95 -9.105 4.483 3.983 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.744 3.985 3.985 1.00 0.00 C ATOM 1331 C TRP A 95 -6.850 5.085 4.542 1.00 0.00 C ATOM 1332 O TRP A 95 -7.034 6.261 4.224 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.304 3.590 2.559 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.494 2.161 2.126 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.196 1.203 2.774 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -6.882 1.474 0.986 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.026 -0.011 2.146 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.138 0.078 1.108 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -6.107 1.870 -0.122 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -6.548 -0.882 0.278 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -5.505 0.913 -0.961 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -5.708 -0.461 -0.759 1.00 0.00 C ATOM 0 H TRP A 95 -9.193 5.390 3.524 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.670 3.090 4.603 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -7.843 4.225 1.856 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.246 3.830 2.459 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -8.801 1.366 3.654 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -8.503 -0.870 2.420 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.973 2.921 -0.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -6.738 -1.933 0.436 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -4.876 1.242 -1.775 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -5.222 -1.185 -1.396 1.00 0.00 H new ATOM 1353 N VAL A 96 -5.857 4.701 5.333 1.00 0.00 N ATOM 1354 CA VAL A 96 -4.712 5.515 5.703 1.00 0.00 C ATOM 1355 C VAL A 96 -3.518 4.661 5.293 1.00 0.00 C ATOM 1356 O VAL A 96 -3.306 3.598 5.876 1.00 0.00 O ATOM 1357 CB VAL A 96 -4.722 5.842 7.222 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -3.818 7.043 7.512 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -6.120 6.111 7.807 1.00 0.00 C ATOM 0 H VAL A 96 -5.829 3.771 5.752 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.700 6.490 5.217 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.348 4.943 7.712 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.834 7.261 8.580 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.798 6.813 7.204 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.177 7.911 6.959 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.033 6.330 8.871 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.570 6.962 7.297 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.748 5.231 7.668 1.00 0.00 H new ATOM 1369 N VAL A 97 -2.814 4.976 4.207 1.00 0.00 N ATOM 1370 CA VAL A 97 -1.429 4.532 4.123 1.00 0.00 C ATOM 1371 C VAL A 97 -0.607 5.566 4.895 1.00 0.00 C ATOM 1372 O VAL A 97 -1.005 6.731 4.993 1.00 0.00 O ATOM 1373 CB VAL A 97 -0.938 4.422 2.670 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -1.494 3.191 1.959 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -1.242 5.657 1.822 1.00 0.00 C ATOM 0 H VAL A 97 -3.160 5.511 3.410 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.325 3.532 4.544 1.00 0.00 H new ATOM 0 HB VAL A 97 0.144 4.332 2.763 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.117 3.160 0.937 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.180 2.292 2.489 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.583 3.241 1.943 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -0.866 5.505 0.810 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.319 5.819 1.788 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.758 6.529 2.262 1.00 0.00 H new ATOM 1385 N THR A 98 0.575 5.200 5.365 1.00 0.00 N ATOM 1386 CA THR A 98 1.552 6.130 5.909 1.00 0.00 C ATOM 1387 C THR A 98 2.885 5.642 5.364 1.00 0.00 C ATOM 1388 O THR A 98 3.123 4.434 5.378 1.00 0.00 O ATOM 1389 CB THR A 98 1.495 6.094 7.444 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.174 6.289 7.910 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.352 7.197 8.051 1.00 0.00 C ATOM 0 H THR A 98 0.888 4.229 5.379 1.00 0.00 H new ATOM 0 HA THR A 98 1.375 7.168 5.628 1.00 0.00 H new ATOM 0 HB THR A 98 1.865 5.114 7.744 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.165 6.260 8.890 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.293 7.147 9.138 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.388 7.067 7.738 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.990 8.167 7.712 1.00 0.00 H new ATOM 1399 N VAL A 99 3.718 6.544 4.841 1.00 0.00 N ATOM 1400 CA VAL A 99 5.003 6.154 4.257 1.00 0.00 C ATOM 1401 C VAL A 99 6.114 6.709 5.143 1.00 0.00 C ATOM 1402 O VAL A 99 6.004 7.830 5.658 1.00 0.00 O ATOM 1403 CB VAL A 99 5.133 6.582 2.777 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.243 5.790 2.071 1.00 0.00 C ATOM 1405 CG2 VAL A 99 3.838 6.362 1.972 1.00 0.00 C ATOM 0 H VAL A 99 3.527 7.545 4.810 1.00 0.00 H new ATOM 0 HA VAL A 99 5.081 5.067 4.230 1.00 0.00 H new ATOM 0 HB VAL A 99 5.363 7.647 2.806 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.314 6.110 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.194 5.971 2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.010 4.726 2.108 1.00 0.00 H new ATOM 0 HG21 VAL A 99 3.992 6.681 0.941 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.574 5.305 1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.030 6.945 2.416 1.00 0.00 H new ATOM 1415 N TYR A 100 7.169 5.920 5.320 1.00 0.00 N ATOM 1416 CA TYR A 100 8.304 6.169 6.188 1.00 0.00 C ATOM 1417 C TYR A 100 9.584 6.079 5.353 1.00 0.00 C ATOM 1418 O TYR A 100 9.735 5.212 4.484 1.00 0.00 O ATOM 1419 CB TYR A 100 8.324 5.155 7.346 1.00 0.00 C ATOM 1420 CG TYR A 100 7.150 5.222 8.317 1.00 0.00 C ATOM 1421 CD1 TYR A 100 5.865 4.816 7.911 1.00 0.00 C ATOM 1422 CD2 TYR A 100 7.340 5.649 9.645 1.00 0.00 C ATOM 1423 CE1 TYR A 100 4.773 4.906 8.790 1.00 0.00 C ATOM 1424 CE2 TYR A 100 6.250 5.757 10.529 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.952 5.409 10.095 1.00 0.00 C ATOM 1426 OH TYR A 100 3.892 5.527 10.943 1.00 0.00 O ATOM 0 H TYR A 100 7.255 5.032 4.826 1.00 0.00 H new ATOM 0 HA TYR A 100 8.230 7.164 6.626 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.362 4.151 6.923 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.245 5.298 7.911 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.717 4.431 6.913 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.333 5.896 9.989 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.793 4.589 8.465 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.406 6.106 11.539 1.00 0.00 H new ATOM 0 HH TYR A 100 4.198 5.890 11.801 1.00 0.00 H new ATOM 1436 N LYS A 101 10.511 6.998 5.615 1.00 0.00 N ATOM 1437 CA LYS A 101 11.838 7.044 5.027 1.00 0.00 C ATOM 1438 C LYS A 101 12.820 6.481 6.056 1.00 0.00 C ATOM 1439 O LYS A 101 12.410 5.964 7.090 1.00 0.00 O ATOM 1440 CB LYS A 101 12.117 8.489 4.561 1.00 0.00 C ATOM 1441 CG LYS A 101 13.059 8.578 3.350 1.00 0.00 C ATOM 1442 CD LYS A 101 12.873 9.828 2.481 1.00 0.00 C ATOM 1443 CE LYS A 101 14.137 10.657 2.228 1.00 0.00 C ATOM 1444 NZ LYS A 101 13.790 11.925 1.545 1.00 0.00 N ATOM 0 H LYS A 101 10.346 7.761 6.271 1.00 0.00 H new ATOM 0 HA LYS A 101 11.943 6.427 4.135 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.171 8.969 4.310 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.550 9.051 5.389 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.089 8.550 3.706 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.913 7.695 2.728 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.464 9.521 1.519 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.129 10.469 2.954 1.00 0.00 H new ATOM 0 HE2 LYS A 101 14.636 10.870 3.173 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.838 10.087 1.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 14.655 12.478 1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.333 11.715 0.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 13.138 12.473 2.141 1.00 0.00 H new ATOM 1458 N ASN A 102 14.116 6.534 5.750 1.00 0.00 N ATOM 1459 CA ASN A 102 15.236 6.015 6.527 1.00 0.00 C ATOM 1460 C ASN A 102 15.390 6.854 7.807 1.00 0.00 C ATOM 1461 O ASN A 102 16.361 7.598 7.968 1.00 0.00 O ATOM 1462 CB ASN A 102 16.543 5.934 5.702 1.00 0.00 C ATOM 1463 CG ASN A 102 17.057 7.218 5.052 1.00 0.00 C ATOM 1464 OD1 ASN A 102 17.999 7.839 5.530 1.00 0.00 O ATOM 1465 ND2 ASN A 102 16.528 7.590 3.898 1.00 0.00 N ATOM 0 H ASN A 102 14.432 6.975 4.886 1.00 0.00 H new ATOM 0 HA ASN A 102 15.022 4.985 6.811 1.00 0.00 H new ATOM 0 HB2 ASN A 102 17.328 5.552 6.355 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.396 5.195 4.914 1.00 0.00 H new ATOM 0 HD21 ASN A 102 16.904 8.398 3.401 1.00 0.00 H new ATOM 0 HD22 ASN A 102 15.744 7.069 3.505 1.00 0.00 H new ATOM 1472 N GLY A 103 14.406 6.794 8.705 1.00 0.00 N ATOM 1473 CA GLY A 103 14.322 7.630 9.884 1.00 0.00 C ATOM 1474 C GLY A 103 12.941 7.595 10.518 1.00 0.00 C ATOM 1475 O GLY A 103 12.818 7.102 11.644 1.00 0.00 O ATOM 0 H GLY A 103 13.627 6.141 8.622 1.00 0.00 H new ATOM 0 HA2 GLY A 103 15.063 7.302 10.613 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.571 8.657 9.617 1.00 0.00 H new ATOM 1479 N LYS A 104 11.929 8.162 9.851 1.00 0.00 N ATOM 1480 CA LYS A 104 10.575 8.311 10.373 1.00 0.00 C ATOM 1481 C LYS A 104 9.556 8.455 9.241 1.00 0.00 C ATOM 1482 O LYS A 104 9.921 8.447 8.062 1.00 0.00 O ATOM 1483 CB LYS A 104 10.537 9.466 11.373 1.00 0.00 C ATOM 1484 CG LYS A 104 10.508 10.853 10.725 1.00 0.00 C ATOM 1485 CD LYS A 104 9.260 11.641 11.146 1.00 0.00 C ATOM 1486 CE LYS A 104 9.352 12.101 12.597 1.00 0.00 C ATOM 1487 NZ LYS A 104 8.080 12.669 13.082 1.00 0.00 N ATOM 0 H LYS A 104 12.037 8.538 8.909 1.00 0.00 H new ATOM 0 HA LYS A 104 10.288 7.407 10.909 1.00 0.00 H new ATOM 0 HB2 LYS A 104 9.658 9.355 12.007 1.00 0.00 H new ATOM 0 HB3 LYS A 104 11.409 9.399 12.023 1.00 0.00 H new ATOM 0 HG2 LYS A 104 11.403 11.407 11.008 1.00 0.00 H new ATOM 0 HG3 LYS A 104 10.526 10.750 9.640 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.139 12.507 10.496 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.375 11.019 11.016 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.635 11.258 13.227 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.141 12.848 12.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.189 12.968 14.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.822 13.490 12.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.332 11.950 13.018 1.00 0.00 H new ATOM 1501 N GLU A 105 8.294 8.668 9.618 1.00 0.00 N ATOM 1502 CA GLU A 105 7.193 9.049 8.742 1.00 0.00 C ATOM 1503 C GLU A 105 7.602 10.237 7.874 1.00 0.00 C ATOM 1504 O GLU A 105 8.180 11.212 8.365 1.00 0.00 O ATOM 1505 CB GLU A 105 5.988 9.455 9.603 1.00 0.00 C ATOM 1506 CG GLU A 105 4.714 9.794 8.804 1.00 0.00 C ATOM 1507 CD GLU A 105 4.054 11.103 9.252 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.529 12.202 8.883 1.00 0.00 O ATOM 1509 OE2 GLU A 105 3.026 11.026 9.972 1.00 0.00 O ATOM 0 H GLU A 105 8.001 8.574 10.591 1.00 0.00 H new ATOM 0 HA GLU A 105 6.935 8.206 8.101 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.762 8.643 10.295 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.264 10.320 10.206 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.964 9.864 7.745 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.998 8.979 8.909 1.00 0.00 H new ATOM 1516 N ILE A 106 7.217 10.204 6.606 1.00 0.00 N ATOM 1517 CA ILE A 106 7.358 11.316 5.684 1.00 0.00 C ATOM 1518 C ILE A 106 6.049 11.638 4.960 1.00 0.00 C ATOM 1519 O ILE A 106 5.877 12.795 4.569 1.00 0.00 O ATOM 1520 CB ILE A 106 8.504 11.033 4.701 1.00 0.00 C ATOM 1521 CG1 ILE A 106 8.363 9.659 4.011 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.856 11.184 5.425 1.00 0.00 C ATOM 1523 CD1 ILE A 106 9.089 9.607 2.669 1.00 0.00 C ATOM 0 H ILE A 106 6.788 9.382 6.182 1.00 0.00 H new ATOM 0 HA ILE A 106 7.607 12.207 6.260 1.00 0.00 H new ATOM 0 HB ILE A 106 8.456 11.769 3.898 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.760 8.884 4.666 1.00 0.00 H new ATOM 0 HG13 ILE A 106 7.307 9.438 3.859 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.668 10.983 4.726 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.952 12.200 5.809 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.906 10.477 6.253 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.960 8.621 2.224 1.00 0.00 H new ATOM 0 HD12 ILE A 106 8.675 10.363 2.002 1.00 0.00 H new ATOM 0 HD13 ILE A 106 10.151 9.800 2.822 1.00 0.00 H new ATOM 1535 N GLU A 107 5.101 10.701 4.839 1.00 0.00 N ATOM 1536 CA GLU A 107 3.866 10.917 4.084 1.00 0.00 C ATOM 1537 C GLU A 107 2.653 10.660 4.966 1.00 0.00 C ATOM 1538 O GLU A 107 2.505 9.572 5.531 1.00 0.00 O ATOM 1539 CB GLU A 107 3.813 9.996 2.860 1.00 0.00 C ATOM 1540 CG GLU A 107 2.650 10.279 1.889 1.00 0.00 C ATOM 1541 CD GLU A 107 2.767 11.592 1.115 1.00 0.00 C ATOM 1542 OE1 GLU A 107 2.755 12.668 1.755 1.00 0.00 O ATOM 1543 OE2 GLU A 107 2.833 11.550 -0.135 1.00 0.00 O ATOM 0 H GLU A 107 5.170 9.775 5.261 1.00 0.00 H new ATOM 0 HA GLU A 107 3.852 11.954 3.748 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.753 10.085 2.315 1.00 0.00 H new ATOM 0 HB3 GLU A 107 3.739 8.964 3.202 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.583 9.458 1.176 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.718 10.288 2.454 1.00 0.00 H new ATOM 1550 N LYS A 108 1.745 11.632 4.998 1.00 0.00 N ATOM 1551 CA LYS A 108 0.464 11.583 5.681 1.00 0.00 C ATOM 1552 C LYS A 108 -0.611 11.939 4.663 1.00 0.00 C ATOM 1553 O LYS A 108 -0.911 13.120 4.463 1.00 0.00 O ATOM 1554 CB LYS A 108 0.493 12.523 6.903 1.00 0.00 C ATOM 1555 CG LYS A 108 -0.824 12.506 7.704 1.00 0.00 C ATOM 1556 CD LYS A 108 -1.474 13.888 7.845 1.00 0.00 C ATOM 1557 CE LYS A 108 -0.760 14.828 8.823 1.00 0.00 C ATOM 1558 NZ LYS A 108 -0.934 14.390 10.221 1.00 0.00 N ATOM 0 H LYS A 108 1.895 12.521 4.521 1.00 0.00 H new ATOM 0 HA LYS A 108 0.244 10.590 6.073 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.315 12.234 7.558 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.696 13.540 6.568 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.527 11.831 7.217 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.630 12.102 8.698 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -1.508 14.362 6.864 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.506 13.759 8.172 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.302 14.866 8.582 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.149 15.839 8.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.511 15.093 10.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.948 14.296 10.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.466 13.472 10.358 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.170 10.946 3.977 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.382 11.088 3.163 1.00 0.00 C ATOM 1574 C LYS A 109 -3.334 9.955 3.557 1.00 0.00 C ATOM 1575 O LYS A 109 -2.908 8.983 4.183 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.008 11.097 1.665 1.00 0.00 C ATOM 1577 CG LYS A 109 -3.010 11.715 0.655 1.00 0.00 C ATOM 1578 CD LYS A 109 -3.619 10.651 -0.269 1.00 0.00 C ATOM 1579 CE LYS A 109 -4.049 11.058 -1.684 1.00 0.00 C ATOM 1580 NZ LYS A 109 -5.169 12.023 -1.775 1.00 0.00 N ATOM 0 H LYS A 109 -0.789 10.000 3.969 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.891 12.035 3.343 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.063 11.630 1.563 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.826 10.066 1.363 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -3.807 12.223 1.198 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -2.502 12.470 0.055 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.894 9.843 -0.364 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -4.493 10.237 0.235 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -3.186 11.486 -2.195 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.328 10.157 -2.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -5.373 12.225 -2.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -6.014 11.618 -1.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -4.907 12.905 -1.290 1.00 0.00 H new ATOM 1594 N SER A 110 -4.608 10.086 3.211 1.00 0.00 N ATOM 1595 CA SER A 110 -5.668 9.140 3.512 1.00 0.00 C ATOM 1596 C SER A 110 -6.706 9.262 2.398 1.00 0.00 C ATOM 1597 O SER A 110 -6.819 10.324 1.769 1.00 0.00 O ATOM 1598 CB SER A 110 -6.176 9.473 4.919 1.00 0.00 C ATOM 1599 OG SER A 110 -7.245 8.651 5.364 1.00 0.00 O ATOM 0 H SER A 110 -4.944 10.895 2.688 1.00 0.00 H new ATOM 0 HA SER A 110 -5.358 8.095 3.532 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.348 9.384 5.622 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.501 10.513 4.939 1.00 0.00 H new ATOM 0 HG SER A 110 -7.279 7.836 4.821 1.00 0.00 H new ATOM 1605 N LEU A 111 -7.433 8.177 2.125 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.465 8.084 1.106 1.00 0.00 C ATOM 1607 C LEU A 111 -9.778 7.688 1.762 1.00 0.00 C ATOM 1608 O LEU A 111 -9.801 7.116 2.857 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.116 7.030 0.043 1.00 0.00 C ATOM 1610 CG LEU A 111 -6.718 7.108 -0.594 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.613 6.037 -1.675 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -6.389 8.457 -1.222 1.00 0.00 C ATOM 0 H LEU A 111 -7.308 7.302 2.635 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.546 9.056 0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.226 6.045 0.496 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.855 7.098 -0.755 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.003 6.956 0.215 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.626 6.081 -2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.762 5.054 -1.229 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.376 6.210 -2.434 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.386 8.425 -1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.110 8.678 -2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.435 9.234 -0.459 1.00 0.00 H new ATOM 1624 N VAL A 112 -10.874 7.921 1.052 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.218 7.659 1.521 1.00 0.00 C ATOM 1626 C VAL A 112 -12.993 7.036 0.376 1.00 0.00 C ATOM 1627 O VAL A 112 -12.936 7.531 -0.751 1.00 0.00 O ATOM 1628 CB VAL A 112 -12.812 8.969 2.074 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -12.759 10.144 1.083 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -14.248 8.769 2.568 1.00 0.00 C ATOM 0 H VAL A 112 -10.846 8.308 0.109 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.255 6.948 2.346 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.172 9.237 2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -13.195 11.030 1.545 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.722 10.348 0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.322 9.888 0.185 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.636 9.713 2.951 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.873 8.429 1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.259 8.023 3.363 1.00 0.00 H new ATOM 1640 N PHE A 113 -13.706 5.952 0.657 1.00 0.00 N ATOM 1641 CA PHE A 113 -14.408 5.166 -0.333 1.00 0.00 C ATOM 1642 C PHE A 113 -15.869 5.183 0.074 1.00 0.00 C ATOM 1643 O PHE A 113 -16.244 4.662 1.127 1.00 0.00 O ATOM 1644 CB PHE A 113 -13.785 3.768 -0.429 1.00 0.00 C ATOM 1645 CG PHE A 113 -12.272 3.729 -0.616 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -11.619 4.626 -1.483 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -11.504 2.775 0.077 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -10.224 4.579 -1.642 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -10.113 2.713 -0.095 1.00 0.00 C ATOM 1650 CZ PHE A 113 -9.468 3.618 -0.951 1.00 0.00 C ATOM 0 H PHE A 113 -13.810 5.592 1.605 1.00 0.00 H new ATOM 0 HA PHE A 113 -14.327 5.570 -1.342 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -14.035 3.216 0.477 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -14.249 3.240 -1.262 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -12.196 5.357 -2.031 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -11.991 2.083 0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -9.732 5.283 -2.297 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -9.538 1.967 0.433 1.00 0.00 H new ATOM 0 HZ PHE A 113 -8.396 3.576 -1.078 1.00 0.00 H new ATOM 1660 N ARG A 114 -16.652 5.948 -0.685 1.00 0.00 N ATOM 1661 CA ARG A 114 -18.021 6.305 -0.368 1.00 0.00 C ATOM 1662 C ARG A 114 -18.771 6.427 -1.672 1.00 0.00 C ATOM 1663 O ARG A 114 -18.612 7.426 -2.387 1.00 0.00 O ATOM 1664 CB ARG A 114 -18.077 7.654 0.341 1.00 0.00 C ATOM 1665 CG ARG A 114 -17.561 7.644 1.784 1.00 0.00 C ATOM 1666 CD ARG A 114 -18.589 7.085 2.769 1.00 0.00 C ATOM 1667 NE ARG A 114 -19.718 8.012 2.938 1.00 0.00 N ATOM 1668 CZ ARG A 114 -20.601 8.027 3.937 1.00 0.00 C ATOM 1669 NH1 ARG A 114 -20.550 7.121 4.909 1.00 0.00 N ATOM 1670 NH2 ARG A 114 -21.521 8.980 3.951 1.00 0.00 N ATOM 0 H ARG A 114 -16.333 6.347 -1.568 1.00 0.00 H new ATOM 0 HA ARG A 114 -18.454 5.546 0.284 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -17.495 8.375 -0.233 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.109 8.006 0.341 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -16.650 7.048 1.837 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -17.295 8.659 2.078 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -18.955 6.123 2.411 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -18.114 6.906 3.733 1.00 0.00 H new ATOM 0 HE ARG A 114 -19.839 8.719 2.213 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -19.828 6.401 4.897 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -21.233 7.146 5.666 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -21.542 9.679 3.209 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -22.208 9.014 4.704 1.00 0.00 H new ATOM 1684 N ASP A 115 -19.573 5.423 -1.950 1.00 0.00 N ATOM 1685 CA ASP A 115 -20.395 5.248 -3.140 1.00 0.00 C ATOM 1686 C ASP A 115 -21.326 4.067 -2.867 1.00 0.00 C ATOM 1687 O ASP A 115 -21.500 3.666 -1.710 1.00 0.00 O ATOM 1688 CB ASP A 115 -19.497 5.055 -4.376 1.00 0.00 C ATOM 1689 CG ASP A 115 -20.174 5.549 -5.653 1.00 0.00 C ATOM 1690 OD1 ASP A 115 -21.126 4.894 -6.127 1.00 0.00 O ATOM 1691 OD2 ASP A 115 -19.772 6.628 -6.144 1.00 0.00 O ATOM 0 H ASP A 115 -19.680 4.643 -1.302 1.00 0.00 H new ATOM 0 HA ASP A 115 -21.003 6.126 -3.358 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -18.559 5.591 -4.231 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -19.247 3.999 -4.482 1.00 0.00 H new ATOM 1696 N GLY A 116 -21.986 3.542 -3.888 1.00 0.00 N ATOM 1697 CA GLY A 116 -22.720 2.296 -3.795 1.00 0.00 C ATOM 1698 C GLY A 116 -22.900 1.629 -5.155 1.00 0.00 C ATOM 1699 O GLY A 116 -23.800 0.802 -5.298 1.00 0.00 O ATOM 0 H GLY A 116 -22.026 3.975 -4.811 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -22.194 1.616 -3.126 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -23.698 2.485 -3.353 1.00 0.00 H new ATOM 1703 N LYS A 117 -22.157 2.051 -6.183 1.00 0.00 N ATOM 1704 CA LYS A 117 -22.361 1.648 -7.568 1.00 0.00 C ATOM 1705 C LYS A 117 -21.004 1.466 -8.242 1.00 0.00 C ATOM 1706 O LYS A 117 -19.957 1.764 -7.661 1.00 0.00 O ATOM 1707 CB LYS A 117 -23.206 2.722 -8.279 1.00 0.00 C ATOM 1708 CG LYS A 117 -24.669 2.758 -7.804 1.00 0.00 C ATOM 1709 CD LYS A 117 -25.524 1.599 -8.338 1.00 0.00 C ATOM 1710 CE LYS A 117 -25.860 1.754 -9.827 1.00 0.00 C ATOM 1711 NZ LYS A 117 -26.711 2.937 -10.069 1.00 0.00 N ATOM 0 H LYS A 117 -21.378 2.699 -6.066 1.00 0.00 H new ATOM 0 HA LYS A 117 -22.895 0.699 -7.621 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -22.753 3.699 -8.113 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -23.184 2.539 -9.353 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -24.688 2.739 -6.714 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -25.119 3.701 -8.114 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -24.993 0.659 -8.185 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -26.449 1.540 -7.764 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -24.938 1.844 -10.402 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -26.371 0.858 -10.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -27.154 2.860 -11.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -27.451 2.987 -9.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -26.128 3.798 -10.031 1.00 0.00 H new ATOM 1725 N GLU A 118 -21.020 0.991 -9.488 1.00 0.00 N ATOM 1726 CA GLU A 118 -19.814 0.891 -10.295 1.00 0.00 C ATOM 1727 C GLU A 118 -19.219 2.295 -10.469 1.00 0.00 C ATOM 1728 O GLU A 118 -19.935 3.251 -10.785 1.00 0.00 O ATOM 1729 CB GLU A 118 -20.115 0.189 -11.640 1.00 0.00 C ATOM 1730 CG GLU A 118 -20.764 1.133 -12.667 1.00 0.00 C ATOM 1731 CD GLU A 118 -21.448 0.457 -13.853 1.00 0.00 C ATOM 1732 OE1 GLU A 118 -20.821 -0.374 -14.551 1.00 0.00 O ATOM 1733 OE2 GLU A 118 -22.613 0.834 -14.115 1.00 0.00 O ATOM 0 H GLU A 118 -21.865 0.668 -9.959 1.00 0.00 H new ATOM 0 HA GLU A 118 -19.070 0.271 -9.794 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -19.188 -0.210 -12.053 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -20.776 -0.659 -11.463 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -21.500 1.750 -12.151 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.996 1.806 -13.050 1.00 0.00 H new ATOM 1740 N ILE A 119 -17.912 2.416 -10.265 1.00 0.00 N ATOM 1741 CA ILE A 119 -17.107 3.615 -10.453 1.00 0.00 C ATOM 1742 C ILE A 119 -15.689 3.165 -10.816 1.00 0.00 C ATOM 1743 O ILE A 119 -15.374 1.972 -10.809 1.00 0.00 O ATOM 1744 CB ILE A 119 -17.155 4.563 -9.227 1.00 0.00 C ATOM 1745 CG1 ILE A 119 -16.747 3.883 -7.909 1.00 0.00 C ATOM 1746 CG2 ILE A 119 -18.530 5.228 -9.043 1.00 0.00 C ATOM 1747 CD1 ILE A 119 -15.236 3.846 -7.699 1.00 0.00 C ATOM 0 H ILE A 119 -17.351 1.627 -9.943 1.00 0.00 H new ATOM 0 HA ILE A 119 -17.514 4.217 -11.265 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.416 5.331 -9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -17.211 4.411 -7.076 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -17.135 2.864 -7.897 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -18.505 5.880 -8.170 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -18.771 5.816 -9.929 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -19.290 4.459 -8.900 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -15.012 3.354 -6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.769 3.294 -8.514 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -14.846 4.864 -7.680 1.00 0.00 H new ATOM 1759 N SER A 120 -14.819 4.126 -11.096 1.00 0.00 N ATOM 1760 CA SER A 120 -13.381 3.957 -11.190 1.00 0.00 C ATOM 1761 C SER A 120 -12.739 5.324 -10.972 1.00 0.00 C ATOM 1762 O SER A 120 -12.594 6.105 -11.914 1.00 0.00 O ATOM 1763 CB SER A 120 -12.996 3.341 -12.537 1.00 0.00 C ATOM 1764 OG SER A 120 -13.199 1.940 -12.481 1.00 0.00 O ATOM 0 H SER A 120 -15.113 5.087 -11.271 1.00 0.00 H new ATOM 0 HA SER A 120 -13.020 3.266 -10.428 1.00 0.00 H new ATOM 0 HB2 SER A 120 -13.597 3.776 -13.335 1.00 0.00 H new ATOM 0 HB3 SER A 120 -11.953 3.561 -12.767 1.00 0.00 H new ATOM 0 HG SER A 120 -13.976 1.744 -11.917 1.00 0.00 H new ATOM 1770 N THR A 121 -12.431 5.655 -9.722 1.00 0.00 N ATOM 1771 CA THR A 121 -11.412 6.637 -9.392 1.00 0.00 C ATOM 1772 C THR A 121 -10.033 6.061 -9.716 1.00 0.00 C ATOM 1773 O THR A 121 -9.852 4.854 -9.907 1.00 0.00 O ATOM 1774 CB THR A 121 -11.571 7.134 -7.932 1.00 0.00 C ATOM 1775 OG1 THR A 121 -12.497 6.379 -7.165 1.00 0.00 O ATOM 1776 CG2 THR A 121 -12.084 8.576 -7.941 1.00 0.00 C ATOM 0 H THR A 121 -12.886 5.245 -8.906 1.00 0.00 H new ATOM 0 HA THR A 121 -11.532 7.530 -10.005 1.00 0.00 H new ATOM 0 HB THR A 121 -10.585 7.034 -7.478 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.546 6.746 -6.257 1.00 0.00 H new ATOM 0 HG21 THR A 121 -12.197 8.928 -6.916 1.00 0.00 H new ATOM 0 HG22 THR A 121 -11.372 9.212 -8.467 1.00 0.00 H new ATOM 0 HG23 THR A 121 -13.049 8.616 -8.447 1.00 0.00 H new ATOM 1784 N ASP A 122 -9.052 6.959 -9.765 1.00 0.00 N ATOM 1785 CA ASP A 122 -7.646 6.612 -9.681 1.00 0.00 C ATOM 1786 C ASP A 122 -7.141 7.279 -8.414 1.00 0.00 C ATOM 1787 O ASP A 122 -6.385 8.254 -8.448 1.00 0.00 O ATOM 1788 CB ASP A 122 -6.863 7.023 -10.931 1.00 0.00 C ATOM 1789 CG ASP A 122 -5.479 6.394 -10.916 1.00 0.00 C ATOM 1790 OD1 ASP A 122 -5.407 5.147 -10.813 1.00 0.00 O ATOM 1791 OD2 ASP A 122 -4.470 7.124 -11.041 1.00 0.00 O ATOM 0 H ASP A 122 -9.219 7.960 -9.866 1.00 0.00 H new ATOM 0 HA ASP A 122 -7.503 5.532 -9.636 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -7.402 6.711 -11.825 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -6.776 8.109 -10.974 1.00 0.00 H new ATOM 1796 N ASP A 123 -7.754 6.881 -7.302 1.00 0.00 N ATOM 1797 CA ASP A 123 -7.516 7.505 -6.001 1.00 0.00 C ATOM 1798 C ASP A 123 -6.124 7.276 -5.414 1.00 0.00 C ATOM 1799 O ASP A 123 -5.735 7.951 -4.458 1.00 0.00 O ATOM 1800 CB ASP A 123 -8.532 7.019 -4.968 1.00 0.00 C ATOM 1801 CG ASP A 123 -8.915 8.134 -3.979 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -8.397 9.273 -4.078 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -9.772 7.887 -3.098 1.00 0.00 O ATOM 0 H ASP A 123 -8.430 6.117 -7.276 1.00 0.00 H new ATOM 0 HA ASP A 123 -7.615 8.571 -6.204 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.427 6.661 -5.478 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -8.118 6.173 -4.420 1.00 0.00 H new ATOM 1808 N LEU A 124 -5.373 6.305 -5.932 1.00 0.00 N ATOM 1809 CA LEU A 124 -4.049 5.966 -5.429 1.00 0.00 C ATOM 1810 C LEU A 124 -3.049 6.091 -6.567 1.00 0.00 C ATOM 1811 O LEU A 124 -3.149 5.402 -7.581 1.00 0.00 O ATOM 1812 CB LEU A 124 -4.060 4.582 -4.786 1.00 0.00 C ATOM 1813 CG LEU A 124 -2.927 4.348 -3.766 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -2.988 5.228 -2.510 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -3.009 2.889 -3.312 1.00 0.00 C ATOM 0 H LEU A 124 -5.672 5.729 -6.719 1.00 0.00 H new ATOM 0 HA LEU A 124 -3.747 6.658 -4.643 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -5.018 4.433 -4.288 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.988 3.829 -5.571 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.998 4.604 -4.275 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.149 4.988 -1.856 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -2.934 6.278 -2.798 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -3.924 5.044 -1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.219 2.688 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.979 2.705 -2.851 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.887 2.232 -4.173 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.135 7.039 -6.420 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.357 7.628 -7.493 1.00 0.00 C ATOM 1829 C ASN A 125 -0.028 8.173 -6.957 1.00 0.00 C ATOM 1830 O ASN A 125 0.305 9.349 -7.126 1.00 0.00 O ATOM 1831 CB ASN A 125 -2.216 8.713 -8.160 1.00 0.00 C ATOM 1832 CG ASN A 125 -2.690 9.816 -7.215 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -3.638 9.635 -6.461 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -2.067 10.978 -7.208 1.00 0.00 N ATOM 0 H ASN A 125 -1.908 7.434 -5.508 1.00 0.00 H new ATOM 0 HA ASN A 125 -1.096 6.879 -8.241 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -1.643 9.166 -8.969 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -3.088 8.241 -8.613 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -2.375 11.718 -6.578 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -1.277 11.137 -7.833 1.00 0.00 H new ATOM 1841 N LEU A 126 0.737 7.334 -6.264 1.00 0.00 N ATOM 1842 CA LEU A 126 1.934 7.739 -5.534 1.00 0.00 C ATOM 1843 C LEU A 126 3.129 7.001 -6.132 1.00 0.00 C ATOM 1844 O LEU A 126 3.013 5.823 -6.459 1.00 0.00 O ATOM 1845 CB LEU A 126 1.772 7.367 -4.058 1.00 0.00 C ATOM 1846 CG LEU A 126 0.490 7.860 -3.350 1.00 0.00 C ATOM 1847 CD1 LEU A 126 0.349 7.047 -2.068 1.00 0.00 C ATOM 1848 CD2 LEU A 126 0.554 9.345 -3.009 1.00 0.00 C ATOM 0 H LEU A 126 0.539 6.336 -6.193 1.00 0.00 H new ATOM 0 HA LEU A 126 2.088 8.815 -5.611 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.809 6.281 -3.976 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.632 7.757 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.364 7.727 -4.014 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.547 7.363 -1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.270 5.988 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.223 7.208 -1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.369 9.645 -2.513 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.399 9.530 -2.346 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.678 9.923 -3.924 1.00 0.00 H new ATOM 1860 N TYR A 127 4.272 7.672 -6.273 1.00 0.00 N ATOM 1861 CA TYR A 127 5.431 7.203 -7.031 1.00 0.00 C ATOM 1862 C TYR A 127 6.704 7.803 -6.437 1.00 0.00 C ATOM 1863 O TYR A 127 7.371 8.639 -7.058 1.00 0.00 O ATOM 1864 CB TYR A 127 5.285 7.554 -8.520 1.00 0.00 C ATOM 1865 CG TYR A 127 4.038 7.018 -9.188 1.00 0.00 C ATOM 1866 CD1 TYR A 127 4.047 5.721 -9.725 1.00 0.00 C ATOM 1867 CD2 TYR A 127 2.880 7.814 -9.282 1.00 0.00 C ATOM 1868 CE1 TYR A 127 2.900 5.210 -10.356 1.00 0.00 C ATOM 1869 CE2 TYR A 127 1.727 7.305 -9.901 1.00 0.00 C ATOM 1870 CZ TYR A 127 1.732 6.000 -10.441 1.00 0.00 C ATOM 1871 OH TYR A 127 0.609 5.522 -11.039 1.00 0.00 O ATOM 0 H TYR A 127 4.421 8.587 -5.848 1.00 0.00 H new ATOM 0 HA TYR A 127 5.494 6.117 -6.960 1.00 0.00 H new ATOM 0 HB2 TYR A 127 5.296 8.639 -8.624 1.00 0.00 H new ATOM 0 HB3 TYR A 127 6.156 7.174 -9.054 1.00 0.00 H new ATOM 0 HD1 TYR A 127 4.938 5.114 -9.653 1.00 0.00 H new ATOM 0 HD2 TYR A 127 2.879 8.816 -8.878 1.00 0.00 H new ATOM 0 HE1 TYR A 127 2.911 4.215 -10.775 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.836 7.912 -9.964 1.00 0.00 H new ATOM 0 HH TYR A 127 -0.095 6.203 -11.004 1.00 0.00 H new ATOM 1881 N TYR A 128 7.043 7.387 -5.217 1.00 0.00 N ATOM 1882 CA TYR A 128 8.284 7.819 -4.576 1.00 0.00 C ATOM 1883 C TYR A 128 9.501 7.304 -5.338 1.00 0.00 C ATOM 1884 O TYR A 128 9.382 6.337 -6.091 1.00 0.00 O ATOM 1885 CB TYR A 128 8.330 7.389 -3.105 1.00 0.00 C ATOM 1886 CG TYR A 128 7.612 8.361 -2.194 1.00 0.00 C ATOM 1887 CD1 TYR A 128 8.092 9.684 -2.108 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.509 7.948 -1.417 1.00 0.00 C ATOM 1889 CE1 TYR A 128 7.473 10.608 -1.254 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.870 8.876 -0.570 1.00 0.00 C ATOM 1891 CZ TYR A 128 6.363 10.204 -0.485 1.00 0.00 C ATOM 1892 OH TYR A 128 5.802 11.097 0.365 1.00 0.00 O ATOM 0 H TYR A 128 6.477 6.753 -4.654 1.00 0.00 H new ATOM 0 HA TYR A 128 8.309 8.908 -4.602 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.880 6.401 -3.004 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.369 7.299 -2.788 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.941 9.987 -2.703 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.157 6.928 -1.471 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.843 11.620 -1.186 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.010 8.578 0.011 1.00 0.00 H new ATOM 0 HH TYR A 128 5.920 12.004 0.012 1.00 0.00 H new ATOM 1902 N ASN A 129 10.648 7.953 -5.118 1.00 0.00 N ATOM 1903 CA ASN A 129 11.946 7.739 -5.749 1.00 0.00 C ATOM 1904 C ASN A 129 12.955 8.461 -4.888 1.00 0.00 C ATOM 1905 O ASN A 129 12.725 9.652 -4.587 1.00 0.00 O ATOM 1906 CB ASN A 129 11.901 8.243 -7.193 1.00 0.00 C ATOM 1907 CG ASN A 129 13.242 8.573 -7.851 1.00 0.00 C ATOM 1908 OD1 ASN A 129 14.333 8.214 -7.418 1.00 0.00 O ATOM 1909 ND2 ASN A 129 13.187 9.214 -9.003 1.00 0.00 N ATOM 0 H ASN A 129 10.692 8.707 -4.433 1.00 0.00 H new ATOM 0 HA ASN A 129 12.223 6.687 -5.814 1.00 0.00 H new ATOM 0 HB2 ASN A 129 11.401 7.489 -7.801 1.00 0.00 H new ATOM 0 HB3 ASN A 129 11.280 9.138 -7.221 1.00 0.00 H new ATOM 0 HD21 ASN A 129 14.044 9.405 -9.522 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.287 9.518 -9.375 1.00 0.00 H new TER 1916 ASN A 129