USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1056 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 105 HIS : no HE2:sc= -1.55! C(o=-1.8!,f=-5.1!) USER MOD Set 1.2: A 116 LYS NZ :NH3+ -150:sc= -0.278 (180deg=0) USER MOD Set 2.1: A 13 MET CE :methyl -179:sc= -1.05 (180deg=-1.09) USER MOD Set 2.2: A 32 THR OG1 : rot 129:sc= 1.02 USER MOD Single : A 10 TYR OH : rot 30:sc=-0.00875 USER MOD Single : A 14 LYS NZ :NH3+ -95:sc= 1.27 (180deg=-0.128) USER MOD Single : A 15 SER OG : rot -117:sc= -0.0837 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0.483 K(o=0.48,f=-5.6!) USER MOD Single : A 20 ASN : amide:sc= -0.499 K(o=-0.5,f=-1.1) USER MOD Single : A 24 SER OG : rot 67:sc= 1.59 USER MOD Single : A 25 GLN : amide:sc=-0.00683 K(o=-0.0068,f=-0.9) USER MOD Single : A 26 GLN : amide:sc= -0.753 K(o=-0.75,f=-1.8!) USER MOD Single : A 27 LYS NZ :NH3+ -151:sc= 0.281 (180deg=0.0497) USER MOD Single : A 31 SER OG : rot 140:sc= -1.39 USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -5.03! C(o=-5!,f=-3.5!) USER MOD Single : A 39 LYS NZ :NH3+ -133:sc= -0.441 (180deg=-1.24) USER MOD Single : A 41 ASN : amide:sc= -2.36! C(o=-2.4!,f=-6.4!) USER MOD Single : A 47 SER OG : rot -148:sc= -0.165 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.188 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 HIS : no HD1:sc= -3.76 X(o=-3.8,f=-4.1!) USER MOD Single : A 63 GLN : amide:sc= -1.34 K(o=-1.3,f=-1.9) USER MOD Single : A 66 SER OG : rot -138:sc= 0.471 USER MOD Single : A 68 MET CE :methyl 177:sc= -2.16 (180deg=-2.21) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -170:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0.0228 USER MOD Single : A 78 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.059) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -141:sc= -0.0852 (180deg=-1.17) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -10.6! C(o=-11!,f=-11!) USER MOD Single : A 106 HIS : no HD1:sc= -3.59! C(o=-3.6!,f=-5.7!) USER MOD Single : A 109 ASN : amide:sc= -2.17! C(o=-2.2!,f=-6.8!) USER MOD Single : A 112 ASN : amide:sc= -0.771 X(o=-0.77,f=-0.79) USER MOD Single : A 114 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.5) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= -2.16 K(o=-2.2,f=-4.2) USER MOD Single : A 120 SER OG : rot 28:sc= 0.0743 USER MOD Single : A 124 GLN : amide:sc=-0.00064 X(o=-0.00064,f=0) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 GLN : amide:sc= -2.57! C(o=-2.6!,f=-9.5!) USER MOD Single : A 136 GLN : amide:sc= -0.708 X(o=-0.71,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -14.561 -7.517 3.161 1.00 0.00 N ATOM 60 CA GLY A 7 -13.956 -6.870 2.011 1.00 0.00 C ATOM 61 C GLY A 7 -12.465 -6.659 2.182 1.00 0.00 C ATOM 62 O GLY A 7 -11.908 -6.946 3.242 1.00 0.00 O ATOM 0 HA2 GLY A 7 -14.135 -7.475 1.122 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.439 -5.907 1.844 1.00 0.00 H new ATOM 66 N VAL A 8 -11.816 -6.158 1.137 1.00 0.00 N ATOM 67 CA VAL A 8 -10.379 -5.909 1.176 1.00 0.00 C ATOM 68 C VAL A 8 -10.066 -4.615 1.917 1.00 0.00 C ATOM 69 O VAL A 8 -10.899 -3.712 1.991 1.00 0.00 O ATOM 70 CB VAL A 8 -9.784 -5.832 -0.243 1.00 0.00 C ATOM 71 CG1 VAL A 8 -10.721 -5.080 -1.175 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.412 -5.177 -0.209 1.00 0.00 C ATOM 0 H VAL A 8 -12.262 -5.916 0.252 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.927 -6.747 1.707 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.668 -6.846 -0.626 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.284 -5.036 -2.173 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.680 -5.597 -1.222 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.872 -4.068 -0.800 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.006 -5.131 -1.219 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.500 -4.168 0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.745 -5.763 0.424 1.00 0.00 H new ATOM 82 N ARG A 9 -8.858 -4.531 2.466 1.00 0.00 N ATOM 83 CA ARG A 9 -8.434 -3.347 3.203 1.00 0.00 C ATOM 84 C ARG A 9 -7.514 -2.477 2.351 1.00 0.00 C ATOM 85 O ARG A 9 -7.162 -2.841 1.229 1.00 0.00 O ATOM 86 CB ARG A 9 -7.719 -3.752 4.493 1.00 0.00 C ATOM 87 CG ARG A 9 -8.607 -4.505 5.471 1.00 0.00 C ATOM 88 CD ARG A 9 -9.307 -3.556 6.432 1.00 0.00 C ATOM 89 NE ARG A 9 -10.401 -4.209 7.145 1.00 0.00 N ATOM 90 CZ ARG A 9 -11.603 -4.414 6.619 1.00 0.00 C ATOM 91 NH1 ARG A 9 -11.864 -4.020 5.380 1.00 0.00 N ATOM 92 NH2 ARG A 9 -12.548 -5.015 7.331 1.00 0.00 N ATOM 0 H ARG A 9 -8.156 -5.269 2.414 1.00 0.00 H new ATOM 0 HA ARG A 9 -9.323 -2.769 3.454 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.860 -4.374 4.242 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.333 -2.857 4.981 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -9.351 -5.081 4.920 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -8.006 -5.218 6.035 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -8.585 -3.170 7.151 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -9.694 -2.700 5.879 1.00 0.00 H new ATOM 0 HE ARG A 9 -10.233 -4.525 8.100 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -11.141 -3.558 4.829 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -12.788 -4.179 4.978 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -12.352 -5.320 8.284 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -13.471 -5.171 6.925 1.00 0.00 H new ATOM 106 N TYR A 10 -7.130 -1.326 2.892 1.00 0.00 N ATOM 107 CA TYR A 10 -6.254 -0.402 2.181 1.00 0.00 C ATOM 108 C TYR A 10 -5.246 0.234 3.132 1.00 0.00 C ATOM 109 O TYR A 10 -5.601 0.680 4.224 1.00 0.00 O ATOM 110 CB TYR A 10 -7.078 0.686 1.490 1.00 0.00 C ATOM 111 CG TYR A 10 -8.035 0.151 0.449 1.00 0.00 C ATOM 112 CD1 TYR A 10 -9.184 -0.537 0.821 1.00 0.00 C ATOM 113 CD2 TYR A 10 -7.792 0.335 -0.907 1.00 0.00 C ATOM 114 CE1 TYR A 10 -10.060 -1.028 -0.127 1.00 0.00 C ATOM 115 CE2 TYR A 10 -8.664 -0.151 -1.862 1.00 0.00 C ATOM 116 CZ TYR A 10 -9.797 -0.832 -1.467 1.00 0.00 C ATOM 117 OH TYR A 10 -10.668 -1.318 -2.414 1.00 0.00 O ATOM 0 H TYR A 10 -7.411 -1.011 3.820 1.00 0.00 H new ATOM 0 HA TYR A 10 -5.707 -0.968 1.427 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -7.643 1.235 2.243 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -6.401 1.398 1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -9.395 -0.690 1.869 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -6.906 0.867 -1.220 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -10.947 -1.563 0.179 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -8.460 0.001 -2.912 1.00 0.00 H new ATOM 0 HH TYR A 10 -11.577 -1.330 -2.047 1.00 0.00 H new ATOM 127 N PHE A 11 -3.987 0.275 2.710 1.00 0.00 N ATOM 128 CA PHE A 11 -2.925 0.856 3.523 1.00 0.00 C ATOM 129 C PHE A 11 -1.991 1.709 2.669 1.00 0.00 C ATOM 130 O PHE A 11 -2.016 1.635 1.441 1.00 0.00 O ATOM 131 CB PHE A 11 -2.130 -0.246 4.225 1.00 0.00 C ATOM 132 CG PHE A 11 -2.994 -1.282 4.885 1.00 0.00 C ATOM 133 CD1 PHE A 11 -3.608 -2.272 4.135 1.00 0.00 C ATOM 134 CD2 PHE A 11 -3.193 -1.266 6.257 1.00 0.00 C ATOM 135 CE1 PHE A 11 -4.404 -3.225 4.740 1.00 0.00 C ATOM 136 CE2 PHE A 11 -3.988 -2.217 6.867 1.00 0.00 C ATOM 137 CZ PHE A 11 -4.594 -3.199 6.108 1.00 0.00 C ATOM 0 H PHE A 11 -3.677 -0.088 1.809 1.00 0.00 H new ATOM 0 HA PHE A 11 -3.386 1.496 4.275 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -1.482 -0.735 3.498 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -1.482 0.207 4.976 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -3.463 -2.299 3.065 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.721 -0.501 6.856 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.878 -3.991 4.143 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -4.136 -2.193 7.937 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.215 -3.944 6.583 1.00 0.00 H new ATOM 147 N ILE A 12 -1.169 2.517 3.330 1.00 0.00 N ATOM 148 CA ILE A 12 -0.226 3.383 2.632 1.00 0.00 C ATOM 149 C ILE A 12 1.211 3.060 3.026 1.00 0.00 C ATOM 150 O ILE A 12 1.573 3.121 4.200 1.00 0.00 O ATOM 151 CB ILE A 12 -0.505 4.869 2.924 1.00 0.00 C ATOM 152 CG1 ILE A 12 -1.819 5.302 2.271 1.00 0.00 C ATOM 153 CG2 ILE A 12 0.648 5.731 2.431 1.00 0.00 C ATOM 154 CD1 ILE A 12 -1.781 5.269 0.759 1.00 0.00 C ATOM 0 H ILE A 12 -1.137 2.590 4.347 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.358 3.200 1.566 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.597 5.001 4.002 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.621 4.652 2.621 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.063 6.313 2.598 1.00 0.00 H new ATOM 0 HG21 ILE A 12 0.436 6.779 2.644 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.566 5.436 2.939 1.00 0.00 H new ATOM 0 HG23 ILE A 12 0.769 5.597 1.356 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.745 5.588 0.364 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.002 5.941 0.400 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.569 4.254 0.422 1.00 0.00 H new ATOM 166 N MET A 13 2.027 2.718 2.034 1.00 0.00 N ATOM 167 CA MET A 13 3.427 2.388 2.276 1.00 0.00 C ATOM 168 C MET A 13 4.347 3.443 1.669 1.00 0.00 C ATOM 169 O MET A 13 4.360 3.646 0.455 1.00 0.00 O ATOM 170 CB MET A 13 3.757 1.012 1.696 1.00 0.00 C ATOM 171 CG MET A 13 3.546 -0.129 2.678 1.00 0.00 C ATOM 172 SD MET A 13 4.376 0.149 4.254 1.00 0.00 S ATOM 173 CE MET A 13 3.091 -0.337 5.404 1.00 0.00 C ATOM 0 H MET A 13 1.743 2.662 1.056 1.00 0.00 H new ATOM 0 HA MET A 13 3.588 2.367 3.354 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.139 0.841 0.815 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.795 1.007 1.363 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.478 -0.260 2.852 1.00 0.00 H new ATOM 0 HG3 MET A 13 3.913 -1.056 2.237 1.00 0.00 H new ATOM 0 HE1 MET A 13 3.447 -0.204 6.425 1.00 0.00 H new ATOM 0 HE2 MET A 13 2.207 0.281 5.245 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.835 -1.384 5.243 1.00 0.00 H new ATOM 183 N LYS A 14 5.116 4.112 2.521 1.00 0.00 N ATOM 184 CA LYS A 14 6.040 5.146 2.070 1.00 0.00 C ATOM 185 C LYS A 14 7.460 4.599 1.969 1.00 0.00 C ATOM 186 O LYS A 14 7.969 3.991 2.910 1.00 0.00 O ATOM 187 CB LYS A 14 6.008 6.340 3.025 1.00 0.00 C ATOM 188 CG LYS A 14 4.604 6.798 3.381 1.00 0.00 C ATOM 189 CD LYS A 14 3.888 7.388 2.178 1.00 0.00 C ATOM 190 CE LYS A 14 4.152 8.881 2.050 1.00 0.00 C ATOM 191 NZ LYS A 14 3.168 9.687 2.824 1.00 0.00 N ATOM 0 H LYS A 14 5.118 3.956 3.529 1.00 0.00 H new ATOM 0 HA LYS A 14 5.724 5.474 1.080 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.538 6.077 3.940 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.548 7.171 2.572 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.032 5.954 3.768 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.654 7.541 4.177 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.218 6.880 1.272 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.816 7.213 2.269 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.160 9.103 2.401 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.110 9.168 0.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.392 9.983 2.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.785 9.113 3.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.639 10.529 3.214 1.00 0.00 H new ATOM 205 N SER A 15 8.095 4.822 0.823 1.00 0.00 N ATOM 206 CA SER A 15 9.457 4.350 0.599 1.00 0.00 C ATOM 207 C SER A 15 10.441 5.515 0.587 1.00 0.00 C ATOM 208 O SER A 15 10.077 6.646 0.265 1.00 0.00 O ATOM 209 CB SER A 15 9.542 3.581 -0.721 1.00 0.00 C ATOM 210 OG SER A 15 10.869 3.158 -0.980 1.00 0.00 O ATOM 0 H SER A 15 7.689 5.326 0.035 1.00 0.00 H new ATOM 0 HA SER A 15 9.723 3.682 1.418 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.882 2.715 -0.684 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.193 4.213 -1.537 1.00 0.00 H new ATOM 0 HG SER A 15 11.193 3.583 -1.802 1.00 0.00 H new ATOM 216 N SER A 16 11.690 5.230 0.940 1.00 0.00 N ATOM 217 CA SER A 16 12.728 6.255 0.973 1.00 0.00 C ATOM 218 C SER A 16 13.226 6.570 -0.434 1.00 0.00 C ATOM 219 O SER A 16 13.321 7.733 -0.824 1.00 0.00 O ATOM 220 CB SER A 16 13.896 5.799 1.850 1.00 0.00 C ATOM 221 OG SER A 16 13.575 5.909 3.225 1.00 0.00 O ATOM 0 H SER A 16 12.008 4.298 1.207 1.00 0.00 H new ATOM 0 HA SER A 16 12.296 7.161 1.397 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.150 4.766 1.614 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.777 6.402 1.630 1.00 0.00 H new ATOM 0 HG SER A 16 14.337 5.610 3.764 1.00 0.00 H new ATOM 227 N ASN A 17 13.542 5.525 -1.191 1.00 0.00 N ATOM 228 CA ASN A 17 14.031 5.689 -2.555 1.00 0.00 C ATOM 229 C ASN A 17 13.371 4.684 -3.494 1.00 0.00 C ATOM 230 O ASN A 17 13.140 3.531 -3.125 1.00 0.00 O ATOM 231 CB ASN A 17 15.551 5.523 -2.598 1.00 0.00 C ATOM 232 CG ASN A 17 16.125 5.799 -3.974 1.00 0.00 C ATOM 233 OD1 ASN A 17 16.220 4.901 -4.811 1.00 0.00 O ATOM 234 ND2 ASN A 17 16.511 7.046 -4.215 1.00 0.00 N ATOM 0 H ASN A 17 13.468 4.555 -0.883 1.00 0.00 H new ATOM 0 HA ASN A 17 13.773 6.694 -2.888 1.00 0.00 H new ATOM 0 HB2 ASN A 17 16.008 6.198 -1.875 1.00 0.00 H new ATOM 0 HB3 ASN A 17 15.811 4.509 -2.296 1.00 0.00 H new ATOM 0 HD21 ASN A 17 16.905 7.291 -5.123 1.00 0.00 H new ATOM 0 HD22 ASN A 17 16.414 7.759 -3.492 1.00 0.00 H new ATOM 241 N LEU A 18 13.071 5.127 -4.710 1.00 0.00 N ATOM 242 CA LEU A 18 12.439 4.266 -5.704 1.00 0.00 C ATOM 243 C LEU A 18 13.082 2.883 -5.715 1.00 0.00 C ATOM 244 O LEU A 18 12.390 1.865 -5.705 1.00 0.00 O ATOM 245 CB LEU A 18 12.538 4.899 -7.093 1.00 0.00 C ATOM 246 CG LEU A 18 11.586 4.344 -8.153 1.00 0.00 C ATOM 247 CD1 LEU A 18 11.196 2.911 -7.823 1.00 0.00 C ATOM 248 CD2 LEU A 18 10.349 5.222 -8.270 1.00 0.00 C ATOM 0 H LEU A 18 13.255 6.077 -5.032 1.00 0.00 H new ATOM 0 HA LEU A 18 11.388 4.155 -5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.357 5.970 -6.996 1.00 0.00 H new ATOM 0 HB3 LEU A 18 13.560 4.779 -7.453 1.00 0.00 H new ATOM 0 HG LEU A 18 12.101 4.346 -9.114 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.518 2.533 -8.588 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.090 2.289 -7.791 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.700 2.883 -6.853 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.682 4.812 -9.029 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.832 5.252 -7.311 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.645 6.232 -8.554 1.00 0.00 H new ATOM 260 N ARG A 19 14.411 2.855 -5.733 1.00 0.00 N ATOM 261 CA ARG A 19 15.148 1.597 -5.745 1.00 0.00 C ATOM 262 C ARG A 19 14.543 0.603 -4.757 1.00 0.00 C ATOM 263 O ARG A 19 14.181 -0.512 -5.128 1.00 0.00 O ATOM 264 CB ARG A 19 16.619 1.840 -5.403 1.00 0.00 C ATOM 265 CG ARG A 19 17.393 0.567 -5.102 1.00 0.00 C ATOM 266 CD ARG A 19 17.396 -0.378 -6.293 1.00 0.00 C ATOM 267 NE ARG A 19 18.604 -1.198 -6.338 1.00 0.00 N ATOM 268 CZ ARG A 19 18.727 -2.284 -7.093 1.00 0.00 C ATOM 269 NH1 ARG A 19 17.722 -2.678 -7.862 1.00 0.00 N ATOM 270 NH2 ARG A 19 19.858 -2.978 -7.079 1.00 0.00 N ATOM 0 H ARG A 19 14.999 3.689 -5.740 1.00 0.00 H new ATOM 0 HA ARG A 19 15.080 1.174 -6.747 1.00 0.00 H new ATOM 0 HB2 ARG A 19 17.096 2.357 -6.236 1.00 0.00 H new ATOM 0 HB3 ARG A 19 16.678 2.503 -4.540 1.00 0.00 H new ATOM 0 HG2 ARG A 19 18.419 0.819 -4.833 1.00 0.00 H new ATOM 0 HG3 ARG A 19 16.951 0.067 -4.240 1.00 0.00 H new ATOM 0 HD2 ARG A 19 16.520 -1.025 -6.245 1.00 0.00 H new ATOM 0 HD3 ARG A 19 17.315 0.199 -7.214 1.00 0.00 H new ATOM 0 HE ARG A 19 19.396 -0.922 -5.758 1.00 0.00 H new ATOM 0 HH11 ARG A 19 16.851 -2.147 -7.875 1.00 0.00 H new ATOM 0 HH12 ARG A 19 17.819 -3.512 -8.441 1.00 0.00 H new ATOM 0 HH21 ARG A 19 20.633 -2.678 -6.488 1.00 0.00 H new ATOM 0 HH22 ARG A 19 19.952 -3.812 -7.659 1.00 0.00 H new ATOM 284 N ASN A 20 14.438 1.017 -3.498 1.00 0.00 N ATOM 285 CA ASN A 20 13.879 0.163 -2.457 1.00 0.00 C ATOM 286 C ASN A 20 12.586 -0.495 -2.930 1.00 0.00 C ATOM 287 O ASN A 20 12.296 -1.640 -2.582 1.00 0.00 O ATOM 288 CB ASN A 20 13.616 0.977 -1.188 1.00 0.00 C ATOM 289 CG ASN A 20 14.852 1.710 -0.705 1.00 0.00 C ATOM 290 OD1 ASN A 20 15.974 1.376 -1.085 1.00 0.00 O ATOM 291 ND2 ASN A 20 14.651 2.716 0.138 1.00 0.00 N ATOM 0 H ASN A 20 14.733 1.938 -3.175 1.00 0.00 H new ATOM 0 HA ASN A 20 14.604 -0.620 -2.235 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.821 1.698 -1.380 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.260 0.313 -0.401 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.445 3.247 0.497 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.703 2.958 0.426 1.00 0.00 H new ATOM 298 N LEU A 21 11.813 0.237 -3.725 1.00 0.00 N ATOM 299 CA LEU A 21 10.550 -0.275 -4.247 1.00 0.00 C ATOM 300 C LEU A 21 10.793 -1.310 -5.341 1.00 0.00 C ATOM 301 O LEU A 21 10.117 -2.337 -5.397 1.00 0.00 O ATOM 302 CB LEU A 21 9.699 0.872 -4.794 1.00 0.00 C ATOM 303 CG LEU A 21 8.215 0.567 -5.000 1.00 0.00 C ATOM 304 CD1 LEU A 21 7.488 0.527 -3.665 1.00 0.00 C ATOM 305 CD2 LEU A 21 7.582 1.598 -5.923 1.00 0.00 C ATOM 0 H LEU A 21 12.038 1.186 -4.022 1.00 0.00 H new ATOM 0 HA LEU A 21 10.015 -0.757 -3.428 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.784 1.718 -4.112 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.121 1.188 -5.748 1.00 0.00 H new ATOM 0 HG LEU A 21 8.127 -0.413 -5.468 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.433 0.309 -3.832 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.924 -0.249 -3.036 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.585 1.493 -3.169 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.526 1.365 -6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.681 2.590 -5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.085 1.578 -6.890 1.00 0.00 H new ATOM 317 N GLU A 22 11.764 -1.033 -6.206 1.00 0.00 N ATOM 318 CA GLU A 22 12.096 -1.941 -7.297 1.00 0.00 C ATOM 319 C GLU A 22 12.165 -3.383 -6.803 1.00 0.00 C ATOM 320 O GLU A 22 11.743 -4.309 -7.497 1.00 0.00 O ATOM 321 CB GLU A 22 13.430 -1.544 -7.932 1.00 0.00 C ATOM 322 CG GLU A 22 13.379 -0.222 -8.679 1.00 0.00 C ATOM 323 CD GLU A 22 14.488 -0.088 -9.705 1.00 0.00 C ATOM 324 OE1 GLU A 22 15.650 -0.392 -9.364 1.00 0.00 O ATOM 325 OE2 GLU A 22 14.193 0.320 -10.848 1.00 0.00 O ATOM 0 H GLU A 22 12.334 -0.188 -6.172 1.00 0.00 H new ATOM 0 HA GLU A 22 11.309 -1.869 -8.047 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.190 -1.482 -7.153 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.743 -2.329 -8.621 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.414 -0.128 -9.178 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.450 0.598 -7.964 1.00 0.00 H new ATOM 332 N ILE A 23 12.700 -3.565 -5.600 1.00 0.00 N ATOM 333 CA ILE A 23 12.823 -4.893 -5.013 1.00 0.00 C ATOM 334 C ILE A 23 11.479 -5.614 -4.994 1.00 0.00 C ATOM 335 O ILE A 23 11.407 -6.821 -5.222 1.00 0.00 O ATOM 336 CB ILE A 23 13.376 -4.825 -3.577 1.00 0.00 C ATOM 337 CG1 ILE A 23 14.848 -4.406 -3.593 1.00 0.00 C ATOM 338 CG2 ILE A 23 13.209 -6.167 -2.880 1.00 0.00 C ATOM 339 CD1 ILE A 23 15.060 -2.960 -3.983 1.00 0.00 C ATOM 0 H ILE A 23 13.055 -2.810 -5.014 1.00 0.00 H new ATOM 0 HA ILE A 23 13.522 -5.449 -5.637 1.00 0.00 H new ATOM 0 HB ILE A 23 12.811 -4.077 -3.021 1.00 0.00 H new ATOM 0 HG12 ILE A 23 15.276 -4.574 -2.605 1.00 0.00 H new ATOM 0 HG13 ILE A 23 15.392 -5.045 -4.289 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.605 -6.102 -1.866 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.151 -6.427 -2.841 1.00 0.00 H new ATOM 0 HG23 ILE A 23 13.751 -6.934 -3.433 1.00 0.00 H new ATOM 0 HD11 ILE A 23 16.126 -2.733 -3.973 1.00 0.00 H new ATOM 0 HD12 ILE A 23 14.662 -2.791 -4.984 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.545 -2.313 -3.274 1.00 0.00 H new ATOM 351 N SER A 24 10.416 -4.864 -4.723 1.00 0.00 N ATOM 352 CA SER A 24 9.073 -5.431 -4.673 1.00 0.00 C ATOM 353 C SER A 24 8.581 -5.785 -6.073 1.00 0.00 C ATOM 354 O SER A 24 7.674 -6.602 -6.235 1.00 0.00 O ATOM 355 CB SER A 24 8.105 -4.446 -4.014 1.00 0.00 C ATOM 356 OG SER A 24 6.848 -5.053 -3.770 1.00 0.00 O ATOM 0 H SER A 24 10.458 -3.862 -4.535 1.00 0.00 H new ATOM 0 HA SER A 24 9.112 -6.344 -4.078 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.528 -4.088 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.973 -3.575 -4.657 1.00 0.00 H new ATOM 0 HG SER A 24 6.949 -5.754 -3.093 1.00 0.00 H new ATOM 362 N GLN A 25 9.185 -5.165 -7.081 1.00 0.00 N ATOM 363 CA GLN A 25 8.808 -5.414 -8.467 1.00 0.00 C ATOM 364 C GLN A 25 9.561 -6.616 -9.029 1.00 0.00 C ATOM 365 O GLN A 25 9.003 -7.409 -9.786 1.00 0.00 O ATOM 366 CB GLN A 25 9.087 -4.177 -9.324 1.00 0.00 C ATOM 367 CG GLN A 25 8.242 -2.971 -8.944 1.00 0.00 C ATOM 368 CD GLN A 25 8.809 -1.671 -9.479 1.00 0.00 C ATOM 369 OE1 GLN A 25 9.744 -1.670 -10.280 1.00 0.00 O ATOM 370 NE2 GLN A 25 8.244 -0.553 -9.037 1.00 0.00 N ATOM 0 H GLN A 25 9.938 -4.487 -6.964 1.00 0.00 H new ATOM 0 HA GLN A 25 7.740 -5.632 -8.493 1.00 0.00 H new ATOM 0 HB2 GLN A 25 10.141 -3.914 -9.236 1.00 0.00 H new ATOM 0 HB3 GLN A 25 8.906 -4.422 -10.371 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.230 -3.106 -9.326 1.00 0.00 H new ATOM 0 HG3 GLN A 25 8.168 -2.911 -7.858 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.471 -0.600 -8.373 1.00 0.00 H new ATOM 0 HE22 GLN A 25 8.583 0.353 -9.362 1.00 0.00 H new ATOM 379 N GLN A 26 10.829 -6.742 -8.652 1.00 0.00 N ATOM 380 CA GLN A 26 11.657 -7.847 -9.119 1.00 0.00 C ATOM 381 C GLN A 26 11.496 -9.067 -8.219 1.00 0.00 C ATOM 382 O GLN A 26 11.133 -10.150 -8.681 1.00 0.00 O ATOM 383 CB GLN A 26 13.127 -7.425 -9.168 1.00 0.00 C ATOM 384 CG GLN A 26 13.326 -5.944 -9.442 1.00 0.00 C ATOM 385 CD GLN A 26 14.610 -5.656 -10.195 1.00 0.00 C ATOM 386 OE1 GLN A 26 15.112 -6.503 -10.935 1.00 0.00 O ATOM 387 NE2 GLN A 26 15.149 -4.457 -10.010 1.00 0.00 N ATOM 0 H GLN A 26 11.305 -6.093 -8.025 1.00 0.00 H new ATOM 0 HA GLN A 26 11.329 -8.114 -10.124 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.601 -7.677 -8.219 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.636 -8.001 -9.941 1.00 0.00 H new ATOM 0 HG2 GLN A 26 12.480 -5.568 -10.017 1.00 0.00 H new ATOM 0 HG3 GLN A 26 13.335 -5.402 -8.497 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.699 -3.786 -9.388 1.00 0.00 H new ATOM 0 HE22 GLN A 26 16.013 -4.207 -10.490 1.00 0.00 H new ATOM 396 N LYS A 27 11.768 -8.886 -6.931 1.00 0.00 N ATOM 397 CA LYS A 27 11.653 -9.972 -5.964 1.00 0.00 C ATOM 398 C LYS A 27 10.191 -10.334 -5.725 1.00 0.00 C ATOM 399 O LYS A 27 9.857 -11.498 -5.508 1.00 0.00 O ATOM 400 CB LYS A 27 12.314 -9.576 -4.642 1.00 0.00 C ATOM 401 CG LYS A 27 13.643 -8.863 -4.815 1.00 0.00 C ATOM 402 CD LYS A 27 14.646 -9.726 -5.562 1.00 0.00 C ATOM 403 CE LYS A 27 16.048 -9.142 -5.490 1.00 0.00 C ATOM 404 NZ LYS A 27 17.079 -10.115 -5.945 1.00 0.00 N ATOM 0 H LYS A 27 12.070 -7.997 -6.532 1.00 0.00 H new ATOM 0 HA LYS A 27 12.163 -10.845 -6.372 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.635 -8.930 -4.085 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.468 -10.472 -4.040 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.489 -7.930 -5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.046 -8.600 -3.837 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.648 -10.731 -5.140 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.342 -9.818 -6.605 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.099 -8.244 -6.106 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.263 -8.838 -4.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.977 -9.923 -5.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.765 -11.082 -5.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 17.216 -10.021 -6.972 1.00 0.00 H new ATOM 418 N GLY A 28 9.321 -9.329 -5.770 1.00 0.00 N ATOM 419 CA GLY A 28 7.905 -9.564 -5.558 1.00 0.00 C ATOM 420 C GLY A 28 7.541 -9.625 -4.088 1.00 0.00 C ATOM 421 O GLY A 28 6.638 -10.365 -3.695 1.00 0.00 O ATOM 0 H GLY A 28 9.572 -8.357 -5.949 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.332 -8.771 -6.038 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.619 -10.499 -6.039 1.00 0.00 H new ATOM 425 N ILE A 29 8.245 -8.846 -3.273 1.00 0.00 N ATOM 426 CA ILE A 29 7.991 -8.816 -1.838 1.00 0.00 C ATOM 427 C ILE A 29 8.084 -7.395 -1.293 1.00 0.00 C ATOM 428 O ILE A 29 8.294 -6.443 -2.045 1.00 0.00 O ATOM 429 CB ILE A 29 8.980 -9.714 -1.072 1.00 0.00 C ATOM 430 CG1 ILE A 29 10.386 -9.578 -1.660 1.00 0.00 C ATOM 431 CG2 ILE A 29 8.521 -11.163 -1.112 1.00 0.00 C ATOM 432 CD1 ILE A 29 11.120 -8.341 -1.191 1.00 0.00 C ATOM 0 H ILE A 29 8.995 -8.228 -3.582 1.00 0.00 H new ATOM 0 HA ILE A 29 6.980 -9.194 -1.689 1.00 0.00 H new ATOM 0 HB ILE A 29 9.009 -9.392 -0.031 1.00 0.00 H new ATOM 0 HG12 ILE A 29 10.969 -10.460 -1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.316 -9.559 -2.748 1.00 0.00 H new ATOM 0 HG21 ILE A 29 9.231 -11.785 -0.566 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.537 -11.246 -0.651 1.00 0.00 H new ATOM 0 HG23 ILE A 29 8.466 -11.499 -2.148 1.00 0.00 H new ATOM 0 HD11 ILE A 29 12.109 -8.310 -1.648 1.00 0.00 H new ATOM 0 HD12 ILE A 29 10.558 -7.453 -1.481 1.00 0.00 H new ATOM 0 HD13 ILE A 29 11.222 -8.368 -0.106 1.00 0.00 H new ATOM 444 N TRP A 30 7.929 -7.259 0.019 1.00 0.00 N ATOM 445 CA TRP A 30 7.998 -5.953 0.665 1.00 0.00 C ATOM 446 C TRP A 30 8.272 -6.099 2.158 1.00 0.00 C ATOM 447 O TRP A 30 7.545 -6.794 2.867 1.00 0.00 O ATOM 448 CB TRP A 30 6.695 -5.183 0.446 1.00 0.00 C ATOM 449 CG TRP A 30 6.745 -3.774 0.953 1.00 0.00 C ATOM 450 CD1 TRP A 30 5.922 -3.207 1.883 1.00 0.00 C ATOM 451 CD2 TRP A 30 7.666 -2.753 0.555 1.00 0.00 C ATOM 452 NE1 TRP A 30 6.275 -1.895 2.087 1.00 0.00 N ATOM 453 CE2 TRP A 30 7.343 -1.592 1.285 1.00 0.00 C ATOM 454 CE3 TRP A 30 8.734 -2.706 -0.346 1.00 0.00 C ATOM 455 CZ2 TRP A 30 8.049 -0.401 1.140 1.00 0.00 C ATOM 456 CZ3 TRP A 30 9.434 -1.523 -0.489 1.00 0.00 C ATOM 457 CH2 TRP A 30 9.090 -0.384 0.251 1.00 0.00 C ATOM 0 H TRP A 30 7.755 -8.036 0.656 1.00 0.00 H new ATOM 0 HA TRP A 30 8.820 -5.396 0.216 1.00 0.00 H new ATOM 0 HB2 TRP A 30 6.464 -5.170 -0.619 1.00 0.00 H new ATOM 0 HB3 TRP A 30 5.881 -5.711 0.943 1.00 0.00 H new ATOM 0 HD1 TRP A 30 5.112 -3.715 2.385 1.00 0.00 H new ATOM 0 HE1 TRP A 30 5.816 -1.251 2.731 1.00 0.00 H new ATOM 0 HE3 TRP A 30 9.007 -3.579 -0.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 7.785 0.478 1.709 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 10.260 -1.476 -1.183 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.657 0.525 0.117 1.00 0.00 H new ATOM 468 N SER A 31 9.325 -5.438 2.630 1.00 0.00 N ATOM 469 CA SER A 31 9.696 -5.497 4.038 1.00 0.00 C ATOM 470 C SER A 31 9.379 -4.180 4.740 1.00 0.00 C ATOM 471 O SER A 31 10.027 -3.161 4.497 1.00 0.00 O ATOM 472 CB SER A 31 11.185 -5.818 4.182 1.00 0.00 C ATOM 473 OG SER A 31 11.520 -6.092 5.531 1.00 0.00 O ATOM 0 H SER A 31 9.936 -4.856 2.057 1.00 0.00 H new ATOM 0 HA SER A 31 9.113 -6.289 4.508 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.437 -6.677 3.560 1.00 0.00 H new ATOM 0 HB3 SER A 31 11.778 -4.978 3.820 1.00 0.00 H new ATOM 0 HG SER A 31 12.154 -6.838 5.565 1.00 0.00 H new ATOM 479 N THR A 32 8.375 -4.208 5.612 1.00 0.00 N ATOM 480 CA THR A 32 7.969 -3.017 6.348 1.00 0.00 C ATOM 481 C THR A 32 8.285 -3.155 7.833 1.00 0.00 C ATOM 482 O THR A 32 8.657 -4.231 8.302 1.00 0.00 O ATOM 483 CB THR A 32 6.464 -2.738 6.178 1.00 0.00 C ATOM 484 OG1 THR A 32 6.182 -1.369 6.489 1.00 0.00 O ATOM 485 CG2 THR A 32 5.640 -3.648 7.078 1.00 0.00 C ATOM 0 H THR A 32 7.829 -5.042 5.825 1.00 0.00 H new ATOM 0 HA THR A 32 8.534 -2.181 5.935 1.00 0.00 H new ATOM 0 HB THR A 32 6.194 -2.938 5.141 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.665 -0.968 5.759 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.580 -3.433 6.941 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.835 -4.689 6.820 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.914 -3.475 8.119 1.00 0.00 H new ATOM 493 N THR A 33 8.133 -2.059 8.570 1.00 0.00 N ATOM 494 CA THR A 33 8.402 -2.058 10.002 1.00 0.00 C ATOM 495 C THR A 33 7.533 -3.079 10.726 1.00 0.00 C ATOM 496 O THR A 33 6.358 -3.264 10.411 1.00 0.00 O ATOM 497 CB THR A 33 8.160 -0.666 10.618 1.00 0.00 C ATOM 498 OG1 THR A 33 8.795 -0.581 11.899 1.00 0.00 O ATOM 499 CG2 THR A 33 6.672 -0.391 10.764 1.00 0.00 C ATOM 0 H THR A 33 7.825 -1.161 8.198 1.00 0.00 H new ATOM 0 HA THR A 33 9.451 -2.325 10.126 1.00 0.00 H new ATOM 0 HB THR A 33 8.587 0.083 9.951 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.638 0.307 12.283 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.526 0.597 11.201 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.197 -0.428 9.784 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.225 -1.144 11.413 1.00 0.00 H new ATOM 507 N PRO A 34 8.122 -3.760 11.721 1.00 0.00 N ATOM 508 CA PRO A 34 7.419 -4.774 12.511 1.00 0.00 C ATOM 509 C PRO A 34 6.359 -4.166 13.423 1.00 0.00 C ATOM 510 O PRO A 34 5.677 -4.879 14.159 1.00 0.00 O ATOM 511 CB PRO A 34 8.534 -5.415 13.340 1.00 0.00 C ATOM 512 CG PRO A 34 9.584 -4.362 13.440 1.00 0.00 C ATOM 513 CD PRO A 34 9.521 -3.591 12.150 1.00 0.00 C ATOM 0 HA PRO A 34 6.880 -5.480 11.880 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.175 -5.711 14.326 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.919 -6.314 12.858 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.402 -3.709 14.294 1.00 0.00 H new ATOM 0 HG3 PRO A 34 10.569 -4.806 13.582 1.00 0.00 H new ATOM 0 HD2 PRO A 34 9.772 -2.541 12.297 1.00 0.00 H new ATOM 0 HD3 PRO A 34 10.219 -3.986 11.411 1.00 0.00 H new ATOM 521 N SER A 35 6.226 -2.845 13.369 1.00 0.00 N ATOM 522 CA SER A 35 5.250 -2.140 14.193 1.00 0.00 C ATOM 523 C SER A 35 3.922 -1.994 13.457 1.00 0.00 C ATOM 524 O SER A 35 2.908 -1.629 14.051 1.00 0.00 O ATOM 525 CB SER A 35 5.784 -0.761 14.585 1.00 0.00 C ATOM 526 OG SER A 35 5.236 -0.334 15.820 1.00 0.00 O ATOM 0 H SER A 35 6.782 -2.241 12.763 1.00 0.00 H new ATOM 0 HA SER A 35 5.082 -2.727 15.096 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.871 -0.796 14.659 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.540 -0.038 13.806 1.00 0.00 H new ATOM 0 HG SER A 35 5.594 0.549 16.049 1.00 0.00 H new ATOM 532 N ASN A 36 3.936 -2.282 12.160 1.00 0.00 N ATOM 533 CA ASN A 36 2.733 -2.183 11.342 1.00 0.00 C ATOM 534 C ASN A 36 2.513 -3.462 10.541 1.00 0.00 C ATOM 535 O ASN A 36 1.886 -3.443 9.482 1.00 0.00 O ATOM 536 CB ASN A 36 2.833 -0.986 10.394 1.00 0.00 C ATOM 537 CG ASN A 36 3.473 0.221 11.053 1.00 0.00 C ATOM 538 OD1 ASN A 36 3.285 0.464 12.245 1.00 0.00 O ATOM 539 ND2 ASN A 36 4.233 0.985 10.278 1.00 0.00 N ATOM 0 H ASN A 36 4.767 -2.586 11.653 1.00 0.00 H new ATOM 0 HA ASN A 36 1.882 -2.041 12.008 1.00 0.00 H new ATOM 0 HB2 ASN A 36 3.415 -1.268 9.516 1.00 0.00 H new ATOM 0 HB3 ASN A 36 1.836 -0.719 10.043 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.689 1.811 10.666 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.361 0.746 9.295 1.00 0.00 H new ATOM 546 N GLU A 37 3.032 -4.573 11.055 1.00 0.00 N ATOM 547 CA GLU A 37 2.892 -5.862 10.387 1.00 0.00 C ATOM 548 C GLU A 37 1.641 -6.591 10.868 1.00 0.00 C ATOM 549 O GLU A 37 0.919 -7.196 10.076 1.00 0.00 O ATOM 550 CB GLU A 37 4.128 -6.728 10.636 1.00 0.00 C ATOM 551 CG GLU A 37 5.301 -6.390 9.731 1.00 0.00 C ATOM 552 CD GLU A 37 6.476 -7.329 9.924 1.00 0.00 C ATOM 553 OE1 GLU A 37 6.605 -7.900 11.027 1.00 0.00 O ATOM 554 OE2 GLU A 37 7.267 -7.492 8.972 1.00 0.00 O ATOM 0 H GLU A 37 3.553 -4.606 11.931 1.00 0.00 H new ATOM 0 HA GLU A 37 2.796 -5.679 9.317 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.437 -6.615 11.675 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.862 -7.776 10.495 1.00 0.00 H new ATOM 0 HG2 GLU A 37 4.976 -6.429 8.691 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.622 -5.367 9.926 1.00 0.00 H new ATOM 561 N ARG A 38 1.392 -6.528 12.172 1.00 0.00 N ATOM 562 CA ARG A 38 0.230 -7.183 12.760 1.00 0.00 C ATOM 563 C ARG A 38 -1.023 -6.915 11.931 1.00 0.00 C ATOM 564 O ARG A 38 -1.874 -7.790 11.771 1.00 0.00 O ATOM 565 CB ARG A 38 0.017 -6.700 14.196 1.00 0.00 C ATOM 566 CG ARG A 38 -0.634 -5.330 14.287 1.00 0.00 C ATOM 567 CD ARG A 38 -2.151 -5.432 14.289 1.00 0.00 C ATOM 568 NE ARG A 38 -2.687 -5.580 15.640 1.00 0.00 N ATOM 569 CZ ARG A 38 -3.936 -5.952 15.897 1.00 0.00 C ATOM 570 NH1 ARG A 38 -4.772 -6.214 14.902 1.00 0.00 N ATOM 571 NH2 ARG A 38 -4.351 -6.064 17.153 1.00 0.00 N ATOM 0 H ARG A 38 1.979 -6.030 12.841 1.00 0.00 H new ATOM 0 HA ARG A 38 0.416 -8.257 12.769 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -0.603 -7.423 14.726 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.979 -6.670 14.707 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -0.301 -4.828 15.195 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -0.311 -4.716 13.446 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -2.575 -4.541 13.826 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -2.458 -6.283 13.682 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.069 -5.387 16.428 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.457 -6.130 13.936 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.730 -6.499 15.103 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -3.711 -5.864 17.921 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -5.310 -6.350 17.350 1.00 0.00 H new ATOM 585 N LYS A 39 -1.130 -5.699 11.406 1.00 0.00 N ATOM 586 CA LYS A 39 -2.277 -5.314 10.593 1.00 0.00 C ATOM 587 C LYS A 39 -2.262 -6.041 9.252 1.00 0.00 C ATOM 588 O LYS A 39 -3.218 -6.734 8.899 1.00 0.00 O ATOM 589 CB LYS A 39 -2.282 -3.801 10.365 1.00 0.00 C ATOM 590 CG LYS A 39 -0.895 -3.181 10.370 1.00 0.00 C ATOM 591 CD LYS A 39 -0.810 -1.998 9.421 1.00 0.00 C ATOM 592 CE LYS A 39 -1.380 -0.736 10.050 1.00 0.00 C ATOM 593 NZ LYS A 39 -2.869 -0.752 10.077 1.00 0.00 N ATOM 0 H LYS A 39 -0.435 -4.963 11.529 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.182 -5.597 11.130 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -2.763 -3.587 9.410 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -2.886 -3.327 11.139 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.644 -2.857 11.380 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.159 -3.932 10.084 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.230 -1.829 9.141 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.353 -2.226 8.504 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -1.000 -0.633 11.066 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -1.036 0.135 9.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.232 0.159 9.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.219 -1.518 9.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.197 -0.909 11.051 1.00 0.00 H new ATOM 607 N LEU A 40 -1.172 -5.881 8.510 1.00 0.00 N ATOM 608 CA LEU A 40 -1.032 -6.524 7.208 1.00 0.00 C ATOM 609 C LEU A 40 -1.256 -8.029 7.316 1.00 0.00 C ATOM 610 O LEU A 40 -1.895 -8.635 6.457 1.00 0.00 O ATOM 611 CB LEU A 40 0.354 -6.244 6.625 1.00 0.00 C ATOM 612 CG LEU A 40 0.789 -4.778 6.601 1.00 0.00 C ATOM 613 CD1 LEU A 40 2.200 -4.648 6.049 1.00 0.00 C ATOM 614 CD2 LEU A 40 -0.186 -3.947 5.780 1.00 0.00 C ATOM 0 H LEU A 40 -0.372 -5.312 8.787 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.790 -6.110 6.543 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.088 -6.811 7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.381 -6.627 5.605 1.00 0.00 H new ATOM 0 HG LEU A 40 0.786 -4.401 7.624 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.492 -3.598 6.040 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.890 -5.211 6.678 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.231 -5.042 5.033 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.139 -2.906 5.773 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.215 -4.325 4.758 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.181 -4.014 6.220 1.00 0.00 H new ATOM 626 N ASN A 41 -0.727 -8.625 8.380 1.00 0.00 N ATOM 627 CA ASN A 41 -0.871 -10.059 8.602 1.00 0.00 C ATOM 628 C ASN A 41 -2.310 -10.412 8.967 1.00 0.00 C ATOM 629 O ASN A 41 -2.994 -11.116 8.224 1.00 0.00 O ATOM 630 CB ASN A 41 0.076 -10.522 9.711 1.00 0.00 C ATOM 631 CG ASN A 41 0.528 -11.958 9.524 1.00 0.00 C ATOM 632 OD1 ASN A 41 0.017 -12.674 8.663 1.00 0.00 O ATOM 633 ND2 ASN A 41 1.490 -12.385 10.333 1.00 0.00 N ATOM 0 H ASN A 41 -0.195 -8.137 9.101 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.614 -10.572 7.675 1.00 0.00 H new ATOM 0 HB2 ASN A 41 0.949 -9.870 9.735 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -0.423 -10.424 10.675 1.00 0.00 H new ATOM 0 HD21 ASN A 41 1.835 -13.342 10.255 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.885 -11.756 11.033 1.00 0.00 H new ATOM 640 N ARG A 42 -2.762 -9.918 10.114 1.00 0.00 N ATOM 641 CA ARG A 42 -4.119 -10.181 10.578 1.00 0.00 C ATOM 642 C ARG A 42 -5.136 -9.876 9.482 1.00 0.00 C ATOM 643 O ARG A 42 -5.898 -10.750 9.068 1.00 0.00 O ATOM 644 CB ARG A 42 -4.427 -9.345 11.821 1.00 0.00 C ATOM 645 CG ARG A 42 -5.863 -9.476 12.303 1.00 0.00 C ATOM 646 CD ARG A 42 -6.042 -10.694 13.195 1.00 0.00 C ATOM 647 NE ARG A 42 -6.461 -11.870 12.437 1.00 0.00 N ATOM 648 CZ ARG A 42 -7.042 -12.931 12.988 1.00 0.00 C ATOM 649 NH1 ARG A 42 -7.272 -12.962 14.293 1.00 0.00 N ATOM 650 NH2 ARG A 42 -7.394 -13.963 12.232 1.00 0.00 N ATOM 0 H ARG A 42 -2.208 -9.333 10.740 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.191 -11.238 10.833 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.754 -9.643 12.625 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.220 -8.297 11.604 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.148 -8.578 12.851 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.531 -9.551 11.445 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.105 -10.908 13.708 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -6.783 -10.475 13.963 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.299 -11.878 11.430 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -7.003 -12.170 14.877 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -7.718 -13.778 14.713 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.219 -13.943 11.227 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -7.840 -14.777 12.655 1.00 0.00 H new ATOM 664 N ALA A 43 -5.143 -8.631 9.018 1.00 0.00 N ATOM 665 CA ALA A 43 -6.065 -8.212 7.970 1.00 0.00 C ATOM 666 C ALA A 43 -6.123 -9.240 6.845 1.00 0.00 C ATOM 667 O ALA A 43 -7.203 -9.614 6.387 1.00 0.00 O ATOM 668 CB ALA A 43 -5.659 -6.851 7.422 1.00 0.00 C ATOM 0 H ALA A 43 -4.521 -7.895 9.351 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.060 -8.134 8.407 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.357 -6.551 6.640 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.676 -6.115 8.226 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.653 -6.911 7.007 1.00 0.00 H new ATOM 674 N PHE A 44 -4.955 -9.695 6.405 1.00 0.00 N ATOM 675 CA PHE A 44 -4.872 -10.680 5.333 1.00 0.00 C ATOM 676 C PHE A 44 -5.847 -11.829 5.574 1.00 0.00 C ATOM 677 O PHE A 44 -6.421 -12.378 4.633 1.00 0.00 O ATOM 678 CB PHE A 44 -3.446 -11.222 5.217 1.00 0.00 C ATOM 679 CG PHE A 44 -3.215 -12.041 3.980 1.00 0.00 C ATOM 680 CD1 PHE A 44 -3.889 -13.236 3.788 1.00 0.00 C ATOM 681 CD2 PHE A 44 -2.323 -11.616 3.008 1.00 0.00 C ATOM 682 CE1 PHE A 44 -3.677 -13.992 2.651 1.00 0.00 C ATOM 683 CE2 PHE A 44 -2.107 -12.368 1.869 1.00 0.00 C ATOM 684 CZ PHE A 44 -2.786 -13.557 1.689 1.00 0.00 C ATOM 0 H PHE A 44 -4.052 -9.397 6.774 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.142 -10.187 4.399 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -2.746 -10.386 5.226 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -3.225 -11.832 6.093 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.588 -13.581 4.536 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -1.790 -10.686 3.142 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.208 -14.923 2.514 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.408 -12.026 1.120 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.621 -14.145 0.798 1.00 0.00 H new ATOM 694 N TRP A 45 -6.029 -12.187 6.839 1.00 0.00 N ATOM 695 CA TRP A 45 -6.934 -13.271 7.205 1.00 0.00 C ATOM 696 C TRP A 45 -8.339 -12.742 7.467 1.00 0.00 C ATOM 697 O TRP A 45 -9.324 -13.316 7.004 1.00 0.00 O ATOM 698 CB TRP A 45 -6.412 -14.003 8.442 1.00 0.00 C ATOM 699 CG TRP A 45 -4.922 -14.168 8.451 1.00 0.00 C ATOM 700 CD1 TRP A 45 -4.113 -14.366 7.368 1.00 0.00 C ATOM 701 CD2 TRP A 45 -4.064 -14.151 9.597 1.00 0.00 C ATOM 702 NE1 TRP A 45 -2.805 -14.473 7.773 1.00 0.00 N ATOM 703 CE2 TRP A 45 -2.748 -14.344 9.135 1.00 0.00 C ATOM 704 CE3 TRP A 45 -4.280 -13.989 10.968 1.00 0.00 C ATOM 705 CZ2 TRP A 45 -1.655 -14.380 9.997 1.00 0.00 C ATOM 706 CZ3 TRP A 45 -3.194 -14.025 11.822 1.00 0.00 C ATOM 707 CH2 TRP A 45 -1.895 -14.219 11.334 1.00 0.00 C ATOM 0 H TRP A 45 -5.562 -11.743 7.630 1.00 0.00 H new ATOM 0 HA TRP A 45 -6.980 -13.970 6.370 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -6.715 -13.455 9.334 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -6.879 -14.986 8.498 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -4.452 -14.429 6.345 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -2.005 -14.624 7.158 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.278 -13.838 11.353 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -0.653 -14.530 9.623 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.349 -13.901 12.884 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -1.067 -14.242 12.027 1.00 0.00 H new ATOM 718 N GLU A 46 -8.424 -11.644 8.212 1.00 0.00 N ATOM 719 CA GLU A 46 -9.711 -11.039 8.536 1.00 0.00 C ATOM 720 C GLU A 46 -10.363 -10.447 7.289 1.00 0.00 C ATOM 721 O GLU A 46 -11.528 -10.051 7.313 1.00 0.00 O ATOM 722 CB GLU A 46 -9.536 -9.951 9.598 1.00 0.00 C ATOM 723 CG GLU A 46 -9.154 -10.493 10.965 1.00 0.00 C ATOM 724 CD GLU A 46 -9.290 -9.455 12.062 1.00 0.00 C ATOM 725 OE1 GLU A 46 -8.805 -8.320 11.869 1.00 0.00 O ATOM 726 OE2 GLU A 46 -9.882 -9.776 13.114 1.00 0.00 O ATOM 0 H GLU A 46 -7.618 -11.156 8.602 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.361 -11.820 8.930 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.769 -9.251 9.266 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.465 -9.388 9.686 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.784 -11.350 11.201 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.125 -10.852 10.935 1.00 0.00 H new ATOM 733 N SER A 47 -9.601 -10.390 6.201 1.00 0.00 N ATOM 734 CA SER A 47 -10.102 -9.842 4.945 1.00 0.00 C ATOM 735 C SER A 47 -9.750 -10.757 3.776 1.00 0.00 C ATOM 736 O SER A 47 -8.896 -11.634 3.895 1.00 0.00 O ATOM 737 CB SER A 47 -9.525 -8.446 4.707 1.00 0.00 C ATOM 738 OG SER A 47 -9.386 -8.181 3.322 1.00 0.00 O ATOM 0 H SER A 47 -8.635 -10.716 6.164 1.00 0.00 H new ATOM 0 HA SER A 47 -11.187 -9.771 5.015 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.176 -7.698 5.160 1.00 0.00 H new ATOM 0 HB3 SER A 47 -8.554 -8.362 5.196 1.00 0.00 H new ATOM 0 HG SER A 47 -8.614 -7.595 3.177 1.00 0.00 H new ATOM 744 N SER A 48 -10.417 -10.544 2.646 1.00 0.00 N ATOM 745 CA SER A 48 -10.179 -11.351 1.454 1.00 0.00 C ATOM 746 C SER A 48 -8.866 -10.956 0.785 1.00 0.00 C ATOM 747 O SER A 48 -8.138 -11.807 0.273 1.00 0.00 O ATOM 748 CB SER A 48 -11.336 -11.193 0.466 1.00 0.00 C ATOM 749 OG SER A 48 -11.517 -12.371 -0.300 1.00 0.00 O ATOM 0 H SER A 48 -11.126 -9.820 2.531 1.00 0.00 H new ATOM 0 HA SER A 48 -10.112 -12.395 1.759 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.253 -10.964 1.009 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.139 -10.351 -0.197 1.00 0.00 H new ATOM 0 HG SER A 48 -12.263 -12.245 -0.923 1.00 0.00 H new ATOM 755 N ILE A 49 -8.570 -9.661 0.793 1.00 0.00 N ATOM 756 CA ILE A 49 -7.345 -9.153 0.188 1.00 0.00 C ATOM 757 C ILE A 49 -6.805 -7.955 0.962 1.00 0.00 C ATOM 758 O ILE A 49 -7.480 -7.412 1.837 1.00 0.00 O ATOM 759 CB ILE A 49 -7.570 -8.743 -1.279 1.00 0.00 C ATOM 760 CG1 ILE A 49 -8.470 -9.761 -1.984 1.00 0.00 C ATOM 761 CG2 ILE A 49 -6.238 -8.615 -2.003 1.00 0.00 C ATOM 762 CD1 ILE A 49 -9.004 -9.276 -3.313 1.00 0.00 C ATOM 0 H ILE A 49 -9.162 -8.944 1.212 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.617 -9.963 0.223 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.067 -7.773 -1.298 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.909 -10.682 -2.141 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.309 -10.006 -1.332 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.413 -8.325 -3.039 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.628 -7.857 -1.512 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.717 -9.572 -1.978 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.633 -10.048 -3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.593 -8.371 -3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.171 -9.059 -3.982 1.00 0.00 H new ATOM 774 N VAL A 50 -5.584 -7.547 0.633 1.00 0.00 N ATOM 775 CA VAL A 50 -4.953 -6.411 1.294 1.00 0.00 C ATOM 776 C VAL A 50 -4.311 -5.471 0.280 1.00 0.00 C ATOM 777 O VAL A 50 -3.222 -5.740 -0.228 1.00 0.00 O ATOM 778 CB VAL A 50 -3.883 -6.871 2.302 1.00 0.00 C ATOM 779 CG1 VAL A 50 -3.073 -5.684 2.800 1.00 0.00 C ATOM 780 CG2 VAL A 50 -4.528 -7.612 3.463 1.00 0.00 C ATOM 0 H VAL A 50 -5.012 -7.986 -0.088 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.740 -5.879 1.829 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.204 -7.557 1.796 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.322 -6.029 3.511 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.579 -5.201 1.957 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.736 -4.971 3.290 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.757 -7.930 4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.231 -6.952 3.970 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.059 -8.487 3.087 1.00 0.00 H new ATOM 790 N TYR A 51 -4.991 -4.368 -0.010 1.00 0.00 N ATOM 791 CA TYR A 51 -4.488 -3.389 -0.965 1.00 0.00 C ATOM 792 C TYR A 51 -3.481 -2.452 -0.305 1.00 0.00 C ATOM 793 O TYR A 51 -3.833 -1.656 0.567 1.00 0.00 O ATOM 794 CB TYR A 51 -5.644 -2.579 -1.555 1.00 0.00 C ATOM 795 CG TYR A 51 -6.276 -3.222 -2.768 1.00 0.00 C ATOM 796 CD1 TYR A 51 -5.497 -3.670 -3.828 1.00 0.00 C ATOM 797 CD2 TYR A 51 -7.654 -3.383 -2.855 1.00 0.00 C ATOM 798 CE1 TYR A 51 -6.071 -4.258 -4.938 1.00 0.00 C ATOM 799 CE2 TYR A 51 -8.236 -3.971 -3.961 1.00 0.00 C ATOM 800 CZ TYR A 51 -7.440 -4.406 -5.001 1.00 0.00 C ATOM 801 OH TYR A 51 -8.016 -4.992 -6.105 1.00 0.00 O ATOM 0 H TYR A 51 -5.893 -4.129 0.403 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.984 -3.928 -1.767 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.407 -2.439 -0.789 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -5.281 -1.588 -1.827 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.424 -3.556 -3.783 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.280 -3.042 -2.044 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.450 -4.600 -5.753 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -9.308 -4.090 -4.012 1.00 0.00 H new ATOM 0 HH TYR A 51 -8.989 -5.021 -5.990 1.00 0.00 H new ATOM 811 N LEU A 52 -2.225 -2.551 -0.728 1.00 0.00 N ATOM 812 CA LEU A 52 -1.165 -1.712 -0.180 1.00 0.00 C ATOM 813 C LEU A 52 -0.688 -0.694 -1.210 1.00 0.00 C ATOM 814 O LEU A 52 -0.023 -1.047 -2.185 1.00 0.00 O ATOM 815 CB LEU A 52 0.010 -2.577 0.281 1.00 0.00 C ATOM 816 CG LEU A 52 -0.349 -3.804 1.120 1.00 0.00 C ATOM 817 CD1 LEU A 52 0.786 -4.817 1.097 1.00 0.00 C ATOM 818 CD2 LEU A 52 -0.673 -3.396 2.550 1.00 0.00 C ATOM 0 H LEU A 52 -1.916 -3.204 -1.448 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.569 -1.172 0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.557 -2.912 -0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.690 -1.952 0.860 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.234 -4.270 0.687 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.513 -5.683 1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.971 -5.133 0.070 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.688 -4.362 1.505 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.926 -4.282 3.133 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.193 -2.905 2.994 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.519 -2.708 2.549 1.00 0.00 H new ATOM 830 N VAL A 53 -1.030 0.571 -0.987 1.00 0.00 N ATOM 831 CA VAL A 53 -0.634 1.641 -1.895 1.00 0.00 C ATOM 832 C VAL A 53 0.736 2.198 -1.524 1.00 0.00 C ATOM 833 O VAL A 53 0.894 2.849 -0.491 1.00 0.00 O ATOM 834 CB VAL A 53 -1.661 2.789 -1.891 1.00 0.00 C ATOM 835 CG1 VAL A 53 -1.261 3.867 -2.887 1.00 0.00 C ATOM 836 CG2 VAL A 53 -3.054 2.259 -2.197 1.00 0.00 C ATOM 0 H VAL A 53 -1.580 0.880 -0.186 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.588 1.208 -2.894 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.677 3.235 -0.897 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.998 4.670 -2.870 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.283 4.267 -2.618 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.214 3.438 -3.888 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.767 3.084 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -3.056 1.786 -3.179 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.339 1.527 -1.441 1.00 0.00 H new ATOM 846 N PHE A 54 1.724 1.938 -2.373 1.00 0.00 N ATOM 847 CA PHE A 54 3.082 2.412 -2.134 1.00 0.00 C ATOM 848 C PHE A 54 3.325 3.743 -2.840 1.00 0.00 C ATOM 849 O PHE A 54 2.807 3.983 -3.930 1.00 0.00 O ATOM 850 CB PHE A 54 4.100 1.375 -2.613 1.00 0.00 C ATOM 851 CG PHE A 54 3.763 -0.029 -2.200 1.00 0.00 C ATOM 852 CD1 PHE A 54 2.773 -0.741 -2.859 1.00 0.00 C ATOM 853 CD2 PHE A 54 4.437 -0.638 -1.154 1.00 0.00 C ATOM 854 CE1 PHE A 54 2.461 -2.033 -2.482 1.00 0.00 C ATOM 855 CE2 PHE A 54 4.130 -1.931 -0.773 1.00 0.00 C ATOM 856 CZ PHE A 54 3.140 -2.629 -1.437 1.00 0.00 C ATOM 0 H PHE A 54 1.610 1.402 -3.233 1.00 0.00 H new ATOM 0 HA PHE A 54 3.204 2.561 -1.061 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.168 1.419 -3.700 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.083 1.635 -2.221 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.239 -0.280 -3.677 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.211 -0.097 -0.630 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.687 -2.576 -3.004 1.00 0.00 H new ATOM 0 HE2 PHE A 54 4.664 -2.395 0.043 1.00 0.00 H new ATOM 0 HZ PHE A 54 2.897 -3.639 -1.140 1.00 0.00 H new ATOM 866 N SER A 55 4.116 4.605 -2.209 1.00 0.00 N ATOM 867 CA SER A 55 4.424 5.914 -2.773 1.00 0.00 C ATOM 868 C SER A 55 5.770 6.422 -2.264 1.00 0.00 C ATOM 869 O SER A 55 5.967 6.594 -1.061 1.00 0.00 O ATOM 870 CB SER A 55 3.323 6.917 -2.423 1.00 0.00 C ATOM 871 OG SER A 55 3.231 7.936 -3.403 1.00 0.00 O ATOM 0 H SER A 55 4.555 4.420 -1.307 1.00 0.00 H new ATOM 0 HA SER A 55 4.480 5.810 -3.857 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.367 6.399 -2.342 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.528 7.362 -1.449 1.00 0.00 H new ATOM 0 HG SER A 55 2.519 8.563 -3.157 1.00 0.00 H new ATOM 877 N VAL A 56 6.695 6.658 -3.189 1.00 0.00 N ATOM 878 CA VAL A 56 8.022 7.147 -2.836 1.00 0.00 C ATOM 879 C VAL A 56 7.969 8.600 -2.377 1.00 0.00 C ATOM 880 O VAL A 56 7.138 9.378 -2.845 1.00 0.00 O ATOM 881 CB VAL A 56 8.997 7.031 -4.023 1.00 0.00 C ATOM 882 CG1 VAL A 56 10.255 7.846 -3.763 1.00 0.00 C ATOM 883 CG2 VAL A 56 9.342 5.573 -4.288 1.00 0.00 C ATOM 0 H VAL A 56 6.549 6.518 -4.189 1.00 0.00 H new ATOM 0 HA VAL A 56 8.381 6.523 -2.017 1.00 0.00 H new ATOM 0 HB VAL A 56 8.510 7.433 -4.911 1.00 0.00 H new ATOM 0 HG11 VAL A 56 10.932 7.752 -4.612 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.988 8.894 -3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.748 7.477 -2.864 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.032 5.509 -5.130 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.810 5.143 -3.402 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.432 5.021 -4.522 1.00 0.00 H new ATOM 893 N GLN A 57 8.861 8.957 -1.459 1.00 0.00 N ATOM 894 CA GLN A 57 8.915 10.318 -0.936 1.00 0.00 C ATOM 895 C GLN A 57 9.270 11.311 -2.038 1.00 0.00 C ATOM 896 O GLN A 57 9.500 10.926 -3.184 1.00 0.00 O ATOM 897 CB GLN A 57 9.937 10.410 0.198 1.00 0.00 C ATOM 898 CG GLN A 57 9.486 9.728 1.480 1.00 0.00 C ATOM 899 CD GLN A 57 8.682 10.648 2.379 1.00 0.00 C ATOM 900 OE1 GLN A 57 7.456 10.712 2.283 1.00 0.00 O ATOM 901 NE2 GLN A 57 9.369 11.366 3.259 1.00 0.00 N ATOM 0 H GLN A 57 9.556 8.324 -1.062 1.00 0.00 H new ATOM 0 HA GLN A 57 7.928 10.571 -0.548 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.874 9.962 -0.132 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.142 11.460 0.407 1.00 0.00 H new ATOM 0 HG2 GLN A 57 8.885 8.854 1.230 1.00 0.00 H new ATOM 0 HG3 GLN A 57 10.360 9.369 2.023 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.385 11.282 3.304 1.00 0.00 H new ATOM 0 HE22 GLN A 57 8.881 12.002 3.890 1.00 0.00 H new ATOM 935 N HIS A 61 3.432 11.717 -6.961 1.00 0.00 N ATOM 936 CA HIS A 61 2.648 10.676 -7.618 1.00 0.00 C ATOM 937 C HIS A 61 2.622 9.404 -6.776 1.00 0.00 C ATOM 938 O HIS A 61 3.311 9.304 -5.761 1.00 0.00 O ATOM 939 CB HIS A 61 3.221 10.374 -9.003 1.00 0.00 C ATOM 940 CG HIS A 61 3.182 11.545 -9.935 1.00 0.00 C ATOM 941 ND1 HIS A 61 3.951 12.676 -9.756 1.00 0.00 N ATOM 942 CD2 HIS A 61 2.463 11.757 -11.062 1.00 0.00 C ATOM 943 CE1 HIS A 61 3.705 13.533 -10.731 1.00 0.00 C ATOM 944 NE2 HIS A 61 2.805 12.999 -11.537 1.00 0.00 N ATOM 0 HA HIS A 61 1.626 11.039 -7.728 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.253 10.040 -8.895 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.663 9.549 -9.446 1.00 0.00 H new ATOM 0 HD2 HIS A 61 1.752 11.076 -11.505 1.00 0.00 H new ATOM 0 HE1 HIS A 61 4.162 14.504 -10.849 1.00 0.00 H new ATOM 0 HE2 HIS A 61 2.426 13.438 -12.376 1.00 0.00 H new ATOM 952 N PHE A 62 1.821 8.434 -7.205 1.00 0.00 N ATOM 953 CA PHE A 62 1.703 7.168 -6.490 1.00 0.00 C ATOM 954 C PHE A 62 2.421 6.050 -7.241 1.00 0.00 C ATOM 955 O PHE A 62 1.948 5.582 -8.277 1.00 0.00 O ATOM 956 CB PHE A 62 0.230 6.803 -6.295 1.00 0.00 C ATOM 957 CG PHE A 62 -0.366 7.368 -5.038 1.00 0.00 C ATOM 958 CD1 PHE A 62 -0.038 6.839 -3.801 1.00 0.00 C ATOM 959 CD2 PHE A 62 -1.256 8.430 -5.094 1.00 0.00 C ATOM 960 CE1 PHE A 62 -0.586 7.357 -2.642 1.00 0.00 C ATOM 961 CE2 PHE A 62 -1.806 8.952 -3.939 1.00 0.00 C ATOM 962 CZ PHE A 62 -1.471 8.415 -2.712 1.00 0.00 C ATOM 0 H PHE A 62 1.244 8.500 -8.044 1.00 0.00 H new ATOM 0 HA PHE A 62 2.173 7.286 -5.514 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -0.341 7.161 -7.151 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.132 5.718 -6.278 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.654 6.012 -3.741 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.522 8.854 -6.051 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.322 6.935 -1.683 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.498 9.780 -3.996 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.900 8.822 -1.808 1.00 0.00 H new ATOM 972 N GLN A 63 3.565 5.629 -6.711 1.00 0.00 N ATOM 973 CA GLN A 63 4.348 4.568 -7.332 1.00 0.00 C ATOM 974 C GLN A 63 3.453 3.411 -7.763 1.00 0.00 C ATOM 975 O GLN A 63 3.796 2.650 -8.667 1.00 0.00 O ATOM 976 CB GLN A 63 5.422 4.065 -6.365 1.00 0.00 C ATOM 977 CG GLN A 63 6.739 4.815 -6.475 1.00 0.00 C ATOM 978 CD GLN A 63 7.157 5.053 -7.913 1.00 0.00 C ATOM 979 OE1 GLN A 63 7.371 4.108 -8.674 1.00 0.00 O ATOM 980 NE2 GLN A 63 7.277 6.319 -8.294 1.00 0.00 N ATOM 0 H GLN A 63 3.970 6.006 -5.854 1.00 0.00 H new ATOM 0 HA GLN A 63 4.831 4.979 -8.219 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.049 4.151 -5.344 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.600 3.006 -6.552 1.00 0.00 H new ATOM 0 HG2 GLN A 63 6.651 5.773 -5.963 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.518 4.250 -5.963 1.00 0.00 H new ATOM 0 HE21 GLN A 63 7.090 7.071 -7.631 1.00 0.00 H new ATOM 0 HE22 GLN A 63 7.556 6.540 -9.250 1.00 0.00 H new ATOM 989 N GLY A 64 2.302 3.284 -7.109 1.00 0.00 N ATOM 990 CA GLY A 64 1.376 2.217 -7.438 1.00 0.00 C ATOM 991 C GLY A 64 0.917 1.449 -6.214 1.00 0.00 C ATOM 992 O GLY A 64 1.269 1.796 -5.086 1.00 0.00 O ATOM 0 H GLY A 64 1.995 3.901 -6.357 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.508 2.637 -7.946 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.852 1.529 -8.137 1.00 0.00 H new ATOM 996 N PHE A 65 0.127 0.403 -6.435 1.00 0.00 N ATOM 997 CA PHE A 65 -0.383 -0.414 -5.340 1.00 0.00 C ATOM 998 C PHE A 65 -0.135 -1.896 -5.607 1.00 0.00 C ATOM 999 O PHE A 65 0.204 -2.289 -6.723 1.00 0.00 O ATOM 1000 CB PHE A 65 -1.879 -0.164 -5.143 1.00 0.00 C ATOM 1001 CG PHE A 65 -2.726 -0.662 -6.279 1.00 0.00 C ATOM 1002 CD1 PHE A 65 -2.983 0.145 -7.375 1.00 0.00 C ATOM 1003 CD2 PHE A 65 -3.263 -1.939 -6.252 1.00 0.00 C ATOM 1004 CE1 PHE A 65 -3.761 -0.311 -8.422 1.00 0.00 C ATOM 1005 CE2 PHE A 65 -4.043 -2.401 -7.296 1.00 0.00 C ATOM 1006 CZ PHE A 65 -4.291 -1.586 -8.383 1.00 0.00 C ATOM 0 H PHE A 65 -0.174 0.101 -7.362 1.00 0.00 H new ATOM 0 HA PHE A 65 0.148 -0.132 -4.431 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.201 -0.648 -4.221 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -2.047 0.906 -5.017 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -2.570 1.142 -7.412 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.070 -2.581 -5.405 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -3.955 0.329 -9.270 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.458 -3.398 -7.261 1.00 0.00 H new ATOM 0 HZ PHE A 65 -4.898 -1.945 -9.201 1.00 0.00 H new ATOM 1016 N SER A 66 -0.305 -2.714 -4.573 1.00 0.00 N ATOM 1017 CA SER A 66 -0.095 -4.152 -4.693 1.00 0.00 C ATOM 1018 C SER A 66 -0.893 -4.907 -3.634 1.00 0.00 C ATOM 1019 O SER A 66 -0.785 -4.625 -2.441 1.00 0.00 O ATOM 1020 CB SER A 66 1.392 -4.485 -4.560 1.00 0.00 C ATOM 1021 OG SER A 66 2.192 -3.520 -5.223 1.00 0.00 O ATOM 0 H SER A 66 -0.588 -2.405 -3.643 1.00 0.00 H new ATOM 0 HA SER A 66 -0.443 -4.464 -5.678 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.666 -4.527 -3.506 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.586 -5.472 -4.979 1.00 0.00 H new ATOM 0 HG SER A 66 2.917 -3.971 -5.705 1.00 0.00 H new ATOM 1027 N ARG A 67 -1.694 -5.869 -4.081 1.00 0.00 N ATOM 1028 CA ARG A 67 -2.512 -6.665 -3.173 1.00 0.00 C ATOM 1029 C ARG A 67 -1.697 -7.801 -2.562 1.00 0.00 C ATOM 1030 O ARG A 67 -1.124 -8.621 -3.279 1.00 0.00 O ATOM 1031 CB ARG A 67 -3.726 -7.233 -3.912 1.00 0.00 C ATOM 1032 CG ARG A 67 -3.362 -8.198 -5.028 1.00 0.00 C ATOM 1033 CD ARG A 67 -4.600 -8.704 -5.752 1.00 0.00 C ATOM 1034 NE ARG A 67 -4.262 -9.599 -6.855 1.00 0.00 N ATOM 1035 CZ ARG A 67 -5.061 -9.821 -7.893 1.00 0.00 C ATOM 1036 NH1 ARG A 67 -6.238 -9.216 -7.969 1.00 0.00 N ATOM 1037 NH2 ARG A 67 -4.682 -10.649 -8.858 1.00 0.00 N ATOM 0 H ARG A 67 -1.794 -6.116 -5.066 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.856 -6.015 -2.369 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.370 -7.744 -3.196 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.305 -6.409 -4.330 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.701 -7.702 -5.738 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -2.810 -9.042 -4.615 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.245 -9.227 -5.046 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.168 -7.856 -6.134 1.00 0.00 H new ATOM 0 HE ARG A 67 -3.363 -10.080 -6.827 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.532 -8.578 -7.229 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -6.849 -9.388 -8.767 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.777 -11.116 -8.803 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.296 -10.819 -9.655 1.00 0.00 H new ATOM 1051 N MET A 68 -1.651 -7.841 -1.235 1.00 0.00 N ATOM 1052 CA MET A 68 -0.907 -8.877 -0.528 1.00 0.00 C ATOM 1053 C MET A 68 -1.319 -10.266 -1.008 1.00 0.00 C ATOM 1054 O MET A 68 -2.502 -10.603 -1.018 1.00 0.00 O ATOM 1055 CB MET A 68 -1.133 -8.759 0.980 1.00 0.00 C ATOM 1056 CG MET A 68 0.032 -9.271 1.812 1.00 0.00 C ATOM 1057 SD MET A 68 0.170 -8.434 3.403 1.00 0.00 S ATOM 1058 CE MET A 68 0.309 -9.834 4.511 1.00 0.00 C ATOM 0 H MET A 68 -2.120 -7.169 -0.628 1.00 0.00 H new ATOM 0 HA MET A 68 0.153 -8.737 -0.741 1.00 0.00 H new ATOM 0 HB2 MET A 68 -1.316 -7.714 1.231 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.032 -9.314 1.249 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.088 -10.342 1.978 1.00 0.00 H new ATOM 0 HG3 MET A 68 0.959 -9.137 1.254 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.455 -9.478 5.531 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.603 -10.429 4.462 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.159 -10.449 4.216 1.00 0.00 H new ATOM 1068 N SER A 69 -0.334 -11.066 -1.404 1.00 0.00 N ATOM 1069 CA SER A 69 -0.595 -12.416 -1.889 1.00 0.00 C ATOM 1070 C SER A 69 -0.201 -13.455 -0.843 1.00 0.00 C ATOM 1071 O SER A 69 -0.785 -14.536 -0.775 1.00 0.00 O ATOM 1072 CB SER A 69 0.169 -12.671 -3.190 1.00 0.00 C ATOM 1073 OG SER A 69 0.093 -14.034 -3.568 1.00 0.00 O ATOM 0 H SER A 69 0.651 -10.803 -1.398 1.00 0.00 H new ATOM 0 HA SER A 69 -1.664 -12.506 -2.081 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.241 -12.047 -3.984 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.213 -12.383 -3.065 1.00 0.00 H new ATOM 0 HG SER A 69 0.588 -14.170 -4.403 1.00 0.00 H new ATOM 1079 N SER A 70 0.794 -13.117 -0.029 1.00 0.00 N ATOM 1080 CA SER A 70 1.269 -14.021 1.012 1.00 0.00 C ATOM 1081 C SER A 70 1.329 -13.311 2.362 1.00 0.00 C ATOM 1082 O SER A 70 1.393 -12.084 2.427 1.00 0.00 O ATOM 1083 CB SER A 70 2.651 -14.568 0.649 1.00 0.00 C ATOM 1084 OG SER A 70 2.904 -15.795 1.311 1.00 0.00 O ATOM 0 H SER A 70 1.286 -12.225 -0.070 1.00 0.00 H new ATOM 0 HA SER A 70 0.566 -14.850 1.088 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.716 -14.713 -0.429 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.416 -13.841 0.920 1.00 0.00 H new ATOM 0 HG SER A 70 3.844 -16.044 1.191 1.00 0.00 H new ATOM 1090 N GLU A 71 1.307 -14.094 3.436 1.00 0.00 N ATOM 1091 CA GLU A 71 1.358 -13.541 4.784 1.00 0.00 C ATOM 1092 C GLU A 71 2.801 -13.334 5.234 1.00 0.00 C ATOM 1093 O GLU A 71 3.725 -13.943 4.692 1.00 0.00 O ATOM 1094 CB GLU A 71 0.635 -14.465 5.766 1.00 0.00 C ATOM 1095 CG GLU A 71 1.208 -15.872 5.813 1.00 0.00 C ATOM 1096 CD GLU A 71 0.539 -16.808 4.825 1.00 0.00 C ATOM 1097 OE1 GLU A 71 -0.673 -16.642 4.577 1.00 0.00 O ATOM 1098 OE2 GLU A 71 1.230 -17.707 4.300 1.00 0.00 O ATOM 0 H GLU A 71 1.254 -15.112 3.399 1.00 0.00 H new ATOM 0 HA GLU A 71 0.857 -12.573 4.770 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.682 -14.029 6.764 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.418 -14.520 5.492 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.277 -15.832 5.603 1.00 0.00 H new ATOM 0 HG3 GLU A 71 1.096 -16.273 6.820 1.00 0.00 H new ATOM 1105 N ILE A 72 2.988 -12.470 6.226 1.00 0.00 N ATOM 1106 CA ILE A 72 4.318 -12.183 6.748 1.00 0.00 C ATOM 1107 C ILE A 72 4.835 -13.337 7.601 1.00 0.00 C ATOM 1108 O ILE A 72 4.105 -13.892 8.421 1.00 0.00 O ATOM 1109 CB ILE A 72 4.325 -10.893 7.591 1.00 0.00 C ATOM 1110 CG1 ILE A 72 3.731 -9.732 6.791 1.00 0.00 C ATOM 1111 CG2 ILE A 72 5.740 -10.564 8.042 1.00 0.00 C ATOM 1112 CD1 ILE A 72 3.290 -8.569 7.651 1.00 0.00 C ATOM 0 H ILE A 72 2.235 -11.957 6.684 1.00 0.00 H new ATOM 0 HA ILE A 72 4.973 -12.049 5.887 1.00 0.00 H new ATOM 0 HB ILE A 72 3.710 -11.051 8.477 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.471 -9.381 6.071 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.877 -10.095 6.219 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.729 -9.650 8.636 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.130 -11.384 8.645 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.376 -10.421 7.169 1.00 0.00 H new ATOM 0 HD11 ILE A 72 2.879 -7.783 7.017 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.527 -8.905 8.353 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.145 -8.180 8.203 1.00 0.00 H new ATOM 1124 N GLY A 73 6.101 -13.691 7.402 1.00 0.00 N ATOM 1125 CA GLY A 73 6.695 -14.776 8.161 1.00 0.00 C ATOM 1126 C GLY A 73 7.885 -15.394 7.453 1.00 0.00 C ATOM 1127 O GLY A 73 8.846 -14.701 7.119 1.00 0.00 O ATOM 0 H GLY A 73 6.725 -13.246 6.729 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.009 -14.404 9.136 1.00 0.00 H new ATOM 0 HA3 GLY A 73 5.943 -15.545 8.340 1.00 0.00 H new ATOM 1131 N ARG A 74 7.823 -16.702 7.227 1.00 0.00 N ATOM 1132 CA ARG A 74 8.905 -17.414 6.558 1.00 0.00 C ATOM 1133 C ARG A 74 9.513 -16.561 5.449 1.00 0.00 C ATOM 1134 O ARG A 74 10.730 -16.393 5.380 1.00 0.00 O ATOM 1135 CB ARG A 74 8.393 -18.734 5.977 1.00 0.00 C ATOM 1136 CG ARG A 74 9.485 -19.770 5.766 1.00 0.00 C ATOM 1137 CD ARG A 74 9.982 -20.333 7.088 1.00 0.00 C ATOM 1138 NE ARG A 74 11.087 -19.551 7.634 1.00 0.00 N ATOM 1139 CZ ARG A 74 11.623 -19.772 8.830 1.00 0.00 C ATOM 1140 NH1 ARG A 74 11.156 -20.746 9.600 1.00 0.00 N ATOM 1141 NH2 ARG A 74 12.627 -19.017 9.258 1.00 0.00 N ATOM 0 H ARG A 74 7.035 -17.290 7.497 1.00 0.00 H new ATOM 0 HA ARG A 74 9.678 -17.625 7.297 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.637 -19.146 6.645 1.00 0.00 H new ATOM 0 HB3 ARG A 74 7.903 -18.536 5.024 1.00 0.00 H new ATOM 0 HG2 ARG A 74 9.104 -20.580 5.145 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.317 -19.318 5.226 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.162 -20.352 7.805 1.00 0.00 H new ATOM 0 HD3 ARG A 74 10.304 -21.365 6.945 1.00 0.00 H new ATOM 0 HE ARG A 74 11.469 -18.794 7.067 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.384 -21.328 9.275 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.569 -20.913 10.517 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.988 -18.266 8.669 1.00 0.00 H new ATOM 0 HH22 ARG A 74 13.038 -19.187 10.176 1.00 0.00 H new ATOM 1155 N GLU A 75 8.658 -16.025 4.584 1.00 0.00 N ATOM 1156 CA GLU A 75 9.112 -15.190 3.479 1.00 0.00 C ATOM 1157 C GLU A 75 10.207 -14.230 3.936 1.00 0.00 C ATOM 1158 O GLU A 75 10.014 -13.447 4.866 1.00 0.00 O ATOM 1159 CB GLU A 75 7.940 -14.401 2.891 1.00 0.00 C ATOM 1160 CG GLU A 75 6.930 -15.268 2.158 1.00 0.00 C ATOM 1161 CD GLU A 75 7.567 -16.473 1.495 1.00 0.00 C ATOM 1162 OE1 GLU A 75 8.297 -16.286 0.499 1.00 0.00 O ATOM 1163 OE2 GLU A 75 7.336 -17.604 1.972 1.00 0.00 O ATOM 0 H GLU A 75 7.647 -16.154 4.627 1.00 0.00 H new ATOM 0 HA GLU A 75 9.523 -15.843 2.710 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.433 -13.867 3.695 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.327 -13.649 2.204 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.169 -15.605 2.861 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.423 -14.668 1.402 1.00 0.00 H new ATOM 1170 N LYS A 76 11.358 -14.298 3.275 1.00 0.00 N ATOM 1171 CA LYS A 76 12.485 -13.436 3.611 1.00 0.00 C ATOM 1172 C LYS A 76 13.276 -13.063 2.362 1.00 0.00 C ATOM 1173 O LYS A 76 13.281 -13.799 1.376 1.00 0.00 O ATOM 1174 CB LYS A 76 13.402 -14.131 4.620 1.00 0.00 C ATOM 1175 CG LYS A 76 12.973 -13.941 6.064 1.00 0.00 C ATOM 1176 CD LYS A 76 13.491 -12.631 6.633 1.00 0.00 C ATOM 1177 CE LYS A 76 12.990 -12.402 8.051 1.00 0.00 C ATOM 1178 NZ LYS A 76 13.819 -13.126 9.055 1.00 0.00 N ATOM 0 H LYS A 76 11.535 -14.941 2.503 1.00 0.00 H new ATOM 0 HA LYS A 76 12.091 -12.522 4.056 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.432 -15.197 4.396 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.416 -13.751 4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.885 -13.961 6.127 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.342 -14.771 6.666 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.581 -12.637 6.628 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.173 -11.806 5.996 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.001 -11.335 8.272 1.00 0.00 H new ATOM 0 HE3 LYS A 76 11.954 -12.733 8.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 13.446 -12.945 10.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 13.788 -14.147 8.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 14.802 -12.792 8.999 1.00 0.00 H new ATOM 1192 N SER A 77 13.945 -11.915 2.411 1.00 0.00 N ATOM 1193 CA SER A 77 14.738 -11.443 1.282 1.00 0.00 C ATOM 1194 C SER A 77 16.103 -10.946 1.747 1.00 0.00 C ATOM 1195 O SER A 77 16.410 -10.968 2.938 1.00 0.00 O ATOM 1196 CB SER A 77 13.999 -10.325 0.544 1.00 0.00 C ATOM 1197 OG SER A 77 14.457 -10.206 -0.792 1.00 0.00 O ATOM 0 H SER A 77 13.953 -11.295 3.221 1.00 0.00 H new ATOM 0 HA SER A 77 14.889 -12.280 0.600 1.00 0.00 H new ATOM 0 HB2 SER A 77 12.928 -10.528 0.548 1.00 0.00 H new ATOM 0 HB3 SER A 77 14.146 -9.380 1.068 1.00 0.00 H new ATOM 0 HG SER A 77 13.968 -9.486 -1.243 1.00 0.00 H new ATOM 1203 N GLN A 78 16.918 -10.498 0.797 1.00 0.00 N ATOM 1204 CA GLN A 78 18.251 -9.996 1.108 1.00 0.00 C ATOM 1205 C GLN A 78 18.389 -8.532 0.705 1.00 0.00 C ATOM 1206 O GLN A 78 18.508 -7.651 1.557 1.00 0.00 O ATOM 1207 CB GLN A 78 19.314 -10.835 0.398 1.00 0.00 C ATOM 1208 CG GLN A 78 20.701 -10.704 1.008 1.00 0.00 C ATOM 1209 CD GLN A 78 20.801 -11.354 2.374 1.00 0.00 C ATOM 1210 OE1 GLN A 78 20.987 -12.566 2.485 1.00 0.00 O ATOM 1211 NE2 GLN A 78 20.679 -10.550 3.423 1.00 0.00 N ATOM 0 H GLN A 78 16.678 -10.473 -0.194 1.00 0.00 H new ATOM 0 HA GLN A 78 18.398 -10.073 2.185 1.00 0.00 H new ATOM 0 HB2 GLN A 78 19.013 -11.882 0.421 1.00 0.00 H new ATOM 0 HB3 GLN A 78 19.358 -10.539 -0.650 1.00 0.00 H new ATOM 0 HG2 GLN A 78 21.432 -11.158 0.339 1.00 0.00 H new ATOM 0 HG3 GLN A 78 20.959 -9.648 1.092 1.00 0.00 H new ATOM 0 HE21 GLN A 78 20.526 -9.551 3.285 1.00 0.00 H new ATOM 0 HE22 GLN A 78 20.739 -10.931 4.367 1.00 0.00 H new ATOM 1220 N ASP A 79 18.373 -8.279 -0.599 1.00 0.00 N ATOM 1221 CA ASP A 79 18.495 -6.920 -1.116 1.00 0.00 C ATOM 1222 C ASP A 79 17.447 -6.005 -0.492 1.00 0.00 C ATOM 1223 O ASP A 79 16.247 -6.263 -0.587 1.00 0.00 O ATOM 1224 CB ASP A 79 18.352 -6.917 -2.639 1.00 0.00 C ATOM 1225 CG ASP A 79 19.392 -7.784 -3.320 1.00 0.00 C ATOM 1226 OD1 ASP A 79 20.598 -7.544 -3.103 1.00 0.00 O ATOM 1227 OD2 ASP A 79 19.000 -8.702 -4.071 1.00 0.00 O ATOM 0 H ASP A 79 18.277 -8.997 -1.318 1.00 0.00 H new ATOM 0 HA ASP A 79 19.483 -6.544 -0.851 1.00 0.00 H new ATOM 0 HB2 ASP A 79 17.356 -7.270 -2.908 1.00 0.00 H new ATOM 0 HB3 ASP A 79 18.438 -5.895 -3.007 1.00 0.00 H new ATOM 1232 N TRP A 80 17.908 -4.936 0.148 1.00 0.00 N ATOM 1233 CA TRP A 80 17.010 -3.982 0.789 1.00 0.00 C ATOM 1234 C TRP A 80 17.723 -2.663 1.064 1.00 0.00 C ATOM 1235 O TRP A 80 18.946 -2.576 0.969 1.00 0.00 O ATOM 1236 CB TRP A 80 16.464 -4.563 2.094 1.00 0.00 C ATOM 1237 CG TRP A 80 15.209 -5.362 1.910 1.00 0.00 C ATOM 1238 CD1 TRP A 80 14.955 -6.612 2.397 1.00 0.00 C ATOM 1239 CD2 TRP A 80 14.039 -4.965 1.187 1.00 0.00 C ATOM 1240 NE1 TRP A 80 13.697 -7.016 2.020 1.00 0.00 N ATOM 1241 CE2 TRP A 80 13.114 -6.023 1.278 1.00 0.00 C ATOM 1242 CE3 TRP A 80 13.682 -3.818 0.474 1.00 0.00 C ATOM 1243 CZ2 TRP A 80 11.858 -5.967 0.680 1.00 0.00 C ATOM 1244 CZ3 TRP A 80 12.434 -3.763 -0.119 1.00 0.00 C ATOM 1245 CH2 TRP A 80 11.534 -4.832 -0.012 1.00 0.00 C ATOM 0 H TRP A 80 18.898 -4.708 0.237 1.00 0.00 H new ATOM 0 HA TRP A 80 16.180 -3.789 0.110 1.00 0.00 H new ATOM 0 HB2 TRP A 80 17.226 -5.196 2.548 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.269 -3.749 2.792 1.00 0.00 H new ATOM 0 HD1 TRP A 80 15.642 -7.197 2.991 1.00 0.00 H new ATOM 0 HE1 TRP A 80 13.267 -7.911 2.255 1.00 0.00 H new ATOM 0 HE3 TRP A 80 14.369 -2.989 0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 11.164 -6.791 0.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 12.148 -2.882 -0.674 1.00 0.00 H new ATOM 0 HH2 TRP A 80 10.566 -4.758 -0.485 1.00 0.00 H new ATOM 1291 N LEU A 85 14.777 -4.402 9.755 1.00 0.00 N ATOM 1292 CA LEU A 85 13.531 -5.050 9.362 1.00 0.00 C ATOM 1293 C LEU A 85 13.357 -6.381 10.086 1.00 0.00 C ATOM 1294 O LEU A 85 14.228 -6.805 10.845 1.00 0.00 O ATOM 1295 CB LEU A 85 13.503 -5.272 7.849 1.00 0.00 C ATOM 1296 CG LEU A 85 13.848 -4.057 6.986 1.00 0.00 C ATOM 1297 CD1 LEU A 85 14.265 -4.495 5.591 1.00 0.00 C ATOM 1298 CD2 LEU A 85 12.667 -3.100 6.915 1.00 0.00 C ATOM 0 HA LEU A 85 12.706 -4.395 9.642 1.00 0.00 H new ATOM 0 HB2 LEU A 85 14.200 -6.074 7.607 1.00 0.00 H new ATOM 0 HB3 LEU A 85 12.508 -5.619 7.571 1.00 0.00 H new ATOM 0 HG LEU A 85 14.686 -3.534 7.447 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.507 -3.618 4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 85 15.141 -5.141 5.659 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.447 -5.041 5.121 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.931 -2.242 6.297 1.00 0.00 H new ATOM 0 HD22 LEU A 85 11.810 -3.612 6.478 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.413 -2.760 7.919 1.00 0.00 H new ATOM 1310 N GLY A 86 12.227 -7.039 9.843 1.00 0.00 N ATOM 1311 CA GLY A 86 11.961 -8.316 10.478 1.00 0.00 C ATOM 1312 C GLY A 86 10.647 -8.923 10.030 1.00 0.00 C ATOM 1313 O GLY A 86 9.589 -8.598 10.569 1.00 0.00 O ATOM 0 H GLY A 86 11.491 -6.710 9.218 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.773 -9.007 10.252 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.947 -8.184 11.560 1.00 0.00 H new ATOM 1317 N GLY A 87 10.712 -9.808 9.040 1.00 0.00 N ATOM 1318 CA GLY A 87 9.510 -10.447 8.536 1.00 0.00 C ATOM 1319 C GLY A 87 9.073 -9.885 7.197 1.00 0.00 C ATOM 1320 O GLY A 87 8.432 -8.836 7.136 1.00 0.00 O ATOM 0 H GLY A 87 11.575 -10.094 8.578 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.686 -11.518 8.437 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.705 -10.322 9.260 1.00 0.00 H new ATOM 1324 N VAL A 88 9.422 -10.583 6.122 1.00 0.00 N ATOM 1325 CA VAL A 88 9.062 -10.148 4.777 1.00 0.00 C ATOM 1326 C VAL A 88 7.824 -10.882 4.275 1.00 0.00 C ATOM 1327 O VAL A 88 7.480 -11.954 4.773 1.00 0.00 O ATOM 1328 CB VAL A 88 10.218 -10.375 3.786 1.00 0.00 C ATOM 1329 CG1 VAL A 88 9.813 -9.943 2.385 1.00 0.00 C ATOM 1330 CG2 VAL A 88 11.464 -9.632 4.242 1.00 0.00 C ATOM 0 H VAL A 88 9.954 -11.453 6.156 1.00 0.00 H new ATOM 0 HA VAL A 88 8.848 -9.081 4.836 1.00 0.00 H new ATOM 0 HB VAL A 88 10.447 -11.440 3.760 1.00 0.00 H new ATOM 0 HG11 VAL A 88 10.643 -10.111 1.698 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.950 -10.524 2.060 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.556 -8.884 2.391 1.00 0.00 H new ATOM 0 HG21 VAL A 88 12.271 -9.804 3.530 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.251 -8.565 4.298 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.764 -9.994 5.225 1.00 0.00 H new ATOM 1340 N PHE A 89 7.158 -10.299 3.284 1.00 0.00 N ATOM 1341 CA PHE A 89 5.957 -10.897 2.713 1.00 0.00 C ATOM 1342 C PHE A 89 5.836 -10.564 1.229 1.00 0.00 C ATOM 1343 O PHE A 89 6.317 -9.526 0.772 1.00 0.00 O ATOM 1344 CB PHE A 89 4.714 -10.410 3.460 1.00 0.00 C ATOM 1345 CG PHE A 89 4.468 -8.935 3.316 1.00 0.00 C ATOM 1346 CD1 PHE A 89 5.206 -8.021 4.051 1.00 0.00 C ATOM 1347 CD2 PHE A 89 3.500 -8.463 2.445 1.00 0.00 C ATOM 1348 CE1 PHE A 89 4.981 -6.664 3.921 1.00 0.00 C ATOM 1349 CE2 PHE A 89 3.270 -7.106 2.310 1.00 0.00 C ATOM 1350 CZ PHE A 89 4.013 -6.206 3.048 1.00 0.00 C ATOM 0 H PHE A 89 7.430 -9.412 2.859 1.00 0.00 H new ATOM 0 HA PHE A 89 6.035 -11.979 2.819 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.843 -10.953 3.093 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.818 -10.651 4.518 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.966 -8.373 4.733 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.918 -9.163 1.864 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.561 -5.962 4.501 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.511 -6.751 1.629 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.838 -5.146 2.943 1.00 0.00 H new ATOM 1360 N LYS A 90 5.190 -11.451 0.480 1.00 0.00 N ATOM 1361 CA LYS A 90 5.004 -11.253 -0.953 1.00 0.00 C ATOM 1362 C LYS A 90 3.881 -10.257 -1.223 1.00 0.00 C ATOM 1363 O LYS A 90 3.026 -10.024 -0.368 1.00 0.00 O ATOM 1364 CB LYS A 90 4.693 -12.587 -1.636 1.00 0.00 C ATOM 1365 CG LYS A 90 5.928 -13.322 -2.127 1.00 0.00 C ATOM 1366 CD LYS A 90 5.611 -14.760 -2.498 1.00 0.00 C ATOM 1367 CE LYS A 90 5.664 -15.674 -1.283 1.00 0.00 C ATOM 1368 NZ LYS A 90 5.956 -17.084 -1.661 1.00 0.00 N ATOM 0 H LYS A 90 4.786 -12.315 0.842 1.00 0.00 H new ATOM 0 HA LYS A 90 5.930 -10.849 -1.363 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.154 -13.226 -0.937 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.028 -12.407 -2.481 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.340 -12.804 -2.993 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.694 -13.306 -1.352 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.620 -14.810 -2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.321 -15.108 -3.248 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.429 -15.317 -0.593 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.712 -15.630 -0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.984 -17.674 -0.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.213 -17.433 -2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.876 -17.131 -2.143 1.00 0.00 H new ATOM 1382 N VAL A 91 3.889 -9.673 -2.416 1.00 0.00 N ATOM 1383 CA VAL A 91 2.869 -8.704 -2.800 1.00 0.00 C ATOM 1384 C VAL A 91 2.618 -8.736 -4.303 1.00 0.00 C ATOM 1385 O VAL A 91 3.556 -8.785 -5.098 1.00 0.00 O ATOM 1386 CB VAL A 91 3.270 -7.275 -2.388 1.00 0.00 C ATOM 1387 CG1 VAL A 91 3.127 -7.093 -0.884 1.00 0.00 C ATOM 1388 CG2 VAL A 91 4.691 -6.970 -2.837 1.00 0.00 C ATOM 0 H VAL A 91 4.591 -9.854 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 91 1.955 -8.983 -2.276 1.00 0.00 H new ATOM 0 HB VAL A 91 2.599 -6.572 -2.881 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.415 -6.078 -0.611 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.091 -7.267 -0.593 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.773 -7.804 -0.368 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.958 -5.956 -2.538 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.379 -7.678 -2.374 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.756 -7.057 -3.922 1.00 0.00 H new ATOM 1398 N GLU A 92 1.345 -8.706 -4.686 1.00 0.00 N ATOM 1399 CA GLU A 92 0.971 -8.732 -6.095 1.00 0.00 C ATOM 1400 C GLU A 92 0.770 -7.318 -6.631 1.00 0.00 C ATOM 1401 O GLU A 92 -0.077 -6.572 -6.141 1.00 0.00 O ATOM 1402 CB GLU A 92 -0.307 -9.550 -6.292 1.00 0.00 C ATOM 1403 CG GLU A 92 -0.390 -10.234 -7.646 1.00 0.00 C ATOM 1404 CD GLU A 92 0.919 -10.885 -8.052 1.00 0.00 C ATOM 1405 OE1 GLU A 92 1.123 -12.069 -7.710 1.00 0.00 O ATOM 1406 OE2 GLU A 92 1.738 -10.211 -8.711 1.00 0.00 O ATOM 0 H GLU A 92 0.556 -8.664 -4.041 1.00 0.00 H new ATOM 0 HA GLU A 92 1.783 -9.201 -6.651 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.369 -10.305 -5.509 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.170 -8.895 -6.172 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.175 -10.990 -7.619 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.677 -9.503 -8.401 1.00 0.00 H new ATOM 1413 N TRP A 93 1.556 -6.956 -7.639 1.00 0.00 N ATOM 1414 CA TRP A 93 1.465 -5.631 -8.241 1.00 0.00 C ATOM 1415 C TRP A 93 0.450 -5.619 -9.379 1.00 0.00 C ATOM 1416 O TRP A 93 0.615 -6.322 -10.377 1.00 0.00 O ATOM 1417 CB TRP A 93 2.835 -5.188 -8.758 1.00 0.00 C ATOM 1418 CG TRP A 93 3.763 -4.740 -7.670 1.00 0.00 C ATOM 1419 CD1 TRP A 93 4.588 -5.528 -6.920 1.00 0.00 C ATOM 1420 CD2 TRP A 93 3.960 -3.398 -7.211 1.00 0.00 C ATOM 1421 NE1 TRP A 93 5.285 -4.757 -6.021 1.00 0.00 N ATOM 1422 CE2 TRP A 93 4.919 -3.447 -6.180 1.00 0.00 C ATOM 1423 CE3 TRP A 93 3.421 -2.160 -7.571 1.00 0.00 C ATOM 1424 CZ2 TRP A 93 5.347 -2.306 -5.508 1.00 0.00 C ATOM 1425 CZ3 TRP A 93 3.847 -1.028 -6.902 1.00 0.00 C ATOM 1426 CH2 TRP A 93 4.803 -1.107 -5.881 1.00 0.00 C ATOM 0 H TRP A 93 2.263 -7.561 -8.056 1.00 0.00 H new ATOM 0 HA TRP A 93 1.131 -4.933 -7.474 1.00 0.00 H new ATOM 0 HB2 TRP A 93 3.295 -6.014 -9.301 1.00 0.00 H new ATOM 0 HB3 TRP A 93 2.701 -4.374 -9.470 1.00 0.00 H new ATOM 0 HD1 TRP A 93 4.679 -6.600 -7.019 1.00 0.00 H new ATOM 0 HE1 TRP A 93 5.965 -5.104 -5.345 1.00 0.00 H new ATOM 0 HE3 TRP A 93 2.685 -2.089 -8.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 6.083 -2.365 -4.720 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 3.436 -0.066 -7.171 1.00 0.00 H new ATOM 0 HH2 TRP A 93 5.117 -0.204 -5.378 1.00 0.00 H new ATOM 1437 N ILE A 94 -0.597 -4.817 -9.224 1.00 0.00 N ATOM 1438 CA ILE A 94 -1.637 -4.713 -10.240 1.00 0.00 C ATOM 1439 C ILE A 94 -1.292 -3.646 -11.273 1.00 0.00 C ATOM 1440 O ILE A 94 -1.158 -3.939 -12.461 1.00 0.00 O ATOM 1441 CB ILE A 94 -3.005 -4.382 -9.614 1.00 0.00 C ATOM 1442 CG1 ILE A 94 -3.355 -5.404 -8.530 1.00 0.00 C ATOM 1443 CG2 ILE A 94 -4.084 -4.349 -10.686 1.00 0.00 C ATOM 1444 CD1 ILE A 94 -2.683 -5.130 -7.202 1.00 0.00 C ATOM 0 H ILE A 94 -0.748 -4.229 -8.404 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.697 -5.685 -10.731 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.948 -3.396 -9.153 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.435 -5.414 -8.386 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.070 -6.398 -8.874 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.045 -4.114 -10.228 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.839 -3.587 -11.426 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -4.143 -5.322 -11.173 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.976 -5.893 -6.481 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.601 -5.149 -7.331 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.987 -4.149 -6.836 1.00 0.00 H new ATOM 1456 N ARG A 95 -1.148 -2.408 -10.811 1.00 0.00 N ATOM 1457 CA ARG A 95 -0.817 -1.297 -11.696 1.00 0.00 C ATOM 1458 C ARG A 95 0.589 -0.777 -11.412 1.00 0.00 C ATOM 1459 O ARG A 95 0.975 -0.596 -10.257 1.00 0.00 O ATOM 1460 CB ARG A 95 -1.834 -0.166 -11.530 1.00 0.00 C ATOM 1461 CG ARG A 95 -3.097 -0.357 -12.354 1.00 0.00 C ATOM 1462 CD ARG A 95 -3.896 -1.560 -11.879 1.00 0.00 C ATOM 1463 NE ARG A 95 -5.335 -1.347 -12.007 1.00 0.00 N ATOM 1464 CZ ARG A 95 -6.027 -1.638 -13.103 1.00 0.00 C ATOM 1465 NH1 ARG A 95 -5.414 -2.152 -14.160 1.00 0.00 N ATOM 1466 NH2 ARG A 95 -7.334 -1.415 -13.142 1.00 0.00 N ATOM 0 H ARG A 95 -1.255 -2.149 -9.830 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.851 -1.660 -12.723 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -2.106 -0.085 -10.478 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.365 0.777 -11.812 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -3.714 0.539 -12.289 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -2.832 -0.486 -13.403 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -3.607 -2.438 -12.457 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -3.652 -1.769 -10.837 1.00 0.00 H new ATOM 0 HE ARG A 95 -5.836 -0.953 -11.211 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -4.409 -2.325 -14.133 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.947 -2.375 -15.001 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -7.808 -1.020 -12.330 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -7.865 -1.639 -13.984 1.00 0.00 H new ATOM 1480 N LYS A 96 1.351 -0.538 -12.474 1.00 0.00 N ATOM 1481 CA LYS A 96 2.714 -0.038 -12.342 1.00 0.00 C ATOM 1482 C LYS A 96 2.844 1.355 -12.949 1.00 0.00 C ATOM 1483 O LYS A 96 3.894 1.714 -13.482 1.00 0.00 O ATOM 1484 CB LYS A 96 3.698 -0.995 -13.018 1.00 0.00 C ATOM 1485 CG LYS A 96 3.585 -2.429 -12.531 1.00 0.00 C ATOM 1486 CD LYS A 96 4.703 -3.296 -13.085 1.00 0.00 C ATOM 1487 CE LYS A 96 5.948 -3.225 -12.214 1.00 0.00 C ATOM 1488 NZ LYS A 96 6.867 -2.135 -12.648 1.00 0.00 N ATOM 0 H LYS A 96 1.047 -0.683 -13.437 1.00 0.00 H new ATOM 0 HA LYS A 96 2.950 0.025 -11.280 1.00 0.00 H new ATOM 0 HB2 LYS A 96 3.532 -0.972 -14.095 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.714 -0.640 -12.844 1.00 0.00 H new ATOM 0 HG2 LYS A 96 3.615 -2.448 -11.442 1.00 0.00 H new ATOM 0 HG3 LYS A 96 2.621 -2.841 -12.831 1.00 0.00 H new ATOM 0 HD2 LYS A 96 4.364 -4.330 -13.153 1.00 0.00 H new ATOM 0 HD3 LYS A 96 4.947 -2.974 -14.097 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.657 -3.063 -11.176 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.473 -4.179 -12.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.852 -2.459 -12.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.664 -1.883 -13.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.727 -1.301 -12.042 1.00 0.00 H new ATOM 1502 N GLU A 97 1.771 2.135 -12.863 1.00 0.00 N ATOM 1503 CA GLU A 97 1.768 3.489 -13.405 1.00 0.00 C ATOM 1504 C GLU A 97 1.971 4.519 -12.296 1.00 0.00 C ATOM 1505 O GLU A 97 1.844 4.206 -11.113 1.00 0.00 O ATOM 1506 CB GLU A 97 0.453 3.766 -14.138 1.00 0.00 C ATOM 1507 CG GLU A 97 0.496 3.417 -15.616 1.00 0.00 C ATOM 1508 CD GLU A 97 0.197 1.953 -15.878 1.00 0.00 C ATOM 1509 OE1 GLU A 97 0.984 1.097 -15.423 1.00 0.00 O ATOM 1510 OE2 GLU A 97 -0.823 1.664 -16.538 1.00 0.00 O ATOM 0 H GLU A 97 0.894 1.853 -12.424 1.00 0.00 H new ATOM 0 HA GLU A 97 2.594 3.572 -14.111 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.346 3.197 -13.662 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.201 4.821 -14.029 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.226 4.033 -16.152 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.481 3.660 -16.015 1.00 0.00 H new ATOM 1517 N SER A 98 2.287 5.748 -12.690 1.00 0.00 N ATOM 1518 CA SER A 98 2.513 6.823 -11.731 1.00 0.00 C ATOM 1519 C SER A 98 1.336 7.795 -11.717 1.00 0.00 C ATOM 1520 O SER A 98 1.252 8.699 -12.549 1.00 0.00 O ATOM 1521 CB SER A 98 3.803 7.573 -12.067 1.00 0.00 C ATOM 1522 OG SER A 98 4.735 6.721 -12.711 1.00 0.00 O ATOM 0 H SER A 98 2.392 6.024 -13.666 1.00 0.00 H new ATOM 0 HA SER A 98 2.607 6.378 -10.740 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.576 8.422 -12.711 1.00 0.00 H new ATOM 0 HB3 SER A 98 4.243 7.974 -11.154 1.00 0.00 H new ATOM 0 HG SER A 98 5.550 7.224 -12.917 1.00 0.00 H new ATOM 1528 N LEU A 99 0.429 7.601 -10.766 1.00 0.00 N ATOM 1529 CA LEU A 99 -0.744 8.459 -10.642 1.00 0.00 C ATOM 1530 C LEU A 99 -0.423 9.705 -9.823 1.00 0.00 C ATOM 1531 O LEU A 99 -0.032 9.629 -8.658 1.00 0.00 O ATOM 1532 CB LEU A 99 -1.896 7.691 -9.992 1.00 0.00 C ATOM 1533 CG LEU A 99 -3.177 8.487 -9.740 1.00 0.00 C ATOM 1534 CD1 LEU A 99 -3.981 8.624 -11.024 1.00 0.00 C ATOM 1535 CD2 LEU A 99 -4.011 7.825 -8.653 1.00 0.00 C ATOM 0 H LEU A 99 0.483 6.857 -10.070 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.042 8.771 -11.643 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.141 6.838 -10.626 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.548 7.291 -9.040 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.901 9.485 -9.400 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.889 9.193 -10.826 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.384 9.143 -11.774 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.247 7.634 -11.394 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.919 8.405 -8.487 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.278 6.815 -8.964 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.435 7.780 -7.729 1.00 0.00 H new ATOM 1547 N PRO A 100 -0.594 10.882 -10.443 1.00 0.00 N ATOM 1548 CA PRO A 100 -0.331 12.167 -9.790 1.00 0.00 C ATOM 1549 C PRO A 100 -1.350 12.483 -8.700 1.00 0.00 C ATOM 1550 O PRO A 100 -2.558 12.451 -8.937 1.00 0.00 O ATOM 1551 CB PRO A 100 -0.443 13.177 -10.934 1.00 0.00 C ATOM 1552 CG PRO A 100 -1.336 12.523 -11.931 1.00 0.00 C ATOM 1553 CD PRO A 100 -1.058 11.048 -11.831 1.00 0.00 C ATOM 0 HA PRO A 100 0.636 12.177 -9.287 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -0.861 14.122 -10.588 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.534 13.399 -11.363 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.383 12.738 -11.717 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.134 12.891 -12.937 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.952 10.456 -12.030 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.301 10.732 -12.548 1.00 0.00 H new ATOM 1561 N PHE A 101 -0.856 12.788 -7.504 1.00 0.00 N ATOM 1562 CA PHE A 101 -1.724 13.109 -6.378 1.00 0.00 C ATOM 1563 C PHE A 101 -2.947 13.896 -6.840 1.00 0.00 C ATOM 1564 O PHE A 101 -4.042 13.731 -6.304 1.00 0.00 O ATOM 1565 CB PHE A 101 -0.955 13.910 -5.326 1.00 0.00 C ATOM 1566 CG PHE A 101 -0.009 13.076 -4.510 1.00 0.00 C ATOM 1567 CD1 PHE A 101 -0.414 11.862 -3.982 1.00 0.00 C ATOM 1568 CD2 PHE A 101 1.287 13.507 -4.273 1.00 0.00 C ATOM 1569 CE1 PHE A 101 0.454 11.093 -3.230 1.00 0.00 C ATOM 1570 CE2 PHE A 101 2.160 12.742 -3.522 1.00 0.00 C ATOM 1571 CZ PHE A 101 1.743 11.533 -3.001 1.00 0.00 C ATOM 0 H PHE A 101 0.141 12.819 -7.290 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.063 12.173 -5.935 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.393 14.701 -5.823 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.667 14.395 -4.658 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.420 11.512 -4.160 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.618 14.451 -4.680 1.00 0.00 H new ATOM 0 HE1 PHE A 101 0.125 10.149 -2.822 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.167 13.089 -3.343 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.424 10.933 -2.416 1.00 0.00 H new ATOM 1581 N GLN A 102 -2.749 14.753 -7.837 1.00 0.00 N ATOM 1582 CA GLN A 102 -3.835 15.567 -8.371 1.00 0.00 C ATOM 1583 C GLN A 102 -5.116 14.750 -8.498 1.00 0.00 C ATOM 1584 O GLN A 102 -6.176 15.160 -8.025 1.00 0.00 O ATOM 1585 CB GLN A 102 -3.446 16.143 -9.733 1.00 0.00 C ATOM 1586 CG GLN A 102 -4.591 16.844 -10.447 1.00 0.00 C ATOM 1587 CD GLN A 102 -5.679 15.884 -10.886 1.00 0.00 C ATOM 1588 OE1 GLN A 102 -5.477 15.069 -11.787 1.00 0.00 O ATOM 1589 NE2 GLN A 102 -6.841 15.975 -10.251 1.00 0.00 N ATOM 0 H GLN A 102 -1.848 14.901 -8.291 1.00 0.00 H new ATOM 0 HA GLN A 102 -4.017 16.387 -7.676 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -2.626 16.849 -9.599 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -3.073 15.338 -10.366 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.021 17.596 -9.785 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -4.203 17.371 -11.319 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -6.965 16.665 -9.510 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -7.610 15.355 -10.504 1.00 0.00 H new ATOM 1598 N PHE A 103 -5.012 13.591 -9.140 1.00 0.00 N ATOM 1599 CA PHE A 103 -6.163 12.717 -9.331 1.00 0.00 C ATOM 1600 C PHE A 103 -6.806 12.363 -7.993 1.00 0.00 C ATOM 1601 O PHE A 103 -8.029 12.348 -7.864 1.00 0.00 O ATOM 1602 CB PHE A 103 -5.744 11.439 -10.062 1.00 0.00 C ATOM 1603 CG PHE A 103 -5.606 11.616 -11.547 1.00 0.00 C ATOM 1604 CD1 PHE A 103 -4.800 12.616 -12.067 1.00 0.00 C ATOM 1605 CD2 PHE A 103 -6.282 10.782 -12.423 1.00 0.00 C ATOM 1606 CE1 PHE A 103 -4.670 12.781 -13.433 1.00 0.00 C ATOM 1607 CE2 PHE A 103 -6.156 10.942 -13.790 1.00 0.00 C ATOM 1608 CZ PHE A 103 -5.350 11.943 -14.295 1.00 0.00 C ATOM 0 H PHE A 103 -4.142 13.235 -9.537 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.896 13.250 -9.936 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.794 11.092 -9.656 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.479 10.659 -9.864 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.267 13.274 -11.397 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.914 9.998 -12.033 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.038 13.564 -13.826 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.687 10.285 -14.462 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.251 12.071 -15.363 1.00 0.00 H new ATOM 1618 N ALA A 104 -5.970 12.079 -6.999 1.00 0.00 N ATOM 1619 CA ALA A 104 -6.455 11.728 -5.670 1.00 0.00 C ATOM 1620 C ALA A 104 -6.518 12.954 -4.766 1.00 0.00 C ATOM 1621 O ALA A 104 -6.624 12.833 -3.545 1.00 0.00 O ATOM 1622 CB ALA A 104 -5.569 10.657 -5.051 1.00 0.00 C ATOM 0 H ALA A 104 -4.954 12.085 -7.089 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.466 11.333 -5.772 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.943 10.404 -4.059 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.580 9.767 -5.680 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.548 11.031 -4.970 1.00 0.00 H new ATOM 1628 N HIS A 105 -6.451 14.135 -5.373 1.00 0.00 N ATOM 1629 CA HIS A 105 -6.500 15.384 -4.622 1.00 0.00 C ATOM 1630 C HIS A 105 -7.840 15.537 -3.908 1.00 0.00 C ATOM 1631 O HIS A 105 -7.896 15.974 -2.758 1.00 0.00 O ATOM 1632 CB HIS A 105 -6.266 16.574 -5.554 1.00 0.00 C ATOM 1633 CG HIS A 105 -5.851 17.822 -4.839 1.00 0.00 C ATOM 1634 ND1 HIS A 105 -6.120 18.051 -3.506 1.00 0.00 N ATOM 1635 CD2 HIS A 105 -5.181 18.913 -5.278 1.00 0.00 C ATOM 1636 CE1 HIS A 105 -5.635 19.229 -3.157 1.00 0.00 C ATOM 1637 NE2 HIS A 105 -5.059 19.773 -4.214 1.00 0.00 N ATOM 0 H HIS A 105 -6.363 14.253 -6.382 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.710 15.359 -3.872 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.499 16.310 -6.282 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -7.180 16.772 -6.113 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -6.616 17.411 -2.886 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.811 19.077 -6.279 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -5.699 19.672 -2.174 1.00 0.00 H new ATOM 1645 N HIS A 106 -8.917 15.175 -4.598 1.00 0.00 N ATOM 1646 CA HIS A 106 -10.257 15.273 -4.031 1.00 0.00 C ATOM 1647 C HIS A 106 -10.459 14.231 -2.934 1.00 0.00 C ATOM 1648 O HIS A 106 -11.208 14.454 -1.982 1.00 0.00 O ATOM 1649 CB HIS A 106 -11.311 15.091 -5.123 1.00 0.00 C ATOM 1650 CG HIS A 106 -11.372 13.699 -5.672 1.00 0.00 C ATOM 1651 ND1 HIS A 106 -10.339 13.124 -6.382 1.00 0.00 N ATOM 1652 CD2 HIS A 106 -12.350 12.765 -5.609 1.00 0.00 C ATOM 1653 CE1 HIS A 106 -10.680 11.897 -6.734 1.00 0.00 C ATOM 1654 NE2 HIS A 106 -11.895 11.655 -6.277 1.00 0.00 N ATOM 0 H HIS A 106 -8.888 14.811 -5.550 1.00 0.00 H new ATOM 0 HA HIS A 106 -10.368 16.265 -3.592 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -12.288 15.357 -4.721 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -11.102 15.785 -5.937 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -13.309 12.873 -5.124 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -10.069 11.209 -7.299 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -12.412 10.784 -6.400 1.00 0.00 H new ATOM 1662 N LEU A 107 -9.787 13.094 -3.074 1.00 0.00 N ATOM 1663 CA LEU A 107 -9.894 12.017 -2.096 1.00 0.00 C ATOM 1664 C LEU A 107 -9.200 12.395 -0.792 1.00 0.00 C ATOM 1665 O LEU A 107 -8.167 13.066 -0.797 1.00 0.00 O ATOM 1666 CB LEU A 107 -9.285 10.730 -2.656 1.00 0.00 C ATOM 1667 CG LEU A 107 -9.880 10.222 -3.970 1.00 0.00 C ATOM 1668 CD1 LEU A 107 -9.199 8.932 -4.401 1.00 0.00 C ATOM 1669 CD2 LEU A 107 -11.381 10.015 -3.831 1.00 0.00 C ATOM 0 H LEU A 107 -9.162 12.894 -3.855 1.00 0.00 H new ATOM 0 HA LEU A 107 -10.951 11.851 -1.889 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.217 10.891 -2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.389 9.946 -1.906 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.707 10.974 -4.740 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -9.635 8.586 -5.338 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.133 9.113 -4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.339 8.172 -3.632 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.787 9.653 -4.776 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.576 9.283 -3.048 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.856 10.961 -3.570 1.00 0.00 H new ATOM 1681 N LEU A 108 -9.773 11.960 0.325 1.00 0.00 N ATOM 1682 CA LEU A 108 -9.209 12.251 1.638 1.00 0.00 C ATOM 1683 C LEU A 108 -9.324 11.042 2.561 1.00 0.00 C ATOM 1684 O LEU A 108 -9.825 9.991 2.163 1.00 0.00 O ATOM 1685 CB LEU A 108 -9.917 13.454 2.264 1.00 0.00 C ATOM 1686 CG LEU A 108 -10.105 14.670 1.356 1.00 0.00 C ATOM 1687 CD1 LEU A 108 -11.193 15.581 1.903 1.00 0.00 C ATOM 1688 CD2 LEU A 108 -8.796 15.430 1.205 1.00 0.00 C ATOM 0 H LEU A 108 -10.628 11.404 0.347 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.153 12.486 1.508 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.898 13.132 2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.352 13.766 3.143 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.414 14.320 0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -11.313 16.441 1.244 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.133 15.032 1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -10.914 15.924 2.899 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.949 16.292 0.556 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.457 15.769 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -8.043 14.775 0.767 1.00 0.00 H new ATOM 1700 N ASN A 109 -8.860 11.200 3.796 1.00 0.00 N ATOM 1701 CA ASN A 109 -8.912 10.122 4.776 1.00 0.00 C ATOM 1702 C ASN A 109 -9.527 10.606 6.086 1.00 0.00 C ATOM 1703 O ASN A 109 -8.877 11.262 6.900 1.00 0.00 O ATOM 1704 CB ASN A 109 -7.509 9.569 5.032 1.00 0.00 C ATOM 1705 CG ASN A 109 -7.526 8.100 5.410 1.00 0.00 C ATOM 1706 OD1 ASN A 109 -8.390 7.344 4.965 1.00 0.00 O ATOM 1707 ND2 ASN A 109 -6.569 7.690 6.234 1.00 0.00 N ATOM 0 H ASN A 109 -8.444 12.065 4.142 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.540 9.328 4.372 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.900 9.704 4.138 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -7.036 10.141 5.830 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.529 6.713 6.523 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -5.874 8.352 6.578 1.00 0.00 H new ATOM 1714 N PRO A 110 -10.810 10.276 6.295 1.00 0.00 N ATOM 1715 CA PRO A 110 -11.541 10.666 7.504 1.00 0.00 C ATOM 1716 C PRO A 110 -11.047 9.927 8.744 1.00 0.00 C ATOM 1717 O PRO A 110 -11.515 10.178 9.854 1.00 0.00 O ATOM 1718 CB PRO A 110 -12.986 10.272 7.188 1.00 0.00 C ATOM 1719 CG PRO A 110 -12.869 9.179 6.182 1.00 0.00 C ATOM 1720 CD PRO A 110 -11.646 9.496 5.367 1.00 0.00 C ATOM 0 HA PRO A 110 -11.414 11.724 7.733 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.508 9.933 8.082 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.549 11.117 6.791 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.773 8.209 6.669 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.757 9.132 5.551 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -11.139 8.590 5.034 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -11.896 10.068 4.474 1.00 0.00 H new ATOM 1728 N TRP A 111 -10.099 9.018 8.546 1.00 0.00 N ATOM 1729 CA TRP A 111 -9.541 8.244 9.649 1.00 0.00 C ATOM 1730 C TRP A 111 -8.350 8.964 10.272 1.00 0.00 C ATOM 1731 O TRP A 111 -7.956 8.669 11.399 1.00 0.00 O ATOM 1732 CB TRP A 111 -9.117 6.857 9.162 1.00 0.00 C ATOM 1733 CG TRP A 111 -10.271 5.927 8.941 1.00 0.00 C ATOM 1734 CD1 TRP A 111 -11.530 6.265 8.534 1.00 0.00 C ATOM 1735 CD2 TRP A 111 -10.272 4.506 9.116 1.00 0.00 C ATOM 1736 NE1 TRP A 111 -12.314 5.140 8.445 1.00 0.00 N ATOM 1737 CE2 TRP A 111 -11.566 4.048 8.797 1.00 0.00 C ATOM 1738 CE3 TRP A 111 -9.307 3.576 9.510 1.00 0.00 C ATOM 1739 CZ2 TRP A 111 -11.915 2.702 8.861 1.00 0.00 C ATOM 1740 CZ3 TRP A 111 -9.655 2.240 9.573 1.00 0.00 C ATOM 1741 CH2 TRP A 111 -10.950 1.813 9.249 1.00 0.00 C ATOM 0 H TRP A 111 -9.701 8.799 7.633 1.00 0.00 H new ATOM 0 HA TRP A 111 -10.313 8.134 10.410 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -8.560 6.961 8.231 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -8.438 6.415 9.892 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -11.861 7.269 8.314 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -13.294 5.121 8.163 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -8.306 3.895 9.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -12.913 2.371 8.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -8.917 1.513 9.877 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -11.191 0.762 9.307 1.00 0.00 H new ATOM 1752 N ASN A 112 -7.781 9.908 9.530 1.00 0.00 N ATOM 1753 CA ASN A 112 -6.634 10.670 10.011 1.00 0.00 C ATOM 1754 C ASN A 112 -6.882 12.169 9.877 1.00 0.00 C ATOM 1755 O ASN A 112 -6.131 12.876 9.204 1.00 0.00 O ATOM 1756 CB ASN A 112 -5.374 10.279 9.236 1.00 0.00 C ATOM 1757 CG ASN A 112 -4.183 11.147 9.592 1.00 0.00 C ATOM 1758 OD1 ASN A 112 -3.821 11.275 10.761 1.00 0.00 O ATOM 1759 ND2 ASN A 112 -3.568 11.750 8.581 1.00 0.00 N ATOM 0 H ASN A 112 -8.095 10.164 8.594 1.00 0.00 H new ATOM 0 HA ASN A 112 -6.491 10.436 11.066 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -5.134 9.236 9.441 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.570 10.357 8.167 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.761 12.348 8.759 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.903 11.615 7.627 1.00 0.00 H new ATOM 1766 N ASP A 113 -7.940 12.648 10.523 1.00 0.00 N ATOM 1767 CA ASP A 113 -8.286 14.064 10.478 1.00 0.00 C ATOM 1768 C ASP A 113 -8.670 14.485 9.063 1.00 0.00 C ATOM 1769 O ASP A 113 -8.181 15.491 8.550 1.00 0.00 O ATOM 1770 CB ASP A 113 -7.116 14.914 10.977 1.00 0.00 C ATOM 1771 CG ASP A 113 -6.576 14.431 12.309 1.00 0.00 C ATOM 1772 OD1 ASP A 113 -5.988 13.330 12.346 1.00 0.00 O ATOM 1773 OD2 ASP A 113 -6.743 15.153 13.314 1.00 0.00 O ATOM 0 H ASP A 113 -8.572 12.077 11.084 1.00 0.00 H new ATOM 0 HA ASP A 113 -9.144 14.223 11.131 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.316 14.897 10.236 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.439 15.951 11.074 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.547 13.707 8.437 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.995 13.999 7.080 1.00 0.00 C ATOM 1780 C ASN A 114 -8.859 14.582 6.245 1.00 0.00 C ATOM 1781 O ASN A 114 -9.072 15.467 5.417 1.00 0.00 O ATOM 1782 CB ASN A 114 -11.174 14.973 7.108 1.00 0.00 C ATOM 1783 CG ASN A 114 -12.410 14.368 7.745 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -12.359 13.862 8.867 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -13.528 14.415 7.030 1.00 0.00 N ATOM 0 H ASN A 114 -9.961 12.870 8.847 1.00 0.00 H new ATOM 0 HA ASN A 114 -10.316 13.064 6.621 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -10.888 15.870 7.657 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -11.409 15.284 6.090 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -14.391 14.022 7.406 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -13.524 14.844 6.105 1.00 0.00 H new ATOM 1792 N LYS A 115 -7.649 14.078 6.469 1.00 0.00 N ATOM 1793 CA LYS A 115 -6.478 14.546 5.737 1.00 0.00 C ATOM 1794 C LYS A 115 -6.360 13.840 4.390 1.00 0.00 C ATOM 1795 O LYS A 115 -6.644 12.648 4.275 1.00 0.00 O ATOM 1796 CB LYS A 115 -5.210 14.311 6.560 1.00 0.00 C ATOM 1797 CG LYS A 115 -4.930 15.409 7.572 1.00 0.00 C ATOM 1798 CD LYS A 115 -4.487 16.694 6.893 1.00 0.00 C ATOM 1799 CE LYS A 115 -4.612 17.889 7.825 1.00 0.00 C ATOM 1800 NZ LYS A 115 -3.932 19.095 7.276 1.00 0.00 N ATOM 0 H LYS A 115 -7.454 13.346 7.152 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.596 15.615 5.558 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.298 13.359 7.084 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.359 14.225 5.884 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.827 15.599 8.162 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.157 15.078 8.265 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.453 16.595 6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.091 16.862 6.001 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.666 18.111 7.991 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.182 17.640 8.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -4.040 19.887 7.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.921 18.892 7.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.359 19.349 6.362 1.00 0.00 H new ATOM 1814 N LYS A 116 -5.939 14.584 3.373 1.00 0.00 N ATOM 1815 CA LYS A 116 -5.780 14.029 2.033 1.00 0.00 C ATOM 1816 C LYS A 116 -5.108 12.661 2.087 1.00 0.00 C ATOM 1817 O LYS A 116 -4.111 12.475 2.785 1.00 0.00 O ATOM 1818 CB LYS A 116 -4.958 14.980 1.160 1.00 0.00 C ATOM 1819 CG LYS A 116 -4.747 14.474 -0.257 1.00 0.00 C ATOM 1820 CD LYS A 116 -3.754 15.339 -1.015 1.00 0.00 C ATOM 1821 CE LYS A 116 -4.317 16.725 -1.290 1.00 0.00 C ATOM 1822 NZ LYS A 116 -3.303 17.623 -1.909 1.00 0.00 N ATOM 0 H LYS A 116 -5.702 15.573 3.451 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.771 13.909 1.596 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.458 15.948 1.121 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -3.987 15.142 1.628 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -4.387 13.446 -0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -5.700 14.463 -0.786 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -2.833 15.427 -0.439 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.495 14.857 -1.958 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -5.180 16.642 -1.951 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.671 17.165 -0.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -3.495 18.607 -1.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -2.353 17.350 -1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -3.352 17.540 -2.945 1.00 0.00 H new ATOM 1836 N VAL A 117 -5.659 11.706 1.344 1.00 0.00 N ATOM 1837 CA VAL A 117 -5.110 10.356 1.305 1.00 0.00 C ATOM 1838 C VAL A 117 -3.588 10.379 1.381 1.00 0.00 C ATOM 1839 O VAL A 117 -2.998 9.894 2.346 1.00 0.00 O ATOM 1840 CB VAL A 117 -5.538 9.613 0.025 1.00 0.00 C ATOM 1841 CG1 VAL A 117 -5.237 8.127 0.144 1.00 0.00 C ATOM 1842 CG2 VAL A 117 -7.015 9.845 -0.256 1.00 0.00 C ATOM 0 H VAL A 117 -6.485 11.843 0.761 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.506 9.828 2.173 1.00 0.00 H new ATOM 0 HB VAL A 117 -4.965 10.009 -0.813 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.546 7.619 -0.769 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.167 7.983 0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.782 7.712 0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.301 9.313 -1.164 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.607 9.477 0.582 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.197 10.912 -0.388 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.958 10.946 0.357 1.00 0.00 N ATOM 1853 CA GLN A 118 -1.503 11.031 0.308 1.00 0.00 C ATOM 1854 C GLN A 118 -0.925 11.274 1.699 1.00 0.00 C ATOM 1855 O GLN A 118 0.104 10.704 2.062 1.00 0.00 O ATOM 1856 CB GLN A 118 -1.068 12.150 -0.640 1.00 0.00 C ATOM 1857 CG GLN A 118 -0.946 13.506 0.036 1.00 0.00 C ATOM 1858 CD GLN A 118 -0.531 14.602 -0.927 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -1.125 14.766 -1.993 1.00 0.00 O ATOM 1860 NE2 GLN A 118 0.494 15.360 -0.555 1.00 0.00 N ATOM 0 H GLN A 118 -3.432 11.353 -0.449 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.121 10.080 -0.064 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -0.108 11.887 -1.083 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.787 12.223 -1.456 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.901 13.769 0.490 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.216 13.441 0.843 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.957 15.189 0.337 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.818 16.113 -1.162 1.00 0.00 H new ATOM 1869 N ILE A 119 -1.594 12.122 2.472 1.00 0.00 N ATOM 1870 CA ILE A 119 -1.147 12.439 3.823 1.00 0.00 C ATOM 1871 C ILE A 119 -1.279 11.231 4.744 1.00 0.00 C ATOM 1872 O ILE A 119 -2.155 11.189 5.608 1.00 0.00 O ATOM 1873 CB ILE A 119 -1.944 13.614 4.419 1.00 0.00 C ATOM 1874 CG1 ILE A 119 -1.869 14.831 3.494 1.00 0.00 C ATOM 1875 CG2 ILE A 119 -1.420 13.961 5.804 1.00 0.00 C ATOM 1876 CD1 ILE A 119 -2.700 16.003 3.969 1.00 0.00 C ATOM 0 H ILE A 119 -2.447 12.602 2.186 1.00 0.00 H new ATOM 0 HA ILE A 119 -0.097 12.723 3.749 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.988 13.316 4.512 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -0.829 15.146 3.405 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.201 14.541 2.497 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.993 14.793 6.212 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.521 13.095 6.459 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.369 14.243 5.735 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.599 16.829 3.265 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.747 15.705 4.031 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.354 16.320 4.953 1.00 0.00 H new ATOM 1888 N SER A 120 -0.403 10.249 4.553 1.00 0.00 N ATOM 1889 CA SER A 120 -0.423 9.038 5.365 1.00 0.00 C ATOM 1890 C SER A 120 0.986 8.485 5.550 1.00 0.00 C ATOM 1891 O SER A 120 1.722 8.294 4.582 1.00 0.00 O ATOM 1892 CB SER A 120 -1.318 7.979 4.717 1.00 0.00 C ATOM 1893 OG SER A 120 -2.662 8.116 5.144 1.00 0.00 O ATOM 0 H SER A 120 0.329 10.269 3.843 1.00 0.00 H new ATOM 0 HA SER A 120 -0.826 9.294 6.345 1.00 0.00 H new ATOM 0 HB2 SER A 120 -1.267 8.070 3.632 1.00 0.00 H new ATOM 0 HB3 SER A 120 -0.952 6.984 4.971 1.00 0.00 H new ATOM 0 HG SER A 120 -2.835 9.050 5.384 1.00 0.00 H new ATOM 1899 N ARG A 121 1.355 8.230 6.801 1.00 0.00 N ATOM 1900 CA ARG A 121 2.677 7.700 7.115 1.00 0.00 C ATOM 1901 C ARG A 121 2.736 6.198 6.854 1.00 0.00 C ATOM 1902 O ARG A 121 1.721 5.505 6.922 1.00 0.00 O ATOM 1903 CB ARG A 121 3.032 7.989 8.575 1.00 0.00 C ATOM 1904 CG ARG A 121 2.131 7.279 9.573 1.00 0.00 C ATOM 1905 CD ARG A 121 2.157 7.963 10.931 1.00 0.00 C ATOM 1906 NE ARG A 121 1.234 7.339 11.875 1.00 0.00 N ATOM 1907 CZ ARG A 121 1.486 6.195 12.503 1.00 0.00 C ATOM 1908 NH1 ARG A 121 2.627 5.555 12.288 1.00 0.00 N ATOM 1909 NH2 ARG A 121 0.597 5.691 13.348 1.00 0.00 N ATOM 0 H ARG A 121 0.757 8.382 7.614 1.00 0.00 H new ATOM 0 HA ARG A 121 3.402 8.193 6.467 1.00 0.00 H new ATOM 0 HB2 ARG A 121 4.065 7.691 8.755 1.00 0.00 H new ATOM 0 HB3 ARG A 121 2.976 9.064 8.748 1.00 0.00 H new ATOM 0 HG2 ARG A 121 1.109 7.260 9.193 1.00 0.00 H new ATOM 0 HG3 ARG A 121 2.451 6.242 9.680 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.169 7.928 11.336 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.898 9.015 10.812 1.00 0.00 H new ATOM 0 HE ARG A 121 0.347 7.807 12.063 1.00 0.00 H new ATOM 0 HH11 ARG A 121 3.314 5.940 11.640 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.818 4.677 12.771 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -0.281 6.181 13.517 1.00 0.00 H new ATOM 0 HH22 ARG A 121 0.792 4.813 13.829 1.00 0.00 H new ATOM 1923 N ASP A 122 3.932 5.703 6.554 1.00 0.00 N ATOM 1924 CA ASP A 122 4.125 4.283 6.283 1.00 0.00 C ATOM 1925 C ASP A 122 3.461 3.429 7.358 1.00 0.00 C ATOM 1926 O ASP A 122 3.671 3.641 8.552 1.00 0.00 O ATOM 1927 CB ASP A 122 5.616 3.955 6.202 1.00 0.00 C ATOM 1928 CG ASP A 122 6.308 4.073 7.546 1.00 0.00 C ATOM 1929 OD1 ASP A 122 5.871 4.906 8.367 1.00 0.00 O ATOM 1930 OD2 ASP A 122 7.288 3.333 7.776 1.00 0.00 O ATOM 0 H ASP A 122 4.782 6.264 6.492 1.00 0.00 H new ATOM 0 HA ASP A 122 3.659 4.055 5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.742 2.942 5.819 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.095 4.627 5.490 1.00 0.00 H new ATOM 1935 N GLY A 123 2.656 2.462 6.927 1.00 0.00 N ATOM 1936 CA GLY A 123 1.973 1.591 7.865 1.00 0.00 C ATOM 1937 C GLY A 123 0.715 2.221 8.430 1.00 0.00 C ATOM 1938 O GLY A 123 0.289 1.886 9.535 1.00 0.00 O ATOM 0 H GLY A 123 2.465 2.267 5.944 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.715 0.656 7.367 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.649 1.341 8.682 1.00 0.00 H new ATOM 1942 N GLN A 124 0.122 3.137 7.671 1.00 0.00 N ATOM 1943 CA GLN A 124 -1.094 3.816 8.104 1.00 0.00 C ATOM 1944 C GLN A 124 -2.330 3.162 7.497 1.00 0.00 C ATOM 1945 O GLN A 124 -2.381 2.908 6.294 1.00 0.00 O ATOM 1946 CB GLN A 124 -1.042 5.295 7.716 1.00 0.00 C ATOM 1947 CG GLN A 124 -2.299 6.065 8.087 1.00 0.00 C ATOM 1948 CD GLN A 124 -2.341 6.443 9.555 1.00 0.00 C ATOM 1949 OE1 GLN A 124 -1.661 7.374 9.987 1.00 0.00 O ATOM 1950 NE2 GLN A 124 -3.141 5.720 10.330 1.00 0.00 N ATOM 0 H GLN A 124 0.463 3.426 6.754 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.159 3.733 9.189 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.184 5.760 8.202 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -0.881 5.375 6.641 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -2.358 6.969 7.481 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -3.174 5.462 7.846 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.687 4.957 9.929 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.210 5.927 11.326 1.00 0.00 H new ATOM 1959 N GLU A 125 -3.323 2.890 8.337 1.00 0.00 N ATOM 1960 CA GLU A 125 -4.559 2.264 7.881 1.00 0.00 C ATOM 1961 C GLU A 125 -5.370 3.226 7.018 1.00 0.00 C ATOM 1962 O GLU A 125 -5.579 4.383 7.386 1.00 0.00 O ATOM 1963 CB GLU A 125 -5.395 1.805 9.077 1.00 0.00 C ATOM 1964 CG GLU A 125 -6.304 0.627 8.769 1.00 0.00 C ATOM 1965 CD GLU A 125 -6.641 -0.189 10.001 1.00 0.00 C ATOM 1966 OE1 GLU A 125 -7.097 0.406 11.000 1.00 0.00 O ATOM 1967 OE2 GLU A 125 -6.448 -1.423 9.968 1.00 0.00 O ATOM 0 H GLU A 125 -3.296 3.093 9.336 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.295 1.396 7.277 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.726 1.533 9.894 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -6.002 2.640 9.427 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -7.226 0.993 8.317 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -5.822 -0.016 8.033 1.00 0.00 H new ATOM 1974 N LEU A 126 -5.826 2.739 5.869 1.00 0.00 N ATOM 1975 CA LEU A 126 -6.615 3.554 4.952 1.00 0.00 C ATOM 1976 C LEU A 126 -8.050 3.045 4.867 1.00 0.00 C ATOM 1977 O LEU A 126 -8.289 1.838 4.836 1.00 0.00 O ATOM 1978 CB LEU A 126 -5.978 3.554 3.561 1.00 0.00 C ATOM 1979 CG LEU A 126 -6.556 4.553 2.558 1.00 0.00 C ATOM 1980 CD1 LEU A 126 -6.409 5.975 3.078 1.00 0.00 C ATOM 1981 CD2 LEU A 126 -5.875 4.405 1.206 1.00 0.00 C ATOM 0 H LEU A 126 -5.663 1.784 5.550 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.634 4.574 5.336 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -4.913 3.756 3.671 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.071 2.553 3.141 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.618 4.341 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.826 6.673 2.352 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.943 6.074 4.023 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.353 6.199 3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.299 5.124 0.505 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.806 4.591 1.315 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.031 3.394 0.829 1.00 0.00 H new ATOM 1993 N GLU A 127 -9.001 3.973 4.829 1.00 0.00 N ATOM 1994 CA GLU A 127 -10.413 3.617 4.746 1.00 0.00 C ATOM 1995 C GLU A 127 -10.720 2.913 3.428 1.00 0.00 C ATOM 1996 O GLU A 127 -10.221 3.285 2.365 1.00 0.00 O ATOM 1997 CB GLU A 127 -11.286 4.866 4.886 1.00 0.00 C ATOM 1998 CG GLU A 127 -12.706 4.568 5.336 1.00 0.00 C ATOM 1999 CD GLU A 127 -13.498 5.826 5.638 1.00 0.00 C ATOM 2000 OE1 GLU A 127 -13.478 6.754 4.804 1.00 0.00 O ATOM 2001 OE2 GLU A 127 -14.137 5.880 6.710 1.00 0.00 O ATOM 0 H GLU A 127 -8.820 4.976 4.854 1.00 0.00 H new ATOM 0 HA GLU A 127 -10.637 2.933 5.564 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -10.822 5.545 5.601 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -11.319 5.385 3.928 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.217 3.999 4.560 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.677 3.939 6.226 1.00 0.00 H new ATOM 2008 N PRO A 128 -11.560 1.869 3.496 1.00 0.00 N ATOM 2009 CA PRO A 128 -11.952 1.091 2.318 1.00 0.00 C ATOM 2010 C PRO A 128 -12.854 1.880 1.375 1.00 0.00 C ATOM 2011 O PRO A 128 -13.048 1.498 0.222 1.00 0.00 O ATOM 2012 CB PRO A 128 -12.712 -0.097 2.915 1.00 0.00 C ATOM 2013 CG PRO A 128 -13.222 0.399 4.223 1.00 0.00 C ATOM 2014 CD PRO A 128 -12.191 1.370 4.729 1.00 0.00 C ATOM 0 HA PRO A 128 -11.091 0.805 1.714 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.529 -0.412 2.265 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.059 -0.960 3.046 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -14.191 0.885 4.105 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.361 -0.423 4.925 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -12.646 2.177 5.303 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.467 0.883 5.383 1.00 0.00 H new ATOM 2022 N GLN A 129 -13.403 2.984 1.874 1.00 0.00 N ATOM 2023 CA GLN A 129 -14.284 3.826 1.075 1.00 0.00 C ATOM 2024 C GLN A 129 -13.479 4.759 0.177 1.00 0.00 C ATOM 2025 O GLN A 129 -13.779 4.909 -1.007 1.00 0.00 O ATOM 2026 CB GLN A 129 -15.205 4.643 1.984 1.00 0.00 C ATOM 2027 CG GLN A 129 -16.536 4.997 1.341 1.00 0.00 C ATOM 2028 CD GLN A 129 -17.295 6.056 2.116 1.00 0.00 C ATOM 2029 OE1 GLN A 129 -18.092 5.742 3.001 1.00 0.00 O ATOM 2030 NE2 GLN A 129 -17.051 7.319 1.787 1.00 0.00 N ATOM 0 H GLN A 129 -13.253 3.315 2.827 1.00 0.00 H new ATOM 0 HA GLN A 129 -14.890 3.177 0.443 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -15.391 4.080 2.899 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -14.695 5.562 2.273 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -16.362 5.351 0.325 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -17.149 4.099 1.265 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.382 7.533 1.047 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -17.532 8.075 2.274 1.00 0.00 H new ATOM 2039 N VAL A 130 -12.454 5.385 0.748 1.00 0.00 N ATOM 2040 CA VAL A 130 -11.605 6.303 -0.001 1.00 0.00 C ATOM 2041 C VAL A 130 -10.460 5.561 -0.681 1.00 0.00 C ATOM 2042 O VAL A 130 -9.905 6.030 -1.673 1.00 0.00 O ATOM 2043 CB VAL A 130 -11.022 7.399 0.911 1.00 0.00 C ATOM 2044 CG1 VAL A 130 -12.136 8.134 1.640 1.00 0.00 C ATOM 2045 CG2 VAL A 130 -10.032 6.800 1.898 1.00 0.00 C ATOM 0 H VAL A 130 -12.192 5.273 1.727 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.234 6.769 -0.760 1.00 0.00 H new ATOM 0 HB VAL A 130 -10.489 8.119 0.290 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.706 8.905 2.280 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.803 8.597 0.913 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.699 7.428 2.251 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.630 7.589 2.534 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.538 6.058 2.516 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.217 6.324 1.352 1.00 0.00 H new ATOM 2055 N GLY A 131 -10.110 4.398 -0.138 1.00 0.00 N ATOM 2056 CA GLY A 131 -9.032 3.609 -0.706 1.00 0.00 C ATOM 2057 C GLY A 131 -9.458 2.856 -1.951 1.00 0.00 C ATOM 2058 O GLY A 131 -8.636 2.564 -2.818 1.00 0.00 O ATOM 0 H GLY A 131 -10.554 3.989 0.684 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.196 4.264 -0.950 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.674 2.899 0.039 1.00 0.00 H new ATOM 2062 N GLU A 132 -10.747 2.540 -2.038 1.00 0.00 N ATOM 2063 CA GLU A 132 -11.279 1.814 -3.185 1.00 0.00 C ATOM 2064 C GLU A 132 -11.407 2.732 -4.398 1.00 0.00 C ATOM 2065 O GLU A 132 -11.067 2.348 -5.517 1.00 0.00 O ATOM 2066 CB GLU A 132 -12.642 1.207 -2.845 1.00 0.00 C ATOM 2067 CG GLU A 132 -13.790 2.198 -2.938 1.00 0.00 C ATOM 2068 CD GLU A 132 -15.145 1.538 -2.774 1.00 0.00 C ATOM 2069 OE1 GLU A 132 -15.452 0.610 -3.552 1.00 0.00 O ATOM 2070 OE2 GLU A 132 -15.898 1.949 -1.867 1.00 0.00 O ATOM 0 H GLU A 132 -11.441 2.775 -1.328 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.583 1.012 -3.430 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.837 0.373 -3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.607 0.799 -1.835 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.668 2.963 -2.171 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.751 2.704 -3.903 1.00 0.00 H new ATOM 2077 N GLN A 133 -11.899 3.944 -4.165 1.00 0.00 N ATOM 2078 CA GLN A 133 -12.073 4.916 -5.239 1.00 0.00 C ATOM 2079 C GLN A 133 -10.741 5.560 -5.611 1.00 0.00 C ATOM 2080 O GLN A 133 -10.643 6.275 -6.610 1.00 0.00 O ATOM 2081 CB GLN A 133 -13.075 5.993 -4.822 1.00 0.00 C ATOM 2082 CG GLN A 133 -12.682 6.733 -3.554 1.00 0.00 C ATOM 2083 CD GLN A 133 -13.715 7.758 -3.131 1.00 0.00 C ATOM 2084 OE1 GLN A 133 -13.714 8.892 -3.611 1.00 0.00 O ATOM 2085 NE2 GLN A 133 -14.606 7.364 -2.229 1.00 0.00 N ATOM 0 H GLN A 133 -12.184 4.277 -3.244 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.458 4.390 -6.113 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -13.181 6.712 -5.634 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.051 5.531 -4.675 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -12.539 6.013 -2.748 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -11.725 7.231 -3.711 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -14.570 6.415 -1.858 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -15.326 8.011 -1.908 1.00 0.00 H new ATOM 2094 N LEU A 134 -9.719 5.303 -4.803 1.00 0.00 N ATOM 2095 CA LEU A 134 -8.392 5.858 -5.047 1.00 0.00 C ATOM 2096 C LEU A 134 -7.646 5.043 -6.099 1.00 0.00 C ATOM 2097 O LEU A 134 -6.834 5.579 -6.854 1.00 0.00 O ATOM 2098 CB LEU A 134 -7.586 5.894 -3.748 1.00 0.00 C ATOM 2099 CG LEU A 134 -6.075 6.070 -3.900 1.00 0.00 C ATOM 2100 CD1 LEU A 134 -5.741 7.499 -4.296 1.00 0.00 C ATOM 2101 CD2 LEU A 134 -5.361 5.690 -2.611 1.00 0.00 C ATOM 0 H LEU A 134 -9.783 4.714 -3.973 1.00 0.00 H new ATOM 0 HA LEU A 134 -8.514 6.875 -5.420 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.966 6.708 -3.131 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -7.771 4.968 -3.204 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.729 5.406 -4.692 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.661 7.605 -4.399 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.221 7.735 -5.245 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.101 8.183 -3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.286 5.822 -2.738 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.711 6.328 -1.799 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.573 4.648 -2.371 1.00 0.00 H new ATOM 2113 N LEU A 135 -7.928 3.746 -6.144 1.00 0.00 N ATOM 2114 CA LEU A 135 -7.286 2.856 -7.105 1.00 0.00 C ATOM 2115 C LEU A 135 -7.871 3.048 -8.501 1.00 0.00 C ATOM 2116 O LEU A 135 -7.137 3.173 -9.480 1.00 0.00 O ATOM 2117 CB LEU A 135 -7.447 1.399 -6.668 1.00 0.00 C ATOM 2118 CG LEU A 135 -6.949 1.061 -5.263 1.00 0.00 C ATOM 2119 CD1 LEU A 135 -7.037 -0.436 -5.011 1.00 0.00 C ATOM 2120 CD2 LEU A 135 -5.522 1.553 -5.069 1.00 0.00 C ATOM 0 H LEU A 135 -8.597 3.287 -5.526 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.225 3.103 -7.139 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -8.503 1.137 -6.730 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.919 0.766 -7.381 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.588 1.569 -4.541 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -6.678 -0.657 -4.006 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -8.073 -0.761 -5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.423 -0.964 -5.740 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.185 1.303 -4.063 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.870 1.075 -5.800 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.488 2.634 -5.205 1.00 0.00 H new ATOM 2132 N GLN A 136 -9.198 3.072 -8.582 1.00 0.00 N ATOM 2133 CA GLN A 136 -9.881 3.250 -9.858 1.00 0.00 C ATOM 2134 C GLN A 136 -9.227 4.359 -10.676 1.00 0.00 C ATOM 2135 O GLN A 136 -9.253 4.334 -11.907 1.00 0.00 O ATOM 2136 CB GLN A 136 -11.358 3.574 -9.628 1.00 0.00 C ATOM 2137 CG GLN A 136 -11.586 4.723 -8.658 1.00 0.00 C ATOM 2138 CD GLN A 136 -13.047 5.110 -8.545 1.00 0.00 C ATOM 2139 OE1 GLN A 136 -13.883 4.309 -8.126 1.00 0.00 O ATOM 2140 NE2 GLN A 136 -13.363 6.345 -8.918 1.00 0.00 N ATOM 0 H GLN A 136 -9.820 2.971 -7.780 1.00 0.00 H new ATOM 0 HA GLN A 136 -9.803 2.317 -10.417 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -11.821 3.820 -10.584 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -11.862 2.685 -9.249 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -11.211 4.442 -7.674 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -11.009 5.588 -8.984 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -12.638 6.976 -9.259 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -14.331 6.662 -8.863 1.00 0.00 H new ATOM 2149 N LEU A 137 -8.641 5.330 -9.984 1.00 0.00 N ATOM 2150 CA LEU A 137 -7.979 6.449 -10.646 1.00 0.00 C ATOM 2151 C LEU A 137 -6.990 5.952 -11.696 1.00 0.00 C ATOM 2152 O LEU A 137 -6.934 6.478 -12.808 1.00 0.00 O ATOM 2153 CB LEU A 137 -7.255 7.320 -9.618 1.00 0.00 C ATOM 2154 CG LEU A 137 -8.139 8.246 -8.782 1.00 0.00 C ATOM 2155 CD1 LEU A 137 -7.311 8.965 -7.728 1.00 0.00 C ATOM 2156 CD2 LEU A 137 -8.855 9.249 -9.675 1.00 0.00 C ATOM 0 H LEU A 137 -8.611 5.365 -8.965 1.00 0.00 H new ATOM 0 HA LEU A 137 -8.742 7.046 -11.146 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.705 6.667 -8.941 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.518 7.929 -10.142 1.00 0.00 H new ATOM 0 HG LEU A 137 -8.890 7.640 -8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -7.956 9.620 -7.142 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.844 8.232 -7.070 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.538 9.559 -8.215 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -9.480 9.900 -9.063 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.120 9.850 -10.210 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.479 8.717 -10.392 1.00 0.00 H new ATOM 2168 N TRP A 138 -6.214 4.937 -11.336 1.00 0.00 N ATOM 2169 CA TRP A 138 -5.228 4.368 -12.248 1.00 0.00 C ATOM 2170 C TRP A 138 -5.861 4.037 -13.596 1.00 0.00 C ATOM 2171 O TRP A 138 -5.168 3.940 -14.609 1.00 0.00 O ATOM 2172 CB TRP A 138 -4.607 3.109 -11.640 1.00 0.00 C ATOM 2173 CG TRP A 138 -3.356 3.381 -10.861 1.00 0.00 C ATOM 2174 CD1 TRP A 138 -2.070 3.244 -11.301 1.00 0.00 C ATOM 2175 CD2 TRP A 138 -3.272 3.835 -9.506 1.00 0.00 C ATOM 2176 NE1 TRP A 138 -1.192 3.585 -10.301 1.00 0.00 N ATOM 2177 CE2 TRP A 138 -1.904 3.952 -9.190 1.00 0.00 C ATOM 2178 CE3 TRP A 138 -4.219 4.157 -8.530 1.00 0.00 C ATOM 2179 CZ2 TRP A 138 -1.463 4.376 -7.939 1.00 0.00 C ATOM 2180 CZ3 TRP A 138 -3.779 4.576 -7.289 1.00 0.00 C ATOM 2181 CH2 TRP A 138 -2.412 4.683 -7.002 1.00 0.00 C ATOM 0 H TRP A 138 -6.248 4.491 -10.419 1.00 0.00 H new ATOM 0 HA TRP A 138 -4.446 5.110 -12.407 1.00 0.00 H new ATOM 0 HB2 TRP A 138 -5.337 2.632 -10.986 1.00 0.00 H new ATOM 0 HB3 TRP A 138 -4.383 2.401 -12.438 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -1.785 2.916 -12.290 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.175 3.568 -10.374 1.00 0.00 H new ATOM 0 HE3 TRP A 138 -5.275 4.080 -8.742 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 -0.410 4.460 -7.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 -4.502 4.826 -6.527 1.00 0.00 H new ATOM 0 HH2 TRP A 138 -2.101 5.014 -6.022 1.00 0.00 H new ATOM 2192 N GLU A 139 -7.179 3.866 -13.600 1.00 0.00 N ATOM 2193 CA GLU A 139 -7.903 3.546 -14.825 1.00 0.00 C ATOM 2194 C GLU A 139 -8.039 4.778 -15.715 1.00 0.00 C ATOM 2195 O GLU A 139 -8.068 4.671 -16.941 1.00 0.00 O ATOM 2196 CB GLU A 139 -9.288 2.987 -14.494 1.00 0.00 C ATOM 2197 CG GLU A 139 -9.249 1.721 -13.655 1.00 0.00 C ATOM 2198 CD GLU A 139 -10.497 0.875 -13.817 1.00 0.00 C ATOM 2199 OE1 GLU A 139 -11.038 0.827 -14.942 1.00 0.00 O ATOM 2200 OE2 GLU A 139 -10.932 0.260 -12.821 1.00 0.00 O ATOM 0 H GLU A 139 -7.767 3.944 -12.770 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.334 2.790 -15.366 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.860 3.748 -13.962 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.819 2.781 -15.423 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.376 1.131 -13.934 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.130 1.989 -12.605 1.00 0.00 H new ATOM 2207 N ARG A 140 -8.121 5.947 -15.088 1.00 0.00 N ATOM 2208 CA ARG A 140 -8.256 7.199 -15.822 1.00 0.00 C ATOM 2209 C ARG A 140 -6.992 7.500 -16.621 1.00 0.00 C ATOM 2210 O ARG A 140 -7.026 8.246 -17.601 1.00 0.00 O ATOM 2211 CB ARG A 140 -8.548 8.351 -14.858 1.00 0.00 C ATOM 2212 CG ARG A 140 -9.753 8.106 -13.964 1.00 0.00 C ATOM 2213 CD ARG A 140 -11.035 8.616 -14.605 1.00 0.00 C ATOM 2214 NE ARG A 140 -11.084 10.075 -14.643 1.00 0.00 N ATOM 2215 CZ ARG A 140 -11.930 10.762 -15.403 1.00 0.00 C ATOM 2216 NH1 ARG A 140 -12.793 10.126 -16.182 1.00 0.00 N ATOM 2217 NH2 ARG A 140 -11.914 12.089 -15.383 1.00 0.00 N ATOM 0 H ARG A 140 -8.096 6.053 -14.074 1.00 0.00 H new ATOM 0 HA ARG A 140 -9.089 7.095 -16.517 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -7.671 8.522 -14.233 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -8.712 9.262 -15.433 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -9.846 7.039 -13.761 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -9.602 8.601 -13.005 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -11.114 8.224 -15.619 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -11.893 8.239 -14.049 1.00 0.00 H new ATOM 0 HE ARG A 140 -10.433 10.595 -14.054 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -12.809 9.106 -16.199 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -13.441 10.656 -16.764 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -11.252 12.582 -14.784 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -12.564 12.616 -15.967 1.00 0.00 H new ATOM 2231 N LEU A 141 -5.877 6.915 -16.197 1.00 0.00 N ATOM 2232 CA LEU A 141 -4.600 7.119 -16.873 1.00 0.00 C ATOM 2233 C LEU A 141 -4.654 6.603 -18.307 1.00 0.00 C ATOM 2234 O LEU A 141 -4.506 7.369 -19.259 1.00 0.00 O ATOM 2235 CB LEU A 141 -3.477 6.417 -16.108 1.00 0.00 C ATOM 2236 CG LEU A 141 -3.457 6.636 -14.594 1.00 0.00 C ATOM 2237 CD1 LEU A 141 -2.491 5.669 -13.928 1.00 0.00 C ATOM 2238 CD2 LEU A 141 -3.083 8.075 -14.269 1.00 0.00 C ATOM 0 H LEU A 141 -5.831 6.295 -15.388 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.399 8.190 -16.899 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -3.548 5.346 -16.299 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.523 6.751 -16.516 1.00 0.00 H new ATOM 0 HG LEU A 141 -4.457 6.444 -14.205 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.490 5.839 -12.851 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.802 4.645 -14.133 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.487 5.829 -14.322 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.074 8.213 -13.188 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.094 8.294 -14.671 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -3.813 8.750 -14.715 1.00 0.00 H new