USER MOD reduce.3.24.130724 H: found=0, std=0, add=648, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 646 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 14 ASN : amide:sc= -2.09 K(o=-4.3,f=-4.9!) USER MOD Set 1.2: A 20 TYR OH : rot 30:sc= -1.45 USER MOD Set 1.3: A 41 GLN : amide:sc= -0.767 K(o=-4.3,f=-5) USER MOD Single : A 1 GLY N :NH3+ -132:sc= 0.086 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.0042) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 180:sc= -0.03 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 ASN : amide:sc= -0.33 K(o=-0.33,f=-3.8!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -1.78 K(o=-1.8,f=-0.27!) USER MOD Single : A 36 GLN : amide:sc= 0.735 K(o=0.73,f=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 45 LYS NZ :NH3+ 143:sc= -1.14 (180deg=-2.91!) USER MOD Single : A 46 LYS NZ :NH3+ 157:sc= -0.975 (180deg=-2.18!) USER MOD Single : A 47 GLN : amide:sc= -0.187 K(o=-0.19,f=-1.5) USER MOD Single : A 48 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.5!) USER MOD Single : A 49 GLN : amide:sc= -0.946 X(o=-0.95,f=-1.2) USER MOD Single : A 53 GLN : amide:sc= 0.226 X(o=0.23,f=-0.067) USER MOD Single : A 55 GLN : amide:sc= 0.0982 X(o=0.098,f=0) USER MOD Single : A 58 GLN : amide:sc= -0.536 K(o=-0.54,f=-1.1!) USER MOD Single : A 66 TYR OH : rot -93:sc= 1.11 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -153:sc= -0.127 (180deg=-0.606) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.270 1.892 -18.100 1.00 0.00 N ATOM 2 CA GLY A 1 -4.589 0.590 -17.544 1.00 0.00 C ATOM 3 C GLY A 1 -5.677 -0.122 -18.324 1.00 0.00 C ATOM 4 O GLY A 1 -6.081 0.332 -19.394 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.238 1.988 -18.190 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.710 1.986 -19.038 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.633 2.636 -17.471 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.691 -0.027 -17.533 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.907 0.708 -16.508 1.00 0.00 H new ATOM 8 N SER A 2 -6.150 -1.243 -17.788 1.00 0.00 N ATOM 9 CA SER A 2 -7.193 -2.022 -18.443 1.00 0.00 C ATOM 10 C SER A 2 -8.400 -2.194 -17.526 1.00 0.00 C ATOM 11 O SER A 2 -8.391 -1.746 -16.380 1.00 0.00 O ATOM 12 CB SER A 2 -6.652 -3.393 -18.856 1.00 0.00 C ATOM 13 OG SER A 2 -5.930 -3.311 -20.072 1.00 0.00 O ATOM 0 H SER A 2 -5.827 -1.631 -16.902 1.00 0.00 H new ATOM 0 HA SER A 2 -7.510 -1.481 -19.334 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.005 -3.784 -18.071 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.478 -4.095 -18.967 1.00 0.00 H new ATOM 0 HG SER A 2 -5.593 -4.199 -20.313 1.00 0.00 H new ATOM 19 N SER A 3 -9.438 -2.846 -18.040 1.00 0.00 N ATOM 20 CA SER A 3 -10.655 -3.074 -17.270 1.00 0.00 C ATOM 21 C SER A 3 -10.410 -4.085 -16.154 1.00 0.00 C ATOM 22 O SER A 3 -10.220 -5.274 -16.408 1.00 0.00 O ATOM 23 CB SER A 3 -11.777 -3.570 -18.184 1.00 0.00 C ATOM 24 OG SER A 3 -12.968 -3.800 -17.452 1.00 0.00 O ATOM 0 H SER A 3 -9.460 -3.226 -18.986 1.00 0.00 H new ATOM 0 HA SER A 3 -10.954 -2.127 -16.821 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.964 -2.835 -18.967 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.467 -4.491 -18.679 1.00 0.00 H new ATOM 0 HG SER A 3 -13.670 -4.115 -18.059 1.00 0.00 H new ATOM 30 N GLY A 4 -10.414 -3.602 -14.915 1.00 0.00 N ATOM 31 CA GLY A 4 -10.191 -4.475 -13.777 1.00 0.00 C ATOM 32 C GLY A 4 -9.709 -3.721 -12.554 1.00 0.00 C ATOM 33 O GLY A 4 -8.508 -3.646 -12.296 1.00 0.00 O ATOM 0 H GLY A 4 -10.568 -2.622 -14.679 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.117 -4.997 -13.537 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.457 -5.235 -14.044 1.00 0.00 H new ATOM 37 N SER A 5 -10.648 -3.159 -11.799 1.00 0.00 N ATOM 38 CA SER A 5 -10.312 -2.402 -10.599 1.00 0.00 C ATOM 39 C SER A 5 -10.192 -3.325 -9.390 1.00 0.00 C ATOM 40 O SER A 5 -10.987 -4.249 -9.219 1.00 0.00 O ATOM 41 CB SER A 5 -11.371 -1.330 -10.333 1.00 0.00 C ATOM 42 OG SER A 5 -11.298 -0.291 -11.293 1.00 0.00 O ATOM 0 H SER A 5 -11.647 -3.214 -11.997 1.00 0.00 H new ATOM 0 HA SER A 5 -9.349 -1.919 -10.762 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.363 -1.781 -10.356 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.231 -0.917 -9.334 1.00 0.00 H new ATOM 0 HG SER A 5 -11.986 0.380 -11.102 1.00 0.00 H new ATOM 48 N SER A 6 -9.191 -3.067 -8.554 1.00 0.00 N ATOM 49 CA SER A 6 -8.963 -3.877 -7.363 1.00 0.00 C ATOM 50 C SER A 6 -8.026 -3.163 -6.392 1.00 0.00 C ATOM 51 O SER A 6 -7.269 -2.275 -6.782 1.00 0.00 O ATOM 52 CB SER A 6 -8.376 -5.236 -7.749 1.00 0.00 C ATOM 53 OG SER A 6 -8.545 -6.179 -6.704 1.00 0.00 O ATOM 0 H SER A 6 -8.526 -2.304 -8.679 1.00 0.00 H new ATOM 0 HA SER A 6 -9.922 -4.031 -6.869 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.860 -5.601 -8.655 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.316 -5.126 -7.977 1.00 0.00 H new ATOM 0 HG SER A 6 -8.163 -7.040 -6.975 1.00 0.00 H new ATOM 59 N GLY A 7 -8.084 -3.559 -5.124 1.00 0.00 N ATOM 60 CA GLY A 7 -7.237 -2.947 -4.117 1.00 0.00 C ATOM 61 C GLY A 7 -8.020 -2.084 -3.148 1.00 0.00 C ATOM 62 O GLY A 7 -9.233 -1.923 -3.290 1.00 0.00 O ATOM 0 H GLY A 7 -8.702 -4.292 -4.776 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.714 -3.727 -3.563 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.476 -2.339 -4.607 1.00 0.00 H new ATOM 66 N ILE A 8 -7.327 -1.528 -2.160 1.00 0.00 N ATOM 67 CA ILE A 8 -7.965 -0.676 -1.164 1.00 0.00 C ATOM 68 C ILE A 8 -7.616 0.791 -1.390 1.00 0.00 C ATOM 69 O ILE A 8 -6.589 1.109 -1.989 1.00 0.00 O ATOM 70 CB ILE A 8 -7.554 -1.077 0.265 1.00 0.00 C ATOM 71 CG1 ILE A 8 -6.063 -0.811 0.484 1.00 0.00 C ATOM 72 CG2 ILE A 8 -7.879 -2.541 0.519 1.00 0.00 C ATOM 73 CD1 ILE A 8 -5.701 -0.551 1.929 1.00 0.00 C ATOM 0 H ILE A 8 -6.323 -1.652 -2.028 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.041 -0.811 -1.275 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.120 -0.472 0.973 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.493 -1.667 0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.763 0.047 -0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.583 -2.809 1.533 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.950 -2.702 0.400 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.337 -3.163 -0.194 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -4.629 -0.371 2.009 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.244 0.323 2.288 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.969 -1.418 2.533 1.00 0.00 H new ATOM 85 N GLN A 9 -8.476 1.680 -0.904 1.00 0.00 N ATOM 86 CA GLN A 9 -8.258 3.114 -1.052 1.00 0.00 C ATOM 87 C GLN A 9 -7.835 3.739 0.273 1.00 0.00 C ATOM 88 O GLN A 9 -8.598 3.748 1.239 1.00 0.00 O ATOM 89 CB GLN A 9 -9.527 3.794 -1.569 1.00 0.00 C ATOM 90 CG GLN A 9 -9.402 5.304 -1.688 1.00 0.00 C ATOM 91 CD GLN A 9 -10.729 5.979 -1.974 1.00 0.00 C ATOM 92 OE1 GLN A 9 -11.670 5.883 -1.185 1.00 0.00 O ATOM 93 NE2 GLN A 9 -10.812 6.667 -3.107 1.00 0.00 N ATOM 0 H GLN A 9 -9.330 1.433 -0.404 1.00 0.00 H new ATOM 0 HA GLN A 9 -7.456 3.262 -1.775 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -9.779 3.380 -2.546 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -10.354 3.558 -0.900 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -8.987 5.704 -0.763 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -8.697 5.545 -2.484 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -10.007 6.720 -3.732 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -11.680 7.142 -3.353 1.00 0.00 H new ATOM 102 N VAL A 10 -6.613 4.262 0.312 1.00 0.00 N ATOM 103 CA VAL A 10 -6.089 4.891 1.519 1.00 0.00 C ATOM 104 C VAL A 10 -5.772 6.362 1.278 1.00 0.00 C ATOM 105 O VAL A 10 -5.248 6.732 0.228 1.00 0.00 O ATOM 106 CB VAL A 10 -4.817 4.178 2.015 1.00 0.00 C ATOM 107 CG1 VAL A 10 -5.065 2.685 2.164 1.00 0.00 C ATOM 108 CG2 VAL A 10 -3.655 4.442 1.070 1.00 0.00 C ATOM 0 H VAL A 10 -5.968 4.262 -0.478 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.864 4.809 2.281 1.00 0.00 H new ATOM 0 HB VAL A 10 -4.556 4.578 2.995 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.155 2.198 2.515 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.866 2.519 2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.352 2.266 1.200 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.765 3.931 1.436 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.903 4.071 0.076 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.463 5.514 1.020 1.00 0.00 H new ATOM 118 N PHE A 11 -6.094 7.199 2.259 1.00 0.00 N ATOM 119 CA PHE A 11 -5.845 8.632 2.155 1.00 0.00 C ATOM 120 C PHE A 11 -4.498 8.996 2.773 1.00 0.00 C ATOM 121 O PHE A 11 -4.213 8.646 3.919 1.00 0.00 O ATOM 122 CB PHE A 11 -6.964 9.417 2.842 1.00 0.00 C ATOM 123 CG PHE A 11 -8.320 9.178 2.243 1.00 0.00 C ATOM 124 CD1 PHE A 11 -8.707 9.835 1.086 1.00 0.00 C ATOM 125 CD2 PHE A 11 -9.208 8.296 2.838 1.00 0.00 C ATOM 126 CE1 PHE A 11 -9.954 9.616 0.532 1.00 0.00 C ATOM 127 CE2 PHE A 11 -10.456 8.073 2.288 1.00 0.00 C ATOM 128 CZ PHE A 11 -10.830 8.735 1.134 1.00 0.00 C ATOM 0 H PHE A 11 -6.528 6.909 3.135 1.00 0.00 H new ATOM 0 HA PHE A 11 -5.823 8.896 1.098 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -6.990 9.148 3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -6.735 10.481 2.790 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -8.026 10.526 0.612 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -8.922 7.777 3.741 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -10.243 10.133 -0.371 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -11.139 7.382 2.760 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.806 8.563 0.704 1.00 0.00 H new ATOM 138 N VAL A 12 -3.673 9.701 2.006 1.00 0.00 N ATOM 139 CA VAL A 12 -2.356 10.114 2.478 1.00 0.00 C ATOM 140 C VAL A 12 -2.309 11.617 2.731 1.00 0.00 C ATOM 141 O VAL A 12 -2.324 12.417 1.796 1.00 0.00 O ATOM 142 CB VAL A 12 -1.256 9.741 1.467 1.00 0.00 C ATOM 143 CG1 VAL A 12 0.108 10.181 1.975 1.00 0.00 C ATOM 144 CG2 VAL A 12 -1.273 8.245 1.188 1.00 0.00 C ATOM 0 H VAL A 12 -3.893 9.998 1.055 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.175 9.585 3.414 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.455 10.264 0.532 1.00 0.00 H new ATOM 0 HG11 VAL A 12 0.872 9.909 1.247 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.112 11.262 2.118 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.319 9.688 2.924 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -0.489 8.000 0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.100 7.700 2.116 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.242 7.963 0.776 1.00 0.00 H new ATOM 154 N LYS A 13 -2.253 11.994 4.004 1.00 0.00 N ATOM 155 CA LYS A 13 -2.202 13.401 4.383 1.00 0.00 C ATOM 156 C LYS A 13 -0.768 13.919 4.361 1.00 0.00 C ATOM 157 O LYS A 13 0.084 13.449 5.113 1.00 0.00 O ATOM 158 CB LYS A 13 -2.804 13.597 5.777 1.00 0.00 C ATOM 159 CG LYS A 13 -2.232 14.789 6.525 1.00 0.00 C ATOM 160 CD LYS A 13 -2.982 15.047 7.820 1.00 0.00 C ATOM 161 CE LYS A 13 -4.169 15.972 7.602 1.00 0.00 C ATOM 162 NZ LYS A 13 -4.992 16.120 8.834 1.00 0.00 N ATOM 0 H LYS A 13 -2.242 11.345 4.791 1.00 0.00 H new ATOM 0 HA LYS A 13 -2.786 13.968 3.658 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -3.883 13.721 5.683 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -2.637 12.695 6.366 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -1.179 14.612 6.743 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -2.282 15.675 5.892 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -3.328 14.101 8.236 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -2.305 15.488 8.552 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -3.812 16.952 7.284 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -4.790 15.582 6.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.791 16.758 8.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.354 15.189 9.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -4.407 16.516 9.597 1.00 0.00 H new ATOM 176 N ASN A 14 -0.508 14.893 3.493 1.00 0.00 N ATOM 177 CA ASN A 14 0.823 15.475 3.374 1.00 0.00 C ATOM 178 C ASN A 14 1.044 16.549 4.435 1.00 0.00 C ATOM 179 O ASN A 14 0.104 17.171 4.930 1.00 0.00 O ATOM 180 CB ASN A 14 1.018 16.073 1.979 1.00 0.00 C ATOM 181 CG ASN A 14 -0.066 17.071 1.621 1.00 0.00 C ATOM 182 OD1 ASN A 14 -0.922 17.396 2.444 1.00 0.00 O ATOM 183 ND2 ASN A 14 -0.035 17.562 0.388 1.00 0.00 N ATOM 0 H ASN A 14 -1.202 15.295 2.863 1.00 0.00 H new ATOM 0 HA ASN A 14 1.554 14.681 3.528 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.990 16.563 1.930 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.028 15.271 1.241 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.739 18.237 0.090 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.693 17.264 -0.261 1.00 0.00 H new ATOM 190 N PRO A 15 2.317 16.774 4.793 1.00 0.00 N ATOM 191 CA PRO A 15 2.692 17.773 5.798 1.00 0.00 C ATOM 192 C PRO A 15 2.477 19.200 5.305 1.00 0.00 C ATOM 193 O PRO A 15 2.610 20.157 6.067 1.00 0.00 O ATOM 194 CB PRO A 15 4.182 17.506 6.025 1.00 0.00 C ATOM 195 CG PRO A 15 4.651 16.872 4.761 1.00 0.00 C ATOM 196 CD PRO A 15 3.488 16.069 4.245 1.00 0.00 C ATOM 0 HA PRO A 15 2.087 17.689 6.701 1.00 0.00 H new ATOM 0 HB2 PRO A 15 4.723 18.430 6.229 1.00 0.00 H new ATOM 0 HB3 PRO A 15 4.341 16.849 6.880 1.00 0.00 H new ATOM 0 HG2 PRO A 15 4.957 17.626 4.036 1.00 0.00 H new ATOM 0 HG3 PRO A 15 5.516 16.234 4.942 1.00 0.00 H new ATOM 0 HD2 PRO A 15 3.469 16.044 3.155 1.00 0.00 H new ATOM 0 HD3 PRO A 15 3.531 15.035 4.587 1.00 0.00 H new ATOM 204 N ASP A 16 2.142 19.335 4.026 1.00 0.00 N ATOM 205 CA ASP A 16 1.906 20.645 3.432 1.00 0.00 C ATOM 206 C ASP A 16 0.515 21.161 3.787 1.00 0.00 C ATOM 207 O ASP A 16 0.354 22.306 4.207 1.00 0.00 O ATOM 208 CB ASP A 16 2.066 20.576 1.912 1.00 0.00 C ATOM 209 CG ASP A 16 3.514 20.431 1.488 1.00 0.00 C ATOM 210 OD1 ASP A 16 4.314 21.341 1.789 1.00 0.00 O ATOM 211 OD2 ASP A 16 3.847 19.408 0.853 1.00 0.00 O ATOM 0 H ASP A 16 2.028 18.553 3.381 1.00 0.00 H new ATOM 0 HA ASP A 16 2.644 21.338 3.836 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.492 19.733 1.527 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.648 21.478 1.464 1.00 0.00 H new ATOM 216 N GLY A 17 -0.489 20.306 3.614 1.00 0.00 N ATOM 217 CA GLY A 17 -1.854 20.694 3.919 1.00 0.00 C ATOM 218 C GLY A 17 -2.861 20.059 2.981 1.00 0.00 C ATOM 219 O GLY A 17 -3.173 20.612 1.927 1.00 0.00 O ATOM 0 H GLY A 17 -0.381 19.352 3.268 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.088 20.410 4.945 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -1.942 21.779 3.861 1.00 0.00 H new ATOM 223 N GLY A 18 -3.370 18.891 3.363 1.00 0.00 N ATOM 224 CA GLY A 18 -4.341 18.199 2.536 1.00 0.00 C ATOM 225 C GLY A 18 -4.115 16.700 2.510 1.00 0.00 C ATOM 226 O GLY A 18 -3.159 16.199 3.100 1.00 0.00 O ATOM 0 H GLY A 18 -3.127 18.412 4.230 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.344 18.406 2.908 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.292 18.589 1.519 1.00 0.00 H new ATOM 230 N SER A 19 -5.000 15.982 1.824 1.00 0.00 N ATOM 231 CA SER A 19 -4.896 14.531 1.728 1.00 0.00 C ATOM 232 C SER A 19 -5.400 14.039 0.375 1.00 0.00 C ATOM 233 O SER A 19 -6.385 14.552 -0.157 1.00 0.00 O ATOM 234 CB SER A 19 -5.691 13.866 2.854 1.00 0.00 C ATOM 235 OG SER A 19 -5.165 12.587 3.162 1.00 0.00 O ATOM 0 H SER A 19 -5.796 16.382 1.327 1.00 0.00 H new ATOM 0 HA SER A 19 -3.845 14.259 1.825 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.666 14.497 3.743 1.00 0.00 H new ATOM 0 HB3 SER A 19 -6.736 13.772 2.559 1.00 0.00 H new ATOM 0 HG SER A 19 -5.689 12.183 3.885 1.00 0.00 H new ATOM 241 N TYR A 20 -4.718 13.042 -0.177 1.00 0.00 N ATOM 242 CA TYR A 20 -5.094 12.481 -1.469 1.00 0.00 C ATOM 243 C TYR A 20 -5.453 11.004 -1.338 1.00 0.00 C ATOM 244 O TYR A 20 -5.026 10.330 -0.401 1.00 0.00 O ATOM 245 CB TYR A 20 -3.954 12.653 -2.474 1.00 0.00 C ATOM 246 CG TYR A 20 -3.204 13.957 -2.322 1.00 0.00 C ATOM 247 CD1 TYR A 20 -3.761 15.155 -2.751 1.00 0.00 C ATOM 248 CD2 TYR A 20 -1.939 13.991 -1.748 1.00 0.00 C ATOM 249 CE1 TYR A 20 -3.079 16.349 -2.615 1.00 0.00 C ATOM 250 CE2 TYR A 20 -1.251 15.180 -1.606 1.00 0.00 C ATOM 251 CZ TYR A 20 -1.824 16.356 -2.042 1.00 0.00 C ATOM 252 OH TYR A 20 -1.142 17.543 -1.903 1.00 0.00 O ATOM 0 H TYR A 20 -3.901 12.605 0.250 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.971 13.019 -1.829 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -3.254 11.826 -2.361 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.359 12.592 -3.484 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.744 15.153 -3.198 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -1.486 13.072 -1.407 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.526 17.271 -2.955 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -0.269 15.189 -1.156 1.00 0.00 H new ATOM 0 HH TYR A 20 -1.782 18.277 -1.791 1.00 0.00 H new ATOM 262 N ALA A 21 -6.242 10.507 -2.286 1.00 0.00 N ATOM 263 CA ALA A 21 -6.657 9.110 -2.280 1.00 0.00 C ATOM 264 C ALA A 21 -5.753 8.265 -3.170 1.00 0.00 C ATOM 265 O ALA A 21 -5.624 8.526 -4.366 1.00 0.00 O ATOM 266 CB ALA A 21 -8.106 8.989 -2.728 1.00 0.00 C ATOM 0 H ALA A 21 -6.606 11.052 -3.068 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.571 8.735 -1.260 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.403 7.940 -2.719 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.745 9.553 -2.049 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.209 9.387 -3.738 1.00 0.00 H new ATOM 272 N TYR A 22 -5.129 7.252 -2.580 1.00 0.00 N ATOM 273 CA TYR A 22 -4.234 6.370 -3.319 1.00 0.00 C ATOM 274 C TYR A 22 -4.845 4.980 -3.474 1.00 0.00 C ATOM 275 O TYR A 22 -5.807 4.632 -2.790 1.00 0.00 O ATOM 276 CB TYR A 22 -2.883 6.269 -2.610 1.00 0.00 C ATOM 277 CG TYR A 22 -2.033 7.512 -2.747 1.00 0.00 C ATOM 278 CD1 TYR A 22 -2.319 8.657 -2.013 1.00 0.00 C ATOM 279 CD2 TYR A 22 -0.944 7.542 -3.609 1.00 0.00 C ATOM 280 CE1 TYR A 22 -1.547 9.795 -2.135 1.00 0.00 C ATOM 281 CE2 TYR A 22 -0.165 8.676 -3.736 1.00 0.00 C ATOM 282 CZ TYR A 22 -0.470 9.800 -2.998 1.00 0.00 C ATOM 283 OH TYR A 22 0.303 10.931 -3.121 1.00 0.00 O ATOM 0 H TYR A 22 -5.227 7.021 -1.591 1.00 0.00 H new ATOM 0 HA TYR A 22 -4.085 6.795 -4.312 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -3.052 6.069 -1.552 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -2.334 5.417 -3.012 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -3.160 8.656 -1.335 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -0.702 6.664 -4.190 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -1.785 10.677 -1.558 1.00 0.00 H new ATOM 0 HE2 TYR A 22 0.679 8.682 -4.410 1.00 0.00 H new ATOM 0 HH TYR A 22 1.021 10.768 -3.768 1.00 0.00 H new ATOM 293 N ALA A 23 -4.277 4.189 -4.379 1.00 0.00 N ATOM 294 CA ALA A 23 -4.762 2.837 -4.624 1.00 0.00 C ATOM 295 C ALA A 23 -3.647 1.813 -4.446 1.00 0.00 C ATOM 296 O ALA A 23 -2.628 1.865 -5.136 1.00 0.00 O ATOM 297 CB ALA A 23 -5.358 2.734 -6.020 1.00 0.00 C ATOM 0 H ALA A 23 -3.480 4.462 -4.954 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.540 2.619 -3.892 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.716 1.718 -6.189 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.190 3.432 -6.113 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.596 2.978 -6.760 1.00 0.00 H new ATOM 303 N ILE A 24 -3.845 0.884 -3.516 1.00 0.00 N ATOM 304 CA ILE A 24 -2.855 -0.152 -3.249 1.00 0.00 C ATOM 305 C ILE A 24 -3.494 -1.364 -2.580 1.00 0.00 C ATOM 306 O ILE A 24 -4.150 -1.240 -1.546 1.00 0.00 O ATOM 307 CB ILE A 24 -1.717 0.374 -2.354 1.00 0.00 C ATOM 308 CG1 ILE A 24 -0.742 -0.755 -2.015 1.00 0.00 C ATOM 309 CG2 ILE A 24 -2.285 0.990 -1.084 1.00 0.00 C ATOM 310 CD1 ILE A 24 0.637 -0.266 -1.629 1.00 0.00 C ATOM 0 H ILE A 24 -4.682 0.828 -2.935 1.00 0.00 H new ATOM 0 HA ILE A 24 -2.441 -0.448 -4.213 1.00 0.00 H new ATOM 0 HB ILE A 24 -1.173 1.146 -2.898 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -1.152 -1.345 -1.195 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -0.656 -1.420 -2.874 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -1.469 1.357 -0.461 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -2.944 1.818 -1.345 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -2.849 0.236 -0.535 1.00 0.00 H new ATOM 0 HD11 ILE A 24 1.275 -1.120 -1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.067 0.299 -2.456 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.563 0.375 -0.751 1.00 0.00 H new ATOM 322 N ASN A 25 -3.297 -2.535 -3.176 1.00 0.00 N ATOM 323 CA ASN A 25 -3.854 -3.770 -2.637 1.00 0.00 C ATOM 324 C ASN A 25 -3.418 -3.977 -1.190 1.00 0.00 C ATOM 325 O ASN A 25 -2.349 -3.536 -0.768 1.00 0.00 O ATOM 326 CB ASN A 25 -3.417 -4.965 -3.488 1.00 0.00 C ATOM 327 CG ASN A 25 -4.138 -5.019 -4.821 1.00 0.00 C ATOM 328 OD1 ASN A 25 -5.224 -5.589 -4.930 1.00 0.00 O ATOM 329 ND2 ASN A 25 -3.535 -4.424 -5.844 1.00 0.00 N ATOM 0 H ASN A 25 -2.756 -2.655 -4.032 1.00 0.00 H new ATOM 0 HA ASN A 25 -4.941 -3.691 -2.663 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.342 -4.911 -3.661 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -3.605 -5.887 -2.938 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.972 -4.428 -6.766 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -2.635 -3.963 -5.708 1.00 0.00 H new ATOM 336 N PRO A 26 -4.265 -4.665 -0.409 1.00 0.00 N ATOM 337 CA PRO A 26 -3.989 -4.947 1.003 1.00 0.00 C ATOM 338 C PRO A 26 -2.854 -5.950 1.182 1.00 0.00 C ATOM 339 O PRO A 26 -2.268 -6.051 2.259 1.00 0.00 O ATOM 340 CB PRO A 26 -5.307 -5.534 1.512 1.00 0.00 C ATOM 341 CG PRO A 26 -5.959 -6.107 0.301 1.00 0.00 C ATOM 342 CD PRO A 26 -5.557 -5.220 -0.845 1.00 0.00 C ATOM 0 HA PRO A 26 -3.668 -4.055 1.542 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.134 -6.300 2.268 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.930 -4.767 1.972 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -5.635 -7.134 0.132 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -7.043 -6.130 0.415 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -5.460 -5.782 -1.774 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.292 -4.435 -1.023 1.00 0.00 H new ATOM 350 N ASN A 27 -2.550 -6.689 0.120 1.00 0.00 N ATOM 351 CA ASN A 27 -1.486 -7.685 0.161 1.00 0.00 C ATOM 352 C ASN A 27 -0.145 -7.063 -0.218 1.00 0.00 C ATOM 353 O ASN A 27 0.914 -7.584 0.133 1.00 0.00 O ATOM 354 CB ASN A 27 -1.808 -8.845 -0.782 1.00 0.00 C ATOM 355 CG ASN A 27 -3.067 -9.587 -0.377 1.00 0.00 C ATOM 356 OD1 ASN A 27 -3.954 -9.024 0.265 1.00 0.00 O ATOM 357 ND2 ASN A 27 -3.150 -10.859 -0.750 1.00 0.00 N ATOM 0 H ASN A 27 -3.026 -6.617 -0.779 1.00 0.00 H new ATOM 0 HA ASN A 27 -1.416 -8.064 1.181 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.925 -8.463 -1.796 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -0.969 -9.540 -0.798 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -3.973 -11.410 -0.505 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -2.391 -11.285 -1.281 1.00 0.00 H new ATOM 364 N SER A 28 -0.199 -5.946 -0.937 1.00 0.00 N ATOM 365 CA SER A 28 1.011 -5.255 -1.367 1.00 0.00 C ATOM 366 C SER A 28 1.777 -4.703 -0.168 1.00 0.00 C ATOM 367 O SER A 28 1.180 -4.255 0.811 1.00 0.00 O ATOM 368 CB SER A 28 0.660 -4.119 -2.330 1.00 0.00 C ATOM 369 OG SER A 28 1.829 -3.534 -2.876 1.00 0.00 O ATOM 0 H SER A 28 -1.067 -5.501 -1.234 1.00 0.00 H new ATOM 0 HA SER A 28 1.647 -5.975 -1.882 1.00 0.00 H new ATOM 0 HB2 SER A 28 0.031 -4.501 -3.134 1.00 0.00 H new ATOM 0 HB3 SER A 28 0.080 -3.359 -1.805 1.00 0.00 H new ATOM 0 HG SER A 28 1.578 -2.812 -3.489 1.00 0.00 H new ATOM 375 N PHE A 29 3.102 -4.738 -0.254 1.00 0.00 N ATOM 376 CA PHE A 29 3.951 -4.243 0.824 1.00 0.00 C ATOM 377 C PHE A 29 3.733 -2.749 1.044 1.00 0.00 C ATOM 378 O PHE A 29 3.418 -2.012 0.109 1.00 0.00 O ATOM 379 CB PHE A 29 5.423 -4.513 0.507 1.00 0.00 C ATOM 380 CG PHE A 29 5.723 -5.961 0.242 1.00 0.00 C ATOM 381 CD1 PHE A 29 5.497 -6.919 1.218 1.00 0.00 C ATOM 382 CD2 PHE A 29 6.230 -6.365 -0.982 1.00 0.00 C ATOM 383 CE1 PHE A 29 5.773 -8.251 0.978 1.00 0.00 C ATOM 384 CE2 PHE A 29 6.508 -7.696 -1.229 1.00 0.00 C ATOM 385 CZ PHE A 29 6.278 -8.641 -0.248 1.00 0.00 C ATOM 0 H PHE A 29 3.612 -5.104 -1.058 1.00 0.00 H new ATOM 0 HA PHE A 29 3.680 -4.771 1.738 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.713 -3.925 -0.364 1.00 0.00 H new ATOM 0 HB3 PHE A 29 6.035 -4.170 1.341 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.101 -6.620 2.177 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.410 -5.631 -1.753 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.594 -8.987 1.748 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.904 -7.997 -2.187 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.492 -9.682 -0.439 1.00 0.00 H new ATOM 395 N ILE A 30 3.902 -2.309 2.287 1.00 0.00 N ATOM 396 CA ILE A 30 3.725 -0.904 2.631 1.00 0.00 C ATOM 397 C ILE A 30 4.588 -0.009 1.748 1.00 0.00 C ATOM 398 O ILE A 30 4.255 1.152 1.508 1.00 0.00 O ATOM 399 CB ILE A 30 4.071 -0.638 4.107 1.00 0.00 C ATOM 400 CG1 ILE A 30 2.998 -1.234 5.021 1.00 0.00 C ATOM 401 CG2 ILE A 30 4.216 0.856 4.356 1.00 0.00 C ATOM 402 CD1 ILE A 30 1.839 -0.298 5.283 1.00 0.00 C ATOM 0 H ILE A 30 4.161 -2.906 3.072 1.00 0.00 H new ATOM 0 HA ILE A 30 2.674 -0.668 2.465 1.00 0.00 H new ATOM 0 HB ILE A 30 5.023 -1.119 4.334 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.619 -2.152 4.572 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.454 -1.509 5.972 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.461 1.028 5.404 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.013 1.254 3.727 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.279 1.358 4.115 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.118 -0.787 5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.206 0.610 5.761 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.357 -0.042 4.339 1.00 0.00 H new ATOM 414 N LEU A 31 5.699 -0.557 1.267 1.00 0.00 N ATOM 415 CA LEU A 31 6.611 0.192 0.408 1.00 0.00 C ATOM 416 C LEU A 31 5.939 0.559 -0.910 1.00 0.00 C ATOM 417 O LEU A 31 6.140 1.652 -1.438 1.00 0.00 O ATOM 418 CB LEU A 31 7.875 -0.626 0.139 1.00 0.00 C ATOM 419 CG LEU A 31 8.934 0.045 -0.736 1.00 0.00 C ATOM 420 CD1 LEU A 31 9.883 0.874 0.115 1.00 0.00 C ATOM 421 CD2 LEU A 31 9.704 -0.997 -1.535 1.00 0.00 C ATOM 0 H LEU A 31 5.990 -1.516 1.457 1.00 0.00 H new ATOM 0 HA LEU A 31 6.884 1.113 0.924 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.331 -0.879 1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.583 -1.564 -0.333 1.00 0.00 H new ATOM 0 HG LEU A 31 8.430 0.712 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 31 10.630 1.344 -0.525 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.320 1.645 0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.380 0.229 0.839 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.453 -0.501 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.196 -1.689 -0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.014 -1.548 -2.174 1.00 0.00 H new ATOM 433 N GLY A 32 5.137 -0.362 -1.438 1.00 0.00 N ATOM 434 CA GLY A 32 4.446 -0.115 -2.689 1.00 0.00 C ATOM 435 C GLY A 32 3.534 1.094 -2.619 1.00 0.00 C ATOM 436 O GLY A 32 3.054 1.580 -3.644 1.00 0.00 O ATOM 0 H GLY A 32 4.954 -1.275 -1.021 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.179 0.032 -3.482 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.859 -0.994 -2.956 1.00 0.00 H new ATOM 440 N LEU A 33 3.292 1.581 -1.407 1.00 0.00 N ATOM 441 CA LEU A 33 2.429 2.740 -1.206 1.00 0.00 C ATOM 442 C LEU A 33 3.237 4.034 -1.250 1.00 0.00 C ATOM 443 O LEU A 33 2.774 5.050 -1.770 1.00 0.00 O ATOM 444 CB LEU A 33 1.695 2.629 0.131 1.00 0.00 C ATOM 445 CG LEU A 33 1.110 3.929 0.686 1.00 0.00 C ATOM 446 CD1 LEU A 33 0.180 4.571 -0.331 1.00 0.00 C ATOM 447 CD2 LEU A 33 0.377 3.668 1.993 1.00 0.00 C ATOM 0 H LEU A 33 3.681 1.191 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 33 1.697 2.762 -2.014 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.885 1.908 0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 33 2.386 2.221 0.869 1.00 0.00 H new ATOM 0 HG LEU A 33 1.930 4.619 0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.227 5.495 0.080 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.735 4.793 -1.242 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.636 3.886 -0.561 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.033 4.604 2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.434 2.960 1.820 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.072 3.253 2.723 1.00 0.00 H new ATOM 459 N LYS A 34 4.447 3.989 -0.704 1.00 0.00 N ATOM 460 CA LYS A 34 5.322 5.155 -0.684 1.00 0.00 C ATOM 461 C LYS A 34 5.787 5.511 -2.092 1.00 0.00 C ATOM 462 O LYS A 34 5.739 6.672 -2.495 1.00 0.00 O ATOM 463 CB LYS A 34 6.533 4.894 0.215 1.00 0.00 C ATOM 464 CG LYS A 34 6.269 5.168 1.686 1.00 0.00 C ATOM 465 CD LYS A 34 5.667 3.957 2.379 1.00 0.00 C ATOM 466 CE LYS A 34 6.713 2.883 2.634 1.00 0.00 C ATOM 467 NZ LYS A 34 7.411 3.086 3.934 1.00 0.00 N ATOM 0 H LYS A 34 4.845 3.157 -0.269 1.00 0.00 H new ATOM 0 HA LYS A 34 4.756 5.996 -0.285 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.845 3.856 0.098 1.00 0.00 H new ATOM 0 HB3 LYS A 34 7.363 5.516 -0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.201 5.444 2.179 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.593 6.018 1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.220 4.263 3.325 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.865 3.547 1.765 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.236 1.903 2.627 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.443 2.888 1.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.116 2.334 4.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.887 4.010 3.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.718 3.056 4.709 1.00 0.00 H new ATOM 481 N GLN A 35 6.236 4.504 -2.834 1.00 0.00 N ATOM 482 CA GLN A 35 6.709 4.712 -4.197 1.00 0.00 C ATOM 483 C GLN A 35 5.740 5.590 -4.982 1.00 0.00 C ATOM 484 O GLN A 35 6.153 6.518 -5.676 1.00 0.00 O ATOM 485 CB GLN A 35 6.889 3.369 -4.908 1.00 0.00 C ATOM 486 CG GLN A 35 7.602 3.479 -6.246 1.00 0.00 C ATOM 487 CD GLN A 35 8.815 4.387 -6.188 1.00 0.00 C ATOM 488 OE1 GLN A 35 8.868 5.416 -6.863 1.00 0.00 O ATOM 489 NE2 GLN A 35 9.798 4.011 -5.378 1.00 0.00 N ATOM 0 H GLN A 35 6.282 3.537 -2.514 1.00 0.00 H new ATOM 0 HA GLN A 35 7.672 5.220 -4.146 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.452 2.697 -4.260 1.00 0.00 H new ATOM 0 HB3 GLN A 35 5.910 2.916 -5.064 1.00 0.00 H new ATOM 0 HG2 GLN A 35 7.912 2.486 -6.571 1.00 0.00 H new ATOM 0 HG3 GLN A 35 6.906 3.857 -6.995 1.00 0.00 H new ATOM 0 HE21 GLN A 35 9.712 3.151 -4.837 1.00 0.00 H new ATOM 0 HE22 GLN A 35 10.639 4.583 -5.297 1.00 0.00 H new ATOM 498 N GLN A 36 4.451 5.290 -4.866 1.00 0.00 N ATOM 499 CA GLN A 36 3.424 6.052 -5.566 1.00 0.00 C ATOM 500 C GLN A 36 3.477 7.525 -5.174 1.00 0.00 C ATOM 501 O GLN A 36 3.294 8.407 -6.014 1.00 0.00 O ATOM 502 CB GLN A 36 2.038 5.481 -5.260 1.00 0.00 C ATOM 503 CG GLN A 36 1.664 4.293 -6.131 1.00 0.00 C ATOM 504 CD GLN A 36 0.220 3.869 -5.951 1.00 0.00 C ATOM 505 OE1 GLN A 36 -0.642 4.196 -6.767 1.00 0.00 O ATOM 506 NE2 GLN A 36 -0.053 3.136 -4.878 1.00 0.00 N ATOM 0 H GLN A 36 4.093 4.525 -4.294 1.00 0.00 H new ATOM 0 HA GLN A 36 3.614 5.972 -6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 36 2.001 5.179 -4.213 1.00 0.00 H new ATOM 0 HB3 GLN A 36 1.293 6.266 -5.392 1.00 0.00 H new ATOM 0 HG2 GLN A 36 1.837 4.546 -7.177 1.00 0.00 H new ATOM 0 HG3 GLN A 36 2.317 3.453 -5.894 1.00 0.00 H new ATOM 0 HE21 GLN A 36 0.692 2.887 -4.227 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -1.008 2.821 -4.705 1.00 0.00 H new ATOM 515 N ILE A 37 3.730 7.784 -3.896 1.00 0.00 N ATOM 516 CA ILE A 37 3.808 9.150 -3.394 1.00 0.00 C ATOM 517 C ILE A 37 5.083 9.838 -3.871 1.00 0.00 C ATOM 518 O ILE A 37 5.069 11.019 -4.217 1.00 0.00 O ATOM 519 CB ILE A 37 3.762 9.188 -1.855 1.00 0.00 C ATOM 520 CG1 ILE A 37 2.465 8.556 -1.346 1.00 0.00 C ATOM 521 CG2 ILE A 37 3.891 10.620 -1.357 1.00 0.00 C ATOM 522 CD1 ILE A 37 2.544 8.088 0.090 1.00 0.00 C ATOM 0 H ILE A 37 3.885 7.065 -3.189 1.00 0.00 H new ATOM 0 HA ILE A 37 2.942 9.681 -3.788 1.00 0.00 H new ATOM 0 HB ILE A 37 4.602 8.612 -1.466 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.656 9.281 -1.439 1.00 0.00 H new ATOM 0 HG13 ILE A 37 2.209 7.709 -1.982 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.857 10.631 -0.268 1.00 0.00 H new ATOM 0 HG22 ILE A 37 4.839 11.039 -1.694 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.070 11.218 -1.752 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.589 7.651 0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.331 7.340 0.186 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.769 8.936 0.737 1.00 0.00 H new ATOM 534 N GLU A 38 6.182 9.091 -3.887 1.00 0.00 N ATOM 535 CA GLU A 38 7.465 9.629 -4.323 1.00 0.00 C ATOM 536 C GLU A 38 7.403 10.068 -5.783 1.00 0.00 C ATOM 537 O GLU A 38 8.195 10.901 -6.226 1.00 0.00 O ATOM 538 CB GLU A 38 8.570 8.587 -4.138 1.00 0.00 C ATOM 539 CG GLU A 38 9.869 8.947 -4.840 1.00 0.00 C ATOM 540 CD GLU A 38 10.938 7.885 -4.667 1.00 0.00 C ATOM 541 OE1 GLU A 38 11.547 7.830 -3.579 1.00 0.00 O ATOM 542 OE2 GLU A 38 11.166 7.111 -5.620 1.00 0.00 O ATOM 0 H GLU A 38 6.210 8.112 -3.603 1.00 0.00 H new ATOM 0 HA GLU A 38 7.692 10.501 -3.709 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.765 8.461 -3.073 1.00 0.00 H new ATOM 0 HB3 GLU A 38 8.218 7.626 -4.513 1.00 0.00 H new ATOM 0 HG2 GLU A 38 9.675 9.093 -5.903 1.00 0.00 H new ATOM 0 HG3 GLU A 38 10.238 9.896 -4.450 1.00 0.00 H new ATOM 549 N ASP A 39 6.459 9.501 -6.525 1.00 0.00 N ATOM 550 CA ASP A 39 6.292 9.833 -7.936 1.00 0.00 C ATOM 551 C ASP A 39 5.283 10.963 -8.113 1.00 0.00 C ATOM 552 O ASP A 39 5.335 11.705 -9.093 1.00 0.00 O ATOM 553 CB ASP A 39 5.840 8.601 -8.721 1.00 0.00 C ATOM 554 CG ASP A 39 6.963 7.605 -8.933 1.00 0.00 C ATOM 555 OD1 ASP A 39 7.559 7.160 -7.930 1.00 0.00 O ATOM 556 OD2 ASP A 39 7.245 7.269 -10.102 1.00 0.00 O ATOM 0 H ASP A 39 5.797 8.809 -6.174 1.00 0.00 H new ATOM 0 HA ASP A 39 7.255 10.167 -8.322 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.023 8.115 -8.189 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.449 8.914 -9.689 1.00 0.00 H new ATOM 561 N GLN A 40 4.367 11.087 -7.158 1.00 0.00 N ATOM 562 CA GLN A 40 3.345 12.126 -7.210 1.00 0.00 C ATOM 563 C GLN A 40 3.874 13.439 -6.643 1.00 0.00 C ATOM 564 O GLN A 40 3.885 14.461 -7.328 1.00 0.00 O ATOM 565 CB GLN A 40 2.101 11.686 -6.435 1.00 0.00 C ATOM 566 CG GLN A 40 1.086 10.941 -7.287 1.00 0.00 C ATOM 567 CD GLN A 40 0.138 11.874 -8.014 1.00 0.00 C ATOM 568 OE1 GLN A 40 -0.541 12.693 -7.396 1.00 0.00 O ATOM 569 NE2 GLN A 40 0.087 11.754 -9.336 1.00 0.00 N ATOM 0 H GLN A 40 4.312 10.481 -6.339 1.00 0.00 H new ATOM 0 HA GLN A 40 3.077 12.285 -8.254 1.00 0.00 H new ATOM 0 HB2 GLN A 40 2.406 11.047 -5.606 1.00 0.00 H new ATOM 0 HB3 GLN A 40 1.624 12.565 -6.001 1.00 0.00 H new ATOM 0 HG2 GLN A 40 1.612 10.324 -8.015 1.00 0.00 H new ATOM 0 HG3 GLN A 40 0.511 10.266 -6.653 1.00 0.00 H new ATOM 0 HE21 GLN A 40 0.668 11.061 -9.808 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -0.533 12.355 -9.879 1.00 0.00 H new ATOM 578 N GLN A 41 4.312 13.402 -5.389 1.00 0.00 N ATOM 579 CA GLN A 41 4.842 14.590 -4.730 1.00 0.00 C ATOM 580 C GLN A 41 6.295 14.829 -5.125 1.00 0.00 C ATOM 581 O GLN A 41 6.772 15.964 -5.122 1.00 0.00 O ATOM 582 CB GLN A 41 4.730 14.450 -3.211 1.00 0.00 C ATOM 583 CG GLN A 41 3.307 14.233 -2.723 1.00 0.00 C ATOM 584 CD GLN A 41 3.097 14.715 -1.301 1.00 0.00 C ATOM 585 OE1 GLN A 41 2.315 15.633 -1.054 1.00 0.00 O ATOM 586 NE2 GLN A 41 3.797 14.097 -0.357 1.00 0.00 N ATOM 0 H GLN A 41 4.310 12.563 -4.809 1.00 0.00 H new ATOM 0 HA GLN A 41 4.251 15.447 -5.053 1.00 0.00 H new ATOM 0 HB2 GLN A 41 5.348 13.614 -2.885 1.00 0.00 H new ATOM 0 HB3 GLN A 41 5.134 15.347 -2.741 1.00 0.00 H new ATOM 0 HG2 GLN A 41 2.616 14.755 -3.385 1.00 0.00 H new ATOM 0 HG3 GLN A 41 3.065 13.172 -2.782 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.434 13.341 -0.607 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.698 14.379 0.618 1.00 0.00 H new ATOM 595 N GLY A 42 6.996 13.752 -5.464 1.00 0.00 N ATOM 596 CA GLY A 42 8.389 13.866 -5.856 1.00 0.00 C ATOM 597 C GLY A 42 9.334 13.761 -4.676 1.00 0.00 C ATOM 598 O GLY A 42 10.525 14.051 -4.796 1.00 0.00 O ATOM 0 H GLY A 42 6.624 12.802 -5.474 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.625 13.084 -6.577 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.545 14.821 -6.358 1.00 0.00 H new ATOM 602 N LEU A 43 8.804 13.347 -3.530 1.00 0.00 N ATOM 603 CA LEU A 43 9.608 13.206 -2.321 1.00 0.00 C ATOM 604 C LEU A 43 10.182 11.797 -2.210 1.00 0.00 C ATOM 605 O LEU A 43 9.516 10.804 -2.505 1.00 0.00 O ATOM 606 CB LEU A 43 8.766 13.524 -1.085 1.00 0.00 C ATOM 607 CG LEU A 43 9.511 14.161 0.089 1.00 0.00 C ATOM 608 CD1 LEU A 43 8.579 15.056 0.891 1.00 0.00 C ATOM 609 CD2 LEU A 43 10.121 13.088 0.979 1.00 0.00 C ATOM 0 H LEU A 43 7.821 13.103 -3.413 1.00 0.00 H new ATOM 0 HA LEU A 43 10.436 13.912 -2.381 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.958 14.193 -1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.303 12.600 -0.738 1.00 0.00 H new ATOM 0 HG LEU A 43 10.318 14.776 -0.309 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.127 15.500 1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.191 15.846 0.248 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.750 14.464 1.278 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.647 13.560 1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 43 9.331 12.446 1.368 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.822 12.489 0.398 1.00 0.00 H new ATOM 621 N PRO A 44 11.447 11.705 -1.773 1.00 0.00 N ATOM 622 CA PRO A 44 12.137 10.423 -1.610 1.00 0.00 C ATOM 623 C PRO A 44 11.575 9.604 -0.453 1.00 0.00 C ATOM 624 O PRO A 44 11.000 10.153 0.487 1.00 0.00 O ATOM 625 CB PRO A 44 13.584 10.832 -1.322 1.00 0.00 C ATOM 626 CG PRO A 44 13.481 12.198 -0.736 1.00 0.00 C ATOM 627 CD PRO A 44 12.300 12.847 -1.404 1.00 0.00 C ATOM 0 HA PRO A 44 12.026 9.787 -2.488 1.00 0.00 H new ATOM 0 HB2 PRO A 44 14.061 10.139 -0.629 1.00 0.00 H new ATOM 0 HB3 PRO A 44 14.183 10.836 -2.232 1.00 0.00 H new ATOM 0 HG2 PRO A 44 13.341 12.150 0.344 1.00 0.00 H new ATOM 0 HG3 PRO A 44 14.392 12.769 -0.914 1.00 0.00 H new ATOM 0 HD2 PRO A 44 11.785 13.533 -0.731 1.00 0.00 H new ATOM 0 HD3 PRO A 44 12.600 13.424 -2.279 1.00 0.00 H new ATOM 635 N LYS A 45 11.744 8.288 -0.528 1.00 0.00 N ATOM 636 CA LYS A 45 11.255 7.393 0.514 1.00 0.00 C ATOM 637 C LYS A 45 12.177 7.417 1.728 1.00 0.00 C ATOM 638 O LYS A 45 11.816 6.941 2.805 1.00 0.00 O ATOM 639 CB LYS A 45 11.139 5.966 -0.025 1.00 0.00 C ATOM 640 CG LYS A 45 10.301 5.858 -1.287 1.00 0.00 C ATOM 641 CD LYS A 45 10.546 4.542 -2.008 1.00 0.00 C ATOM 642 CE LYS A 45 11.805 4.599 -2.859 1.00 0.00 C ATOM 643 NZ LYS A 45 13.033 4.366 -2.050 1.00 0.00 N ATOM 0 H LYS A 45 12.216 7.818 -1.300 1.00 0.00 H new ATOM 0 HA LYS A 45 10.269 7.739 0.823 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.138 5.581 -0.229 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.704 5.330 0.746 1.00 0.00 H new ATOM 0 HG2 LYS A 45 9.245 5.943 -1.032 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.536 6.688 -1.953 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.635 3.737 -1.278 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.689 4.307 -2.639 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.743 3.851 -3.649 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.870 5.572 -3.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.716 3.813 -2.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.457 5.280 -1.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.786 3.842 -1.186 1.00 0.00 H new ATOM 657 N LYS A 46 13.370 7.974 1.549 1.00 0.00 N ATOM 658 CA LYS A 46 14.344 8.063 2.630 1.00 0.00 C ATOM 659 C LYS A 46 14.086 9.292 3.496 1.00 0.00 C ATOM 660 O LYS A 46 14.890 9.631 4.363 1.00 0.00 O ATOM 661 CB LYS A 46 15.764 8.116 2.062 1.00 0.00 C ATOM 662 CG LYS A 46 16.153 9.482 1.524 1.00 0.00 C ATOM 663 CD LYS A 46 17.602 9.509 1.067 1.00 0.00 C ATOM 664 CE LYS A 46 18.540 9.869 2.209 1.00 0.00 C ATOM 665 NZ LYS A 46 18.641 8.772 3.211 1.00 0.00 N ATOM 0 H LYS A 46 13.686 8.371 0.664 1.00 0.00 H new ATOM 0 HA LYS A 46 14.241 7.174 3.252 1.00 0.00 H new ATOM 0 HB2 LYS A 46 16.469 7.827 2.842 1.00 0.00 H new ATOM 0 HB3 LYS A 46 15.854 7.381 1.262 1.00 0.00 H new ATOM 0 HG2 LYS A 46 15.502 9.744 0.690 1.00 0.00 H new ATOM 0 HG3 LYS A 46 16.000 10.235 2.297 1.00 0.00 H new ATOM 0 HD2 LYS A 46 17.876 8.534 0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 46 17.716 10.232 0.259 1.00 0.00 H new ATOM 0 HE2 LYS A 46 19.530 10.089 1.810 1.00 0.00 H new ATOM 0 HE3 LYS A 46 18.185 10.776 2.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 19.534 8.863 3.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.841 8.832 3.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 18.618 7.854 2.724 1.00 0.00 H new ATOM 679 N GLN A 47 12.958 9.953 3.256 1.00 0.00 N ATOM 680 CA GLN A 47 12.595 11.144 4.015 1.00 0.00 C ATOM 681 C GLN A 47 11.157 11.051 4.517 1.00 0.00 C ATOM 682 O GLN A 47 10.852 11.471 5.633 1.00 0.00 O ATOM 683 CB GLN A 47 12.767 12.396 3.154 1.00 0.00 C ATOM 684 CG GLN A 47 14.192 12.926 3.128 1.00 0.00 C ATOM 685 CD GLN A 47 14.546 13.707 4.378 1.00 0.00 C ATOM 686 OE1 GLN A 47 14.815 13.129 5.431 1.00 0.00 O ATOM 687 NE2 GLN A 47 14.548 15.031 4.268 1.00 0.00 N ATOM 0 H GLN A 47 12.280 9.684 2.543 1.00 0.00 H new ATOM 0 HA GLN A 47 13.259 11.211 4.877 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.453 12.172 2.135 1.00 0.00 H new ATOM 0 HB3 GLN A 47 12.104 13.177 3.527 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.884 12.091 3.017 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.322 13.566 2.255 1.00 0.00 H new ATOM 0 HE21 GLN A 47 14.319 15.469 3.376 1.00 0.00 H new ATOM 0 HE22 GLN A 47 14.779 15.610 5.076 1.00 0.00 H new ATOM 696 N GLN A 48 10.279 10.501 3.685 1.00 0.00 N ATOM 697 CA GLN A 48 8.874 10.355 4.045 1.00 0.00 C ATOM 698 C GLN A 48 8.678 9.195 5.016 1.00 0.00 C ATOM 699 O GLN A 48 9.344 8.165 4.909 1.00 0.00 O ATOM 700 CB GLN A 48 8.025 10.135 2.792 1.00 0.00 C ATOM 701 CG GLN A 48 7.871 8.672 2.410 1.00 0.00 C ATOM 702 CD GLN A 48 7.026 8.479 1.166 1.00 0.00 C ATOM 703 OE1 GLN A 48 5.846 8.136 1.250 1.00 0.00 O ATOM 704 NE2 GLN A 48 7.626 8.699 0.003 1.00 0.00 N ATOM 0 H GLN A 48 10.516 10.149 2.757 1.00 0.00 H new ATOM 0 HA GLN A 48 8.554 11.274 4.536 1.00 0.00 H new ATOM 0 HB2 GLN A 48 7.037 10.566 2.953 1.00 0.00 H new ATOM 0 HB3 GLN A 48 8.476 10.674 1.959 1.00 0.00 H new ATOM 0 HG2 GLN A 48 8.857 8.238 2.246 1.00 0.00 H new ATOM 0 HG3 GLN A 48 7.418 8.130 3.240 1.00 0.00 H new ATOM 0 HE21 GLN A 48 8.606 8.982 -0.020 1.00 0.00 H new ATOM 0 HE22 GLN A 48 7.107 8.585 -0.868 1.00 0.00 H new ATOM 713 N GLN A 49 7.762 9.371 5.963 1.00 0.00 N ATOM 714 CA GLN A 49 7.480 8.339 6.953 1.00 0.00 C ATOM 715 C GLN A 49 5.990 8.283 7.273 1.00 0.00 C ATOM 716 O GLN A 49 5.424 9.237 7.809 1.00 0.00 O ATOM 717 CB GLN A 49 8.279 8.597 8.232 1.00 0.00 C ATOM 718 CG GLN A 49 8.035 7.566 9.321 1.00 0.00 C ATOM 719 CD GLN A 49 8.943 7.756 10.520 1.00 0.00 C ATOM 720 OE1 GLN A 49 9.917 8.508 10.462 1.00 0.00 O ATOM 721 NE2 GLN A 49 8.629 7.075 11.616 1.00 0.00 N ATOM 0 H GLN A 49 7.203 10.218 6.065 1.00 0.00 H new ATOM 0 HA GLN A 49 7.779 7.378 6.534 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.342 8.612 7.990 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.025 9.585 8.616 1.00 0.00 H new ATOM 0 HG2 GLN A 49 6.996 7.624 9.645 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.186 6.567 8.911 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.813 6.463 11.620 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.204 7.164 12.454 1.00 0.00 H new ATOM 730 N LEU A 50 5.360 7.162 6.941 1.00 0.00 N ATOM 731 CA LEU A 50 3.935 6.982 7.193 1.00 0.00 C ATOM 732 C LEU A 50 3.696 6.399 8.582 1.00 0.00 C ATOM 733 O LEU A 50 4.362 5.447 8.988 1.00 0.00 O ATOM 734 CB LEU A 50 3.321 6.067 6.131 1.00 0.00 C ATOM 735 CG LEU A 50 3.256 6.635 4.713 1.00 0.00 C ATOM 736 CD1 LEU A 50 2.809 5.564 3.730 1.00 0.00 C ATOM 737 CD2 LEU A 50 2.321 7.834 4.660 1.00 0.00 C ATOM 0 H LEU A 50 5.814 6.364 6.497 1.00 0.00 H new ATOM 0 HA LEU A 50 3.456 7.960 7.143 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.894 5.140 6.104 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.310 5.808 6.444 1.00 0.00 H new ATOM 0 HG LEU A 50 4.255 6.967 4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.768 5.986 2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.517 4.736 3.747 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.820 5.202 4.012 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.288 8.225 3.643 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.320 7.528 4.964 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.685 8.609 5.335 1.00 0.00 H new ATOM 749 N GLU A 51 2.741 6.975 9.304 1.00 0.00 N ATOM 750 CA GLU A 51 2.414 6.511 10.648 1.00 0.00 C ATOM 751 C GLU A 51 0.923 6.214 10.773 1.00 0.00 C ATOM 752 O GLU A 51 0.094 6.860 10.132 1.00 0.00 O ATOM 753 CB GLU A 51 2.826 7.556 11.687 1.00 0.00 C ATOM 754 CG GLU A 51 4.331 7.708 11.833 1.00 0.00 C ATOM 755 CD GLU A 51 4.728 9.054 12.408 1.00 0.00 C ATOM 756 OE1 GLU A 51 4.110 9.476 13.408 1.00 0.00 O ATOM 757 OE2 GLU A 51 5.656 9.684 11.859 1.00 0.00 O ATOM 0 H GLU A 51 2.180 7.763 8.982 1.00 0.00 H new ATOM 0 HA GLU A 51 2.967 5.590 10.831 1.00 0.00 H new ATOM 0 HB2 GLU A 51 2.397 8.519 11.411 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.401 7.283 12.653 1.00 0.00 H new ATOM 0 HG2 GLU A 51 4.712 6.915 12.477 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.802 7.580 10.858 1.00 0.00 H new ATOM 764 N PHE A 52 0.589 5.232 11.603 1.00 0.00 N ATOM 765 CA PHE A 52 -0.802 4.847 11.812 1.00 0.00 C ATOM 766 C PHE A 52 -1.064 4.529 13.281 1.00 0.00 C ATOM 767 O PHE A 52 -0.486 3.595 13.836 1.00 0.00 O ATOM 768 CB PHE A 52 -1.154 3.636 10.946 1.00 0.00 C ATOM 769 CG PHE A 52 -2.612 3.275 10.983 1.00 0.00 C ATOM 770 CD1 PHE A 52 -3.544 4.031 10.290 1.00 0.00 C ATOM 771 CD2 PHE A 52 -3.050 2.181 11.710 1.00 0.00 C ATOM 772 CE1 PHE A 52 -4.886 3.702 10.324 1.00 0.00 C ATOM 773 CE2 PHE A 52 -4.391 1.846 11.747 1.00 0.00 C ATOM 774 CZ PHE A 52 -5.310 2.608 11.052 1.00 0.00 C ATOM 0 H PHE A 52 1.263 4.688 12.142 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.432 5.688 11.523 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.865 3.840 9.915 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.567 2.779 11.278 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.218 4.887 9.717 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.335 1.582 12.255 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -5.603 4.300 9.781 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.719 0.990 12.318 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.358 2.349 11.078 1.00 0.00 H new ATOM 784 N GLN A 53 -1.938 5.314 13.904 1.00 0.00 N ATOM 785 CA GLN A 53 -2.275 5.117 15.309 1.00 0.00 C ATOM 786 C GLN A 53 -1.036 5.244 16.189 1.00 0.00 C ATOM 787 O GLN A 53 -0.896 4.539 17.187 1.00 0.00 O ATOM 788 CB GLN A 53 -2.921 3.745 15.513 1.00 0.00 C ATOM 789 CG GLN A 53 -4.366 3.678 15.045 1.00 0.00 C ATOM 790 CD GLN A 53 -5.155 2.589 15.745 1.00 0.00 C ATOM 791 OE1 GLN A 53 -5.288 2.592 16.969 1.00 0.00 O ATOM 792 NE2 GLN A 53 -5.684 1.650 14.970 1.00 0.00 N ATOM 0 H GLN A 53 -2.425 6.092 13.458 1.00 0.00 H new ATOM 0 HA GLN A 53 -2.985 5.892 15.598 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -2.339 2.995 14.977 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -2.878 3.486 16.571 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -4.846 4.640 15.222 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -4.388 3.503 13.969 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -5.549 1.687 13.960 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -6.226 0.892 15.385 1.00 0.00 H new ATOM 801 N GLY A 54 -0.138 6.150 15.811 1.00 0.00 N ATOM 802 CA GLY A 54 1.078 6.353 16.577 1.00 0.00 C ATOM 803 C GLY A 54 2.061 5.210 16.418 1.00 0.00 C ATOM 804 O GLY A 54 2.613 4.717 17.402 1.00 0.00 O ATOM 0 H GLY A 54 -0.231 6.746 14.989 1.00 0.00 H new ATOM 0 HA2 GLY A 54 1.552 7.282 16.261 1.00 0.00 H new ATOM 0 HA3 GLY A 54 0.825 6.467 17.631 1.00 0.00 H new ATOM 808 N GLN A 55 2.278 4.786 15.177 1.00 0.00 N ATOM 809 CA GLN A 55 3.199 3.691 14.895 1.00 0.00 C ATOM 810 C GLN A 55 4.011 3.975 13.635 1.00 0.00 C ATOM 811 O GLN A 55 3.646 4.829 12.828 1.00 0.00 O ATOM 812 CB GLN A 55 2.431 2.378 14.736 1.00 0.00 C ATOM 813 CG GLN A 55 1.462 2.098 15.874 1.00 0.00 C ATOM 814 CD GLN A 55 0.812 0.733 15.765 1.00 0.00 C ATOM 815 OE1 GLN A 55 1.182 -0.202 16.475 1.00 0.00 O ATOM 816 NE2 GLN A 55 -0.163 0.612 14.872 1.00 0.00 N ATOM 0 H GLN A 55 1.829 5.184 14.352 1.00 0.00 H new ATOM 0 HA GLN A 55 3.886 3.601 15.736 1.00 0.00 H new ATOM 0 HB2 GLN A 55 1.878 2.401 13.797 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.144 1.556 14.666 1.00 0.00 H new ATOM 0 HG2 GLN A 55 1.993 2.169 16.823 1.00 0.00 H new ATOM 0 HG3 GLN A 55 0.688 2.865 15.884 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -0.437 1.414 14.305 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.638 -0.283 14.753 1.00 0.00 H new ATOM 825 N VAL A 56 5.115 3.252 13.474 1.00 0.00 N ATOM 826 CA VAL A 56 5.979 3.425 12.312 1.00 0.00 C ATOM 827 C VAL A 56 5.796 2.285 11.317 1.00 0.00 C ATOM 828 O VAL A 56 6.210 1.152 11.570 1.00 0.00 O ATOM 829 CB VAL A 56 7.461 3.502 12.722 1.00 0.00 C ATOM 830 CG1 VAL A 56 8.343 3.710 11.500 1.00 0.00 C ATOM 831 CG2 VAL A 56 7.676 4.611 13.740 1.00 0.00 C ATOM 0 H VAL A 56 5.432 2.541 14.133 1.00 0.00 H new ATOM 0 HA VAL A 56 5.691 4.364 11.840 1.00 0.00 H new ATOM 0 HB VAL A 56 7.741 2.556 13.186 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.387 3.762 11.809 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.210 2.877 10.809 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.065 4.640 11.004 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.729 4.650 14.018 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.379 5.566 13.306 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.074 4.413 14.627 1.00 0.00 H new ATOM 841 N LEU A 57 5.174 2.590 10.183 1.00 0.00 N ATOM 842 CA LEU A 57 4.937 1.591 9.147 1.00 0.00 C ATOM 843 C LEU A 57 6.229 1.252 8.411 1.00 0.00 C ATOM 844 O LEU A 57 6.888 2.131 7.858 1.00 0.00 O ATOM 845 CB LEU A 57 3.888 2.096 8.155 1.00 0.00 C ATOM 846 CG LEU A 57 2.638 2.731 8.764 1.00 0.00 C ATOM 847 CD1 LEU A 57 1.683 3.184 7.671 1.00 0.00 C ATOM 848 CD2 LEU A 57 1.949 1.755 9.706 1.00 0.00 C ATOM 0 H LEU A 57 4.825 3.522 9.958 1.00 0.00 H new ATOM 0 HA LEU A 57 4.567 0.685 9.628 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.360 2.828 7.499 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.578 1.260 7.528 1.00 0.00 H new ATOM 0 HG LEU A 57 2.942 3.606 9.338 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.799 3.633 8.123 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.179 3.918 7.036 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.386 2.325 7.069 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.061 2.224 10.130 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.659 0.861 9.155 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.633 1.480 10.509 1.00 0.00 H new ATOM 860 N GLN A 58 6.584 -0.029 8.408 1.00 0.00 N ATOM 861 CA GLN A 58 7.796 -0.484 7.738 1.00 0.00 C ATOM 862 C GLN A 58 7.568 -0.625 6.237 1.00 0.00 C ATOM 863 O GLN A 58 6.503 -0.281 5.726 1.00 0.00 O ATOM 864 CB GLN A 58 8.257 -1.820 8.324 1.00 0.00 C ATOM 865 CG GLN A 58 8.944 -1.688 9.674 1.00 0.00 C ATOM 866 CD GLN A 58 9.824 -0.457 9.762 1.00 0.00 C ATOM 867 OE1 GLN A 58 10.622 -0.184 8.865 1.00 0.00 O ATOM 868 NE2 GLN A 58 9.684 0.295 10.848 1.00 0.00 N ATOM 0 H GLN A 58 6.049 -0.770 8.862 1.00 0.00 H new ATOM 0 HA GLN A 58 8.573 0.263 7.900 1.00 0.00 H new ATOM 0 HB2 GLN A 58 7.395 -2.479 8.427 1.00 0.00 H new ATOM 0 HB3 GLN A 58 8.941 -2.298 7.623 1.00 0.00 H new ATOM 0 HG2 GLN A 58 8.189 -1.647 10.459 1.00 0.00 H new ATOM 0 HG3 GLN A 58 9.548 -2.576 9.858 1.00 0.00 H new ATOM 0 HE21 GLN A 58 9.010 0.032 11.567 1.00 0.00 H new ATOM 0 HE22 GLN A 58 10.250 1.136 10.963 1.00 0.00 H new ATOM 877 N ASP A 59 8.576 -1.133 5.536 1.00 0.00 N ATOM 878 CA ASP A 59 8.486 -1.321 4.093 1.00 0.00 C ATOM 879 C ASP A 59 8.217 -2.783 3.750 1.00 0.00 C ATOM 880 O ASP A 59 7.379 -3.087 2.902 1.00 0.00 O ATOM 881 CB ASP A 59 9.775 -0.854 3.415 1.00 0.00 C ATOM 882 CG ASP A 59 11.005 -1.133 4.256 1.00 0.00 C ATOM 883 OD1 ASP A 59 11.111 -0.560 5.360 1.00 0.00 O ATOM 884 OD2 ASP A 59 11.861 -1.924 3.809 1.00 0.00 O ATOM 0 H ASP A 59 9.465 -1.422 5.944 1.00 0.00 H new ATOM 0 HA ASP A 59 7.653 -0.722 3.725 1.00 0.00 H new ATOM 0 HB2 ASP A 59 9.877 -1.353 2.451 1.00 0.00 H new ATOM 0 HB3 ASP A 59 9.710 0.216 3.215 1.00 0.00 H new ATOM 889 N TRP A 60 8.933 -3.682 4.416 1.00 0.00 N ATOM 890 CA TRP A 60 8.772 -5.112 4.181 1.00 0.00 C ATOM 891 C TRP A 60 7.520 -5.640 4.873 1.00 0.00 C ATOM 892 O TRP A 60 7.206 -6.828 4.788 1.00 0.00 O ATOM 893 CB TRP A 60 10.003 -5.873 4.677 1.00 0.00 C ATOM 894 CG TRP A 60 9.924 -6.251 6.125 1.00 0.00 C ATOM 895 CD1 TRP A 60 9.357 -7.378 6.648 1.00 0.00 C ATOM 896 CD2 TRP A 60 10.428 -5.500 7.235 1.00 0.00 C ATOM 897 NE1 TRP A 60 9.478 -7.372 8.017 1.00 0.00 N ATOM 898 CE2 TRP A 60 10.131 -6.232 8.401 1.00 0.00 C ATOM 899 CE3 TRP A 60 11.102 -4.282 7.357 1.00 0.00 C ATOM 900 CZ2 TRP A 60 10.485 -5.783 9.671 1.00 0.00 C ATOM 901 CZ3 TRP A 60 11.452 -3.838 8.618 1.00 0.00 C ATOM 902 CH2 TRP A 60 11.145 -4.588 9.761 1.00 0.00 C ATOM 0 H TRP A 60 9.630 -3.446 5.122 1.00 0.00 H new ATOM 0 HA TRP A 60 8.665 -5.269 3.108 1.00 0.00 H new ATOM 0 HB2 TRP A 60 10.128 -6.776 4.079 1.00 0.00 H new ATOM 0 HB3 TRP A 60 10.890 -5.259 4.517 1.00 0.00 H new ATOM 0 HD1 TRP A 60 8.884 -8.159 6.071 1.00 0.00 H new ATOM 0 HE1 TRP A 60 9.136 -8.099 8.645 1.00 0.00 H new ATOM 0 HE3 TRP A 60 11.345 -3.698 6.482 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 10.247 -6.358 10.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 11.971 -2.897 8.724 1.00 0.00 H new ATOM 0 HH2 TRP A 60 11.435 -4.215 10.732 1.00 0.00 H new ATOM 913 N LEU A 61 6.809 -4.751 5.557 1.00 0.00 N ATOM 914 CA LEU A 61 5.589 -5.128 6.264 1.00 0.00 C ATOM 915 C LEU A 61 4.354 -4.798 5.433 1.00 0.00 C ATOM 916 O LEU A 61 4.125 -3.643 5.074 1.00 0.00 O ATOM 917 CB LEU A 61 5.517 -4.412 7.614 1.00 0.00 C ATOM 918 CG LEU A 61 6.493 -4.900 8.685 1.00 0.00 C ATOM 919 CD1 LEU A 61 6.093 -4.369 10.053 1.00 0.00 C ATOM 920 CD2 LEU A 61 6.554 -6.421 8.699 1.00 0.00 C ATOM 0 H LEU A 61 7.055 -3.764 5.637 1.00 0.00 H new ATOM 0 HA LEU A 61 5.613 -6.205 6.432 1.00 0.00 H new ATOM 0 HB2 LEU A 61 5.692 -3.349 7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 61 4.503 -4.512 8.002 1.00 0.00 H new ATOM 0 HG LEU A 61 7.486 -4.519 8.445 1.00 0.00 H new ATOM 0 HD11 LEU A 61 6.799 -4.727 10.803 1.00 0.00 H new ATOM 0 HD12 LEU A 61 6.102 -3.279 10.037 1.00 0.00 H new ATOM 0 HD13 LEU A 61 5.091 -4.720 10.301 1.00 0.00 H new ATOM 0 HD21 LEU A 61 7.254 -6.750 9.467 1.00 0.00 H new ATOM 0 HD22 LEU A 61 5.564 -6.823 8.914 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.888 -6.781 7.726 1.00 0.00 H new ATOM 932 N GLY A 62 3.558 -5.820 5.132 1.00 0.00 N ATOM 933 CA GLY A 62 2.354 -5.616 4.348 1.00 0.00 C ATOM 934 C GLY A 62 1.409 -4.617 4.985 1.00 0.00 C ATOM 935 O GLY A 62 1.741 -3.992 5.993 1.00 0.00 O ATOM 0 H GLY A 62 3.726 -6.785 5.417 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.628 -5.268 3.352 1.00 0.00 H new ATOM 0 HA3 GLY A 62 1.840 -6.569 4.223 1.00 0.00 H new ATOM 939 N LEU A 63 0.227 -4.465 4.397 1.00 0.00 N ATOM 940 CA LEU A 63 -0.770 -3.533 4.913 1.00 0.00 C ATOM 941 C LEU A 63 -1.592 -4.176 6.025 1.00 0.00 C ATOM 942 O LEU A 63 -1.923 -3.530 7.018 1.00 0.00 O ATOM 943 CB LEU A 63 -1.692 -3.066 3.785 1.00 0.00 C ATOM 944 CG LEU A 63 -1.197 -1.877 2.962 1.00 0.00 C ATOM 945 CD1 LEU A 63 -0.228 -2.339 1.884 1.00 0.00 C ATOM 946 CD2 LEU A 63 -2.370 -1.132 2.342 1.00 0.00 C ATOM 0 H LEU A 63 -0.064 -4.975 3.563 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.247 -2.671 5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.860 -3.905 3.110 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.658 -2.806 4.217 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.669 -1.194 3.628 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.113 -1.478 1.309 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.628 -2.827 2.349 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.730 -3.043 1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.999 -0.289 1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.926 -1.806 1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.027 -0.767 3.131 1.00 0.00 H new ATOM 958 N GLY A 64 -1.917 -5.453 5.851 1.00 0.00 N ATOM 959 CA GLY A 64 -2.697 -6.163 6.848 1.00 0.00 C ATOM 960 C GLY A 64 -1.987 -6.249 8.185 1.00 0.00 C ATOM 961 O GLY A 64 -2.630 -6.319 9.233 1.00 0.00 O ATOM 0 H GLY A 64 -1.654 -6.009 5.037 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.655 -5.661 6.980 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.911 -7.169 6.488 1.00 0.00 H new ATOM 965 N ILE A 65 -0.659 -6.245 8.149 1.00 0.00 N ATOM 966 CA ILE A 65 0.138 -6.324 9.367 1.00 0.00 C ATOM 967 C ILE A 65 -0.276 -5.248 10.365 1.00 0.00 C ATOM 968 O ILE A 65 -0.349 -5.498 11.568 1.00 0.00 O ATOM 969 CB ILE A 65 1.642 -6.179 9.067 1.00 0.00 C ATOM 970 CG1 ILE A 65 2.091 -7.252 8.073 1.00 0.00 C ATOM 971 CG2 ILE A 65 2.450 -6.268 10.352 1.00 0.00 C ATOM 972 CD1 ILE A 65 2.029 -8.657 8.632 1.00 0.00 C ATOM 0 H ILE A 65 -0.112 -6.188 7.290 1.00 0.00 H new ATOM 0 HA ILE A 65 -0.044 -7.308 9.800 1.00 0.00 H new ATOM 0 HB ILE A 65 1.816 -5.200 8.620 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.465 -7.196 7.183 1.00 0.00 H new ATOM 0 HG13 ILE A 65 3.113 -7.040 7.758 1.00 0.00 H new ATOM 0 HG21 ILE A 65 3.511 -6.164 10.123 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.145 -5.470 11.030 1.00 0.00 H new ATOM 0 HG23 ILE A 65 2.274 -7.234 10.826 1.00 0.00 H new ATOM 0 HD11 ILE A 65 2.361 -9.365 7.873 1.00 0.00 H new ATOM 0 HD12 ILE A 65 2.677 -8.730 9.505 1.00 0.00 H new ATOM 0 HD13 ILE A 65 1.004 -8.889 8.921 1.00 0.00 H new ATOM 984 N TYR A 66 -0.546 -4.051 9.857 1.00 0.00 N ATOM 985 CA TYR A 66 -0.953 -2.935 10.704 1.00 0.00 C ATOM 986 C TYR A 66 -2.472 -2.799 10.734 1.00 0.00 C ATOM 987 O TYR A 66 -3.005 -1.723 11.002 1.00 0.00 O ATOM 988 CB TYR A 66 -0.322 -1.634 10.206 1.00 0.00 C ATOM 989 CG TYR A 66 1.135 -1.485 10.579 1.00 0.00 C ATOM 990 CD1 TYR A 66 1.523 -1.343 11.905 1.00 0.00 C ATOM 991 CD2 TYR A 66 2.126 -1.489 9.604 1.00 0.00 C ATOM 992 CE1 TYR A 66 2.854 -1.207 12.250 1.00 0.00 C ATOM 993 CE2 TYR A 66 3.459 -1.354 9.939 1.00 0.00 C ATOM 994 CZ TYR A 66 3.818 -1.213 11.264 1.00 0.00 C ATOM 995 OH TYR A 66 5.145 -1.079 11.603 1.00 0.00 O ATOM 0 H TYR A 66 -0.491 -3.828 8.863 1.00 0.00 H new ATOM 0 HA TYR A 66 -0.605 -3.135 11.717 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.417 -1.586 9.121 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.880 -0.791 10.612 1.00 0.00 H new ATOM 0 HD1 TYR A 66 0.771 -1.339 12.680 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.849 -1.600 8.566 1.00 0.00 H new ATOM 0 HE1 TYR A 66 3.138 -1.097 13.286 1.00 0.00 H new ATOM 0 HE2 TYR A 66 4.216 -1.359 9.169 1.00 0.00 H new ATOM 0 HH TYR A 66 5.402 -0.134 11.553 1.00 0.00 H new ATOM 1005 N GLY A 67 -3.164 -3.900 10.457 1.00 0.00 N ATOM 1006 CA GLY A 67 -4.615 -3.884 10.457 1.00 0.00 C ATOM 1007 C GLY A 67 -5.182 -2.731 9.654 1.00 0.00 C ATOM 1008 O GLY A 67 -6.285 -2.256 9.930 1.00 0.00 O ATOM 0 H GLY A 67 -2.745 -4.803 10.233 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.986 -4.824 10.048 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.975 -3.819 11.484 1.00 0.00 H new ATOM 1012 N ILE A 68 -4.428 -2.278 8.658 1.00 0.00 N ATOM 1013 CA ILE A 68 -4.862 -1.172 7.813 1.00 0.00 C ATOM 1014 C ILE A 68 -6.048 -1.578 6.944 1.00 0.00 C ATOM 1015 O ILE A 68 -6.003 -2.595 6.252 1.00 0.00 O ATOM 1016 CB ILE A 68 -3.721 -0.675 6.906 1.00 0.00 C ATOM 1017 CG1 ILE A 68 -2.590 -0.085 7.750 1.00 0.00 C ATOM 1018 CG2 ILE A 68 -4.243 0.354 5.915 1.00 0.00 C ATOM 1019 CD1 ILE A 68 -1.323 0.177 6.964 1.00 0.00 C ATOM 0 H ILE A 68 -3.514 -2.660 8.416 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.163 -0.364 8.480 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.326 -1.522 6.345 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.930 0.849 8.197 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.365 -0.767 8.570 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.425 0.696 5.281 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.018 -0.098 5.296 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.661 1.202 6.457 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.564 0.595 7.626 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.959 -0.758 6.539 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.533 0.883 6.161 1.00 0.00 H new ATOM 1031 N GLN A 69 -7.106 -0.774 6.984 1.00 0.00 N ATOM 1032 CA GLN A 69 -8.303 -1.049 6.199 1.00 0.00 C ATOM 1033 C GLN A 69 -8.554 0.059 5.181 1.00 0.00 C ATOM 1034 O GLN A 69 -7.827 1.052 5.139 1.00 0.00 O ATOM 1035 CB GLN A 69 -9.517 -1.199 7.117 1.00 0.00 C ATOM 1036 CG GLN A 69 -10.014 0.119 7.689 1.00 0.00 C ATOM 1037 CD GLN A 69 -11.213 -0.055 8.600 1.00 0.00 C ATOM 1038 OE1 GLN A 69 -12.359 0.004 8.153 1.00 0.00 O ATOM 1039 NE2 GLN A 69 -10.956 -0.271 9.884 1.00 0.00 N ATOM 0 H GLN A 69 -7.158 0.072 7.551 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.146 -1.983 5.660 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -10.326 -1.672 6.561 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -9.261 -1.868 7.938 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -9.207 0.597 8.244 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -10.278 0.789 6.871 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -9.991 -0.312 10.211 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -11.724 -0.396 10.544 1.00 0.00 H new ATOM 1048 N ASP A 70 -9.586 -0.117 4.364 1.00 0.00 N ATOM 1049 CA ASP A 70 -9.933 0.868 3.347 1.00 0.00 C ATOM 1050 C ASP A 70 -10.491 2.136 3.986 1.00 0.00 C ATOM 1051 O ASP A 70 -10.937 2.119 5.134 1.00 0.00 O ATOM 1052 CB ASP A 70 -10.952 0.285 2.367 1.00 0.00 C ATOM 1053 CG ASP A 70 -12.251 -0.104 3.046 1.00 0.00 C ATOM 1054 OD1 ASP A 70 -12.268 -1.140 3.743 1.00 0.00 O ATOM 1055 OD2 ASP A 70 -13.250 0.627 2.880 1.00 0.00 O ATOM 0 H ASP A 70 -10.197 -0.933 4.386 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.025 1.126 2.803 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.159 1.016 1.585 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -10.523 -0.591 1.880 1.00 0.00 H new ATOM 1060 N SER A 71 -10.463 3.233 3.237 1.00 0.00 N ATOM 1061 CA SER A 71 -10.962 4.510 3.732 1.00 0.00 C ATOM 1062 C SER A 71 -10.248 4.910 5.020 1.00 0.00 C ATOM 1063 O SER A 71 -10.854 5.477 5.929 1.00 0.00 O ATOM 1064 CB SER A 71 -12.470 4.433 3.975 1.00 0.00 C ATOM 1065 OG SER A 71 -13.192 4.652 2.775 1.00 0.00 O ATOM 0 H SER A 71 -10.100 3.263 2.284 1.00 0.00 H new ATOM 0 HA SER A 71 -10.761 5.268 2.975 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.726 3.456 4.384 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.760 5.176 4.718 1.00 0.00 H new ATOM 0 HG SER A 71 -14.153 4.596 2.957 1.00 0.00 H new ATOM 1071 N ASP A 72 -8.955 4.610 5.089 1.00 0.00 N ATOM 1072 CA ASP A 72 -8.156 4.938 6.265 1.00 0.00 C ATOM 1073 C ASP A 72 -7.372 6.228 6.046 1.00 0.00 C ATOM 1074 O ASP A 72 -7.266 6.720 4.922 1.00 0.00 O ATOM 1075 CB ASP A 72 -7.197 3.792 6.591 1.00 0.00 C ATOM 1076 CG ASP A 72 -6.002 3.754 5.659 1.00 0.00 C ATOM 1077 OD1 ASP A 72 -6.163 4.111 4.474 1.00 0.00 O ATOM 1078 OD2 ASP A 72 -4.906 3.367 6.115 1.00 0.00 O ATOM 0 H ASP A 72 -8.438 4.141 4.345 1.00 0.00 H new ATOM 0 HA ASP A 72 -8.834 5.085 7.106 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -6.849 3.894 7.619 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -7.733 2.845 6.529 1.00 0.00 H new ATOM 1083 N THR A 73 -6.825 6.773 7.128 1.00 0.00 N ATOM 1084 CA THR A 73 -6.052 8.006 7.055 1.00 0.00 C ATOM 1085 C THR A 73 -4.612 7.780 7.498 1.00 0.00 C ATOM 1086 O THR A 73 -4.360 7.194 8.552 1.00 0.00 O ATOM 1087 CB THR A 73 -6.678 9.113 7.925 1.00 0.00 C ATOM 1088 OG1 THR A 73 -8.046 9.313 7.555 1.00 0.00 O ATOM 1089 CG2 THR A 73 -5.911 10.418 7.775 1.00 0.00 C ATOM 0 H THR A 73 -6.903 6.379 8.066 1.00 0.00 H new ATOM 0 HA THR A 73 -6.062 8.324 6.012 1.00 0.00 H new ATOM 0 HB THR A 73 -6.627 8.797 8.967 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.437 10.017 8.114 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.371 11.184 8.398 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.877 10.270 8.086 1.00 0.00 H new ATOM 0 HG23 THR A 73 -5.934 10.736 6.733 1.00 0.00 H new ATOM 1097 N LEU A 74 -3.668 8.248 6.688 1.00 0.00 N ATOM 1098 CA LEU A 74 -2.251 8.098 6.998 1.00 0.00 C ATOM 1099 C LEU A 74 -1.549 9.452 7.012 1.00 0.00 C ATOM 1100 O LEU A 74 -1.684 10.241 6.076 1.00 0.00 O ATOM 1101 CB LEU A 74 -1.581 7.174 5.979 1.00 0.00 C ATOM 1102 CG LEU A 74 -2.261 5.824 5.748 1.00 0.00 C ATOM 1103 CD1 LEU A 74 -1.651 5.118 4.547 1.00 0.00 C ATOM 1104 CD2 LEU A 74 -2.155 4.954 6.992 1.00 0.00 C ATOM 0 H LEU A 74 -3.859 8.734 5.812 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.167 7.656 7.991 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.525 7.698 5.025 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.556 6.991 6.303 1.00 0.00 H new ATOM 0 HG LEU A 74 -3.317 6.001 5.542 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -2.147 4.159 4.398 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.780 5.735 3.658 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.588 4.953 4.723 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.644 3.997 6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.105 4.785 7.229 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -2.640 5.456 7.829 1.00 0.00 H new ATOM 1116 N ILE A 75 -0.799 9.713 8.077 1.00 0.00 N ATOM 1117 CA ILE A 75 -0.074 10.971 8.210 1.00 0.00 C ATOM 1118 C ILE A 75 1.303 10.883 7.561 1.00 0.00 C ATOM 1119 O ILE A 75 1.964 9.845 7.620 1.00 0.00 O ATOM 1120 CB ILE A 75 0.092 11.371 9.688 1.00 0.00 C ATOM 1121 CG1 ILE A 75 -1.236 11.217 10.433 1.00 0.00 C ATOM 1122 CG2 ILE A 75 0.604 12.800 9.796 1.00 0.00 C ATOM 1123 CD1 ILE A 75 -2.304 12.183 9.970 1.00 0.00 C ATOM 0 H ILE A 75 -0.677 9.071 8.860 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.665 11.732 7.700 1.00 0.00 H new ATOM 0 HB ILE A 75 0.824 10.708 10.149 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.599 10.197 10.304 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.064 11.362 11.500 1.00 0.00 H new ATOM 0 HG21 ILE A 75 0.716 13.068 10.847 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.569 12.879 9.296 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.106 13.478 9.323 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -3.217 12.017 10.541 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -1.961 13.206 10.124 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.504 12.023 8.911 1.00 0.00 H new ATOM 1135 N LEU A 76 1.731 11.979 6.944 1.00 0.00 N ATOM 1136 CA LEU A 76 3.031 12.027 6.285 1.00 0.00 C ATOM 1137 C LEU A 76 3.927 13.084 6.924 1.00 0.00 C ATOM 1138 O LEU A 76 3.531 14.240 7.071 1.00 0.00 O ATOM 1139 CB LEU A 76 2.858 12.322 4.794 1.00 0.00 C ATOM 1140 CG LEU A 76 4.143 12.373 3.966 1.00 0.00 C ATOM 1141 CD1 LEU A 76 4.645 10.967 3.672 1.00 0.00 C ATOM 1142 CD2 LEU A 76 3.915 13.141 2.673 1.00 0.00 C ATOM 0 H LEU A 76 1.197 12.846 6.886 1.00 0.00 H new ATOM 0 HA LEU A 76 3.507 11.054 6.404 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.204 11.561 4.367 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.345 13.278 4.690 1.00 0.00 H new ATOM 0 HG LEU A 76 4.905 12.895 4.545 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.560 11.023 3.082 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.849 10.450 4.610 1.00 0.00 H new ATOM 0 HD13 LEU A 76 3.886 10.419 3.113 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.840 13.167 2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.138 12.648 2.089 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.603 14.159 2.905 1.00 0.00 H new ATOM 1154 N SER A 77 5.136 12.679 7.300 1.00 0.00 N ATOM 1155 CA SER A 77 6.087 13.590 7.924 1.00 0.00 C ATOM 1156 C SER A 77 7.512 13.278 7.477 1.00 0.00 C ATOM 1157 O SER A 77 7.939 12.123 7.484 1.00 0.00 O ATOM 1158 CB SER A 77 5.987 13.500 9.448 1.00 0.00 C ATOM 1159 OG SER A 77 4.691 13.856 9.896 1.00 0.00 O ATOM 0 H SER A 77 5.480 11.726 7.183 1.00 0.00 H new ATOM 0 HA SER A 77 5.840 14.604 7.610 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.221 12.486 9.772 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.726 14.159 9.904 1.00 0.00 H new ATOM 0 HG SER A 77 4.653 13.789 10.873 1.00 0.00 H new ATOM 1165 N LYS A 78 8.244 14.316 7.088 1.00 0.00 N ATOM 1166 CA LYS A 78 9.622 14.156 6.638 1.00 0.00 C ATOM 1167 C LYS A 78 10.560 13.950 7.823 1.00 0.00 C ATOM 1168 O LYS A 78 10.369 14.534 8.890 1.00 0.00 O ATOM 1169 CB LYS A 78 10.063 15.380 5.833 1.00 0.00 C ATOM 1170 CG LYS A 78 10.189 16.644 6.666 1.00 0.00 C ATOM 1171 CD LYS A 78 10.211 17.887 5.793 1.00 0.00 C ATOM 1172 CE LYS A 78 11.436 17.915 4.892 1.00 0.00 C ATOM 1173 NZ LYS A 78 12.611 18.526 5.573 1.00 0.00 N ATOM 0 H LYS A 78 7.906 15.278 7.075 1.00 0.00 H new ATOM 0 HA LYS A 78 9.669 13.273 6.001 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.023 15.168 5.362 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.346 15.554 5.030 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.355 16.704 7.366 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.102 16.600 7.261 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.309 17.920 5.183 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.202 18.776 6.424 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.683 16.899 4.583 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.208 18.477 3.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.425 18.527 4.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.385 19.504 5.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 12.845 17.975 6.423 1.00 0.00 H new ATOM 1187 N LYS A 79 11.576 13.116 7.629 1.00 0.00 N ATOM 1188 CA LYS A 79 12.547 12.834 8.680 1.00 0.00 C ATOM 1189 C LYS A 79 13.384 14.070 8.993 1.00 0.00 C ATOM 1190 O LYS A 79 13.815 14.786 8.089 1.00 0.00 O ATOM 1191 CB LYS A 79 13.460 11.678 8.262 1.00 0.00 C ATOM 1192 CG LYS A 79 12.709 10.477 7.716 1.00 0.00 C ATOM 1193 CD LYS A 79 13.450 9.180 7.997 1.00 0.00 C ATOM 1194 CE LYS A 79 12.604 7.967 7.647 1.00 0.00 C ATOM 1195 NZ LYS A 79 13.353 6.694 7.837 1.00 0.00 N ATOM 0 H LYS A 79 11.749 12.623 6.753 1.00 0.00 H new ATOM 0 HA LYS A 79 12.000 12.550 9.579 1.00 0.00 H new ATOM 0 HB2 LYS A 79 14.159 12.034 7.505 1.00 0.00 H new ATOM 0 HB3 LYS A 79 14.053 11.365 9.122 1.00 0.00 H new ATOM 0 HG2 LYS A 79 11.716 10.434 8.163 1.00 0.00 H new ATOM 0 HG3 LYS A 79 12.570 10.592 6.641 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.376 9.157 7.422 1.00 0.00 H new ATOM 0 HD3 LYS A 79 13.728 9.139 9.050 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.708 7.957 8.268 1.00 0.00 H new ATOM 0 HE3 LYS A 79 12.273 8.042 6.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 12.741 5.891 7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 14.194 6.692 7.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 13.647 6.609 8.831 1.00 0.00 H new ATOM 1209 N LYS A 80 13.614 14.313 10.279 1.00 0.00 N ATOM 1210 CA LYS A 80 14.402 15.460 10.712 1.00 0.00 C ATOM 1211 C LYS A 80 15.884 15.108 10.779 1.00 0.00 C ATOM 1212 O LYS A 80 16.367 14.603 11.792 1.00 0.00 O ATOM 1213 CB LYS A 80 13.920 15.949 12.080 1.00 0.00 C ATOM 1214 CG LYS A 80 14.113 17.440 12.296 1.00 0.00 C ATOM 1215 CD LYS A 80 15.467 17.744 12.914 1.00 0.00 C ATOM 1216 CE LYS A 80 15.403 17.727 14.433 1.00 0.00 C ATOM 1217 NZ LYS A 80 14.518 18.800 14.964 1.00 0.00 N ATOM 0 H LYS A 80 13.265 13.730 11.040 1.00 0.00 H new ATOM 0 HA LYS A 80 14.269 16.257 9.981 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.863 15.708 12.191 1.00 0.00 H new ATOM 0 HB3 LYS A 80 14.454 15.405 12.860 1.00 0.00 H new ATOM 0 HG2 LYS A 80 14.022 17.961 11.343 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.323 17.820 12.944 1.00 0.00 H new ATOM 0 HD2 LYS A 80 16.197 17.011 12.571 1.00 0.00 H new ATOM 0 HD3 LYS A 80 15.812 18.721 12.574 1.00 0.00 H new ATOM 0 HE2 LYS A 80 15.039 16.756 14.770 1.00 0.00 H new ATOM 0 HE3 LYS A 80 16.407 17.850 14.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 14.828 19.064 15.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 14.569 19.632 14.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 13.538 18.455 15.001 1.00 0.00 H new ATOM 1231 N GLY A 81 16.603 15.379 9.693 1.00 0.00 N ATOM 1232 CA GLY A 81 18.023 15.085 9.651 1.00 0.00 C ATOM 1233 C GLY A 81 18.310 13.598 9.728 1.00 0.00 C ATOM 1234 O GLY A 81 17.437 12.808 10.087 1.00 0.00 O ATOM 0 H GLY A 81 16.227 15.797 8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.447 15.487 8.731 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.520 15.591 10.478 1.00 0.00 H new ATOM 1238 N SER A 82 19.537 13.215 9.388 1.00 0.00 N ATOM 1239 CA SER A 82 19.935 11.813 9.415 1.00 0.00 C ATOM 1240 C SER A 82 21.357 11.662 9.945 1.00 0.00 C ATOM 1241 O SER A 82 22.163 12.588 9.866 1.00 0.00 O ATOM 1242 CB SER A 82 19.832 11.205 8.015 1.00 0.00 C ATOM 1243 OG SER A 82 20.628 11.923 7.088 1.00 0.00 O ATOM 0 H SER A 82 20.272 13.856 9.091 1.00 0.00 H new ATOM 0 HA SER A 82 19.259 11.281 10.085 1.00 0.00 H new ATOM 0 HB2 SER A 82 20.151 10.163 8.043 1.00 0.00 H new ATOM 0 HB3 SER A 82 18.792 11.211 7.688 1.00 0.00 H new ATOM 0 HG SER A 82 20.547 11.514 6.201 1.00 0.00 H new ATOM 1249 N GLY A 83 21.659 10.485 10.485 1.00 0.00 N ATOM 1250 CA GLY A 83 22.984 10.233 11.021 1.00 0.00 C ATOM 1251 C GLY A 83 23.577 8.934 10.512 1.00 0.00 C ATOM 1252 O GLY A 83 23.622 7.928 11.221 1.00 0.00 O ATOM 0 H GLY A 83 21.010 9.702 10.561 1.00 0.00 H new ATOM 0 HA2 GLY A 83 23.644 11.059 10.755 1.00 0.00 H new ATOM 0 HA3 GLY A 83 22.933 10.204 12.109 1.00 0.00 H new ATOM 1256 N PRO A 84 24.045 8.944 9.255 1.00 0.00 N ATOM 1257 CA PRO A 84 24.645 7.765 8.624 1.00 0.00 C ATOM 1258 C PRO A 84 25.999 7.410 9.229 1.00 0.00 C ATOM 1259 O PRO A 84 26.328 6.235 9.393 1.00 0.00 O ATOM 1260 CB PRO A 84 24.807 8.188 7.162 1.00 0.00 C ATOM 1261 CG PRO A 84 24.894 9.675 7.206 1.00 0.00 C ATOM 1262 CD PRO A 84 24.023 10.107 8.353 1.00 0.00 C ATOM 0 HA PRO A 84 24.031 6.874 8.758 1.00 0.00 H new ATOM 0 HB2 PRO A 84 25.703 7.752 6.720 1.00 0.00 H new ATOM 0 HB3 PRO A 84 23.961 7.858 6.558 1.00 0.00 H new ATOM 0 HG2 PRO A 84 25.923 10.001 7.353 1.00 0.00 H new ATOM 0 HG3 PRO A 84 24.551 10.114 6.269 1.00 0.00 H new ATOM 0 HD2 PRO A 84 24.414 11.001 8.840 1.00 0.00 H new ATOM 0 HD3 PRO A 84 23.011 10.341 8.023 1.00 0.00 H new ATOM 1270 N SER A 85 26.781 8.433 9.558 1.00 0.00 N ATOM 1271 CA SER A 85 28.102 8.229 10.142 1.00 0.00 C ATOM 1272 C SER A 85 28.001 7.475 11.465 1.00 0.00 C ATOM 1273 O SER A 85 27.872 8.081 12.529 1.00 0.00 O ATOM 1274 CB SER A 85 28.800 9.573 10.360 1.00 0.00 C ATOM 1275 OG SER A 85 30.202 9.406 10.477 1.00 0.00 O ATOM 0 H SER A 85 26.523 9.412 9.430 1.00 0.00 H new ATOM 0 HA SER A 85 28.691 7.631 9.447 1.00 0.00 H new ATOM 0 HB2 SER A 85 28.578 10.241 9.528 1.00 0.00 H new ATOM 0 HB3 SER A 85 28.411 10.047 11.261 1.00 0.00 H new ATOM 0 HG SER A 85 30.625 10.279 10.614 1.00 0.00 H new ATOM 1281 N SER A 86 28.059 6.149 11.389 1.00 0.00 N ATOM 1282 CA SER A 86 27.970 5.311 12.579 1.00 0.00 C ATOM 1283 C SER A 86 29.330 5.188 13.259 1.00 0.00 C ATOM 1284 O SER A 86 30.371 5.255 12.607 1.00 0.00 O ATOM 1285 CB SER A 86 27.443 3.922 12.212 1.00 0.00 C ATOM 1286 OG SER A 86 28.404 3.191 11.471 1.00 0.00 O ATOM 0 H SER A 86 28.167 5.632 10.516 1.00 0.00 H new ATOM 0 HA SER A 86 27.276 5.783 13.275 1.00 0.00 H new ATOM 0 HB2 SER A 86 27.187 3.376 13.120 1.00 0.00 H new ATOM 0 HB3 SER A 86 26.527 4.020 11.629 1.00 0.00 H new ATOM 0 HG SER A 86 28.044 2.307 11.250 1.00 0.00 H new ATOM 1292 N GLY A 87 29.312 5.006 14.576 1.00 0.00 N ATOM 1293 CA GLY A 87 30.549 4.876 15.324 1.00 0.00 C ATOM 1294 C GLY A 87 30.555 5.719 16.584 1.00 0.00 C ATOM 1295 O GLY A 87 31.614 6.005 17.142 1.00 0.00 O ATOM 0 H GLY A 87 28.463 4.946 15.138 1.00 0.00 H new ATOM 0 HA2 GLY A 87 30.701 3.830 15.590 1.00 0.00 H new ATOM 0 HA3 GLY A 87 31.386 5.169 14.690 1.00 0.00 H new TER 1299 GLY A 87