USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 555 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 139 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0517 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -2.31! C(o=-2.3!,f=-4.3!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0.0542 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 155:sc= -0.434 (180deg=-2.06!) USER MOD Single : A 111 THR OG1 : rot 89:sc= 0.646 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 ASN :FLIP amide:sc= 0.727 F(o=-0.21,f=0.73) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 80 176.437 15.614 -9.997 1.00 0.00 N ATOM 2 CA LYS A 80 176.609 16.147 -8.615 1.00 0.00 C ATOM 3 C LYS A 80 175.420 15.740 -7.741 1.00 0.00 C ATOM 4 O LYS A 80 174.373 16.357 -7.760 1.00 0.00 O ATOM 5 CB LYS A 80 176.659 17.667 -8.782 1.00 0.00 C ATOM 6 CG LYS A 80 177.081 18.312 -7.460 1.00 0.00 C ATOM 7 CD LYS A 80 177.199 19.826 -7.647 1.00 0.00 C ATOM 8 CE LYS A 80 178.009 20.424 -6.494 1.00 0.00 C ATOM 9 NZ LYS A 80 176.993 20.956 -5.545 1.00 0.00 N ATOM 0 HA LYS A 80 177.505 15.761 -8.130 1.00 0.00 H new ATOM 0 HB2 LYS A 80 177.363 17.934 -9.570 1.00 0.00 H new ATOM 0 HB3 LYS A 80 175.682 18.042 -9.087 1.00 0.00 H new ATOM 0 HG2 LYS A 80 176.350 18.086 -6.683 1.00 0.00 H new ATOM 0 HG3 LYS A 80 178.035 17.900 -7.130 1.00 0.00 H new ATOM 0 HD2 LYS A 80 177.682 20.049 -8.598 1.00 0.00 H new ATOM 0 HD3 LYS A 80 176.207 20.277 -7.680 1.00 0.00 H new ATOM 0 HE2 LYS A 80 178.636 19.669 -6.019 1.00 0.00 H new ATOM 0 HE3 LYS A 80 178.672 21.214 -6.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 177.472 21.383 -4.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 176.416 21.677 -6.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 176.380 20.180 -5.222 1.00 0.00 H new ATOM 23 N ALA A 81 175.592 14.694 -6.978 1.00 0.00 N ATOM 24 CA ALA A 81 174.505 14.201 -6.085 1.00 0.00 C ATOM 25 C ALA A 81 174.877 14.435 -4.618 1.00 0.00 C ATOM 26 O ALA A 81 176.042 14.531 -4.278 1.00 0.00 O ATOM 27 CB ALA A 81 174.429 12.700 -6.370 1.00 0.00 C ATOM 0 H ALA A 81 176.455 14.152 -6.936 1.00 0.00 H new ATOM 0 HA ALA A 81 173.558 14.712 -6.262 1.00 0.00 H new ATOM 0 HB1 ALA A 81 173.650 12.251 -5.753 1.00 0.00 H new ATOM 0 HB2 ALA A 81 174.195 12.541 -7.423 1.00 0.00 H new ATOM 0 HB3 ALA A 81 175.388 12.237 -6.138 1.00 0.00 H new ATOM 33 N LYS A 82 173.901 14.537 -3.751 1.00 0.00 N ATOM 34 CA LYS A 82 174.199 14.779 -2.311 1.00 0.00 C ATOM 35 C LYS A 82 174.065 13.489 -1.504 1.00 0.00 C ATOM 36 O LYS A 82 173.425 12.541 -1.916 1.00 0.00 O ATOM 37 CB LYS A 82 173.155 15.800 -1.860 1.00 0.00 C ATOM 38 CG LYS A 82 173.451 17.155 -2.504 1.00 0.00 C ATOM 39 CD LYS A 82 172.366 18.158 -2.105 1.00 0.00 C ATOM 40 CE LYS A 82 172.751 19.563 -2.587 1.00 0.00 C ATOM 41 NZ LYS A 82 172.902 20.373 -1.345 1.00 0.00 N ATOM 0 H LYS A 82 172.910 14.463 -3.981 1.00 0.00 H new ATOM 0 HA LYS A 82 175.218 15.135 -2.161 1.00 0.00 H new ATOM 0 HB2 LYS A 82 172.157 15.463 -2.141 1.00 0.00 H new ATOM 0 HB3 LYS A 82 173.167 15.892 -0.774 1.00 0.00 H new ATOM 0 HG2 LYS A 82 174.429 17.515 -2.185 1.00 0.00 H new ATOM 0 HG3 LYS A 82 173.487 17.054 -3.589 1.00 0.00 H new ATOM 0 HD2 LYS A 82 171.410 17.865 -2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 82 172.238 18.158 -1.022 1.00 0.00 H new ATOM 0 HE2 LYS A 82 173.678 19.543 -3.159 1.00 0.00 H new ATOM 0 HE3 LYS A 82 171.983 19.980 -3.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 173.165 21.347 -1.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 172.002 20.381 -0.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 173.644 19.957 -0.747 1.00 0.00 H new ATOM 55 N THR A 83 174.676 13.466 -0.344 1.00 0.00 N ATOM 56 CA THR A 83 174.608 12.254 0.536 1.00 0.00 C ATOM 57 C THR A 83 173.141 11.835 0.712 1.00 0.00 C ATOM 58 O THR A 83 172.824 10.675 0.869 1.00 0.00 O ATOM 59 CB THR A 83 175.213 12.691 1.871 1.00 0.00 C ATOM 60 OG1 THR A 83 176.368 13.482 1.628 1.00 0.00 O ATOM 61 CG2 THR A 83 175.601 11.457 2.689 1.00 0.00 C ATOM 0 H THR A 83 175.223 14.239 0.034 1.00 0.00 H new ATOM 0 HA THR A 83 175.143 11.400 0.120 1.00 0.00 H new ATOM 0 HB THR A 83 174.480 13.276 2.427 1.00 0.00 H new ATOM 0 HG1 THR A 83 176.757 13.765 2.482 1.00 0.00 H new ATOM 0 HG21 THR A 83 176.032 11.771 3.640 1.00 0.00 H new ATOM 0 HG22 THR A 83 174.715 10.850 2.875 1.00 0.00 H new ATOM 0 HG23 THR A 83 176.333 10.869 2.136 1.00 0.00 H new ATOM 69 N GLU A 84 172.255 12.795 0.673 1.00 0.00 N ATOM 70 CA GLU A 84 170.793 12.510 0.822 1.00 0.00 C ATOM 71 C GLU A 84 170.338 11.423 -0.159 1.00 0.00 C ATOM 72 O GLU A 84 169.509 10.594 0.165 1.00 0.00 O ATOM 73 CB GLU A 84 170.107 13.835 0.478 1.00 0.00 C ATOM 74 CG GLU A 84 170.379 14.855 1.585 1.00 0.00 C ATOM 75 CD GLU A 84 169.743 16.199 1.219 1.00 0.00 C ATOM 76 OE1 GLU A 84 168.731 16.191 0.535 1.00 0.00 O ATOM 77 OE2 GLU A 84 170.275 17.217 1.631 1.00 0.00 O ATOM 0 H GLU A 84 172.484 13.780 0.542 1.00 0.00 H new ATOM 0 HA GLU A 84 170.552 12.150 1.822 1.00 0.00 H new ATOM 0 HB2 GLU A 84 170.477 14.211 -0.476 1.00 0.00 H new ATOM 0 HB3 GLU A 84 169.034 13.682 0.366 1.00 0.00 H new ATOM 0 HG2 GLU A 84 169.973 14.496 2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 84 171.453 14.976 1.724 1.00 0.00 H new ATOM 84 N ASP A 85 170.873 11.427 -1.353 1.00 0.00 N ATOM 85 CA ASP A 85 170.471 10.394 -2.359 1.00 0.00 C ATOM 86 C ASP A 85 170.803 8.996 -1.830 1.00 0.00 C ATOM 87 O ASP A 85 169.977 8.103 -1.839 1.00 0.00 O ATOM 88 CB ASP A 85 171.295 10.709 -3.611 1.00 0.00 C ATOM 89 CG ASP A 85 170.925 9.730 -4.729 1.00 0.00 C ATOM 90 OD1 ASP A 85 169.752 9.421 -4.854 1.00 0.00 O ATOM 91 OD2 ASP A 85 171.822 9.306 -5.439 1.00 0.00 O ATOM 0 H ASP A 85 171.569 12.099 -1.676 1.00 0.00 H new ATOM 0 HA ASP A 85 169.401 10.412 -2.568 1.00 0.00 H new ATOM 0 HB2 ASP A 85 171.108 11.733 -3.934 1.00 0.00 H new ATOM 0 HB3 ASP A 85 172.359 10.635 -3.386 1.00 0.00 H new ATOM 96 N PHE A 86 172.012 8.810 -1.373 1.00 0.00 N ATOM 97 CA PHE A 86 172.427 7.479 -0.837 1.00 0.00 C ATOM 98 C PHE A 86 171.840 7.244 0.561 1.00 0.00 C ATOM 99 O PHE A 86 171.435 6.144 0.889 1.00 0.00 O ATOM 100 CB PHE A 86 173.959 7.535 -0.768 1.00 0.00 C ATOM 101 CG PHE A 86 174.548 6.808 -1.956 1.00 0.00 C ATOM 102 CD1 PHE A 86 174.206 5.472 -2.193 1.00 0.00 C ATOM 103 CD2 PHE A 86 175.430 7.467 -2.821 1.00 0.00 C ATOM 104 CE1 PHE A 86 174.743 4.794 -3.293 1.00 0.00 C ATOM 105 CE2 PHE A 86 175.967 6.790 -3.923 1.00 0.00 C ATOM 106 CZ PHE A 86 175.624 5.453 -4.159 1.00 0.00 C ATOM 0 H PHE A 86 172.736 9.528 -1.347 1.00 0.00 H new ATOM 0 HA PHE A 86 172.071 6.663 -1.466 1.00 0.00 H new ATOM 0 HB2 PHE A 86 174.295 8.572 -0.760 1.00 0.00 H new ATOM 0 HB3 PHE A 86 174.308 7.080 0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 86 173.526 4.963 -1.526 1.00 0.00 H new ATOM 0 HD2 PHE A 86 175.696 8.498 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE A 86 174.478 3.763 -3.474 1.00 0.00 H new ATOM 0 HE2 PHE A 86 176.646 7.299 -4.591 1.00 0.00 H new ATOM 0 HZ PHE A 86 176.039 4.931 -5.008 1.00 0.00 H new ATOM 116 N VAL A 87 171.816 8.256 1.395 1.00 0.00 N ATOM 117 CA VAL A 87 171.282 8.072 2.783 1.00 0.00 C ATOM 118 C VAL A 87 169.804 7.662 2.743 1.00 0.00 C ATOM 119 O VAL A 87 169.396 6.713 3.386 1.00 0.00 O ATOM 120 CB VAL A 87 171.446 9.443 3.457 1.00 0.00 C ATOM 121 CG1 VAL A 87 170.907 9.389 4.890 1.00 0.00 C ATOM 122 CG2 VAL A 87 172.933 9.819 3.489 1.00 0.00 C ATOM 0 H VAL A 87 172.141 9.198 1.177 1.00 0.00 H new ATOM 0 HA VAL A 87 171.808 7.285 3.323 1.00 0.00 H new ATOM 0 HB VAL A 87 170.888 10.189 2.891 1.00 0.00 H new ATOM 0 HG11 VAL A 87 171.027 10.365 5.361 1.00 0.00 H new ATOM 0 HG12 VAL A 87 169.850 9.122 4.871 1.00 0.00 H new ATOM 0 HG13 VAL A 87 171.460 8.641 5.459 1.00 0.00 H new ATOM 0 HG21 VAL A 87 173.052 10.791 3.967 1.00 0.00 H new ATOM 0 HG22 VAL A 87 173.486 9.068 4.052 1.00 0.00 H new ATOM 0 HG23 VAL A 87 173.319 9.865 2.471 1.00 0.00 H new ATOM 132 N LYS A 88 169.002 8.382 2.000 1.00 0.00 N ATOM 133 CA LYS A 88 167.542 8.056 1.921 1.00 0.00 C ATOM 134 C LYS A 88 167.330 6.639 1.385 1.00 0.00 C ATOM 135 O LYS A 88 166.400 5.955 1.763 1.00 0.00 O ATOM 136 CB LYS A 88 166.952 9.081 0.949 1.00 0.00 C ATOM 137 CG LYS A 88 166.601 10.364 1.706 1.00 0.00 C ATOM 138 CD LYS A 88 165.178 10.256 2.256 1.00 0.00 C ATOM 139 CE LYS A 88 164.715 11.629 2.750 1.00 0.00 C ATOM 140 NZ LYS A 88 163.574 11.344 3.664 1.00 0.00 N ATOM 0 H LYS A 88 169.295 9.184 1.442 1.00 0.00 H new ATOM 0 HA LYS A 88 167.068 8.097 2.902 1.00 0.00 H new ATOM 0 HB2 LYS A 88 167.667 9.299 0.156 1.00 0.00 H new ATOM 0 HB3 LYS A 88 166.061 8.673 0.471 1.00 0.00 H new ATOM 0 HG2 LYS A 88 167.307 10.523 2.521 1.00 0.00 H new ATOM 0 HG3 LYS A 88 166.682 11.225 1.042 1.00 0.00 H new ATOM 0 HD2 LYS A 88 164.504 9.890 1.481 1.00 0.00 H new ATOM 0 HD3 LYS A 88 165.146 9.534 3.072 1.00 0.00 H new ATOM 0 HE2 LYS A 88 165.517 12.152 3.271 1.00 0.00 H new ATOM 0 HE3 LYS A 88 164.407 12.264 1.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 163.202 12.238 4.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 162.823 10.852 3.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 163.899 10.743 4.448 1.00 0.00 H new ATOM 154 N ALA A 89 168.178 6.209 0.492 1.00 0.00 N ATOM 155 CA ALA A 89 168.028 4.844 -0.101 1.00 0.00 C ATOM 156 C ALA A 89 168.150 3.749 0.964 1.00 0.00 C ATOM 157 O ALA A 89 167.306 2.876 1.055 1.00 0.00 O ATOM 158 CB ALA A 89 169.163 4.722 -1.118 1.00 0.00 C ATOM 0 H ALA A 89 168.973 6.745 0.144 1.00 0.00 H new ATOM 0 HA ALA A 89 167.045 4.718 -0.555 1.00 0.00 H new ATOM 0 HB1 ALA A 89 169.119 3.744 -1.596 1.00 0.00 H new ATOM 0 HB2 ALA A 89 169.060 5.501 -1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 89 170.121 4.835 -0.610 1.00 0.00 H new ATOM 164 N PHE A 90 169.194 3.769 1.753 1.00 0.00 N ATOM 165 CA PHE A 90 169.370 2.707 2.792 1.00 0.00 C ATOM 166 C PHE A 90 168.464 2.943 4.007 1.00 0.00 C ATOM 167 O PHE A 90 167.740 2.063 4.430 1.00 0.00 O ATOM 168 CB PHE A 90 170.841 2.794 3.203 1.00 0.00 C ATOM 169 CG PHE A 90 171.698 2.116 2.163 1.00 0.00 C ATOM 170 CD1 PHE A 90 172.199 2.845 1.078 1.00 0.00 C ATOM 171 CD2 PHE A 90 171.991 0.754 2.285 1.00 0.00 C ATOM 172 CE1 PHE A 90 172.995 2.212 0.117 1.00 0.00 C ATOM 173 CE2 PHE A 90 172.787 0.120 1.325 1.00 0.00 C ATOM 174 CZ PHE A 90 173.289 0.849 0.240 1.00 0.00 C ATOM 0 H PHE A 90 169.931 4.473 1.724 1.00 0.00 H new ATOM 0 HA PHE A 90 169.100 1.726 2.402 1.00 0.00 H new ATOM 0 HB2 PHE A 90 171.138 3.837 3.310 1.00 0.00 H new ATOM 0 HB3 PHE A 90 170.986 2.320 4.174 1.00 0.00 H new ATOM 0 HD1 PHE A 90 171.971 3.896 0.983 1.00 0.00 H new ATOM 0 HD2 PHE A 90 171.602 0.191 3.121 1.00 0.00 H new ATOM 0 HE1 PHE A 90 173.382 2.775 -0.719 1.00 0.00 H new ATOM 0 HE2 PHE A 90 173.014 -0.931 1.421 1.00 0.00 H new ATOM 0 HZ PHE A 90 173.903 0.360 -0.502 1.00 0.00 H new ATOM 184 N GLN A 91 168.552 4.103 4.606 1.00 0.00 N ATOM 185 CA GLN A 91 167.758 4.389 5.848 1.00 0.00 C ATOM 186 C GLN A 91 166.278 3.999 5.716 1.00 0.00 C ATOM 187 O GLN A 91 165.684 3.551 6.680 1.00 0.00 O ATOM 188 CB GLN A 91 167.895 5.894 6.075 1.00 0.00 C ATOM 189 CG GLN A 91 169.254 6.192 6.710 1.00 0.00 C ATOM 190 CD GLN A 91 169.264 7.625 7.244 1.00 0.00 C ATOM 191 OE1 GLN A 91 168.820 8.539 6.578 1.00 0.00 O ATOM 192 NE2 GLN A 91 169.756 7.863 8.430 1.00 0.00 N ATOM 0 H GLN A 91 169.143 4.872 4.289 1.00 0.00 H new ATOM 0 HA GLN A 91 168.135 3.799 6.683 1.00 0.00 H new ATOM 0 HB2 GLN A 91 167.800 6.426 5.128 1.00 0.00 H new ATOM 0 HB3 GLN A 91 167.093 6.249 6.722 1.00 0.00 H new ATOM 0 HG2 GLN A 91 169.451 5.489 7.520 1.00 0.00 H new ATOM 0 HG3 GLN A 91 170.048 6.061 5.974 1.00 0.00 H new ATOM 0 HE21 GLN A 91 170.129 7.097 8.990 1.00 0.00 H new ATOM 0 HE22 GLN A 91 169.767 8.815 8.796 1.00 0.00 H new ATOM 201 N VAL A 92 165.666 4.150 4.561 1.00 0.00 N ATOM 202 CA VAL A 92 164.220 3.761 4.447 1.00 0.00 C ATOM 203 C VAL A 92 164.076 2.259 4.754 1.00 0.00 C ATOM 204 O VAL A 92 163.066 1.810 5.261 1.00 0.00 O ATOM 205 CB VAL A 92 163.808 4.091 3.008 1.00 0.00 C ATOM 206 CG1 VAL A 92 162.366 3.637 2.760 1.00 0.00 C ATOM 207 CG2 VAL A 92 163.899 5.603 2.792 1.00 0.00 C ATOM 0 H VAL A 92 166.093 4.517 3.711 1.00 0.00 H new ATOM 0 HA VAL A 92 163.582 4.294 5.152 1.00 0.00 H new ATOM 0 HB VAL A 92 164.474 3.573 2.317 1.00 0.00 H new ATOM 0 HG11 VAL A 92 162.081 3.875 1.735 1.00 0.00 H new ATOM 0 HG12 VAL A 92 162.291 2.561 2.917 1.00 0.00 H new ATOM 0 HG13 VAL A 92 161.699 4.152 3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 92 163.607 5.843 1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 92 163.232 6.111 3.489 1.00 0.00 H new ATOM 0 HG23 VAL A 92 164.923 5.934 2.964 1.00 0.00 H new ATOM 217 N PHE A 93 165.105 1.494 4.473 1.00 0.00 N ATOM 218 CA PHE A 93 165.074 0.029 4.768 1.00 0.00 C ATOM 219 C PHE A 93 165.677 -0.233 6.161 1.00 0.00 C ATOM 220 O PHE A 93 166.121 -1.327 6.453 1.00 0.00 O ATOM 221 CB PHE A 93 165.934 -0.615 3.680 1.00 0.00 C ATOM 222 CG PHE A 93 165.568 -2.074 3.546 1.00 0.00 C ATOM 223 CD1 PHE A 93 164.544 -2.461 2.673 1.00 0.00 C ATOM 224 CD2 PHE A 93 166.252 -3.038 4.296 1.00 0.00 C ATOM 225 CE1 PHE A 93 164.204 -3.812 2.550 1.00 0.00 C ATOM 226 CE2 PHE A 93 165.912 -4.391 4.172 1.00 0.00 C ATOM 227 CZ PHE A 93 164.887 -4.778 3.299 1.00 0.00 C ATOM 0 H PHE A 93 165.971 1.827 4.049 1.00 0.00 H new ATOM 0 HA PHE A 93 164.062 -0.375 4.773 1.00 0.00 H new ATOM 0 HB2 PHE A 93 165.782 -0.102 2.730 1.00 0.00 H new ATOM 0 HB3 PHE A 93 166.990 -0.516 3.930 1.00 0.00 H new ATOM 0 HD1 PHE A 93 164.017 -1.716 2.095 1.00 0.00 H new ATOM 0 HD2 PHE A 93 167.041 -2.739 4.970 1.00 0.00 H new ATOM 0 HE1 PHE A 93 163.414 -4.110 1.877 1.00 0.00 H new ATOM 0 HE2 PHE A 93 166.440 -5.136 4.749 1.00 0.00 H new ATOM 0 HZ PHE A 93 164.624 -5.821 3.204 1.00 0.00 H new ATOM 237 N ASP A 94 165.677 0.753 7.024 1.00 0.00 N ATOM 238 CA ASP A 94 166.224 0.568 8.401 1.00 0.00 C ATOM 239 C ASP A 94 165.221 1.126 9.413 1.00 0.00 C ATOM 240 O ASP A 94 165.372 2.222 9.917 1.00 0.00 O ATOM 241 CB ASP A 94 167.530 1.363 8.431 1.00 0.00 C ATOM 242 CG ASP A 94 168.400 0.872 9.590 1.00 0.00 C ATOM 243 OD1 ASP A 94 167.848 0.586 10.639 1.00 0.00 O ATOM 244 OD2 ASP A 94 169.604 0.790 9.407 1.00 0.00 O ATOM 0 H ASP A 94 165.317 1.687 6.829 1.00 0.00 H new ATOM 0 HA ASP A 94 166.398 -0.478 8.651 1.00 0.00 H new ATOM 0 HB2 ASP A 94 168.062 1.244 7.487 1.00 0.00 H new ATOM 0 HB3 ASP A 94 167.318 2.426 8.546 1.00 0.00 H new ATOM 249 N LYS A 95 164.185 0.376 9.692 1.00 0.00 N ATOM 250 CA LYS A 95 163.139 0.848 10.651 1.00 0.00 C ATOM 251 C LYS A 95 163.713 1.034 12.058 1.00 0.00 C ATOM 252 O LYS A 95 163.440 2.028 12.706 1.00 0.00 O ATOM 253 CB LYS A 95 162.073 -0.250 10.654 1.00 0.00 C ATOM 254 CG LYS A 95 161.434 -0.348 9.267 1.00 0.00 C ATOM 255 CD LYS A 95 160.577 0.893 9.010 1.00 0.00 C ATOM 256 CE LYS A 95 159.855 0.746 7.669 1.00 0.00 C ATOM 257 NZ LYS A 95 159.591 2.143 7.221 1.00 0.00 N ATOM 0 H LYS A 95 164.018 -0.548 9.295 1.00 0.00 H new ATOM 0 HA LYS A 95 162.738 1.817 10.354 1.00 0.00 H new ATOM 0 HB2 LYS A 95 162.521 -1.205 10.927 1.00 0.00 H new ATOM 0 HB3 LYS A 95 161.311 -0.029 11.402 1.00 0.00 H new ATOM 0 HG2 LYS A 95 162.208 -0.433 8.504 1.00 0.00 H new ATOM 0 HG3 LYS A 95 160.821 -1.247 9.200 1.00 0.00 H new ATOM 0 HD2 LYS A 95 159.852 1.020 9.814 1.00 0.00 H new ATOM 0 HD3 LYS A 95 161.203 1.785 9.002 1.00 0.00 H new ATOM 0 HE2 LYS A 95 160.469 0.209 6.946 1.00 0.00 H new ATOM 0 HE3 LYS A 95 158.927 0.184 7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 159.097 2.127 6.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 158.999 2.627 7.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 160.493 2.651 7.119 1.00 0.00 H new ATOM 271 N GLU A 96 164.488 0.096 12.552 1.00 0.00 N ATOM 272 CA GLU A 96 165.050 0.241 13.932 1.00 0.00 C ATOM 273 C GLU A 96 166.395 0.982 13.914 1.00 0.00 C ATOM 274 O GLU A 96 167.130 0.951 14.881 1.00 0.00 O ATOM 275 CB GLU A 96 165.240 -1.192 14.431 1.00 0.00 C ATOM 276 CG GLU A 96 163.871 -1.835 14.666 1.00 0.00 C ATOM 277 CD GLU A 96 163.174 -1.139 15.836 1.00 0.00 C ATOM 278 OE1 GLU A 96 163.725 -1.158 16.925 1.00 0.00 O ATOM 279 OE2 GLU A 96 162.102 -0.598 15.624 1.00 0.00 O ATOM 0 H GLU A 96 164.754 -0.758 12.062 1.00 0.00 H new ATOM 0 HA GLU A 96 164.390 0.824 14.574 1.00 0.00 H new ATOM 0 HB2 GLU A 96 165.805 -1.771 13.701 1.00 0.00 H new ATOM 0 HB3 GLU A 96 165.818 -1.193 15.355 1.00 0.00 H new ATOM 0 HG2 GLU A 96 163.261 -1.756 13.766 1.00 0.00 H new ATOM 0 HG3 GLU A 96 163.988 -2.898 14.879 1.00 0.00 H new ATOM 286 N SER A 97 166.700 1.681 12.843 1.00 0.00 N ATOM 287 CA SER A 97 167.971 2.477 12.746 1.00 0.00 C ATOM 288 C SER A 97 169.195 1.798 13.383 1.00 0.00 C ATOM 289 O SER A 97 170.001 2.457 14.015 1.00 0.00 O ATOM 290 CB SER A 97 167.658 3.779 13.480 1.00 0.00 C ATOM 291 OG SER A 97 168.423 4.833 12.911 1.00 0.00 O ATOM 0 H SER A 97 166.108 1.734 12.014 1.00 0.00 H new ATOM 0 HA SER A 97 168.249 2.606 11.700 1.00 0.00 H new ATOM 0 HB2 SER A 97 166.594 4.005 13.406 1.00 0.00 H new ATOM 0 HB3 SER A 97 167.889 3.677 14.540 1.00 0.00 H new ATOM 0 HG SER A 97 168.224 5.671 13.378 1.00 0.00 H new ATOM 297 N THR A 98 169.351 0.501 13.230 1.00 0.00 N ATOM 298 CA THR A 98 170.542 -0.167 13.848 1.00 0.00 C ATOM 299 C THR A 98 171.828 0.382 13.212 1.00 0.00 C ATOM 300 O THR A 98 172.839 0.531 13.873 1.00 0.00 O ATOM 301 CB THR A 98 170.377 -1.673 13.589 1.00 0.00 C ATOM 302 OG1 THR A 98 171.531 -2.356 14.058 1.00 0.00 O ATOM 303 CG2 THR A 98 170.195 -1.958 12.094 1.00 0.00 C ATOM 0 H THR A 98 168.719 -0.112 12.715 1.00 0.00 H new ATOM 0 HA THR A 98 170.612 0.023 14.919 1.00 0.00 H new ATOM 0 HB THR A 98 169.489 -2.020 14.117 1.00 0.00 H new ATOM 0 HG1 THR A 98 171.430 -3.317 13.897 1.00 0.00 H new ATOM 0 HG21 THR A 98 170.081 -3.031 11.939 1.00 0.00 H new ATOM 0 HG22 THR A 98 169.306 -1.442 11.731 1.00 0.00 H new ATOM 0 HG23 THR A 98 171.069 -1.604 11.547 1.00 0.00 H new ATOM 311 N GLY A 99 171.787 0.709 11.945 1.00 0.00 N ATOM 312 CA GLY A 99 172.992 1.277 11.269 1.00 0.00 C ATOM 313 C GLY A 99 173.809 0.182 10.568 1.00 0.00 C ATOM 314 O GLY A 99 174.947 0.406 10.197 1.00 0.00 O ATOM 0 H GLY A 99 170.967 0.606 11.348 1.00 0.00 H new ATOM 0 HA2 GLY A 99 172.683 2.026 10.540 1.00 0.00 H new ATOM 0 HA3 GLY A 99 173.617 1.786 12.003 1.00 0.00 H new ATOM 318 N LYS A 100 173.255 -0.992 10.382 1.00 0.00 N ATOM 319 CA LYS A 100 174.025 -2.082 9.705 1.00 0.00 C ATOM 320 C LYS A 100 173.172 -2.755 8.624 1.00 0.00 C ATOM 321 O LYS A 100 171.958 -2.769 8.706 1.00 0.00 O ATOM 322 CB LYS A 100 174.353 -3.078 10.816 1.00 0.00 C ATOM 323 CG LYS A 100 175.268 -2.413 11.844 1.00 0.00 C ATOM 324 CD LYS A 100 175.871 -3.485 12.753 1.00 0.00 C ATOM 325 CE LYS A 100 176.756 -2.823 13.812 1.00 0.00 C ATOM 326 NZ LYS A 100 176.438 -3.537 15.081 1.00 0.00 N ATOM 0 H LYS A 100 172.308 -1.241 10.668 1.00 0.00 H new ATOM 0 HA LYS A 100 174.919 -1.703 9.210 1.00 0.00 H new ATOM 0 HB2 LYS A 100 173.436 -3.418 11.296 1.00 0.00 H new ATOM 0 HB3 LYS A 100 174.839 -3.959 10.397 1.00 0.00 H new ATOM 0 HG2 LYS A 100 176.060 -1.861 11.339 1.00 0.00 H new ATOM 0 HG3 LYS A 100 174.705 -1.692 12.437 1.00 0.00 H new ATOM 0 HD2 LYS A 100 175.077 -4.057 13.234 1.00 0.00 H new ATOM 0 HD3 LYS A 100 176.458 -4.189 12.162 1.00 0.00 H new ATOM 0 HE2 LYS A 100 177.812 -2.918 13.559 1.00 0.00 H new ATOM 0 HE3 LYS A 100 176.543 -1.757 13.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 177.007 -3.139 15.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 175.428 -3.423 15.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 176.658 -4.548 14.975 1.00 0.00 H new ATOM 340 N VAL A 101 173.796 -3.325 7.622 1.00 0.00 N ATOM 341 CA VAL A 101 173.018 -4.015 6.545 1.00 0.00 C ATOM 342 C VAL A 101 173.845 -5.161 5.953 1.00 0.00 C ATOM 343 O VAL A 101 175.056 -5.187 6.067 1.00 0.00 O ATOM 344 CB VAL A 101 172.728 -2.945 5.483 1.00 0.00 C ATOM 345 CG1 VAL A 101 171.853 -1.847 6.090 1.00 0.00 C ATOM 346 CG2 VAL A 101 174.044 -2.333 4.991 1.00 0.00 C ATOM 0 H VAL A 101 174.809 -3.343 7.503 1.00 0.00 H new ATOM 0 HA VAL A 101 172.094 -4.450 6.926 1.00 0.00 H new ATOM 0 HB VAL A 101 172.207 -3.405 4.643 1.00 0.00 H new ATOM 0 HG11 VAL A 101 171.647 -1.087 5.336 1.00 0.00 H new ATOM 0 HG12 VAL A 101 170.914 -2.279 6.435 1.00 0.00 H new ATOM 0 HG13 VAL A 101 172.374 -1.391 6.932 1.00 0.00 H new ATOM 0 HG21 VAL A 101 173.833 -1.574 4.237 1.00 0.00 H new ATOM 0 HG22 VAL A 101 174.569 -1.875 5.830 1.00 0.00 H new ATOM 0 HG23 VAL A 101 174.668 -3.113 4.555 1.00 0.00 H new ATOM 356 N SER A 102 173.198 -6.097 5.308 1.00 0.00 N ATOM 357 CA SER A 102 173.934 -7.240 4.685 1.00 0.00 C ATOM 358 C SER A 102 174.433 -6.837 3.298 1.00 0.00 C ATOM 359 O SER A 102 173.797 -6.056 2.614 1.00 0.00 O ATOM 360 CB SER A 102 172.894 -8.353 4.566 1.00 0.00 C ATOM 361 OG SER A 102 171.689 -7.817 4.036 1.00 0.00 O ATOM 0 H SER A 102 172.186 -6.120 5.185 1.00 0.00 H new ATOM 0 HA SER A 102 174.802 -7.547 5.268 1.00 0.00 H new ATOM 0 HB2 SER A 102 173.267 -9.147 3.919 1.00 0.00 H new ATOM 0 HB3 SER A 102 172.708 -8.798 5.543 1.00 0.00 H new ATOM 0 HG SER A 102 171.021 -8.530 3.957 1.00 0.00 H new ATOM 367 N VAL A 103 175.562 -7.350 2.874 1.00 0.00 N ATOM 368 CA VAL A 103 176.082 -6.972 1.523 1.00 0.00 C ATOM 369 C VAL A 103 175.113 -7.438 0.432 1.00 0.00 C ATOM 370 O VAL A 103 174.962 -6.781 -0.581 1.00 0.00 O ATOM 371 CB VAL A 103 177.457 -7.645 1.379 1.00 0.00 C ATOM 372 CG1 VAL A 103 178.366 -7.203 2.525 1.00 0.00 C ATOM 373 CG2 VAL A 103 177.323 -9.170 1.410 1.00 0.00 C ATOM 0 H VAL A 103 176.140 -8.007 3.398 1.00 0.00 H new ATOM 0 HA VAL A 103 176.175 -5.891 1.417 1.00 0.00 H new ATOM 0 HB VAL A 103 177.886 -7.347 0.422 1.00 0.00 H new ATOM 0 HG11 VAL A 103 179.340 -7.681 2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 103 178.488 -6.120 2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 103 177.919 -7.492 3.476 1.00 0.00 H new ATOM 0 HG21 VAL A 103 178.309 -9.624 1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 103 176.880 -9.477 2.357 1.00 0.00 H new ATOM 0 HG23 VAL A 103 176.685 -9.496 0.588 1.00 0.00 H new ATOM 383 N GLY A 104 174.452 -8.558 0.619 1.00 0.00 N ATOM 384 CA GLY A 104 173.492 -9.047 -0.419 1.00 0.00 C ATOM 385 C GLY A 104 172.373 -8.021 -0.611 1.00 0.00 C ATOM 386 O GLY A 104 171.974 -7.722 -1.721 1.00 0.00 O ATOM 0 H GLY A 104 174.537 -9.152 1.444 1.00 0.00 H new ATOM 0 HA2 GLY A 104 174.014 -9.211 -1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 104 173.071 -10.006 -0.116 1.00 0.00 H new ATOM 390 N ASP A 105 171.874 -7.473 0.470 1.00 0.00 N ATOM 391 CA ASP A 105 170.787 -6.455 0.371 1.00 0.00 C ATOM 392 C ASP A 105 171.389 -5.101 0.002 1.00 0.00 C ATOM 393 O ASP A 105 170.855 -4.371 -0.813 1.00 0.00 O ATOM 394 CB ASP A 105 170.156 -6.403 1.765 1.00 0.00 C ATOM 395 CG ASP A 105 168.866 -5.578 1.715 1.00 0.00 C ATOM 396 OD1 ASP A 105 168.808 -4.649 0.927 1.00 0.00 O ATOM 397 OD2 ASP A 105 167.959 -5.892 2.468 1.00 0.00 O ATOM 0 H ASP A 105 172.176 -7.689 1.420 1.00 0.00 H new ATOM 0 HA ASP A 105 170.049 -6.703 -0.392 1.00 0.00 H new ATOM 0 HB2 ASP A 105 169.941 -7.412 2.116 1.00 0.00 H new ATOM 0 HB3 ASP A 105 170.855 -5.961 2.475 1.00 0.00 H new ATOM 402 N LEU A 106 172.507 -4.771 0.596 1.00 0.00 N ATOM 403 CA LEU A 106 173.174 -3.470 0.288 1.00 0.00 C ATOM 404 C LEU A 106 173.522 -3.421 -1.204 1.00 0.00 C ATOM 405 O LEU A 106 173.234 -2.456 -1.887 1.00 0.00 O ATOM 406 CB LEU A 106 174.447 -3.460 1.146 1.00 0.00 C ATOM 407 CG LEU A 106 175.265 -2.191 0.862 1.00 0.00 C ATOM 408 CD1 LEU A 106 175.833 -1.639 2.173 1.00 0.00 C ATOM 409 CD2 LEU A 106 176.420 -2.527 -0.086 1.00 0.00 C ATOM 0 H LEU A 106 172.989 -5.349 1.284 1.00 0.00 H new ATOM 0 HA LEU A 106 172.543 -2.608 0.504 1.00 0.00 H new ATOM 0 HB2 LEU A 106 174.183 -3.503 2.203 1.00 0.00 H new ATOM 0 HB3 LEU A 106 175.047 -4.344 0.931 1.00 0.00 H new ATOM 0 HG LEU A 106 174.619 -1.444 0.402 1.00 0.00 H new ATOM 0 HD11 LEU A 106 176.413 -0.739 1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 106 175.014 -1.397 2.851 1.00 0.00 H new ATOM 0 HD13 LEU A 106 176.477 -2.388 2.634 1.00 0.00 H new ATOM 0 HD21 LEU A 106 177.000 -1.626 -0.287 1.00 0.00 H new ATOM 0 HD22 LEU A 106 177.063 -3.277 0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 106 176.021 -2.918 -1.022 1.00 0.00 H new ATOM 421 N ARG A 107 174.143 -4.456 -1.705 1.00 0.00 N ATOM 422 CA ARG A 107 174.521 -4.480 -3.150 1.00 0.00 C ATOM 423 C ARG A 107 173.272 -4.450 -4.032 1.00 0.00 C ATOM 424 O ARG A 107 173.291 -3.911 -5.124 1.00 0.00 O ATOM 425 CB ARG A 107 175.294 -5.789 -3.346 1.00 0.00 C ATOM 426 CG ARG A 107 175.772 -5.900 -4.799 1.00 0.00 C ATOM 427 CD ARG A 107 175.628 -7.349 -5.276 1.00 0.00 C ATOM 428 NE ARG A 107 176.769 -7.564 -6.211 1.00 0.00 N ATOM 429 CZ ARG A 107 176.689 -8.479 -7.141 1.00 0.00 C ATOM 430 NH1 ARG A 107 176.149 -9.638 -6.875 1.00 0.00 N ATOM 431 NH2 ARG A 107 177.151 -8.234 -8.335 1.00 0.00 N ATOM 0 H ARG A 107 174.405 -5.287 -1.176 1.00 0.00 H new ATOM 0 HA ARG A 107 175.120 -3.613 -3.428 1.00 0.00 H new ATOM 0 HB2 ARG A 107 176.148 -5.822 -2.669 1.00 0.00 H new ATOM 0 HB3 ARG A 107 174.657 -6.638 -3.097 1.00 0.00 H new ATOM 0 HG2 ARG A 107 175.188 -5.236 -5.437 1.00 0.00 H new ATOM 0 HG3 ARG A 107 176.812 -5.582 -4.876 1.00 0.00 H new ATOM 0 HD2 ARG A 107 175.668 -8.046 -4.439 1.00 0.00 H new ATOM 0 HD3 ARG A 107 174.673 -7.506 -5.777 1.00 0.00 H new ATOM 0 HE ARG A 107 177.612 -6.997 -6.125 1.00 0.00 H new ATOM 0 HH11 ARG A 107 175.789 -9.830 -5.940 1.00 0.00 H new ATOM 0 HH12 ARG A 107 176.087 -10.351 -7.602 1.00 0.00 H new ATOM 0 HH21 ARG A 107 177.574 -7.329 -8.542 1.00 0.00 H new ATOM 0 HH22 ARG A 107 177.089 -8.947 -9.062 1.00 0.00 H new ATOM 445 N TYR A 108 172.191 -5.039 -3.576 1.00 0.00 N ATOM 446 CA TYR A 108 170.951 -5.052 -4.407 1.00 0.00 C ATOM 447 C TYR A 108 170.394 -3.636 -4.556 1.00 0.00 C ATOM 448 O TYR A 108 170.082 -3.202 -5.650 1.00 0.00 O ATOM 449 CB TYR A 108 169.964 -5.960 -3.671 1.00 0.00 C ATOM 450 CG TYR A 108 168.720 -6.136 -4.510 1.00 0.00 C ATOM 451 CD1 TYR A 108 167.648 -5.246 -4.367 1.00 0.00 C ATOM 452 CD2 TYR A 108 168.640 -7.188 -5.430 1.00 0.00 C ATOM 453 CE1 TYR A 108 166.496 -5.410 -5.146 1.00 0.00 C ATOM 454 CE2 TYR A 108 167.488 -7.350 -6.208 1.00 0.00 C ATOM 455 CZ TYR A 108 166.416 -6.462 -6.067 1.00 0.00 C ATOM 456 OH TYR A 108 165.281 -6.622 -6.833 1.00 0.00 O ATOM 0 H TYR A 108 172.117 -5.506 -2.672 1.00 0.00 H new ATOM 0 HA TYR A 108 171.143 -5.418 -5.416 1.00 0.00 H new ATOM 0 HB2 TYR A 108 170.422 -6.929 -3.473 1.00 0.00 H new ATOM 0 HB3 TYR A 108 169.706 -5.527 -2.705 1.00 0.00 H new ATOM 0 HD1 TYR A 108 167.710 -4.435 -3.657 1.00 0.00 H new ATOM 0 HD2 TYR A 108 169.467 -7.874 -5.539 1.00 0.00 H new ATOM 0 HE1 TYR A 108 165.669 -4.725 -5.036 1.00 0.00 H new ATOM 0 HE2 TYR A 108 167.426 -8.161 -6.918 1.00 0.00 H new ATOM 0 HH TYR A 108 165.390 -7.399 -7.421 1.00 0.00 H new ATOM 466 N MET A 109 170.261 -2.911 -3.469 1.00 0.00 N ATOM 467 CA MET A 109 169.718 -1.527 -3.569 1.00 0.00 C ATOM 468 C MET A 109 170.729 -0.624 -4.249 1.00 0.00 C ATOM 469 O MET A 109 170.368 0.266 -4.997 1.00 0.00 O ATOM 470 CB MET A 109 169.492 -1.073 -2.132 1.00 0.00 C ATOM 471 CG MET A 109 168.027 -1.301 -1.748 1.00 0.00 C ATOM 472 SD MET A 109 167.257 0.268 -1.253 1.00 0.00 S ATOM 473 CE MET A 109 167.686 1.225 -2.736 1.00 0.00 C ATOM 0 H MET A 109 170.504 -3.218 -2.527 1.00 0.00 H new ATOM 0 HA MET A 109 168.799 -1.490 -4.154 1.00 0.00 H new ATOM 0 HB2 MET A 109 170.146 -1.626 -1.458 1.00 0.00 H new ATOM 0 HB3 MET A 109 169.746 -0.018 -2.029 1.00 0.00 H new ATOM 0 HG2 MET A 109 167.485 -1.731 -2.591 1.00 0.00 H new ATOM 0 HG3 MET A 109 167.965 -2.019 -0.930 1.00 0.00 H new ATOM 0 HE1 MET A 109 166.972 2.039 -2.863 1.00 0.00 H new ATOM 0 HE2 MET A 109 168.690 1.636 -2.626 1.00 0.00 H new ATOM 0 HE3 MET A 109 167.654 0.575 -3.610 1.00 0.00 H new ATOM 483 N LEU A 110 171.996 -0.831 -3.994 1.00 0.00 N ATOM 484 CA LEU A 110 173.040 0.033 -4.626 1.00 0.00 C ATOM 485 C LEU A 110 172.852 0.040 -6.143 1.00 0.00 C ATOM 486 O LEU A 110 172.879 1.081 -6.771 1.00 0.00 O ATOM 487 CB LEU A 110 174.369 -0.641 -4.244 1.00 0.00 C ATOM 488 CG LEU A 110 175.549 0.129 -4.836 1.00 0.00 C ATOM 489 CD1 LEU A 110 175.796 1.397 -4.016 1.00 0.00 C ATOM 490 CD2 LEU A 110 176.799 -0.752 -4.792 1.00 0.00 C ATOM 0 H LEU A 110 172.353 -1.560 -3.376 1.00 0.00 H new ATOM 0 HA LEU A 110 172.996 1.071 -4.296 1.00 0.00 H new ATOM 0 HB2 LEU A 110 174.463 -0.684 -3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 110 174.380 -1.669 -4.606 1.00 0.00 H new ATOM 0 HG LEU A 110 175.325 0.401 -5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 110 176.638 1.946 -4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 110 174.905 2.025 -4.039 1.00 0.00 H new ATOM 0 HD13 LEU A 110 176.021 1.125 -2.985 1.00 0.00 H new ATOM 0 HD21 LEU A 110 177.643 -0.207 -5.213 1.00 0.00 H new ATOM 0 HD22 LEU A 110 177.019 -1.020 -3.759 1.00 0.00 H new ATOM 0 HD23 LEU A 110 176.626 -1.658 -5.373 1.00 0.00 H new ATOM 502 N THR A 111 172.632 -1.112 -6.724 1.00 0.00 N ATOM 503 CA THR A 111 172.424 -1.183 -8.207 1.00 0.00 C ATOM 504 C THR A 111 171.122 -0.478 -8.615 1.00 0.00 C ATOM 505 O THR A 111 170.937 -0.109 -9.760 1.00 0.00 O ATOM 506 CB THR A 111 172.335 -2.678 -8.525 1.00 0.00 C ATOM 507 OG1 THR A 111 173.451 -3.348 -7.956 1.00 0.00 O ATOM 508 CG2 THR A 111 172.334 -2.880 -10.041 1.00 0.00 C ATOM 0 H THR A 111 172.587 -2.008 -6.238 1.00 0.00 H new ATOM 0 HA THR A 111 173.230 -0.689 -8.749 1.00 0.00 H new ATOM 0 HB THR A 111 171.414 -3.085 -8.107 1.00 0.00 H new ATOM 0 HG1 THR A 111 173.233 -3.629 -7.043 1.00 0.00 H new ATOM 0 HG21 THR A 111 172.271 -3.945 -10.266 1.00 0.00 H new ATOM 0 HG22 THR A 111 171.477 -2.365 -10.476 1.00 0.00 H new ATOM 0 HG23 THR A 111 173.253 -2.474 -10.463 1.00 0.00 H new ATOM 516 N GLY A 112 170.232 -0.274 -7.679 1.00 0.00 N ATOM 517 CA GLY A 112 168.947 0.424 -7.974 1.00 0.00 C ATOM 518 C GLY A 112 169.123 1.944 -7.850 1.00 0.00 C ATOM 519 O GLY A 112 168.265 2.710 -8.246 1.00 0.00 O ATOM 0 H GLY A 112 170.344 -0.566 -6.708 1.00 0.00 H new ATOM 0 HA2 GLY A 112 168.611 0.171 -8.980 1.00 0.00 H new ATOM 0 HA3 GLY A 112 168.174 0.084 -7.285 1.00 0.00 H new ATOM 523 N LEU A 113 170.205 2.381 -7.255 1.00 0.00 N ATOM 524 CA LEU A 113 170.433 3.840 -7.036 1.00 0.00 C ATOM 525 C LEU A 113 171.287 4.481 -8.147 1.00 0.00 C ATOM 526 O LEU A 113 171.707 5.616 -8.017 1.00 0.00 O ATOM 527 CB LEU A 113 171.189 3.897 -5.706 1.00 0.00 C ATOM 528 CG LEU A 113 170.602 4.997 -4.823 1.00 0.00 C ATOM 529 CD1 LEU A 113 171.149 4.849 -3.405 1.00 0.00 C ATOM 530 CD2 LEU A 113 170.996 6.362 -5.385 1.00 0.00 C ATOM 0 H LEU A 113 170.950 1.778 -6.907 1.00 0.00 H new ATOM 0 HA LEU A 113 169.492 4.391 -7.037 1.00 0.00 H new ATOM 0 HB2 LEU A 113 171.122 2.935 -5.198 1.00 0.00 H new ATOM 0 HB3 LEU A 113 172.247 4.089 -5.886 1.00 0.00 H new ATOM 0 HG LEU A 113 169.515 4.914 -4.804 1.00 0.00 H new ATOM 0 HD11 LEU A 113 170.733 5.632 -2.771 1.00 0.00 H new ATOM 0 HD12 LEU A 113 170.870 3.873 -3.007 1.00 0.00 H new ATOM 0 HD13 LEU A 113 172.235 4.936 -3.423 1.00 0.00 H new ATOM 0 HD21 LEU A 113 170.578 7.149 -4.757 1.00 0.00 H new ATOM 0 HD22 LEU A 113 172.082 6.449 -5.401 1.00 0.00 H new ATOM 0 HD23 LEU A 113 170.609 6.464 -6.399 1.00 0.00 H new ATOM 542 N GLY A 114 171.577 3.776 -9.212 1.00 0.00 N ATOM 543 CA GLY A 114 172.436 4.365 -10.295 1.00 0.00 C ATOM 544 C GLY A 114 173.847 3.774 -10.178 1.00 0.00 C ATOM 545 O GLY A 114 174.832 4.401 -10.520 1.00 0.00 O ATOM 0 H GLY A 114 171.259 2.822 -9.382 1.00 0.00 H new ATOM 0 HA2 GLY A 114 172.013 4.144 -11.275 1.00 0.00 H new ATOM 0 HA3 GLY A 114 172.472 5.450 -10.201 1.00 0.00 H new ATOM 549 N GLU A 115 173.929 2.557 -9.719 1.00 0.00 N ATOM 550 CA GLU A 115 175.252 1.870 -9.592 1.00 0.00 C ATOM 551 C GLU A 115 175.317 0.672 -10.540 1.00 0.00 C ATOM 552 O GLU A 115 174.511 -0.234 -10.451 1.00 0.00 O ATOM 553 CB GLU A 115 175.343 1.405 -8.138 1.00 0.00 C ATOM 554 CG GLU A 115 175.159 2.605 -7.195 1.00 0.00 C ATOM 555 CD GLU A 115 176.436 3.447 -7.188 1.00 0.00 C ATOM 556 OE1 GLU A 115 177.507 2.863 -7.151 1.00 0.00 O ATOM 557 OE2 GLU A 115 176.322 4.661 -7.220 1.00 0.00 O ATOM 0 H GLU A 115 173.128 1.999 -9.422 1.00 0.00 H new ATOM 0 HA GLU A 115 176.077 2.533 -9.851 1.00 0.00 H new ATOM 0 HB2 GLU A 115 174.579 0.654 -7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 115 176.309 0.933 -7.957 1.00 0.00 H new ATOM 0 HG2 GLU A 115 174.313 3.210 -7.520 1.00 0.00 H new ATOM 0 HG3 GLU A 115 174.934 2.258 -6.187 1.00 0.00 H new ATOM 564 N LYS A 116 176.272 0.642 -11.433 1.00 0.00 N ATOM 565 CA LYS A 116 176.386 -0.523 -12.358 1.00 0.00 C ATOM 566 C LYS A 116 177.768 -1.158 -12.226 1.00 0.00 C ATOM 567 O LYS A 116 178.525 -1.253 -13.173 1.00 0.00 O ATOM 568 CB LYS A 116 176.116 0.002 -13.769 1.00 0.00 C ATOM 569 CG LYS A 116 174.638 0.376 -13.899 1.00 0.00 C ATOM 570 CD LYS A 116 174.364 0.902 -15.309 1.00 0.00 C ATOM 571 CE LYS A 116 172.886 1.276 -15.438 1.00 0.00 C ATOM 572 NZ LYS A 116 172.655 1.435 -16.901 1.00 0.00 N ATOM 0 H LYS A 116 176.974 1.370 -11.561 1.00 0.00 H new ATOM 0 HA LYS A 116 175.665 -1.305 -12.119 1.00 0.00 H new ATOM 0 HB2 LYS A 116 176.741 0.872 -13.971 1.00 0.00 H new ATOM 0 HB3 LYS A 116 176.377 -0.757 -14.507 1.00 0.00 H new ATOM 0 HG2 LYS A 116 174.013 -0.494 -13.697 1.00 0.00 H new ATOM 0 HG3 LYS A 116 174.378 1.134 -13.160 1.00 0.00 H new ATOM 0 HD2 LYS A 116 174.989 1.772 -15.512 1.00 0.00 H new ATOM 0 HD3 LYS A 116 174.624 0.144 -16.048 1.00 0.00 H new ATOM 0 HE2 LYS A 116 172.245 0.501 -15.019 1.00 0.00 H new ATOM 0 HE3 LYS A 116 172.664 2.198 -14.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 171.661 1.692 -17.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 173.274 2.184 -17.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 172.868 0.540 -17.385 1.00 0.00 H new ATOM 586 N LEU A 117 178.071 -1.632 -11.047 1.00 0.00 N ATOM 587 CA LEU A 117 179.368 -2.317 -10.794 1.00 0.00 C ATOM 588 C LEU A 117 179.170 -3.818 -11.022 1.00 0.00 C ATOM 589 O LEU A 117 178.096 -4.342 -10.788 1.00 0.00 O ATOM 590 CB LEU A 117 179.703 -2.025 -9.330 1.00 0.00 C ATOM 591 CG LEU A 117 179.834 -0.514 -9.124 1.00 0.00 C ATOM 592 CD1 LEU A 117 179.915 -0.208 -7.627 1.00 0.00 C ATOM 593 CD2 LEU A 117 181.106 -0.016 -9.814 1.00 0.00 C ATOM 0 H LEU A 117 177.460 -1.571 -10.233 1.00 0.00 H new ATOM 0 HA LEU A 117 180.171 -1.979 -11.449 1.00 0.00 H new ATOM 0 HB2 LEU A 117 178.923 -2.424 -8.682 1.00 0.00 H new ATOM 0 HB3 LEU A 117 180.633 -2.522 -9.053 1.00 0.00 H new ATOM 0 HG LEU A 117 178.966 -0.012 -9.551 1.00 0.00 H new ATOM 0 HD11 LEU A 117 180.008 0.868 -7.480 1.00 0.00 H new ATOM 0 HD12 LEU A 117 179.011 -0.565 -7.133 1.00 0.00 H new ATOM 0 HD13 LEU A 117 180.784 -0.709 -7.200 1.00 0.00 H new ATOM 0 HD21 LEU A 117 181.201 1.060 -9.669 1.00 0.00 H new ATOM 0 HD22 LEU A 117 181.973 -0.518 -9.385 1.00 0.00 H new ATOM 0 HD23 LEU A 117 181.051 -0.235 -10.880 1.00 0.00 H new ATOM 605 N THR A 118 180.183 -4.517 -11.462 1.00 0.00 N ATOM 606 CA THR A 118 180.035 -5.988 -11.686 1.00 0.00 C ATOM 607 C THR A 118 180.855 -6.760 -10.650 1.00 0.00 C ATOM 608 O THR A 118 181.903 -6.301 -10.240 1.00 0.00 O ATOM 609 CB THR A 118 180.579 -6.233 -13.091 1.00 0.00 C ATOM 610 OG1 THR A 118 180.104 -5.218 -13.965 1.00 0.00 O ATOM 611 CG2 THR A 118 180.113 -7.600 -13.591 1.00 0.00 C ATOM 0 H THR A 118 181.105 -4.136 -11.676 1.00 0.00 H new ATOM 0 HA THR A 118 179.002 -6.320 -11.588 1.00 0.00 H new ATOM 0 HB THR A 118 181.669 -6.211 -13.067 1.00 0.00 H new ATOM 0 HG1 THR A 118 180.454 -5.373 -14.867 1.00 0.00 H new ATOM 0 HG21 THR A 118 180.503 -7.773 -14.594 1.00 0.00 H new ATOM 0 HG22 THR A 118 180.480 -8.377 -12.921 1.00 0.00 H new ATOM 0 HG23 THR A 118 179.024 -7.627 -13.615 1.00 0.00 H new ATOM 619 N ASP A 119 180.376 -7.903 -10.187 1.00 0.00 N ATOM 620 CA ASP A 119 181.113 -8.696 -9.131 1.00 0.00 C ATOM 621 C ASP A 119 182.636 -8.694 -9.346 1.00 0.00 C ATOM 622 O ASP A 119 183.397 -8.742 -8.400 1.00 0.00 O ATOM 623 CB ASP A 119 180.566 -10.118 -9.264 1.00 0.00 C ATOM 624 CG ASP A 119 180.999 -10.948 -8.053 1.00 0.00 C ATOM 625 OD1 ASP A 119 181.068 -10.388 -6.971 1.00 0.00 O ATOM 626 OD2 ASP A 119 181.253 -12.127 -8.228 1.00 0.00 O ATOM 0 H ASP A 119 179.500 -8.323 -10.498 1.00 0.00 H new ATOM 0 HA ASP A 119 180.958 -8.264 -8.142 1.00 0.00 H new ATOM 0 HB2 ASP A 119 179.478 -10.096 -9.332 1.00 0.00 H new ATOM 0 HB3 ASP A 119 180.934 -10.576 -10.182 1.00 0.00 H new ATOM 631 N ALA A 120 183.080 -8.585 -10.572 1.00 0.00 N ATOM 632 CA ALA A 120 184.551 -8.516 -10.835 1.00 0.00 C ATOM 633 C ALA A 120 185.120 -7.269 -10.145 1.00 0.00 C ATOM 634 O ALA A 120 186.044 -7.348 -9.356 1.00 0.00 O ATOM 635 CB ALA A 120 184.678 -8.379 -12.355 1.00 0.00 C ATOM 0 H ALA A 120 182.489 -8.541 -11.402 1.00 0.00 H new ATOM 0 HA ALA A 120 185.090 -9.387 -10.462 1.00 0.00 H new ATOM 0 HB1 ALA A 120 185.732 -8.322 -12.628 1.00 0.00 H new ATOM 0 HB2 ALA A 120 184.224 -9.245 -12.838 1.00 0.00 H new ATOM 0 HB3 ALA A 120 184.169 -7.473 -12.682 1.00 0.00 H new ATOM 641 N GLU A 121 184.550 -6.124 -10.425 1.00 0.00 N ATOM 642 CA GLU A 121 185.023 -4.864 -9.780 1.00 0.00 C ATOM 643 C GLU A 121 184.518 -4.785 -8.333 1.00 0.00 C ATOM 644 O GLU A 121 185.226 -4.361 -7.440 1.00 0.00 O ATOM 645 CB GLU A 121 184.415 -3.740 -10.620 1.00 0.00 C ATOM 646 CG GLU A 121 185.094 -3.701 -11.991 1.00 0.00 C ATOM 647 CD GLU A 121 184.419 -2.643 -12.865 1.00 0.00 C ATOM 648 OE1 GLU A 121 184.754 -1.479 -12.718 1.00 0.00 O ATOM 649 OE2 GLU A 121 183.576 -3.014 -13.667 1.00 0.00 O ATOM 0 H GLU A 121 183.773 -6.009 -11.076 1.00 0.00 H new ATOM 0 HA GLU A 121 186.111 -4.804 -9.740 1.00 0.00 H new ATOM 0 HB2 GLU A 121 183.343 -3.899 -10.738 1.00 0.00 H new ATOM 0 HB3 GLU A 121 184.541 -2.784 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU A 121 186.154 -3.472 -11.877 1.00 0.00 H new ATOM 0 HG3 GLU A 121 185.029 -4.678 -12.469 1.00 0.00 H new ATOM 656 N VAL A 122 183.293 -5.190 -8.104 1.00 0.00 N ATOM 657 CA VAL A 122 182.719 -5.144 -6.721 1.00 0.00 C ATOM 658 C VAL A 122 183.485 -6.087 -5.786 1.00 0.00 C ATOM 659 O VAL A 122 183.674 -5.781 -4.623 1.00 0.00 O ATOM 660 CB VAL A 122 181.258 -5.587 -6.859 1.00 0.00 C ATOM 661 CG1 VAL A 122 180.576 -5.556 -5.486 1.00 0.00 C ATOM 662 CG2 VAL A 122 180.517 -4.639 -7.805 1.00 0.00 C ATOM 0 H VAL A 122 182.662 -5.553 -8.819 1.00 0.00 H new ATOM 0 HA VAL A 122 182.794 -4.146 -6.290 1.00 0.00 H new ATOM 0 HB VAL A 122 181.232 -6.600 -7.260 1.00 0.00 H new ATOM 0 HG11 VAL A 122 179.538 -5.872 -5.588 1.00 0.00 H new ATOM 0 HG12 VAL A 122 181.095 -6.232 -4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 122 180.610 -4.543 -5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 122 179.479 -4.958 -7.900 1.00 0.00 H new ATOM 0 HG22 VAL A 122 180.550 -3.626 -7.404 1.00 0.00 H new ATOM 0 HG23 VAL A 122 180.993 -4.657 -8.785 1.00 0.00 H new ATOM 672 N ASP A 123 183.933 -7.225 -6.270 1.00 0.00 N ATOM 673 CA ASP A 123 184.690 -8.161 -5.375 1.00 0.00 C ATOM 674 C ASP A 123 185.939 -7.446 -4.851 1.00 0.00 C ATOM 675 O ASP A 123 186.294 -7.560 -3.693 1.00 0.00 O ATOM 676 CB ASP A 123 185.059 -9.368 -6.241 1.00 0.00 C ATOM 677 CG ASP A 123 185.839 -10.383 -5.402 1.00 0.00 C ATOM 678 OD1 ASP A 123 186.965 -10.082 -5.039 1.00 0.00 O ATOM 679 OD2 ASP A 123 185.299 -11.444 -5.137 1.00 0.00 O ATOM 0 H ASP A 123 183.809 -7.542 -7.232 1.00 0.00 H new ATOM 0 HA ASP A 123 184.108 -8.480 -4.510 1.00 0.00 H new ATOM 0 HB2 ASP A 123 184.157 -9.830 -6.642 1.00 0.00 H new ATOM 0 HB3 ASP A 123 185.659 -9.047 -7.093 1.00 0.00 H new ATOM 684 N GLU A 124 186.586 -6.683 -5.698 1.00 0.00 N ATOM 685 CA GLU A 124 187.800 -5.922 -5.257 1.00 0.00 C ATOM 686 C GLU A 124 187.435 -5.026 -4.066 1.00 0.00 C ATOM 687 O GLU A 124 188.156 -4.950 -3.088 1.00 0.00 O ATOM 688 CB GLU A 124 188.199 -5.067 -6.463 1.00 0.00 C ATOM 689 CG GLU A 124 188.638 -5.976 -7.612 1.00 0.00 C ATOM 690 CD GLU A 124 190.090 -6.408 -7.398 1.00 0.00 C ATOM 691 OE1 GLU A 124 190.453 -6.656 -6.259 1.00 0.00 O ATOM 692 OE2 GLU A 124 190.815 -6.484 -8.375 1.00 0.00 O ATOM 0 H GLU A 124 186.327 -6.553 -6.676 1.00 0.00 H new ATOM 0 HA GLU A 124 188.612 -6.577 -4.942 1.00 0.00 H new ATOM 0 HB2 GLU A 124 187.359 -4.447 -6.776 1.00 0.00 H new ATOM 0 HB3 GLU A 124 189.009 -4.391 -6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 124 187.991 -6.852 -7.664 1.00 0.00 H new ATOM 0 HG3 GLU A 124 188.540 -5.451 -8.562 1.00 0.00 H new ATOM 699 N LEU A 125 186.310 -4.359 -4.146 1.00 0.00 N ATOM 700 CA LEU A 125 185.869 -3.472 -3.024 1.00 0.00 C ATOM 701 C LEU A 125 185.675 -4.301 -1.751 1.00 0.00 C ATOM 702 O LEU A 125 186.178 -3.974 -0.694 1.00 0.00 O ATOM 703 CB LEU A 125 184.529 -2.895 -3.484 1.00 0.00 C ATOM 704 CG LEU A 125 184.761 -1.924 -4.643 1.00 0.00 C ATOM 705 CD1 LEU A 125 183.414 -1.465 -5.204 1.00 0.00 C ATOM 706 CD2 LEU A 125 185.545 -0.709 -4.142 1.00 0.00 C ATOM 0 H LEU A 125 185.675 -4.391 -4.944 1.00 0.00 H new ATOM 0 HA LEU A 125 186.598 -2.693 -2.799 1.00 0.00 H new ATOM 0 HB2 LEU A 125 183.863 -3.699 -3.797 1.00 0.00 H new ATOM 0 HB3 LEU A 125 184.040 -2.380 -2.657 1.00 0.00 H new ATOM 0 HG LEU A 125 185.329 -2.425 -5.427 1.00 0.00 H new ATOM 0 HD11 LEU A 125 183.580 -0.773 -6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 125 182.855 -2.330 -5.562 1.00 0.00 H new ATOM 0 HD13 LEU A 125 182.845 -0.965 -4.420 1.00 0.00 H new ATOM 0 HD21 LEU A 125 185.710 -0.017 -4.968 1.00 0.00 H new ATOM 0 HD22 LEU A 125 184.978 -0.208 -3.357 1.00 0.00 H new ATOM 0 HD23 LEU A 125 186.506 -1.035 -3.744 1.00 0.00 H new ATOM 718 N LEU A 126 184.944 -5.383 -1.862 1.00 0.00 N ATOM 719 CA LEU A 126 184.696 -6.271 -0.682 1.00 0.00 C ATOM 720 C LEU A 126 185.989 -6.965 -0.241 1.00 0.00 C ATOM 721 O LEU A 126 186.105 -7.433 0.874 1.00 0.00 O ATOM 722 CB LEU A 126 183.698 -7.320 -1.184 1.00 0.00 C ATOM 723 CG LEU A 126 182.323 -6.673 -1.372 1.00 0.00 C ATOM 724 CD1 LEU A 126 181.608 -7.336 -2.549 1.00 0.00 C ATOM 725 CD2 LEU A 126 181.485 -6.852 -0.098 1.00 0.00 C ATOM 0 H LEU A 126 184.504 -5.692 -2.729 1.00 0.00 H new ATOM 0 HA LEU A 126 184.325 -5.708 0.174 1.00 0.00 H new ATOM 0 HB2 LEU A 126 184.044 -7.743 -2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 126 183.630 -8.142 -0.471 1.00 0.00 H new ATOM 0 HG LEU A 126 182.449 -5.609 -1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 126 180.629 -6.877 -2.685 1.00 0.00 H new ATOM 0 HD12 LEU A 126 182.199 -7.204 -3.455 1.00 0.00 H new ATOM 0 HD13 LEU A 126 181.485 -8.400 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 126 180.508 -6.390 -0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 126 181.358 -7.915 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 126 181.994 -6.379 0.742 1.00 0.00 H new ATOM 737 N LYS A 127 186.943 -7.072 -1.130 1.00 0.00 N ATOM 738 CA LYS A 127 188.217 -7.777 -0.793 1.00 0.00 C ATOM 739 C LYS A 127 188.901 -7.143 0.424 1.00 0.00 C ATOM 740 O LYS A 127 189.741 -7.758 1.054 1.00 0.00 O ATOM 741 CB LYS A 127 189.099 -7.600 -2.032 1.00 0.00 C ATOM 742 CG LYS A 127 190.338 -8.488 -1.910 1.00 0.00 C ATOM 743 CD LYS A 127 191.204 -8.329 -3.162 1.00 0.00 C ATOM 744 CE LYS A 127 192.357 -9.336 -3.118 1.00 0.00 C ATOM 745 NZ LYS A 127 192.512 -9.803 -4.524 1.00 0.00 N ATOM 0 H LYS A 127 186.894 -6.700 -2.079 1.00 0.00 H new ATOM 0 HA LYS A 127 188.040 -8.823 -0.541 1.00 0.00 H new ATOM 0 HB2 LYS A 127 188.539 -7.861 -2.930 1.00 0.00 H new ATOM 0 HB3 LYS A 127 189.396 -6.556 -2.134 1.00 0.00 H new ATOM 0 HG2 LYS A 127 190.909 -8.214 -1.023 1.00 0.00 H new ATOM 0 HG3 LYS A 127 190.042 -9.530 -1.790 1.00 0.00 H new ATOM 0 HD2 LYS A 127 190.602 -8.489 -4.056 1.00 0.00 H new ATOM 0 HD3 LYS A 127 191.596 -7.314 -3.219 1.00 0.00 H new ATOM 0 HE2 LYS A 127 193.273 -8.872 -2.753 1.00 0.00 H new ATOM 0 HE3 LYS A 127 192.131 -10.166 -2.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 193.285 -10.497 -4.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 191.627 -10.246 -4.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 192.733 -8.992 -5.137 1.00 0.00 H new ATOM 759 N GLY A 128 188.564 -5.916 0.752 1.00 0.00 N ATOM 760 CA GLY A 128 189.218 -5.250 1.917 1.00 0.00 C ATOM 761 C GLY A 128 188.188 -4.865 2.988 1.00 0.00 C ATOM 762 O GLY A 128 188.556 -4.555 4.107 1.00 0.00 O ATOM 0 H GLY A 128 187.868 -5.353 0.264 1.00 0.00 H new ATOM 0 HA2 GLY A 128 189.963 -5.918 2.349 1.00 0.00 H new ATOM 0 HA3 GLY A 128 189.746 -4.358 1.580 1.00 0.00 H new ATOM 766 N VAL A 129 186.912 -4.867 2.672 1.00 0.00 N ATOM 767 CA VAL A 129 185.897 -4.482 3.705 1.00 0.00 C ATOM 768 C VAL A 129 185.866 -5.515 4.840 1.00 0.00 C ATOM 769 O VAL A 129 185.766 -6.706 4.620 1.00 0.00 O ATOM 770 CB VAL A 129 184.546 -4.378 2.966 1.00 0.00 C ATOM 771 CG1 VAL A 129 183.987 -5.770 2.638 1.00 0.00 C ATOM 772 CG2 VAL A 129 183.546 -3.634 3.853 1.00 0.00 C ATOM 0 H VAL A 129 186.535 -5.115 1.757 1.00 0.00 H new ATOM 0 HA VAL A 129 186.138 -3.530 4.178 1.00 0.00 H new ATOM 0 HB VAL A 129 184.703 -3.839 2.032 1.00 0.00 H new ATOM 0 HG11 VAL A 129 183.035 -5.666 2.118 1.00 0.00 H new ATOM 0 HG12 VAL A 129 184.692 -6.305 2.001 1.00 0.00 H new ATOM 0 HG13 VAL A 129 183.837 -6.329 3.562 1.00 0.00 H new ATOM 0 HG21 VAL A 129 182.589 -3.557 3.337 1.00 0.00 H new ATOM 0 HG22 VAL A 129 183.412 -4.180 4.787 1.00 0.00 H new ATOM 0 HG23 VAL A 129 183.924 -2.634 4.068 1.00 0.00 H new ATOM 782 N GLU A 130 185.966 -5.040 6.053 1.00 0.00 N ATOM 783 CA GLU A 130 185.962 -5.945 7.238 1.00 0.00 C ATOM 784 C GLU A 130 184.533 -6.254 7.695 1.00 0.00 C ATOM 785 O GLU A 130 183.910 -5.479 8.394 1.00 0.00 O ATOM 786 CB GLU A 130 186.708 -5.166 8.323 1.00 0.00 C ATOM 787 CG GLU A 130 186.851 -6.036 9.574 1.00 0.00 C ATOM 788 CD GLU A 130 187.598 -5.255 10.658 1.00 0.00 C ATOM 789 OE1 GLU A 130 186.939 -4.583 11.435 1.00 0.00 O ATOM 790 OE2 GLU A 130 188.813 -5.343 10.693 1.00 0.00 O ATOM 0 H GLU A 130 186.052 -4.048 6.275 1.00 0.00 H new ATOM 0 HA GLU A 130 186.427 -6.905 7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 130 187.692 -4.869 7.960 1.00 0.00 H new ATOM 0 HB3 GLU A 130 186.168 -4.251 8.564 1.00 0.00 H new ATOM 0 HG2 GLU A 130 185.867 -6.333 9.938 1.00 0.00 H new ATOM 0 HG3 GLU A 130 187.391 -6.952 9.333 1.00 0.00 H new ATOM 797 N VAL A 131 184.030 -7.401 7.320 1.00 0.00 N ATOM 798 CA VAL A 131 182.660 -7.805 7.741 1.00 0.00 C ATOM 799 C VAL A 131 182.731 -8.441 9.136 1.00 0.00 C ATOM 800 O VAL A 131 183.773 -8.911 9.552 1.00 0.00 O ATOM 801 CB VAL A 131 182.197 -8.821 6.686 1.00 0.00 C ATOM 802 CG1 VAL A 131 183.154 -10.020 6.635 1.00 0.00 C ATOM 803 CG2 VAL A 131 180.795 -9.310 7.037 1.00 0.00 C ATOM 0 H VAL A 131 184.516 -8.080 6.734 1.00 0.00 H new ATOM 0 HA VAL A 131 181.967 -6.966 7.804 1.00 0.00 H new ATOM 0 HB VAL A 131 182.190 -8.335 5.710 1.00 0.00 H new ATOM 0 HG11 VAL A 131 182.809 -10.729 5.882 1.00 0.00 H new ATOM 0 HG12 VAL A 131 184.156 -9.675 6.378 1.00 0.00 H new ATOM 0 HG13 VAL A 131 183.177 -10.508 7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 131 180.464 -10.031 6.290 1.00 0.00 H new ATOM 0 HG22 VAL A 131 180.810 -9.785 8.018 1.00 0.00 H new ATOM 0 HG23 VAL A 131 180.108 -8.464 7.054 1.00 0.00 H new ATOM 813 N ASP A 132 181.643 -8.442 9.862 1.00 0.00 N ATOM 814 CA ASP A 132 181.658 -9.029 11.235 1.00 0.00 C ATOM 815 C ASP A 132 181.146 -10.473 11.226 1.00 0.00 C ATOM 816 O ASP A 132 180.891 -11.053 10.188 1.00 0.00 O ATOM 817 CB ASP A 132 180.717 -8.139 12.048 1.00 0.00 C ATOM 818 CG ASP A 132 181.378 -6.781 12.288 1.00 0.00 C ATOM 819 OD1 ASP A 132 182.578 -6.760 12.512 1.00 0.00 O ATOM 820 OD2 ASP A 132 180.675 -5.786 12.244 1.00 0.00 O ATOM 0 H ASP A 132 180.745 -8.062 9.563 1.00 0.00 H new ATOM 0 HA ASP A 132 182.666 -9.063 11.649 1.00 0.00 H new ATOM 0 HB2 ASP A 132 179.774 -8.008 11.517 1.00 0.00 H new ATOM 0 HB3 ASP A 132 180.482 -8.614 13.000 1.00 0.00 H new ATOM 825 N SER A 133 181.007 -11.051 12.392 1.00 0.00 N ATOM 826 CA SER A 133 180.522 -12.463 12.499 1.00 0.00 C ATOM 827 C SER A 133 179.024 -12.582 12.160 1.00 0.00 C ATOM 828 O SER A 133 178.477 -13.670 12.164 1.00 0.00 O ATOM 829 CB SER A 133 180.774 -12.857 13.953 1.00 0.00 C ATOM 830 OG SER A 133 182.170 -12.828 14.213 1.00 0.00 O ATOM 0 H SER A 133 181.211 -10.601 13.284 1.00 0.00 H new ATOM 0 HA SER A 133 181.039 -13.113 11.793 1.00 0.00 H new ATOM 0 HB2 SER A 133 180.254 -12.172 14.623 1.00 0.00 H new ATOM 0 HB3 SER A 133 180.377 -13.854 14.145 1.00 0.00 H new ATOM 0 HG SER A 133 182.334 -13.079 15.146 1.00 0.00 H new ATOM 836 N ASN A 134 178.359 -11.494 11.844 1.00 0.00 N ATOM 837 CA ASN A 134 176.912 -11.569 11.482 1.00 0.00 C ATOM 838 C ASN A 134 176.727 -11.356 9.969 1.00 0.00 C ATOM 839 O ASN A 134 175.657 -11.585 9.436 1.00 0.00 O ATOM 840 CB ASN A 134 176.242 -10.443 12.272 1.00 0.00 C ATOM 841 CG ASN A 134 174.762 -10.772 12.472 1.00 0.00 C ATOM 842 OD1 ASN A 134 174.257 -10.741 13.675 1.00 0.00 O flip ATOM 843 ND2 ASN A 134 174.058 -11.059 11.525 1.00 0.00 N flip ATOM 0 H ASN A 134 178.760 -10.557 11.822 1.00 0.00 H new ATOM 0 HA ASN A 134 176.480 -12.541 11.718 1.00 0.00 H new ATOM 0 HB2 ASN A 134 176.732 -10.320 13.238 1.00 0.00 H new ATOM 0 HB3 ASN A 134 176.347 -9.498 11.739 1.00 0.00 H new ATOM 0 HD21 ASN A 134 174.453 -11.083 10.585 1.00 0.00 H new ATOM 0 HD22 ASN A 134 173.072 -11.276 11.670 1.00 0.00 H new ATOM 850 N GLY A 135 177.757 -10.927 9.275 1.00 0.00 N ATOM 851 CA GLY A 135 177.637 -10.708 7.803 1.00 0.00 C ATOM 852 C GLY A 135 177.050 -9.321 7.525 1.00 0.00 C ATOM 853 O GLY A 135 176.441 -9.093 6.497 1.00 0.00 O ATOM 0 H GLY A 135 178.675 -10.720 9.669 1.00 0.00 H new ATOM 0 HA2 GLY A 135 178.616 -10.798 7.333 1.00 0.00 H new ATOM 0 HA3 GLY A 135 177.000 -11.476 7.364 1.00 0.00 H new ATOM 857 N GLU A 136 177.220 -8.399 8.440 1.00 0.00 N ATOM 858 CA GLU A 136 176.661 -7.029 8.239 1.00 0.00 C ATOM 859 C GLU A 136 177.780 -6.003 8.046 1.00 0.00 C ATOM 860 O GLU A 136 178.796 -6.039 8.714 1.00 0.00 O ATOM 861 CB GLU A 136 175.877 -6.732 9.517 1.00 0.00 C ATOM 862 CG GLU A 136 174.663 -7.661 9.598 1.00 0.00 C ATOM 863 CD GLU A 136 173.877 -7.365 10.878 1.00 0.00 C ATOM 864 OE1 GLU A 136 174.290 -7.836 11.925 1.00 0.00 O ATOM 865 OE2 GLU A 136 172.877 -6.672 10.788 1.00 0.00 O ATOM 0 H GLU A 136 177.722 -8.537 9.317 1.00 0.00 H new ATOM 0 HA GLU A 136 176.036 -6.973 7.348 1.00 0.00 H new ATOM 0 HB2 GLU A 136 176.515 -6.873 10.389 1.00 0.00 H new ATOM 0 HB3 GLU A 136 175.553 -5.691 9.524 1.00 0.00 H new ATOM 0 HG2 GLU A 136 174.025 -7.519 8.726 1.00 0.00 H new ATOM 0 HG3 GLU A 136 174.987 -8.702 9.590 1.00 0.00 H new ATOM 872 N ILE A 137 177.586 -5.082 7.139 1.00 0.00 N ATOM 873 CA ILE A 137 178.615 -4.030 6.891 1.00 0.00 C ATOM 874 C ILE A 137 177.961 -2.645 6.994 1.00 0.00 C ATOM 875 O ILE A 137 176.806 -2.463 6.657 1.00 0.00 O ATOM 876 CB ILE A 137 179.152 -4.310 5.476 1.00 0.00 C ATOM 877 CG1 ILE A 137 180.023 -5.572 5.511 1.00 0.00 C ATOM 878 CG2 ILE A 137 180.010 -3.137 4.980 1.00 0.00 C ATOM 879 CD1 ILE A 137 179.144 -6.824 5.501 1.00 0.00 C ATOM 0 H ILE A 137 176.752 -5.013 6.555 1.00 0.00 H new ATOM 0 HA ILE A 137 179.427 -4.046 7.618 1.00 0.00 H new ATOM 0 HB ILE A 137 178.306 -4.444 4.802 1.00 0.00 H new ATOM 0 HG12 ILE A 137 180.694 -5.583 4.652 1.00 0.00 H new ATOM 0 HG13 ILE A 137 180.649 -5.566 6.404 1.00 0.00 H new ATOM 0 HG21 ILE A 137 180.380 -3.355 3.978 1.00 0.00 H new ATOM 0 HG22 ILE A 137 179.406 -2.230 4.955 1.00 0.00 H new ATOM 0 HG23 ILE A 137 180.854 -2.993 5.655 1.00 0.00 H new ATOM 0 HD11 ILE A 137 179.775 -7.712 5.526 1.00 0.00 H new ATOM 0 HD12 ILE A 137 178.492 -6.818 6.374 1.00 0.00 H new ATOM 0 HD13 ILE A 137 178.538 -6.836 4.595 1.00 0.00 H new ATOM 891 N ASP A 138 178.700 -1.682 7.468 1.00 0.00 N ATOM 892 CA ASP A 138 178.141 -0.303 7.615 1.00 0.00 C ATOM 893 C ASP A 138 177.903 0.320 6.235 1.00 0.00 C ATOM 894 O ASP A 138 178.829 0.556 5.482 1.00 0.00 O ATOM 895 CB ASP A 138 179.208 0.481 8.381 1.00 0.00 C ATOM 896 CG ASP A 138 178.649 1.847 8.786 1.00 0.00 C ATOM 897 OD1 ASP A 138 177.920 2.424 7.996 1.00 0.00 O ATOM 898 OD2 ASP A 138 178.958 2.292 9.878 1.00 0.00 O ATOM 0 H ASP A 138 179.671 -1.788 7.762 1.00 0.00 H new ATOM 0 HA ASP A 138 177.183 -0.300 8.136 1.00 0.00 H new ATOM 0 HB2 ASP A 138 179.516 -0.074 9.267 1.00 0.00 H new ATOM 0 HB3 ASP A 138 180.095 0.609 7.761 1.00 0.00 H new ATOM 903 N TYR A 139 176.662 0.567 5.894 1.00 0.00 N ATOM 904 CA TYR A 139 176.344 1.153 4.552 1.00 0.00 C ATOM 905 C TYR A 139 176.858 2.594 4.430 1.00 0.00 C ATOM 906 O TYR A 139 177.331 3.002 3.385 1.00 0.00 O ATOM 907 CB TYR A 139 174.807 1.108 4.440 1.00 0.00 C ATOM 908 CG TYR A 139 174.157 2.030 5.450 1.00 0.00 C ATOM 909 CD1 TYR A 139 173.935 3.375 5.126 1.00 0.00 C ATOM 910 CD2 TYR A 139 173.764 1.539 6.700 1.00 0.00 C ATOM 911 CE1 TYR A 139 173.323 4.226 6.053 1.00 0.00 C ATOM 912 CE2 TYR A 139 173.154 2.390 7.626 1.00 0.00 C ATOM 913 CZ TYR A 139 172.933 3.734 7.303 1.00 0.00 C ATOM 914 OH TYR A 139 172.329 4.574 8.217 1.00 0.00 O ATOM 0 H TYR A 139 175.852 0.388 6.488 1.00 0.00 H new ATOM 0 HA TYR A 139 176.829 0.594 3.751 1.00 0.00 H new ATOM 0 HB2 TYR A 139 174.505 1.396 3.433 1.00 0.00 H new ATOM 0 HB3 TYR A 139 174.458 0.088 4.598 1.00 0.00 H new ATOM 0 HD1 TYR A 139 174.236 3.755 4.161 1.00 0.00 H new ATOM 0 HD2 TYR A 139 173.932 0.502 6.949 1.00 0.00 H new ATOM 0 HE1 TYR A 139 173.152 5.263 5.803 1.00 0.00 H new ATOM 0 HE2 TYR A 139 172.853 2.010 8.591 1.00 0.00 H new ATOM 0 HH TYR A 139 172.121 4.073 9.033 1.00 0.00 H new ATOM 924 N LYS A 140 176.754 3.369 5.480 1.00 0.00 N ATOM 925 CA LYS A 140 177.219 4.789 5.413 1.00 0.00 C ATOM 926 C LYS A 140 178.729 4.837 5.170 1.00 0.00 C ATOM 927 O LYS A 140 179.230 5.684 4.454 1.00 0.00 O ATOM 928 CB LYS A 140 176.873 5.401 6.779 1.00 0.00 C ATOM 929 CG LYS A 140 175.766 6.448 6.616 1.00 0.00 C ATOM 930 CD LYS A 140 175.154 6.759 7.983 1.00 0.00 C ATOM 931 CE LYS A 140 173.882 7.589 7.798 1.00 0.00 C ATOM 932 NZ LYS A 140 173.332 7.763 9.170 1.00 0.00 N ATOM 0 H LYS A 140 176.368 3.081 6.379 1.00 0.00 H new ATOM 0 HA LYS A 140 176.745 5.336 4.598 1.00 0.00 H new ATOM 0 HB2 LYS A 140 176.548 4.619 7.466 1.00 0.00 H new ATOM 0 HB3 LYS A 140 177.759 5.861 7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 140 176.173 7.357 6.172 1.00 0.00 H new ATOM 0 HG3 LYS A 140 174.998 6.078 5.937 1.00 0.00 H new ATOM 0 HD2 LYS A 140 174.923 5.833 8.509 1.00 0.00 H new ATOM 0 HD3 LYS A 140 175.870 7.304 8.598 1.00 0.00 H new ATOM 0 HE2 LYS A 140 174.103 8.551 7.336 1.00 0.00 H new ATOM 0 HE3 LYS A 140 173.170 7.080 7.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 172.457 8.323 9.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 173.125 6.831 9.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 174.029 8.257 9.763 1.00 0.00 H new ATOM 946 N LYS A 141 179.451 3.933 5.776 1.00 0.00 N ATOM 947 CA LYS A 141 180.934 3.909 5.609 1.00 0.00 C ATOM 948 C LYS A 141 181.318 3.472 4.192 1.00 0.00 C ATOM 949 O LYS A 141 182.228 4.011 3.590 1.00 0.00 O ATOM 950 CB LYS A 141 181.437 2.888 6.632 1.00 0.00 C ATOM 951 CG LYS A 141 181.224 3.432 8.046 1.00 0.00 C ATOM 952 CD LYS A 141 182.226 4.556 8.317 1.00 0.00 C ATOM 953 CE LYS A 141 182.094 5.018 9.771 1.00 0.00 C ATOM 954 NZ LYS A 141 182.652 6.398 9.787 1.00 0.00 N ATOM 0 H LYS A 141 179.075 3.205 6.384 1.00 0.00 H new ATOM 0 HA LYS A 141 181.371 4.896 5.762 1.00 0.00 H new ATOM 0 HB2 LYS A 141 180.906 1.944 6.511 1.00 0.00 H new ATOM 0 HB3 LYS A 141 182.494 2.682 6.466 1.00 0.00 H new ATOM 0 HG2 LYS A 141 180.205 3.805 8.154 1.00 0.00 H new ATOM 0 HG3 LYS A 141 181.351 2.634 8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 141 183.241 4.207 8.126 1.00 0.00 H new ATOM 0 HD3 LYS A 141 182.044 5.391 7.641 1.00 0.00 H new ATOM 0 HE2 LYS A 141 181.053 5.009 10.095 1.00 0.00 H new ATOM 0 HE3 LYS A 141 182.644 4.362 10.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 182.597 6.784 10.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 183.645 6.374 9.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 182.104 7.001 9.141 1.00 0.00 H new ATOM 968 N PHE A 142 180.648 2.473 3.671 1.00 0.00 N ATOM 969 CA PHE A 142 180.990 1.963 2.308 1.00 0.00 C ATOM 970 C PHE A 142 180.555 2.961 1.238 1.00 0.00 C ATOM 971 O PHE A 142 181.138 3.032 0.175 1.00 0.00 O ATOM 972 CB PHE A 142 180.231 0.642 2.165 1.00 0.00 C ATOM 973 CG PHE A 142 180.789 -0.160 1.013 1.00 0.00 C ATOM 974 CD1 PHE A 142 182.149 -0.488 0.984 1.00 0.00 C ATOM 975 CD2 PHE A 142 179.940 -0.593 -0.015 1.00 0.00 C ATOM 976 CE1 PHE A 142 182.663 -1.247 -0.075 1.00 0.00 C ATOM 977 CE2 PHE A 142 180.455 -1.356 -1.072 1.00 0.00 C ATOM 978 CZ PHE A 142 181.815 -1.682 -1.102 1.00 0.00 C ATOM 0 H PHE A 142 179.878 1.989 4.132 1.00 0.00 H new ATOM 0 HA PHE A 142 182.064 1.823 2.183 1.00 0.00 H new ATOM 0 HB2 PHE A 142 180.309 0.068 3.088 1.00 0.00 H new ATOM 0 HB3 PHE A 142 179.172 0.839 2.001 1.00 0.00 H new ATOM 0 HD1 PHE A 142 182.802 -0.156 1.778 1.00 0.00 H new ATOM 0 HD2 PHE A 142 178.891 -0.339 0.007 1.00 0.00 H new ATOM 0 HE1 PHE A 142 183.713 -1.497 -0.100 1.00 0.00 H new ATOM 0 HE2 PHE A 142 179.802 -1.692 -1.863 1.00 0.00 H new ATOM 0 HZ PHE A 142 182.211 -2.269 -1.917 1.00 0.00 H new ATOM 988 N ILE A 143 179.538 3.732 1.511 1.00 0.00 N ATOM 989 CA ILE A 143 179.058 4.732 0.513 1.00 0.00 C ATOM 990 C ILE A 143 179.865 6.031 0.630 1.00 0.00 C ATOM 991 O ILE A 143 180.397 6.532 -0.343 1.00 0.00 O ATOM 992 CB ILE A 143 177.587 4.957 0.882 1.00 0.00 C ATOM 993 CG1 ILE A 143 176.810 3.653 0.697 1.00 0.00 C ATOM 994 CG2 ILE A 143 176.979 6.033 -0.016 1.00 0.00 C ATOM 995 CD1 ILE A 143 175.438 3.778 1.362 1.00 0.00 C ATOM 0 H ILE A 143 179.016 3.713 2.387 1.00 0.00 H new ATOM 0 HA ILE A 143 179.175 4.394 -0.517 1.00 0.00 H new ATOM 0 HB ILE A 143 177.529 5.280 1.921 1.00 0.00 H new ATOM 0 HG12 ILE A 143 176.693 3.434 -0.364 1.00 0.00 H new ATOM 0 HG13 ILE A 143 177.364 2.822 1.134 1.00 0.00 H new ATOM 0 HG21 ILE A 143 175.934 6.185 0.255 1.00 0.00 H new ATOM 0 HG22 ILE A 143 177.527 6.967 0.113 1.00 0.00 H new ATOM 0 HG23 ILE A 143 177.042 5.716 -1.057 1.00 0.00 H new ATOM 0 HD11 ILE A 143 174.884 2.849 1.230 1.00 0.00 H new ATOM 0 HD12 ILE A 143 175.566 3.976 2.426 1.00 0.00 H new ATOM 0 HD13 ILE A 143 174.885 4.598 0.904 1.00 0.00 H new ATOM 1007 N GLU A 144 179.959 6.576 1.816 1.00 0.00 N ATOM 1008 CA GLU A 144 180.729 7.844 2.011 1.00 0.00 C ATOM 1009 C GLU A 144 182.200 7.648 1.636 1.00 0.00 C ATOM 1010 O GLU A 144 182.865 8.583 1.228 1.00 0.00 O ATOM 1011 CB GLU A 144 180.602 8.166 3.501 1.00 0.00 C ATOM 1012 CG GLU A 144 179.165 8.588 3.814 1.00 0.00 C ATOM 1013 CD GLU A 144 179.032 8.903 5.307 1.00 0.00 C ATOM 1014 OE1 GLU A 144 180.010 9.335 5.894 1.00 0.00 O ATOM 1015 OE2 GLU A 144 177.950 8.712 5.837 1.00 0.00 O ATOM 0 H GLU A 144 179.534 6.196 2.662 1.00 0.00 H new ATOM 0 HA GLU A 144 180.347 8.648 1.382 1.00 0.00 H new ATOM 0 HB2 GLU A 144 180.874 7.294 4.096 1.00 0.00 H new ATOM 0 HB3 GLU A 144 181.293 8.964 3.771 1.00 0.00 H new ATOM 0 HG2 GLU A 144 178.896 9.463 3.223 1.00 0.00 H new ATOM 0 HG3 GLU A 144 178.474 7.792 3.538 1.00 0.00 H new ATOM 1022 N ASP A 145 182.715 6.449 1.756 1.00 0.00 N ATOM 1023 CA ASP A 145 184.145 6.219 1.387 1.00 0.00 C ATOM 1024 C ASP A 145 184.270 5.888 -0.109 1.00 0.00 C ATOM 1025 O ASP A 145 185.348 5.961 -0.669 1.00 0.00 O ATOM 1026 CB ASP A 145 184.634 5.068 2.266 1.00 0.00 C ATOM 1027 CG ASP A 145 186.128 4.844 2.029 1.00 0.00 C ATOM 1028 OD1 ASP A 145 186.474 4.378 0.956 1.00 0.00 O ATOM 1029 OD2 ASP A 145 186.902 5.141 2.925 1.00 0.00 O ATOM 0 H ASP A 145 182.212 5.627 2.090 1.00 0.00 H new ATOM 0 HA ASP A 145 184.752 7.109 1.552 1.00 0.00 H new ATOM 0 HB2 ASP A 145 184.452 5.296 3.316 1.00 0.00 H new ATOM 0 HB3 ASP A 145 184.078 4.159 2.036 1.00 0.00 H new ATOM 1034 N VAL A 146 183.180 5.577 -0.773 1.00 0.00 N ATOM 1035 CA VAL A 146 183.250 5.307 -2.242 1.00 0.00 C ATOM 1036 C VAL A 146 182.884 6.609 -2.975 1.00 0.00 C ATOM 1037 O VAL A 146 183.468 6.957 -3.983 1.00 0.00 O ATOM 1038 CB VAL A 146 182.232 4.181 -2.498 1.00 0.00 C ATOM 1039 CG1 VAL A 146 181.954 4.033 -4.000 1.00 0.00 C ATOM 1040 CG2 VAL A 146 182.805 2.865 -1.971 1.00 0.00 C ATOM 0 H VAL A 146 182.250 5.499 -0.361 1.00 0.00 H new ATOM 0 HA VAL A 146 184.234 5.000 -2.595 1.00 0.00 H new ATOM 0 HB VAL A 146 181.300 4.427 -1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 146 181.232 3.232 -4.159 1.00 0.00 H new ATOM 0 HG12 VAL A 146 181.551 4.968 -4.389 1.00 0.00 H new ATOM 0 HG13 VAL A 146 182.882 3.794 -4.520 1.00 0.00 H new ATOM 0 HG21 VAL A 146 182.091 2.061 -2.148 1.00 0.00 H new ATOM 0 HG22 VAL A 146 183.738 2.642 -2.488 1.00 0.00 H new ATOM 0 HG23 VAL A 146 182.995 2.953 -0.901 1.00 0.00 H new ATOM 1050 N LEU A 147 181.932 7.331 -2.444 1.00 0.00 N ATOM 1051 CA LEU A 147 181.514 8.630 -3.060 1.00 0.00 C ATOM 1052 C LEU A 147 182.684 9.618 -3.121 1.00 0.00 C ATOM 1053 O LEU A 147 182.663 10.565 -3.886 1.00 0.00 O ATOM 1054 CB LEU A 147 180.414 9.177 -2.147 1.00 0.00 C ATOM 1055 CG LEU A 147 179.079 8.522 -2.501 1.00 0.00 C ATOM 1056 CD1 LEU A 147 178.024 8.930 -1.470 1.00 0.00 C ATOM 1057 CD2 LEU A 147 178.637 8.987 -3.891 1.00 0.00 C ATOM 0 H LEU A 147 181.419 7.075 -1.600 1.00 0.00 H new ATOM 0 HA LEU A 147 181.171 8.488 -4.085 1.00 0.00 H new ATOM 0 HB2 LEU A 147 180.662 8.980 -1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 147 180.340 10.259 -2.258 1.00 0.00 H new ATOM 0 HG LEU A 147 179.193 7.438 -2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 147 177.071 8.464 -1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 147 178.338 8.603 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 147 177.910 10.014 -1.475 1.00 0.00 H new ATOM 0 HD21 LEU A 147 177.685 8.521 -4.145 1.00 0.00 H new ATOM 0 HD22 LEU A 147 178.522 10.071 -3.893 1.00 0.00 H new ATOM 0 HD23 LEU A 147 179.389 8.701 -4.627 1.00 0.00 H new ATOM 1069 N ARG A 148 183.704 9.407 -2.325 1.00 0.00 N ATOM 1070 CA ARG A 148 184.881 10.337 -2.340 1.00 0.00 C ATOM 1071 C ARG A 148 185.492 10.397 -3.743 1.00 0.00 C ATOM 1072 O ARG A 148 185.633 9.390 -4.411 1.00 0.00 O ATOM 1073 CB ARG A 148 185.882 9.729 -1.354 1.00 0.00 C ATOM 1074 CG ARG A 148 185.449 10.045 0.079 1.00 0.00 C ATOM 1075 CD ARG A 148 185.747 11.514 0.389 1.00 0.00 C ATOM 1076 NE ARG A 148 185.973 11.558 1.860 1.00 0.00 N ATOM 1077 CZ ARG A 148 187.128 11.941 2.332 1.00 0.00 C ATOM 1078 NH1 ARG A 148 187.578 13.136 2.063 1.00 0.00 N ATOM 1079 NH2 ARG A 148 187.833 11.128 3.071 1.00 0.00 N ATOM 0 H ARG A 148 183.774 8.632 -1.665 1.00 0.00 H new ATOM 0 HA ARG A 148 184.602 11.355 -2.067 1.00 0.00 H new ATOM 0 HB2 ARG A 148 185.939 8.650 -1.498 1.00 0.00 H new ATOM 0 HB3 ARG A 148 186.879 10.129 -1.540 1.00 0.00 H new ATOM 0 HG2 ARG A 148 184.385 9.845 0.201 1.00 0.00 H new ATOM 0 HG3 ARG A 148 185.977 9.400 0.781 1.00 0.00 H new ATOM 0 HD2 ARG A 148 186.624 11.862 -0.156 1.00 0.00 H new ATOM 0 HD3 ARG A 148 184.915 12.156 0.098 1.00 0.00 H new ATOM 0 HE ARG A 148 185.225 11.289 2.499 1.00 0.00 H new ATOM 0 HH11 ARG A 148 187.027 13.770 1.484 1.00 0.00 H new ATOM 0 HH12 ARG A 148 188.481 13.436 2.432 1.00 0.00 H new ATOM 0 HH21 ARG A 148 187.481 10.194 3.279 1.00 0.00 H new ATOM 0 HH22 ARG A 148 188.736 11.427 3.440 1.00 0.00 H new ATOM 1093 N GLN A 149 185.853 11.573 -4.192 1.00 0.00 N ATOM 1094 CA GLN A 149 186.457 11.710 -5.551 1.00 0.00 C ATOM 1095 C GLN A 149 187.150 13.068 -5.687 1.00 0.00 C ATOM 1096 O GLN A 149 188.368 13.084 -5.754 1.00 0.00 O ATOM 1097 CB GLN A 149 185.276 11.610 -6.518 1.00 0.00 C ATOM 1098 CG GLN A 149 185.788 11.663 -7.959 1.00 0.00 C ATOM 1099 CD GLN A 149 184.624 11.435 -8.925 1.00 0.00 C ATOM 1100 OE1 GLN A 149 183.550 11.969 -8.737 1.00 0.00 O ATOM 1101 NE2 GLN A 149 184.794 10.656 -9.958 1.00 0.00 N ATOM 1102 OXT GLN A 149 186.451 14.067 -5.721 1.00 0.00 O ATOM 0 H GLN A 149 185.755 12.446 -3.674 1.00 0.00 H new ATOM 0 HA GLN A 149 187.212 10.949 -5.748 1.00 0.00 H new ATOM 0 HB2 GLN A 149 184.732 10.681 -6.349 1.00 0.00 H new ATOM 0 HB3 GLN A 149 184.576 12.427 -6.339 1.00 0.00 H new ATOM 0 HG2 GLN A 149 186.253 12.629 -8.155 1.00 0.00 H new ATOM 0 HG3 GLN A 149 186.555 10.903 -8.112 1.00 0.00 H new ATOM 0 HE21 GLN A 149 185.696 10.208 -10.116 1.00 0.00 H new ATOM 0 HE22 GLN A 149 184.024 10.496 -10.608 1.00 0.00 H new TER 1111 GLN A 149