USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 650 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 127 HIS :FLIP no HE2:sc= -7.22! C(o=-8.8!,f=-7.5!) USER MOD Set 1.2: A 129 THR OG1 : rot -68:sc= -0.312 USER MOD Set 2.1: A 71 THR OG1 : rot -122:sc= 1.01 USER MOD Set 2.2: A 75 TYR OH : rot -94:sc= 1.24 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.00592 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 150:sc= -0.54 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 1:sc= 1.18 USER MOD Single : A 88 MET CE :methyl 144:sc= -0.345 (180deg=-0.914) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 HIS : no HD1:sc= -1.42 K(o=-1.4,f=-4!) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 SER OG : rot 36:sc= 0.0206 USER MOD Single : A 117 TYR OH : rot 161:sc= 0.324 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.32 USER MOD Single : A 132 TYR OH : rot 180:sc= -0.19 USER MOD Single : A 133 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 63 -25.857 4.114 -12.937 1.00 0.00 N ATOM 2 CA GLU A 63 -24.470 3.787 -12.500 1.00 0.00 C ATOM 3 C GLU A 63 -23.438 4.645 -13.234 1.00 0.00 C ATOM 4 O GLU A 63 -23.574 4.907 -14.431 1.00 0.00 O ATOM 5 CB GLU A 63 -24.203 2.294 -12.752 1.00 0.00 C ATOM 6 CG GLU A 63 -24.435 1.851 -14.193 1.00 0.00 C ATOM 7 CD GLU A 63 -24.085 0.392 -14.419 1.00 0.00 C ATOM 8 OE1 GLU A 63 -24.970 -0.469 -14.221 1.00 0.00 O ATOM 9 OE2 GLU A 63 -22.928 0.110 -14.793 1.00 0.00 O ATOM 0 HA GLU A 63 -24.377 4.004 -11.436 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -23.173 2.069 -12.476 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -24.844 1.706 -12.095 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -25.480 2.015 -14.456 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -23.837 2.472 -14.861 1.00 0.00 H new ATOM 18 N GLU A 64 -22.407 5.083 -12.506 1.00 0.00 N ATOM 19 CA GLU A 64 -21.349 5.913 -13.082 1.00 0.00 C ATOM 20 C GLU A 64 -19.974 5.274 -12.893 1.00 0.00 C ATOM 21 O GLU A 64 -19.790 4.418 -12.027 1.00 0.00 O ATOM 22 CB GLU A 64 -21.368 7.302 -12.457 1.00 0.00 C ATOM 23 CG GLU A 64 -22.615 8.107 -12.799 1.00 0.00 C ATOM 24 CD GLU A 64 -22.299 9.521 -13.249 1.00 0.00 C ATOM 25 OE1 GLU A 64 -21.970 9.707 -14.439 1.00 0.00 O ATOM 26 OE2 GLU A 64 -22.380 10.444 -12.411 1.00 0.00 O ATOM 0 H GLU A 64 -22.284 4.875 -11.515 1.00 0.00 H new ATOM 0 HA GLU A 64 -21.538 5.998 -14.152 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -21.294 7.205 -11.374 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -20.488 7.853 -12.789 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -23.167 7.595 -13.587 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -23.267 8.146 -11.926 1.00 0.00 H new ATOM 33 N THR A 65 -19.013 5.701 -13.714 1.00 0.00 N ATOM 34 CA THR A 65 -17.644 5.182 -13.654 1.00 0.00 C ATOM 35 C THR A 65 -16.630 6.328 -13.652 1.00 0.00 C ATOM 36 O THR A 65 -16.831 7.349 -14.310 1.00 0.00 O ATOM 37 CB THR A 65 -17.378 4.235 -14.829 1.00 0.00 C ATOM 38 OG1 THR A 65 -17.226 4.954 -16.042 1.00 0.00 O ATOM 39 CG2 THR A 65 -18.475 3.209 -15.036 1.00 0.00 C ATOM 0 H THR A 65 -19.159 6.410 -14.433 1.00 0.00 H new ATOM 0 HA THR A 65 -17.531 4.623 -12.725 1.00 0.00 H new ATOM 0 HB THR A 65 -16.458 3.713 -14.567 1.00 0.00 H new ATOM 0 HG1 THR A 65 -17.056 4.326 -16.775 1.00 0.00 H new ATOM 0 HG21 THR A 65 -18.222 2.572 -15.883 1.00 0.00 H new ATOM 0 HG22 THR A 65 -18.575 2.597 -14.139 1.00 0.00 H new ATOM 0 HG23 THR A 65 -19.418 3.719 -15.234 1.00 0.00 H new ATOM 47 N CYS A 66 -15.539 6.140 -12.910 1.00 0.00 N ATOM 48 CA CYS A 66 -14.473 7.136 -12.807 1.00 0.00 C ATOM 49 C CYS A 66 -13.181 6.550 -13.353 1.00 0.00 C ATOM 50 O CYS A 66 -12.840 5.409 -13.044 1.00 0.00 O ATOM 51 CB CYS A 66 -14.254 7.552 -11.357 1.00 0.00 C ATOM 52 SG CYS A 66 -15.749 8.123 -10.489 1.00 0.00 S ATOM 0 H CYS A 66 -15.369 5.295 -12.365 1.00 0.00 H new ATOM 0 HA CYS A 66 -14.766 8.013 -13.384 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -13.835 6.707 -10.811 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -13.510 8.348 -11.331 1.00 0.00 H new ATOM 57 N PHE A 67 -12.466 7.315 -14.168 1.00 0.00 N ATOM 58 CA PHE A 67 -11.219 6.832 -14.743 1.00 0.00 C ATOM 59 C PHE A 67 -10.008 7.567 -14.179 1.00 0.00 C ATOM 60 O PHE A 67 -9.898 8.789 -14.305 1.00 0.00 O ATOM 61 CB PHE A 67 -11.234 6.956 -16.259 1.00 0.00 C ATOM 62 CG PHE A 67 -9.934 6.552 -16.892 1.00 0.00 C ATOM 63 CD1 PHE A 67 -9.574 5.216 -16.954 1.00 0.00 C ATOM 64 CD2 PHE A 67 -9.058 7.505 -17.390 1.00 0.00 C ATOM 65 CE1 PHE A 67 -8.366 4.839 -17.506 1.00 0.00 C ATOM 66 CE2 PHE A 67 -7.845 7.132 -17.934 1.00 0.00 C ATOM 67 CZ PHE A 67 -7.500 5.797 -17.995 1.00 0.00 C ATOM 0 H PHE A 67 -12.725 8.262 -14.443 1.00 0.00 H new ATOM 0 HA PHE A 67 -11.134 5.780 -14.471 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -12.036 6.337 -16.661 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -11.460 7.987 -16.532 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -10.244 4.463 -16.567 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -9.328 8.550 -17.352 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -8.098 3.794 -17.555 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -7.167 7.884 -18.311 1.00 0.00 H new ATOM 0 HZ PHE A 67 -6.554 5.502 -18.425 1.00 0.00 H new ATOM 77 N ASP A 68 -9.083 6.807 -13.588 1.00 0.00 N ATOM 78 CA ASP A 68 -7.860 7.380 -13.042 1.00 0.00 C ATOM 79 C ASP A 68 -6.715 7.175 -14.034 1.00 0.00 C ATOM 80 O ASP A 68 -6.131 6.093 -14.103 1.00 0.00 O ATOM 81 CB ASP A 68 -7.508 6.763 -11.684 1.00 0.00 C ATOM 82 CG ASP A 68 -6.497 7.592 -10.911 1.00 0.00 C ATOM 83 OD1 ASP A 68 -6.725 8.810 -10.751 1.00 0.00 O ATOM 84 OD2 ASP A 68 -5.480 7.023 -10.463 1.00 0.00 O ATOM 0 H ASP A 68 -9.161 5.796 -13.478 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.020 8.447 -12.884 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.416 6.658 -11.090 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -7.109 5.760 -11.837 1.00 0.00 H new ATOM 89 N LYS A 69 -6.417 8.213 -14.821 1.00 0.00 N ATOM 90 CA LYS A 69 -5.356 8.145 -15.838 1.00 0.00 C ATOM 91 C LYS A 69 -4.000 7.725 -15.253 1.00 0.00 C ATOM 92 O LYS A 69 -3.109 7.311 -15.998 1.00 0.00 O ATOM 93 CB LYS A 69 -5.222 9.495 -16.562 1.00 0.00 C ATOM 94 CG LYS A 69 -4.825 10.656 -15.656 1.00 0.00 C ATOM 95 CD LYS A 69 -4.874 11.991 -16.392 1.00 0.00 C ATOM 96 CE LYS A 69 -6.283 12.567 -16.427 1.00 0.00 C ATOM 97 NZ LYS A 69 -6.331 13.885 -17.122 1.00 0.00 N ATOM 0 H LYS A 69 -6.895 9.113 -14.775 1.00 0.00 H new ATOM 0 HA LYS A 69 -5.651 7.375 -16.550 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.480 9.397 -17.354 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.171 9.732 -17.042 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.493 10.691 -14.796 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.819 10.490 -15.272 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -4.204 12.699 -15.905 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.511 11.858 -17.411 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.948 11.867 -16.932 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.653 12.681 -15.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -7.308 14.241 -17.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.716 14.562 -16.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.002 13.773 -18.102 1.00 0.00 H new ATOM 111 N TYR A 70 -3.838 7.829 -13.929 1.00 0.00 N ATOM 112 CA TYR A 70 -2.584 7.453 -13.279 1.00 0.00 C ATOM 113 C TYR A 70 -2.364 5.944 -13.383 1.00 0.00 C ATOM 114 O TYR A 70 -1.270 5.486 -13.719 1.00 0.00 O ATOM 115 CB TYR A 70 -2.592 7.872 -11.814 1.00 0.00 C ATOM 116 CG TYR A 70 -2.586 9.372 -11.575 1.00 0.00 C ATOM 117 CD1 TYR A 70 -3.292 10.242 -12.398 1.00 0.00 C ATOM 118 CD2 TYR A 70 -1.897 9.913 -10.499 1.00 0.00 C ATOM 119 CE1 TYR A 70 -3.305 11.600 -12.158 1.00 0.00 C ATOM 120 CE2 TYR A 70 -1.912 11.264 -10.250 1.00 0.00 C ATOM 121 CZ TYR A 70 -2.615 12.107 -11.081 1.00 0.00 C ATOM 122 OH TYR A 70 -2.629 13.461 -10.833 1.00 0.00 O ATOM 0 H TYR A 70 -4.558 8.169 -13.292 1.00 0.00 H new ATOM 0 HA TYR A 70 -1.769 7.968 -13.787 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -3.474 7.447 -11.335 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -1.721 7.438 -11.323 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -3.840 9.847 -13.241 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -1.338 9.260 -9.845 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -3.854 12.262 -12.812 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -1.373 11.664 -9.404 1.00 0.00 H new ATOM 0 HH TYR A 70 -2.094 13.653 -10.035 1.00 0.00 H new ATOM 132 N THR A 71 -3.423 5.181 -13.097 1.00 0.00 N ATOM 133 CA THR A 71 -3.372 3.720 -13.161 1.00 0.00 C ATOM 134 C THR A 71 -3.774 3.236 -14.560 1.00 0.00 C ATOM 135 O THR A 71 -3.042 2.478 -15.199 1.00 0.00 O ATOM 136 CB THR A 71 -4.284 3.090 -12.090 1.00 0.00 C ATOM 137 OG1 THR A 71 -5.569 2.809 -12.616 1.00 0.00 O ATOM 138 CG2 THR A 71 -4.476 3.956 -10.858 1.00 0.00 C ATOM 0 H THR A 71 -4.330 5.555 -12.818 1.00 0.00 H new ATOM 0 HA THR A 71 -2.348 3.404 -12.961 1.00 0.00 H new ATOM 0 HB THR A 71 -3.768 2.177 -11.792 1.00 0.00 H new ATOM 0 HG1 THR A 71 -6.249 3.276 -12.086 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.129 3.444 -10.152 1.00 0.00 H new ATOM 0 HG22 THR A 71 -3.510 4.141 -10.389 1.00 0.00 H new ATOM 0 HG23 THR A 71 -4.927 4.905 -11.147 1.00 0.00 H new ATOM 146 N GLY A 72 -4.942 3.693 -15.031 1.00 0.00 N ATOM 147 CA GLY A 72 -5.438 3.320 -16.352 1.00 0.00 C ATOM 148 C GLY A 72 -6.649 2.398 -16.306 1.00 0.00 C ATOM 149 O GLY A 72 -7.033 1.830 -17.330 1.00 0.00 O ATOM 0 H GLY A 72 -5.557 4.321 -14.513 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -5.700 4.224 -16.902 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -4.638 2.830 -16.907 1.00 0.00 H new ATOM 153 N ASN A 73 -7.264 2.262 -15.128 1.00 0.00 N ATOM 154 CA ASN A 73 -8.455 1.422 -14.965 1.00 0.00 C ATOM 155 C ASN A 73 -9.644 2.271 -14.514 1.00 0.00 C ATOM 156 O ASN A 73 -9.463 3.250 -13.791 1.00 0.00 O ATOM 157 CB ASN A 73 -8.189 0.312 -13.952 1.00 0.00 C ATOM 158 CG ASN A 73 -7.674 -0.962 -14.600 1.00 0.00 C ATOM 159 OD1 ASN A 73 -6.466 -1.182 -14.683 1.00 0.00 O ATOM 160 ND2 ASN A 73 -8.589 -1.807 -15.064 1.00 0.00 N ATOM 0 H ASN A 73 -6.957 2.723 -14.272 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.692 0.967 -15.927 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.462 0.661 -13.219 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.109 0.093 -13.410 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.300 -2.678 -15.510 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -9.580 -1.585 -14.974 1.00 0.00 H new ATOM 167 N THR A 74 -10.861 1.892 -14.918 1.00 0.00 N ATOM 168 CA THR A 74 -12.054 2.637 -14.508 1.00 0.00 C ATOM 169 C THR A 74 -12.587 2.099 -13.186 1.00 0.00 C ATOM 170 O THR A 74 -12.280 0.971 -12.794 1.00 0.00 O ATOM 171 CB THR A 74 -13.163 2.592 -15.560 1.00 0.00 C ATOM 172 OG1 THR A 74 -12.683 2.090 -16.796 1.00 0.00 O ATOM 173 CG2 THR A 74 -13.785 3.952 -15.816 1.00 0.00 C ATOM 0 H THR A 74 -11.044 1.088 -15.518 1.00 0.00 H new ATOM 0 HA THR A 74 -11.750 3.677 -14.391 1.00 0.00 H new ATOM 0 HB THR A 74 -13.923 1.927 -15.150 1.00 0.00 H new ATOM 0 HG1 THR A 74 -13.415 2.071 -17.448 1.00 0.00 H new ATOM 0 HG21 THR A 74 -14.565 3.859 -16.571 1.00 0.00 H new ATOM 0 HG22 THR A 74 -14.218 4.334 -14.892 1.00 0.00 H new ATOM 0 HG23 THR A 74 -13.019 4.642 -16.169 1.00 0.00 H new ATOM 181 N TYR A 75 -13.376 2.918 -12.500 1.00 0.00 N ATOM 182 CA TYR A 75 -13.949 2.541 -11.213 1.00 0.00 C ATOM 183 C TYR A 75 -15.398 2.963 -11.129 1.00 0.00 C ATOM 184 O TYR A 75 -15.721 4.123 -11.364 1.00 0.00 O ATOM 185 CB TYR A 75 -13.165 3.211 -10.087 1.00 0.00 C ATOM 186 CG TYR A 75 -11.683 3.198 -10.333 1.00 0.00 C ATOM 187 CD1 TYR A 75 -10.942 2.074 -10.034 1.00 0.00 C ATOM 188 CD2 TYR A 75 -11.041 4.292 -10.896 1.00 0.00 C ATOM 189 CE1 TYR A 75 -9.580 2.035 -10.282 1.00 0.00 C ATOM 190 CE2 TYR A 75 -9.685 4.266 -11.154 1.00 0.00 C ATOM 191 CZ TYR A 75 -8.958 3.133 -10.844 1.00 0.00 C ATOM 192 OH TYR A 75 -7.606 3.099 -11.096 1.00 0.00 O ATOM 0 H TYR A 75 -13.635 3.853 -12.816 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.891 1.457 -11.114 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -13.503 4.241 -9.976 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -13.379 2.703 -9.147 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -11.430 1.213 -9.601 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -11.611 5.177 -11.136 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -9.008 1.152 -10.038 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -9.197 5.123 -11.594 1.00 0.00 H new ATOM 0 HH TYR A 75 -7.122 3.494 -10.341 1.00 0.00 H new ATOM 202 N ARG A 76 -16.270 2.041 -10.747 1.00 0.00 N ATOM 203 CA ARG A 76 -17.668 2.382 -10.590 1.00 0.00 C ATOM 204 C ARG A 76 -17.814 3.152 -9.286 1.00 0.00 C ATOM 205 O ARG A 76 -17.044 2.924 -8.353 1.00 0.00 O ATOM 206 CB ARG A 76 -18.547 1.149 -10.607 1.00 0.00 C ATOM 207 CG ARG A 76 -19.322 1.022 -11.904 1.00 0.00 C ATOM 208 CD ARG A 76 -20.604 0.240 -11.719 1.00 0.00 C ATOM 209 NE ARG A 76 -20.629 -0.992 -12.513 1.00 0.00 N ATOM 210 CZ ARG A 76 -21.639 -1.867 -12.506 1.00 0.00 C ATOM 211 NH1 ARG A 76 -22.714 -1.656 -11.750 1.00 0.00 N ATOM 212 NH2 ARG A 76 -21.574 -2.959 -13.258 1.00 0.00 N ATOM 0 H ARG A 76 -16.036 1.069 -10.544 1.00 0.00 H new ATOM 0 HA ARG A 76 -17.996 2.999 -11.427 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -17.930 0.262 -10.465 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -19.244 1.189 -9.770 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -19.555 2.016 -12.287 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -18.701 0.529 -12.652 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -20.725 -0.008 -10.665 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -21.451 0.866 -11.999 1.00 0.00 H new ATOM 0 HE ARG A 76 -19.825 -1.194 -13.108 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -22.772 -0.820 -11.169 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -23.479 -2.330 -11.752 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -20.754 -3.129 -13.840 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -22.344 -3.628 -13.254 1.00 0.00 H new ATOM 226 N VAL A 77 -18.751 4.089 -9.215 1.00 0.00 N ATOM 227 CA VAL A 77 -18.903 4.889 -7.999 1.00 0.00 C ATOM 228 C VAL A 77 -18.903 4.000 -6.748 1.00 0.00 C ATOM 229 O VAL A 77 -19.466 2.903 -6.748 1.00 0.00 O ATOM 230 CB VAL A 77 -20.146 5.822 -8.035 1.00 0.00 C ATOM 231 CG1 VAL A 77 -21.146 5.350 -9.067 1.00 0.00 C ATOM 232 CG2 VAL A 77 -20.802 5.966 -6.668 1.00 0.00 C ATOM 0 H VAL A 77 -19.405 4.313 -9.965 1.00 0.00 H new ATOM 0 HA VAL A 77 -18.034 5.546 -7.950 1.00 0.00 H new ATOM 0 HB VAL A 77 -19.792 6.812 -8.324 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -22.006 6.019 -9.073 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -20.680 5.350 -10.052 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -21.474 4.340 -8.821 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -21.665 6.627 -6.746 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -21.126 4.987 -6.315 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -20.085 6.387 -5.963 1.00 0.00 H new ATOM 242 N GLY A 78 -18.259 4.494 -5.690 1.00 0.00 N ATOM 243 CA GLY A 78 -18.169 3.763 -4.436 1.00 0.00 C ATOM 244 C GLY A 78 -17.091 2.685 -4.435 1.00 0.00 C ATOM 245 O GLY A 78 -17.087 1.820 -3.558 1.00 0.00 O ATOM 0 H GLY A 78 -17.792 5.401 -5.682 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -17.968 4.467 -3.628 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -19.133 3.301 -4.224 1.00 0.00 H new ATOM 249 N ASP A 79 -16.153 2.751 -5.390 1.00 0.00 N ATOM 250 CA ASP A 79 -15.051 1.786 -5.452 1.00 0.00 C ATOM 251 C ASP A 79 -13.748 2.506 -5.147 1.00 0.00 C ATOM 252 O ASP A 79 -13.442 3.527 -5.768 1.00 0.00 O ATOM 253 CB ASP A 79 -14.947 1.096 -6.828 1.00 0.00 C ATOM 254 CG ASP A 79 -16.270 0.521 -7.305 1.00 0.00 C ATOM 255 OD1 ASP A 79 -17.186 0.354 -6.471 1.00 0.00 O ATOM 256 OD2 ASP A 79 -16.387 0.230 -8.514 1.00 0.00 O ATOM 0 H ASP A 79 -16.136 3.458 -6.125 1.00 0.00 H new ATOM 0 HA ASP A 79 -15.248 1.008 -4.715 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -14.584 1.815 -7.562 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -14.208 0.296 -6.772 1.00 0.00 H new ATOM 261 N THR A 80 -12.990 1.989 -4.185 1.00 0.00 N ATOM 262 CA THR A 80 -11.732 2.617 -3.809 1.00 0.00 C ATOM 263 C THR A 80 -10.544 1.820 -4.344 1.00 0.00 C ATOM 264 O THR A 80 -10.497 0.595 -4.222 1.00 0.00 O ATOM 265 CB THR A 80 -11.618 2.767 -2.289 1.00 0.00 C ATOM 266 OG1 THR A 80 -11.361 1.519 -1.664 1.00 0.00 O ATOM 267 CG2 THR A 80 -12.848 3.366 -1.641 1.00 0.00 C ATOM 0 H THR A 80 -13.222 1.147 -3.658 1.00 0.00 H new ATOM 0 HA THR A 80 -11.718 3.611 -4.255 1.00 0.00 H new ATOM 0 HB THR A 80 -10.784 3.454 -2.143 1.00 0.00 H new ATOM 0 HG1 THR A 80 -11.292 1.647 -0.695 1.00 0.00 H new ATOM 0 HG21 THR A 80 -12.692 3.441 -0.565 1.00 0.00 H new ATOM 0 HG22 THR A 80 -13.028 4.360 -2.052 1.00 0.00 H new ATOM 0 HG23 THR A 80 -13.710 2.730 -1.839 1.00 0.00 H new ATOM 275 N TYR A 81 -9.597 2.533 -4.951 1.00 0.00 N ATOM 276 CA TYR A 81 -8.405 1.916 -5.533 1.00 0.00 C ATOM 277 C TYR A 81 -7.137 2.607 -5.030 1.00 0.00 C ATOM 278 O TYR A 81 -7.207 3.526 -4.213 1.00 0.00 O ATOM 279 CB TYR A 81 -8.479 2.009 -7.062 1.00 0.00 C ATOM 280 CG TYR A 81 -8.629 3.429 -7.578 1.00 0.00 C ATOM 281 CD1 TYR A 81 -9.873 4.053 -7.602 1.00 0.00 C ATOM 282 CD2 TYR A 81 -7.529 4.144 -8.035 1.00 0.00 C ATOM 283 CE1 TYR A 81 -10.014 5.347 -8.066 1.00 0.00 C ATOM 284 CE2 TYR A 81 -7.663 5.438 -8.500 1.00 0.00 C ATOM 285 CZ TYR A 81 -8.906 6.035 -8.513 1.00 0.00 C ATOM 286 OH TYR A 81 -9.043 7.324 -8.973 1.00 0.00 O ATOM 0 H TYR A 81 -9.633 3.547 -5.053 1.00 0.00 H new ATOM 0 HA TYR A 81 -8.367 0.870 -5.230 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -7.577 1.570 -7.488 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -9.321 1.413 -7.414 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -10.743 3.517 -7.252 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -6.553 3.681 -8.027 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -10.986 5.817 -8.078 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -6.798 5.980 -8.852 1.00 0.00 H new ATOM 0 HH TYR A 81 -8.217 7.822 -8.800 1.00 0.00 H new ATOM 296 N GLU A 82 -5.979 2.166 -5.530 1.00 0.00 N ATOM 297 CA GLU A 82 -4.700 2.756 -5.138 1.00 0.00 C ATOM 298 C GLU A 82 -3.923 3.236 -6.363 1.00 0.00 C ATOM 299 O GLU A 82 -3.825 2.526 -7.365 1.00 0.00 O ATOM 300 CB GLU A 82 -3.854 1.769 -4.339 1.00 0.00 C ATOM 301 CG GLU A 82 -4.666 0.830 -3.461 1.00 0.00 C ATOM 302 CD GLU A 82 -3.809 0.078 -2.459 1.00 0.00 C ATOM 303 OE1 GLU A 82 -3.093 -0.858 -2.874 1.00 0.00 O ATOM 304 OE2 GLU A 82 -3.854 0.426 -1.261 1.00 0.00 O ATOM 0 H GLU A 82 -5.903 1.405 -6.205 1.00 0.00 H new ATOM 0 HA GLU A 82 -4.919 3.614 -4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.255 1.177 -5.030 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -3.159 2.327 -3.712 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.424 1.403 -2.927 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.193 0.114 -4.092 1.00 0.00 H new ATOM 311 N ARG A 83 -3.359 4.440 -6.264 1.00 0.00 N ATOM 312 CA ARG A 83 -2.568 5.024 -7.348 1.00 0.00 C ATOM 313 C ARG A 83 -1.366 5.772 -6.767 1.00 0.00 C ATOM 314 O ARG A 83 -1.458 6.339 -5.679 1.00 0.00 O ATOM 315 CB ARG A 83 -3.427 5.970 -8.209 1.00 0.00 C ATOM 316 CG ARG A 83 -3.815 7.285 -7.531 1.00 0.00 C ATOM 317 CD ARG A 83 -2.757 8.359 -7.714 1.00 0.00 C ATOM 318 NE ARG A 83 -3.219 9.670 -7.247 1.00 0.00 N ATOM 319 CZ ARG A 83 -4.097 10.440 -7.898 1.00 0.00 C ATOM 320 NH1 ARG A 83 -4.631 10.043 -9.051 1.00 0.00 N ATOM 321 NH2 ARG A 83 -4.441 11.620 -7.393 1.00 0.00 N ATOM 0 H ARG A 83 -3.436 5.034 -5.438 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.211 4.219 -7.990 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.883 6.198 -9.126 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.337 5.446 -8.500 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.762 7.637 -7.940 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -3.973 7.110 -6.467 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -1.856 8.077 -7.169 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.485 8.424 -8.768 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.845 10.019 -6.365 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.372 9.140 -9.449 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.300 10.641 -9.536 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.036 11.935 -6.512 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.110 12.210 -7.887 1.00 0.00 H new ATOM 335 N PRO A 84 -0.225 5.797 -7.479 1.00 0.00 N ATOM 336 CA PRO A 84 0.970 6.496 -7.009 1.00 0.00 C ATOM 337 C PRO A 84 0.931 7.982 -7.378 1.00 0.00 C ATOM 338 O PRO A 84 0.796 8.331 -8.552 1.00 0.00 O ATOM 339 CB PRO A 84 2.092 5.770 -7.750 1.00 0.00 C ATOM 340 CG PRO A 84 1.477 5.327 -9.040 1.00 0.00 C ATOM 341 CD PRO A 84 -0.007 5.163 -8.795 1.00 0.00 C ATOM 0 HA PRO A 84 1.082 6.478 -5.925 1.00 0.00 H new ATOM 0 HB2 PRO A 84 2.942 6.430 -7.924 1.00 0.00 H new ATOM 0 HB3 PRO A 84 2.460 4.920 -7.175 1.00 0.00 H new ATOM 0 HG2 PRO A 84 1.659 6.061 -9.825 1.00 0.00 H new ATOM 0 HG3 PRO A 84 1.918 4.388 -9.374 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -0.596 5.648 -9.574 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.296 4.112 -8.784 1.00 0.00 H new ATOM 349 N LYS A 85 1.063 8.854 -6.374 1.00 0.00 N ATOM 350 CA LYS A 85 1.059 10.300 -6.602 1.00 0.00 C ATOM 351 C LYS A 85 2.386 10.934 -6.191 1.00 0.00 C ATOM 352 O LYS A 85 2.720 10.957 -5.006 1.00 0.00 O ATOM 353 CB LYS A 85 -0.092 10.962 -5.854 1.00 0.00 C ATOM 354 CG LYS A 85 -0.970 11.843 -6.731 1.00 0.00 C ATOM 355 CD LYS A 85 -0.173 12.939 -7.433 1.00 0.00 C ATOM 356 CE LYS A 85 -0.808 14.311 -7.247 1.00 0.00 C ATOM 357 NZ LYS A 85 -0.552 14.869 -5.888 1.00 0.00 N ATOM 0 H LYS A 85 1.174 8.583 -5.397 1.00 0.00 H new ATOM 0 HA LYS A 85 0.923 10.461 -7.671 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -0.710 10.188 -5.399 1.00 0.00 H new ATOM 0 HB3 LYS A 85 0.314 11.564 -5.041 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -1.470 11.226 -7.477 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -1.749 12.298 -6.120 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.845 12.954 -7.043 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -0.103 12.712 -8.497 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -0.416 14.996 -7.999 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -1.883 14.238 -7.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -1.002 15.803 -5.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -0.948 14.229 -5.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 0.473 14.964 -5.739 1.00 0.00 H new ATOM 371 N ASP A 86 3.130 11.461 -7.168 1.00 0.00 N ATOM 372 CA ASP A 86 4.418 12.116 -6.903 1.00 0.00 C ATOM 373 C ASP A 86 5.472 11.116 -6.409 1.00 0.00 C ATOM 374 O ASP A 86 6.444 10.835 -7.113 1.00 0.00 O ATOM 375 CB ASP A 86 4.241 13.261 -5.890 1.00 0.00 C ATOM 376 CG ASP A 86 5.365 14.279 -5.952 1.00 0.00 C ATOM 377 OD1 ASP A 86 5.260 15.230 -6.755 1.00 0.00 O ATOM 378 OD2 ASP A 86 6.350 14.124 -5.199 1.00 0.00 O ATOM 0 H ASP A 86 2.863 11.448 -8.152 1.00 0.00 H new ATOM 0 HA ASP A 86 4.777 12.532 -7.844 1.00 0.00 H new ATOM 0 HB2 ASP A 86 3.292 13.763 -6.078 1.00 0.00 H new ATOM 0 HB3 ASP A 86 4.188 12.845 -4.884 1.00 0.00 H new ATOM 383 N SER A 87 5.272 10.580 -5.199 1.00 0.00 N ATOM 384 CA SER A 87 6.203 9.610 -4.615 1.00 0.00 C ATOM 385 C SER A 87 5.554 8.849 -3.451 1.00 0.00 C ATOM 386 O SER A 87 6.236 8.453 -2.503 1.00 0.00 O ATOM 387 CB SER A 87 7.476 10.318 -4.131 1.00 0.00 C ATOM 388 OG SER A 87 8.281 10.730 -5.222 1.00 0.00 O ATOM 0 H SER A 87 4.473 10.803 -4.606 1.00 0.00 H new ATOM 0 HA SER A 87 6.465 8.890 -5.390 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.206 11.185 -3.528 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.046 9.647 -3.488 1.00 0.00 H new ATOM 0 HG SER A 87 7.842 10.485 -6.063 1.00 0.00 H new ATOM 394 N MET A 88 4.234 8.641 -3.528 1.00 0.00 N ATOM 395 CA MET A 88 3.499 7.924 -2.482 1.00 0.00 C ATOM 396 C MET A 88 2.375 7.091 -3.088 1.00 0.00 C ATOM 397 O MET A 88 2.002 7.294 -4.241 1.00 0.00 O ATOM 398 CB MET A 88 2.907 8.897 -1.445 1.00 0.00 C ATOM 399 CG MET A 88 3.336 10.337 -1.637 1.00 0.00 C ATOM 400 SD MET A 88 2.729 11.428 -0.332 1.00 0.00 S ATOM 401 CE MET A 88 2.164 12.841 -1.277 1.00 0.00 C ATOM 0 H MET A 88 3.654 8.960 -4.304 1.00 0.00 H new ATOM 0 HA MET A 88 4.209 7.266 -1.981 1.00 0.00 H new ATOM 0 HB2 MET A 88 1.819 8.843 -1.491 1.00 0.00 H new ATOM 0 HB3 MET A 88 3.200 8.571 -0.447 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.424 10.386 -1.668 1.00 0.00 H new ATOM 0 HG3 MET A 88 2.973 10.694 -2.601 1.00 0.00 H new ATOM 0 HE1 MET A 88 1.270 13.256 -0.812 1.00 0.00 H new ATOM 0 HE2 MET A 88 2.946 13.600 -1.300 1.00 0.00 H new ATOM 0 HE3 MET A 88 1.931 12.528 -2.295 1.00 0.00 H new ATOM 411 N ILE A 89 1.804 6.190 -2.287 1.00 0.00 N ATOM 412 CA ILE A 89 0.682 5.369 -2.731 1.00 0.00 C ATOM 413 C ILE A 89 -0.593 5.950 -2.130 1.00 0.00 C ATOM 414 O ILE A 89 -0.735 6.035 -0.908 1.00 0.00 O ATOM 415 CB ILE A 89 0.861 3.879 -2.341 1.00 0.00 C ATOM 416 CG1 ILE A 89 1.540 3.113 -3.488 1.00 0.00 C ATOM 417 CG2 ILE A 89 -0.468 3.219 -1.962 1.00 0.00 C ATOM 418 CD1 ILE A 89 0.622 2.790 -4.653 1.00 0.00 C ATOM 0 H ILE A 89 2.102 6.012 -1.328 1.00 0.00 H new ATOM 0 HA ILE A 89 0.627 5.389 -3.819 1.00 0.00 H new ATOM 0 HB ILE A 89 1.499 3.842 -1.458 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.380 3.702 -3.855 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.950 2.183 -3.095 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.294 2.176 -1.696 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.904 3.742 -1.111 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.153 3.268 -2.808 1.00 0.00 H new ATOM 0 HD11 ILE A 89 1.180 2.250 -5.417 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.206 2.173 -4.304 1.00 0.00 H new ATOM 0 HD13 ILE A 89 0.231 3.716 -5.076 1.00 0.00 H new ATOM 430 N TRP A 90 -1.483 6.405 -2.998 1.00 0.00 N ATOM 431 CA TRP A 90 -2.720 7.049 -2.574 1.00 0.00 C ATOM 432 C TRP A 90 -3.917 6.111 -2.610 1.00 0.00 C ATOM 433 O TRP A 90 -3.956 5.159 -3.389 1.00 0.00 O ATOM 434 CB TRP A 90 -2.974 8.249 -3.480 1.00 0.00 C ATOM 435 CG TRP A 90 -2.096 9.405 -3.135 1.00 0.00 C ATOM 436 CD1 TRP A 90 -0.726 9.432 -3.119 1.00 0.00 C ATOM 437 CD2 TRP A 90 -2.530 10.700 -2.731 1.00 0.00 C ATOM 438 NE1 TRP A 90 -0.290 10.669 -2.725 1.00 0.00 N ATOM 439 CE2 TRP A 90 -1.377 11.463 -2.482 1.00 0.00 C ATOM 440 CE3 TRP A 90 -3.785 11.288 -2.556 1.00 0.00 C ATOM 441 CZ2 TRP A 90 -1.437 12.781 -2.066 1.00 0.00 C ATOM 442 CZ3 TRP A 90 -3.845 12.603 -2.143 1.00 0.00 C ATOM 443 CH2 TRP A 90 -2.676 13.339 -1.899 1.00 0.00 C ATOM 0 H TRP A 90 -1.371 6.340 -4.010 1.00 0.00 H new ATOM 0 HA TRP A 90 -2.600 7.359 -1.536 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -2.805 7.962 -4.518 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -4.018 8.550 -3.399 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -0.086 8.602 -3.378 1.00 0.00 H new ATOM 0 HE1 TRP A 90 0.685 10.952 -2.629 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -4.688 10.726 -2.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -0.538 13.350 -1.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -4.807 13.073 -2.005 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -2.755 14.366 -1.573 1.00 0.00 H new ATOM 454 N ASP A 91 -4.909 6.423 -1.776 1.00 0.00 N ATOM 455 CA ASP A 91 -6.147 5.659 -1.708 1.00 0.00 C ATOM 456 C ASP A 91 -7.273 6.523 -2.263 1.00 0.00 C ATOM 457 O ASP A 91 -7.636 7.540 -1.667 1.00 0.00 O ATOM 458 CB ASP A 91 -6.448 5.240 -0.263 1.00 0.00 C ATOM 459 CG ASP A 91 -7.498 4.146 -0.175 1.00 0.00 C ATOM 460 OD1 ASP A 91 -7.124 2.957 -0.246 1.00 0.00 O ATOM 461 OD2 ASP A 91 -8.693 4.482 -0.036 1.00 0.00 O ATOM 0 H ASP A 91 -4.874 7.212 -1.131 1.00 0.00 H new ATOM 0 HA ASP A 91 -6.052 4.748 -2.299 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.529 4.894 0.209 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -6.788 6.110 0.300 1.00 0.00 H new ATOM 466 N CYS A 92 -7.783 6.150 -3.432 1.00 0.00 N ATOM 467 CA CYS A 92 -8.824 6.934 -4.092 1.00 0.00 C ATOM 468 C CYS A 92 -10.183 6.233 -4.061 1.00 0.00 C ATOM 469 O CYS A 92 -10.281 5.050 -3.747 1.00 0.00 O ATOM 470 CB CYS A 92 -8.429 7.194 -5.547 1.00 0.00 C ATOM 471 SG CYS A 92 -6.775 7.930 -5.762 1.00 0.00 S ATOM 0 H CYS A 92 -7.495 5.314 -3.941 1.00 0.00 H new ATOM 0 HA CYS A 92 -8.918 7.873 -3.547 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -8.468 6.252 -6.094 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -9.169 7.856 -5.998 1.00 0.00 H new ATOM 476 N THR A 93 -11.221 7.001 -4.396 1.00 0.00 N ATOM 477 CA THR A 93 -12.607 6.529 -4.431 1.00 0.00 C ATOM 478 C THR A 93 -13.330 7.145 -5.630 1.00 0.00 C ATOM 479 O THR A 93 -12.971 8.241 -6.064 1.00 0.00 O ATOM 480 CB THR A 93 -13.372 6.869 -3.156 1.00 0.00 C ATOM 481 OG1 THR A 93 -12.503 6.937 -2.037 1.00 0.00 O ATOM 482 CG2 THR A 93 -14.463 5.857 -2.846 1.00 0.00 C ATOM 0 H THR A 93 -11.121 7.983 -4.654 1.00 0.00 H new ATOM 0 HA THR A 93 -12.575 5.443 -4.518 1.00 0.00 H new ATOM 0 HB THR A 93 -13.830 7.841 -3.337 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.020 7.158 -1.234 1.00 0.00 H new ATOM 0 HG21 THR A 93 -14.977 6.145 -1.929 1.00 0.00 H new ATOM 0 HG22 THR A 93 -15.177 5.829 -3.669 1.00 0.00 H new ATOM 0 HG23 THR A 93 -14.018 4.870 -2.718 1.00 0.00 H new ATOM 490 N CYS A 94 -14.351 6.467 -6.157 1.00 0.00 N ATOM 491 CA CYS A 94 -15.097 7.010 -7.293 1.00 0.00 C ATOM 492 C CYS A 94 -16.437 7.540 -6.798 1.00 0.00 C ATOM 493 O CYS A 94 -17.283 6.791 -6.316 1.00 0.00 O ATOM 494 CB CYS A 94 -15.318 5.952 -8.380 1.00 0.00 C ATOM 495 SG CYS A 94 -16.514 6.430 -9.678 1.00 0.00 S ATOM 0 H CYS A 94 -14.675 5.559 -5.824 1.00 0.00 H new ATOM 0 HA CYS A 94 -14.515 7.818 -7.737 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -14.361 5.729 -8.851 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -15.663 5.032 -7.908 1.00 0.00 H new ATOM 500 N ILE A 95 -16.595 8.858 -6.896 1.00 0.00 N ATOM 501 CA ILE A 95 -17.801 9.533 -6.442 1.00 0.00 C ATOM 502 C ILE A 95 -18.945 9.397 -7.449 1.00 0.00 C ATOM 503 O ILE A 95 -20.086 9.126 -7.067 1.00 0.00 O ATOM 504 CB ILE A 95 -17.498 10.997 -6.119 1.00 0.00 C ATOM 505 CG1 ILE A 95 -17.210 11.081 -4.623 1.00 0.00 C ATOM 506 CG2 ILE A 95 -18.637 11.929 -6.511 1.00 0.00 C ATOM 507 CD1 ILE A 95 -15.744 11.019 -4.283 1.00 0.00 C ATOM 0 H ILE A 95 -15.892 9.483 -7.291 1.00 0.00 H new ATOM 0 HA ILE A 95 -18.138 9.046 -5.527 1.00 0.00 H new ATOM 0 HB ILE A 95 -16.637 11.327 -6.701 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -17.625 12.011 -4.234 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -17.726 10.265 -4.117 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -18.370 12.956 -6.260 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -18.817 11.853 -7.583 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -19.541 11.647 -5.971 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -15.618 11.084 -3.202 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -15.327 10.077 -4.641 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -15.224 11.850 -4.760 1.00 0.00 H new ATOM 519 N GLY A 96 -18.629 9.571 -8.736 1.00 0.00 N ATOM 520 CA GLY A 96 -19.632 9.452 -9.787 1.00 0.00 C ATOM 521 C GLY A 96 -20.840 10.347 -9.559 1.00 0.00 C ATOM 522 O GLY A 96 -21.955 9.857 -9.380 1.00 0.00 O ATOM 0 H GLY A 96 -17.691 9.793 -9.069 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -19.177 9.702 -10.746 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -19.962 8.415 -9.851 1.00 0.00 H new ATOM 526 N ALA A 97 -20.614 11.663 -9.567 1.00 0.00 N ATOM 527 CA ALA A 97 -21.690 12.633 -9.362 1.00 0.00 C ATOM 528 C ALA A 97 -22.211 13.167 -10.696 1.00 0.00 C ATOM 529 O ALA A 97 -23.416 13.141 -10.956 1.00 0.00 O ATOM 530 CB ALA A 97 -21.210 13.780 -8.481 1.00 0.00 C ATOM 0 H ALA A 97 -19.695 12.080 -9.713 1.00 0.00 H new ATOM 0 HA ALA A 97 -22.512 12.124 -8.858 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -22.022 14.493 -8.338 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -20.896 13.389 -7.513 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -20.368 14.280 -8.961 1.00 0.00 H new ATOM 536 N GLY A 98 -21.292 13.646 -11.535 1.00 0.00 N ATOM 537 CA GLY A 98 -21.663 14.179 -12.837 1.00 0.00 C ATOM 538 C GLY A 98 -21.132 13.333 -13.979 1.00 0.00 C ATOM 539 O GLY A 98 -21.904 12.697 -14.698 1.00 0.00 O ATOM 0 H GLY A 98 -20.292 13.674 -11.334 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -22.749 14.238 -12.907 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -21.281 15.195 -12.933 1.00 0.00 H new ATOM 543 N ARG A 99 -19.807 13.327 -14.145 1.00 0.00 N ATOM 544 CA ARG A 99 -19.161 12.554 -15.206 1.00 0.00 C ATOM 545 C ARG A 99 -18.002 11.719 -14.651 1.00 0.00 C ATOM 546 O ARG A 99 -16.920 11.666 -15.239 1.00 0.00 O ATOM 547 CB ARG A 99 -18.669 13.487 -16.314 1.00 0.00 C ATOM 548 CG ARG A 99 -19.100 13.067 -17.716 1.00 0.00 C ATOM 549 CD ARG A 99 -20.402 13.739 -18.138 1.00 0.00 C ATOM 550 NE ARG A 99 -21.580 13.045 -17.611 1.00 0.00 N ATOM 551 CZ ARG A 99 -22.835 13.477 -17.766 1.00 0.00 C ATOM 552 NH1 ARG A 99 -23.089 14.600 -18.434 1.00 0.00 N ATOM 553 NH2 ARG A 99 -23.842 12.779 -17.252 1.00 0.00 N ATOM 0 H ARG A 99 -19.160 13.851 -13.556 1.00 0.00 H new ATOM 0 HA ARG A 99 -19.897 11.868 -15.626 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -19.038 14.494 -16.118 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -17.581 13.534 -16.278 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -18.314 13.320 -18.428 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -19.223 11.985 -17.748 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -20.405 14.772 -17.790 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -20.457 13.769 -19.226 1.00 0.00 H new ATOM 0 HE ARG A 99 -21.433 12.178 -17.094 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -22.322 15.140 -18.834 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -24.051 14.920 -18.546 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -23.656 11.916 -16.741 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -24.801 13.106 -17.369 1.00 0.00 H new ATOM 567 N GLY A 100 -18.239 11.062 -13.512 1.00 0.00 N ATOM 568 CA GLY A 100 -17.213 10.236 -12.892 1.00 0.00 C ATOM 569 C GLY A 100 -16.104 11.058 -12.258 1.00 0.00 C ATOM 570 O GLY A 100 -14.990 11.118 -12.784 1.00 0.00 O ATOM 0 H GLY A 100 -19.126 11.089 -13.008 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -17.671 9.604 -12.132 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -16.784 9.572 -13.642 1.00 0.00 H new ATOM 574 N ARG A 101 -16.410 11.691 -11.124 1.00 0.00 N ATOM 575 CA ARG A 101 -15.433 12.514 -10.409 1.00 0.00 C ATOM 576 C ARG A 101 -14.445 11.643 -9.632 1.00 0.00 C ATOM 577 O ARG A 101 -14.838 10.671 -8.986 1.00 0.00 O ATOM 578 CB ARG A 101 -16.140 13.481 -9.461 1.00 0.00 C ATOM 579 CG ARG A 101 -15.816 14.945 -9.720 1.00 0.00 C ATOM 580 CD ARG A 101 -16.446 15.854 -8.673 1.00 0.00 C ATOM 581 NE ARG A 101 -16.145 17.267 -8.915 1.00 0.00 N ATOM 582 CZ ARG A 101 -14.995 17.863 -8.580 1.00 0.00 C ATOM 583 NH1 ARG A 101 -14.021 17.177 -7.986 1.00 0.00 N ATOM 584 NH2 ARG A 101 -14.819 19.153 -8.842 1.00 0.00 N ATOM 0 H ARG A 101 -17.328 11.649 -10.681 1.00 0.00 H new ATOM 0 HA ARG A 101 -14.875 13.089 -11.147 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -17.217 13.337 -9.547 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.866 13.234 -8.435 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.735 15.084 -9.720 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -16.174 15.227 -10.710 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -17.526 15.709 -8.671 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -16.085 15.571 -7.684 1.00 0.00 H new ATOM 0 HE ARG A 101 -16.860 17.835 -9.369 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -14.147 16.186 -7.781 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -13.149 17.643 -7.735 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -15.559 19.687 -9.297 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -13.943 19.610 -8.588 1.00 0.00 H new ATOM 598 N ILE A 102 -13.160 12.001 -9.700 1.00 0.00 N ATOM 599 CA ILE A 102 -12.112 11.252 -9.005 1.00 0.00 C ATOM 600 C ILE A 102 -11.694 11.979 -7.723 1.00 0.00 C ATOM 601 O ILE A 102 -11.296 13.145 -7.761 1.00 0.00 O ATOM 602 CB ILE A 102 -10.871 11.035 -9.919 1.00 0.00 C ATOM 603 CG1 ILE A 102 -11.160 9.966 -10.989 1.00 0.00 C ATOM 604 CG2 ILE A 102 -9.647 10.639 -9.096 1.00 0.00 C ATOM 605 CD1 ILE A 102 -11.899 10.491 -12.205 1.00 0.00 C ATOM 0 H ILE A 102 -12.821 12.805 -10.229 1.00 0.00 H new ATOM 0 HA ILE A 102 -12.520 10.275 -8.745 1.00 0.00 H new ATOM 0 HB ILE A 102 -10.658 11.980 -10.419 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -10.216 9.527 -11.312 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -11.747 9.165 -10.538 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -8.794 10.494 -9.759 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -9.419 11.428 -8.380 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -9.853 9.712 -8.561 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -12.064 9.677 -12.910 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -12.860 10.904 -11.897 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -11.306 11.270 -12.683 1.00 0.00 H new ATOM 617 N SER A 103 -11.786 11.274 -6.592 1.00 0.00 N ATOM 618 CA SER A 103 -11.419 11.831 -5.290 1.00 0.00 C ATOM 619 C SER A 103 -10.275 11.024 -4.672 1.00 0.00 C ATOM 620 O SER A 103 -10.460 9.862 -4.303 1.00 0.00 O ATOM 621 CB SER A 103 -12.638 11.824 -4.367 1.00 0.00 C ATOM 622 OG SER A 103 -12.257 11.776 -3.001 1.00 0.00 O ATOM 0 H SER A 103 -12.114 10.309 -6.554 1.00 0.00 H new ATOM 0 HA SER A 103 -11.081 12.859 -5.422 1.00 0.00 H new ATOM 0 HB2 SER A 103 -13.237 12.717 -4.547 1.00 0.00 H new ATOM 0 HB3 SER A 103 -13.267 10.965 -4.600 1.00 0.00 H new ATOM 0 HG SER A 103 -13.059 11.774 -2.438 1.00 0.00 H new ATOM 628 N CYS A 104 -9.082 11.628 -4.589 1.00 0.00 N ATOM 629 CA CYS A 104 -7.908 10.933 -4.048 1.00 0.00 C ATOM 630 C CYS A 104 -7.363 11.584 -2.776 1.00 0.00 C ATOM 631 O CYS A 104 -7.145 12.796 -2.723 1.00 0.00 O ATOM 632 CB CYS A 104 -6.797 10.879 -5.100 1.00 0.00 C ATOM 633 SG CYS A 104 -7.157 9.779 -6.505 1.00 0.00 S ATOM 0 H CYS A 104 -8.906 12.588 -4.887 1.00 0.00 H new ATOM 0 HA CYS A 104 -8.237 9.927 -3.787 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -6.619 11.886 -5.477 1.00 0.00 H new ATOM 0 HB3 CYS A 104 -5.874 10.550 -4.622 1.00 0.00 H new ATOM 638 N THR A 105 -7.119 10.745 -1.766 1.00 0.00 N ATOM 639 CA THR A 105 -6.561 11.182 -0.485 1.00 0.00 C ATOM 640 C THR A 105 -5.544 10.160 0.006 1.00 0.00 C ATOM 641 O THR A 105 -5.770 8.953 -0.103 1.00 0.00 O ATOM 642 CB THR A 105 -7.670 11.373 0.557 1.00 0.00 C ATOM 643 OG1 THR A 105 -8.512 10.235 0.612 1.00 0.00 O ATOM 644 CG2 THR A 105 -8.547 12.580 0.288 1.00 0.00 C ATOM 0 H THR A 105 -7.303 9.743 -1.814 1.00 0.00 H new ATOM 0 HA THR A 105 -6.065 12.142 -0.629 1.00 0.00 H new ATOM 0 HB THR A 105 -7.150 11.525 1.503 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.211 10.377 1.284 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.310 12.655 1.063 1.00 0.00 H new ATOM 0 HG22 THR A 105 -7.935 13.482 0.292 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.027 12.471 -0.685 1.00 0.00 H new ATOM 652 N ILE A 106 -4.419 10.644 0.535 1.00 0.00 N ATOM 653 CA ILE A 106 -3.362 9.753 1.028 1.00 0.00 C ATOM 654 C ILE A 106 -3.949 8.674 1.946 1.00 0.00 C ATOM 655 O ILE A 106 -4.986 8.886 2.579 1.00 0.00 O ATOM 656 CB ILE A 106 -2.224 10.501 1.778 1.00 0.00 C ATOM 657 CG1 ILE A 106 -2.199 11.995 1.419 1.00 0.00 C ATOM 658 CG2 ILE A 106 -0.888 9.859 1.430 1.00 0.00 C ATOM 659 CD1 ILE A 106 -1.106 12.779 2.118 1.00 0.00 C ATOM 0 H ILE A 106 -4.215 11.639 0.634 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.921 9.296 0.142 1.00 0.00 H new ATOM 0 HB ILE A 106 -2.408 10.422 2.850 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.073 12.097 0.341 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -3.164 12.435 1.670 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -0.087 10.380 1.954 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.898 8.812 1.732 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -0.722 9.925 0.355 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.155 13.824 1.812 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.242 12.710 3.197 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -0.133 12.367 1.848 1.00 0.00 H new ATOM 671 N ALA A 107 -3.292 7.516 2.006 1.00 0.00 N ATOM 672 CA ALA A 107 -3.764 6.405 2.835 1.00 0.00 C ATOM 673 C ALA A 107 -3.283 6.528 4.281 1.00 0.00 C ATOM 674 O ALA A 107 -2.264 7.163 4.555 1.00 0.00 O ATOM 675 CB ALA A 107 -3.312 5.078 2.240 1.00 0.00 C ATOM 0 H ALA A 107 -2.433 7.322 1.492 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.853 6.443 2.848 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -3.669 4.259 2.865 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.720 4.972 1.235 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -2.223 5.052 2.194 1.00 0.00 H new ATOM 681 N ASN A 108 -4.022 5.896 5.200 1.00 0.00 N ATOM 682 CA ASN A 108 -3.675 5.910 6.623 1.00 0.00 C ATOM 683 C ASN A 108 -2.753 4.735 6.955 1.00 0.00 C ATOM 684 O ASN A 108 -3.056 3.907 7.816 1.00 0.00 O ATOM 685 CB ASN A 108 -4.941 5.870 7.481 1.00 0.00 C ATOM 686 CG ASN A 108 -5.041 7.053 8.429 1.00 0.00 C ATOM 687 OD1 ASN A 108 -4.629 6.970 9.586 1.00 0.00 O ATOM 688 ND2 ASN A 108 -5.592 8.162 7.942 1.00 0.00 N ATOM 0 H ASN A 108 -4.866 5.367 4.981 1.00 0.00 H new ATOM 0 HA ASN A 108 -3.143 6.835 6.846 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -5.816 5.855 6.831 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -4.956 4.945 8.057 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -5.686 8.987 8.534 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -5.920 8.187 6.977 1.00 0.00 H new ATOM 695 N ARG A 109 -1.623 4.676 6.249 1.00 0.00 N ATOM 696 CA ARG A 109 -0.636 3.617 6.434 1.00 0.00 C ATOM 697 C ARG A 109 0.768 4.156 6.160 1.00 0.00 C ATOM 698 O ARG A 109 0.919 5.275 5.666 1.00 0.00 O ATOM 699 CB ARG A 109 -0.940 2.441 5.494 1.00 0.00 C ATOM 700 CG ARG A 109 -1.978 1.467 6.040 1.00 0.00 C ATOM 701 CD ARG A 109 -3.335 1.645 5.372 1.00 0.00 C ATOM 702 NE ARG A 109 -3.346 1.145 3.995 1.00 0.00 N ATOM 703 CZ ARG A 109 -4.421 1.155 3.202 1.00 0.00 C ATOM 704 NH1 ARG A 109 -5.580 1.642 3.638 1.00 0.00 N ATOM 705 NH2 ARG A 109 -4.335 0.679 1.965 1.00 0.00 N ATOM 0 H ARG A 109 -1.369 5.359 5.536 1.00 0.00 H new ATOM 0 HA ARG A 109 -0.686 3.266 7.465 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.291 2.833 4.539 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.016 1.898 5.296 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -1.631 0.445 5.889 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -2.081 1.613 7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -4.095 1.122 5.952 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -3.603 2.701 5.375 1.00 0.00 H new ATOM 0 HE ARG A 109 -2.478 0.765 3.618 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -5.653 2.012 4.586 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -6.395 1.645 3.025 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -3.449 0.307 1.622 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -5.155 0.686 1.358 1.00 0.00 H new ATOM 719 N CYS A 110 1.790 3.351 6.456 1.00 0.00 N ATOM 720 CA CYS A 110 3.171 3.757 6.207 1.00 0.00 C ATOM 721 C CYS A 110 3.834 2.776 5.245 1.00 0.00 C ATOM 722 O CYS A 110 3.813 1.567 5.468 1.00 0.00 O ATOM 723 CB CYS A 110 3.963 3.839 7.524 1.00 0.00 C ATOM 724 SG CYS A 110 3.884 2.339 8.565 1.00 0.00 S ATOM 0 H CYS A 110 1.688 2.422 6.865 1.00 0.00 H new ATOM 0 HA CYS A 110 3.167 4.749 5.755 1.00 0.00 H new ATOM 0 HB2 CYS A 110 5.007 4.047 7.291 1.00 0.00 H new ATOM 0 HB3 CYS A 110 3.591 4.685 8.102 1.00 0.00 H new ATOM 729 N HIS A 111 4.414 3.300 4.167 1.00 0.00 N ATOM 730 CA HIS A 111 5.072 2.468 3.162 1.00 0.00 C ATOM 731 C HIS A 111 6.412 3.072 2.755 1.00 0.00 C ATOM 732 O HIS A 111 6.572 4.293 2.775 1.00 0.00 O ATOM 733 CB HIS A 111 4.166 2.321 1.929 1.00 0.00 C ATOM 734 CG HIS A 111 4.214 3.495 0.995 1.00 0.00 C ATOM 735 ND1 HIS A 111 4.392 4.794 1.425 1.00 0.00 N ATOM 736 CD2 HIS A 111 4.137 3.555 -0.353 1.00 0.00 C ATOM 737 CE1 HIS A 111 4.426 5.599 0.385 1.00 0.00 C ATOM 738 NE2 HIS A 111 4.273 4.874 -0.710 1.00 0.00 N ATOM 0 H HIS A 111 4.441 4.300 3.967 1.00 0.00 H new ATOM 0 HA HIS A 111 5.254 1.484 3.593 1.00 0.00 H new ATOM 0 HB2 HIS A 111 4.455 1.423 1.383 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.138 2.175 2.261 1.00 0.00 H new ATOM 0 HD2 HIS A 111 3.995 2.721 -1.024 1.00 0.00 H new ATOM 0 HE1 HIS A 111 4.557 6.670 0.420 1.00 0.00 H new ATOM 0 HE2 HIS A 111 4.258 5.235 -1.664 1.00 0.00 H new ATOM 747 N GLU A 112 7.367 2.216 2.372 1.00 0.00 N ATOM 748 CA GLU A 112 8.691 2.678 1.945 1.00 0.00 C ATOM 749 C GLU A 112 9.675 1.511 1.818 1.00 0.00 C ATOM 750 O GLU A 112 9.537 0.496 2.501 1.00 0.00 O ATOM 751 CB GLU A 112 9.239 3.731 2.922 1.00 0.00 C ATOM 752 CG GLU A 112 9.520 3.200 4.325 1.00 0.00 C ATOM 753 CD GLU A 112 10.990 2.901 4.560 1.00 0.00 C ATOM 754 OE1 GLU A 112 11.756 3.854 4.816 1.00 0.00 O ATOM 755 OE2 GLU A 112 11.374 1.714 4.488 1.00 0.00 O ATOM 0 H GLU A 112 7.247 1.203 2.349 1.00 0.00 H new ATOM 0 HA GLU A 112 8.580 3.135 0.962 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.160 4.146 2.512 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.524 4.551 2.993 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.181 3.931 5.059 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.939 2.292 4.488 1.00 0.00 H new ATOM 762 N GLY A 113 10.670 1.667 0.941 1.00 0.00 N ATOM 763 CA GLY A 113 11.668 0.623 0.745 1.00 0.00 C ATOM 764 C GLY A 113 11.342 -0.310 -0.413 1.00 0.00 C ATOM 765 O GLY A 113 12.244 -0.752 -1.127 1.00 0.00 O ATOM 0 H GLY A 113 10.802 2.497 0.364 1.00 0.00 H new ATOM 0 HA2 GLY A 113 12.639 1.086 0.567 1.00 0.00 H new ATOM 0 HA3 GLY A 113 11.757 0.038 1.660 1.00 0.00 H new ATOM 769 N GLY A 114 10.054 -0.615 -0.600 1.00 0.00 N ATOM 770 CA GLY A 114 9.647 -1.505 -1.681 1.00 0.00 C ATOM 771 C GLY A 114 8.306 -2.187 -1.428 1.00 0.00 C ATOM 772 O GLY A 114 7.748 -2.806 -2.335 1.00 0.00 O ATOM 0 H GLY A 114 9.289 -0.263 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 114 9.588 -0.936 -2.609 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.413 -2.267 -1.823 1.00 0.00 H new ATOM 776 N GLN A 115 7.784 -2.072 -0.202 1.00 0.00 N ATOM 777 CA GLN A 115 6.500 -2.676 0.159 1.00 0.00 C ATOM 778 C GLN A 115 5.647 -1.675 0.940 1.00 0.00 C ATOM 779 O GLN A 115 6.110 -0.579 1.262 1.00 0.00 O ATOM 780 CB GLN A 115 6.724 -3.945 0.991 1.00 0.00 C ATOM 781 CG GLN A 115 7.319 -5.101 0.199 1.00 0.00 C ATOM 782 CD GLN A 115 7.498 -6.356 1.036 1.00 0.00 C ATOM 783 OE1 GLN A 115 8.570 -6.595 1.591 1.00 0.00 O ATOM 784 NE2 GLN A 115 6.445 -7.164 1.134 1.00 0.00 N ATOM 0 H GLN A 115 8.235 -1.564 0.559 1.00 0.00 H new ATOM 0 HA GLN A 115 5.972 -2.948 -0.755 1.00 0.00 H new ATOM 0 HB2 GLN A 115 7.385 -3.710 1.825 1.00 0.00 H new ATOM 0 HB3 GLN A 115 5.772 -4.261 1.418 1.00 0.00 H new ATOM 0 HG2 GLN A 115 6.673 -5.325 -0.650 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.285 -4.799 -0.206 1.00 0.00 H new ATOM 0 HE21 GLN A 115 5.575 -6.928 0.657 1.00 0.00 H new ATOM 0 HE22 GLN A 115 6.508 -8.020 1.686 1.00 0.00 H new ATOM 793 N SER A 116 4.403 -2.053 1.249 1.00 0.00 N ATOM 794 CA SER A 116 3.506 -1.172 1.998 1.00 0.00 C ATOM 795 C SER A 116 3.180 -1.756 3.373 1.00 0.00 C ATOM 796 O SER A 116 2.741 -2.901 3.488 1.00 0.00 O ATOM 797 CB SER A 116 2.218 -0.921 1.206 1.00 0.00 C ATOM 798 OG SER A 116 1.678 -2.132 0.704 1.00 0.00 O ATOM 0 H SER A 116 3.998 -2.954 0.995 1.00 0.00 H new ATOM 0 HA SER A 116 4.017 -0.221 2.148 1.00 0.00 H new ATOM 0 HB2 SER A 116 1.484 -0.431 1.846 1.00 0.00 H new ATOM 0 HB3 SER A 116 2.424 -0.242 0.379 1.00 0.00 H new ATOM 0 HG SER A 116 1.826 -2.850 1.354 1.00 0.00 H new ATOM 804 N TYR A 117 3.423 -0.954 4.415 1.00 0.00 N ATOM 805 CA TYR A 117 3.185 -1.369 5.798 1.00 0.00 C ATOM 806 C TYR A 117 1.997 -0.621 6.411 1.00 0.00 C ATOM 807 O TYR A 117 1.633 0.463 5.956 1.00 0.00 O ATOM 808 CB TYR A 117 4.443 -1.124 6.647 1.00 0.00 C ATOM 809 CG TYR A 117 5.748 -1.398 5.919 1.00 0.00 C ATOM 810 CD1 TYR A 117 6.214 -2.699 5.761 1.00 0.00 C ATOM 811 CD2 TYR A 117 6.516 -0.358 5.392 1.00 0.00 C ATOM 812 CE1 TYR A 117 7.400 -2.958 5.103 1.00 0.00 C ATOM 813 CE2 TYR A 117 7.702 -0.614 4.734 1.00 0.00 C ATOM 814 CZ TYR A 117 8.140 -1.914 4.591 1.00 0.00 C ATOM 815 OH TYR A 117 9.323 -2.170 3.936 1.00 0.00 O ATOM 0 H TYR A 117 3.788 -0.006 4.323 1.00 0.00 H new ATOM 0 HA TYR A 117 2.950 -2.433 5.790 1.00 0.00 H new ATOM 0 HB2 TYR A 117 4.441 -0.089 6.989 1.00 0.00 H new ATOM 0 HB3 TYR A 117 4.396 -1.754 7.536 1.00 0.00 H new ATOM 0 HD1 TYR A 117 5.638 -3.521 6.160 1.00 0.00 H new ATOM 0 HD2 TYR A 117 6.177 0.662 5.501 1.00 0.00 H new ATOM 0 HE1 TYR A 117 7.746 -3.975 4.990 1.00 0.00 H new ATOM 0 HE2 TYR A 117 8.285 0.201 4.332 1.00 0.00 H new ATOM 0 HH TYR A 117 9.566 -1.397 3.385 1.00 0.00 H new ATOM 825 N LYS A 118 1.407 -1.206 7.456 1.00 0.00 N ATOM 826 CA LYS A 118 0.271 -0.598 8.154 1.00 0.00 C ATOM 827 C LYS A 118 0.730 -0.026 9.496 1.00 0.00 C ATOM 828 O LYS A 118 1.761 -0.443 10.026 1.00 0.00 O ATOM 829 CB LYS A 118 -0.836 -1.638 8.380 1.00 0.00 C ATOM 830 CG LYS A 118 -1.360 -2.268 7.095 1.00 0.00 C ATOM 831 CD LYS A 118 -2.835 -1.959 6.871 1.00 0.00 C ATOM 832 CE LYS A 118 -3.195 -1.982 5.393 1.00 0.00 C ATOM 833 NZ LYS A 118 -4.652 -1.773 5.167 1.00 0.00 N ATOM 0 H LYS A 118 1.699 -2.105 7.839 1.00 0.00 H new ATOM 0 HA LYS A 118 -0.127 0.208 7.538 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -0.455 -2.425 9.030 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -1.665 -1.164 8.906 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -0.780 -1.902 6.248 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -1.217 -3.348 7.136 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -3.445 -2.687 7.406 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -3.069 -0.979 7.288 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -2.633 -1.207 4.872 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -2.895 -2.937 4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -4.852 -1.796 4.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -5.189 -2.527 5.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -4.934 -0.850 5.554 1.00 0.00 H new ATOM 847 N ILE A 119 -0.027 0.931 10.048 1.00 0.00 N ATOM 848 CA ILE A 119 0.333 1.541 11.332 1.00 0.00 C ATOM 849 C ILE A 119 0.578 0.464 12.396 1.00 0.00 C ATOM 850 O ILE A 119 -0.287 -0.378 12.647 1.00 0.00 O ATOM 851 CB ILE A 119 -0.749 2.536 11.823 1.00 0.00 C ATOM 852 CG1 ILE A 119 -0.483 3.943 11.266 1.00 0.00 C ATOM 853 CG2 ILE A 119 -0.822 2.583 13.350 1.00 0.00 C ATOM 854 CD1 ILE A 119 -0.770 4.083 9.786 1.00 0.00 C ATOM 0 H ILE A 119 -0.883 1.296 9.630 1.00 0.00 H new ATOM 0 HA ILE A 119 1.255 2.101 11.173 1.00 0.00 H new ATOM 0 HB ILE A 119 -1.710 2.181 11.451 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -1.093 4.661 11.814 1.00 0.00 H new ATOM 0 HG13 ILE A 119 0.559 4.205 11.450 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.592 3.292 13.656 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.068 1.593 13.733 1.00 0.00 H new ATOM 0 HG23 ILE A 119 0.141 2.898 13.751 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -0.558 5.104 9.469 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -0.141 3.391 9.226 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -1.819 3.855 9.596 1.00 0.00 H new ATOM 866 N GLY A 120 1.761 0.499 13.012 1.00 0.00 N ATOM 867 CA GLY A 120 2.103 -0.478 14.036 1.00 0.00 C ATOM 868 C GLY A 120 2.981 -1.609 13.518 1.00 0.00 C ATOM 869 O GLY A 120 3.531 -2.377 14.310 1.00 0.00 O ATOM 0 H GLY A 120 2.489 1.187 12.819 1.00 0.00 H new ATOM 0 HA2 GLY A 120 2.618 0.027 14.853 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.186 -0.899 14.448 1.00 0.00 H new ATOM 873 N ASP A 121 3.109 -1.726 12.190 1.00 0.00 N ATOM 874 CA ASP A 121 3.921 -2.783 11.585 1.00 0.00 C ATOM 875 C ASP A 121 5.408 -2.448 11.664 1.00 0.00 C ATOM 876 O ASP A 121 5.787 -1.281 11.776 1.00 0.00 O ATOM 877 CB ASP A 121 3.515 -3.003 10.122 1.00 0.00 C ATOM 878 CG ASP A 121 2.242 -3.821 9.987 1.00 0.00 C ATOM 879 OD1 ASP A 121 1.204 -3.400 10.539 1.00 0.00 O ATOM 880 OD2 ASP A 121 2.287 -4.882 9.331 1.00 0.00 O ATOM 0 H ASP A 121 2.661 -1.103 11.518 1.00 0.00 H new ATOM 0 HA ASP A 121 3.743 -3.700 12.146 1.00 0.00 H new ATOM 0 HB2 ASP A 121 3.375 -2.036 9.638 1.00 0.00 H new ATOM 0 HB3 ASP A 121 4.325 -3.508 9.596 1.00 0.00 H new ATOM 885 N THR A 122 6.243 -3.485 11.606 1.00 0.00 N ATOM 886 CA THR A 122 7.693 -3.316 11.673 1.00 0.00 C ATOM 887 C THR A 122 8.372 -4.030 10.503 1.00 0.00 C ATOM 888 O THR A 122 7.870 -5.041 10.005 1.00 0.00 O ATOM 889 CB THR A 122 8.234 -3.851 13.009 1.00 0.00 C ATOM 890 OG1 THR A 122 8.515 -5.238 12.926 1.00 0.00 O ATOM 891 CG2 THR A 122 7.285 -3.647 14.173 1.00 0.00 C ATOM 0 H THR A 122 5.938 -4.454 11.512 1.00 0.00 H new ATOM 0 HA THR A 122 7.918 -2.252 11.606 1.00 0.00 H new ATOM 0 HB THR A 122 9.140 -3.275 13.194 1.00 0.00 H new ATOM 0 HG1 THR A 122 8.859 -5.554 13.787 1.00 0.00 H new ATOM 0 HG21 THR A 122 7.733 -4.049 15.082 1.00 0.00 H new ATOM 0 HG22 THR A 122 7.092 -2.582 14.303 1.00 0.00 H new ATOM 0 HG23 THR A 122 6.346 -4.163 13.972 1.00 0.00 H new ATOM 899 N TRP A 123 9.523 -3.507 10.078 1.00 0.00 N ATOM 900 CA TRP A 123 10.285 -4.095 8.978 1.00 0.00 C ATOM 901 C TRP A 123 11.783 -3.985 9.268 1.00 0.00 C ATOM 902 O TRP A 123 12.441 -3.023 8.867 1.00 0.00 O ATOM 903 CB TRP A 123 9.927 -3.425 7.638 1.00 0.00 C ATOM 904 CG TRP A 123 10.282 -1.966 7.557 1.00 0.00 C ATOM 905 CD1 TRP A 123 11.324 -1.414 6.867 1.00 0.00 C ATOM 906 CD2 TRP A 123 9.595 -0.875 8.184 1.00 0.00 C ATOM 907 NE1 TRP A 123 11.331 -0.051 7.033 1.00 0.00 N ATOM 908 CE2 TRP A 123 10.280 0.305 7.835 1.00 0.00 C ATOM 909 CE3 TRP A 123 8.469 -0.782 9.007 1.00 0.00 C ATOM 910 CZ2 TRP A 123 9.876 1.559 8.282 1.00 0.00 C ATOM 911 CZ3 TRP A 123 8.068 0.462 9.449 1.00 0.00 C ATOM 912 CH2 TRP A 123 8.771 1.621 9.085 1.00 0.00 C ATOM 0 H TRP A 123 9.949 -2.673 10.482 1.00 0.00 H new ATOM 0 HA TRP A 123 10.023 -5.150 8.894 1.00 0.00 H new ATOM 0 HB2 TRP A 123 10.436 -3.955 6.833 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.857 -3.536 7.465 1.00 0.00 H new ATOM 0 HD1 TRP A 123 12.038 -1.969 6.277 1.00 0.00 H new ATOM 0 HE1 TRP A 123 12.009 0.592 6.625 1.00 0.00 H new ATOM 0 HE3 TRP A 123 7.922 -1.669 9.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 10.416 2.452 8.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 7.199 0.545 10.085 1.00 0.00 H new ATOM 0 HH2 TRP A 123 8.432 2.581 9.446 1.00 0.00 H new ATOM 923 N ARG A 124 12.311 -4.971 9.990 1.00 0.00 N ATOM 924 CA ARG A 124 13.724 -4.977 10.357 1.00 0.00 C ATOM 925 C ARG A 124 14.603 -5.433 9.192 1.00 0.00 C ATOM 926 O ARG A 124 14.872 -6.624 9.026 1.00 0.00 O ATOM 927 CB ARG A 124 13.962 -5.866 11.586 1.00 0.00 C ATOM 928 CG ARG A 124 13.220 -5.407 12.841 1.00 0.00 C ATOM 929 CD ARG A 124 11.858 -6.077 12.992 1.00 0.00 C ATOM 930 NE ARG A 124 11.938 -7.537 12.869 1.00 0.00 N ATOM 931 CZ ARG A 124 10.945 -8.315 12.420 1.00 0.00 C ATOM 932 NH1 ARG A 124 9.782 -7.788 12.042 1.00 0.00 N ATOM 933 NH2 ARG A 124 11.119 -9.629 12.350 1.00 0.00 N ATOM 0 H ARG A 124 11.783 -5.774 10.331 1.00 0.00 H new ATOM 0 HA ARG A 124 14.003 -3.953 10.607 1.00 0.00 H new ATOM 0 HB2 ARG A 124 13.657 -6.885 11.349 1.00 0.00 H new ATOM 0 HB3 ARG A 124 15.031 -5.895 11.799 1.00 0.00 H new ATOM 0 HG2 ARG A 124 13.828 -5.625 13.719 1.00 0.00 H new ATOM 0 HG3 ARG A 124 13.088 -4.326 12.806 1.00 0.00 H new ATOM 0 HD2 ARG A 124 11.435 -5.819 13.963 1.00 0.00 H new ATOM 0 HD3 ARG A 124 11.178 -5.688 12.234 1.00 0.00 H new ATOM 0 HE ARG A 124 12.809 -7.990 13.144 1.00 0.00 H new ATOM 0 HH11 ARG A 124 9.639 -6.779 12.092 1.00 0.00 H new ATOM 0 HH12 ARG A 124 9.034 -8.393 11.702 1.00 0.00 H new ATOM 0 HH21 ARG A 124 12.006 -10.042 12.638 1.00 0.00 H new ATOM 0 HH22 ARG A 124 10.365 -10.226 12.009 1.00 0.00 H new ATOM 947 N ARG A 125 15.054 -4.463 8.395 1.00 0.00 N ATOM 948 CA ARG A 125 15.915 -4.729 7.244 1.00 0.00 C ATOM 949 C ARG A 125 17.216 -3.931 7.373 1.00 0.00 C ATOM 950 O ARG A 125 17.291 -3.000 8.173 1.00 0.00 O ATOM 951 CB ARG A 125 15.190 -4.360 5.940 1.00 0.00 C ATOM 952 CG ARG A 125 14.596 -5.557 5.209 1.00 0.00 C ATOM 953 CD ARG A 125 13.860 -5.134 3.945 1.00 0.00 C ATOM 954 NE ARG A 125 13.590 -6.270 3.060 1.00 0.00 N ATOM 955 CZ ARG A 125 14.486 -6.806 2.224 1.00 0.00 C ATOM 956 NH1 ARG A 125 15.725 -6.323 2.151 1.00 0.00 N ATOM 957 NH2 ARG A 125 14.141 -7.834 1.457 1.00 0.00 N ATOM 0 H ARG A 125 14.834 -3.476 8.529 1.00 0.00 H new ATOM 0 HA ARG A 125 16.153 -5.792 7.218 1.00 0.00 H new ATOM 0 HB2 ARG A 125 14.393 -3.652 6.166 1.00 0.00 H new ATOM 0 HB3 ARG A 125 15.890 -3.852 5.277 1.00 0.00 H new ATOM 0 HG2 ARG A 125 15.391 -6.257 4.951 1.00 0.00 H new ATOM 0 HG3 ARG A 125 13.909 -6.084 5.871 1.00 0.00 H new ATOM 0 HD2 ARG A 125 12.919 -4.655 4.217 1.00 0.00 H new ATOM 0 HD3 ARG A 125 14.454 -4.392 3.411 1.00 0.00 H new ATOM 0 HE ARG A 125 12.656 -6.680 3.083 1.00 0.00 H new ATOM 0 HH11 ARG A 125 16.001 -5.535 2.737 1.00 0.00 H new ATOM 0 HH12 ARG A 125 16.398 -6.741 1.509 1.00 0.00 H new ATOM 0 HH21 ARG A 125 13.195 -8.212 1.507 1.00 0.00 H new ATOM 0 HH22 ARG A 125 14.822 -8.245 0.818 1.00 0.00 H new ATOM 971 N PRO A 126 18.264 -4.287 6.595 1.00 0.00 N ATOM 972 CA PRO A 126 19.567 -3.601 6.638 1.00 0.00 C ATOM 973 C PRO A 126 19.460 -2.071 6.702 1.00 0.00 C ATOM 974 O PRO A 126 18.362 -1.514 6.646 1.00 0.00 O ATOM 975 CB PRO A 126 20.218 -4.045 5.339 1.00 0.00 C ATOM 976 CG PRO A 126 19.712 -5.427 5.163 1.00 0.00 C ATOM 977 CD PRO A 126 18.279 -5.397 5.620 1.00 0.00 C ATOM 0 HA PRO A 126 20.128 -3.856 7.537 1.00 0.00 H new ATOM 0 HB2 PRO A 126 19.933 -3.403 4.506 1.00 0.00 H new ATOM 0 HB3 PRO A 126 21.306 -4.019 5.404 1.00 0.00 H new ATOM 0 HG2 PRO A 126 19.784 -5.741 4.122 1.00 0.00 H new ATOM 0 HG3 PRO A 126 20.296 -6.136 5.751 1.00 0.00 H new ATOM 0 HD2 PRO A 126 17.595 -5.215 4.791 1.00 0.00 H new ATOM 0 HD3 PRO A 126 17.982 -6.340 6.078 1.00 0.00 H new ATOM 985 N HIS A 127 20.606 -1.396 6.813 1.00 0.00 N ATOM 986 CA HIS A 127 20.620 0.064 6.883 1.00 0.00 C ATOM 987 C HIS A 127 21.001 0.694 5.543 1.00 0.00 C ATOM 988 O HIS A 127 22.045 0.378 4.969 1.00 0.00 O ATOM 989 CB HIS A 127 21.579 0.567 7.975 1.00 0.00 C ATOM 990 CG HIS A 127 21.343 2.003 8.355 1.00 0.00 C ATOM 991 ND1 HIS A 127 22.062 2.853 9.129 1.00 0.00 N flip ATOM 992 CD2 HIS A 127 20.266 2.732 7.898 1.00 0.00 C flip ATOM 993 CE1 HIS A 127 21.415 4.060 9.116 1.00 0.00 C flip ATOM 994 NE2 HIS A 127 20.338 3.960 8.365 1.00 0.00 N flip ATOM 0 H HIS A 127 21.527 -1.833 6.856 1.00 0.00 H new ATOM 0 HA HIS A 127 19.605 0.370 7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 127 21.471 -0.059 8.861 1.00 0.00 H new ATOM 0 HB3 HIS A 127 22.606 0.454 7.628 1.00 0.00 H new ATOM 0 HD1 HIS A 127 22.924 2.634 9.628 1.00 0.00 H new ATOM 0 HD2 HIS A 127 19.484 2.354 7.256 1.00 0.00 H new ATOM 0 HE1 HIS A 127 21.736 4.950 9.637 1.00 0.00 H new ATOM 1003 N GLU A 128 20.148 1.605 5.067 1.00 0.00 N ATOM 1004 CA GLU A 128 20.384 2.314 3.812 1.00 0.00 C ATOM 1005 C GLU A 128 21.555 3.293 3.952 1.00 0.00 C ATOM 1006 O GLU A 128 22.337 3.471 3.017 1.00 0.00 O ATOM 1007 CB GLU A 128 19.115 3.047 3.383 1.00 0.00 C ATOM 1008 CG GLU A 128 19.367 4.250 2.491 1.00 0.00 C ATOM 1009 CD GLU A 128 18.104 4.768 1.830 1.00 0.00 C ATOM 1010 OE1 GLU A 128 17.432 5.636 2.428 1.00 0.00 O ATOM 1011 OE2 GLU A 128 17.785 4.306 0.714 1.00 0.00 O ATOM 0 H GLU A 128 19.282 1.868 5.538 1.00 0.00 H new ATOM 0 HA GLU A 128 20.646 1.587 3.043 1.00 0.00 H new ATOM 0 HB2 GLU A 128 18.464 2.348 2.857 1.00 0.00 H new ATOM 0 HB3 GLU A 128 18.578 3.374 4.273 1.00 0.00 H new ATOM 0 HG2 GLU A 128 19.815 5.048 3.083 1.00 0.00 H new ATOM 0 HG3 GLU A 128 20.090 3.980 1.721 1.00 0.00 H new ATOM 1018 N THR A 129 21.670 3.920 5.130 1.00 0.00 N ATOM 1019 CA THR A 129 22.745 4.878 5.397 1.00 0.00 C ATOM 1020 C THR A 129 23.778 4.302 6.378 1.00 0.00 C ATOM 1021 O THR A 129 24.552 5.050 6.981 1.00 0.00 O ATOM 1022 CB THR A 129 22.178 6.201 5.936 1.00 0.00 C ATOM 1023 OG1 THR A 129 21.747 6.065 7.278 1.00 0.00 O ATOM 1024 CG2 THR A 129 21.007 6.731 5.131 1.00 0.00 C ATOM 0 H THR A 129 21.030 3.779 5.912 1.00 0.00 H new ATOM 0 HA THR A 129 23.250 5.075 4.451 1.00 0.00 H new ATOM 0 HB THR A 129 23.003 6.909 5.859 1.00 0.00 H new ATOM 0 HG1 THR A 129 20.958 5.485 7.311 1.00 0.00 H new ATOM 0 HG21 THR A 129 20.658 7.666 5.569 1.00 0.00 H new ATOM 0 HG22 THR A 129 21.322 6.907 4.103 1.00 0.00 H new ATOM 0 HG23 THR A 129 20.198 6.001 5.142 1.00 0.00 H new ATOM 1032 N GLY A 130 23.788 2.972 6.532 1.00 0.00 N ATOM 1033 CA GLY A 130 24.729 2.319 7.434 1.00 0.00 C ATOM 1034 C GLY A 130 25.164 0.957 6.934 1.00 0.00 C ATOM 1035 O GLY A 130 24.667 0.478 5.913 1.00 0.00 O ATOM 0 H GLY A 130 23.157 2.335 6.045 1.00 0.00 H new ATOM 0 HA2 GLY A 130 25.606 2.953 7.559 1.00 0.00 H new ATOM 0 HA3 GLY A 130 24.270 2.212 8.417 1.00 0.00 H new ATOM 1039 N GLY A 131 26.094 0.330 7.655 1.00 0.00 N ATOM 1040 CA GLY A 131 26.584 -0.983 7.268 1.00 0.00 C ATOM 1041 C GLY A 131 26.204 -2.058 8.270 1.00 0.00 C ATOM 1042 O GLY A 131 26.914 -3.056 8.410 1.00 0.00 O ATOM 0 H GLY A 131 26.517 0.710 8.502 1.00 0.00 H new ATOM 0 HA2 GLY A 131 26.183 -1.244 6.289 1.00 0.00 H new ATOM 0 HA3 GLY A 131 27.669 -0.949 7.169 1.00 0.00 H new ATOM 1046 N TYR A 132 25.078 -1.862 8.961 1.00 0.00 N ATOM 1047 CA TYR A 132 24.599 -2.828 9.947 1.00 0.00 C ATOM 1048 C TYR A 132 23.099 -3.055 9.807 1.00 0.00 C ATOM 1049 O TYR A 132 22.394 -2.236 9.216 1.00 0.00 O ATOM 1050 CB TYR A 132 24.950 -2.384 11.381 1.00 0.00 C ATOM 1051 CG TYR A 132 24.501 -0.981 11.790 1.00 0.00 C ATOM 1052 CD1 TYR A 132 23.466 -0.296 11.146 1.00 0.00 C ATOM 1053 CD2 TYR A 132 25.122 -0.347 12.858 1.00 0.00 C ATOM 1054 CE1 TYR A 132 23.078 0.962 11.554 1.00 0.00 C ATOM 1055 CE2 TYR A 132 24.738 0.912 13.273 1.00 0.00 C ATOM 1056 CZ TYR A 132 23.715 1.564 12.619 1.00 0.00 C ATOM 1057 OH TYR A 132 23.330 2.820 13.027 1.00 0.00 O ATOM 0 H TYR A 132 24.482 -1.041 8.854 1.00 0.00 H new ATOM 0 HA TYR A 132 25.106 -3.773 9.754 1.00 0.00 H new ATOM 0 HB2 TYR A 132 24.511 -3.099 12.077 1.00 0.00 H new ATOM 0 HB3 TYR A 132 26.032 -2.445 11.502 1.00 0.00 H new ATOM 0 HD1 TYR A 132 22.961 -0.762 10.313 1.00 0.00 H new ATOM 0 HD2 TYR A 132 25.924 -0.851 13.376 1.00 0.00 H new ATOM 0 HE1 TYR A 132 22.278 1.475 11.041 1.00 0.00 H new ATOM 0 HE2 TYR A 132 25.237 1.384 14.106 1.00 0.00 H new ATOM 0 HH TYR A 132 23.878 3.099 13.790 1.00 0.00 H new ATOM 1067 N MET A 133 22.603 -4.178 10.327 1.00 0.00 N ATOM 1068 CA MET A 133 21.180 -4.483 10.229 1.00 0.00 C ATOM 1069 C MET A 133 20.358 -3.506 11.068 1.00 0.00 C ATOM 1070 O MET A 133 20.456 -3.483 12.296 1.00 0.00 O ATOM 1071 CB MET A 133 20.880 -5.926 10.654 1.00 0.00 C ATOM 1072 CG MET A 133 21.905 -6.945 10.172 1.00 0.00 C ATOM 1073 SD MET A 133 21.298 -8.642 10.258 1.00 0.00 S ATOM 1074 CE MET A 133 22.774 -9.554 9.810 1.00 0.00 C ATOM 0 H MET A 133 23.159 -4.881 10.814 1.00 0.00 H new ATOM 0 HA MET A 133 20.896 -4.375 9.182 1.00 0.00 H new ATOM 0 HB2 MET A 133 20.826 -5.969 11.742 1.00 0.00 H new ATOM 0 HB3 MET A 133 19.898 -6.208 10.275 1.00 0.00 H new ATOM 0 HG2 MET A 133 22.183 -6.715 9.143 1.00 0.00 H new ATOM 0 HG3 MET A 133 22.809 -6.857 10.774 1.00 0.00 H new ATOM 0 HE1 MET A 133 22.558 -10.622 9.819 1.00 0.00 H new ATOM 0 HE2 MET A 133 23.096 -9.257 8.812 1.00 0.00 H new ATOM 0 HE3 MET A 133 23.567 -9.338 10.527 1.00 0.00 H new ATOM 1084 N LEU A 134 19.549 -2.707 10.382 1.00 0.00 N ATOM 1085 CA LEU A 134 18.688 -1.716 11.019 1.00 0.00 C ATOM 1086 C LEU A 134 17.319 -2.333 11.304 1.00 0.00 C ATOM 1087 O LEU A 134 16.832 -3.158 10.531 1.00 0.00 O ATOM 1088 CB LEU A 134 18.568 -0.496 10.093 1.00 0.00 C ATOM 1089 CG LEU A 134 17.908 0.749 10.694 1.00 0.00 C ATOM 1090 CD1 LEU A 134 18.823 1.380 11.732 1.00 0.00 C ATOM 1091 CD2 LEU A 134 17.564 1.754 9.597 1.00 0.00 C ATOM 0 H LEU A 134 19.471 -2.728 9.365 1.00 0.00 H new ATOM 0 HA LEU A 134 19.115 -1.394 11.969 1.00 0.00 H new ATOM 0 HB2 LEU A 134 19.568 -0.224 9.754 1.00 0.00 H new ATOM 0 HB3 LEU A 134 18.002 -0.791 9.210 1.00 0.00 H new ATOM 0 HG LEU A 134 16.982 0.450 11.185 1.00 0.00 H new ATOM 0 HD11 LEU A 134 18.342 2.264 12.151 1.00 0.00 H new ATOM 0 HD12 LEU A 134 19.020 0.662 12.528 1.00 0.00 H new ATOM 0 HD13 LEU A 134 19.763 1.667 11.262 1.00 0.00 H new ATOM 0 HD21 LEU A 134 17.096 2.632 10.042 1.00 0.00 H new ATOM 0 HD22 LEU A 134 18.475 2.052 9.078 1.00 0.00 H new ATOM 0 HD23 LEU A 134 16.875 1.296 8.887 1.00 0.00 H new ATOM 1103 N GLU A 135 16.697 -1.923 12.404 1.00 0.00 N ATOM 1104 CA GLU A 135 15.371 -2.429 12.775 1.00 0.00 C ATOM 1105 C GLU A 135 14.408 -1.253 12.890 1.00 0.00 C ATOM 1106 O GLU A 135 14.601 -0.390 13.740 1.00 0.00 O ATOM 1107 CB GLU A 135 15.441 -3.181 14.112 1.00 0.00 C ATOM 1108 CG GLU A 135 16.406 -4.360 14.105 1.00 0.00 C ATOM 1109 CD GLU A 135 16.235 -5.264 15.313 1.00 0.00 C ATOM 1110 OE1 GLU A 135 16.452 -4.787 16.447 1.00 0.00 O ATOM 1111 OE2 GLU A 135 15.883 -6.447 15.125 1.00 0.00 O ATOM 0 H GLU A 135 17.085 -1.242 13.057 1.00 0.00 H new ATOM 0 HA GLU A 135 15.020 -3.121 12.009 1.00 0.00 H new ATOM 0 HB2 GLU A 135 15.740 -2.484 14.895 1.00 0.00 H new ATOM 0 HB3 GLU A 135 14.445 -3.541 14.368 1.00 0.00 H new ATOM 0 HG2 GLU A 135 16.255 -4.942 13.196 1.00 0.00 H new ATOM 0 HG3 GLU A 135 17.430 -3.986 14.078 1.00 0.00 H new ATOM 1118 N CYS A 136 13.389 -1.201 12.024 1.00 0.00 N ATOM 1119 CA CYS A 136 12.436 -0.086 12.035 1.00 0.00 C ATOM 1120 C CYS A 136 11.036 -0.495 12.498 1.00 0.00 C ATOM 1121 O CYS A 136 10.658 -1.667 12.444 1.00 0.00 O ATOM 1122 CB CYS A 136 12.363 0.564 10.647 1.00 0.00 C ATOM 1123 SG CYS A 136 13.900 1.399 10.122 1.00 0.00 S ATOM 0 H CYS A 136 13.204 -1.910 11.314 1.00 0.00 H new ATOM 0 HA CYS A 136 12.809 0.635 12.763 1.00 0.00 H new ATOM 0 HB2 CYS A 136 12.112 -0.202 9.913 1.00 0.00 H new ATOM 0 HB3 CYS A 136 11.550 1.290 10.642 1.00 0.00 H new ATOM 1128 N VAL A 137 10.281 0.509 12.959 1.00 0.00 N ATOM 1129 CA VAL A 137 8.914 0.336 13.457 1.00 0.00 C ATOM 1130 C VAL A 137 8.006 1.431 12.881 1.00 0.00 C ATOM 1131 O VAL A 137 8.496 2.374 12.257 1.00 0.00 O ATOM 1132 CB VAL A 137 8.870 0.398 15.007 1.00 0.00 C ATOM 1133 CG1 VAL A 137 8.439 -0.936 15.597 1.00 0.00 C ATOM 1134 CG2 VAL A 137 10.208 0.825 15.578 1.00 0.00 C ATOM 0 H VAL A 137 10.607 1.475 12.997 1.00 0.00 H new ATOM 0 HA VAL A 137 8.562 -0.645 13.138 1.00 0.00 H new ATOM 0 HB VAL A 137 8.129 1.148 15.284 1.00 0.00 H new ATOM 0 HG11 VAL A 137 8.417 -0.863 16.684 1.00 0.00 H new ATOM 0 HG12 VAL A 137 7.445 -1.192 15.230 1.00 0.00 H new ATOM 0 HG13 VAL A 137 9.146 -1.711 15.300 1.00 0.00 H new ATOM 0 HG21 VAL A 137 10.145 0.859 16.666 1.00 0.00 H new ATOM 0 HG22 VAL A 137 10.975 0.110 15.281 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.467 1.813 15.198 1.00 0.00 H new ATOM 1144 N CYS A 138 6.689 1.314 13.090 1.00 0.00 N ATOM 1145 CA CYS A 138 5.743 2.316 12.582 1.00 0.00 C ATOM 1146 C CYS A 138 4.737 2.733 13.656 1.00 0.00 C ATOM 1147 O CYS A 138 3.958 1.912 14.142 1.00 0.00 O ATOM 1148 CB CYS A 138 4.995 1.785 11.351 1.00 0.00 C ATOM 1149 SG CYS A 138 4.025 3.052 10.462 1.00 0.00 S ATOM 0 H CYS A 138 6.257 0.544 13.602 1.00 0.00 H new ATOM 0 HA CYS A 138 6.324 3.193 12.296 1.00 0.00 H new ATOM 0 HB2 CYS A 138 5.717 1.346 10.662 1.00 0.00 H new ATOM 0 HB3 CYS A 138 4.325 0.984 11.664 1.00 0.00 H new ATOM 1154 N LEU A 139 4.755 4.020 14.008 1.00 0.00 N ATOM 1155 CA LEU A 139 3.840 4.568 15.009 1.00 0.00 C ATOM 1156 C LEU A 139 2.851 5.535 14.355 1.00 0.00 C ATOM 1157 O LEU A 139 3.253 6.548 13.779 1.00 0.00 O ATOM 1158 CB LEU A 139 4.625 5.285 16.114 1.00 0.00 C ATOM 1159 CG LEU A 139 5.580 4.391 16.922 1.00 0.00 C ATOM 1160 CD1 LEU A 139 6.952 5.042 17.045 1.00 0.00 C ATOM 1161 CD2 LEU A 139 5.002 4.088 18.299 1.00 0.00 C ATOM 0 H LEU A 139 5.398 4.705 13.611 1.00 0.00 H new ATOM 0 HA LEU A 139 3.282 3.744 15.454 1.00 0.00 H new ATOM 0 HB2 LEU A 139 5.202 6.092 15.663 1.00 0.00 H new ATOM 0 HB3 LEU A 139 3.916 5.746 16.801 1.00 0.00 H new ATOM 0 HG LEU A 139 5.696 3.448 16.388 1.00 0.00 H new ATOM 0 HD11 LEU A 139 7.612 4.393 17.620 1.00 0.00 H new ATOM 0 HD12 LEU A 139 7.371 5.197 16.051 1.00 0.00 H new ATOM 0 HD13 LEU A 139 6.855 6.002 17.552 1.00 0.00 H new ATOM 0 HD21 LEU A 139 5.695 3.454 18.853 1.00 0.00 H new ATOM 0 HD22 LEU A 139 4.849 5.020 18.843 1.00 0.00 H new ATOM 0 HD23 LEU A 139 4.048 3.572 18.188 1.00 0.00 H new ATOM 1173 N GLY A 140 1.559 5.215 14.441 1.00 0.00 N ATOM 1174 CA GLY A 140 0.536 6.063 13.850 1.00 0.00 C ATOM 1175 C GLY A 140 0.077 7.168 14.785 1.00 0.00 C ATOM 1176 O GLY A 140 -0.767 6.940 15.653 1.00 0.00 O ATOM 0 H GLY A 140 1.204 4.382 14.910 1.00 0.00 H new ATOM 0 HA2 GLY A 140 0.923 6.507 12.933 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -0.321 5.450 13.571 1.00 0.00 H new ATOM 1180 N ASN A 141 0.632 8.369 14.605 1.00 0.00 N ATOM 1181 CA ASN A 141 0.275 9.520 15.437 1.00 0.00 C ATOM 1182 C ASN A 141 0.139 10.789 14.587 1.00 0.00 C ATOM 1183 O ASN A 141 0.754 11.816 14.881 1.00 0.00 O ATOM 1184 CB ASN A 141 1.318 9.725 16.547 1.00 0.00 C ATOM 1185 CG ASN A 141 2.748 9.756 16.027 1.00 0.00 C ATOM 1186 OD1 ASN A 141 3.249 10.806 15.625 1.00 0.00 O ATOM 1187 ND2 ASN A 141 3.410 8.603 16.033 1.00 0.00 N ATOM 0 H ASN A 141 1.331 8.569 13.890 1.00 0.00 H new ATOM 0 HA ASN A 141 -0.691 9.317 15.900 1.00 0.00 H new ATOM 0 HB2 ASN A 141 1.107 10.659 17.067 1.00 0.00 H new ATOM 0 HB3 ASN A 141 1.222 8.924 17.280 1.00 0.00 H new ATOM 0 HD21 ASN A 141 4.372 8.565 15.695 1.00 0.00 H new ATOM 0 HD22 ASN A 141 2.956 7.756 16.375 1.00 0.00 H new ATOM 1194 N GLY A 142 -0.673 10.704 13.531 1.00 0.00 N ATOM 1195 CA GLY A 142 -0.882 11.843 12.651 1.00 0.00 C ATOM 1196 C GLY A 142 -1.081 11.430 11.204 1.00 0.00 C ATOM 1197 O GLY A 142 -2.207 11.431 10.703 1.00 0.00 O ATOM 0 H GLY A 142 -1.190 9.864 13.271 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.753 12.404 12.989 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.025 12.513 12.720 1.00 0.00 H new ATOM 1201 N LYS A 143 0.017 11.076 10.531 1.00 0.00 N ATOM 1202 CA LYS A 143 -0.032 10.655 9.130 1.00 0.00 C ATOM 1203 C LYS A 143 0.719 9.338 8.916 1.00 0.00 C ATOM 1204 O LYS A 143 0.242 8.454 8.202 1.00 0.00 O ATOM 1205 CB LYS A 143 0.539 11.751 8.215 1.00 0.00 C ATOM 1206 CG LYS A 143 1.912 12.261 8.633 1.00 0.00 C ATOM 1207 CD LYS A 143 2.386 13.400 7.739 1.00 0.00 C ATOM 1208 CE LYS A 143 3.893 13.371 7.549 1.00 0.00 C ATOM 1209 NZ LYS A 143 4.387 14.558 6.796 1.00 0.00 N ATOM 0 H LYS A 143 0.953 11.073 10.936 1.00 0.00 H new ATOM 0 HA LYS A 143 -1.078 10.491 8.870 1.00 0.00 H new ATOM 0 HB2 LYS A 143 0.602 11.363 7.198 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -0.157 12.590 8.194 1.00 0.00 H new ATOM 0 HG2 LYS A 143 1.874 12.602 9.668 1.00 0.00 H new ATOM 0 HG3 LYS A 143 2.632 11.443 8.593 1.00 0.00 H new ATOM 0 HD2 LYS A 143 1.895 13.330 6.768 1.00 0.00 H new ATOM 0 HD3 LYS A 143 2.092 14.354 8.177 1.00 0.00 H new ATOM 0 HE2 LYS A 143 4.380 13.332 8.523 1.00 0.00 H new ATOM 0 HE3 LYS A 143 4.173 12.462 7.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 5.420 14.497 6.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 3.943 14.582 5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 4.143 15.425 7.316 1.00 0.00 H new ATOM 1223 N GLY A 144 1.895 9.211 9.538 1.00 0.00 N ATOM 1224 CA GLY A 144 2.687 7.998 9.402 1.00 0.00 C ATOM 1225 C GLY A 144 4.128 8.191 9.843 1.00 0.00 C ATOM 1226 O GLY A 144 4.983 8.572 9.043 1.00 0.00 O ATOM 0 H GLY A 144 2.311 9.928 10.133 1.00 0.00 H new ATOM 0 HA2 GLY A 144 2.233 7.203 9.994 1.00 0.00 H new ATOM 0 HA3 GLY A 144 2.669 7.671 8.362 1.00 0.00 H new ATOM 1230 N GLU A 145 4.391 7.922 11.124 1.00 0.00 N ATOM 1231 CA GLU A 145 5.736 8.062 11.686 1.00 0.00 C ATOM 1232 C GLU A 145 6.394 6.695 11.867 1.00 0.00 C ATOM 1233 O GLU A 145 5.709 5.683 12.025 1.00 0.00 O ATOM 1234 CB GLU A 145 5.673 8.802 13.029 1.00 0.00 C ATOM 1235 CG GLU A 145 6.973 9.495 13.410 1.00 0.00 C ATOM 1236 CD GLU A 145 6.844 10.329 14.672 1.00 0.00 C ATOM 1237 OE1 GLU A 145 6.464 11.514 14.564 1.00 0.00 O ATOM 1238 OE2 GLU A 145 7.125 9.797 15.766 1.00 0.00 O ATOM 0 H GLU A 145 3.689 7.605 11.793 1.00 0.00 H new ATOM 0 HA GLU A 145 6.340 8.643 10.989 1.00 0.00 H new ATOM 0 HB2 GLU A 145 4.875 9.544 12.987 1.00 0.00 H new ATOM 0 HB3 GLU A 145 5.408 8.092 13.812 1.00 0.00 H new ATOM 0 HG2 GLU A 145 7.751 8.745 13.553 1.00 0.00 H new ATOM 0 HG3 GLU A 145 7.294 10.135 12.588 1.00 0.00 H new ATOM 1245 N TRP A 146 7.726 6.676 11.841 1.00 0.00 N ATOM 1246 CA TRP A 146 8.484 5.435 12.000 1.00 0.00 C ATOM 1247 C TRP A 146 9.687 5.640 12.926 1.00 0.00 C ATOM 1248 O TRP A 146 10.067 6.774 13.224 1.00 0.00 O ATOM 1249 CB TRP A 146 8.933 4.898 10.633 1.00 0.00 C ATOM 1250 CG TRP A 146 9.215 5.965 9.617 1.00 0.00 C ATOM 1251 CD1 TRP A 146 10.256 6.840 9.626 1.00 0.00 C ATOM 1252 CD2 TRP A 146 8.444 6.269 8.448 1.00 0.00 C ATOM 1253 NE1 TRP A 146 10.187 7.672 8.536 1.00 0.00 N ATOM 1254 CE2 TRP A 146 9.081 7.341 7.795 1.00 0.00 C ATOM 1255 CE3 TRP A 146 7.278 5.738 7.887 1.00 0.00 C ATOM 1256 CZ2 TRP A 146 8.592 7.892 6.614 1.00 0.00 C ATOM 1257 CZ3 TRP A 146 6.794 6.286 6.714 1.00 0.00 C ATOM 1258 CH2 TRP A 146 7.450 7.352 6.088 1.00 0.00 C ATOM 0 H TRP A 146 8.303 7.507 11.711 1.00 0.00 H new ATOM 0 HA TRP A 146 7.830 4.695 12.461 1.00 0.00 H new ATOM 0 HB2 TRP A 146 9.831 4.295 10.769 1.00 0.00 H new ATOM 0 HB3 TRP A 146 8.160 4.236 10.243 1.00 0.00 H new ATOM 0 HD1 TRP A 146 11.026 6.875 10.382 1.00 0.00 H new ATOM 0 HE1 TRP A 146 10.850 8.415 8.314 1.00 0.00 H new ATOM 0 HE3 TRP A 146 6.765 4.915 8.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 9.096 8.716 6.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 5.894 5.884 6.273 1.00 0.00 H new ATOM 0 HH2 TRP A 146 7.047 7.757 5.171 1.00 0.00 H new ATOM 1269 N THR A 147 10.265 4.530 13.396 1.00 0.00 N ATOM 1270 CA THR A 147 11.406 4.577 14.314 1.00 0.00 C ATOM 1271 C THR A 147 12.294 3.343 14.137 1.00 0.00 C ATOM 1272 O THR A 147 11.794 2.262 13.853 1.00 0.00 O ATOM 1273 CB THR A 147 10.873 4.695 15.762 1.00 0.00 C ATOM 1274 OG1 THR A 147 11.413 5.836 16.404 1.00 0.00 O ATOM 1275 CG2 THR A 147 11.131 3.502 16.670 1.00 0.00 C ATOM 0 H THR A 147 9.960 3.587 13.155 1.00 0.00 H new ATOM 0 HA THR A 147 12.025 5.446 14.093 1.00 0.00 H new ATOM 0 HB THR A 147 9.794 4.761 15.624 1.00 0.00 H new ATOM 0 HG1 THR A 147 11.063 5.894 17.317 1.00 0.00 H new ATOM 0 HG21 THR A 147 10.713 3.699 17.657 1.00 0.00 H new ATOM 0 HG22 THR A 147 10.660 2.614 16.247 1.00 0.00 H new ATOM 0 HG23 THR A 147 12.205 3.336 16.757 1.00 0.00 H new ATOM 1283 N CYS A 148 13.611 3.497 14.315 1.00 0.00 N ATOM 1284 CA CYS A 148 14.525 2.355 14.186 1.00 0.00 C ATOM 1285 C CYS A 148 15.635 2.409 15.233 1.00 0.00 C ATOM 1286 O CYS A 148 16.054 3.487 15.660 1.00 0.00 O ATOM 1287 CB CYS A 148 15.139 2.249 12.770 1.00 0.00 C ATOM 1288 SG CYS A 148 14.115 2.945 11.427 1.00 0.00 S ATOM 0 H CYS A 148 14.062 4.383 14.544 1.00 0.00 H new ATOM 0 HA CYS A 148 13.924 1.462 14.356 1.00 0.00 H new ATOM 0 HB2 CYS A 148 16.104 2.756 12.770 1.00 0.00 H new ATOM 0 HB3 CYS A 148 15.331 1.198 12.552 1.00 0.00 H new ATOM 1293 N LYS A 149 16.107 1.227 15.630 1.00 0.00 N ATOM 1294 CA LYS A 149 17.176 1.097 16.618 1.00 0.00 C ATOM 1295 C LYS A 149 18.191 0.057 16.140 1.00 0.00 C ATOM 1296 O LYS A 149 18.034 -1.138 16.402 1.00 0.00 O ATOM 1297 CB LYS A 149 16.600 0.692 17.981 1.00 0.00 C ATOM 1298 CG LYS A 149 15.771 1.780 18.655 1.00 0.00 C ATOM 1299 CD LYS A 149 15.269 1.343 20.026 1.00 0.00 C ATOM 1300 CE LYS A 149 14.012 0.491 19.922 1.00 0.00 C ATOM 1301 NZ LYS A 149 13.506 0.077 21.261 1.00 0.00 N ATOM 0 H LYS A 149 15.760 0.336 15.276 1.00 0.00 H new ATOM 0 HA LYS A 149 17.675 2.059 16.731 1.00 0.00 H new ATOM 0 HB2 LYS A 149 15.980 -0.195 17.852 1.00 0.00 H new ATOM 0 HB3 LYS A 149 17.421 0.414 18.642 1.00 0.00 H new ATOM 0 HG2 LYS A 149 16.373 2.683 18.759 1.00 0.00 H new ATOM 0 HG3 LYS A 149 14.921 2.034 18.021 1.00 0.00 H new ATOM 0 HD2 LYS A 149 16.050 0.779 20.536 1.00 0.00 H new ATOM 0 HD3 LYS A 149 15.062 2.223 20.635 1.00 0.00 H new ATOM 0 HE2 LYS A 149 13.237 1.051 19.399 1.00 0.00 H new ATOM 0 HE3 LYS A 149 14.223 -0.396 19.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 12.649 -0.501 21.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 14.235 -0.479 21.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 13.279 0.922 21.823 1.00 0.00 H new ATOM 1315 N PRO A 150 19.235 0.493 15.405 1.00 0.00 N ATOM 1316 CA PRO A 150 20.254 -0.414 14.870 1.00 0.00 C ATOM 1317 C PRO A 150 21.169 -1.002 15.936 1.00 0.00 C ATOM 1318 O PRO A 150 21.187 -0.549 17.082 1.00 0.00 O ATOM 1319 CB PRO A 150 21.070 0.465 13.925 1.00 0.00 C ATOM 1320 CG PRO A 150 20.848 1.861 14.396 1.00 0.00 C ATOM 1321 CD PRO A 150 19.486 1.897 15.022 1.00 0.00 C ATOM 0 HA PRO A 150 19.785 -1.276 14.395 1.00 0.00 H new ATOM 0 HB2 PRO A 150 22.127 0.202 13.958 1.00 0.00 H new ATOM 0 HB3 PRO A 150 20.743 0.342 12.893 1.00 0.00 H new ATOM 0 HG2 PRO A 150 21.612 2.152 15.117 1.00 0.00 H new ATOM 0 HG3 PRO A 150 20.910 2.564 13.565 1.00 0.00 H new ATOM 0 HD2 PRO A 150 19.462 2.558 15.888 1.00 0.00 H new ATOM 0 HD3 PRO A 150 18.734 2.261 14.322 1.00 0.00 H new ATOM 1329 N ILE A 151 21.936 -2.009 15.527 1.00 0.00 N ATOM 1330 CA ILE A 151 22.884 -2.679 16.417 1.00 0.00 C ATOM 1331 C ILE A 151 24.247 -2.836 15.745 1.00 0.00 C ATOM 1332 O ILE A 151 24.290 -3.359 14.611 1.00 0.00 O ATOM 1333 CB ILE A 151 22.378 -4.062 16.867 1.00 0.00 C ATOM 1334 CG1 ILE A 151 20.909 -3.992 17.311 1.00 0.00 C ATOM 1335 CG2 ILE A 151 23.250 -4.616 17.992 1.00 0.00 C ATOM 1336 CD1 ILE A 151 19.925 -4.329 16.211 1.00 0.00 C ATOM 1337 OXT ILE A 151 25.258 -2.436 16.358 1.00 0.00 O ATOM 0 H ILE A 151 21.920 -2.382 14.578 1.00 0.00 H new ATOM 0 HA ILE A 151 22.983 -2.046 17.299 1.00 0.00 H new ATOM 0 HB ILE A 151 22.444 -4.738 16.014 1.00 0.00 H new ATOM 0 HG12 ILE A 151 20.757 -4.678 18.145 1.00 0.00 H new ATOM 0 HG13 ILE A 151 20.698 -2.989 17.681 1.00 0.00 H new ATOM 0 HG21 ILE A 151 22.875 -5.594 18.295 1.00 0.00 H new ATOM 0 HG22 ILE A 151 24.277 -4.714 17.641 1.00 0.00 H new ATOM 0 HG23 ILE A 151 23.221 -3.936 18.844 1.00 0.00 H new ATOM 0 HD11 ILE A 151 18.908 -4.259 16.598 1.00 0.00 H new ATOM 0 HD12 ILE A 151 20.048 -3.628 15.385 1.00 0.00 H new ATOM 0 HD13 ILE A 151 20.109 -5.343 15.857 1.00 0.00 H new TER 1349 ILE A 151