USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1218 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 102 SER OG : rot 180:sc= 0.0816 USER MOD Set 1.2: A 103 ASN : amide:sc= -0.749 K(o=-0.67,f=-7.4!) USER MOD Set 2.1: A 86 TYR OH : rot 119:sc= -0.206 USER MOD Set 2.2: A 90 ASN : amide:sc= -11.7! C(o=-12!,f=-12!) USER MOD Set 3.1: A 67 SER OG : rot 146:sc= 1.24 USER MOD Set 3.2: A 70 THR OG1 : rot 172:sc= -0.397 USER MOD Set 4.1: A 25 SER OG : rot 130:sc= -0.0267 USER MOD Set 4.2: A 32 HIS : no HE2:sc= -0.572 X(o=-0.6,f=-0.52) USER MOD Set 5.1: A 31 CYS SG : rot 39:sc= 0.116 USER MOD Set 5.2: A 79 CYS SG : rot -60:sc= -1.07! USER MOD Single : A 19 GLN : amide:sc= -1.04 K(o=-1,f=-4.1!) USER MOD Single : A 21 THR OG1 : rot -23:sc= -0.273 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -3.58! C(o=-3.6!,f=-5.3!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -157:sc= -0.0462 (180deg=-0.348) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= -0.0587 X(o=-0.059,f=-0.0016) USER MOD Single : A 64 HIS :FLIP no HE2:sc= -2.14 F(o=-3!,f=-2.1) USER MOD Single : A 71 ASN : amide:sc= -0.0464 X(o=-0.046,f=0) USER MOD Single : A 74 CYS SG : rot 72:sc= 0.507 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.21) USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 125:sc= 1.24 USER MOD Single : A 88 SER OG : rot -70:sc= 1.06 USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.608 USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.303 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 73:sc= 0.0503 USER MOD Single : A 110 MET CE :methyl -155:sc= -0.112 (180deg=-0.359) USER MOD Single : A 111 CYS SG : rot 115:sc= -0.657! USER MOD Single : A 112 ASN : amide:sc= -0.14 X(o=-0.14,f=0) USER MOD Single : A 114 HIS : no HD1:sc= -0.0439 X(o=-0.044,f=-0.25) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.1!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.217 K(o=-0.22,f=-0.82) USER MOD Single : A 138 MET CE :methyl -163:sc= -1.08 (180deg=-1.34) USER MOD Single : A 144 ASN : amide:sc= -0.489 X(o=-0.49,f=-0.07) USER MOD Single : A 148 ASN : amide:sc= -0.947 K(o=-0.95,f=-3.8!) USER MOD Single : A 151 GLN : amide:sc= -0.439 K(o=-0.44,f=-3.6!) USER MOD Single : A 153 ASN : amide:sc= -0.45 X(o=-0.45,f=-0.48) USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.076 USER MOD Single : A 155 THR OG1 : rot 140:sc= -1.42 USER MOD Single : A 160 MET CE :methyl -146:sc= -5.97! (180deg=-7.11!) USER MOD Single : A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 167 MET CE :methyl -109:sc= -0.0376 (180deg=-2.42!) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N GLU A 13 1.849 -12.562 6.623 1.00 0.00 N ATOM 70 CA GLU A 13 2.561 -11.475 5.960 1.00 0.00 C ATOM 71 C GLU A 13 3.186 -10.530 6.983 1.00 0.00 C ATOM 72 O GLU A 13 4.386 -10.262 6.945 1.00 0.00 O ATOM 73 CB GLU A 13 1.613 -10.698 5.045 1.00 0.00 C ATOM 74 CG GLU A 13 1.421 -11.341 3.682 1.00 0.00 C ATOM 75 CD GLU A 13 0.284 -12.344 3.665 1.00 0.00 C ATOM 76 OE1 GLU A 13 -0.004 -12.933 4.728 1.00 0.00 O ATOM 77 OE2 GLU A 13 -0.318 -12.540 2.589 1.00 0.00 O ATOM 0 HA GLU A 13 3.359 -11.911 5.359 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.643 -10.606 5.534 1.00 0.00 H new ATOM 0 HB3 GLU A 13 1.999 -9.688 4.910 1.00 0.00 H new ATOM 0 HG2 GLU A 13 1.227 -10.564 2.942 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.344 -11.839 3.386 1.00 0.00 H new ATOM 84 N GLY A 14 2.361 -10.028 7.898 1.00 0.00 N ATOM 85 CA GLY A 14 2.849 -9.119 8.918 1.00 0.00 C ATOM 86 C GLY A 14 4.128 -9.610 9.568 1.00 0.00 C ATOM 87 O GLY A 14 5.086 -8.852 9.718 1.00 0.00 O ATOM 0 H GLY A 14 1.364 -10.235 7.950 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.024 -8.139 8.474 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.083 -8.990 9.682 1.00 0.00 H new ATOM 91 N ASP A 15 4.141 -10.880 9.958 1.00 0.00 N ATOM 92 CA ASP A 15 5.311 -11.471 10.597 1.00 0.00 C ATOM 93 C ASP A 15 6.538 -11.356 9.697 1.00 0.00 C ATOM 94 O ASP A 15 7.570 -10.823 10.103 1.00 0.00 O ATOM 95 CB ASP A 15 5.047 -12.939 10.935 1.00 0.00 C ATOM 96 CG ASP A 15 6.015 -13.478 11.970 1.00 0.00 C ATOM 97 OD1 ASP A 15 6.372 -12.723 12.898 1.00 0.00 O ATOM 98 OD2 ASP A 15 6.417 -14.655 11.851 1.00 0.00 O ATOM 0 H ASP A 15 3.355 -11.520 9.843 1.00 0.00 H new ATOM 0 HA ASP A 15 5.506 -10.923 11.519 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.027 -13.046 11.305 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.121 -13.537 10.027 1.00 0.00 H new ATOM 103 N ALA A 16 6.418 -11.862 8.474 1.00 0.00 N ATOM 104 CA ALA A 16 7.516 -11.815 7.517 1.00 0.00 C ATOM 105 C ALA A 16 8.131 -10.421 7.454 1.00 0.00 C ATOM 106 O ALA A 16 9.352 -10.272 7.391 1.00 0.00 O ATOM 107 CB ALA A 16 7.034 -12.245 6.139 1.00 0.00 C ATOM 0 H ALA A 16 5.571 -12.309 8.123 1.00 0.00 H new ATOM 0 HA ALA A 16 8.287 -12.508 7.853 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.865 -12.205 5.434 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.650 -13.264 6.190 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.242 -11.575 5.805 1.00 0.00 H new ATOM 113 N LEU A 17 7.278 -9.403 7.469 1.00 0.00 N ATOM 114 CA LEU A 17 7.737 -8.019 7.413 1.00 0.00 C ATOM 115 C LEU A 17 8.407 -7.614 8.722 1.00 0.00 C ATOM 116 O LEU A 17 9.561 -7.185 8.735 1.00 0.00 O ATOM 117 CB LEU A 17 6.564 -7.083 7.116 1.00 0.00 C ATOM 118 CG LEU A 17 5.852 -7.302 5.781 1.00 0.00 C ATOM 119 CD1 LEU A 17 4.632 -6.401 5.672 1.00 0.00 C ATOM 120 CD2 LEU A 17 6.805 -7.054 4.621 1.00 0.00 C ATOM 0 H LEU A 17 6.265 -9.509 7.519 1.00 0.00 H new ATOM 0 HA LEU A 17 8.470 -7.938 6.611 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.832 -7.186 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.928 -6.056 7.147 1.00 0.00 H new ATOM 0 HG LEU A 17 5.518 -8.339 5.736 1.00 0.00 H new ATOM 0 HD11 LEU A 17 4.138 -6.571 4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.939 -6.627 6.483 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.942 -5.358 5.740 1.00 0.00 H new ATOM 0 HD21 LEU A 17 6.281 -7.215 3.679 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.170 -6.028 4.663 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.648 -7.742 4.689 1.00 0.00 H new ATOM 132 N LEU A 18 7.676 -7.754 9.823 1.00 0.00 N ATOM 133 CA LEU A 18 8.199 -7.405 11.139 1.00 0.00 C ATOM 134 C LEU A 18 9.692 -7.706 11.228 1.00 0.00 C ATOM 135 O LEU A 18 10.466 -6.904 11.750 1.00 0.00 O ATOM 136 CB LEU A 18 7.447 -8.171 12.228 1.00 0.00 C ATOM 137 CG LEU A 18 6.206 -7.482 12.798 1.00 0.00 C ATOM 138 CD1 LEU A 18 5.201 -8.512 13.289 1.00 0.00 C ATOM 139 CD2 LEU A 18 6.593 -6.533 13.924 1.00 0.00 C ATOM 0 H LEU A 18 6.719 -8.107 9.830 1.00 0.00 H new ATOM 0 HA LEU A 18 8.053 -6.335 11.289 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.148 -9.138 11.823 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.137 -8.368 13.048 1.00 0.00 H new ATOM 0 HG LEU A 18 5.740 -6.900 12.003 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.325 -8.003 13.691 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.900 -9.151 12.459 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.656 -9.121 14.070 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.698 -6.051 14.318 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.083 -7.094 14.720 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.275 -5.774 13.542 1.00 0.00 H new ATOM 151 N GLN A 19 10.088 -8.866 10.715 1.00 0.00 N ATOM 152 CA GLN A 19 11.489 -9.272 10.736 1.00 0.00 C ATOM 153 C GLN A 19 12.327 -8.382 9.824 1.00 0.00 C ATOM 154 O GLN A 19 13.186 -7.632 10.290 1.00 0.00 O ATOM 155 CB GLN A 19 11.625 -10.734 10.307 1.00 0.00 C ATOM 156 CG GLN A 19 11.291 -11.725 11.410 1.00 0.00 C ATOM 157 CD GLN A 19 12.325 -11.736 12.518 1.00 0.00 C ATOM 158 OE1 GLN A 19 12.564 -10.719 13.170 1.00 0.00 O ATOM 159 NE2 GLN A 19 12.947 -12.889 12.737 1.00 0.00 N ATOM 0 H GLN A 19 9.459 -9.541 10.280 1.00 0.00 H new ATOM 0 HA GLN A 19 11.857 -9.165 11.756 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.970 -10.917 9.455 1.00 0.00 H new ATOM 0 HB3 GLN A 19 12.646 -10.911 9.968 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.316 -11.479 11.831 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.211 -12.725 10.983 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.718 -13.707 12.173 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.654 -12.956 13.469 1.00 0.00 H new ATOM 168 N PHE A 20 12.073 -8.470 8.523 1.00 0.00 N ATOM 169 CA PHE A 20 12.805 -7.674 7.545 1.00 0.00 C ATOM 170 C PHE A 20 12.920 -6.223 8.002 1.00 0.00 C ATOM 171 O PHE A 20 14.014 -5.658 8.046 1.00 0.00 O ATOM 172 CB PHE A 20 12.112 -7.737 6.182 1.00 0.00 C ATOM 173 CG PHE A 20 12.714 -6.816 5.160 1.00 0.00 C ATOM 174 CD1 PHE A 20 12.402 -5.467 5.155 1.00 0.00 C ATOM 175 CD2 PHE A 20 13.593 -7.300 4.205 1.00 0.00 C ATOM 176 CE1 PHE A 20 12.954 -4.617 4.215 1.00 0.00 C ATOM 177 CE2 PHE A 20 14.149 -6.456 3.262 1.00 0.00 C ATOM 178 CZ PHE A 20 13.830 -5.112 3.268 1.00 0.00 C ATOM 0 H PHE A 20 11.365 -9.085 8.121 1.00 0.00 H new ATOM 0 HA PHE A 20 13.809 -8.089 7.454 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.156 -8.760 5.808 1.00 0.00 H new ATOM 0 HB3 PHE A 20 11.058 -7.488 6.307 1.00 0.00 H new ATOM 0 HD1 PHE A 20 11.719 -5.074 5.894 1.00 0.00 H new ATOM 0 HD2 PHE A 20 13.847 -8.350 4.197 1.00 0.00 H new ATOM 0 HE1 PHE A 20 12.701 -3.567 4.221 1.00 0.00 H new ATOM 0 HE2 PHE A 20 14.832 -6.847 2.522 1.00 0.00 H new ATOM 0 HZ PHE A 20 14.264 -4.449 2.534 1.00 0.00 H new ATOM 188 N THR A 21 11.783 -5.623 8.342 1.00 0.00 N ATOM 189 CA THR A 21 11.755 -4.238 8.795 1.00 0.00 C ATOM 190 C THR A 21 12.839 -3.977 9.835 1.00 0.00 C ATOM 191 O THR A 21 13.596 -3.014 9.728 1.00 0.00 O ATOM 192 CB THR A 21 10.385 -3.871 9.394 1.00 0.00 C ATOM 193 OG1 THR A 21 10.069 -4.756 10.474 1.00 0.00 O ATOM 194 CG2 THR A 21 9.294 -3.944 8.336 1.00 0.00 C ATOM 0 H THR A 21 10.869 -6.075 8.312 1.00 0.00 H new ATOM 0 HA THR A 21 11.939 -3.615 7.919 1.00 0.00 H new ATOM 0 HB THR A 21 10.439 -2.848 9.767 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.572 -5.591 10.371 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.335 -3.681 8.783 1.00 0.00 H new ATOM 0 HG22 THR A 21 9.522 -3.247 7.530 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.242 -4.957 7.936 1.00 0.00 H new ATOM 202 N ALA A 22 12.907 -4.843 10.841 1.00 0.00 N ATOM 203 CA ALA A 22 13.900 -4.707 11.900 1.00 0.00 C ATOM 204 C ALA A 22 15.313 -4.681 11.326 1.00 0.00 C ATOM 205 O ALA A 22 15.998 -3.661 11.387 1.00 0.00 O ATOM 206 CB ALA A 22 13.757 -5.839 12.906 1.00 0.00 C ATOM 0 H ALA A 22 12.287 -5.646 10.945 1.00 0.00 H new ATOM 0 HA ALA A 22 13.725 -3.759 12.410 1.00 0.00 H new ATOM 0 HB1 ALA A 22 14.505 -5.725 13.691 1.00 0.00 H new ATOM 0 HB2 ALA A 22 12.761 -5.810 13.347 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.903 -6.794 12.402 1.00 0.00 H new ATOM 212 N GLU A 23 15.742 -5.810 10.771 1.00 0.00 N ATOM 213 CA GLU A 23 17.075 -5.915 10.189 1.00 0.00 C ATOM 214 C GLU A 23 17.321 -4.792 9.186 1.00 0.00 C ATOM 215 O GLU A 23 18.228 -3.978 9.358 1.00 0.00 O ATOM 216 CB GLU A 23 17.251 -7.272 9.504 1.00 0.00 C ATOM 217 CG GLU A 23 17.252 -8.446 10.470 1.00 0.00 C ATOM 218 CD GLU A 23 18.610 -8.678 11.103 1.00 0.00 C ATOM 219 OE1 GLU A 23 19.434 -9.394 10.496 1.00 0.00 O ATOM 220 OE2 GLU A 23 18.849 -8.144 12.206 1.00 0.00 O ATOM 0 H GLU A 23 15.187 -6.664 10.712 1.00 0.00 H new ATOM 0 HA GLU A 23 17.803 -5.825 10.995 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.449 -7.410 8.778 1.00 0.00 H new ATOM 0 HB3 GLU A 23 18.188 -7.270 8.947 1.00 0.00 H new ATOM 0 HG2 GLU A 23 16.516 -8.268 11.254 1.00 0.00 H new ATOM 0 HG3 GLU A 23 16.943 -9.347 9.941 1.00 0.00 H new ATOM 227 N PHE A 24 16.506 -4.754 8.137 1.00 0.00 N ATOM 228 CA PHE A 24 16.635 -3.733 7.104 1.00 0.00 C ATOM 229 C PHE A 24 17.108 -2.411 7.703 1.00 0.00 C ATOM 230 O PHE A 24 17.969 -1.735 7.141 1.00 0.00 O ATOM 231 CB PHE A 24 15.299 -3.531 6.386 1.00 0.00 C ATOM 232 CG PHE A 24 15.300 -2.370 5.434 1.00 0.00 C ATOM 233 CD1 PHE A 24 15.087 -1.080 5.892 1.00 0.00 C ATOM 234 CD2 PHE A 24 15.512 -2.569 4.079 1.00 0.00 C ATOM 235 CE1 PHE A 24 15.087 -0.009 5.018 1.00 0.00 C ATOM 236 CE2 PHE A 24 15.514 -1.502 3.200 1.00 0.00 C ATOM 237 CZ PHE A 24 15.300 -0.221 3.670 1.00 0.00 C ATOM 0 H PHE A 24 15.749 -5.419 7.980 1.00 0.00 H new ATOM 0 HA PHE A 24 17.379 -4.073 6.383 1.00 0.00 H new ATOM 0 HB2 PHE A 24 15.049 -4.440 5.838 1.00 0.00 H new ATOM 0 HB3 PHE A 24 14.515 -3.381 7.129 1.00 0.00 H new ATOM 0 HD1 PHE A 24 14.919 -0.909 6.945 1.00 0.00 H new ATOM 0 HD2 PHE A 24 15.677 -3.569 3.706 1.00 0.00 H new ATOM 0 HE1 PHE A 24 14.921 0.992 5.389 1.00 0.00 H new ATOM 0 HE2 PHE A 24 15.683 -1.670 2.147 1.00 0.00 H new ATOM 0 HZ PHE A 24 15.299 0.614 2.984 1.00 0.00 H new ATOM 247 N SER A 25 16.537 -2.049 8.848 1.00 0.00 N ATOM 248 CA SER A 25 16.896 -0.807 9.522 1.00 0.00 C ATOM 249 C SER A 25 18.203 -0.965 10.293 1.00 0.00 C ATOM 250 O SER A 25 19.202 -0.317 9.982 1.00 0.00 O ATOM 251 CB SER A 25 15.778 -0.377 10.474 1.00 0.00 C ATOM 252 OG SER A 25 14.749 0.304 9.777 1.00 0.00 O ATOM 0 H SER A 25 15.824 -2.598 9.328 1.00 0.00 H new ATOM 0 HA SER A 25 17.033 -0.037 8.763 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.365 -1.253 10.974 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.186 0.270 11.250 1.00 0.00 H new ATOM 0 HG SER A 25 13.881 -0.086 10.012 1.00 0.00 H new ATOM 258 N SER A 26 18.187 -1.832 11.301 1.00 0.00 N ATOM 259 CA SER A 26 19.369 -2.074 12.120 1.00 0.00 C ATOM 260 C SER A 26 20.635 -2.038 11.270 1.00 0.00 C ATOM 261 O SER A 26 21.653 -1.476 11.676 1.00 0.00 O ATOM 262 CB SER A 26 19.255 -3.424 12.831 1.00 0.00 C ATOM 263 OG SER A 26 20.462 -3.752 13.497 1.00 0.00 O ATOM 0 H SER A 26 17.369 -2.378 11.570 1.00 0.00 H new ATOM 0 HA SER A 26 19.432 -1.283 12.867 1.00 0.00 H new ATOM 0 HB2 SER A 26 18.436 -3.392 13.550 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.013 -4.201 12.106 1.00 0.00 H new ATOM 0 HG SER A 26 20.364 -4.618 13.945 1.00 0.00 H new ATOM 269 N ARG A 27 20.565 -2.642 10.089 1.00 0.00 N ATOM 270 CA ARG A 27 21.705 -2.682 9.181 1.00 0.00 C ATOM 271 C ARG A 27 22.232 -1.276 8.909 1.00 0.00 C ATOM 272 O ARG A 27 23.396 -0.976 9.172 1.00 0.00 O ATOM 273 CB ARG A 27 21.313 -3.355 7.865 1.00 0.00 C ATOM 274 CG ARG A 27 21.131 -4.859 7.981 1.00 0.00 C ATOM 275 CD ARG A 27 20.872 -5.496 6.624 1.00 0.00 C ATOM 276 NE ARG A 27 21.383 -6.862 6.553 1.00 0.00 N ATOM 277 CZ ARG A 27 22.597 -7.170 6.110 1.00 0.00 C ATOM 278 NH1 ARG A 27 23.419 -6.214 5.700 1.00 0.00 N ATOM 279 NH2 ARG A 27 22.991 -8.436 6.076 1.00 0.00 N ATOM 0 H ARG A 27 19.730 -3.111 9.738 1.00 0.00 H new ATOM 0 HA ARG A 27 22.496 -3.263 9.656 1.00 0.00 H new ATOM 0 HB2 ARG A 27 20.385 -2.912 7.502 1.00 0.00 H new ATOM 0 HB3 ARG A 27 22.079 -3.147 7.118 1.00 0.00 H new ATOM 0 HG2 ARG A 27 22.022 -5.301 8.427 1.00 0.00 H new ATOM 0 HG3 ARG A 27 20.298 -5.075 8.650 1.00 0.00 H new ATOM 0 HD2 ARG A 27 19.801 -5.499 6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 27 21.340 -4.893 5.846 1.00 0.00 H new ATOM 0 HE ARG A 27 20.775 -7.621 6.860 1.00 0.00 H new ATOM 0 HH11 ARG A 27 23.120 -5.239 5.724 1.00 0.00 H new ATOM 0 HH12 ARG A 27 24.351 -6.453 5.360 1.00 0.00 H new ATOM 0 HH21 ARG A 27 22.362 -9.175 6.390 1.00 0.00 H new ATOM 0 HH22 ARG A 27 23.923 -8.671 5.736 1.00 0.00 H new ATOM 293 N TYR A 28 21.366 -0.418 8.380 1.00 0.00 N ATOM 294 CA TYR A 28 21.745 0.956 8.069 1.00 0.00 C ATOM 295 C TYR A 28 21.614 1.849 9.299 1.00 0.00 C ATOM 296 O TYR A 28 22.604 2.373 9.808 1.00 0.00 O ATOM 297 CB TYR A 28 20.876 1.502 6.934 1.00 0.00 C ATOM 298 CG TYR A 28 20.996 0.715 5.648 1.00 0.00 C ATOM 299 CD1 TYR A 28 20.415 -0.541 5.524 1.00 0.00 C ATOM 300 CD2 TYR A 28 21.689 1.228 4.559 1.00 0.00 C ATOM 301 CE1 TYR A 28 20.522 -1.264 4.351 1.00 0.00 C ATOM 302 CE2 TYR A 28 21.800 0.513 3.382 1.00 0.00 C ATOM 303 CZ TYR A 28 21.215 -0.733 3.283 1.00 0.00 C ATOM 304 OH TYR A 28 21.324 -1.448 2.113 1.00 0.00 O ATOM 0 H TYR A 28 20.398 -0.649 8.158 1.00 0.00 H new ATOM 0 HA TYR A 28 22.788 0.956 7.752 1.00 0.00 H new ATOM 0 HB2 TYR A 28 19.834 1.503 7.254 1.00 0.00 H new ATOM 0 HB3 TYR A 28 21.152 2.539 6.743 1.00 0.00 H new ATOM 0 HD1 TYR A 28 19.871 -0.959 6.358 1.00 0.00 H new ATOM 0 HD2 TYR A 28 22.149 2.202 4.634 1.00 0.00 H new ATOM 0 HE1 TYR A 28 20.065 -2.239 4.271 1.00 0.00 H new ATOM 0 HE2 TYR A 28 22.341 0.927 2.544 1.00 0.00 H new ATOM 0 HH TYR A 28 21.842 -0.931 1.461 1.00 0.00 H new ATOM 314 N GLY A 29 20.383 2.016 9.773 1.00 0.00 N ATOM 315 CA GLY A 29 20.144 2.845 10.940 1.00 0.00 C ATOM 316 C GLY A 29 18.710 2.763 11.425 1.00 0.00 C ATOM 317 O GLY A 29 17.989 1.822 11.095 1.00 0.00 O ATOM 0 H GLY A 29 19.547 1.592 9.370 1.00 0.00 H new ATOM 0 HA2 GLY A 29 20.814 2.538 11.743 1.00 0.00 H new ATOM 0 HA3 GLY A 29 20.385 3.881 10.702 1.00 0.00 H new ATOM 321 N ASP A 30 18.297 3.749 12.213 1.00 0.00 N ATOM 322 CA ASP A 30 16.940 3.784 12.746 1.00 0.00 C ATOM 323 C ASP A 30 16.003 4.527 11.799 1.00 0.00 C ATOM 324 O ASP A 30 14.888 4.076 11.533 1.00 0.00 O ATOM 325 CB ASP A 30 16.927 4.450 14.123 1.00 0.00 C ATOM 326 CG ASP A 30 17.790 3.716 15.130 1.00 0.00 C ATOM 327 OD1 ASP A 30 17.760 2.467 15.137 1.00 0.00 O ATOM 328 OD2 ASP A 30 18.494 4.389 15.911 1.00 0.00 O ATOM 0 H ASP A 30 18.882 4.535 12.497 1.00 0.00 H new ATOM 0 HA ASP A 30 16.588 2.757 12.844 1.00 0.00 H new ATOM 0 HB2 ASP A 30 17.278 5.478 14.029 1.00 0.00 H new ATOM 0 HB3 ASP A 30 15.902 4.495 14.492 1.00 0.00 H new ATOM 333 N CYS A 31 16.462 5.667 11.295 1.00 0.00 N ATOM 334 CA CYS A 31 15.664 6.474 10.379 1.00 0.00 C ATOM 335 C CYS A 31 15.174 5.636 9.202 1.00 0.00 C ATOM 336 O CYS A 31 15.969 5.161 8.390 1.00 0.00 O ATOM 337 CB CYS A 31 16.481 7.662 9.869 1.00 0.00 C ATOM 338 SG CYS A 31 17.991 7.197 8.991 1.00 0.00 S ATOM 0 H CYS A 31 17.382 6.053 11.505 1.00 0.00 H new ATOM 0 HA CYS A 31 14.796 6.846 10.923 1.00 0.00 H new ATOM 0 HB2 CYS A 31 15.857 8.260 9.205 1.00 0.00 H new ATOM 0 HB3 CYS A 31 16.746 8.297 10.715 1.00 0.00 H new ATOM 0 HG CYS A 31 17.764 6.142 8.266 1.00 0.00 H new ATOM 344 N HIS A 32 13.859 5.457 9.117 1.00 0.00 N ATOM 345 CA HIS A 32 13.262 4.675 8.040 1.00 0.00 C ATOM 346 C HIS A 32 11.751 4.879 7.994 1.00 0.00 C ATOM 347 O HIS A 32 11.118 5.237 8.987 1.00 0.00 O ATOM 348 CB HIS A 32 13.584 3.191 8.220 1.00 0.00 C ATOM 349 CG HIS A 32 12.593 2.464 9.076 1.00 0.00 C ATOM 350 ND1 HIS A 32 11.504 1.792 8.562 1.00 0.00 N ATOM 351 CD2 HIS A 32 12.533 2.303 10.419 1.00 0.00 C ATOM 352 CE1 HIS A 32 10.816 1.251 9.551 1.00 0.00 C ATOM 353 NE2 HIS A 32 11.419 1.547 10.689 1.00 0.00 N ATOM 0 H HIS A 32 13.187 5.843 9.781 1.00 0.00 H new ATOM 0 HA HIS A 32 13.686 5.019 7.096 1.00 0.00 H new ATOM 0 HB2 HIS A 32 13.624 2.715 7.240 1.00 0.00 H new ATOM 0 HB3 HIS A 32 14.575 3.094 8.663 1.00 0.00 H new ATOM 0 HD1 HIS A 32 11.267 1.723 7.572 1.00 0.00 H new ATOM 0 HD2 HIS A 32 13.231 2.696 11.143 1.00 0.00 H new ATOM 0 HE1 HIS A 32 9.914 0.666 9.447 1.00 0.00 H new ATOM 361 N PRO A 33 11.158 4.645 6.814 1.00 0.00 N ATOM 362 CA PRO A 33 9.714 4.797 6.610 1.00 0.00 C ATOM 363 C PRO A 33 8.910 3.724 7.337 1.00 0.00 C ATOM 364 O PRO A 33 9.174 2.531 7.191 1.00 0.00 O ATOM 365 CB PRO A 33 9.552 4.651 5.095 1.00 0.00 C ATOM 366 CG PRO A 33 10.724 3.838 4.665 1.00 0.00 C ATOM 367 CD PRO A 33 11.851 4.215 5.587 1.00 0.00 C ATOM 0 HA PRO A 33 9.345 5.744 7.003 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.614 4.157 4.843 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.543 5.623 4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 33 10.505 2.772 4.732 1.00 0.00 H new ATOM 0 HG3 PRO A 33 10.983 4.046 3.627 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.516 3.372 5.775 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.462 5.015 5.169 1.00 0.00 H new ATOM 375 N VAL A 34 7.928 4.157 8.121 1.00 0.00 N ATOM 376 CA VAL A 34 7.084 3.234 8.870 1.00 0.00 C ATOM 377 C VAL A 34 6.372 2.260 7.937 1.00 0.00 C ATOM 378 O VAL A 34 5.536 2.659 7.127 1.00 0.00 O ATOM 379 CB VAL A 34 6.033 3.987 9.707 1.00 0.00 C ATOM 380 CG1 VAL A 34 5.351 5.058 8.870 1.00 0.00 C ATOM 381 CG2 VAL A 34 5.013 3.015 10.280 1.00 0.00 C ATOM 0 H VAL A 34 7.697 5.142 8.254 1.00 0.00 H new ATOM 0 HA VAL A 34 7.740 2.678 9.540 1.00 0.00 H new ATOM 0 HB VAL A 34 6.539 4.478 10.538 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.612 5.579 9.478 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.095 5.770 8.514 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.856 4.593 8.017 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.278 3.564 10.869 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.510 2.494 9.466 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.519 2.290 10.917 1.00 0.00 H new ATOM 391 N PHE A 35 6.709 0.980 8.058 1.00 0.00 N ATOM 392 CA PHE A 35 6.102 -0.051 7.225 1.00 0.00 C ATOM 393 C PHE A 35 4.826 -0.588 7.867 1.00 0.00 C ATOM 394 O PHE A 35 4.827 -0.999 9.028 1.00 0.00 O ATOM 395 CB PHE A 35 7.090 -1.196 6.993 1.00 0.00 C ATOM 396 CG PHE A 35 8.267 -0.810 6.144 1.00 0.00 C ATOM 397 CD1 PHE A 35 8.104 -0.532 4.796 1.00 0.00 C ATOM 398 CD2 PHE A 35 9.536 -0.725 6.692 1.00 0.00 C ATOM 399 CE1 PHE A 35 9.185 -0.177 4.012 1.00 0.00 C ATOM 400 CE2 PHE A 35 10.622 -0.370 5.913 1.00 0.00 C ATOM 401 CZ PHE A 35 10.445 -0.095 4.571 1.00 0.00 C ATOM 0 H PHE A 35 7.399 0.632 8.724 1.00 0.00 H new ATOM 0 HA PHE A 35 5.844 0.398 6.266 1.00 0.00 H new ATOM 0 HB2 PHE A 35 7.450 -1.555 7.957 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.567 -2.026 6.519 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.121 -0.594 4.353 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.679 -0.939 7.741 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.045 0.036 2.963 1.00 0.00 H new ATOM 0 HE2 PHE A 35 11.606 -0.308 6.353 1.00 0.00 H new ATOM 0 HZ PHE A 35 11.291 0.184 3.960 1.00 0.00 H new ATOM 411 N PHE A 36 3.738 -0.580 7.104 1.00 0.00 N ATOM 412 CA PHE A 36 2.454 -1.064 7.597 1.00 0.00 C ATOM 413 C PHE A 36 2.518 -2.557 7.906 1.00 0.00 C ATOM 414 O PHE A 36 2.568 -3.388 6.998 1.00 0.00 O ATOM 415 CB PHE A 36 1.353 -0.791 6.571 1.00 0.00 C ATOM 416 CG PHE A 36 -0.019 -1.169 7.049 1.00 0.00 C ATOM 417 CD1 PHE A 36 -0.365 -2.500 7.223 1.00 0.00 C ATOM 418 CD2 PHE A 36 -0.965 -0.194 7.324 1.00 0.00 C ATOM 419 CE1 PHE A 36 -1.627 -2.851 7.663 1.00 0.00 C ATOM 420 CE2 PHE A 36 -2.228 -0.540 7.765 1.00 0.00 C ATOM 421 CZ PHE A 36 -2.560 -1.870 7.934 1.00 0.00 C ATOM 0 H PHE A 36 3.720 -0.243 6.141 1.00 0.00 H new ATOM 0 HA PHE A 36 2.222 -0.529 8.518 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.361 0.268 6.315 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.575 -1.341 5.657 1.00 0.00 H new ATOM 0 HD1 PHE A 36 0.360 -3.272 7.012 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -0.712 0.848 7.192 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -1.883 -3.892 7.795 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.955 0.229 7.978 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.547 -2.142 8.277 1.00 0.00 H new ATOM 431 N ILE A 37 2.517 -2.890 9.192 1.00 0.00 N ATOM 432 CA ILE A 37 2.574 -4.282 9.621 1.00 0.00 C ATOM 433 C ILE A 37 1.302 -5.029 9.235 1.00 0.00 C ATOM 434 O ILE A 37 0.255 -4.856 9.859 1.00 0.00 O ATOM 435 CB ILE A 37 2.781 -4.394 11.143 1.00 0.00 C ATOM 436 CG1 ILE A 37 4.075 -3.691 11.557 1.00 0.00 C ATOM 437 CG2 ILE A 37 2.806 -5.855 11.568 1.00 0.00 C ATOM 438 CD1 ILE A 37 5.267 -4.068 10.706 1.00 0.00 C ATOM 0 H ILE A 37 2.477 -2.215 9.955 1.00 0.00 H new ATOM 0 HA ILE A 37 3.426 -4.734 9.113 1.00 0.00 H new ATOM 0 HB ILE A 37 1.947 -3.904 11.645 1.00 0.00 H new ATOM 0 HG12 ILE A 37 3.926 -2.613 11.502 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.292 -3.930 12.598 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.953 -5.918 12.646 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.860 -6.327 11.303 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.623 -6.368 11.060 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.149 -3.532 11.057 1.00 0.00 H new ATOM 0 HD12 ILE A 37 5.442 -5.141 10.780 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.071 -3.803 9.667 1.00 0.00 H new ATOM 450 N GLY A 38 1.400 -5.861 8.203 1.00 0.00 N ATOM 451 CA GLY A 38 0.251 -6.623 7.753 1.00 0.00 C ATOM 452 C GLY A 38 0.409 -7.126 6.331 1.00 0.00 C ATOM 453 O GLY A 38 1.516 -7.152 5.795 1.00 0.00 O ATOM 0 H GLY A 38 2.255 -6.021 7.671 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.098 -7.471 8.420 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -0.642 -6.001 7.818 1.00 0.00 H new ATOM 457 N SER A 39 -0.701 -7.528 5.721 1.00 0.00 N ATOM 458 CA SER A 39 -0.680 -8.038 4.355 1.00 0.00 C ATOM 459 C SER A 39 -1.157 -6.974 3.370 1.00 0.00 C ATOM 460 O SER A 39 -1.927 -6.082 3.727 1.00 0.00 O ATOM 461 CB SER A 39 -1.558 -9.286 4.240 1.00 0.00 C ATOM 462 OG SER A 39 -2.895 -9.004 4.616 1.00 0.00 O ATOM 0 H SER A 39 -1.626 -7.511 6.151 1.00 0.00 H new ATOM 0 HA SER A 39 0.348 -8.302 4.108 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.535 -9.657 3.215 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.157 -10.076 4.875 1.00 0.00 H new ATOM 0 HG SER A 39 -3.437 -9.816 4.532 1.00 0.00 H new ATOM 468 N LEU A 40 -0.693 -7.076 2.129 1.00 0.00 N ATOM 469 CA LEU A 40 -1.071 -6.123 1.091 1.00 0.00 C ATOM 470 C LEU A 40 -2.555 -5.780 1.181 1.00 0.00 C ATOM 471 O LEU A 40 -2.946 -4.627 1.006 1.00 0.00 O ATOM 472 CB LEU A 40 -0.750 -6.692 -0.292 1.00 0.00 C ATOM 473 CG LEU A 40 -0.794 -5.698 -1.453 1.00 0.00 C ATOM 474 CD1 LEU A 40 0.270 -4.626 -1.279 1.00 0.00 C ATOM 475 CD2 LEU A 40 -0.613 -6.420 -2.780 1.00 0.00 C ATOM 0 H LEU A 40 -0.055 -7.808 1.817 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.496 -5.210 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.245 -7.137 -0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.453 -7.498 -0.503 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.771 -5.214 -1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.223 -3.928 -2.115 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.096 -4.088 -0.347 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.255 -5.092 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.647 -5.697 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.350 -6.931 -2.788 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.412 -7.150 -2.909 1.00 0.00 H new ATOM 487 N GLU A 41 -3.375 -6.790 1.455 1.00 0.00 N ATOM 488 CA GLU A 41 -4.815 -6.594 1.569 1.00 0.00 C ATOM 489 C GLU A 41 -5.140 -5.557 2.640 1.00 0.00 C ATOM 490 O GLU A 41 -6.034 -4.728 2.466 1.00 0.00 O ATOM 491 CB GLU A 41 -5.508 -7.918 1.900 1.00 0.00 C ATOM 492 CG GLU A 41 -5.297 -8.994 0.848 1.00 0.00 C ATOM 493 CD GLU A 41 -6.101 -8.743 -0.413 1.00 0.00 C ATOM 494 OE1 GLU A 41 -6.179 -7.574 -0.844 1.00 0.00 O ATOM 495 OE2 GLU A 41 -6.651 -9.717 -0.969 1.00 0.00 O ATOM 0 H GLU A 41 -3.067 -7.751 1.602 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.183 -6.229 0.610 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.139 -8.282 2.859 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.577 -7.740 2.016 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.238 -9.047 0.595 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.574 -9.963 1.264 1.00 0.00 H new ATOM 502 N ALA A 42 -4.408 -5.609 3.748 1.00 0.00 N ATOM 503 CA ALA A 42 -4.617 -4.674 4.846 1.00 0.00 C ATOM 504 C ALA A 42 -4.433 -3.233 4.382 1.00 0.00 C ATOM 505 O ALA A 42 -5.320 -2.398 4.555 1.00 0.00 O ATOM 506 CB ALA A 42 -3.667 -4.986 5.993 1.00 0.00 C ATOM 0 H ALA A 42 -3.665 -6.289 3.909 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.643 -4.787 5.197 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -3.834 -4.280 6.806 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.848 -6.000 6.350 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.637 -4.902 5.646 1.00 0.00 H new ATOM 512 N ALA A 43 -3.276 -2.948 3.795 1.00 0.00 N ATOM 513 CA ALA A 43 -2.977 -1.608 3.305 1.00 0.00 C ATOM 514 C ALA A 43 -4.187 -0.995 2.609 1.00 0.00 C ATOM 515 O ALA A 43 -4.523 0.167 2.835 1.00 0.00 O ATOM 516 CB ALA A 43 -1.785 -1.645 2.360 1.00 0.00 C ATOM 0 H ALA A 43 -2.530 -3.627 3.647 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.728 -0.982 4.162 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.573 -0.638 2.002 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.914 -2.033 2.888 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.013 -2.291 1.512 1.00 0.00 H new ATOM 522 N PHE A 44 -4.838 -1.784 1.760 1.00 0.00 N ATOM 523 CA PHE A 44 -6.010 -1.318 1.029 1.00 0.00 C ATOM 524 C PHE A 44 -7.096 -0.841 1.989 1.00 0.00 C ATOM 525 O PHE A 44 -7.812 0.119 1.704 1.00 0.00 O ATOM 526 CB PHE A 44 -6.558 -2.434 0.137 1.00 0.00 C ATOM 527 CG PHE A 44 -5.701 -2.716 -1.064 1.00 0.00 C ATOM 528 CD1 PHE A 44 -5.269 -1.685 -1.882 1.00 0.00 C ATOM 529 CD2 PHE A 44 -5.327 -4.014 -1.375 1.00 0.00 C ATOM 530 CE1 PHE A 44 -4.480 -1.941 -2.987 1.00 0.00 C ATOM 531 CE2 PHE A 44 -4.538 -4.276 -2.479 1.00 0.00 C ATOM 532 CZ PHE A 44 -4.115 -3.239 -3.287 1.00 0.00 C ATOM 0 H PHE A 44 -4.573 -2.749 1.562 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.707 -0.478 0.404 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -6.654 -3.346 0.727 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -7.560 -2.163 -0.197 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -5.552 -0.668 -1.653 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -5.656 -4.829 -0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -4.149 -1.127 -3.615 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -4.252 -5.292 -2.710 1.00 0.00 H new ATOM 0 HZ PHE A 44 -3.500 -3.442 -4.151 1.00 0.00 H new ATOM 542 N GLN A 45 -7.210 -1.518 3.127 1.00 0.00 N ATOM 543 CA GLN A 45 -8.209 -1.164 4.129 1.00 0.00 C ATOM 544 C GLN A 45 -7.908 0.201 4.739 1.00 0.00 C ATOM 545 O GLN A 45 -8.793 0.853 5.291 1.00 0.00 O ATOM 546 CB GLN A 45 -8.260 -2.227 5.227 1.00 0.00 C ATOM 547 CG GLN A 45 -8.841 -3.553 4.764 1.00 0.00 C ATOM 548 CD GLN A 45 -10.342 -3.633 4.962 1.00 0.00 C ATOM 549 OE1 GLN A 45 -11.081 -4.001 4.048 1.00 0.00 O ATOM 550 NE2 GLN A 45 -10.801 -3.289 6.159 1.00 0.00 N ATOM 0 H GLN A 45 -6.624 -2.314 3.378 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.180 -1.115 3.636 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.252 -2.394 5.606 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.855 -1.850 6.059 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.609 -3.698 3.709 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.362 -4.366 5.310 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -10.152 -2.990 6.887 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -11.802 -3.324 6.351 1.00 0.00 H new ATOM 559 N GLU A 46 -6.652 0.625 4.637 1.00 0.00 N ATOM 560 CA GLU A 46 -6.235 1.912 5.181 1.00 0.00 C ATOM 561 C GLU A 46 -5.777 2.850 4.068 1.00 0.00 C ATOM 562 O GLU A 46 -5.265 3.938 4.330 1.00 0.00 O ATOM 563 CB GLU A 46 -5.107 1.720 6.197 1.00 0.00 C ATOM 564 CG GLU A 46 -4.923 2.903 7.133 1.00 0.00 C ATOM 565 CD GLU A 46 -5.738 2.773 8.405 1.00 0.00 C ATOM 566 OE1 GLU A 46 -6.937 2.436 8.308 1.00 0.00 O ATOM 567 OE2 GLU A 46 -5.179 3.009 9.496 1.00 0.00 O ATOM 0 H GLU A 46 -5.907 0.097 4.183 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.093 2.361 5.682 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.310 0.827 6.789 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.174 1.542 5.662 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.868 2.997 7.390 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.208 3.819 6.615 1.00 0.00 H new ATOM 574 N ALA A 47 -5.965 2.420 2.825 1.00 0.00 N ATOM 575 CA ALA A 47 -5.572 3.221 1.672 1.00 0.00 C ATOM 576 C ALA A 47 -6.760 3.998 1.113 1.00 0.00 C ATOM 577 O ALA A 47 -6.741 5.228 1.063 1.00 0.00 O ATOM 578 CB ALA A 47 -4.966 2.334 0.594 1.00 0.00 C ATOM 0 H ALA A 47 -6.387 1.522 2.590 1.00 0.00 H new ATOM 0 HA ALA A 47 -4.821 3.940 2.000 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.677 2.946 -0.261 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.086 1.828 0.991 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -5.700 1.592 0.278 1.00 0.00 H new ATOM 584 N PHE A 48 -7.792 3.272 0.695 1.00 0.00 N ATOM 585 CA PHE A 48 -8.988 3.894 0.138 1.00 0.00 C ATOM 586 C PHE A 48 -10.204 3.617 1.018 1.00 0.00 C ATOM 587 O PHE A 48 -11.079 4.469 1.171 1.00 0.00 O ATOM 588 CB PHE A 48 -9.243 3.380 -1.280 1.00 0.00 C ATOM 589 CG PHE A 48 -8.014 3.369 -2.143 1.00 0.00 C ATOM 590 CD1 PHE A 48 -7.651 4.492 -2.869 1.00 0.00 C ATOM 591 CD2 PHE A 48 -7.221 2.236 -2.229 1.00 0.00 C ATOM 592 CE1 PHE A 48 -6.521 4.484 -3.665 1.00 0.00 C ATOM 593 CE2 PHE A 48 -6.090 2.222 -3.023 1.00 0.00 C ATOM 594 CZ PHE A 48 -5.739 3.348 -3.741 1.00 0.00 C ATOM 0 H PHE A 48 -7.824 2.253 0.731 1.00 0.00 H new ATOM 0 HA PHE A 48 -8.824 4.971 0.102 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -9.647 2.369 -1.224 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.003 4.002 -1.752 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.258 5.384 -2.812 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.490 1.353 -1.669 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -6.250 5.365 -4.227 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -5.482 1.332 -3.082 1.00 0.00 H new ATOM 0 HZ PHE A 48 -4.855 3.340 -4.361 1.00 0.00 H new ATOM 604 N TYR A 49 -10.250 2.421 1.593 1.00 0.00 N ATOM 605 CA TYR A 49 -11.360 2.030 2.455 1.00 0.00 C ATOM 606 C TYR A 49 -11.616 3.085 3.526 1.00 0.00 C ATOM 607 O TYR A 49 -12.735 3.228 4.018 1.00 0.00 O ATOM 608 CB TYR A 49 -11.070 0.679 3.112 1.00 0.00 C ATOM 609 CG TYR A 49 -11.283 -0.501 2.191 1.00 0.00 C ATOM 610 CD1 TYR A 49 -10.935 -0.430 0.848 1.00 0.00 C ATOM 611 CD2 TYR A 49 -11.830 -1.687 2.665 1.00 0.00 C ATOM 612 CE1 TYR A 49 -11.128 -1.506 0.003 1.00 0.00 C ATOM 613 CE2 TYR A 49 -12.025 -2.768 1.828 1.00 0.00 C ATOM 614 CZ TYR A 49 -11.673 -2.672 0.497 1.00 0.00 C ATOM 615 OH TYR A 49 -11.866 -3.747 -0.341 1.00 0.00 O ATOM 0 H TYR A 49 -9.532 1.705 1.478 1.00 0.00 H new ATOM 0 HA TYR A 49 -12.254 1.942 1.837 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -10.039 0.671 3.467 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -11.709 0.566 3.988 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -10.506 0.481 0.458 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -12.107 -1.765 3.706 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -10.853 -1.434 -1.039 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -12.450 -3.683 2.213 1.00 0.00 H new ATOM 0 HH TYR A 49 -12.258 -4.490 0.165 1.00 0.00 H new ATOM 625 N VAL A 50 -10.570 3.824 3.882 1.00 0.00 N ATOM 626 CA VAL A 50 -10.680 4.869 4.893 1.00 0.00 C ATOM 627 C VAL A 50 -11.652 5.958 4.454 1.00 0.00 C ATOM 628 O VAL A 50 -12.200 5.910 3.353 1.00 0.00 O ATOM 629 CB VAL A 50 -9.310 5.508 5.191 1.00 0.00 C ATOM 630 CG1 VAL A 50 -8.391 4.508 5.875 1.00 0.00 C ATOM 631 CG2 VAL A 50 -8.679 6.035 3.911 1.00 0.00 C ATOM 0 H VAL A 50 -9.636 3.718 3.485 1.00 0.00 H new ATOM 0 HA VAL A 50 -11.056 4.394 5.799 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.460 6.349 5.868 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -7.428 4.978 6.077 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.841 4.183 6.813 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -8.244 3.645 5.225 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -7.712 6.483 4.140 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -8.541 5.213 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -9.331 6.787 3.467 1.00 0.00 H new ATOM 641 N LYS A 51 -11.863 6.940 5.324 1.00 0.00 N ATOM 642 CA LYS A 51 -12.768 8.044 5.027 1.00 0.00 C ATOM 643 C LYS A 51 -12.281 8.838 3.820 1.00 0.00 C ATOM 644 O LYS A 51 -11.112 8.759 3.444 1.00 0.00 O ATOM 645 CB LYS A 51 -12.895 8.967 6.241 1.00 0.00 C ATOM 646 CG LYS A 51 -13.284 8.243 7.518 1.00 0.00 C ATOM 647 CD LYS A 51 -14.780 7.986 7.580 1.00 0.00 C ATOM 648 CE LYS A 51 -15.138 6.632 6.987 1.00 0.00 C ATOM 649 NZ LYS A 51 -15.130 5.556 8.016 1.00 0.00 N ATOM 0 H LYS A 51 -11.419 6.994 6.241 1.00 0.00 H new ATOM 0 HA LYS A 51 -13.747 7.625 4.793 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -11.946 9.479 6.398 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -13.639 9.734 6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -12.748 7.296 7.578 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -12.980 8.836 8.381 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -15.115 8.031 8.616 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -15.308 8.772 7.040 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -16.124 6.687 6.526 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -14.430 6.383 6.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -15.379 4.649 7.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -14.182 5.486 8.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -15.824 5.780 8.758 1.00 0.00 H new ATOM 663 N ALA A 52 -13.184 9.605 3.217 1.00 0.00 N ATOM 664 CA ALA A 52 -12.844 10.416 2.055 1.00 0.00 C ATOM 665 C ALA A 52 -11.723 11.398 2.379 1.00 0.00 C ATOM 666 O ALA A 52 -10.899 11.717 1.523 1.00 0.00 O ATOM 667 CB ALA A 52 -14.073 11.161 1.554 1.00 0.00 C ATOM 0 H ALA A 52 -14.157 9.681 3.515 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.491 9.749 1.268 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.805 11.763 0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -14.844 10.444 1.274 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -14.451 11.811 2.343 1.00 0.00 H new ATOM 673 N ARG A 53 -11.700 11.873 3.620 1.00 0.00 N ATOM 674 CA ARG A 53 -10.681 12.820 4.057 1.00 0.00 C ATOM 675 C ARG A 53 -9.393 12.096 4.436 1.00 0.00 C ATOM 676 O ARG A 53 -8.294 12.614 4.233 1.00 0.00 O ATOM 677 CB ARG A 53 -11.189 13.636 5.246 1.00 0.00 C ATOM 678 CG ARG A 53 -10.617 15.043 5.308 1.00 0.00 C ATOM 679 CD ARG A 53 -9.263 15.064 5.999 1.00 0.00 C ATOM 680 NE ARG A 53 -8.162 14.912 5.050 1.00 0.00 N ATOM 681 CZ ARG A 53 -6.881 14.996 5.392 1.00 0.00 C ATOM 682 NH1 ARG A 53 -6.541 15.228 6.652 1.00 0.00 N ATOM 683 NH2 ARG A 53 -5.937 14.847 4.471 1.00 0.00 N ATOM 0 H ARG A 53 -12.375 11.618 4.341 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.468 13.494 3.227 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -12.276 13.697 5.196 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.941 13.111 6.169 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.518 15.441 4.298 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.309 15.695 5.841 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.147 16.002 6.541 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -9.220 14.262 6.736 1.00 0.00 H new ATOM 0 HE ARG A 53 -8.389 14.732 4.072 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.264 15.343 7.362 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -5.557 15.292 6.911 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -6.195 14.668 3.501 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -4.954 14.912 4.734 1.00 0.00 H new ATOM 697 N ASP A 54 -9.535 10.896 4.988 1.00 0.00 N ATOM 698 CA ASP A 54 -8.383 10.100 5.396 1.00 0.00 C ATOM 699 C ASP A 54 -7.849 9.279 4.227 1.00 0.00 C ATOM 700 O ASP A 54 -6.881 8.531 4.371 1.00 0.00 O ATOM 701 CB ASP A 54 -8.759 9.175 6.555 1.00 0.00 C ATOM 702 CG ASP A 54 -8.909 9.922 7.866 1.00 0.00 C ATOM 703 OD1 ASP A 54 -7.884 10.137 8.546 1.00 0.00 O ATOM 704 OD2 ASP A 54 -10.051 10.289 8.213 1.00 0.00 O ATOM 0 H ASP A 54 -10.437 10.453 5.163 1.00 0.00 H new ATOM 0 HA ASP A 54 -7.600 10.782 5.726 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -9.694 8.666 6.321 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -7.995 8.405 6.664 1.00 0.00 H new ATOM 709 N ARG A 55 -8.485 9.423 3.069 1.00 0.00 N ATOM 710 CA ARG A 55 -8.075 8.693 1.876 1.00 0.00 C ATOM 711 C ARG A 55 -6.590 8.901 1.594 1.00 0.00 C ATOM 712 O ARG A 55 -6.038 9.967 1.869 1.00 0.00 O ATOM 713 CB ARG A 55 -8.901 9.142 0.669 1.00 0.00 C ATOM 714 CG ARG A 55 -10.137 8.290 0.426 1.00 0.00 C ATOM 715 CD ARG A 55 -10.663 8.463 -0.990 1.00 0.00 C ATOM 716 NE ARG A 55 -12.066 8.074 -1.104 1.00 0.00 N ATOM 717 CZ ARG A 55 -12.626 7.667 -2.238 1.00 0.00 C ATOM 718 NH1 ARG A 55 -11.906 7.596 -3.349 1.00 0.00 N ATOM 719 NH2 ARG A 55 -13.909 7.329 -2.262 1.00 0.00 N ATOM 0 H ARG A 55 -9.286 10.039 2.932 1.00 0.00 H new ATOM 0 HA ARG A 55 -8.248 7.632 2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -9.207 10.178 0.814 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -8.272 9.117 -0.221 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -9.897 7.241 0.601 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -10.914 8.563 1.140 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -10.549 9.503 -1.294 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -10.064 7.863 -1.675 1.00 0.00 H new ATOM 0 HE ARG A 55 -12.648 8.117 -0.267 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -10.919 7.854 -3.335 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -12.339 7.283 -4.218 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.466 7.382 -1.409 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.338 7.017 -3.133 1.00 0.00 H new ATOM 733 N LYS A 56 -5.948 7.875 1.046 1.00 0.00 N ATOM 734 CA LYS A 56 -4.527 7.944 0.726 1.00 0.00 C ATOM 735 C LYS A 56 -4.195 7.062 -0.473 1.00 0.00 C ATOM 736 O LYS A 56 -5.067 6.380 -1.014 1.00 0.00 O ATOM 737 CB LYS A 56 -3.690 7.517 1.934 1.00 0.00 C ATOM 738 CG LYS A 56 -3.826 8.446 3.128 1.00 0.00 C ATOM 739 CD LYS A 56 -2.649 8.308 4.079 1.00 0.00 C ATOM 740 CE LYS A 56 -2.916 7.262 5.150 1.00 0.00 C ATOM 741 NZ LYS A 56 -3.970 7.703 6.105 1.00 0.00 N ATOM 0 H LYS A 56 -6.389 6.985 0.814 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.287 8.977 0.472 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.985 6.511 2.232 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.642 7.468 1.640 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -3.896 9.477 2.782 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -4.752 8.224 3.659 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.756 8.035 3.517 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.447 9.270 4.551 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.221 6.328 4.678 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.995 7.057 5.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.862 7.189 7.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -3.877 8.724 6.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.908 7.504 5.703 1.00 0.00 H new ATOM 755 N LEU A 57 -2.932 7.078 -0.882 1.00 0.00 N ATOM 756 CA LEU A 57 -2.485 6.278 -2.017 1.00 0.00 C ATOM 757 C LEU A 57 -1.554 5.159 -1.561 1.00 0.00 C ATOM 758 O LEU A 57 -1.008 5.201 -0.458 1.00 0.00 O ATOM 759 CB LEU A 57 -1.773 7.163 -3.042 1.00 0.00 C ATOM 760 CG LEU A 57 -2.606 8.293 -3.647 1.00 0.00 C ATOM 761 CD1 LEU A 57 -1.740 9.186 -4.522 1.00 0.00 C ATOM 762 CD2 LEU A 57 -3.771 7.728 -4.446 1.00 0.00 C ATOM 0 H LEU A 57 -2.199 7.636 -0.445 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.363 5.829 -2.482 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.895 7.600 -2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.414 6.529 -3.853 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.008 8.897 -2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.351 9.984 -4.944 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.941 9.619 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.307 8.595 -5.329 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.353 8.547 -4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.389 7.100 -5.251 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.406 7.132 -3.791 1.00 0.00 H new ATOM 774 N LEU A 58 -1.376 4.159 -2.418 1.00 0.00 N ATOM 775 CA LEU A 58 -0.509 3.028 -2.104 1.00 0.00 C ATOM 776 C LEU A 58 0.679 2.972 -3.059 1.00 0.00 C ATOM 777 O LEU A 58 0.568 3.346 -4.226 1.00 0.00 O ATOM 778 CB LEU A 58 -1.298 1.720 -2.176 1.00 0.00 C ATOM 779 CG LEU A 58 -0.573 0.470 -1.677 1.00 0.00 C ATOM 780 CD1 LEU A 58 -0.288 0.577 -0.187 1.00 0.00 C ATOM 781 CD2 LEU A 58 -1.391 -0.777 -1.977 1.00 0.00 C ATOM 0 H LEU A 58 -1.820 4.108 -3.335 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.131 3.161 -1.090 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.214 1.839 -1.598 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.594 1.554 -3.212 1.00 0.00 H new ATOM 0 HG LEU A 58 0.378 0.391 -2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.228 -0.322 0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.339 1.448 0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.227 0.681 0.356 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.859 -1.657 -1.615 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.358 -0.707 -1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.543 -0.862 -3.053 1.00 0.00 H new ATOM 793 N ALA A 59 1.814 2.500 -2.555 1.00 0.00 N ATOM 794 CA ALA A 59 3.022 2.390 -3.365 1.00 0.00 C ATOM 795 C ALA A 59 3.863 1.192 -2.937 1.00 0.00 C ATOM 796 O ALA A 59 4.464 1.197 -1.862 1.00 0.00 O ATOM 797 CB ALA A 59 3.838 3.671 -3.271 1.00 0.00 C ATOM 0 H ALA A 59 1.923 2.188 -1.590 1.00 0.00 H new ATOM 0 HA ALA A 59 2.722 2.238 -4.402 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.737 3.575 -3.880 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.242 4.509 -3.632 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.120 3.847 -2.233 1.00 0.00 H new ATOM 803 N ILE A 60 3.900 0.169 -3.783 1.00 0.00 N ATOM 804 CA ILE A 60 4.668 -1.035 -3.491 1.00 0.00 C ATOM 805 C ILE A 60 6.135 -0.857 -3.868 1.00 0.00 C ATOM 806 O ILE A 60 6.457 -0.509 -5.004 1.00 0.00 O ATOM 807 CB ILE A 60 4.103 -2.258 -4.238 1.00 0.00 C ATOM 808 CG1 ILE A 60 2.655 -2.516 -3.816 1.00 0.00 C ATOM 809 CG2 ILE A 60 4.964 -3.484 -3.974 1.00 0.00 C ATOM 810 CD1 ILE A 60 1.637 -1.828 -4.698 1.00 0.00 C ATOM 0 H ILE A 60 3.407 0.149 -4.676 1.00 0.00 H new ATOM 0 HA ILE A 60 4.589 -1.206 -2.417 1.00 0.00 H new ATOM 0 HB ILE A 60 4.119 -2.051 -5.308 1.00 0.00 H new ATOM 0 HG12 ILE A 60 2.467 -3.590 -3.828 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.519 -2.180 -2.788 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.552 -4.340 -4.509 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.981 -3.296 -4.319 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.977 -3.696 -2.905 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.633 -2.055 -4.340 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.798 -0.750 -4.667 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.745 -2.182 -5.723 1.00 0.00 H new ATOM 822 N TYR A 61 7.020 -1.099 -2.907 1.00 0.00 N ATOM 823 CA TYR A 61 8.453 -0.964 -3.138 1.00 0.00 C ATOM 824 C TYR A 61 9.130 -2.331 -3.175 1.00 0.00 C ATOM 825 O TYR A 61 9.319 -2.972 -2.140 1.00 0.00 O ATOM 826 CB TYR A 61 9.087 -0.098 -2.047 1.00 0.00 C ATOM 827 CG TYR A 61 10.591 -0.233 -1.965 1.00 0.00 C ATOM 828 CD1 TYR A 61 11.178 -1.206 -1.165 1.00 0.00 C ATOM 829 CD2 TYR A 61 11.425 0.613 -2.686 1.00 0.00 C ATOM 830 CE1 TYR A 61 12.551 -1.333 -1.086 1.00 0.00 C ATOM 831 CE2 TYR A 61 12.799 0.493 -2.614 1.00 0.00 C ATOM 832 CZ TYR A 61 13.357 -0.481 -1.812 1.00 0.00 C ATOM 833 OH TYR A 61 14.726 -0.604 -1.737 1.00 0.00 O ATOM 0 H TYR A 61 6.770 -1.389 -1.962 1.00 0.00 H new ATOM 0 HA TYR A 61 8.596 -0.482 -4.105 1.00 0.00 H new ATOM 0 HB2 TYR A 61 8.834 0.946 -2.231 1.00 0.00 H new ATOM 0 HB3 TYR A 61 8.653 -0.367 -1.084 1.00 0.00 H new ATOM 0 HD1 TYR A 61 10.550 -1.874 -0.595 1.00 0.00 H new ATOM 0 HD2 TYR A 61 10.991 1.378 -3.313 1.00 0.00 H new ATOM 0 HE1 TYR A 61 12.991 -2.095 -0.460 1.00 0.00 H new ATOM 0 HE2 TYR A 61 13.433 1.158 -3.182 1.00 0.00 H new ATOM 0 HH TYR A 61 15.147 0.071 -2.309 1.00 0.00 H new ATOM 843 N LEU A 62 9.494 -2.771 -4.374 1.00 0.00 N ATOM 844 CA LEU A 62 10.150 -4.062 -4.548 1.00 0.00 C ATOM 845 C LEU A 62 11.621 -3.983 -4.151 1.00 0.00 C ATOM 846 O LEU A 62 12.402 -3.254 -4.764 1.00 0.00 O ATOM 847 CB LEU A 62 10.027 -4.527 -6.000 1.00 0.00 C ATOM 848 CG LEU A 62 8.604 -4.648 -6.548 1.00 0.00 C ATOM 849 CD1 LEU A 62 8.629 -5.038 -8.017 1.00 0.00 C ATOM 850 CD2 LEU A 62 7.806 -5.660 -5.739 1.00 0.00 C ATOM 0 H LEU A 62 9.346 -2.253 -5.240 1.00 0.00 H new ATOM 0 HA LEU A 62 9.655 -4.784 -3.898 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.580 -3.832 -6.631 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.514 -5.498 -6.092 1.00 0.00 H new ATOM 0 HG LEU A 62 8.117 -3.677 -6.460 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.608 -5.119 -8.389 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.163 -4.277 -8.586 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.134 -5.997 -8.130 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.796 -5.733 -6.143 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.291 -6.635 -5.795 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.758 -5.338 -4.699 1.00 0.00 H new ATOM 862 N HIS A 63 11.993 -4.738 -3.123 1.00 0.00 N ATOM 863 CA HIS A 63 13.371 -4.756 -2.646 1.00 0.00 C ATOM 864 C HIS A 63 14.184 -5.823 -3.372 1.00 0.00 C ATOM 865 O HIS A 63 13.728 -6.953 -3.549 1.00 0.00 O ATOM 866 CB HIS A 63 13.408 -5.009 -1.138 1.00 0.00 C ATOM 867 CG HIS A 63 14.780 -4.907 -0.547 1.00 0.00 C ATOM 868 ND1 HIS A 63 15.253 -3.766 0.065 1.00 0.00 N ATOM 869 CD2 HIS A 63 15.783 -5.814 -0.476 1.00 0.00 C ATOM 870 CE1 HIS A 63 16.488 -3.975 0.486 1.00 0.00 C ATOM 871 NE2 HIS A 63 16.833 -5.210 0.171 1.00 0.00 N ATOM 0 H HIS A 63 11.359 -5.346 -2.604 1.00 0.00 H new ATOM 0 HA HIS A 63 13.814 -3.782 -2.855 1.00 0.00 H new ATOM 0 HB2 HIS A 63 12.753 -4.293 -0.642 1.00 0.00 H new ATOM 0 HB3 HIS A 63 13.007 -6.002 -0.935 1.00 0.00 H new ATOM 0 HD2 HIS A 63 15.761 -6.824 -0.857 1.00 0.00 H new ATOM 0 HE1 HIS A 63 17.110 -3.257 1.001 1.00 0.00 H new ATOM 0 HE2 HIS A 63 17.733 -5.645 0.375 1.00 0.00 H new ATOM 879 N HIS A 64 15.391 -5.456 -3.792 1.00 0.00 N ATOM 880 CA HIS A 64 16.268 -6.382 -4.500 1.00 0.00 C ATOM 881 C HIS A 64 17.724 -6.162 -4.103 1.00 0.00 C ATOM 882 O HIS A 64 18.250 -5.056 -4.222 1.00 0.00 O ATOM 883 CB HIS A 64 16.108 -6.214 -6.012 1.00 0.00 C ATOM 884 CG HIS A 64 16.332 -7.479 -6.782 1.00 0.00 C ATOM 885 ND1 HIS A 64 15.508 -8.174 -7.601 1.00 0.00 N flip ATOM 886 CD2 HIS A 64 17.522 -8.175 -6.757 1.00 0.00 C flip ATOM 887 CE1 HIS A 64 16.209 -9.265 -8.052 1.00 0.00 C flip ATOM 888 NE2 HIS A 64 17.422 -9.242 -7.529 1.00 0.00 N flip ATOM 0 H HIS A 64 15.784 -4.525 -3.654 1.00 0.00 H new ATOM 0 HA HIS A 64 15.984 -7.397 -4.223 1.00 0.00 H new ATOM 0 HB2 HIS A 64 15.106 -5.842 -6.224 1.00 0.00 H new ATOM 0 HB3 HIS A 64 16.810 -5.457 -6.361 1.00 0.00 H new ATOM 0 HD1 HIS A 64 14.546 -7.932 -7.839 1.00 0.00 H new ATOM 0 HD2 HIS A 64 18.399 -7.892 -6.194 1.00 0.00 H new ATOM 0 HE1 HIS A 64 15.830 -10.020 -8.725 1.00 0.00 H new ATOM 896 N ASP A 65 18.370 -7.223 -3.631 1.00 0.00 N ATOM 897 CA ASP A 65 19.766 -7.146 -3.216 1.00 0.00 C ATOM 898 C ASP A 65 20.693 -7.134 -4.428 1.00 0.00 C ATOM 899 O ASP A 65 21.494 -6.216 -4.599 1.00 0.00 O ATOM 900 CB ASP A 65 20.115 -8.323 -2.304 1.00 0.00 C ATOM 901 CG ASP A 65 21.278 -8.015 -1.381 1.00 0.00 C ATOM 902 OD1 ASP A 65 21.323 -6.891 -0.839 1.00 0.00 O ATOM 903 OD2 ASP A 65 22.143 -8.898 -1.202 1.00 0.00 O ATOM 0 H ASP A 65 17.949 -8.146 -3.526 1.00 0.00 H new ATOM 0 HA ASP A 65 19.905 -6.216 -2.665 1.00 0.00 H new ATOM 0 HB2 ASP A 65 19.242 -8.588 -1.708 1.00 0.00 H new ATOM 0 HB3 ASP A 65 20.360 -9.192 -2.915 1.00 0.00 H new ATOM 908 N GLU A 66 20.578 -8.160 -5.265 1.00 0.00 N ATOM 909 CA GLU A 66 21.407 -8.268 -6.460 1.00 0.00 C ATOM 910 C GLU A 66 21.622 -6.898 -7.098 1.00 0.00 C ATOM 911 O GLU A 66 22.725 -6.574 -7.539 1.00 0.00 O ATOM 912 CB GLU A 66 20.763 -9.218 -7.471 1.00 0.00 C ATOM 913 CG GLU A 66 20.517 -10.614 -6.923 1.00 0.00 C ATOM 914 CD GLU A 66 20.479 -11.670 -8.011 1.00 0.00 C ATOM 915 OE1 GLU A 66 19.792 -11.446 -9.030 1.00 0.00 O ATOM 916 OE2 GLU A 66 21.135 -12.719 -7.844 1.00 0.00 O ATOM 0 H GLU A 66 19.919 -8.928 -5.138 1.00 0.00 H new ATOM 0 HA GLU A 66 22.376 -8.668 -6.163 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.815 -8.794 -7.802 1.00 0.00 H new ATOM 0 HB3 GLU A 66 21.404 -9.289 -8.349 1.00 0.00 H new ATOM 0 HG2 GLU A 66 21.301 -10.863 -6.208 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.573 -10.625 -6.378 1.00 0.00 H new ATOM 923 N SER A 67 20.561 -6.100 -7.142 1.00 0.00 N ATOM 924 CA SER A 67 20.631 -4.767 -7.730 1.00 0.00 C ATOM 925 C SER A 67 21.673 -3.912 -7.014 1.00 0.00 C ATOM 926 O SER A 67 21.984 -4.141 -5.845 1.00 0.00 O ATOM 927 CB SER A 67 19.263 -4.085 -7.665 1.00 0.00 C ATOM 928 OG SER A 67 19.316 -2.782 -8.219 1.00 0.00 O ATOM 0 H SER A 67 19.642 -6.353 -6.778 1.00 0.00 H new ATOM 0 HA SER A 67 20.927 -4.872 -8.774 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.529 -4.683 -8.205 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.930 -4.030 -6.629 1.00 0.00 H new ATOM 0 HG SER A 67 18.464 -2.579 -8.659 1.00 0.00 H new ATOM 934 N VAL A 68 22.209 -2.925 -7.725 1.00 0.00 N ATOM 935 CA VAL A 68 23.214 -2.034 -7.159 1.00 0.00 C ATOM 936 C VAL A 68 22.584 -0.737 -6.665 1.00 0.00 C ATOM 937 O VAL A 68 23.024 -0.159 -5.670 1.00 0.00 O ATOM 938 CB VAL A 68 24.311 -1.700 -8.188 1.00 0.00 C ATOM 939 CG1 VAL A 68 25.071 -2.955 -8.585 1.00 0.00 C ATOM 940 CG2 VAL A 68 23.706 -1.024 -9.409 1.00 0.00 C ATOM 0 H VAL A 68 21.964 -2.723 -8.694 1.00 0.00 H new ATOM 0 HA VAL A 68 23.664 -2.559 -6.316 1.00 0.00 H new ATOM 0 HB VAL A 68 25.017 -1.008 -7.729 1.00 0.00 H new ATOM 0 HG11 VAL A 68 25.841 -2.699 -9.312 1.00 0.00 H new ATOM 0 HG12 VAL A 68 25.537 -3.393 -7.702 1.00 0.00 H new ATOM 0 HG13 VAL A 68 24.381 -3.674 -9.026 1.00 0.00 H new ATOM 0 HG21 VAL A 68 24.494 -0.795 -10.126 1.00 0.00 H new ATOM 0 HG22 VAL A 68 22.978 -1.691 -9.871 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.211 -0.101 -9.106 1.00 0.00 H new ATOM 950 N LEU A 69 21.550 -0.284 -7.366 1.00 0.00 N ATOM 951 CA LEU A 69 20.857 0.946 -6.998 1.00 0.00 C ATOM 952 C LEU A 69 20.130 0.785 -5.667 1.00 0.00 C ATOM 953 O LEU A 69 20.013 1.734 -4.891 1.00 0.00 O ATOM 954 CB LEU A 69 19.861 1.340 -8.091 1.00 0.00 C ATOM 955 CG LEU A 69 20.468 1.838 -9.404 1.00 0.00 C ATOM 956 CD1 LEU A 69 19.427 1.823 -10.512 1.00 0.00 C ATOM 957 CD2 LEU A 69 21.043 3.236 -9.229 1.00 0.00 C ATOM 0 H LEU A 69 21.173 -0.750 -8.192 1.00 0.00 H new ATOM 0 HA LEU A 69 21.602 1.735 -6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 69 19.231 0.477 -8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 69 19.209 2.119 -7.697 1.00 0.00 H new ATOM 0 HG LEU A 69 21.279 1.166 -9.686 1.00 0.00 H new ATOM 0 HD11 LEU A 69 19.877 2.180 -11.438 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.062 0.806 -10.655 1.00 0.00 H new ATOM 0 HD13 LEU A 69 18.595 2.472 -10.238 1.00 0.00 H new ATOM 0 HD21 LEU A 69 21.471 3.574 -10.173 1.00 0.00 H new ATOM 0 HD22 LEU A 69 20.251 3.920 -8.924 1.00 0.00 H new ATOM 0 HD23 LEU A 69 21.820 3.217 -8.465 1.00 0.00 H new ATOM 969 N THR A 70 19.644 -0.425 -5.406 1.00 0.00 N ATOM 970 CA THR A 70 18.930 -0.711 -4.169 1.00 0.00 C ATOM 971 C THR A 70 19.770 -0.342 -2.951 1.00 0.00 C ATOM 972 O THR A 70 19.257 0.197 -1.972 1.00 0.00 O ATOM 973 CB THR A 70 18.539 -2.198 -4.077 1.00 0.00 C ATOM 974 OG1 THR A 70 17.658 -2.541 -5.153 1.00 0.00 O ATOM 975 CG2 THR A 70 17.865 -2.500 -2.747 1.00 0.00 C ATOM 0 H THR A 70 19.732 -1.222 -6.036 1.00 0.00 H new ATOM 0 HA THR A 70 18.024 -0.105 -4.180 1.00 0.00 H new ATOM 0 HB THR A 70 19.449 -2.794 -4.149 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.513 -3.510 -5.161 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.598 -3.556 -2.706 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.549 -2.266 -1.931 1.00 0.00 H new ATOM 0 HG23 THR A 70 16.964 -1.894 -2.650 1.00 0.00 H new ATOM 983 N ASN A 71 21.064 -0.636 -3.020 1.00 0.00 N ATOM 984 CA ASN A 71 21.976 -0.335 -1.922 1.00 0.00 C ATOM 985 C ASN A 71 21.815 1.111 -1.463 1.00 0.00 C ATOM 986 O ASN A 71 21.415 1.373 -0.328 1.00 0.00 O ATOM 987 CB ASN A 71 23.423 -0.588 -2.349 1.00 0.00 C ATOM 988 CG ASN A 71 24.400 -0.442 -1.198 1.00 0.00 C ATOM 989 OD1 ASN A 71 25.343 0.347 -1.266 1.00 0.00 O ATOM 990 ND2 ASN A 71 24.177 -1.204 -0.134 1.00 0.00 N ATOM 0 H ASN A 71 21.505 -1.082 -3.824 1.00 0.00 H new ATOM 0 HA ASN A 71 21.730 -0.992 -1.088 1.00 0.00 H new ATOM 0 HB2 ASN A 71 23.505 -1.591 -2.767 1.00 0.00 H new ATOM 0 HB3 ASN A 71 23.692 0.110 -3.141 1.00 0.00 H new ATOM 0 HD21 ASN A 71 24.800 -1.150 0.672 1.00 0.00 H new ATOM 0 HD22 ASN A 71 23.383 -1.844 -0.122 1.00 0.00 H new ATOM 997 N VAL A 72 22.129 2.047 -2.353 1.00 0.00 N ATOM 998 CA VAL A 72 22.018 3.467 -2.040 1.00 0.00 C ATOM 999 C VAL A 72 20.558 3.895 -1.942 1.00 0.00 C ATOM 1000 O VAL A 72 20.127 4.442 -0.926 1.00 0.00 O ATOM 1001 CB VAL A 72 22.725 4.332 -3.100 1.00 0.00 C ATOM 1002 CG1 VAL A 72 24.234 4.161 -3.010 1.00 0.00 C ATOM 1003 CG2 VAL A 72 22.223 3.984 -4.493 1.00 0.00 C ATOM 0 H VAL A 72 22.462 1.848 -3.296 1.00 0.00 H new ATOM 0 HA VAL A 72 22.504 3.618 -1.076 1.00 0.00 H new ATOM 0 HB VAL A 72 22.490 5.378 -2.905 1.00 0.00 H new ATOM 0 HG11 VAL A 72 24.716 4.780 -3.767 1.00 0.00 H new ATOM 0 HG12 VAL A 72 24.576 4.465 -2.021 1.00 0.00 H new ATOM 0 HG13 VAL A 72 24.492 3.115 -3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.733 4.605 -5.229 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.426 2.933 -4.701 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.149 4.164 -4.548 1.00 0.00 H new ATOM 1013 N PHE A 73 19.800 3.643 -3.004 1.00 0.00 N ATOM 1014 CA PHE A 73 18.387 4.003 -3.038 1.00 0.00 C ATOM 1015 C PHE A 73 17.689 3.586 -1.747 1.00 0.00 C ATOM 1016 O PHE A 73 16.625 4.106 -1.409 1.00 0.00 O ATOM 1017 CB PHE A 73 17.701 3.346 -4.237 1.00 0.00 C ATOM 1018 CG PHE A 73 16.248 3.704 -4.366 1.00 0.00 C ATOM 1019 CD1 PHE A 73 15.320 3.227 -3.454 1.00 0.00 C ATOM 1020 CD2 PHE A 73 15.810 4.517 -5.399 1.00 0.00 C ATOM 1021 CE1 PHE A 73 13.982 3.554 -3.571 1.00 0.00 C ATOM 1022 CE2 PHE A 73 14.473 4.848 -5.520 1.00 0.00 C ATOM 1023 CZ PHE A 73 13.559 4.367 -4.604 1.00 0.00 C ATOM 0 H PHE A 73 20.140 3.191 -3.853 1.00 0.00 H new ATOM 0 HA PHE A 73 18.315 5.086 -3.136 1.00 0.00 H new ATOM 0 HB2 PHE A 73 18.222 3.639 -5.149 1.00 0.00 H new ATOM 0 HB3 PHE A 73 17.794 2.263 -4.151 1.00 0.00 H new ATOM 0 HD1 PHE A 73 15.646 2.593 -2.643 1.00 0.00 H new ATOM 0 HD2 PHE A 73 16.521 4.896 -6.118 1.00 0.00 H new ATOM 0 HE1 PHE A 73 13.268 3.174 -2.855 1.00 0.00 H new ATOM 0 HE2 PHE A 73 14.144 5.482 -6.330 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.515 4.626 -4.695 1.00 0.00 H new ATOM 1033 N CYS A 74 18.294 2.645 -1.031 1.00 0.00 N ATOM 1034 CA CYS A 74 17.730 2.157 0.222 1.00 0.00 C ATOM 1035 C CYS A 74 17.902 3.187 1.334 1.00 0.00 C ATOM 1036 O CYS A 74 16.933 3.585 1.980 1.00 0.00 O ATOM 1037 CB CYS A 74 18.394 0.839 0.625 1.00 0.00 C ATOM 1038 SG CYS A 74 18.025 0.312 2.315 1.00 0.00 S ATOM 0 H CYS A 74 19.175 2.205 -1.297 1.00 0.00 H new ATOM 0 HA CYS A 74 16.664 1.988 0.070 1.00 0.00 H new ATOM 0 HB2 CYS A 74 18.075 0.058 -0.065 1.00 0.00 H new ATOM 0 HB3 CYS A 74 19.474 0.940 0.515 1.00 0.00 H new ATOM 0 HG CYS A 74 16.789 -0.084 2.386 1.00 0.00 H new ATOM 1044 N SER A 75 19.142 3.614 1.552 1.00 0.00 N ATOM 1045 CA SER A 75 19.441 4.594 2.589 1.00 0.00 C ATOM 1046 C SER A 75 19.527 5.999 2.000 1.00 0.00 C ATOM 1047 O SER A 75 19.785 6.967 2.715 1.00 0.00 O ATOM 1048 CB SER A 75 20.755 4.241 3.289 1.00 0.00 C ATOM 1049 OG SER A 75 21.847 4.306 2.387 1.00 0.00 O ATOM 0 H SER A 75 19.955 3.297 1.024 1.00 0.00 H new ATOM 0 HA SER A 75 18.631 4.574 3.319 1.00 0.00 H new ATOM 0 HB2 SER A 75 20.924 4.927 4.119 1.00 0.00 H new ATOM 0 HB3 SER A 75 20.688 3.239 3.712 1.00 0.00 H new ATOM 0 HG SER A 75 22.675 4.078 2.859 1.00 0.00 H new ATOM 1055 N GLN A 76 19.307 6.101 0.694 1.00 0.00 N ATOM 1056 CA GLN A 76 19.360 7.387 0.008 1.00 0.00 C ATOM 1057 C GLN A 76 17.958 7.870 -0.350 1.00 0.00 C ATOM 1058 O GLN A 76 17.612 9.028 -0.115 1.00 0.00 O ATOM 1059 CB GLN A 76 20.214 7.280 -1.256 1.00 0.00 C ATOM 1060 CG GLN A 76 21.697 7.105 -0.975 1.00 0.00 C ATOM 1061 CD GLN A 76 22.269 8.231 -0.136 1.00 0.00 C ATOM 1062 OE1 GLN A 76 22.050 9.408 -0.423 1.00 0.00 O ATOM 1063 NE2 GLN A 76 23.006 7.875 0.910 1.00 0.00 N ATOM 0 H GLN A 76 19.090 5.309 0.089 1.00 0.00 H new ATOM 0 HA GLN A 76 19.814 8.113 0.683 1.00 0.00 H new ATOM 0 HB2 GLN A 76 19.863 6.437 -1.851 1.00 0.00 H new ATOM 0 HB3 GLN A 76 20.070 8.177 -1.859 1.00 0.00 H new ATOM 0 HG2 GLN A 76 21.856 6.157 -0.461 1.00 0.00 H new ATOM 0 HG3 GLN A 76 22.238 7.050 -1.920 1.00 0.00 H new ATOM 0 HE21 GLN A 76 23.162 6.887 1.111 1.00 0.00 H new ATOM 0 HE22 GLN A 76 23.416 8.589 1.512 1.00 0.00 H new ATOM 1072 N MET A 77 17.157 6.977 -0.920 1.00 0.00 N ATOM 1073 CA MET A 77 15.792 7.313 -1.309 1.00 0.00 C ATOM 1074 C MET A 77 14.796 6.857 -0.248 1.00 0.00 C ATOM 1075 O MET A 77 14.020 7.659 0.275 1.00 0.00 O ATOM 1076 CB MET A 77 15.451 6.671 -2.655 1.00 0.00 C ATOM 1077 CG MET A 77 16.121 7.350 -3.839 1.00 0.00 C ATOM 1078 SD MET A 77 17.890 7.592 -3.591 1.00 0.00 S ATOM 1079 CE MET A 77 18.521 7.168 -5.213 1.00 0.00 C ATOM 0 H MET A 77 17.429 6.015 -1.123 1.00 0.00 H new ATOM 0 HA MET A 77 15.724 8.397 -1.403 1.00 0.00 H new ATOM 0 HB2 MET A 77 15.746 5.622 -2.633 1.00 0.00 H new ATOM 0 HB3 MET A 77 14.370 6.695 -2.796 1.00 0.00 H new ATOM 0 HG2 MET A 77 15.962 6.749 -4.735 1.00 0.00 H new ATOM 0 HG3 MET A 77 15.647 8.316 -4.015 1.00 0.00 H new ATOM 0 HE1 MET A 77 19.606 7.269 -5.219 1.00 0.00 H new ATOM 0 HE2 MET A 77 18.251 6.139 -5.451 1.00 0.00 H new ATOM 0 HE3 MET A 77 18.090 7.837 -5.957 1.00 0.00 H new ATOM 1089 N LEU A 78 14.821 5.567 0.065 1.00 0.00 N ATOM 1090 CA LEU A 78 13.919 5.004 1.065 1.00 0.00 C ATOM 1091 C LEU A 78 14.125 5.671 2.421 1.00 0.00 C ATOM 1092 O LEU A 78 13.197 5.763 3.225 1.00 0.00 O ATOM 1093 CB LEU A 78 14.140 3.495 1.187 1.00 0.00 C ATOM 1094 CG LEU A 78 13.177 2.610 0.396 1.00 0.00 C ATOM 1095 CD1 LEU A 78 13.454 1.140 0.672 1.00 0.00 C ATOM 1096 CD2 LEU A 78 11.734 2.955 0.735 1.00 0.00 C ATOM 0 H LEU A 78 15.456 4.890 -0.359 1.00 0.00 H new ATOM 0 HA LEU A 78 12.895 5.190 0.741 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.157 3.270 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 78 14.071 3.222 2.240 1.00 0.00 H new ATOM 0 HG LEU A 78 13.334 2.795 -0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 78 12.759 0.525 0.100 1.00 0.00 H new ATOM 0 HD12 LEU A 78 14.476 0.901 0.378 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.326 0.939 1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.063 2.315 0.162 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.563 2.799 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 78 11.541 3.998 0.485 1.00 0.00 H new ATOM 1108 N CYS A 79 15.344 6.137 2.666 1.00 0.00 N ATOM 1109 CA CYS A 79 15.671 6.798 3.925 1.00 0.00 C ATOM 1110 C CYS A 79 15.430 8.301 3.828 1.00 0.00 C ATOM 1111 O CYS A 79 15.497 9.016 4.828 1.00 0.00 O ATOM 1112 CB CYS A 79 17.128 6.527 4.304 1.00 0.00 C ATOM 1113 SG CYS A 79 17.347 5.143 5.447 1.00 0.00 S ATOM 0 H CYS A 79 16.122 6.070 2.010 1.00 0.00 H new ATOM 0 HA CYS A 79 15.020 6.393 4.700 1.00 0.00 H new ATOM 0 HB2 CYS A 79 17.698 6.328 3.396 1.00 0.00 H new ATOM 0 HB3 CYS A 79 17.549 7.426 4.754 1.00 0.00 H new ATOM 0 HG CYS A 79 16.705 5.386 6.551 1.00 0.00 H new ATOM 1119 N ALA A 80 15.150 8.774 2.618 1.00 0.00 N ATOM 1120 CA ALA A 80 14.899 10.191 2.391 1.00 0.00 C ATOM 1121 C ALA A 80 13.833 10.719 3.346 1.00 0.00 C ATOM 1122 O ALA A 80 12.640 10.496 3.143 1.00 0.00 O ATOM 1123 CB ALA A 80 14.481 10.429 0.948 1.00 0.00 C ATOM 0 H ALA A 80 15.091 8.196 1.780 1.00 0.00 H new ATOM 0 HA ALA A 80 15.824 10.734 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 80 14.297 11.492 0.793 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.276 10.097 0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 80 13.571 9.868 0.736 1.00 0.00 H new ATOM 1129 N GLU A 81 14.273 11.420 4.387 1.00 0.00 N ATOM 1130 CA GLU A 81 13.355 11.978 5.373 1.00 0.00 C ATOM 1131 C GLU A 81 12.192 12.693 4.691 1.00 0.00 C ATOM 1132 O GLU A 81 11.028 12.365 4.921 1.00 0.00 O ATOM 1133 CB GLU A 81 14.093 12.949 6.297 1.00 0.00 C ATOM 1134 CG GLU A 81 13.540 12.983 7.712 1.00 0.00 C ATOM 1135 CD GLU A 81 12.465 14.038 7.893 1.00 0.00 C ATOM 1136 OE1 GLU A 81 11.444 13.972 7.177 1.00 0.00 O ATOM 1137 OE2 GLU A 81 12.646 14.928 8.749 1.00 0.00 O ATOM 0 H GLU A 81 15.258 11.614 4.569 1.00 0.00 H new ATOM 0 HA GLU A 81 12.956 11.155 5.966 1.00 0.00 H new ATOM 0 HB2 GLU A 81 15.147 12.672 6.334 1.00 0.00 H new ATOM 0 HB3 GLU A 81 14.042 13.951 5.872 1.00 0.00 H new ATOM 0 HG2 GLU A 81 13.129 12.005 7.961 1.00 0.00 H new ATOM 0 HG3 GLU A 81 14.354 13.175 8.412 1.00 0.00 H new ATOM 1144 N SER A 82 12.517 13.672 3.853 1.00 0.00 N ATOM 1145 CA SER A 82 11.500 14.437 3.140 1.00 0.00 C ATOM 1146 C SER A 82 10.479 13.509 2.489 1.00 0.00 C ATOM 1147 O SER A 82 9.373 13.928 2.147 1.00 0.00 O ATOM 1148 CB SER A 82 12.150 15.324 2.077 1.00 0.00 C ATOM 1149 OG SER A 82 12.523 16.579 2.619 1.00 0.00 O ATOM 0 H SER A 82 13.476 13.954 3.651 1.00 0.00 H new ATOM 0 HA SER A 82 10.983 15.068 3.863 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.029 14.824 1.670 1.00 0.00 H new ATOM 0 HB3 SER A 82 11.456 15.473 1.250 1.00 0.00 H new ATOM 0 HG SER A 82 12.938 17.127 1.920 1.00 0.00 H new ATOM 1155 N ILE A 83 10.859 12.247 2.321 1.00 0.00 N ATOM 1156 CA ILE A 83 9.977 11.259 1.712 1.00 0.00 C ATOM 1157 C ILE A 83 9.271 10.423 2.774 1.00 0.00 C ATOM 1158 O ILE A 83 8.061 10.540 2.967 1.00 0.00 O ATOM 1159 CB ILE A 83 10.751 10.320 0.767 1.00 0.00 C ATOM 1160 CG1 ILE A 83 11.350 11.112 -0.397 1.00 0.00 C ATOM 1161 CG2 ILE A 83 9.838 9.218 0.251 1.00 0.00 C ATOM 1162 CD1 ILE A 83 12.190 10.270 -1.331 1.00 0.00 C ATOM 0 H ILE A 83 11.771 11.885 2.598 1.00 0.00 H new ATOM 0 HA ILE A 83 9.235 11.811 1.135 1.00 0.00 H new ATOM 0 HB ILE A 83 11.566 9.858 1.325 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.543 11.575 -0.965 1.00 0.00 H new ATOM 0 HG13 ILE A 83 11.963 11.920 0.001 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.399 8.563 -0.415 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.455 8.639 1.092 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.004 9.661 -0.294 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.582 10.897 -2.132 1.00 0.00 H new ATOM 0 HD12 ILE A 83 13.018 9.828 -0.777 1.00 0.00 H new ATOM 0 HD13 ILE A 83 11.576 9.477 -1.758 1.00 0.00 H new ATOM 1174 N VAL A 84 10.035 9.581 3.462 1.00 0.00 N ATOM 1175 CA VAL A 84 9.483 8.728 4.508 1.00 0.00 C ATOM 1176 C VAL A 84 8.394 9.453 5.290 1.00 0.00 C ATOM 1177 O VAL A 84 7.455 8.831 5.788 1.00 0.00 O ATOM 1178 CB VAL A 84 10.578 8.260 5.486 1.00 0.00 C ATOM 1179 CG1 VAL A 84 11.678 7.519 4.741 1.00 0.00 C ATOM 1180 CG2 VAL A 84 11.146 9.443 6.254 1.00 0.00 C ATOM 0 H VAL A 84 11.038 9.471 3.314 1.00 0.00 H new ATOM 0 HA VAL A 84 9.052 7.858 4.013 1.00 0.00 H new ATOM 0 HB VAL A 84 10.131 7.571 6.203 1.00 0.00 H new ATOM 0 HG11 VAL A 84 12.442 7.196 5.448 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.255 6.648 4.241 1.00 0.00 H new ATOM 0 HG13 VAL A 84 12.126 8.181 4.000 1.00 0.00 H new ATOM 0 HG21 VAL A 84 11.918 9.095 6.940 1.00 0.00 H new ATOM 0 HG22 VAL A 84 11.579 10.158 5.554 1.00 0.00 H new ATOM 0 HG23 VAL A 84 10.349 9.926 6.819 1.00 0.00 H new ATOM 1190 N SER A 85 8.526 10.771 5.395 1.00 0.00 N ATOM 1191 CA SER A 85 7.554 11.581 6.120 1.00 0.00 C ATOM 1192 C SER A 85 6.234 11.657 5.359 1.00 0.00 C ATOM 1193 O SER A 85 5.170 11.367 5.908 1.00 0.00 O ATOM 1194 CB SER A 85 8.104 12.990 6.352 1.00 0.00 C ATOM 1195 OG SER A 85 8.869 13.049 7.543 1.00 0.00 O ATOM 0 H SER A 85 9.296 11.301 4.987 1.00 0.00 H new ATOM 0 HA SER A 85 7.370 11.107 7.084 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.722 13.287 5.504 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.280 13.701 6.410 1.00 0.00 H new ATOM 0 HG SER A 85 9.763 13.397 7.341 1.00 0.00 H new ATOM 1201 N TYR A 86 6.311 12.048 4.092 1.00 0.00 N ATOM 1202 CA TYR A 86 5.123 12.165 3.255 1.00 0.00 C ATOM 1203 C TYR A 86 4.680 10.798 2.744 1.00 0.00 C ATOM 1204 O TYR A 86 3.535 10.388 2.942 1.00 0.00 O ATOM 1205 CB TYR A 86 5.395 13.100 2.075 1.00 0.00 C ATOM 1206 CG TYR A 86 4.175 13.371 1.224 1.00 0.00 C ATOM 1207 CD1 TYR A 86 3.795 12.491 0.218 1.00 0.00 C ATOM 1208 CD2 TYR A 86 3.403 14.509 1.424 1.00 0.00 C ATOM 1209 CE1 TYR A 86 2.681 12.736 -0.562 1.00 0.00 C ATOM 1210 CE2 TYR A 86 2.287 14.761 0.650 1.00 0.00 C ATOM 1211 CZ TYR A 86 1.931 13.872 -0.342 1.00 0.00 C ATOM 1212 OH TYR A 86 0.821 14.120 -1.117 1.00 0.00 O ATOM 0 H TYR A 86 7.184 12.289 3.622 1.00 0.00 H new ATOM 0 HA TYR A 86 4.321 12.583 3.863 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.781 14.046 2.454 1.00 0.00 H new ATOM 0 HB3 TYR A 86 6.175 12.665 1.450 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.380 11.600 0.043 1.00 0.00 H new ATOM 0 HD2 TYR A 86 3.680 15.209 2.198 1.00 0.00 H new ATOM 0 HE1 TYR A 86 2.399 12.042 -1.340 1.00 0.00 H new ATOM 0 HE2 TYR A 86 1.697 15.649 0.821 1.00 0.00 H new ATOM 0 HH TYR A 86 0.024 14.149 -0.547 1.00 0.00 H new ATOM 1222 N LEU A 87 5.595 10.095 2.085 1.00 0.00 N ATOM 1223 CA LEU A 87 5.301 8.772 1.545 1.00 0.00 C ATOM 1224 C LEU A 87 4.483 7.949 2.535 1.00 0.00 C ATOM 1225 O LEU A 87 3.624 7.160 2.141 1.00 0.00 O ATOM 1226 CB LEU A 87 6.599 8.039 1.205 1.00 0.00 C ATOM 1227 CG LEU A 87 6.506 6.515 1.117 1.00 0.00 C ATOM 1228 CD1 LEU A 87 5.906 6.092 -0.214 1.00 0.00 C ATOM 1229 CD2 LEU A 87 7.878 5.885 1.310 1.00 0.00 C ATOM 0 H LEU A 87 6.547 10.419 1.912 1.00 0.00 H new ATOM 0 HA LEU A 87 4.714 8.900 0.635 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.967 8.416 0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.345 8.295 1.957 1.00 0.00 H new ATOM 0 HG LEU A 87 5.851 6.164 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.848 5.004 -0.258 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.905 6.513 -0.312 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.534 6.455 -1.028 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.793 4.800 1.244 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.555 6.243 0.535 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.270 6.159 2.289 1.00 0.00 H new ATOM 1241 N SER A 88 4.754 8.140 3.822 1.00 0.00 N ATOM 1242 CA SER A 88 4.044 7.415 4.869 1.00 0.00 C ATOM 1243 C SER A 88 2.801 8.179 5.313 1.00 0.00 C ATOM 1244 O SER A 88 1.735 7.594 5.502 1.00 0.00 O ATOM 1245 CB SER A 88 4.965 7.176 6.067 1.00 0.00 C ATOM 1246 OG SER A 88 5.218 8.383 6.764 1.00 0.00 O ATOM 0 H SER A 88 5.460 8.791 4.165 1.00 0.00 H new ATOM 0 HA SER A 88 3.731 6.453 4.462 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.509 6.452 6.742 1.00 0.00 H new ATOM 0 HB3 SER A 88 5.906 6.745 5.726 1.00 0.00 H new ATOM 0 HG SER A 88 5.789 8.963 6.218 1.00 0.00 H new ATOM 1252 N GLN A 89 2.947 9.490 5.476 1.00 0.00 N ATOM 1253 CA GLN A 89 1.837 10.336 5.898 1.00 0.00 C ATOM 1254 C GLN A 89 0.746 10.374 4.833 1.00 0.00 C ATOM 1255 O GLN A 89 -0.389 9.970 5.078 1.00 0.00 O ATOM 1256 CB GLN A 89 2.330 11.754 6.191 1.00 0.00 C ATOM 1257 CG GLN A 89 2.876 11.929 7.599 1.00 0.00 C ATOM 1258 CD GLN A 89 3.321 13.351 7.880 1.00 0.00 C ATOM 1259 OE1 GLN A 89 3.639 14.107 6.961 1.00 0.00 O ATOM 1260 NE2 GLN A 89 3.347 13.723 9.154 1.00 0.00 N ATOM 0 H GLN A 89 3.823 9.989 5.322 1.00 0.00 H new ATOM 0 HA GLN A 89 1.416 9.911 6.809 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.108 12.015 5.473 1.00 0.00 H new ATOM 0 HB3 GLN A 89 1.508 12.454 6.039 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.110 11.643 8.320 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.719 11.253 7.744 1.00 0.00 H new ATOM 0 HE21 GLN A 89 3.075 13.064 9.883 1.00 0.00 H new ATOM 0 HE22 GLN A 89 3.639 14.668 9.404 1.00 0.00 H new ATOM 1269 N ASN A 90 1.100 10.864 3.649 1.00 0.00 N ATOM 1270 CA ASN A 90 0.150 10.956 2.546 1.00 0.00 C ATOM 1271 C ASN A 90 -0.069 9.591 1.901 1.00 0.00 C ATOM 1272 O ASN A 90 -1.205 9.154 1.718 1.00 0.00 O ATOM 1273 CB ASN A 90 0.649 11.953 1.498 1.00 0.00 C ATOM 1274 CG ASN A 90 0.313 13.387 1.858 1.00 0.00 C ATOM 1275 OD1 ASN A 90 -0.585 13.992 1.272 1.00 0.00 O ATOM 1276 ND2 ASN A 90 1.034 13.939 2.827 1.00 0.00 N ATOM 0 H ASN A 90 2.037 11.203 3.429 1.00 0.00 H new ATOM 0 HA ASN A 90 -0.801 11.305 2.947 1.00 0.00 H new ATOM 0 HB2 ASN A 90 1.729 11.852 1.390 1.00 0.00 H new ATOM 0 HB3 ASN A 90 0.208 11.711 0.531 1.00 0.00 H new ATOM 0 HD21 ASN A 90 0.853 14.901 3.112 1.00 0.00 H new ATOM 0 HD22 ASN A 90 1.769 13.401 3.286 1.00 0.00 H new ATOM 1283 N PHE A 91 1.027 8.921 1.559 1.00 0.00 N ATOM 1284 CA PHE A 91 0.956 7.606 0.934 1.00 0.00 C ATOM 1285 C PHE A 91 1.182 6.502 1.963 1.00 0.00 C ATOM 1286 O PHE A 91 1.461 6.775 3.131 1.00 0.00 O ATOM 1287 CB PHE A 91 1.991 7.493 -0.187 1.00 0.00 C ATOM 1288 CG PHE A 91 1.630 8.276 -1.417 1.00 0.00 C ATOM 1289 CD1 PHE A 91 1.253 9.606 -1.322 1.00 0.00 C ATOM 1290 CD2 PHE A 91 1.667 7.682 -2.668 1.00 0.00 C ATOM 1291 CE1 PHE A 91 0.921 10.329 -2.453 1.00 0.00 C ATOM 1292 CE2 PHE A 91 1.336 8.400 -3.802 1.00 0.00 C ATOM 1293 CZ PHE A 91 0.961 9.725 -3.694 1.00 0.00 C ATOM 0 H PHE A 91 1.975 9.268 1.704 1.00 0.00 H new ATOM 0 HA PHE A 91 -0.041 7.486 0.511 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.956 7.839 0.184 1.00 0.00 H new ATOM 0 HB3 PHE A 91 2.110 6.444 -0.456 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.218 10.083 -0.354 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.958 6.646 -2.758 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.631 11.366 -2.366 1.00 0.00 H new ATOM 0 HE2 PHE A 91 1.371 7.925 -4.771 1.00 0.00 H new ATOM 0 HZ PHE A 91 0.700 10.287 -4.578 1.00 0.00 H new ATOM 1303 N ILE A 92 1.058 5.255 1.521 1.00 0.00 N ATOM 1304 CA ILE A 92 1.249 4.110 2.402 1.00 0.00 C ATOM 1305 C ILE A 92 2.486 3.311 2.005 1.00 0.00 C ATOM 1306 O ILE A 92 2.555 2.757 0.908 1.00 0.00 O ATOM 1307 CB ILE A 92 0.023 3.178 2.389 1.00 0.00 C ATOM 1308 CG1 ILE A 92 -1.218 3.925 2.880 1.00 0.00 C ATOM 1309 CG2 ILE A 92 0.283 1.949 3.247 1.00 0.00 C ATOM 1310 CD1 ILE A 92 -1.210 4.198 4.368 1.00 0.00 C ATOM 0 H ILE A 92 0.826 5.012 0.558 1.00 0.00 H new ATOM 0 HA ILE A 92 1.383 4.506 3.409 1.00 0.00 H new ATOM 0 HB ILE A 92 -0.155 2.851 1.365 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.297 4.872 2.346 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.105 3.343 2.630 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -0.593 1.300 3.228 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.145 1.408 2.856 1.00 0.00 H new ATOM 0 HG23 ILE A 92 0.484 2.257 4.273 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.120 4.730 4.645 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -1.162 3.254 4.911 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.342 4.807 4.622 1.00 0.00 H new ATOM 1322 N THR A 93 3.462 3.254 2.907 1.00 0.00 N ATOM 1323 CA THR A 93 4.696 2.522 2.651 1.00 0.00 C ATOM 1324 C THR A 93 4.504 1.026 2.873 1.00 0.00 C ATOM 1325 O THR A 93 3.914 0.607 3.869 1.00 0.00 O ATOM 1326 CB THR A 93 5.841 3.020 3.553 1.00 0.00 C ATOM 1327 OG1 THR A 93 5.963 4.442 3.449 1.00 0.00 O ATOM 1328 CG2 THR A 93 7.158 2.362 3.168 1.00 0.00 C ATOM 0 H THR A 93 3.421 3.706 3.821 1.00 0.00 H new ATOM 0 HA THR A 93 4.960 2.701 1.609 1.00 0.00 H new ATOM 0 HB THR A 93 5.607 2.751 4.583 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.692 4.751 4.027 1.00 0.00 H new ATOM 0 HG21 THR A 93 7.952 2.729 3.818 1.00 0.00 H new ATOM 0 HG22 THR A 93 7.070 1.281 3.277 1.00 0.00 H new ATOM 0 HG23 THR A 93 7.397 2.604 2.132 1.00 0.00 H new ATOM 1336 N TRP A 94 5.005 0.225 1.939 1.00 0.00 N ATOM 1337 CA TRP A 94 4.888 -1.225 2.033 1.00 0.00 C ATOM 1338 C TRP A 94 5.990 -1.913 1.234 1.00 0.00 C ATOM 1339 O TRP A 94 5.978 -1.899 0.004 1.00 0.00 O ATOM 1340 CB TRP A 94 3.517 -1.681 1.531 1.00 0.00 C ATOM 1341 CG TRP A 94 3.220 -3.118 1.838 1.00 0.00 C ATOM 1342 CD1 TRP A 94 2.768 -3.627 3.022 1.00 0.00 C ATOM 1343 CD2 TRP A 94 3.355 -4.230 0.946 1.00 0.00 C ATOM 1344 NE1 TRP A 94 2.615 -4.989 2.920 1.00 0.00 N ATOM 1345 CE2 TRP A 94 2.968 -5.383 1.657 1.00 0.00 C ATOM 1346 CE3 TRP A 94 3.765 -4.364 -0.383 1.00 0.00 C ATOM 1347 CZ2 TRP A 94 2.979 -6.651 1.081 1.00 0.00 C ATOM 1348 CZ3 TRP A 94 3.776 -5.623 -0.953 1.00 0.00 C ATOM 1349 CH2 TRP A 94 3.384 -6.752 -0.222 1.00 0.00 C ATOM 0 H TRP A 94 5.496 0.556 1.108 1.00 0.00 H new ATOM 0 HA TRP A 94 4.995 -1.506 3.081 1.00 0.00 H new ATOM 0 HB2 TRP A 94 2.747 -1.054 1.980 1.00 0.00 H new ATOM 0 HB3 TRP A 94 3.464 -1.529 0.453 1.00 0.00 H new ATOM 0 HD1 TRP A 94 2.561 -3.045 3.908 1.00 0.00 H new ATOM 0 HE1 TRP A 94 2.291 -5.606 3.665 1.00 0.00 H new ATOM 0 HE3 TRP A 94 4.068 -3.499 -0.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 2.679 -7.523 1.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 4.092 -5.738 -1.979 1.00 0.00 H new ATOM 0 HH2 TRP A 94 3.402 -7.722 -0.697 1.00 0.00 H new ATOM 1360 N ALA A 95 6.940 -2.514 1.942 1.00 0.00 N ATOM 1361 CA ALA A 95 8.048 -3.209 1.297 1.00 0.00 C ATOM 1362 C ALA A 95 7.789 -4.711 1.230 1.00 0.00 C ATOM 1363 O ALA A 95 7.172 -5.284 2.128 1.00 0.00 O ATOM 1364 CB ALA A 95 9.348 -2.928 2.036 1.00 0.00 C ATOM 0 H ALA A 95 6.965 -2.534 2.961 1.00 0.00 H new ATOM 0 HA ALA A 95 8.135 -2.836 0.277 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.167 -3.453 1.544 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.547 -1.856 2.028 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.263 -3.273 3.066 1.00 0.00 H new ATOM 1370 N TRP A 96 8.265 -5.341 0.162 1.00 0.00 N ATOM 1371 CA TRP A 96 8.084 -6.776 -0.021 1.00 0.00 C ATOM 1372 C TRP A 96 9.342 -7.414 -0.599 1.00 0.00 C ATOM 1373 O TRP A 96 9.874 -6.954 -1.610 1.00 0.00 O ATOM 1374 CB TRP A 96 6.891 -7.048 -0.940 1.00 0.00 C ATOM 1375 CG TRP A 96 6.651 -8.506 -1.187 1.00 0.00 C ATOM 1376 CD1 TRP A 96 6.994 -9.216 -2.302 1.00 0.00 C ATOM 1377 CD2 TRP A 96 6.014 -9.432 -0.300 1.00 0.00 C ATOM 1378 NE1 TRP A 96 6.609 -10.527 -2.162 1.00 0.00 N ATOM 1379 CE2 TRP A 96 6.006 -10.686 -0.942 1.00 0.00 C ATOM 1380 CE3 TRP A 96 5.451 -9.324 0.974 1.00 0.00 C ATOM 1381 CZ2 TRP A 96 5.456 -11.820 -0.351 1.00 0.00 C ATOM 1382 CZ3 TRP A 96 4.905 -10.451 1.559 1.00 0.00 C ATOM 1383 CH2 TRP A 96 4.911 -11.686 0.897 1.00 0.00 C ATOM 0 H TRP A 96 8.779 -4.881 -0.590 1.00 0.00 H new ATOM 0 HA TRP A 96 7.890 -7.220 0.956 1.00 0.00 H new ATOM 0 HB2 TRP A 96 5.995 -6.609 -0.500 1.00 0.00 H new ATOM 0 HB3 TRP A 96 7.055 -6.548 -1.894 1.00 0.00 H new ATOM 0 HD1 TRP A 96 7.495 -8.807 -3.167 1.00 0.00 H new ATOM 0 HE1 TRP A 96 6.749 -11.263 -2.854 1.00 0.00 H new ATOM 0 HE3 TRP A 96 5.443 -8.377 1.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 5.459 -12.773 -0.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 4.466 -10.378 2.543 1.00 0.00 H new ATOM 0 HH2 TRP A 96 4.477 -12.549 1.381 1.00 0.00 H new ATOM 1394 N ASP A 97 9.813 -8.475 0.047 1.00 0.00 N ATOM 1395 CA ASP A 97 11.009 -9.177 -0.405 1.00 0.00 C ATOM 1396 C ASP A 97 10.668 -10.184 -1.499 1.00 0.00 C ATOM 1397 O ASP A 97 10.064 -11.224 -1.233 1.00 0.00 O ATOM 1398 CB ASP A 97 11.682 -9.889 0.770 1.00 0.00 C ATOM 1399 CG ASP A 97 10.679 -10.445 1.761 1.00 0.00 C ATOM 1400 OD1 ASP A 97 10.131 -11.537 1.501 1.00 0.00 O ATOM 1401 OD2 ASP A 97 10.441 -9.789 2.797 1.00 0.00 O ATOM 0 H ASP A 97 9.385 -8.868 0.885 1.00 0.00 H new ATOM 0 HA ASP A 97 11.699 -8.441 -0.817 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.303 -10.701 0.392 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.346 -9.192 1.282 1.00 0.00 H new ATOM 1406 N LEU A 98 11.057 -9.868 -2.729 1.00 0.00 N ATOM 1407 CA LEU A 98 10.792 -10.744 -3.864 1.00 0.00 C ATOM 1408 C LEU A 98 12.093 -11.279 -4.455 1.00 0.00 C ATOM 1409 O LEU A 98 12.092 -11.925 -5.503 1.00 0.00 O ATOM 1410 CB LEU A 98 10.001 -9.995 -4.938 1.00 0.00 C ATOM 1411 CG LEU A 98 10.823 -9.147 -5.908 1.00 0.00 C ATOM 1412 CD1 LEU A 98 9.987 -8.756 -7.117 1.00 0.00 C ATOM 1413 CD2 LEU A 98 11.363 -7.908 -5.208 1.00 0.00 C ATOM 0 H LEU A 98 11.557 -9.011 -2.966 1.00 0.00 H new ATOM 0 HA LEU A 98 10.201 -11.589 -3.509 1.00 0.00 H new ATOM 0 HB2 LEU A 98 9.432 -10.723 -5.516 1.00 0.00 H new ATOM 0 HB3 LEU A 98 9.278 -9.347 -4.443 1.00 0.00 H new ATOM 0 HG LEU A 98 11.668 -9.742 -6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 98 10.589 -8.153 -7.796 1.00 0.00 H new ATOM 0 HD12 LEU A 98 9.650 -9.655 -7.633 1.00 0.00 H new ATOM 0 HD13 LEU A 98 9.122 -8.179 -6.790 1.00 0.00 H new ATOM 0 HD21 LEU A 98 11.946 -7.316 -5.914 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.532 -7.311 -4.833 1.00 0.00 H new ATOM 0 HD23 LEU A 98 11.999 -8.209 -4.375 1.00 0.00 H new ATOM 1425 N THR A 99 13.202 -11.007 -3.774 1.00 0.00 N ATOM 1426 CA THR A 99 14.509 -11.461 -4.230 1.00 0.00 C ATOM 1427 C THR A 99 14.589 -12.983 -4.243 1.00 0.00 C ATOM 1428 O THR A 99 15.155 -13.578 -5.161 1.00 0.00 O ATOM 1429 CB THR A 99 15.638 -10.907 -3.340 1.00 0.00 C ATOM 1430 OG1 THR A 99 15.490 -9.492 -3.185 1.00 0.00 O ATOM 1431 CG2 THR A 99 17.001 -11.216 -3.941 1.00 0.00 C ATOM 0 H THR A 99 13.220 -10.474 -2.904 1.00 0.00 H new ATOM 0 HA THR A 99 14.638 -11.084 -5.245 1.00 0.00 H new ATOM 0 HB THR A 99 15.571 -11.388 -2.364 1.00 0.00 H new ATOM 0 HG1 THR A 99 16.210 -9.148 -2.617 1.00 0.00 H new ATOM 0 HG21 THR A 99 17.783 -10.815 -3.295 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.123 -12.295 -4.031 1.00 0.00 H new ATOM 0 HG23 THR A 99 17.076 -10.759 -4.928 1.00 0.00 H new ATOM 1439 N LYS A 100 14.017 -13.610 -3.220 1.00 0.00 N ATOM 1440 CA LYS A 100 14.021 -15.064 -3.115 1.00 0.00 C ATOM 1441 C LYS A 100 13.210 -15.694 -4.243 1.00 0.00 C ATOM 1442 O LYS A 100 12.040 -15.364 -4.438 1.00 0.00 O ATOM 1443 CB LYS A 100 13.455 -15.499 -1.761 1.00 0.00 C ATOM 1444 CG LYS A 100 14.492 -15.538 -0.652 1.00 0.00 C ATOM 1445 CD LYS A 100 14.648 -14.181 0.013 1.00 0.00 C ATOM 1446 CE LYS A 100 15.972 -14.073 0.756 1.00 0.00 C ATOM 1447 NZ LYS A 100 15.992 -14.923 1.979 1.00 0.00 N ATOM 0 H LYS A 100 13.545 -13.133 -2.452 1.00 0.00 H new ATOM 0 HA LYS A 100 15.052 -15.406 -3.198 1.00 0.00 H new ATOM 0 HB2 LYS A 100 12.655 -14.816 -1.475 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.008 -16.488 -1.864 1.00 0.00 H new ATOM 0 HG2 LYS A 100 14.201 -16.278 0.093 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.451 -15.857 -1.060 1.00 0.00 H new ATOM 0 HD2 LYS A 100 14.588 -13.396 -0.741 1.00 0.00 H new ATOM 0 HD3 LYS A 100 13.825 -14.019 0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.785 -14.370 0.094 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.150 -13.034 1.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.910 -14.822 2.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 15.232 -14.623 2.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 15.848 -15.918 1.713 1.00 0.00 H new ATOM 1461 N ASP A 101 13.839 -16.602 -4.981 1.00 0.00 N ATOM 1462 CA ASP A 101 13.175 -17.280 -6.089 1.00 0.00 C ATOM 1463 C ASP A 101 11.694 -17.490 -5.787 1.00 0.00 C ATOM 1464 O ASP A 101 10.832 -17.163 -6.603 1.00 0.00 O ATOM 1465 CB ASP A 101 13.847 -18.625 -6.368 1.00 0.00 C ATOM 1466 CG ASP A 101 13.676 -19.606 -5.226 1.00 0.00 C ATOM 1467 OD1 ASP A 101 14.403 -19.478 -4.219 1.00 0.00 O ATOM 1468 OD2 ASP A 101 12.814 -20.504 -5.339 1.00 0.00 O ATOM 0 H ASP A 101 14.807 -16.886 -4.832 1.00 0.00 H new ATOM 0 HA ASP A 101 13.262 -16.649 -6.974 1.00 0.00 H new ATOM 0 HB2 ASP A 101 13.428 -19.055 -7.278 1.00 0.00 H new ATOM 0 HB3 ASP A 101 14.910 -18.466 -6.550 1.00 0.00 H new ATOM 1473 N SER A 102 11.407 -18.039 -4.611 1.00 0.00 N ATOM 1474 CA SER A 102 10.031 -18.297 -4.204 1.00 0.00 C ATOM 1475 C SER A 102 9.202 -17.017 -4.245 1.00 0.00 C ATOM 1476 O SER A 102 8.275 -16.890 -5.043 1.00 0.00 O ATOM 1477 CB SER A 102 9.997 -18.896 -2.797 1.00 0.00 C ATOM 1478 OG SER A 102 10.750 -18.109 -1.890 1.00 0.00 O ATOM 0 H SER A 102 12.109 -18.314 -3.924 1.00 0.00 H new ATOM 0 HA SER A 102 9.599 -19.011 -4.906 1.00 0.00 H new ATOM 0 HB2 SER A 102 8.965 -18.966 -2.453 1.00 0.00 H new ATOM 0 HB3 SER A 102 10.395 -19.911 -2.820 1.00 0.00 H new ATOM 0 HG SER A 102 10.711 -18.512 -0.997 1.00 0.00 H new ATOM 1484 N ASN A 103 9.545 -16.070 -3.377 1.00 0.00 N ATOM 1485 CA ASN A 103 8.833 -14.799 -3.313 1.00 0.00 C ATOM 1486 C ASN A 103 8.708 -14.175 -4.699 1.00 0.00 C ATOM 1487 O ASN A 103 7.609 -13.840 -5.143 1.00 0.00 O ATOM 1488 CB ASN A 103 9.555 -13.834 -2.370 1.00 0.00 C ATOM 1489 CG ASN A 103 9.898 -14.474 -1.038 1.00 0.00 C ATOM 1490 OD1 ASN A 103 10.628 -15.463 -0.982 1.00 0.00 O ATOM 1491 ND2 ASN A 103 9.370 -13.910 0.042 1.00 0.00 N ATOM 0 H ASN A 103 10.311 -16.159 -2.709 1.00 0.00 H new ATOM 0 HA ASN A 103 7.831 -14.991 -2.929 1.00 0.00 H new ATOM 0 HB2 ASN A 103 10.470 -13.481 -2.846 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.927 -12.960 -2.199 1.00 0.00 H new ATOM 0 HD21 ASN A 103 9.564 -14.296 0.966 1.00 0.00 H new ATOM 0 HD22 ASN A 103 8.770 -13.091 -0.052 1.00 0.00 H new ATOM 1498 N ARG A 104 9.840 -14.021 -5.378 1.00 0.00 N ATOM 1499 CA ARG A 104 9.857 -13.437 -6.713 1.00 0.00 C ATOM 1500 C ARG A 104 8.597 -13.813 -7.487 1.00 0.00 C ATOM 1501 O ARG A 104 7.832 -12.945 -7.907 1.00 0.00 O ATOM 1502 CB ARG A 104 11.097 -13.901 -7.480 1.00 0.00 C ATOM 1503 CG ARG A 104 11.449 -13.013 -8.663 1.00 0.00 C ATOM 1504 CD ARG A 104 10.690 -13.426 -9.914 1.00 0.00 C ATOM 1505 NE ARG A 104 10.981 -14.803 -10.302 1.00 0.00 N ATOM 1506 CZ ARG A 104 12.034 -15.155 -11.032 1.00 0.00 C ATOM 1507 NH1 ARG A 104 12.890 -14.234 -11.453 1.00 0.00 N ATOM 1508 NH2 ARG A 104 12.231 -16.429 -11.344 1.00 0.00 N ATOM 0 H ARG A 104 10.758 -14.293 -5.025 1.00 0.00 H new ATOM 0 HA ARG A 104 9.888 -12.353 -6.608 1.00 0.00 H new ATOM 0 HB2 ARG A 104 11.945 -13.934 -6.796 1.00 0.00 H new ATOM 0 HB3 ARG A 104 10.934 -14.918 -7.836 1.00 0.00 H new ATOM 0 HG2 ARG A 104 11.218 -11.975 -8.422 1.00 0.00 H new ATOM 0 HG3 ARG A 104 12.521 -13.065 -8.853 1.00 0.00 H new ATOM 0 HD2 ARG A 104 9.619 -13.317 -9.741 1.00 0.00 H new ATOM 0 HD3 ARG A 104 10.950 -12.756 -10.733 1.00 0.00 H new ATOM 0 HE ARG A 104 10.341 -15.535 -9.996 1.00 0.00 H new ATOM 0 HH11 ARG A 104 12.741 -13.253 -11.217 1.00 0.00 H new ATOM 0 HH12 ARG A 104 13.698 -14.506 -12.013 1.00 0.00 H new ATOM 0 HH21 ARG A 104 11.574 -17.140 -11.024 1.00 0.00 H new ATOM 0 HH22 ARG A 104 13.040 -16.698 -11.904 1.00 0.00 H new ATOM 1522 N ALA A 105 8.388 -15.112 -7.672 1.00 0.00 N ATOM 1523 CA ALA A 105 7.220 -15.603 -8.394 1.00 0.00 C ATOM 1524 C ALA A 105 5.929 -15.141 -7.728 1.00 0.00 C ATOM 1525 O ALA A 105 5.021 -14.641 -8.392 1.00 0.00 O ATOM 1526 CB ALA A 105 7.256 -17.122 -8.485 1.00 0.00 C ATOM 0 H ALA A 105 9.012 -15.844 -7.332 1.00 0.00 H new ATOM 0 HA ALA A 105 7.246 -15.189 -9.402 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.378 -17.475 -9.026 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.157 -17.434 -9.013 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.258 -17.547 -7.481 1.00 0.00 H new ATOM 1532 N ARG A 106 5.853 -15.312 -6.412 1.00 0.00 N ATOM 1533 CA ARG A 106 4.671 -14.914 -5.657 1.00 0.00 C ATOM 1534 C ARG A 106 4.172 -13.545 -6.109 1.00 0.00 C ATOM 1535 O ARG A 106 3.093 -13.427 -6.689 1.00 0.00 O ATOM 1536 CB ARG A 106 4.982 -14.886 -4.159 1.00 0.00 C ATOM 1537 CG ARG A 106 3.781 -15.194 -3.281 1.00 0.00 C ATOM 1538 CD ARG A 106 4.183 -15.361 -1.824 1.00 0.00 C ATOM 1539 NE ARG A 106 3.032 -15.297 -0.928 1.00 0.00 N ATOM 1540 CZ ARG A 106 2.255 -16.339 -0.654 1.00 0.00 C ATOM 1541 NH1 ARG A 106 2.504 -17.519 -1.205 1.00 0.00 N ATOM 1542 NH2 ARG A 106 1.225 -16.201 0.172 1.00 0.00 N ATOM 0 H ARG A 106 6.596 -15.723 -5.847 1.00 0.00 H new ATOM 0 HA ARG A 106 3.887 -15.648 -5.845 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.771 -15.608 -3.947 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.371 -13.902 -3.896 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.050 -14.390 -3.368 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.296 -16.105 -3.632 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.690 -16.317 -1.695 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.897 -14.583 -1.553 1.00 0.00 H new ATOM 0 HE ARG A 106 2.812 -14.403 -0.488 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.294 -17.628 -1.841 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.906 -18.317 -0.993 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.030 -15.294 0.597 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.629 -17.002 0.382 1.00 0.00 H new ATOM 1556 N PHE A 107 4.965 -12.514 -5.840 1.00 0.00 N ATOM 1557 CA PHE A 107 4.604 -11.152 -6.218 1.00 0.00 C ATOM 1558 C PHE A 107 3.991 -11.120 -7.615 1.00 0.00 C ATOM 1559 O PHE A 107 2.838 -10.726 -7.791 1.00 0.00 O ATOM 1560 CB PHE A 107 5.833 -10.242 -6.166 1.00 0.00 C ATOM 1561 CG PHE A 107 5.565 -8.845 -6.647 1.00 0.00 C ATOM 1562 CD1 PHE A 107 4.760 -7.988 -5.913 1.00 0.00 C ATOM 1563 CD2 PHE A 107 6.117 -8.388 -7.832 1.00 0.00 C ATOM 1564 CE1 PHE A 107 4.511 -6.702 -6.354 1.00 0.00 C ATOM 1565 CE2 PHE A 107 5.873 -7.103 -8.278 1.00 0.00 C ATOM 1566 CZ PHE A 107 5.069 -6.258 -7.537 1.00 0.00 C ATOM 0 H PHE A 107 5.862 -12.595 -5.362 1.00 0.00 H new ATOM 0 HA PHE A 107 3.862 -10.789 -5.507 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.201 -10.200 -5.141 1.00 0.00 H new ATOM 0 HB3 PHE A 107 6.626 -10.681 -6.772 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.323 -8.329 -4.986 1.00 0.00 H new ATOM 0 HD2 PHE A 107 6.746 -9.044 -8.415 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.880 -6.045 -5.774 1.00 0.00 H new ATOM 0 HE2 PHE A 107 6.310 -6.760 -9.204 1.00 0.00 H new ATOM 0 HZ PHE A 107 4.877 -5.253 -7.882 1.00 0.00 H new ATOM 1576 N LEU A 108 4.772 -11.537 -8.606 1.00 0.00 N ATOM 1577 CA LEU A 108 4.308 -11.557 -9.989 1.00 0.00 C ATOM 1578 C LEU A 108 2.880 -12.083 -10.077 1.00 0.00 C ATOM 1579 O LEU A 108 2.000 -11.433 -10.642 1.00 0.00 O ATOM 1580 CB LEU A 108 5.236 -12.419 -10.846 1.00 0.00 C ATOM 1581 CG LEU A 108 6.416 -11.695 -11.496 1.00 0.00 C ATOM 1582 CD1 LEU A 108 7.498 -12.687 -11.893 1.00 0.00 C ATOM 1583 CD2 LEU A 108 5.951 -10.898 -12.707 1.00 0.00 C ATOM 0 H LEU A 108 5.729 -11.866 -8.478 1.00 0.00 H new ATOM 0 HA LEU A 108 4.322 -10.534 -10.366 1.00 0.00 H new ATOM 0 HB2 LEU A 108 5.628 -13.224 -10.224 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.643 -12.884 -11.633 1.00 0.00 H new ATOM 0 HG LEU A 108 6.837 -11.001 -10.768 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.329 -12.154 -12.354 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.852 -13.214 -11.007 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.090 -13.406 -12.604 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.804 -10.389 -13.157 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.504 -11.573 -13.437 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.212 -10.160 -12.395 1.00 0.00 H new ATOM 1595 N THR A 109 2.654 -13.266 -9.513 1.00 0.00 N ATOM 1596 CA THR A 109 1.333 -13.880 -9.526 1.00 0.00 C ATOM 1597 C THR A 109 0.293 -12.960 -8.897 1.00 0.00 C ATOM 1598 O THR A 109 -0.793 -12.770 -9.443 1.00 0.00 O ATOM 1599 CB THR A 109 1.331 -15.226 -8.778 1.00 0.00 C ATOM 1600 OG1 THR A 109 2.300 -16.108 -9.355 1.00 0.00 O ATOM 1601 CG2 THR A 109 -0.045 -15.872 -8.830 1.00 0.00 C ATOM 0 H THR A 109 3.370 -13.818 -9.041 1.00 0.00 H new ATOM 0 HA THR A 109 1.076 -14.054 -10.571 1.00 0.00 H new ATOM 0 HB THR A 109 1.587 -15.038 -7.735 1.00 0.00 H new ATOM 0 HG1 THR A 109 3.201 -15.813 -9.105 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.022 -16.821 -8.295 1.00 0.00 H new ATOM 0 HG22 THR A 109 -0.775 -15.211 -8.364 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.326 -16.048 -9.869 1.00 0.00 H new ATOM 1609 N MET A 110 0.633 -12.391 -7.745 1.00 0.00 N ATOM 1610 CA MET A 110 -0.273 -11.489 -7.042 1.00 0.00 C ATOM 1611 C MET A 110 -0.639 -10.296 -7.918 1.00 0.00 C ATOM 1612 O MET A 110 -1.818 -9.997 -8.114 1.00 0.00 O ATOM 1613 CB MET A 110 0.367 -11.003 -5.740 1.00 0.00 C ATOM 1614 CG MET A 110 0.774 -12.131 -4.805 1.00 0.00 C ATOM 1615 SD MET A 110 0.694 -11.656 -3.067 1.00 0.00 S ATOM 1616 CE MET A 110 2.428 -11.394 -2.707 1.00 0.00 C ATOM 0 H MET A 110 1.528 -12.538 -7.279 1.00 0.00 H new ATOM 0 HA MET A 110 -1.185 -12.039 -6.808 1.00 0.00 H new ATOM 0 HB2 MET A 110 1.246 -10.404 -5.978 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.334 -10.348 -5.222 1.00 0.00 H new ATOM 0 HG2 MET A 110 0.124 -12.990 -4.973 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.789 -12.448 -5.045 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.603 -11.534 -1.640 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.029 -12.108 -3.270 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.709 -10.380 -2.991 1.00 0.00 H new ATOM 1626 N CYS A 111 0.376 -9.618 -8.442 1.00 0.00 N ATOM 1627 CA CYS A 111 0.159 -8.456 -9.297 1.00 0.00 C ATOM 1628 C CYS A 111 -0.660 -8.831 -10.527 1.00 0.00 C ATOM 1629 O CYS A 111 -1.579 -8.111 -10.915 1.00 0.00 O ATOM 1630 CB CYS A 111 1.499 -7.856 -9.725 1.00 0.00 C ATOM 1631 SG CYS A 111 2.203 -6.694 -8.532 1.00 0.00 S ATOM 0 H CYS A 111 1.357 -9.853 -8.290 1.00 0.00 H new ATOM 0 HA CYS A 111 -0.398 -7.714 -8.725 1.00 0.00 H new ATOM 0 HB2 CYS A 111 2.210 -8.665 -9.891 1.00 0.00 H new ATOM 0 HB3 CYS A 111 1.368 -7.346 -10.679 1.00 0.00 H new ATOM 0 HG CYS A 111 3.310 -7.180 -8.055 1.00 0.00 H new ATOM 1637 N ASN A 112 -0.320 -9.962 -11.136 1.00 0.00 N ATOM 1638 CA ASN A 112 -1.023 -10.432 -12.324 1.00 0.00 C ATOM 1639 C ASN A 112 -2.530 -10.252 -12.171 1.00 0.00 C ATOM 1640 O ASN A 112 -3.221 -9.882 -13.121 1.00 0.00 O ATOM 1641 CB ASN A 112 -0.698 -11.904 -12.586 1.00 0.00 C ATOM 1642 CG ASN A 112 -1.566 -12.503 -13.676 1.00 0.00 C ATOM 1643 OD1 ASN A 112 -1.242 -12.417 -14.860 1.00 0.00 O ATOM 1644 ND2 ASN A 112 -2.677 -13.113 -13.279 1.00 0.00 N ATOM 0 H ASN A 112 0.438 -10.570 -10.826 1.00 0.00 H new ATOM 0 HA ASN A 112 -0.688 -9.836 -13.173 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.351 -11.997 -12.868 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -0.832 -12.472 -11.665 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -3.301 -13.534 -13.967 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.906 -13.160 -12.286 1.00 0.00 H new ATOM 1651 N ARG A 113 -3.033 -10.515 -10.969 1.00 0.00 N ATOM 1652 CA ARG A 113 -4.458 -10.382 -10.691 1.00 0.00 C ATOM 1653 C ARG A 113 -4.775 -9.004 -10.118 1.00 0.00 C ATOM 1654 O ARG A 113 -5.451 -8.195 -10.755 1.00 0.00 O ATOM 1655 CB ARG A 113 -4.912 -11.469 -9.715 1.00 0.00 C ATOM 1656 CG ARG A 113 -6.185 -11.118 -8.962 1.00 0.00 C ATOM 1657 CD ARG A 113 -6.660 -12.277 -8.101 1.00 0.00 C ATOM 1658 NE ARG A 113 -7.387 -11.819 -6.919 1.00 0.00 N ATOM 1659 CZ ARG A 113 -8.654 -11.421 -6.945 1.00 0.00 C ATOM 1660 NH1 ARG A 113 -9.331 -11.425 -8.085 1.00 0.00 N ATOM 1661 NH2 ARG A 113 -9.247 -11.018 -5.828 1.00 0.00 N ATOM 0 H ARG A 113 -2.475 -10.821 -10.172 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.998 -10.498 -11.631 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -5.069 -12.397 -10.265 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -4.114 -11.656 -8.996 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.008 -10.245 -8.334 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -6.966 -10.847 -9.672 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -7.303 -12.928 -8.693 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -5.802 -12.873 -7.790 1.00 0.00 H new ATOM 0 HE ARG A 113 -6.895 -11.804 -6.026 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.879 -11.734 -8.945 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -10.304 -11.119 -8.102 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -8.730 -11.014 -4.949 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.220 -10.712 -5.849 1.00 0.00 H new ATOM 1675 N HIS A 114 -4.282 -8.743 -8.911 1.00 0.00 N ATOM 1676 CA HIS A 114 -4.512 -7.463 -8.252 1.00 0.00 C ATOM 1677 C HIS A 114 -4.550 -6.327 -9.270 1.00 0.00 C ATOM 1678 O HIS A 114 -5.526 -5.579 -9.345 1.00 0.00 O ATOM 1679 CB HIS A 114 -3.422 -7.196 -7.214 1.00 0.00 C ATOM 1680 CG HIS A 114 -3.742 -7.740 -5.856 1.00 0.00 C ATOM 1681 ND1 HIS A 114 -4.918 -7.461 -5.191 1.00 0.00 N ATOM 1682 CD2 HIS A 114 -3.033 -8.553 -5.038 1.00 0.00 C ATOM 1683 CE1 HIS A 114 -4.917 -8.077 -4.023 1.00 0.00 C ATOM 1684 NE2 HIS A 114 -3.785 -8.747 -3.905 1.00 0.00 N ATOM 0 H HIS A 114 -3.721 -9.401 -8.370 1.00 0.00 H new ATOM 0 HA HIS A 114 -5.478 -7.510 -7.749 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -2.486 -7.635 -7.561 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -3.261 -6.121 -7.137 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -2.058 -8.971 -5.239 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -5.708 -8.039 -3.289 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.513 -9.316 -3.103 1.00 0.00 H new ATOM 1692 N PHE A 115 -3.482 -6.202 -10.051 1.00 0.00 N ATOM 1693 CA PHE A 115 -3.393 -5.156 -11.063 1.00 0.00 C ATOM 1694 C PHE A 115 -3.799 -5.690 -12.434 1.00 0.00 C ATOM 1695 O PHE A 115 -4.742 -5.194 -13.050 1.00 0.00 O ATOM 1696 CB PHE A 115 -1.971 -4.595 -11.123 1.00 0.00 C ATOM 1697 CG PHE A 115 -1.476 -4.074 -9.804 1.00 0.00 C ATOM 1698 CD1 PHE A 115 -2.306 -3.326 -8.984 1.00 0.00 C ATOM 1699 CD2 PHE A 115 -0.182 -4.333 -9.383 1.00 0.00 C ATOM 1700 CE1 PHE A 115 -1.852 -2.844 -7.771 1.00 0.00 C ATOM 1701 CE2 PHE A 115 0.277 -3.855 -8.170 1.00 0.00 C ATOM 1702 CZ PHE A 115 -0.560 -3.110 -7.362 1.00 0.00 C ATOM 0 H PHE A 115 -2.666 -6.812 -10.002 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.080 -4.357 -10.785 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.295 -5.376 -11.473 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -1.937 -3.791 -11.858 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -3.319 -3.118 -9.296 1.00 0.00 H new ATOM 0 HD2 PHE A 115 0.476 -4.916 -10.010 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.508 -2.259 -7.143 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.289 -4.064 -7.854 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.205 -2.737 -6.413 1.00 0.00 H new ATOM 1712 N GLY A 116 -3.080 -6.704 -12.905 1.00 0.00 N ATOM 1713 CA GLY A 116 -3.379 -7.288 -14.199 1.00 0.00 C ATOM 1714 C GLY A 116 -2.145 -7.835 -14.888 1.00 0.00 C ATOM 1715 O GLY A 116 -1.019 -7.553 -14.476 1.00 0.00 O ATOM 0 H GLY A 116 -2.295 -7.132 -12.413 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -4.106 -8.090 -14.073 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.843 -6.535 -14.836 1.00 0.00 H new ATOM 1719 N SER A 117 -2.355 -8.622 -15.938 1.00 0.00 N ATOM 1720 CA SER A 117 -1.250 -9.215 -16.682 1.00 0.00 C ATOM 1721 C SER A 117 -0.343 -8.134 -17.262 1.00 0.00 C ATOM 1722 O SER A 117 0.882 -8.228 -17.185 1.00 0.00 O ATOM 1723 CB SER A 117 -1.784 -10.106 -17.806 1.00 0.00 C ATOM 1724 OG SER A 117 -0.805 -11.042 -18.223 1.00 0.00 O ATOM 0 H SER A 117 -3.280 -8.864 -16.293 1.00 0.00 H new ATOM 0 HA SER A 117 -0.665 -9.824 -15.992 1.00 0.00 H new ATOM 0 HB2 SER A 117 -2.674 -10.634 -17.464 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.085 -9.488 -18.652 1.00 0.00 H new ATOM 0 HG SER A 117 -1.171 -11.600 -18.940 1.00 0.00 H new ATOM 1730 N VAL A 118 -0.954 -7.107 -17.844 1.00 0.00 N ATOM 1731 CA VAL A 118 -0.204 -6.007 -18.437 1.00 0.00 C ATOM 1732 C VAL A 118 0.871 -5.498 -17.483 1.00 0.00 C ATOM 1733 O VAL A 118 2.020 -5.295 -17.877 1.00 0.00 O ATOM 1734 CB VAL A 118 -1.130 -4.837 -18.819 1.00 0.00 C ATOM 1735 CG1 VAL A 118 -0.326 -3.689 -19.409 1.00 0.00 C ATOM 1736 CG2 VAL A 118 -2.202 -5.303 -19.792 1.00 0.00 C ATOM 0 H VAL A 118 -1.967 -7.014 -17.917 1.00 0.00 H new ATOM 0 HA VAL A 118 0.268 -6.396 -19.339 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.622 -4.477 -17.916 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.998 -2.872 -19.673 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.401 -3.339 -18.676 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.196 -4.032 -20.302 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.848 -4.464 -20.051 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.730 -5.691 -20.695 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -2.798 -6.089 -19.328 1.00 0.00 H new ATOM 1746 N VAL A 119 0.491 -5.295 -16.225 1.00 0.00 N ATOM 1747 CA VAL A 119 1.423 -4.812 -15.214 1.00 0.00 C ATOM 1748 C VAL A 119 2.487 -5.859 -14.902 1.00 0.00 C ATOM 1749 O VAL A 119 3.671 -5.654 -15.168 1.00 0.00 O ATOM 1750 CB VAL A 119 0.692 -4.435 -13.911 1.00 0.00 C ATOM 1751 CG1 VAL A 119 1.691 -4.057 -12.828 1.00 0.00 C ATOM 1752 CG2 VAL A 119 -0.290 -3.301 -14.162 1.00 0.00 C ATOM 0 H VAL A 119 -0.456 -5.458 -15.882 1.00 0.00 H new ATOM 0 HA VAL A 119 1.902 -3.923 -15.624 1.00 0.00 H new ATOM 0 HB VAL A 119 0.130 -5.303 -13.565 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.156 -3.794 -11.915 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.351 -4.902 -12.631 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.283 -3.204 -13.160 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.798 -3.047 -13.232 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.249 -2.428 -14.531 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.025 -3.614 -14.903 1.00 0.00 H new ATOM 1762 N ALA A 120 2.057 -6.982 -14.336 1.00 0.00 N ATOM 1763 CA ALA A 120 2.972 -8.062 -13.990 1.00 0.00 C ATOM 1764 C ALA A 120 4.038 -8.244 -15.065 1.00 0.00 C ATOM 1765 O ALA A 120 5.234 -8.183 -14.781 1.00 0.00 O ATOM 1766 CB ALA A 120 2.203 -9.358 -13.781 1.00 0.00 C ATOM 0 H ALA A 120 1.080 -7.167 -14.107 1.00 0.00 H new ATOM 0 HA ALA A 120 3.474 -7.796 -13.060 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.899 -10.156 -13.523 1.00 0.00 H new ATOM 0 HB2 ALA A 120 1.484 -9.228 -12.972 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.675 -9.619 -14.698 1.00 0.00 H new ATOM 1772 N GLN A 121 3.596 -8.469 -16.298 1.00 0.00 N ATOM 1773 CA GLN A 121 4.513 -8.661 -17.414 1.00 0.00 C ATOM 1774 C GLN A 121 5.690 -7.696 -17.325 1.00 0.00 C ATOM 1775 O GLN A 121 6.848 -8.098 -17.442 1.00 0.00 O ATOM 1776 CB GLN A 121 3.781 -8.469 -18.743 1.00 0.00 C ATOM 1777 CG GLN A 121 4.704 -8.450 -19.950 1.00 0.00 C ATOM 1778 CD GLN A 121 4.039 -7.876 -21.186 1.00 0.00 C ATOM 1779 OE1 GLN A 121 2.941 -8.289 -21.562 1.00 0.00 O ATOM 1780 NE2 GLN A 121 4.701 -6.919 -21.825 1.00 0.00 N ATOM 0 H GLN A 121 2.609 -8.523 -16.549 1.00 0.00 H new ATOM 0 HA GLN A 121 4.897 -9.680 -17.363 1.00 0.00 H new ATOM 0 HB2 GLN A 121 3.053 -9.271 -18.866 1.00 0.00 H new ATOM 0 HB3 GLN A 121 3.223 -7.534 -18.709 1.00 0.00 H new ATOM 0 HG2 GLN A 121 5.592 -7.863 -19.714 1.00 0.00 H new ATOM 0 HG3 GLN A 121 5.040 -9.465 -20.161 1.00 0.00 H new ATOM 0 HE21 GLN A 121 5.608 -6.607 -21.478 1.00 0.00 H new ATOM 0 HE22 GLN A 121 4.302 -6.495 -22.663 1.00 0.00 H new ATOM 1789 N THR A 122 5.387 -6.418 -17.116 1.00 0.00 N ATOM 1790 CA THR A 122 6.419 -5.395 -17.012 1.00 0.00 C ATOM 1791 C THR A 122 7.494 -5.797 -16.009 1.00 0.00 C ATOM 1792 O THR A 122 8.685 -5.602 -16.250 1.00 0.00 O ATOM 1793 CB THR A 122 5.824 -4.037 -16.592 1.00 0.00 C ATOM 1794 OG1 THR A 122 4.863 -3.603 -17.561 1.00 0.00 O ATOM 1795 CG2 THR A 122 6.916 -2.988 -16.449 1.00 0.00 C ATOM 0 H THR A 122 4.434 -6.068 -17.016 1.00 0.00 H new ATOM 0 HA THR A 122 6.867 -5.298 -18.001 1.00 0.00 H new ATOM 0 HB THR A 122 5.335 -4.163 -15.626 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.488 -2.740 -17.286 1.00 0.00 H new ATOM 0 HG21 THR A 122 6.471 -2.038 -16.152 1.00 0.00 H new ATOM 0 HG22 THR A 122 7.630 -3.307 -15.690 1.00 0.00 H new ATOM 0 HG23 THR A 122 7.430 -2.866 -17.402 1.00 0.00 H new ATOM 1803 N ILE A 123 7.065 -6.361 -14.884 1.00 0.00 N ATOM 1804 CA ILE A 123 7.993 -6.793 -13.846 1.00 0.00 C ATOM 1805 C ILE A 123 8.848 -7.962 -14.324 1.00 0.00 C ATOM 1806 O ILE A 123 9.953 -8.180 -13.826 1.00 0.00 O ATOM 1807 CB ILE A 123 7.247 -7.208 -12.563 1.00 0.00 C ATOM 1808 CG1 ILE A 123 6.228 -6.137 -12.171 1.00 0.00 C ATOM 1809 CG2 ILE A 123 8.235 -7.448 -11.431 1.00 0.00 C ATOM 1810 CD1 ILE A 123 6.859 -4.844 -11.704 1.00 0.00 C ATOM 0 H ILE A 123 6.082 -6.529 -14.669 1.00 0.00 H new ATOM 0 HA ILE A 123 8.637 -5.942 -13.624 1.00 0.00 H new ATOM 0 HB ILE A 123 6.712 -8.138 -12.755 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.584 -5.930 -13.026 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.590 -6.527 -11.378 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.694 -7.740 -10.531 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.926 -8.243 -11.713 1.00 0.00 H new ATOM 0 HG23 ILE A 123 8.795 -6.533 -11.236 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.077 -4.131 -11.443 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.481 -5.037 -10.830 1.00 0.00 H new ATOM 0 HD13 ILE A 123 7.475 -4.430 -12.503 1.00 0.00 H new ATOM 1822 N ARG A 124 8.331 -8.709 -15.294 1.00 0.00 N ATOM 1823 CA ARG A 124 9.047 -9.855 -15.840 1.00 0.00 C ATOM 1824 C ARG A 124 10.204 -9.401 -16.725 1.00 0.00 C ATOM 1825 O ARG A 124 11.355 -9.785 -16.509 1.00 0.00 O ATOM 1826 CB ARG A 124 8.095 -10.743 -16.643 1.00 0.00 C ATOM 1827 CG ARG A 124 8.480 -12.214 -16.631 1.00 0.00 C ATOM 1828 CD ARG A 124 8.042 -12.914 -17.908 1.00 0.00 C ATOM 1829 NE ARG A 124 8.785 -12.441 -19.073 1.00 0.00 N ATOM 1830 CZ ARG A 124 8.950 -13.158 -20.180 1.00 0.00 C ATOM 1831 NH1 ARG A 124 8.428 -14.373 -20.271 1.00 0.00 N ATOM 1832 NH2 ARG A 124 9.639 -12.658 -21.198 1.00 0.00 N ATOM 0 H ARG A 124 7.419 -8.541 -15.718 1.00 0.00 H new ATOM 0 HA ARG A 124 9.452 -10.429 -15.007 1.00 0.00 H new ATOM 0 HB2 ARG A 124 7.087 -10.636 -16.242 1.00 0.00 H new ATOM 0 HB3 ARG A 124 8.067 -10.392 -17.674 1.00 0.00 H new ATOM 0 HG2 ARG A 124 9.560 -12.308 -16.515 1.00 0.00 H new ATOM 0 HG3 ARG A 124 8.023 -12.704 -15.771 1.00 0.00 H new ATOM 0 HD2 ARG A 124 8.184 -13.989 -17.799 1.00 0.00 H new ATOM 0 HD3 ARG A 124 6.976 -12.748 -18.066 1.00 0.00 H new ATOM 0 HE ARG A 124 9.200 -11.510 -19.035 1.00 0.00 H new ATOM 0 HH11 ARG A 124 7.898 -14.760 -19.490 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.556 -14.921 -21.122 1.00 0.00 H new ATOM 0 HH21 ARG A 124 10.042 -11.723 -21.131 1.00 0.00 H new ATOM 0 HH22 ARG A 124 9.766 -13.208 -22.047 1.00 0.00 H new ATOM 1846 N THR A 125 9.892 -8.582 -17.725 1.00 0.00 N ATOM 1847 CA THR A 125 10.904 -8.077 -18.644 1.00 0.00 C ATOM 1848 C THR A 125 11.882 -7.151 -17.930 1.00 0.00 C ATOM 1849 O THR A 125 13.016 -6.971 -18.373 1.00 0.00 O ATOM 1850 CB THR A 125 10.265 -7.319 -19.823 1.00 0.00 C ATOM 1851 OG1 THR A 125 11.283 -6.851 -20.714 1.00 0.00 O ATOM 1852 CG2 THR A 125 9.439 -6.142 -19.326 1.00 0.00 C ATOM 0 H THR A 125 8.946 -8.254 -17.919 1.00 0.00 H new ATOM 0 HA THR A 125 11.442 -8.944 -19.028 1.00 0.00 H new ATOM 0 HB THR A 125 9.606 -8.006 -20.354 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.868 -6.372 -21.461 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.998 -5.622 -20.176 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.646 -6.504 -18.671 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.080 -5.455 -18.774 1.00 0.00 H new ATOM 1860 N GLN A 126 11.436 -6.566 -16.823 1.00 0.00 N ATOM 1861 CA GLN A 126 12.273 -5.658 -16.048 1.00 0.00 C ATOM 1862 C GLN A 126 13.458 -6.399 -15.436 1.00 0.00 C ATOM 1863 O GLN A 126 13.283 -7.304 -14.619 1.00 0.00 O ATOM 1864 CB GLN A 126 11.451 -4.987 -14.946 1.00 0.00 C ATOM 1865 CG GLN A 126 10.621 -3.812 -15.436 1.00 0.00 C ATOM 1866 CD GLN A 126 11.425 -2.531 -15.535 1.00 0.00 C ATOM 1867 OE1 GLN A 126 12.611 -2.552 -15.865 1.00 0.00 O ATOM 1868 NE2 GLN A 126 10.782 -1.405 -15.249 1.00 0.00 N ATOM 0 H GLN A 126 10.500 -6.705 -16.443 1.00 0.00 H new ATOM 0 HA GLN A 126 12.656 -4.892 -16.723 1.00 0.00 H new ATOM 0 HB2 GLN A 126 10.788 -5.727 -14.497 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.124 -4.643 -14.160 1.00 0.00 H new ATOM 0 HG2 GLN A 126 10.203 -4.050 -16.414 1.00 0.00 H new ATOM 0 HG3 GLN A 126 9.781 -3.658 -14.759 1.00 0.00 H new ATOM 0 HE21 GLN A 126 9.799 -1.434 -14.980 1.00 0.00 H new ATOM 0 HE22 GLN A 126 11.271 -0.511 -15.299 1.00 0.00 H new ATOM 1877 N LYS A 127 14.664 -6.009 -15.835 1.00 0.00 N ATOM 1878 CA LYS A 127 15.878 -6.634 -15.326 1.00 0.00 C ATOM 1879 C LYS A 127 16.085 -6.301 -13.852 1.00 0.00 C ATOM 1880 O LYS A 127 15.341 -5.508 -13.274 1.00 0.00 O ATOM 1881 CB LYS A 127 17.091 -6.176 -16.139 1.00 0.00 C ATOM 1882 CG LYS A 127 17.043 -6.602 -17.596 1.00 0.00 C ATOM 1883 CD LYS A 127 17.514 -8.035 -17.775 1.00 0.00 C ATOM 1884 CE LYS A 127 17.681 -8.388 -19.245 1.00 0.00 C ATOM 1885 NZ LYS A 127 19.036 -8.033 -19.750 1.00 0.00 N ATOM 0 H LYS A 127 14.826 -5.262 -16.510 1.00 0.00 H new ATOM 0 HA LYS A 127 15.769 -7.714 -15.424 1.00 0.00 H new ATOM 0 HB2 LYS A 127 17.162 -5.089 -16.089 1.00 0.00 H new ATOM 0 HB3 LYS A 127 17.996 -6.576 -15.682 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.024 -6.504 -17.971 1.00 0.00 H new ATOM 0 HG3 LYS A 127 17.668 -5.936 -18.191 1.00 0.00 H new ATOM 0 HD2 LYS A 127 18.462 -8.175 -17.256 1.00 0.00 H new ATOM 0 HD3 LYS A 127 16.796 -8.715 -17.316 1.00 0.00 H new ATOM 0 HE2 LYS A 127 17.510 -9.455 -19.384 1.00 0.00 H new ATOM 0 HE3 LYS A 127 16.926 -7.865 -19.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 19.110 -8.289 -20.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 19.190 -7.010 -19.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 19.756 -8.551 -19.207 1.00 0.00 H new ATOM 1899 N THR A 128 17.101 -6.910 -13.249 1.00 0.00 N ATOM 1900 CA THR A 128 17.406 -6.677 -11.843 1.00 0.00 C ATOM 1901 C THR A 128 17.952 -5.271 -11.624 1.00 0.00 C ATOM 1902 O THR A 128 17.374 -4.480 -10.879 1.00 0.00 O ATOM 1903 CB THR A 128 18.429 -7.700 -11.313 1.00 0.00 C ATOM 1904 OG1 THR A 128 17.878 -9.021 -11.376 1.00 0.00 O ATOM 1905 CG2 THR A 128 18.825 -7.378 -9.881 1.00 0.00 C ATOM 0 H THR A 128 17.727 -7.569 -13.713 1.00 0.00 H new ATOM 0 HA THR A 128 16.471 -6.790 -11.294 1.00 0.00 H new ATOM 0 HB THR A 128 19.320 -7.648 -11.939 1.00 0.00 H new ATOM 0 HG1 THR A 128 18.535 -9.666 -11.039 1.00 0.00 H new ATOM 0 HG21 THR A 128 19.548 -8.114 -9.529 1.00 0.00 H new ATOM 0 HG22 THR A 128 19.271 -6.384 -9.841 1.00 0.00 H new ATOM 0 HG23 THR A 128 17.941 -7.405 -9.244 1.00 0.00 H new ATOM 1913 N ASP A 129 19.067 -4.965 -12.279 1.00 0.00 N ATOM 1914 CA ASP A 129 19.690 -3.652 -12.157 1.00 0.00 C ATOM 1915 C ASP A 129 18.633 -2.558 -12.041 1.00 0.00 C ATOM 1916 O ASP A 129 18.764 -1.639 -11.233 1.00 0.00 O ATOM 1917 CB ASP A 129 20.595 -3.380 -13.359 1.00 0.00 C ATOM 1918 CG ASP A 129 19.835 -2.796 -14.535 1.00 0.00 C ATOM 1919 OD1 ASP A 129 19.343 -3.581 -15.371 1.00 0.00 O ATOM 1920 OD2 ASP A 129 19.735 -1.554 -14.618 1.00 0.00 O ATOM 0 H ASP A 129 19.558 -5.608 -12.900 1.00 0.00 H new ATOM 0 HA ASP A 129 20.294 -3.646 -11.250 1.00 0.00 H new ATOM 0 HB2 ASP A 129 21.388 -2.692 -13.065 1.00 0.00 H new ATOM 0 HB3 ASP A 129 21.076 -4.309 -13.666 1.00 0.00 H new ATOM 1925 N GLN A 130 17.588 -2.664 -12.856 1.00 0.00 N ATOM 1926 CA GLN A 130 16.510 -1.682 -12.846 1.00 0.00 C ATOM 1927 C GLN A 130 16.003 -1.445 -11.427 1.00 0.00 C ATOM 1928 O GLN A 130 15.821 -0.303 -11.004 1.00 0.00 O ATOM 1929 CB GLN A 130 15.359 -2.147 -13.740 1.00 0.00 C ATOM 1930 CG GLN A 130 15.771 -2.392 -15.183 1.00 0.00 C ATOM 1931 CD GLN A 130 16.489 -1.205 -15.793 1.00 0.00 C ATOM 1932 OE1 GLN A 130 16.187 -0.053 -15.481 1.00 0.00 O ATOM 1933 NE2 GLN A 130 17.448 -1.480 -16.670 1.00 0.00 N ATOM 0 H GLN A 130 17.465 -3.419 -13.531 1.00 0.00 H new ATOM 0 HA GLN A 130 16.905 -0.743 -13.233 1.00 0.00 H new ATOM 0 HB2 GLN A 130 14.939 -3.065 -13.330 1.00 0.00 H new ATOM 0 HB3 GLN A 130 14.568 -1.398 -13.719 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.420 -3.267 -15.228 1.00 0.00 H new ATOM 0 HG3 GLN A 130 14.886 -2.621 -15.776 1.00 0.00 H new ATOM 0 HE21 GLN A 130 17.666 -2.450 -16.900 1.00 0.00 H new ATOM 0 HE22 GLN A 130 17.966 -0.722 -17.113 1.00 0.00 H new ATOM 1942 N PHE A 131 15.776 -2.531 -10.695 1.00 0.00 N ATOM 1943 CA PHE A 131 15.288 -2.441 -9.324 1.00 0.00 C ATOM 1944 C PHE A 131 16.161 -1.501 -8.497 1.00 0.00 C ATOM 1945 O PHE A 131 17.331 -1.269 -8.804 1.00 0.00 O ATOM 1946 CB PHE A 131 15.259 -3.828 -8.679 1.00 0.00 C ATOM 1947 CG PHE A 131 14.092 -4.667 -9.115 1.00 0.00 C ATOM 1948 CD1 PHE A 131 14.103 -5.306 -10.345 1.00 0.00 C ATOM 1949 CD2 PHE A 131 12.985 -4.818 -8.296 1.00 0.00 C ATOM 1950 CE1 PHE A 131 13.031 -6.079 -10.749 1.00 0.00 C ATOM 1951 CE2 PHE A 131 11.910 -5.589 -8.695 1.00 0.00 C ATOM 1952 CZ PHE A 131 11.933 -6.221 -9.922 1.00 0.00 C ATOM 0 H PHE A 131 15.922 -3.484 -11.029 1.00 0.00 H new ATOM 0 HA PHE A 131 14.275 -2.039 -9.350 1.00 0.00 H new ATOM 0 HB2 PHE A 131 16.184 -4.352 -8.921 1.00 0.00 H new ATOM 0 HB3 PHE A 131 15.231 -3.716 -7.595 1.00 0.00 H new ATOM 0 HD1 PHE A 131 14.959 -5.199 -10.995 1.00 0.00 H new ATOM 0 HD2 PHE A 131 12.962 -4.327 -7.334 1.00 0.00 H new ATOM 0 HE1 PHE A 131 13.051 -6.572 -11.710 1.00 0.00 H new ATOM 0 HE2 PHE A 131 11.052 -5.697 -8.047 1.00 0.00 H new ATOM 0 HZ PHE A 131 11.094 -6.825 -10.235 1.00 0.00 H new ATOM 1962 N PRO A 132 15.580 -0.947 -7.423 1.00 0.00 N ATOM 1963 CA PRO A 132 14.189 -1.216 -7.048 1.00 0.00 C ATOM 1964 C PRO A 132 13.195 -0.598 -8.026 1.00 0.00 C ATOM 1965 O PRO A 132 13.555 0.261 -8.832 1.00 0.00 O ATOM 1966 CB PRO A 132 14.060 -0.563 -5.670 1.00 0.00 C ATOM 1967 CG PRO A 132 15.098 0.506 -5.659 1.00 0.00 C ATOM 1968 CD PRO A 132 16.237 -0.015 -6.491 1.00 0.00 C ATOM 0 HA PRO A 132 13.965 -2.283 -7.052 1.00 0.00 H new ATOM 0 HB2 PRO A 132 13.063 -0.148 -5.520 1.00 0.00 H new ATOM 0 HB3 PRO A 132 14.228 -1.286 -4.872 1.00 0.00 H new ATOM 0 HG2 PRO A 132 14.706 1.435 -6.072 1.00 0.00 H new ATOM 0 HG3 PRO A 132 15.425 0.722 -4.642 1.00 0.00 H new ATOM 0 HD2 PRO A 132 16.749 0.789 -7.020 1.00 0.00 H new ATOM 0 HD3 PRO A 132 16.984 -0.519 -5.878 1.00 0.00 H new ATOM 1976 N LEU A 133 11.945 -1.040 -7.950 1.00 0.00 N ATOM 1977 CA LEU A 133 10.898 -0.529 -8.829 1.00 0.00 C ATOM 1978 C LEU A 133 9.747 0.059 -8.019 1.00 0.00 C ATOM 1979 O LEU A 133 8.944 -0.673 -7.440 1.00 0.00 O ATOM 1980 CB LEU A 133 10.380 -1.644 -9.739 1.00 0.00 C ATOM 1981 CG LEU A 133 11.125 -1.833 -11.060 1.00 0.00 C ATOM 1982 CD1 LEU A 133 10.656 -3.098 -11.762 1.00 0.00 C ATOM 1983 CD2 LEU A 133 10.934 -0.620 -11.959 1.00 0.00 C ATOM 0 H LEU A 133 11.631 -1.751 -7.289 1.00 0.00 H new ATOM 0 HA LEU A 133 11.327 0.263 -9.443 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.417 -2.583 -9.187 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.331 -1.446 -9.961 1.00 0.00 H new ATOM 0 HG LEU A 133 12.188 -1.936 -10.843 1.00 0.00 H new ATOM 0 HD11 LEU A 133 11.198 -3.215 -12.701 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.846 -3.960 -11.123 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.588 -3.026 -11.966 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.472 -0.773 -12.895 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.873 -0.485 -12.168 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.321 0.268 -11.459 1.00 0.00 H new ATOM 1995 N PHE A 134 9.671 1.385 -7.986 1.00 0.00 N ATOM 1996 CA PHE A 134 8.617 2.073 -7.249 1.00 0.00 C ATOM 1997 C PHE A 134 7.420 2.360 -8.151 1.00 0.00 C ATOM 1998 O PHE A 134 7.518 3.135 -9.103 1.00 0.00 O ATOM 1999 CB PHE A 134 9.148 3.379 -6.656 1.00 0.00 C ATOM 2000 CG PHE A 134 8.474 3.772 -5.372 1.00 0.00 C ATOM 2001 CD1 PHE A 134 8.696 3.052 -4.209 1.00 0.00 C ATOM 2002 CD2 PHE A 134 7.620 4.862 -5.328 1.00 0.00 C ATOM 2003 CE1 PHE A 134 8.078 3.412 -3.026 1.00 0.00 C ATOM 2004 CE2 PHE A 134 7.000 5.226 -4.148 1.00 0.00 C ATOM 2005 CZ PHE A 134 7.228 4.500 -2.996 1.00 0.00 C ATOM 0 H PHE A 134 10.327 2.005 -8.461 1.00 0.00 H new ATOM 0 HA PHE A 134 8.291 1.421 -6.439 1.00 0.00 H new ATOM 0 HB2 PHE A 134 10.219 3.280 -6.479 1.00 0.00 H new ATOM 0 HB3 PHE A 134 9.018 4.179 -7.385 1.00 0.00 H new ATOM 0 HD1 PHE A 134 9.359 2.200 -4.227 1.00 0.00 H new ATOM 0 HD2 PHE A 134 7.437 5.434 -6.226 1.00 0.00 H new ATOM 0 HE1 PHE A 134 8.260 2.843 -2.126 1.00 0.00 H new ATOM 0 HE2 PHE A 134 6.337 6.078 -4.127 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.743 4.782 -2.073 1.00 0.00 H new ATOM 2015 N LEU A 135 6.292 1.729 -7.846 1.00 0.00 N ATOM 2016 CA LEU A 135 5.075 1.916 -8.629 1.00 0.00 C ATOM 2017 C LEU A 135 3.974 2.546 -7.782 1.00 0.00 C ATOM 2018 O LEU A 135 3.767 2.163 -6.630 1.00 0.00 O ATOM 2019 CB LEU A 135 4.597 0.576 -9.192 1.00 0.00 C ATOM 2020 CG LEU A 135 5.562 -0.134 -10.142 1.00 0.00 C ATOM 2021 CD1 LEU A 135 6.550 -0.987 -9.361 1.00 0.00 C ATOM 2022 CD2 LEU A 135 4.795 -0.986 -11.143 1.00 0.00 C ATOM 0 H LEU A 135 6.194 1.083 -7.062 1.00 0.00 H new ATOM 0 HA LEU A 135 5.303 2.590 -9.455 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.384 -0.091 -8.357 1.00 0.00 H new ATOM 0 HB3 LEU A 135 3.656 0.740 -9.717 1.00 0.00 H new ATOM 0 HG LEU A 135 6.122 0.623 -10.692 1.00 0.00 H new ATOM 0 HD11 LEU A 135 7.229 -1.484 -10.054 1.00 0.00 H new ATOM 0 HD12 LEU A 135 7.123 -0.353 -8.685 1.00 0.00 H new ATOM 0 HD13 LEU A 135 6.007 -1.736 -8.784 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.498 -1.484 -11.811 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.209 -1.735 -10.610 1.00 0.00 H new ATOM 0 HD23 LEU A 135 4.128 -0.351 -11.726 1.00 0.00 H new ATOM 2034 N ILE A 136 3.269 3.512 -8.362 1.00 0.00 N ATOM 2035 CA ILE A 136 2.186 4.192 -7.662 1.00 0.00 C ATOM 2036 C ILE A 136 0.826 3.749 -8.190 1.00 0.00 C ATOM 2037 O ILE A 136 0.479 4.016 -9.340 1.00 0.00 O ATOM 2038 CB ILE A 136 2.303 5.722 -7.796 1.00 0.00 C ATOM 2039 CG1 ILE A 136 3.680 6.193 -7.324 1.00 0.00 C ATOM 2040 CG2 ILE A 136 1.202 6.409 -7.002 1.00 0.00 C ATOM 2041 CD1 ILE A 136 3.945 7.657 -7.598 1.00 0.00 C ATOM 0 H ILE A 136 3.428 3.841 -9.314 1.00 0.00 H new ATOM 0 HA ILE A 136 2.270 3.920 -6.610 1.00 0.00 H new ATOM 0 HB ILE A 136 2.188 5.990 -8.846 1.00 0.00 H new ATOM 0 HG12 ILE A 136 3.770 6.010 -6.253 1.00 0.00 H new ATOM 0 HG13 ILE A 136 4.448 5.595 -7.815 1.00 0.00 H new ATOM 0 HG21 ILE A 136 1.298 7.490 -7.107 1.00 0.00 H new ATOM 0 HG22 ILE A 136 0.230 6.093 -7.380 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.288 6.137 -5.950 1.00 0.00 H new ATOM 0 HD11 ILE A 136 4.939 7.921 -7.237 1.00 0.00 H new ATOM 0 HD12 ILE A 136 3.887 7.843 -8.671 1.00 0.00 H new ATOM 0 HD13 ILE A 136 3.200 8.264 -7.084 1.00 0.00 H new ATOM 2053 N ILE A 137 0.060 3.073 -7.341 1.00 0.00 N ATOM 2054 CA ILE A 137 -1.264 2.596 -7.721 1.00 0.00 C ATOM 2055 C ILE A 137 -2.359 3.424 -7.056 1.00 0.00 C ATOM 2056 O ILE A 137 -2.190 3.912 -5.939 1.00 0.00 O ATOM 2057 CB ILE A 137 -1.458 1.115 -7.346 1.00 0.00 C ATOM 2058 CG1 ILE A 137 -0.501 0.233 -8.152 1.00 0.00 C ATOM 2059 CG2 ILE A 137 -2.900 0.693 -7.582 1.00 0.00 C ATOM 2060 CD1 ILE A 137 0.852 0.055 -7.498 1.00 0.00 C ATOM 0 H ILE A 137 0.333 2.843 -6.386 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.338 2.702 -8.803 1.00 0.00 H new ATOM 0 HB ILE A 137 -1.232 0.991 -6.287 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -0.957 -0.746 -8.297 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -0.363 0.670 -9.141 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.021 -0.356 -7.312 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.563 1.304 -6.969 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.151 0.828 -8.634 1.00 0.00 H new ATOM 0 HD11 ILE A 137 1.478 -0.581 -8.124 1.00 0.00 H new ATOM 0 HD12 ILE A 137 1.329 1.028 -7.378 1.00 0.00 H new ATOM 0 HD13 ILE A 137 0.725 -0.410 -6.521 1.00 0.00 H new ATOM 2072 N MET A 138 -3.481 3.576 -7.751 1.00 0.00 N ATOM 2073 CA MET A 138 -4.606 4.343 -7.226 1.00 0.00 C ATOM 2074 C MET A 138 -5.916 3.890 -7.862 1.00 0.00 C ATOM 2075 O MET A 138 -5.987 3.667 -9.070 1.00 0.00 O ATOM 2076 CB MET A 138 -4.393 5.837 -7.477 1.00 0.00 C ATOM 2077 CG MET A 138 -5.571 6.698 -7.051 1.00 0.00 C ATOM 2078 SD MET A 138 -5.760 8.172 -8.073 1.00 0.00 S ATOM 2079 CE MET A 138 -6.285 7.444 -9.623 1.00 0.00 C ATOM 0 H MET A 138 -3.636 3.179 -8.678 1.00 0.00 H new ATOM 0 HA MET A 138 -4.664 4.167 -6.152 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.502 6.164 -6.941 1.00 0.00 H new ATOM 0 HB3 MET A 138 -4.203 5.995 -8.538 1.00 0.00 H new ATOM 0 HG2 MET A 138 -6.485 6.106 -7.101 1.00 0.00 H new ATOM 0 HG3 MET A 138 -5.441 6.996 -6.011 1.00 0.00 H new ATOM 0 HE1 MET A 138 -6.154 8.168 -10.428 1.00 0.00 H new ATOM 0 HE2 MET A 138 -5.685 6.558 -9.831 1.00 0.00 H new ATOM 0 HE3 MET A 138 -7.336 7.163 -9.555 1.00 0.00 H new ATOM 2164 N ASN A 144 -8.045 -1.430 -9.395 1.00 0.00 N ATOM 2165 CA ASN A 144 -6.926 -0.497 -9.333 1.00 0.00 C ATOM 2166 C ASN A 144 -6.076 -0.583 -10.596 1.00 0.00 C ATOM 2167 O ASN A 144 -6.318 -1.422 -11.463 1.00 0.00 O ATOM 2168 CB ASN A 144 -6.063 -0.786 -8.103 1.00 0.00 C ATOM 2169 CG ASN A 144 -6.620 -0.151 -6.843 1.00 0.00 C ATOM 2170 OD1 ASN A 144 -7.830 0.037 -6.713 1.00 0.00 O ATOM 2171 ND2 ASN A 144 -5.738 0.182 -5.908 1.00 0.00 N ATOM 0 HA ASN A 144 -7.330 0.513 -9.257 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.988 -1.864 -7.961 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -5.052 -0.416 -8.277 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -6.054 0.612 -5.039 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -4.744 0.007 -6.059 1.00 0.00 H new ATOM 2178 N GLU A 145 -5.078 0.291 -10.692 1.00 0.00 N ATOM 2179 CA GLU A 145 -4.192 0.313 -11.850 1.00 0.00 C ATOM 2180 C GLU A 145 -2.916 1.092 -11.544 1.00 0.00 C ATOM 2181 O GLU A 145 -2.850 1.836 -10.565 1.00 0.00 O ATOM 2182 CB GLU A 145 -4.905 0.934 -13.054 1.00 0.00 C ATOM 2183 CG GLU A 145 -5.318 2.380 -12.837 1.00 0.00 C ATOM 2184 CD GLU A 145 -5.972 2.989 -14.062 1.00 0.00 C ATOM 2185 OE1 GLU A 145 -7.089 2.556 -14.415 1.00 0.00 O ATOM 2186 OE2 GLU A 145 -5.368 3.899 -14.668 1.00 0.00 O ATOM 0 H GLU A 145 -4.863 0.992 -9.983 1.00 0.00 H new ATOM 0 HA GLU A 145 -3.921 -0.716 -12.088 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -4.249 0.879 -13.923 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -5.791 0.343 -13.286 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -6.009 2.434 -11.996 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -4.441 2.968 -12.568 1.00 0.00 H new ATOM 2193 N VAL A 146 -1.905 0.915 -12.388 1.00 0.00 N ATOM 2194 CA VAL A 146 -0.630 1.601 -12.209 1.00 0.00 C ATOM 2195 C VAL A 146 -0.705 3.039 -12.709 1.00 0.00 C ATOM 2196 O VAL A 146 -0.868 3.283 -13.906 1.00 0.00 O ATOM 2197 CB VAL A 146 0.508 0.871 -12.945 1.00 0.00 C ATOM 2198 CG1 VAL A 146 1.809 1.650 -12.824 1.00 0.00 C ATOM 2199 CG2 VAL A 146 0.672 -0.542 -12.405 1.00 0.00 C ATOM 0 H VAL A 146 -1.944 0.302 -13.203 1.00 0.00 H new ATOM 0 HA VAL A 146 -0.418 1.602 -11.140 1.00 0.00 H new ATOM 0 HB VAL A 146 0.249 0.804 -14.002 1.00 0.00 H new ATOM 0 HG11 VAL A 146 2.602 1.118 -13.350 1.00 0.00 H new ATOM 0 HG12 VAL A 146 1.683 2.640 -13.263 1.00 0.00 H new ATOM 0 HG13 VAL A 146 2.076 1.751 -11.772 1.00 0.00 H new ATOM 0 HG21 VAL A 146 1.481 -1.043 -12.937 1.00 0.00 H new ATOM 0 HG22 VAL A 146 0.908 -0.500 -11.342 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -0.255 -1.096 -12.549 1.00 0.00 H new ATOM 2209 N LEU A 147 -0.585 3.987 -11.787 1.00 0.00 N ATOM 2210 CA LEU A 147 -0.638 5.403 -12.135 1.00 0.00 C ATOM 2211 C LEU A 147 0.716 5.890 -12.642 1.00 0.00 C ATOM 2212 O LEU A 147 0.817 6.444 -13.736 1.00 0.00 O ATOM 2213 CB LEU A 147 -1.069 6.230 -10.923 1.00 0.00 C ATOM 2214 CG LEU A 147 -2.576 6.358 -10.699 1.00 0.00 C ATOM 2215 CD1 LEU A 147 -3.170 7.394 -11.641 1.00 0.00 C ATOM 2216 CD2 LEU A 147 -3.259 5.011 -10.885 1.00 0.00 C ATOM 0 H LEU A 147 -0.450 3.802 -10.793 1.00 0.00 H new ATOM 0 HA LEU A 147 -1.371 5.529 -12.932 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.626 5.788 -10.031 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.651 7.231 -11.024 1.00 0.00 H new ATOM 0 HG LEU A 147 -2.745 6.690 -9.675 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -4.243 7.471 -11.467 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -2.702 8.362 -11.459 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -2.991 7.093 -12.673 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -4.331 5.121 -10.722 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -3.081 4.650 -11.898 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.854 4.296 -10.169 1.00 0.00 H new ATOM 2228 N ASN A 148 1.754 5.679 -11.840 1.00 0.00 N ATOM 2229 CA ASN A 148 3.102 6.095 -12.208 1.00 0.00 C ATOM 2230 C ASN A 148 4.083 4.933 -12.084 1.00 0.00 C ATOM 2231 O ASN A 148 3.861 3.999 -11.314 1.00 0.00 O ATOM 2232 CB ASN A 148 3.558 7.259 -11.326 1.00 0.00 C ATOM 2233 CG ASN A 148 4.501 8.200 -12.051 1.00 0.00 C ATOM 2234 OD1 ASN A 148 4.951 7.912 -13.160 1.00 0.00 O ATOM 2235 ND2 ASN A 148 4.803 9.332 -11.426 1.00 0.00 N ATOM 0 H ASN A 148 1.687 5.222 -10.930 1.00 0.00 H new ATOM 0 HA ASN A 148 3.083 6.422 -13.248 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.685 7.816 -10.984 1.00 0.00 H new ATOM 0 HB3 ASN A 148 4.053 6.866 -10.438 1.00 0.00 H new ATOM 0 HD21 ASN A 148 5.432 10.005 -11.865 1.00 0.00 H new ATOM 0 HD22 ASN A 148 4.406 9.529 -10.507 1.00 0.00 H new ATOM 2242 N VAL A 149 5.170 4.999 -12.847 1.00 0.00 N ATOM 2243 CA VAL A 149 6.186 3.954 -12.822 1.00 0.00 C ATOM 2244 C VAL A 149 7.583 4.550 -12.690 1.00 0.00 C ATOM 2245 O VAL A 149 8.118 5.120 -13.641 1.00 0.00 O ATOM 2246 CB VAL A 149 6.129 3.085 -14.092 1.00 0.00 C ATOM 2247 CG1 VAL A 149 7.203 2.008 -14.051 1.00 0.00 C ATOM 2248 CG2 VAL A 149 4.748 2.467 -14.252 1.00 0.00 C ATOM 0 H VAL A 149 5.369 5.765 -13.490 1.00 0.00 H new ATOM 0 HA VAL A 149 5.976 3.329 -11.954 1.00 0.00 H new ATOM 0 HB VAL A 149 6.320 3.721 -14.956 1.00 0.00 H new ATOM 0 HG11 VAL A 149 7.147 1.404 -14.957 1.00 0.00 H new ATOM 0 HG12 VAL A 149 8.185 2.476 -13.987 1.00 0.00 H new ATOM 0 HG13 VAL A 149 7.047 1.371 -13.180 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.725 1.856 -15.154 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.526 1.844 -13.386 1.00 0.00 H new ATOM 0 HG23 VAL A 149 4.002 3.258 -14.330 1.00 0.00 H new ATOM 2258 N ILE A 150 8.169 4.413 -11.505 1.00 0.00 N ATOM 2259 CA ILE A 150 9.505 4.936 -11.249 1.00 0.00 C ATOM 2260 C ILE A 150 10.530 3.810 -11.166 1.00 0.00 C ATOM 2261 O ILE A 150 10.233 2.724 -10.671 1.00 0.00 O ATOM 2262 CB ILE A 150 9.550 5.752 -9.944 1.00 0.00 C ATOM 2263 CG1 ILE A 150 8.521 6.884 -9.989 1.00 0.00 C ATOM 2264 CG2 ILE A 150 10.947 6.309 -9.714 1.00 0.00 C ATOM 2265 CD1 ILE A 150 8.163 7.430 -8.624 1.00 0.00 C ATOM 0 H ILE A 150 7.739 3.944 -10.707 1.00 0.00 H new ATOM 0 HA ILE A 150 9.753 5.589 -12.085 1.00 0.00 H new ATOM 0 HB ILE A 150 9.302 5.092 -9.113 1.00 0.00 H new ATOM 0 HG12 ILE A 150 8.911 7.694 -10.605 1.00 0.00 H new ATOM 0 HG13 ILE A 150 7.615 6.522 -10.475 1.00 0.00 H new ATOM 0 HG21 ILE A 150 10.962 6.883 -8.788 1.00 0.00 H new ATOM 0 HG22 ILE A 150 11.659 5.487 -9.643 1.00 0.00 H new ATOM 0 HG23 ILE A 150 11.222 6.956 -10.547 1.00 0.00 H new ATOM 0 HD11 ILE A 150 7.429 8.229 -8.733 1.00 0.00 H new ATOM 0 HD12 ILE A 150 7.743 6.632 -8.012 1.00 0.00 H new ATOM 0 HD13 ILE A 150 9.059 7.823 -8.143 1.00 0.00 H new ATOM 2277 N GLN A 151 11.737 4.079 -11.654 1.00 0.00 N ATOM 2278 CA GLN A 151 12.806 3.088 -11.634 1.00 0.00 C ATOM 2279 C GLN A 151 13.836 3.420 -10.559 1.00 0.00 C ATOM 2280 O GLN A 151 14.053 4.586 -10.232 1.00 0.00 O ATOM 2281 CB GLN A 151 13.486 3.013 -13.002 1.00 0.00 C ATOM 2282 CG GLN A 151 12.541 2.633 -14.131 1.00 0.00 C ATOM 2283 CD GLN A 151 11.822 3.831 -14.718 1.00 0.00 C ATOM 2284 OE1 GLN A 151 12.066 4.972 -14.322 1.00 0.00 O ATOM 2285 NE2 GLN A 151 10.928 3.579 -15.667 1.00 0.00 N ATOM 0 H GLN A 151 11.999 4.974 -12.068 1.00 0.00 H new ATOM 0 HA GLN A 151 12.364 2.119 -11.402 1.00 0.00 H new ATOM 0 HB2 GLN A 151 13.938 3.979 -13.227 1.00 0.00 H new ATOM 0 HB3 GLN A 151 14.296 2.285 -12.957 1.00 0.00 H new ATOM 0 HG2 GLN A 151 13.104 2.131 -14.918 1.00 0.00 H new ATOM 0 HG3 GLN A 151 11.806 1.919 -13.760 1.00 0.00 H new ATOM 0 HE21 GLN A 151 10.757 2.618 -15.965 1.00 0.00 H new ATOM 0 HE22 GLN A 151 10.412 4.346 -16.098 1.00 0.00 H new ATOM 2294 N GLY A 152 14.469 2.386 -10.013 1.00 0.00 N ATOM 2295 CA GLY A 152 15.468 2.589 -8.980 1.00 0.00 C ATOM 2296 C GLY A 152 16.542 3.573 -9.398 1.00 0.00 C ATOM 2297 O GLY A 152 17.298 4.068 -8.564 1.00 0.00 O ATOM 0 H GLY A 152 14.308 1.412 -10.268 1.00 0.00 H new ATOM 0 HA2 GLY A 152 14.981 2.950 -8.074 1.00 0.00 H new ATOM 0 HA3 GLY A 152 15.931 1.633 -8.734 1.00 0.00 H new ATOM 2301 N ASN A 153 16.611 3.855 -10.695 1.00 0.00 N ATOM 2302 CA ASN A 153 17.603 4.785 -11.223 1.00 0.00 C ATOM 2303 C ASN A 153 17.122 6.227 -11.091 1.00 0.00 C ATOM 2304 O ASN A 153 17.741 7.151 -11.620 1.00 0.00 O ATOM 2305 CB ASN A 153 17.901 4.467 -12.690 1.00 0.00 C ATOM 2306 CG ASN A 153 19.068 5.271 -13.230 1.00 0.00 C ATOM 2307 OD1 ASN A 153 18.890 6.168 -14.054 1.00 0.00 O ATOM 2308 ND2 ASN A 153 20.271 4.952 -12.767 1.00 0.00 N ATOM 0 H ASN A 153 15.992 3.453 -11.399 1.00 0.00 H new ATOM 0 HA ASN A 153 18.517 4.671 -10.640 1.00 0.00 H new ATOM 0 HB2 ASN A 153 18.118 3.404 -12.792 1.00 0.00 H new ATOM 0 HB3 ASN A 153 17.014 4.670 -13.290 1.00 0.00 H new ATOM 0 HD21 ASN A 153 21.094 5.458 -13.094 1.00 0.00 H new ATOM 0 HD22 ASN A 153 20.372 4.201 -12.084 1.00 0.00 H new ATOM 2315 N THR A 154 16.014 6.412 -10.380 1.00 0.00 N ATOM 2316 CA THR A 154 15.449 7.740 -10.178 1.00 0.00 C ATOM 2317 C THR A 154 16.200 8.498 -9.089 1.00 0.00 C ATOM 2318 O THR A 154 17.038 7.930 -8.388 1.00 0.00 O ATOM 2319 CB THR A 154 13.958 7.665 -9.800 1.00 0.00 C ATOM 2320 OG1 THR A 154 13.354 8.957 -9.925 1.00 0.00 O ATOM 2321 CG2 THR A 154 13.786 7.155 -8.377 1.00 0.00 C ATOM 0 H THR A 154 15.490 5.659 -9.935 1.00 0.00 H new ATOM 0 HA THR A 154 15.550 8.273 -11.123 1.00 0.00 H new ATOM 0 HB THR A 154 13.468 6.969 -10.481 1.00 0.00 H new ATOM 0 HG1 THR A 154 12.406 8.899 -9.684 1.00 0.00 H new ATOM 0 HG21 THR A 154 12.725 7.110 -8.132 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.220 6.159 -8.293 1.00 0.00 H new ATOM 0 HG23 THR A 154 14.290 7.830 -7.685 1.00 0.00 H new ATOM 2329 N THR A 155 15.895 9.784 -8.951 1.00 0.00 N ATOM 2330 CA THR A 155 16.541 10.620 -7.948 1.00 0.00 C ATOM 2331 C THR A 155 15.632 10.837 -6.744 1.00 0.00 C ATOM 2332 O THR A 155 14.409 10.878 -6.876 1.00 0.00 O ATOM 2333 CB THR A 155 16.940 11.990 -8.529 1.00 0.00 C ATOM 2334 OG1 THR A 155 15.786 12.649 -9.065 1.00 0.00 O ATOM 2335 CG2 THR A 155 17.990 11.831 -9.618 1.00 0.00 C ATOM 0 H THR A 155 15.204 10.270 -9.522 1.00 0.00 H new ATOM 0 HA THR A 155 17.441 10.093 -7.630 1.00 0.00 H new ATOM 0 HB THR A 155 17.362 12.592 -7.725 1.00 0.00 H new ATOM 0 HG1 THR A 155 15.823 13.603 -8.846 1.00 0.00 H new ATOM 0 HG21 THR A 155 18.256 12.811 -10.013 1.00 0.00 H new ATOM 0 HG22 THR A 155 18.877 11.355 -9.201 1.00 0.00 H new ATOM 0 HG23 THR A 155 17.590 11.212 -10.421 1.00 0.00 H new ATOM 2343 N VAL A 156 16.237 10.976 -5.568 1.00 0.00 N ATOM 2344 CA VAL A 156 15.481 11.191 -4.340 1.00 0.00 C ATOM 2345 C VAL A 156 14.410 12.259 -4.533 1.00 0.00 C ATOM 2346 O VAL A 156 13.240 12.043 -4.218 1.00 0.00 O ATOM 2347 CB VAL A 156 16.403 11.608 -3.179 1.00 0.00 C ATOM 2348 CG1 VAL A 156 15.593 11.853 -1.915 1.00 0.00 C ATOM 2349 CG2 VAL A 156 17.471 10.551 -2.942 1.00 0.00 C ATOM 0 H VAL A 156 17.248 10.943 -5.440 1.00 0.00 H new ATOM 0 HA VAL A 156 15.004 10.243 -4.093 1.00 0.00 H new ATOM 0 HB VAL A 156 16.900 12.540 -3.449 1.00 0.00 H new ATOM 0 HG11 VAL A 156 16.261 12.147 -1.106 1.00 0.00 H new ATOM 0 HG12 VAL A 156 14.870 12.648 -2.095 1.00 0.00 H new ATOM 0 HG13 VAL A 156 15.067 10.940 -1.637 1.00 0.00 H new ATOM 0 HG21 VAL A 156 18.114 10.862 -2.118 1.00 0.00 H new ATOM 0 HG22 VAL A 156 16.995 9.602 -2.693 1.00 0.00 H new ATOM 0 HG23 VAL A 156 18.070 10.431 -3.844 1.00 0.00 H new ATOM 2359 N ASP A 157 14.819 13.411 -5.054 1.00 0.00 N ATOM 2360 CA ASP A 157 13.894 14.513 -5.291 1.00 0.00 C ATOM 2361 C ASP A 157 12.766 14.085 -6.224 1.00 0.00 C ATOM 2362 O ASP A 157 11.590 14.286 -5.924 1.00 0.00 O ATOM 2363 CB ASP A 157 14.637 15.711 -5.885 1.00 0.00 C ATOM 2364 CG ASP A 157 15.510 16.415 -4.864 1.00 0.00 C ATOM 2365 OD1 ASP A 157 15.030 16.652 -3.736 1.00 0.00 O ATOM 2366 OD2 ASP A 157 16.674 16.728 -5.193 1.00 0.00 O ATOM 0 H ASP A 157 15.784 13.606 -5.320 1.00 0.00 H new ATOM 0 HA ASP A 157 13.459 14.802 -4.334 1.00 0.00 H new ATOM 0 HB2 ASP A 157 15.255 15.375 -6.717 1.00 0.00 H new ATOM 0 HB3 ASP A 157 13.914 16.419 -6.290 1.00 0.00 H new ATOM 2371 N GLU A 158 13.134 13.496 -7.358 1.00 0.00 N ATOM 2372 CA GLU A 158 12.152 13.042 -8.336 1.00 0.00 C ATOM 2373 C GLU A 158 11.066 12.204 -7.667 1.00 0.00 C ATOM 2374 O GLU A 158 9.874 12.455 -7.848 1.00 0.00 O ATOM 2375 CB GLU A 158 12.835 12.227 -9.436 1.00 0.00 C ATOM 2376 CG GLU A 158 13.371 13.074 -10.578 1.00 0.00 C ATOM 2377 CD GLU A 158 12.280 13.851 -11.290 1.00 0.00 C ATOM 2378 OE1 GLU A 158 11.991 14.991 -10.870 1.00 0.00 O ATOM 2379 OE2 GLU A 158 11.715 13.317 -12.267 1.00 0.00 O ATOM 0 H GLU A 158 14.104 13.322 -7.622 1.00 0.00 H new ATOM 0 HA GLU A 158 11.686 13.921 -8.781 1.00 0.00 H new ATOM 0 HB2 GLU A 158 13.657 11.660 -8.999 1.00 0.00 H new ATOM 0 HB3 GLU A 158 12.124 11.503 -9.834 1.00 0.00 H new ATOM 0 HG2 GLU A 158 14.114 13.771 -10.191 1.00 0.00 H new ATOM 0 HG3 GLU A 158 13.880 12.430 -11.295 1.00 0.00 H new ATOM 2386 N LEU A 159 11.486 11.209 -6.894 1.00 0.00 N ATOM 2387 CA LEU A 159 10.550 10.333 -6.198 1.00 0.00 C ATOM 2388 C LEU A 159 9.449 11.141 -5.520 1.00 0.00 C ATOM 2389 O LEU A 159 8.277 11.034 -5.878 1.00 0.00 O ATOM 2390 CB LEU A 159 11.289 9.485 -5.161 1.00 0.00 C ATOM 2391 CG LEU A 159 12.042 8.269 -5.701 1.00 0.00 C ATOM 2392 CD1 LEU A 159 13.163 7.870 -4.754 1.00 0.00 C ATOM 2393 CD2 LEU A 159 11.086 7.104 -5.920 1.00 0.00 C ATOM 0 H LEU A 159 12.469 10.988 -6.733 1.00 0.00 H new ATOM 0 HA LEU A 159 10.090 9.675 -6.935 1.00 0.00 H new ATOM 0 HB2 LEU A 159 12.000 10.125 -4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 159 10.566 9.141 -4.421 1.00 0.00 H new ATOM 0 HG LEU A 159 12.484 8.537 -6.661 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.687 7.003 -5.156 1.00 0.00 H new ATOM 0 HD12 LEU A 159 13.862 8.699 -4.648 1.00 0.00 H new ATOM 0 HD13 LEU A 159 12.744 7.621 -3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 159 11.639 6.247 -6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 159 10.615 6.837 -4.974 1.00 0.00 H new ATOM 0 HD23 LEU A 159 10.319 7.393 -6.638 1.00 0.00 H new ATOM 2405 N MET A 160 9.836 11.952 -4.540 1.00 0.00 N ATOM 2406 CA MET A 160 8.881 12.782 -3.814 1.00 0.00 C ATOM 2407 C MET A 160 7.968 13.531 -4.779 1.00 0.00 C ATOM 2408 O MET A 160 6.753 13.577 -4.589 1.00 0.00 O ATOM 2409 CB MET A 160 9.618 13.776 -2.914 1.00 0.00 C ATOM 2410 CG MET A 160 8.697 14.761 -2.214 1.00 0.00 C ATOM 2411 SD MET A 160 7.160 14.000 -1.658 1.00 0.00 S ATOM 2412 CE MET A 160 7.780 12.824 -0.457 1.00 0.00 C ATOM 0 H MET A 160 10.803 12.052 -4.231 1.00 0.00 H new ATOM 0 HA MET A 160 8.267 12.129 -3.194 1.00 0.00 H new ATOM 0 HB2 MET A 160 10.183 13.224 -2.163 1.00 0.00 H new ATOM 0 HB3 MET A 160 10.340 14.330 -3.514 1.00 0.00 H new ATOM 0 HG2 MET A 160 9.215 15.191 -1.357 1.00 0.00 H new ATOM 0 HG3 MET A 160 8.467 15.582 -2.893 1.00 0.00 H new ATOM 0 HE1 MET A 160 7.157 11.930 -0.468 1.00 0.00 H new ATOM 0 HE2 MET A 160 8.806 12.555 -0.708 1.00 0.00 H new ATOM 0 HE3 MET A 160 7.755 13.271 0.537 1.00 0.00 H new ATOM 2422 N MET A 161 8.562 14.118 -5.813 1.00 0.00 N ATOM 2423 CA MET A 161 7.801 14.865 -6.808 1.00 0.00 C ATOM 2424 C MET A 161 6.730 13.985 -7.446 1.00 0.00 C ATOM 2425 O MET A 161 5.561 14.367 -7.516 1.00 0.00 O ATOM 2426 CB MET A 161 8.734 15.416 -7.887 1.00 0.00 C ATOM 2427 CG MET A 161 9.475 16.674 -7.466 1.00 0.00 C ATOM 2428 SD MET A 161 8.383 18.098 -7.293 1.00 0.00 S ATOM 2429 CE MET A 161 9.446 19.414 -7.881 1.00 0.00 C ATOM 0 H MET A 161 9.567 14.091 -5.984 1.00 0.00 H new ATOM 0 HA MET A 161 7.310 15.697 -6.304 1.00 0.00 H new ATOM 0 HB2 MET A 161 9.461 14.649 -8.154 1.00 0.00 H new ATOM 0 HB3 MET A 161 8.152 15.630 -8.784 1.00 0.00 H new ATOM 0 HG2 MET A 161 9.982 16.492 -6.518 1.00 0.00 H new ATOM 0 HG3 MET A 161 10.247 16.900 -8.202 1.00 0.00 H new ATOM 0 HE1 MET A 161 8.911 20.362 -7.835 1.00 0.00 H new ATOM 0 HE2 MET A 161 10.337 19.469 -7.255 1.00 0.00 H new ATOM 0 HE3 MET A 161 9.739 19.212 -8.911 1.00 0.00 H new ATOM 2439 N ARG A 162 7.136 12.808 -7.909 1.00 0.00 N ATOM 2440 CA ARG A 162 6.211 11.876 -8.542 1.00 0.00 C ATOM 2441 C ARG A 162 4.983 11.649 -7.666 1.00 0.00 C ATOM 2442 O ARG A 162 3.848 11.824 -8.112 1.00 0.00 O ATOM 2443 CB ARG A 162 6.907 10.542 -8.818 1.00 0.00 C ATOM 2444 CG ARG A 162 8.164 10.674 -9.663 1.00 0.00 C ATOM 2445 CD ARG A 162 7.848 10.592 -11.148 1.00 0.00 C ATOM 2446 NE ARG A 162 8.846 11.284 -11.959 1.00 0.00 N ATOM 2447 CZ ARG A 162 9.078 11.004 -13.237 1.00 0.00 C ATOM 2448 NH1 ARG A 162 8.386 10.050 -13.846 1.00 0.00 N ATOM 2449 NH2 ARG A 162 10.003 11.678 -13.908 1.00 0.00 N ATOM 0 H ARG A 162 8.099 12.477 -7.858 1.00 0.00 H new ATOM 0 HA ARG A 162 5.886 12.311 -9.487 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.165 10.073 -7.868 1.00 0.00 H new ATOM 0 HB3 ARG A 162 6.208 9.875 -9.323 1.00 0.00 H new ATOM 0 HG2 ARG A 162 8.652 11.624 -9.446 1.00 0.00 H new ATOM 0 HG3 ARG A 162 8.868 9.886 -9.396 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.797 9.546 -11.451 1.00 0.00 H new ATOM 0 HD3 ARG A 162 6.866 11.026 -11.334 1.00 0.00 H new ATOM 0 HE ARG A 162 9.395 12.023 -11.520 1.00 0.00 H new ATOM 0 HH11 ARG A 162 7.674 9.530 -13.333 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.566 9.837 -14.827 1.00 0.00 H new ATOM 0 HH21 ARG A 162 10.537 12.412 -13.443 1.00 0.00 H new ATOM 0 HH22 ARG A 162 10.180 11.462 -14.889 1.00 0.00 H new ATOM 2463 N LEU A 163 5.217 11.259 -6.418 1.00 0.00 N ATOM 2464 CA LEU A 163 4.130 11.008 -5.478 1.00 0.00 C ATOM 2465 C LEU A 163 3.068 12.099 -5.570 1.00 0.00 C ATOM 2466 O LEU A 163 1.876 11.811 -5.680 1.00 0.00 O ATOM 2467 CB LEU A 163 4.672 10.926 -4.050 1.00 0.00 C ATOM 2468 CG LEU A 163 5.429 9.647 -3.692 1.00 0.00 C ATOM 2469 CD1 LEU A 163 6.187 9.824 -2.385 1.00 0.00 C ATOM 2470 CD2 LEU A 163 4.470 8.469 -3.598 1.00 0.00 C ATOM 0 H LEU A 163 6.150 11.110 -6.033 1.00 0.00 H new ATOM 0 HA LEU A 163 3.669 10.055 -5.740 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.335 11.775 -3.885 1.00 0.00 H new ATOM 0 HB3 LEU A 163 3.836 11.035 -3.359 1.00 0.00 H new ATOM 0 HG LEU A 163 6.151 9.441 -4.482 1.00 0.00 H new ATOM 0 HD11 LEU A 163 6.720 8.904 -2.146 1.00 0.00 H new ATOM 0 HD12 LEU A 163 6.901 10.641 -2.486 1.00 0.00 H new ATOM 0 HD13 LEU A 163 5.484 10.054 -1.585 1.00 0.00 H new ATOM 0 HD21 LEU A 163 5.026 7.567 -3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 163 3.725 8.667 -2.827 1.00 0.00 H new ATOM 0 HD23 LEU A 163 3.971 8.328 -4.557 1.00 0.00 H new ATOM 2482 N MET A 164 3.509 13.352 -5.525 1.00 0.00 N ATOM 2483 CA MET A 164 2.596 14.486 -5.607 1.00 0.00 C ATOM 2484 C MET A 164 1.829 14.473 -6.925 1.00 0.00 C ATOM 2485 O MET A 164 0.647 14.812 -6.969 1.00 0.00 O ATOM 2486 CB MET A 164 3.367 15.800 -5.465 1.00 0.00 C ATOM 2487 CG MET A 164 3.936 16.023 -4.073 1.00 0.00 C ATOM 2488 SD MET A 164 4.689 17.651 -3.883 1.00 0.00 S ATOM 2489 CE MET A 164 3.763 18.292 -2.490 1.00 0.00 C ATOM 0 H MET A 164 4.492 13.607 -5.432 1.00 0.00 H new ATOM 0 HA MET A 164 1.880 14.403 -4.790 1.00 0.00 H new ATOM 0 HB2 MET A 164 4.182 15.813 -6.188 1.00 0.00 H new ATOM 0 HB3 MET A 164 2.705 16.629 -5.715 1.00 0.00 H new ATOM 0 HG2 MET A 164 3.141 15.907 -3.337 1.00 0.00 H new ATOM 0 HG3 MET A 164 4.681 15.256 -3.862 1.00 0.00 H new ATOM 0 HE1 MET A 164 4.114 19.296 -2.251 1.00 0.00 H new ATOM 0 HE2 MET A 164 2.703 18.329 -2.743 1.00 0.00 H new ATOM 0 HE3 MET A 164 3.907 17.642 -1.627 1.00 0.00 H new ATOM 2499 N ALA A 165 2.509 14.080 -7.997 1.00 0.00 N ATOM 2500 CA ALA A 165 1.891 14.021 -9.315 1.00 0.00 C ATOM 2501 C ALA A 165 0.770 12.988 -9.351 1.00 0.00 C ATOM 2502 O ALA A 165 -0.136 13.069 -10.179 1.00 0.00 O ATOM 2503 CB ALA A 165 2.936 13.706 -10.375 1.00 0.00 C ATOM 0 H ALA A 165 3.489 13.798 -7.978 1.00 0.00 H new ATOM 0 HA ALA A 165 1.456 14.997 -9.528 1.00 0.00 H new ATOM 0 HB1 ALA A 165 2.460 13.665 -11.355 1.00 0.00 H new ATOM 0 HB2 ALA A 165 3.700 14.483 -10.375 1.00 0.00 H new ATOM 0 HB3 ALA A 165 3.398 12.743 -10.156 1.00 0.00 H new ATOM 2509 N ALA A 166 0.839 12.016 -8.447 1.00 0.00 N ATOM 2510 CA ALA A 166 -0.170 10.967 -8.374 1.00 0.00 C ATOM 2511 C ALA A 166 -1.314 11.369 -7.449 1.00 0.00 C ATOM 2512 O ALA A 166 -2.479 11.089 -7.729 1.00 0.00 O ATOM 2513 CB ALA A 166 0.457 9.662 -7.906 1.00 0.00 C ATOM 0 H ALA A 166 1.584 11.934 -7.755 1.00 0.00 H new ATOM 0 HA ALA A 166 -0.580 10.822 -9.373 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -0.309 8.888 -7.856 1.00 0.00 H new ATOM 0 HB2 ALA A 166 1.234 9.359 -8.608 1.00 0.00 H new ATOM 0 HB3 ALA A 166 0.895 9.803 -6.918 1.00 0.00 H new ATOM 2519 N MET A 167 -0.973 12.026 -6.345 1.00 0.00 N ATOM 2520 CA MET A 167 -1.972 12.466 -5.379 1.00 0.00 C ATOM 2521 C MET A 167 -2.714 13.698 -5.887 1.00 0.00 C ATOM 2522 O MET A 167 -3.894 13.887 -5.594 1.00 0.00 O ATOM 2523 CB MET A 167 -1.311 12.774 -4.034 1.00 0.00 C ATOM 2524 CG MET A 167 -0.563 14.097 -4.013 1.00 0.00 C ATOM 2525 SD MET A 167 -1.627 15.490 -3.591 1.00 0.00 S ATOM 2526 CE MET A 167 -0.705 16.849 -4.304 1.00 0.00 C ATOM 0 H MET A 167 -0.013 12.265 -6.098 1.00 0.00 H new ATOM 0 HA MET A 167 -2.692 11.659 -5.246 1.00 0.00 H new ATOM 0 HB2 MET A 167 -2.075 12.786 -3.257 1.00 0.00 H new ATOM 0 HB3 MET A 167 -0.618 11.970 -3.787 1.00 0.00 H new ATOM 0 HG2 MET A 167 0.253 14.037 -3.293 1.00 0.00 H new ATOM 0 HG3 MET A 167 -0.113 14.271 -4.991 1.00 0.00 H new ATOM 0 HE1 MET A 167 -0.272 17.453 -3.507 1.00 0.00 H new ATOM 0 HE2 MET A 167 0.092 16.456 -4.936 1.00 0.00 H new ATOM 0 HE3 MET A 167 -1.373 17.467 -4.904 1.00 0.00 H new ATOM 2536 N GLU A 168 -2.015 14.532 -6.650 1.00 0.00 N ATOM 2537 CA GLU A 168 -2.609 15.746 -7.198 1.00 0.00 C ATOM 2538 C GLU A 168 -3.672 15.409 -8.239 1.00 0.00 C ATOM 2539 O GLU A 168 -4.679 16.108 -8.361 1.00 0.00 O ATOM 2540 CB GLU A 168 -1.529 16.631 -7.824 1.00 0.00 C ATOM 2541 CG GLU A 168 -1.073 16.158 -9.194 1.00 0.00 C ATOM 2542 CD GLU A 168 -0.198 17.175 -9.901 1.00 0.00 C ATOM 2543 OE1 GLU A 168 0.637 17.811 -9.223 1.00 0.00 O ATOM 2544 OE2 GLU A 168 -0.348 17.336 -11.130 1.00 0.00 O ATOM 0 H GLU A 168 -1.037 14.390 -6.903 1.00 0.00 H new ATOM 0 HA GLU A 168 -3.084 16.288 -6.381 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -1.909 17.649 -7.908 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -0.668 16.667 -7.156 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -0.523 15.223 -9.087 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -1.947 15.945 -9.810 1.00 0.00 H new ATOM 2551 N ILE A 169 -3.441 14.336 -8.987 1.00 0.00 N ATOM 2552 CA ILE A 169 -4.379 13.906 -10.017 1.00 0.00 C ATOM 2553 C ILE A 169 -5.619 13.268 -9.399 1.00 0.00 C ATOM 2554 O ILE A 169 -6.739 13.490 -9.860 1.00 0.00 O ATOM 2555 CB ILE A 169 -3.728 12.904 -10.988 1.00 0.00 C ATOM 2556 CG1 ILE A 169 -2.625 13.587 -11.798 1.00 0.00 C ATOM 2557 CG2 ILE A 169 -4.778 12.304 -11.912 1.00 0.00 C ATOM 2558 CD1 ILE A 169 -1.751 12.620 -12.565 1.00 0.00 C ATOM 0 H ILE A 169 -2.612 13.748 -8.899 1.00 0.00 H new ATOM 0 HA ILE A 169 -4.671 14.798 -10.571 1.00 0.00 H new ATOM 0 HB ILE A 169 -3.279 12.098 -10.408 1.00 0.00 H new ATOM 0 HG12 ILE A 169 -3.080 14.287 -12.499 1.00 0.00 H new ATOM 0 HG13 ILE A 169 -2.000 14.173 -11.124 1.00 0.00 H new ATOM 0 HG21 ILE A 169 -4.303 11.598 -12.593 1.00 0.00 H new ATOM 0 HG22 ILE A 169 -5.531 11.786 -11.319 1.00 0.00 H new ATOM 0 HG23 ILE A 169 -5.253 13.099 -12.487 1.00 0.00 H new ATOM 0 HD11 ILE A 169 -0.991 13.175 -13.116 1.00 0.00 H new ATOM 0 HD12 ILE A 169 -1.267 11.936 -11.868 1.00 0.00 H new ATOM 0 HD13 ILE A 169 -2.364 12.052 -13.265 1.00 0.00 H new ATOM 2570 N PHE A 170 -5.410 12.475 -8.353 1.00 0.00 N ATOM 2571 CA PHE A 170 -6.511 11.805 -7.672 1.00 0.00 C ATOM 2572 C PHE A 170 -7.637 12.786 -7.361 1.00 0.00 C ATOM 2573 O PHE A 170 -8.782 12.586 -7.767 1.00 0.00 O ATOM 2574 CB PHE A 170 -6.017 11.152 -6.379 1.00 0.00 C ATOM 2575 CG PHE A 170 -7.126 10.680 -5.483 1.00 0.00 C ATOM 2576 CD1 PHE A 170 -8.045 9.745 -5.930 1.00 0.00 C ATOM 2577 CD2 PHE A 170 -7.251 11.173 -4.194 1.00 0.00 C ATOM 2578 CE1 PHE A 170 -9.067 9.308 -5.108 1.00 0.00 C ATOM 2579 CE2 PHE A 170 -8.270 10.740 -3.367 1.00 0.00 C ATOM 2580 CZ PHE A 170 -9.180 9.807 -3.825 1.00 0.00 C ATOM 0 H PHE A 170 -4.489 12.281 -7.959 1.00 0.00 H new ATOM 0 HA PHE A 170 -6.899 11.033 -8.336 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -5.379 10.305 -6.630 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -5.400 11.866 -5.834 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -7.962 9.353 -6.933 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -6.544 11.904 -3.831 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -9.776 8.577 -5.468 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -8.355 11.131 -2.364 1.00 0.00 H new ATOM 0 HZ PHE A 170 -9.978 9.468 -3.181 1.00 0.00 H new ATOM 2590 N THR A 171 -7.304 13.850 -6.636 1.00 0.00 N ATOM 2591 CA THR A 171 -8.285 14.862 -6.268 1.00 0.00 C ATOM 2592 C THR A 171 -8.935 15.474 -7.504 1.00 0.00 C ATOM 2593 O THR A 171 -10.157 15.599 -7.578 1.00 0.00 O ATOM 2594 CB THR A 171 -7.647 15.985 -5.429 1.00 0.00 C ATOM 2595 OG1 THR A 171 -6.526 16.541 -6.126 1.00 0.00 O ATOM 2596 CG2 THR A 171 -7.198 15.460 -4.074 1.00 0.00 C ATOM 0 H THR A 171 -6.361 14.032 -6.292 1.00 0.00 H new ATOM 0 HA THR A 171 -9.047 14.360 -5.671 1.00 0.00 H new ATOM 0 HB THR A 171 -8.397 16.760 -5.270 1.00 0.00 H new ATOM 0 HG1 THR A 171 -6.127 17.255 -5.587 1.00 0.00 H new ATOM 0 HG21 THR A 171 -6.751 16.271 -3.500 1.00 0.00 H new ATOM 0 HG22 THR A 171 -8.058 15.064 -3.534 1.00 0.00 H new ATOM 0 HG23 THR A 171 -6.463 14.668 -4.216 1.00 0.00 H new