USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1058 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 78 MET CE :methyl -126:sc= -16.6! (180deg=-25.6!) USER MOD Set 1.2: A 86 MET CE :methyl -140:sc= -6.93! (180deg=-12.1!) USER MOD Set 2.1: A 53 ASN : amide:sc= -4.34! C(o=-7.9!,f=-15!) USER MOD Set 2.2: A 70 HIS : no HD1:sc= -3.6! C(o=-7.9!,f=-17!) USER MOD Set 3.1: A 67 ASN :FLIP amide:sc= -0.565 F(o=-2.6!,f=-0.55) USER MOD Set 3.2: A 80 HIS : no HE2:sc= 0.0106 K(o=-0.55,f=-8.8!) USER MOD Set 4.1: A 16 MET CE :methyl -122:sc= -16.4! (180deg=-28.1!) USER MOD Set 4.2: A 34 TYR OH : rot 177:sc= 0.438 USER MOD Set 5.1: A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 18 GLN : amide:sc= -2.39! C(o=-2.4!,f=-3.4!) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN :FLIP amide:sc= -0.478 F(o=-1.2,f=-0.48) USER MOD Single : A 9 SER OG : rot 180:sc= -0.54 USER MOD Single : A 10 ASN : amide:sc= -2.25! C(o=-2.2!,f=-3.8!) USER MOD Single : A 11 ASN : amide:sc= -6.01! C(o=-6!,f=-8.9!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 42:sc= 0.56 USER MOD Single : A 28 SER OG : rot 180:sc= -0.488 USER MOD Single : A 35 ASN : amide:sc= -0.015 X(o=-0.015,f=-0.015) USER MOD Single : A 38 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00667) USER MOD Single : A 41 TYR OH : rot 165:sc= -4.35! USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.136 X(o=-0.14,f=-0.5) USER MOD Single : A 72 ASN :FLIP amide:sc= -0.45! F(o=-1.3,f=-0.45!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.766 USER MOD Single : A 88 GLN : amide:sc= -9! C(o=-9!,f=-8.6!) USER MOD Single : A 89 GLN : amide:sc= -0.0576 K(o=-0.058,f=-2.9!) USER MOD Single : A 95 HIS : no HD1:sc= -4.28! C(o=-4.3!,f=-5.3!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0603 K(o=-0.06,f=-4.5!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -113:sc= -0.404 (180deg=-0.547) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot -160:sc= -0.232 USER MOD Single : A 116 MET CE :methyl 148:sc= -5.51! (180deg=-10.8!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HE2:sc= -14.3! C(o=-14!,f=-19!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN :FLIP amide:sc= -1.35! C(o=-2.7!,f=-1.4!) USER MOD Single : A 130 ASN : amide:sc=-0.000613 K(o=-0.00061,f=-2.5!) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 26 N GLU A 3 -7.675 -10.224 -8.103 1.00 0.00 N ATOM 27 CA GLU A 3 -8.189 -9.180 -7.231 1.00 0.00 C ATOM 28 C GLU A 3 -8.647 -7.977 -8.058 1.00 0.00 C ATOM 29 O GLU A 3 -9.512 -7.217 -7.628 1.00 0.00 O ATOM 30 CB GLU A 3 -7.142 -8.766 -6.195 1.00 0.00 C ATOM 31 CG GLU A 3 -7.189 -9.686 -4.973 1.00 0.00 C ATOM 32 CD GLU A 3 -6.046 -10.704 -5.010 1.00 0.00 C ATOM 33 OE1 GLU A 3 -4.925 -10.287 -5.372 1.00 0.00 O ATOM 34 OE2 GLU A 3 -6.321 -11.876 -4.675 1.00 0.00 O ATOM 0 HA GLU A 3 -9.050 -9.575 -6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.149 -8.800 -6.643 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -7.318 -7.736 -5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -7.122 -9.091 -4.062 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -8.145 -10.208 -4.943 1.00 0.00 H new ATOM 41 N ILE A 4 -8.046 -7.843 -9.232 1.00 0.00 N ATOM 42 CA ILE A 4 -8.382 -6.746 -10.123 1.00 0.00 C ATOM 43 C ILE A 4 -9.884 -6.772 -10.417 1.00 0.00 C ATOM 44 O ILE A 4 -10.522 -5.726 -10.500 1.00 0.00 O ATOM 45 CB ILE A 4 -7.508 -6.787 -11.379 1.00 0.00 C ATOM 46 CG1 ILE A 4 -6.067 -7.172 -11.032 1.00 0.00 C ATOM 47 CG2 ILE A 4 -7.581 -5.465 -12.143 1.00 0.00 C ATOM 48 CD1 ILE A 4 -5.592 -6.437 -9.777 1.00 0.00 C ATOM 0 H ILE A 4 -7.329 -8.476 -9.586 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.168 -5.790 -9.645 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.897 -7.561 -12.041 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.002 -8.249 -10.874 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -5.411 -6.932 -11.869 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.951 -5.522 -13.030 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.612 -5.274 -12.442 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -7.233 -4.655 -11.502 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.566 -6.728 -9.552 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.635 -5.361 -9.947 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.236 -6.698 -8.937 1.00 0.00 H new ATOM 60 N MET A 5 -10.402 -7.982 -10.565 1.00 0.00 N ATOM 61 CA MET A 5 -11.816 -8.160 -10.847 1.00 0.00 C ATOM 62 C MET A 5 -12.593 -8.489 -9.572 1.00 0.00 C ATOM 63 O MET A 5 -13.820 -8.567 -9.589 1.00 0.00 O ATOM 64 CB MET A 5 -11.996 -9.292 -11.862 1.00 0.00 C ATOM 65 CG MET A 5 -13.206 -9.034 -12.761 1.00 0.00 C ATOM 66 SD MET A 5 -13.100 -10.045 -14.230 1.00 0.00 S ATOM 67 CE MET A 5 -13.927 -11.518 -13.653 1.00 0.00 C ATOM 0 H MET A 5 -9.868 -8.848 -10.495 1.00 0.00 H new ATOM 0 HA MET A 5 -12.205 -7.228 -11.256 1.00 0.00 H new ATOM 0 HB2 MET A 5 -11.098 -9.384 -12.473 1.00 0.00 H new ATOM 0 HB3 MET A 5 -12.123 -10.239 -11.337 1.00 0.00 H new ATOM 0 HG2 MET A 5 -14.126 -9.258 -12.221 1.00 0.00 H new ATOM 0 HG3 MET A 5 -13.247 -7.980 -13.037 1.00 0.00 H new ATOM 0 HE1 MET A 5 -13.950 -12.259 -14.452 1.00 0.00 H new ATOM 0 HE2 MET A 5 -13.390 -11.925 -12.796 1.00 0.00 H new ATOM 0 HE3 MET A 5 -14.947 -11.271 -13.358 1.00 0.00 H new ATOM 77 N LYS A 6 -11.846 -8.674 -8.492 1.00 0.00 N ATOM 78 CA LYS A 6 -12.450 -8.993 -7.210 1.00 0.00 C ATOM 79 C LYS A 6 -12.117 -7.886 -6.206 1.00 0.00 C ATOM 80 O LYS A 6 -10.990 -7.802 -5.721 1.00 0.00 O ATOM 81 CB LYS A 6 -12.025 -10.389 -6.750 1.00 0.00 C ATOM 82 CG LYS A 6 -13.036 -10.971 -5.761 1.00 0.00 C ATOM 83 CD LYS A 6 -14.160 -11.705 -6.495 1.00 0.00 C ATOM 84 CE LYS A 6 -15.520 -11.389 -5.867 1.00 0.00 C ATOM 85 NZ LYS A 6 -15.979 -12.519 -5.027 1.00 0.00 N ATOM 0 H LYS A 6 -10.828 -8.609 -8.479 1.00 0.00 H new ATOM 0 HA LYS A 6 -13.536 -9.029 -7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.934 -11.048 -7.613 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -11.042 -10.338 -6.283 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -12.531 -11.658 -5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -13.456 -10.171 -5.152 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -14.164 -11.415 -7.546 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -13.980 -12.780 -6.462 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -15.447 -10.485 -5.262 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -16.251 -11.190 -6.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -16.903 -12.288 -4.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -16.068 -13.373 -5.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -15.289 -12.690 -4.268 1.00 0.00 H new ATOM 99 N ASN A 7 -13.118 -7.067 -5.924 1.00 0.00 N ATOM 100 CA ASN A 7 -12.946 -5.970 -4.987 1.00 0.00 C ATOM 101 C ASN A 7 -13.917 -6.147 -3.817 1.00 0.00 C ATOM 102 O ASN A 7 -15.073 -6.518 -4.016 1.00 0.00 O ATOM 103 CB ASN A 7 -13.246 -4.625 -5.651 1.00 0.00 C ATOM 104 CG ASN A 7 -14.755 -4.412 -5.802 1.00 0.00 C ATOM 105 OD1 ASN A 7 -15.263 -3.529 -4.948 1.00 0.00 O flip ATOM 106 ND2 ASN A 7 -15.412 -5.012 -6.638 1.00 0.00 N flip ATOM 0 H ASN A 7 -14.052 -7.141 -6.328 1.00 0.00 H new ATOM 0 HA ASN A 7 -11.911 -5.979 -4.644 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.819 -3.818 -5.055 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.770 -4.585 -6.631 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.957 -5.677 -7.263 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -16.416 -4.848 -6.711 1.00 0.00 H new ATOM 113 N LEU A 8 -13.411 -5.873 -2.624 1.00 0.00 N ATOM 114 CA LEU A 8 -14.218 -5.998 -1.423 1.00 0.00 C ATOM 115 C LEU A 8 -15.249 -4.867 -1.385 1.00 0.00 C ATOM 116 O LEU A 8 -15.456 -4.179 -2.385 1.00 0.00 O ATOM 117 CB LEU A 8 -13.326 -6.056 -0.180 1.00 0.00 C ATOM 118 CG LEU A 8 -12.615 -4.757 0.198 1.00 0.00 C ATOM 119 CD1 LEU A 8 -13.584 -3.774 0.861 1.00 0.00 C ATOM 120 CD2 LEU A 8 -11.392 -5.034 1.072 1.00 0.00 C ATOM 0 H LEU A 8 -12.452 -5.565 -2.463 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.772 -6.936 -1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -13.936 -6.372 0.666 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.572 -6.828 -0.335 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.255 -4.287 -0.717 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -13.053 -2.858 1.120 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.394 -3.540 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.996 -4.223 1.765 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.905 -4.092 1.326 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.705 -5.539 1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -10.692 -5.669 0.528 1.00 0.00 H new ATOM 132 N SER A 9 -15.868 -4.710 -0.225 1.00 0.00 N ATOM 133 CA SER A 9 -16.871 -3.674 -0.046 1.00 0.00 C ATOM 134 C SER A 9 -16.339 -2.336 -0.558 1.00 0.00 C ATOM 135 O SER A 9 -16.334 -2.085 -1.763 1.00 0.00 O ATOM 136 CB SER A 9 -17.281 -3.555 1.423 1.00 0.00 C ATOM 137 OG SER A 9 -17.926 -2.313 1.698 1.00 0.00 O ATOM 0 H SER A 9 -15.695 -5.283 0.601 1.00 0.00 H new ATOM 0 HA SER A 9 -17.755 -3.950 -0.622 1.00 0.00 H new ATOM 0 HB2 SER A 9 -17.950 -4.376 1.680 1.00 0.00 H new ATOM 0 HB3 SER A 9 -16.398 -3.653 2.055 1.00 0.00 H new ATOM 0 HG SER A 9 -18.174 -2.276 2.645 1.00 0.00 H new ATOM 143 N ASN A 10 -15.902 -1.510 0.382 1.00 0.00 N ATOM 144 CA ASN A 10 -15.367 -0.201 0.039 1.00 0.00 C ATOM 145 C ASN A 10 -13.968 -0.054 0.641 1.00 0.00 C ATOM 146 O ASN A 10 -13.096 0.576 0.045 1.00 0.00 O ATOM 147 CB ASN A 10 -16.246 0.916 0.601 1.00 0.00 C ATOM 148 CG ASN A 10 -17.176 1.478 -0.476 1.00 0.00 C ATOM 149 OD1 ASN A 10 -17.320 0.930 -1.555 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.799 2.599 -0.122 1.00 0.00 N ATOM 0 H ASN A 10 -15.907 -1.721 1.380 1.00 0.00 H new ATOM 0 HA ASN A 10 -15.336 -0.122 -1.048 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.837 0.534 1.433 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.617 1.714 0.996 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.443 3.052 -0.771 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.633 3.006 0.798 1.00 0.00 H new ATOM 157 N ASN A 11 -13.800 -0.642 1.816 1.00 0.00 N ATOM 158 CA ASN A 11 -12.523 -0.584 2.506 1.00 0.00 C ATOM 159 C ASN A 11 -11.397 -0.460 1.476 1.00 0.00 C ATOM 160 O ASN A 11 -10.423 0.258 1.699 1.00 0.00 O ATOM 161 CB ASN A 11 -12.278 -1.854 3.322 1.00 0.00 C ATOM 162 CG ASN A 11 -13.599 -2.531 3.691 1.00 0.00 C ATOM 163 OD1 ASN A 11 -14.619 -1.892 3.894 1.00 0.00 O ATOM 164 ND2 ASN A 11 -13.526 -3.856 3.768 1.00 0.00 N ATOM 0 H ASN A 11 -14.527 -1.161 2.308 1.00 0.00 H new ATOM 0 HA ASN A 11 -12.541 0.276 3.175 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.659 -2.545 2.750 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -11.726 -1.607 4.229 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -14.355 -4.399 4.009 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -12.641 -4.329 3.586 1.00 0.00 H new ATOM 171 N PHE A 12 -11.569 -1.170 0.371 1.00 0.00 N ATOM 172 CA PHE A 12 -10.579 -1.149 -0.694 1.00 0.00 C ATOM 173 C PHE A 12 -11.099 -0.380 -1.908 1.00 0.00 C ATOM 174 O PHE A 12 -10.548 0.660 -2.272 1.00 0.00 O ATOM 175 CB PHE A 12 -10.325 -2.603 -1.097 1.00 0.00 C ATOM 176 CG PHE A 12 -8.848 -2.936 -1.324 1.00 0.00 C ATOM 177 CD1 PHE A 12 -7.942 -2.722 -0.332 1.00 0.00 C ATOM 178 CD2 PHE A 12 -8.443 -3.445 -2.519 1.00 0.00 C ATOM 179 CE1 PHE A 12 -6.572 -3.031 -0.544 1.00 0.00 C ATOM 180 CE2 PHE A 12 -7.073 -3.753 -2.730 1.00 0.00 C ATOM 181 CZ PHE A 12 -6.167 -3.539 -1.738 1.00 0.00 C ATOM 0 H PHE A 12 -12.378 -1.763 0.189 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.669 -0.658 -0.348 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -10.720 -3.259 -0.321 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.880 -2.819 -2.010 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -8.264 -2.317 0.616 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -9.163 -3.615 -3.306 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.852 -2.862 0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.750 -4.157 -3.678 1.00 0.00 H new ATOM 0 HZ PHE A 12 -5.125 -3.773 -1.899 1.00 0.00 H new ATOM 191 N GLY A 13 -12.152 -0.918 -2.505 1.00 0.00 N ATOM 192 CA GLY A 13 -12.752 -0.294 -3.671 1.00 0.00 C ATOM 193 C GLY A 13 -12.880 1.219 -3.481 1.00 0.00 C ATOM 194 O GLY A 13 -12.677 1.986 -4.420 1.00 0.00 O ATOM 0 H GLY A 13 -12.605 -1.780 -2.202 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -12.145 -0.503 -4.552 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.736 -0.726 -3.852 1.00 0.00 H new ATOM 198 N LYS A 14 -13.217 1.602 -2.259 1.00 0.00 N ATOM 199 CA LYS A 14 -13.374 3.009 -1.931 1.00 0.00 C ATOM 200 C LYS A 14 -11.997 3.674 -1.882 1.00 0.00 C ATOM 201 O LYS A 14 -11.778 4.704 -2.516 1.00 0.00 O ATOM 202 CB LYS A 14 -14.183 3.173 -0.643 1.00 0.00 C ATOM 203 CG LYS A 14 -14.380 4.651 -0.303 1.00 0.00 C ATOM 204 CD LYS A 14 -13.506 5.063 0.883 1.00 0.00 C ATOM 205 CE LYS A 14 -14.271 4.926 2.201 1.00 0.00 C ATOM 206 NZ LYS A 14 -13.981 6.073 3.089 1.00 0.00 N ATOM 0 H LYS A 14 -13.386 0.962 -1.483 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.947 3.519 -2.706 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -15.154 2.690 -0.755 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.671 2.672 0.179 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.134 5.263 -1.171 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.428 4.837 -0.069 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.610 4.443 0.912 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.176 6.094 0.755 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.342 4.873 2.003 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.992 3.996 2.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.508 5.965 3.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -12.962 6.106 3.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.269 6.956 2.621 1.00 0.00 H new ATOM 220 N ALA A 15 -11.104 3.057 -1.121 1.00 0.00 N ATOM 221 CA ALA A 15 -9.755 3.576 -0.981 1.00 0.00 C ATOM 222 C ALA A 15 -9.123 3.725 -2.367 1.00 0.00 C ATOM 223 O ALA A 15 -8.455 4.720 -2.645 1.00 0.00 O ATOM 224 CB ALA A 15 -8.945 2.653 -0.068 1.00 0.00 C ATOM 0 H ALA A 15 -11.289 2.203 -0.595 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.770 4.563 -0.518 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.932 3.042 0.037 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.419 2.604 0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.906 1.654 -0.502 1.00 0.00 H new ATOM 230 N MET A 16 -9.356 2.721 -3.200 1.00 0.00 N ATOM 231 CA MET A 16 -8.819 2.729 -4.549 1.00 0.00 C ATOM 232 C MET A 16 -9.410 3.877 -5.369 1.00 0.00 C ATOM 233 O MET A 16 -8.677 4.626 -6.012 1.00 0.00 O ATOM 234 CB MET A 16 -9.137 1.396 -5.232 1.00 0.00 C ATOM 235 CG MET A 16 -7.854 0.634 -5.572 1.00 0.00 C ATOM 236 SD MET A 16 -7.983 -1.056 -5.015 1.00 0.00 S ATOM 237 CE MET A 16 -8.331 -0.789 -3.285 1.00 0.00 C ATOM 0 H MET A 16 -9.910 1.897 -2.966 1.00 0.00 H new ATOM 0 HA MET A 16 -7.740 2.870 -4.490 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.763 0.788 -4.578 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.709 1.577 -6.142 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.681 0.659 -6.648 1.00 0.00 H new ATOM 0 HG3 MET A 16 -6.998 1.117 -5.100 1.00 0.00 H new ATOM 0 HE1 MET A 16 -7.569 -1.281 -2.680 1.00 0.00 H new ATOM 0 HE2 MET A 16 -8.327 0.280 -3.074 1.00 0.00 H new ATOM 0 HE3 MET A 16 -9.310 -1.203 -3.043 1.00 0.00 H new ATOM 247 N ASP A 17 -10.731 3.977 -5.320 1.00 0.00 N ATOM 248 CA ASP A 17 -11.429 5.022 -6.050 1.00 0.00 C ATOM 249 C ASP A 17 -11.070 6.384 -5.452 1.00 0.00 C ATOM 250 O ASP A 17 -10.856 7.350 -6.184 1.00 0.00 O ATOM 251 CB ASP A 17 -12.945 4.846 -5.947 1.00 0.00 C ATOM 252 CG ASP A 17 -13.770 5.989 -6.542 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.456 7.151 -6.206 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.697 5.675 -7.319 1.00 0.00 O ATOM 0 H ASP A 17 -11.335 3.352 -4.787 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.128 4.961 -7.096 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.223 3.918 -6.447 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.212 4.734 -4.896 1.00 0.00 H new ATOM 259 N GLN A 18 -11.013 6.418 -4.129 1.00 0.00 N ATOM 260 CA GLN A 18 -10.684 7.645 -3.426 1.00 0.00 C ATOM 261 C GLN A 18 -9.218 8.015 -3.662 1.00 0.00 C ATOM 262 O GLN A 18 -8.894 9.185 -3.859 1.00 0.00 O ATOM 263 CB GLN A 18 -10.982 7.517 -1.930 1.00 0.00 C ATOM 264 CG GLN A 18 -12.374 8.056 -1.600 1.00 0.00 C ATOM 265 CD GLN A 18 -12.534 8.280 -0.096 1.00 0.00 C ATOM 266 OE1 GLN A 18 -11.573 8.419 0.643 1.00 0.00 O ATOM 267 NE2 GLN A 18 -13.798 8.308 0.317 1.00 0.00 N ATOM 0 H GLN A 18 -11.189 5.615 -3.526 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.309 8.446 -3.821 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.913 6.471 -1.630 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.232 8.063 -1.358 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.540 8.994 -2.130 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.132 7.354 -1.949 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.557 8.185 -0.354 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.009 8.453 1.304 1.00 0.00 H new ATOM 276 N CYS A 19 -8.371 6.996 -3.635 1.00 0.00 N ATOM 277 CA CYS A 19 -6.948 7.200 -3.846 1.00 0.00 C ATOM 278 C CYS A 19 -6.749 7.800 -5.240 1.00 0.00 C ATOM 279 O CYS A 19 -5.891 8.660 -5.431 1.00 0.00 O ATOM 280 CB CYS A 19 -6.158 5.903 -3.665 1.00 0.00 C ATOM 281 SG CYS A 19 -5.603 5.574 -1.953 1.00 0.00 S ATOM 0 H CYS A 19 -8.643 6.027 -3.470 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.562 7.891 -3.096 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.775 5.069 -3.998 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.284 5.933 -4.316 1.00 0.00 H new ATOM 286 N LYS A 20 -7.557 7.322 -6.175 1.00 0.00 N ATOM 287 CA LYS A 20 -7.479 7.802 -7.545 1.00 0.00 C ATOM 288 C LYS A 20 -7.942 9.259 -7.597 1.00 0.00 C ATOM 289 O LYS A 20 -7.868 9.900 -8.644 1.00 0.00 O ATOM 290 CB LYS A 20 -8.258 6.875 -8.480 1.00 0.00 C ATOM 291 CG LYS A 20 -7.494 6.646 -9.786 1.00 0.00 C ATOM 292 CD LYS A 20 -8.389 5.982 -10.834 1.00 0.00 C ATOM 293 CE LYS A 20 -8.899 7.008 -11.848 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.289 6.696 -12.247 1.00 0.00 N ATOM 0 H LYS A 20 -8.268 6.609 -6.012 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.448 7.783 -7.899 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.436 5.920 -7.986 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.235 7.308 -8.697 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.125 7.598 -10.168 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.622 6.019 -9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.832 5.200 -11.351 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.234 5.500 -10.343 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.854 8.008 -11.416 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.254 7.011 -12.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.619 7.402 -12.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.322 5.750 -12.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.904 6.716 -11.408 1.00 0.00 H new ATOM 308 N ASP A 21 -8.408 9.741 -6.454 1.00 0.00 N ATOM 309 CA ASP A 21 -8.882 11.112 -6.357 1.00 0.00 C ATOM 310 C ASP A 21 -7.931 11.913 -5.469 1.00 0.00 C ATOM 311 O ASP A 21 -7.214 12.788 -5.952 1.00 0.00 O ATOM 312 CB ASP A 21 -10.276 11.167 -5.730 1.00 0.00 C ATOM 313 CG ASP A 21 -11.309 11.972 -6.522 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.341 11.794 -7.759 1.00 0.00 O ATOM 315 OD2 ASP A 21 -12.043 12.749 -5.874 1.00 0.00 O ATOM 0 H ASP A 21 -8.468 9.207 -5.587 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.922 11.529 -7.363 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.645 10.148 -5.611 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.192 11.595 -4.731 1.00 0.00 H new ATOM 320 N GLU A 22 -7.955 11.587 -4.186 1.00 0.00 N ATOM 321 CA GLU A 22 -7.103 12.267 -3.224 1.00 0.00 C ATOM 322 C GLU A 22 -5.682 12.400 -3.775 1.00 0.00 C ATOM 323 O GLU A 22 -5.070 13.462 -3.673 1.00 0.00 O ATOM 324 CB GLU A 22 -7.103 11.538 -1.879 1.00 0.00 C ATOM 325 CG GLU A 22 -6.981 10.026 -2.075 1.00 0.00 C ATOM 326 CD GLU A 22 -8.141 9.290 -1.403 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.180 9.949 -1.180 1.00 0.00 O ATOM 328 OE2 GLU A 22 -7.965 8.083 -1.127 1.00 0.00 O ATOM 0 H GLU A 22 -8.551 10.861 -3.789 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.503 13.267 -3.058 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.276 11.897 -1.267 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.022 11.765 -1.338 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.967 9.794 -3.140 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.035 9.677 -1.660 1.00 0.00 H new ATOM 335 N LEU A 23 -5.198 11.307 -4.347 1.00 0.00 N ATOM 336 CA LEU A 23 -3.860 11.288 -4.915 1.00 0.00 C ATOM 337 C LEU A 23 -3.950 11.497 -6.427 1.00 0.00 C ATOM 338 O LEU A 23 -2.939 11.731 -7.086 1.00 0.00 O ATOM 339 CB LEU A 23 -3.126 10.008 -4.513 1.00 0.00 C ATOM 340 CG LEU A 23 -3.495 9.422 -3.148 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.359 7.898 -3.151 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.673 10.071 -2.033 1.00 0.00 C ATOM 0 H LEU A 23 -5.709 10.428 -4.429 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.264 12.108 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.314 9.251 -5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.055 10.209 -4.522 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.542 9.650 -2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.627 7.507 -2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.024 7.475 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.329 7.625 -3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.955 9.637 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.612 9.895 -2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.866 11.144 -2.016 1.00 0.00 H new ATOM 354 N SER A 24 -5.171 11.406 -6.935 1.00 0.00 N ATOM 355 CA SER A 24 -5.406 11.581 -8.357 1.00 0.00 C ATOM 356 C SER A 24 -4.469 10.678 -9.158 1.00 0.00 C ATOM 357 O SER A 24 -4.261 10.893 -10.352 1.00 0.00 O ATOM 358 CB SER A 24 -5.215 13.043 -8.770 1.00 0.00 C ATOM 359 OG SER A 24 -6.404 13.808 -8.592 1.00 0.00 O ATOM 0 H SER A 24 -6.008 11.213 -6.385 1.00 0.00 H new ATOM 0 HA SER A 24 -6.438 11.302 -8.570 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.409 13.483 -8.183 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.908 13.087 -9.815 1.00 0.00 H new ATOM 0 HG SER A 24 -6.822 13.569 -7.739 1.00 0.00 H new ATOM 365 N LEU A 25 -3.927 9.683 -8.470 1.00 0.00 N ATOM 366 CA LEU A 25 -3.016 8.744 -9.103 1.00 0.00 C ATOM 367 C LEU A 25 -3.824 7.647 -9.799 1.00 0.00 C ATOM 368 O LEU A 25 -5.030 7.527 -9.585 1.00 0.00 O ATOM 369 CB LEU A 25 -2.005 8.211 -8.087 1.00 0.00 C ATOM 370 CG LEU A 25 -2.459 7.011 -7.252 1.00 0.00 C ATOM 371 CD1 LEU A 25 -3.947 7.115 -6.908 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.127 5.695 -7.958 1.00 0.00 C ATOM 0 H LEU A 25 -4.101 9.507 -7.481 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.427 9.244 -9.872 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.096 7.934 -8.621 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.741 9.022 -7.408 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.908 7.021 -6.312 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.245 6.250 -6.315 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.126 8.026 -6.337 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.532 7.143 -7.827 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.460 4.858 -7.344 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.634 5.661 -8.922 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.050 5.626 -8.112 1.00 0.00 H new ATOM 384 N PRO A 26 -3.110 6.852 -10.641 1.00 0.00 N ATOM 385 CA PRO A 26 -3.748 5.769 -11.370 1.00 0.00 C ATOM 386 C PRO A 26 -4.041 4.585 -10.447 1.00 0.00 C ATOM 387 O PRO A 26 -3.129 4.017 -9.849 1.00 0.00 O ATOM 388 CB PRO A 26 -2.777 5.424 -12.488 1.00 0.00 C ATOM 389 CG PRO A 26 -1.435 6.001 -12.071 1.00 0.00 C ATOM 390 CD PRO A 26 -1.680 6.964 -10.919 1.00 0.00 C ATOM 0 HA PRO A 26 -4.720 6.049 -11.776 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.711 4.345 -12.628 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.107 5.849 -13.436 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.755 5.205 -11.766 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -0.965 6.518 -12.908 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.085 6.697 -10.046 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.408 7.984 -11.191 1.00 0.00 H new ATOM 398 N ASP A 27 -5.320 4.249 -10.358 1.00 0.00 N ATOM 399 CA ASP A 27 -5.746 3.143 -9.517 1.00 0.00 C ATOM 400 C ASP A 27 -5.215 1.832 -10.099 1.00 0.00 C ATOM 401 O ASP A 27 -5.416 0.765 -9.520 1.00 0.00 O ATOM 402 CB ASP A 27 -7.272 3.051 -9.459 1.00 0.00 C ATOM 403 CG ASP A 27 -7.837 2.490 -8.153 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.309 2.885 -7.091 1.00 0.00 O ATOM 405 OD2 ASP A 27 -8.784 1.679 -8.247 1.00 0.00 O ATOM 0 H ASP A 27 -6.075 4.723 -10.854 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.357 3.313 -8.513 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.687 4.046 -9.619 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.615 2.426 -10.284 1.00 0.00 H new ATOM 410 N SER A 28 -4.548 1.954 -11.236 1.00 0.00 N ATOM 411 CA SER A 28 -3.986 0.791 -11.904 1.00 0.00 C ATOM 412 C SER A 28 -2.649 0.415 -11.263 1.00 0.00 C ATOM 413 O SER A 28 -2.351 -0.766 -11.086 1.00 0.00 O ATOM 414 CB SER A 28 -3.804 1.050 -13.401 1.00 0.00 C ATOM 415 OG SER A 28 -3.141 2.287 -13.652 1.00 0.00 O ATOM 0 H SER A 28 -4.383 2.840 -11.713 1.00 0.00 H new ATOM 0 HA SER A 28 -4.683 -0.040 -11.789 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.231 0.235 -13.843 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.779 1.055 -13.889 1.00 0.00 H new ATOM 0 HG SER A 28 -3.042 2.415 -14.619 1.00 0.00 H new ATOM 421 N VAL A 29 -1.879 1.441 -10.933 1.00 0.00 N ATOM 422 CA VAL A 29 -0.580 1.232 -10.315 1.00 0.00 C ATOM 423 C VAL A 29 -0.769 0.546 -8.960 1.00 0.00 C ATOM 424 O VAL A 29 0.045 -0.286 -8.564 1.00 0.00 O ATOM 425 CB VAL A 29 0.170 2.562 -10.212 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.449 3.143 -11.600 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.598 3.560 -9.343 1.00 0.00 C ATOM 0 H VAL A 29 -2.129 2.419 -11.082 1.00 0.00 H new ATOM 0 HA VAL A 29 0.034 0.574 -10.930 1.00 0.00 H new ATOM 0 HB VAL A 29 1.129 2.369 -9.731 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.983 4.088 -11.498 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.057 2.442 -12.172 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.494 3.313 -12.120 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.043 4.496 -9.287 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.578 3.745 -9.782 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.721 3.150 -8.340 1.00 0.00 H new ATOM 437 N VAL A 30 -1.847 0.922 -8.288 1.00 0.00 N ATOM 438 CA VAL A 30 -2.152 0.354 -6.986 1.00 0.00 C ATOM 439 C VAL A 30 -2.777 -1.031 -7.172 1.00 0.00 C ATOM 440 O VAL A 30 -2.600 -1.914 -6.334 1.00 0.00 O ATOM 441 CB VAL A 30 -3.043 1.310 -6.193 1.00 0.00 C ATOM 442 CG1 VAL A 30 -4.443 1.391 -6.808 1.00 0.00 C ATOM 443 CG2 VAL A 30 -3.114 0.901 -4.720 1.00 0.00 C ATOM 0 H VAL A 30 -2.520 1.613 -8.621 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.240 0.224 -6.404 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.596 2.303 -6.243 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.057 2.078 -6.225 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.369 1.752 -7.834 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.900 0.402 -6.803 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.754 1.598 -4.179 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.525 -0.105 -4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.113 0.919 -4.289 1.00 0.00 H new ATOM 453 N ALA A 31 -3.494 -1.177 -8.277 1.00 0.00 N ATOM 454 CA ALA A 31 -4.147 -2.438 -8.584 1.00 0.00 C ATOM 455 C ALA A 31 -3.086 -3.484 -8.934 1.00 0.00 C ATOM 456 O ALA A 31 -3.362 -4.683 -8.918 1.00 0.00 O ATOM 457 CB ALA A 31 -5.155 -2.230 -9.717 1.00 0.00 C ATOM 0 H ALA A 31 -3.637 -0.443 -8.970 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.700 -2.804 -7.719 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.644 -3.176 -9.947 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -5.903 -1.500 -9.409 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.636 -1.865 -10.603 1.00 0.00 H new ATOM 463 N ASP A 32 -1.895 -2.992 -9.240 1.00 0.00 N ATOM 464 CA ASP A 32 -0.791 -3.870 -9.592 1.00 0.00 C ATOM 465 C ASP A 32 -0.222 -4.502 -8.321 1.00 0.00 C ATOM 466 O ASP A 32 0.244 -5.640 -8.344 1.00 0.00 O ATOM 467 CB ASP A 32 0.334 -3.091 -10.278 1.00 0.00 C ATOM 468 CG ASP A 32 1.425 -3.956 -10.911 1.00 0.00 C ATOM 469 OD1 ASP A 32 1.293 -5.197 -10.818 1.00 0.00 O ATOM 470 OD2 ASP A 32 2.368 -3.359 -11.474 1.00 0.00 O ATOM 0 H ASP A 32 -1.670 -1.997 -9.252 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.170 -4.632 -10.273 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.101 -2.458 -11.051 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.796 -2.428 -9.546 1.00 0.00 H new ATOM 475 N LEU A 33 -0.278 -3.737 -7.241 1.00 0.00 N ATOM 476 CA LEU A 33 0.226 -4.207 -5.962 1.00 0.00 C ATOM 477 C LEU A 33 -0.371 -5.582 -5.658 1.00 0.00 C ATOM 478 O LEU A 33 0.317 -6.462 -5.143 1.00 0.00 O ATOM 479 CB LEU A 33 -0.033 -3.168 -4.869 1.00 0.00 C ATOM 480 CG LEU A 33 1.057 -2.112 -4.675 1.00 0.00 C ATOM 481 CD1 LEU A 33 0.800 -1.284 -3.414 1.00 0.00 C ATOM 482 CD2 LEU A 33 2.446 -2.753 -4.666 1.00 0.00 C ATOM 0 H LEU A 33 -0.665 -2.794 -7.225 1.00 0.00 H new ATOM 0 HA LEU A 33 1.308 -4.331 -6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.969 -2.658 -5.095 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.176 -3.692 -3.924 1.00 0.00 H new ATOM 0 HG LEU A 33 1.024 -1.427 -5.522 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.589 -0.541 -3.300 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.163 -0.780 -3.499 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.790 -1.940 -2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.202 -1.981 -4.527 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.509 -3.474 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.618 -3.262 -5.614 1.00 0.00 H new ATOM 494 N TYR A 34 -1.646 -5.726 -5.991 1.00 0.00 N ATOM 495 CA TYR A 34 -2.344 -6.978 -5.760 1.00 0.00 C ATOM 496 C TYR A 34 -1.913 -8.041 -6.774 1.00 0.00 C ATOM 497 O TYR A 34 -2.078 -9.236 -6.534 1.00 0.00 O ATOM 498 CB TYR A 34 -3.830 -6.676 -5.958 1.00 0.00 C ATOM 499 CG TYR A 34 -4.253 -5.289 -5.471 1.00 0.00 C ATOM 500 CD1 TYR A 34 -3.621 -4.716 -4.386 1.00 0.00 C ATOM 501 CD2 TYR A 34 -5.268 -4.610 -6.116 1.00 0.00 C ATOM 502 CE1 TYR A 34 -4.018 -3.410 -3.927 1.00 0.00 C ATOM 503 CE2 TYR A 34 -5.666 -3.304 -5.658 1.00 0.00 C ATOM 504 CZ TYR A 34 -5.022 -2.769 -4.586 1.00 0.00 C ATOM 505 OH TYR A 34 -5.398 -1.535 -4.153 1.00 0.00 O ATOM 0 H TYR A 34 -2.213 -4.995 -6.419 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.124 -7.361 -4.763 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.071 -6.767 -7.017 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.417 -7.429 -5.432 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -2.828 -5.247 -3.881 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -5.763 -5.059 -6.964 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -3.531 -2.950 -3.080 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -6.457 -2.762 -6.154 1.00 0.00 H new ATOM 0 HH TYR A 34 -6.091 -1.177 -4.746 1.00 0.00 H new ATOM 515 N ASN A 35 -1.368 -7.566 -7.885 1.00 0.00 N ATOM 516 CA ASN A 35 -0.912 -8.460 -8.935 1.00 0.00 C ATOM 517 C ASN A 35 0.290 -9.262 -8.432 1.00 0.00 C ATOM 518 O ASN A 35 0.172 -10.452 -8.147 1.00 0.00 O ATOM 519 CB ASN A 35 -0.473 -7.677 -10.173 1.00 0.00 C ATOM 520 CG ASN A 35 -1.163 -8.206 -11.432 1.00 0.00 C ATOM 521 OD1 ASN A 35 -1.147 -9.390 -11.728 1.00 0.00 O ATOM 522 ND2 ASN A 35 -1.767 -7.267 -12.154 1.00 0.00 N ATOM 0 H ASN A 35 -1.232 -6.574 -8.080 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.740 -9.118 -9.199 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -0.709 -6.621 -10.042 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.608 -7.750 -10.289 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.256 -7.520 -13.013 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.742 -6.294 -11.849 1.00 0.00 H new ATOM 529 N PHE A 36 1.420 -8.574 -8.336 1.00 0.00 N ATOM 530 CA PHE A 36 2.642 -9.207 -7.872 1.00 0.00 C ATOM 531 C PHE A 36 3.871 -8.391 -8.277 1.00 0.00 C ATOM 532 O PHE A 36 4.954 -8.943 -8.460 1.00 0.00 O ATOM 533 CB PHE A 36 2.715 -10.583 -8.537 1.00 0.00 C ATOM 534 CG PHE A 36 2.481 -11.752 -7.579 1.00 0.00 C ATOM 535 CD1 PHE A 36 1.710 -11.580 -6.471 1.00 0.00 C ATOM 536 CD2 PHE A 36 3.042 -12.964 -7.835 1.00 0.00 C ATOM 537 CE1 PHE A 36 1.492 -12.665 -5.582 1.00 0.00 C ATOM 538 CE2 PHE A 36 2.824 -14.049 -6.946 1.00 0.00 C ATOM 539 CZ PHE A 36 2.053 -13.877 -5.838 1.00 0.00 C ATOM 0 H PHE A 36 1.514 -7.586 -8.572 1.00 0.00 H new ATOM 0 HA PHE A 36 2.632 -9.282 -6.785 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.975 -10.628 -9.336 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.694 -10.699 -9.002 1.00 0.00 H new ATOM 0 HD1 PHE A 36 1.264 -10.618 -6.268 1.00 0.00 H new ATOM 0 HD2 PHE A 36 3.653 -13.101 -8.715 1.00 0.00 H new ATOM 0 HE1 PHE A 36 0.881 -12.528 -4.702 1.00 0.00 H new ATOM 0 HE2 PHE A 36 3.270 -15.011 -7.149 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.887 -14.703 -5.162 1.00 0.00 H new ATOM 549 N TRP A 37 3.660 -7.089 -8.405 1.00 0.00 N ATOM 550 CA TRP A 37 4.736 -6.191 -8.786 1.00 0.00 C ATOM 551 C TRP A 37 5.336 -5.602 -7.507 1.00 0.00 C ATOM 552 O TRP A 37 5.890 -4.505 -7.526 1.00 0.00 O ATOM 553 CB TRP A 37 4.240 -5.121 -9.761 1.00 0.00 C ATOM 554 CG TRP A 37 3.518 -3.954 -9.087 1.00 0.00 C ATOM 555 CD1 TRP A 37 2.579 -4.003 -8.133 1.00 0.00 C ATOM 556 CD2 TRP A 37 3.714 -2.549 -9.359 1.00 0.00 C ATOM 557 NE1 TRP A 37 2.158 -2.740 -7.770 1.00 0.00 N ATOM 558 CE2 TRP A 37 2.870 -1.827 -8.539 1.00 0.00 C ATOM 559 CE3 TRP A 37 4.577 -1.911 -10.268 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.807 -0.430 -8.546 1.00 0.00 C ATOM 561 CZ3 TRP A 37 4.501 -0.513 -10.261 1.00 0.00 C ATOM 562 CH2 TRP A 37 3.657 0.228 -9.443 1.00 0.00 C ATOM 0 H TRP A 37 2.760 -6.635 -8.252 1.00 0.00 H new ATOM 0 HA TRP A 37 5.517 -6.732 -9.321 1.00 0.00 H new ATOM 0 HB2 TRP A 37 5.090 -4.734 -10.323 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.566 -5.585 -10.482 1.00 0.00 H new ATOM 0 HD1 TRP A 37 2.199 -4.917 -7.702 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.454 -2.517 -7.067 1.00 0.00 H new ATOM 0 HE3 TRP A 37 5.245 -2.456 -10.919 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.138 0.112 -7.894 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.144 0.028 -10.940 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.657 1.307 -9.499 1.00 0.00 H new ATOM 573 N LYS A 38 5.203 -6.358 -6.427 1.00 0.00 N ATOM 574 CA LYS A 38 5.724 -5.924 -5.142 1.00 0.00 C ATOM 575 C LYS A 38 7.120 -5.329 -5.337 1.00 0.00 C ATOM 576 O LYS A 38 7.385 -4.207 -4.911 1.00 0.00 O ATOM 577 CB LYS A 38 5.681 -7.072 -4.131 1.00 0.00 C ATOM 578 CG LYS A 38 4.252 -7.320 -3.643 1.00 0.00 C ATOM 579 CD LYS A 38 4.148 -8.655 -2.904 1.00 0.00 C ATOM 580 CE LYS A 38 2.780 -9.302 -3.128 1.00 0.00 C ATOM 581 NZ LYS A 38 1.715 -8.491 -2.498 1.00 0.00 N ATOM 0 H LYS A 38 4.742 -7.268 -6.415 1.00 0.00 H new ATOM 0 HA LYS A 38 5.097 -5.137 -4.723 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.075 -7.979 -4.589 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.323 -6.838 -3.282 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.944 -6.510 -2.982 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.568 -7.316 -4.492 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.933 -9.328 -3.249 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.309 -8.498 -1.838 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.588 -9.399 -4.196 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.774 -10.309 -2.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.799 -8.970 -2.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.919 -8.377 -1.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.677 -7.556 -2.951 1.00 0.00 H new ATOM 595 N ASP A 39 7.976 -6.109 -5.982 1.00 0.00 N ATOM 596 CA ASP A 39 9.338 -5.673 -6.239 1.00 0.00 C ATOM 597 C ASP A 39 9.317 -4.248 -6.794 1.00 0.00 C ATOM 598 O ASP A 39 10.204 -3.449 -6.498 1.00 0.00 O ATOM 599 CB ASP A 39 10.020 -6.573 -7.271 1.00 0.00 C ATOM 600 CG ASP A 39 11.509 -6.300 -7.484 1.00 0.00 C ATOM 601 OD1 ASP A 39 12.076 -5.559 -6.652 1.00 0.00 O ATOM 602 OD2 ASP A 39 12.049 -6.840 -8.475 1.00 0.00 O ATOM 0 H ASP A 39 7.752 -7.040 -6.334 1.00 0.00 H new ATOM 0 HA ASP A 39 9.889 -5.720 -5.300 1.00 0.00 H new ATOM 0 HB2 ASP A 39 9.897 -7.611 -6.963 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.505 -6.461 -8.225 1.00 0.00 H new ATOM 607 N ASP A 40 8.295 -3.973 -7.590 1.00 0.00 N ATOM 608 CA ASP A 40 8.147 -2.658 -8.190 1.00 0.00 C ATOM 609 C ASP A 40 7.343 -1.759 -7.247 1.00 0.00 C ATOM 610 O ASP A 40 6.158 -1.517 -7.474 1.00 0.00 O ATOM 611 CB ASP A 40 7.393 -2.740 -9.520 1.00 0.00 C ATOM 612 CG ASP A 40 7.286 -1.421 -10.286 1.00 0.00 C ATOM 613 OD1 ASP A 40 7.011 -0.398 -9.621 1.00 0.00 O ATOM 614 OD2 ASP A 40 7.484 -1.463 -11.520 1.00 0.00 O ATOM 0 H ASP A 40 7.561 -4.638 -7.834 1.00 0.00 H new ATOM 0 HA ASP A 40 9.144 -2.254 -8.364 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.889 -3.473 -10.157 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.387 -3.113 -9.328 1.00 0.00 H new ATOM 619 N TYR A 41 8.020 -1.289 -6.210 1.00 0.00 N ATOM 620 CA TYR A 41 7.383 -0.423 -5.232 1.00 0.00 C ATOM 621 C TYR A 41 7.676 1.049 -5.531 1.00 0.00 C ATOM 622 O TYR A 41 8.193 1.378 -6.597 1.00 0.00 O ATOM 623 CB TYR A 41 8.001 -0.788 -3.880 1.00 0.00 C ATOM 624 CG TYR A 41 7.258 -1.899 -3.136 1.00 0.00 C ATOM 625 CD1 TYR A 41 5.909 -1.769 -2.871 1.00 0.00 C ATOM 626 CD2 TYR A 41 7.934 -3.031 -2.731 1.00 0.00 C ATOM 627 CE1 TYR A 41 5.209 -2.814 -2.171 1.00 0.00 C ATOM 628 CE2 TYR A 41 7.234 -4.076 -2.029 1.00 0.00 C ATOM 629 CZ TYR A 41 5.906 -3.916 -1.784 1.00 0.00 C ATOM 630 OH TYR A 41 5.245 -4.904 -1.124 1.00 0.00 O ATOM 0 H TYR A 41 9.003 -1.491 -6.025 1.00 0.00 H new ATOM 0 HA TYR A 41 6.301 -0.556 -5.248 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.034 -1.097 -4.036 1.00 0.00 H new ATOM 0 HB3 TYR A 41 8.026 0.102 -3.251 1.00 0.00 H new ATOM 0 HD1 TYR A 41 5.379 -0.883 -3.189 1.00 0.00 H new ATOM 0 HD2 TYR A 41 8.989 -3.134 -2.940 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.154 -2.725 -1.958 1.00 0.00 H new ATOM 0 HE2 TYR A 41 7.752 -4.966 -1.705 1.00 0.00 H new ATOM 0 HH TYR A 41 5.791 -5.718 -1.121 1.00 0.00 H new ATOM 640 N VAL A 42 7.330 1.894 -4.571 1.00 0.00 N ATOM 641 CA VAL A 42 7.549 3.324 -4.719 1.00 0.00 C ATOM 642 C VAL A 42 8.810 3.559 -5.554 1.00 0.00 C ATOM 643 O VAL A 42 8.866 4.497 -6.347 1.00 0.00 O ATOM 644 CB VAL A 42 7.611 3.988 -3.342 1.00 0.00 C ATOM 645 CG1 VAL A 42 6.281 3.840 -2.602 1.00 0.00 C ATOM 646 CG2 VAL A 42 8.768 3.423 -2.513 1.00 0.00 C ATOM 0 H VAL A 42 6.900 1.617 -3.689 1.00 0.00 H new ATOM 0 HA VAL A 42 6.717 3.785 -5.251 1.00 0.00 H new ATOM 0 HB VAL A 42 7.794 5.052 -3.490 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.352 4.321 -1.626 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.488 4.312 -3.182 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.054 2.782 -2.470 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.790 3.912 -1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.629 2.350 -2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.710 3.604 -3.031 1.00 0.00 H new ATOM 656 N MET A 43 9.788 2.691 -5.347 1.00 0.00 N ATOM 657 CA MET A 43 11.045 2.792 -6.071 1.00 0.00 C ATOM 658 C MET A 43 10.806 3.186 -7.530 1.00 0.00 C ATOM 659 O MET A 43 11.669 3.794 -8.161 1.00 0.00 O ATOM 660 CB MET A 43 11.775 1.449 -6.017 1.00 0.00 C ATOM 661 CG MET A 43 13.203 1.579 -6.553 1.00 0.00 C ATOM 662 SD MET A 43 13.293 0.928 -8.212 1.00 0.00 S ATOM 663 CE MET A 43 14.700 1.837 -8.826 1.00 0.00 C ATOM 0 H MET A 43 9.737 1.914 -4.688 1.00 0.00 H new ATOM 0 HA MET A 43 11.653 3.564 -5.600 1.00 0.00 H new ATOM 0 HB2 MET A 43 11.800 1.086 -4.990 1.00 0.00 H new ATOM 0 HB3 MET A 43 11.229 0.710 -6.603 1.00 0.00 H new ATOM 0 HG2 MET A 43 13.509 2.625 -6.547 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.894 1.041 -5.904 1.00 0.00 H new ATOM 0 HE1 MET A 43 14.897 1.549 -9.859 1.00 0.00 H new ATOM 0 HE2 MET A 43 14.491 2.906 -8.781 1.00 0.00 H new ATOM 0 HE3 MET A 43 15.574 1.612 -8.214 1.00 0.00 H new ATOM 673 N THR A 44 9.631 2.824 -8.022 1.00 0.00 N ATOM 674 CA THR A 44 9.267 3.132 -9.395 1.00 0.00 C ATOM 675 C THR A 44 8.016 4.011 -9.432 1.00 0.00 C ATOM 676 O THR A 44 7.995 5.040 -10.107 1.00 0.00 O ATOM 677 CB THR A 44 9.103 1.810 -10.149 1.00 0.00 C ATOM 678 OG1 THR A 44 10.421 1.499 -10.594 1.00 0.00 O ATOM 679 CG2 THR A 44 8.301 1.969 -11.442 1.00 0.00 C ATOM 0 H THR A 44 8.918 2.320 -7.495 1.00 0.00 H new ATOM 0 HA THR A 44 10.047 3.711 -9.890 1.00 0.00 H new ATOM 0 HB THR A 44 8.610 1.083 -9.504 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.408 0.655 -11.091 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.214 1.002 -11.938 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.306 2.348 -11.209 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.811 2.671 -12.102 1.00 0.00 H new ATOM 687 N ASP A 45 7.003 3.575 -8.696 1.00 0.00 N ATOM 688 CA ASP A 45 5.752 4.311 -8.635 1.00 0.00 C ATOM 689 C ASP A 45 5.413 4.612 -7.174 1.00 0.00 C ATOM 690 O ASP A 45 4.876 3.758 -6.469 1.00 0.00 O ATOM 691 CB ASP A 45 4.603 3.492 -9.229 1.00 0.00 C ATOM 692 CG ASP A 45 3.543 4.309 -9.969 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.853 4.756 -11.095 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.445 4.467 -9.392 1.00 0.00 O ATOM 0 H ASP A 45 7.024 2.722 -8.137 1.00 0.00 H new ATOM 0 HA ASP A 45 5.873 5.231 -9.207 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.019 2.756 -9.917 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.118 2.938 -8.425 1.00 0.00 H new ATOM 699 N ARG A 46 5.740 5.828 -6.763 1.00 0.00 N ATOM 700 CA ARG A 46 5.476 6.252 -5.397 1.00 0.00 C ATOM 701 C ARG A 46 3.972 6.227 -5.116 1.00 0.00 C ATOM 702 O ARG A 46 3.547 5.821 -4.036 1.00 0.00 O ATOM 703 CB ARG A 46 6.011 7.664 -5.146 1.00 0.00 C ATOM 704 CG ARG A 46 5.511 8.210 -3.808 1.00 0.00 C ATOM 705 CD ARG A 46 4.686 9.482 -4.009 1.00 0.00 C ATOM 706 NE ARG A 46 5.582 10.630 -4.280 1.00 0.00 N ATOM 707 CZ ARG A 46 5.248 11.909 -4.069 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.037 12.215 -3.584 1.00 0.00 N ATOM 709 NH2 ARG A 46 6.125 12.885 -4.344 1.00 0.00 N ATOM 0 H ARG A 46 6.185 6.533 -7.350 1.00 0.00 H new ATOM 0 HA ARG A 46 5.986 5.558 -4.729 1.00 0.00 H new ATOM 0 HB2 ARG A 46 7.101 7.650 -5.153 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.696 8.325 -5.953 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.906 7.455 -3.307 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.360 8.422 -3.158 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.992 9.348 -4.839 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.086 9.680 -3.121 1.00 0.00 H new ATOM 0 HE ARG A 46 6.512 10.434 -4.651 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.369 11.473 -3.375 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.783 13.190 -3.423 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.047 12.653 -4.714 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.870 13.860 -4.183 1.00 0.00 H new ATOM 723 N LEU A 47 3.209 6.666 -6.105 1.00 0.00 N ATOM 724 CA LEU A 47 1.762 6.700 -5.977 1.00 0.00 C ATOM 725 C LEU A 47 1.274 5.362 -5.418 1.00 0.00 C ATOM 726 O LEU A 47 0.419 5.329 -4.533 1.00 0.00 O ATOM 727 CB LEU A 47 1.114 7.082 -7.309 1.00 0.00 C ATOM 728 CG LEU A 47 1.784 8.223 -8.077 1.00 0.00 C ATOM 729 CD1 LEU A 47 2.383 9.253 -7.117 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.824 7.685 -9.062 1.00 0.00 C ATOM 0 H LEU A 47 3.566 7.002 -7.000 1.00 0.00 H new ATOM 0 HA LEU A 47 1.460 7.472 -5.270 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.098 6.200 -7.949 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.076 7.358 -7.120 1.00 0.00 H new ATOM 0 HG LEU A 47 1.020 8.735 -8.663 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.853 10.053 -7.689 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.594 9.669 -6.491 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.130 8.771 -6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.285 8.517 -9.595 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.590 7.134 -8.517 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.339 7.021 -9.777 1.00 0.00 H new ATOM 742 N ALA A 48 1.837 4.290 -5.955 1.00 0.00 N ATOM 743 CA ALA A 48 1.470 2.954 -5.522 1.00 0.00 C ATOM 744 C ALA A 48 1.670 2.840 -4.009 1.00 0.00 C ATOM 745 O ALA A 48 0.942 2.111 -3.336 1.00 0.00 O ATOM 746 CB ALA A 48 2.290 1.921 -6.297 1.00 0.00 C ATOM 0 H ALA A 48 2.546 4.320 -6.688 1.00 0.00 H new ATOM 0 HA ALA A 48 0.418 2.759 -5.732 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.014 0.918 -5.971 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.090 2.024 -7.364 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.351 2.084 -6.109 1.00 0.00 H new ATOM 752 N GLY A 49 2.658 3.572 -3.519 1.00 0.00 N ATOM 753 CA GLY A 49 2.964 3.563 -2.098 1.00 0.00 C ATOM 754 C GLY A 49 2.037 4.511 -1.333 1.00 0.00 C ATOM 755 O GLY A 49 1.743 4.284 -0.161 1.00 0.00 O ATOM 0 H GLY A 49 3.258 4.176 -4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.860 2.551 -1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.001 3.859 -1.944 1.00 0.00 H new ATOM 759 N CYS A 50 1.606 5.553 -2.028 1.00 0.00 N ATOM 760 CA CYS A 50 0.720 6.538 -1.428 1.00 0.00 C ATOM 761 C CYS A 50 -0.701 5.968 -1.427 1.00 0.00 C ATOM 762 O CYS A 50 -1.406 6.054 -0.422 1.00 0.00 O ATOM 763 CB CYS A 50 0.796 7.882 -2.154 1.00 0.00 C ATOM 764 SG CYS A 50 1.846 9.138 -1.336 1.00 0.00 S ATOM 0 H CYS A 50 1.853 5.737 -3.000 1.00 0.00 H new ATOM 0 HA CYS A 50 1.031 6.736 -0.402 1.00 0.00 H new ATOM 0 HB2 CYS A 50 1.174 7.713 -3.162 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.213 8.282 -2.255 1.00 0.00 H new ATOM 769 N ALA A 51 -1.075 5.398 -2.562 1.00 0.00 N ATOM 770 CA ALA A 51 -2.398 4.815 -2.704 1.00 0.00 C ATOM 771 C ALA A 51 -2.607 3.761 -1.615 1.00 0.00 C ATOM 772 O ALA A 51 -3.639 3.750 -0.947 1.00 0.00 O ATOM 773 CB ALA A 51 -2.553 4.234 -4.112 1.00 0.00 C ATOM 0 H ALA A 51 -0.486 5.327 -3.392 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.167 5.577 -2.578 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.546 3.797 -4.218 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.425 5.027 -4.849 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.798 3.464 -4.273 1.00 0.00 H new ATOM 779 N ILE A 52 -1.609 2.901 -1.469 1.00 0.00 N ATOM 780 CA ILE A 52 -1.669 1.847 -0.471 1.00 0.00 C ATOM 781 C ILE A 52 -1.772 2.473 0.921 1.00 0.00 C ATOM 782 O ILE A 52 -2.497 1.973 1.780 1.00 0.00 O ATOM 783 CB ILE A 52 -0.485 0.890 -0.628 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.653 -0.341 0.262 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.840 1.610 -0.369 1.00 0.00 C ATOM 786 CD1 ILE A 52 -2.119 -0.775 0.328 1.00 0.00 C ATOM 0 H ILE A 52 -0.754 2.913 -2.026 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.562 1.239 -0.615 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.464 0.539 -1.660 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.045 -1.159 -0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.290 -0.121 1.266 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.665 0.907 -0.487 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.955 2.428 -1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.845 2.009 0.645 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -2.210 -1.653 0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.721 0.036 0.738 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.472 -1.018 -0.674 1.00 0.00 H new ATOM 798 N ASN A 53 -1.034 3.559 1.103 1.00 0.00 N ATOM 799 CA ASN A 53 -1.033 4.260 2.376 1.00 0.00 C ATOM 800 C ASN A 53 -2.455 4.727 2.697 1.00 0.00 C ATOM 801 O ASN A 53 -2.928 4.558 3.821 1.00 0.00 O ATOM 802 CB ASN A 53 -0.130 5.494 2.326 1.00 0.00 C ATOM 803 CG ASN A 53 1.109 5.302 3.202 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.623 4.208 3.366 1.00 0.00 O ATOM 805 ND2 ASN A 53 1.558 6.425 3.756 1.00 0.00 N ATOM 0 H ASN A 53 -0.432 3.971 0.389 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.663 3.574 3.138 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.174 5.685 1.297 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.685 6.369 2.662 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.380 6.403 4.360 1.00 0.00 H new ATOM 0 HD22 ASN A 53 1.080 7.308 3.577 1.00 0.00 H new ATOM 812 N CYS A 54 -3.094 5.306 1.693 1.00 0.00 N ATOM 813 CA CYS A 54 -4.452 5.799 1.854 1.00 0.00 C ATOM 814 C CYS A 54 -5.377 4.599 2.059 1.00 0.00 C ATOM 815 O CYS A 54 -6.483 4.743 2.581 1.00 0.00 O ATOM 816 CB CYS A 54 -4.886 6.659 0.666 1.00 0.00 C ATOM 817 SG CYS A 54 -6.275 5.974 -0.310 1.00 0.00 S ATOM 0 H CYS A 54 -2.697 5.445 0.764 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.505 6.450 2.727 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.170 7.645 1.034 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.031 6.800 0.005 1.00 0.00 H new ATOM 822 N LEU A 55 -4.892 3.439 1.638 1.00 0.00 N ATOM 823 CA LEU A 55 -5.663 2.215 1.768 1.00 0.00 C ATOM 824 C LEU A 55 -6.102 2.046 3.224 1.00 0.00 C ATOM 825 O LEU A 55 -7.191 1.542 3.493 1.00 0.00 O ATOM 826 CB LEU A 55 -4.873 1.023 1.223 1.00 0.00 C ATOM 827 CG LEU A 55 -5.703 -0.160 0.724 1.00 0.00 C ATOM 828 CD1 LEU A 55 -6.605 -0.705 1.832 1.00 0.00 C ATOM 829 CD2 LEU A 55 -6.498 0.217 -0.528 1.00 0.00 C ATOM 0 H LEU A 55 -3.975 3.322 1.207 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.569 2.271 1.165 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.246 1.373 0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.204 0.667 2.007 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.019 -0.961 0.443 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.184 -1.546 1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.992 -1.038 2.670 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.283 0.079 2.168 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.080 -0.642 -0.862 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.171 1.043 -0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.811 0.519 -1.318 1.00 0.00 H new ATOM 841 N ALA A 56 -5.233 2.477 4.125 1.00 0.00 N ATOM 842 CA ALA A 56 -5.517 2.380 5.547 1.00 0.00 C ATOM 843 C ALA A 56 -6.580 3.414 5.921 1.00 0.00 C ATOM 844 O ALA A 56 -7.135 3.368 7.018 1.00 0.00 O ATOM 845 CB ALA A 56 -4.221 2.563 6.341 1.00 0.00 C ATOM 0 H ALA A 56 -4.331 2.895 3.898 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.913 1.395 5.793 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.434 2.490 7.407 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.509 1.787 6.060 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.795 3.542 6.122 1.00 0.00 H new ATOM 851 N THR A 57 -6.833 4.321 4.989 1.00 0.00 N ATOM 852 CA THR A 57 -7.819 5.364 5.208 1.00 0.00 C ATOM 853 C THR A 57 -8.688 5.030 6.423 1.00 0.00 C ATOM 854 O THR A 57 -8.720 5.785 7.392 1.00 0.00 O ATOM 855 CB THR A 57 -8.621 5.534 3.915 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.837 6.146 4.339 1.00 0.00 O ATOM 857 CG2 THR A 57 -9.065 4.196 3.322 1.00 0.00 C ATOM 0 H THR A 57 -6.372 4.355 4.080 1.00 0.00 H new ATOM 0 HA THR A 57 -7.343 6.317 5.441 1.00 0.00 H new ATOM 0 HB THR A 57 -8.020 6.074 3.183 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.417 6.294 3.563 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.630 4.373 2.407 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.188 3.589 3.096 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.694 3.670 4.040 1.00 0.00 H new ATOM 865 N LYS A 58 -9.371 3.900 6.328 1.00 0.00 N ATOM 866 CA LYS A 58 -10.238 3.457 7.406 1.00 0.00 C ATOM 867 C LYS A 58 -9.641 2.206 8.055 1.00 0.00 C ATOM 868 O LYS A 58 -9.704 1.117 7.487 1.00 0.00 O ATOM 869 CB LYS A 58 -11.669 3.263 6.901 1.00 0.00 C ATOM 870 CG LYS A 58 -12.375 4.608 6.721 1.00 0.00 C ATOM 871 CD LYS A 58 -13.310 4.897 7.898 1.00 0.00 C ATOM 872 CE LYS A 58 -14.037 6.229 7.706 1.00 0.00 C ATOM 873 NZ LYS A 58 -13.744 7.145 8.830 1.00 0.00 N ATOM 0 H LYS A 58 -9.342 3.277 5.521 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.300 4.221 8.181 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.654 2.727 5.952 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.227 2.647 7.606 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.634 5.403 6.636 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.945 4.603 5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -14.038 4.092 7.995 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.737 4.922 8.825 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.728 6.687 6.766 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -15.111 6.058 7.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -14.245 8.045 8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -14.060 6.713 9.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.720 7.322 8.875 1.00 0.00 H new ATOM 887 N LEU A 59 -9.074 2.404 9.236 1.00 0.00 N ATOM 888 CA LEU A 59 -8.465 1.305 9.967 1.00 0.00 C ATOM 889 C LEU A 59 -9.562 0.384 10.499 1.00 0.00 C ATOM 890 O LEU A 59 -9.314 -0.792 10.767 1.00 0.00 O ATOM 891 CB LEU A 59 -7.530 1.840 11.054 1.00 0.00 C ATOM 892 CG LEU A 59 -6.782 3.132 10.721 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.798 3.500 11.834 1.00 0.00 C ATOM 894 CD2 LEU A 59 -6.092 3.029 9.359 1.00 0.00 C ATOM 0 H LEU A 59 -9.023 3.308 9.705 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.839 0.706 9.306 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -8.115 2.005 11.959 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.796 1.068 11.286 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.510 3.940 10.655 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.280 4.422 11.571 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -6.342 3.643 12.768 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.071 2.698 11.957 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.567 3.960 9.146 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.378 2.205 9.374 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.839 2.848 8.586 1.00 0.00 H new ATOM 906 N ASP A 60 -10.752 0.949 10.637 1.00 0.00 N ATOM 907 CA ASP A 60 -11.889 0.191 11.132 1.00 0.00 C ATOM 908 C ASP A 60 -12.195 -0.954 10.164 1.00 0.00 C ATOM 909 O ASP A 60 -12.613 -2.031 10.583 1.00 0.00 O ATOM 910 CB ASP A 60 -13.137 1.072 11.233 1.00 0.00 C ATOM 911 CG ASP A 60 -13.095 2.127 12.339 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.087 2.866 12.382 1.00 0.00 O ATOM 913 OD2 ASP A 60 -14.072 2.173 13.117 1.00 0.00 O ATOM 0 H ASP A 60 -10.954 1.924 10.415 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.635 -0.189 12.121 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -13.287 1.575 10.278 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.004 0.431 11.395 1.00 0.00 H new ATOM 918 N VAL A 61 -11.975 -0.679 8.886 1.00 0.00 N ATOM 919 CA VAL A 61 -12.221 -1.671 7.855 1.00 0.00 C ATOM 920 C VAL A 61 -10.959 -2.513 7.650 1.00 0.00 C ATOM 921 O VAL A 61 -11.041 -3.726 7.458 1.00 0.00 O ATOM 922 CB VAL A 61 -12.698 -0.987 6.572 1.00 0.00 C ATOM 923 CG1 VAL A 61 -14.032 -0.274 6.795 1.00 0.00 C ATOM 924 CG2 VAL A 61 -11.639 -0.016 6.043 1.00 0.00 C ATOM 0 H VAL A 61 -11.629 0.217 8.542 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.018 -2.349 8.161 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.853 -1.759 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -14.349 0.204 5.868 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.785 -0.999 7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.915 0.482 7.571 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.002 0.457 5.131 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.439 0.749 6.794 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -10.720 -0.562 5.828 1.00 0.00 H new ATOM 934 N VAL A 62 -9.821 -1.836 7.699 1.00 0.00 N ATOM 935 CA VAL A 62 -8.545 -2.506 7.521 1.00 0.00 C ATOM 936 C VAL A 62 -8.315 -3.474 8.683 1.00 0.00 C ATOM 937 O VAL A 62 -7.886 -4.607 8.476 1.00 0.00 O ATOM 938 CB VAL A 62 -7.426 -1.471 7.374 1.00 0.00 C ATOM 939 CG1 VAL A 62 -6.201 -1.867 8.201 1.00 0.00 C ATOM 940 CG2 VAL A 62 -7.055 -1.269 5.904 1.00 0.00 C ATOM 0 H VAL A 62 -9.757 -0.831 7.859 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.548 -3.095 6.604 1.00 0.00 H new ATOM 0 HB VAL A 62 -7.796 -0.521 7.758 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.421 -1.115 8.079 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.478 -1.934 9.253 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.830 -2.834 7.861 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -6.258 -0.529 5.828 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -6.714 -2.214 5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.928 -0.920 5.353 1.00 0.00 H new ATOM 950 N ASP A 63 -8.610 -2.991 9.881 1.00 0.00 N ATOM 951 CA ASP A 63 -8.441 -3.798 11.077 1.00 0.00 C ATOM 952 C ASP A 63 -9.737 -3.776 11.890 1.00 0.00 C ATOM 953 O ASP A 63 -10.043 -2.783 12.549 1.00 0.00 O ATOM 954 CB ASP A 63 -7.319 -3.248 11.960 1.00 0.00 C ATOM 955 CG ASP A 63 -7.333 -1.730 12.152 1.00 0.00 C ATOM 956 OD1 ASP A 63 -8.232 -1.259 12.881 1.00 0.00 O ATOM 957 OD2 ASP A 63 -6.445 -1.075 11.566 1.00 0.00 O ATOM 0 H ASP A 63 -8.965 -2.050 10.049 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.190 -4.812 10.766 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.381 -3.724 12.939 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.361 -3.536 11.526 1.00 0.00 H new ATOM 962 N PRO A 64 -10.483 -4.910 11.813 1.00 0.00 N ATOM 963 CA PRO A 64 -11.739 -5.029 12.533 1.00 0.00 C ATOM 964 C PRO A 64 -11.495 -5.249 14.028 1.00 0.00 C ATOM 965 O PRO A 64 -12.177 -4.661 14.865 1.00 0.00 O ATOM 966 CB PRO A 64 -12.464 -6.190 11.872 1.00 0.00 C ATOM 967 CG PRO A 64 -11.398 -6.971 11.120 1.00 0.00 C ATOM 968 CD PRO A 64 -10.153 -6.104 11.041 1.00 0.00 C ATOM 0 HA PRO A 64 -12.340 -4.121 12.482 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.957 -6.817 12.615 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.238 -5.832 11.193 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -11.179 -7.908 11.632 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.748 -7.229 10.120 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -9.286 -6.617 11.457 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.910 -5.853 10.008 1.00 0.00 H new ATOM 976 N ASP A 65 -10.520 -6.099 14.317 1.00 0.00 N ATOM 977 CA ASP A 65 -10.178 -6.405 15.695 1.00 0.00 C ATOM 978 C ASP A 65 -8.813 -5.796 16.024 1.00 0.00 C ATOM 979 O ASP A 65 -8.289 -5.995 17.119 1.00 0.00 O ATOM 980 CB ASP A 65 -10.089 -7.914 15.919 1.00 0.00 C ATOM 981 CG ASP A 65 -11.197 -8.507 16.792 1.00 0.00 C ATOM 982 OD1 ASP A 65 -12.335 -8.596 16.281 1.00 0.00 O ATOM 983 OD2 ASP A 65 -10.883 -8.853 17.951 1.00 0.00 O ATOM 0 H ASP A 65 -9.956 -6.585 13.620 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.957 -5.992 16.335 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.107 -8.411 14.949 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.126 -8.142 16.377 1.00 0.00 H new ATOM 988 N GLY A 66 -8.277 -5.067 15.056 1.00 0.00 N ATOM 989 CA GLY A 66 -6.982 -4.429 15.228 1.00 0.00 C ATOM 990 C GLY A 66 -5.870 -5.266 14.595 1.00 0.00 C ATOM 991 O GLY A 66 -4.822 -5.473 15.204 1.00 0.00 O ATOM 0 H GLY A 66 -8.716 -4.904 14.150 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.998 -3.438 14.775 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.779 -4.291 16.290 1.00 0.00 H new ATOM 995 N ASN A 67 -6.136 -5.724 13.381 1.00 0.00 N ATOM 996 CA ASN A 67 -5.171 -6.534 12.659 1.00 0.00 C ATOM 997 C ASN A 67 -3.813 -5.826 12.659 1.00 0.00 C ATOM 998 O ASN A 67 -2.777 -6.462 12.835 1.00 0.00 O ATOM 999 CB ASN A 67 -5.597 -6.734 11.203 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.647 -7.690 10.478 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -3.473 -7.149 10.166 1.00 0.00 O flip ATOM 1002 ND2 ASN A 67 -4.958 -8.841 10.220 1.00 0.00 N flip ATOM 0 H ASN A 67 -7.007 -5.549 12.879 1.00 0.00 H new ATOM 0 HA ASN A 67 -5.110 -7.503 13.154 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.612 -7.130 11.169 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.612 -5.773 10.690 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -5.877 -9.193 10.488 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.299 -9.451 9.736 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.867 -4.517 12.462 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.656 -3.715 12.438 1.00 0.00 C ATOM 1011 C LEU A 68 -3.033 -2.231 12.419 1.00 0.00 C ATOM 1012 O LEU A 68 -4.207 -1.884 12.533 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.757 -4.135 11.274 1.00 0.00 C ATOM 1014 CG LEU A 68 -2.036 -3.455 9.931 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.391 -2.747 9.946 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.898 -2.507 9.551 1.00 0.00 C ATOM 0 H LEU A 68 -4.730 -3.992 12.318 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.069 -3.885 13.341 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.722 -3.937 11.551 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.850 -5.213 11.139 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.084 -4.225 9.161 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.564 -2.272 8.980 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.179 -3.474 10.140 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.397 -1.989 10.729 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.121 -2.037 8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.794 -1.739 10.317 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.033 -3.069 9.472 1.00 0.00 H new ATOM 1028 N HIS A 69 -2.012 -1.397 12.275 1.00 0.00 N ATOM 1029 CA HIS A 69 -2.222 0.040 12.240 1.00 0.00 C ATOM 1030 C HIS A 69 -1.200 0.686 11.301 1.00 0.00 C ATOM 1031 O HIS A 69 0.005 0.557 11.508 1.00 0.00 O ATOM 1032 CB HIS A 69 -2.184 0.630 13.651 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.410 0.323 14.479 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.511 -0.797 15.284 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -4.585 1.004 14.616 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.697 -0.783 15.874 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -5.361 0.334 15.458 1.00 0.00 N ATOM 0 H HIS A 69 -1.039 -1.689 12.181 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.215 0.255 11.845 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -1.304 0.250 14.169 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -2.069 1.711 13.578 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -4.840 1.931 14.123 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -5.072 -1.525 16.563 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -6.300 0.609 15.747 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.720 1.364 10.288 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.868 2.029 9.317 1.00 0.00 C ATOM 1048 C HIS A 70 0.250 2.777 10.043 1.00 0.00 C ATOM 1049 O HIS A 70 0.020 3.387 11.085 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.692 2.937 8.403 1.00 0.00 C ATOM 1051 CG HIS A 70 -0.926 3.478 7.220 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.119 4.754 6.722 1.00 0.00 N ATOM 1053 CD2 HIS A 70 0.038 2.904 6.445 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -0.304 4.929 5.691 1.00 0.00 C ATOM 1055 NE2 HIS A 70 0.411 3.780 5.521 1.00 0.00 N ATOM 0 H HIS A 70 -2.721 1.467 10.119 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.401 1.287 8.670 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.556 2.381 8.039 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -2.074 3.773 8.988 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.431 1.905 6.563 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.221 5.824 5.092 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.116 3.620 4.802 1.00 0.00 H new ATOM 1064 N GLY A 71 1.441 2.705 9.463 1.00 0.00 N ATOM 1065 CA GLY A 71 2.596 3.367 10.043 1.00 0.00 C ATOM 1066 C GLY A 71 3.194 2.535 11.179 1.00 0.00 C ATOM 1067 O GLY A 71 4.409 2.359 11.251 1.00 0.00 O ATOM 0 H GLY A 71 1.629 2.198 8.598 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.350 3.532 9.273 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.306 4.348 10.420 1.00 0.00 H new ATOM 1071 N ASN A 72 2.312 2.046 12.039 1.00 0.00 N ATOM 1072 CA ASN A 72 2.737 1.237 13.168 1.00 0.00 C ATOM 1073 C ASN A 72 1.993 -0.100 13.142 1.00 0.00 C ATOM 1074 O ASN A 72 1.048 -0.304 13.901 1.00 0.00 O ATOM 1075 CB ASN A 72 2.417 1.930 14.494 1.00 0.00 C ATOM 1076 CG ASN A 72 2.771 1.033 15.682 1.00 0.00 C ATOM 1077 OD1 ASN A 72 3.938 1.322 16.249 1.00 0.00 O flip ATOM 1078 ND2 ASN A 72 2.033 0.138 16.058 1.00 0.00 N flip ATOM 0 H ASN A 72 1.305 2.195 11.976 1.00 0.00 H new ATOM 0 HA ASN A 72 3.814 1.089 13.089 1.00 0.00 H new ATOM 0 HB2 ASN A 72 2.972 2.866 14.562 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.358 2.184 14.529 1.00 0.00 H new ATOM 0 HD21 ASN A 72 1.150 -0.030 15.577 1.00 0.00 H new ATOM 0 HD22 ASN A 72 2.299 -0.442 16.854 1.00 0.00 H new ATOM 1085 N ALA A 73 2.448 -0.975 12.258 1.00 0.00 N ATOM 1086 CA ALA A 73 1.837 -2.287 12.121 1.00 0.00 C ATOM 1087 C ALA A 73 1.996 -3.058 13.433 1.00 0.00 C ATOM 1088 O ALA A 73 3.091 -3.118 13.993 1.00 0.00 O ATOM 1089 CB ALA A 73 2.462 -3.022 10.934 1.00 0.00 C ATOM 0 H ALA A 73 3.232 -0.802 11.629 1.00 0.00 H new ATOM 0 HA ALA A 73 0.770 -2.193 11.920 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.003 -4.005 10.832 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.296 -2.448 10.022 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.533 -3.137 11.100 1.00 0.00 H new ATOM 1095 N LYS A 74 0.889 -3.628 13.886 1.00 0.00 N ATOM 1096 CA LYS A 74 0.893 -4.392 15.122 1.00 0.00 C ATOM 1097 C LYS A 74 1.857 -5.572 14.984 1.00 0.00 C ATOM 1098 O LYS A 74 2.368 -5.837 13.896 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.531 -4.802 15.502 1.00 0.00 C ATOM 1100 CG LYS A 74 -0.687 -4.896 17.021 1.00 0.00 C ATOM 1101 CD LYS A 74 -0.955 -6.338 17.458 1.00 0.00 C ATOM 1102 CE LYS A 74 -1.608 -6.381 18.840 1.00 0.00 C ATOM 1103 NZ LYS A 74 -3.080 -6.439 18.717 1.00 0.00 N ATOM 0 H LYS A 74 -0.017 -3.576 13.419 1.00 0.00 H new ATOM 0 HA LYS A 74 1.255 -3.780 15.948 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -1.241 -4.077 15.104 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.770 -5.764 15.048 1.00 0.00 H new ATOM 0 HG2 LYS A 74 0.217 -4.527 17.506 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -1.507 -4.256 17.346 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.603 -6.827 16.731 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.019 -6.896 17.477 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -1.249 -7.250 19.391 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.320 -5.499 19.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.507 -6.468 19.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -3.419 -5.597 18.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -3.351 -7.293 18.190 1.00 0.00 H new ATOM 1117 N ASP A 75 2.078 -6.249 16.101 1.00 0.00 N ATOM 1118 CA ASP A 75 2.971 -7.394 16.118 1.00 0.00 C ATOM 1119 C ASP A 75 2.308 -8.565 15.389 1.00 0.00 C ATOM 1120 O ASP A 75 2.879 -9.651 15.304 1.00 0.00 O ATOM 1121 CB ASP A 75 3.269 -7.839 17.552 1.00 0.00 C ATOM 1122 CG ASP A 75 3.814 -6.743 18.469 1.00 0.00 C ATOM 1123 OD1 ASP A 75 4.390 -5.777 17.921 1.00 0.00 O ATOM 1124 OD2 ASP A 75 3.644 -6.894 19.699 1.00 0.00 O ATOM 0 H ASP A 75 1.653 -6.026 17.001 1.00 0.00 H new ATOM 0 HA ASP A 75 3.901 -7.103 15.629 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.354 -8.237 17.991 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.989 -8.657 17.520 1.00 0.00 H new ATOM 1129 N PHE A 76 1.114 -8.302 14.879 1.00 0.00 N ATOM 1130 CA PHE A 76 0.368 -9.320 14.159 1.00 0.00 C ATOM 1131 C PHE A 76 0.454 -9.095 12.648 1.00 0.00 C ATOM 1132 O PHE A 76 0.387 -10.048 11.872 1.00 0.00 O ATOM 1133 CB PHE A 76 -1.094 -9.197 14.599 1.00 0.00 C ATOM 1134 CG PHE A 76 -1.383 -9.816 15.968 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -0.612 -9.492 17.039 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -2.416 -10.691 16.114 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -0.882 -10.065 18.310 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.686 -11.265 17.384 1.00 0.00 C ATOM 1139 CZ PHE A 76 -1.914 -10.940 18.456 1.00 0.00 C ATOM 0 H PHE A 76 0.645 -7.399 14.950 1.00 0.00 H new ATOM 0 HA PHE A 76 0.777 -10.307 14.377 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.369 -8.142 14.623 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.729 -9.675 13.853 1.00 0.00 H new ATOM 0 HD1 PHE A 76 0.207 -8.798 16.923 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.030 -10.948 15.264 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.269 -9.806 19.160 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.505 -11.960 17.499 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.120 -11.376 19.422 1.00 0.00 H new ATOM 1149 N ALA A 77 0.600 -7.832 12.277 1.00 0.00 N ATOM 1150 CA ALA A 77 0.695 -7.472 10.873 1.00 0.00 C ATOM 1151 C ALA A 77 1.846 -8.247 10.228 1.00 0.00 C ATOM 1152 O ALA A 77 1.620 -9.229 9.522 1.00 0.00 O ATOM 1153 CB ALA A 77 0.868 -5.957 10.745 1.00 0.00 C ATOM 0 H ALA A 77 0.655 -7.045 12.924 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.220 -7.742 10.345 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.939 -5.687 9.691 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.010 -5.454 11.191 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.778 -5.650 11.261 1.00 0.00 H new ATOM 1159 N MET A 78 3.056 -7.775 10.494 1.00 0.00 N ATOM 1160 CA MET A 78 4.242 -8.412 9.949 1.00 0.00 C ATOM 1161 C MET A 78 4.544 -9.725 10.674 1.00 0.00 C ATOM 1162 O MET A 78 5.697 -10.017 10.986 1.00 0.00 O ATOM 1163 CB MET A 78 5.438 -7.466 10.088 1.00 0.00 C ATOM 1164 CG MET A 78 6.012 -7.512 11.506 1.00 0.00 C ATOM 1165 SD MET A 78 4.794 -6.937 12.676 1.00 0.00 S ATOM 1166 CE MET A 78 4.306 -8.492 13.404 1.00 0.00 C ATOM 0 H MET A 78 3.240 -6.960 11.079 1.00 0.00 H new ATOM 0 HA MET A 78 4.061 -8.634 8.897 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.210 -7.743 9.370 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.131 -6.448 9.849 1.00 0.00 H new ATOM 0 HG2 MET A 78 6.313 -8.530 11.753 1.00 0.00 H new ATOM 0 HG3 MET A 78 6.907 -6.892 11.565 1.00 0.00 H new ATOM 0 HE1 MET A 78 3.224 -8.602 13.335 1.00 0.00 H new ATOM 0 HE2 MET A 78 4.789 -9.311 12.871 1.00 0.00 H new ATOM 0 HE3 MET A 78 4.607 -8.514 14.452 1.00 0.00 H new ATOM 1176 N LYS A 79 3.486 -10.482 10.923 1.00 0.00 N ATOM 1177 CA LYS A 79 3.621 -11.757 11.606 1.00 0.00 C ATOM 1178 C LYS A 79 2.671 -12.775 10.972 1.00 0.00 C ATOM 1179 O LYS A 79 3.079 -13.882 10.628 1.00 0.00 O ATOM 1180 CB LYS A 79 3.420 -11.582 13.113 1.00 0.00 C ATOM 1181 CG LYS A 79 4.730 -11.803 13.870 1.00 0.00 C ATOM 1182 CD LYS A 79 4.501 -12.646 15.127 1.00 0.00 C ATOM 1183 CE LYS A 79 5.145 -14.027 14.984 1.00 0.00 C ATOM 1184 NZ LYS A 79 6.251 -14.186 15.953 1.00 0.00 N ATOM 0 H LYS A 79 2.531 -10.237 10.664 1.00 0.00 H new ATOM 0 HA LYS A 79 4.632 -12.148 11.486 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.041 -10.581 13.319 1.00 0.00 H new ATOM 0 HB3 LYS A 79 2.668 -12.287 13.467 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.450 -12.300 13.220 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.161 -10.841 14.146 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.918 -12.134 15.994 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.431 -12.756 15.306 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.397 -14.802 15.147 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.521 -14.156 13.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.677 -15.128 15.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.973 -13.458 15.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.883 -14.084 16.920 1.00 0.00 H new ATOM 1198 N HIS A 80 1.418 -12.362 10.837 1.00 0.00 N ATOM 1199 CA HIS A 80 0.405 -13.224 10.252 1.00 0.00 C ATOM 1200 C HIS A 80 0.689 -13.409 8.760 1.00 0.00 C ATOM 1201 O HIS A 80 0.012 -14.183 8.086 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.998 -12.677 10.524 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.392 -11.523 9.632 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.507 -10.524 9.265 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.581 -11.223 9.036 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.149 -9.666 8.485 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.434 -10.099 8.345 1.00 0.00 N ATOM 0 H HIS A 80 1.082 -11.442 11.123 1.00 0.00 H new ATOM 0 HA HIS A 80 0.445 -14.208 10.720 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.721 -13.483 10.399 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.056 -12.355 11.564 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.471 -10.459 9.546 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.489 -11.802 9.113 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -0.727 -8.778 8.038 1.00 0.00 H new ATOM 1216 N GLY A 81 1.693 -12.685 8.287 1.00 0.00 N ATOM 1217 CA GLY A 81 2.077 -12.758 6.887 1.00 0.00 C ATOM 1218 C GLY A 81 3.582 -12.548 6.718 1.00 0.00 C ATOM 1219 O GLY A 81 4.042 -12.160 5.646 1.00 0.00 O ATOM 0 H GLY A 81 2.253 -12.044 8.849 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.794 -13.728 6.479 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.535 -12.003 6.318 1.00 0.00 H new ATOM 1223 N ALA A 82 4.308 -12.814 7.795 1.00 0.00 N ATOM 1224 CA ALA A 82 5.754 -12.658 7.779 1.00 0.00 C ATOM 1225 C ALA A 82 6.402 -13.895 8.405 1.00 0.00 C ATOM 1226 O ALA A 82 5.763 -14.615 9.169 1.00 0.00 O ATOM 1227 CB ALA A 82 6.135 -11.368 8.507 1.00 0.00 C ATOM 0 H ALA A 82 3.923 -13.136 8.683 1.00 0.00 H new ATOM 0 HA ALA A 82 6.121 -12.576 6.756 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.219 -11.250 8.496 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.672 -10.517 8.006 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.786 -11.416 9.539 1.00 0.00 H new ATOM 1233 N ASP A 83 7.663 -14.102 8.055 1.00 0.00 N ATOM 1234 CA ASP A 83 8.406 -15.239 8.572 1.00 0.00 C ATOM 1235 C ASP A 83 9.116 -14.833 9.866 1.00 0.00 C ATOM 1236 O ASP A 83 9.499 -13.677 10.031 1.00 0.00 O ATOM 1237 CB ASP A 83 9.469 -15.703 7.574 1.00 0.00 C ATOM 1238 CG ASP A 83 9.358 -15.087 6.178 1.00 0.00 C ATOM 1239 OD1 ASP A 83 8.520 -15.592 5.401 1.00 0.00 O ATOM 1240 OD2 ASP A 83 10.114 -14.125 5.920 1.00 0.00 O ATOM 0 H ASP A 83 8.189 -13.502 7.420 1.00 0.00 H new ATOM 0 HA ASP A 83 7.700 -16.051 8.749 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.453 -15.470 7.980 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.411 -16.788 7.482 1.00 0.00 H new ATOM 1245 N GLU A 84 9.269 -15.807 10.750 1.00 0.00 N ATOM 1246 CA GLU A 84 9.926 -15.566 12.023 1.00 0.00 C ATOM 1247 C GLU A 84 11.169 -14.699 11.823 1.00 0.00 C ATOM 1248 O GLU A 84 11.554 -13.943 12.714 1.00 0.00 O ATOM 1249 CB GLU A 84 10.283 -16.884 12.714 1.00 0.00 C ATOM 1250 CG GLU A 84 9.547 -17.020 14.049 1.00 0.00 C ATOM 1251 CD GLU A 84 9.804 -18.391 14.678 1.00 0.00 C ATOM 1252 OE1 GLU A 84 10.967 -18.629 15.064 1.00 0.00 O ATOM 1253 OE2 GLU A 84 8.827 -19.168 14.761 1.00 0.00 O ATOM 0 H GLU A 84 8.949 -16.765 10.610 1.00 0.00 H new ATOM 0 HA GLU A 84 9.233 -15.030 12.671 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.024 -17.721 12.065 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.359 -16.931 12.881 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.875 -16.236 14.731 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.477 -16.881 13.895 1.00 0.00 H new ATOM 1260 N THR A 85 11.764 -14.836 10.647 1.00 0.00 N ATOM 1261 CA THR A 85 12.956 -14.073 10.317 1.00 0.00 C ATOM 1262 C THR A 85 12.621 -12.587 10.191 1.00 0.00 C ATOM 1263 O THR A 85 13.408 -11.731 10.595 1.00 0.00 O ATOM 1264 CB THR A 85 13.564 -14.670 9.047 1.00 0.00 C ATOM 1265 OG1 THR A 85 14.938 -14.295 9.108 1.00 0.00 O ATOM 1266 CG2 THR A 85 13.048 -13.990 7.777 1.00 0.00 C ATOM 0 H THR A 85 11.443 -15.464 9.911 1.00 0.00 H new ATOM 0 HA THR A 85 13.699 -14.139 11.111 1.00 0.00 H new ATOM 0 HB THR A 85 13.342 -15.736 9.005 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.407 -14.644 8.322 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.510 -14.451 6.904 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.966 -14.104 7.717 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.300 -12.930 7.804 1.00 0.00 H new ATOM 1274 N MET A 86 11.450 -12.323 9.627 1.00 0.00 N ATOM 1275 CA MET A 86 11.000 -10.953 9.441 1.00 0.00 C ATOM 1276 C MET A 86 11.143 -10.150 10.734 1.00 0.00 C ATOM 1277 O MET A 86 11.505 -8.974 10.702 1.00 0.00 O ATOM 1278 CB MET A 86 9.536 -10.954 8.998 1.00 0.00 C ATOM 1279 CG MET A 86 8.635 -10.365 10.085 1.00 0.00 C ATOM 1280 SD MET A 86 8.156 -11.641 11.237 1.00 0.00 S ATOM 1281 CE MET A 86 7.679 -10.635 12.633 1.00 0.00 C ATOM 0 H MET A 86 10.800 -13.034 9.293 1.00 0.00 H new ATOM 0 HA MET A 86 11.620 -10.486 8.676 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.430 -10.376 8.080 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.221 -11.973 8.772 1.00 0.00 H new ATOM 0 HG2 MET A 86 9.159 -9.567 10.611 1.00 0.00 H new ATOM 0 HG3 MET A 86 7.749 -9.920 9.633 1.00 0.00 H new ATOM 0 HE1 MET A 86 8.023 -11.105 13.554 1.00 0.00 H new ATOM 0 HE2 MET A 86 8.129 -9.646 12.540 1.00 0.00 H new ATOM 0 HE3 MET A 86 6.594 -10.539 12.658 1.00 0.00 H new ATOM 1291 N ALA A 87 10.851 -10.815 11.842 1.00 0.00 N ATOM 1292 CA ALA A 87 10.943 -10.176 13.144 1.00 0.00 C ATOM 1293 C ALA A 87 12.277 -9.436 13.252 1.00 0.00 C ATOM 1294 O ALA A 87 12.318 -8.278 13.669 1.00 0.00 O ATOM 1295 CB ALA A 87 10.771 -11.227 14.242 1.00 0.00 C ATOM 0 H ALA A 87 10.551 -11.789 11.865 1.00 0.00 H new ATOM 0 HA ALA A 87 10.147 -9.441 13.267 1.00 0.00 H new ATOM 0 HB1 ALA A 87 10.840 -10.748 15.219 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.796 -11.704 14.140 1.00 0.00 H new ATOM 0 HB3 ALA A 87 11.554 -11.980 14.151 1.00 0.00 H new ATOM 1301 N GLN A 88 13.337 -10.131 12.868 1.00 0.00 N ATOM 1302 CA GLN A 88 14.670 -9.553 12.915 1.00 0.00 C ATOM 1303 C GLN A 88 15.029 -8.934 11.563 1.00 0.00 C ATOM 1304 O GLN A 88 15.431 -7.774 11.495 1.00 0.00 O ATOM 1305 CB GLN A 88 15.707 -10.600 13.332 1.00 0.00 C ATOM 1306 CG GLN A 88 16.996 -9.933 13.811 1.00 0.00 C ATOM 1307 CD GLN A 88 17.411 -8.802 12.866 1.00 0.00 C ATOM 1308 OE1 GLN A 88 17.648 -7.675 13.271 1.00 0.00 O ATOM 1309 NE2 GLN A 88 17.486 -9.164 11.590 1.00 0.00 N ATOM 0 H GLN A 88 13.300 -11.090 12.523 1.00 0.00 H new ATOM 0 HA GLN A 88 14.676 -8.763 13.666 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.299 -11.224 14.127 1.00 0.00 H new ATOM 0 HB3 GLN A 88 15.924 -11.257 12.490 1.00 0.00 H new ATOM 0 HG2 GLN A 88 16.853 -9.538 14.817 1.00 0.00 H new ATOM 0 HG3 GLN A 88 17.793 -10.674 13.870 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.274 -10.124 11.319 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.755 -8.482 10.881 1.00 0.00 H new ATOM 1318 N GLN A 89 14.869 -9.736 10.520 1.00 0.00 N ATOM 1319 CA GLN A 89 15.172 -9.281 9.174 1.00 0.00 C ATOM 1320 C GLN A 89 14.726 -7.829 8.992 1.00 0.00 C ATOM 1321 O GLN A 89 15.531 -6.969 8.637 1.00 0.00 O ATOM 1322 CB GLN A 89 14.520 -10.189 8.130 1.00 0.00 C ATOM 1323 CG GLN A 89 15.479 -11.301 7.694 1.00 0.00 C ATOM 1324 CD GLN A 89 15.359 -11.572 6.193 1.00 0.00 C ATOM 1325 OE1 GLN A 89 14.369 -12.092 5.707 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.422 -11.190 5.489 1.00 0.00 N ATOM 0 H GLN A 89 14.534 -10.697 10.580 1.00 0.00 H new ATOM 0 HA GLN A 89 16.251 -9.330 9.028 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.611 -10.628 8.542 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.224 -9.598 7.263 1.00 0.00 H new ATOM 0 HG2 GLN A 89 16.504 -11.018 7.935 1.00 0.00 H new ATOM 0 HG3 GLN A 89 15.261 -12.213 8.250 1.00 0.00 H new ATOM 0 HE21 GLN A 89 17.218 -10.760 5.960 1.00 0.00 H new ATOM 0 HE22 GLN A 89 16.440 -11.327 4.478 1.00 0.00 H new ATOM 1335 N LEU A 90 13.446 -7.600 9.244 1.00 0.00 N ATOM 1336 CA LEU A 90 12.883 -6.266 9.111 1.00 0.00 C ATOM 1337 C LEU A 90 13.797 -5.261 9.814 1.00 0.00 C ATOM 1338 O LEU A 90 14.138 -4.226 9.245 1.00 0.00 O ATOM 1339 CB LEU A 90 11.439 -6.242 9.616 1.00 0.00 C ATOM 1340 CG LEU A 90 10.367 -6.640 8.599 1.00 0.00 C ATOM 1341 CD1 LEU A 90 10.761 -7.920 7.861 1.00 0.00 C ATOM 1342 CD2 LEU A 90 8.995 -6.763 9.268 1.00 0.00 C ATOM 0 H LEU A 90 12.782 -8.315 9.540 1.00 0.00 H new ATOM 0 HA LEU A 90 12.834 -5.975 8.062 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.364 -6.910 10.474 1.00 0.00 H new ATOM 0 HB3 LEU A 90 11.217 -5.237 9.974 1.00 0.00 H new ATOM 0 HG LEU A 90 10.292 -5.848 7.854 1.00 0.00 H new ATOM 0 HD11 LEU A 90 9.982 -8.181 7.144 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.701 -7.761 7.333 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.880 -8.732 8.579 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.251 -7.047 8.523 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.037 -7.524 10.047 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.719 -5.806 9.710 1.00 0.00 H new ATOM 1354 N VAL A 91 14.167 -5.602 11.040 1.00 0.00 N ATOM 1355 CA VAL A 91 15.034 -4.741 11.826 1.00 0.00 C ATOM 1356 C VAL A 91 16.293 -4.417 11.018 1.00 0.00 C ATOM 1357 O VAL A 91 17.035 -3.498 11.360 1.00 0.00 O ATOM 1358 CB VAL A 91 15.343 -5.398 13.173 1.00 0.00 C ATOM 1359 CG1 VAL A 91 15.872 -4.372 14.176 1.00 0.00 C ATOM 1360 CG2 VAL A 91 14.111 -6.119 13.725 1.00 0.00 C ATOM 0 H VAL A 91 13.882 -6.462 11.508 1.00 0.00 H new ATOM 0 HA VAL A 91 14.536 -3.797 12.046 1.00 0.00 H new ATOM 0 HB VAL A 91 16.124 -6.141 13.012 1.00 0.00 H new ATOM 0 HG11 VAL A 91 16.083 -4.866 15.124 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.787 -3.923 13.789 1.00 0.00 H new ATOM 0 HG13 VAL A 91 15.123 -3.595 14.331 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.357 -6.578 14.683 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.301 -5.402 13.863 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.796 -6.891 13.023 1.00 0.00 H new ATOM 1370 N ASP A 92 16.493 -5.190 9.960 1.00 0.00 N ATOM 1371 CA ASP A 92 17.648 -4.997 9.100 1.00 0.00 C ATOM 1372 C ASP A 92 17.383 -3.826 8.153 1.00 0.00 C ATOM 1373 O ASP A 92 17.998 -2.768 8.278 1.00 0.00 O ATOM 1374 CB ASP A 92 17.918 -6.241 8.252 1.00 0.00 C ATOM 1375 CG ASP A 92 19.334 -6.342 7.683 1.00 0.00 C ATOM 1376 OD1 ASP A 92 20.186 -5.547 8.136 1.00 0.00 O ATOM 1377 OD2 ASP A 92 19.535 -7.213 6.809 1.00 0.00 O ATOM 0 H ASP A 92 15.875 -5.951 9.679 1.00 0.00 H new ATOM 0 HA ASP A 92 18.512 -4.800 9.735 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.723 -7.125 8.859 1.00 0.00 H new ATOM 0 HB3 ASP A 92 17.208 -6.259 7.425 1.00 0.00 H new ATOM 1382 N ILE A 93 16.466 -4.055 7.224 1.00 0.00 N ATOM 1383 CA ILE A 93 16.111 -3.033 6.254 1.00 0.00 C ATOM 1384 C ILE A 93 15.412 -1.877 6.971 1.00 0.00 C ATOM 1385 O ILE A 93 15.746 -0.713 6.753 1.00 0.00 O ATOM 1386 CB ILE A 93 15.288 -3.638 5.114 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.789 -3.513 5.395 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.703 -5.086 4.846 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.321 -4.599 6.365 1.00 0.00 C ATOM 0 H ILE A 93 15.958 -4.934 7.123 1.00 0.00 H new ATOM 0 HA ILE A 93 17.007 -2.624 5.787 1.00 0.00 H new ATOM 0 HB ILE A 93 15.494 -3.072 4.206 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.575 -2.530 5.813 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.233 -3.590 4.461 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.103 -5.492 4.032 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.757 -5.117 4.570 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.545 -5.682 5.745 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.252 -4.488 6.548 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.515 -5.581 5.933 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.862 -4.504 7.306 1.00 0.00 H new ATOM 1401 N ILE A 94 14.453 -2.237 7.812 1.00 0.00 N ATOM 1402 CA ILE A 94 13.704 -1.245 8.562 1.00 0.00 C ATOM 1403 C ILE A 94 14.680 -0.309 9.278 1.00 0.00 C ATOM 1404 O ILE A 94 14.339 0.833 9.585 1.00 0.00 O ATOM 1405 CB ILE A 94 12.705 -1.924 9.501 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.750 -2.832 8.721 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.953 -0.890 10.343 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.314 -2.674 9.222 1.00 0.00 C ATOM 0 H ILE A 94 14.178 -3.203 7.990 1.00 0.00 H new ATOM 0 HA ILE A 94 13.107 -0.630 7.888 1.00 0.00 H new ATOM 0 HB ILE A 94 13.261 -2.558 10.191 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.798 -2.590 7.659 1.00 0.00 H new ATOM 0 HG13 ILE A 94 12.063 -3.871 8.825 1.00 0.00 H new ATOM 0 HG21 ILE A 94 11.249 -1.399 11.002 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.665 -0.322 10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.409 -0.212 9.686 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.656 -3.329 8.652 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.266 -2.940 10.278 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.996 -1.639 9.094 1.00 0.00 H new ATOM 1420 N HIS A 95 15.875 -0.826 9.521 1.00 0.00 N ATOM 1421 CA HIS A 95 16.903 -0.051 10.194 1.00 0.00 C ATOM 1422 C HIS A 95 17.509 0.959 9.217 1.00 0.00 C ATOM 1423 O HIS A 95 17.910 2.051 9.615 1.00 0.00 O ATOM 1424 CB HIS A 95 17.952 -0.969 10.825 1.00 0.00 C ATOM 1425 CG HIS A 95 17.753 -1.209 12.302 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.807 -1.329 13.190 1.00 0.00 N ATOM 1427 CD2 HIS A 95 16.610 -1.347 13.036 1.00 0.00 C ATOM 1428 CE1 HIS A 95 18.310 -1.532 14.403 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.949 -1.543 14.304 1.00 0.00 N ATOM 0 H HIS A 95 16.154 -1.773 9.264 1.00 0.00 H new ATOM 0 HA HIS A 95 16.458 0.512 11.014 1.00 0.00 H new ATOM 0 HB2 HIS A 95 17.939 -1.928 10.307 1.00 0.00 H new ATOM 0 HB3 HIS A 95 18.940 -0.536 10.668 1.00 0.00 H new ATOM 0 HD2 HIS A 95 15.602 -1.304 12.650 1.00 0.00 H new ATOM 0 HE1 HIS A 95 18.882 -1.665 15.309 1.00 0.00 H new ATOM 0 HE2 HIS A 95 16.299 -1.680 15.078 1.00 0.00 H new ATOM 1438 N GLY A 96 17.553 0.557 7.956 1.00 0.00 N ATOM 1439 CA GLY A 96 18.104 1.412 6.917 1.00 0.00 C ATOM 1440 C GLY A 96 17.015 2.293 6.300 1.00 0.00 C ATOM 1441 O GLY A 96 17.308 3.354 5.752 1.00 0.00 O ATOM 0 H GLY A 96 17.217 -0.349 7.629 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.891 2.039 7.336 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.564 0.799 6.142 1.00 0.00 H new ATOM 1445 N CYS A 97 15.782 1.820 6.409 1.00 0.00 N ATOM 1446 CA CYS A 97 14.650 2.552 5.869 1.00 0.00 C ATOM 1447 C CYS A 97 14.144 3.515 6.943 1.00 0.00 C ATOM 1448 O CYS A 97 14.183 4.732 6.760 1.00 0.00 O ATOM 1449 CB CYS A 97 13.547 1.608 5.383 1.00 0.00 C ATOM 1450 SG CYS A 97 13.554 1.282 3.583 1.00 0.00 S ATOM 0 H CYS A 97 15.543 0.939 6.863 1.00 0.00 H new ATOM 0 HA CYS A 97 14.965 3.120 4.993 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.642 0.659 5.910 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.580 2.030 5.658 1.00 0.00 H new ATOM 1455 N GLU A 98 13.680 2.938 8.042 1.00 0.00 N ATOM 1456 CA GLU A 98 13.167 3.731 9.146 1.00 0.00 C ATOM 1457 C GLU A 98 14.108 4.900 9.442 1.00 0.00 C ATOM 1458 O GLU A 98 13.659 5.984 9.814 1.00 0.00 O ATOM 1459 CB GLU A 98 12.957 2.867 10.391 1.00 0.00 C ATOM 1460 CG GLU A 98 12.058 3.576 11.406 1.00 0.00 C ATOM 1461 CD GLU A 98 12.435 3.187 12.837 1.00 0.00 C ATOM 1462 OE1 GLU A 98 13.577 3.511 13.230 1.00 0.00 O ATOM 1463 OE2 GLU A 98 11.573 2.577 13.505 1.00 0.00 O ATOM 0 H GLU A 98 13.649 1.929 8.191 1.00 0.00 H new ATOM 0 HA GLU A 98 12.197 4.135 8.857 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.509 1.915 10.106 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.920 2.642 10.848 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.146 4.656 11.284 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.016 3.318 11.217 1.00 0.00 H new ATOM 1470 N LYS A 99 15.396 4.642 9.265 1.00 0.00 N ATOM 1471 CA LYS A 99 16.403 5.659 9.508 1.00 0.00 C ATOM 1472 C LYS A 99 16.367 6.688 8.376 1.00 0.00 C ATOM 1473 O LYS A 99 16.677 7.860 8.586 1.00 0.00 O ATOM 1474 CB LYS A 99 17.777 5.016 9.709 1.00 0.00 C ATOM 1475 CG LYS A 99 18.418 4.657 8.367 1.00 0.00 C ATOM 1476 CD LYS A 99 19.939 4.807 8.428 1.00 0.00 C ATOM 1477 CE LYS A 99 20.634 3.488 8.086 1.00 0.00 C ATOM 1478 NZ LYS A 99 22.088 3.590 8.333 1.00 0.00 N ATOM 0 H LYS A 99 15.764 3.742 8.956 1.00 0.00 H new ATOM 0 HA LYS A 99 16.188 6.194 10.433 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.426 5.701 10.254 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.676 4.118 10.319 1.00 0.00 H new ATOM 0 HG2 LYS A 99 18.161 3.632 8.100 1.00 0.00 H new ATOM 0 HG3 LYS A 99 18.017 5.301 7.584 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.260 5.582 7.732 1.00 0.00 H new ATOM 0 HD3 LYS A 99 20.236 5.131 9.425 1.00 0.00 H new ATOM 0 HE2 LYS A 99 20.213 2.682 8.687 1.00 0.00 H new ATOM 0 HE3 LYS A 99 20.453 3.235 7.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.545 2.686 8.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 22.488 4.346 7.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.255 3.810 9.336 1.00 0.00 H new ATOM 1492 N SER A 100 15.985 6.213 7.200 1.00 0.00 N ATOM 1493 CA SER A 100 15.903 7.077 6.034 1.00 0.00 C ATOM 1494 C SER A 100 14.466 7.565 5.844 1.00 0.00 C ATOM 1495 O SER A 100 14.203 8.421 5.001 1.00 0.00 O ATOM 1496 CB SER A 100 16.390 6.353 4.776 1.00 0.00 C ATOM 1497 OG SER A 100 17.454 7.051 4.138 1.00 0.00 O ATOM 0 H SER A 100 15.729 5.241 7.029 1.00 0.00 H new ATOM 0 HA SER A 100 16.552 7.937 6.199 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.722 5.349 5.041 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.560 6.240 4.078 1.00 0.00 H new ATOM 0 HG SER A 100 17.738 6.557 3.341 1.00 0.00 H new ATOM 1503 N ALA A 101 13.572 6.998 6.641 1.00 0.00 N ATOM 1504 CA ALA A 101 12.167 7.365 6.570 1.00 0.00 C ATOM 1505 C ALA A 101 11.741 7.990 7.900 1.00 0.00 C ATOM 1506 O ALA A 101 11.146 7.319 8.744 1.00 0.00 O ATOM 1507 CB ALA A 101 11.336 6.132 6.212 1.00 0.00 C ATOM 0 H ALA A 101 13.793 6.288 7.339 1.00 0.00 H new ATOM 0 HA ALA A 101 12.002 8.107 5.789 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.282 6.406 6.159 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.659 5.743 5.246 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.473 5.366 6.976 1.00 0.00 H new ATOM 1513 N PRO A 102 12.070 9.300 8.052 1.00 0.00 N ATOM 1514 CA PRO A 102 11.728 10.023 9.265 1.00 0.00 C ATOM 1515 C PRO A 102 10.235 10.358 9.301 1.00 0.00 C ATOM 1516 O PRO A 102 9.518 10.116 8.331 1.00 0.00 O ATOM 1517 CB PRO A 102 12.614 11.258 9.252 1.00 0.00 C ATOM 1518 CG PRO A 102 13.079 11.420 7.814 1.00 0.00 C ATOM 1519 CD PRO A 102 12.775 10.127 7.075 1.00 0.00 C ATOM 0 HA PRO A 102 11.901 9.436 10.167 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.064 12.137 9.586 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.462 11.138 9.926 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.569 12.259 7.340 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.147 11.636 7.781 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.161 10.310 6.193 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.689 9.642 6.732 1.00 0.00 H new ATOM 1527 N PRO A 103 9.801 10.924 10.459 1.00 0.00 N ATOM 1528 CA PRO A 103 8.406 11.294 10.633 1.00 0.00 C ATOM 1529 C PRO A 103 8.075 12.563 9.848 1.00 0.00 C ATOM 1530 O PRO A 103 7.353 13.432 10.340 1.00 0.00 O ATOM 1531 CB PRO A 103 8.228 11.460 12.134 1.00 0.00 C ATOM 1532 CG PRO A 103 9.627 11.632 12.703 1.00 0.00 C ATOM 1533 CD PRO A 103 10.622 11.224 11.629 1.00 0.00 C ATOM 0 HA PRO A 103 7.719 10.542 10.245 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.605 12.326 12.360 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.734 10.590 12.567 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.792 12.667 13.003 1.00 0.00 H new ATOM 0 HG3 PRO A 103 9.754 11.018 13.594 1.00 0.00 H new ATOM 0 HD2 PRO A 103 11.331 12.025 11.421 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.204 10.356 11.938 1.00 0.00 H new ATOM 1541 N ASN A 104 8.615 12.633 8.640 1.00 0.00 N ATOM 1542 CA ASN A 104 8.384 13.781 7.782 1.00 0.00 C ATOM 1543 C ASN A 104 6.892 13.885 7.464 1.00 0.00 C ATOM 1544 O ASN A 104 6.205 12.870 7.354 1.00 0.00 O ATOM 1545 CB ASN A 104 9.140 13.642 6.459 1.00 0.00 C ATOM 1546 CG ASN A 104 9.388 15.011 5.822 1.00 0.00 C ATOM 1547 OD1 ASN A 104 8.543 15.568 5.140 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.590 15.519 6.079 1.00 0.00 N ATOM 0 H ASN A 104 9.212 11.912 8.235 1.00 0.00 H new ATOM 0 HA ASN A 104 8.736 14.669 8.307 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.092 13.139 6.631 1.00 0.00 H new ATOM 0 HB3 ASN A 104 8.568 13.016 5.774 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.852 16.428 5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.250 15.000 6.658 1.00 0.00 H new ATOM 1555 N ASP A 105 6.433 15.120 7.325 1.00 0.00 N ATOM 1556 CA ASP A 105 5.033 15.368 7.021 1.00 0.00 C ATOM 1557 C ASP A 105 4.649 14.609 5.750 1.00 0.00 C ATOM 1558 O ASP A 105 3.471 14.336 5.517 1.00 0.00 O ATOM 1559 CB ASP A 105 4.778 16.857 6.779 1.00 0.00 C ATOM 1560 CG ASP A 105 4.703 17.715 8.042 1.00 0.00 C ATOM 1561 OD1 ASP A 105 4.484 17.121 9.120 1.00 0.00 O ATOM 1562 OD2 ASP A 105 4.865 18.946 7.902 1.00 0.00 O ATOM 0 H ASP A 105 7.005 15.960 7.417 1.00 0.00 H new ATOM 0 HA ASP A 105 4.439 15.034 7.871 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.571 17.247 6.140 1.00 0.00 H new ATOM 0 HB3 ASP A 105 3.843 16.965 6.229 1.00 0.00 H new ATOM 1567 N ASP A 106 5.663 14.287 4.961 1.00 0.00 N ATOM 1568 CA ASP A 106 5.446 13.565 3.720 1.00 0.00 C ATOM 1569 C ASP A 106 5.367 12.065 4.014 1.00 0.00 C ATOM 1570 O ASP A 106 5.730 11.244 3.174 1.00 0.00 O ATOM 1571 CB ASP A 106 6.599 13.794 2.740 1.00 0.00 C ATOM 1572 CG ASP A 106 6.180 14.280 1.351 1.00 0.00 C ATOM 1573 OD1 ASP A 106 5.106 13.834 0.893 1.00 0.00 O ATOM 1574 OD2 ASP A 106 6.945 15.085 0.777 1.00 0.00 O ATOM 0 H ASP A 106 6.638 14.513 5.158 1.00 0.00 H new ATOM 0 HA ASP A 106 4.519 13.928 3.277 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.284 14.523 3.172 1.00 0.00 H new ATOM 0 HB3 ASP A 106 7.153 12.862 2.630 1.00 0.00 H new ATOM 1579 N LYS A 107 4.891 11.754 5.212 1.00 0.00 N ATOM 1580 CA LYS A 107 4.761 10.368 5.628 1.00 0.00 C ATOM 1581 C LYS A 107 4.251 9.533 4.451 1.00 0.00 C ATOM 1582 O LYS A 107 4.553 8.345 4.352 1.00 0.00 O ATOM 1583 CB LYS A 107 3.886 10.266 6.880 1.00 0.00 C ATOM 1584 CG LYS A 107 2.590 11.059 6.709 1.00 0.00 C ATOM 1585 CD LYS A 107 2.351 11.983 7.907 1.00 0.00 C ATOM 1586 CE LYS A 107 1.800 11.200 9.100 1.00 0.00 C ATOM 1587 NZ LYS A 107 1.243 12.125 10.113 1.00 0.00 N ATOM 0 H LYS A 107 4.591 12.438 5.907 1.00 0.00 H new ATOM 0 HA LYS A 107 5.732 9.961 5.911 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.653 9.220 7.081 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.435 10.642 7.743 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.638 11.649 5.794 1.00 0.00 H new ATOM 0 HG3 LYS A 107 1.750 10.372 6.601 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.285 12.471 8.187 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.651 12.771 7.629 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.026 10.510 8.764 1.00 0.00 H new ATOM 0 HE3 LYS A 107 2.592 10.598 9.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.873 11.578 10.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.991 12.766 10.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.473 12.681 9.689 1.00 0.00 H new ATOM 1601 N CYS A 108 3.486 10.187 3.590 1.00 0.00 N ATOM 1602 CA CYS A 108 2.932 9.520 2.424 1.00 0.00 C ATOM 1603 C CYS A 108 4.072 8.814 1.687 1.00 0.00 C ATOM 1604 O CYS A 108 3.954 7.644 1.326 1.00 0.00 O ATOM 1605 CB CYS A 108 2.184 10.496 1.515 1.00 0.00 C ATOM 1606 SG CYS A 108 0.974 9.719 0.383 1.00 0.00 S ATOM 0 H CYS A 108 3.237 11.172 3.676 1.00 0.00 H new ATOM 0 HA CYS A 108 2.194 8.783 2.741 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.663 11.223 2.138 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.912 11.049 0.922 1.00 0.00 H new ATOM 1611 N MET A 109 5.152 9.555 1.485 1.00 0.00 N ATOM 1612 CA MET A 109 6.313 9.016 0.798 1.00 0.00 C ATOM 1613 C MET A 109 7.416 8.648 1.792 1.00 0.00 C ATOM 1614 O MET A 109 8.427 8.057 1.412 1.00 0.00 O ATOM 1615 CB MET A 109 6.844 10.049 -0.196 1.00 0.00 C ATOM 1616 CG MET A 109 7.268 11.334 0.523 1.00 0.00 C ATOM 1617 SD MET A 109 8.474 12.213 -0.458 1.00 0.00 S ATOM 1618 CE MET A 109 9.521 12.850 0.839 1.00 0.00 C ATOM 0 H MET A 109 5.247 10.525 1.786 1.00 0.00 H new ATOM 0 HA MET A 109 6.011 8.112 0.268 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.694 9.634 -0.738 1.00 0.00 H new ATOM 0 HB3 MET A 109 6.075 10.278 -0.934 1.00 0.00 H new ATOM 0 HG2 MET A 109 6.398 11.967 0.697 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.688 11.093 1.500 1.00 0.00 H new ATOM 0 HE1 MET A 109 9.437 13.936 0.874 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.211 12.431 1.796 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.556 12.573 0.640 1.00 0.00 H new ATOM 1628 N LYS A 110 7.186 9.011 3.046 1.00 0.00 N ATOM 1629 CA LYS A 110 8.147 8.726 4.096 1.00 0.00 C ATOM 1630 C LYS A 110 7.836 7.361 4.711 1.00 0.00 C ATOM 1631 O LYS A 110 8.483 6.367 4.385 1.00 0.00 O ATOM 1632 CB LYS A 110 8.181 9.868 5.115 1.00 0.00 C ATOM 1633 CG LYS A 110 9.620 10.258 5.455 1.00 0.00 C ATOM 1634 CD LYS A 110 10.343 10.811 4.224 1.00 0.00 C ATOM 1635 CE LYS A 110 11.109 12.089 4.567 1.00 0.00 C ATOM 1636 NZ LYS A 110 12.294 12.235 3.691 1.00 0.00 N ATOM 0 H LYS A 110 6.347 9.500 3.357 1.00 0.00 H new ATOM 0 HA LYS A 110 9.155 8.667 3.684 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.651 10.733 4.715 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.658 9.566 6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.620 11.006 6.248 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.156 9.389 5.836 1.00 0.00 H new ATOM 0 HD2 LYS A 110 11.033 10.062 3.836 1.00 0.00 H new ATOM 0 HD3 LYS A 110 9.620 11.017 3.435 1.00 0.00 H new ATOM 0 HE2 LYS A 110 10.455 12.954 4.452 1.00 0.00 H new ATOM 0 HE3 LYS A 110 11.422 12.063 5.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 12.803 13.108 3.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 12.925 11.418 3.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.988 12.281 2.698 1.00 0.00 H new ATOM 1650 N THR A 111 6.845 7.356 5.591 1.00 0.00 N ATOM 1651 CA THR A 111 6.439 6.129 6.254 1.00 0.00 C ATOM 1652 C THR A 111 6.334 4.985 5.242 1.00 0.00 C ATOM 1653 O THR A 111 6.801 3.878 5.502 1.00 0.00 O ATOM 1654 CB THR A 111 5.132 6.404 6.998 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.363 7.644 7.662 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.886 5.411 8.137 1.00 0.00 C ATOM 0 H THR A 111 6.311 8.183 5.860 1.00 0.00 H new ATOM 0 HA THR A 111 7.183 5.808 6.983 1.00 0.00 H new ATOM 0 HB THR A 111 4.300 6.364 6.295 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.725 7.744 8.399 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.945 5.651 8.632 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.836 4.400 7.734 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.702 5.474 8.857 1.00 0.00 H new ATOM 1664 N ILE A 112 5.718 5.294 4.110 1.00 0.00 N ATOM 1665 CA ILE A 112 5.546 4.306 3.060 1.00 0.00 C ATOM 1666 C ILE A 112 6.874 3.589 2.817 1.00 0.00 C ATOM 1667 O ILE A 112 6.910 2.366 2.688 1.00 0.00 O ATOM 1668 CB ILE A 112 4.959 4.956 1.805 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.282 3.912 0.913 1.00 0.00 C ATOM 1670 CG2 ILE A 112 6.026 5.751 1.049 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.230 2.753 0.609 1.00 0.00 C ATOM 0 H ILE A 112 5.332 6.214 3.898 1.00 0.00 H new ATOM 0 HA ILE A 112 4.826 3.547 3.365 1.00 0.00 H new ATOM 0 HB ILE A 112 4.190 5.663 2.114 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.386 3.534 1.405 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.961 4.378 -0.019 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.583 6.203 0.162 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.422 6.534 1.695 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.834 5.083 0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.724 2.026 -0.026 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.114 3.131 0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.530 2.274 1.541 1.00 0.00 H new ATOM 1683 N ASP A 113 7.935 4.380 2.761 1.00 0.00 N ATOM 1684 CA ASP A 113 9.264 3.836 2.536 1.00 0.00 C ATOM 1685 C ASP A 113 9.469 2.615 3.434 1.00 0.00 C ATOM 1686 O ASP A 113 9.925 1.569 2.973 1.00 0.00 O ATOM 1687 CB ASP A 113 10.346 4.863 2.880 1.00 0.00 C ATOM 1688 CG ASP A 113 11.581 4.827 1.979 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.535 4.073 0.982 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.543 5.554 2.305 1.00 0.00 O ATOM 0 H ASP A 113 7.902 5.394 2.868 1.00 0.00 H new ATOM 0 HA ASP A 113 9.344 3.567 1.483 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.908 5.860 2.831 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.662 4.704 3.911 1.00 0.00 H new ATOM 1695 N VAL A 114 9.123 2.787 4.702 1.00 0.00 N ATOM 1696 CA VAL A 114 9.263 1.711 5.668 1.00 0.00 C ATOM 1697 C VAL A 114 8.154 0.682 5.445 1.00 0.00 C ATOM 1698 O VAL A 114 8.430 -0.496 5.230 1.00 0.00 O ATOM 1699 CB VAL A 114 9.274 2.282 7.088 1.00 0.00 C ATOM 1700 CG1 VAL A 114 10.213 1.483 7.994 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.650 3.765 7.080 1.00 0.00 C ATOM 0 H VAL A 114 8.746 3.655 5.082 1.00 0.00 H new ATOM 0 HA VAL A 114 10.214 1.196 5.531 1.00 0.00 H new ATOM 0 HB VAL A 114 8.265 2.194 7.491 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.202 1.910 8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.881 0.446 8.038 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.226 1.523 7.594 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.650 4.146 8.101 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.643 3.886 6.647 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.925 4.321 6.486 1.00 0.00 H new ATOM 1711 N ALA A 115 6.922 1.166 5.504 1.00 0.00 N ATOM 1712 CA ALA A 115 5.769 0.302 5.311 1.00 0.00 C ATOM 1713 C ALA A 115 5.987 -0.562 4.067 1.00 0.00 C ATOM 1714 O ALA A 115 5.367 -1.613 3.922 1.00 0.00 O ATOM 1715 CB ALA A 115 4.503 1.156 5.213 1.00 0.00 C ATOM 0 H ALA A 115 6.697 2.145 5.683 1.00 0.00 H new ATOM 0 HA ALA A 115 5.645 -0.369 6.161 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.638 0.509 5.068 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.378 1.728 6.132 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.590 1.840 4.369 1.00 0.00 H new ATOM 1721 N MET A 116 6.871 -0.086 3.204 1.00 0.00 N ATOM 1722 CA MET A 116 7.179 -0.802 1.977 1.00 0.00 C ATOM 1723 C MET A 116 8.507 -1.550 2.097 1.00 0.00 C ATOM 1724 O MET A 116 8.659 -2.646 1.559 1.00 0.00 O ATOM 1725 CB MET A 116 7.253 0.188 0.813 1.00 0.00 C ATOM 1726 CG MET A 116 7.808 -0.486 -0.445 1.00 0.00 C ATOM 1727 SD MET A 116 9.276 0.365 -0.997 1.00 0.00 S ATOM 1728 CE MET A 116 10.504 -0.449 0.012 1.00 0.00 C ATOM 0 H MET A 116 7.384 0.787 3.329 1.00 0.00 H new ATOM 0 HA MET A 116 6.389 -1.531 1.796 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.260 0.588 0.608 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.886 1.031 1.088 1.00 0.00 H new ATOM 0 HG2 MET A 116 8.040 -1.530 -0.236 1.00 0.00 H new ATOM 0 HG3 MET A 116 7.055 -0.479 -1.233 1.00 0.00 H new ATOM 0 HE1 MET A 116 11.448 -0.498 -0.532 1.00 0.00 H new ATOM 0 HE2 MET A 116 10.646 0.112 0.936 1.00 0.00 H new ATOM 0 HE3 MET A 116 10.169 -1.459 0.249 1.00 0.00 H new ATOM 1738 N CYS A 117 9.438 -0.929 2.807 1.00 0.00 N ATOM 1739 CA CYS A 117 10.749 -1.521 3.005 1.00 0.00 C ATOM 1740 C CYS A 117 10.560 -2.995 3.373 1.00 0.00 C ATOM 1741 O CYS A 117 11.116 -3.877 2.721 1.00 0.00 O ATOM 1742 CB CYS A 117 11.556 -0.768 4.064 1.00 0.00 C ATOM 1743 SG CYS A 117 13.371 -0.833 3.836 1.00 0.00 S ATOM 0 H CYS A 117 9.309 -0.021 3.252 1.00 0.00 H new ATOM 0 HA CYS A 117 11.326 -1.448 2.083 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.241 0.276 4.066 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.312 -1.176 5.045 1.00 0.00 H new ATOM 1748 N PHE A 118 9.772 -3.214 4.415 1.00 0.00 N ATOM 1749 CA PHE A 118 9.503 -4.566 4.878 1.00 0.00 C ATOM 1750 C PHE A 118 8.743 -5.366 3.818 1.00 0.00 C ATOM 1751 O PHE A 118 8.968 -6.566 3.659 1.00 0.00 O ATOM 1752 CB PHE A 118 8.631 -4.445 6.129 1.00 0.00 C ATOM 1753 CG PHE A 118 7.817 -5.701 6.444 1.00 0.00 C ATOM 1754 CD1 PHE A 118 8.360 -6.931 6.242 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.552 -5.589 6.928 1.00 0.00 C ATOM 1756 CE1 PHE A 118 7.605 -8.098 6.534 1.00 0.00 C ATOM 1757 CE2 PHE A 118 5.797 -6.754 7.221 1.00 0.00 C ATOM 1758 CZ PHE A 118 6.340 -7.985 7.018 1.00 0.00 C ATOM 0 H PHE A 118 9.311 -2.479 4.952 1.00 0.00 H new ATOM 0 HA PHE A 118 10.440 -5.083 5.084 1.00 0.00 H new ATOM 0 HB2 PHE A 118 9.268 -4.214 6.983 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.949 -3.604 6.004 1.00 0.00 H new ATOM 0 HD1 PHE A 118 9.366 -7.021 5.859 1.00 0.00 H new ATOM 0 HD2 PHE A 118 6.121 -4.612 7.090 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.036 -9.075 6.371 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.792 -6.664 7.605 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.766 -8.872 7.241 1.00 0.00 H new ATOM 1768 N LYS A 119 7.859 -4.671 3.117 1.00 0.00 N ATOM 1769 CA LYS A 119 7.066 -5.301 2.077 1.00 0.00 C ATOM 1770 C LYS A 119 7.994 -5.830 0.982 1.00 0.00 C ATOM 1771 O LYS A 119 7.684 -6.825 0.328 1.00 0.00 O ATOM 1772 CB LYS A 119 5.994 -4.337 1.561 1.00 0.00 C ATOM 1773 CG LYS A 119 4.628 -5.022 1.490 1.00 0.00 C ATOM 1774 CD LYS A 119 3.540 -4.033 1.066 1.00 0.00 C ATOM 1775 CE LYS A 119 2.151 -4.547 1.452 1.00 0.00 C ATOM 1776 NZ LYS A 119 1.593 -3.746 2.562 1.00 0.00 N ATOM 0 H LYS A 119 7.675 -3.677 3.250 1.00 0.00 H new ATOM 0 HA LYS A 119 6.525 -6.158 2.479 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.935 -3.468 2.217 1.00 0.00 H new ATOM 0 HB3 LYS A 119 6.274 -3.972 0.573 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.668 -5.849 0.782 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.379 -5.447 2.462 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.718 -3.067 1.538 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.587 -3.875 -0.012 1.00 0.00 H new ATOM 0 HE2 LYS A 119 1.486 -4.498 0.590 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.213 -5.594 1.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.650 -4.108 2.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.220 -3.814 3.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 1.515 -2.752 2.268 1.00 0.00 H new ATOM 1790 N LYS A 120 9.114 -5.143 0.817 1.00 0.00 N ATOM 1791 CA LYS A 120 10.090 -5.532 -0.186 1.00 0.00 C ATOM 1792 C LYS A 120 10.637 -6.920 0.152 1.00 0.00 C ATOM 1793 O LYS A 120 11.054 -7.660 -0.737 1.00 0.00 O ATOM 1794 CB LYS A 120 11.174 -4.460 -0.322 1.00 0.00 C ATOM 1795 CG LYS A 120 10.993 -3.658 -1.613 1.00 0.00 C ATOM 1796 CD LYS A 120 12.338 -3.151 -2.137 1.00 0.00 C ATOM 1797 CE LYS A 120 12.150 -2.290 -3.387 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.445 -1.729 -3.829 1.00 0.00 N ATOM 0 H LYS A 120 9.368 -4.319 1.361 1.00 0.00 H new ATOM 0 HA LYS A 120 9.620 -5.605 -1.167 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.136 -3.789 0.536 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.158 -4.930 -0.316 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.516 -4.282 -2.369 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.328 -2.814 -1.431 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.838 -2.570 -1.363 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.985 -3.997 -2.368 1.00 0.00 H new ATOM 0 HE2 LYS A 120 11.715 -2.889 -4.187 1.00 0.00 H new ATOM 0 HE3 LYS A 120 11.449 -1.482 -3.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 13.299 -1.147 -4.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 13.845 -1.140 -3.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 14.102 -2.504 -4.049 1.00 0.00 H new ATOM 1812 N GLU A 121 10.617 -7.232 1.440 1.00 0.00 N ATOM 1813 CA GLU A 121 11.106 -8.519 1.905 1.00 0.00 C ATOM 1814 C GLU A 121 10.334 -9.655 1.231 1.00 0.00 C ATOM 1815 O GLU A 121 10.862 -10.753 1.064 1.00 0.00 O ATOM 1816 CB GLU A 121 11.015 -8.621 3.429 1.00 0.00 C ATOM 1817 CG GLU A 121 11.768 -7.472 4.102 1.00 0.00 C ATOM 1818 CD GLU A 121 13.281 -7.633 3.931 1.00 0.00 C ATOM 1819 OE1 GLU A 121 13.790 -8.692 4.355 1.00 0.00 O ATOM 1820 OE2 GLU A 121 13.892 -6.693 3.379 1.00 0.00 O ATOM 0 H GLU A 121 10.270 -6.616 2.175 1.00 0.00 H new ATOM 0 HA GLU A 121 12.157 -8.608 1.630 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.969 -8.604 3.736 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.429 -9.574 3.758 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.449 -6.522 3.672 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.519 -7.442 5.163 1.00 0.00 H new ATOM 1827 N ILE A 122 9.097 -9.351 0.865 1.00 0.00 N ATOM 1828 CA ILE A 122 8.248 -10.333 0.214 1.00 0.00 C ATOM 1829 C ILE A 122 8.610 -10.410 -1.271 1.00 0.00 C ATOM 1830 O ILE A 122 8.676 -11.497 -1.842 1.00 0.00 O ATOM 1831 CB ILE A 122 6.774 -10.022 0.473 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.586 -9.350 1.834 1.00 0.00 C ATOM 1833 CG2 ILE A 122 5.914 -11.280 0.332 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.386 -10.073 2.918 1.00 0.00 C ATOM 0 H ILE A 122 8.663 -8.439 1.007 1.00 0.00 H new ATOM 0 HA ILE A 122 8.419 -11.324 0.635 1.00 0.00 H new ATOM 0 HB ILE A 122 6.437 -9.315 -0.285 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.904 -8.309 1.776 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.529 -9.347 2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.870 -11.030 0.521 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.014 -11.678 -0.678 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.244 -12.029 1.052 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.234 -9.575 3.875 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.049 -11.107 2.990 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.445 -10.053 2.662 1.00 0.00 H new ATOM 1846 N HIS A 123 8.833 -9.241 -1.853 1.00 0.00 N ATOM 1847 CA HIS A 123 9.186 -9.161 -3.261 1.00 0.00 C ATOM 1848 C HIS A 123 10.284 -10.180 -3.573 1.00 0.00 C ATOM 1849 O HIS A 123 10.454 -10.582 -4.722 1.00 0.00 O ATOM 1850 CB HIS A 123 9.577 -7.733 -3.643 1.00 0.00 C ATOM 1851 CG HIS A 123 10.956 -7.613 -4.244 1.00 0.00 C ATOM 1852 ND1 HIS A 123 11.363 -8.354 -5.341 1.00 0.00 N ATOM 1853 CD2 HIS A 123 12.018 -6.831 -3.893 1.00 0.00 C ATOM 1854 CE1 HIS A 123 12.615 -8.027 -5.626 1.00 0.00 C ATOM 1855 NE2 HIS A 123 13.019 -7.082 -4.728 1.00 0.00 N ATOM 0 H HIS A 123 8.776 -8.341 -1.376 1.00 0.00 H new ATOM 0 HA HIS A 123 8.319 -9.414 -3.872 1.00 0.00 H new ATOM 0 HB2 HIS A 123 8.847 -7.346 -4.354 1.00 0.00 H new ATOM 0 HB3 HIS A 123 9.523 -7.103 -2.755 1.00 0.00 H new ATOM 0 HD1 HIS A 123 10.795 -9.036 -5.844 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.040 -6.127 -3.074 1.00 0.00 H new ATOM 0 HE1 HIS A 123 13.211 -8.436 -6.428 1.00 0.00 H new ATOM 1864 N LYS A 124 11.001 -10.567 -2.529 1.00 0.00 N ATOM 1865 CA LYS A 124 12.078 -11.533 -2.676 1.00 0.00 C ATOM 1866 C LYS A 124 11.563 -12.926 -2.311 1.00 0.00 C ATOM 1867 O LYS A 124 12.327 -13.772 -1.851 1.00 0.00 O ATOM 1868 CB LYS A 124 13.302 -11.097 -1.869 1.00 0.00 C ATOM 1869 CG LYS A 124 13.005 -11.121 -0.368 1.00 0.00 C ATOM 1870 CD LYS A 124 14.280 -11.377 0.438 1.00 0.00 C ATOM 1871 CE LYS A 124 14.891 -10.063 0.928 1.00 0.00 C ATOM 1872 NZ LYS A 124 16.358 -10.067 0.730 1.00 0.00 N ATOM 0 H LYS A 124 10.858 -10.230 -1.577 1.00 0.00 H new ATOM 0 HA LYS A 124 12.409 -11.579 -3.713 1.00 0.00 H new ATOM 0 HB2 LYS A 124 14.141 -11.758 -2.088 1.00 0.00 H new ATOM 0 HB3 LYS A 124 13.601 -10.092 -2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.564 -10.171 -0.066 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.271 -11.897 -0.151 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.053 -12.017 1.291 1.00 0.00 H new ATOM 0 HD3 LYS A 124 15.003 -11.911 -0.178 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.448 -9.226 0.389 1.00 0.00 H new ATOM 0 HE3 LYS A 124 14.661 -9.920 1.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 16.756 -9.168 1.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 16.778 -10.854 1.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 16.571 -10.182 -0.281 1.00 0.00 H new ATOM 1886 N LEU A 125 10.272 -13.121 -2.529 1.00 0.00 N ATOM 1887 CA LEU A 125 9.646 -14.398 -2.227 1.00 0.00 C ATOM 1888 C LEU A 125 10.556 -15.531 -2.702 1.00 0.00 C ATOM 1889 O LEU A 125 11.452 -15.957 -1.975 1.00 0.00 O ATOM 1890 CB LEU A 125 8.235 -14.454 -2.816 1.00 0.00 C ATOM 1891 CG LEU A 125 7.934 -13.455 -3.936 1.00 0.00 C ATOM 1892 CD1 LEU A 125 9.049 -13.454 -4.984 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.563 -13.726 -4.559 1.00 0.00 C ATOM 0 H LEU A 125 9.641 -12.417 -2.911 1.00 0.00 H new ATOM 0 HA LEU A 125 9.523 -14.518 -1.151 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.062 -15.460 -3.198 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.520 -14.292 -2.010 1.00 0.00 H new ATOM 0 HG LEU A 125 7.899 -12.456 -3.502 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.810 -12.736 -5.768 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.992 -13.176 -4.512 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.140 -14.449 -5.419 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.374 -13.002 -5.352 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.545 -14.733 -4.975 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.792 -13.636 -3.794 1.00 0.00 H new ATOM 1905 N ASN A 126 10.296 -15.987 -3.919 1.00 0.00 N ATOM 1906 CA ASN A 126 11.081 -17.063 -4.499 1.00 0.00 C ATOM 1907 C ASN A 126 11.896 -16.519 -5.674 1.00 0.00 C ATOM 1908 O ASN A 126 12.691 -17.244 -6.271 1.00 0.00 O ATOM 1909 CB ASN A 126 10.179 -18.181 -5.027 1.00 0.00 C ATOM 1910 CG ASN A 126 10.965 -19.146 -5.916 1.00 0.00 C ATOM 1911 OD1 ASN A 126 10.999 -18.795 -7.198 1.00 0.00 O flip ATOM 1912 ND2 ASN A 126 11.506 -20.144 -5.467 1.00 0.00 N flip ATOM 0 H ASN A 126 9.552 -15.630 -4.519 1.00 0.00 H new ATOM 0 HA ASN A 126 11.732 -17.462 -3.721 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.742 -18.726 -4.190 1.00 0.00 H new ATOM 0 HB3 ASN A 126 9.353 -17.750 -5.593 1.00 0.00 H new ATOM 0 HD21 ASN A 126 11.441 -20.355 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 126 12.023 -20.767 -6.088 1.00 0.00 H new ATOM 1919 N TRP A 127 11.671 -15.247 -5.969 1.00 0.00 N ATOM 1920 CA TRP A 127 12.375 -14.598 -7.061 1.00 0.00 C ATOM 1921 C TRP A 127 13.650 -13.970 -6.495 1.00 0.00 C ATOM 1922 O TRP A 127 13.708 -13.629 -5.315 1.00 0.00 O ATOM 1923 CB TRP A 127 11.472 -13.583 -7.768 1.00 0.00 C ATOM 1924 CG TRP A 127 9.990 -13.959 -7.764 1.00 0.00 C ATOM 1925 CD1 TRP A 127 9.449 -15.186 -7.721 1.00 0.00 C ATOM 1926 CD2 TRP A 127 8.871 -13.050 -7.806 1.00 0.00 C ATOM 1927 NE1 TRP A 127 8.071 -15.132 -7.731 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.708 -13.791 -7.786 1.00 0.00 C ATOM 1929 CE3 TRP A 127 8.843 -11.644 -7.860 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 6.431 -13.216 -7.816 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 7.560 -11.085 -7.890 1.00 0.00 C ATOM 1932 CH2 TRP A 127 6.379 -11.819 -7.870 1.00 0.00 C ATOM 0 H TRP A 127 11.012 -14.649 -5.471 1.00 0.00 H new ATOM 0 HA TRP A 127 12.654 -15.323 -7.825 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.591 -12.611 -7.289 1.00 0.00 H new ATOM 0 HB3 TRP A 127 11.805 -13.473 -8.800 1.00 0.00 H new ATOM 0 HD1 TRP A 127 10.021 -16.101 -7.683 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.435 -15.929 -7.703 1.00 0.00 H new ATOM 0 HE3 TRP A 127 9.741 -11.044 -7.877 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.535 -13.819 -7.798 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 7.482 -10.009 -7.932 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.425 -11.313 -7.896 1.00 0.00 H new ATOM 1943 N VAL A 128 14.641 -13.835 -7.365 1.00 0.00 N ATOM 1944 CA VAL A 128 15.912 -13.256 -6.967 1.00 0.00 C ATOM 1945 C VAL A 128 15.883 -11.748 -7.224 1.00 0.00 C ATOM 1946 O VAL A 128 15.744 -11.312 -8.367 1.00 0.00 O ATOM 1947 CB VAL A 128 17.060 -13.965 -7.689 1.00 0.00 C ATOM 1948 CG1 VAL A 128 16.796 -14.040 -9.195 1.00 0.00 C ATOM 1949 CG2 VAL A 128 18.397 -13.277 -7.401 1.00 0.00 C ATOM 0 H VAL A 128 14.589 -14.117 -8.344 1.00 0.00 H new ATOM 0 HA VAL A 128 16.080 -13.400 -5.900 1.00 0.00 H new ATOM 0 HB VAL A 128 17.118 -14.984 -7.307 1.00 0.00 H new ATOM 0 HG11 VAL A 128 17.626 -14.548 -9.685 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.874 -14.593 -9.376 1.00 0.00 H new ATOM 0 HG13 VAL A 128 16.699 -13.032 -9.598 1.00 0.00 H new ATOM 0 HG21 VAL A 128 19.196 -13.801 -7.926 1.00 0.00 H new ATOM 0 HG22 VAL A 128 18.355 -12.243 -7.743 1.00 0.00 H new ATOM 0 HG23 VAL A 128 18.593 -13.297 -6.329 1.00 0.00 H new ATOM 1959 N PRO A 129 16.021 -10.973 -6.116 1.00 0.00 N ATOM 1960 CA PRO A 129 16.011 -9.524 -6.211 1.00 0.00 C ATOM 1961 C PRO A 129 17.332 -9.003 -6.780 1.00 0.00 C ATOM 1962 O PRO A 129 17.947 -8.102 -6.210 1.00 0.00 O ATOM 1963 CB PRO A 129 15.743 -9.038 -4.796 1.00 0.00 C ATOM 1964 CG PRO A 129 16.072 -10.208 -3.884 1.00 0.00 C ATOM 1965 CD PRO A 129 16.188 -11.454 -4.748 1.00 0.00 C ATOM 0 HA PRO A 129 15.249 -9.153 -6.897 1.00 0.00 H new ATOM 0 HB2 PRO A 129 16.360 -8.171 -4.557 1.00 0.00 H new ATOM 0 HB3 PRO A 129 14.704 -8.732 -4.679 1.00 0.00 H new ATOM 0 HG2 PRO A 129 17.005 -10.025 -3.350 1.00 0.00 H new ATOM 0 HG3 PRO A 129 15.294 -10.336 -3.132 1.00 0.00 H new ATOM 0 HD2 PRO A 129 17.154 -11.940 -4.614 1.00 0.00 H new ATOM 0 HD3 PRO A 129 15.424 -12.187 -4.490 1.00 0.00 H new ATOM 1973 N ASN A 130 17.730 -9.590 -7.899 1.00 0.00 N ATOM 1974 CA ASN A 130 18.967 -9.197 -8.552 1.00 0.00 C ATOM 1975 C ASN A 130 19.106 -7.675 -8.499 1.00 0.00 C ATOM 1976 O ASN A 130 20.215 -7.150 -8.415 1.00 0.00 O ATOM 1977 CB ASN A 130 18.972 -9.621 -10.022 1.00 0.00 C ATOM 1978 CG ASN A 130 20.061 -10.662 -10.290 1.00 0.00 C ATOM 1979 OD1 ASN A 130 20.142 -11.694 -9.642 1.00 0.00 O ATOM 1980 ND2 ASN A 130 20.892 -10.336 -11.275 1.00 0.00 N ATOM 0 H ASN A 130 17.217 -10.335 -8.370 1.00 0.00 H new ATOM 0 HA ASN A 130 19.792 -9.685 -8.033 1.00 0.00 H new ATOM 0 HB2 ASN A 130 17.998 -10.032 -10.289 1.00 0.00 H new ATOM 0 HB3 ASN A 130 19.134 -8.749 -10.655 1.00 0.00 H new ATOM 0 HD21 ASN A 130 21.654 -10.965 -11.529 1.00 0.00 H new ATOM 0 HD22 ASN A 130 20.768 -9.457 -11.777 1.00 0.00 H new ATOM 1987 N MET A 131 17.962 -7.006 -8.549 1.00 0.00 N ATOM 1988 CA MET A 131 17.942 -5.554 -8.507 1.00 0.00 C ATOM 1989 C MET A 131 17.666 -5.050 -7.089 1.00 0.00 C ATOM 1990 O MET A 131 16.523 -5.056 -6.635 1.00 0.00 O ATOM 1991 CB MET A 131 16.861 -5.031 -9.454 1.00 0.00 C ATOM 1992 CG MET A 131 17.330 -3.769 -10.180 1.00 0.00 C ATOM 1993 SD MET A 131 16.229 -3.397 -11.534 1.00 0.00 S ATOM 1994 CE MET A 131 17.410 -3.251 -12.864 1.00 0.00 C ATOM 0 H MET A 131 17.043 -7.443 -8.618 1.00 0.00 H new ATOM 0 HA MET A 131 18.920 -5.187 -8.819 1.00 0.00 H new ATOM 0 HB2 MET A 131 16.608 -5.801 -10.183 1.00 0.00 H new ATOM 0 HB3 MET A 131 15.953 -4.814 -8.891 1.00 0.00 H new ATOM 0 HG2 MET A 131 17.361 -2.930 -9.485 1.00 0.00 H new ATOM 0 HG3 MET A 131 18.344 -3.910 -10.554 1.00 0.00 H new ATOM 0 HE1 MET A 131 16.887 -3.019 -13.791 1.00 0.00 H new ATOM 0 HE2 MET A 131 18.117 -2.453 -12.637 1.00 0.00 H new ATOM 0 HE3 MET A 131 17.949 -4.192 -12.977 1.00 0.00 H new ATOM 2004 N ASP A 132 18.734 -4.628 -6.428 1.00 0.00 N ATOM 2005 CA ASP A 132 18.622 -4.121 -5.071 1.00 0.00 C ATOM 2006 C ASP A 132 19.272 -2.738 -4.991 1.00 0.00 C ATOM 2007 O ASP A 132 20.483 -2.627 -4.812 1.00 0.00 O ATOM 2008 CB ASP A 132 19.340 -5.038 -4.079 1.00 0.00 C ATOM 2009 CG ASP A 132 18.427 -5.978 -3.290 1.00 0.00 C ATOM 2010 OD1 ASP A 132 17.537 -5.450 -2.589 1.00 0.00 O ATOM 2011 OD2 ASP A 132 18.640 -7.205 -3.407 1.00 0.00 O ATOM 0 H ASP A 132 19.681 -4.627 -6.807 1.00 0.00 H new ATOM 0 HA ASP A 132 17.563 -4.072 -4.817 1.00 0.00 H new ATOM 0 HB2 ASP A 132 20.070 -5.637 -4.624 1.00 0.00 H new ATOM 0 HB3 ASP A 132 19.897 -4.421 -3.374 1.00 0.00 H new ATOM 2016 N LEU A 133 18.436 -1.719 -5.129 1.00 0.00 N ATOM 2017 CA LEU A 133 18.914 -0.347 -5.075 1.00 0.00 C ATOM 2018 C LEU A 133 17.721 0.607 -5.138 1.00 0.00 C ATOM 2019 O LEU A 133 16.832 0.440 -5.972 1.00 0.00 O ATOM 2020 CB LEU A 133 19.959 -0.101 -6.167 1.00 0.00 C ATOM 2021 CG LEU A 133 19.425 0.446 -7.493 1.00 0.00 C ATOM 2022 CD1 LEU A 133 18.301 -0.437 -8.037 1.00 0.00 C ATOM 2023 CD2 LEU A 133 18.989 1.905 -7.351 1.00 0.00 C ATOM 0 H LEU A 133 17.432 -1.816 -5.278 1.00 0.00 H new ATOM 0 HA LEU A 133 19.423 -0.157 -4.130 1.00 0.00 H new ATOM 0 HB2 LEU A 133 20.702 0.597 -5.781 1.00 0.00 H new ATOM 0 HB3 LEU A 133 20.476 -1.040 -6.366 1.00 0.00 H new ATOM 0 HG LEU A 133 20.235 0.423 -8.222 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.939 -0.026 -8.980 1.00 0.00 H new ATOM 0 HD12 LEU A 133 18.679 -1.446 -8.202 1.00 0.00 H new ATOM 0 HD13 LEU A 133 17.483 -0.469 -7.318 1.00 0.00 H new ATOM 0 HD21 LEU A 133 18.614 2.268 -8.308 1.00 0.00 H new ATOM 0 HD22 LEU A 133 18.201 1.978 -6.601 1.00 0.00 H new ATOM 0 HD23 LEU A 133 19.841 2.511 -7.042 1.00 0.00 H new ATOM 2035 N VAL A 134 17.740 1.588 -4.247 1.00 0.00 N ATOM 2036 CA VAL A 134 16.670 2.570 -4.191 1.00 0.00 C ATOM 2037 C VAL A 134 17.230 3.948 -4.545 1.00 0.00 C ATOM 2038 O VAL A 134 16.768 4.586 -5.490 1.00 0.00 O ATOM 2039 CB VAL A 134 15.996 2.531 -2.818 1.00 0.00 C ATOM 2040 CG1 VAL A 134 15.061 3.728 -2.633 1.00 0.00 C ATOM 2041 CG2 VAL A 134 15.247 1.213 -2.611 1.00 0.00 C ATOM 0 H VAL A 134 18.480 1.724 -3.558 1.00 0.00 H new ATOM 0 HA VAL A 134 15.897 2.336 -4.923 1.00 0.00 H new ATOM 0 HB VAL A 134 16.777 2.594 -2.060 1.00 0.00 H new ATOM 0 HG11 VAL A 134 14.594 3.677 -1.649 1.00 0.00 H new ATOM 0 HG12 VAL A 134 15.633 4.652 -2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 134 14.289 3.709 -3.402 1.00 0.00 H new ATOM 0 HG21 VAL A 134 14.777 1.212 -1.627 1.00 0.00 H new ATOM 0 HG22 VAL A 134 14.481 1.105 -3.379 1.00 0.00 H new ATOM 0 HG23 VAL A 134 15.948 0.381 -2.679 1.00 0.00 H new ATOM 2051 N ILE A 135 18.215 4.368 -3.767 1.00 0.00 N ATOM 2052 CA ILE A 135 18.843 5.661 -3.985 1.00 0.00 C ATOM 2053 C ILE A 135 20.229 5.451 -4.599 1.00 0.00 C ATOM 2054 O ILE A 135 20.902 6.414 -4.963 1.00 0.00 O ATOM 2055 CB ILE A 135 18.860 6.475 -2.690 1.00 0.00 C ATOM 2056 CG1 ILE A 135 19.247 5.598 -1.497 1.00 0.00 C ATOM 2057 CG2 ILE A 135 17.523 7.184 -2.470 1.00 0.00 C ATOM 2058 CD1 ILE A 135 18.017 4.915 -0.898 1.00 0.00 C ATOM 0 H ILE A 135 18.595 3.836 -2.984 1.00 0.00 H new ATOM 0 HA ILE A 135 18.264 6.251 -4.696 1.00 0.00 H new ATOM 0 HB ILE A 135 19.622 7.248 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE A 135 19.968 4.844 -1.814 1.00 0.00 H new ATOM 0 HG13 ILE A 135 19.736 6.207 -0.737 1.00 0.00 H new ATOM 0 HG21 ILE A 135 17.562 7.755 -1.543 1.00 0.00 H new ATOM 0 HG22 ILE A 135 17.327 7.858 -3.304 1.00 0.00 H new ATOM 0 HG23 ILE A 135 16.725 6.444 -2.407 1.00 0.00 H new ATOM 0 HD11 ILE A 135 18.319 4.298 -0.052 1.00 0.00 H new ATOM 0 HD12 ILE A 135 17.309 5.672 -0.560 1.00 0.00 H new ATOM 0 HD13 ILE A 135 17.545 4.288 -1.654 1.00 0.00 H new ATOM 2070 N GLY A 136 20.614 4.189 -4.696 1.00 0.00 N ATOM 2071 CA GLY A 136 21.908 3.840 -5.259 1.00 0.00 C ATOM 2072 C GLY A 136 23.004 3.896 -4.193 1.00 0.00 C ATOM 2073 O GLY A 136 24.156 4.197 -4.497 1.00 0.00 O ATOM 0 H GLY A 136 20.052 3.393 -4.394 1.00 0.00 H new ATOM 0 HA2 GLY A 136 21.864 2.839 -5.688 1.00 0.00 H new ATOM 0 HA3 GLY A 136 22.151 4.524 -6.072 1.00 0.00 H new ATOM 2077 N GLU A 137 22.604 3.602 -2.964 1.00 0.00 N ATOM 2078 CA GLU A 137 23.538 3.614 -1.851 1.00 0.00 C ATOM 2079 C GLU A 137 23.504 2.275 -1.114 1.00 0.00 C ATOM 2080 O GLU A 137 22.693 1.406 -1.434 1.00 0.00 O ATOM 2081 CB GLU A 137 23.237 4.773 -0.896 1.00 0.00 C ATOM 2082 CG GLU A 137 22.148 4.388 0.107 1.00 0.00 C ATOM 2083 CD GLU A 137 21.827 5.555 1.042 1.00 0.00 C ATOM 2084 OE1 GLU A 137 21.746 6.691 0.525 1.00 0.00 O ATOM 2085 OE2 GLU A 137 21.668 5.286 2.252 1.00 0.00 O ATOM 0 H GLU A 137 21.646 3.354 -2.715 1.00 0.00 H new ATOM 0 HA GLU A 137 24.543 3.763 -2.247 1.00 0.00 H new ATOM 0 HB2 GLU A 137 24.145 5.054 -0.362 1.00 0.00 H new ATOM 0 HB3 GLU A 137 22.919 5.646 -1.466 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.247 4.087 -0.427 1.00 0.00 H new ATOM 0 HG3 GLU A 137 22.475 3.528 0.692 1.00 0.00 H new ATOM 2092 N VAL A 138 24.393 2.148 -0.140 1.00 0.00 N ATOM 2093 CA VAL A 138 24.475 0.927 0.645 1.00 0.00 C ATOM 2094 C VAL A 138 23.218 0.794 1.505 1.00 0.00 C ATOM 2095 O VAL A 138 23.006 1.579 2.429 1.00 0.00 O ATOM 2096 CB VAL A 138 25.765 0.922 1.467 1.00 0.00 C ATOM 2097 CG1 VAL A 138 25.462 1.019 2.964 1.00 0.00 C ATOM 2098 CG2 VAL A 138 26.606 -0.320 1.158 1.00 0.00 C ATOM 0 H VAL A 138 25.063 2.870 0.124 1.00 0.00 H new ATOM 0 HA VAL A 138 24.516 0.054 -0.007 1.00 0.00 H new ATOM 0 HB VAL A 138 26.346 1.800 1.185 1.00 0.00 H new ATOM 0 HG11 VAL A 138 26.396 1.013 3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 138 24.922 1.944 3.167 1.00 0.00 H new ATOM 0 HG13 VAL A 138 24.851 0.169 3.267 1.00 0.00 H new ATOM 0 HG21 VAL A 138 27.518 -0.300 1.755 1.00 0.00 H new ATOM 0 HG22 VAL A 138 26.034 -1.216 1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 138 26.866 -0.329 0.099 1.00 0.00 H new ATOM 2108 N LEU A 139 22.414 -0.205 1.171 1.00 0.00 N ATOM 2109 CA LEU A 139 21.183 -0.450 1.901 1.00 0.00 C ATOM 2110 C LEU A 139 20.509 -1.708 1.347 1.00 0.00 C ATOM 2111 O LEU A 139 20.144 -2.607 2.105 1.00 0.00 O ATOM 2112 CB LEU A 139 20.286 0.789 1.875 1.00 0.00 C ATOM 2113 CG LEU A 139 19.375 0.984 3.088 1.00 0.00 C ATOM 2114 CD1 LEU A 139 19.426 2.431 3.584 1.00 0.00 C ATOM 2115 CD2 LEU A 139 17.946 0.533 2.779 1.00 0.00 C ATOM 0 H LEU A 139 22.592 -0.854 0.404 1.00 0.00 H new ATOM 0 HA LEU A 139 21.396 -0.637 2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 139 20.920 1.670 1.777 1.00 0.00 H new ATOM 0 HB3 LEU A 139 19.663 0.743 0.982 1.00 0.00 H new ATOM 0 HG LEU A 139 19.743 0.353 3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 139 18.770 2.543 4.447 1.00 0.00 H new ATOM 0 HD12 LEU A 139 20.447 2.682 3.870 1.00 0.00 H new ATOM 0 HD13 LEU A 139 19.097 3.100 2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 139 17.319 0.682 3.658 1.00 0.00 H new ATOM 0 HD22 LEU A 139 17.551 1.118 1.948 1.00 0.00 H new ATOM 0 HD23 LEU A 139 17.948 -0.523 2.510 1.00 0.00 H new ATOM 2127 N ALA A 140 20.365 -1.732 0.030 1.00 0.00 N ATOM 2128 CA ALA A 140 19.741 -2.865 -0.633 1.00 0.00 C ATOM 2129 C ALA A 140 20.754 -4.006 -0.746 1.00 0.00 C ATOM 2130 O ALA A 140 21.952 -3.797 -0.563 1.00 0.00 O ATOM 2131 CB ALA A 140 19.206 -2.425 -1.998 1.00 0.00 C ATOM 0 H ALA A 140 20.669 -0.986 -0.595 1.00 0.00 H new ATOM 0 HA ALA A 140 18.895 -3.231 -0.052 1.00 0.00 H new ATOM 0 HB1 ALA A 140 18.738 -3.274 -2.496 1.00 0.00 H new ATOM 0 HB2 ALA A 140 18.470 -1.633 -1.862 1.00 0.00 H new ATOM 0 HB3 ALA A 140 20.029 -2.054 -2.609 1.00 0.00 H new ATOM 2137 N GLU A 141 20.235 -5.187 -1.044 1.00 0.00 N ATOM 2138 CA GLU A 141 21.079 -6.362 -1.183 1.00 0.00 C ATOM 2139 C GLU A 141 21.939 -6.254 -2.444 1.00 0.00 C ATOM 2140 O GLU A 141 21.575 -6.778 -3.495 1.00 0.00 O ATOM 2141 CB GLU A 141 20.240 -7.642 -1.200 1.00 0.00 C ATOM 2142 CG GLU A 141 20.541 -8.511 0.023 1.00 0.00 C ATOM 2143 CD GLU A 141 20.464 -9.998 -0.330 1.00 0.00 C ATOM 2144 OE1 GLU A 141 21.248 -10.412 -1.212 1.00 0.00 O ATOM 2145 OE2 GLU A 141 19.627 -10.686 0.291 1.00 0.00 O ATOM 0 H GLU A 141 19.240 -5.356 -1.193 1.00 0.00 H new ATOM 0 HA GLU A 141 21.741 -6.412 -0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 141 19.181 -7.386 -1.217 1.00 0.00 H new ATOM 0 HB3 GLU A 141 20.447 -8.205 -2.110 1.00 0.00 H new ATOM 0 HG2 GLU A 141 21.534 -8.275 0.406 1.00 0.00 H new ATOM 0 HG3 GLU A 141 19.831 -8.285 0.818 1.00 0.00 H new ATOM 2152 N VAL A 142 23.064 -5.568 -2.297 1.00 0.00 N ATOM 2153 CA VAL A 142 23.979 -5.383 -3.411 1.00 0.00 C ATOM 2154 C VAL A 142 25.257 -6.182 -3.153 1.00 0.00 C ATOM 2155 O VAL A 142 25.879 -6.684 -4.088 1.00 0.00 O ATOM 2156 CB VAL A 142 24.239 -3.893 -3.633 1.00 0.00 C ATOM 2157 CG1 VAL A 142 25.233 -3.350 -2.604 1.00 0.00 C ATOM 2158 CG2 VAL A 142 24.724 -3.626 -5.059 1.00 0.00 C ATOM 0 H VAL A 142 23.362 -5.134 -1.424 1.00 0.00 H new ATOM 0 HA VAL A 142 23.540 -5.762 -4.334 1.00 0.00 H new ATOM 0 HB VAL A 142 23.295 -3.365 -3.497 1.00 0.00 H new ATOM 0 HG11 VAL A 142 25.400 -2.288 -2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 142 24.830 -3.488 -1.601 1.00 0.00 H new ATOM 0 HG13 VAL A 142 26.178 -3.886 -2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 142 24.901 -2.558 -5.189 1.00 0.00 H new ATOM 0 HG22 VAL A 142 25.651 -4.172 -5.236 1.00 0.00 H new ATOM 0 HG23 VAL A 142 23.966 -3.957 -5.769 1.00 0.00 H new