USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1426 hydrogens (16 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 NoAdj : A 64 ASNHD21 : A 64 ASN OD1 : A 203 CACA :(metal ligand) USER MOD NoAdj : A 64 ASNHD22 : A 64 ASN OD1 : A 203 CACA :(metal ligand) USER MOD NoAdj : B 64 ASNHD21 : B 64 ASN OD1 : B 203 CACA :(metal ligand) USER MOD NoAdj : B 64 ASNHD22 : B 64 ASN OD1 : B 203 CACA :(metal ligand) USER MOD NoAdj-H: A 201 HCS HXT : A 201 HCS OXT : A 201 HCS C :(short bond) USER MOD NoAdj-H: B 201 HCS HXT : B 201 HCS OXT : B 201 HCS C :(short bond) USER MOD Set 1.1: B 34 LYS NZ :NH3+ -168:sc= -1.29! (180deg=-0.936) USER MOD Set 1.2: B 38 GLN :FLIP amide:sc= -3.26! C(o=-19!,f=-4.6!) USER MOD Set 2.1: B 29 SER OG : rot 8:sc= -2.36 USER MOD Set 2.2: B 31 LYS NZ :NH3+ 176:sc= 1.19 (180deg=0) USER MOD Set 3.1: B 18 HIS :FLIP no HD1:sc= -1.58 F(o=-5.5,f=-4.2) USER MOD Set 3.2: B 21 LYS NZ :NH3+ 144:sc= -3.5! (180deg=-3.55!) USER MOD Set 3.3: B 39 THR OG1 : rot -22:sc= 0.827 USER MOD Set 4.1: A 82 THR OG1 : rot 74:sc= 0.549 USER MOD Set 4.2: B 8 MET CE :methyl -143:sc= -1.04 (180deg=-0.687) USER MOD Set 5.1: A 34 LYS NZ :NH3+ -164:sc= -1.48! (180deg=-0.861) USER MOD Set 5.2: A 38 GLN :FLIP amide:sc= -3.16! C(o=-18!,f=-4.6!) USER MOD Set 6.1: A 29 SER OG : rot 8:sc= -2.39 USER MOD Set 6.2: A 31 LYS NZ :NH3+ 180:sc= 1.25 (180deg=0) USER MOD Set 7.1: A 18 HIS :FLIP no HD1:sc= -1.55 F(o=-5.6,f=-4.4) USER MOD Set 7.2: A 21 LYS NZ :NH3+ 143:sc= -3.62! (180deg=-3.57!) USER MOD Set 7.3: A 39 THR OG1 : rot -21:sc= 0.793 USER MOD Set 8.1: A 8 MET CE :methyl -141:sc= -1.03 (180deg=-0.745) USER MOD Set 8.2: B 82 THR OG1 : rot 71:sc= 0.617 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0637 (180deg=0) USER MOD Single : A 2 SER OG : rot 20:sc= -2.09! USER MOD Single : A 6 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 10 THR OG1 : rot 68:sc= 1.1 USER MOD Single : A 13 ASN : amide:sc= -0.729 K(o=-0.73,f=-2.4!) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 19 SER OG : rot 50:sc= -0.723 USER MOD Single : A 25 LYS NZ :NH3+ -161:sc= -0.759 (180deg=-1.42) USER MOD Single : A 26 TYR OH : rot -142:sc= -0.243! USER MOD Single : A 27 LYS NZ :NH3+ -157:sc= 0.785! (180deg=0.182!) USER MOD Single : A 30 LYS NZ :NH3+ 148:sc= -0.102 (180deg=-0.653) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.13) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -159:sc= -0.27 (180deg=-0.913) USER MOD Single : A 58 MET CE :methyl -134:sc= -0.527 (180deg=-5.05!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 74 TYR OH : rot 120:sc= -1.31 USER MOD Single : A 86 ASN :FLIP amide:sc= -2.48! C(o=-3.6!,f=-2.5!) USER MOD Single : A 87 ASN : amide:sc= -3.74! C(o=-3.7!,f=-3.6!) USER MOD Single : A 92 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 93 SER OG : rot -70:sc= 0.978 USER MOD Single : B 1 GLY N :NH3+ 134:sc= 0.0655 (180deg=0) USER MOD Single : B 2 SER OG : rot 24:sc= -2.13! USER MOD Single : B 6 THR OG1 : rot 86:sc= 1.22 USER MOD Single : B 10 THR OG1 : rot 69:sc= 1.12 USER MOD Single : B 13 ASN : amide:sc= -0.664 K(o=-0.66,f=-2.3!) USER MOD Single : B 16 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : B 19 SER OG : rot 50:sc= -0.621 USER MOD Single : B 25 LYS NZ :NH3+ -157:sc= -0.805 (180deg=-1.48) USER MOD Single : B 26 TYR OH : rot -150:sc= -0.161 USER MOD Single : B 27 LYS NZ :NH3+ -164:sc= 0.75 (180deg=0.28!) USER MOD Single : B 30 LYS NZ :NH3+ 147:sc= -0.098 (180deg=-0.655) USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.14) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ -159:sc= -0.269 (180deg=-0.869) USER MOD Single : B 58 MET CE :methyl -133:sc= -0.511 (180deg=-5.07!) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : B 74 TYR OH : rot 120:sc= -1.33 USER MOD Single : B 86 ASN :FLIP amide:sc= -2.7! C(o=-3.6!,f=-2.7!) USER MOD Single : B 87 ASN : amide:sc= -3.55! C(o=-3.5!,f=-3.7!) USER MOD Single : B 92 ASN : amide:sc= -0.0084 K(o=-0.0084,f=-1.6!) USER MOD Single : B 93 SER OG : rot -67:sc= 0.983 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.613 9.001 14.336 1.00 0.00 N ATOM 2 CA GLY A 1 -9.527 8.470 13.520 1.00 0.00 C ATOM 3 C GLY A 1 -9.898 7.112 12.934 1.00 0.00 C ATOM 4 O GLY A 1 -10.730 6.393 13.487 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.975 9.876 13.905 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.379 8.300 14.393 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.260 9.206 15.293 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.298 9.168 12.714 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.625 8.375 14.125 1.00 0.00 H new ATOM 8 N SER A 2 -9.274 6.768 11.810 1.00 0.00 N ATOM 9 CA SER A 2 -9.542 5.491 11.149 1.00 0.00 C ATOM 10 C SER A 2 -8.284 4.635 11.084 1.00 0.00 C ATOM 11 O SER A 2 -7.185 5.145 10.865 1.00 0.00 O ATOM 12 CB SER A 2 -10.057 5.742 9.738 1.00 0.00 C ATOM 13 OG SER A 2 -10.271 4.495 9.097 1.00 0.00 O ATOM 0 H SER A 2 -8.583 7.351 11.339 1.00 0.00 H new ATOM 0 HA SER A 2 -10.295 4.957 11.729 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.985 6.312 9.772 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.338 6.337 9.175 1.00 0.00 H new ATOM 0 HG SER A 2 -10.356 3.790 9.773 1.00 0.00 H new ATOM 19 N GLU A 3 -8.451 3.331 11.283 1.00 0.00 N ATOM 20 CA GLU A 3 -7.317 2.417 11.253 1.00 0.00 C ATOM 21 C GLU A 3 -6.646 2.374 9.884 1.00 0.00 C ATOM 22 O GLU A 3 -5.419 2.288 9.793 1.00 0.00 O ATOM 23 CB GLU A 3 -7.791 1.007 11.614 1.00 0.00 C ATOM 24 CG GLU A 3 -8.264 0.982 13.064 1.00 0.00 C ATOM 25 CD GLU A 3 -8.687 -0.431 13.452 1.00 0.00 C ATOM 26 OE1 GLU A 3 -8.759 -1.270 12.570 1.00 0.00 O ATOM 27 OE2 GLU A 3 -8.932 -0.654 14.626 1.00 0.00 O ATOM 0 H GLU A 3 -9.352 2.888 11.465 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.586 2.780 11.976 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -8.602 0.704 10.951 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.980 0.293 11.473 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -7.465 1.324 13.721 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -9.100 1.669 13.194 1.00 0.00 H new ATOM 34 N LEU A 4 -7.437 2.420 8.815 1.00 0.00 N ATOM 35 CA LEU A 4 -6.852 2.366 7.481 1.00 0.00 C ATOM 36 C LEU A 4 -5.983 3.604 7.261 1.00 0.00 C ATOM 37 O LEU A 4 -4.861 3.530 6.737 1.00 0.00 O ATOM 38 CB LEU A 4 -7.973 2.365 6.444 1.00 0.00 C ATOM 39 CG LEU A 4 -7.453 1.847 5.085 1.00 0.00 C ATOM 40 CD1 LEU A 4 -8.624 1.563 4.134 1.00 0.00 C ATOM 41 CD2 LEU A 4 -6.483 2.835 4.426 1.00 0.00 C ATOM 0 H LEU A 4 -8.454 2.492 8.843 1.00 0.00 H new ATOM 0 HA LEU A 4 -6.248 1.464 7.383 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -8.795 1.737 6.789 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.370 3.374 6.328 1.00 0.00 H new ATOM 0 HG LEU A 4 -6.910 0.923 5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -8.239 1.199 3.181 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -9.276 0.808 4.574 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -9.190 2.480 3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.143 2.430 3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.990 3.785 4.256 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.625 2.994 5.080 1.00 0.00 H new ATOM 53 N GLU A 5 -6.515 4.750 7.694 1.00 0.00 N ATOM 54 CA GLU A 5 -5.799 6.009 7.563 1.00 0.00 C ATOM 55 C GLU A 5 -4.539 5.961 8.406 1.00 0.00 C ATOM 56 O GLU A 5 -3.476 6.415 7.986 1.00 0.00 O ATOM 57 CB GLU A 5 -6.699 7.163 8.023 1.00 0.00 C ATOM 58 CG GLU A 5 -6.261 8.478 7.369 1.00 0.00 C ATOM 59 CD GLU A 5 -4.933 8.947 7.956 1.00 0.00 C ATOM 60 OE1 GLU A 5 -4.552 8.434 8.995 1.00 0.00 O ATOM 61 OE2 GLU A 5 -4.318 9.814 7.358 1.00 0.00 O ATOM 0 H GLU A 5 -7.432 4.826 8.134 1.00 0.00 H new ATOM 0 HA GLU A 5 -5.525 6.169 6.520 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -7.736 6.949 7.764 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -6.654 7.257 9.108 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -6.162 8.341 6.292 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.024 9.241 7.524 1.00 0.00 H new ATOM 68 N THR A 6 -4.663 5.375 9.594 1.00 0.00 N ATOM 69 CA THR A 6 -3.519 5.245 10.479 1.00 0.00 C ATOM 70 C THR A 6 -2.447 4.427 9.785 1.00 0.00 C ATOM 71 O THR A 6 -1.255 4.733 9.869 1.00 0.00 O ATOM 72 CB THR A 6 -3.936 4.559 11.782 1.00 0.00 C ATOM 73 OG1 THR A 6 -5.020 5.270 12.364 1.00 0.00 O ATOM 74 CG2 THR A 6 -2.754 4.544 12.753 1.00 0.00 C ATOM 0 H THR A 6 -5.534 4.989 9.959 1.00 0.00 H new ATOM 0 HA THR A 6 -3.130 6.235 10.717 1.00 0.00 H new ATOM 0 HB THR A 6 -4.244 3.535 11.572 1.00 0.00 H new ATOM 0 HG1 THR A 6 -5.866 4.923 12.011 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.051 4.055 13.681 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.923 3.999 12.306 1.00 0.00 H new ATOM 0 HG23 THR A 6 -2.444 5.567 12.965 1.00 0.00 H new ATOM 82 N ALA A 7 -2.886 3.386 9.084 1.00 0.00 N ATOM 83 CA ALA A 7 -1.956 2.535 8.367 1.00 0.00 C ATOM 84 C ALA A 7 -1.249 3.331 7.280 1.00 0.00 C ATOM 85 O ALA A 7 -0.030 3.241 7.128 1.00 0.00 O ATOM 86 CB ALA A 7 -2.716 1.369 7.735 1.00 0.00 C ATOM 0 H ALA A 7 -3.867 3.118 9.000 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.213 2.152 9.066 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -2.018 0.729 7.196 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.210 0.791 8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.464 1.755 7.042 1.00 0.00 H new ATOM 92 N MET A 8 -2.012 4.141 6.544 1.00 0.00 N ATOM 93 CA MET A 8 -1.409 4.961 5.492 1.00 0.00 C ATOM 94 C MET A 8 -0.350 5.876 6.105 1.00 0.00 C ATOM 95 O MET A 8 0.764 6.041 5.569 1.00 0.00 O ATOM 96 CB MET A 8 -2.509 5.813 4.840 1.00 0.00 C ATOM 97 CG MET A 8 -3.493 4.912 4.077 1.00 0.00 C ATOM 98 SD MET A 8 -4.780 5.916 3.281 1.00 0.00 S ATOM 99 CE MET A 8 -3.786 6.618 1.951 1.00 0.00 C ATOM 0 H MET A 8 -3.021 4.246 6.651 1.00 0.00 H new ATOM 0 HA MET A 8 -0.941 4.322 4.743 1.00 0.00 H new ATOM 0 HB2 MET A 8 -3.041 6.380 5.604 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.063 6.537 4.158 1.00 0.00 H new ATOM 0 HG2 MET A 8 -2.958 4.332 3.325 1.00 0.00 H new ATOM 0 HG3 MET A 8 -3.951 4.199 4.763 1.00 0.00 H new ATOM 0 HE1 MET A 8 -4.068 7.659 1.797 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.731 6.564 2.218 1.00 0.00 H new ATOM 0 HE3 MET A 8 -3.957 6.056 1.033 1.00 0.00 H new ATOM 109 N GLU A 9 -0.682 6.428 7.268 1.00 0.00 N ATOM 110 CA GLU A 9 0.249 7.283 7.971 1.00 0.00 C ATOM 111 C GLU A 9 1.462 6.486 8.406 1.00 0.00 C ATOM 112 O GLU A 9 2.577 7.000 8.405 1.00 0.00 O ATOM 113 CB GLU A 9 -0.420 7.918 9.193 1.00 0.00 C ATOM 114 CG GLU A 9 -1.522 8.876 8.737 1.00 0.00 C ATOM 115 CD GLU A 9 -2.155 9.557 9.946 1.00 0.00 C ATOM 116 OE1 GLU A 9 -1.848 9.155 11.055 1.00 0.00 O ATOM 117 OE2 GLU A 9 -2.937 10.472 9.744 1.00 0.00 O ATOM 0 H GLU A 9 -1.580 6.297 7.734 1.00 0.00 H new ATOM 0 HA GLU A 9 0.565 8.077 7.294 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.841 7.143 9.833 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.320 8.455 9.787 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.108 9.626 8.063 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.282 8.330 8.178 1.00 0.00 H new ATOM 124 N THR A 10 1.250 5.222 8.775 1.00 0.00 N ATOM 125 CA THR A 10 2.362 4.398 9.195 1.00 0.00 C ATOM 126 C THR A 10 3.326 4.194 8.042 1.00 0.00 C ATOM 127 O THR A 10 4.542 4.289 8.215 1.00 0.00 O ATOM 128 CB THR A 10 1.855 3.045 9.691 1.00 0.00 C ATOM 129 OG1 THR A 10 0.891 3.249 10.714 1.00 0.00 O ATOM 130 CG2 THR A 10 3.028 2.235 10.245 1.00 0.00 C ATOM 0 H THR A 10 0.339 4.764 8.789 1.00 0.00 H new ATOM 0 HA THR A 10 2.883 4.903 10.008 1.00 0.00 H new ATOM 0 HB THR A 10 1.397 2.500 8.865 1.00 0.00 H new ATOM 0 HG1 THR A 10 0.087 3.657 10.329 1.00 0.00 H new ATOM 0 HG21 THR A 10 2.668 1.269 10.599 1.00 0.00 H new ATOM 0 HG22 THR A 10 3.767 2.081 9.459 1.00 0.00 H new ATOM 0 HG23 THR A 10 3.486 2.777 11.072 1.00 0.00 H new ATOM 138 N LEU A 11 2.784 3.918 6.854 1.00 0.00 N ATOM 139 CA LEU A 11 3.651 3.709 5.704 1.00 0.00 C ATOM 140 C LEU A 11 4.431 4.983 5.425 1.00 0.00 C ATOM 141 O LEU A 11 5.648 4.951 5.180 1.00 0.00 O ATOM 142 CB LEU A 11 2.826 3.362 4.457 1.00 0.00 C ATOM 143 CG LEU A 11 1.894 2.169 4.713 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.215 1.768 3.403 1.00 0.00 C ATOM 145 CD2 LEU A 11 2.664 0.973 5.273 1.00 0.00 C ATOM 0 H LEU A 11 1.784 3.837 6.670 1.00 0.00 H new ATOM 0 HA LEU A 11 4.327 2.884 5.929 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.236 4.228 4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.496 3.131 3.629 1.00 0.00 H new ATOM 0 HG LEU A 11 1.148 2.469 5.449 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.552 0.921 3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.635 2.608 3.022 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.973 1.488 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.976 0.145 5.443 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.430 0.668 4.560 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.136 1.253 6.215 1.00 0.00 H new ATOM 157 N ILE A 12 3.729 6.116 5.494 1.00 0.00 N ATOM 158 CA ILE A 12 4.391 7.395 5.263 1.00 0.00 C ATOM 159 C ILE A 12 5.480 7.649 6.297 1.00 0.00 C ATOM 160 O ILE A 12 6.591 8.062 5.958 1.00 0.00 O ATOM 161 CB ILE A 12 3.377 8.547 5.291 1.00 0.00 C ATOM 162 CG1 ILE A 12 2.366 8.379 4.149 1.00 0.00 C ATOM 163 CG2 ILE A 12 4.115 9.876 5.129 1.00 0.00 C ATOM 164 CD1 ILE A 12 1.242 9.409 4.293 1.00 0.00 C ATOM 0 H ILE A 12 2.732 6.173 5.702 1.00 0.00 H new ATOM 0 HA ILE A 12 4.852 7.348 4.276 1.00 0.00 H new ATOM 0 HB ILE A 12 2.846 8.537 6.243 1.00 0.00 H new ATOM 0 HG12 ILE A 12 2.865 8.504 3.188 1.00 0.00 H new ATOM 0 HG13 ILE A 12 1.952 7.371 4.164 1.00 0.00 H new ATOM 0 HG21 ILE A 12 3.397 10.696 5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 12 4.828 9.998 5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 12 4.648 9.883 4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 12 0.528 9.284 3.479 1.00 0.00 H new ATOM 0 HD12 ILE A 12 0.735 9.263 5.247 1.00 0.00 H new ATOM 0 HD13 ILE A 12 1.662 10.414 4.256 1.00 0.00 H new ATOM 176 N ASN A 13 5.145 7.422 7.562 1.00 0.00 N ATOM 177 CA ASN A 13 6.090 7.655 8.641 1.00 0.00 C ATOM 178 C ASN A 13 7.340 6.787 8.534 1.00 0.00 C ATOM 179 O ASN A 13 8.441 7.271 8.775 1.00 0.00 O ATOM 180 CB ASN A 13 5.406 7.391 9.981 1.00 0.00 C ATOM 181 CG ASN A 13 4.282 8.397 10.201 1.00 0.00 C ATOM 182 OD1 ASN A 13 4.244 9.438 9.546 1.00 0.00 O ATOM 183 ND2 ASN A 13 3.359 8.146 11.088 1.00 0.00 N ATOM 0 H ASN A 13 4.232 7.079 7.862 1.00 0.00 H new ATOM 0 HA ASN A 13 6.411 8.694 8.567 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.006 6.377 10.001 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.133 7.463 10.790 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.603 8.814 11.240 1.00 0.00 H new ATOM 0 HD22 ASN A 13 3.393 7.282 11.629 1.00 0.00 H new ATOM 190 N VAL A 14 7.185 5.507 8.184 1.00 0.00 N ATOM 191 CA VAL A 14 8.369 4.644 8.092 1.00 0.00 C ATOM 192 C VAL A 14 9.209 4.952 6.842 1.00 0.00 C ATOM 193 O VAL A 14 10.460 5.039 6.921 1.00 0.00 O ATOM 194 CB VAL A 14 7.994 3.141 8.164 1.00 0.00 C ATOM 195 CG1 VAL A 14 7.154 2.875 9.424 1.00 0.00 C ATOM 196 CG2 VAL A 14 7.207 2.684 6.926 1.00 0.00 C ATOM 0 H VAL A 14 6.294 5.059 7.968 1.00 0.00 H new ATOM 0 HA VAL A 14 8.988 4.867 8.961 1.00 0.00 H new ATOM 0 HB VAL A 14 8.924 2.573 8.201 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.893 1.818 9.471 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.730 3.146 10.309 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.243 3.473 9.387 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.965 1.625 7.019 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.286 3.261 6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 14 7.811 2.841 6.032 1.00 0.00 H new ATOM 206 N PHE A 15 8.547 5.178 5.696 1.00 0.00 N ATOM 207 CA PHE A 15 9.301 5.511 4.501 1.00 0.00 C ATOM 208 C PHE A 15 10.079 6.782 4.733 1.00 0.00 C ATOM 209 O PHE A 15 11.278 6.855 4.467 1.00 0.00 O ATOM 210 CB PHE A 15 8.384 5.676 3.293 1.00 0.00 C ATOM 211 CG PHE A 15 9.246 6.000 2.103 1.00 0.00 C ATOM 212 CD1 PHE A 15 10.029 5.006 1.510 1.00 0.00 C ATOM 213 CD2 PHE A 15 9.272 7.306 1.600 1.00 0.00 C ATOM 214 CE1 PHE A 15 10.840 5.320 0.414 1.00 0.00 C ATOM 215 CE2 PHE A 15 10.079 7.616 0.502 1.00 0.00 C ATOM 216 CZ PHE A 15 10.866 6.624 -0.090 1.00 0.00 C ATOM 0 H PHE A 15 7.534 5.137 5.582 1.00 0.00 H new ATOM 0 HA PHE A 15 9.988 4.691 4.291 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.817 4.762 3.116 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.660 6.472 3.469 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.008 3.998 1.897 1.00 0.00 H new ATOM 0 HD2 PHE A 15 8.668 8.074 2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 15 11.447 4.553 -0.044 1.00 0.00 H new ATOM 0 HE2 PHE A 15 10.095 8.622 0.111 1.00 0.00 H new ATOM 0 HZ PHE A 15 11.493 6.864 -0.936 1.00 0.00 H new ATOM 226 N HIS A 16 9.390 7.771 5.267 1.00 0.00 N ATOM 227 CA HIS A 16 10.026 9.029 5.577 1.00 0.00 C ATOM 228 C HIS A 16 11.071 8.833 6.637 1.00 0.00 C ATOM 229 O HIS A 16 12.101 9.508 6.636 1.00 0.00 O ATOM 230 CB HIS A 16 8.996 10.068 6.021 1.00 0.00 C ATOM 231 CG HIS A 16 9.679 11.388 6.243 1.00 0.00 C ATOM 232 ND1 HIS A 16 10.250 12.108 5.206 1.00 0.00 N ATOM 233 CD2 HIS A 16 9.889 12.134 7.377 1.00 0.00 C ATOM 234 CE1 HIS A 16 10.773 13.232 5.732 1.00 0.00 C ATOM 235 NE2 HIS A 16 10.580 13.297 7.052 1.00 0.00 N ATOM 0 H HIS A 16 8.396 7.726 5.493 1.00 0.00 H new ATOM 0 HA HIS A 16 10.509 9.402 4.674 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.219 10.172 5.264 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.506 9.741 6.938 1.00 0.00 H new ATOM 0 HD2 HIS A 16 9.567 11.859 8.370 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.286 13.989 5.157 1.00 0.00 H new ATOM 0 HE2 HIS A 16 10.876 14.040 7.686 1.00 0.00 H new ATOM 244 N ALA A 17 10.806 7.927 7.565 1.00 0.00 N ATOM 245 CA ALA A 17 11.758 7.721 8.621 1.00 0.00 C ATOM 246 C ALA A 17 13.096 7.354 8.045 1.00 0.00 C ATOM 247 O ALA A 17 14.095 7.985 8.344 1.00 0.00 O ATOM 248 CB ALA A 17 11.319 6.552 9.516 1.00 0.00 C ATOM 0 H ALA A 17 9.968 7.346 7.603 1.00 0.00 H new ATOM 0 HA ALA A 17 11.820 8.645 9.196 1.00 0.00 H new ATOM 0 HB1 ALA A 17 12.050 6.408 10.311 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.346 6.774 9.954 1.00 0.00 H new ATOM 0 HB3 ALA A 17 11.249 5.643 8.919 1.00 0.00 H new ATOM 254 N HIS A 18 13.128 6.351 7.191 1.00 0.00 N ATOM 255 CA HIS A 18 14.420 5.963 6.621 1.00 0.00 C ATOM 256 C HIS A 18 14.895 6.865 5.488 1.00 0.00 C ATOM 257 O HIS A 18 16.048 7.311 5.492 1.00 0.00 O ATOM 258 CB HIS A 18 14.395 4.503 6.196 1.00 0.00 C ATOM 259 CG HIS A 18 14.580 3.642 7.418 1.00 0.00 C ATOM 260 ND1 HIS A 18 13.805 3.450 8.534 1.00 0.00 N flip ATOM 261 CD2 HIS A 18 15.728 2.894 7.623 1.00 0.00 C flip ATOM 262 CE1 HIS A 18 14.459 2.599 9.418 1.00 0.00 C flip ATOM 263 NE2 HIS A 18 15.613 2.295 8.821 1.00 0.00 N flip ATOM 0 H HIS A 18 12.322 5.807 6.882 1.00 0.00 H new ATOM 0 HA HIS A 18 15.156 6.092 7.415 1.00 0.00 H new ATOM 0 HB2 HIS A 18 13.450 4.268 5.707 1.00 0.00 H new ATOM 0 HB3 HIS A 18 15.186 4.306 5.472 1.00 0.00 H new ATOM 0 HD2 HIS A 18 16.563 2.808 6.944 1.00 0.00 H new ATOM 0 HE1 HIS A 18 14.108 2.258 10.381 1.00 0.00 H new ATOM 0 HE2 HIS A 18 16.322 1.683 9.225 1.00 0.00 H new ATOM 272 N SER A 19 14.031 7.123 4.506 1.00 0.00 N ATOM 273 CA SER A 19 14.448 7.955 3.387 1.00 0.00 C ATOM 274 C SER A 19 14.913 9.314 3.872 1.00 0.00 C ATOM 275 O SER A 19 15.921 9.841 3.397 1.00 0.00 O ATOM 276 CB SER A 19 13.301 8.166 2.406 1.00 0.00 C ATOM 277 OG SER A 19 13.779 8.957 1.321 1.00 0.00 O ATOM 0 H SER A 19 13.071 6.780 4.464 1.00 0.00 H new ATOM 0 HA SER A 19 15.267 7.437 2.889 1.00 0.00 H new ATOM 0 HB2 SER A 19 12.931 7.207 2.043 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.466 8.663 2.899 1.00 0.00 H new ATOM 0 HG SER A 19 14.618 8.578 0.984 1.00 0.00 H new ATOM 283 N GLY A 20 14.176 9.876 4.825 1.00 0.00 N ATOM 284 CA GLY A 20 14.529 11.176 5.368 1.00 0.00 C ATOM 285 C GLY A 20 15.682 11.086 6.365 1.00 0.00 C ATOM 286 O GLY A 20 16.588 11.920 6.348 1.00 0.00 O ATOM 0 H GLY A 20 13.341 9.455 5.231 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.805 11.846 4.554 1.00 0.00 H new ATOM 0 HA3 GLY A 20 13.659 11.612 5.859 1.00 0.00 H new ATOM 290 N LYS A 21 15.643 10.083 7.248 1.00 0.00 N ATOM 291 CA LYS A 21 16.701 9.931 8.254 1.00 0.00 C ATOM 292 C LYS A 21 18.091 9.767 7.651 1.00 0.00 C ATOM 293 O LYS A 21 19.052 10.337 8.167 1.00 0.00 O ATOM 294 CB LYS A 21 16.400 8.717 9.126 1.00 0.00 C ATOM 295 CG LYS A 21 17.476 8.520 10.184 1.00 0.00 C ATOM 296 CD LYS A 21 17.090 7.308 11.032 1.00 0.00 C ATOM 297 CE LYS A 21 17.141 6.035 10.178 1.00 0.00 C ATOM 298 NZ LYS A 21 15.778 5.735 9.657 1.00 0.00 N ATOM 0 H LYS A 21 14.907 9.378 7.288 1.00 0.00 H new ATOM 0 HA LYS A 21 16.708 10.851 8.839 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.431 8.844 9.608 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.332 7.826 8.502 1.00 0.00 H new ATOM 0 HG2 LYS A 21 18.447 8.363 9.715 1.00 0.00 H new ATOM 0 HG3 LYS A 21 17.564 9.409 10.808 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.769 7.215 11.879 1.00 0.00 H new ATOM 0 HD3 LYS A 21 16.088 7.443 11.440 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.838 6.167 9.350 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.507 5.199 10.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 15.851 5.358 8.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 15.319 5.031 10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 15.211 6.607 9.646 1.00 0.00 H new ATOM 312 N GLU A 22 18.221 8.972 6.589 1.00 0.00 N ATOM 313 CA GLU A 22 19.544 8.752 5.997 1.00 0.00 C ATOM 314 C GLU A 22 19.578 9.035 4.498 1.00 0.00 C ATOM 315 O GLU A 22 18.647 8.699 3.765 1.00 0.00 O ATOM 316 CB GLU A 22 19.989 7.312 6.264 1.00 0.00 C ATOM 317 CG GLU A 22 21.431 7.124 5.789 1.00 0.00 C ATOM 318 CD GLU A 22 21.859 5.672 5.981 1.00 0.00 C ATOM 319 OE1 GLU A 22 21.043 4.890 6.441 1.00 0.00 O ATOM 320 OE2 GLU A 22 22.998 5.366 5.672 1.00 0.00 O ATOM 0 H GLU A 22 17.453 8.482 6.131 1.00 0.00 H new ATOM 0 HA GLU A 22 20.230 9.456 6.467 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.914 7.089 7.328 1.00 0.00 H new ATOM 0 HB3 GLU A 22 19.331 6.615 5.745 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.515 7.401 4.738 1.00 0.00 H new ATOM 0 HG3 GLU A 22 22.095 7.784 6.347 1.00 0.00 H new ATOM 327 N GLY A 23 20.689 9.627 4.055 1.00 0.00 N ATOM 328 CA GLY A 23 20.894 9.918 2.639 1.00 0.00 C ATOM 329 C GLY A 23 19.928 10.970 2.123 1.00 0.00 C ATOM 330 O GLY A 23 19.466 11.836 2.866 1.00 0.00 O ATOM 0 H GLY A 23 21.460 9.914 4.659 1.00 0.00 H new ATOM 0 HA2 GLY A 23 21.917 10.260 2.485 1.00 0.00 H new ATOM 0 HA3 GLY A 23 20.774 9.002 2.061 1.00 0.00 H new ATOM 334 N ASP A 24 19.619 10.866 0.834 1.00 0.00 N ATOM 335 CA ASP A 24 18.694 11.788 0.198 1.00 0.00 C ATOM 336 C ASP A 24 17.293 11.556 0.739 1.00 0.00 C ATOM 337 O ASP A 24 16.924 10.427 1.070 1.00 0.00 O ATOM 338 CB ASP A 24 18.704 11.578 -1.318 1.00 0.00 C ATOM 339 CG ASP A 24 20.062 11.968 -1.890 1.00 0.00 C ATOM 340 OD1 ASP A 24 20.826 12.594 -1.174 1.00 0.00 O ATOM 341 OD2 ASP A 24 20.318 11.635 -3.035 1.00 0.00 O ATOM 0 H ASP A 24 19.997 10.151 0.212 1.00 0.00 H new ATOM 0 HA ASP A 24 19.002 12.811 0.416 1.00 0.00 H new ATOM 0 HB2 ASP A 24 18.488 10.535 -1.550 1.00 0.00 H new ATOM 0 HB3 ASP A 24 17.920 12.176 -1.781 1.00 0.00 H new ATOM 346 N LYS A 25 16.517 12.625 0.841 1.00 0.00 N ATOM 347 CA LYS A 25 15.165 12.510 1.360 1.00 0.00 C ATOM 348 C LYS A 25 14.224 12.128 0.216 1.00 0.00 C ATOM 349 O LYS A 25 14.485 12.450 -0.943 1.00 0.00 O ATOM 350 CB LYS A 25 14.718 13.843 1.964 1.00 0.00 C ATOM 351 CG LYS A 25 15.749 14.311 3.019 1.00 0.00 C ATOM 352 CD LYS A 25 15.184 15.512 3.783 1.00 0.00 C ATOM 353 CE LYS A 25 14.946 16.675 2.816 1.00 0.00 C ATOM 354 NZ LYS A 25 16.055 16.739 1.822 1.00 0.00 N ATOM 0 H LYS A 25 16.796 13.569 0.575 1.00 0.00 H new ATOM 0 HA LYS A 25 15.139 11.745 2.136 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.620 14.594 1.180 1.00 0.00 H new ATOM 0 HB3 LYS A 25 13.736 13.733 2.425 1.00 0.00 H new ATOM 0 HG2 LYS A 25 15.973 13.499 3.710 1.00 0.00 H new ATOM 0 HG3 LYS A 25 16.686 14.583 2.533 1.00 0.00 H new ATOM 0 HD2 LYS A 25 14.250 15.237 4.272 1.00 0.00 H new ATOM 0 HD3 LYS A 25 15.878 15.815 4.567 1.00 0.00 H new ATOM 0 HE2 LYS A 25 13.993 16.545 2.303 1.00 0.00 H new ATOM 0 HE3 LYS A 25 14.886 17.613 3.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 16.075 17.682 1.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 16.961 16.560 2.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 15.904 16.019 1.086 1.00 0.00 H new ATOM 368 N TYR A 26 13.138 11.439 0.544 1.00 0.00 N ATOM 369 CA TYR A 26 12.167 11.016 -0.465 1.00 0.00 C ATOM 370 C TYR A 26 12.780 10.079 -1.509 1.00 0.00 C ATOM 371 O TYR A 26 12.125 9.715 -2.486 1.00 0.00 O ATOM 372 CB TYR A 26 11.558 12.241 -1.146 1.00 0.00 C ATOM 373 CG TYR A 26 10.877 13.080 -0.095 1.00 0.00 C ATOM 374 CD1 TYR A 26 9.597 12.728 0.351 1.00 0.00 C ATOM 375 CD2 TYR A 26 11.527 14.194 0.448 1.00 0.00 C ATOM 376 CE1 TYR A 26 8.967 13.492 1.338 1.00 0.00 C ATOM 377 CE2 TYR A 26 10.897 14.956 1.438 1.00 0.00 C ATOM 378 CZ TYR A 26 9.616 14.604 1.882 1.00 0.00 C ATOM 379 OH TYR A 26 8.996 15.350 2.861 1.00 0.00 O ATOM 0 H TYR A 26 12.905 11.160 1.497 1.00 0.00 H new ATOM 0 HA TYR A 26 11.386 10.455 0.048 1.00 0.00 H new ATOM 0 HB2 TYR A 26 12.333 12.819 -1.650 1.00 0.00 H new ATOM 0 HB3 TYR A 26 10.842 11.934 -1.909 1.00 0.00 H new ATOM 0 HD1 TYR A 26 9.097 11.867 -0.067 1.00 0.00 H new ATOM 0 HD2 TYR A 26 12.514 14.465 0.103 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.979 13.223 1.680 1.00 0.00 H new ATOM 0 HE2 TYR A 26 11.398 15.815 1.860 1.00 0.00 H new ATOM 0 HH TYR A 26 9.198 16.299 2.726 1.00 0.00 H new ATOM 389 N LYS A 27 13.998 9.614 -1.246 1.00 0.00 N ATOM 390 CA LYS A 27 14.638 8.630 -2.117 1.00 0.00 C ATOM 391 C LYS A 27 15.305 7.632 -1.178 1.00 0.00 C ATOM 392 O LYS A 27 15.942 8.033 -0.198 1.00 0.00 O ATOM 393 CB LYS A 27 15.660 9.263 -3.080 1.00 0.00 C ATOM 394 CG LYS A 27 15.987 8.298 -4.234 1.00 0.00 C ATOM 395 CD LYS A 27 14.796 8.261 -5.233 1.00 0.00 C ATOM 396 CE LYS A 27 15.215 7.637 -6.564 1.00 0.00 C ATOM 397 NZ LYS A 27 14.350 8.173 -7.652 1.00 0.00 N ATOM 0 H LYS A 27 14.559 9.899 -0.443 1.00 0.00 H new ATOM 0 HA LYS A 27 13.903 8.155 -2.767 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.262 10.195 -3.480 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.572 9.513 -2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.894 8.620 -4.745 1.00 0.00 H new ATOM 0 HG3 LYS A 27 16.179 7.299 -3.843 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.974 7.690 -4.803 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.427 9.273 -5.402 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.261 7.862 -6.771 1.00 0.00 H new ATOM 0 HE3 LYS A 27 15.126 6.552 -6.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.345 7.508 -8.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 13.380 8.294 -7.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 14.720 9.092 -7.969 1.00 0.00 H new ATOM 411 N LEU A 28 15.107 6.348 -1.413 1.00 0.00 N ATOM 412 CA LEU A 28 15.643 5.339 -0.509 1.00 0.00 C ATOM 413 C LEU A 28 16.769 4.563 -1.190 1.00 0.00 C ATOM 414 O LEU A 28 16.573 3.980 -2.251 1.00 0.00 O ATOM 415 CB LEU A 28 14.447 4.447 -0.154 1.00 0.00 C ATOM 416 CG LEU A 28 14.685 3.532 1.068 1.00 0.00 C ATOM 417 CD1 LEU A 28 14.988 4.344 2.343 1.00 0.00 C ATOM 418 CD2 LEU A 28 13.394 2.723 1.326 1.00 0.00 C ATOM 0 H LEU A 28 14.587 5.979 -2.209 1.00 0.00 H new ATOM 0 HA LEU A 28 16.086 5.767 0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.581 5.079 0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.201 3.827 -1.016 1.00 0.00 H new ATOM 0 HG LEU A 28 15.539 2.891 0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.149 3.663 3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.884 4.945 2.187 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.146 4.999 2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.540 2.069 2.186 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.570 3.407 1.526 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.160 2.121 0.448 1.00 0.00 H new ATOM 430 N SER A 29 17.953 4.562 -0.580 1.00 0.00 N ATOM 431 CA SER A 29 19.092 3.858 -1.157 1.00 0.00 C ATOM 432 C SER A 29 19.108 2.388 -0.730 1.00 0.00 C ATOM 433 O SER A 29 18.377 1.995 0.180 1.00 0.00 O ATOM 434 CB SER A 29 20.399 4.551 -0.783 1.00 0.00 C ATOM 435 OG SER A 29 20.641 4.374 0.595 1.00 0.00 O ATOM 0 H SER A 29 18.146 5.035 0.303 1.00 0.00 H new ATOM 0 HA SER A 29 18.991 3.885 -2.242 1.00 0.00 H new ATOM 0 HB2 SER A 29 21.223 4.138 -1.365 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.342 5.613 -1.021 1.00 0.00 H new ATOM 0 HG SER A 29 19.984 3.748 0.965 1.00 0.00 H new ATOM 441 N LYS A 30 19.917 1.569 -1.409 1.00 0.00 N ATOM 442 CA LYS A 30 19.969 0.139 -1.093 1.00 0.00 C ATOM 443 C LYS A 30 20.323 -0.117 0.364 1.00 0.00 C ATOM 444 O LYS A 30 19.675 -0.921 1.056 1.00 0.00 O ATOM 445 CB LYS A 30 21.073 -0.525 -1.907 1.00 0.00 C ATOM 446 CG LYS A 30 21.033 -2.041 -1.681 1.00 0.00 C ATOM 447 CD LYS A 30 22.227 -2.679 -2.383 1.00 0.00 C ATOM 448 CE LYS A 30 23.521 -2.292 -1.634 1.00 0.00 C ATOM 449 NZ LYS A 30 24.255 -1.261 -2.422 1.00 0.00 N ATOM 0 H LYS A 30 20.533 1.864 -2.166 1.00 0.00 H new ATOM 0 HA LYS A 30 18.980 -0.260 -1.316 1.00 0.00 H new ATOM 0 HB2 LYS A 30 20.944 -0.301 -2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 30 22.045 -0.128 -1.613 1.00 0.00 H new ATOM 0 HG2 LYS A 30 21.060 -2.264 -0.614 1.00 0.00 H new ATOM 0 HG3 LYS A 30 20.103 -2.455 -2.069 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.115 -3.763 -2.404 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.278 -2.343 -3.419 1.00 0.00 H new ATOM 0 HE2 LYS A 30 23.280 -1.906 -0.643 1.00 0.00 H new ATOM 0 HE3 LYS A 30 24.149 -3.171 -1.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 24.763 -0.626 -1.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 24.936 -1.727 -3.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 23.578 -0.709 -2.987 1.00 0.00 H new ATOM 463 N LYS A 31 21.360 0.552 0.826 1.00 0.00 N ATOM 464 CA LYS A 31 21.796 0.356 2.185 1.00 0.00 C ATOM 465 C LYS A 31 20.679 0.741 3.140 1.00 0.00 C ATOM 466 O LYS A 31 20.378 0.026 4.093 1.00 0.00 O ATOM 467 CB LYS A 31 23.021 1.224 2.439 1.00 0.00 C ATOM 468 CG LYS A 31 22.596 2.689 2.407 1.00 0.00 C ATOM 469 CD LYS A 31 23.818 3.566 2.489 1.00 0.00 C ATOM 470 CE LYS A 31 23.403 5.024 2.704 1.00 0.00 C ATOM 471 NZ LYS A 31 22.920 5.597 1.415 1.00 0.00 N ATOM 0 H LYS A 31 21.906 1.225 0.287 1.00 0.00 H new ATOM 0 HA LYS A 31 22.051 -0.691 2.346 1.00 0.00 H new ATOM 0 HB2 LYS A 31 23.464 0.980 3.405 1.00 0.00 H new ATOM 0 HB3 LYS A 31 23.782 1.035 1.682 1.00 0.00 H new ATOM 0 HG2 LYS A 31 22.045 2.899 1.491 1.00 0.00 H new ATOM 0 HG3 LYS A 31 21.925 2.903 3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 31 24.458 3.237 3.308 1.00 0.00 H new ATOM 0 HD3 LYS A 31 24.402 3.477 1.573 1.00 0.00 H new ATOM 0 HE2 LYS A 31 22.618 5.083 3.458 1.00 0.00 H new ATOM 0 HE3 LYS A 31 24.248 5.603 3.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 22.638 6.587 1.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 23.682 5.554 0.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 22.103 5.050 1.077 1.00 0.00 H new ATOM 485 N GLU A 32 20.086 1.901 2.887 1.00 0.00 N ATOM 486 CA GLU A 32 19.016 2.387 3.751 1.00 0.00 C ATOM 487 C GLU A 32 17.805 1.453 3.754 1.00 0.00 C ATOM 488 O GLU A 32 17.319 1.088 4.828 1.00 0.00 O ATOM 489 CB GLU A 32 18.546 3.758 3.258 1.00 0.00 C ATOM 490 CG GLU A 32 19.681 4.771 3.385 1.00 0.00 C ATOM 491 CD GLU A 32 19.217 6.150 2.932 1.00 0.00 C ATOM 492 OE1 GLU A 32 18.083 6.267 2.489 1.00 0.00 O ATOM 493 OE2 GLU A 32 20.019 7.061 3.002 1.00 0.00 O ATOM 0 H GLU A 32 20.321 2.513 2.106 1.00 0.00 H new ATOM 0 HA GLU A 32 19.421 2.441 4.762 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.222 3.690 2.220 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.685 4.088 3.839 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.022 4.817 4.419 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.531 4.451 2.783 1.00 0.00 H new ATOM 500 N LEU A 33 17.325 1.018 2.577 1.00 0.00 N ATOM 501 CA LEU A 33 16.176 0.119 2.596 1.00 0.00 C ATOM 502 C LEU A 33 16.544 -1.142 3.324 1.00 0.00 C ATOM 503 O LEU A 33 15.727 -1.709 4.045 1.00 0.00 O ATOM 504 CB LEU A 33 15.579 -0.201 1.216 1.00 0.00 C ATOM 505 CG LEU A 33 16.654 -0.545 0.164 1.00 0.00 C ATOM 506 CD1 LEU A 33 16.727 -2.072 -0.056 1.00 0.00 C ATOM 507 CD2 LEU A 33 16.284 0.144 -1.171 1.00 0.00 C ATOM 0 H LEU A 33 17.692 1.259 1.656 1.00 0.00 H new ATOM 0 HA LEU A 33 15.382 0.651 3.121 1.00 0.00 H new ATOM 0 HB2 LEU A 33 14.888 -1.039 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.999 0.654 0.869 1.00 0.00 H new ATOM 0 HG LEU A 33 17.624 -0.195 0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 33 17.490 -2.296 -0.801 1.00 0.00 H new ATOM 0 HD12 LEU A 33 16.981 -2.563 0.883 1.00 0.00 H new ATOM 0 HD13 LEU A 33 15.761 -2.436 -0.406 1.00 0.00 H new ATOM 0 HD21 LEU A 33 17.037 -0.092 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU A 33 15.311 -0.213 -1.507 1.00 0.00 H new ATOM 0 HD23 LEU A 33 16.243 1.223 -1.024 1.00 0.00 H new ATOM 519 N LYS A 34 17.783 -1.575 3.186 1.00 0.00 N ATOM 520 CA LYS A 34 18.174 -2.759 3.907 1.00 0.00 C ATOM 521 C LYS A 34 17.881 -2.534 5.386 1.00 0.00 C ATOM 522 O LYS A 34 17.463 -3.450 6.089 1.00 0.00 O ATOM 523 CB LYS A 34 19.672 -3.035 3.721 1.00 0.00 C ATOM 524 CG LYS A 34 20.076 -4.343 4.419 1.00 0.00 C ATOM 525 CD LYS A 34 19.636 -5.550 3.586 1.00 0.00 C ATOM 526 CE LYS A 34 20.145 -6.849 4.233 1.00 0.00 C ATOM 527 NZ LYS A 34 21.148 -6.538 5.292 1.00 0.00 N ATOM 0 H LYS A 34 18.504 -1.144 2.607 1.00 0.00 H new ATOM 0 HA LYS A 34 17.618 -3.617 3.529 1.00 0.00 H new ATOM 0 HB2 LYS A 34 19.906 -3.097 2.658 1.00 0.00 H new ATOM 0 HB3 LYS A 34 20.252 -2.206 4.127 1.00 0.00 H new ATOM 0 HG2 LYS A 34 21.156 -4.367 4.563 1.00 0.00 H new ATOM 0 HG3 LYS A 34 19.621 -4.390 5.408 1.00 0.00 H new ATOM 0 HD2 LYS A 34 18.549 -5.573 3.510 1.00 0.00 H new ATOM 0 HD3 LYS A 34 20.024 -5.463 2.571 1.00 0.00 H new ATOM 0 HE2 LYS A 34 19.310 -7.401 4.664 1.00 0.00 H new ATOM 0 HE3 LYS A 34 20.593 -7.490 3.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 21.679 -7.400 5.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 21.806 -5.811 4.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 20.660 -6.186 6.140 1.00 0.00 H new ATOM 541 N GLU A 35 18.093 -1.302 5.858 1.00 0.00 N ATOM 542 CA GLU A 35 17.832 -0.990 7.254 1.00 0.00 C ATOM 543 C GLU A 35 16.335 -0.886 7.575 1.00 0.00 C ATOM 544 O GLU A 35 15.892 -1.329 8.637 1.00 0.00 O ATOM 545 CB GLU A 35 18.523 0.325 7.622 1.00 0.00 C ATOM 546 CG GLU A 35 20.039 0.154 7.506 1.00 0.00 C ATOM 547 CD GLU A 35 20.741 1.437 7.935 1.00 0.00 C ATOM 548 OE1 GLU A 35 20.056 2.426 8.133 1.00 0.00 O ATOM 549 OE2 GLU A 35 21.955 1.411 8.059 1.00 0.00 O ATOM 0 H GLU A 35 18.439 -0.521 5.300 1.00 0.00 H new ATOM 0 HA GLU A 35 18.231 -1.815 7.845 1.00 0.00 H new ATOM 0 HB2 GLU A 35 18.185 1.123 6.961 1.00 0.00 H new ATOM 0 HB3 GLU A 35 18.256 0.617 8.638 1.00 0.00 H new ATOM 0 HG2 GLU A 35 20.369 -0.677 8.130 1.00 0.00 H new ATOM 0 HG3 GLU A 35 20.308 -0.092 6.479 1.00 0.00 H new ATOM 556 N LEU A 36 15.562 -0.256 6.680 1.00 0.00 N ATOM 557 CA LEU A 36 14.132 -0.069 6.948 1.00 0.00 C ATOM 558 C LEU A 36 13.398 -1.415 7.003 1.00 0.00 C ATOM 559 O LEU A 36 12.604 -1.655 7.914 1.00 0.00 O ATOM 560 CB LEU A 36 13.515 0.808 5.837 1.00 0.00 C ATOM 561 CG LEU A 36 12.154 1.427 6.259 1.00 0.00 C ATOM 562 CD1 LEU A 36 11.601 2.272 5.101 1.00 0.00 C ATOM 563 CD2 LEU A 36 11.138 0.339 6.616 1.00 0.00 C ATOM 0 H LEU A 36 15.890 0.122 5.791 1.00 0.00 H new ATOM 0 HA LEU A 36 14.024 0.419 7.916 1.00 0.00 H new ATOM 0 HB2 LEU A 36 14.210 1.607 5.580 1.00 0.00 H new ATOM 0 HB3 LEU A 36 13.375 0.207 4.939 1.00 0.00 H new ATOM 0 HG LEU A 36 12.318 2.048 7.139 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.646 2.708 5.393 1.00 0.00 H new ATOM 0 HD12 LEU A 36 12.306 3.068 4.863 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.458 1.640 4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.196 0.803 6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.974 -0.304 5.751 1.00 0.00 H new ATOM 0 HD23 LEU A 36 11.520 -0.258 7.444 1.00 0.00 H new ATOM 575 N LEU A 37 13.669 -2.312 6.046 1.00 0.00 N ATOM 576 CA LEU A 37 12.991 -3.608 6.066 1.00 0.00 C ATOM 577 C LEU A 37 13.386 -4.420 7.291 1.00 0.00 C ATOM 578 O LEU A 37 12.528 -5.003 7.946 1.00 0.00 O ATOM 579 CB LEU A 37 13.304 -4.435 4.802 1.00 0.00 C ATOM 580 CG LEU A 37 12.574 -3.886 3.560 1.00 0.00 C ATOM 581 CD1 LEU A 37 11.132 -4.406 3.527 1.00 0.00 C ATOM 582 CD2 LEU A 37 12.556 -2.362 3.572 1.00 0.00 C ATOM 0 H LEU A 37 14.326 -2.172 5.279 1.00 0.00 H new ATOM 0 HA LEU A 37 11.922 -3.396 6.098 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.379 -4.431 4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.012 -5.472 4.966 1.00 0.00 H new ATOM 0 HG LEU A 37 13.110 -4.227 2.674 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.624 -4.013 2.646 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.139 -5.495 3.486 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.607 -4.080 4.425 1.00 0.00 H new ATOM 0 HD21 LEU A 37 12.036 -1.997 2.686 1.00 0.00 H new ATOM 0 HD22 LEU A 37 12.040 -2.011 4.466 1.00 0.00 H new ATOM 0 HD23 LEU A 37 13.579 -1.986 3.572 1.00 0.00 H new ATOM 594 N GLN A 38 14.678 -4.445 7.612 1.00 0.00 N ATOM 595 CA GLN A 38 15.134 -5.196 8.778 1.00 0.00 C ATOM 596 C GLN A 38 14.556 -4.632 10.065 1.00 0.00 C ATOM 597 O GLN A 38 14.185 -5.380 10.969 1.00 0.00 O ATOM 598 CB GLN A 38 16.661 -5.192 8.848 1.00 0.00 C ATOM 599 CG GLN A 38 17.226 -5.968 7.656 1.00 0.00 C ATOM 600 CD GLN A 38 18.749 -5.915 7.675 1.00 0.00 C ATOM 601 OE1 GLN A 38 19.429 -6.774 6.967 1.00 0.00 O flip ATOM 602 NE2 GLN A 38 19.335 -5.073 8.354 1.00 0.00 N flip ATOM 0 H GLN A 38 15.413 -3.965 7.093 1.00 0.00 H new ATOM 0 HA GLN A 38 14.781 -6.221 8.669 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.034 -4.168 8.839 1.00 0.00 H new ATOM 0 HB3 GLN A 38 16.995 -5.645 9.782 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.889 -7.004 7.693 1.00 0.00 H new ATOM 0 HG3 GLN A 38 16.851 -5.544 6.725 1.00 0.00 H new ATOM 0 HE21 GLN A 38 18.801 -4.402 8.907 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.355 -5.046 8.364 1.00 0.00 H new ATOM 611 N THR A 39 14.474 -3.309 10.145 1.00 0.00 N ATOM 612 CA THR A 39 13.929 -2.674 11.334 1.00 0.00 C ATOM 613 C THR A 39 12.425 -2.884 11.427 1.00 0.00 C ATOM 614 O THR A 39 11.871 -2.972 12.523 1.00 0.00 O ATOM 615 CB THR A 39 14.246 -1.176 11.327 1.00 0.00 C ATOM 616 OG1 THR A 39 13.616 -0.566 10.209 1.00 0.00 O ATOM 617 CG2 THR A 39 15.763 -0.957 11.254 1.00 0.00 C ATOM 0 H THR A 39 14.773 -2.666 9.412 1.00 0.00 H new ATOM 0 HA THR A 39 14.394 -3.136 12.205 1.00 0.00 H new ATOM 0 HB THR A 39 13.871 -0.726 12.246 1.00 0.00 H new ATOM 0 HG1 THR A 39 13.417 -1.248 9.533 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.977 0.112 11.250 1.00 0.00 H new ATOM 0 HG22 THR A 39 16.239 -1.419 12.119 1.00 0.00 H new ATOM 0 HG23 THR A 39 16.152 -1.408 10.341 1.00 0.00 H new ATOM 625 N GLU A 40 11.759 -2.944 10.273 1.00 0.00 N ATOM 626 CA GLU A 40 10.310 -3.122 10.257 1.00 0.00 C ATOM 627 C GLU A 40 9.877 -4.557 9.938 1.00 0.00 C ATOM 628 O GLU A 40 9.193 -5.190 10.741 1.00 0.00 O ATOM 629 CB GLU A 40 9.696 -2.163 9.236 1.00 0.00 C ATOM 630 CG GLU A 40 9.813 -0.709 9.718 1.00 0.00 C ATOM 631 CD GLU A 40 9.122 -0.530 11.068 1.00 0.00 C ATOM 632 OE1 GLU A 40 7.969 -0.927 11.178 1.00 0.00 O ATOM 633 OE2 GLU A 40 9.752 0.000 11.969 1.00 0.00 O ATOM 0 H GLU A 40 12.193 -2.873 9.352 1.00 0.00 H new ATOM 0 HA GLU A 40 9.951 -2.904 11.263 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.200 -2.275 8.276 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.648 -2.415 9.077 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.864 -0.432 9.802 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.365 -0.040 8.983 1.00 0.00 H new ATOM 640 N LEU A 41 10.252 -5.071 8.764 1.00 0.00 N ATOM 641 CA LEU A 41 9.854 -6.433 8.386 1.00 0.00 C ATOM 642 C LEU A 41 10.972 -7.432 8.640 1.00 0.00 C ATOM 643 O LEU A 41 12.145 -7.147 8.414 1.00 0.00 O ATOM 644 CB LEU A 41 9.462 -6.504 6.904 1.00 0.00 C ATOM 645 CG LEU A 41 8.358 -5.493 6.555 1.00 0.00 C ATOM 646 CD1 LEU A 41 7.944 -5.706 5.096 1.00 0.00 C ATOM 647 CD2 LEU A 41 7.122 -5.695 7.445 1.00 0.00 C ATOM 0 H LEU A 41 10.818 -4.580 8.072 1.00 0.00 H new ATOM 0 HA LEU A 41 8.995 -6.690 9.006 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.339 -6.311 6.287 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.120 -7.511 6.667 1.00 0.00 H new ATOM 0 HG LEU A 41 8.745 -4.486 6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.160 -4.995 4.833 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.806 -5.552 4.447 1.00 0.00 H new ATOM 0 HD13 LEU A 41 7.570 -6.722 4.968 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.357 -4.966 7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 41 6.731 -6.702 7.301 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.400 -5.560 8.490 1.00 0.00 H new ATOM 659 N SER A 42 10.600 -8.619 9.103 1.00 0.00 N ATOM 660 CA SER A 42 11.590 -9.658 9.371 1.00 0.00 C ATOM 661 C SER A 42 11.431 -10.841 8.420 1.00 0.00 C ATOM 662 O SER A 42 12.360 -11.204 7.704 1.00 0.00 O ATOM 663 CB SER A 42 11.447 -10.146 10.812 1.00 0.00 C ATOM 664 OG SER A 42 12.650 -10.787 11.212 1.00 0.00 O ATOM 0 H SER A 42 9.635 -8.885 9.299 1.00 0.00 H new ATOM 0 HA SER A 42 12.579 -9.226 9.217 1.00 0.00 H new ATOM 0 HB2 SER A 42 11.232 -9.306 11.473 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.609 -10.838 10.892 1.00 0.00 H new ATOM 0 HG SER A 42 12.562 -11.100 12.137 1.00 0.00 H new ATOM 670 N GLY A 43 10.256 -11.459 8.446 1.00 0.00 N ATOM 671 CA GLY A 43 9.992 -12.629 7.618 1.00 0.00 C ATOM 672 C GLY A 43 10.173 -12.388 6.116 1.00 0.00 C ATOM 673 O GLY A 43 10.659 -13.269 5.408 1.00 0.00 O ATOM 0 H GLY A 43 9.472 -11.170 9.031 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.655 -13.437 7.928 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.972 -12.967 7.800 1.00 0.00 H new ATOM 677 N PHE A 44 9.757 -11.227 5.613 1.00 0.00 N ATOM 678 CA PHE A 44 9.874 -10.975 4.175 1.00 0.00 C ATOM 679 C PHE A 44 11.328 -10.964 3.693 1.00 0.00 C ATOM 680 O PHE A 44 11.684 -11.711 2.782 1.00 0.00 O ATOM 681 CB PHE A 44 9.199 -9.647 3.830 1.00 0.00 C ATOM 682 CG PHE A 44 7.703 -9.792 3.990 1.00 0.00 C ATOM 683 CD1 PHE A 44 6.930 -10.254 2.917 1.00 0.00 C ATOM 684 CD2 PHE A 44 7.088 -9.473 5.206 1.00 0.00 C ATOM 685 CE1 PHE A 44 5.545 -10.394 3.061 1.00 0.00 C ATOM 686 CE2 PHE A 44 5.702 -9.613 5.350 1.00 0.00 C ATOM 687 CZ PHE A 44 4.931 -10.072 4.277 1.00 0.00 C ATOM 0 H PHE A 44 9.349 -10.467 6.157 1.00 0.00 H new ATOM 0 HA PHE A 44 9.375 -11.796 3.660 1.00 0.00 H new ATOM 0 HB2 PHE A 44 9.571 -8.856 4.481 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.441 -9.358 2.807 1.00 0.00 H new ATOM 0 HD1 PHE A 44 7.403 -10.502 1.978 1.00 0.00 H new ATOM 0 HD2 PHE A 44 7.683 -9.118 6.035 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.950 -10.751 2.234 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.229 -9.367 6.289 1.00 0.00 H new ATOM 0 HZ PHE A 44 3.862 -10.178 4.387 1.00 0.00 H new ATOM 697 N LEU A 45 12.171 -10.142 4.311 1.00 0.00 N ATOM 698 CA LEU A 45 13.585 -10.094 3.922 1.00 0.00 C ATOM 699 C LEU A 45 14.352 -11.314 4.403 1.00 0.00 C ATOM 700 O LEU A 45 15.228 -11.823 3.703 1.00 0.00 O ATOM 701 CB LEU A 45 14.248 -8.795 4.426 1.00 0.00 C ATOM 702 CG LEU A 45 14.301 -7.761 3.288 1.00 0.00 C ATOM 703 CD1 LEU A 45 15.384 -8.203 2.282 1.00 0.00 C ATOM 704 CD2 LEU A 45 12.928 -7.651 2.591 1.00 0.00 C ATOM 0 H LEU A 45 11.912 -9.510 5.069 1.00 0.00 H new ATOM 0 HA LEU A 45 13.620 -10.101 2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 45 13.686 -8.393 5.269 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.255 -9.006 4.785 1.00 0.00 H new ATOM 0 HG LEU A 45 14.547 -6.778 3.691 1.00 0.00 H new ATOM 0 HD11 LEU A 45 15.438 -7.483 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.349 -8.254 2.786 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.131 -9.185 1.883 1.00 0.00 H new ATOM 0 HD21 LEU A 45 12.985 -6.915 1.789 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.652 -8.620 2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.176 -7.340 3.316 1.00 0.00 H new ATOM 716 N ASP A 46 14.026 -11.775 5.592 1.00 0.00 N ATOM 717 CA ASP A 46 14.697 -12.931 6.152 1.00 0.00 C ATOM 718 C ASP A 46 14.528 -14.152 5.256 1.00 0.00 C ATOM 719 O ASP A 46 15.370 -15.050 5.249 1.00 0.00 O ATOM 720 CB ASP A 46 14.181 -13.237 7.560 1.00 0.00 C ATOM 721 CG ASP A 46 15.019 -14.343 8.192 1.00 0.00 C ATOM 722 OD1 ASP A 46 15.997 -14.741 7.581 1.00 0.00 O ATOM 723 OD2 ASP A 46 14.671 -14.775 9.279 1.00 0.00 O ATOM 0 H ASP A 46 13.304 -11.370 6.188 1.00 0.00 H new ATOM 0 HA ASP A 46 15.759 -12.694 6.215 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.225 -12.339 8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 46 13.135 -13.542 7.515 1.00 0.00 H new ATOM 728 N ALA A 47 13.416 -14.198 4.533 1.00 0.00 N ATOM 729 CA ALA A 47 13.122 -15.338 3.676 1.00 0.00 C ATOM 730 C ALA A 47 14.259 -15.608 2.694 1.00 0.00 C ATOM 731 O ALA A 47 14.504 -16.761 2.342 1.00 0.00 O ATOM 732 CB ALA A 47 11.830 -15.082 2.899 1.00 0.00 C ATOM 0 H ALA A 47 12.708 -13.464 4.523 1.00 0.00 H new ATOM 0 HA ALA A 47 13.007 -16.214 4.314 1.00 0.00 H new ATOM 0 HB1 ALA A 47 11.614 -15.938 2.259 1.00 0.00 H new ATOM 0 HB2 ALA A 47 11.007 -14.936 3.599 1.00 0.00 H new ATOM 0 HB3 ALA A 47 11.946 -14.190 2.284 1.00 0.00 H new ATOM 738 N GLN A 48 14.971 -14.568 2.258 1.00 0.00 N ATOM 739 CA GLN A 48 16.080 -14.795 1.334 1.00 0.00 C ATOM 740 C GLN A 48 17.388 -14.852 2.123 1.00 0.00 C ATOM 741 O GLN A 48 17.758 -13.894 2.802 1.00 0.00 O ATOM 742 CB GLN A 48 16.157 -13.669 0.308 1.00 0.00 C ATOM 743 CG GLN A 48 14.778 -13.427 -0.307 1.00 0.00 C ATOM 744 CD GLN A 48 14.224 -14.725 -0.881 1.00 0.00 C ATOM 745 OE1 GLN A 48 14.900 -15.402 -1.656 1.00 0.00 O ATOM 746 NE2 GLN A 48 13.029 -15.121 -0.534 1.00 0.00 N ATOM 0 H GLN A 48 14.808 -13.595 2.518 1.00 0.00 H new ATOM 0 HA GLN A 48 15.918 -15.737 0.810 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.518 -12.757 0.783 1.00 0.00 H new ATOM 0 HB3 GLN A 48 16.873 -13.926 -0.473 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.098 -13.036 0.449 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.849 -12.674 -1.092 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.472 -14.558 0.108 1.00 0.00 H new ATOM 0 HE22 GLN A 48 12.653 -15.994 -0.905 1.00 0.00 H new ATOM 755 N LYS A 49 18.064 -15.992 2.051 1.00 0.00 N ATOM 756 CA LYS A 49 19.313 -16.191 2.784 1.00 0.00 C ATOM 757 C LYS A 49 20.446 -15.251 2.360 1.00 0.00 C ATOM 758 O LYS A 49 21.222 -14.798 3.201 1.00 0.00 O ATOM 759 CB LYS A 49 19.772 -17.644 2.627 1.00 0.00 C ATOM 760 CG LYS A 49 20.996 -17.900 3.511 1.00 0.00 C ATOM 761 CD LYS A 49 21.481 -19.337 3.305 1.00 0.00 C ATOM 762 CE LYS A 49 22.603 -19.648 4.298 1.00 0.00 C ATOM 763 NZ LYS A 49 22.674 -21.120 4.520 1.00 0.00 N ATOM 0 H LYS A 49 17.770 -16.794 1.493 1.00 0.00 H new ATOM 0 HA LYS A 49 19.094 -15.956 3.826 1.00 0.00 H new ATOM 0 HB2 LYS A 49 18.964 -18.322 2.903 1.00 0.00 H new ATOM 0 HB3 LYS A 49 20.016 -17.847 1.584 1.00 0.00 H new ATOM 0 HG2 LYS A 49 21.791 -17.197 3.262 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.742 -17.737 4.558 1.00 0.00 H new ATOM 0 HD2 LYS A 49 20.655 -20.034 3.445 1.00 0.00 H new ATOM 0 HD3 LYS A 49 21.839 -19.468 2.284 1.00 0.00 H new ATOM 0 HE2 LYS A 49 23.555 -19.281 3.915 1.00 0.00 H new ATOM 0 HE3 LYS A 49 22.420 -19.135 5.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 23.436 -21.333 5.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.768 -21.457 4.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.867 -21.598 3.617 1.00 0.00 H new ATOM 777 N ASP A 50 20.576 -15.002 1.063 1.00 0.00 N ATOM 778 CA ASP A 50 21.669 -14.162 0.574 1.00 0.00 C ATOM 779 C ASP A 50 21.494 -12.689 0.923 1.00 0.00 C ATOM 780 O ASP A 50 20.389 -12.149 0.862 1.00 0.00 O ATOM 781 CB ASP A 50 21.807 -14.286 -0.938 1.00 0.00 C ATOM 782 CG ASP A 50 22.234 -15.701 -1.312 1.00 0.00 C ATOM 783 OD1 ASP A 50 22.645 -16.429 -0.424 1.00 0.00 O ATOM 784 OD2 ASP A 50 22.142 -16.037 -2.482 1.00 0.00 O ATOM 0 H ASP A 50 19.952 -15.361 0.340 1.00 0.00 H new ATOM 0 HA ASP A 50 22.567 -14.524 1.074 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.859 -14.045 -1.418 1.00 0.00 H new ATOM 0 HB3 ASP A 50 22.541 -13.568 -1.304 1.00 0.00 H new ATOM 789 N VAL A 51 22.612 -12.036 1.242 1.00 0.00 N ATOM 790 CA VAL A 51 22.591 -10.610 1.545 1.00 0.00 C ATOM 791 C VAL A 51 22.358 -9.858 0.242 1.00 0.00 C ATOM 792 O VAL A 51 21.765 -8.782 0.215 1.00 0.00 O ATOM 793 CB VAL A 51 23.916 -10.166 2.183 1.00 0.00 C ATOM 794 CG1 VAL A 51 24.284 -11.123 3.324 1.00 0.00 C ATOM 795 CG2 VAL A 51 25.039 -10.155 1.134 1.00 0.00 C ATOM 0 H VAL A 51 23.534 -12.469 1.296 1.00 0.00 H new ATOM 0 HA VAL A 51 21.795 -10.395 2.258 1.00 0.00 H new ATOM 0 HB VAL A 51 23.796 -9.157 2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 51 25.224 -10.806 3.775 1.00 0.00 H new ATOM 0 HG12 VAL A 51 23.497 -11.110 4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 51 24.393 -12.134 2.930 1.00 0.00 H new ATOM 0 HG21 VAL A 51 25.971 -9.838 1.602 1.00 0.00 H new ATOM 0 HG22 VAL A 51 25.162 -11.157 0.722 1.00 0.00 H new ATOM 0 HG23 VAL A 51 24.782 -9.462 0.333 1.00 0.00 H new ATOM 805 N ASP A 52 22.810 -10.485 -0.840 1.00 0.00 N ATOM 806 CA ASP A 52 22.647 -9.955 -2.185 1.00 0.00 C ATOM 807 C ASP A 52 21.165 -9.816 -2.485 1.00 0.00 C ATOM 808 O ASP A 52 20.747 -9.027 -3.340 1.00 0.00 O ATOM 809 CB ASP A 52 23.299 -10.889 -3.206 1.00 0.00 C ATOM 810 CG ASP A 52 24.813 -10.887 -3.024 1.00 0.00 C ATOM 811 OD1 ASP A 52 25.302 -10.029 -2.309 1.00 0.00 O ATOM 812 OD2 ASP A 52 25.460 -11.744 -3.602 1.00 0.00 O ATOM 0 H ASP A 52 23.301 -11.378 -0.806 1.00 0.00 H new ATOM 0 HA ASP A 52 23.130 -8.980 -2.251 1.00 0.00 H new ATOM 0 HB2 ASP A 52 22.911 -11.901 -3.085 1.00 0.00 H new ATOM 0 HB3 ASP A 52 23.046 -10.569 -4.217 1.00 0.00 H new ATOM 817 N ALA A 53 20.381 -10.631 -1.793 1.00 0.00 N ATOM 818 CA ALA A 53 18.947 -10.649 -1.998 1.00 0.00 C ATOM 819 C ALA A 53 18.369 -9.244 -1.906 1.00 0.00 C ATOM 820 O ALA A 53 17.473 -8.894 -2.673 1.00 0.00 O ATOM 821 CB ALA A 53 18.300 -11.515 -0.929 1.00 0.00 C ATOM 0 H ALA A 53 20.717 -11.286 -1.087 1.00 0.00 H new ATOM 0 HA ALA A 53 18.745 -11.050 -2.991 1.00 0.00 H new ATOM 0 HB1 ALA A 53 17.220 -11.532 -1.079 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.692 -12.530 -0.997 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.523 -11.105 0.056 1.00 0.00 H new ATOM 827 N VAL A 54 18.888 -8.422 -1.000 1.00 0.00 N ATOM 828 CA VAL A 54 18.385 -7.060 -0.904 1.00 0.00 C ATOM 829 C VAL A 54 18.607 -6.340 -2.221 1.00 0.00 C ATOM 830 O VAL A 54 17.726 -5.632 -2.713 1.00 0.00 O ATOM 831 CB VAL A 54 19.105 -6.296 0.205 1.00 0.00 C ATOM 832 CG1 VAL A 54 20.551 -6.028 -0.220 1.00 0.00 C ATOM 833 CG2 VAL A 54 18.397 -4.955 0.429 1.00 0.00 C ATOM 0 H VAL A 54 19.630 -8.664 -0.344 1.00 0.00 H new ATOM 0 HA VAL A 54 17.320 -7.103 -0.674 1.00 0.00 H new ATOM 0 HB VAL A 54 19.093 -6.884 1.123 1.00 0.00 H new ATOM 0 HG11 VAL A 54 21.067 -5.483 0.570 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.059 -6.976 -0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.557 -5.435 -1.134 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.905 -4.403 1.220 1.00 0.00 H new ATOM 0 HG22 VAL A 54 18.420 -4.373 -0.492 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.362 -5.134 0.719 1.00 0.00 H new ATOM 843 N ASP A 55 19.786 -6.543 -2.804 1.00 0.00 N ATOM 844 CA ASP A 55 20.086 -5.917 -4.074 1.00 0.00 C ATOM 845 C ASP A 55 19.106 -6.414 -5.117 1.00 0.00 C ATOM 846 O ASP A 55 18.597 -5.643 -5.925 1.00 0.00 O ATOM 847 CB ASP A 55 21.515 -6.254 -4.504 1.00 0.00 C ATOM 848 CG ASP A 55 21.902 -5.423 -5.723 1.00 0.00 C ATOM 849 OD1 ASP A 55 21.117 -4.573 -6.109 1.00 0.00 O ATOM 850 OD2 ASP A 55 22.978 -5.648 -6.252 1.00 0.00 O ATOM 0 H ASP A 55 20.531 -7.125 -2.421 1.00 0.00 H new ATOM 0 HA ASP A 55 19.998 -4.835 -3.973 1.00 0.00 H new ATOM 0 HB2 ASP A 55 22.206 -6.057 -3.685 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.592 -7.316 -4.738 1.00 0.00 H new ATOM 855 N LYS A 56 18.830 -7.714 -5.073 1.00 0.00 N ATOM 856 CA LYS A 56 17.894 -8.303 -6.017 1.00 0.00 C ATOM 857 C LYS A 56 16.518 -7.668 -5.871 1.00 0.00 C ATOM 858 O LYS A 56 15.832 -7.416 -6.861 1.00 0.00 O ATOM 859 CB LYS A 56 17.788 -9.810 -5.774 1.00 0.00 C ATOM 860 CG LYS A 56 19.138 -10.472 -6.062 1.00 0.00 C ATOM 861 CD LYS A 56 19.000 -11.990 -5.931 1.00 0.00 C ATOM 862 CE LYS A 56 20.372 -12.646 -6.096 1.00 0.00 C ATOM 863 NZ LYS A 56 21.140 -11.930 -7.154 1.00 0.00 N ATOM 0 H LYS A 56 19.235 -8.369 -4.404 1.00 0.00 H new ATOM 0 HA LYS A 56 18.262 -8.121 -7.027 1.00 0.00 H new ATOM 0 HB2 LYS A 56 17.490 -10.002 -4.743 1.00 0.00 H new ATOM 0 HB3 LYS A 56 17.017 -10.239 -6.414 1.00 0.00 H new ATOM 0 HG2 LYS A 56 19.476 -10.212 -7.065 1.00 0.00 H new ATOM 0 HG3 LYS A 56 19.892 -10.103 -5.366 1.00 0.00 H new ATOM 0 HD2 LYS A 56 18.579 -12.244 -4.958 1.00 0.00 H new ATOM 0 HD3 LYS A 56 18.311 -12.369 -6.686 1.00 0.00 H new ATOM 0 HE2 LYS A 56 20.917 -12.616 -5.153 1.00 0.00 H new ATOM 0 HE3 LYS A 56 20.255 -13.696 -6.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 21.890 -12.551 -7.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 20.500 -11.668 -7.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 21.567 -11.071 -6.752 1.00 0.00 H new ATOM 877 N VAL A 57 16.118 -7.411 -4.627 1.00 0.00 N ATOM 878 CA VAL A 57 14.817 -6.805 -4.378 1.00 0.00 C ATOM 879 C VAL A 57 14.756 -5.385 -4.929 1.00 0.00 C ATOM 880 O VAL A 57 13.778 -4.996 -5.561 1.00 0.00 O ATOM 881 CB VAL A 57 14.544 -6.758 -2.870 1.00 0.00 C ATOM 882 CG1 VAL A 57 13.256 -5.975 -2.610 1.00 0.00 C ATOM 883 CG2 VAL A 57 14.393 -8.177 -2.315 1.00 0.00 C ATOM 0 H VAL A 57 16.667 -7.610 -3.791 1.00 0.00 H new ATOM 0 HA VAL A 57 14.065 -7.413 -4.881 1.00 0.00 H new ATOM 0 HB VAL A 57 15.382 -6.268 -2.374 1.00 0.00 H new ATOM 0 HG11 VAL A 57 13.061 -5.941 -1.538 1.00 0.00 H new ATOM 0 HG12 VAL A 57 13.364 -4.960 -2.992 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.424 -6.466 -3.115 1.00 0.00 H new ATOM 0 HG21 VAL A 57 14.200 -8.130 -1.243 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.561 -8.676 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 57 15.311 -8.737 -2.494 1.00 0.00 H new ATOM 893 N MET A 58 15.804 -4.609 -4.658 1.00 0.00 N ATOM 894 CA MET A 58 15.858 -3.218 -5.102 1.00 0.00 C ATOM 895 C MET A 58 16.015 -3.045 -6.620 1.00 0.00 C ATOM 896 O MET A 58 15.487 -2.081 -7.181 1.00 0.00 O ATOM 897 CB MET A 58 16.943 -2.453 -4.324 1.00 0.00 C ATOM 898 CG MET A 58 18.280 -2.474 -5.063 1.00 0.00 C ATOM 899 SD MET A 58 18.369 -1.064 -6.196 1.00 0.00 S ATOM 900 CE MET A 58 19.096 0.131 -5.047 1.00 0.00 C ATOM 0 H MET A 58 16.624 -4.918 -4.136 1.00 0.00 H new ATOM 0 HA MET A 58 14.884 -2.785 -4.876 1.00 0.00 H new ATOM 0 HB2 MET A 58 16.625 -1.421 -4.173 1.00 0.00 H new ATOM 0 HB3 MET A 58 17.065 -2.897 -3.336 1.00 0.00 H new ATOM 0 HG2 MET A 58 19.103 -2.432 -4.349 1.00 0.00 H new ATOM 0 HG3 MET A 58 18.386 -3.406 -5.617 1.00 0.00 H new ATOM 0 HE1 MET A 58 18.561 1.078 -5.120 1.00 0.00 H new ATOM 0 HE2 MET A 58 19.020 -0.251 -4.029 1.00 0.00 H new ATOM 0 HE3 MET A 58 20.145 0.286 -5.299 1.00 0.00 H new ATOM 910 N LYS A 59 16.735 -3.944 -7.299 1.00 0.00 N ATOM 911 CA LYS A 59 16.901 -3.776 -8.741 1.00 0.00 C ATOM 912 C LYS A 59 15.559 -3.767 -9.456 1.00 0.00 C ATOM 913 O LYS A 59 15.339 -2.970 -10.367 1.00 0.00 O ATOM 914 CB LYS A 59 17.782 -4.863 -9.332 1.00 0.00 C ATOM 915 CG LYS A 59 19.197 -4.748 -8.733 1.00 0.00 C ATOM 916 CD LYS A 59 20.212 -4.877 -9.851 1.00 0.00 C ATOM 917 CE LYS A 59 20.119 -6.268 -10.484 1.00 0.00 C ATOM 918 NZ LYS A 59 21.401 -6.585 -11.174 1.00 0.00 N ATOM 0 H LYS A 59 17.193 -4.760 -6.894 1.00 0.00 H new ATOM 0 HA LYS A 59 17.387 -2.812 -8.890 1.00 0.00 H new ATOM 0 HB2 LYS A 59 17.362 -5.846 -9.117 1.00 0.00 H new ATOM 0 HB3 LYS A 59 17.824 -4.764 -10.417 1.00 0.00 H new ATOM 0 HG2 LYS A 59 19.315 -3.791 -8.225 1.00 0.00 H new ATOM 0 HG3 LYS A 59 19.356 -5.527 -7.987 1.00 0.00 H new ATOM 0 HD2 LYS A 59 20.033 -4.112 -10.606 1.00 0.00 H new ATOM 0 HD3 LYS A 59 21.217 -4.712 -9.462 1.00 0.00 H new ATOM 0 HE2 LYS A 59 19.911 -7.015 -9.718 1.00 0.00 H new ATOM 0 HE3 LYS A 59 19.293 -6.302 -11.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 21.339 -7.530 -11.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 21.580 -5.878 -11.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 22.179 -6.569 -10.485 1.00 0.00 H new ATOM 932 N GLU A 60 14.653 -4.640 -9.030 1.00 0.00 N ATOM 933 CA GLU A 60 13.332 -4.688 -9.639 1.00 0.00 C ATOM 934 C GLU A 60 12.581 -3.392 -9.393 1.00 0.00 C ATOM 935 O GLU A 60 11.875 -2.886 -10.264 1.00 0.00 O ATOM 936 CB GLU A 60 12.533 -5.849 -9.045 1.00 0.00 C ATOM 937 CG GLU A 60 11.184 -5.965 -9.755 1.00 0.00 C ATOM 938 CD GLU A 60 10.344 -7.060 -9.106 1.00 0.00 C ATOM 939 OE1 GLU A 60 10.814 -7.648 -8.146 1.00 0.00 O ATOM 940 OE2 GLU A 60 9.246 -7.296 -9.579 1.00 0.00 O ATOM 0 H GLU A 60 14.806 -5.313 -8.279 1.00 0.00 H new ATOM 0 HA GLU A 60 13.453 -4.830 -10.713 1.00 0.00 H new ATOM 0 HB2 GLU A 60 13.092 -6.779 -9.151 1.00 0.00 H new ATOM 0 HB3 GLU A 60 12.380 -5.689 -7.978 1.00 0.00 H new ATOM 0 HG2 GLU A 60 10.655 -5.013 -9.706 1.00 0.00 H new ATOM 0 HG3 GLU A 60 11.338 -6.191 -10.810 1.00 0.00 H new ATOM 947 N LEU A 61 12.733 -2.874 -8.183 1.00 0.00 N ATOM 948 CA LEU A 61 12.061 -1.645 -7.795 1.00 0.00 C ATOM 949 C LEU A 61 12.587 -0.427 -8.526 1.00 0.00 C ATOM 950 O LEU A 61 11.829 0.505 -8.792 1.00 0.00 O ATOM 951 CB LEU A 61 12.177 -1.419 -6.283 1.00 0.00 C ATOM 952 CG LEU A 61 11.563 -2.587 -5.493 1.00 0.00 C ATOM 953 CD1 LEU A 61 11.677 -2.281 -3.996 1.00 0.00 C ATOM 954 CD2 LEU A 61 10.077 -2.771 -5.856 1.00 0.00 C ATOM 0 H LEU A 61 13.316 -3.286 -7.454 1.00 0.00 H new ATOM 0 HA LEU A 61 11.015 -1.770 -8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 61 13.226 -1.305 -6.010 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.674 -0.490 -6.013 1.00 0.00 H new ATOM 0 HG LEU A 61 12.099 -3.503 -5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 61 11.245 -3.102 -3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 61 12.727 -2.164 -3.727 1.00 0.00 H new ATOM 0 HD13 LEU A 61 11.140 -1.359 -3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.663 -3.603 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.529 -1.859 -5.618 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.986 -2.981 -6.922 1.00 0.00 H new ATOM 966 N ASP A 62 13.877 -0.392 -8.824 1.00 0.00 N ATOM 967 CA ASP A 62 14.402 0.790 -9.481 1.00 0.00 C ATOM 968 C ASP A 62 13.969 0.854 -10.939 1.00 0.00 C ATOM 969 O ASP A 62 14.723 0.510 -11.849 1.00 0.00 O ATOM 970 CB ASP A 62 15.921 0.825 -9.405 1.00 0.00 C ATOM 971 CG ASP A 62 16.400 2.188 -9.882 1.00 0.00 C ATOM 972 OD1 ASP A 62 15.580 3.101 -9.919 1.00 0.00 O ATOM 973 OD2 ASP A 62 17.573 2.305 -10.190 1.00 0.00 O ATOM 0 H ASP A 62 14.551 -1.133 -8.632 1.00 0.00 H new ATOM 0 HA ASP A 62 13.996 1.655 -8.956 1.00 0.00 H new ATOM 0 HB2 ASP A 62 16.253 0.644 -8.383 1.00 0.00 H new ATOM 0 HB3 ASP A 62 16.349 0.036 -10.023 1.00 0.00 H new ATOM 978 N GLU A 63 12.762 1.356 -11.136 1.00 0.00 N ATOM 979 CA GLU A 63 12.204 1.551 -12.467 1.00 0.00 C ATOM 980 C GLU A 63 12.939 2.617 -13.245 1.00 0.00 C ATOM 981 O GLU A 63 13.244 2.483 -14.429 1.00 0.00 O ATOM 982 CB GLU A 63 10.770 2.034 -12.274 1.00 0.00 C ATOM 983 CG GLU A 63 10.170 2.427 -13.617 1.00 0.00 C ATOM 984 CD GLU A 63 8.752 2.949 -13.422 1.00 0.00 C ATOM 985 OE1 GLU A 63 8.322 3.030 -12.283 1.00 0.00 O ATOM 986 OE2 GLU A 63 8.116 3.263 -14.415 1.00 0.00 O ATOM 0 H GLU A 63 12.140 1.640 -10.379 1.00 0.00 H new ATOM 0 HA GLU A 63 12.278 0.615 -13.021 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.171 1.248 -11.814 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.752 2.886 -11.595 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.786 3.192 -14.090 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.161 1.567 -14.286 1.00 0.00 H new ATOM 993 N ASN A 64 13.146 3.689 -12.541 1.00 0.00 N ATOM 994 CA ASN A 64 13.770 4.878 -13.056 1.00 0.00 C ATOM 995 C ASN A 64 15.160 4.629 -13.626 1.00 0.00 C ATOM 996 O ASN A 64 15.580 5.295 -14.573 1.00 0.00 O ATOM 997 CB ASN A 64 13.881 5.793 -11.869 1.00 0.00 C ATOM 998 CG ASN A 64 12.512 6.130 -11.307 1.00 0.00 C ATOM 999 OD1 ASN A 64 12.282 5.925 -10.111 1.00 0.00 O ATOM 1000 ND2 ASN A 64 11.593 6.632 -12.085 1.00 0.00 N ATOM 0 H ASN A 64 12.878 3.766 -11.560 1.00 0.00 H new ATOM 0 HA ASN A 64 13.182 5.284 -13.879 1.00 0.00 H new ATOM 0 HB2 ASN A 64 14.488 5.320 -11.097 1.00 0.00 H new ATOM 0 HB3 ASN A 64 14.394 6.710 -12.160 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.673 6.859 -11.707 1.00 0.00 H new ATOM 0 HD22 ASN A 64 11.794 6.797 -13.071 1.00 0.00 H new ATOM 1007 N GLY A 65 15.890 3.710 -13.013 1.00 0.00 N ATOM 1008 CA GLY A 65 17.257 3.438 -13.440 1.00 0.00 C ATOM 1009 C GLY A 65 18.189 4.367 -12.668 1.00 0.00 C ATOM 1010 O GLY A 65 19.401 4.396 -12.882 1.00 0.00 O ATOM 0 H GLY A 65 15.566 3.145 -12.228 1.00 0.00 H new ATOM 0 HA2 GLY A 65 17.515 2.396 -13.250 1.00 0.00 H new ATOM 0 HA3 GLY A 65 17.360 3.601 -14.513 1.00 0.00 H new ATOM 1014 N ASP A 66 17.576 5.117 -11.755 1.00 0.00 N ATOM 1015 CA ASP A 66 18.267 6.065 -10.898 1.00 0.00 C ATOM 1016 C ASP A 66 19.280 5.366 -9.998 1.00 0.00 C ATOM 1017 O ASP A 66 20.305 5.940 -9.630 1.00 0.00 O ATOM 1018 CB ASP A 66 17.211 6.827 -10.078 1.00 0.00 C ATOM 1019 CG ASP A 66 16.419 5.861 -9.196 1.00 0.00 C ATOM 1020 OD1 ASP A 66 16.870 4.749 -9.007 1.00 0.00 O ATOM 1021 OD2 ASP A 66 15.357 6.244 -8.734 1.00 0.00 O ATOM 0 H ASP A 66 16.570 5.079 -11.591 1.00 0.00 H new ATOM 0 HA ASP A 66 18.835 6.768 -11.507 1.00 0.00 H new ATOM 0 HB2 ASP A 66 17.697 7.580 -9.458 1.00 0.00 H new ATOM 0 HB3 ASP A 66 16.533 7.356 -10.748 1.00 0.00 H new ATOM 1026 N GLY A 67 18.978 4.127 -9.647 1.00 0.00 N ATOM 1027 CA GLY A 67 19.847 3.340 -8.784 1.00 0.00 C ATOM 1028 C GLY A 67 19.326 3.339 -7.356 1.00 0.00 C ATOM 1029 O GLY A 67 19.841 2.619 -6.502 1.00 0.00 O ATOM 0 H GLY A 67 18.133 3.641 -9.948 1.00 0.00 H new ATOM 0 HA2 GLY A 67 19.907 2.317 -9.155 1.00 0.00 H new ATOM 0 HA3 GLY A 67 20.858 3.748 -8.808 1.00 0.00 H new ATOM 1033 N GLU A 68 18.276 4.121 -7.104 1.00 0.00 N ATOM 1034 CA GLU A 68 17.675 4.158 -5.774 1.00 0.00 C ATOM 1035 C GLU A 68 16.203 3.785 -5.892 1.00 0.00 C ATOM 1036 O GLU A 68 15.625 3.788 -6.991 1.00 0.00 O ATOM 1037 CB GLU A 68 17.752 5.534 -5.110 1.00 0.00 C ATOM 1038 CG GLU A 68 19.153 6.143 -5.171 1.00 0.00 C ATOM 1039 CD GLU A 68 20.246 5.195 -4.678 1.00 0.00 C ATOM 1040 OE1 GLU A 68 19.928 4.196 -4.078 1.00 0.00 O ATOM 1041 OE2 GLU A 68 21.404 5.497 -4.918 1.00 0.00 O ATOM 0 H GLU A 68 17.831 4.728 -7.792 1.00 0.00 H new ATOM 0 HA GLU A 68 18.237 3.457 -5.157 1.00 0.00 H new ATOM 0 HB2 GLU A 68 17.046 6.207 -5.597 1.00 0.00 H new ATOM 0 HB3 GLU A 68 17.443 5.448 -4.068 1.00 0.00 H new ATOM 0 HG2 GLU A 68 19.371 6.434 -6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 68 19.173 7.053 -4.571 1.00 0.00 H new ATOM 1048 N VAL A 69 15.588 3.492 -4.755 1.00 0.00 N ATOM 1049 CA VAL A 69 14.180 3.145 -4.734 1.00 0.00 C ATOM 1050 C VAL A 69 13.387 4.385 -4.338 1.00 0.00 C ATOM 1051 O VAL A 69 13.741 5.073 -3.392 1.00 0.00 O ATOM 1052 CB VAL A 69 13.945 2.030 -3.708 1.00 0.00 C ATOM 1053 CG1 VAL A 69 12.495 1.557 -3.765 1.00 0.00 C ATOM 1054 CG2 VAL A 69 14.877 0.858 -4.004 1.00 0.00 C ATOM 0 H VAL A 69 16.041 3.488 -3.841 1.00 0.00 H new ATOM 0 HA VAL A 69 13.861 2.795 -5.716 1.00 0.00 H new ATOM 0 HB VAL A 69 14.151 2.418 -2.711 1.00 0.00 H new ATOM 0 HG11 VAL A 69 12.341 0.765 -3.032 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.831 2.392 -3.542 1.00 0.00 H new ATOM 0 HG13 VAL A 69 12.276 1.175 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL A 69 14.709 0.066 -3.274 1.00 0.00 H new ATOM 0 HG22 VAL A 69 14.676 0.477 -5.005 1.00 0.00 H new ATOM 0 HG23 VAL A 69 15.913 1.193 -3.944 1.00 0.00 H new ATOM 1064 N ASP A 70 12.331 4.683 -5.082 1.00 0.00 N ATOM 1065 CA ASP A 70 11.524 5.870 -4.805 1.00 0.00 C ATOM 1066 C ASP A 70 10.306 5.535 -3.958 1.00 0.00 C ATOM 1067 O ASP A 70 9.891 4.383 -3.867 1.00 0.00 O ATOM 1068 CB ASP A 70 11.111 6.555 -6.109 1.00 0.00 C ATOM 1069 CG ASP A 70 10.419 7.879 -5.807 1.00 0.00 C ATOM 1070 OD1 ASP A 70 11.118 8.862 -5.626 1.00 0.00 O ATOM 1071 OD2 ASP A 70 9.200 7.892 -5.765 1.00 0.00 O ATOM 0 H ASP A 70 12.013 4.127 -5.876 1.00 0.00 H new ATOM 0 HA ASP A 70 12.139 6.563 -4.230 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.988 6.728 -6.732 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.442 5.906 -6.674 1.00 0.00 H new ATOM 1076 N PHE A 71 9.767 6.557 -3.309 1.00 0.00 N ATOM 1077 CA PHE A 71 8.620 6.392 -2.425 1.00 0.00 C ATOM 1078 C PHE A 71 7.517 5.619 -3.147 1.00 0.00 C ATOM 1079 O PHE A 71 6.945 4.690 -2.597 1.00 0.00 O ATOM 1080 CB PHE A 71 8.120 7.802 -2.080 1.00 0.00 C ATOM 1081 CG PHE A 71 7.180 7.848 -0.885 1.00 0.00 C ATOM 1082 CD1 PHE A 71 6.600 6.694 -0.326 1.00 0.00 C ATOM 1083 CD2 PHE A 71 6.880 9.099 -0.340 1.00 0.00 C ATOM 1084 CE1 PHE A 71 5.733 6.808 0.771 1.00 0.00 C ATOM 1085 CE2 PHE A 71 6.020 9.206 0.750 1.00 0.00 C ATOM 1086 CZ PHE A 71 5.447 8.063 1.305 1.00 0.00 C ATOM 0 H PHE A 71 10.108 7.516 -3.378 1.00 0.00 H new ATOM 0 HA PHE A 71 8.894 5.839 -1.527 1.00 0.00 H new ATOM 0 HB2 PHE A 71 8.979 8.442 -1.879 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.609 8.218 -2.948 1.00 0.00 H new ATOM 0 HD1 PHE A 71 6.822 5.722 -0.741 1.00 0.00 H new ATOM 0 HD2 PHE A 71 7.318 9.989 -0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 71 5.287 5.923 1.202 1.00 0.00 H new ATOM 0 HE2 PHE A 71 5.796 10.177 1.166 1.00 0.00 H new ATOM 0 HZ PHE A 71 4.780 8.150 2.150 1.00 0.00 H new ATOM 1096 N GLN A 72 7.239 5.976 -4.389 1.00 0.00 N ATOM 1097 CA GLN A 72 6.211 5.258 -5.137 1.00 0.00 C ATOM 1098 C GLN A 72 6.593 3.783 -5.300 1.00 0.00 C ATOM 1099 O GLN A 72 5.746 2.884 -5.185 1.00 0.00 O ATOM 1100 CB GLN A 72 6.031 5.906 -6.515 1.00 0.00 C ATOM 1101 CG GLN A 72 5.492 7.331 -6.340 1.00 0.00 C ATOM 1102 CD GLN A 72 5.340 8.020 -7.685 1.00 0.00 C ATOM 1103 OE1 GLN A 72 5.889 7.566 -8.689 1.00 0.00 O ATOM 1104 NE2 GLN A 72 4.619 9.104 -7.759 1.00 0.00 N ATOM 0 H GLN A 72 7.694 6.737 -4.894 1.00 0.00 H new ATOM 0 HA GLN A 72 5.273 5.312 -4.584 1.00 0.00 H new ATOM 0 HB2 GLN A 72 6.983 5.928 -7.046 1.00 0.00 H new ATOM 0 HB3 GLN A 72 5.342 5.316 -7.119 1.00 0.00 H new ATOM 0 HG2 GLN A 72 4.528 7.300 -5.831 1.00 0.00 H new ATOM 0 HG3 GLN A 72 6.168 7.905 -5.707 1.00 0.00 H new ATOM 0 HE21 GLN A 72 4.167 9.474 -6.923 1.00 0.00 H new ATOM 0 HE22 GLN A 72 4.507 9.582 -8.653 1.00 0.00 H new ATOM 1113 N GLU A 73 7.881 3.535 -5.555 1.00 0.00 N ATOM 1114 CA GLU A 73 8.358 2.167 -5.725 1.00 0.00 C ATOM 1115 C GLU A 73 8.213 1.383 -4.409 1.00 0.00 C ATOM 1116 O GLU A 73 7.772 0.226 -4.380 1.00 0.00 O ATOM 1117 CB GLU A 73 9.834 2.210 -6.133 1.00 0.00 C ATOM 1118 CG GLU A 73 10.001 2.904 -7.493 1.00 0.00 C ATOM 1119 CD GLU A 73 11.476 2.880 -7.907 1.00 0.00 C ATOM 1120 OE1 GLU A 73 12.261 2.324 -7.165 1.00 0.00 O ATOM 1121 OE2 GLU A 73 11.799 3.397 -8.969 1.00 0.00 O ATOM 0 H GLU A 73 8.599 4.254 -5.646 1.00 0.00 H new ATOM 0 HA GLU A 73 7.767 1.670 -6.494 1.00 0.00 H new ATOM 0 HB2 GLU A 73 10.411 2.740 -5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 73 10.232 1.197 -6.185 1.00 0.00 H new ATOM 0 HG2 GLU A 73 9.394 2.401 -8.246 1.00 0.00 H new ATOM 0 HG3 GLU A 73 9.647 3.933 -7.433 1.00 0.00 H new ATOM 1128 N TYR A 74 8.560 2.052 -3.313 1.00 0.00 N ATOM 1129 CA TYR A 74 8.453 1.467 -1.980 1.00 0.00 C ATOM 1130 C TYR A 74 6.989 1.182 -1.664 1.00 0.00 C ATOM 1131 O TYR A 74 6.628 0.155 -1.072 1.00 0.00 O ATOM 1132 CB TYR A 74 9.034 2.453 -0.961 1.00 0.00 C ATOM 1133 CG TYR A 74 9.063 1.841 0.416 1.00 0.00 C ATOM 1134 CD1 TYR A 74 10.177 1.099 0.821 1.00 0.00 C ATOM 1135 CD2 TYR A 74 7.986 2.023 1.292 1.00 0.00 C ATOM 1136 CE1 TYR A 74 10.217 0.540 2.101 1.00 0.00 C ATOM 1137 CE2 TYR A 74 8.025 1.460 2.574 1.00 0.00 C ATOM 1138 CZ TYR A 74 9.142 0.719 2.976 1.00 0.00 C ATOM 1139 OH TYR A 74 9.190 0.168 4.239 1.00 0.00 O ATOM 0 H TYR A 74 8.920 3.006 -3.323 1.00 0.00 H new ATOM 0 HA TYR A 74 9.008 0.530 -1.935 1.00 0.00 H new ATOM 0 HB2 TYR A 74 10.043 2.739 -1.259 1.00 0.00 H new ATOM 0 HB3 TYR A 74 8.436 3.364 -0.947 1.00 0.00 H new ATOM 0 HD1 TYR A 74 11.007 0.958 0.144 1.00 0.00 H new ATOM 0 HD2 TYR A 74 7.126 2.597 0.980 1.00 0.00 H new ATOM 0 HE1 TYR A 74 11.079 -0.031 2.414 1.00 0.00 H new ATOM 0 HE2 TYR A 74 7.195 1.597 3.251 1.00 0.00 H new ATOM 0 HH TYR A 74 9.123 0.880 4.909 1.00 0.00 H new ATOM 1149 N VAL A 75 6.158 2.134 -2.072 1.00 0.00 N ATOM 1150 CA VAL A 75 4.717 2.048 -1.846 1.00 0.00 C ATOM 1151 C VAL A 75 4.143 0.816 -2.538 1.00 0.00 C ATOM 1152 O VAL A 75 3.410 0.025 -1.915 1.00 0.00 O ATOM 1153 CB VAL A 75 4.011 3.379 -2.318 1.00 0.00 C ATOM 1154 CG1 VAL A 75 3.032 3.145 -3.476 1.00 0.00 C ATOM 1155 CG2 VAL A 75 3.228 4.009 -1.154 1.00 0.00 C ATOM 0 H VAL A 75 6.457 2.977 -2.562 1.00 0.00 H new ATOM 0 HA VAL A 75 4.526 1.937 -0.779 1.00 0.00 H new ATOM 0 HB VAL A 75 4.805 4.043 -2.659 1.00 0.00 H new ATOM 0 HG11 VAL A 75 2.574 4.092 -3.762 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.569 2.730 -4.329 1.00 0.00 H new ATOM 0 HG13 VAL A 75 2.256 2.447 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.746 4.926 -1.494 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.469 3.309 -0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.912 4.240 -0.338 1.00 0.00 H new ATOM 1165 N VAL A 76 4.490 0.609 -3.806 1.00 0.00 N ATOM 1166 CA VAL A 76 3.974 -0.571 -4.470 1.00 0.00 C ATOM 1167 C VAL A 76 4.599 -1.811 -3.847 1.00 0.00 C ATOM 1168 O VAL A 76 3.944 -2.837 -3.734 1.00 0.00 O ATOM 1169 CB VAL A 76 4.195 -0.536 -5.988 1.00 0.00 C ATOM 1170 CG1 VAL A 76 3.635 0.774 -6.552 1.00 0.00 C ATOM 1171 CG2 VAL A 76 5.682 -0.641 -6.316 1.00 0.00 C ATOM 0 H VAL A 76 5.094 1.211 -4.365 1.00 0.00 H new ATOM 0 HA VAL A 76 2.894 -0.598 -4.326 1.00 0.00 H new ATOM 0 HB VAL A 76 3.679 -1.384 -6.439 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.791 0.802 -7.630 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.568 0.836 -6.338 1.00 0.00 H new ATOM 0 HG13 VAL A 76 4.147 1.618 -6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 76 5.819 -0.614 -7.397 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.215 0.195 -5.862 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.076 -1.578 -5.923 1.00 0.00 H new ATOM 1181 N LEU A 77 5.861 -1.723 -3.414 1.00 0.00 N ATOM 1182 CA LEU A 77 6.476 -2.887 -2.777 1.00 0.00 C ATOM 1183 C LEU A 77 5.668 -3.373 -1.576 1.00 0.00 C ATOM 1184 O LEU A 77 5.320 -4.554 -1.489 1.00 0.00 O ATOM 1185 CB LEU A 77 7.901 -2.542 -2.313 1.00 0.00 C ATOM 1186 CG LEU A 77 8.511 -3.691 -1.479 1.00 0.00 C ATOM 1187 CD1 LEU A 77 8.723 -4.950 -2.323 1.00 0.00 C ATOM 1188 CD2 LEU A 77 9.853 -3.227 -0.914 1.00 0.00 C ATOM 0 H LEU A 77 6.453 -0.896 -3.488 1.00 0.00 H new ATOM 0 HA LEU A 77 6.502 -3.685 -3.519 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.531 -2.345 -3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.882 -1.628 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 77 7.818 -3.941 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.153 -5.736 -1.702 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.766 -5.286 -2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 77 9.401 -4.726 -3.147 1.00 0.00 H new ATOM 0 HD21 LEU A 77 10.295 -4.029 -0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.523 -2.969 -1.734 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.699 -2.352 -0.282 1.00 0.00 H new ATOM 1200 N VAL A 78 5.359 -2.475 -0.643 1.00 0.00 N ATOM 1201 CA VAL A 78 4.606 -2.916 0.532 1.00 0.00 C ATOM 1202 C VAL A 78 3.172 -3.281 0.183 1.00 0.00 C ATOM 1203 O VAL A 78 2.617 -4.221 0.752 1.00 0.00 O ATOM 1204 CB VAL A 78 4.609 -1.879 1.675 1.00 0.00 C ATOM 1205 CG1 VAL A 78 6.046 -1.618 2.142 1.00 0.00 C ATOM 1206 CG2 VAL A 78 3.948 -0.559 1.243 1.00 0.00 C ATOM 0 H VAL A 78 5.603 -1.485 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 78 5.125 -3.807 0.886 1.00 0.00 H new ATOM 0 HB VAL A 78 4.027 -2.289 2.500 1.00 0.00 H new ATOM 0 HG11 VAL A 78 6.039 -0.885 2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.487 -2.548 2.501 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.635 -1.235 1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.968 0.147 2.073 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.492 -0.140 0.397 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.914 -0.748 0.952 1.00 0.00 H new ATOM 1216 N ALA A 79 2.559 -2.550 -0.742 1.00 0.00 N ATOM 1217 CA ALA A 79 1.171 -2.864 -1.094 1.00 0.00 C ATOM 1218 C ALA A 79 1.057 -4.209 -1.823 1.00 0.00 C ATOM 1219 O ALA A 79 0.221 -5.068 -1.471 1.00 0.00 O ATOM 1220 CB ALA A 79 0.591 -1.745 -1.958 1.00 0.00 C ATOM 0 H ALA A 79 2.976 -1.767 -1.246 1.00 0.00 H new ATOM 0 HA ALA A 79 0.601 -2.945 -0.168 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.441 -1.983 -2.217 1.00 0.00 H new ATOM 0 HB2 ALA A 79 0.619 -0.806 -1.405 1.00 0.00 H new ATOM 0 HB3 ALA A 79 1.180 -1.646 -2.870 1.00 0.00 H new ATOM 1226 N ALA A 80 1.911 -4.399 -2.825 1.00 0.00 N ATOM 1227 CA ALA A 80 1.908 -5.637 -3.584 1.00 0.00 C ATOM 1228 C ALA A 80 2.272 -6.789 -2.661 1.00 0.00 C ATOM 1229 O ALA A 80 1.657 -7.857 -2.699 1.00 0.00 O ATOM 1230 CB ALA A 80 2.900 -5.544 -4.742 1.00 0.00 C ATOM 0 H ALA A 80 2.606 -3.716 -3.125 1.00 0.00 H new ATOM 0 HA ALA A 80 0.915 -5.811 -3.998 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.890 -6.477 -5.305 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.617 -4.721 -5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.902 -5.367 -4.350 1.00 0.00 H new ATOM 1236 N LEU A 81 3.240 -6.558 -1.779 1.00 0.00 N ATOM 1237 CA LEU A 81 3.585 -7.589 -0.821 1.00 0.00 C ATOM 1238 C LEU A 81 2.416 -7.828 0.122 1.00 0.00 C ATOM 1239 O LEU A 81 2.213 -8.944 0.568 1.00 0.00 O ATOM 1240 CB LEU A 81 4.873 -7.261 -0.054 1.00 0.00 C ATOM 1241 CG LEU A 81 6.107 -7.810 -0.807 1.00 0.00 C ATOM 1242 CD1 LEU A 81 6.053 -7.491 -2.309 1.00 0.00 C ATOM 1243 CD2 LEU A 81 7.377 -7.196 -0.210 1.00 0.00 C ATOM 0 H LEU A 81 3.780 -5.695 -1.711 1.00 0.00 H new ATOM 0 HA LEU A 81 3.785 -8.509 -1.370 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.965 -6.182 0.069 1.00 0.00 H new ATOM 0 HB3 LEU A 81 4.828 -7.693 0.946 1.00 0.00 H new ATOM 0 HG LEU A 81 6.112 -8.894 -0.694 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.939 -7.895 -2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.161 -7.941 -2.745 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.021 -6.411 -2.451 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.250 -7.580 -0.738 1.00 0.00 H new ATOM 0 HD22 LEU A 81 7.340 -6.111 -0.312 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.447 -7.459 0.846 1.00 0.00 H new ATOM 1255 N THR A 82 1.648 -6.783 0.442 1.00 0.00 N ATOM 1256 CA THR A 82 0.508 -6.968 1.343 1.00 0.00 C ATOM 1257 C THR A 82 -0.533 -7.912 0.736 1.00 0.00 C ATOM 1258 O THR A 82 -0.945 -8.909 1.366 1.00 0.00 O ATOM 1259 CB THR A 82 -0.158 -5.613 1.601 1.00 0.00 C ATOM 1260 OG1 THR A 82 0.804 -4.677 2.059 1.00 0.00 O ATOM 1261 CG2 THR A 82 -1.242 -5.778 2.655 1.00 0.00 C ATOM 0 H THR A 82 1.787 -5.831 0.104 1.00 0.00 H new ATOM 0 HA THR A 82 0.879 -7.402 2.272 1.00 0.00 H new ATOM 0 HB THR A 82 -0.597 -5.248 0.672 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.371 -4.397 1.310 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.718 -4.815 2.841 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.988 -6.490 2.301 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.798 -6.148 3.579 1.00 0.00 H new ATOM 1269 N VAL A 83 -0.942 -7.623 -0.505 1.00 0.00 N ATOM 1270 CA VAL A 83 -1.923 -8.497 -1.164 1.00 0.00 C ATOM 1271 C VAL A 83 -1.352 -9.896 -1.361 1.00 0.00 C ATOM 1272 O VAL A 83 -2.051 -10.898 -1.171 1.00 0.00 O ATOM 1273 CB VAL A 83 -2.429 -7.918 -2.504 1.00 0.00 C ATOM 1274 CG1 VAL A 83 -1.306 -7.823 -3.537 1.00 0.00 C ATOM 1275 CG2 VAL A 83 -3.517 -8.843 -3.065 1.00 0.00 C ATOM 0 H VAL A 83 -0.626 -6.825 -1.056 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.786 -8.559 -0.502 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.815 -6.917 -2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.700 -7.411 -4.466 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.517 -7.173 -3.158 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.899 -8.817 -3.724 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.882 -8.444 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.101 -9.837 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.342 -8.906 -2.356 1.00 0.00 H new ATOM 1285 N ALA A 84 -0.072 -9.969 -1.710 1.00 0.00 N ATOM 1286 CA ALA A 84 0.568 -11.258 -1.896 1.00 0.00 C ATOM 1287 C ALA A 84 0.621 -12.004 -0.572 1.00 0.00 C ATOM 1288 O ALA A 84 0.496 -13.227 -0.529 1.00 0.00 O ATOM 1289 CB ALA A 84 1.979 -11.063 -2.445 1.00 0.00 C ATOM 0 H ALA A 84 0.532 -9.162 -1.867 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.010 -11.845 -2.610 1.00 0.00 H new ATOM 0 HB1 ALA A 84 2.454 -12.035 -2.582 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.928 -10.545 -3.403 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.564 -10.469 -1.742 1.00 0.00 H new ATOM 1295 N CYS A 85 0.804 -11.246 0.506 1.00 0.00 N ATOM 1296 CA CYS A 85 0.880 -11.817 1.839 1.00 0.00 C ATOM 1297 C CYS A 85 -0.426 -12.485 2.186 1.00 0.00 C ATOM 1298 O CYS A 85 -0.461 -13.680 2.503 1.00 0.00 O ATOM 1299 CB CYS A 85 1.176 -10.718 2.861 1.00 0.00 C ATOM 1300 SG CYS A 85 1.554 -11.471 4.464 1.00 0.00 S ATOM 0 H CYS A 85 0.902 -10.231 0.477 1.00 0.00 H new ATOM 0 HA CYS A 85 1.681 -12.556 1.861 1.00 0.00 H new ATOM 0 HB2 CYS A 85 2.017 -10.111 2.525 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.318 -10.052 2.953 1.00 0.00 H new ATOM 1305 N ASN A 86 -1.514 -11.730 2.109 1.00 0.00 N ATOM 1306 CA ASN A 86 -2.794 -12.337 2.412 1.00 0.00 C ATOM 1307 C ASN A 86 -3.007 -13.529 1.489 1.00 0.00 C ATOM 1308 O ASN A 86 -3.512 -14.573 1.911 1.00 0.00 O ATOM 1309 CB ASN A 86 -3.935 -11.334 2.253 1.00 0.00 C ATOM 1310 CG ASN A 86 -5.203 -11.910 2.880 1.00 0.00 C ATOM 1311 OD1 ASN A 86 -6.243 -11.146 3.065 1.00 0.00 O flip ATOM 1312 ND2 ASN A 86 -5.237 -13.091 3.231 1.00 0.00 N flip ATOM 0 H ASN A 86 -1.537 -10.743 1.852 1.00 0.00 H new ATOM 0 HA ASN A 86 -2.790 -12.668 3.451 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.675 -10.390 2.732 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.102 -11.120 1.197 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -4.424 -13.690 3.087 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.078 -13.470 3.666 1.00 0.00 H new ATOM 1319 N ASN A 87 -2.602 -13.376 0.223 1.00 0.00 N ATOM 1320 CA ASN A 87 -2.746 -14.465 -0.736 1.00 0.00 C ATOM 1321 C ASN A 87 -1.987 -15.704 -0.272 1.00 0.00 C ATOM 1322 O ASN A 87 -2.486 -16.819 -0.398 1.00 0.00 O ATOM 1323 CB ASN A 87 -2.222 -14.029 -2.105 1.00 0.00 C ATOM 1324 CG ASN A 87 -3.078 -12.893 -2.653 1.00 0.00 C ATOM 1325 OD1 ASN A 87 -4.196 -12.675 -2.186 1.00 0.00 O ATOM 1326 ND2 ASN A 87 -2.618 -12.149 -3.622 1.00 0.00 N ATOM 0 H ASN A 87 -2.181 -12.526 -0.151 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.805 -14.713 -0.811 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -1.185 -13.705 -2.020 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.237 -14.873 -2.795 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -3.185 -11.386 -3.993 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -1.692 -12.330 -4.008 1.00 0.00 H new ATOM 1333 N PHE A 88 -0.789 -15.513 0.287 1.00 0.00 N ATOM 1334 CA PHE A 88 -0.028 -16.656 0.777 1.00 0.00 C ATOM 1335 C PHE A 88 -0.709 -17.291 1.979 1.00 0.00 C ATOM 1336 O PHE A 88 -0.731 -18.511 2.113 1.00 0.00 O ATOM 1337 CB PHE A 88 1.417 -16.284 1.136 1.00 0.00 C ATOM 1338 CG PHE A 88 2.207 -16.004 -0.124 1.00 0.00 C ATOM 1339 CD1 PHE A 88 2.497 -17.051 -1.007 1.00 0.00 C ATOM 1340 CD2 PHE A 88 2.670 -14.713 -0.400 1.00 0.00 C ATOM 1341 CE1 PHE A 88 3.240 -16.806 -2.167 1.00 0.00 C ATOM 1342 CE2 PHE A 88 3.414 -14.467 -1.560 1.00 0.00 C ATOM 1343 CZ PHE A 88 3.697 -15.514 -2.445 1.00 0.00 C ATOM 0 H PHE A 88 -0.339 -14.606 0.408 1.00 0.00 H new ATOM 0 HA PHE A 88 0.006 -17.378 -0.039 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.425 -15.407 1.783 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.883 -17.096 1.694 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.147 -18.050 -0.792 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.453 -13.905 0.283 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.461 -17.615 -2.848 1.00 0.00 H new ATOM 0 HE2 PHE A 88 3.770 -13.470 -1.772 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.268 -15.324 -3.342 1.00 0.00 H new ATOM 1353 N PHE A 89 -1.252 -16.466 2.869 1.00 0.00 N ATOM 1354 CA PHE A 89 -1.906 -17.010 4.053 1.00 0.00 C ATOM 1355 C PHE A 89 -3.111 -17.872 3.674 1.00 0.00 C ATOM 1356 O PHE A 89 -3.215 -19.024 4.093 1.00 0.00 O ATOM 1357 CB PHE A 89 -2.364 -15.869 4.963 1.00 0.00 C ATOM 1358 CG PHE A 89 -2.928 -16.441 6.242 1.00 0.00 C ATOM 1359 CD1 PHE A 89 -2.075 -16.766 7.302 1.00 0.00 C ATOM 1360 CD2 PHE A 89 -4.308 -16.645 6.367 1.00 0.00 C ATOM 1361 CE1 PHE A 89 -2.599 -17.295 8.487 1.00 0.00 C ATOM 1362 CE2 PHE A 89 -4.833 -17.174 7.552 1.00 0.00 C ATOM 1363 CZ PHE A 89 -3.979 -17.498 8.611 1.00 0.00 C ATOM 0 H PHE A 89 -1.254 -15.448 2.798 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.185 -17.637 4.578 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.526 -15.208 5.186 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -3.119 -15.267 4.457 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.011 -16.609 7.206 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -4.967 -16.394 5.549 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.940 -17.546 9.305 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -5.897 -17.332 7.648 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.384 -17.905 9.526 1.00 0.00 H new ATOM 1373 N TRP A 90 -4.011 -17.314 2.865 1.00 0.00 N ATOM 1374 CA TRP A 90 -5.188 -18.053 2.422 1.00 0.00 C ATOM 1375 C TRP A 90 -4.832 -19.203 1.498 1.00 0.00 C ATOM 1376 O TRP A 90 -5.448 -20.268 1.540 1.00 0.00 O ATOM 1377 CB TRP A 90 -6.168 -17.136 1.713 1.00 0.00 C ATOM 1378 CG TRP A 90 -7.346 -17.957 1.332 1.00 0.00 C ATOM 1379 CD1 TRP A 90 -7.361 -18.785 0.278 1.00 0.00 C ATOM 1380 CD2 TRP A 90 -8.654 -18.061 1.962 1.00 0.00 C ATOM 1381 NE1 TRP A 90 -8.597 -19.396 0.199 1.00 0.00 N ATOM 1382 CE2 TRP A 90 -9.435 -18.979 1.216 1.00 0.00 C ATOM 1383 CE3 TRP A 90 -9.239 -17.455 3.088 1.00 0.00 C ATOM 1384 CZ2 TRP A 90 -10.748 -19.284 1.577 1.00 0.00 C ATOM 1385 CZ3 TRP A 90 -10.560 -17.760 3.454 1.00 0.00 C ATOM 1386 CH2 TRP A 90 -11.313 -18.672 2.700 1.00 0.00 C ATOM 0 H TRP A 90 -3.947 -16.361 2.507 1.00 0.00 H new ATOM 0 HA TRP A 90 -5.649 -18.464 3.321 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -6.467 -16.315 2.365 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -5.708 -16.691 0.831 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -6.537 -18.948 -0.401 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -8.859 -20.071 -0.520 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -8.669 -16.750 3.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -11.323 -19.987 0.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -10.999 -17.289 4.321 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -12.329 -18.901 2.987 1.00 0.00 H new ATOM 1397 N GLU A 91 -3.878 -18.950 0.620 1.00 0.00 N ATOM 1398 CA GLU A 91 -3.480 -19.931 -0.376 1.00 0.00 C ATOM 1399 C GLU A 91 -2.166 -20.615 -0.009 1.00 0.00 C ATOM 1400 O GLU A 91 -1.238 -19.980 0.479 1.00 0.00 O ATOM 1401 CB GLU A 91 -3.343 -19.199 -1.712 1.00 0.00 C ATOM 1402 CG GLU A 91 -3.703 -20.134 -2.872 1.00 0.00 C ATOM 1403 CD GLU A 91 -2.636 -21.214 -3.026 1.00 0.00 C ATOM 1404 OE1 GLU A 91 -1.570 -21.050 -2.455 1.00 0.00 O ATOM 1405 OE2 GLU A 91 -2.900 -22.185 -3.715 1.00 0.00 O ATOM 0 H GLU A 91 -3.363 -18.071 0.576 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.234 -20.716 -0.434 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.995 -18.326 -1.724 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.322 -18.836 -1.832 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.674 -20.595 -2.690 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.789 -19.563 -3.796 1.00 0.00 H new ATOM 1412 N ASN A 92 -2.097 -21.920 -0.262 1.00 0.00 N ATOM 1413 CA ASN A 92 -0.892 -22.689 0.037 1.00 0.00 C ATOM 1414 C ASN A 92 -0.128 -23.004 -1.245 1.00 0.00 C ATOM 1415 O ASN A 92 -0.724 -23.355 -2.263 1.00 0.00 O ATOM 1416 CB ASN A 92 -1.270 -23.995 0.740 1.00 0.00 C ATOM 1417 CG ASN A 92 -1.908 -23.693 2.092 1.00 0.00 C ATOM 1418 OD1 ASN A 92 -1.764 -22.588 2.615 1.00 0.00 O ATOM 1419 ND2 ASN A 92 -2.608 -24.616 2.693 1.00 0.00 N ATOM 0 H ASN A 92 -2.857 -22.464 -0.671 1.00 0.00 H new ATOM 0 HA ASN A 92 -0.255 -22.094 0.691 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.963 -24.564 0.120 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.383 -24.614 0.877 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.037 -24.422 3.598 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.726 -25.531 2.258 1.00 0.00 H new ATOM 1426 N SER A 93 1.193 -22.877 -1.188 1.00 0.00 N ATOM 1427 CA SER A 93 2.028 -23.151 -2.351 1.00 0.00 C ATOM 1428 C SER A 93 2.152 -24.654 -2.580 1.00 0.00 C ATOM 1429 O SER A 93 3.246 -25.099 -2.884 1.00 0.00 O ATOM 1430 CB SER A 93 3.418 -22.548 -2.151 1.00 0.00 C ATOM 1431 OG SER A 93 4.288 -23.024 -3.169 1.00 0.00 O ATOM 0 H SER A 93 1.706 -22.588 -0.355 1.00 0.00 H new ATOM 0 HA SER A 93 1.559 -22.699 -3.225 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.363 -21.460 -2.183 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.806 -22.818 -1.169 1.00 0.00 H new ATOM 0 HG SER A 93 4.476 -23.974 -3.021 1.00 0.00 H new TER 1437 SER A 93 ATOM 1438 N GLY B 1 6.812 -6.934 17.454 1.00 0.00 N ATOM 1439 CA GLY B 1 5.955 -6.529 16.345 1.00 0.00 C ATOM 1440 C GLY B 1 6.474 -5.253 15.694 1.00 0.00 C ATOM 1441 O GLY B 1 7.165 -4.456 16.332 1.00 0.00 O ATOM 0 H1 GLY B 1 6.223 -7.184 18.274 1.00 0.00 H new ATOM 0 H2 GLY B 1 7.379 -7.758 17.171 1.00 0.00 H new ATOM 0 H3 GLY B 1 7.445 -6.149 17.708 1.00 0.00 H new ATOM 0 HA2 GLY B 1 5.910 -7.328 15.604 1.00 0.00 H new ATOM 0 HA3 GLY B 1 4.938 -6.371 16.705 1.00 0.00 H new ATOM 1445 N SER B 2 6.138 -5.063 14.421 1.00 0.00 N ATOM 1446 CA SER B 2 6.573 -3.878 13.684 1.00 0.00 C ATOM 1447 C SER B 2 5.378 -3.057 13.217 1.00 0.00 C ATOM 1448 O SER B 2 4.353 -3.607 12.813 1.00 0.00 O ATOM 1449 CB SER B 2 7.400 -4.299 12.477 1.00 0.00 C ATOM 1450 OG SER B 2 7.777 -3.141 11.751 1.00 0.00 O ATOM 0 H SER B 2 5.568 -5.712 13.879 1.00 0.00 H new ATOM 0 HA SER B 2 7.177 -3.263 14.351 1.00 0.00 H new ATOM 0 HB2 SER B 2 8.286 -4.846 12.800 1.00 0.00 H new ATOM 0 HB3 SER B 2 6.824 -4.971 11.841 1.00 0.00 H new ATOM 0 HG SER B 2 7.774 -2.365 12.349 1.00 0.00 H new ATOM 1456 N GLU B 3 5.513 -1.735 13.282 1.00 0.00 N ATOM 1457 CA GLU B 3 4.432 -0.849 12.869 1.00 0.00 C ATOM 1458 C GLU B 3 4.102 -0.992 11.387 1.00 0.00 C ATOM 1459 O GLU B 3 2.932 -0.937 11.000 1.00 0.00 O ATOM 1460 CB GLU B 3 4.830 0.602 13.149 1.00 0.00 C ATOM 1461 CG GLU B 3 4.949 0.819 14.655 1.00 0.00 C ATOM 1462 CD GLU B 3 5.290 2.276 14.947 1.00 0.00 C ATOM 1463 OE1 GLU B 3 5.581 2.996 14.006 1.00 0.00 O ATOM 1464 OE2 GLU B 3 5.256 2.650 16.108 1.00 0.00 O ATOM 0 H GLU B 3 6.352 -1.259 13.613 1.00 0.00 H new ATOM 0 HA GLU B 3 3.546 -1.127 13.439 1.00 0.00 H new ATOM 0 HB2 GLU B 3 5.778 0.830 12.663 1.00 0.00 H new ATOM 0 HB3 GLU B 3 4.086 1.281 12.731 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.013 0.551 15.144 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.721 0.167 15.065 1.00 0.00 H new ATOM 1471 N LEU B 4 5.121 -1.162 10.549 1.00 0.00 N ATOM 1472 CA LEU B 4 4.867 -1.287 9.119 1.00 0.00 C ATOM 1473 C LEU B 4 4.055 -2.556 8.861 1.00 0.00 C ATOM 1474 O LEU B 4 3.089 -2.567 8.083 1.00 0.00 O ATOM 1475 CB LEU B 4 6.200 -1.401 8.382 1.00 0.00 C ATOM 1476 CG LEU B 4 6.021 -1.069 6.885 1.00 0.00 C ATOM 1477 CD1 LEU B 4 7.387 -0.890 6.208 1.00 0.00 C ATOM 1478 CD2 LEU B 4 5.219 -2.148 6.149 1.00 0.00 C ATOM 0 H LEU B 4 6.102 -1.215 10.825 1.00 0.00 H new ATOM 0 HA LEU B 4 4.317 -0.414 8.768 1.00 0.00 H new ATOM 0 HB2 LEU B 4 6.927 -0.722 8.827 1.00 0.00 H new ATOM 0 HB3 LEU B 4 6.598 -2.410 8.492 1.00 0.00 H new ATOM 0 HG LEU B 4 5.460 -0.136 6.829 1.00 0.00 H new ATOM 0 HD11 LEU B 4 7.242 -0.656 5.153 1.00 0.00 H new ATOM 0 HD12 LEU B 4 7.928 -0.075 6.689 1.00 0.00 H new ATOM 0 HD13 LEU B 4 7.962 -1.811 6.300 1.00 0.00 H new ATOM 0 HD21 LEU B 4 5.118 -1.873 5.099 1.00 0.00 H new ATOM 0 HD22 LEU B 4 5.738 -3.103 6.226 1.00 0.00 H new ATOM 0 HD23 LEU B 4 4.230 -2.236 6.598 1.00 0.00 H new ATOM 1490 N GLU B 5 4.453 -3.630 9.548 1.00 0.00 N ATOM 1491 CA GLU B 5 3.769 -4.905 9.414 1.00 0.00 C ATOM 1492 C GLU B 5 2.348 -4.770 9.926 1.00 0.00 C ATOM 1493 O GLU B 5 1.407 -5.290 9.330 1.00 0.00 O ATOM 1494 CB GLU B 5 4.518 -5.978 10.217 1.00 0.00 C ATOM 1495 CG GLU B 5 4.226 -7.371 9.652 1.00 0.00 C ATOM 1496 CD GLU B 5 2.790 -7.782 9.966 1.00 0.00 C ATOM 1497 OE1 GLU B 5 2.183 -7.148 10.812 1.00 0.00 O ATOM 1498 OE2 GLU B 5 2.319 -8.729 9.355 1.00 0.00 O ATOM 0 H GLU B 5 5.240 -3.636 10.196 1.00 0.00 H new ATOM 0 HA GLU B 5 3.745 -5.200 8.365 1.00 0.00 H new ATOM 0 HB2 GLU B 5 5.590 -5.783 10.184 1.00 0.00 H new ATOM 0 HB3 GLU B 5 4.218 -5.933 11.264 1.00 0.00 H new ATOM 0 HG2 GLU B 5 4.384 -7.374 8.574 1.00 0.00 H new ATOM 0 HG3 GLU B 5 4.920 -8.096 10.078 1.00 0.00 H new ATOM 1505 N THR B 6 2.199 -4.035 11.026 1.00 0.00 N ATOM 1506 CA THR B 6 0.883 -3.810 11.594 1.00 0.00 C ATOM 1507 C THR B 6 0.016 -3.104 10.571 1.00 0.00 C ATOM 1508 O THR B 6 -1.166 -3.413 10.417 1.00 0.00 O ATOM 1509 CB THR B 6 0.990 -2.958 12.860 1.00 0.00 C ATOM 1510 OG1 THR B 6 1.896 -3.572 13.766 1.00 0.00 O ATOM 1511 CG2 THR B 6 -0.387 -2.838 13.515 1.00 0.00 C ATOM 0 H THR B 6 2.966 -3.592 11.532 1.00 0.00 H new ATOM 0 HA THR B 6 0.436 -4.768 11.858 1.00 0.00 H new ATOM 0 HB THR B 6 1.353 -1.964 12.600 1.00 0.00 H new ATOM 0 HG1 THR B 6 2.810 -3.285 13.560 1.00 0.00 H new ATOM 0 HG21 THR B 6 -0.309 -2.231 14.417 1.00 0.00 H new ATOM 0 HG22 THR B 6 -1.081 -2.367 12.819 1.00 0.00 H new ATOM 0 HG23 THR B 6 -0.753 -3.831 13.777 1.00 0.00 H new ATOM 1519 N ALA B 7 0.622 -2.155 9.863 1.00 0.00 N ATOM 1520 CA ALA B 7 -0.101 -1.417 8.845 1.00 0.00 C ATOM 1521 C ALA B 7 -0.546 -2.356 7.734 1.00 0.00 C ATOM 1522 O ALA B 7 -1.693 -2.305 7.289 1.00 0.00 O ATOM 1523 CB ALA B 7 0.802 -0.330 8.266 1.00 0.00 C ATOM 0 H ALA B 7 1.599 -1.885 9.977 1.00 0.00 H new ATOM 0 HA ALA B 7 -0.982 -0.959 9.295 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.259 0.225 7.501 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.107 0.351 9.060 1.00 0.00 H new ATOM 0 HB3 ALA B 7 1.686 -0.789 7.823 1.00 0.00 H new ATOM 1529 N MET B 8 0.357 -3.244 7.309 1.00 0.00 N ATOM 1530 CA MET B 8 0.005 -4.201 6.259 1.00 0.00 C ATOM 1531 C MET B 8 -1.183 -5.047 6.717 1.00 0.00 C ATOM 1532 O MET B 8 -2.143 -5.296 5.960 1.00 0.00 O ATOM 1533 CB MET B 8 1.217 -5.111 5.997 1.00 0.00 C ATOM 1534 CG MET B 8 2.363 -4.299 5.376 1.00 0.00 C ATOM 1535 SD MET B 8 3.787 -5.376 5.038 1.00 0.00 S ATOM 1536 CE MET B 8 3.120 -6.256 3.613 1.00 0.00 C ATOM 0 H MET B 8 1.310 -3.320 7.664 1.00 0.00 H new ATOM 0 HA MET B 8 -0.266 -3.671 5.346 1.00 0.00 H new ATOM 0 HB2 MET B 8 1.548 -5.566 6.930 1.00 0.00 H new ATOM 0 HB3 MET B 8 0.933 -5.924 5.329 1.00 0.00 H new ATOM 0 HG2 MET B 8 2.026 -3.829 4.452 1.00 0.00 H new ATOM 0 HG3 MET B 8 2.658 -3.497 6.052 1.00 0.00 H new ATOM 0 HE1 MET B 8 3.444 -7.296 3.643 1.00 0.00 H new ATOM 0 HE2 MET B 8 2.031 -6.214 3.637 1.00 0.00 H new ATOM 0 HE3 MET B 8 3.481 -5.790 2.696 1.00 0.00 H new ATOM 1546 N GLU B 9 -1.141 -5.441 7.987 1.00 0.00 N ATOM 1547 CA GLU B 9 -2.225 -6.217 8.554 1.00 0.00 C ATOM 1548 C GLU B 9 -3.493 -5.390 8.582 1.00 0.00 C ATOM 1549 O GLU B 9 -4.582 -5.912 8.369 1.00 0.00 O ATOM 1550 CB GLU B 9 -1.873 -6.678 9.969 1.00 0.00 C ATOM 1551 CG GLU B 9 -0.707 -7.666 9.910 1.00 0.00 C ATOM 1552 CD GLU B 9 -0.385 -8.178 11.310 1.00 0.00 C ATOM 1553 OE1 GLU B 9 -0.939 -7.642 12.256 1.00 0.00 O ATOM 1554 OE2 GLU B 9 0.409 -9.097 11.415 1.00 0.00 O ATOM 0 H GLU B 9 -0.377 -5.236 8.631 1.00 0.00 H new ATOM 0 HA GLU B 9 -2.384 -7.097 7.931 1.00 0.00 H new ATOM 0 HB2 GLU B 9 -1.605 -5.820 10.586 1.00 0.00 H new ATOM 0 HB3 GLU B 9 -2.739 -7.149 10.435 1.00 0.00 H new ATOM 0 HG2 GLU B 9 -0.961 -8.502 9.258 1.00 0.00 H new ATOM 0 HG3 GLU B 9 0.170 -7.181 9.481 1.00 0.00 H new ATOM 1561 N THR B 10 -3.353 -4.094 8.841 1.00 0.00 N ATOM 1562 CA THR B 10 -4.519 -3.232 8.875 1.00 0.00 C ATOM 1563 C THR B 10 -5.182 -3.187 7.508 1.00 0.00 C ATOM 1564 O THR B 10 -6.406 -3.277 7.400 1.00 0.00 O ATOM 1565 CB THR B 10 -4.122 -1.817 9.296 1.00 0.00 C ATOM 1566 OG1 THR B 10 -3.429 -1.870 10.535 1.00 0.00 O ATOM 1567 CG2 THR B 10 -5.379 -0.958 9.448 1.00 0.00 C ATOM 0 H THR B 10 -2.464 -3.630 9.026 1.00 0.00 H new ATOM 0 HA THR B 10 -5.223 -3.637 9.602 1.00 0.00 H new ATOM 0 HB THR B 10 -3.474 -1.379 8.536 1.00 0.00 H new ATOM 0 HG1 THR B 10 -2.556 -2.296 10.404 1.00 0.00 H new ATOM 0 HG21 THR B 10 -5.096 0.051 9.748 1.00 0.00 H new ATOM 0 HG22 THR B 10 -5.910 -0.918 8.497 1.00 0.00 H new ATOM 0 HG23 THR B 10 -6.028 -1.394 10.208 1.00 0.00 H new ATOM 1575 N LEU B 11 -4.373 -3.054 6.453 1.00 0.00 N ATOM 1576 CA LEU B 11 -4.944 -3.005 5.116 1.00 0.00 C ATOM 1577 C LEU B 11 -5.656 -4.317 4.824 1.00 0.00 C ATOM 1578 O LEU B 11 -6.780 -4.334 4.299 1.00 0.00 O ATOM 1579 CB LEU B 11 -3.846 -2.802 4.061 1.00 0.00 C ATOM 1580 CG LEU B 11 -2.989 -1.563 4.368 1.00 0.00 C ATOM 1581 CD1 LEU B 11 -2.009 -1.333 3.217 1.00 0.00 C ATOM 1582 CD2 LEU B 11 -3.858 -0.312 4.542 1.00 0.00 C ATOM 0 H LEU B 11 -3.357 -2.981 6.499 1.00 0.00 H new ATOM 0 HA LEU B 11 -5.643 -2.170 5.072 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -3.209 -3.686 4.023 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -4.302 -2.695 3.077 1.00 0.00 H new ATOM 0 HG LEU B 11 -2.452 -1.741 5.300 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.398 -0.455 3.429 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -1.365 -2.206 3.108 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -2.564 -1.174 2.293 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -3.221 0.546 4.758 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -4.417 -0.127 3.625 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -4.554 -0.464 5.367 1.00 0.00 H new ATOM 1594 N ILE B 12 -5.007 -5.421 5.199 1.00 0.00 N ATOM 1595 CA ILE B 12 -5.617 -6.730 4.983 1.00 0.00 C ATOM 1596 C ILE B 12 -6.923 -6.867 5.755 1.00 0.00 C ATOM 1597 O ILE B 12 -7.928 -7.337 5.220 1.00 0.00 O ATOM 1598 CB ILE B 12 -4.655 -7.853 5.394 1.00 0.00 C ATOM 1599 CG1 ILE B 12 -3.402 -7.817 4.511 1.00 0.00 C ATOM 1600 CG2 ILE B 12 -5.354 -9.202 5.236 1.00 0.00 C ATOM 1601 CD1 ILE B 12 -2.359 -8.802 5.044 1.00 0.00 C ATOM 0 H ILE B 12 -4.087 -5.436 5.640 1.00 0.00 H new ATOM 0 HA ILE B 12 -5.833 -6.816 3.918 1.00 0.00 H new ATOM 0 HB ILE B 12 -4.361 -7.712 6.434 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -3.663 -8.071 3.484 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -2.987 -6.809 4.494 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -4.673 -10.001 5.527 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -6.239 -9.230 5.872 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -5.650 -9.339 4.196 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -1.472 -8.770 4.411 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -2.087 -8.528 6.063 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -2.774 -9.810 5.037 1.00 0.00 H new ATOM 1613 N ASN B 13 -6.890 -6.475 7.023 1.00 0.00 N ATOM 1614 CA ASN B 13 -8.066 -6.583 7.872 1.00 0.00 C ATOM 1615 C ASN B 13 -9.241 -5.754 7.364 1.00 0.00 C ATOM 1616 O ASN B 13 -10.375 -6.219 7.399 1.00 0.00 O ATOM 1617 CB ASN B 13 -7.711 -6.139 9.290 1.00 0.00 C ATOM 1618 CG ASN B 13 -6.686 -7.092 9.894 1.00 0.00 C ATOM 1619 OD1 ASN B 13 -6.510 -8.208 9.405 1.00 0.00 O ATOM 1620 ND2 ASN B 13 -5.993 -6.716 10.934 1.00 0.00 N ATOM 0 H ASN B 13 -6.068 -6.083 7.482 1.00 0.00 H new ATOM 0 HA ASN B 13 -8.377 -7.628 7.859 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -7.311 -5.125 9.273 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -8.608 -6.117 9.908 1.00 0.00 H new ATOM 0 HD21 ASN B 13 -5.304 -7.347 11.343 1.00 0.00 H new ATOM 0 HD22 ASN B 13 -6.140 -5.791 11.338 1.00 0.00 H new ATOM 1627 N VAL B 14 -8.990 -4.527 6.901 1.00 0.00 N ATOM 1628 CA VAL B 14 -10.104 -3.700 6.425 1.00 0.00 C ATOM 1629 C VAL B 14 -10.632 -4.178 5.062 1.00 0.00 C ATOM 1630 O VAL B 14 -11.868 -4.274 4.855 1.00 0.00 O ATOM 1631 CB VAL B 14 -9.734 -2.196 6.391 1.00 0.00 C ATOM 1632 CG1 VAL B 14 -9.209 -1.759 7.767 1.00 0.00 C ATOM 1633 CG2 VAL B 14 -8.672 -1.888 5.323 1.00 0.00 C ATOM 0 H VAL B 14 -8.067 -4.097 6.845 1.00 0.00 H new ATOM 0 HA VAL B 14 -10.913 -3.819 7.146 1.00 0.00 H new ATOM 0 HB VAL B 14 -10.638 -1.642 6.137 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -8.950 -0.701 7.738 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -9.980 -1.924 8.520 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -8.324 -2.342 8.021 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -8.443 -0.822 5.334 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -7.766 -2.456 5.536 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -9.053 -2.167 4.340 1.00 0.00 H new ATOM 1643 N PHE B 15 -9.723 -4.538 4.142 1.00 0.00 N ATOM 1644 CA PHE B 15 -10.181 -5.033 2.855 1.00 0.00 C ATOM 1645 C PHE B 15 -11.010 -6.276 3.059 1.00 0.00 C ATOM 1646 O PHE B 15 -12.115 -6.401 2.530 1.00 0.00 O ATOM 1647 CB PHE B 15 -9.009 -5.337 1.928 1.00 0.00 C ATOM 1648 CG PHE B 15 -9.572 -5.823 0.620 1.00 0.00 C ATOM 1649 CD1 PHE B 15 -10.178 -4.925 -0.262 1.00 0.00 C ATOM 1650 CD2 PHE B 15 -9.499 -7.182 0.295 1.00 0.00 C ATOM 1651 CE1 PHE B 15 -10.715 -5.387 -1.468 1.00 0.00 C ATOM 1652 CE2 PHE B 15 -10.031 -7.643 -0.912 1.00 0.00 C ATOM 1653 CZ PHE B 15 -10.641 -6.745 -1.793 1.00 0.00 C ATOM 0 H PHE B 15 -8.711 -4.496 4.265 1.00 0.00 H new ATOM 0 HA PHE B 15 -10.787 -4.258 2.386 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -8.402 -4.445 1.775 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -8.359 -6.093 2.369 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -10.232 -3.875 -0.013 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -9.031 -7.875 0.978 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -11.187 -4.694 -2.149 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -9.971 -8.691 -1.164 1.00 0.00 H new ATOM 0 HZ PHE B 15 -11.055 -7.100 -2.725 1.00 0.00 H new ATOM 1663 N HIS B 16 -10.482 -7.179 3.861 1.00 0.00 N ATOM 1664 CA HIS B 16 -11.191 -8.396 4.169 1.00 0.00 C ATOM 1665 C HIS B 16 -12.454 -8.081 4.922 1.00 0.00 C ATOM 1666 O HIS B 16 -13.465 -8.767 4.765 1.00 0.00 O ATOM 1667 CB HIS B 16 -10.310 -9.354 4.973 1.00 0.00 C ATOM 1668 CG HIS B 16 -11.046 -10.647 5.195 1.00 0.00 C ATOM 1669 ND1 HIS B 16 -11.370 -11.500 4.153 1.00 0.00 N ATOM 1670 CD2 HIS B 16 -11.528 -11.244 6.333 1.00 0.00 C ATOM 1671 CE1 HIS B 16 -12.017 -12.557 4.680 1.00 0.00 C ATOM 1672 NE2 HIS B 16 -12.141 -12.450 6.006 1.00 0.00 N ATOM 0 H HIS B 16 -9.569 -7.090 4.307 1.00 0.00 H new ATOM 0 HA HIS B 16 -11.453 -8.888 3.233 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -9.378 -9.541 4.440 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -10.046 -8.905 5.930 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -11.444 -10.839 7.331 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -12.390 -13.389 4.102 1.00 0.00 H new ATOM 0 HE2 HIS B 16 -12.589 -13.110 6.642 1.00 0.00 H new ATOM 1681 N ALA B 17 -12.401 -7.061 5.762 1.00 0.00 N ATOM 1682 CA ALA B 17 -13.570 -6.737 6.530 1.00 0.00 C ATOM 1683 C ALA B 17 -14.730 -6.466 5.612 1.00 0.00 C ATOM 1684 O ALA B 17 -15.781 -7.068 5.747 1.00 0.00 O ATOM 1685 CB ALA B 17 -13.335 -5.456 7.346 1.00 0.00 C ATOM 0 H ALA B 17 -11.587 -6.467 5.920 1.00 0.00 H new ATOM 0 HA ALA B 17 -13.780 -7.581 7.188 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -14.230 -5.223 7.923 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -12.495 -5.605 8.024 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -13.114 -4.630 6.670 1.00 0.00 H new ATOM 1691 N HIS B 18 -14.544 -5.580 4.654 1.00 0.00 N ATOM 1692 CA HIS B 18 -15.659 -5.287 3.749 1.00 0.00 C ATOM 1693 C HIS B 18 -15.870 -6.334 2.663 1.00 0.00 C ATOM 1694 O HIS B 18 -16.999 -6.793 2.454 1.00 0.00 O ATOM 1695 CB HIS B 18 -15.507 -3.892 3.156 1.00 0.00 C ATOM 1696 CG HIS B 18 -15.965 -2.885 4.182 1.00 0.00 C ATOM 1697 ND1 HIS B 18 -15.472 -2.544 5.417 1.00 0.00 N flip ATOM 1698 CD2 HIS B 18 -17.119 -2.136 4.015 1.00 0.00 C flip ATOM 1699 CE1 HIS B 18 -16.305 -1.600 6.009 1.00 0.00 C flip ATOM 1700 NE2 HIS B 18 -17.281 -1.390 5.122 1.00 0.00 N flip ATOM 0 H HIS B 18 -13.680 -5.068 4.478 1.00 0.00 H new ATOM 0 HA HIS B 18 -16.563 -5.323 4.356 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -14.468 -3.708 2.881 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -16.098 -3.801 2.245 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -17.770 -2.149 3.153 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -16.188 -1.137 6.977 1.00 0.00 H new ATOM 0 HE2 HIS B 18 -18.055 -0.742 5.267 1.00 0.00 H new ATOM 1709 N SER B 19 -14.805 -6.704 1.955 1.00 0.00 N ATOM 1710 CA SER B 19 -14.958 -7.679 0.885 1.00 0.00 C ATOM 1711 C SER B 19 -15.545 -8.971 1.417 1.00 0.00 C ATOM 1712 O SER B 19 -16.421 -9.570 0.790 1.00 0.00 O ATOM 1713 CB SER B 19 -13.616 -7.994 0.237 1.00 0.00 C ATOM 1714 OG SER B 19 -13.839 -8.925 -0.818 1.00 0.00 O ATOM 0 H SER B 19 -13.857 -6.355 2.097 1.00 0.00 H new ATOM 0 HA SER B 19 -15.629 -7.243 0.145 1.00 0.00 H new ATOM 0 HB2 SER B 19 -13.158 -7.084 -0.150 1.00 0.00 H new ATOM 0 HB3 SER B 19 -12.927 -8.410 0.972 1.00 0.00 H new ATOM 0 HG SER B 19 -14.569 -8.605 -1.388 1.00 0.00 H new ATOM 1720 N GLY B 20 -15.061 -9.396 2.580 1.00 0.00 N ATOM 1721 CA GLY B 20 -15.551 -10.621 3.186 1.00 0.00 C ATOM 1722 C GLY B 20 -16.906 -10.422 3.864 1.00 0.00 C ATOM 1723 O GLY B 20 -17.795 -11.264 3.740 1.00 0.00 O ATOM 0 H GLY B 20 -14.338 -8.914 3.114 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -15.638 -11.394 2.422 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -14.828 -10.977 3.919 1.00 0.00 H new ATOM 1727 N LYS B 21 -17.059 -9.314 4.597 1.00 0.00 N ATOM 1728 CA LYS B 21 -18.321 -9.052 5.298 1.00 0.00 C ATOM 1729 C LYS B 21 -19.528 -8.987 4.370 1.00 0.00 C ATOM 1730 O LYS B 21 -20.592 -9.501 4.714 1.00 0.00 O ATOM 1731 CB LYS B 21 -18.215 -7.731 6.054 1.00 0.00 C ATOM 1732 CG LYS B 21 -19.507 -7.419 6.795 1.00 0.00 C ATOM 1733 CD LYS B 21 -19.311 -6.101 7.549 1.00 0.00 C ATOM 1734 CE LYS B 21 -19.141 -4.949 6.551 1.00 0.00 C ATOM 1735 NZ LYS B 21 -17.689 -4.697 6.331 1.00 0.00 N ATOM 0 H LYS B 21 -16.342 -8.598 4.719 1.00 0.00 H new ATOM 0 HA LYS B 21 -18.479 -9.890 5.977 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.388 -7.779 6.763 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -17.989 -6.926 5.355 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -20.338 -7.338 6.095 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -19.752 -8.223 7.489 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -20.168 -5.911 8.195 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -18.435 -6.168 8.194 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -19.626 -5.196 5.607 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -19.624 -4.049 6.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -17.529 -4.431 5.338 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -17.373 -3.925 6.951 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -17.150 -5.559 6.550 1.00 0.00 H new ATOM 1749 N GLU B 22 -19.393 -8.335 3.215 1.00 0.00 N ATOM 1750 CA GLU B 22 -20.537 -8.214 2.305 1.00 0.00 C ATOM 1751 C GLU B 22 -20.222 -8.687 0.890 1.00 0.00 C ATOM 1752 O GLU B 22 -19.139 -8.433 0.358 1.00 0.00 O ATOM 1753 CB GLU B 22 -21.008 -6.758 2.273 1.00 0.00 C ATOM 1754 CG GLU B 22 -22.297 -6.654 1.455 1.00 0.00 C ATOM 1755 CD GLU B 22 -22.736 -5.197 1.353 1.00 0.00 C ATOM 1756 OE1 GLU B 22 -22.037 -4.350 1.887 1.00 0.00 O ATOM 1757 OE2 GLU B 22 -23.766 -4.949 0.748 1.00 0.00 O ATOM 0 H GLU B 22 -18.532 -7.894 2.892 1.00 0.00 H new ATOM 0 HA GLU B 22 -21.325 -8.863 2.687 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -21.179 -6.398 3.288 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -20.236 -6.125 1.836 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -22.138 -7.065 0.458 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -23.083 -7.247 1.923 1.00 0.00 H new ATOM 1764 N GLY B 23 -21.206 -9.346 0.277 1.00 0.00 N ATOM 1765 CA GLY B 23 -21.078 -9.819 -1.099 1.00 0.00 C ATOM 1766 C GLY B 23 -20.033 -10.913 -1.236 1.00 0.00 C ATOM 1767 O GLY B 23 -19.773 -11.671 -0.302 1.00 0.00 O ATOM 0 H GLY B 23 -22.102 -9.564 0.714 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -22.042 -10.195 -1.443 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -20.812 -8.983 -1.745 1.00 0.00 H new ATOM 1771 N ASP B 24 -19.428 -10.968 -2.418 1.00 0.00 N ATOM 1772 CA ASP B 24 -18.393 -11.949 -2.697 1.00 0.00 C ATOM 1773 C ASP B 24 -17.155 -11.629 -1.875 1.00 0.00 C ATOM 1774 O ASP B 24 -16.858 -10.463 -1.614 1.00 0.00 O ATOM 1775 CB ASP B 24 -18.043 -11.935 -4.186 1.00 0.00 C ATOM 1776 CG ASP B 24 -19.236 -12.416 -5.006 1.00 0.00 C ATOM 1777 OD1 ASP B 24 -20.157 -12.957 -4.415 1.00 0.00 O ATOM 1778 OD2 ASP B 24 -19.212 -12.236 -6.213 1.00 0.00 O ATOM 0 H ASP B 24 -19.639 -10.343 -3.196 1.00 0.00 H new ATOM 0 HA ASP B 24 -18.760 -12.940 -2.430 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -17.763 -10.927 -4.493 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -17.181 -12.576 -4.372 1.00 0.00 H new ATOM 1783 N LYS B 25 -16.442 -12.664 -1.459 1.00 0.00 N ATOM 1784 CA LYS B 25 -15.249 -12.465 -0.656 1.00 0.00 C ATOM 1785 C LYS B 25 -14.060 -12.217 -1.585 1.00 0.00 C ATOM 1786 O LYS B 25 -14.046 -12.688 -2.722 1.00 0.00 O ATOM 1787 CB LYS B 25 -14.977 -13.704 0.202 1.00 0.00 C ATOM 1788 CG LYS B 25 -16.234 -14.048 1.036 1.00 0.00 C ATOM 1789 CD LYS B 25 -15.882 -15.132 2.057 1.00 0.00 C ATOM 1790 CE LYS B 25 -15.441 -16.406 1.330 1.00 0.00 C ATOM 1791 NZ LYS B 25 -16.286 -16.613 0.120 1.00 0.00 N ATOM 0 H LYS B 25 -16.666 -13.638 -1.662 1.00 0.00 H new ATOM 0 HA LYS B 25 -15.395 -11.607 0.001 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -14.709 -14.547 -0.435 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -14.129 -13.522 0.863 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -16.601 -13.157 1.546 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -17.035 -14.394 0.382 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -15.085 -14.782 2.712 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -16.745 -15.343 2.689 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -14.392 -16.328 1.044 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -15.527 -17.264 1.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -16.271 -17.618 -0.146 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -17.264 -16.323 0.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -15.914 -16.042 -0.665 1.00 0.00 H new ATOM 1805 N TYR B 26 -13.070 -11.477 -1.102 1.00 0.00 N ATOM 1806 CA TYR B 26 -11.883 -11.171 -1.900 1.00 0.00 C ATOM 1807 C TYR B 26 -12.223 -10.382 -3.168 1.00 0.00 C ATOM 1808 O TYR B 26 -11.352 -10.134 -4.002 1.00 0.00 O ATOM 1809 CB TYR B 26 -11.151 -12.462 -2.257 1.00 0.00 C ATOM 1810 CG TYR B 26 -10.748 -13.150 -0.978 1.00 0.00 C ATOM 1811 CD1 TYR B 26 -9.604 -12.724 -0.293 1.00 0.00 C ATOM 1812 CD2 TYR B 26 -11.524 -14.196 -0.466 1.00 0.00 C ATOM 1813 CE1 TYR B 26 -9.234 -13.346 0.903 1.00 0.00 C ATOM 1814 CE2 TYR B 26 -11.156 -14.815 0.734 1.00 0.00 C ATOM 1815 CZ TYR B 26 -10.011 -14.389 1.418 1.00 0.00 C ATOM 1816 OH TYR B 26 -9.650 -14.995 2.601 1.00 0.00 O ATOM 0 H TYR B 26 -13.063 -11.077 -0.164 1.00 0.00 H new ATOM 0 HA TYR B 26 -11.234 -10.538 -1.295 1.00 0.00 H new ATOM 0 HB2 TYR B 26 -11.795 -13.111 -2.850 1.00 0.00 H new ATOM 0 HB3 TYR B 26 -10.272 -12.244 -2.864 1.00 0.00 H new ATOM 0 HD1 TYR B 26 -9.007 -11.915 -0.688 1.00 0.00 H new ATOM 0 HD2 TYR B 26 -12.406 -14.525 -0.996 1.00 0.00 H new ATOM 0 HE1 TYR B 26 -8.349 -13.021 1.429 1.00 0.00 H new ATOM 0 HE2 TYR B 26 -11.755 -15.621 1.132 1.00 0.00 H new ATOM 0 HH TYR B 26 -9.943 -15.930 2.592 1.00 0.00 H new ATOM 1826 N LYS B 27 -13.462 -9.907 -3.259 1.00 0.00 N ATOM 1827 CA LYS B 27 -13.865 -9.050 -4.372 1.00 0.00 C ATOM 1828 C LYS B 27 -14.715 -7.951 -3.750 1.00 0.00 C ATOM 1829 O LYS B 27 -15.570 -8.232 -2.904 1.00 0.00 O ATOM 1830 CB LYS B 27 -14.646 -9.814 -5.460 1.00 0.00 C ATOM 1831 CG LYS B 27 -14.676 -9.011 -6.775 1.00 0.00 C ATOM 1832 CD LYS B 27 -13.295 -9.121 -7.475 1.00 0.00 C ATOM 1833 CE LYS B 27 -13.372 -8.655 -8.928 1.00 0.00 C ATOM 1834 NZ LYS B 27 -12.280 -9.306 -9.706 1.00 0.00 N ATOM 0 H LYS B 27 -14.200 -10.098 -2.582 1.00 0.00 H new ATOM 0 HA LYS B 27 -12.991 -8.651 -4.887 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -14.183 -10.786 -5.632 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -15.664 -10.002 -5.120 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -15.460 -9.392 -7.430 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -14.911 -7.966 -6.571 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -12.563 -8.520 -6.936 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -12.948 -10.154 -7.440 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -14.342 -8.911 -9.354 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -13.277 -7.570 -8.981 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -12.150 -8.805 -10.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -11.396 -9.271 -9.160 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -12.531 -10.297 -9.894 1.00 0.00 H new ATOM 1848 N LEU B 28 -14.448 -6.705 -4.097 1.00 0.00 N ATOM 1849 CA LEU B 28 -15.166 -5.597 -3.481 1.00 0.00 C ATOM 1850 C LEU B 28 -16.088 -4.931 -4.500 1.00 0.00 C ATOM 1851 O LEU B 28 -15.638 -4.487 -5.551 1.00 0.00 O ATOM 1852 CB LEU B 28 -14.073 -4.649 -2.969 1.00 0.00 C ATOM 1853 CG LEU B 28 -14.579 -3.590 -1.961 1.00 0.00 C ATOM 1854 CD1 LEU B 28 -15.184 -4.241 -0.699 1.00 0.00 C ATOM 1855 CD2 LEU B 28 -13.371 -2.735 -1.516 1.00 0.00 C ATOM 0 H LEU B 28 -13.751 -6.434 -4.791 1.00 0.00 H new ATOM 0 HA LEU B 28 -15.815 -5.914 -2.664 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -13.287 -5.239 -2.497 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -13.621 -4.139 -3.820 1.00 0.00 H new ATOM 0 HG LEU B 28 -15.350 -2.995 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -15.527 -3.463 -0.017 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -16.026 -4.872 -0.983 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.426 -4.849 -0.204 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -13.703 -1.980 -0.804 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -12.626 -3.376 -1.045 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -12.932 -2.246 -2.385 1.00 0.00 H new ATOM 1867 N SER B 29 -17.382 -4.871 -4.192 1.00 0.00 N ATOM 1868 CA SER B 29 -18.342 -4.264 -5.107 1.00 0.00 C ATOM 1869 C SER B 29 -18.436 -2.753 -4.886 1.00 0.00 C ATOM 1870 O SER B 29 -17.933 -2.237 -3.888 1.00 0.00 O ATOM 1871 CB SER B 29 -19.711 -4.924 -4.964 1.00 0.00 C ATOM 1872 OG SER B 29 -20.269 -4.576 -3.717 1.00 0.00 O ATOM 0 H SER B 29 -17.785 -5.231 -3.327 1.00 0.00 H new ATOM 0 HA SER B 29 -17.989 -4.428 -6.125 1.00 0.00 H new ATOM 0 HB2 SER B 29 -20.368 -4.602 -5.772 1.00 0.00 H new ATOM 0 HB3 SER B 29 -19.615 -6.007 -5.043 1.00 0.00 H new ATOM 0 HG SER B 29 -19.708 -3.898 -3.285 1.00 0.00 H new ATOM 1878 N LYS B 30 -19.051 -2.040 -5.834 1.00 0.00 N ATOM 1879 CA LYS B 30 -19.154 -0.582 -5.726 1.00 0.00 C ATOM 1880 C LYS B 30 -19.836 -0.148 -4.437 1.00 0.00 C ATOM 1881 O LYS B 30 -19.358 0.747 -3.719 1.00 0.00 O ATOM 1882 CB LYS B 30 -20.026 -0.045 -6.854 1.00 0.00 C ATOM 1883 CG LYS B 30 -20.017 1.488 -6.819 1.00 0.00 C ATOM 1884 CD LYS B 30 -21.003 2.014 -7.858 1.00 0.00 C ATOM 1885 CE LYS B 30 -22.442 1.705 -7.391 1.00 0.00 C ATOM 1886 NZ LYS B 30 -22.986 0.572 -8.190 1.00 0.00 N ATOM 0 H LYS B 30 -19.478 -2.439 -6.670 1.00 0.00 H new ATOM 0 HA LYS B 30 -18.134 -0.199 -5.762 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -19.655 -0.400 -7.816 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -21.045 -0.416 -6.749 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -20.291 1.844 -5.826 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -19.015 1.864 -7.027 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -20.873 3.088 -7.990 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -20.814 1.549 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -22.446 1.452 -6.331 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -23.073 2.586 -7.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -23.629 0.007 -7.599 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -23.507 0.944 -9.010 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -22.203 -0.027 -8.520 1.00 0.00 H new ATOM 1900 N LYS B 31 -20.964 -0.769 -4.150 1.00 0.00 N ATOM 1901 CA LYS B 31 -21.704 -0.406 -2.968 1.00 0.00 C ATOM 1902 C LYS B 31 -20.848 -0.651 -1.737 1.00 0.00 C ATOM 1903 O LYS B 31 -20.768 0.185 -0.839 1.00 0.00 O ATOM 1904 CB LYS B 31 -22.970 -1.251 -2.902 1.00 0.00 C ATOM 1905 CG LYS B 31 -22.572 -2.700 -2.642 1.00 0.00 C ATOM 1906 CD LYS B 31 -23.790 -3.581 -2.741 1.00 0.00 C ATOM 1907 CE LYS B 31 -23.457 -4.992 -2.250 1.00 0.00 C ATOM 1908 NZ LYS B 31 -22.694 -5.718 -3.306 1.00 0.00 N ATOM 0 H LYS B 31 -21.378 -1.514 -4.711 1.00 0.00 H new ATOM 0 HA LYS B 31 -21.972 0.650 -3.004 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -23.625 -0.890 -2.109 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -23.527 -1.173 -3.836 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -21.821 -3.017 -3.365 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -22.122 -2.793 -1.654 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -24.601 -3.162 -2.146 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -24.139 -3.619 -3.773 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -22.870 -4.941 -1.333 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -24.374 -5.532 -2.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -22.409 -6.652 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -23.294 -5.838 -4.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -21.847 -5.171 -3.560 1.00 0.00 H new ATOM 1922 N GLU B 32 -20.231 -1.824 -1.694 1.00 0.00 N ATOM 1923 CA GLU B 32 -19.401 -2.180 -0.547 1.00 0.00 C ATOM 1924 C GLU B 32 -18.210 -1.235 -0.379 1.00 0.00 C ATOM 1925 O GLU B 32 -17.983 -0.728 0.724 1.00 0.00 O ATOM 1926 CB GLU B 32 -18.847 -3.596 -0.736 1.00 0.00 C ATOM 1927 CG GLU B 32 -19.991 -4.605 -0.750 1.00 0.00 C ATOM 1928 CD GLU B 32 -19.453 -6.021 -0.901 1.00 0.00 C ATOM 1929 OE1 GLU B 32 -18.250 -6.175 -1.045 1.00 0.00 O ATOM 1930 OE2 GLU B 32 -20.263 -6.929 -0.908 1.00 0.00 O ATOM 0 H GLU B 32 -20.286 -2.534 -2.424 1.00 0.00 H new ATOM 0 HA GLU B 32 -20.034 -2.111 0.338 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -18.287 -3.655 -1.669 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -18.151 -3.834 0.068 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -20.566 -4.525 0.173 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -20.672 -4.379 -1.570 1.00 0.00 H new ATOM 1937 N LEU B 33 -17.460 -0.945 -1.455 1.00 0.00 N ATOM 1938 CA LEU B 33 -16.335 -0.034 -1.282 1.00 0.00 C ATOM 1939 C LEU B 33 -16.842 1.305 -0.828 1.00 0.00 C ATOM 1940 O LEU B 33 -16.210 1.971 -0.012 1.00 0.00 O ATOM 1941 CB LEU B 33 -15.424 0.117 -2.513 1.00 0.00 C ATOM 1942 CG LEU B 33 -16.217 0.308 -3.823 1.00 0.00 C ATOM 1943 CD1 LEU B 33 -16.212 1.793 -4.246 1.00 0.00 C ATOM 1944 CD2 LEU B 33 -15.554 -0.540 -4.934 1.00 0.00 C ATOM 0 H LEU B 33 -17.604 -1.307 -2.398 1.00 0.00 H new ATOM 0 HA LEU B 33 -15.697 -0.484 -0.522 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -14.762 0.970 -2.367 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -14.791 -0.766 -2.602 1.00 0.00 H new ATOM 0 HG LEU B 33 -17.248 -0.008 -3.667 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -16.776 1.910 -5.172 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -16.672 2.396 -3.463 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -15.185 2.123 -4.403 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -16.105 -0.414 -5.866 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -14.524 -0.214 -5.075 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -15.565 -1.591 -4.645 1.00 0.00 H new ATOM 1956 N LYS B 34 -18.008 1.697 -1.307 1.00 0.00 N ATOM 1957 CA LYS B 34 -18.539 2.957 -0.855 1.00 0.00 C ATOM 1958 C LYS B 34 -18.604 2.926 0.667 1.00 0.00 C ATOM 1959 O LYS B 34 -18.350 3.932 1.326 1.00 0.00 O ATOM 1960 CB LYS B 34 -19.948 3.183 -1.421 1.00 0.00 C ATOM 1961 CG LYS B 34 -20.484 4.564 -1.010 1.00 0.00 C ATOM 1962 CD LYS B 34 -19.843 5.661 -1.863 1.00 0.00 C ATOM 1963 CE LYS B 34 -20.469 7.025 -1.525 1.00 0.00 C ATOM 1964 NZ LYS B 34 -21.697 6.835 -0.700 1.00 0.00 N ATOM 0 H LYS B 34 -18.580 1.184 -1.979 1.00 0.00 H new ATOM 0 HA LYS B 34 -17.897 3.768 -1.198 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -19.925 3.105 -2.508 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -20.620 2.404 -1.059 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -21.567 4.590 -1.127 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -20.273 4.744 0.044 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -18.768 5.691 -1.684 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -19.984 5.439 -2.921 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -19.750 7.640 -0.984 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -20.717 7.558 -2.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -22.222 7.731 -0.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -22.298 6.106 -1.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -21.428 6.535 0.259 1.00 0.00 H new ATOM 1978 N GLU B 35 -18.941 1.761 1.230 1.00 0.00 N ATOM 1979 CA GLU B 35 -19.020 1.634 2.677 1.00 0.00 C ATOM 1980 C GLU B 35 -17.642 1.595 3.350 1.00 0.00 C ATOM 1981 O GLU B 35 -17.454 2.176 4.421 1.00 0.00 O ATOM 1982 CB GLU B 35 -19.797 0.368 3.037 1.00 0.00 C ATOM 1983 CG GLU B 35 -21.241 0.499 2.547 1.00 0.00 C ATOM 1984 CD GLU B 35 -22.044 -0.730 2.958 1.00 0.00 C ATOM 1985 OE1 GLU B 35 -21.440 -1.675 3.437 1.00 0.00 O ATOM 1986 OE2 GLU B 35 -23.253 -0.707 2.789 1.00 0.00 O ATOM 0 H GLU B 35 -19.159 0.910 0.711 1.00 0.00 H new ATOM 0 HA GLU B 35 -19.534 2.521 3.048 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -19.325 -0.503 2.582 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -19.780 0.213 4.116 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -21.696 1.397 2.965 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -21.257 0.608 1.463 1.00 0.00 H new ATOM 1993 N LEU B 36 -16.690 0.868 2.750 1.00 0.00 N ATOM 1994 CA LEU B 36 -15.366 0.738 3.367 1.00 0.00 C ATOM 1995 C LEU B 36 -14.646 2.091 3.422 1.00 0.00 C ATOM 1996 O LEU B 36 -14.083 2.458 4.455 1.00 0.00 O ATOM 1997 CB LEU B 36 -14.519 -0.264 2.553 1.00 0.00 C ATOM 1998 CG LEU B 36 -13.306 -0.803 3.359 1.00 0.00 C ATOM 1999 CD1 LEU B 36 -12.513 -1.784 2.483 1.00 0.00 C ATOM 2000 CD2 LEU B 36 -12.384 0.336 3.800 1.00 0.00 C ATOM 0 H LEU B 36 -16.806 0.375 1.865 1.00 0.00 H new ATOM 0 HA LEU B 36 -15.495 0.378 4.388 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -15.147 -1.100 2.244 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -14.162 0.220 1.644 1.00 0.00 H new ATOM 0 HG LEU B 36 -13.682 -1.306 4.250 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -11.660 -2.165 3.044 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -13.157 -2.614 2.192 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -12.159 -1.270 1.590 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -11.544 -0.073 4.362 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -12.011 0.863 2.922 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -12.939 1.030 4.431 1.00 0.00 H new ATOM 2012 N LEU B 37 -14.671 2.855 2.320 1.00 0.00 N ATOM 2013 CA LEU B 37 -13.996 4.154 2.333 1.00 0.00 C ATOM 2014 C LEU B 37 -14.655 5.108 3.320 1.00 0.00 C ATOM 2015 O LEU B 37 -13.967 5.783 4.077 1.00 0.00 O ATOM 2016 CB LEU B 37 -13.991 4.808 0.937 1.00 0.00 C ATOM 2017 CG LEU B 37 -12.998 4.116 -0.018 1.00 0.00 C ATOM 2018 CD1 LEU B 37 -11.581 4.649 0.223 1.00 0.00 C ATOM 2019 CD2 LEU B 37 -13.007 2.608 0.193 1.00 0.00 C ATOM 0 H LEU B 37 -15.132 2.608 1.444 1.00 0.00 H new ATOM 0 HA LEU B 37 -12.967 3.965 2.640 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -14.994 4.764 0.512 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.730 5.862 1.031 1.00 0.00 H new ATOM 0 HG LEU B 37 -13.305 4.333 -1.041 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.886 4.155 -0.456 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.561 5.724 0.043 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.287 4.448 1.253 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -12.299 2.141 -0.491 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -12.721 2.383 1.220 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -14.007 2.220 0.001 1.00 0.00 H new ATOM 2031 N GLN B 38 -15.986 5.155 3.321 1.00 0.00 N ATOM 2032 CA GLN B 38 -16.692 6.042 4.242 1.00 0.00 C ATOM 2033 C GLN B 38 -16.440 5.655 5.690 1.00 0.00 C ATOM 2034 O GLN B 38 -16.281 6.518 6.553 1.00 0.00 O ATOM 2035 CB GLN B 38 -18.193 6.023 3.951 1.00 0.00 C ATOM 2036 CG GLN B 38 -18.450 6.631 2.571 1.00 0.00 C ATOM 2037 CD GLN B 38 -19.935 6.559 2.238 1.00 0.00 C ATOM 2038 OE1 GLN B 38 -20.417 7.310 1.286 1.00 0.00 O flip ATOM 2039 NE2 GLN B 38 -20.676 5.800 2.862 1.00 0.00 N flip ATOM 0 H GLN B 38 -16.586 4.602 2.709 1.00 0.00 H new ATOM 0 HA GLN B 38 -16.308 7.051 4.090 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -18.569 5.000 3.986 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -18.730 6.586 4.714 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -18.115 7.668 2.553 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -17.873 6.097 1.816 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -20.297 5.214 3.606 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -21.670 5.757 2.635 1.00 0.00 H new ATOM 2048 N THR B 39 -16.400 4.354 5.954 1.00 0.00 N ATOM 2049 CA THR B 39 -16.160 3.884 7.310 1.00 0.00 C ATOM 2050 C THR B 39 -14.716 4.127 7.726 1.00 0.00 C ATOM 2051 O THR B 39 -14.433 4.363 8.900 1.00 0.00 O ATOM 2052 CB THR B 39 -16.487 2.393 7.420 1.00 0.00 C ATOM 2053 OG1 THR B 39 -15.622 1.655 6.567 1.00 0.00 O ATOM 2054 CG2 THR B 39 -17.948 2.143 7.022 1.00 0.00 C ATOM 0 H THR B 39 -16.528 3.618 5.259 1.00 0.00 H new ATOM 0 HA THR B 39 -16.811 4.445 7.980 1.00 0.00 H new ATOM 0 HB THR B 39 -16.343 2.070 8.451 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.272 2.245 5.867 1.00 0.00 H new ATOM 0 HG21 THR B 39 -18.170 1.079 7.104 1.00 0.00 H new ATOM 0 HG22 THR B 39 -18.607 2.703 7.685 1.00 0.00 H new ATOM 0 HG23 THR B 39 -18.106 2.469 5.994 1.00 0.00 H new ATOM 2062 N GLU B 40 -13.798 4.050 6.763 1.00 0.00 N ATOM 2063 CA GLU B 40 -12.381 4.246 7.065 1.00 0.00 C ATOM 2064 C GLU B 40 -11.863 5.637 6.675 1.00 0.00 C ATOM 2065 O GLU B 40 -11.378 6.376 7.530 1.00 0.00 O ATOM 2066 CB GLU B 40 -11.560 3.176 6.348 1.00 0.00 C ATOM 2067 CG GLU B 40 -11.810 1.793 6.969 1.00 0.00 C ATOM 2068 CD GLU B 40 -11.456 1.798 8.455 1.00 0.00 C ATOM 2069 OE1 GLU B 40 -10.357 2.222 8.781 1.00 0.00 O ATOM 2070 OE2 GLU B 40 -12.288 1.378 9.243 1.00 0.00 O ATOM 0 H GLU B 40 -14.005 3.857 5.783 1.00 0.00 H new ATOM 0 HA GLU B 40 -12.272 4.163 8.146 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -11.822 3.158 5.290 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -10.500 3.422 6.410 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -12.856 1.514 6.840 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -11.214 1.042 6.450 1.00 0.00 H new ATOM 2077 N LEU B 41 -11.945 5.990 5.391 1.00 0.00 N ATOM 2078 CA LEU B 41 -11.449 7.299 4.946 1.00 0.00 C ATOM 2079 C LEU B 41 -12.580 8.305 4.801 1.00 0.00 C ATOM 2080 O LEU B 41 -13.671 7.976 4.345 1.00 0.00 O ATOM 2081 CB LEU B 41 -10.719 7.187 3.602 1.00 0.00 C ATOM 2082 CG LEU B 41 -9.579 6.156 3.654 1.00 0.00 C ATOM 2083 CD1 LEU B 41 -8.831 6.187 2.317 1.00 0.00 C ATOM 2084 CD2 LEU B 41 -8.584 6.489 4.776 1.00 0.00 C ATOM 0 H LEU B 41 -12.340 5.406 4.654 1.00 0.00 H new ATOM 0 HA LEU B 41 -10.755 7.646 5.712 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -11.429 6.904 2.825 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -10.315 8.161 3.326 1.00 0.00 H new ATOM 0 HG LEU B 41 -10.007 5.172 3.845 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -8.019 5.461 2.338 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.519 5.939 1.509 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -8.422 7.184 2.152 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -7.789 5.744 4.790 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.154 7.475 4.600 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.102 6.484 5.735 1.00 0.00 H new ATOM 2096 N SER B 42 -12.308 9.547 5.183 1.00 0.00 N ATOM 2097 CA SER B 42 -13.319 10.595 5.076 1.00 0.00 C ATOM 2098 C SER B 42 -12.922 11.651 4.046 1.00 0.00 C ATOM 2099 O SER B 42 -13.652 11.904 3.092 1.00 0.00 O ATOM 2100 CB SER B 42 -13.509 11.266 6.437 1.00 0.00 C ATOM 2101 OG SER B 42 -14.764 11.934 6.459 1.00 0.00 O ATOM 0 H SER B 42 -11.412 9.851 5.564 1.00 0.00 H new ATOM 0 HA SER B 42 -14.250 10.131 4.751 1.00 0.00 H new ATOM 0 HB2 SER B 42 -13.466 10.521 7.232 1.00 0.00 H new ATOM 0 HB3 SER B 42 -12.703 11.976 6.621 1.00 0.00 H new ATOM 0 HG SER B 42 -14.890 12.364 7.330 1.00 0.00 H new ATOM 2107 N GLY B 43 -11.778 12.285 4.269 1.00 0.00 N ATOM 2108 CA GLY B 43 -11.308 13.344 3.383 1.00 0.00 C ATOM 2109 C GLY B 43 -11.135 12.910 1.924 1.00 0.00 C ATOM 2110 O GLY B 43 -11.427 13.685 1.016 1.00 0.00 O ATOM 0 H GLY B 43 -11.159 12.085 5.054 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -12.012 14.175 3.422 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -10.354 13.717 3.755 1.00 0.00 H new ATOM 2114 N PHE B 44 -10.631 11.700 1.686 1.00 0.00 N ATOM 2115 CA PHE B 44 -10.411 11.266 0.305 1.00 0.00 C ATOM 2116 C PHE B 44 -11.710 11.172 -0.500 1.00 0.00 C ATOM 2117 O PHE B 44 -11.831 11.790 -1.557 1.00 0.00 O ATOM 2118 CB PHE B 44 -9.694 9.916 0.299 1.00 0.00 C ATOM 2119 CG PHE B 44 -8.275 10.103 0.786 1.00 0.00 C ATOM 2120 CD1 PHE B 44 -7.265 10.435 -0.124 1.00 0.00 C ATOM 2121 CD2 PHE B 44 -7.969 9.950 2.145 1.00 0.00 C ATOM 2122 CE1 PHE B 44 -5.950 10.614 0.321 1.00 0.00 C ATOM 2123 CE2 PHE B 44 -6.653 10.128 2.589 1.00 0.00 C ATOM 2124 CZ PHE B 44 -5.644 10.460 1.679 1.00 0.00 C ATOM 0 H PHE B 44 -10.374 11.022 2.403 1.00 0.00 H new ATOM 0 HA PHE B 44 -9.793 12.023 -0.178 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -10.221 9.209 0.940 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -9.693 9.496 -0.707 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -7.501 10.553 -1.171 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -8.747 9.695 2.849 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -5.172 10.871 -0.382 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -6.417 10.009 3.636 1.00 0.00 H new ATOM 0 HZ PHE B 44 -4.630 10.598 2.023 1.00 0.00 H new ATOM 2134 N LEU B 45 -12.687 10.422 0.003 1.00 0.00 N ATOM 2135 CA LEU B 45 -13.970 10.302 -0.697 1.00 0.00 C ATOM 2136 C LEU B 45 -14.811 11.562 -0.571 1.00 0.00 C ATOM 2137 O LEU B 45 -15.490 11.965 -1.515 1.00 0.00 O ATOM 2138 CB LEU B 45 -14.753 9.069 -0.202 1.00 0.00 C ATOM 2139 CG LEU B 45 -14.554 7.898 -1.180 1.00 0.00 C ATOM 2140 CD1 LEU B 45 -15.363 8.192 -2.460 1.00 0.00 C ATOM 2141 CD2 LEU B 45 -13.057 7.721 -1.515 1.00 0.00 C ATOM 0 H LEU B 45 -12.622 9.896 0.875 1.00 0.00 H new ATOM 0 HA LEU B 45 -13.747 10.168 -1.755 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.411 8.785 0.793 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.813 9.309 -0.119 1.00 0.00 H new ATOM 0 HG LEU B 45 -14.903 6.971 -0.725 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -15.235 7.373 -3.167 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -16.419 8.293 -2.208 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -15.008 9.119 -2.910 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -12.935 6.888 -2.208 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -12.676 8.634 -1.974 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -12.501 7.516 -0.600 1.00 0.00 H new ATOM 2153 N ASP B 46 -14.767 12.177 0.593 1.00 0.00 N ATOM 2154 CA ASP B 46 -15.533 13.384 0.828 1.00 0.00 C ATOM 2155 C ASP B 46 -15.140 14.483 -0.152 1.00 0.00 C ATOM 2156 O ASP B 46 -15.942 15.361 -0.471 1.00 0.00 O ATOM 2157 CB ASP B 46 -15.358 13.875 2.267 1.00 0.00 C ATOM 2158 CG ASP B 46 -16.304 15.039 2.538 1.00 0.00 C ATOM 2159 OD1 ASP B 46 -17.105 15.342 1.669 1.00 0.00 O ATOM 2160 OD2 ASP B 46 -16.214 15.611 3.612 1.00 0.00 O ATOM 0 H ASP B 46 -14.211 11.863 1.388 1.00 0.00 H new ATOM 0 HA ASP B 46 -16.584 13.141 0.671 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -15.559 13.062 2.965 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -14.327 14.188 2.431 1.00 0.00 H new ATOM 2165 N ALA B 47 -13.888 14.454 -0.593 1.00 0.00 N ATOM 2166 CA ALA B 47 -13.384 15.480 -1.496 1.00 0.00 C ATOM 2167 C ALA B 47 -14.254 15.604 -2.743 1.00 0.00 C ATOM 2168 O ALA B 47 -14.392 16.700 -3.286 1.00 0.00 O ATOM 2169 CB ALA B 47 -11.949 15.147 -1.909 1.00 0.00 C ATOM 0 H ALA B 47 -13.208 13.737 -0.342 1.00 0.00 H new ATOM 0 HA ALA B 47 -13.409 16.432 -0.966 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -11.577 15.917 -2.584 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -11.316 15.104 -1.023 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -11.931 14.182 -2.415 1.00 0.00 H new ATOM 2175 N GLN B 48 -14.860 14.507 -3.197 1.00 0.00 N ATOM 2176 CA GLN B 48 -15.717 14.598 -4.378 1.00 0.00 C ATOM 2177 C GLN B 48 -17.172 14.734 -3.931 1.00 0.00 C ATOM 2178 O GLN B 48 -17.706 13.865 -3.243 1.00 0.00 O ATOM 2179 CB GLN B 48 -15.568 13.349 -5.240 1.00 0.00 C ATOM 2180 CG GLN B 48 -14.087 13.050 -5.478 1.00 0.00 C ATOM 2181 CD GLN B 48 -13.394 14.274 -6.067 1.00 0.00 C ATOM 2182 OE1 GLN B 48 -13.858 14.835 -7.059 1.00 0.00 O ATOM 2183 NE2 GLN B 48 -12.309 14.729 -5.504 1.00 0.00 N ATOM 0 H GLN B 48 -14.779 13.578 -2.784 1.00 0.00 H new ATOM 0 HA GLN B 48 -15.423 15.468 -4.965 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -16.044 12.500 -4.750 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -16.076 13.493 -6.194 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -13.609 12.768 -4.540 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -13.983 12.202 -6.155 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -11.927 14.262 -4.682 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -11.843 15.552 -5.886 1.00 0.00 H new ATOM 2192 N LYS B 49 -17.795 15.846 -4.305 1.00 0.00 N ATOM 2193 CA LYS B 49 -19.178 16.118 -3.918 1.00 0.00 C ATOM 2194 C LYS B 49 -20.194 15.114 -4.473 1.00 0.00 C ATOM 2195 O LYS B 49 -21.152 14.760 -3.787 1.00 0.00 O ATOM 2196 CB LYS B 49 -19.566 17.531 -4.362 1.00 0.00 C ATOM 2197 CG LYS B 49 -20.959 17.878 -3.830 1.00 0.00 C ATOM 2198 CD LYS B 49 -21.360 19.270 -4.325 1.00 0.00 C ATOM 2199 CE LYS B 49 -22.679 19.688 -3.673 1.00 0.00 C ATOM 2200 NZ LYS B 49 -22.778 21.175 -3.663 1.00 0.00 N ATOM 0 H LYS B 49 -17.366 16.575 -4.876 1.00 0.00 H new ATOM 0 HA LYS B 49 -19.213 16.021 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -18.836 18.251 -3.993 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -19.556 17.596 -5.450 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -21.684 17.137 -4.167 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -20.961 17.853 -2.740 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -20.579 19.991 -4.084 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -21.465 19.265 -5.410 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -23.519 19.260 -4.220 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -22.732 19.302 -2.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -23.675 21.460 -3.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -21.983 21.572 -3.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -22.746 21.532 -4.639 1.00 0.00 H new ATOM 2214 N ASP B 50 -20.020 14.698 -5.721 1.00 0.00 N ATOM 2215 CA ASP B 50 -20.981 13.787 -6.341 1.00 0.00 C ATOM 2216 C ASP B 50 -20.914 12.374 -5.776 1.00 0.00 C ATOM 2217 O ASP B 50 -19.834 11.847 -5.508 1.00 0.00 O ATOM 2218 CB ASP B 50 -20.757 13.715 -7.847 1.00 0.00 C ATOM 2219 CG ASP B 50 -21.062 15.064 -8.488 1.00 0.00 C ATOM 2220 OD1 ASP B 50 -21.660 15.893 -7.821 1.00 0.00 O ATOM 2221 OD2 ASP B 50 -20.694 15.250 -9.636 1.00 0.00 O ATOM 0 H ASP B 50 -19.238 14.969 -6.317 1.00 0.00 H new ATOM 0 HA ASP B 50 -21.966 14.196 -6.117 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -19.726 13.429 -8.056 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -21.395 12.945 -8.281 1.00 0.00 H new ATOM 2226 N VAL B 51 -22.085 11.749 -5.648 1.00 0.00 N ATOM 2227 CA VAL B 51 -22.158 10.373 -5.170 1.00 0.00 C ATOM 2228 C VAL B 51 -21.638 9.467 -6.275 1.00 0.00 C ATOM 2229 O VAL B 51 -21.071 8.404 -6.024 1.00 0.00 O ATOM 2230 CB VAL B 51 -23.603 9.995 -4.809 1.00 0.00 C ATOM 2231 CG1 VAL B 51 -24.213 11.083 -3.918 1.00 0.00 C ATOM 2232 CG2 VAL B 51 -24.447 9.833 -6.082 1.00 0.00 C ATOM 0 H VAL B 51 -22.987 12.171 -5.867 1.00 0.00 H new ATOM 0 HA VAL B 51 -21.555 10.261 -4.269 1.00 0.00 H new ATOM 0 HB VAL B 51 -23.595 9.047 -4.271 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -25.238 10.813 -3.663 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -23.625 11.178 -3.005 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -24.210 12.034 -4.451 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -25.468 9.565 -5.810 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -24.453 10.772 -6.636 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -24.019 9.047 -6.704 1.00 0.00 H new ATOM 2242 N ASP B 52 -21.813 9.943 -7.503 1.00 0.00 N ATOM 2243 CA ASP B 52 -21.346 9.247 -8.693 1.00 0.00 C ATOM 2244 C ASP B 52 -19.839 9.094 -8.618 1.00 0.00 C ATOM 2245 O ASP B 52 -19.243 8.209 -9.241 1.00 0.00 O ATOM 2246 CB ASP B 52 -21.726 10.034 -9.950 1.00 0.00 C ATOM 2247 CG ASP B 52 -23.240 10.032 -10.129 1.00 0.00 C ATOM 2248 OD1 ASP B 52 -23.897 9.265 -9.445 1.00 0.00 O ATOM 2249 OD2 ASP B 52 -23.721 10.799 -10.947 1.00 0.00 O ATOM 0 H ASP B 52 -22.285 10.826 -7.700 1.00 0.00 H new ATOM 0 HA ASP B 52 -21.814 8.264 -8.744 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -21.362 11.059 -9.871 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -21.248 9.592 -10.824 1.00 0.00 H new ATOM 2254 N ALA B 53 -19.226 10.003 -7.870 1.00 0.00 N ATOM 2255 CA ALA B 53 -17.784 10.016 -7.734 1.00 0.00 C ATOM 2256 C ALA B 53 -17.265 8.644 -7.329 1.00 0.00 C ATOM 2257 O ALA B 53 -16.219 8.213 -7.813 1.00 0.00 O ATOM 2258 CB ALA B 53 -17.393 11.021 -6.662 1.00 0.00 C ATOM 0 H ALA B 53 -19.708 10.737 -7.351 1.00 0.00 H new ATOM 0 HA ALA B 53 -17.349 10.289 -8.695 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -16.308 11.035 -6.555 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -17.743 12.013 -6.948 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -17.847 10.736 -5.713 1.00 0.00 H new ATOM 2264 N VAL B 54 -17.995 7.936 -6.473 1.00 0.00 N ATOM 2265 CA VAL B 54 -17.549 6.606 -6.089 1.00 0.00 C ATOM 2266 C VAL B 54 -17.467 5.720 -7.319 1.00 0.00 C ATOM 2267 O VAL B 54 -16.505 4.968 -7.495 1.00 0.00 O ATOM 2268 CB VAL B 54 -18.520 5.978 -5.093 1.00 0.00 C ATOM 2269 CG1 VAL B 54 -19.831 5.636 -5.807 1.00 0.00 C ATOM 2270 CG2 VAL B 54 -17.906 4.688 -4.539 1.00 0.00 C ATOM 0 H VAL B 54 -18.867 8.248 -6.046 1.00 0.00 H new ATOM 0 HA VAL B 54 -16.567 6.695 -5.623 1.00 0.00 H new ATOM 0 HB VAL B 54 -18.714 6.679 -4.281 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -20.526 5.187 -5.097 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -20.269 6.545 -6.218 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -19.632 4.932 -6.615 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -18.595 4.234 -3.827 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -17.720 3.993 -5.358 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -16.966 4.918 -4.038 1.00 0.00 H new ATOM 2280 N ASP B 55 -18.472 5.829 -8.183 1.00 0.00 N ATOM 2281 CA ASP B 55 -18.476 5.043 -9.398 1.00 0.00 C ATOM 2282 C ASP B 55 -17.270 5.417 -10.235 1.00 0.00 C ATOM 2283 O ASP B 55 -16.597 4.557 -10.797 1.00 0.00 O ATOM 2284 CB ASP B 55 -19.758 5.300 -10.191 1.00 0.00 C ATOM 2285 CG ASP B 55 -19.861 4.314 -11.350 1.00 0.00 C ATOM 2286 OD1 ASP B 55 -19.019 3.434 -11.430 1.00 0.00 O ATOM 2287 OD2 ASP B 55 -20.779 4.453 -12.141 1.00 0.00 O ATOM 0 H ASP B 55 -19.277 6.444 -8.063 1.00 0.00 H new ATOM 0 HA ASP B 55 -18.432 3.984 -9.142 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -20.625 5.199 -9.539 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -19.762 6.322 -10.571 1.00 0.00 H new ATOM 2292 N LYS B 56 -16.994 6.716 -10.295 1.00 0.00 N ATOM 2293 CA LYS B 56 -15.852 7.194 -11.059 1.00 0.00 C ATOM 2294 C LYS B 56 -14.559 6.604 -10.514 1.00 0.00 C ATOM 2295 O LYS B 56 -13.664 6.238 -11.276 1.00 0.00 O ATOM 2296 CB LYS B 56 -15.784 8.722 -10.992 1.00 0.00 C ATOM 2297 CG LYS B 56 -17.018 9.320 -11.671 1.00 0.00 C ATOM 2298 CD LYS B 56 -16.890 10.844 -11.706 1.00 0.00 C ATOM 2299 CE LYS B 56 -18.175 11.453 -12.272 1.00 0.00 C ATOM 2300 NZ LYS B 56 -18.685 10.597 -13.380 1.00 0.00 N ATOM 0 H LYS B 56 -17.537 7.444 -9.831 1.00 0.00 H new ATOM 0 HA LYS B 56 -15.974 6.879 -12.095 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -15.734 9.049 -9.953 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -14.878 9.078 -11.483 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -17.115 8.929 -12.684 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -17.920 9.032 -11.130 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -16.705 11.227 -10.702 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -16.037 11.134 -12.320 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -18.927 11.536 -11.487 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -17.982 12.462 -12.637 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -19.319 11.156 -13.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -17.885 10.247 -13.944 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -19.208 9.790 -12.983 1.00 0.00 H new ATOM 2314 N VAL B 57 -14.465 6.513 -9.189 1.00 0.00 N ATOM 2315 CA VAL B 57 -13.270 5.965 -8.567 1.00 0.00 C ATOM 2316 C VAL B 57 -13.102 4.486 -8.901 1.00 0.00 C ATOM 2317 O VAL B 57 -12.009 4.035 -9.232 1.00 0.00 O ATOM 2318 CB VAL B 57 -13.359 6.113 -7.043 1.00 0.00 C ATOM 2319 CG1 VAL B 57 -12.180 5.390 -6.391 1.00 0.00 C ATOM 2320 CG2 VAL B 57 -13.320 7.594 -6.654 1.00 0.00 C ATOM 0 H VAL B 57 -15.192 6.808 -8.537 1.00 0.00 H new ATOM 0 HA VAL B 57 -12.413 6.517 -8.953 1.00 0.00 H new ATOM 0 HB VAL B 57 -14.297 5.677 -6.699 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -12.243 5.495 -5.308 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -12.210 4.333 -6.656 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -11.245 5.826 -6.744 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -13.384 7.687 -5.570 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -12.387 8.037 -7.002 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -14.161 8.113 -7.113 1.00 0.00 H new ATOM 2330 N MET B 58 -14.197 3.736 -8.788 1.00 0.00 N ATOM 2331 CA MET B 58 -14.166 2.299 -9.051 1.00 0.00 C ATOM 2332 C MET B 58 -13.964 1.931 -10.528 1.00 0.00 C ATOM 2333 O MET B 58 -13.334 0.911 -10.822 1.00 0.00 O ATOM 2334 CB MET B 58 -15.415 1.623 -8.458 1.00 0.00 C ATOM 2335 CG MET B 58 -16.540 1.530 -9.487 1.00 0.00 C ATOM 2336 SD MET B 58 -16.381 -0.016 -10.420 1.00 0.00 S ATOM 2337 CE MET B 58 -17.377 -1.065 -9.331 1.00 0.00 C ATOM 0 H MET B 58 -15.112 4.097 -8.518 1.00 0.00 H new ATOM 0 HA MET B 58 -13.279 1.914 -8.549 1.00 0.00 H new ATOM 0 HB2 MET B 58 -15.158 0.624 -8.107 1.00 0.00 H new ATOM 0 HB3 MET B 58 -15.759 2.187 -7.591 1.00 0.00 H new ATOM 0 HG2 MET B 58 -17.508 1.568 -8.987 1.00 0.00 H new ATOM 0 HG3 MET B 58 -16.498 2.382 -10.165 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.847 -1.998 -9.140 1.00 0.00 H new ATOM 0 HE2 MET B 58 -17.552 -0.547 -8.388 1.00 0.00 H new ATOM 0 HE3 MET B 58 -18.332 -1.282 -9.809 1.00 0.00 H new ATOM 2347 N LYS B 59 -14.491 2.725 -11.467 1.00 0.00 N ATOM 2348 CA LYS B 59 -14.317 2.372 -12.874 1.00 0.00 C ATOM 2349 C LYS B 59 -12.844 2.293 -13.246 1.00 0.00 C ATOM 2350 O LYS B 59 -12.430 1.389 -13.971 1.00 0.00 O ATOM 2351 CB LYS B 59 -15.018 3.361 -13.789 1.00 0.00 C ATOM 2352 CG LYS B 59 -16.534 3.302 -13.529 1.00 0.00 C ATOM 2353 CD LYS B 59 -17.257 3.272 -14.862 1.00 0.00 C ATOM 2354 CE LYS B 59 -16.997 4.572 -15.627 1.00 0.00 C ATOM 2355 NZ LYS B 59 -18.076 4.779 -16.633 1.00 0.00 N ATOM 0 H LYS B 59 -15.019 3.579 -11.288 1.00 0.00 H new ATOM 0 HA LYS B 59 -14.770 1.390 -13.010 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -14.645 4.369 -13.609 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -14.806 3.124 -14.832 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -16.783 2.416 -12.945 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -16.851 4.167 -12.947 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -16.917 2.420 -15.450 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -18.327 3.142 -14.702 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -16.964 5.414 -14.935 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -16.027 4.528 -16.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -17.901 5.662 -17.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -18.087 3.981 -17.299 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -18.995 4.839 -16.149 1.00 0.00 H new ATOM 2369 N GLU B 60 -12.051 3.227 -12.735 1.00 0.00 N ATOM 2370 CA GLU B 60 -10.623 3.217 -13.019 1.00 0.00 C ATOM 2371 C GLU B 60 -9.971 1.974 -12.438 1.00 0.00 C ATOM 2372 O GLU B 60 -9.088 1.372 -13.048 1.00 0.00 O ATOM 2373 CB GLU B 60 -9.969 4.456 -12.405 1.00 0.00 C ATOM 2374 CG GLU B 60 -8.488 4.501 -12.788 1.00 0.00 C ATOM 2375 CD GLU B 60 -7.809 5.683 -12.106 1.00 0.00 C ATOM 2376 OE1 GLU B 60 -8.482 6.381 -11.364 1.00 0.00 O ATOM 2377 OE2 GLU B 60 -6.625 5.873 -12.332 1.00 0.00 O ATOM 0 H GLU B 60 -12.366 3.988 -12.133 1.00 0.00 H new ATOM 0 HA GLU B 60 -10.486 3.219 -14.100 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -10.473 5.357 -12.756 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -10.074 4.434 -11.320 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -8.000 3.572 -12.495 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -8.386 4.587 -13.870 1.00 0.00 H new ATOM 2384 N LEU B 61 -10.410 1.612 -11.242 1.00 0.00 N ATOM 2385 CA LEU B 61 -9.867 0.453 -10.554 1.00 0.00 C ATOM 2386 C LEU B 61 -10.225 -0.856 -11.228 1.00 0.00 C ATOM 2387 O LEU B 61 -9.440 -1.803 -11.186 1.00 0.00 O ATOM 2388 CB LEU B 61 -10.339 0.421 -9.096 1.00 0.00 C ATOM 2389 CG LEU B 61 -9.909 1.689 -8.339 1.00 0.00 C ATOM 2390 CD1 LEU B 61 -10.376 1.574 -6.883 1.00 0.00 C ATOM 2391 CD2 LEU B 61 -8.377 1.847 -8.363 1.00 0.00 C ATOM 0 H LEU B 61 -11.141 2.105 -10.729 1.00 0.00 H new ATOM 0 HA LEU B 61 -8.783 0.556 -10.593 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -11.425 0.328 -9.065 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -9.929 -0.458 -8.599 1.00 0.00 H new ATOM 0 HG LEU B 61 -10.357 2.558 -8.821 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -10.078 2.467 -6.334 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -11.461 1.477 -6.856 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -9.921 0.696 -6.423 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -8.096 2.750 -7.822 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -7.914 0.981 -7.889 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -8.035 1.921 -9.395 1.00 0.00 H new ATOM 2403 N ASP B 62 -11.410 -0.948 -11.812 1.00 0.00 N ATOM 2404 CA ASP B 62 -11.784 -2.212 -12.417 1.00 0.00 C ATOM 2405 C ASP B 62 -11.022 -2.454 -13.713 1.00 0.00 C ATOM 2406 O ASP B 62 -11.536 -2.242 -14.810 1.00 0.00 O ATOM 2407 CB ASP B 62 -13.278 -2.261 -12.698 1.00 0.00 C ATOM 2408 CG ASP B 62 -13.652 -3.681 -13.096 1.00 0.00 C ATOM 2409 OD1 ASP B 62 -12.860 -4.578 -12.822 1.00 0.00 O ATOM 2410 OD2 ASP B 62 -14.722 -3.853 -13.653 1.00 0.00 O ATOM 0 H ASP B 62 -12.100 -0.199 -11.879 1.00 0.00 H new ATOM 0 HA ASP B 62 -11.526 -2.996 -11.704 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -13.839 -1.956 -11.815 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -13.536 -1.564 -13.496 1.00 0.00 H new ATOM 2415 N GLU B 63 -9.810 -2.958 -13.556 1.00 0.00 N ATOM 2416 CA GLU B 63 -8.957 -3.314 -14.682 1.00 0.00 C ATOM 2417 C GLU B 63 -9.504 -4.482 -15.468 1.00 0.00 C ATOM 2418 O GLU B 63 -9.521 -4.504 -16.699 1.00 0.00 O ATOM 2419 CB GLU B 63 -7.617 -3.746 -14.098 1.00 0.00 C ATOM 2420 CG GLU B 63 -6.725 -4.298 -15.200 1.00 0.00 C ATOM 2421 CD GLU B 63 -5.400 -4.770 -14.613 1.00 0.00 C ATOM 2422 OE1 GLU B 63 -5.250 -4.697 -13.404 1.00 0.00 O ATOM 2423 OE2 GLU B 63 -4.553 -5.198 -15.381 1.00 0.00 O ATOM 0 H GLU B 63 -9.387 -3.133 -12.644 1.00 0.00 H new ATOM 0 HA GLU B 63 -8.885 -2.457 -15.352 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -7.131 -2.898 -13.615 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -7.773 -4.504 -13.330 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -7.225 -5.126 -15.703 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -6.546 -3.530 -15.952 1.00 0.00 H new ATOM 2430 N ASN B 64 -9.888 -5.459 -14.703 1.00 0.00 N ATOM 2431 CA ASN B 64 -10.391 -6.713 -15.193 1.00 0.00 C ATOM 2432 C ASN B 64 -11.605 -6.560 -16.101 1.00 0.00 C ATOM 2433 O ASN B 64 -11.802 -7.347 -17.027 1.00 0.00 O ATOM 2434 CB ASN B 64 -10.792 -7.470 -13.959 1.00 0.00 C ATOM 2435 CG ASN B 64 -9.600 -7.712 -13.053 1.00 0.00 C ATOM 2436 OD1 ASN B 64 -9.653 -7.352 -11.872 1.00 0.00 O ATOM 2437 ND2 ASN B 64 -8.530 -8.296 -13.523 1.00 0.00 N ATOM 0 H ASN B 64 -9.860 -5.406 -13.685 1.00 0.00 H new ATOM 0 HA ASN B 64 -9.632 -7.212 -15.796 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -11.556 -6.911 -13.418 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -11.236 -8.424 -14.243 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -7.728 -8.459 -12.914 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -8.496 -8.589 -14.499 1.00 0.00 H new ATOM 2444 N GLY B 65 -12.445 -5.581 -15.799 1.00 0.00 N ATOM 2445 CA GLY B 65 -13.669 -5.387 -16.565 1.00 0.00 C ATOM 2446 C GLY B 65 -14.770 -6.224 -15.922 1.00 0.00 C ATOM 2447 O GLY B 65 -15.898 -6.299 -16.409 1.00 0.00 O ATOM 0 H GLY B 65 -12.305 -4.916 -15.039 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -13.949 -4.334 -16.575 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -13.520 -5.687 -17.602 1.00 0.00 H new ATOM 2451 N ASP B 66 -14.399 -6.842 -14.802 1.00 0.00 N ATOM 2452 CA ASP B 66 -15.286 -7.684 -14.018 1.00 0.00 C ATOM 2453 C ASP B 66 -16.473 -6.891 -13.479 1.00 0.00 C ATOM 2454 O ASP B 66 -17.564 -7.430 -13.290 1.00 0.00 O ATOM 2455 CB ASP B 66 -14.466 -8.318 -12.883 1.00 0.00 C ATOM 2456 CG ASP B 66 -13.889 -7.235 -11.969 1.00 0.00 C ATOM 2457 OD1 ASP B 66 -14.354 -6.115 -12.037 1.00 0.00 O ATOM 2458 OD2 ASP B 66 -12.972 -7.539 -11.224 1.00 0.00 O ATOM 0 H ASP B 66 -13.459 -6.768 -14.412 1.00 0.00 H new ATOM 0 HA ASP B 66 -15.704 -8.469 -14.649 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -15.097 -8.993 -12.304 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -13.658 -8.918 -13.302 1.00 0.00 H new ATOM 2463 N GLY B 67 -16.243 -5.613 -13.226 1.00 0.00 N ATOM 2464 CA GLY B 67 -17.279 -4.737 -12.699 1.00 0.00 C ATOM 2465 C GLY B 67 -17.108 -4.545 -11.201 1.00 0.00 C ATOM 2466 O GLY B 67 -17.798 -3.729 -10.591 1.00 0.00 O ATOM 0 H GLY B 67 -15.344 -5.156 -13.378 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -17.236 -3.771 -13.202 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -18.261 -5.161 -12.907 1.00 0.00 H new ATOM 2470 N GLU B 68 -16.158 -5.272 -10.612 1.00 0.00 N ATOM 2471 CA GLU B 68 -15.887 -5.129 -9.186 1.00 0.00 C ATOM 2472 C GLU B 68 -14.421 -4.752 -8.999 1.00 0.00 C ATOM 2473 O GLU B 68 -13.602 -4.887 -9.924 1.00 0.00 O ATOM 2474 CB GLU B 68 -16.139 -6.411 -8.388 1.00 0.00 C ATOM 2475 CG GLU B 68 -17.495 -7.044 -8.697 1.00 0.00 C ATOM 2476 CD GLU B 68 -18.659 -6.057 -8.600 1.00 0.00 C ATOM 2477 OE1 GLU B 68 -18.475 -4.985 -8.074 1.00 0.00 O ATOM 2478 OE2 GLU B 68 -19.732 -6.404 -9.065 1.00 0.00 O ATOM 0 H GLU B 68 -15.573 -5.955 -11.093 1.00 0.00 H new ATOM 0 HA GLU B 68 -16.567 -4.363 -8.814 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -15.349 -7.130 -8.606 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -16.082 -6.188 -7.323 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -17.470 -7.468 -9.701 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -17.669 -7.869 -8.006 1.00 0.00 H new ATOM 2485 N VAL B 69 -14.087 -4.308 -7.796 1.00 0.00 N ATOM 2486 CA VAL B 69 -12.717 -3.939 -7.490 1.00 0.00 C ATOM 2487 C VAL B 69 -12.057 -5.107 -6.765 1.00 0.00 C ATOM 2488 O VAL B 69 -12.633 -5.677 -5.849 1.00 0.00 O ATOM 2489 CB VAL B 69 -12.712 -2.699 -6.590 1.00 0.00 C ATOM 2490 CG1 VAL B 69 -11.284 -2.215 -6.364 1.00 0.00 C ATOM 2491 CG2 VAL B 69 -13.532 -1.590 -7.242 1.00 0.00 C ATOM 0 H VAL B 69 -14.742 -4.196 -7.022 1.00 0.00 H new ATOM 0 HA VAL B 69 -12.171 -3.712 -8.406 1.00 0.00 H new ATOM 0 HB VAL B 69 -13.152 -2.960 -5.627 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -11.296 -1.334 -5.723 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -10.704 -3.004 -5.885 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -10.830 -1.961 -7.322 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -13.527 -0.709 -6.600 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -13.098 -1.337 -8.209 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -14.558 -1.931 -7.383 1.00 0.00 H new ATOM 2501 N ASP B 70 -10.859 -5.478 -7.198 1.00 0.00 N ATOM 2502 CA ASP B 70 -10.155 -6.608 -6.594 1.00 0.00 C ATOM 2503 C ASP B 70 -9.173 -6.149 -5.527 1.00 0.00 C ATOM 2504 O ASP B 70 -8.773 -4.989 -5.486 1.00 0.00 O ATOM 2505 CB ASP B 70 -9.437 -7.430 -7.665 1.00 0.00 C ATOM 2506 CG ASP B 70 -8.869 -8.703 -7.046 1.00 0.00 C ATOM 2507 OD1 ASP B 70 -9.614 -9.661 -6.920 1.00 0.00 O ATOM 2508 OD2 ASP B 70 -7.697 -8.700 -6.705 1.00 0.00 O ATOM 0 H ASP B 70 -10.356 -5.020 -7.958 1.00 0.00 H new ATOM 0 HA ASP B 70 -10.900 -7.239 -6.110 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -10.130 -7.683 -8.467 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -8.634 -6.842 -8.110 1.00 0.00 H new ATOM 2513 N PHE B 71 -8.816 -7.073 -4.646 1.00 0.00 N ATOM 2514 CA PHE B 71 -7.908 -6.780 -3.545 1.00 0.00 C ATOM 2515 C PHE B 71 -6.654 -6.088 -4.080 1.00 0.00 C ATOM 2516 O PHE B 71 -6.213 -5.087 -3.535 1.00 0.00 O ATOM 2517 CB PHE B 71 -7.523 -8.126 -2.916 1.00 0.00 C ATOM 2518 CG PHE B 71 -6.890 -8.005 -1.538 1.00 0.00 C ATOM 2519 CD1 PHE B 71 -6.440 -6.781 -1.010 1.00 0.00 C ATOM 2520 CD2 PHE B 71 -6.747 -9.172 -0.783 1.00 0.00 C ATOM 2521 CE1 PHE B 71 -5.857 -6.741 0.265 1.00 0.00 C ATOM 2522 CE2 PHE B 71 -6.167 -9.126 0.483 1.00 0.00 C ATOM 2523 CZ PHE B 71 -5.723 -7.913 1.007 1.00 0.00 C ATOM 0 H PHE B 71 -9.144 -8.039 -4.673 1.00 0.00 H new ATOM 0 HA PHE B 71 -8.379 -6.123 -2.814 1.00 0.00 H new ATOM 0 HB2 PHE B 71 -8.414 -8.749 -2.842 1.00 0.00 H new ATOM 0 HB3 PHE B 71 -6.828 -8.641 -3.580 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -6.543 -5.873 -1.586 1.00 0.00 H new ATOM 0 HD2 PHE B 71 -7.088 -10.115 -1.183 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -5.512 -5.802 0.672 1.00 0.00 H new ATOM 0 HE2 PHE B 71 -6.061 -10.033 1.060 1.00 0.00 H new ATOM 0 HZ PHE B 71 -5.275 -7.881 1.989 1.00 0.00 H new ATOM 2533 N GLN B 72 -6.097 -6.595 -5.167 1.00 0.00 N ATOM 2534 CA GLN B 72 -4.910 -5.963 -5.738 1.00 0.00 C ATOM 2535 C GLN B 72 -5.222 -4.527 -6.174 1.00 0.00 C ATOM 2536 O GLN B 72 -4.411 -3.608 -5.977 1.00 0.00 O ATOM 2537 CB GLN B 72 -4.421 -6.780 -6.941 1.00 0.00 C ATOM 2538 CG GLN B 72 -3.961 -8.162 -6.464 1.00 0.00 C ATOM 2539 CD GLN B 72 -3.508 -9.015 -7.637 1.00 0.00 C ATOM 2540 OE1 GLN B 72 -3.798 -8.701 -8.792 1.00 0.00 O ATOM 2541 NE2 GLN B 72 -2.806 -10.088 -7.402 1.00 0.00 N ATOM 0 H GLN B 72 -6.433 -7.420 -5.664 1.00 0.00 H new ATOM 0 HA GLN B 72 -4.129 -5.931 -4.979 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -5.221 -6.884 -7.674 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -3.600 -6.262 -7.437 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -3.144 -8.052 -5.751 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -4.776 -8.661 -5.940 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -2.569 -10.343 -6.443 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -2.494 -10.673 -8.177 1.00 0.00 H new ATOM 2550 N GLU B 73 -6.409 -4.334 -6.753 1.00 0.00 N ATOM 2551 CA GLU B 73 -6.811 -3.005 -7.203 1.00 0.00 C ATOM 2552 C GLU B 73 -6.969 -2.058 -6.001 1.00 0.00 C ATOM 2553 O GLU B 73 -6.529 -0.900 -6.018 1.00 0.00 O ATOM 2554 CB GLU B 73 -8.150 -3.122 -7.938 1.00 0.00 C ATOM 2555 CG GLU B 73 -8.003 -3.984 -9.201 1.00 0.00 C ATOM 2556 CD GLU B 73 -9.340 -4.039 -9.948 1.00 0.00 C ATOM 2557 OE1 GLU B 73 -10.269 -3.408 -9.486 1.00 0.00 O ATOM 2558 OE2 GLU B 73 -9.412 -4.692 -10.982 1.00 0.00 O ATOM 0 H GLU B 73 -7.097 -5.069 -6.918 1.00 0.00 H new ATOM 0 HA GLU B 73 -6.047 -2.601 -7.867 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -8.896 -3.562 -7.276 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -8.510 -2.129 -8.209 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -7.231 -3.569 -9.848 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -7.685 -4.991 -8.931 1.00 0.00 H new ATOM 2565 N TYR B 74 -7.572 -2.586 -4.941 1.00 0.00 N ATOM 2566 CA TYR B 74 -7.774 -1.836 -3.707 1.00 0.00 C ATOM 2567 C TYR B 74 -6.420 -1.491 -3.094 1.00 0.00 C ATOM 2568 O TYR B 74 -6.193 -0.391 -2.569 1.00 0.00 O ATOM 2569 CB TYR B 74 -8.593 -2.693 -2.735 1.00 0.00 C ATOM 2570 CG TYR B 74 -8.935 -1.910 -1.493 1.00 0.00 C ATOM 2571 CD1 TYR B 74 -10.101 -1.140 -1.459 1.00 0.00 C ATOM 2572 CD2 TYR B 74 -8.097 -1.964 -0.372 1.00 0.00 C ATOM 2573 CE1 TYR B 74 -10.433 -0.424 -0.306 1.00 0.00 C ATOM 2574 CE2 TYR B 74 -8.428 -1.243 0.782 1.00 0.00 C ATOM 2575 CZ TYR B 74 -9.598 -0.474 0.814 1.00 0.00 C ATOM 2576 OH TYR B 74 -9.932 0.232 1.949 1.00 0.00 O ATOM 0 H TYR B 74 -7.932 -3.540 -4.913 1.00 0.00 H new ATOM 0 HA TYR B 74 -8.311 -0.910 -3.914 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -9.508 -3.030 -3.222 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -8.028 -3.585 -2.465 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -10.746 -1.098 -2.324 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -7.197 -2.561 -0.398 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -11.336 0.169 -0.280 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -7.782 -1.280 1.646 1.00 0.00 H new ATOM 0 HH TYR B 74 -10.036 -0.388 2.701 1.00 0.00 H new ATOM 2586 N VAL B 75 -5.531 -2.473 -3.171 1.00 0.00 N ATOM 2587 CA VAL B 75 -4.182 -2.338 -2.626 1.00 0.00 C ATOM 2588 C VAL B 75 -3.443 -1.195 -3.315 1.00 0.00 C ATOM 2589 O VAL B 75 -2.864 -0.321 -2.643 1.00 0.00 O ATOM 2590 CB VAL B 75 -3.407 -3.707 -2.744 1.00 0.00 C ATOM 2591 CG1 VAL B 75 -2.179 -3.608 -3.659 1.00 0.00 C ATOM 2592 CG2 VAL B 75 -2.928 -4.173 -1.360 1.00 0.00 C ATOM 0 H VAL B 75 -5.719 -3.376 -3.607 1.00 0.00 H new ATOM 0 HA VAL B 75 -4.244 -2.090 -1.567 1.00 0.00 H new ATOM 0 HB VAL B 75 -4.111 -4.420 -3.174 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -1.681 -4.577 -3.706 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -2.494 -3.313 -4.660 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -1.488 -2.864 -3.262 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -2.395 -5.119 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -2.261 -3.423 -0.934 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -3.788 -4.308 -0.704 1.00 0.00 H new ATOM 2602 N VAL B 76 -3.480 -1.158 -4.644 1.00 0.00 N ATOM 2603 CA VAL B 76 -2.802 -0.063 -5.313 1.00 0.00 C ATOM 2604 C VAL B 76 -3.538 1.235 -5.018 1.00 0.00 C ATOM 2605 O VAL B 76 -2.913 2.278 -4.886 1.00 0.00 O ATOM 2606 CB VAL B 76 -2.663 -0.295 -6.823 1.00 0.00 C ATOM 2607 CG1 VAL B 76 -2.006 -1.658 -7.069 1.00 0.00 C ATOM 2608 CG2 VAL B 76 -4.030 -0.257 -7.502 1.00 0.00 C ATOM 0 H VAL B 76 -3.946 -1.835 -5.248 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.786 -0.001 -4.924 1.00 0.00 H new ATOM 0 HB VAL B 76 -2.044 0.497 -7.244 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.906 -1.825 -8.141 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -1.020 -1.675 -6.605 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -2.625 -2.444 -6.635 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -3.909 -0.424 -8.572 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -4.666 -1.036 -7.083 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -4.492 0.716 -7.336 1.00 0.00 H new ATOM 2618 N LEU B 77 -4.868 1.184 -4.886 1.00 0.00 N ATOM 2619 CA LEU B 77 -5.598 2.411 -4.565 1.00 0.00 C ATOM 2620 C LEU B 77 -5.087 3.058 -3.279 1.00 0.00 C ATOM 2621 O LEU B 77 -4.752 4.246 -3.264 1.00 0.00 O ATOM 2622 CB LEU B 77 -7.097 2.106 -4.408 1.00 0.00 C ATOM 2623 CG LEU B 77 -7.868 3.342 -3.895 1.00 0.00 C ATOM 2624 CD1 LEU B 77 -7.857 4.480 -4.918 1.00 0.00 C ATOM 2625 CD2 LEU B 77 -9.313 2.934 -3.606 1.00 0.00 C ATOM 0 H LEU B 77 -5.439 0.345 -4.991 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.437 3.107 -5.388 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.509 1.789 -5.366 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -7.231 1.276 -3.714 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.379 3.703 -2.990 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.409 5.332 -4.521 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -6.828 4.777 -5.120 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.326 4.143 -5.842 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.869 3.798 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -9.776 2.563 -4.520 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.325 2.150 -2.849 1.00 0.00 H new ATOM 2637 N VAL B 78 -5.020 2.291 -2.194 1.00 0.00 N ATOM 2638 CA VAL B 78 -4.557 2.889 -0.942 1.00 0.00 C ATOM 2639 C VAL B 78 -3.076 3.229 -0.988 1.00 0.00 C ATOM 2640 O VAL B 78 -2.657 4.243 -0.428 1.00 0.00 O ATOM 2641 CB VAL B 78 -4.845 2.007 0.292 1.00 0.00 C ATOM 2642 CG1 VAL B 78 -6.355 1.786 0.438 1.00 0.00 C ATOM 2643 CG2 VAL B 78 -4.121 0.652 0.199 1.00 0.00 C ATOM 0 H VAL B 78 -5.267 1.302 -2.151 1.00 0.00 H new ATOM 0 HA VAL B 78 -5.131 3.810 -0.836 1.00 0.00 H new ATOM 0 HB VAL B 78 -4.468 2.529 1.172 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.549 1.163 1.311 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -6.853 2.748 0.561 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.738 1.290 -0.454 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.346 0.057 1.084 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.458 0.120 -0.691 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.045 0.818 0.138 1.00 0.00 H new ATOM 2653 N ALA B 79 -2.274 2.396 -1.641 1.00 0.00 N ATOM 2654 CA ALA B 79 -0.838 2.683 -1.695 1.00 0.00 C ATOM 2655 C ALA B 79 -0.534 3.926 -2.542 1.00 0.00 C ATOM 2656 O ALA B 79 0.208 4.836 -2.116 1.00 0.00 O ATOM 2657 CB ALA B 79 -0.088 1.472 -2.248 1.00 0.00 C ATOM 0 H ALA B 79 -2.573 1.549 -2.124 1.00 0.00 H new ATOM 0 HA ALA B 79 -0.501 2.890 -0.679 1.00 0.00 H new ATOM 0 HB1 ALA B 79 0.979 1.691 -2.286 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -0.259 0.612 -1.601 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -0.448 1.248 -3.252 1.00 0.00 H new ATOM 2663 N ALA B 80 -1.127 3.974 -3.733 1.00 0.00 N ATOM 2664 CA ALA B 80 -0.926 5.104 -4.620 1.00 0.00 C ATOM 2665 C ALA B 80 -1.480 6.359 -3.963 1.00 0.00 C ATOM 2666 O ALA B 80 -0.856 7.423 -3.992 1.00 0.00 O ATOM 2667 CB ALA B 80 -1.620 4.849 -5.959 1.00 0.00 C ATOM 0 H ALA B 80 -1.744 3.248 -4.098 1.00 0.00 H new ATOM 0 HA ALA B 80 0.139 5.238 -4.807 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -1.464 5.703 -6.618 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -1.203 3.953 -6.420 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -2.688 4.709 -5.794 1.00 0.00 H new ATOM 2673 N LEU B 81 -2.631 6.228 -3.311 1.00 0.00 N ATOM 2674 CA LEU B 81 -3.174 7.368 -2.601 1.00 0.00 C ATOM 2675 C LEU B 81 -2.255 7.743 -1.449 1.00 0.00 C ATOM 2676 O LEU B 81 -2.145 8.909 -1.114 1.00 0.00 O ATOM 2677 CB LEU B 81 -4.607 7.117 -2.117 1.00 0.00 C ATOM 2678 CG LEU B 81 -5.630 7.544 -3.203 1.00 0.00 C ATOM 2679 CD1 LEU B 81 -5.228 7.041 -4.599 1.00 0.00 C ATOM 2680 CD2 LEU B 81 -7.025 6.998 -2.859 1.00 0.00 C ATOM 0 H LEU B 81 -3.186 5.373 -3.262 1.00 0.00 H new ATOM 0 HA LEU B 81 -3.227 8.206 -3.295 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -4.738 6.061 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -4.790 7.674 -1.198 1.00 0.00 H new ATOM 0 HG LEU B 81 -5.645 8.634 -3.221 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -5.971 7.362 -5.329 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -4.255 7.452 -4.867 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -5.173 5.952 -4.592 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -7.735 7.304 -3.628 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -6.988 5.910 -2.811 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -7.343 7.393 -1.894 1.00 0.00 H new ATOM 2692 N THR B 82 -1.600 6.758 -0.827 1.00 0.00 N ATOM 2693 CA THR B 82 -0.703 7.075 0.286 1.00 0.00 C ATOM 2694 C THR B 82 0.467 7.950 -0.176 1.00 0.00 C ATOM 2695 O THR B 82 0.733 9.025 0.402 1.00 0.00 O ATOM 2696 CB THR B 82 -0.136 5.774 0.863 1.00 0.00 C ATOM 2697 OG1 THR B 82 -1.193 4.889 1.198 1.00 0.00 O ATOM 2698 CG2 THR B 82 0.672 6.089 2.114 1.00 0.00 C ATOM 0 H THR B 82 -1.669 5.768 -1.064 1.00 0.00 H new ATOM 0 HA THR B 82 -1.275 7.618 1.038 1.00 0.00 H new ATOM 0 HB THR B 82 0.503 5.301 0.118 1.00 0.00 H new ATOM 0 HG1 THR B 82 -1.604 4.545 0.378 1.00 0.00 H new ATOM 0 HG21 THR B 82 1.077 5.165 2.528 1.00 0.00 H new ATOM 0 HG22 THR B 82 1.490 6.762 1.859 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.028 6.565 2.853 1.00 0.00 H new ATOM 2706 N VAL B 83 1.150 7.510 -1.238 1.00 0.00 N ATOM 2707 CA VAL B 83 2.272 8.309 -1.754 1.00 0.00 C ATOM 2708 C VAL B 83 1.785 9.662 -2.256 1.00 0.00 C ATOM 2709 O VAL B 83 2.435 10.691 -2.038 1.00 0.00 O ATOM 2710 CB VAL B 83 3.069 7.570 -2.853 1.00 0.00 C ATOM 2711 CG1 VAL B 83 2.218 7.327 -4.100 1.00 0.00 C ATOM 2712 CG2 VAL B 83 4.273 8.433 -3.256 1.00 0.00 C ATOM 0 H VAL B 83 0.960 6.643 -1.741 1.00 0.00 H new ATOM 0 HA VAL B 83 2.957 8.470 -0.921 1.00 0.00 H new ATOM 0 HB VAL B 83 3.384 6.607 -2.452 1.00 0.00 H new ATOM 0 HG11 VAL B 83 2.812 6.805 -4.850 1.00 0.00 H new ATOM 0 HG12 VAL B 83 1.352 6.720 -3.837 1.00 0.00 H new ATOM 0 HG13 VAL B 83 1.882 8.282 -4.503 1.00 0.00 H new ATOM 0 HG21 VAL B 83 4.844 7.922 -4.031 1.00 0.00 H new ATOM 0 HG22 VAL B 83 3.922 9.392 -3.636 1.00 0.00 H new ATOM 0 HG23 VAL B 83 4.909 8.598 -2.387 1.00 0.00 H new ATOM 2722 N ALA B 84 0.622 9.670 -2.903 1.00 0.00 N ATOM 2723 CA ALA B 84 0.064 10.915 -3.397 1.00 0.00 C ATOM 2724 C ALA B 84 -0.287 11.824 -2.228 1.00 0.00 C ATOM 2725 O ALA B 84 -0.157 13.043 -2.314 1.00 0.00 O ATOM 2726 CB ALA B 84 -1.182 10.631 -4.232 1.00 0.00 C ATOM 0 H ALA B 84 0.060 8.841 -3.093 1.00 0.00 H new ATOM 0 HA ALA B 84 0.803 11.414 -4.024 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -1.596 11.570 -4.600 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -0.917 9.996 -5.077 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -1.925 10.124 -3.616 1.00 0.00 H new ATOM 2732 N CYS B 85 -0.728 11.206 -1.135 1.00 0.00 N ATOM 2733 CA CYS B 85 -1.108 11.940 0.059 1.00 0.00 C ATOM 2734 C CYS B 85 0.090 12.667 0.615 1.00 0.00 C ATOM 2735 O CYS B 85 0.069 13.892 0.776 1.00 0.00 O ATOM 2736 CB CYS B 85 -1.652 10.976 1.114 1.00 0.00 C ATOM 2737 SG CYS B 85 -2.384 11.921 2.474 1.00 0.00 S ATOM 0 H CYS B 85 -0.830 10.194 -1.056 1.00 0.00 H new ATOM 0 HA CYS B 85 -1.882 12.662 -0.202 1.00 0.00 H new ATOM 0 HB2 CYS B 85 -2.399 10.318 0.670 1.00 0.00 H new ATOM 0 HB3 CYS B 85 -0.850 10.340 1.489 1.00 0.00 H new ATOM 2742 N ASN B 86 1.154 11.926 0.892 1.00 0.00 N ATOM 2743 CA ASN B 86 2.337 12.584 1.408 1.00 0.00 C ATOM 2744 C ASN B 86 2.779 13.653 0.415 1.00 0.00 C ATOM 2745 O ASN B 86 3.186 14.751 0.808 1.00 0.00 O ATOM 2746 CB ASN B 86 3.468 11.588 1.649 1.00 0.00 C ATOM 2747 CG ASN B 86 4.562 12.260 2.479 1.00 0.00 C ATOM 2748 OD1 ASN B 86 5.517 11.540 2.998 1.00 0.00 O flip ATOM 2749 ND2 ASN B 86 4.531 13.475 2.674 1.00 0.00 N flip ATOM 0 H ASN B 86 1.221 10.915 0.774 1.00 0.00 H new ATOM 0 HA ASN B 86 2.095 13.042 2.367 1.00 0.00 H new ATOM 0 HB2 ASN B 86 3.089 10.708 2.169 1.00 0.00 H new ATOM 0 HB3 ASN B 86 3.875 11.245 0.698 1.00 0.00 H new ATOM 0 HD21 ASN B 86 3.784 14.038 2.268 1.00 0.00 H new ATOM 0 HD22 ASN B 86 5.253 13.919 3.242 1.00 0.00 H new ATOM 2756 N ASN B 87 2.680 13.334 -0.880 1.00 0.00 N ATOM 2757 CA ASN B 87 3.062 14.294 -1.910 1.00 0.00 C ATOM 2758 C ASN B 87 2.234 15.569 -1.799 1.00 0.00 C ATOM 2759 O ASN B 87 2.766 16.667 -1.946 1.00 0.00 O ATOM 2760 CB ASN B 87 2.867 13.678 -3.296 1.00 0.00 C ATOM 2761 CG ASN B 87 3.811 12.495 -3.479 1.00 0.00 C ATOM 2762 OD1 ASN B 87 4.785 12.356 -2.739 1.00 0.00 O ATOM 2763 ND2 ASN B 87 3.579 11.628 -4.425 1.00 0.00 N ATOM 0 H ASN B 87 2.345 12.437 -1.231 1.00 0.00 H new ATOM 0 HA ASN B 87 4.113 14.547 -1.766 1.00 0.00 H new ATOM 0 HB2 ASN B 87 1.834 13.351 -3.416 1.00 0.00 H new ATOM 0 HB3 ASN B 87 3.056 14.427 -4.065 1.00 0.00 H new ATOM 0 HD21 ASN B 87 4.205 10.833 -4.553 1.00 0.00 H new ATOM 0 HD22 ASN B 87 2.771 11.745 -5.037 1.00 0.00 H new ATOM 2770 N PHE B 88 0.936 15.434 -1.518 1.00 0.00 N ATOM 2771 CA PHE B 88 0.098 16.618 -1.370 1.00 0.00 C ATOM 2772 C PHE B 88 0.488 17.412 -0.132 1.00 0.00 C ATOM 2773 O PHE B 88 0.496 18.639 -0.153 1.00 0.00 O ATOM 2774 CB PHE B 88 -1.397 16.273 -1.315 1.00 0.00 C ATOM 2775 CG PHE B 88 -1.872 15.822 -2.679 1.00 0.00 C ATOM 2776 CD1 PHE B 88 -1.931 16.744 -3.731 1.00 0.00 C ATOM 2777 CD2 PHE B 88 -2.279 14.500 -2.889 1.00 0.00 C ATOM 2778 CE1 PHE B 88 -2.385 16.342 -4.992 1.00 0.00 C ATOM 2779 CE2 PHE B 88 -2.732 14.097 -4.150 1.00 0.00 C ATOM 2780 CZ PHE B 88 -2.784 15.017 -5.203 1.00 0.00 C ATOM 0 H PHE B 88 0.456 14.543 -1.392 1.00 0.00 H new ATOM 0 HA PHE B 88 0.267 17.229 -2.257 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -1.571 15.486 -0.581 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -1.968 17.143 -0.991 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -1.626 17.767 -3.569 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -2.243 13.789 -2.076 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -2.428 17.054 -5.803 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -3.042 13.075 -4.311 1.00 0.00 H new ATOM 0 HZ PHE B 88 -3.131 14.705 -6.177 1.00 0.00 H new ATOM 2790 N PHE B 89 0.793 16.715 0.958 1.00 0.00 N ATOM 2791 CA PHE B 89 1.160 17.416 2.183 1.00 0.00 C ATOM 2792 C PHE B 89 2.433 18.240 1.991 1.00 0.00 C ATOM 2793 O PHE B 89 2.452 19.438 2.272 1.00 0.00 O ATOM 2794 CB PHE B 89 1.373 16.408 3.313 1.00 0.00 C ATOM 2795 CG PHE B 89 1.631 17.146 4.605 1.00 0.00 C ATOM 2796 CD1 PHE B 89 0.556 17.590 5.384 1.00 0.00 C ATOM 2797 CD2 PHE B 89 2.945 17.385 5.024 1.00 0.00 C ATOM 2798 CE1 PHE B 89 0.797 18.274 6.583 1.00 0.00 C ATOM 2799 CE2 PHE B 89 3.185 18.069 6.222 1.00 0.00 C ATOM 2800 CZ PHE B 89 2.111 18.513 7.001 1.00 0.00 C ATOM 0 H PHE B 89 0.794 15.697 1.020 1.00 0.00 H new ATOM 0 HA PHE B 89 0.346 18.095 2.439 1.00 0.00 H new ATOM 0 HB2 PHE B 89 0.495 15.770 3.415 1.00 0.00 H new ATOM 0 HB3 PHE B 89 2.215 15.757 3.080 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -0.458 17.406 5.061 1.00 0.00 H new ATOM 0 HD2 PHE B 89 3.774 17.042 4.423 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -0.032 18.617 7.185 1.00 0.00 H new ATOM 0 HE2 PHE B 89 4.199 18.254 6.545 1.00 0.00 H new ATOM 0 HZ PHE B 89 2.296 19.040 7.925 1.00 0.00 H new ATOM 2810 N TRP B 90 3.489 17.598 1.493 1.00 0.00 N ATOM 2811 CA TRP B 90 4.748 18.292 1.249 1.00 0.00 C ATOM 2812 C TRP B 90 4.637 19.309 0.129 1.00 0.00 C ATOM 2813 O TRP B 90 5.242 20.380 0.178 1.00 0.00 O ATOM 2814 CB TRP B 90 5.853 17.307 0.913 1.00 0.00 C ATOM 2815 CG TRP B 90 7.100 18.091 0.718 1.00 0.00 C ATOM 2816 CD1 TRP B 90 7.375 18.777 -0.399 1.00 0.00 C ATOM 2817 CD2 TRP B 90 8.226 18.293 1.618 1.00 0.00 C ATOM 2818 NE1 TRP B 90 8.603 19.393 -0.263 1.00 0.00 N ATOM 2819 CE2 TRP B 90 9.172 19.121 0.967 1.00 0.00 C ATOM 2820 CE3 TRP B 90 8.520 17.846 2.917 1.00 0.00 C ATOM 2821 CZ2 TRP B 90 10.368 19.491 1.584 1.00 0.00 C ATOM 2822 CZ3 TRP B 90 9.723 18.215 3.542 1.00 0.00 C ATOM 2823 CH2 TRP B 90 10.644 19.035 2.876 1.00 0.00 C ATOM 0 H TRP B 90 3.496 16.607 1.253 1.00 0.00 H new ATOM 0 HA TRP B 90 4.991 18.821 2.171 1.00 0.00 H new ATOM 0 HB2 TRP B 90 5.977 16.581 1.716 1.00 0.00 H new ATOM 0 HB3 TRP B 90 5.607 16.746 0.011 1.00 0.00 H new ATOM 0 HD1 TRP B 90 6.737 18.839 -1.268 1.00 0.00 H new ATOM 0 HE1 TRP B 90 9.036 19.975 -0.980 1.00 0.00 H new ATOM 0 HE3 TRP B 90 7.816 17.214 3.439 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 11.074 20.124 1.067 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 9.939 17.865 4.541 1.00 0.00 H new ATOM 0 HH2 TRP B 90 11.567 19.315 3.361 1.00 0.00 H new ATOM 2834 N GLU B 91 3.912 18.932 -0.909 1.00 0.00 N ATOM 2835 CA GLU B 91 3.774 19.772 -2.087 1.00 0.00 C ATOM 2836 C GLU B 91 2.421 20.477 -2.130 1.00 0.00 C ATOM 2837 O GLU B 91 1.394 19.895 -1.796 1.00 0.00 O ATOM 2838 CB GLU B 91 3.943 18.873 -3.314 1.00 0.00 C ATOM 2839 CG GLU B 91 4.579 19.658 -4.466 1.00 0.00 C ATOM 2840 CD GLU B 91 3.594 20.692 -5.003 1.00 0.00 C ATOM 2841 OE1 GLU B 91 2.423 20.588 -4.683 1.00 0.00 O ATOM 2842 OE2 GLU B 91 4.027 21.572 -5.729 1.00 0.00 O ATOM 0 H GLU B 91 3.408 18.047 -0.961 1.00 0.00 H new ATOM 0 HA GLU B 91 4.532 20.555 -2.065 1.00 0.00 H new ATOM 0 HB2 GLU B 91 4.567 18.015 -3.062 1.00 0.00 H new ATOM 0 HB3 GLU B 91 2.974 18.482 -3.623 1.00 0.00 H new ATOM 0 HG2 GLU B 91 5.486 20.154 -4.121 1.00 0.00 H new ATOM 0 HG3 GLU B 91 4.872 18.975 -5.263 1.00 0.00 H new ATOM 2849 N ASN B 92 2.433 21.738 -2.556 1.00 0.00 N ATOM 2850 CA ASN B 92 1.204 22.520 -2.649 1.00 0.00 C ATOM 2851 C ASN B 92 0.766 22.657 -4.103 1.00 0.00 C ATOM 2852 O ASN B 92 1.590 22.885 -4.990 1.00 0.00 O ATOM 2853 CB ASN B 92 1.425 23.910 -2.049 1.00 0.00 C ATOM 2854 CG ASN B 92 1.722 23.793 -0.558 1.00 0.00 C ATOM 2855 OD1 ASN B 92 1.443 22.762 0.053 1.00 0.00 O ATOM 2856 ND2 ASN B 92 2.277 24.795 0.067 1.00 0.00 N ATOM 0 H ASN B 92 3.276 22.237 -2.841 1.00 0.00 H new ATOM 0 HA ASN B 92 0.422 22.003 -2.093 1.00 0.00 H new ATOM 0 HB2 ASN B 92 2.253 24.406 -2.555 1.00 0.00 H new ATOM 0 HB3 ASN B 92 0.540 24.527 -2.205 1.00 0.00 H new ATOM 0 HD21 ASN B 92 2.480 24.725 1.064 1.00 0.00 H new ATOM 0 HD22 ASN B 92 2.507 25.649 -0.441 1.00 0.00 H new ATOM 2863 N SER B 93 -0.533 22.518 -4.342 1.00 0.00 N ATOM 2864 CA SER B 93 -1.067 22.628 -5.696 1.00 0.00 C ATOM 2865 C SER B 93 -1.111 24.088 -6.136 1.00 0.00 C ATOM 2866 O SER B 93 -2.096 24.474 -6.743 1.00 0.00 O ATOM 2867 CB SER B 93 -2.475 22.035 -5.751 1.00 0.00 C ATOM 2868 OG SER B 93 -3.073 22.364 -6.997 1.00 0.00 O ATOM 0 H SER B 93 -1.232 22.330 -3.623 1.00 0.00 H new ATOM 0 HA SER B 93 -0.413 22.075 -6.371 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.431 20.953 -5.630 1.00 0.00 H new ATOM 0 HB3 SER B 93 -3.078 22.424 -4.931 1.00 0.00 H new ATOM 0 HG SER B 93 -3.232 23.330 -7.039 1.00 0.00 H new TER 2874 SER B 93 HETATM 2875 N HCS A 201 0.589 -14.946 8.311 1.00 0.00 N HETATM 2876 CA HCS A 201 1.670 -13.924 8.230 1.00 0.00 C HETATM 2877 CB HCS A 201 1.500 -13.105 6.948 1.00 0.00 C HETATM 2878 CG HCS A 201 0.110 -12.467 6.930 1.00 0.00 C HETATM 2879 SD HCS A 201 -0.259 -11.873 5.260 1.00 0.00 S HETATM 2880 C HCS A 201 1.592 -13.008 9.447 1.00 0.00 C HETATM 2881 OXT HCS A 201 1.175 -13.478 10.493 1.00 0.00 O HETATM 2882 O HCS A 201 1.951 -11.849 9.316 1.00 0.00 O HETATM 0 HG3 HCS A 201 -0.640 -13.194 7.243 1.00 0.00 H new HETATM 0 HG2 HCS A 201 0.068 -11.640 7.639 1.00 0.00 H new HETATM 0 HCA HCS A 201 2.642 -14.416 8.214 1.00 0.00 H new HETATM 0 HB3 HCS A 201 2.267 -12.332 6.893 1.00 0.00 H new HETATM 0 HB2 HCS A 201 1.629 -13.745 6.075 1.00 0.00 H new HETATM 0 H2 HCS A 201 0.549 -15.584 9.106 1.00 0.00 H new HETATM 0 H HCS A 201 -0.111 -15.008 7.571 1.00 0.00 H new HETATM 2891 CA CA A 202 17.062 8.187 1.993 1.00 0.00 CA HETATM 2892 CA CA A 203 13.979 4.353 -8.915 1.00 0.00 CA HETATM 2893 N HCS B 201 -2.297 15.873 5.964 1.00 0.00 N HETATM 2894 CA HCS B 201 -3.345 14.833 5.763 1.00 0.00 C HETATM 2895 CB HCS B 201 -2.891 13.860 4.672 1.00 0.00 C HETATM 2896 CG HCS B 201 -1.545 13.246 5.062 1.00 0.00 C HETATM 2897 SD HCS B 201 -0.803 12.449 3.616 1.00 0.00 S HETATM 2898 C HCS B 201 -3.569 14.081 7.070 1.00 0.00 C HETATM 2899 OXT HCS B 201 -3.402 14.687 8.116 1.00 0.00 O HETATM 2900 O HCS B 201 -3.904 12.910 7.007 1.00 0.00 O HETATM 0 HG3 HCS B 201 -0.879 14.018 5.447 1.00 0.00 H new HETATM 0 HG2 HCS B 201 -1.683 12.518 5.861 1.00 0.00 H new HETATM 0 HCA HCS B 201 -4.279 15.305 5.457 1.00 0.00 H new HETATM 0 HB3 HCS B 201 -3.635 13.075 4.538 1.00 0.00 H new HETATM 0 HB2 HCS B 201 -2.802 14.382 3.719 1.00 0.00 H new HETATM 0 H2 HCS B 201 -2.434 16.608 6.658 1.00 0.00 H new HETATM 0 H HCS B 201 -1.443 15.850 5.407 1.00 0.00 H new HETATM 2909 CA CA B 202 -17.175 -8.128 -1.039 1.00 0.00 CA HETATM 2910 CA CA B 203 -11.560 -5.666 -11.318 1.00 0.00 CA