USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1229 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 43 GLN : amide:sc= 0.187 K(o=-1.5,f=-3.7) USER MOD Set 1.2: B 49 ASN : amide:sc= -1.65 K(o=-1.5,f=-3.7!) USER MOD Set 2.1: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 3 LYS NZ :NH3+ -179:sc= -0.568 (180deg=-0.598) USER MOD Set 3.1: A 43 GLN : amide:sc= -1.06 K(o=-5,f=-6) USER MOD Set 3.2: B 2 ASN : amide:sc= -3.9 X(o=-5,f=-4.9!) USER MOD Set 4.1: A 35 THR OG1 : rot 95:sc= 1.01 USER MOD Set 4.2: B 1 MET CE :methyl 127:sc= -5.36 (180deg=-6.71!) USER MOD Set 5.1: A 1 MET CE :methyl -113:sc= -8.72! (180deg=-11.2!) USER MOD Set 5.2: B 35 THR OG1 : rot 86:sc= -0.241 USER MOD Single : A 1 MET N :NH3+ 139:sc= -1.14 (180deg=-4.05!) USER MOD Single : A 2 ASN : amide:sc= -1.74 K(o=-1.7,f=-8.4!) USER MOD Single : A 3 LYS NZ :NH3+ 154:sc= -0.435! (180deg=-2.29!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 152:sc= -0.257 (180deg=-0.748) USER MOD Single : A 12 GLN : amide:sc= -0.984 K(o=-0.98,f=-5.8!) USER MOD Single : A 14 THR OG1 : rot 74:sc= -4.72! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 20 SER OG : rot -169:sc= -9.31! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -139:sc= -9.9! (180deg=-15!) USER MOD Single : A 27 SER OG : rot 104:sc= 0.977 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= -4.26! USER MOD Single : A 38 LYS NZ :NH3+ 135:sc= 1.03 (180deg=-1.02) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 120:sc= -0.0616 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -85:sc= 0.0368 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -167:sc= 0.062 (180deg=0.0342) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ -178:sc= 0.0122 (180deg=0.0117) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 14 THR OG1 : rot -66:sc= -7.84! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 20 SER OG : rot -82:sc= -8.62! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -134:sc= -4.62! (180deg=-7.31!) USER MOD Single : B 27 SER OG : rot 71:sc= -2.06! USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 92:sc= -4.65! USER MOD Single : B 38 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00187) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -69:sc= 0.54 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot -129:sc= -2.05 USER MOD Single : B 80 LYS NZ :NH3+ 155:sc= -2.88 (180deg=-4.67!) USER MOD Single : B 84 SER OG : rot 180:sc= -1.13 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.00357) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.470 3.525 10.067 1.00 0.00 N ATOM 2 CA MET A 1 3.802 4.862 10.014 1.00 0.00 C ATOM 3 C MET A 1 2.280 4.689 9.901 1.00 0.00 C ATOM 4 O MET A 1 1.763 3.608 10.106 1.00 0.00 O ATOM 5 CB MET A 1 4.367 5.550 8.767 1.00 0.00 C ATOM 6 CG MET A 1 5.493 6.507 9.177 1.00 0.00 C ATOM 7 SD MET A 1 6.824 6.449 7.952 1.00 0.00 S ATOM 8 CE MET A 1 6.042 7.524 6.724 1.00 0.00 C ATOM 0 H1 MET A 1 5.333 3.545 9.486 1.00 0.00 H new ATOM 0 H2 MET A 1 4.720 3.301 11.051 1.00 0.00 H new ATOM 0 H3 MET A 1 3.822 2.799 9.700 1.00 0.00 H new ATOM 0 HA MET A 1 3.987 5.450 10.913 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.745 4.805 8.067 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.578 6.099 8.252 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.107 7.523 9.260 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.878 6.231 10.159 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.800 6.943 5.834 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.128 7.948 7.141 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.726 8.329 6.457 1.00 0.00 H new ATOM 20 N ASN A 2 1.553 5.736 9.581 1.00 0.00 N ATOM 21 CA ASN A 2 0.066 5.595 9.465 1.00 0.00 C ATOM 22 C ASN A 2 -0.586 6.884 8.944 1.00 0.00 C ATOM 23 O ASN A 2 0.082 7.794 8.499 1.00 0.00 O ATOM 24 CB ASN A 2 -0.418 5.292 10.887 1.00 0.00 C ATOM 25 CG ASN A 2 -1.669 4.412 10.831 1.00 0.00 C ATOM 26 OD1 ASN A 2 -2.713 4.849 10.386 1.00 0.00 O ATOM 27 ND2 ASN A 2 -1.610 3.183 11.263 1.00 0.00 N ATOM 0 H ASN A 2 1.920 6.670 9.398 1.00 0.00 H new ATOM 0 HA ASN A 2 -0.202 4.812 8.756 1.00 0.00 H new ATOM 0 HB2 ASN A 2 0.368 4.788 11.449 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.639 6.221 11.412 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -2.439 2.590 11.227 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -0.735 2.815 11.636 1.00 0.00 H new ATOM 34 N LYS A 3 -1.898 6.961 9.005 1.00 0.00 N ATOM 35 CA LYS A 3 -2.614 8.186 8.519 1.00 0.00 C ATOM 36 C LYS A 3 -2.119 9.440 9.268 1.00 0.00 C ATOM 37 O LYS A 3 -2.505 10.545 8.950 1.00 0.00 O ATOM 38 CB LYS A 3 -4.106 7.924 8.797 1.00 0.00 C ATOM 39 CG LYS A 3 -4.953 8.336 7.576 1.00 0.00 C ATOM 40 CD LYS A 3 -6.130 7.354 7.395 1.00 0.00 C ATOM 41 CE LYS A 3 -7.238 7.982 6.516 1.00 0.00 C ATOM 42 NZ LYS A 3 -8.210 8.570 7.483 1.00 0.00 N ATOM 0 H LYS A 3 -2.503 6.226 9.371 1.00 0.00 H new ATOM 0 HA LYS A 3 -2.432 8.372 7.461 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.263 6.868 9.019 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.424 8.485 9.676 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.331 9.349 7.711 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.334 8.344 6.679 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -5.773 6.432 6.935 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.540 7.087 8.369 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.831 8.745 5.852 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.714 7.232 5.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.719 9.355 7.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -8.890 7.841 7.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.699 8.924 8.317 1.00 0.00 H new ATOM 56 N THR A 4 -1.259 9.272 10.250 1.00 0.00 N ATOM 57 CA THR A 4 -0.714 10.447 11.008 1.00 0.00 C ATOM 58 C THR A 4 0.816 10.401 10.965 1.00 0.00 C ATOM 59 O THR A 4 1.485 11.405 10.785 1.00 0.00 O ATOM 60 CB THR A 4 -1.227 10.278 12.438 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.648 10.304 12.436 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.697 11.416 13.313 1.00 0.00 C ATOM 0 H THR A 4 -0.910 8.365 10.560 1.00 0.00 H new ATOM 0 HA THR A 4 -1.025 11.405 10.591 1.00 0.00 H new ATOM 0 HB THR A 4 -0.880 9.325 12.837 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.978 10.194 13.352 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.064 11.293 14.332 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.393 11.396 13.315 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.041 12.371 12.916 1.00 0.00 H new ATOM 70 N GLU A 5 1.385 9.237 11.096 1.00 0.00 N ATOM 71 CA GLU A 5 2.866 9.145 11.021 1.00 0.00 C ATOM 72 C GLU A 5 3.290 9.620 9.632 1.00 0.00 C ATOM 73 O GLU A 5 4.125 10.496 9.488 1.00 0.00 O ATOM 74 CB GLU A 5 3.198 7.672 11.237 1.00 0.00 C ATOM 75 CG GLU A 5 4.335 7.541 12.256 1.00 0.00 C ATOM 76 CD GLU A 5 3.922 6.570 13.366 1.00 0.00 C ATOM 77 OE1 GLU A 5 2.797 6.673 13.827 1.00 0.00 O ATOM 78 OE2 GLU A 5 4.738 5.743 13.735 1.00 0.00 O ATOM 0 H GLU A 5 0.895 8.356 11.250 1.00 0.00 H new ATOM 0 HA GLU A 5 3.383 9.756 11.760 1.00 0.00 H new ATOM 0 HB2 GLU A 5 2.316 7.139 11.592 1.00 0.00 H new ATOM 0 HB3 GLU A 5 3.489 7.213 10.292 1.00 0.00 H new ATOM 0 HG2 GLU A 5 5.239 7.182 11.763 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.570 8.517 12.681 1.00 0.00 H new ATOM 85 N LEU A 6 2.679 9.084 8.603 1.00 0.00 N ATOM 86 CA LEU A 6 3.014 9.555 7.226 1.00 0.00 C ATOM 87 C LEU A 6 2.753 11.057 7.158 1.00 0.00 C ATOM 88 O LEU A 6 3.430 11.792 6.462 1.00 0.00 O ATOM 89 CB LEU A 6 2.070 8.802 6.287 1.00 0.00 C ATOM 90 CG LEU A 6 2.738 7.515 5.807 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.689 6.604 5.167 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.813 7.858 4.774 1.00 0.00 C ATOM 0 H LEU A 6 1.972 8.351 8.657 1.00 0.00 H new ATOM 0 HA LEU A 6 4.054 9.374 6.955 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.138 8.569 6.803 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.813 9.430 5.434 1.00 0.00 H new ATOM 0 HG LEU A 6 3.195 7.003 6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.165 5.685 4.824 1.00 0.00 H new ATOM 0 HD12 LEU A 6 0.920 6.362 5.901 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.233 7.114 4.319 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.292 6.942 4.429 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.354 8.368 3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.560 8.509 5.229 1.00 0.00 H new ATOM 104 N ILE A 7 1.788 11.527 7.912 1.00 0.00 N ATOM 105 CA ILE A 7 1.506 12.988 7.926 1.00 0.00 C ATOM 106 C ILE A 7 2.821 13.697 8.220 1.00 0.00 C ATOM 107 O ILE A 7 3.245 14.567 7.493 1.00 0.00 O ATOM 108 CB ILE A 7 0.476 13.185 9.047 1.00 0.00 C ATOM 109 CG1 ILE A 7 -0.892 12.723 8.555 1.00 0.00 C ATOM 110 CG2 ILE A 7 0.384 14.650 9.454 1.00 0.00 C ATOM 111 CD1 ILE A 7 -1.993 13.315 9.440 1.00 0.00 C ATOM 0 H ILE A 7 1.189 10.962 8.514 1.00 0.00 H new ATOM 0 HA ILE A 7 1.114 13.385 6.990 1.00 0.00 H new ATOM 0 HB ILE A 7 0.791 12.601 9.912 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.039 13.033 7.520 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.946 11.634 8.573 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.353 14.761 10.250 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.356 14.991 9.810 1.00 0.00 H new ATOM 0 HG23 ILE A 7 0.083 15.248 8.594 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -2.967 12.980 9.082 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.851 12.983 10.469 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.946 14.403 9.400 1.00 0.00 H new ATOM 123 N LYS A 8 3.488 13.290 9.264 1.00 0.00 N ATOM 124 CA LYS A 8 4.807 13.905 9.592 1.00 0.00 C ATOM 125 C LYS A 8 5.762 13.671 8.433 1.00 0.00 C ATOM 126 O LYS A 8 6.592 14.502 8.123 1.00 0.00 O ATOM 127 CB LYS A 8 5.305 13.190 10.855 1.00 0.00 C ATOM 128 CG LYS A 8 4.285 13.336 11.990 1.00 0.00 C ATOM 129 CD LYS A 8 3.838 14.795 12.109 1.00 0.00 C ATOM 130 CE LYS A 8 2.664 15.033 11.159 1.00 0.00 C ATOM 131 NZ LYS A 8 1.751 15.958 11.890 1.00 0.00 N ATOM 0 H LYS A 8 3.178 12.559 9.904 1.00 0.00 H new ATOM 0 HA LYS A 8 4.735 14.980 9.758 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.472 12.134 10.641 1.00 0.00 H new ATOM 0 HB3 LYS A 8 6.263 13.608 11.163 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.423 12.697 11.799 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.725 13.004 12.930 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.543 15.016 13.135 1.00 0.00 H new ATOM 0 HD3 LYS A 8 4.663 15.463 11.863 1.00 0.00 H new ATOM 0 HE2 LYS A 8 3.000 15.472 10.220 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.162 14.098 10.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 1.214 16.528 11.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 1.091 15.405 12.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.310 16.587 12.501 1.00 0.00 H new ATOM 145 N ALA A 9 5.641 12.549 7.776 1.00 0.00 N ATOM 146 CA ALA A 9 6.534 12.277 6.621 1.00 0.00 C ATOM 147 C ALA A 9 6.424 13.420 5.610 1.00 0.00 C ATOM 148 O ALA A 9 7.402 13.832 5.021 1.00 0.00 O ATOM 149 CB ALA A 9 6.015 10.980 6.028 1.00 0.00 C ATOM 0 H ALA A 9 4.966 11.815 7.990 1.00 0.00 H new ATOM 0 HA ALA A 9 7.584 12.199 6.904 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.622 10.706 5.165 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.071 10.190 6.777 1.00 0.00 H new ATOM 0 HB3 ALA A 9 4.979 11.112 5.716 1.00 0.00 H new ATOM 155 N ILE A 10 5.243 13.961 5.431 1.00 0.00 N ATOM 156 CA ILE A 10 5.084 15.096 4.493 1.00 0.00 C ATOM 157 C ILE A 10 5.120 16.376 5.318 1.00 0.00 C ATOM 158 O ILE A 10 5.575 17.405 4.877 1.00 0.00 O ATOM 159 CB ILE A 10 3.710 14.880 3.826 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.896 14.506 2.351 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.865 16.157 3.906 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.724 13.223 2.240 1.00 0.00 C ATOM 0 H ILE A 10 4.388 13.660 5.898 1.00 0.00 H new ATOM 0 HA ILE A 10 5.862 15.164 3.733 1.00 0.00 H new ATOM 0 HB ILE A 10 3.200 14.074 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.925 14.365 1.877 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.394 15.318 1.821 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.900 15.985 3.430 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.712 16.427 4.951 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.382 16.968 3.394 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.853 12.963 1.189 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.701 13.380 2.697 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.209 12.412 2.754 1.00 0.00 H new ATOM 174 N ALA A 11 4.676 16.310 6.536 1.00 0.00 N ATOM 175 CA ALA A 11 4.724 17.525 7.380 1.00 0.00 C ATOM 176 C ALA A 11 6.187 17.853 7.677 1.00 0.00 C ATOM 177 O ALA A 11 6.516 18.935 8.123 1.00 0.00 O ATOM 178 CB ALA A 11 3.961 17.156 8.650 1.00 0.00 C ATOM 0 H ALA A 11 4.287 15.478 6.979 1.00 0.00 H new ATOM 0 HA ALA A 11 4.284 18.403 6.908 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.952 18.008 9.330 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.937 16.885 8.393 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.449 16.311 9.135 1.00 0.00 H new ATOM 184 N GLN A 12 7.073 16.923 7.410 1.00 0.00 N ATOM 185 CA GLN A 12 8.516 17.177 7.649 1.00 0.00 C ATOM 186 C GLN A 12 9.247 17.263 6.307 1.00 0.00 C ATOM 187 O GLN A 12 10.094 18.113 6.111 1.00 0.00 O ATOM 188 CB GLN A 12 9.004 15.993 8.500 1.00 0.00 C ATOM 189 CG GLN A 12 9.360 14.796 7.608 1.00 0.00 C ATOM 190 CD GLN A 12 9.778 13.613 8.483 1.00 0.00 C ATOM 191 OE1 GLN A 12 9.203 12.546 8.398 1.00 0.00 O ATOM 192 NE2 GLN A 12 10.763 13.758 9.328 1.00 0.00 N ATOM 0 H GLN A 12 6.852 16.000 7.037 1.00 0.00 H new ATOM 0 HA GLN A 12 8.704 18.119 8.164 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.876 16.292 9.082 1.00 0.00 H new ATOM 0 HB3 GLN A 12 8.229 15.706 9.211 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.504 14.521 6.991 1.00 0.00 H new ATOM 0 HG3 GLN A 12 10.169 15.063 6.929 1.00 0.00 H new ATOM 0 HE21 GLN A 12 11.246 14.654 9.400 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.049 12.976 9.916 1.00 0.00 H new ATOM 201 N ASP A 13 8.896 16.426 5.361 1.00 0.00 N ATOM 202 CA ASP A 13 9.550 16.525 4.025 1.00 0.00 C ATOM 203 C ASP A 13 9.105 17.844 3.422 1.00 0.00 C ATOM 204 O ASP A 13 9.847 18.546 2.762 1.00 0.00 O ATOM 205 CB ASP A 13 9.000 15.362 3.205 1.00 0.00 C ATOM 206 CG ASP A 13 9.750 14.078 3.565 1.00 0.00 C ATOM 207 OD1 ASP A 13 9.859 13.792 4.746 1.00 0.00 O ATOM 208 OD2 ASP A 13 10.203 13.405 2.654 1.00 0.00 O ATOM 0 H ASP A 13 8.196 15.690 5.456 1.00 0.00 H new ATOM 0 HA ASP A 13 10.639 16.484 4.064 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.935 15.239 3.399 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.108 15.572 2.141 1.00 0.00 H new ATOM 213 N THR A 14 7.880 18.181 3.694 1.00 0.00 N ATOM 214 CA THR A 14 7.304 19.450 3.214 1.00 0.00 C ATOM 215 C THR A 14 7.410 20.470 4.350 1.00 0.00 C ATOM 216 O THR A 14 8.166 21.418 4.275 1.00 0.00 O ATOM 217 CB THR A 14 5.847 19.098 2.899 1.00 0.00 C ATOM 218 OG1 THR A 14 5.670 17.689 2.949 1.00 0.00 O ATOM 219 CG2 THR A 14 5.508 19.565 1.502 1.00 0.00 C ATOM 0 H THR A 14 7.240 17.609 4.245 1.00 0.00 H new ATOM 0 HA THR A 14 7.800 19.878 2.343 1.00 0.00 H new ATOM 0 HB THR A 14 5.202 19.583 3.631 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.671 17.392 3.883 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.471 19.315 1.276 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.644 20.645 1.436 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.164 19.073 0.784 1.00 0.00 H new ATOM 227 N GLY A 15 6.676 20.258 5.417 1.00 0.00 N ATOM 228 CA GLY A 15 6.747 21.186 6.590 1.00 0.00 C ATOM 229 C GLY A 15 6.688 22.639 6.125 1.00 0.00 C ATOM 230 O GLY A 15 7.231 23.527 6.753 1.00 0.00 O ATOM 0 H GLY A 15 6.028 19.478 5.526 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.922 20.983 7.273 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.670 21.012 7.144 1.00 0.00 H new ATOM 234 N LEU A 16 6.024 22.883 5.037 1.00 0.00 N ATOM 235 CA LEU A 16 5.917 24.298 4.536 1.00 0.00 C ATOM 236 C LEU A 16 4.691 24.965 5.142 1.00 0.00 C ATOM 237 O LEU A 16 4.625 26.172 5.276 1.00 0.00 O ATOM 238 CB LEU A 16 5.785 24.294 2.998 1.00 0.00 C ATOM 239 CG LEU A 16 5.651 22.882 2.470 1.00 0.00 C ATOM 240 CD1 LEU A 16 4.239 22.369 2.760 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.891 22.864 0.957 1.00 0.00 C ATOM 0 H LEU A 16 5.551 22.180 4.469 1.00 0.00 H new ATOM 0 HA LEU A 16 6.812 24.849 4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.915 24.881 2.702 1.00 0.00 H new ATOM 0 HB3 LEU A 16 6.658 24.771 2.553 1.00 0.00 H new ATOM 0 HG LEU A 16 6.388 22.245 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.137 21.352 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.063 22.375 3.836 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.510 23.014 2.269 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.793 21.844 0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.157 23.502 0.465 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.894 23.233 0.743 1.00 0.00 H new ATOM 253 N THR A 17 3.710 24.184 5.484 1.00 0.00 N ATOM 254 CA THR A 17 2.466 24.754 6.053 1.00 0.00 C ATOM 255 C THR A 17 1.655 23.671 6.776 1.00 0.00 C ATOM 256 O THR A 17 0.604 23.947 7.322 1.00 0.00 O ATOM 257 CB THR A 17 1.719 25.281 4.813 1.00 0.00 C ATOM 258 OG1 THR A 17 1.311 26.622 5.040 1.00 0.00 O ATOM 259 CG2 THR A 17 0.494 24.422 4.507 1.00 0.00 C ATOM 0 H THR A 17 3.718 23.168 5.393 1.00 0.00 H new ATOM 0 HA THR A 17 2.647 25.530 6.797 1.00 0.00 H new ATOM 0 HB THR A 17 2.395 25.236 3.959 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.837 26.958 4.251 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.016 24.815 3.627 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.808 23.396 4.316 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.186 24.441 5.359 1.00 0.00 H new ATOM 267 N GLN A 18 2.098 22.433 6.752 1.00 0.00 N ATOM 268 CA GLN A 18 1.289 21.355 7.394 1.00 0.00 C ATOM 269 C GLN A 18 -0.108 21.430 6.781 1.00 0.00 C ATOM 270 O GLN A 18 -1.106 21.138 7.409 1.00 0.00 O ATOM 271 CB GLN A 18 1.257 21.669 8.895 1.00 0.00 C ATOM 272 CG GLN A 18 2.632 22.164 9.348 1.00 0.00 C ATOM 273 CD GLN A 18 2.812 21.880 10.841 1.00 0.00 C ATOM 274 OE1 GLN A 18 2.918 20.739 11.246 1.00 0.00 O ATOM 275 NE2 GLN A 18 2.850 22.876 11.682 1.00 0.00 N ATOM 0 H GLN A 18 2.972 22.130 6.322 1.00 0.00 H new ATOM 0 HA GLN A 18 1.693 20.354 7.243 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.501 22.426 9.102 1.00 0.00 H new ATOM 0 HB3 GLN A 18 0.977 20.778 9.457 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.415 21.667 8.776 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.726 23.233 9.157 1.00 0.00 H new ATOM 0 HE21 GLN A 18 2.761 23.834 11.343 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.969 22.697 12.679 1.00 0.00 H new ATOM 284 N VAL A 19 -0.145 21.863 5.537 1.00 0.00 N ATOM 285 CA VAL A 19 -1.418 22.039 4.765 1.00 0.00 C ATOM 286 C VAL A 19 -2.602 21.381 5.477 1.00 0.00 C ATOM 287 O VAL A 19 -3.218 21.958 6.350 1.00 0.00 O ATOM 288 CB VAL A 19 -1.116 21.402 3.383 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.456 20.025 3.547 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.394 21.230 2.548 1.00 0.00 C ATOM 0 H VAL A 19 0.691 22.110 5.008 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.713 23.084 4.667 1.00 0.00 H new ATOM 0 HB VAL A 19 -0.438 22.082 2.867 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.254 19.599 2.564 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.480 20.133 4.095 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.125 19.364 4.098 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.143 20.781 1.587 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.092 20.583 3.080 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.855 22.204 2.384 1.00 0.00 H new ATOM 300 N SER A 20 -2.895 20.178 5.129 1.00 0.00 N ATOM 301 CA SER A 20 -3.982 19.439 5.755 1.00 0.00 C ATOM 302 C SER A 20 -3.388 18.122 6.180 1.00 0.00 C ATOM 303 O SER A 20 -4.083 17.146 6.298 1.00 0.00 O ATOM 304 CB SER A 20 -5.033 19.244 4.660 1.00 0.00 C ATOM 305 OG SER A 20 -6.205 19.988 4.984 1.00 0.00 O ATOM 0 H SER A 20 -2.399 19.660 4.403 1.00 0.00 H new ATOM 0 HA SER A 20 -4.435 19.932 6.615 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.636 19.571 3.699 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.277 18.186 4.561 1.00 0.00 H new ATOM 0 HG SER A 20 -6.934 19.729 4.382 1.00 0.00 H new ATOM 311 N VAL A 21 -2.082 18.078 6.368 1.00 0.00 N ATOM 312 CA VAL A 21 -1.400 16.812 6.760 1.00 0.00 C ATOM 313 C VAL A 21 -2.388 15.904 7.455 1.00 0.00 C ATOM 314 O VAL A 21 -2.425 14.707 7.248 1.00 0.00 O ATOM 315 CB VAL A 21 -0.295 17.238 7.722 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.799 17.979 6.953 1.00 0.00 C ATOM 317 CG2 VAL A 21 -0.862 18.154 8.813 1.00 0.00 C ATOM 0 H VAL A 21 -1.461 18.880 6.263 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.000 16.267 5.905 1.00 0.00 H new ATOM 0 HB VAL A 21 0.125 16.348 8.190 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.587 18.282 7.643 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.217 17.321 6.191 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.374 18.863 6.477 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.062 18.450 9.492 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.295 19.042 8.353 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.633 17.622 9.371 1.00 0.00 H new ATOM 327 N SER A 22 -3.231 16.503 8.231 1.00 0.00 N ATOM 328 CA SER A 22 -4.285 15.726 8.934 1.00 0.00 C ATOM 329 C SER A 22 -5.456 15.494 7.985 1.00 0.00 C ATOM 330 O SER A 22 -6.080 14.456 7.993 1.00 0.00 O ATOM 331 CB SER A 22 -4.707 16.594 10.118 1.00 0.00 C ATOM 332 OG SER A 22 -5.730 15.929 10.848 1.00 0.00 O ATOM 0 H SER A 22 -3.240 17.506 8.414 1.00 0.00 H new ATOM 0 HA SER A 22 -3.936 14.749 9.267 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.851 16.788 10.764 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.066 17.561 9.765 1.00 0.00 H new ATOM 0 HG SER A 22 -6.002 16.483 11.609 1.00 0.00 H new ATOM 338 N LYS A 23 -5.749 16.461 7.163 1.00 0.00 N ATOM 339 CA LYS A 23 -6.868 16.323 6.206 1.00 0.00 C ATOM 340 C LYS A 23 -6.422 15.650 4.905 1.00 0.00 C ATOM 341 O LYS A 23 -7.190 14.941 4.290 1.00 0.00 O ATOM 342 CB LYS A 23 -7.321 17.751 5.956 1.00 0.00 C ATOM 343 CG LYS A 23 -8.476 18.081 6.891 1.00 0.00 C ATOM 344 CD LYS A 23 -7.938 18.743 8.163 1.00 0.00 C ATOM 345 CE LYS A 23 -7.267 20.072 7.808 1.00 0.00 C ATOM 346 NZ LYS A 23 -7.730 21.029 8.851 1.00 0.00 N ATOM 0 H LYS A 23 -5.252 17.350 7.117 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.666 15.691 6.597 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.494 18.442 6.122 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.632 17.870 4.918 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.181 18.747 6.393 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.022 17.172 7.145 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.751 18.912 8.869 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -7.223 18.083 8.654 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.181 19.979 7.812 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -7.555 20.405 6.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -7.311 21.964 8.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -8.767 21.102 8.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -7.436 20.689 9.789 1.00 0.00 H new ATOM 360 N MET A 24 -5.202 15.844 4.467 1.00 0.00 N ATOM 361 CA MET A 24 -4.787 15.171 3.201 1.00 0.00 C ATOM 362 C MET A 24 -4.463 13.704 3.475 1.00 0.00 C ATOM 363 O MET A 24 -4.761 12.853 2.663 1.00 0.00 O ATOM 364 CB MET A 24 -3.561 15.903 2.623 1.00 0.00 C ATOM 365 CG MET A 24 -2.929 16.854 3.634 1.00 0.00 C ATOM 366 SD MET A 24 -1.156 16.869 3.372 1.00 0.00 S ATOM 367 CE MET A 24 -0.957 15.196 3.994 1.00 0.00 C ATOM 0 H MET A 24 -4.494 16.423 4.918 1.00 0.00 H new ATOM 0 HA MET A 24 -5.599 15.209 2.475 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.820 15.170 2.303 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.859 16.463 1.737 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.338 17.858 3.516 1.00 0.00 H new ATOM 0 HG3 MET A 24 -3.159 16.533 4.650 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.063 15.143 4.615 1.00 0.00 H new ATOM 0 HE2 MET A 24 -1.829 14.923 4.588 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.858 14.506 3.156 1.00 0.00 H new ATOM 377 N LEU A 25 -3.876 13.379 4.605 1.00 0.00 N ATOM 378 CA LEU A 25 -3.588 11.940 4.870 1.00 0.00 C ATOM 379 C LEU A 25 -4.857 11.254 5.370 1.00 0.00 C ATOM 380 O LEU A 25 -5.214 10.190 4.900 1.00 0.00 O ATOM 381 CB LEU A 25 -2.479 11.909 5.917 1.00 0.00 C ATOM 382 CG LEU A 25 -1.127 12.304 5.289 1.00 0.00 C ATOM 383 CD1 LEU A 25 -0.037 11.367 5.805 1.00 0.00 C ATOM 384 CD2 LEU A 25 -1.165 12.200 3.757 1.00 0.00 C ATOM 0 H LEU A 25 -3.592 14.032 5.335 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.269 11.409 3.973 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.721 12.592 6.731 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.407 10.911 6.349 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.920 13.337 5.567 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.920 11.644 5.363 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.028 11.447 6.890 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.280 10.340 5.531 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.196 12.486 3.349 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.392 11.174 3.467 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.934 12.866 3.366 1.00 0.00 H new ATOM 396 N ALA A 26 -5.572 11.865 6.283 1.00 0.00 N ATOM 397 CA ALA A 26 -6.843 11.237 6.747 1.00 0.00 C ATOM 398 C ALA A 26 -7.730 11.032 5.524 1.00 0.00 C ATOM 399 O ALA A 26 -8.464 10.069 5.414 1.00 0.00 O ATOM 400 CB ALA A 26 -7.477 12.235 7.715 1.00 0.00 C ATOM 0 H ALA A 26 -5.334 12.756 6.719 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.695 10.275 7.238 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.416 11.830 8.091 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -6.799 12.414 8.549 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.669 13.174 7.196 1.00 0.00 H new ATOM 406 N SER A 27 -7.632 11.925 4.580 1.00 0.00 N ATOM 407 CA SER A 27 -8.432 11.777 3.347 1.00 0.00 C ATOM 408 C SER A 27 -7.661 10.918 2.347 1.00 0.00 C ATOM 409 O SER A 27 -8.242 10.205 1.578 1.00 0.00 O ATOM 410 CB SER A 27 -8.641 13.187 2.811 1.00 0.00 C ATOM 411 OG SER A 27 -9.314 13.966 3.791 1.00 0.00 O ATOM 0 H SER A 27 -7.031 12.749 4.614 1.00 0.00 H new ATOM 0 HA SER A 27 -9.390 11.289 3.528 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.681 13.641 2.565 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.224 13.156 1.891 1.00 0.00 H new ATOM 0 HG SER A 27 -8.676 14.571 4.223 1.00 0.00 H new ATOM 417 N PHE A 28 -6.352 10.970 2.363 1.00 0.00 N ATOM 418 CA PHE A 28 -5.556 10.133 1.406 1.00 0.00 C ATOM 419 C PHE A 28 -5.893 8.663 1.599 1.00 0.00 C ATOM 420 O PHE A 28 -6.195 7.957 0.671 1.00 0.00 O ATOM 421 CB PHE A 28 -4.093 10.392 1.766 1.00 0.00 C ATOM 422 CG PHE A 28 -3.274 9.119 1.656 1.00 0.00 C ATOM 423 CD1 PHE A 28 -2.728 8.738 0.423 1.00 0.00 C ATOM 424 CD2 PHE A 28 -3.025 8.343 2.796 1.00 0.00 C ATOM 425 CE1 PHE A 28 -1.943 7.587 0.334 1.00 0.00 C ATOM 426 CE2 PHE A 28 -2.231 7.197 2.702 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.689 6.820 1.472 1.00 0.00 C ATOM 0 H PHE A 28 -5.800 11.552 2.993 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.769 10.382 0.366 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.681 11.153 1.103 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.028 10.784 2.781 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -2.914 9.334 -0.458 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -3.447 8.631 3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.531 7.289 -0.619 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.036 6.602 3.582 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.074 5.935 1.401 1.00 0.00 H new ATOM 437 N GLU A 29 -5.863 8.202 2.800 1.00 0.00 N ATOM 438 CA GLU A 29 -6.202 6.793 3.048 1.00 0.00 C ATOM 439 C GLU A 29 -7.689 6.654 2.882 1.00 0.00 C ATOM 440 O GLU A 29 -8.191 5.693 2.331 1.00 0.00 O ATOM 441 CB GLU A 29 -5.768 6.555 4.474 1.00 0.00 C ATOM 442 CG GLU A 29 -4.460 5.811 4.432 1.00 0.00 C ATOM 443 CD GLU A 29 -3.597 6.220 5.628 1.00 0.00 C ATOM 444 OE1 GLU A 29 -3.722 5.594 6.667 1.00 0.00 O ATOM 445 OE2 GLU A 29 -2.832 7.159 5.489 1.00 0.00 O ATOM 0 H GLU A 29 -5.616 8.744 3.628 1.00 0.00 H new ATOM 0 HA GLU A 29 -5.726 6.078 2.376 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.654 7.501 5.003 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.520 5.978 5.012 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.641 4.736 4.452 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.936 6.029 3.501 1.00 0.00 H new ATOM 452 N LYS A 30 -8.390 7.649 3.313 1.00 0.00 N ATOM 453 CA LYS A 30 -9.848 7.635 3.139 1.00 0.00 C ATOM 454 C LYS A 30 -10.144 7.785 1.648 1.00 0.00 C ATOM 455 O LYS A 30 -11.224 7.488 1.216 1.00 0.00 O ATOM 456 CB LYS A 30 -10.374 8.830 3.930 1.00 0.00 C ATOM 457 CG LYS A 30 -11.893 8.927 3.772 1.00 0.00 C ATOM 458 CD LYS A 30 -12.450 9.915 4.799 1.00 0.00 C ATOM 459 CE LYS A 30 -12.428 11.329 4.212 1.00 0.00 C ATOM 460 NZ LYS A 30 -13.660 11.982 4.737 1.00 0.00 N ATOM 0 H LYS A 30 -8.012 8.473 3.780 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.317 6.716 3.489 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.115 8.723 4.983 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.903 9.747 3.577 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.144 9.254 2.763 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.347 7.946 3.911 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -13.469 9.638 5.070 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.856 9.880 5.712 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.533 11.870 4.519 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.428 11.304 3.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.716 12.957 4.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.496 11.449 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.629 11.997 5.776 1.00 0.00 H new ATOM 474 N ILE A 31 -9.181 8.220 0.847 1.00 0.00 N ATOM 475 CA ILE A 31 -9.443 8.351 -0.612 1.00 0.00 C ATOM 476 C ILE A 31 -8.721 7.262 -1.373 1.00 0.00 C ATOM 477 O ILE A 31 -9.164 6.816 -2.405 1.00 0.00 O ATOM 478 CB ILE A 31 -8.960 9.717 -1.076 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.470 9.895 -0.839 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.754 10.825 -0.390 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.731 9.834 -2.180 1.00 0.00 C ATOM 0 H ILE A 31 -8.243 8.483 1.149 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.512 8.252 -0.802 1.00 0.00 H new ATOM 0 HB ILE A 31 -9.129 9.781 -2.151 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.280 10.850 -0.349 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.101 9.116 -0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -9.396 11.795 -0.733 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.811 10.721 -0.636 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.623 10.751 0.690 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.662 9.962 -2.012 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.912 8.868 -2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -7.093 10.629 -2.832 1.00 0.00 H new ATOM 493 N ILE A 32 -7.626 6.812 -0.862 1.00 0.00 N ATOM 494 CA ILE A 32 -6.904 5.712 -1.554 1.00 0.00 C ATOM 495 C ILE A 32 -7.818 4.520 -1.538 1.00 0.00 C ATOM 496 O ILE A 32 -8.036 3.861 -2.535 1.00 0.00 O ATOM 497 CB ILE A 32 -5.641 5.407 -0.759 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.701 6.626 -0.795 1.00 0.00 C ATOM 499 CG2 ILE A 32 -4.957 4.198 -1.415 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.525 6.374 -1.743 1.00 0.00 C ATOM 0 H ILE A 32 -7.195 7.150 -0.001 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.632 5.972 -2.577 1.00 0.00 H new ATOM 0 HB ILE A 32 -5.883 5.188 0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.253 7.508 -1.119 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.328 6.834 0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.047 3.954 -0.868 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.633 3.343 -1.396 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.706 4.438 -2.448 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.873 7.247 -1.754 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.962 5.505 -1.402 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.902 6.190 -2.749 1.00 0.00 H new ATOM 512 N THR A 33 -8.390 4.269 -0.404 1.00 0.00 N ATOM 513 CA THR A 33 -9.332 3.158 -0.319 1.00 0.00 C ATOM 514 C THR A 33 -10.662 3.647 -0.911 1.00 0.00 C ATOM 515 O THR A 33 -11.308 2.956 -1.673 1.00 0.00 O ATOM 516 CB THR A 33 -9.401 2.792 1.170 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.361 1.378 1.305 1.00 0.00 O ATOM 518 CG2 THR A 33 -10.680 3.317 1.795 1.00 0.00 C ATOM 0 H THR A 33 -8.240 4.789 0.460 1.00 0.00 H new ATOM 0 HA THR A 33 -9.050 2.265 -0.877 1.00 0.00 H new ATOM 0 HB THR A 33 -8.552 3.245 1.681 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.403 1.139 2.254 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.707 3.046 2.850 1.00 0.00 H new ATOM 0 HG22 THR A 33 -10.713 4.402 1.698 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.539 2.881 1.286 1.00 0.00 H new ATOM 526 N GLU A 34 -11.048 4.862 -0.605 1.00 0.00 N ATOM 527 CA GLU A 34 -12.307 5.409 -1.189 1.00 0.00 C ATOM 528 C GLU A 34 -12.193 5.409 -2.717 1.00 0.00 C ATOM 529 O GLU A 34 -13.153 5.140 -3.408 1.00 0.00 O ATOM 530 CB GLU A 34 -12.430 6.819 -0.590 1.00 0.00 C ATOM 531 CG GLU A 34 -12.120 7.920 -1.601 1.00 0.00 C ATOM 532 CD GLU A 34 -13.304 8.127 -2.543 1.00 0.00 C ATOM 533 OE1 GLU A 34 -14.410 8.268 -2.049 1.00 0.00 O ATOM 534 OE2 GLU A 34 -13.085 8.144 -3.743 1.00 0.00 O ATOM 0 H GLU A 34 -10.547 5.493 0.020 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.198 4.824 -0.960 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -13.440 6.959 -0.206 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -11.751 6.909 0.258 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -11.896 8.850 -1.078 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -11.232 7.656 -2.175 1.00 0.00 H new ATOM 541 N THR A 35 -11.020 5.663 -3.252 1.00 0.00 N ATOM 542 CA THR A 35 -10.862 5.623 -4.734 1.00 0.00 C ATOM 543 C THR A 35 -11.128 4.208 -5.178 1.00 0.00 C ATOM 544 O THR A 35 -11.912 3.969 -6.072 1.00 0.00 O ATOM 545 CB THR A 35 -9.416 6.013 -5.038 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.240 7.403 -4.804 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.107 5.694 -6.507 1.00 0.00 C ATOM 0 H THR A 35 -10.176 5.894 -2.728 1.00 0.00 H new ATOM 0 HA THR A 35 -11.545 6.299 -5.249 1.00 0.00 H new ATOM 0 HB THR A 35 -8.740 5.452 -4.392 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.898 7.541 -3.896 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.076 5.970 -6.730 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.243 4.627 -6.684 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.781 6.258 -7.151 1.00 0.00 H new ATOM 555 N VAL A 36 -10.513 3.258 -4.536 1.00 0.00 N ATOM 556 CA VAL A 36 -10.800 1.852 -4.915 1.00 0.00 C ATOM 557 C VAL A 36 -12.310 1.656 -4.797 1.00 0.00 C ATOM 558 O VAL A 36 -12.929 0.982 -5.596 1.00 0.00 O ATOM 559 CB VAL A 36 -10.041 0.993 -3.906 1.00 0.00 C ATOM 560 CG1 VAL A 36 -10.566 -0.450 -3.932 1.00 0.00 C ATOM 561 CG2 VAL A 36 -8.559 1.010 -4.271 1.00 0.00 C ATOM 0 H VAL A 36 -9.839 3.389 -3.782 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.496 1.590 -5.928 1.00 0.00 H new ATOM 0 HB VAL A 36 -10.186 1.394 -2.903 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -10.016 -1.051 -3.208 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -11.626 -0.456 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -10.430 -0.869 -4.929 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.002 0.401 -3.559 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -8.427 0.607 -5.275 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -8.188 2.035 -4.239 1.00 0.00 H new ATOM 571 N ALA A 37 -12.911 2.297 -3.824 1.00 0.00 N ATOM 572 CA ALA A 37 -14.384 2.204 -3.686 1.00 0.00 C ATOM 573 C ALA A 37 -15.029 3.219 -4.630 1.00 0.00 C ATOM 574 O ALA A 37 -16.231 3.296 -4.756 1.00 0.00 O ATOM 575 CB ALA A 37 -14.707 2.523 -2.234 1.00 0.00 C ATOM 0 H ALA A 37 -12.442 2.875 -3.127 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.764 1.215 -3.944 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.785 2.468 -2.080 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -14.210 1.803 -1.584 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -14.358 3.528 -1.996 1.00 0.00 H new ATOM 581 N LYS A 38 -14.228 3.968 -5.335 1.00 0.00 N ATOM 582 CA LYS A 38 -14.786 4.932 -6.318 1.00 0.00 C ATOM 583 C LYS A 38 -14.532 4.362 -7.701 1.00 0.00 C ATOM 584 O LYS A 38 -15.090 4.795 -8.690 1.00 0.00 O ATOM 585 CB LYS A 38 -14.038 6.251 -6.099 1.00 0.00 C ATOM 586 CG LYS A 38 -15.025 7.434 -6.090 1.00 0.00 C ATOM 587 CD LYS A 38 -16.228 7.158 -5.166 1.00 0.00 C ATOM 588 CE LYS A 38 -15.774 6.467 -3.874 1.00 0.00 C ATOM 589 NZ LYS A 38 -16.582 7.101 -2.796 1.00 0.00 N ATOM 0 H LYS A 38 -13.210 3.953 -5.271 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.857 5.102 -6.207 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.495 6.216 -5.155 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.299 6.392 -6.887 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.510 8.336 -5.760 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.379 7.622 -7.104 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.730 8.095 -4.926 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.954 6.531 -5.684 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.949 5.392 -3.918 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -14.707 6.610 -3.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -16.949 6.365 -2.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -15.985 7.760 -2.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.377 7.621 -3.219 1.00 0.00 H new ATOM 603 N GLY A 39 -13.716 3.347 -7.754 1.00 0.00 N ATOM 604 CA GLY A 39 -13.436 2.679 -9.028 1.00 0.00 C ATOM 605 C GLY A 39 -12.310 3.375 -9.780 1.00 0.00 C ATOM 606 O GLY A 39 -12.406 3.603 -10.972 1.00 0.00 O ATOM 0 H GLY A 39 -13.229 2.955 -6.948 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.166 1.639 -8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.336 2.671 -9.643 1.00 0.00 H new ATOM 610 N ASP A 40 -11.233 3.698 -9.118 1.00 0.00 N ATOM 611 CA ASP A 40 -10.110 4.360 -9.847 1.00 0.00 C ATOM 612 C ASP A 40 -8.817 3.562 -9.652 1.00 0.00 C ATOM 613 O ASP A 40 -8.567 3.012 -8.598 1.00 0.00 O ATOM 614 CB ASP A 40 -9.998 5.763 -9.253 1.00 0.00 C ATOM 615 CG ASP A 40 -10.387 6.798 -10.309 1.00 0.00 C ATOM 616 OD1 ASP A 40 -9.534 7.152 -11.108 1.00 0.00 O ATOM 617 OD2 ASP A 40 -11.532 7.222 -10.301 1.00 0.00 O ATOM 0 H ASP A 40 -11.081 3.537 -8.122 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.287 4.409 -10.921 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.648 5.854 -8.383 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.979 5.944 -8.910 1.00 0.00 H new ATOM 622 N LYS A 41 -8.002 3.490 -10.671 1.00 0.00 N ATOM 623 CA LYS A 41 -6.730 2.720 -10.568 1.00 0.00 C ATOM 624 C LYS A 41 -5.544 3.675 -10.449 1.00 0.00 C ATOM 625 O LYS A 41 -5.049 4.192 -11.432 1.00 0.00 O ATOM 626 CB LYS A 41 -6.641 1.919 -11.871 1.00 0.00 C ATOM 627 CG LYS A 41 -7.907 1.074 -12.050 1.00 0.00 C ATOM 628 CD LYS A 41 -8.825 1.733 -13.084 1.00 0.00 C ATOM 629 CE LYS A 41 -9.469 0.654 -13.958 1.00 0.00 C ATOM 630 NZ LYS A 41 -10.842 0.483 -13.407 1.00 0.00 N ATOM 0 H LYS A 41 -8.165 3.934 -11.575 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.710 2.074 -9.690 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.522 2.596 -12.717 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.762 1.274 -11.853 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.641 0.068 -12.374 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.428 0.975 -11.098 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -9.596 2.317 -12.581 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -8.255 2.425 -13.704 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -9.498 0.959 -15.004 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.906 -0.278 -13.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.348 -0.242 -13.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.782 0.186 -12.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.356 1.385 -13.469 1.00 0.00 H new ATOM 644 N VAL A 42 -5.088 3.913 -9.254 1.00 0.00 N ATOM 645 CA VAL A 42 -3.928 4.843 -9.068 1.00 0.00 C ATOM 646 C VAL A 42 -2.610 4.086 -9.256 1.00 0.00 C ATOM 647 O VAL A 42 -2.584 2.877 -9.369 1.00 0.00 O ATOM 648 CB VAL A 42 -4.009 5.369 -7.626 1.00 0.00 C ATOM 649 CG1 VAL A 42 -3.148 6.627 -7.500 1.00 0.00 C ATOM 650 CG2 VAL A 42 -5.456 5.713 -7.242 1.00 0.00 C ATOM 0 H VAL A 42 -5.463 3.508 -8.396 1.00 0.00 H new ATOM 0 HA VAL A 42 -3.963 5.655 -9.794 1.00 0.00 H new ATOM 0 HB VAL A 42 -3.648 4.589 -6.955 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.202 7.004 -6.479 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.113 6.386 -7.743 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.514 7.389 -8.188 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.482 6.082 -6.217 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.838 6.481 -7.914 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.076 4.820 -7.322 1.00 0.00 H new ATOM 660 N GLN A 43 -1.516 4.798 -9.270 1.00 0.00 N ATOM 661 CA GLN A 43 -0.185 4.143 -9.427 1.00 0.00 C ATOM 662 C GLN A 43 0.899 5.063 -8.860 1.00 0.00 C ATOM 663 O GLN A 43 1.222 6.085 -9.431 1.00 0.00 O ATOM 664 CB GLN A 43 0.005 3.929 -10.934 1.00 0.00 C ATOM 665 CG GLN A 43 -0.322 5.215 -11.700 1.00 0.00 C ATOM 666 CD GLN A 43 0.177 5.086 -13.140 1.00 0.00 C ATOM 667 OE1 GLN A 43 1.173 5.678 -13.506 1.00 0.00 O ATOM 668 NE2 GLN A 43 -0.479 4.330 -13.980 1.00 0.00 N ATOM 0 H GLN A 43 -1.487 5.813 -9.179 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.122 3.195 -8.893 1.00 0.00 H new ATOM 0 HB2 GLN A 43 1.032 3.627 -11.139 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -0.639 3.120 -11.277 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -1.397 5.394 -11.690 1.00 0.00 H new ATOM 0 HG3 GLN A 43 0.148 6.070 -11.215 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.315 3.833 -13.673 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -0.155 4.237 -14.943 1.00 0.00 H new ATOM 677 N LEU A 44 1.447 4.719 -7.728 1.00 0.00 N ATOM 678 CA LEU A 44 2.493 5.591 -7.111 1.00 0.00 C ATOM 679 C LEU A 44 3.796 5.540 -7.911 1.00 0.00 C ATOM 680 O LEU A 44 3.895 4.863 -8.915 1.00 0.00 O ATOM 681 CB LEU A 44 2.697 5.036 -5.696 1.00 0.00 C ATOM 682 CG LEU A 44 1.365 5.036 -4.930 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.637 4.861 -3.437 1.00 0.00 C ATOM 684 CD2 LEU A 44 0.633 6.364 -5.142 1.00 0.00 C ATOM 0 H LEU A 44 1.219 3.875 -7.203 1.00 0.00 H new ATOM 0 HA LEU A 44 2.188 6.637 -7.097 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.095 4.023 -5.749 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.432 5.640 -5.163 1.00 0.00 H new ATOM 0 HG LEU A 44 0.748 4.217 -5.300 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.693 4.861 -2.893 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.153 3.915 -3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.260 5.682 -3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.309 6.352 -4.594 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.253 7.183 -4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.433 6.504 -6.204 1.00 0.00 H new ATOM 696 N THR A 45 4.790 6.271 -7.462 1.00 0.00 N ATOM 697 CA THR A 45 6.116 6.311 -8.162 1.00 0.00 C ATOM 698 C THR A 45 6.428 4.979 -8.844 1.00 0.00 C ATOM 699 O THR A 45 6.889 4.943 -9.968 1.00 0.00 O ATOM 700 CB THR A 45 7.146 6.594 -7.060 1.00 0.00 C ATOM 701 OG1 THR A 45 8.453 6.397 -7.581 1.00 0.00 O ATOM 702 CG2 THR A 45 6.923 5.650 -5.876 1.00 0.00 C ATOM 0 H THR A 45 4.737 6.852 -6.625 1.00 0.00 H new ATOM 0 HA THR A 45 6.125 7.068 -8.946 1.00 0.00 H new ATOM 0 HB THR A 45 7.033 7.623 -6.719 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.115 6.578 -6.881 1.00 0.00 H new ATOM 0 HG21 THR A 45 7.659 5.859 -5.100 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.921 5.800 -5.475 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.030 4.618 -6.209 1.00 0.00 H new ATOM 710 N GLY A 46 6.179 3.885 -8.178 1.00 0.00 N ATOM 711 CA GLY A 46 6.464 2.568 -8.807 1.00 0.00 C ATOM 712 C GLY A 46 6.277 1.426 -7.805 1.00 0.00 C ATOM 713 O GLY A 46 6.846 0.366 -7.972 1.00 0.00 O ATOM 0 H GLY A 46 5.794 3.847 -7.234 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.803 2.419 -9.661 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.485 2.557 -9.189 1.00 0.00 H new ATOM 717 N PHE A 47 5.479 1.604 -6.777 1.00 0.00 N ATOM 718 CA PHE A 47 5.286 0.477 -5.820 1.00 0.00 C ATOM 719 C PHE A 47 3.803 0.178 -5.598 1.00 0.00 C ATOM 720 O PHE A 47 3.384 -0.958 -5.672 1.00 0.00 O ATOM 721 CB PHE A 47 6.008 0.858 -4.511 1.00 0.00 C ATOM 722 CG PHE A 47 5.392 2.065 -3.823 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.779 3.358 -4.196 1.00 0.00 C ATOM 724 CD2 PHE A 47 4.476 1.893 -2.773 1.00 0.00 C ATOM 725 CE1 PHE A 47 5.254 4.467 -3.530 1.00 0.00 C ATOM 726 CE2 PHE A 47 3.948 3.006 -2.115 1.00 0.00 C ATOM 727 CZ PHE A 47 4.338 4.293 -2.492 1.00 0.00 C ATOM 0 H PHE A 47 4.966 2.460 -6.566 1.00 0.00 H new ATOM 0 HA PHE A 47 5.711 -0.443 -6.221 1.00 0.00 H new ATOM 0 HB2 PHE A 47 5.986 0.008 -3.829 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.056 1.066 -4.728 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.485 3.498 -5.001 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.179 0.899 -2.474 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.558 5.462 -3.819 1.00 0.00 H new ATOM 0 HE2 PHE A 47 3.237 2.871 -1.313 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.931 5.153 -1.981 1.00 0.00 H new ATOM 737 N LEU A 48 3.004 1.162 -5.320 1.00 0.00 N ATOM 738 CA LEU A 48 1.563 0.883 -5.085 1.00 0.00 C ATOM 739 C LEU A 48 0.712 1.107 -6.335 1.00 0.00 C ATOM 740 O LEU A 48 0.508 2.217 -6.785 1.00 0.00 O ATOM 741 CB LEU A 48 1.180 1.842 -3.975 1.00 0.00 C ATOM 742 CG LEU A 48 0.816 1.067 -2.710 1.00 0.00 C ATOM 743 CD1 LEU A 48 -0.612 0.532 -2.845 1.00 0.00 C ATOM 744 CD2 LEU A 48 1.783 -0.108 -2.489 1.00 0.00 C ATOM 0 H LEU A 48 3.281 2.141 -5.245 1.00 0.00 H new ATOM 0 HA LEU A 48 1.390 -0.161 -4.822 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.008 2.520 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 48 0.336 2.456 -4.290 1.00 0.00 H new ATOM 0 HG LEU A 48 0.889 1.738 -1.854 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.879 -0.023 -1.946 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -1.302 1.366 -2.976 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.673 -0.128 -3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.503 -0.644 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.733 -0.786 -3.341 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.800 0.272 -2.387 1.00 0.00 H new ATOM 756 N ASN A 49 0.210 0.036 -6.881 1.00 0.00 N ATOM 757 CA ASN A 49 -0.653 0.115 -8.100 1.00 0.00 C ATOM 758 C ASN A 49 -2.123 -0.133 -7.712 1.00 0.00 C ATOM 759 O ASN A 49 -2.707 -1.114 -8.122 1.00 0.00 O ATOM 760 CB ASN A 49 -0.139 -1.034 -8.978 1.00 0.00 C ATOM 761 CG ASN A 49 -0.058 -0.573 -10.435 1.00 0.00 C ATOM 762 OD1 ASN A 49 -0.985 0.021 -10.948 1.00 0.00 O ATOM 763 ND2 ASN A 49 1.019 -0.825 -11.127 1.00 0.00 N ATOM 0 H ASN A 49 0.362 -0.910 -6.530 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.610 1.084 -8.598 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.843 -1.356 -8.633 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.804 -1.894 -8.895 1.00 0.00 H new ATOM 0 HD21 ASN A 49 1.083 -0.523 -12.099 1.00 0.00 H new ATOM 0 HD22 ASN A 49 1.797 -1.324 -10.696 1.00 0.00 H new ATOM 770 N ILE A 50 -2.713 0.721 -6.899 1.00 0.00 N ATOM 771 CA ILE A 50 -4.135 0.479 -6.443 1.00 0.00 C ATOM 772 C ILE A 50 -5.118 0.357 -7.613 1.00 0.00 C ATOM 773 O ILE A 50 -5.157 1.183 -8.502 1.00 0.00 O ATOM 774 CB ILE A 50 -4.519 1.643 -5.509 1.00 0.00 C ATOM 775 CG1 ILE A 50 -4.963 2.855 -6.310 1.00 0.00 C ATOM 776 CG2 ILE A 50 -3.339 2.027 -4.611 1.00 0.00 C ATOM 777 CD1 ILE A 50 -6.482 2.788 -6.512 1.00 0.00 C ATOM 0 H ILE A 50 -2.279 1.568 -6.533 1.00 0.00 H new ATOM 0 HA ILE A 50 -4.192 -0.475 -5.919 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.348 1.309 -4.885 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.692 3.772 -5.787 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.455 2.876 -7.274 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.631 2.851 -3.959 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -3.049 1.169 -4.004 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.496 2.335 -5.230 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -6.811 3.654 -7.086 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -6.737 1.876 -7.052 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.978 2.786 -5.542 1.00 0.00 H new ATOM 789 N LYS A 51 -5.926 -0.685 -7.598 1.00 0.00 N ATOM 790 CA LYS A 51 -6.935 -0.892 -8.678 1.00 0.00 C ATOM 791 C LYS A 51 -7.797 -2.126 -8.320 1.00 0.00 C ATOM 792 O LYS A 51 -7.307 -3.235 -8.273 1.00 0.00 O ATOM 793 CB LYS A 51 -6.123 -1.077 -9.982 1.00 0.00 C ATOM 794 CG LYS A 51 -5.860 -2.555 -10.292 1.00 0.00 C ATOM 795 CD LYS A 51 -7.068 -3.143 -11.032 1.00 0.00 C ATOM 796 CE LYS A 51 -6.597 -4.218 -12.013 1.00 0.00 C ATOM 797 NZ LYS A 51 -6.446 -3.509 -13.314 1.00 0.00 N ATOM 0 H LYS A 51 -5.924 -1.403 -6.874 1.00 0.00 H new ATOM 0 HA LYS A 51 -7.625 -0.057 -8.798 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.664 -0.623 -10.813 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.173 -0.551 -9.895 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.962 -2.656 -10.901 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.682 -3.106 -9.368 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -7.771 -3.571 -10.318 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.598 -2.355 -11.567 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.654 -4.660 -11.692 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.321 -5.030 -12.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.125 -4.181 -14.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.361 -3.104 -13.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -5.746 -2.746 -13.214 1.00 0.00 H new ATOM 811 N PRO A 52 -9.053 -1.889 -8.030 1.00 0.00 N ATOM 812 CA PRO A 52 -9.962 -2.988 -7.637 1.00 0.00 C ATOM 813 C PRO A 52 -10.674 -3.589 -8.855 1.00 0.00 C ATOM 814 O PRO A 52 -10.828 -2.945 -9.875 1.00 0.00 O ATOM 815 CB PRO A 52 -10.972 -2.285 -6.740 1.00 0.00 C ATOM 816 CG PRO A 52 -10.977 -0.846 -7.183 1.00 0.00 C ATOM 817 CD PRO A 52 -9.742 -0.599 -8.021 1.00 0.00 C ATOM 0 HA PRO A 52 -9.439 -3.816 -7.157 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.962 -2.729 -6.842 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.690 -2.371 -5.691 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -11.876 -0.630 -7.760 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.987 -0.183 -6.318 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.002 -0.279 -9.030 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.118 0.183 -7.590 1.00 0.00 H new ATOM 825 N VAL A 53 -11.125 -4.814 -8.747 1.00 0.00 N ATOM 826 CA VAL A 53 -11.849 -5.445 -9.893 1.00 0.00 C ATOM 827 C VAL A 53 -13.046 -6.268 -9.404 1.00 0.00 C ATOM 828 O VAL A 53 -12.907 -7.247 -8.704 1.00 0.00 O ATOM 829 CB VAL A 53 -10.825 -6.322 -10.602 1.00 0.00 C ATOM 830 CG1 VAL A 53 -9.656 -5.456 -11.079 1.00 0.00 C ATOM 831 CG2 VAL A 53 -10.306 -7.388 -9.638 1.00 0.00 C ATOM 0 H VAL A 53 -11.024 -5.402 -7.919 1.00 0.00 H new ATOM 0 HA VAL A 53 -12.258 -4.693 -10.568 1.00 0.00 H new ATOM 0 HB VAL A 53 -11.295 -6.806 -11.458 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -8.922 -6.082 -11.587 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.024 -4.696 -11.769 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.188 -4.972 -10.222 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.574 -8.014 -10.148 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.837 -6.906 -8.780 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -11.137 -8.006 -9.297 1.00 0.00 H new ATOM 841 N ALA A 54 -14.222 -5.846 -9.762 1.00 0.00 N ATOM 842 CA ALA A 54 -15.464 -6.554 -9.312 1.00 0.00 C ATOM 843 C ALA A 54 -15.459 -8.038 -9.706 1.00 0.00 C ATOM 844 O ALA A 54 -15.662 -8.384 -10.852 1.00 0.00 O ATOM 845 CB ALA A 54 -16.622 -5.818 -9.996 1.00 0.00 C ATOM 0 H ALA A 54 -14.385 -5.032 -10.354 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.547 -6.539 -8.225 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.566 -6.282 -9.712 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -16.623 -4.773 -9.685 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.501 -5.874 -11.078 1.00 0.00 H new ATOM 1164 N VAL A 75 -15.022 -7.299 -4.528 1.00 0.00 N ATOM 1165 CA VAL A 75 -14.210 -6.771 -5.663 1.00 0.00 C ATOM 1166 C VAL A 75 -12.829 -7.417 -5.578 1.00 0.00 C ATOM 1167 O VAL A 75 -12.543 -8.140 -4.643 1.00 0.00 O ATOM 1168 CB VAL A 75 -14.166 -5.238 -5.491 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.814 -4.797 -4.921 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -14.363 -4.565 -6.852 1.00 0.00 C ATOM 0 HA VAL A 75 -14.622 -7.000 -6.646 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.960 -4.947 -4.803 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.803 -3.713 -4.807 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.659 -5.265 -3.949 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -12.017 -5.098 -5.601 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -14.332 -3.482 -6.730 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -13.569 -4.877 -7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -15.329 -4.856 -7.265 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.980 -7.197 -6.535 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.642 -7.846 -6.471 1.00 0.00 C ATOM 1182 C GLY A 76 -9.560 -6.781 -6.423 1.00 0.00 C ATOM 1183 O GLY A 76 -9.160 -6.245 -7.437 1.00 0.00 O ATOM 0 H GLY A 76 -12.147 -6.605 -7.349 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.578 -8.484 -5.589 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.496 -8.488 -7.340 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.077 -6.476 -5.252 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.007 -5.451 -5.144 1.00 0.00 C ATOM 1189 C VAL A 77 -6.764 -5.957 -5.892 1.00 0.00 C ATOM 1190 O VAL A 77 -5.853 -6.534 -5.330 1.00 0.00 O ATOM 1191 CB VAL A 77 -7.757 -5.282 -3.638 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -7.431 -6.635 -3.000 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -6.594 -4.316 -3.410 1.00 0.00 C ATOM 0 H VAL A 77 -9.376 -6.891 -4.369 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.272 -4.492 -5.588 1.00 0.00 H new ATOM 0 HB VAL A 77 -8.659 -4.879 -3.177 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.256 -6.501 -1.933 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -8.268 -7.318 -3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.537 -7.051 -3.465 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.422 -4.200 -2.340 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.695 -4.712 -3.882 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.836 -3.346 -3.846 1.00 0.00 H new ATOM 1203 N SER A 78 -6.758 -5.734 -7.171 1.00 0.00 N ATOM 1204 CA SER A 78 -5.642 -6.164 -8.065 1.00 0.00 C ATOM 1205 C SER A 78 -4.305 -5.591 -7.601 1.00 0.00 C ATOM 1206 O SER A 78 -3.281 -6.244 -7.659 1.00 0.00 O ATOM 1207 CB SER A 78 -6.002 -5.631 -9.451 1.00 0.00 C ATOM 1208 OG SER A 78 -6.113 -6.722 -10.358 1.00 0.00 O ATOM 0 H SER A 78 -7.512 -5.250 -7.658 1.00 0.00 H new ATOM 0 HA SER A 78 -5.527 -7.248 -8.060 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.942 -5.080 -9.409 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.239 -4.933 -9.795 1.00 0.00 H new ATOM 0 HG SER A 78 -7.019 -6.747 -10.730 1.00 0.00 H new ATOM 1214 N VAL A 79 -4.295 -4.342 -7.252 1.00 0.00 N ATOM 1215 CA VAL A 79 -3.017 -3.652 -6.902 1.00 0.00 C ATOM 1216 C VAL A 79 -2.116 -4.453 -5.965 1.00 0.00 C ATOM 1217 O VAL A 79 -2.473 -5.486 -5.433 1.00 0.00 O ATOM 1218 CB VAL A 79 -3.511 -2.422 -6.126 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -4.589 -2.843 -5.124 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -2.361 -1.758 -5.345 1.00 0.00 C ATOM 0 H VAL A 79 -5.127 -3.755 -7.191 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.423 -3.464 -7.797 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.912 -1.712 -6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.937 -1.968 -4.575 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.426 -3.293 -5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.172 -3.568 -4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.741 -0.890 -4.806 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -1.943 -2.472 -4.635 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -1.584 -1.441 -6.041 1.00 0.00 H new ATOM 1230 N LYS A 80 -0.930 -3.932 -5.779 1.00 0.00 N ATOM 1231 CA LYS A 80 0.080 -4.556 -4.906 1.00 0.00 C ATOM 1232 C LYS A 80 1.348 -3.699 -4.953 1.00 0.00 C ATOM 1233 O LYS A 80 1.447 -2.794 -5.758 1.00 0.00 O ATOM 1234 CB LYS A 80 0.363 -5.932 -5.536 1.00 0.00 C ATOM 1235 CG LYS A 80 0.257 -5.883 -7.072 1.00 0.00 C ATOM 1236 CD LYS A 80 1.179 -4.797 -7.635 1.00 0.00 C ATOM 1237 CE LYS A 80 1.500 -5.105 -9.099 1.00 0.00 C ATOM 1238 NZ LYS A 80 2.748 -4.346 -9.388 1.00 0.00 N ATOM 0 H LYS A 80 -0.620 -3.066 -6.219 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.248 -4.646 -3.870 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.360 -6.266 -5.250 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -0.343 -6.664 -5.145 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.526 -6.852 -7.493 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.773 -5.683 -7.366 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.700 -3.821 -7.555 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.099 -4.749 -7.053 1.00 0.00 H new ATOM 0 HE2 LYS A 80 1.643 -6.174 -9.255 1.00 0.00 H new ATOM 0 HE3 LYS A 80 0.687 -4.793 -9.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.032 -4.507 -10.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.580 -3.331 -9.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.506 -4.669 -8.753 1.00 0.00 H new ATOM 1252 N PRO A 81 2.303 -4.046 -4.145 1.00 0.00 N ATOM 1253 CA PRO A 81 3.601 -3.341 -4.164 1.00 0.00 C ATOM 1254 C PRO A 81 4.306 -3.622 -5.493 1.00 0.00 C ATOM 1255 O PRO A 81 4.081 -4.636 -6.125 1.00 0.00 O ATOM 1256 CB PRO A 81 4.359 -3.949 -2.988 1.00 0.00 C ATOM 1257 CG PRO A 81 3.720 -5.281 -2.789 1.00 0.00 C ATOM 1258 CD PRO A 81 2.267 -5.091 -3.129 1.00 0.00 C ATOM 0 HA PRO A 81 3.520 -2.257 -4.077 1.00 0.00 H new ATOM 0 HB2 PRO A 81 5.422 -4.046 -3.207 1.00 0.00 H new ATOM 0 HB3 PRO A 81 4.273 -3.329 -2.096 1.00 0.00 H new ATOM 0 HG2 PRO A 81 4.177 -6.034 -3.431 1.00 0.00 H new ATOM 0 HG3 PRO A 81 3.840 -5.623 -1.761 1.00 0.00 H new ATOM 0 HD2 PRO A 81 1.818 -6.009 -3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.685 -4.788 -2.259 1.00 0.00 H new ATOM 1266 N GLY A 82 5.151 -2.735 -5.917 1.00 0.00 N ATOM 1267 CA GLY A 82 5.876 -2.935 -7.206 1.00 0.00 C ATOM 1268 C GLY A 82 7.366 -2.955 -6.915 1.00 0.00 C ATOM 1269 O GLY A 82 7.958 -4.002 -6.730 1.00 0.00 O ATOM 0 H GLY A 82 5.377 -1.870 -5.426 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.568 -3.870 -7.674 1.00 0.00 H new ATOM 0 HA3 GLY A 82 5.636 -2.134 -7.905 1.00 0.00 H new ATOM 1273 N GLU A 83 7.974 -1.807 -6.829 1.00 0.00 N ATOM 1274 CA GLU A 83 9.422 -1.761 -6.495 1.00 0.00 C ATOM 1275 C GLU A 83 9.588 -2.013 -5.017 1.00 0.00 C ATOM 1276 O GLU A 83 10.381 -1.371 -4.367 1.00 0.00 O ATOM 1277 CB GLU A 83 9.887 -0.356 -6.836 1.00 0.00 C ATOM 1278 CG GLU A 83 11.398 -0.295 -6.656 1.00 0.00 C ATOM 1279 CD GLU A 83 11.983 0.804 -7.546 1.00 0.00 C ATOM 1280 OE1 GLU A 83 11.890 1.959 -7.165 1.00 0.00 O ATOM 1281 OE2 GLU A 83 12.512 0.470 -8.593 1.00 0.00 O ATOM 0 H GLU A 83 7.531 -0.900 -6.975 1.00 0.00 H new ATOM 0 HA GLU A 83 9.996 -2.509 -7.041 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.616 -0.105 -7.862 1.00 0.00 H new ATOM 0 HB3 GLU A 83 9.398 0.373 -6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.641 -0.098 -5.612 1.00 0.00 H new ATOM 0 HG3 GLU A 83 11.843 -1.257 -6.911 1.00 0.00 H new ATOM 1288 N SER A 84 8.867 -2.980 -4.508 1.00 0.00 N ATOM 1289 CA SER A 84 8.939 -3.374 -3.072 1.00 0.00 C ATOM 1290 C SER A 84 9.796 -2.405 -2.311 1.00 0.00 C ATOM 1291 O SER A 84 10.743 -2.766 -1.640 1.00 0.00 O ATOM 1292 CB SER A 84 9.539 -4.779 -3.063 1.00 0.00 C ATOM 1293 OG SER A 84 8.506 -5.729 -2.834 1.00 0.00 O ATOM 0 H SER A 84 8.206 -3.533 -5.054 1.00 0.00 H new ATOM 0 HA SER A 84 7.961 -3.364 -2.591 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.032 -4.983 -4.014 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.300 -4.857 -2.286 1.00 0.00 H new ATOM 0 HG SER A 84 8.360 -5.828 -1.870 1.00 0.00 H new ATOM 1299 N LEU A 85 9.615 -1.144 -2.538 1.00 0.00 N ATOM 1300 CA LEU A 85 10.599 -0.212 -1.931 1.00 0.00 C ATOM 1301 C LEU A 85 11.820 -1.083 -1.634 1.00 0.00 C ATOM 1302 O LEU A 85 12.624 -0.833 -0.776 1.00 0.00 O ATOM 1303 CB LEU A 85 9.966 0.331 -0.638 1.00 0.00 C ATOM 1304 CG LEU A 85 8.438 0.159 -0.657 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.837 0.775 0.607 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.844 0.858 -1.882 1.00 0.00 C ATOM 0 H LEU A 85 8.866 -0.727 -3.091 1.00 0.00 H new ATOM 0 HA LEU A 85 10.875 0.635 -2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.384 -0.192 0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 85 10.215 1.386 -0.522 1.00 0.00 H new ATOM 0 HG LEU A 85 8.205 -0.905 -0.699 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.754 0.652 0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.247 0.276 1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.081 1.837 0.646 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.762 0.730 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 85 8.083 1.921 -1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.264 0.422 -2.789 1.00 0.00 H new ATOM 1318 N LYS A 86 11.925 -2.112 -2.474 1.00 0.00 N ATOM 1319 CA LYS A 86 13.038 -3.087 -2.491 1.00 0.00 C ATOM 1320 C LYS A 86 14.223 -2.254 -2.809 1.00 0.00 C ATOM 1321 O LYS A 86 15.281 -2.321 -2.217 1.00 0.00 O ATOM 1322 CB LYS A 86 12.656 -3.950 -3.701 1.00 0.00 C ATOM 1323 CG LYS A 86 13.848 -4.739 -4.242 1.00 0.00 C ATOM 1324 CD LYS A 86 13.753 -4.761 -5.773 1.00 0.00 C ATOM 1325 CE LYS A 86 14.975 -5.474 -6.355 1.00 0.00 C ATOM 1326 NZ LYS A 86 14.512 -6.033 -7.655 1.00 0.00 N ATOM 0 H LYS A 86 11.221 -2.304 -3.187 1.00 0.00 H new ATOM 0 HA LYS A 86 13.220 -3.681 -1.596 1.00 0.00 H new ATOM 0 HB2 LYS A 86 11.863 -4.641 -3.417 1.00 0.00 H new ATOM 0 HB3 LYS A 86 12.256 -3.312 -4.489 1.00 0.00 H new ATOM 0 HG2 LYS A 86 14.784 -4.278 -3.926 1.00 0.00 H new ATOM 0 HG3 LYS A 86 13.843 -5.755 -3.846 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.841 -5.271 -6.083 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.696 -3.743 -6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 86 15.805 -4.782 -6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 86 15.326 -6.262 -5.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 15.296 -6.538 -8.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 13.726 -6.693 -7.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 14.190 -5.259 -8.271 1.00 0.00 H new ATOM 1340 N LYS A 87 13.968 -1.390 -3.728 1.00 0.00 N ATOM 1341 CA LYS A 87 14.955 -0.423 -4.119 1.00 0.00 C ATOM 1342 C LYS A 87 15.113 0.483 -2.910 1.00 0.00 C ATOM 1343 O LYS A 87 16.199 0.931 -2.556 1.00 0.00 O ATOM 1344 CB LYS A 87 14.295 0.299 -5.293 1.00 0.00 C ATOM 1345 CG LYS A 87 15.319 1.185 -6.007 1.00 0.00 C ATOM 1346 CD LYS A 87 16.031 0.373 -7.091 1.00 0.00 C ATOM 1347 CE LYS A 87 17.172 1.205 -7.685 1.00 0.00 C ATOM 1348 NZ LYS A 87 18.091 0.210 -8.304 1.00 0.00 N ATOM 0 H LYS A 87 13.082 -1.326 -4.230 1.00 0.00 H new ATOM 0 HA LYS A 87 15.934 -0.804 -4.408 1.00 0.00 H new ATOM 0 HB2 LYS A 87 13.882 -0.428 -5.992 1.00 0.00 H new ATOM 0 HB3 LYS A 87 13.463 0.906 -4.936 1.00 0.00 H new ATOM 0 HG2 LYS A 87 14.822 2.047 -6.451 1.00 0.00 H new ATOM 0 HG3 LYS A 87 16.045 1.570 -5.291 1.00 0.00 H new ATOM 0 HD2 LYS A 87 16.423 -0.552 -6.669 1.00 0.00 H new ATOM 0 HD3 LYS A 87 15.325 0.093 -7.873 1.00 0.00 H new ATOM 0 HE2 LYS A 87 16.800 1.913 -8.425 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.680 1.786 -6.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 18.899 0.704 -8.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 18.434 -0.447 -7.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 17.582 -0.323 -9.038 1.00 0.00 H new ATOM 1362 N ALA A 88 14.015 0.713 -2.222 1.00 0.00 N ATOM 1363 CA ALA A 88 14.110 1.552 -1.011 1.00 0.00 C ATOM 1364 C ALA A 88 14.830 0.754 0.071 1.00 0.00 C ATOM 1365 O ALA A 88 15.490 1.293 0.932 1.00 0.00 O ATOM 1366 CB ALA A 88 12.668 1.857 -0.623 1.00 0.00 C ATOM 0 H ALA A 88 13.085 0.360 -2.450 1.00 0.00 H new ATOM 0 HA ALA A 88 14.668 2.476 -1.160 1.00 0.00 H new ATOM 0 HB1 ALA A 88 12.656 2.479 0.272 1.00 0.00 H new ATOM 0 HB2 ALA A 88 12.176 2.386 -1.439 1.00 0.00 H new ATOM 0 HB3 ALA A 88 12.140 0.925 -0.424 1.00 0.00 H new ATOM 1372 N ALA A 89 14.726 -0.540 0.020 1.00 0.00 N ATOM 1373 CA ALA A 89 15.414 -1.374 1.039 1.00 0.00 C ATOM 1374 C ALA A 89 16.905 -1.102 0.988 1.00 0.00 C ATOM 1375 O ALA A 89 17.519 -0.801 1.993 1.00 0.00 O ATOM 1376 CB ALA A 89 15.090 -2.817 0.670 1.00 0.00 C ATOM 0 H ALA A 89 14.196 -1.057 -0.681 1.00 0.00 H new ATOM 0 HA ALA A 89 15.089 -1.156 2.056 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.567 -3.491 1.382 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.011 -2.966 0.697 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.461 -3.028 -0.333 1.00 0.00 H new ATOM 1382 N GLU A 90 17.490 -1.150 -0.175 1.00 0.00 N ATOM 1383 CA GLU A 90 18.937 -0.827 -0.261 1.00 0.00 C ATOM 1384 C GLU A 90 19.114 0.582 0.315 1.00 0.00 C ATOM 1385 O GLU A 90 20.148 0.930 0.851 1.00 0.00 O ATOM 1386 CB GLU A 90 19.292 -0.898 -1.757 1.00 0.00 C ATOM 1387 CG GLU A 90 19.144 0.477 -2.420 1.00 0.00 C ATOM 1388 CD GLU A 90 18.952 0.299 -3.927 1.00 0.00 C ATOM 1389 OE1 GLU A 90 19.882 -0.154 -4.573 1.00 0.00 O ATOM 1390 OE2 GLU A 90 17.877 0.616 -4.408 1.00 0.00 O ATOM 0 H GLU A 90 17.037 -1.395 -1.055 1.00 0.00 H new ATOM 0 HA GLU A 90 19.586 -1.504 0.295 1.00 0.00 H new ATOM 0 HB2 GLU A 90 20.315 -1.255 -1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.643 -1.618 -2.255 1.00 0.00 H new ATOM 0 HG2 GLU A 90 18.292 1.008 -1.994 1.00 0.00 H new ATOM 0 HG3 GLU A 90 20.028 1.084 -2.224 1.00 0.00 H new ATOM 1397 N GLY A 91 18.079 1.385 0.212 1.00 0.00 N ATOM 1398 CA GLY A 91 18.140 2.769 0.756 1.00 0.00 C ATOM 1399 C GLY A 91 18.200 2.760 2.298 1.00 0.00 C ATOM 1400 O GLY A 91 18.809 3.630 2.890 1.00 0.00 O ATOM 0 H GLY A 91 17.194 1.134 -0.228 1.00 0.00 H new ATOM 0 HA2 GLY A 91 19.016 3.281 0.358 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.266 3.331 0.427 1.00 0.00 H new ATOM 1404 N LEU A 92 17.581 1.804 2.972 1.00 0.00 N ATOM 1405 CA LEU A 92 17.642 1.813 4.475 1.00 0.00 C ATOM 1406 C LEU A 92 18.909 1.132 4.973 1.00 0.00 C ATOM 1407 O LEU A 92 18.955 0.651 6.087 1.00 0.00 O ATOM 1408 CB LEU A 92 16.401 1.037 4.963 1.00 0.00 C ATOM 1409 CG LEU A 92 16.659 -0.481 4.959 1.00 0.00 C ATOM 1410 CD1 LEU A 92 16.929 -0.967 6.389 1.00 0.00 C ATOM 1411 CD2 LEU A 92 15.427 -1.206 4.408 1.00 0.00 C ATOM 0 H LEU A 92 17.050 1.039 2.556 1.00 0.00 H new ATOM 0 HA LEU A 92 17.655 2.835 4.855 1.00 0.00 H new ATOM 0 HB2 LEU A 92 16.138 1.362 5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 92 15.550 1.266 4.322 1.00 0.00 H new ATOM 0 HG LEU A 92 17.525 -0.694 4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.111 -2.042 6.380 1.00 0.00 H new ATOM 0 HD12 LEU A 92 17.804 -0.454 6.788 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.064 -0.751 7.016 1.00 0.00 H new ATOM 0 HD21 LEU A 92 15.609 -2.281 4.405 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.564 -0.986 5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.231 -0.868 3.390 1.00 0.00 H new ATOM 1423 N LYS A 93 19.925 1.045 4.160 1.00 0.00 N ATOM 1424 CA LYS A 93 21.152 0.332 4.614 1.00 0.00 C ATOM 1425 C LYS A 93 20.707 -1.062 5.042 1.00 0.00 C ATOM 1426 O LYS A 93 21.159 -1.617 6.027 1.00 0.00 O ATOM 1427 CB LYS A 93 21.703 1.133 5.799 1.00 0.00 C ATOM 1428 CG LYS A 93 22.736 2.145 5.298 1.00 0.00 C ATOM 1429 CD LYS A 93 24.003 1.409 4.851 1.00 0.00 C ATOM 1430 CE LYS A 93 25.229 2.056 5.500 1.00 0.00 C ATOM 1431 NZ LYS A 93 26.328 1.881 4.508 1.00 0.00 N ATOM 0 H LYS A 93 19.960 1.430 3.216 1.00 0.00 H new ATOM 0 HA LYS A 93 21.924 0.243 3.849 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.891 1.650 6.311 1.00 0.00 H new ATOM 0 HB3 LYS A 93 22.160 0.460 6.525 1.00 0.00 H new ATOM 0 HG2 LYS A 93 22.325 2.719 4.467 1.00 0.00 H new ATOM 0 HG3 LYS A 93 22.976 2.856 6.088 1.00 0.00 H new ATOM 0 HD2 LYS A 93 23.943 0.357 5.132 1.00 0.00 H new ATOM 0 HD3 LYS A 93 24.092 1.445 3.765 1.00 0.00 H new ATOM 0 HE2 LYS A 93 25.053 3.111 5.712 1.00 0.00 H new ATOM 0 HE3 LYS A 93 25.473 1.577 6.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 27.240 2.095 4.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 26.333 0.899 4.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 26.178 2.527 3.706 1.00 0.00 H new ATOM 1445 N TYR A 94 19.775 -1.601 4.297 1.00 0.00 N ATOM 1446 CA TYR A 94 19.212 -2.945 4.595 1.00 0.00 C ATOM 1447 C TYR A 94 20.285 -3.865 5.197 1.00 0.00 C ATOM 1448 O TYR A 94 20.028 -4.608 6.124 1.00 0.00 O ATOM 1449 CB TYR A 94 18.742 -3.458 3.235 1.00 0.00 C ATOM 1450 CG TYR A 94 18.881 -4.945 3.217 1.00 0.00 C ATOM 1451 CD1 TYR A 94 17.917 -5.737 3.834 1.00 0.00 C ATOM 1452 CD2 TYR A 94 19.997 -5.521 2.623 1.00 0.00 C ATOM 1453 CE1 TYR A 94 18.067 -7.128 3.844 1.00 0.00 C ATOM 1454 CE2 TYR A 94 20.155 -6.910 2.641 1.00 0.00 C ATOM 1455 CZ TYR A 94 19.187 -7.714 3.249 1.00 0.00 C ATOM 1456 OH TYR A 94 19.341 -9.086 3.268 1.00 0.00 O ATOM 0 H TYR A 94 19.374 -1.150 3.475 1.00 0.00 H new ATOM 0 HA TYR A 94 18.406 -2.912 5.328 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.705 -3.172 3.060 1.00 0.00 H new ATOM 0 HB3 TYR A 94 19.335 -3.012 2.436 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.058 -5.280 4.303 1.00 0.00 H new ATOM 0 HD2 TYR A 94 20.740 -4.898 2.149 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.317 -7.749 4.312 1.00 0.00 H new ATOM 0 HE2 TYR A 94 21.024 -7.361 2.186 1.00 0.00 H new ATOM 0 HH TYR A 94 20.173 -9.328 2.810 1.00 0.00 H new ATOM 1466 N GLU A 95 21.484 -3.815 4.678 1.00 0.00 N ATOM 1467 CA GLU A 95 22.572 -4.681 5.224 1.00 0.00 C ATOM 1468 C GLU A 95 22.713 -4.442 6.726 1.00 0.00 C ATOM 1469 O GLU A 95 22.830 -5.370 7.504 1.00 0.00 O ATOM 1470 CB GLU A 95 23.843 -4.270 4.480 1.00 0.00 C ATOM 1471 CG GLU A 95 24.124 -2.781 4.702 1.00 0.00 C ATOM 1472 CD GLU A 95 25.113 -2.278 3.647 1.00 0.00 C ATOM 1473 OE1 GLU A 95 25.201 -2.897 2.599 1.00 0.00 O ATOM 1474 OE2 GLU A 95 25.766 -1.280 3.907 1.00 0.00 O ATOM 0 H GLU A 95 21.757 -3.213 3.901 1.00 0.00 H new ATOM 0 HA GLU A 95 22.366 -5.742 5.085 1.00 0.00 H new ATOM 0 HB2 GLU A 95 24.687 -4.864 4.831 1.00 0.00 H new ATOM 0 HB3 GLU A 95 23.732 -4.472 3.415 1.00 0.00 H new ATOM 0 HG2 GLU A 95 23.195 -2.213 4.643 1.00 0.00 H new ATOM 0 HG3 GLU A 95 24.531 -2.623 5.701 1.00 0.00 H new ATOM 1547 N MET B 1 -6.215 7.414 -11.126 1.00 0.00 N ATOM 1548 CA MET B 1 -5.454 8.486 -10.420 1.00 0.00 C ATOM 1549 C MET B 1 -3.956 8.349 -10.716 1.00 0.00 C ATOM 1550 O MET B 1 -3.564 7.654 -11.633 1.00 0.00 O ATOM 1551 CB MET B 1 -5.743 8.261 -8.936 1.00 0.00 C ATOM 1552 CG MET B 1 -6.609 9.400 -8.396 1.00 0.00 C ATOM 1553 SD MET B 1 -7.637 8.785 -7.042 1.00 0.00 S ATOM 1554 CE MET B 1 -6.474 9.157 -5.708 1.00 0.00 C ATOM 0 H1 MET B 1 -7.232 7.535 -10.947 1.00 0.00 H new ATOM 0 H2 MET B 1 -6.034 7.475 -12.148 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.910 6.484 -10.775 1.00 0.00 H new ATOM 0 HA MET B 1 -5.745 9.487 -10.739 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.252 7.308 -8.796 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.808 8.208 -8.378 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.978 10.217 -8.046 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.238 9.802 -9.191 1.00 0.00 H new ATOM 0 HE1 MET B 1 -6.975 9.750 -4.943 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.114 8.226 -5.269 1.00 0.00 H new ATOM 0 HE3 MET B 1 -5.630 9.719 -6.107 1.00 0.00 H new ATOM 1566 N ASN B 2 -3.110 9.005 -9.954 1.00 0.00 N ATOM 1567 CA ASN B 2 -1.638 8.901 -10.213 1.00 0.00 C ATOM 1568 C ASN B 2 -0.843 9.781 -9.255 1.00 0.00 C ATOM 1569 O ASN B 2 -1.400 10.511 -8.461 1.00 0.00 O ATOM 1570 CB ASN B 2 -1.442 9.386 -11.656 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.869 8.254 -12.511 1.00 0.00 C ATOM 1572 OD1 ASN B 2 0.297 7.928 -12.407 1.00 0.00 O ATOM 1573 ND2 ASN B 2 -1.645 7.638 -13.361 1.00 0.00 N ATOM 0 H ASN B 2 -3.373 9.603 -9.171 1.00 0.00 H new ATOM 0 HA ASN B 2 -1.285 7.880 -10.066 1.00 0.00 H new ATOM 0 HB2 ASN B 2 -2.394 9.720 -12.069 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.769 10.243 -11.673 1.00 0.00 H new ATOM 0 HD21 ASN B 2 -1.273 6.883 -13.937 1.00 0.00 H new ATOM 0 HD22 ASN B 2 -2.624 7.911 -13.449 1.00 0.00 H new ATOM 1580 N LYS B 3 0.468 9.723 -9.339 1.00 0.00 N ATOM 1581 CA LYS B 3 1.317 10.569 -8.447 1.00 0.00 C ATOM 1582 C LYS B 3 0.779 12.004 -8.473 1.00 0.00 C ATOM 1583 O LYS B 3 0.881 12.733 -7.513 1.00 0.00 O ATOM 1584 CB LYS B 3 2.736 10.503 -9.044 1.00 0.00 C ATOM 1585 CG LYS B 3 3.717 9.896 -8.023 1.00 0.00 C ATOM 1586 CD LYS B 3 5.124 10.482 -8.239 1.00 0.00 C ATOM 1587 CE LYS B 3 6.136 9.845 -7.264 1.00 0.00 C ATOM 1588 NZ LYS B 3 7.352 9.605 -8.088 1.00 0.00 N ATOM 0 H LYS B 3 0.982 9.126 -9.987 1.00 0.00 H new ATOM 0 HA LYS B 3 1.315 10.231 -7.411 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.728 9.902 -9.953 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.066 11.503 -9.326 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.377 10.107 -7.009 1.00 0.00 H new ATOM 0 HG3 LYS B 3 3.744 8.812 -8.131 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.442 10.307 -9.267 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.100 11.562 -8.092 1.00 0.00 H new ATOM 0 HE2 LYS B 3 6.350 10.508 -6.426 1.00 0.00 H new ATOM 0 HE3 LYS B 3 5.751 8.915 -6.845 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 8.085 9.156 -7.502 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 7.114 8.980 -8.884 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 7.708 10.511 -8.454 1.00 0.00 H new ATOM 1602 N THR B 4 0.176 12.394 -9.572 1.00 0.00 N ATOM 1603 CA THR B 4 -0.398 13.772 -9.675 1.00 0.00 C ATOM 1604 C THR B 4 -1.888 13.738 -9.330 1.00 0.00 C ATOM 1605 O THR B 4 -2.391 14.559 -8.578 1.00 0.00 O ATOM 1606 CB THR B 4 -0.188 14.185 -11.137 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.191 14.444 -11.357 1.00 0.00 O ATOM 1608 CG2 THR B 4 -1.001 15.446 -11.446 1.00 0.00 C ATOM 0 H THR B 4 0.057 11.815 -10.403 1.00 0.00 H new ATOM 0 HA THR B 4 0.075 14.474 -8.988 1.00 0.00 H new ATOM 0 HB THR B 4 -0.520 13.378 -11.791 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.330 14.707 -12.291 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.846 15.733 -12.486 1.00 0.00 H new ATOM 0 HG22 THR B 4 -2.059 15.247 -11.278 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.676 16.257 -10.794 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.605 12.789 -9.862 1.00 0.00 N ATOM 1617 CA GLU B 5 -4.053 12.709 -9.539 1.00 0.00 C ATOM 1618 C GLU B 5 -4.195 12.622 -8.023 1.00 0.00 C ATOM 1619 O GLU B 5 -4.918 13.389 -7.412 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.570 11.456 -10.241 1.00 0.00 C ATOM 1621 CG GLU B 5 -5.743 11.827 -11.158 1.00 0.00 C ATOM 1622 CD GLU B 5 -5.496 11.268 -12.562 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -4.403 11.458 -13.069 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -6.404 10.660 -13.105 1.00 0.00 O ATOM 0 H GLU B 5 -2.255 12.073 -10.499 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.624 13.576 -9.872 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.771 10.997 -10.823 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -4.890 10.720 -9.504 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -6.673 11.427 -10.755 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -5.855 12.910 -11.202 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.468 11.730 -7.399 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.528 11.654 -5.909 1.00 0.00 C ATOM 1633 C LEU B 6 -3.184 13.028 -5.335 1.00 0.00 C ATOM 1634 O LEU B 6 -3.747 13.454 -4.341 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.473 10.627 -5.504 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.133 9.262 -5.340 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -2.052 8.183 -5.240 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -3.978 9.255 -4.065 1.00 0.00 C ATOM 0 H LEU B 6 -2.844 11.060 -7.849 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.513 11.368 -5.541 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.690 10.576 -6.260 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -1.996 10.927 -4.571 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.771 9.060 -6.201 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.522 7.207 -5.123 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.448 8.188 -6.147 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.415 8.385 -4.379 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.450 8.280 -3.947 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.340 9.456 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.747 10.024 -4.134 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.284 13.748 -5.977 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.944 15.111 -5.481 1.00 0.00 C ATOM 1652 C ILE B 7 -3.245 15.870 -5.289 1.00 0.00 C ATOM 1653 O ILE B 7 -3.484 16.448 -4.261 1.00 0.00 O ATOM 1654 CB ILE B 7 -1.070 15.758 -6.576 1.00 0.00 C ATOM 1655 CG1 ILE B 7 0.220 16.277 -5.960 1.00 0.00 C ATOM 1656 CG2 ILE B 7 -1.792 16.942 -7.222 1.00 0.00 C ATOM 1657 CD1 ILE B 7 1.025 17.022 -7.034 1.00 0.00 C ATOM 0 H ILE B 7 -1.781 13.448 -6.812 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.407 15.107 -4.533 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.863 14.999 -7.331 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -0.003 16.944 -5.127 1.00 0.00 H new ATOM 0 HG13 ILE B 7 0.805 15.449 -5.558 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -1.156 17.381 -7.990 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -2.722 16.598 -7.674 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -2.013 17.692 -6.462 1.00 0.00 H new ATOM 0 HD11 ILE B 7 1.952 17.397 -6.599 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.258 16.341 -7.852 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.438 17.858 -7.414 1.00 0.00 H new ATOM 1669 N LYS B 8 -4.097 15.840 -6.279 1.00 0.00 N ATOM 1670 CA LYS B 8 -5.407 16.536 -6.159 1.00 0.00 C ATOM 1671 C LYS B 8 -6.191 15.909 -5.018 1.00 0.00 C ATOM 1672 O LYS B 8 -6.862 16.586 -4.267 1.00 0.00 O ATOM 1673 CB LYS B 8 -6.136 16.303 -7.483 1.00 0.00 C ATOM 1674 CG LYS B 8 -5.275 16.770 -8.659 1.00 0.00 C ATOM 1675 CD LYS B 8 -6.081 16.659 -9.959 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.755 15.283 -10.037 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.415 15.252 -11.372 1.00 0.00 N ATOM 0 H LYS B 8 -3.940 15.362 -7.166 1.00 0.00 H new ATOM 0 HA LYS B 8 -5.291 17.601 -5.957 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -6.370 15.244 -7.594 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -7.084 16.841 -7.483 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -4.956 17.801 -8.503 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -4.372 16.163 -8.726 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -6.834 17.446 -9.999 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -5.425 16.802 -10.818 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -6.025 14.480 -9.939 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -7.481 15.153 -9.235 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -7.898 14.340 -11.499 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.110 16.024 -11.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -6.698 15.371 -12.116 1.00 0.00 H new ATOM 1691 N ALA B 9 -6.093 14.615 -4.870 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.810 13.945 -3.753 1.00 0.00 C ATOM 1693 C ALA B 9 -6.452 14.641 -2.450 1.00 0.00 C ATOM 1694 O ALA B 9 -7.261 14.776 -1.557 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.267 12.526 -3.750 1.00 0.00 C ATOM 0 H ALA B 9 -5.549 13.997 -5.473 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.894 13.971 -3.862 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -6.743 11.956 -2.953 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.478 12.054 -4.710 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.190 12.549 -3.586 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.239 15.106 -2.352 1.00 0.00 N ATOM 1702 CA ILE B 10 -4.807 15.803 -1.136 1.00 0.00 C ATOM 1703 C ILE B 10 -4.884 17.294 -1.397 1.00 0.00 C ATOM 1704 O ILE B 10 -5.264 18.048 -0.547 1.00 0.00 O ATOM 1705 CB ILE B 10 -3.365 15.308 -0.927 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -3.372 14.180 0.104 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -2.441 16.436 -0.453 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -3.669 12.853 -0.598 1.00 0.00 C ATOM 0 H ILE B 10 -4.528 15.026 -3.079 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.413 15.612 -0.250 1.00 0.00 H new ATOM 0 HB ILE B 10 -2.983 14.948 -1.882 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -2.408 14.129 0.610 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.124 14.376 0.869 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -1.432 16.047 -0.317 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -2.426 17.231 -1.198 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -2.808 16.833 0.494 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -3.675 12.047 0.135 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -4.643 12.908 -1.084 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -2.901 12.657 -1.346 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.564 17.708 -2.587 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.643 19.158 -2.916 1.00 0.00 C ATOM 1722 C ALA B 11 -6.091 19.613 -2.803 1.00 0.00 C ATOM 1723 O ALA B 11 -6.375 20.761 -2.521 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.125 19.271 -4.344 1.00 0.00 C ATOM 0 H ALA B 11 -4.251 17.106 -3.348 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.059 19.787 -2.244 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.152 20.314 -4.660 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.099 18.905 -4.389 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.752 18.675 -5.007 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.010 18.705 -2.977 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.438 19.066 -2.832 1.00 0.00 C ATOM 1732 C GLN B 12 -8.847 18.768 -1.399 1.00 0.00 C ATOM 1733 O GLN B 12 -9.541 19.545 -0.771 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.200 18.188 -3.828 1.00 0.00 C ATOM 1735 CG GLN B 12 -8.699 18.468 -5.246 1.00 0.00 C ATOM 1736 CD GLN B 12 -9.488 19.632 -5.849 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -9.171 20.781 -5.616 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -10.511 19.380 -6.619 1.00 0.00 N ATOM 0 H GLN B 12 -6.829 17.729 -3.213 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.643 20.117 -3.034 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -9.059 17.135 -3.583 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -10.269 18.390 -3.763 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -7.636 18.708 -5.226 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -8.814 17.578 -5.865 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -10.777 18.415 -6.814 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -11.045 20.148 -7.026 1.00 0.00 H new ATOM 1747 N ASP B 13 -8.368 17.681 -0.845 1.00 0.00 N ATOM 1748 CA ASP B 13 -8.688 17.403 0.578 1.00 0.00 C ATOM 1749 C ASP B 13 -7.964 18.463 1.405 1.00 0.00 C ATOM 1750 O ASP B 13 -8.325 18.761 2.527 1.00 0.00 O ATOM 1751 CB ASP B 13 -8.153 16.000 0.858 1.00 0.00 C ATOM 1752 CG ASP B 13 -9.192 14.970 0.405 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.371 15.270 0.497 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -8.793 13.900 -0.021 1.00 0.00 O ATOM 0 H ASP B 13 -7.781 16.989 -1.311 1.00 0.00 H new ATOM 0 HA ASP B 13 -9.751 17.441 0.817 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -7.213 15.843 0.330 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -7.945 15.882 1.921 1.00 0.00 H new ATOM 1759 N THR B 14 -6.959 19.067 0.814 1.00 0.00 N ATOM 1760 CA THR B 14 -6.215 20.147 1.497 1.00 0.00 C ATOM 1761 C THR B 14 -6.828 21.481 1.091 1.00 0.00 C ATOM 1762 O THR B 14 -7.573 22.092 1.834 1.00 0.00 O ATOM 1763 CB THR B 14 -4.779 20.080 0.969 1.00 0.00 C ATOM 1764 OG1 THR B 14 -4.798 20.074 -0.442 1.00 0.00 O ATOM 1765 CG2 THR B 14 -4.077 18.831 1.487 1.00 0.00 C ATOM 0 H THR B 14 -6.627 18.847 -0.125 1.00 0.00 H new ATOM 0 HA THR B 14 -6.247 20.044 2.582 1.00 0.00 H new ATOM 0 HB THR B 14 -4.230 20.953 1.322 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.220 19.249 -0.760 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.058 18.800 1.102 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.052 18.853 2.577 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.618 17.945 1.154 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.507 21.942 -0.093 1.00 0.00 N ATOM 1774 CA GLY B 15 -7.062 23.248 -0.555 1.00 0.00 C ATOM 1775 C GLY B 15 -6.584 24.362 0.383 1.00 0.00 C ATOM 1776 O GLY B 15 -7.057 25.480 0.329 1.00 0.00 O ATOM 0 H GLY B 15 -5.889 21.473 -0.754 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -6.739 23.453 -1.576 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -8.151 23.209 -0.567 1.00 0.00 H new ATOM 1780 N LEU B 16 -5.638 24.062 1.234 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.108 25.101 2.173 1.00 0.00 C ATOM 1782 C LEU B 16 -4.061 25.926 1.460 1.00 0.00 C ATOM 1783 O LEU B 16 -4.212 27.112 1.233 1.00 0.00 O ATOM 1784 CB LEU B 16 -4.440 24.339 3.323 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.452 23.432 4.006 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -5.243 21.998 3.541 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.255 23.487 5.524 1.00 0.00 C ATOM 0 H LEU B 16 -5.207 23.141 1.321 1.00 0.00 H new ATOM 0 HA LEU B 16 -5.899 25.760 2.529 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -3.608 23.747 2.942 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.026 25.043 4.044 1.00 0.00 H new ATOM 0 HG LEU B 16 -6.457 23.767 3.751 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.968 21.348 4.030 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -5.377 21.943 2.461 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -4.234 21.675 3.799 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -5.982 22.836 6.009 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.247 23.154 5.772 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -5.395 24.510 5.872 1.00 0.00 H new ATOM 1799 N THR B 17 -2.993 25.287 1.115 1.00 0.00 N ATOM 1800 CA THR B 17 -1.893 25.975 0.419 1.00 0.00 C ATOM 1801 C THR B 17 -1.331 25.047 -0.655 1.00 0.00 C ATOM 1802 O THR B 17 -0.305 25.319 -1.247 1.00 0.00 O ATOM 1803 CB THR B 17 -0.862 26.234 1.531 1.00 0.00 C ATOM 1804 OG1 THR B 17 -0.379 27.566 1.431 1.00 0.00 O ATOM 1805 CG2 THR B 17 0.309 25.255 1.425 1.00 0.00 C ATOM 0 H THR B 17 -2.834 24.295 1.291 1.00 0.00 H new ATOM 0 HA THR B 17 -2.189 26.897 -0.081 1.00 0.00 H new ATOM 0 HB THR B 17 -1.349 26.089 2.496 1.00 0.00 H new ATOM 0 HG1 THR B 17 0.276 27.730 2.141 1.00 0.00 H new ATOM 0 HG21 THR B 17 1.025 25.457 2.221 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.061 24.234 1.520 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.798 25.376 0.458 1.00 0.00 H new ATOM 1813 N GLN B 18 -1.964 23.917 -0.873 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.410 22.945 -1.851 1.00 0.00 C ATOM 1815 C GLN B 18 0.003 22.614 -1.377 1.00 0.00 C ATOM 1816 O GLN B 18 0.862 22.237 -2.147 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.389 23.660 -3.208 1.00 0.00 C ATOM 1818 CG GLN B 18 -2.706 24.411 -3.416 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.073 24.405 -4.901 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -3.858 23.589 -5.342 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -2.534 25.288 -5.698 1.00 0.00 N ATOM 0 H GLN B 18 -2.832 23.634 -0.417 1.00 0.00 H new ATOM 0 HA GLN B 18 -1.987 22.024 -1.937 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -0.552 24.356 -3.250 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.242 22.936 -4.009 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -3.499 23.942 -2.833 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -2.612 25.436 -3.059 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -1.875 25.973 -5.329 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -2.772 25.292 -6.690 1.00 0.00 H new ATOM 1830 N VAL B 19 0.223 22.789 -0.083 1.00 0.00 N ATOM 1831 CA VAL B 19 1.554 22.539 0.550 1.00 0.00 C ATOM 1832 C VAL B 19 2.628 22.494 -0.532 1.00 0.00 C ATOM 1833 O VAL B 19 3.101 23.512 -0.999 1.00 0.00 O ATOM 1834 CB VAL B 19 1.365 21.215 1.362 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.301 20.330 0.718 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.649 20.380 1.512 1.00 0.00 C ATOM 0 H VAL B 19 -0.493 23.104 0.571 1.00 0.00 H new ATOM 0 HA VAL B 19 1.893 23.322 1.228 1.00 0.00 H new ATOM 0 HB VAL B 19 1.061 21.541 2.357 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.187 19.416 1.300 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.649 20.864 0.692 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.604 20.078 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.432 19.480 2.087 1.00 0.00 H new ATOM 0 HG22 VAL B 19 3.019 20.100 0.525 1.00 0.00 H new ATOM 0 HG23 VAL B 19 3.407 20.968 2.030 1.00 0.00 H new ATOM 1846 N SER B 20 2.962 21.345 -0.964 1.00 0.00 N ATOM 1847 CA SER B 20 3.927 21.181 -2.042 1.00 0.00 C ATOM 1848 C SER B 20 3.348 20.129 -2.957 1.00 0.00 C ATOM 1849 O SER B 20 4.071 19.455 -3.636 1.00 0.00 O ATOM 1850 CB SER B 20 5.216 20.722 -1.372 1.00 0.00 C ATOM 1851 OG SER B 20 5.283 19.309 -1.393 1.00 0.00 O ATOM 0 H SER B 20 2.589 20.469 -0.597 1.00 0.00 H new ATOM 0 HA SER B 20 4.130 22.080 -2.625 1.00 0.00 H new ATOM 0 HB2 SER B 20 6.077 21.145 -1.889 1.00 0.00 H new ATOM 0 HB3 SER B 20 5.252 21.083 -0.344 1.00 0.00 H new ATOM 0 HG SER B 20 4.756 18.945 -0.651 1.00 0.00 H new ATOM 1857 N VAL B 21 2.037 19.950 -2.921 1.00 0.00 N ATOM 1858 CA VAL B 21 1.345 18.903 -3.730 1.00 0.00 C ATOM 1859 C VAL B 21 2.326 18.212 -4.650 1.00 0.00 C ATOM 1860 O VAL B 21 2.369 17.005 -4.766 1.00 0.00 O ATOM 1861 CB VAL B 21 0.265 19.651 -4.521 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -0.812 20.160 -3.562 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.881 20.836 -5.273 1.00 0.00 C ATOM 0 H VAL B 21 1.409 20.509 -2.343 1.00 0.00 H new ATOM 0 HA VAL B 21 0.909 18.121 -3.108 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.180 18.967 -5.243 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.579 20.691 -4.125 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.264 19.316 -3.041 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.362 20.836 -2.835 1.00 0.00 H new ATOM 0 HG21 VAL B 21 0.103 21.358 -5.830 1.00 0.00 H new ATOM 0 HG22 VAL B 21 1.338 21.522 -4.560 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.641 20.473 -5.965 1.00 0.00 H new ATOM 1873 N SER B 22 3.155 18.991 -5.240 1.00 0.00 N ATOM 1874 CA SER B 22 4.199 18.431 -6.147 1.00 0.00 C ATOM 1875 C SER B 22 5.295 17.738 -5.338 1.00 0.00 C ATOM 1876 O SER B 22 5.786 16.690 -5.716 1.00 0.00 O ATOM 1877 CB SER B 22 4.762 19.633 -6.902 1.00 0.00 C ATOM 1878 OG SER B 22 5.905 19.229 -7.645 1.00 0.00 O ATOM 0 H SER B 22 3.167 20.006 -5.142 1.00 0.00 H new ATOM 0 HA SER B 22 3.791 17.682 -6.826 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.006 20.043 -7.571 1.00 0.00 H new ATOM 0 HB3 SER B 22 5.030 20.424 -6.201 1.00 0.00 H new ATOM 0 HG SER B 22 6.267 19.998 -8.132 1.00 0.00 H new ATOM 1884 N LYS B 23 5.687 18.309 -4.234 1.00 0.00 N ATOM 1885 CA LYS B 23 6.745 17.685 -3.424 1.00 0.00 C ATOM 1886 C LYS B 23 6.152 16.781 -2.337 1.00 0.00 C ATOM 1887 O LYS B 23 6.791 15.836 -1.943 1.00 0.00 O ATOM 1888 CB LYS B 23 7.538 18.856 -2.836 1.00 0.00 C ATOM 1889 CG LYS B 23 8.018 18.511 -1.428 1.00 0.00 C ATOM 1890 CD LYS B 23 9.143 19.463 -1.023 1.00 0.00 C ATOM 1891 CE LYS B 23 8.580 20.876 -0.881 1.00 0.00 C ATOM 1892 NZ LYS B 23 9.692 21.678 -0.301 1.00 0.00 N ATOM 0 H LYS B 23 5.314 19.183 -3.864 1.00 0.00 H new ATOM 0 HA LYS B 23 7.386 17.032 -4.016 1.00 0.00 H new ATOM 0 HB2 LYS B 23 8.392 19.084 -3.474 1.00 0.00 H new ATOM 0 HB3 LYS B 23 6.914 19.750 -2.807 1.00 0.00 H new ATOM 0 HG2 LYS B 23 7.191 18.588 -0.722 1.00 0.00 H new ATOM 0 HG3 LYS B 23 8.371 17.480 -1.395 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.588 19.140 -0.082 1.00 0.00 H new ATOM 0 HD3 LYS B 23 9.935 19.448 -1.772 1.00 0.00 H new ATOM 0 HE2 LYS B 23 8.267 21.275 -1.846 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.704 20.888 -0.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 9.381 22.662 -0.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 9.964 21.279 0.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 10.509 21.654 -0.944 1.00 0.00 H new ATOM 1906 N MET B 24 4.948 17.014 -1.844 1.00 0.00 N ATOM 1907 CA MET B 24 4.440 16.077 -0.807 1.00 0.00 C ATOM 1908 C MET B 24 4.064 14.770 -1.488 1.00 0.00 C ATOM 1909 O MET B 24 4.120 13.716 -0.888 1.00 0.00 O ATOM 1910 CB MET B 24 3.238 16.718 -0.093 1.00 0.00 C ATOM 1911 CG MET B 24 2.523 17.747 -0.968 1.00 0.00 C ATOM 1912 SD MET B 24 0.747 17.518 -0.787 1.00 0.00 S ATOM 1913 CE MET B 24 0.637 16.269 -2.083 1.00 0.00 C ATOM 0 H MET B 24 4.328 17.780 -2.107 1.00 0.00 H new ATOM 0 HA MET B 24 5.200 15.870 -0.054 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.533 15.939 0.197 1.00 0.00 H new ATOM 0 HB3 MET B 24 3.578 17.198 0.825 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.806 18.757 -0.673 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.816 17.626 -2.011 1.00 0.00 H new ATOM 0 HE1 MET B 24 -0.208 16.494 -2.734 1.00 0.00 H new ATOM 0 HE2 MET B 24 1.557 16.270 -2.668 1.00 0.00 H new ATOM 0 HE3 MET B 24 0.495 15.287 -1.631 1.00 0.00 H new ATOM 1923 N LEU B 25 3.735 14.812 -2.759 1.00 0.00 N ATOM 1924 CA LEU B 25 3.431 13.544 -3.463 1.00 0.00 C ATOM 1925 C LEU B 25 4.764 12.924 -3.870 1.00 0.00 C ATOM 1926 O LEU B 25 5.010 11.753 -3.656 1.00 0.00 O ATOM 1927 CB LEU B 25 2.578 13.940 -4.675 1.00 0.00 C ATOM 1928 CG LEU B 25 3.398 13.874 -5.975 1.00 0.00 C ATOM 1929 CD1 LEU B 25 3.638 12.411 -6.357 1.00 0.00 C ATOM 1930 CD2 LEU B 25 2.652 14.567 -7.111 1.00 0.00 C ATOM 0 H LEU B 25 3.667 15.659 -3.323 1.00 0.00 H new ATOM 0 HA LEU B 25 2.891 12.813 -2.862 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.717 13.276 -4.750 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.191 14.949 -4.537 1.00 0.00 H new ATOM 0 HG LEU B 25 4.350 14.378 -5.811 1.00 0.00 H new ATOM 0 HD11 LEU B 25 4.219 12.366 -7.278 1.00 0.00 H new ATOM 0 HD12 LEU B 25 4.186 11.911 -5.558 1.00 0.00 H new ATOM 0 HD13 LEU B 25 2.680 11.912 -6.507 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.246 14.511 -8.023 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.693 14.073 -7.271 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.483 15.612 -6.851 1.00 0.00 H new ATOM 1942 N ALA B 26 5.643 13.721 -4.428 1.00 0.00 N ATOM 1943 CA ALA B 26 6.973 13.195 -4.812 1.00 0.00 C ATOM 1944 C ALA B 26 7.679 12.780 -3.534 1.00 0.00 C ATOM 1945 O ALA B 26 8.487 11.876 -3.518 1.00 0.00 O ATOM 1946 CB ALA B 26 7.698 14.361 -5.487 1.00 0.00 C ATOM 0 H ALA B 26 5.490 14.709 -4.630 1.00 0.00 H new ATOM 0 HA ALA B 26 6.931 12.337 -5.483 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.692 14.040 -5.797 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.132 14.685 -6.360 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.787 15.190 -4.785 1.00 0.00 H new ATOM 1952 N SER B 27 7.333 13.421 -2.448 1.00 0.00 N ATOM 1953 CA SER B 27 7.941 13.053 -1.148 1.00 0.00 C ATOM 1954 C SER B 27 7.175 11.876 -0.574 1.00 0.00 C ATOM 1955 O SER B 27 7.748 10.971 -0.034 1.00 0.00 O ATOM 1956 CB SER B 27 7.789 14.269 -0.239 1.00 0.00 C ATOM 1957 OG SER B 27 8.211 13.921 1.072 1.00 0.00 O ATOM 0 H SER B 27 6.655 14.182 -2.411 1.00 0.00 H new ATOM 0 HA SER B 27 8.990 12.774 -1.248 1.00 0.00 H new ATOM 0 HB2 SER B 27 8.384 15.100 -0.618 1.00 0.00 H new ATOM 0 HB3 SER B 27 6.751 14.601 -0.225 1.00 0.00 H new ATOM 0 HG SER B 27 9.184 13.804 1.082 1.00 0.00 H new ATOM 1963 N PHE B 28 5.874 11.886 -0.708 1.00 0.00 N ATOM 1964 CA PHE B 28 5.045 10.760 -0.180 1.00 0.00 C ATOM 1965 C PHE B 28 5.601 9.441 -0.692 1.00 0.00 C ATOM 1966 O PHE B 28 5.803 8.511 0.050 1.00 0.00 O ATOM 1967 CB PHE B 28 3.647 11.021 -0.732 1.00 0.00 C ATOM 1968 CG PHE B 28 2.923 9.727 -1.044 1.00 0.00 C ATOM 1969 CD1 PHE B 28 2.262 9.022 -0.030 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.852 9.269 -2.366 1.00 0.00 C ATOM 1971 CE1 PHE B 28 1.534 7.878 -0.338 1.00 0.00 C ATOM 1972 CE2 PHE B 28 2.136 8.118 -2.669 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.466 7.423 -1.656 1.00 0.00 C ATOM 0 H PHE B 28 5.346 12.631 -1.164 1.00 0.00 H new ATOM 0 HA PHE B 28 5.041 10.701 0.908 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.070 11.596 -0.008 1.00 0.00 H new ATOM 0 HB3 PHE B 28 3.719 11.626 -1.636 1.00 0.00 H new ATOM 0 HD1 PHE B 28 2.318 9.367 0.992 1.00 0.00 H new ATOM 0 HD2 PHE B 28 3.355 9.812 -3.152 1.00 0.00 H new ATOM 0 HE1 PHE B 28 1.020 7.340 0.445 1.00 0.00 H new ATOM 0 HE2 PHE B 28 2.096 7.759 -3.687 1.00 0.00 H new ATOM 0 HZ PHE B 28 0.897 6.536 -1.893 1.00 0.00 H new ATOM 1983 N GLU B 29 5.890 9.369 -1.944 1.00 0.00 N ATOM 1984 CA GLU B 29 6.475 8.131 -2.479 1.00 0.00 C ATOM 1985 C GLU B 29 7.916 8.101 -2.038 1.00 0.00 C ATOM 1986 O GLU B 29 8.481 7.068 -1.744 1.00 0.00 O ATOM 1987 CB GLU B 29 6.305 8.263 -3.977 1.00 0.00 C ATOM 1988 CG GLU B 29 4.923 7.721 -4.299 1.00 0.00 C ATOM 1989 CD GLU B 29 4.151 8.697 -5.186 1.00 0.00 C ATOM 1990 OE1 GLU B 29 4.436 9.880 -5.122 1.00 0.00 O ATOM 1991 OE2 GLU B 29 3.281 8.242 -5.909 1.00 0.00 O ATOM 0 H GLU B 29 5.746 10.116 -2.623 1.00 0.00 H new ATOM 0 HA GLU B 29 6.019 7.201 -2.138 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.397 9.304 -4.288 1.00 0.00 H new ATOM 0 HB3 GLU B 29 7.075 7.703 -4.507 1.00 0.00 H new ATOM 0 HG2 GLU B 29 5.013 6.758 -4.802 1.00 0.00 H new ATOM 0 HG3 GLU B 29 4.371 7.547 -3.375 1.00 0.00 H new ATOM 1998 N LYS B 30 8.488 9.256 -1.917 1.00 0.00 N ATOM 1999 CA LYS B 30 9.873 9.332 -1.411 1.00 0.00 C ATOM 2000 C LYS B 30 9.851 8.996 0.079 1.00 0.00 C ATOM 2001 O LYS B 30 10.840 8.641 0.639 1.00 0.00 O ATOM 2002 CB LYS B 30 10.338 10.769 -1.632 1.00 0.00 C ATOM 2003 CG LYS B 30 11.861 10.836 -1.501 1.00 0.00 C ATOM 2004 CD LYS B 30 12.383 12.076 -2.231 1.00 0.00 C ATOM 2005 CE LYS B 30 12.635 13.197 -1.220 1.00 0.00 C ATOM 2006 NZ LYS B 30 13.154 14.333 -2.030 1.00 0.00 N ATOM 0 H LYS B 30 8.056 10.151 -2.147 1.00 0.00 H new ATOM 0 HA LYS B 30 10.544 8.638 -1.917 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.031 11.114 -2.619 1.00 0.00 H new ATOM 0 HB3 LYS B 30 9.870 11.431 -0.903 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.145 10.874 -0.449 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.312 9.937 -1.921 1.00 0.00 H new ATOM 0 HD2 LYS B 30 13.304 11.837 -2.762 1.00 0.00 H new ATOM 0 HD3 LYS B 30 11.660 12.402 -2.978 1.00 0.00 H new ATOM 0 HE2 LYS B 30 11.719 13.471 -0.697 1.00 0.00 H new ATOM 0 HE3 LYS B 30 13.356 12.891 -0.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 13.351 15.142 -1.407 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 14.030 14.045 -2.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 12.444 14.607 -2.739 1.00 0.00 H new ATOM 2020 N ILE B 31 8.725 9.070 0.733 1.00 0.00 N ATOM 2021 CA ILE B 31 8.702 8.707 2.173 1.00 0.00 C ATOM 2022 C ILE B 31 8.032 7.359 2.322 1.00 0.00 C ATOM 2023 O ILE B 31 8.395 6.571 3.152 1.00 0.00 O ATOM 2024 CB ILE B 31 7.962 9.807 2.912 1.00 0.00 C ATOM 2025 CG1 ILE B 31 6.665 10.171 2.219 1.00 0.00 C ATOM 2026 CG2 ILE B 31 8.872 11.030 3.000 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.543 10.153 3.247 1.00 0.00 C ATOM 0 H ILE B 31 7.832 9.362 0.337 1.00 0.00 H new ATOM 0 HA ILE B 31 9.704 8.622 2.594 1.00 0.00 H new ATOM 0 HB ILE B 31 7.706 9.451 3.910 1.00 0.00 H new ATOM 0 HG12 ILE B 31 6.744 11.158 1.763 1.00 0.00 H new ATOM 0 HG13 ILE B 31 6.454 9.465 1.416 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.355 11.831 3.529 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.783 10.768 3.539 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.129 11.365 1.995 1.00 0.00 H new ATOM 0 HD11 ILE B 31 4.602 10.413 2.763 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.464 9.157 3.682 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.759 10.876 4.034 1.00 0.00 H new ATOM 2039 N ILE B 32 7.100 7.065 1.476 1.00 0.00 N ATOM 2040 CA ILE B 32 6.462 5.718 1.524 1.00 0.00 C ATOM 2041 C ILE B 32 7.512 4.709 1.118 1.00 0.00 C ATOM 2042 O ILE B 32 7.934 3.864 1.895 1.00 0.00 O ATOM 2043 CB ILE B 32 5.324 5.722 0.499 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.261 6.756 0.909 1.00 0.00 C ATOM 2045 CG2 ILE B 32 4.701 4.321 0.438 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.075 6.075 1.602 1.00 0.00 C ATOM 0 H ILE B 32 6.747 7.691 0.752 1.00 0.00 H new ATOM 0 HA ILE B 32 6.075 5.475 2.514 1.00 0.00 H new ATOM 0 HB ILE B 32 5.712 5.989 -0.484 1.00 0.00 H new ATOM 0 HG12 ILE B 32 4.704 7.493 1.578 1.00 0.00 H new ATOM 0 HG13 ILE B 32 3.912 7.294 0.028 1.00 0.00 H new ATOM 0 HG21 ILE B 32 3.890 4.315 -0.290 1.00 0.00 H new ATOM 0 HG22 ILE B 32 5.460 3.598 0.141 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.310 4.054 1.420 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.337 6.827 1.882 1.00 0.00 H new ATOM 0 HD12 ILE B 32 2.620 5.356 0.921 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.424 5.558 2.496 1.00 0.00 H new ATOM 2058 N THR B 33 7.965 4.817 -0.095 1.00 0.00 N ATOM 2059 CA THR B 33 9.005 3.895 -0.558 1.00 0.00 C ATOM 2060 C THR B 33 10.266 4.140 0.271 1.00 0.00 C ATOM 2061 O THR B 33 10.903 3.218 0.739 1.00 0.00 O ATOM 2062 CB THR B 33 9.204 4.230 -2.048 1.00 0.00 C ATOM 2063 OG1 THR B 33 8.787 3.131 -2.840 1.00 0.00 O ATOM 2064 CG2 THR B 33 10.670 4.525 -2.342 1.00 0.00 C ATOM 0 H THR B 33 7.654 5.507 -0.779 1.00 0.00 H new ATOM 0 HA THR B 33 8.750 2.841 -0.444 1.00 0.00 H new ATOM 0 HB THR B 33 8.610 5.112 -2.286 1.00 0.00 H new ATOM 0 HG1 THR B 33 7.844 3.242 -3.083 1.00 0.00 H new ATOM 0 HG21 THR B 33 10.789 4.759 -3.400 1.00 0.00 H new ATOM 0 HG22 THR B 33 10.997 5.375 -1.743 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.274 3.652 -2.094 1.00 0.00 H new ATOM 2072 N GLU B 34 10.624 5.385 0.468 1.00 0.00 N ATOM 2073 CA GLU B 34 11.838 5.684 1.261 1.00 0.00 C ATOM 2074 C GLU B 34 11.637 5.325 2.737 1.00 0.00 C ATOM 2075 O GLU B 34 12.586 4.985 3.407 1.00 0.00 O ATOM 2076 CB GLU B 34 12.049 7.172 1.061 1.00 0.00 C ATOM 2077 CG GLU B 34 12.300 7.443 -0.445 1.00 0.00 C ATOM 2078 CD GLU B 34 13.557 6.700 -0.899 1.00 0.00 C ATOM 2079 OE1 GLU B 34 14.631 7.266 -0.782 1.00 0.00 O ATOM 2080 OE2 GLU B 34 13.424 5.577 -1.356 1.00 0.00 O ATOM 0 H GLU B 34 10.124 6.200 0.112 1.00 0.00 H new ATOM 0 HA GLU B 34 12.704 5.102 0.945 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.175 7.727 1.404 1.00 0.00 H new ATOM 0 HB3 GLU B 34 12.897 7.516 1.653 1.00 0.00 H new ATOM 0 HG2 GLU B 34 11.441 7.117 -1.031 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.416 8.513 -0.618 1.00 0.00 H new ATOM 2087 N THR B 35 10.421 5.352 3.258 1.00 0.00 N ATOM 2088 CA THR B 35 10.251 4.949 4.694 1.00 0.00 C ATOM 2089 C THR B 35 10.782 3.552 4.808 1.00 0.00 C ATOM 2090 O THR B 35 11.621 3.269 5.638 1.00 0.00 O ATOM 2091 CB THR B 35 8.757 4.968 5.034 1.00 0.00 C ATOM 2092 OG1 THR B 35 8.388 6.265 5.484 1.00 0.00 O ATOM 2093 CG2 THR B 35 8.489 3.947 6.147 1.00 0.00 C ATOM 0 H THR B 35 9.570 5.626 2.767 1.00 0.00 H new ATOM 0 HA THR B 35 10.775 5.621 5.374 1.00 0.00 H new ATOM 0 HB THR B 35 8.173 4.715 4.149 1.00 0.00 H new ATOM 0 HG1 THR B 35 8.166 6.828 4.713 1.00 0.00 H new ATOM 0 HG21 THR B 35 7.428 3.952 6.397 1.00 0.00 H new ATOM 0 HG22 THR B 35 8.777 2.953 5.806 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.071 4.210 7.030 1.00 0.00 H new ATOM 2101 N VAL B 36 10.336 2.675 3.957 1.00 0.00 N ATOM 2102 CA VAL B 36 10.910 1.303 4.028 1.00 0.00 C ATOM 2103 C VAL B 36 12.431 1.447 3.935 1.00 0.00 C ATOM 2104 O VAL B 36 13.178 0.757 4.598 1.00 0.00 O ATOM 2105 CB VAL B 36 10.349 0.540 2.834 1.00 0.00 C ATOM 2106 CG1 VAL B 36 11.263 -0.642 2.498 1.00 0.00 C ATOM 2107 CG2 VAL B 36 8.961 0.027 3.203 1.00 0.00 C ATOM 0 H VAL B 36 9.627 2.836 3.241 1.00 0.00 H new ATOM 0 HA VAL B 36 10.663 0.772 4.947 1.00 0.00 H new ATOM 0 HB VAL B 36 10.290 1.195 1.965 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.857 -1.184 1.644 1.00 0.00 H new ATOM 0 HG12 VAL B 36 12.259 -0.274 2.254 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.323 -1.311 3.357 1.00 0.00 H new ATOM 0 HG21 VAL B 36 8.541 -0.523 2.361 1.00 0.00 H new ATOM 0 HG22 VAL B 36 9.035 -0.633 4.067 1.00 0.00 H new ATOM 0 HG23 VAL B 36 8.314 0.870 3.445 1.00 0.00 H new ATOM 2117 N ALA B 37 12.882 2.392 3.142 1.00 0.00 N ATOM 2118 CA ALA B 37 14.346 2.638 3.039 1.00 0.00 C ATOM 2119 C ALA B 37 14.796 3.503 4.220 1.00 0.00 C ATOM 2120 O ALA B 37 15.951 3.843 4.350 1.00 0.00 O ATOM 2121 CB ALA B 37 14.562 3.380 1.732 1.00 0.00 C ATOM 0 H ALA B 37 12.297 2.998 2.566 1.00 0.00 H new ATOM 0 HA ALA B 37 14.918 1.710 3.060 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.624 3.588 1.603 1.00 0.00 H new ATOM 0 HB2 ALA B 37 14.209 2.767 0.903 1.00 0.00 H new ATOM 0 HB3 ALA B 37 14.008 4.319 1.751 1.00 0.00 H new ATOM 2127 N LYS B 38 13.886 3.848 5.090 1.00 0.00 N ATOM 2128 CA LYS B 38 14.254 4.663 6.278 1.00 0.00 C ATOM 2129 C LYS B 38 14.173 3.770 7.502 1.00 0.00 C ATOM 2130 O LYS B 38 14.853 3.978 8.489 1.00 0.00 O ATOM 2131 CB LYS B 38 13.226 5.795 6.341 1.00 0.00 C ATOM 2132 CG LYS B 38 13.944 7.131 6.544 1.00 0.00 C ATOM 2133 CD LYS B 38 14.750 7.477 5.288 1.00 0.00 C ATOM 2134 CE LYS B 38 13.798 7.701 4.109 1.00 0.00 C ATOM 2135 NZ LYS B 38 14.188 9.023 3.544 1.00 0.00 N ATOM 0 H LYS B 38 12.899 3.598 5.027 1.00 0.00 H new ATOM 0 HA LYS B 38 15.262 5.074 6.227 1.00 0.00 H new ATOM 0 HB2 LYS B 38 12.642 5.821 5.421 1.00 0.00 H new ATOM 0 HB3 LYS B 38 12.526 5.619 7.158 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.218 7.918 6.751 1.00 0.00 H new ATOM 0 HG3 LYS B 38 14.606 7.072 7.408 1.00 0.00 H new ATOM 0 HD2 LYS B 38 15.346 8.373 5.462 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.446 6.671 5.057 1.00 0.00 H new ATOM 0 HE2 LYS B 38 13.897 6.910 3.366 1.00 0.00 H new ATOM 0 HE3 LYS B 38 12.758 7.703 4.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 13.568 9.254 2.741 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 14.093 9.755 4.277 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 15.175 8.984 3.219 1.00 0.00 H new ATOM 2149 N GLY B 39 13.366 2.750 7.427 1.00 0.00 N ATOM 2150 CA GLY B 39 13.260 1.812 8.557 1.00 0.00 C ATOM 2151 C GLY B 39 11.915 1.961 9.258 1.00 0.00 C ATOM 2152 O GLY B 39 11.836 1.916 10.471 1.00 0.00 O ATOM 0 H GLY B 39 12.776 2.532 6.624 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.378 0.789 8.199 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.067 1.996 9.266 1.00 0.00 H new ATOM 2156 N ASP B 40 10.852 2.131 8.519 1.00 0.00 N ATOM 2157 CA ASP B 40 9.523 2.270 9.184 1.00 0.00 C ATOM 2158 C ASP B 40 8.464 1.449 8.445 1.00 0.00 C ATOM 2159 O ASP B 40 8.385 1.462 7.234 1.00 0.00 O ATOM 2160 CB ASP B 40 9.194 3.764 9.126 1.00 0.00 C ATOM 2161 CG ASP B 40 9.100 4.324 10.547 1.00 0.00 C ATOM 2162 OD1 ASP B 40 8.529 3.653 11.391 1.00 0.00 O ATOM 2163 OD2 ASP B 40 9.601 5.415 10.767 1.00 0.00 O ATOM 0 H ASP B 40 10.844 2.179 7.500 1.00 0.00 H new ATOM 0 HA ASP B 40 9.541 1.902 10.210 1.00 0.00 H new ATOM 0 HB2 ASP B 40 9.963 4.295 8.565 1.00 0.00 H new ATOM 0 HB3 ASP B 40 8.252 3.919 8.600 1.00 0.00 H new ATOM 2168 N LYS B 41 7.644 0.742 9.174 1.00 0.00 N ATOM 2169 CA LYS B 41 6.578 -0.070 8.527 1.00 0.00 C ATOM 2170 C LYS B 41 5.320 0.784 8.384 1.00 0.00 C ATOM 2171 O LYS B 41 4.511 0.879 9.286 1.00 0.00 O ATOM 2172 CB LYS B 41 6.335 -1.260 9.464 1.00 0.00 C ATOM 2173 CG LYS B 41 5.952 -0.763 10.863 1.00 0.00 C ATOM 2174 CD LYS B 41 6.957 -1.290 11.890 1.00 0.00 C ATOM 2175 CE LYS B 41 6.351 -1.197 13.292 1.00 0.00 C ATOM 2176 NZ LYS B 41 7.499 -0.886 14.187 1.00 0.00 N ATOM 0 H LYS B 41 7.668 0.693 10.193 1.00 0.00 H new ATOM 0 HA LYS B 41 6.856 -0.414 7.531 1.00 0.00 H new ATOM 0 HB2 LYS B 41 5.541 -1.891 9.064 1.00 0.00 H new ATOM 0 HB3 LYS B 41 7.233 -1.876 9.522 1.00 0.00 H new ATOM 0 HG2 LYS B 41 5.937 0.327 10.881 1.00 0.00 H new ATOM 0 HG3 LYS B 41 4.947 -1.100 11.117 1.00 0.00 H new ATOM 0 HD2 LYS B 41 7.217 -2.324 11.663 1.00 0.00 H new ATOM 0 HD3 LYS B 41 7.879 -0.711 11.842 1.00 0.00 H new ATOM 0 HE2 LYS B 41 5.589 -0.419 13.342 1.00 0.00 H new ATOM 0 HE3 LYS B 41 5.870 -2.133 13.577 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 7.163 -0.807 15.168 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 8.205 -1.647 14.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.933 0.013 13.896 1.00 0.00 H new ATOM 2190 N VAL B 42 5.164 1.422 7.261 1.00 0.00 N ATOM 2191 CA VAL B 42 3.967 2.294 7.056 1.00 0.00 C ATOM 2192 C VAL B 42 2.689 1.469 7.197 1.00 0.00 C ATOM 2193 O VAL B 42 2.583 0.376 6.677 1.00 0.00 O ATOM 2194 CB VAL B 42 4.096 2.859 5.639 1.00 0.00 C ATOM 2195 CG1 VAL B 42 3.061 3.968 5.445 1.00 0.00 C ATOM 2196 CG2 VAL B 42 5.497 3.444 5.436 1.00 0.00 C ATOM 0 H VAL B 42 5.811 1.381 6.473 1.00 0.00 H new ATOM 0 HA VAL B 42 3.916 3.094 7.794 1.00 0.00 H new ATOM 0 HB VAL B 42 3.930 2.059 4.917 1.00 0.00 H new ATOM 0 HG11 VAL B 42 3.148 4.375 4.437 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.060 3.560 5.587 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.236 4.761 6.172 1.00 0.00 H new ATOM 0 HG21 VAL B 42 5.581 3.844 4.426 1.00 0.00 H new ATOM 0 HG22 VAL B 42 5.666 4.243 6.158 1.00 0.00 H new ATOM 0 HG23 VAL B 42 6.242 2.662 5.580 1.00 0.00 H new ATOM 2206 N GLN B 43 1.721 1.984 7.906 1.00 0.00 N ATOM 2207 CA GLN B 43 0.447 1.231 8.095 1.00 0.00 C ATOM 2208 C GLN B 43 -0.742 2.149 7.815 1.00 0.00 C ATOM 2209 O GLN B 43 -1.222 2.836 8.693 1.00 0.00 O ATOM 2210 CB GLN B 43 0.442 0.800 9.567 1.00 0.00 C ATOM 2211 CG GLN B 43 1.846 0.357 9.990 1.00 0.00 C ATOM 2212 CD GLN B 43 1.751 -0.537 11.228 1.00 0.00 C ATOM 2213 OE1 GLN B 43 1.527 -1.726 11.118 1.00 0.00 O ATOM 2214 NE2 GLN B 43 1.916 -0.012 12.412 1.00 0.00 N ATOM 0 H GLN B 43 1.757 2.895 8.363 1.00 0.00 H new ATOM 0 HA GLN B 43 0.372 0.377 7.422 1.00 0.00 H new ATOM 0 HB2 GLN B 43 0.108 1.626 10.195 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -0.265 -0.017 9.713 1.00 0.00 H new ATOM 0 HG2 GLN B 43 2.329 -0.183 9.175 1.00 0.00 H new ATOM 0 HG3 GLN B 43 2.464 1.229 10.205 1.00 0.00 H new ATOM 0 HE21 GLN B 43 2.104 0.986 12.506 1.00 0.00 H new ATOM 0 HE22 GLN B 43 1.857 -0.600 13.243 1.00 0.00 H new ATOM 2223 N LEU B 44 -1.218 2.171 6.602 1.00 0.00 N ATOM 2224 CA LEU B 44 -2.371 3.058 6.277 1.00 0.00 C ATOM 2225 C LEU B 44 -3.645 2.583 6.984 1.00 0.00 C ATOM 2226 O LEU B 44 -3.639 1.619 7.720 1.00 0.00 O ATOM 2227 CB LEU B 44 -2.545 2.968 4.760 1.00 0.00 C ATOM 2228 CG LEU B 44 -1.285 3.447 4.018 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -1.665 3.897 2.605 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -0.650 4.629 4.748 1.00 0.00 C ATOM 0 H LEU B 44 -0.861 1.616 5.824 1.00 0.00 H new ATOM 0 HA LEU B 44 -2.189 4.080 6.608 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.765 1.938 4.478 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.400 3.571 4.454 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.574 2.622 3.978 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.773 4.236 2.079 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.109 3.061 2.064 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.384 4.714 2.664 1.00 0.00 H new ATOM 0 HD21 LEU B 44 0.240 4.954 4.209 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.364 5.451 4.799 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.372 4.326 5.758 1.00 0.00 H new ATOM 2242 N THR B 45 -4.729 3.280 6.760 1.00 0.00 N ATOM 2243 CA THR B 45 -6.040 2.929 7.396 1.00 0.00 C ATOM 2244 C THR B 45 -6.408 1.461 7.161 1.00 0.00 C ATOM 2245 O THR B 45 -7.295 1.157 6.387 1.00 0.00 O ATOM 2246 CB THR B 45 -7.065 3.836 6.701 1.00 0.00 C ATOM 2247 OG1 THR B 45 -8.374 3.466 7.113 1.00 0.00 O ATOM 2248 CG2 THR B 45 -6.949 3.689 5.175 1.00 0.00 C ATOM 0 H THR B 45 -4.763 4.096 6.150 1.00 0.00 H new ATOM 0 HA THR B 45 -6.005 3.069 8.476 1.00 0.00 H new ATOM 0 HB THR B 45 -6.870 4.873 6.975 1.00 0.00 H new ATOM 0 HG1 THR B 45 -8.599 2.588 6.740 1.00 0.00 H new ATOM 0 HG21 THR B 45 -7.680 4.336 4.691 1.00 0.00 H new ATOM 0 HG22 THR B 45 -5.946 3.973 4.857 1.00 0.00 H new ATOM 0 HG23 THR B 45 -7.139 2.653 4.894 1.00 0.00 H new ATOM 2256 N GLY B 46 -5.747 0.549 7.829 1.00 0.00 N ATOM 2257 CA GLY B 46 -6.065 -0.900 7.649 1.00 0.00 C ATOM 2258 C GLY B 46 -6.336 -1.194 6.172 1.00 0.00 C ATOM 2259 O GLY B 46 -7.419 -1.596 5.800 1.00 0.00 O ATOM 0 H GLY B 46 -4.999 0.747 8.493 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.235 -1.510 8.004 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.936 -1.167 8.248 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.361 -0.989 5.331 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.552 -1.250 3.879 1.00 0.00 C ATOM 2265 C PHE B 47 -4.183 -1.329 3.210 1.00 0.00 C ATOM 2266 O PHE B 47 -3.911 -2.224 2.441 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.435 -0.083 3.375 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.659 0.987 2.620 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.462 0.870 1.236 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.184 2.129 3.285 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.794 1.871 0.535 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -4.526 3.127 2.568 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.330 2.999 1.207 1.00 0.00 C ATOM 0 H PHE B 47 -4.435 -0.650 5.590 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.043 -2.196 3.650 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.213 -0.482 2.725 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -6.936 0.377 4.227 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.830 0.000 0.712 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -5.328 2.234 4.350 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.636 1.773 -0.529 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -4.167 4.007 3.081 1.00 0.00 H new ATOM 0 HZ PHE B 47 -3.815 3.776 0.662 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.318 -0.415 3.529 1.00 0.00 N ATOM 2284 CA LEU B 48 -1.950 -0.425 2.948 1.00 0.00 C ATOM 2285 C LEU B 48 -0.901 -0.416 4.074 1.00 0.00 C ATOM 2286 O LEU B 48 -0.635 0.603 4.677 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.896 0.868 2.147 1.00 0.00 C ATOM 2288 CG LEU B 48 -1.906 0.634 0.622 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -0.525 0.954 0.039 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.288 -0.810 0.255 1.00 0.00 C ATOM 0 H LEU B 48 -3.502 0.351 4.177 1.00 0.00 H new ATOM 0 HA LEU B 48 -1.742 -1.305 2.339 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.747 1.493 2.419 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.996 1.420 2.418 1.00 0.00 H new ATOM 0 HG LEU B 48 -2.661 1.297 0.199 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -0.537 0.787 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -0.277 1.996 0.242 1.00 0.00 H new ATOM 0 HD13 LEU B 48 0.223 0.307 0.498 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.281 -0.924 -0.829 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -1.569 -1.500 0.697 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -3.285 -1.031 0.636 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.312 -1.545 4.364 1.00 0.00 N ATOM 2303 CA ASN B 49 0.711 -1.620 5.449 1.00 0.00 C ATOM 2304 C ASN B 49 2.047 -2.097 4.893 1.00 0.00 C ATOM 2305 O ASN B 49 2.244 -3.271 4.682 1.00 0.00 O ATOM 2306 CB ASN B 49 0.158 -2.671 6.388 1.00 0.00 C ATOM 2307 CG ASN B 49 -0.116 -2.059 7.763 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -1.043 -1.292 7.925 1.00 0.00 O ATOM 2309 ND2 ASN B 49 0.658 -2.369 8.767 1.00 0.00 N ATOM 0 H ASN B 49 -0.498 -2.429 3.890 1.00 0.00 H new ATOM 0 HA ASN B 49 0.886 -0.655 5.924 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.762 -3.088 5.978 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.867 -3.494 6.483 1.00 0.00 H new ATOM 0 HD21 ASN B 49 0.484 -1.967 9.688 1.00 0.00 H new ATOM 0 HD22 ASN B 49 1.437 -3.013 8.631 1.00 0.00 H new ATOM 2316 N ILE B 50 2.960 -1.210 4.658 1.00 0.00 N ATOM 2317 CA ILE B 50 4.271 -1.632 4.098 1.00 0.00 C ATOM 2318 C ILE B 50 5.266 -1.940 5.213 1.00 0.00 C ATOM 2319 O ILE B 50 5.326 -1.250 6.212 1.00 0.00 O ATOM 2320 CB ILE B 50 4.722 -0.439 3.241 1.00 0.00 C ATOM 2321 CG1 ILE B 50 5.119 -0.940 1.852 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.905 0.289 3.880 1.00 0.00 C ATOM 2323 CD1 ILE B 50 6.249 -1.965 1.974 1.00 0.00 C ATOM 0 H ILE B 50 2.860 -0.209 4.828 1.00 0.00 H new ATOM 0 HA ILE B 50 4.203 -2.548 3.511 1.00 0.00 H new ATOM 0 HB ILE B 50 3.893 0.265 3.166 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.258 -1.391 1.358 1.00 0.00 H new ATOM 0 HG13 ILE B 50 5.440 -0.103 1.232 1.00 0.00 H new ATOM 0 HG21 ILE B 50 6.200 1.128 3.249 1.00 0.00 H new ATOM 0 HG22 ILE B 50 5.616 0.659 4.864 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.743 -0.400 3.983 1.00 0.00 H new ATOM 0 HD11 ILE B 50 6.528 -2.319 0.981 1.00 0.00 H new ATOM 0 HD12 ILE B 50 7.112 -1.500 2.449 1.00 0.00 H new ATOM 0 HD13 ILE B 50 5.912 -2.808 2.578 1.00 0.00 H new ATOM 2335 N LYS B 51 6.059 -2.964 5.042 1.00 0.00 N ATOM 2336 CA LYS B 51 7.062 -3.291 6.102 1.00 0.00 C ATOM 2337 C LYS B 51 8.219 -4.106 5.518 1.00 0.00 C ATOM 2338 O LYS B 51 8.017 -5.188 5.005 1.00 0.00 O ATOM 2339 CB LYS B 51 6.306 -4.103 7.159 1.00 0.00 C ATOM 2340 CG LYS B 51 5.656 -5.334 6.519 1.00 0.00 C ATOM 2341 CD LYS B 51 6.450 -6.599 6.872 1.00 0.00 C ATOM 2342 CE LYS B 51 6.484 -6.795 8.390 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.368 -7.738 8.682 1.00 0.00 N ATOM 0 H LYS B 51 6.059 -3.580 4.229 1.00 0.00 H new ATOM 0 HA LYS B 51 7.499 -2.389 6.530 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.991 -4.414 7.948 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.542 -3.482 7.627 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.628 -5.433 6.867 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.616 -5.211 5.437 1.00 0.00 H new ATOM 0 HD2 LYS B 51 5.995 -7.468 6.396 1.00 0.00 H new ATOM 0 HD3 LYS B 51 7.466 -6.519 6.485 1.00 0.00 H new ATOM 0 HE2 LYS B 51 7.441 -7.204 8.714 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.348 -5.849 8.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.327 -7.921 9.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.469 -7.319 8.369 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 5.528 -8.632 8.176 1.00 0.00 H new ATOM 2357 N PRO B 52 9.407 -3.557 5.612 1.00 0.00 N ATOM 2358 CA PRO B 52 10.598 -4.247 5.089 1.00 0.00 C ATOM 2359 C PRO B 52 11.196 -5.169 6.145 1.00 0.00 C ATOM 2360 O PRO B 52 11.333 -4.809 7.299 1.00 0.00 O ATOM 2361 CB PRO B 52 11.563 -3.112 4.798 1.00 0.00 C ATOM 2362 CG PRO B 52 11.167 -2.007 5.728 1.00 0.00 C ATOM 2363 CD PRO B 52 9.750 -2.258 6.191 1.00 0.00 C ATOM 0 HA PRO B 52 10.376 -4.867 4.221 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.595 -3.419 4.969 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.494 -2.794 3.758 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.844 -1.969 6.582 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.236 -1.043 5.223 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.684 -2.277 7.279 1.00 0.00 H new ATOM 0 HD3 PRO B 52 9.074 -1.477 5.844 1.00 0.00 H new ATOM 2371 N VAL B 53 11.568 -6.347 5.750 1.00 0.00 N ATOM 2372 CA VAL B 53 12.183 -7.299 6.717 1.00 0.00 C ATOM 2373 C VAL B 53 13.505 -7.844 6.171 1.00 0.00 C ATOM 2374 O VAL B 53 13.549 -8.573 5.203 1.00 0.00 O ATOM 2375 CB VAL B 53 11.163 -8.411 6.910 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.858 -7.808 7.441 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.889 -9.105 5.576 1.00 0.00 C ATOM 0 H VAL B 53 11.474 -6.697 4.797 1.00 0.00 H new ATOM 0 HA VAL B 53 12.420 -6.816 7.665 1.00 0.00 H new ATOM 0 HB VAL B 53 11.555 -9.140 7.620 1.00 0.00 H new ATOM 0 HG11 VAL B 53 9.122 -8.600 7.582 1.00 0.00 H new ATOM 0 HG12 VAL B 53 10.047 -7.314 8.394 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.476 -7.080 6.725 1.00 0.00 H new ATOM 0 HG21 VAL B 53 10.158 -9.900 5.723 1.00 0.00 H new ATOM 0 HG22 VAL B 53 10.498 -8.380 4.862 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.815 -9.531 5.190 1.00 0.00 H new ATOM 2387 N ALA B 54 14.578 -7.465 6.792 1.00 0.00 N ATOM 2388 CA ALA B 54 15.932 -7.909 6.329 1.00 0.00 C ATOM 2389 C ALA B 54 16.079 -9.432 6.400 1.00 0.00 C ATOM 2390 O ALA B 54 15.844 -10.033 7.430 1.00 0.00 O ATOM 2391 CB ALA B 54 16.918 -7.229 7.283 1.00 0.00 C ATOM 0 H ALA B 54 14.584 -6.859 7.612 1.00 0.00 H new ATOM 0 HA ALA B 54 16.106 -7.639 5.288 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.937 -7.504 7.010 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.804 -6.147 7.214 1.00 0.00 H new ATOM 0 HB3 ALA B 54 16.716 -7.551 8.305 1.00 0.00 H new ATOM 2710 N VAL B 75 16.222 -6.144 1.810 1.00 0.00 N ATOM 2711 CA VAL B 75 15.199 -6.345 2.879 1.00 0.00 C ATOM 2712 C VAL B 75 14.010 -7.122 2.305 1.00 0.00 C ATOM 2713 O VAL B 75 13.970 -7.419 1.126 1.00 0.00 O ATOM 2714 CB VAL B 75 14.813 -4.935 3.364 1.00 0.00 C ATOM 2715 CG1 VAL B 75 13.595 -4.414 2.596 1.00 0.00 C ATOM 2716 CG2 VAL B 75 14.476 -4.996 4.854 1.00 0.00 C ATOM 0 HA VAL B 75 15.569 -6.933 3.719 1.00 0.00 H new ATOM 0 HB VAL B 75 15.652 -4.261 3.191 1.00 0.00 H new ATOM 0 HG11 VAL B 75 13.339 -3.417 2.954 1.00 0.00 H new ATOM 0 HG12 VAL B 75 13.828 -4.369 1.532 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.751 -5.085 2.755 1.00 0.00 H new ATOM 0 HG21 VAL B 75 14.201 -4.002 5.206 1.00 0.00 H new ATOM 0 HG22 VAL B 75 13.642 -5.680 5.011 1.00 0.00 H new ATOM 0 HG23 VAL B 75 15.344 -5.350 5.409 1.00 0.00 H new ATOM 2726 N GLY B 76 13.055 -7.470 3.116 1.00 0.00 N ATOM 2727 CA GLY B 76 11.899 -8.241 2.596 1.00 0.00 C ATOM 2728 C GLY B 76 10.688 -7.333 2.549 1.00 0.00 C ATOM 2729 O GLY B 76 9.672 -7.615 3.146 1.00 0.00 O ATOM 0 H GLY B 76 13.025 -7.255 4.113 1.00 0.00 H new ATOM 0 HA2 GLY B 76 12.120 -8.627 1.601 1.00 0.00 H new ATOM 0 HA3 GLY B 76 11.701 -9.101 3.235 1.00 0.00 H new ATOM 2733 N VAL B 77 10.798 -6.238 1.842 1.00 0.00 N ATOM 2734 CA VAL B 77 9.659 -5.287 1.743 1.00 0.00 C ATOM 2735 C VAL B 77 8.371 -6.047 1.484 1.00 0.00 C ATOM 2736 O VAL B 77 7.969 -6.244 0.354 1.00 0.00 O ATOM 2737 CB VAL B 77 9.998 -4.373 0.557 1.00 0.00 C ATOM 2738 CG1 VAL B 77 8.816 -3.439 0.261 1.00 0.00 C ATOM 2739 CG2 VAL B 77 11.236 -3.535 0.891 1.00 0.00 C ATOM 0 H VAL B 77 11.635 -5.963 1.327 1.00 0.00 H new ATOM 0 HA VAL B 77 9.514 -4.717 2.661 1.00 0.00 H new ATOM 0 HB VAL B 77 10.199 -4.989 -0.320 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.064 -2.794 -0.582 1.00 0.00 H new ATOM 0 HG12 VAL B 77 7.935 -4.033 0.016 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.608 -2.826 1.138 1.00 0.00 H new ATOM 0 HG21 VAL B 77 11.475 -2.887 0.048 1.00 0.00 H new ATOM 0 HG22 VAL B 77 11.036 -2.925 1.772 1.00 0.00 H new ATOM 0 HG23 VAL B 77 12.079 -4.196 1.091 1.00 0.00 H new ATOM 2749 N SER B 78 7.727 -6.477 2.532 1.00 0.00 N ATOM 2750 CA SER B 78 6.448 -7.230 2.361 1.00 0.00 C ATOM 2751 C SER B 78 5.470 -6.347 1.578 1.00 0.00 C ATOM 2752 O SER B 78 5.823 -5.828 0.537 1.00 0.00 O ATOM 2753 CB SER B 78 5.949 -7.503 3.780 1.00 0.00 C ATOM 2754 OG SER B 78 7.030 -7.978 4.572 1.00 0.00 O ATOM 0 H SER B 78 8.027 -6.342 3.497 1.00 0.00 H new ATOM 0 HA SER B 78 6.560 -8.164 1.810 1.00 0.00 H new ATOM 0 HB2 SER B 78 5.536 -6.593 4.215 1.00 0.00 H new ATOM 0 HB3 SER B 78 5.146 -8.239 3.761 1.00 0.00 H new ATOM 0 HG SER B 78 6.763 -8.803 5.028 1.00 0.00 H new ATOM 2760 N VAL B 79 4.259 -6.142 2.026 1.00 0.00 N ATOM 2761 CA VAL B 79 3.370 -5.263 1.213 1.00 0.00 C ATOM 2762 C VAL B 79 2.449 -4.411 2.051 1.00 0.00 C ATOM 2763 O VAL B 79 2.433 -4.461 3.256 1.00 0.00 O ATOM 2764 CB VAL B 79 2.508 -6.170 0.331 1.00 0.00 C ATOM 2765 CG1 VAL B 79 3.334 -7.335 -0.208 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.335 -6.717 1.157 1.00 0.00 C ATOM 0 H VAL B 79 3.860 -6.526 2.882 1.00 0.00 H new ATOM 0 HA VAL B 79 4.003 -4.587 0.638 1.00 0.00 H new ATOM 0 HB VAL B 79 2.132 -5.588 -0.510 1.00 0.00 H new ATOM 0 HG11 VAL B 79 2.705 -7.969 -0.833 1.00 0.00 H new ATOM 0 HG12 VAL B 79 4.163 -6.949 -0.801 1.00 0.00 H new ATOM 0 HG13 VAL B 79 3.725 -7.920 0.625 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.719 -7.363 0.531 1.00 0.00 H new ATOM 0 HG22 VAL B 79 1.720 -7.289 2.001 1.00 0.00 H new ATOM 0 HG23 VAL B 79 0.732 -5.888 1.526 1.00 0.00 H new ATOM 2776 N LYS B 80 1.673 -3.637 1.359 1.00 0.00 N ATOM 2777 CA LYS B 80 0.705 -2.735 2.002 1.00 0.00 C ATOM 2778 C LYS B 80 -0.727 -3.281 1.956 1.00 0.00 C ATOM 2779 O LYS B 80 -1.381 -3.364 2.977 1.00 0.00 O ATOM 2780 CB LYS B 80 0.811 -1.425 1.243 1.00 0.00 C ATOM 2781 CG LYS B 80 2.030 -0.656 1.749 1.00 0.00 C ATOM 2782 CD LYS B 80 1.578 0.525 2.607 1.00 0.00 C ATOM 2783 CE LYS B 80 2.218 1.816 2.083 1.00 0.00 C ATOM 2784 NZ LYS B 80 1.643 2.905 2.918 1.00 0.00 N ATOM 0 H LYS B 80 1.674 -3.595 0.340 1.00 0.00 H new ATOM 0 HA LYS B 80 0.931 -2.619 3.062 1.00 0.00 H new ATOM 0 HB2 LYS B 80 0.903 -1.615 0.174 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.093 -0.833 1.385 1.00 0.00 H new ATOM 0 HG2 LYS B 80 2.672 -1.316 2.332 1.00 0.00 H new ATOM 0 HG3 LYS B 80 2.622 -0.299 0.906 1.00 0.00 H new ATOM 0 HD2 LYS B 80 0.492 0.610 2.583 1.00 0.00 H new ATOM 0 HD3 LYS B 80 1.862 0.362 3.647 1.00 0.00 H new ATOM 0 HE2 LYS B 80 3.304 1.782 2.174 1.00 0.00 H new ATOM 0 HE3 LYS B 80 1.991 1.968 1.028 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 2.297 3.713 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 0.731 3.205 2.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 1.498 2.559 3.888 1.00 0.00 H new ATOM 2798 N PRO B 81 -1.192 -3.591 0.784 1.00 0.00 N ATOM 2799 CA PRO B 81 -2.584 -4.069 0.626 1.00 0.00 C ATOM 2800 C PRO B 81 -2.848 -5.246 1.555 1.00 0.00 C ATOM 2801 O PRO B 81 -2.265 -6.305 1.438 1.00 0.00 O ATOM 2802 CB PRO B 81 -2.681 -4.408 -0.863 1.00 0.00 C ATOM 2803 CG PRO B 81 -1.264 -4.592 -1.286 1.00 0.00 C ATOM 2804 CD PRO B 81 -0.481 -3.583 -0.484 1.00 0.00 C ATOM 0 HA PRO B 81 -3.346 -3.341 0.904 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -3.267 -5.312 -1.029 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -3.164 -3.608 -1.424 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -0.921 -5.607 -1.085 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -1.147 -4.422 -2.356 1.00 0.00 H new ATOM 0 HD2 PRO B 81 0.563 -3.874 -0.369 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -0.487 -2.597 -0.950 1.00 0.00 H new ATOM 2812 N GLY B 82 -3.727 -5.038 2.497 1.00 0.00 N ATOM 2813 CA GLY B 82 -4.058 -6.094 3.476 1.00 0.00 C ATOM 2814 C GLY B 82 -5.562 -6.192 3.530 1.00 0.00 C ATOM 2815 O GLY B 82 -6.147 -7.216 3.235 1.00 0.00 O ATOM 0 H GLY B 82 -4.235 -4.163 2.626 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -3.620 -7.047 3.178 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -3.652 -5.850 4.458 1.00 0.00 H new ATOM 2819 N GLU B 83 -6.195 -5.105 3.849 1.00 0.00 N ATOM 2820 CA GLU B 83 -7.669 -5.094 3.861 1.00 0.00 C ATOM 2821 C GLU B 83 -8.140 -4.867 2.446 1.00 0.00 C ATOM 2822 O GLU B 83 -8.900 -3.965 2.176 1.00 0.00 O ATOM 2823 CB GLU B 83 -8.078 -3.935 4.748 1.00 0.00 C ATOM 2824 CG GLU B 83 -9.522 -4.153 5.185 1.00 0.00 C ATOM 2825 CD GLU B 83 -9.836 -3.270 6.395 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -8.945 -3.067 7.202 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -10.962 -2.812 6.492 1.00 0.00 O ATOM 0 H GLU B 83 -5.750 -4.223 4.102 1.00 0.00 H new ATOM 0 HA GLU B 83 -8.098 -6.025 4.231 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -7.423 -3.873 5.617 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -7.983 -2.992 4.209 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.200 -3.916 4.365 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -9.681 -5.201 5.437 1.00 0.00 H new ATOM 2834 N SER B 84 -7.700 -5.725 1.564 1.00 0.00 N ATOM 2835 CA SER B 84 -8.078 -5.678 0.120 1.00 0.00 C ATOM 2836 C SER B 84 -8.832 -4.421 -0.213 1.00 0.00 C ATOM 2837 O SER B 84 -9.923 -4.447 -0.767 1.00 0.00 O ATOM 2838 CB SER B 84 -8.942 -6.917 -0.111 1.00 0.00 C ATOM 2839 OG SER B 84 -8.118 -7.993 -0.542 1.00 0.00 O ATOM 0 H SER B 84 -7.066 -6.490 1.797 1.00 0.00 H new ATOM 0 HA SER B 84 -7.198 -5.671 -0.523 1.00 0.00 H new ATOM 0 HB2 SER B 84 -9.462 -7.188 0.808 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.706 -6.707 -0.859 1.00 0.00 H new ATOM 0 HG SER B 84 -8.670 -8.789 -0.689 1.00 0.00 H new ATOM 2845 N LEU B 85 -8.378 -3.297 0.249 1.00 0.00 N ATOM 2846 CA LEU B 85 -9.256 -2.119 0.050 1.00 0.00 C ATOM 2847 C LEU B 85 -10.642 -2.728 -0.141 1.00 0.00 C ATOM 2848 O LEU B 85 -11.518 -2.203 -0.769 1.00 0.00 O ATOM 2849 CB LEU B 85 -8.753 -1.451 -1.237 1.00 0.00 C ATOM 2850 CG LEU B 85 -7.317 -0.953 -1.035 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -6.412 -1.520 -2.133 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -7.295 0.576 -1.102 1.00 0.00 C ATOM 0 H LEU B 85 -7.491 -3.143 0.729 1.00 0.00 H new ATOM 0 HA LEU B 85 -9.267 -1.384 0.854 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -8.789 -2.160 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -9.403 -0.617 -1.503 1.00 0.00 H new ATOM 0 HG LEU B 85 -6.956 -1.285 -0.062 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -5.393 -1.163 -1.985 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -6.425 -2.609 -2.089 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.773 -1.192 -3.108 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -6.275 0.932 -0.959 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -7.660 0.903 -2.076 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -7.935 0.984 -0.319 1.00 0.00 H new ATOM 2864 N LYS B 86 -10.775 -3.883 0.509 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.015 -4.688 0.572 1.00 0.00 C ATOM 2866 C LYS B 86 -13.015 -3.767 1.192 1.00 0.00 C ATOM 2867 O LYS B 86 -14.146 -3.619 0.776 1.00 0.00 O ATOM 2868 CB LYS B 86 -11.606 -5.794 1.560 1.00 0.00 C ATOM 2869 CG LYS B 86 -12.143 -7.158 1.148 1.00 0.00 C ATOM 2870 CD LYS B 86 -11.485 -8.213 2.043 1.00 0.00 C ATOM 2871 CE LYS B 86 -12.360 -9.468 2.090 1.00 0.00 C ATOM 2872 NZ LYS B 86 -12.144 -10.038 3.449 1.00 0.00 N ATOM 0 H LYS B 86 -10.004 -4.306 1.026 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.413 -5.093 -0.358 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -10.519 -5.838 1.625 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -11.975 -5.545 2.555 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -13.227 -7.189 1.255 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.920 -7.355 0.099 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -10.495 -8.462 1.660 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -11.347 -7.816 3.049 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -13.410 -9.224 1.927 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -12.074 -10.178 1.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -12.712 -10.902 3.557 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -11.137 -10.267 3.573 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -12.432 -9.343 4.167 1.00 0.00 H new ATOM 2886 N LYS B 87 -12.509 -3.074 2.157 1.00 0.00 N ATOM 2887 CA LYS B 87 -13.272 -2.042 2.835 1.00 0.00 C ATOM 2888 C LYS B 87 -13.566 -0.989 1.783 1.00 0.00 C ATOM 2889 O LYS B 87 -14.646 -0.424 1.709 1.00 0.00 O ATOM 2890 CB LYS B 87 -12.283 -1.537 3.880 1.00 0.00 C ATOM 2891 CG LYS B 87 -13.006 -0.668 4.913 1.00 0.00 C ATOM 2892 CD LYS B 87 -12.141 0.547 5.253 1.00 0.00 C ATOM 2893 CE LYS B 87 -12.628 1.169 6.565 1.00 0.00 C ATOM 2894 NZ LYS B 87 -11.919 0.415 7.636 1.00 0.00 N ATOM 0 H LYS B 87 -11.559 -3.195 2.508 1.00 0.00 H new ATOM 0 HA LYS B 87 -14.214 -2.344 3.292 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -11.803 -2.381 4.375 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -11.494 -0.961 3.397 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -13.969 -0.343 4.520 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -13.208 -1.247 5.814 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -11.097 0.249 5.345 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -12.193 1.281 4.449 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -12.392 2.232 6.609 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -13.709 1.078 6.668 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -12.454 0.489 8.525 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -11.839 -0.585 7.362 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -10.968 0.814 7.770 1.00 0.00 H new ATOM 2908 N ALA B 88 -12.607 -0.758 0.921 1.00 0.00 N ATOM 2909 CA ALA B 88 -12.835 0.225 -0.159 1.00 0.00 C ATOM 2910 C ALA B 88 -13.683 -0.440 -1.236 1.00 0.00 C ATOM 2911 O ALA B 88 -14.383 0.194 -1.988 1.00 0.00 O ATOM 2912 CB ALA B 88 -11.444 0.557 -0.676 1.00 0.00 C ATOM 0 H ALA B 88 -11.690 -1.206 0.925 1.00 0.00 H new ATOM 0 HA ALA B 88 -13.358 1.126 0.163 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -11.520 1.284 -1.484 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -10.845 0.975 0.133 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -10.968 -0.350 -1.048 1.00 0.00 H new ATOM 2918 N ALA B 89 -13.630 -1.728 -1.305 1.00 0.00 N ATOM 2919 CA ALA B 89 -14.429 -2.438 -2.323 1.00 0.00 C ATOM 2920 C ALA B 89 -15.882 -2.465 -1.882 1.00 0.00 C ATOM 2921 O ALA B 89 -16.781 -2.280 -2.679 1.00 0.00 O ATOM 2922 CB ALA B 89 -13.811 -3.830 -2.406 1.00 0.00 C ATOM 0 H ALA B 89 -13.066 -2.324 -0.699 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.418 -1.962 -3.303 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.350 -4.424 -3.144 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -12.765 -3.747 -2.701 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -13.876 -4.316 -1.432 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.127 -2.627 -0.617 1.00 0.00 N ATOM 2929 CA GLU B 90 -17.533 -2.581 -0.150 1.00 0.00 C ATOM 2930 C GLU B 90 -18.024 -1.142 -0.357 1.00 0.00 C ATOM 2931 O GLU B 90 -19.205 -0.879 -0.476 1.00 0.00 O ATOM 2932 CB GLU B 90 -17.492 -2.979 1.336 1.00 0.00 C ATOM 2933 CG GLU B 90 -17.363 -1.737 2.228 1.00 0.00 C ATOM 2934 CD GLU B 90 -16.767 -2.132 3.582 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -16.208 -3.214 3.672 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -16.880 -1.345 4.508 1.00 0.00 O ATOM 0 H GLU B 90 -15.425 -2.787 0.105 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.209 -3.250 -0.682 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.398 -3.527 1.596 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -16.652 -3.650 1.515 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -16.729 -0.994 1.744 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -18.341 -1.277 2.371 1.00 0.00 H new ATOM 2943 N GLY B 91 -17.097 -0.209 -0.403 1.00 0.00 N ATOM 2944 CA GLY B 91 -17.460 1.220 -0.604 1.00 0.00 C ATOM 2945 C GLY B 91 -17.918 1.486 -2.052 1.00 0.00 C ATOM 2946 O GLY B 91 -18.838 2.252 -2.264 1.00 0.00 O ATOM 0 H GLY B 91 -16.097 -0.386 -0.308 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -18.256 1.495 0.087 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -16.603 1.851 -0.370 1.00 0.00 H new ATOM 2950 N LEU B 92 -17.306 0.887 -3.066 1.00 0.00 N ATOM 2951 CA LEU B 92 -17.782 1.178 -4.462 1.00 0.00 C ATOM 2952 C LEU B 92 -19.074 0.433 -4.753 1.00 0.00 C ATOM 2953 O LEU B 92 -19.394 0.168 -5.895 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.682 0.692 -5.420 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.593 -0.838 -5.403 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -17.293 -1.405 -6.639 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.123 -1.263 -5.419 1.00 0.00 C ATOM 0 H LEU B 92 -16.527 0.234 -2.987 1.00 0.00 H new ATOM 0 HA LEU B 92 -17.976 2.244 -4.584 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.893 1.039 -6.432 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -15.723 1.121 -5.130 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.076 -1.218 -4.503 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -17.229 -2.493 -6.626 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -18.340 -1.103 -6.635 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -16.809 -1.024 -7.538 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -15.059 -2.351 -5.407 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.644 -0.881 -6.320 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -14.618 -0.860 -4.541 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.805 0.055 -3.739 1.00 0.00 N ATOM 2970 CA LYS B 93 -21.052 -0.717 -3.990 1.00 0.00 C ATOM 2971 C LYS B 93 -20.651 -1.924 -4.826 1.00 0.00 C ATOM 2972 O LYS B 93 -21.210 -2.202 -5.870 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.988 0.218 -4.764 1.00 0.00 C ATOM 2974 CG LYS B 93 -22.720 1.134 -3.782 1.00 0.00 C ATOM 2975 CD LYS B 93 -21.887 2.395 -3.539 1.00 0.00 C ATOM 2976 CE LYS B 93 -22.375 3.516 -4.460 1.00 0.00 C ATOM 2977 NZ LYS B 93 -23.407 4.242 -3.669 1.00 0.00 N ATOM 0 H LYS B 93 -19.595 0.245 -2.759 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.554 -1.060 -3.085 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -21.417 0.813 -5.477 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -22.707 -0.365 -5.339 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.698 1.403 -4.180 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -22.892 0.612 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -21.971 2.704 -2.497 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -20.833 2.189 -3.726 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -21.557 4.178 -4.744 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -22.795 3.115 -5.382 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -23.789 5.027 -4.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -24.176 3.588 -3.419 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -22.977 4.619 -2.800 1.00 0.00 H new ATOM 2991 N TYR B 94 -19.629 -2.605 -4.373 1.00 0.00 N ATOM 2992 CA TYR B 94 -19.092 -3.784 -5.101 1.00 0.00 C ATOM 2993 C TYR B 94 -20.173 -4.479 -5.944 1.00 0.00 C ATOM 2994 O TYR B 94 -19.956 -4.808 -7.093 1.00 0.00 O ATOM 2995 CB TYR B 94 -18.587 -4.719 -4.010 1.00 0.00 C ATOM 2996 CG TYR B 94 -18.275 -6.024 -4.664 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -17.337 -6.068 -5.698 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -18.957 -7.172 -4.278 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -17.083 -7.273 -6.353 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -18.695 -8.377 -4.928 1.00 0.00 C ATOM 3001 CZ TYR B 94 -17.759 -8.422 -5.968 1.00 0.00 C ATOM 3002 OH TYR B 94 -17.490 -9.610 -6.604 1.00 0.00 O ATOM 0 H TYR B 94 -19.136 -2.384 -3.508 1.00 0.00 H new ATOM 0 HA TYR B 94 -18.310 -3.493 -5.803 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -17.700 -4.307 -3.529 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -19.340 -4.847 -3.233 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.810 -5.172 -5.990 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -19.684 -7.131 -3.481 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -16.363 -7.312 -7.157 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -19.214 -9.276 -4.629 1.00 0.00 H new ATOM 0 HH TYR B 94 -18.044 -10.320 -6.218 1.00 0.00 H new ATOM 3012 N GLU B 95 -21.330 -4.703 -5.381 1.00 0.00 N ATOM 3013 CA GLU B 95 -22.417 -5.379 -6.155 1.00 0.00 C ATOM 3014 C GLU B 95 -22.720 -4.584 -7.423 1.00 0.00 C ATOM 3015 O GLU B 95 -22.779 -5.127 -8.510 1.00 0.00 O ATOM 3016 CB GLU B 95 -23.632 -5.396 -5.230 1.00 0.00 C ATOM 3017 CG GLU B 95 -23.297 -6.168 -3.950 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.921 -7.563 -4.014 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -23.677 -8.256 -4.989 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -24.634 -7.915 -3.089 1.00 0.00 O ATOM 0 H GLU B 95 -21.571 -4.449 -4.423 1.00 0.00 H new ATOM 0 HA GLU B 95 -22.137 -6.387 -6.462 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -23.928 -4.376 -4.984 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -24.479 -5.861 -5.735 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -22.216 -6.247 -3.833 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -23.673 -5.630 -3.080 1.00 0.00 H new ATOM 3027 N ASP B 96 -22.888 -3.296 -7.296 1.00 0.00 N ATOM 3028 CA ASP B 96 -23.162 -2.454 -8.499 1.00 0.00 C ATOM 3029 C ASP B 96 -22.066 -2.696 -9.536 1.00 0.00 C ATOM 3030 O ASP B 96 -22.304 -2.683 -10.728 1.00 0.00 O ATOM 3031 CB ASP B 96 -23.118 -1.008 -8.001 1.00 0.00 C ATOM 3032 CG ASP B 96 -24.502 -0.601 -7.489 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -25.479 -0.988 -8.109 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -24.561 0.090 -6.485 1.00 0.00 O ATOM 0 H ASP B 96 -22.848 -2.789 -6.412 1.00 0.00 H new ATOM 0 HA ASP B 96 -24.120 -2.684 -8.965 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -22.380 -0.909 -7.205 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -22.807 -0.344 -8.808 1.00 0.00 H new ATOM 3039 N PHE B 97 -20.869 -2.943 -9.078 1.00 0.00 N ATOM 3040 CA PHE B 97 -19.745 -3.217 -10.018 1.00 0.00 C ATOM 3041 C PHE B 97 -19.723 -4.712 -10.351 1.00 0.00 C ATOM 3042 O PHE B 97 -19.196 -5.130 -11.363 1.00 0.00 O ATOM 3043 CB PHE B 97 -18.490 -2.811 -9.243 1.00 0.00 C ATOM 3044 CG PHE B 97 -17.520 -2.100 -10.158 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -17.960 -1.051 -10.974 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -16.176 -2.492 -10.184 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -17.055 -0.394 -11.817 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -15.271 -1.835 -11.026 1.00 0.00 C ATOM 3049 CZ PHE B 97 -15.710 -0.785 -11.843 1.00 0.00 C ATOM 0 H PHE B 97 -20.620 -2.967 -8.089 1.00 0.00 H new ATOM 0 HA PHE B 97 -19.828 -2.677 -10.961 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -18.761 -2.160 -8.412 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -18.016 -3.694 -8.814 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -18.997 -0.749 -10.953 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -15.837 -3.301 -9.554 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -17.394 0.415 -12.447 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -14.234 -2.138 -11.046 1.00 0.00 H new ATOM 0 HZ PHE B 97 -15.012 -0.277 -12.492 1.00 0.00 H new